USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 836 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 180:sc= -2.29 USER MOD Single : A 12 SER OG : rot -26:sc= 0.481 USER MOD Single : A 16 SER OG : rot 58:sc= 1.14 USER MOD Single : A 19 HIS : no HD1:sc= -0.918 K(o=-0.92,f=-0.13) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -109:sc= 0.345 USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 11 CYS SG : rot 180:sc= -2.27 USER MOD Single : B 12 SER OG : rot -30:sc= 0.497 USER MOD Single : B 16 SER OG : rot 96:sc= 1.22 USER MOD Single : B 19 HIS : no HD1:sc= -0.841 K(o=-0.84,f=-0.11) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot -110:sc= 0.265 USER MOD Single : B 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 9 SER OG : rot 180:sc= 0 USER MOD Single : C 11 CYS SG : rot 180:sc= -2.3 USER MOD Single : C 12 SER OG : rot -29:sc= 0.521 USER MOD Single : C 16 SER OG : rot 59:sc= 1.14 USER MOD Single : C 19 HIS : no HD1:sc= -0.864 K(o=-0.86,f=-0.13) USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot -92:sc= 0.216 USER MOD Single : C 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : D 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 9 SER OG : rot 180:sc= 0 USER MOD Single : D 11 CYS SG : rot 180:sc= -2.32 USER MOD Single : D 12 SER OG : rot -27:sc= 0.498 USER MOD Single : D 16 SER OG : rot 94:sc= 1.26 USER MOD Single : D 19 HIS : no HD1:sc= -0.884 K(o=-0.88,f=-0.15) USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot -110:sc= 0.259 USER MOD Single : D 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 3 48.641 25.958 8.646 1.00 0.00 N0 ATOM 41 CA GLU A 3 47.332 25.317 8.700 1.00 0.00 C0 ATOM 42 C GLU A 3 46.836 25.210 10.145 1.00 0.00 C0 ATOM 43 O GLU A 3 47.637 25.148 11.078 1.00 0.00 O0 ATOM 44 CB GLU A 3 47.410 23.921 8.082 1.00 0.00 C0 ATOM 45 CG GLU A 3 48.400 23.068 8.875 1.00 0.00 C0 ATOM 46 CD GLU A 3 49.462 22.503 7.939 1.00 0.00 C0 ATOM 47 OE1 GLU A 3 49.129 21.623 7.161 1.00 0.00 O0 ATOM 48 OE2 GLU A 3 50.591 22.960 8.010 1.00 0.00 O1- ATOM 0 HA GLU A 3 46.629 25.929 8.135 1.00 0.00 H new ATOM 0 HB2 GLU A 3 46.425 23.454 8.087 1.00 0.00 H new ATOM 0 HB3 GLU A 3 47.725 23.990 7.041 1.00 0.00 H new ATOM 0 HG2 GLU A 3 48.871 23.670 9.653 1.00 0.00 H new ATOM 0 HG3 GLU A 3 47.874 22.255 9.376 1.00 0.00 H new ATOM 55 N PRO A 4 45.539 25.178 10.345 1.00 0.00 N0 ATOM 56 CA PRO A 4 44.935 25.064 11.707 1.00 0.00 C0 ATOM 57 C PRO A 4 45.122 23.670 12.304 1.00 0.00 C0 ATOM 58 O PRO A 4 45.466 23.527 13.479 1.00 0.00 O0 ATOM 59 CB PRO A 4 43.451 25.354 11.470 1.00 0.00 C0 ATOM 60 CG PRO A 4 43.201 25.004 10.040 1.00 0.00 C0 ATOM 61 CD PRO A 4 44.511 25.249 9.296 1.00 0.00 C0 ATOM 0 HA PRO A 4 45.402 25.745 12.419 1.00 0.00 H new ATOM 0 HB2 PRO A 4 42.824 24.760 12.135 1.00 0.00 H new ATOM 0 HB3 PRO A 4 43.220 26.401 11.664 1.00 0.00 H new ATOM 0 HG2 PRO A 4 42.890 23.964 9.944 1.00 0.00 H new ATOM 0 HG3 PRO A 4 42.400 25.616 9.626 1.00 0.00 H new ATOM 0 HD2 PRO A 4 44.677 24.498 8.524 1.00 0.00 H new ATOM 0 HD3 PRO A 4 44.513 26.220 8.801 1.00 0.00 H new ATOM 69 N PHE A 5 44.898 22.647 11.486 1.00 0.00 N0 ATOM 70 CA PHE A 5 45.047 21.269 11.938 1.00 0.00 C0 ATOM 71 C PHE A 5 45.630 20.404 10.823 1.00 0.00 C0 ATOM 72 O PHE A 5 46.842 20.194 10.758 1.00 0.00 O0 ATOM 73 CB PHE A 5 43.689 20.709 12.387 1.00 0.00 C0 ATOM 74 CG PHE A 5 43.634 20.651 13.892 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 43.100 21.722 14.614 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 44.112 19.521 14.563 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 43.043 21.663 16.011 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 44.057 19.460 15.959 1.00 0.00 C0 ATOM 79 CZ PHE A 5 43.521 20.531 16.684 1.00 0.00 C0 ATOM 0 H PHE A 5 44.614 22.745 10.511 1.00 0.00 H new ATOM 0 HA PHE A 5 45.732 21.253 12.786 1.00 0.00 H new ATOM 0 HB2 PHE A 5 42.883 21.337 12.008 1.00 0.00 H new ATOM 0 HB3 PHE A 5 43.540 19.713 11.970 1.00 0.00 H new ATOM 0 HD1 PHE A 5 42.732 22.594 14.094 1.00 0.00 H new ATOM 0 HD2 PHE A 5 44.524 18.695 14.003 1.00 0.00 H new ATOM 0 HE1 PHE A 5 42.631 22.490 16.570 1.00 0.00 H new ATOM 0 HE2 PHE A 5 44.428 18.588 16.477 1.00 0.00 H new ATOM 0 HZ PHE A 5 43.476 20.485 17.762 1.00 0.00 H new ATOM 89 N GLN A 6 44.764 19.900 9.945 1.00 0.00 N0 ATOM 90 CA GLN A 6 45.199 19.056 8.842 1.00 0.00 C0 ATOM 91 C GLN A 6 44.233 19.177 7.669 1.00 0.00 C0 ATOM 92 O GLN A 6 43.095 19.617 7.831 1.00 0.00 O0 ATOM 93 CB GLN A 6 45.276 17.595 9.293 1.00 0.00 C0 ATOM 94 CG GLN A 6 46.329 17.447 10.394 1.00 0.00 C0 ATOM 95 CD GLN A 6 46.557 15.973 10.705 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 47.216 15.270 9.939 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 46.038 15.456 11.784 1.00 0.00 N0 ATOM 0 H GLN A 6 43.758 20.064 9.979 1.00 0.00 H new ATOM 0 HA GLN A 6 46.188 19.387 8.525 1.00 0.00 H new ATOM 0 HB2 GLN A 6 44.304 17.267 9.660 1.00 0.00 H new ATOM 0 HB3 GLN A 6 45.529 16.956 8.447 1.00 0.00 H new ATOM 0 HG2 GLN A 6 47.264 17.909 10.078 1.00 0.00 H new ATOM 0 HG3 GLN A 6 46.003 17.970 11.293 1.00 0.00 H new ATOM 0 HE21 GLN A 6 45.492 16.040 12.418 1.00 0.00 H new ATOM 0 HE22 GLN A 6 46.178 14.468 11.994 1.00 0.00 H new ATOM 106 N ILE A 7 44.697 18.793 6.490 1.00 0.00 N0 ATOM 107 CA ILE A 7 43.866 18.864 5.298 1.00 0.00 C0 ATOM 108 C ILE A 7 42.599 18.025 5.480 1.00 0.00 C0 ATOM 109 O ILE A 7 41.523 18.387 4.997 1.00 0.00 O0 ATOM 110 CB ILE A 7 44.664 18.358 4.088 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 44.996 16.871 4.272 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 45.964 19.157 3.955 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 45.869 16.389 3.109 1.00 0.00 C0 ATOM 0 H ILE A 7 45.638 18.431 6.333 1.00 0.00 H new ATOM 0 HA ILE A 7 43.572 19.900 5.130 1.00 0.00 H new ATOM 0 HB ILE A 7 44.065 18.487 3.186 1.00 0.00 H new ATOM 0 HG12 ILE A 7 45.517 16.719 5.217 1.00 0.00 H new ATOM 0 HG13 ILE A 7 44.077 16.286 4.316 1.00 0.00 H new ATOM 0 HG21 ILE A 7 46.527 18.795 3.095 1.00 0.00 H new ATOM 0 HG22 ILE A 7 45.730 20.213 3.817 1.00 0.00 H new ATOM 0 HG23 ILE A 7 46.561 19.033 4.858 1.00 0.00 H new ATOM 0 HD11 ILE A 7 46.103 15.333 3.243 1.00 0.00 H new ATOM 0 HD12 ILE A 7 45.332 16.526 2.170 1.00 0.00 H new ATOM 0 HD13 ILE A 7 46.794 16.965 3.085 1.00 0.00 H new ATOM 125 N LEU A 8 42.737 16.912 6.192 1.00 0.00 N0 ATOM 126 CA LEU A 8 41.607 16.027 6.451 1.00 0.00 C0 ATOM 127 C LEU A 8 40.648 16.658 7.455 1.00 0.00 C0 ATOM 128 O LEU A 8 39.432 16.477 7.369 1.00 0.00 O0 ATOM 129 CB LEU A 8 42.106 14.680 6.983 1.00 0.00 C0 ATOM 130 CG LEU A 8 42.869 13.941 5.878 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 43.584 12.726 6.476 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 41.886 13.473 4.798 1.00 0.00 C0 ATOM 0 H LEU A 8 43.619 16.601 6.600 1.00 0.00 H new ATOM 0 HA LEU A 8 41.073 15.867 5.514 1.00 0.00 H new ATOM 0 HB2 LEU A 8 42.755 14.836 7.845 1.00 0.00 H new ATOM 0 HB3 LEU A 8 41.264 14.077 7.323 1.00 0.00 H new ATOM 0 HG LEU A 8 43.602 14.614 5.434 1.00 0.00 H new ATOM 0 HD11 LEU A 8 44.127 12.200 5.690 1.00 0.00 H new ATOM 0 HD12 LEU A 8 44.285 13.057 7.242 1.00 0.00 H new ATOM 0 HD13 LEU A 8 42.850 12.055 6.922 1.00 0.00 H new ATOM 0 HD21 LEU A 8 42.431 12.948 4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 8 41.151 12.801 5.241 1.00 0.00 H new ATOM 0 HD23 LEU A 8 41.377 14.337 4.371 1.00 0.00 H new ATOM 144 N SER A 9 41.208 17.409 8.395 1.00 0.00 N0 ATOM 145 CA SER A 9 40.405 18.078 9.411 1.00 0.00 C0 ATOM 146 C SER A 9 39.601 19.220 8.798 1.00 0.00 C0 ATOM 147 O SER A 9 38.420 19.389 9.094 1.00 0.00 O0 ATOM 148 CB SER A 9 41.303 18.618 10.526 1.00 0.00 C0 ATOM 149 OG SER A 9 40.495 19.241 11.516 1.00 0.00 O0 ATOM 0 H SER A 9 42.212 17.570 8.475 1.00 0.00 H new ATOM 0 HA SER A 9 39.712 17.349 9.831 1.00 0.00 H new ATOM 0 HB2 SER A 9 41.881 17.807 10.969 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.018 19.334 10.119 1.00 0.00 H new ATOM 0 HG SER A 9 41.066 19.587 12.234 1.00 0.00 H new ATOM 155 N ILE A 10 40.250 19.999 7.937 1.00 0.00 N0 ATOM 156 CA ILE A 10 39.583 21.123 7.286 1.00 0.00 C0 ATOM 157 C ILE A 10 38.447 20.633 6.394 1.00 0.00 C0 ATOM 158 O ILE A 10 37.342 21.176 6.433 1.00 0.00 O0 ATOM 159 CB ILE A 10 40.588 21.907 6.443 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 41.585 22.611 7.365 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 39.847 22.951 5.604 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 42.787 23.084 6.547 1.00 0.00 C0 ATOM 0 H ILE A 10 41.228 19.875 7.675 1.00 0.00 H new ATOM 0 HA ILE A 10 39.169 21.770 8.059 1.00 0.00 H new ATOM 0 HB ILE A 10 41.121 21.222 5.783 1.00 0.00 H new ATOM 0 HG12 ILE A 10 41.108 23.460 7.854 1.00 0.00 H new ATOM 0 HG13 ILE A 10 41.912 21.931 8.152 1.00 0.00 H new ATOM 0 HG21 ILE A 10 40.564 23.510 5.003 1.00 0.00 H new ATOM 0 HG22 ILE A 10 39.135 22.451 4.948 1.00 0.00 H new ATOM 0 HG23 ILE A 10 39.314 23.636 6.263 1.00 0.00 H new ATOM 0 HD11 ILE A 10 43.498 23.586 7.203 1.00 0.00 H new ATOM 0 HD12 ILE A 10 43.269 22.226 6.078 1.00 0.00 H new ATOM 0 HD13 ILE A 10 42.452 23.778 5.776 1.00 0.00 H new ATOM 174 N CYS A 11 38.730 19.612 5.589 1.00 0.00 N0 ATOM 175 CA CYS A 11 37.722 19.065 4.685 1.00 0.00 C0 ATOM 176 C CYS A 11 36.519 18.579 5.483 1.00 0.00 C0 ATOM 177 O CYS A 11 35.378 18.924 5.175 1.00 0.00 O0 ATOM 178 CB CYS A 11 38.315 17.906 3.886 1.00 0.00 C0 ATOM 179 SG CYS A 11 37.178 17.442 2.558 1.00 0.00 S0 ATOM 0 H CYS A 11 39.639 19.151 5.544 1.00 0.00 H new ATOM 0 HA CYS A 11 37.401 19.846 3.996 1.00 0.00 H new ATOM 0 HB2 CYS A 11 39.280 18.195 3.469 1.00 0.00 H new ATOM 0 HB3 CYS A 11 38.493 17.053 4.541 1.00 0.00 H new ATOM 0 HG CYS A 11 37.685 16.457 1.877 1.00 0.00 H new ATOM 185 N SER A 12 36.770 17.765 6.501 1.00 0.00 N0 ATOM 186 CA SER A 12 35.684 17.247 7.314 1.00 0.00 C0 ATOM 187 C SER A 12 34.931 18.385 7.989 1.00 0.00 C0 ATOM 188 O SER A 12 33.714 18.338 8.113 1.00 0.00 O0 ATOM 189 CB SER A 12 36.232 16.308 8.381 1.00 0.00 C0 ATOM 190 OG SER A 12 37.131 17.031 9.210 1.00 0.00 O0 ATOM 0 H SER A 12 37.701 17.455 6.778 1.00 0.00 H new ATOM 0 HA SER A 12 35.000 16.703 6.663 1.00 0.00 H new ATOM 0 HB2 SER A 12 35.417 15.897 8.977 1.00 0.00 H new ATOM 0 HB3 SER A 12 36.743 15.465 7.916 1.00 0.00 H new ATOM 0 HG SER A 12 37.515 17.777 8.704 1.00 0.00 H new ATOM 196 N PHE A 13 35.660 19.401 8.447 1.00 0.00 N0 ATOM 197 CA PHE A 13 35.030 20.527 9.129 1.00 0.00 C0 ATOM 198 C PHE A 13 33.967 21.183 8.246 1.00 0.00 C0 ATOM 199 O PHE A 13 32.806 21.306 8.644 1.00 0.00 O0 ATOM 200 CB PHE A 13 36.098 21.563 9.473 1.00 0.00 C0 ATOM 201 CG PHE A 13 35.435 22.835 9.943 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 34.927 22.920 11.244 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 35.328 23.931 9.077 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 34.310 24.098 11.679 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 34.712 25.110 9.512 1.00 0.00 C0 ATOM 206 CZ PHE A 13 34.202 25.193 10.813 1.00 0.00 C0 ATOM 0 H PHE A 13 36.674 19.467 8.360 1.00 0.00 H new ATOM 0 HA PHE A 13 34.548 20.156 10.034 1.00 0.00 H new ATOM 0 HB2 PHE A 13 36.758 21.176 10.250 1.00 0.00 H new ATOM 0 HB3 PHE A 13 36.718 21.765 8.600 1.00 0.00 H new ATOM 0 HD1 PHE A 13 35.011 22.076 11.913 1.00 0.00 H new ATOM 0 HD2 PHE A 13 35.721 23.866 8.073 1.00 0.00 H new ATOM 0 HE1 PHE A 13 33.917 24.163 12.683 1.00 0.00 H new ATOM 0 HE2 PHE A 13 34.630 25.955 8.845 1.00 0.00 H new ATOM 0 HZ PHE A 13 33.725 26.102 11.149 1.00 0.00 H new ATOM 216 N ILE A 14 34.368 21.603 7.053 1.00 0.00 N0 ATOM 217 CA ILE A 14 33.435 22.249 6.135 1.00 0.00 C0 ATOM 218 C ILE A 14 32.342 21.271 5.715 1.00 0.00 C0 ATOM 219 O ILE A 14 31.169 21.642 5.605 1.00 0.00 O0 ATOM 220 CB ILE A 14 34.189 22.775 4.902 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 33.213 23.429 3.912 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 34.933 21.632 4.207 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 32.792 24.799 4.442 1.00 0.00 C0 ATOM 0 H ILE A 14 35.321 21.510 6.700 1.00 0.00 H new ATOM 0 HA ILE A 14 32.966 23.091 6.644 1.00 0.00 H new ATOM 0 HB ILE A 14 34.909 23.522 5.236 1.00 0.00 H new ATOM 0 HG12 ILE A 14 33.685 23.534 2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 14 32.337 22.795 3.776 1.00 0.00 H new ATOM 0 HG21 ILE A 14 35.462 22.019 3.336 1.00 0.00 H new ATOM 0 HG22 ILE A 14 35.649 21.190 4.900 1.00 0.00 H new ATOM 0 HG23 ILE A 14 34.218 20.873 3.890 1.00 0.00 H new ATOM 0 HD11 ILE A 14 32.100 25.264 3.740 1.00 0.00 H new ATOM 0 HD12 ILE A 14 32.303 24.681 5.409 1.00 0.00 H new ATOM 0 HD13 ILE A 14 33.672 25.432 4.555 1.00 0.00 H new ATOM 235 N LEU A 15 32.733 20.028 5.478 1.00 0.00 N0 ATOM 236 CA LEU A 15 31.782 19.009 5.064 1.00 0.00 C0 ATOM 237 C LEU A 15 30.761 18.750 6.163 1.00 0.00 C0 ATOM 238 O LEU A 15 29.624 18.376 5.889 1.00 0.00 O0 ATOM 239 CB LEU A 15 32.521 17.714 4.717 1.00 0.00 C0 ATOM 240 CG LEU A 15 33.013 17.768 3.267 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 34.115 16.728 3.060 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 31.848 17.453 2.325 1.00 0.00 C0 ATOM 0 H LEU A 15 33.696 19.702 5.565 1.00 0.00 H new ATOM 0 HA LEU A 15 31.254 19.366 4.180 1.00 0.00 H new ATOM 0 HB2 LEU A 15 33.365 17.575 5.392 1.00 0.00 H new ATOM 0 HB3 LEU A 15 31.859 16.859 4.854 1.00 0.00 H new ATOM 0 HG LEU A 15 33.404 18.763 3.055 1.00 0.00 H new ATOM 0 HD11 LEU A 15 34.464 16.768 2.028 1.00 0.00 H new ATOM 0 HD12 LEU A 15 34.946 16.940 3.732 1.00 0.00 H new ATOM 0 HD13 LEU A 15 33.721 15.734 3.272 1.00 0.00 H new ATOM 0 HD21 LEU A 15 32.195 17.491 1.292 1.00 0.00 H new ATOM 0 HD22 LEU A 15 31.463 16.457 2.543 1.00 0.00 H new ATOM 0 HD23 LEU A 15 31.055 18.187 2.469 1.00 0.00 H new ATOM 254 N SER A 16 31.174 18.970 7.401 1.00 0.00 N0 ATOM 255 CA SER A 16 30.292 18.770 8.540 1.00 0.00 C0 ATOM 256 C SER A 16 29.261 19.888 8.623 1.00 0.00 C0 ATOM 257 O SER A 16 28.078 19.640 8.851 1.00 0.00 O0 ATOM 258 CB SER A 16 31.105 18.721 9.824 1.00 0.00 C0 ATOM 259 OG SER A 16 31.976 17.597 9.781 1.00 0.00 O0 ATOM 0 H SER A 16 32.113 19.287 7.643 1.00 0.00 H new ATOM 0 HA SER A 16 29.768 17.823 8.409 1.00 0.00 H new ATOM 0 HB2 SER A 16 31.681 19.639 9.939 1.00 0.00 H new ATOM 0 HB3 SER A 16 30.442 18.650 10.686 1.00 0.00 H new ATOM 0 HG SER A 16 32.557 17.663 8.995 1.00 0.00 H new ATOM 265 N ALA A 17 29.722 21.123 8.455 1.00 0.00 N0 ATOM 266 CA ALA A 17 28.820 22.263 8.531 1.00 0.00 C0 ATOM 267 C ALA A 17 27.716 22.132 7.491 1.00 0.00 C0 ATOM 268 O ALA A 17 26.530 22.223 7.812 1.00 0.00 O0 ATOM 269 CB ALA A 17 29.599 23.555 8.284 1.00 0.00 C0 ATOM 0 H ALA A 17 30.697 21.357 8.269 1.00 0.00 H new ATOM 0 HA ALA A 17 28.372 22.290 9.525 1.00 0.00 H new ATOM 0 HB1 ALA A 17 28.920 24.406 8.342 1.00 0.00 H new ATOM 0 HB2 ALA A 17 30.378 23.660 9.039 1.00 0.00 H new ATOM 0 HB3 ALA A 17 30.055 23.521 7.295 1.00 0.00 H new ATOM 275 N LEU A 18 28.108 21.895 6.243 1.00 0.00 N0 ATOM 276 CA LEU A 18 27.135 21.739 5.171 1.00 0.00 C0 ATOM 277 C LEU A 18 26.356 20.441 5.332 1.00 0.00 C0 ATOM 278 O LEU A 18 25.220 20.324 4.869 1.00 0.00 O0 ATOM 279 CB LEU A 18 27.845 21.744 3.819 1.00 0.00 C0 ATOM 280 CG LEU A 18 26.849 22.124 2.724 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 27.495 23.127 1.769 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 26.454 20.871 1.948 1.00 0.00 C0 ATOM 0 H LEU A 18 29.082 21.808 5.952 1.00 0.00 H new ATOM 0 HA LEU A 18 26.436 22.574 5.220 1.00 0.00 H new ATOM 0 HB2 LEU A 18 28.674 22.452 3.834 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.269 20.761 3.615 1.00 0.00 H new ATOM 0 HG LEU A 18 25.964 22.572 3.176 1.00 0.00 H new ATOM 0 HD11 LEU A 18 26.783 23.397 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 18 27.784 24.021 2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 18 28.379 22.679 1.315 1.00 0.00 H new ATOM 0 HD21 LEU A 18 25.743 21.137 1.165 1.00 0.00 H new ATOM 0 HD22 LEU A 18 27.342 20.428 1.497 1.00 0.00 H new ATOM 0 HD23 LEU A 18 25.994 20.152 2.627 1.00 0.00 H new ATOM 294 N HIS A 19 26.969 19.471 6.002 1.00 0.00 N0 ATOM 295 CA HIS A 19 26.318 18.193 6.223 1.00 0.00 C0 ATOM 296 C HIS A 19 25.068 18.352 7.070 1.00 0.00 C0 ATOM 297 O HIS A 19 23.984 17.911 6.686 1.00 0.00 O0 ATOM 298 CB HIS A 19 27.279 17.225 6.912 1.00 0.00 C0 ATOM 299 CG HIS A 19 26.503 16.190 7.672 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 26.127 14.981 7.109 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 26.028 16.171 8.958 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 25.455 14.290 8.048 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 25.366 14.969 9.194 1.00 0.00 N0 ATOM 0 H HIS A 19 27.907 19.547 6.396 1.00 0.00 H new ATOM 0 HA HIS A 19 26.029 17.793 5.251 1.00 0.00 H new ATOM 0 HB2 HIS A 19 27.917 16.743 6.171 1.00 0.00 H new ATOM 0 HB3 HIS A 19 27.935 17.771 7.590 1.00 0.00 H new ATOM 0 HD2 HIS A 19 26.149 16.967 9.678 1.00 0.00 H new ATOM 0 HE1 HIS A 19 25.038 13.306 7.893 1.00 0.00 H new ATOM 0 HE2 HIS A 19 24.911 14.671 10.057 1.00 0.00 H new ATOM 311 N PHE A 20 25.218 19.003 8.212 1.00 0.00 N0 ATOM 312 CA PHE A 20 24.089 19.224 9.096 1.00 0.00 C0 ATOM 313 C PHE A 20 23.160 20.283 8.520 1.00 0.00 C0 ATOM 314 O PHE A 20 21.980 20.335 8.859 1.00 0.00 O0 ATOM 315 CB PHE A 20 24.580 19.657 10.479 1.00 0.00 C0 ATOM 316 CG PHE A 20 24.184 18.619 11.503 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 25.161 17.816 12.104 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 22.837 18.463 11.853 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 24.790 16.857 13.055 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 22.467 17.504 12.803 1.00 0.00 C0 ATOM 321 CZ PHE A 20 23.443 16.702 13.405 1.00 0.00 C0 ATOM 0 H PHE A 20 26.103 19.384 8.545 1.00 0.00 H new ATOM 0 HA PHE A 20 23.536 18.289 9.191 1.00 0.00 H new ATOM 0 HB2 PHE A 20 25.663 19.779 10.470 1.00 0.00 H new ATOM 0 HB3 PHE A 20 24.152 20.624 10.742 1.00 0.00 H new ATOM 0 HD1 PHE A 20 26.200 17.936 11.834 1.00 0.00 H new ATOM 0 HD2 PHE A 20 22.084 19.083 11.390 1.00 0.00 H new ATOM 0 HE1 PHE A 20 25.543 16.237 13.519 1.00 0.00 H new ATOM 0 HE2 PHE A 20 21.428 17.383 13.071 1.00 0.00 H new ATOM 0 HZ PHE A 20 23.157 15.964 14.140 1.00 0.00 H new ATOM 331 N MET A 21 23.688 21.120 7.635 1.00 0.00 N0 ATOM 332 CA MET A 21 22.880 22.159 7.021 1.00 0.00 C0 ATOM 333 C MET A 21 21.847 21.560 6.068 1.00 0.00 C0 ATOM 334 O MET A 21 20.645 21.775 6.220 1.00 0.00 O0 ATOM 335 CB MET A 21 23.787 23.109 6.253 1.00 0.00 C0 ATOM 336 CG MET A 21 23.514 24.542 6.709 1.00 0.00 C0 ATOM 337 SD MET A 21 24.152 24.784 8.386 1.00 0.00 S0 ATOM 338 CE MET A 21 22.933 26.011 8.923 1.00 0.00 C0 ATOM 0 H MET A 21 24.661 21.099 7.331 1.00 0.00 H new ATOM 0 HA MET A 21 22.350 22.697 7.807 1.00 0.00 H new ATOM 0 HB2 MET A 21 24.832 22.852 6.426 1.00 0.00 H new ATOM 0 HB3 MET A 21 23.609 23.015 5.182 1.00 0.00 H new ATOM 0 HG2 MET A 21 23.986 25.247 6.025 1.00 0.00 H new ATOM 0 HG3 MET A 21 22.443 24.743 6.685 1.00 0.00 H new ATOM 0 HE1 MET A 21 23.142 26.306 9.951 1.00 0.00 H new ATOM 0 HE2 MET A 21 22.988 26.886 8.276 1.00 0.00 H new ATOM 0 HE3 MET A 21 21.933 25.580 8.866 1.00 0.00 H new ATOM 348 N ALA A 22 22.327 20.809 5.084 1.00 0.00 N0 ATOM 349 CA ALA A 22 21.439 20.188 4.111 1.00 0.00 C0 ATOM 350 C ALA A 22 20.536 19.155 4.776 1.00 0.00 C0 ATOM 351 O ALA A 22 19.357 19.038 4.437 1.00 0.00 O0 ATOM 352 CB ALA A 22 22.253 19.522 3.003 1.00 0.00 C0 ATOM 0 H ALA A 22 23.318 20.617 4.940 1.00 0.00 H new ATOM 0 HA ALA A 22 20.813 20.969 3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 22 21.578 19.061 2.282 1.00 0.00 H new ATOM 0 HB2 ALA A 22 22.864 20.271 2.500 1.00 0.00 H new ATOM 0 HB3 ALA A 22 22.899 18.757 3.435 1.00 0.00 H new ATOM 358 N TRP A 23 21.096 18.396 5.711 1.00 0.00 N0 ATOM 359 CA TRP A 23 20.331 17.363 6.401 1.00 0.00 C0 ATOM 360 C TRP A 23 19.169 17.984 7.178 1.00 0.00 C0 ATOM 361 O TRP A 23 18.055 17.458 7.175 1.00 0.00 O0 ATOM 362 CB TRP A 23 21.247 16.602 7.359 1.00 0.00 C0 ATOM 363 CG TRP A 23 20.657 15.265 7.654 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 21.029 14.107 7.064 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 19.593 14.923 8.591 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 20.267 13.075 7.581 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 19.366 13.528 8.525 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 18.810 15.680 9.484 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 18.399 12.906 9.315 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 17.834 15.055 10.280 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 17.631 13.671 10.196 1.00 0.00 C0 ATOM 0 H TRP A 23 22.069 18.475 6.007 1.00 0.00 H new ATOM 0 HA TRP A 23 19.924 16.674 5.661 1.00 0.00 H new ATOM 0 HB2 TRP A 23 22.237 16.485 6.917 1.00 0.00 H new ATOM 0 HB3 TRP A 23 21.375 17.167 8.282 1.00 0.00 H new ATOM 0 HD1 TRP A 23 21.797 14.004 6.311 1.00 0.00 H new ATOM 0 HE1 TRP A 23 20.359 12.099 7.300 1.00 0.00 H new ATOM 0 HE3 TRP A 23 18.960 16.747 9.558 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 18.245 11.839 9.246 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 17.237 15.645 10.960 1.00 0.00 H new ATOM 0 HH2 TRP A 23 16.881 13.196 10.812 1.00 0.00 H new ATOM 382 N THR A 24 19.431 19.115 7.832 1.00 0.00 N0 ATOM 383 CA THR A 24 18.394 19.798 8.599 1.00 0.00 C0 ATOM 384 C THR A 24 17.322 20.362 7.673 1.00 0.00 C0 ATOM 385 O THR A 24 16.135 20.333 7.997 1.00 0.00 O0 ATOM 386 CB THR A 24 19.012 20.931 9.426 1.00 0.00 C0 ATOM 387 OG1 THR A 24 19.886 21.694 8.607 1.00 0.00 O0 ATOM 388 CG2 THR A 24 19.786 20.347 10.614 1.00 0.00 C0 ATOM 0 H THR A 24 20.343 19.573 7.846 1.00 0.00 H new ATOM 0 HA THR A 24 17.930 19.074 9.269 1.00 0.00 H new ATOM 0 HB THR A 24 18.219 21.576 9.804 1.00 0.00 H new ATOM 0 HG1 THR A 24 20.814 21.526 8.873 1.00 0.00 H new ATOM 0 HG21 THR A 24 20.223 21.157 11.198 1.00 0.00 H new ATOM 0 HG22 THR A 24 19.107 19.772 11.243 1.00 0.00 H new ATOM 0 HG23 THR A 24 20.579 19.696 10.247 1.00 0.00 H new ATOM 396 N ILE A 25 17.743 20.864 6.520 1.00 0.00 N0 ATOM 397 CA ILE A 25 16.800 21.420 5.557 1.00 0.00 C0 ATOM 398 C ILE A 25 15.836 20.344 5.067 1.00 0.00 C0 ATOM 399 O ILE A 25 14.630 20.570 4.988 1.00 0.00 O0 ATOM 400 CB ILE A 25 17.555 22.012 4.370 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 18.296 23.274 4.817 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 16.566 22.370 3.259 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 19.307 23.681 3.744 1.00 0.00 C0 ATOM 0 H ILE A 25 18.720 20.898 6.230 1.00 0.00 H new ATOM 0 HA ILE A 25 16.227 22.206 6.050 1.00 0.00 H new ATOM 0 HB ILE A 25 18.271 21.281 3.995 1.00 0.00 H new ATOM 0 HG12 ILE A 25 17.586 24.083 4.988 1.00 0.00 H new ATOM 0 HG13 ILE A 25 18.807 23.093 5.763 1.00 0.00 H new ATOM 0 HG21 ILE A 25 17.107 22.793 2.412 1.00 0.00 H new ATOM 0 HG22 ILE A 25 16.037 21.472 2.940 1.00 0.00 H new ATOM 0 HG23 ILE A 25 15.848 23.101 3.632 1.00 0.00 H new ATOM 0 HD11 ILE A 25 19.834 24.580 4.063 1.00 0.00 H new ATOM 0 HD12 ILE A 25 20.024 22.874 3.595 1.00 0.00 H new ATOM 0 HD13 ILE A 25 18.784 23.880 2.808 1.00 0.00 H new ATOM 415 N GLY A 26 16.374 19.172 4.738 1.00 0.00 N0 ATOM 416 CA GLY A 26 15.544 18.070 4.260 1.00 0.00 C0 ATOM 417 C GLY A 26 14.561 17.624 5.336 1.00 0.00 C0 ATOM 418 O GLY A 26 13.391 17.365 5.055 1.00 0.00 O0 ATOM 0 H GLY A 26 17.371 18.962 4.793 1.00 0.00 H new ATOM 0 HA2 GLY A 26 14.998 18.380 3.369 1.00 0.00 H new ATOM 0 HA3 GLY A 26 16.177 17.232 3.970 1.00 0.00 H new ATOM 422 N HIS A 27 15.043 17.545 6.571 1.00 0.00 N0 ATOM 423 CA HIS A 27 14.199 17.138 7.689 1.00 0.00 C0 ATOM 424 C HIS A 27 13.031 18.102 7.860 1.00 0.00 C0 ATOM 425 O HIS A 27 11.898 17.684 8.099 1.00 0.00 O0 ATOM 426 CB HIS A 27 15.022 17.089 8.977 1.00 0.00 C0 ATOM 427 CG HIS A 27 14.100 16.966 10.156 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 13.400 15.802 10.436 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 13.751 17.859 11.137 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 12.670 16.025 11.545 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 12.847 17.264 12.013 1.00 0.00 N0 ATOM 0 H HIS A 27 16.009 17.756 6.823 1.00 0.00 H new ATOM 0 HA HIS A 27 13.803 16.145 7.477 1.00 0.00 H new ATOM 0 HB2 HIS A 27 15.710 16.244 8.950 1.00 0.00 H new ATOM 0 HB3 HIS A 27 15.628 17.990 9.068 1.00 0.00 H new ATOM 0 HD2 HIS A 27 14.121 18.870 11.218 1.00 0.00 H new ATOM 0 HE1 HIS A 27 12.021 15.292 12.001 1.00 0.00 H new ATOM 0 HE2 HIS A 27 12.413 17.684 12.835 1.00 0.00 H new ATOM 439 N LEU A 28 13.313 19.395 7.742 1.00 0.00 N0 ATOM 440 CA LEU A 28 12.277 20.410 7.890 1.00 0.00 C0 ATOM 441 C LEU A 28 11.567 20.653 6.560 1.00 0.00 C0 ATOM 442 O LEU A 28 12.204 20.767 5.515 1.00 0.00 O0 ATOM 443 CB LEU A 28 12.903 21.715 8.387 1.00 0.00 C0 ATOM 444 CG LEU A 28 13.551 21.486 9.755 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 14.330 22.737 10.166 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 12.464 21.201 10.796 1.00 0.00 C0 ATOM 0 H LEU A 28 14.244 19.763 7.546 1.00 0.00 H new ATOM 0 HA LEU A 28 11.544 20.057 8.615 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.649 22.067 7.674 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.141 22.491 8.460 1.00 0.00 H new ATOM 0 HG LEU A 28 14.230 20.635 9.696 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.792 22.575 11.140 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.105 22.942 9.427 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.650 23.587 10.224 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.926 21.038 11.770 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.785 22.051 10.855 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.907 20.311 10.506 1.00 0.00 H new ATOM 594 N GLU B 3 41.680 18.407 30.964 1.00 0.00 N0 ATOM 595 CA GLU B 3 40.697 17.928 29.999 1.00 0.00 C0 ATOM 596 C GLU B 3 40.761 16.403 29.867 1.00 0.00 C0 ATOM 597 O GLU B 3 41.812 15.800 30.089 1.00 0.00 O0 ATOM 598 CB GLU B 3 40.952 18.570 28.636 1.00 0.00 C0 ATOM 599 CG GLU B 3 42.345 18.180 28.141 1.00 0.00 C0 ATOM 600 CD GLU B 3 43.147 19.434 27.816 1.00 0.00 C0 ATOM 601 OE1 GLU B 3 42.834 20.074 26.825 1.00 0.00 O0 ATOM 602 OE2 GLU B 3 44.061 19.737 28.564 1.00 0.00 O1- ATOM 0 HA GLU B 3 39.705 18.205 30.355 1.00 0.00 H new ATOM 0 HB2 GLU B 3 40.196 18.244 27.922 1.00 0.00 H new ATOM 0 HB3 GLU B 3 40.872 19.654 28.712 1.00 0.00 H new ATOM 0 HG2 GLU B 3 42.861 17.595 28.902 1.00 0.00 H new ATOM 0 HG3 GLU B 3 42.263 17.550 27.255 1.00 0.00 H new ATOM 609 N PRO B 4 39.668 15.776 29.500 1.00 0.00 N0 ATOM 610 CA PRO B 4 39.608 14.293 29.327 1.00 0.00 C0 ATOM 611 C PRO B 4 40.366 13.829 28.084 1.00 0.00 C0 ATOM 612 O PRO B 4 41.108 12.848 28.127 1.00 0.00 O0 ATOM 613 CB PRO B 4 38.111 14.005 29.185 1.00 0.00 C0 ATOM 614 CG PRO B 4 37.508 15.274 28.680 1.00 0.00 C0 ATOM 615 CD PRO B 4 38.372 16.411 29.218 1.00 0.00 C0 ATOM 0 HA PRO B 4 40.073 13.765 30.160 1.00 0.00 H new ATOM 0 HB2 PRO B 4 37.933 13.183 28.492 1.00 0.00 H new ATOM 0 HB3 PRO B 4 37.674 13.716 30.141 1.00 0.00 H new ATOM 0 HG2 PRO B 4 37.486 15.286 27.590 1.00 0.00 H new ATOM 0 HG3 PRO B 4 36.478 15.376 29.020 1.00 0.00 H new ATOM 0 HD2 PRO B 4 38.472 17.215 28.488 1.00 0.00 H new ATOM 0 HD3 PRO B 4 37.939 16.849 30.117 1.00 0.00 H new ATOM 623 N PHE B 5 40.175 14.546 26.981 1.00 0.00 N0 ATOM 624 CA PHE B 5 40.846 14.206 25.732 1.00 0.00 C0 ATOM 625 C PHE B 5 41.242 15.475 24.977 1.00 0.00 C0 ATOM 626 O PHE B 5 42.371 15.951 25.098 1.00 0.00 O0 ATOM 627 CB PHE B 5 39.928 13.335 24.860 1.00 0.00 C0 ATOM 628 CG PHE B 5 40.394 11.904 24.898 1.00 0.00 C0 ATOM 629 CD1 PHE B 5 39.855 11.016 25.834 1.00 0.00 C0 ATOM 630 CD2 PHE B 5 41.363 11.463 23.989 1.00 0.00 C0 ATOM 631 CE1 PHE B 5 40.284 9.684 25.863 1.00 0.00 C0 ATOM 632 CE2 PHE B 5 41.793 10.132 24.018 1.00 0.00 C0 ATOM 633 CZ PHE B 5 41.254 9.242 24.955 1.00 0.00 C0 ATOM 0 H PHE B 5 39.565 15.361 26.927 1.00 0.00 H new ATOM 0 HA PHE B 5 41.750 13.644 25.964 1.00 0.00 H new ATOM 0 HB2 PHE B 5 38.901 13.402 25.218 1.00 0.00 H new ATOM 0 HB3 PHE B 5 39.932 13.701 23.833 1.00 0.00 H new ATOM 0 HD1 PHE B 5 39.108 11.358 26.535 1.00 0.00 H new ATOM 0 HD2 PHE B 5 41.778 12.150 23.266 1.00 0.00 H new ATOM 0 HE1 PHE B 5 39.867 8.998 26.585 1.00 0.00 H new ATOM 0 HE2 PHE B 5 42.541 9.791 23.317 1.00 0.00 H new ATOM 0 HZ PHE B 5 41.586 8.215 24.977 1.00 0.00 H new ATOM 643 N GLN B 6 40.309 16.016 24.195 1.00 0.00 N0 ATOM 644 CA GLN B 6 40.569 17.223 23.422 1.00 0.00 C0 ATOM 645 C GLN B 6 39.276 17.994 23.195 1.00 0.00 C0 ATOM 646 O GLN B 6 38.181 17.446 23.323 1.00 0.00 O0 ATOM 647 CB GLN B 6 41.196 16.859 22.072 1.00 0.00 C0 ATOM 648 CG GLN B 6 42.552 16.186 22.296 1.00 0.00 C0 ATOM 649 CD GLN B 6 43.273 16.009 20.965 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 43.808 16.971 20.416 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 43.310 14.830 20.406 1.00 0.00 N0 ATOM 0 H GLN B 6 39.369 15.636 24.082 1.00 0.00 H new ATOM 0 HA GLN B 6 41.262 17.850 23.982 1.00 0.00 H new ATOM 0 HB2 GLN B 6 40.534 16.190 21.522 1.00 0.00 H new ATOM 0 HB3 GLN B 6 41.320 17.756 21.465 1.00 0.00 H new ATOM 0 HG2 GLN B 6 43.160 16.789 22.971 1.00 0.00 H new ATOM 0 HG3 GLN B 6 42.411 15.217 22.774 1.00 0.00 H new ATOM 0 HE21 GLN B 6 42.865 14.034 20.864 1.00 0.00 H new ATOM 0 HE22 GLN B 6 43.784 14.704 19.511 1.00 0.00 H new ATOM 660 N ILE B 7 39.409 19.270 22.861 1.00 0.00 N0 ATOM 661 CA ILE B 7 38.245 20.108 22.619 1.00 0.00 C0 ATOM 662 C ILE B 7 37.398 19.526 21.484 1.00 0.00 C0 ATOM 663 O ILE B 7 36.166 19.608 21.505 1.00 0.00 O0 ATOM 664 CB ILE B 7 38.702 21.528 22.262 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 39.480 21.505 20.938 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 39.607 22.075 23.372 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 40.012 22.906 20.626 1.00 0.00 C0 ATOM 0 H ILE B 7 40.305 19.744 22.752 1.00 0.00 H new ATOM 0 HA ILE B 7 37.636 20.142 23.522 1.00 0.00 H new ATOM 0 HB ILE B 7 37.826 22.168 22.158 1.00 0.00 H new ATOM 0 HG12 ILE B 7 40.307 20.798 21.004 1.00 0.00 H new ATOM 0 HG13 ILE B 7 38.832 21.164 20.131 1.00 0.00 H new ATOM 0 HG21 ILE B 7 39.929 23.084 23.114 1.00 0.00 H new ATOM 0 HG22 ILE B 7 39.056 22.099 24.312 1.00 0.00 H new ATOM 0 HG23 ILE B 7 40.480 21.431 23.480 1.00 0.00 H new ATOM 0 HD11 ILE B 7 40.563 22.885 19.686 1.00 0.00 H new ATOM 0 HD12 ILE B 7 39.177 23.602 20.542 1.00 0.00 H new ATOM 0 HD13 ILE B 7 40.675 23.230 21.428 1.00 0.00 H new ATOM 679 N LEU B 8 38.070 18.931 20.504 1.00 0.00 N0 ATOM 680 CA LEU B 8 37.383 18.326 19.367 1.00 0.00 C0 ATOM 681 C LEU B 8 36.678 17.040 19.785 1.00 0.00 C0 ATOM 682 O LEU B 8 35.605 16.711 19.274 1.00 0.00 O0 ATOM 683 CB LEU B 8 38.387 18.029 18.248 1.00 0.00 C0 ATOM 684 CG LEU B 8 38.912 19.344 17.664 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 40.095 19.054 16.735 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 37.799 20.037 16.869 1.00 0.00 C0 ATOM 0 H LEU B 8 39.087 18.854 20.473 1.00 0.00 H new ATOM 0 HA LEU B 8 36.634 19.029 19.003 1.00 0.00 H new ATOM 0 HB2 LEU B 8 39.215 17.436 18.637 1.00 0.00 H new ATOM 0 HB3 LEU B 8 37.911 17.437 17.466 1.00 0.00 H new ATOM 0 HG LEU B 8 39.236 19.995 18.476 1.00 0.00 H new ATOM 0 HD11 LEU B 8 40.469 19.990 16.319 1.00 0.00 H new ATOM 0 HD12 LEU B 8 40.889 18.565 17.299 1.00 0.00 H new ATOM 0 HD13 LEU B 8 39.770 18.401 15.925 1.00 0.00 H new ATOM 0 HD21 LEU B 8 38.176 20.972 16.455 1.00 0.00 H new ATOM 0 HD22 LEU B 8 37.472 19.387 16.058 1.00 0.00 H new ATOM 0 HD23 LEU B 8 36.957 20.246 17.528 1.00 0.00 H new ATOM 698 N SER B 9 37.286 16.329 20.728 1.00 0.00 N0 ATOM 699 CA SER B 9 36.713 15.085 21.227 1.00 0.00 C0 ATOM 700 C SER B 9 35.468 15.360 22.063 1.00 0.00 C0 ATOM 701 O SER B 9 34.454 14.676 21.929 1.00 0.00 O0 ATOM 702 CB SER B 9 37.742 14.328 22.067 1.00 0.00 C0 ATOM 703 OG SER B 9 37.169 13.108 22.522 1.00 0.00 O0 ATOM 0 H SER B 9 38.172 16.591 21.161 1.00 0.00 H new ATOM 0 HA SER B 9 36.430 14.474 20.370 1.00 0.00 H new ATOM 0 HB2 SER B 9 38.634 14.126 21.475 1.00 0.00 H new ATOM 0 HB3 SER B 9 38.054 14.936 22.916 1.00 0.00 H new ATOM 0 HG SER B 9 37.826 12.619 23.060 1.00 0.00 H new ATOM 709 N ILE B 10 35.549 16.372 22.922 1.00 0.00 N0 ATOM 710 CA ILE B 10 34.418 16.732 23.773 1.00 0.00 C0 ATOM 711 C ILE B 10 33.235 17.195 22.933 1.00 0.00 C0 ATOM 712 O ILE B 10 32.101 16.771 23.157 1.00 0.00 O0 ATOM 713 CB ILE B 10 34.825 17.845 24.737 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 35.833 17.299 25.749 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 33.588 18.357 25.478 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 36.509 18.464 26.473 1.00 0.00 C0 ATOM 0 H ILE B 10 36.378 16.953 23.047 1.00 0.00 H new ATOM 0 HA ILE B 10 34.121 15.849 24.338 1.00 0.00 H new ATOM 0 HB ILE B 10 35.278 18.663 24.176 1.00 0.00 H new ATOM 0 HG12 ILE B 10 35.329 16.653 26.468 1.00 0.00 H new ATOM 0 HG13 ILE B 10 36.580 16.689 25.241 1.00 0.00 H new ATOM 0 HG21 ILE B 10 33.879 19.151 26.166 1.00 0.00 H new ATOM 0 HG22 ILE B 10 32.868 18.746 24.758 1.00 0.00 H new ATOM 0 HG23 ILE B 10 33.135 17.539 26.039 1.00 0.00 H new ATOM 0 HD11 ILE B 10 37.228 18.076 27.195 1.00 0.00 H new ATOM 0 HD12 ILE B 10 37.026 19.092 25.748 1.00 0.00 H new ATOM 0 HD13 ILE B 10 35.756 19.055 26.993 1.00 0.00 H new ATOM 728 N CYS B 11 33.507 18.073 21.968 1.00 0.00 N0 ATOM 729 CA CYS B 11 32.449 18.593 21.107 1.00 0.00 C0 ATOM 730 C CYS B 11 31.766 17.446 20.373 1.00 0.00 C0 ATOM 731 O CYS B 11 30.542 17.338 20.374 1.00 0.00 O0 ATOM 732 CB CYS B 11 33.042 19.575 20.095 1.00 0.00 C0 ATOM 733 SG CYS B 11 31.706 20.450 19.246 1.00 0.00 S0 ATOM 0 H CYS B 11 34.439 18.435 21.765 1.00 0.00 H new ATOM 0 HA CYS B 11 31.712 19.111 21.721 1.00 0.00 H new ATOM 0 HB2 CYS B 11 33.692 20.287 20.602 1.00 0.00 H new ATOM 0 HB3 CYS B 11 33.658 19.040 19.372 1.00 0.00 H new ATOM 0 HG CYS B 11 32.211 21.286 18.388 1.00 0.00 H new ATOM 739 N SER B 12 32.559 16.596 19.733 1.00 0.00 N0 ATOM 740 CA SER B 12 31.996 15.474 19.000 1.00 0.00 C0 ATOM 741 C SER B 12 31.226 14.552 19.937 1.00 0.00 C0 ATOM 742 O SER B 12 30.182 14.025 19.570 1.00 0.00 O0 ATOM 743 CB SER B 12 33.108 14.681 18.326 1.00 0.00 C0 ATOM 744 OG SER B 12 33.991 14.191 19.322 1.00 0.00 O0 ATOM 0 H SER B 12 33.577 16.661 19.707 1.00 0.00 H new ATOM 0 HA SER B 12 31.314 15.868 18.246 1.00 0.00 H new ATOM 0 HB2 SER B 12 32.688 13.853 17.755 1.00 0.00 H new ATOM 0 HB3 SER B 12 33.648 15.313 17.621 1.00 0.00 H new ATOM 0 HG SER B 12 34.006 14.812 20.080 1.00 0.00 H new ATOM 750 N PHE B 13 31.749 14.348 21.144 1.00 0.00 N0 ATOM 751 CA PHE B 13 31.094 13.466 22.105 1.00 0.00 C0 ATOM 752 C PHE B 13 29.662 13.918 22.385 1.00 0.00 C0 ATOM 753 O PHE B 13 28.714 13.145 22.221 1.00 0.00 O0 ATOM 754 CB PHE B 13 31.882 13.479 23.413 1.00 0.00 C0 ATOM 755 CG PHE B 13 31.086 12.781 24.489 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 31.037 11.383 24.527 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 30.395 13.532 25.449 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 30.296 10.736 25.522 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 29.655 12.885 26.445 1.00 0.00 C0 ATOM 760 CZ PHE B 13 29.605 11.487 26.481 1.00 0.00 C0 ATOM 0 H PHE B 13 32.613 14.776 21.476 1.00 0.00 H new ATOM 0 HA PHE B 13 31.064 12.461 21.683 1.00 0.00 H new ATOM 0 HB2 PHE B 13 32.842 12.982 23.276 1.00 0.00 H new ATOM 0 HB3 PHE B 13 32.094 14.506 23.711 1.00 0.00 H new ATOM 0 HD1 PHE B 13 31.571 10.804 23.788 1.00 0.00 H new ATOM 0 HD2 PHE B 13 30.434 14.611 25.420 1.00 0.00 H new ATOM 0 HE1 PHE B 13 30.257 9.657 25.550 1.00 0.00 H new ATOM 0 HE2 PHE B 13 29.123 13.464 27.185 1.00 0.00 H new ATOM 0 HZ PHE B 13 29.033 10.987 27.249 1.00 0.00 H new ATOM 770 N ILE B 14 29.508 15.166 22.807 1.00 0.00 N0 ATOM 771 CA ILE B 14 28.182 15.696 23.106 1.00 0.00 C0 ATOM 772 C ILE B 14 27.330 15.743 21.843 1.00 0.00 C0 ATOM 773 O ILE B 14 26.135 15.438 21.874 1.00 0.00 O0 ATOM 774 CB ILE B 14 28.305 17.099 23.727 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 26.914 17.682 24.018 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 29.061 18.034 22.779 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 26.329 17.008 25.261 1.00 0.00 C0 ATOM 0 H ILE B 14 30.274 15.824 22.949 1.00 0.00 H new ATOM 0 HA ILE B 14 27.693 15.037 23.823 1.00 0.00 H new ATOM 0 HB ILE B 14 28.857 17.011 24.663 1.00 0.00 H new ATOM 0 HG12 ILE B 14 26.984 18.758 24.174 1.00 0.00 H new ATOM 0 HG13 ILE B 14 26.256 17.526 23.163 1.00 0.00 H new ATOM 0 HG21 ILE B 14 29.141 19.023 23.230 1.00 0.00 H new ATOM 0 HG22 ILE B 14 30.059 17.637 22.596 1.00 0.00 H new ATOM 0 HG23 ILE B 14 28.522 18.109 21.835 1.00 0.00 H new ATOM 0 HD11 ILE B 14 25.342 17.421 25.468 1.00 0.00 H new ATOM 0 HD12 ILE B 14 26.244 15.935 25.087 1.00 0.00 H new ATOM 0 HD13 ILE B 14 26.984 17.187 26.114 1.00 0.00 H new ATOM 789 N LEU B 15 27.950 16.130 20.737 1.00 0.00 N0 ATOM 790 CA LEU B 15 27.239 16.222 19.472 1.00 0.00 C0 ATOM 791 C LEU B 15 26.757 14.848 19.027 1.00 0.00 C0 ATOM 792 O LEU B 15 25.746 14.728 18.342 1.00 0.00 O0 ATOM 793 CB LEU B 15 28.149 16.831 18.403 1.00 0.00 C0 ATOM 794 CG LEU B 15 28.096 18.359 18.485 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 29.312 18.953 17.770 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 26.823 18.858 17.798 1.00 0.00 C0 ATOM 0 H LEU B 15 28.937 16.383 20.691 1.00 0.00 H new ATOM 0 HA LEU B 15 26.370 16.865 19.609 1.00 0.00 H new ATOM 0 HB2 LEU B 15 29.173 16.486 18.544 1.00 0.00 H new ATOM 0 HB3 LEU B 15 27.835 16.500 17.413 1.00 0.00 H new ATOM 0 HG LEU B 15 28.099 18.665 19.531 1.00 0.00 H new ATOM 0 HD11 LEU B 15 29.273 20.041 17.829 1.00 0.00 H new ATOM 0 HD12 LEU B 15 30.225 18.596 18.247 1.00 0.00 H new ATOM 0 HD13 LEU B 15 29.305 18.646 16.724 1.00 0.00 H new ATOM 0 HD21 LEU B 15 26.782 19.946 17.854 1.00 0.00 H new ATOM 0 HD22 LEU B 15 26.828 18.549 16.753 1.00 0.00 H new ATOM 0 HD23 LEU B 15 25.951 18.435 18.297 1.00 0.00 H new ATOM 808 N SER B 16 27.479 13.819 19.439 1.00 0.00 N0 ATOM 809 CA SER B 16 27.119 12.453 19.091 1.00 0.00 C0 ATOM 810 C SER B 16 25.908 11.996 19.893 1.00 0.00 C0 ATOM 811 O SER B 16 24.988 11.386 19.353 1.00 0.00 O0 ATOM 812 CB SER B 16 28.293 11.523 19.357 1.00 0.00 C0 ATOM 813 OG SER B 16 29.377 11.890 18.513 1.00 0.00 O0 ATOM 0 H SER B 16 28.317 13.903 20.014 1.00 0.00 H new ATOM 0 HA SER B 16 26.867 12.422 18.031 1.00 0.00 H new ATOM 0 HB2 SER B 16 28.593 11.586 20.403 1.00 0.00 H new ATOM 0 HB3 SER B 16 28.004 10.489 19.170 1.00 0.00 H new ATOM 0 HG SER B 16 29.989 12.478 19.003 1.00 0.00 H new ATOM 819 N ALA B 17 25.923 12.283 21.191 1.00 0.00 N0 ATOM 820 CA ALA B 17 24.818 11.879 22.047 1.00 0.00 C0 ATOM 821 C ALA B 17 23.515 12.485 21.548 1.00 0.00 C0 ATOM 822 O ALA B 17 22.527 11.778 21.338 1.00 0.00 O0 ATOM 823 CB ALA B 17 25.077 12.346 23.480 1.00 0.00 C0 ATOM 0 H ALA B 17 26.674 12.785 21.665 1.00 0.00 H new ATOM 0 HA ALA B 17 24.738 10.792 22.024 1.00 0.00 H new ATOM 0 HB1 ALA B 17 24.247 12.041 24.118 1.00 0.00 H new ATOM 0 HB2 ALA B 17 26.000 11.898 23.847 1.00 0.00 H new ATOM 0 HB3 ALA B 17 25.169 13.432 23.498 1.00 0.00 H new ATOM 829 N LEU B 18 23.518 13.797 21.332 1.00 0.00 N0 ATOM 830 CA LEU B 18 22.327 14.476 20.840 1.00 0.00 C0 ATOM 831 C LEU B 18 22.042 14.093 19.396 1.00 0.00 C0 ATOM 832 O LEU B 18 20.897 14.146 18.942 1.00 0.00 O0 ATOM 833 CB LEU B 18 22.518 15.989 20.935 1.00 0.00 C0 ATOM 834 CG LEU B 18 21.151 16.672 20.952 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 21.135 17.765 22.024 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 20.886 17.298 19.586 1.00 0.00 C0 ATOM 0 H LEU B 18 24.323 14.404 21.488 1.00 0.00 H new ATOM 0 HA LEU B 18 21.481 14.171 21.456 1.00 0.00 H new ATOM 0 HB2 LEU B 18 23.074 16.241 21.838 1.00 0.00 H new ATOM 0 HB3 LEU B 18 23.105 16.347 20.089 1.00 0.00 H new ATOM 0 HG LEU B 18 20.379 15.936 21.176 1.00 0.00 H new ATOM 0 HD11 LEU B 18 20.159 18.251 22.034 1.00 0.00 H new ATOM 0 HD12 LEU B 18 21.329 17.320 23.000 1.00 0.00 H new ATOM 0 HD13 LEU B 18 21.905 18.504 21.802 1.00 0.00 H new ATOM 0 HD21 LEU B 18 19.912 17.787 19.593 1.00 0.00 H new ATOM 0 HD22 LEU B 18 21.660 18.034 19.367 1.00 0.00 H new ATOM 0 HD23 LEU B 18 20.897 16.521 18.821 1.00 0.00 H new ATOM 848 N HIS B 19 23.087 13.697 18.679 1.00 0.00 N0 ATOM 849 CA HIS B 19 22.930 13.299 17.292 1.00 0.00 C0 ATOM 850 C HIS B 19 22.042 12.073 17.170 1.00 0.00 C0 ATOM 851 O HIS B 19 21.060 12.077 16.426 1.00 0.00 O0 ATOM 852 CB HIS B 19 24.296 12.999 16.674 1.00 0.00 C0 ATOM 853 CG HIS B 19 24.137 12.045 15.527 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 23.947 12.475 14.224 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 24.141 10.675 15.475 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 23.846 11.380 13.448 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 23.957 10.257 14.161 1.00 0.00 N0 ATOM 0 H HIS B 19 24.042 13.644 19.034 1.00 0.00 H new ATOM 0 HA HIS B 19 22.458 14.124 16.759 1.00 0.00 H new ATOM 0 HB2 HIS B 19 24.760 13.923 16.329 1.00 0.00 H new ATOM 0 HB3 HIS B 19 24.959 12.571 17.426 1.00 0.00 H new ATOM 0 HD2 HIS B 19 24.268 10.020 16.325 1.00 0.00 H new ATOM 0 HE1 HIS B 19 23.694 11.407 12.379 1.00 0.00 H new ATOM 0 HE2 HIS B 19 23.916 9.298 13.816 1.00 0.00 H new ATOM 865 N PHE B 20 22.376 11.034 17.919 1.00 0.00 N0 ATOM 866 CA PHE B 20 21.592 9.812 17.893 1.00 0.00 C0 ATOM 867 C PHE B 20 20.270 10.012 18.619 1.00 0.00 C0 ATOM 868 O PHE B 20 19.304 9.293 18.373 1.00 0.00 O0 ATOM 869 CB PHE B 20 22.374 8.667 18.542 1.00 0.00 C0 ATOM 870 CG PHE B 20 22.649 7.594 17.512 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 23.954 7.382 17.046 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 21.597 6.813 17.016 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 24.204 6.392 16.085 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 21.847 5.822 16.058 1.00 0.00 C0 ATOM 875 CZ PHE B 20 23.151 5.611 15.589 1.00 0.00 C0 ATOM 0 H PHE B 20 23.179 11.013 18.548 1.00 0.00 H new ATOM 0 HA PHE B 20 21.386 9.557 16.853 1.00 0.00 H new ATOM 0 HB2 PHE B 20 23.312 9.040 18.952 1.00 0.00 H new ATOM 0 HB3 PHE B 20 21.806 8.250 19.374 1.00 0.00 H new ATOM 0 HD1 PHE B 20 24.767 7.982 17.427 1.00 0.00 H new ATOM 0 HD2 PHE B 20 20.591 6.975 17.373 1.00 0.00 H new ATOM 0 HE1 PHE B 20 25.210 6.231 15.726 1.00 0.00 H new ATOM 0 HE2 PHE B 20 21.034 5.220 15.680 1.00 0.00 H new ATOM 0 HZ PHE B 20 23.344 4.849 14.848 1.00 0.00 H new ATOM 885 N MET B 21 20.218 11.006 19.497 1.00 0.00 N0 ATOM 886 CA MET B 21 18.995 11.283 20.231 1.00 0.00 C0 ATOM 887 C MET B 21 17.916 11.841 19.307 1.00 0.00 C0 ATOM 888 O MET B 21 16.824 11.284 19.197 1.00 0.00 O0 ATOM 889 CB MET B 21 19.291 12.291 21.332 1.00 0.00 C0 ATOM 890 CG MET B 21 18.796 11.735 22.667 1.00 0.00 C0 ATOM 891 SD MET B 21 19.862 10.369 23.195 1.00 0.00 S0 ATOM 892 CE MET B 21 18.599 9.418 24.080 1.00 0.00 C0 ATOM 0 H MET B 21 20.999 11.625 19.715 1.00 0.00 H new ATOM 0 HA MET B 21 18.629 10.351 20.662 1.00 0.00 H new ATOM 0 HB2 MET B 21 20.362 12.490 21.382 1.00 0.00 H new ATOM 0 HB3 MET B 21 18.800 13.240 21.115 1.00 0.00 H new ATOM 0 HG2 MET B 21 18.796 12.521 23.422 1.00 0.00 H new ATOM 0 HG3 MET B 21 17.767 11.389 22.568 1.00 0.00 H new ATOM 0 HE1 MET B 21 19.047 8.515 24.495 1.00 0.00 H new ATOM 0 HE2 MET B 21 18.187 10.023 24.888 1.00 0.00 H new ATOM 0 HE3 MET B 21 17.801 9.143 23.390 1.00 0.00 H new ATOM 902 N ALA B 22 18.227 12.949 18.646 1.00 0.00 N0 ATOM 903 CA ALA B 22 17.275 13.576 17.739 1.00 0.00 C0 ATOM 904 C ALA B 22 16.972 12.671 16.550 1.00 0.00 C0 ATOM 905 O ALA B 22 15.830 12.592 16.096 1.00 0.00 O0 ATOM 906 CB ALA B 22 17.824 14.911 17.242 1.00 0.00 C0 ATOM 0 H ALA B 22 19.124 13.429 18.720 1.00 0.00 H new ATOM 0 HA ALA B 22 16.349 13.746 18.288 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.104 15.371 16.565 1.00 0.00 H new ATOM 0 HB2 ALA B 22 17.997 15.572 18.091 1.00 0.00 H new ATOM 0 HB3 ALA B 22 18.763 14.744 16.715 1.00 0.00 H new ATOM 912 N TRP B 23 18.000 12.000 16.041 1.00 0.00 N0 ATOM 913 CA TRP B 23 17.828 11.117 14.893 1.00 0.00 C0 ATOM 914 C TRP B 23 16.869 9.977 15.230 1.00 0.00 C0 ATOM 915 O TRP B 23 16.011 9.616 14.423 1.00 0.00 O0 ATOM 916 CB TRP B 23 19.183 10.545 14.479 1.00 0.00 C0 ATOM 917 CG TRP B 23 19.121 10.097 13.057 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 19.584 10.808 12.004 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 18.570 8.865 12.510 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 19.358 10.089 10.845 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 18.734 8.885 11.105 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 17.951 7.743 13.090 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 18.299 7.829 10.302 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 17.511 6.678 12.285 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 17.686 6.722 10.895 1.00 0.00 C0 ATOM 0 H TRP B 23 18.953 12.050 16.401 1.00 0.00 H new ATOM 0 HA TRP B 23 17.407 11.693 14.069 1.00 0.00 H new ATOM 0 HB2 TRP B 23 19.960 11.299 14.600 1.00 0.00 H new ATOM 0 HB3 TRP B 23 19.448 9.707 15.124 1.00 0.00 H new ATOM 0 HD1 TRP B 23 20.054 11.779 12.059 1.00 0.00 H new ATOM 0 HE1 TRP B 23 19.620 10.409 9.912 1.00 0.00 H new ATOM 0 HE3 TRP B 23 17.813 7.700 14.160 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 18.435 7.867 9.231 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 17.036 5.821 12.740 1.00 0.00 H new ATOM 0 HH2 TRP B 23 17.347 5.900 10.282 1.00 0.00 H new ATOM 936 N THR B 24 17.005 9.425 16.434 1.00 0.00 N0 ATOM 937 CA THR B 24 16.135 8.336 16.865 1.00 0.00 C0 ATOM 938 C THR B 24 14.706 8.828 17.051 1.00 0.00 C0 ATOM 939 O THR B 24 13.751 8.122 16.725 1.00 0.00 O0 ATOM 940 CB THR B 24 16.650 7.737 18.179 1.00 0.00 C0 ATOM 941 OG1 THR B 24 16.951 8.786 19.089 1.00 0.00 O0 ATOM 942 CG2 THR B 24 17.905 6.899 17.915 1.00 0.00 C0 ATOM 0 H THR B 24 17.702 9.711 17.121 1.00 0.00 H new ATOM 0 HA THR B 24 16.142 7.568 16.091 1.00 0.00 H new ATOM 0 HB THR B 24 15.882 7.094 18.609 1.00 0.00 H new ATOM 0 HG1 THR B 24 17.922 8.844 19.212 1.00 0.00 H new ATOM 0 HG21 THR B 24 18.265 6.477 18.853 1.00 0.00 H new ATOM 0 HG22 THR B 24 17.665 6.092 17.223 1.00 0.00 H new ATOM 0 HG23 THR B 24 18.680 7.531 17.481 1.00 0.00 H new ATOM 950 N ILE B 25 14.559 10.044 17.564 1.00 0.00 N0 ATOM 951 CA ILE B 25 13.234 10.613 17.770 1.00 0.00 C0 ATOM 952 C ILE B 25 12.504 10.770 16.440 1.00 0.00 C0 ATOM 953 O ILE B 25 11.330 10.429 16.326 1.00 0.00 O0 ATOM 954 CB ILE B 25 13.355 11.972 18.456 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 13.821 11.773 19.900 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 11.995 12.672 18.454 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 14.261 13.115 20.487 1.00 0.00 C0 ATOM 0 H ILE B 25 15.332 10.649 17.842 1.00 0.00 H new ATOM 0 HA ILE B 25 12.661 9.936 18.404 1.00 0.00 H new ATOM 0 HB ILE B 25 14.079 12.585 17.919 1.00 0.00 H new ATOM 0 HG12 ILE B 25 13.014 11.350 20.498 1.00 0.00 H new ATOM 0 HG13 ILE B 25 14.647 11.063 19.932 1.00 0.00 H new ATOM 0 HG21 ILE B 25 12.084 13.642 18.944 1.00 0.00 H new ATOM 0 HG22 ILE B 25 11.661 12.814 17.426 1.00 0.00 H new ATOM 0 HG23 ILE B 25 11.270 12.060 18.990 1.00 0.00 H new ATOM 0 HD11 ILE B 25 14.592 12.971 21.515 1.00 0.00 H new ATOM 0 HD12 ILE B 25 15.081 13.520 19.895 1.00 0.00 H new ATOM 0 HD13 ILE B 25 13.423 13.812 20.470 1.00 0.00 H new ATOM 969 N GLY B 26 13.206 11.293 15.438 1.00 0.00 N0 ATOM 970 CA GLY B 26 12.604 11.487 14.121 1.00 0.00 C0 ATOM 971 C GLY B 26 12.201 10.152 13.505 1.00 0.00 C0 ATOM 972 O GLY B 26 11.125 10.024 12.920 1.00 0.00 O0 ATOM 0 H GLY B 26 14.180 11.587 15.510 1.00 0.00 H new ATOM 0 HA2 GLY B 26 11.729 12.131 14.208 1.00 0.00 H new ATOM 0 HA3 GLY B 26 13.310 11.996 13.465 1.00 0.00 H new ATOM 976 N HIS B 27 13.070 9.157 13.648 1.00 0.00 N0 ATOM 977 CA HIS B 27 12.796 7.830 13.112 1.00 0.00 C0 ATOM 978 C HIS B 27 11.532 7.247 13.733 1.00 0.00 C0 ATOM 979 O HIS B 27 10.708 6.648 13.042 1.00 0.00 O0 ATOM 980 CB HIS B 27 13.980 6.899 13.381 1.00 0.00 C0 ATOM 981 CG HIS B 27 13.574 5.481 13.099 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 13.359 5.007 11.813 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 13.337 4.418 13.935 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 13.008 3.711 11.912 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 12.980 3.301 13.183 1.00 0.00 N0 ATOM 0 H HIS B 27 13.966 9.244 14.128 1.00 0.00 H new ATOM 0 HA HIS B 27 12.646 7.921 12.036 1.00 0.00 H new ATOM 0 HB2 HIS B 27 14.826 7.178 12.753 1.00 0.00 H new ATOM 0 HB3 HIS B 27 14.305 6.997 14.417 1.00 0.00 H new ATOM 0 HD2 HIS B 27 13.415 4.444 15.012 1.00 0.00 H new ATOM 0 HE1 HIS B 27 12.777 3.080 11.067 1.00 0.00 H new ATOM 0 HE2 HIS B 27 12.747 2.370 13.529 1.00 0.00 H new ATOM 993 N LEU B 28 11.385 7.425 15.042 1.00 0.00 N0 ATOM 994 CA LEU B 28 10.216 6.910 15.746 1.00 0.00 C0 ATOM 995 C LEU B 28 9.067 7.914 15.690 1.00 0.00 C0 ATOM 996 O LEU B 28 9.263 9.110 15.893 1.00 0.00 O0 ATOM 997 CB LEU B 28 10.581 6.623 17.205 1.00 0.00 C0 ATOM 998 CG LEU B 28 11.683 5.562 17.260 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 12.171 5.408 18.702 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 11.129 4.221 16.766 1.00 0.00 C0 ATOM 0 H LEU B 28 12.055 7.918 15.633 1.00 0.00 H new ATOM 0 HA LEU B 28 9.894 5.989 15.261 1.00 0.00 H new ATOM 0 HB2 LEU B 28 10.918 7.538 17.693 1.00 0.00 H new ATOM 0 HB3 LEU B 28 9.702 6.277 17.749 1.00 0.00 H new ATOM 0 HG LEU B 28 12.513 5.869 16.624 1.00 0.00 H new ATOM 0 HD11 LEU B 28 12.956 4.653 18.742 1.00 0.00 H new ATOM 0 HD12 LEU B 28 12.566 6.360 19.056 1.00 0.00 H new ATOM 0 HD13 LEU B 28 11.340 5.101 19.337 1.00 0.00 H new ATOM 0 HD21 LEU B 28 11.914 3.466 16.805 1.00 0.00 H new ATOM 0 HD22 LEU B 28 10.298 3.914 17.402 1.00 0.00 H new ATOM 0 HD23 LEU B 28 10.780 4.328 15.739 1.00 0.00 H new ATOM 1148 N GLU C 3 44.861 -4.595 23.541 1.00 0.00 N0 ATOM 1149 CA GLU C 3 43.801 -4.019 22.722 1.00 0.00 C0 ATOM 1150 C GLU C 3 44.260 -3.866 21.267 1.00 0.00 C0 ATOM 1151 O GLU C 3 45.452 -3.714 21.000 1.00 0.00 O0 ATOM 1152 CB GLU C 3 43.398 -2.653 23.276 1.00 0.00 C0 ATOM 1153 CG GLU C 3 44.603 -1.712 23.240 1.00 0.00 C0 ATOM 1154 CD GLU C 3 44.854 -1.141 24.631 1.00 0.00 C0 ATOM 1155 OE1 GLU C 3 44.062 -0.323 25.065 1.00 0.00 O0 ATOM 1156 OE2 GLU C 3 45.834 -1.534 25.242 1.00 0.00 O1- ATOM 0 HA GLU C 3 42.944 -4.692 22.750 1.00 0.00 H new ATOM 0 HB2 GLU C 3 42.580 -2.237 22.687 1.00 0.00 H new ATOM 0 HB3 GLU C 3 43.034 -2.756 24.298 1.00 0.00 H new ATOM 0 HG2 GLU C 3 45.485 -2.249 22.893 1.00 0.00 H new ATOM 0 HG3 GLU C 3 44.423 -0.903 22.532 1.00 0.00 H new ATOM 1163 N PRO C 4 43.340 -3.889 20.331 1.00 0.00 N0 ATOM 1164 CA PRO C 4 43.661 -3.738 18.880 1.00 0.00 C0 ATOM 1165 C PRO C 4 44.072 -2.309 18.527 1.00 0.00 C0 ATOM 1166 O PRO C 4 45.039 -2.092 17.798 1.00 0.00 O0 ATOM 1167 CB PRO C 4 42.354 -4.113 18.179 1.00 0.00 C0 ATOM 1168 CG PRO C 4 41.275 -3.848 19.178 1.00 0.00 C0 ATOM 1169 CD PRO C 4 41.897 -4.065 20.554 1.00 0.00 C0 ATOM 0 HA PRO C 4 44.506 -4.359 18.582 1.00 0.00 H new ATOM 0 HB2 PRO C 4 42.208 -3.519 17.277 1.00 0.00 H new ATOM 0 HB3 PRO C 4 42.358 -5.160 17.874 1.00 0.00 H new ATOM 0 HG2 PRO C 4 40.896 -2.831 19.079 1.00 0.00 H new ATOM 0 HG3 PRO C 4 40.430 -4.519 19.024 1.00 0.00 H new ATOM 0 HD2 PRO C 4 41.516 -3.347 21.281 1.00 0.00 H new ATOM 0 HD3 PRO C 4 41.672 -5.059 20.940 1.00 0.00 H new ATOM 1177 N PHE C 5 43.330 -1.341 19.056 1.00 0.00 N0 ATOM 1178 CA PHE C 5 43.625 0.063 18.796 1.00 0.00 C0 ATOM 1179 C PHE C 5 43.366 0.901 20.048 1.00 0.00 C0 ATOM 1180 O PHE C 5 44.282 1.168 20.825 1.00 0.00 O0 ATOM 1181 CB PHE C 5 42.768 0.577 17.628 1.00 0.00 C0 ATOM 1182 CG PHE C 5 43.617 0.705 16.389 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 43.694 -0.355 15.481 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 44.320 1.890 16.145 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 44.474 -0.231 14.325 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 45.102 2.014 14.991 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 45.179 0.954 14.079 1.00 0.00 C0 ATOM 0 H PHE C 5 42.526 -1.501 19.663 1.00 0.00 H new ATOM 0 HA PHE C 5 44.677 0.154 18.527 1.00 0.00 H new ATOM 0 HB2 PHE C 5 41.940 -0.108 17.444 1.00 0.00 H new ATOM 0 HB3 PHE C 5 42.332 1.543 17.883 1.00 0.00 H new ATOM 0 HD1 PHE C 5 43.152 -1.270 15.671 1.00 0.00 H new ATOM 0 HD2 PHE C 5 44.259 2.709 16.847 1.00 0.00 H new ATOM 0 HE1 PHE C 5 44.532 -1.049 13.623 1.00 0.00 H new ATOM 0 HE2 PHE C 5 45.646 2.928 14.804 1.00 0.00 H new ATOM 0 HZ PHE C 5 45.781 1.050 13.187 1.00 0.00 H new ATOM 1197 N GLN C 6 42.115 1.318 20.236 1.00 0.00 N0 ATOM 1198 CA GLN C 6 41.746 2.127 21.390 1.00 0.00 C0 ATOM 1199 C GLN C 6 40.284 1.897 21.751 1.00 0.00 C0 ATOM 1200 O GLN C 6 39.501 1.406 20.938 1.00 0.00 O0 ATOM 1201 CB GLN C 6 41.974 3.610 21.087 1.00 0.00 C0 ATOM 1202 CG GLN C 6 43.462 3.865 20.836 1.00 0.00 C0 ATOM 1203 CD GLN C 6 43.727 5.363 20.739 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 43.749 6.057 21.755 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 43.920 5.907 19.570 1.00 0.00 N0 ATOM 0 H GLN C 6 41.343 1.108 19.603 1.00 0.00 H new ATOM 0 HA GLN C 6 42.370 1.833 22.234 1.00 0.00 H new ATOM 0 HB2 GLN C 6 41.393 3.906 20.214 1.00 0.00 H new ATOM 0 HB3 GLN C 6 41.627 4.219 21.922 1.00 0.00 H new ATOM 0 HG2 GLN C 6 44.054 3.434 21.644 1.00 0.00 H new ATOM 0 HG3 GLN C 6 43.773 3.372 19.915 1.00 0.00 H new ATOM 0 HE21 GLN C 6 43.901 5.330 18.729 1.00 0.00 H new ATOM 0 HE22 GLN C 6 44.090 6.910 19.496 1.00 0.00 H new ATOM 1214 N ILE C 7 39.924 2.250 22.977 1.00 0.00 N0 ATOM 1215 CA ILE C 7 38.555 2.077 23.436 1.00 0.00 C0 ATOM 1216 C ILE C 7 37.591 2.859 22.540 1.00 0.00 C0 ATOM 1217 O ILE C 7 36.468 2.419 22.280 1.00 0.00 O0 ATOM 1218 CB ILE C 7 38.437 2.561 24.888 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 38.706 4.072 24.954 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 39.455 1.826 25.764 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 38.674 4.539 26.412 1.00 0.00 C0 ATOM 0 H ILE C 7 40.557 2.655 23.667 1.00 0.00 H new ATOM 0 HA ILE C 7 38.292 1.020 23.386 1.00 0.00 H new ATOM 0 HB ILE C 7 37.430 2.354 25.251 1.00 0.00 H new ATOM 0 HG12 ILE C 7 39.676 4.298 24.511 1.00 0.00 H new ATOM 0 HG13 ILE C 7 37.957 4.610 24.373 1.00 0.00 H new ATOM 0 HG21 ILE C 7 39.367 2.173 26.793 1.00 0.00 H new ATOM 0 HG22 ILE C 7 39.262 0.754 25.725 1.00 0.00 H new ATOM 0 HG23 ILE C 7 40.462 2.027 25.398 1.00 0.00 H new ATOM 0 HD11 ILE C 7 38.865 5.611 26.455 1.00 0.00 H new ATOM 0 HD12 ILE C 7 37.694 4.328 26.840 1.00 0.00 H new ATOM 0 HD13 ILE C 7 39.440 4.011 26.980 1.00 0.00 H new ATOM 1233 N LEU C 8 38.047 4.013 22.064 1.00 0.00 N0 ATOM 1234 CA LEU C 8 37.232 4.852 21.190 1.00 0.00 C0 ATOM 1235 C LEU C 8 37.106 4.223 19.806 1.00 0.00 C0 ATOM 1236 O LEU C 8 36.069 4.338 19.151 1.00 0.00 O0 ATOM 1237 CB LEU C 8 37.854 6.247 21.074 1.00 0.00 C0 ATOM 1238 CG LEU C 8 37.755 6.967 22.423 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 38.600 8.243 22.383 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 36.293 7.335 22.706 1.00 0.00 C0 ATOM 0 H LEU C 8 38.973 4.388 22.267 1.00 0.00 H new ATOM 0 HA LEU C 8 36.236 4.938 21.624 1.00 0.00 H new ATOM 0 HB2 LEU C 8 38.897 6.167 20.769 1.00 0.00 H new ATOM 0 HB3 LEU C 8 37.340 6.823 20.304 1.00 0.00 H new ATOM 0 HG LEU C 8 38.122 6.309 23.210 1.00 0.00 H new ATOM 0 HD11 LEU C 8 38.530 8.756 23.342 1.00 0.00 H new ATOM 0 HD12 LEU C 8 39.640 7.985 22.185 1.00 0.00 H new ATOM 0 HD13 LEU C 8 38.232 8.898 21.594 1.00 0.00 H new ATOM 0 HD21 LEU C 8 36.226 7.847 23.666 1.00 0.00 H new ATOM 0 HD22 LEU C 8 35.924 7.992 21.918 1.00 0.00 H new ATOM 0 HD23 LEU C 8 35.689 6.428 22.735 1.00 0.00 H new ATOM 1252 N SER C 9 38.167 3.549 19.380 1.00 0.00 N0 ATOM 1253 CA SER C 9 38.177 2.892 18.079 1.00 0.00 C0 ATOM 1254 C SER C 9 37.250 1.681 18.080 1.00 0.00 C0 ATOM 1255 O SER C 9 36.493 1.467 17.134 1.00 0.00 O0 ATOM 1256 CB SER C 9 39.598 2.455 17.717 1.00 0.00 C0 ATOM 1257 OG SER C 9 39.586 1.841 16.434 1.00 0.00 O0 ATOM 0 H SER C 9 39.029 3.443 19.915 1.00 0.00 H new ATOM 0 HA SER C 9 37.821 3.605 17.335 1.00 0.00 H new ATOM 0 HB2 SER C 9 40.267 3.316 17.715 1.00 0.00 H new ATOM 0 HB3 SER C 9 39.978 1.758 18.464 1.00 0.00 H new ATOM 0 HG SER C 9 40.495 1.561 16.197 1.00 0.00 H new ATOM 1263 N ILE C 10 37.311 0.895 19.150 1.00 0.00 N0 ATOM 1264 CA ILE C 10 36.469 -0.291 19.264 1.00 0.00 C0 ATOM 1265 C ILE C 10 34.995 0.094 19.303 1.00 0.00 C0 ATOM 1266 O ILE C 10 34.172 -0.501 18.606 1.00 0.00 O0 ATOM 1267 CB ILE C 10 36.826 -1.065 20.533 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 38.223 -1.671 20.384 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 35.807 -2.188 20.751 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 38.728 -2.128 21.753 1.00 0.00 C0 ATOM 0 H ILE C 10 37.930 1.056 19.945 1.00 0.00 H new ATOM 0 HA ILE C 10 36.645 -0.919 18.391 1.00 0.00 H new ATOM 0 HB ILE C 10 36.810 -0.388 21.387 1.00 0.00 H new ATOM 0 HG12 ILE C 10 38.194 -2.515 19.695 1.00 0.00 H new ATOM 0 HG13 ILE C 10 38.907 -0.936 19.959 1.00 0.00 H new ATOM 0 HG21 ILE C 10 36.062 -2.740 21.656 1.00 0.00 H new ATOM 0 HG22 ILE C 10 34.810 -1.760 20.856 1.00 0.00 H new ATOM 0 HG23 ILE C 10 35.823 -2.865 19.897 1.00 0.00 H new ATOM 0 HD11 ILE C 10 39.723 -2.560 21.648 1.00 0.00 H new ATOM 0 HD12 ILE C 10 38.773 -1.273 22.428 1.00 0.00 H new ATOM 0 HD13 ILE C 10 38.049 -2.877 22.160 1.00 0.00 H new ATOM 1282 N CYS C 11 34.668 1.088 20.126 1.00 0.00 N0 ATOM 1283 CA CYS C 11 33.285 1.537 20.250 1.00 0.00 C0 ATOM 1284 C CYS C 11 32.766 2.000 18.895 1.00 0.00 C0 ATOM 1285 O CYS C 11 31.696 1.582 18.455 1.00 0.00 O0 ATOM 1286 CB CYS C 11 33.201 2.685 21.257 1.00 0.00 C0 ATOM 1287 SG CYS C 11 31.469 3.025 21.645 1.00 0.00 S0 ATOM 0 H CYS C 11 35.334 1.593 20.711 1.00 0.00 H new ATOM 0 HA CYS C 11 32.672 0.707 20.601 1.00 0.00 H new ATOM 0 HB2 CYS C 11 33.744 2.425 22.166 1.00 0.00 H new ATOM 0 HB3 CYS C 11 33.674 3.577 20.847 1.00 0.00 H new ATOM 0 HG CYS C 11 31.400 4.000 22.503 1.00 0.00 H new ATOM 1293 N SER C 12 33.517 2.877 18.241 1.00 0.00 N0 ATOM 1294 CA SER C 12 33.098 3.380 16.943 1.00 0.00 C0 ATOM 1295 C SER C 12 32.976 2.241 15.940 1.00 0.00 C0 ATOM 1296 O SER C 12 32.072 2.234 15.115 1.00 0.00 O0 ATOM 1297 CB SER C 12 34.108 4.396 16.426 1.00 0.00 C0 ATOM 1298 OG SER C 12 35.372 3.760 16.297 1.00 0.00 O0 ATOM 0 H SER C 12 34.404 3.248 18.582 1.00 0.00 H new ATOM 0 HA SER C 12 32.125 3.857 17.061 1.00 0.00 H new ATOM 0 HB2 SER C 12 33.785 4.793 15.464 1.00 0.00 H new ATOM 0 HB3 SER C 12 34.179 5.240 17.112 1.00 0.00 H new ATOM 0 HG SER C 12 35.444 3.038 16.956 1.00 0.00 H new ATOM 1304 N PHE C 13 33.904 1.287 15.999 1.00 0.00 N0 ATOM 1305 CA PHE C 13 33.884 0.165 15.066 1.00 0.00 C0 ATOM 1306 C PHE C 13 32.554 -0.585 15.131 1.00 0.00 C0 ATOM 1307 O PHE C 13 31.871 -0.745 14.116 1.00 0.00 O0 ATOM 1308 CB PHE C 13 35.015 -0.798 15.420 1.00 0.00 C0 ATOM 1309 CG PHE C 13 34.853 -2.077 14.634 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 35.229 -2.123 13.287 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 34.326 -3.217 15.253 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 35.076 -3.308 12.558 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 34.174 -4.403 14.525 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 34.548 -4.447 13.177 1.00 0.00 C0 ATOM 0 H PHE C 13 34.669 1.269 16.674 1.00 0.00 H new ATOM 0 HA PHE C 13 34.012 0.555 14.056 1.00 0.00 H new ATOM 0 HB2 PHE C 13 35.979 -0.341 15.197 1.00 0.00 H new ATOM 0 HB3 PHE C 13 35.004 -1.012 16.489 1.00 0.00 H new ATOM 0 HD1 PHE C 13 35.637 -1.244 12.810 1.00 0.00 H new ATOM 0 HD2 PHE C 13 34.037 -3.181 16.293 1.00 0.00 H new ATOM 0 HE1 PHE C 13 35.365 -3.344 11.518 1.00 0.00 H new ATOM 0 HE2 PHE C 13 33.769 -5.283 15.003 1.00 0.00 H new ATOM 0 HZ PHE C 13 34.429 -5.361 12.614 1.00 0.00 H new ATOM 1324 N ILE C 14 32.193 -1.043 16.322 1.00 0.00 N0 ATOM 1325 CA ILE C 14 30.944 -1.779 16.493 1.00 0.00 C0 ATOM 1326 C ILE C 14 29.752 -0.880 16.185 1.00 0.00 C0 ATOM 1327 O ILE C 14 28.776 -1.313 15.564 1.00 0.00 O0 ATOM 1328 CB ILE C 14 30.849 -2.328 17.928 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 29.522 -3.076 18.131 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 30.951 -1.184 18.941 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 29.597 -4.440 17.442 1.00 0.00 C0 ATOM 0 H ILE C 14 32.738 -0.921 17.175 1.00 0.00 H new ATOM 0 HA ILE C 14 30.930 -2.617 15.796 1.00 0.00 H new ATOM 0 HB ILE C 14 31.675 -3.021 18.084 1.00 0.00 H new ATOM 0 HG12 ILE C 14 29.323 -3.204 19.195 1.00 0.00 H new ATOM 0 HG13 ILE C 14 28.697 -2.494 17.720 1.00 0.00 H new ATOM 0 HG21 ILE C 14 30.882 -1.586 19.952 1.00 0.00 H new ATOM 0 HG22 ILE C 14 31.906 -0.673 18.818 1.00 0.00 H new ATOM 0 HG23 ILE C 14 30.137 -0.478 18.775 1.00 0.00 H new ATOM 0 HD11 ILE C 14 28.656 -4.972 17.585 1.00 0.00 H new ATOM 0 HD12 ILE C 14 29.776 -4.300 16.376 1.00 0.00 H new ATOM 0 HD13 ILE C 14 30.412 -5.021 17.873 1.00 0.00 H new ATOM 1343 N LEU C 15 29.835 0.368 16.622 1.00 0.00 N0 ATOM 1344 CA LEU C 15 28.755 1.316 16.395 1.00 0.00 C0 ATOM 1345 C LEU C 15 28.574 1.574 14.907 1.00 0.00 C0 ATOM 1346 O LEU C 15 27.475 1.874 14.451 1.00 0.00 O0 ATOM 1347 CB LEU C 15 29.050 2.629 17.127 1.00 0.00 C0 ATOM 1348 CG LEU C 15 28.583 2.527 18.584 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 29.270 3.610 19.418 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 27.068 2.738 18.644 1.00 0.00 C0 ATOM 0 H LEU C 15 30.633 0.746 17.132 1.00 0.00 H new ATOM 0 HA LEU C 15 27.830 0.891 16.785 1.00 0.00 H new ATOM 0 HB2 LEU C 15 30.118 2.844 17.092 1.00 0.00 H new ATOM 0 HB3 LEU C 15 28.542 3.455 16.630 1.00 0.00 H new ATOM 0 HG LEU C 15 28.838 1.543 18.978 1.00 0.00 H new ATOM 0 HD11 LEU C 15 28.938 3.537 20.454 1.00 0.00 H new ATOM 0 HD12 LEU C 15 30.350 3.473 19.373 1.00 0.00 H new ATOM 0 HD13 LEU C 15 29.012 4.592 19.022 1.00 0.00 H new ATOM 0 HD21 LEU C 15 26.731 2.666 19.678 1.00 0.00 H new ATOM 0 HD22 LEU C 15 26.822 3.724 18.250 1.00 0.00 H new ATOM 0 HD23 LEU C 15 26.570 1.974 18.047 1.00 0.00 H new ATOM 1362 N SER C 16 29.657 1.441 14.159 1.00 0.00 N0 ATOM 1363 CA SER C 16 29.614 1.653 12.721 1.00 0.00 C0 ATOM 1364 C SER C 16 28.918 0.488 12.029 1.00 0.00 C0 ATOM 1365 O SER C 16 28.089 0.685 11.142 1.00 0.00 O0 ATOM 1366 CB SER C 16 31.025 1.808 12.178 1.00 0.00 C0 ATOM 1367 OG SER C 16 31.619 2.969 12.748 1.00 0.00 O0 ATOM 0 H SER C 16 30.576 1.188 14.523 1.00 0.00 H new ATOM 0 HA SER C 16 29.050 2.564 12.521 1.00 0.00 H new ATOM 0 HB2 SER C 16 31.619 0.926 12.417 1.00 0.00 H new ATOM 0 HB3 SER C 16 31.003 1.892 11.091 1.00 0.00 H new ATOM 0 HG SER C 16 31.635 2.883 13.724 1.00 0.00 H new ATOM 1373 N ALA C 17 29.276 -0.727 12.427 1.00 0.00 N0 ATOM 1374 CA ALA C 17 28.680 -1.907 11.818 1.00 0.00 C0 ATOM 1375 C ALA C 17 27.168 -1.883 11.991 1.00 0.00 C0 ATOM 1376 O ALA C 17 26.416 -2.018 11.022 1.00 0.00 O0 ATOM 1377 CB ALA C 17 29.246 -3.170 12.472 1.00 0.00 C0 ATOM 0 H ALA C 17 29.964 -0.919 13.156 1.00 0.00 H new ATOM 0 HA ALA C 17 28.917 -1.909 10.754 1.00 0.00 H new ATOM 0 HB1 ALA C 17 28.797 -4.050 12.013 1.00 0.00 H new ATOM 0 HB2 ALA C 17 30.327 -3.199 12.332 1.00 0.00 H new ATOM 0 HB3 ALA C 17 29.018 -3.161 13.538 1.00 0.00 H new ATOM 1383 N LEU C 18 26.720 -1.687 13.227 1.00 0.00 N0 ATOM 1384 CA LEU C 18 25.291 -1.632 13.506 1.00 0.00 C0 ATOM 1385 C LEU C 18 24.672 -0.369 12.921 1.00 0.00 C0 ATOM 1386 O LEU C 18 23.481 -0.336 12.609 1.00 0.00 O0 ATOM 1387 CB LEU C 18 25.053 -1.664 15.014 1.00 0.00 C0 ATOM 1388 CG LEU C 18 23.632 -2.151 15.293 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 23.651 -3.167 16.435 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 22.764 -0.961 15.689 1.00 0.00 C0 ATOM 0 H LEU C 18 27.319 -1.565 14.043 1.00 0.00 H new ATOM 0 HA LEU C 18 24.820 -2.499 13.042 1.00 0.00 H new ATOM 0 HB2 LEU C 18 25.776 -2.324 15.494 1.00 0.00 H new ATOM 0 HB3 LEU C 18 25.198 -0.670 15.437 1.00 0.00 H new ATOM 0 HG LEU C 18 23.226 -2.623 14.398 1.00 0.00 H new ATOM 0 HD11 LEU C 18 22.636 -3.512 16.632 1.00 0.00 H new ATOM 0 HD12 LEU C 18 24.276 -4.016 16.157 1.00 0.00 H new ATOM 0 HD13 LEU C 18 24.055 -2.698 17.332 1.00 0.00 H new ATOM 0 HD21 LEU C 18 21.748 -1.302 15.889 1.00 0.00 H new ATOM 0 HD22 LEU C 18 23.173 -0.494 16.585 1.00 0.00 H new ATOM 0 HD23 LEU C 18 22.749 -0.235 14.876 1.00 0.00 H new ATOM 1402 N HIS C 19 25.493 0.665 12.767 1.00 0.00 N0 ATOM 1403 CA HIS C 19 25.013 1.919 12.213 1.00 0.00 C0 ATOM 1404 C HIS C 19 24.532 1.735 10.783 1.00 0.00 C0 ATOM 1405 O HIS C 19 23.406 2.099 10.445 1.00 0.00 O0 ATOM 1406 CB HIS C 19 26.128 2.964 12.241 1.00 0.00 C0 ATOM 1407 CG HIS C 19 25.889 3.993 11.176 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 25.168 5.152 11.412 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 26.274 4.049 9.861 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 25.142 5.853 10.263 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 25.800 5.225 9.286 1.00 0.00 N0 ATOM 0 H HIS C 19 26.482 0.657 13.016 1.00 0.00 H new ATOM 0 HA HIS C 19 24.175 2.258 12.823 1.00 0.00 H new ATOM 0 HB2 HIS C 19 26.166 3.443 13.220 1.00 0.00 H new ATOM 0 HB3 HIS C 19 27.093 2.483 12.084 1.00 0.00 H new ATOM 0 HD2 HIS C 19 26.856 3.296 9.350 1.00 0.00 H new ATOM 0 HE1 HIS C 19 24.649 6.807 10.146 1.00 0.00 H new ATOM 0 HE2 HIS C 19 25.928 5.539 8.324 1.00 0.00 H new ATOM 1419 N PHE C 20 25.381 1.150 9.952 1.00 0.00 N0 ATOM 1420 CA PHE C 20 25.022 0.915 8.565 1.00 0.00 C0 ATOM 1421 C PHE C 20 24.009 -0.217 8.460 1.00 0.00 C0 ATOM 1422 O PHE C 20 23.271 -0.311 7.482 1.00 0.00 O0 ATOM 1423 CB PHE C 20 26.269 0.576 7.747 1.00 0.00 C0 ATOM 1424 CG PHE C 20 26.492 1.640 6.699 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 27.580 2.515 6.807 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 25.615 1.745 5.613 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 27.791 3.494 5.827 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 25.825 2.724 4.636 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 26.912 3.596 4.742 1.00 0.00 C0 ATOM 0 H PHE C 20 26.315 0.832 10.212 1.00 0.00 H new ATOM 0 HA PHE C 20 24.572 1.825 8.167 1.00 0.00 H new ATOM 0 HB2 PHE C 20 27.138 0.508 8.401 1.00 0.00 H new ATOM 0 HB3 PHE C 20 26.151 -0.398 7.272 1.00 0.00 H new ATOM 0 HD1 PHE C 20 28.256 2.435 7.645 1.00 0.00 H new ATOM 0 HD2 PHE C 20 24.776 1.070 5.529 1.00 0.00 H new ATOM 0 HE1 PHE C 20 28.630 4.169 5.908 1.00 0.00 H new ATOM 0 HE2 PHE C 20 25.147 2.806 3.799 1.00 0.00 H new ATOM 0 HZ PHE C 20 27.074 4.350 3.986 1.00 0.00 H new ATOM 1439 N MET C 21 23.962 -1.067 9.478 1.00 0.00 N0 ATOM 1440 CA MET C 21 23.022 -2.175 9.476 1.00 0.00 C0 ATOM 1441 C MET C 21 21.587 -1.676 9.626 1.00 0.00 C0 ATOM 1442 O MET C 21 20.732 -1.941 8.781 1.00 0.00 O0 ATOM 1443 CB MET C 21 23.356 -3.112 10.628 1.00 0.00 C0 ATOM 1444 CG MET C 21 23.510 -4.533 10.086 1.00 0.00 C0 ATOM 1445 SD MET C 21 25.038 -4.662 9.123 1.00 0.00 S0 ATOM 1446 CE MET C 21 24.468 -5.916 7.947 1.00 0.00 C0 ATOM 0 H MET C 21 24.557 -1.010 10.305 1.00 0.00 H new ATOM 0 HA MET C 21 23.104 -2.701 8.525 1.00 0.00 H new ATOM 0 HB2 MET C 21 24.277 -2.794 11.117 1.00 0.00 H new ATOM 0 HB3 MET C 21 22.568 -3.079 11.380 1.00 0.00 H new ATOM 0 HG2 MET C 21 23.528 -5.246 10.910 1.00 0.00 H new ATOM 0 HG3 MET C 21 22.654 -4.788 9.462 1.00 0.00 H new ATOM 0 HE1 MET C 21 25.270 -6.149 7.247 1.00 0.00 H new ATOM 0 HE2 MET C 21 24.184 -6.819 8.487 1.00 0.00 H new ATOM 0 HE3 MET C 21 23.606 -5.535 7.398 1.00 0.00 H new ATOM 1456 N ALA C 22 21.331 -0.954 10.710 1.00 0.00 N0 ATOM 1457 CA ALA C 22 19.997 -0.428 10.962 1.00 0.00 C0 ATOM 1458 C ALA C 22 19.599 0.591 9.901 1.00 0.00 C0 ATOM 1459 O ALA C 22 18.447 0.632 9.469 1.00 0.00 O0 ATOM 1460 CB ALA C 22 19.940 0.220 12.344 1.00 0.00 C0 ATOM 0 H ALA C 22 22.023 -0.721 11.422 1.00 0.00 H new ATOM 0 HA ALA C 22 19.294 -1.260 10.922 1.00 0.00 H new ATOM 0 HB1 ALA C 22 18.938 0.610 12.522 1.00 0.00 H new ATOM 0 HB2 ALA C 22 20.181 -0.523 13.104 1.00 0.00 H new ATOM 0 HB3 ALA C 22 20.661 1.036 12.393 1.00 0.00 H new ATOM 1466 N TRP C 23 20.552 1.423 9.494 1.00 0.00 N0 ATOM 1467 CA TRP C 23 20.278 2.449 8.494 1.00 0.00 C0 ATOM 1468 C TRP C 23 19.854 1.811 7.172 1.00 0.00 C0 ATOM 1469 O TRP C 23 18.922 2.279 6.516 1.00 0.00 O0 ATOM 1470 CB TRP C 23 21.528 3.301 8.281 1.00 0.00 C0 ATOM 1471 CG TRP C 23 21.140 4.622 7.706 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 21.005 5.766 8.410 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 20.823 4.954 6.321 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 20.633 6.781 7.550 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 20.506 6.330 6.252 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 20.782 4.203 5.130 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 20.160 6.942 5.045 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 20.434 4.816 3.914 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 20.123 6.182 3.872 1.00 0.00 C0 ATOM 0 H TRP C 23 21.512 1.408 9.837 1.00 0.00 H new ATOM 0 HA TRP C 23 19.463 3.079 8.851 1.00 0.00 H new ATOM 0 HB2 TRP C 23 22.049 3.444 9.228 1.00 0.00 H new ATOM 0 HB3 TRP C 23 22.219 2.790 7.611 1.00 0.00 H new ATOM 0 HD1 TRP C 23 21.162 5.871 9.473 1.00 0.00 H new ATOM 0 HE1 TRP C 23 20.472 7.746 7.839 1.00 0.00 H new ATOM 0 HE3 TRP C 23 21.019 3.150 5.151 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 19.923 7.995 5.018 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 20.406 4.231 3.007 1.00 0.00 H new ATOM 0 HH2 TRP C 23 19.855 6.647 2.935 1.00 0.00 H new ATOM 1490 N THR C 24 20.534 0.730 6.791 1.00 0.00 N0 ATOM 1491 CA THR C 24 20.208 0.034 5.550 1.00 0.00 C0 ATOM 1492 C THR C 24 18.839 -0.627 5.645 1.00 0.00 C0 ATOM 1493 O THR C 24 18.079 -0.642 4.677 1.00 0.00 O0 ATOM 1494 CB THR C 24 21.274 -1.022 5.243 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 21.537 -1.782 6.414 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 22.562 -0.342 4.763 1.00 0.00 C0 ATOM 0 H THR C 24 21.306 0.322 7.318 1.00 0.00 H new ATOM 0 HA THR C 24 20.185 0.767 4.743 1.00 0.00 H new ATOM 0 HB THR C 24 20.910 -1.683 4.456 1.00 0.00 H new ATOM 0 HG1 THR C 24 22.282 -1.378 6.906 1.00 0.00 H new ATOM 0 HG21 THR C 24 23.315 -1.100 4.547 1.00 0.00 H new ATOM 0 HG22 THR C 24 22.355 0.232 3.860 1.00 0.00 H new ATOM 0 HG23 THR C 24 22.932 0.326 5.541 1.00 0.00 H new ATOM 1504 N ILE C 25 18.523 -1.166 6.816 1.00 0.00 N0 ATOM 1505 CA ILE C 25 17.235 -1.814 7.019 1.00 0.00 C0 ATOM 1506 C ILE C 25 16.098 -0.813 6.844 1.00 0.00 C0 ATOM 1507 O ILE C 25 15.103 -1.103 6.184 1.00 0.00 O0 ATOM 1508 CB ILE C 25 17.173 -2.425 8.417 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 18.121 -3.625 8.489 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 15.746 -2.888 8.712 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 18.318 -4.034 9.950 1.00 0.00 C0 ATOM 0 H ILE C 25 19.135 -1.167 7.632 1.00 0.00 H new ATOM 0 HA ILE C 25 17.124 -2.603 6.275 1.00 0.00 H new ATOM 0 HB ILE C 25 17.471 -1.678 9.152 1.00 0.00 H new ATOM 0 HG12 ILE C 25 17.712 -4.459 7.919 1.00 0.00 H new ATOM 0 HG13 ILE C 25 19.081 -3.371 8.039 1.00 0.00 H new ATOM 0 HG21 ILE C 25 15.704 -3.324 9.710 1.00 0.00 H new ATOM 0 HG22 ILE C 25 15.069 -2.036 8.659 1.00 0.00 H new ATOM 0 HG23 ILE C 25 15.447 -3.635 7.977 1.00 0.00 H new ATOM 0 HD11 ILE C 25 18.993 -4.888 10.001 1.00 0.00 H new ATOM 0 HD12 ILE C 25 18.746 -3.200 10.507 1.00 0.00 H new ATOM 0 HD13 ILE C 25 17.356 -4.305 10.385 1.00 0.00 H new ATOM 1523 N GLY C 26 16.250 0.367 7.441 1.00 0.00 N0 ATOM 1524 CA GLY C 26 15.224 1.400 7.337 1.00 0.00 C0 ATOM 1525 C GLY C 26 15.047 1.846 5.890 1.00 0.00 C0 ATOM 1526 O GLY C 26 13.925 2.028 5.418 1.00 0.00 O0 ATOM 0 H GLY C 26 17.065 0.629 7.996 1.00 0.00 H new ATOM 0 HA2 GLY C 26 14.278 1.019 7.723 1.00 0.00 H new ATOM 0 HA3 GLY C 26 15.499 2.255 7.954 1.00 0.00 H new ATOM 1530 N HIS C 27 16.164 2.014 5.191 1.00 0.00 N0 ATOM 1531 CA HIS C 27 16.125 2.432 3.794 1.00 0.00 C0 ATOM 1532 C HIS C 27 15.359 1.419 2.951 1.00 0.00 C0 ATOM 1533 O HIS C 27 14.563 1.791 2.088 1.00 0.00 O0 ATOM 1534 CB HIS C 27 17.548 2.587 3.255 1.00 0.00 C0 ATOM 1535 CG HIS C 27 17.504 2.719 1.759 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 17.030 3.858 1.125 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 17.872 1.858 0.756 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 17.124 3.652 -0.202 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 17.631 2.448 -0.481 1.00 0.00 N0 ATOM 0 H HIS C 27 17.102 1.868 5.565 1.00 0.00 H new ATOM 0 HA HIS C 27 15.612 3.392 3.735 1.00 0.00 H new ATOM 0 HB2 HIS C 27 18.021 3.465 3.695 1.00 0.00 H new ATOM 0 HB3 HIS C 27 18.151 1.724 3.537 1.00 0.00 H new ATOM 0 HD2 HIS C 27 18.286 0.872 0.904 1.00 0.00 H new ATOM 0 HE1 HIS C 27 16.826 4.372 -0.950 1.00 0.00 H new ATOM 0 HE2 HIS C 27 17.804 2.047 -1.403 1.00 0.00 H new ATOM 1547 N LEU C 28 15.608 0.140 3.202 1.00 0.00 N0 ATOM 1548 CA LEU C 28 14.938 -0.919 2.455 1.00 0.00 C0 ATOM 1549 C LEU C 28 13.595 -1.263 3.094 1.00 0.00 C0 ATOM 1550 O LEU C 28 13.488 -1.395 4.312 1.00 0.00 O0 ATOM 1551 CB LEU C 28 15.825 -2.165 2.418 1.00 0.00 C0 ATOM 1552 CG LEU C 28 17.143 -1.838 1.709 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 18.098 -3.027 1.831 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 16.870 -1.556 0.227 1.00 0.00 C0 ATOM 0 H LEU C 28 16.263 -0.188 3.911 1.00 0.00 H new ATOM 0 HA LEU C 28 14.759 -0.567 1.439 1.00 0.00 H new ATOM 0 HB2 LEU C 28 16.023 -2.513 3.432 1.00 0.00 H new ATOM 0 HB3 LEU C 28 15.312 -2.974 1.898 1.00 0.00 H new ATOM 0 HG LEU C 28 17.594 -0.960 2.171 1.00 0.00 H new ATOM 0 HD11 LEU C 28 19.036 -2.794 1.326 1.00 0.00 H new ATOM 0 HD12 LEU C 28 18.293 -3.230 2.884 1.00 0.00 H new ATOM 0 HD13 LEU C 28 17.646 -3.905 1.370 1.00 0.00 H new ATOM 0 HD21 LEU C 28 17.808 -1.323 -0.278 1.00 0.00 H new ATOM 0 HD22 LEU C 28 16.418 -2.435 -0.233 1.00 0.00 H new ATOM 0 HD23 LEU C 28 16.190 -0.709 0.137 1.00 0.00 H new ATOM 1702 N GLU D 3 52.202 3.653 1.404 1.00 0.00 N0 ATOM 1703 CA GLU D 3 50.803 4.018 1.600 1.00 0.00 C0 ATOM 1704 C GLU D 3 50.656 5.535 1.766 1.00 0.00 C0 ATOM 1705 O GLU D 3 51.580 6.207 2.221 1.00 0.00 O0 ATOM 1706 CB GLU D 3 50.250 3.312 2.839 1.00 0.00 C0 ATOM 1707 CG GLU D 3 51.044 3.747 4.071 1.00 0.00 C0 ATOM 1708 CD GLU D 3 51.595 2.522 4.789 1.00 0.00 C0 ATOM 1709 OE1 GLU D 3 50.808 1.807 5.386 1.00 0.00 O0 ATOM 1710 OE2 GLU D 3 52.795 2.315 4.730 1.00 0.00 O1- ATOM 0 HA GLU D 3 50.240 3.706 0.720 1.00 0.00 H new ATOM 0 HB2 GLU D 3 49.195 3.555 2.969 1.00 0.00 H new ATOM 0 HB3 GLU D 3 50.315 2.231 2.714 1.00 0.00 H new ATOM 0 HG2 GLU D 3 51.861 4.404 3.775 1.00 0.00 H new ATOM 0 HG3 GLU D 3 50.404 4.317 4.744 1.00 0.00 H new ATOM 1717 N PRO D 4 49.512 6.078 1.420 1.00 0.00 N0 ATOM 1718 CA PRO D 4 49.243 7.542 1.545 1.00 0.00 C0 ATOM 1719 C PRO D 4 49.075 7.974 3.002 1.00 0.00 C0 ATOM 1720 O PRO D 4 49.614 8.997 3.423 1.00 0.00 O0 ATOM 1721 CB PRO D 4 47.939 7.738 0.769 1.00 0.00 C0 ATOM 1722 CG PRO D 4 47.254 6.412 0.799 1.00 0.00 C0 ATOM 1723 CD PRO D 4 48.355 5.357 0.868 1.00 0.00 C0 ATOM 0 HA PRO D 4 50.068 8.143 1.163 1.00 0.00 H new ATOM 0 HB2 PRO D 4 47.321 8.509 1.228 1.00 0.00 H new ATOM 0 HB3 PRO D 4 48.136 8.055 -0.255 1.00 0.00 H new ATOM 0 HG2 PRO D 4 46.591 6.337 1.661 1.00 0.00 H new ATOM 0 HG3 PRO D 4 46.639 6.273 -0.090 1.00 0.00 H new ATOM 0 HD2 PRO D 4 48.066 4.521 1.505 1.00 0.00 H new ATOM 0 HD3 PRO D 4 48.575 4.946 -0.117 1.00 0.00 H new ATOM 1731 N PHE D 5 48.327 7.182 3.763 1.00 0.00 N0 ATOM 1732 CA PHE D 5 48.096 7.485 5.170 1.00 0.00 C0 ATOM 1733 C PHE D 5 48.067 6.197 5.994 1.00 0.00 C0 ATOM 1734 O PHE D 5 49.081 5.792 6.562 1.00 0.00 O0 ATOM 1735 CB PHE D 5 46.774 8.250 5.336 1.00 0.00 C0 ATOM 1736 CG PHE D 5 47.056 9.705 5.603 1.00 0.00 C0 ATOM 1737 CD1 PHE D 5 47.107 10.615 4.542 1.00 0.00 C0 ATOM 1738 CD2 PHE D 5 47.259 10.146 6.915 1.00 0.00 C0 ATOM 1739 CE1 PHE D 5 47.361 11.967 4.793 1.00 0.00 C0 ATOM 1740 CE2 PHE D 5 47.515 11.498 7.167 1.00 0.00 C0 ATOM 1741 CZ PHE D 5 47.566 12.409 6.105 1.00 0.00 C0 ATOM 0 H PHE D 5 47.873 6.331 3.432 1.00 0.00 H new ATOM 0 HA PHE D 5 48.913 8.110 5.531 1.00 0.00 H new ATOM 0 HB2 PHE D 5 46.168 8.147 4.436 1.00 0.00 H new ATOM 0 HB3 PHE D 5 46.198 7.825 6.158 1.00 0.00 H new ATOM 0 HD1 PHE D 5 46.950 10.274 3.529 1.00 0.00 H new ATOM 0 HD2 PHE D 5 47.218 9.443 7.733 1.00 0.00 H new ATOM 0 HE1 PHE D 5 47.399 12.670 3.974 1.00 0.00 H new ATOM 0 HE2 PHE D 5 47.673 11.839 8.180 1.00 0.00 H new ATOM 0 HZ PHE D 5 47.764 13.453 6.298 1.00 0.00 H new ATOM 1751 N GLN D 6 46.899 5.560 6.058 1.00 0.00 N0 ATOM 1752 CA GLN D 6 46.744 4.326 6.816 1.00 0.00 C0 ATOM 1753 C GLN D 6 45.636 3.471 6.216 1.00 0.00 C0 ATOM 1754 O GLN D 6 44.792 3.966 5.468 1.00 0.00 O0 ATOM 1755 CB GLN D 6 46.417 4.643 8.278 1.00 0.00 C0 ATOM 1756 CG GLN D 6 47.583 5.402 8.916 1.00 0.00 C0 ATOM 1757 CD GLN D 6 47.355 5.542 10.417 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 47.536 4.582 11.165 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 46.958 6.686 10.904 1.00 0.00 N0 ATOM 0 H GLN D 6 46.049 5.880 5.594 1.00 0.00 H new ATOM 0 HA GLN D 6 47.682 3.772 6.771 1.00 0.00 H new ATOM 0 HB2 GLN D 6 45.507 5.240 8.336 1.00 0.00 H new ATOM 0 HB3 GLN D 6 46.228 3.720 8.826 1.00 0.00 H new ATOM 0 HG2 GLN D 6 48.518 4.873 8.730 1.00 0.00 H new ATOM 0 HG3 GLN D 6 47.679 6.388 8.461 1.00 0.00 H new ATOM 0 HE21 GLN D 6 46.809 7.481 10.282 1.00 0.00 H new ATOM 0 HE22 GLN D 6 46.797 6.785 11.906 1.00 0.00 H new ATOM 1768 N ILE D 7 45.644 2.188 6.544 1.00 0.00 N0 ATOM 1769 CA ILE D 7 44.636 1.274 6.033 1.00 0.00 C0 ATOM 1770 C ILE D 7 43.237 1.740 6.447 1.00 0.00 C0 ATOM 1771 O ILE D 7 42.271 1.592 5.695 1.00 0.00 O0 ATOM 1772 CB ILE D 7 44.904 -0.138 6.574 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 44.733 -0.150 8.100 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 46.331 -0.564 6.223 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 45.088 -1.536 8.647 1.00 0.00 C0 ATOM 0 H ILE D 7 46.335 1.758 7.159 1.00 0.00 H new ATOM 0 HA ILE D 7 44.687 1.259 4.944 1.00 0.00 H new ATOM 0 HB ILE D 7 44.195 -0.832 6.122 1.00 0.00 H new ATOM 0 HG12 ILE D 7 45.374 0.606 8.554 1.00 0.00 H new ATOM 0 HG13 ILE D 7 43.706 0.103 8.363 1.00 0.00 H new ATOM 0 HG21 ILE D 7 46.517 -1.566 6.609 1.00 0.00 H new ATOM 0 HG22 ILE D 7 46.455 -0.563 5.140 1.00 0.00 H new ATOM 0 HG23 ILE D 7 47.039 0.134 6.670 1.00 0.00 H new ATOM 0 HD11 ILE D 7 44.966 -1.542 9.730 1.00 0.00 H new ATOM 0 HD12 ILE D 7 44.429 -2.282 8.203 1.00 0.00 H new ATOM 0 HD13 ILE D 7 46.122 -1.772 8.397 1.00 0.00 H new ATOM 1787 N LEU D 8 43.146 2.312 7.643 1.00 0.00 N0 ATOM 1788 CA LEU D 8 41.873 2.808 8.156 1.00 0.00 C0 ATOM 1789 C LEU D 8 41.454 4.076 7.419 1.00 0.00 C0 ATOM 1790 O LEU D 8 40.265 4.313 7.194 1.00 0.00 O0 ATOM 1791 CB LEU D 8 41.990 3.094 9.657 1.00 0.00 C0 ATOM 1792 CG LEU D 8 42.171 1.777 10.419 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 42.545 2.077 11.872 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 40.864 0.977 10.384 1.00 0.00 C0 ATOM 0 H LEU D 8 43.936 2.444 8.274 1.00 0.00 H new ATOM 0 HA LEU D 8 41.113 2.044 7.993 1.00 0.00 H new ATOM 0 HB2 LEU D 8 42.836 3.755 9.847 1.00 0.00 H new ATOM 0 HB3 LEU D 8 41.097 3.610 10.010 1.00 0.00 H new ATOM 0 HG LEU D 8 42.964 1.194 9.950 1.00 0.00 H new ATOM 0 HD11 LEU D 8 42.674 1.141 12.415 1.00 0.00 H new ATOM 0 HD12 LEU D 8 43.476 2.643 11.899 1.00 0.00 H new ATOM 0 HD13 LEU D 8 41.752 2.661 12.339 1.00 0.00 H new ATOM 0 HD21 LEU D 8 40.996 0.041 10.927 1.00 0.00 H new ATOM 0 HD22 LEU D 8 40.069 1.558 10.851 1.00 0.00 H new ATOM 0 HD23 LEU D 8 40.597 0.762 9.349 1.00 0.00 H new ATOM 1806 N SER D 9 42.443 4.873 7.034 1.00 0.00 N0 ATOM 1807 CA SER D 9 42.183 6.111 6.310 1.00 0.00 C0 ATOM 1808 C SER D 9 41.703 5.819 4.892 1.00 0.00 C0 ATOM 1809 O SER D 9 40.758 6.436 4.406 1.00 0.00 O0 ATOM 1810 CB SER D 9 43.445 6.971 6.259 1.00 0.00 C0 ATOM 1811 OG SER D 9 43.158 8.184 5.575 1.00 0.00 O0 ATOM 0 H SER D 9 43.430 4.685 7.210 1.00 0.00 H new ATOM 0 HA SER D 9 41.400 6.654 6.840 1.00 0.00 H new ATOM 0 HB2 SER D 9 43.796 7.183 7.269 1.00 0.00 H new ATOM 0 HB3 SER D 9 44.245 6.433 5.750 1.00 0.00 H new ATOM 0 HG SER D 9 43.965 8.739 5.541 1.00 0.00 H new ATOM 1817 N ILE D 10 42.357 4.864 4.236 1.00 0.00 N0 ATOM 1818 CA ILE D 10 41.985 4.494 2.874 1.00 0.00 C0 ATOM 1819 C ILE D 10 40.576 3.916 2.836 1.00 0.00 C0 ATOM 1820 O ILE D 10 39.766 4.290 1.986 1.00 0.00 O0 ATOM 1821 CB ILE D 10 42.971 3.462 2.327 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 44.337 4.122 2.123 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 42.460 2.929 0.985 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 45.400 3.040 1.933 1.00 0.00 C0 ATOM 0 H ILE D 10 43.140 4.337 4.621 1.00 0.00 H new ATOM 0 HA ILE D 10 42.013 5.392 2.257 1.00 0.00 H new ATOM 0 HB ILE D 10 43.065 2.638 3.035 1.00 0.00 H new ATOM 0 HG12 ILE D 10 44.310 4.778 1.253 1.00 0.00 H new ATOM 0 HG13 ILE D 10 44.585 4.744 2.983 1.00 0.00 H new ATOM 0 HG21 ILE D 10 43.163 2.193 0.594 1.00 0.00 H new ATOM 0 HG22 ILE D 10 41.486 2.461 1.127 1.00 0.00 H new ATOM 0 HG23 ILE D 10 42.367 3.753 0.278 1.00 0.00 H new ATOM 0 HD11 ILE D 10 46.374 3.508 1.788 1.00 0.00 H new ATOM 0 HD12 ILE D 10 45.432 2.402 2.817 1.00 0.00 H new ATOM 0 HD13 ILE D 10 45.153 2.437 1.059 1.00 0.00 H new ATOM 1836 N CYS D 11 40.290 2.999 3.759 1.00 0.00 N0 ATOM 1837 CA CYS D 11 38.974 2.372 3.814 1.00 0.00 C0 ATOM 1838 C CYS D 11 37.900 3.434 4.012 1.00 0.00 C0 ATOM 1839 O CYS D 11 36.910 3.472 3.283 1.00 0.00 O0 ATOM 1840 CB CYS D 11 38.926 1.367 4.965 1.00 0.00 C0 ATOM 1841 SG CYS D 11 37.421 0.371 4.839 1.00 0.00 S0 ATOM 0 H CYS D 11 40.945 2.677 4.471 1.00 0.00 H new ATOM 0 HA CYS D 11 38.790 1.850 2.875 1.00 0.00 H new ATOM 0 HB2 CYS D 11 39.804 0.722 4.935 1.00 0.00 H new ATOM 0 HB3 CYS D 11 38.948 1.892 5.920 1.00 0.00 H new ATOM 0 HG CYS D 11 37.383 -0.484 5.817 1.00 0.00 H new ATOM 1847 N SER D 12 38.087 4.288 5.011 1.00 0.00 N0 ATOM 1848 CA SER D 12 37.112 5.331 5.280 1.00 0.00 C0 ATOM 1849 C SER D 12 36.977 6.262 4.083 1.00 0.00 C0 ATOM 1850 O SER D 12 35.882 6.710 3.765 1.00 0.00 O0 ATOM 1851 CB SER D 12 37.540 6.143 6.496 1.00 0.00 C0 ATOM 1852 OG SER D 12 38.801 6.738 6.228 1.00 0.00 O0 ATOM 0 H SER D 12 38.892 4.279 5.638 1.00 0.00 H new ATOM 0 HA SER D 12 36.150 4.856 5.473 1.00 0.00 H new ATOM 0 HB2 SER D 12 36.799 6.912 6.716 1.00 0.00 H new ATOM 0 HB3 SER D 12 37.605 5.501 7.375 1.00 0.00 H new ATOM 0 HG SER D 12 39.292 6.188 5.582 1.00 0.00 H new ATOM 1858 N PHE D 13 38.097 6.566 3.429 1.00 0.00 N0 ATOM 1859 CA PHE D 13 38.072 7.466 2.281 1.00 0.00 C0 ATOM 1860 C PHE D 13 37.128 6.954 1.195 1.00 0.00 C0 ATOM 1861 O PHE D 13 36.208 7.660 0.774 1.00 0.00 O0 ATOM 1862 CB PHE D 13 39.481 7.574 1.700 1.00 0.00 C0 ATOM 1863 CG PHE D 13 39.425 8.289 0.371 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 39.298 9.681 0.332 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 39.500 7.558 -0.821 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 39.244 10.343 -0.901 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 39.446 8.219 -2.052 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 39.317 9.613 -2.092 1.00 0.00 C0 ATOM 0 H PHE D 13 39.021 6.207 3.671 1.00 0.00 H new ATOM 0 HA PHE D 13 37.717 8.440 2.617 1.00 0.00 H new ATOM 0 HB2 PHE D 13 40.129 8.115 2.389 1.00 0.00 H new ATOM 0 HB3 PHE D 13 39.910 6.580 1.572 1.00 0.00 H new ATOM 0 HD1 PHE D 13 39.242 10.245 1.251 1.00 0.00 H new ATOM 0 HD2 PHE D 13 39.600 6.483 -0.790 1.00 0.00 H new ATOM 0 HE1 PHE D 13 39.146 11.418 -0.932 1.00 0.00 H new ATOM 0 HE2 PHE D 13 39.504 7.655 -2.971 1.00 0.00 H new ATOM 0 HZ PHE D 13 39.274 10.124 -3.042 1.00 0.00 H new ATOM 1878 N ILE D 14 37.354 5.725 0.746 1.00 0.00 N0 ATOM 1879 CA ILE D 14 36.511 5.143 -0.292 1.00 0.00 C0 ATOM 1880 C ILE D 14 35.084 4.974 0.215 1.00 0.00 C0 ATOM 1881 O ILE D 14 34.119 5.218 -0.516 1.00 0.00 O0 ATOM 1882 CB ILE D 14 37.089 3.786 -0.737 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 36.192 3.144 -1.807 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 37.211 2.841 0.461 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 36.404 3.857 -3.144 1.00 0.00 C0 ATOM 0 H ILE D 14 38.104 5.119 1.079 1.00 0.00 H new ATOM 0 HA ILE D 14 36.492 5.816 -1.150 1.00 0.00 H new ATOM 0 HB ILE D 14 38.079 3.960 -1.159 1.00 0.00 H new ATOM 0 HG12 ILE D 14 36.427 2.084 -1.906 1.00 0.00 H new ATOM 0 HG13 ILE D 14 35.146 3.212 -1.508 1.00 0.00 H new ATOM 0 HG21 ILE D 14 37.621 1.886 0.131 1.00 0.00 H new ATOM 0 HG22 ILE D 14 37.873 3.282 1.206 1.00 0.00 H new ATOM 0 HG23 ILE D 14 36.226 2.681 0.900 1.00 0.00 H new ATOM 0 HD11 ILE D 14 35.768 3.402 -3.904 1.00 0.00 H new ATOM 0 HD12 ILE D 14 36.147 4.911 -3.039 1.00 0.00 H new ATOM 0 HD13 ILE D 14 37.448 3.766 -3.443 1.00 0.00 H new ATOM 1897 N LEU D 15 34.955 4.554 1.465 1.00 0.00 N0 ATOM 1898 CA LEU D 15 33.643 4.348 2.056 1.00 0.00 C0 ATOM 1899 C LEU D 15 32.882 5.664 2.147 1.00 0.00 C0 ATOM 1900 O LEU D 15 31.657 5.686 2.096 1.00 0.00 O0 ATOM 1901 CB LEU D 15 33.788 3.729 3.449 1.00 0.00 C0 ATOM 1902 CG LEU D 15 33.914 2.207 3.332 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 34.509 1.641 4.623 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 32.524 1.601 3.118 1.00 0.00 C0 ATOM 0 H LEU D 15 35.738 4.350 2.086 1.00 0.00 H new ATOM 0 HA LEU D 15 33.080 3.667 1.418 1.00 0.00 H new ATOM 0 HB2 LEU D 15 34.666 4.138 3.949 1.00 0.00 H new ATOM 0 HB3 LEU D 15 32.924 3.985 4.062 1.00 0.00 H new ATOM 0 HG LEU D 15 34.562 1.961 2.491 1.00 0.00 H new ATOM 0 HD11 LEU D 15 34.598 0.558 4.538 1.00 0.00 H new ATOM 0 HD12 LEU D 15 35.495 2.074 4.790 1.00 0.00 H new ATOM 0 HD13 LEU D 15 33.858 1.887 5.462 1.00 0.00 H new ATOM 0 HD21 LEU D 15 32.608 0.518 3.034 1.00 0.00 H new ATOM 0 HD22 LEU D 15 31.884 1.851 3.964 1.00 0.00 H new ATOM 0 HD23 LEU D 15 32.089 2.003 2.203 1.00 0.00 H new ATOM 1916 N SER D 16 33.624 6.755 2.260 1.00 0.00 N0 ATOM 1917 CA SER D 16 33.019 8.075 2.345 1.00 0.00 C0 ATOM 1918 C SER D 16 32.488 8.511 0.986 1.00 0.00 C0 ATOM 1919 O SER D 16 31.381 9.036 0.880 1.00 0.00 O0 ATOM 1920 CB SER D 16 34.042 9.083 2.845 1.00 0.00 C0 ATOM 1921 OG SER D 16 34.436 8.730 4.165 1.00 0.00 O0 ATOM 0 H SER D 16 34.643 6.753 2.295 1.00 0.00 H new ATOM 0 HA SER D 16 32.185 8.028 3.046 1.00 0.00 H new ATOM 0 HB2 SER D 16 34.909 9.098 2.185 1.00 0.00 H new ATOM 0 HB3 SER D 16 33.617 10.087 2.835 1.00 0.00 H new ATOM 0 HG SER D 16 35.247 8.181 4.129 1.00 0.00 H new ATOM 1927 N ALA D 17 33.292 8.303 -0.051 1.00 0.00 N0 ATOM 1928 CA ALA D 17 32.883 8.695 -1.391 1.00 0.00 C0 ATOM 1929 C ALA D 17 31.590 7.989 -1.774 1.00 0.00 C0 ATOM 1930 O ALA D 17 30.617 8.627 -2.182 1.00 0.00 O0 ATOM 1931 CB ALA D 17 33.977 8.329 -2.395 1.00 0.00 C0 ATOM 0 H ALA D 17 34.215 7.873 0.009 1.00 0.00 H new ATOM 0 HA ALA D 17 32.720 9.773 -1.405 1.00 0.00 H new ATOM 0 HB1 ALA D 17 33.665 8.625 -3.397 1.00 0.00 H new ATOM 0 HB2 ALA D 17 34.899 8.848 -2.134 1.00 0.00 H new ATOM 0 HB3 ALA D 17 34.147 7.253 -2.371 1.00 0.00 H new ATOM 1937 N LEU D 18 31.570 6.668 -1.623 1.00 0.00 N0 ATOM 1938 CA LEU D 18 30.377 5.896 -1.945 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.262 6.180 -0.952 1.00 0.00 C0 ATOM 1940 O LEU D 18 28.079 6.043 -1.272 1.00 0.00 O0 ATOM 1941 CB LEU D 18 30.703 4.405 -1.922 1.00 0.00 C0 ATOM 1942 CG LEU D 18 29.674 3.649 -2.761 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 30.386 2.623 -3.646 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 28.701 2.929 -1.831 1.00 0.00 C0 ATOM 0 H LEU D 18 32.358 6.116 -1.283 1.00 0.00 H new ATOM 0 HA LEU D 18 30.043 6.187 -2.941 1.00 0.00 H new ATOM 0 HB2 LEU D 18 31.705 4.234 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU D 18 30.695 4.035 -0.897 1.00 0.00 H new ATOM 0 HG LEU D 18 29.129 4.352 -3.391 1.00 0.00 H new ATOM 0 HD11 LEU D 18 29.650 2.085 -4.244 1.00 0.00 H new ATOM 0 HD12 LEU D 18 31.085 3.135 -4.307 1.00 0.00 H new ATOM 0 HD13 LEU D 18 30.930 1.917 -3.019 1.00 0.00 H new ATOM 0 HD21 LEU D 18 27.964 2.388 -2.424 1.00 0.00 H new ATOM 0 HD22 LEU D 18 29.250 2.226 -1.204 1.00 0.00 H new ATOM 0 HD23 LEU D 18 28.194 3.659 -1.200 1.00 0.00 H new ATOM 1956 N HIS D 19 29.643 6.588 0.253 1.00 0.00 N0 ATOM 1957 CA HIS D 19 28.664 6.893 1.278 1.00 0.00 C0 ATOM 1958 C HIS D 19 27.782 8.058 0.865 1.00 0.00 C0 ATOM 1959 O HIS D 19 26.554 7.956 0.878 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.368 7.229 2.593 1.00 0.00 C0 ATOM 1961 CG HIS D 19 28.485 8.102 3.434 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 27.594 7.585 4.362 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 28.346 9.465 3.499 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 26.965 8.625 4.942 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 27.386 9.793 4.452 1.00 0.00 N0 ATOM 0 H HIS D 19 30.614 6.713 0.538 1.00 0.00 H new ATOM 0 HA HIS D 19 28.035 6.013 1.413 1.00 0.00 H new ATOM 0 HB2 HIS D 19 29.608 6.312 3.132 1.00 0.00 H new ATOM 0 HB3 HIS D 19 30.311 7.737 2.392 1.00 0.00 H new ATOM 0 HD2 HIS D 19 28.898 10.176 2.902 1.00 0.00 H new ATOM 0 HE1 HIS D 19 26.212 8.526 5.710 1.00 0.00 H new ATOM 0 HE2 HIS D 19 27.072 10.726 4.719 1.00 0.00 H new ATOM 1973 N PHE D 20 28.412 9.156 0.478 1.00 0.00 N0 ATOM 1974 CA PHE D 20 27.669 10.329 0.051 1.00 0.00 C0 ATOM 1975 C PHE D 20 27.055 10.099 -1.322 1.00 0.00 C0 ATOM 1976 O PHE D 20 26.079 10.749 -1.690 1.00 0.00 O0 ATOM 1977 CB PHE D 20 28.592 11.550 0.010 1.00 0.00 C0 ATOM 1978 CG PHE D 20 28.114 12.573 1.012 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 28.865 12.832 2.166 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 26.914 13.259 0.790 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 28.412 13.773 3.097 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 26.464 14.201 1.719 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 27.210 14.458 2.871 1.00 0.00 C0 ATOM 0 H PHE D 20 29.426 9.259 0.451 1.00 0.00 H new ATOM 0 HA PHE D 20 26.868 10.511 0.767 1.00 0.00 H new ATOM 0 HB2 PHE D 20 29.616 11.253 0.237 1.00 0.00 H new ATOM 0 HB3 PHE D 20 28.599 11.981 -0.991 1.00 0.00 H new ATOM 0 HD1 PHE D 20 29.793 12.306 2.337 1.00 0.00 H new ATOM 0 HD2 PHE D 20 26.336 13.060 -0.100 1.00 0.00 H new ATOM 0 HE1 PHE D 20 28.988 13.971 3.989 1.00 0.00 H new ATOM 0 HE2 PHE D 20 25.539 14.730 1.546 1.00 0.00 H new ATOM 0 HZ PHE D 20 26.861 15.185 3.589 1.00 0.00 H new ATOM 1993 N MET D 21 27.613 9.157 -2.073 1.00 0.00 N0 ATOM 1994 CA MET D 21 27.091 8.856 -3.395 1.00 0.00 C0 ATOM 1995 C MET D 21 25.723 8.186 -3.305 1.00 0.00 C0 ATOM 1996 O MET D 21 24.739 8.675 -3.858 1.00 0.00 O0 ATOM 1997 CB MET D 21 28.062 7.933 -4.116 1.00 0.00 C0 ATOM 1998 CG MET D 21 28.414 8.538 -5.475 1.00 0.00 C0 ATOM 1999 SD MET D 21 29.473 9.989 -5.244 1.00 0.00 S0 ATOM 2000 CE MET D 21 28.910 10.919 -6.692 1.00 0.00 C0 ATOM 0 H MET D 21 28.417 8.596 -1.792 1.00 0.00 H new ATOM 0 HA MET D 21 26.979 9.790 -3.946 1.00 0.00 H new ATOM 0 HB2 MET D 21 28.964 7.797 -3.520 1.00 0.00 H new ATOM 0 HB3 MET D 21 27.616 6.947 -4.248 1.00 0.00 H new ATOM 0 HG2 MET D 21 28.924 7.798 -6.092 1.00 0.00 H new ATOM 0 HG3 MET D 21 27.504 8.821 -6.004 1.00 0.00 H new ATOM 0 HE1 MET D 21 29.444 11.868 -6.745 1.00 0.00 H new ATOM 0 HE2 MET D 21 29.107 10.341 -7.595 1.00 0.00 H new ATOM 0 HE3 MET D 21 27.840 11.109 -6.609 1.00 0.00 H new ATOM 2010 N ALA D 22 25.667 7.060 -2.604 1.00 0.00 N0 ATOM 2011 CA ALA D 22 24.417 6.329 -2.453 1.00 0.00 C0 ATOM 2012 C ALA D 22 23.397 7.145 -1.666 1.00 0.00 C0 ATOM 2013 O ALA D 22 22.206 7.134 -1.978 1.00 0.00 O0 ATOM 2014 CB ALA D 22 24.667 4.999 -1.746 1.00 0.00 C0 ATOM 0 H ALA D 22 26.467 6.636 -2.134 1.00 0.00 H new ATOM 0 HA ALA D 22 24.015 6.140 -3.448 1.00 0.00 H new ATOM 0 HB1 ALA D 22 23.725 4.461 -1.639 1.00 0.00 H new ATOM 0 HB2 ALA D 22 25.362 4.400 -2.334 1.00 0.00 H new ATOM 0 HB3 ALA D 22 25.093 5.185 -0.760 1.00 0.00 H new ATOM 2020 N TRP D 23 23.866 7.840 -0.635 1.00 0.00 N0 ATOM 2021 CA TRP D 23 22.976 8.643 0.197 1.00 0.00 C0 ATOM 2022 C TRP D 23 22.317 9.746 -0.628 1.00 0.00 C0 ATOM 2023 O TRP D 23 21.122 10.011 -0.487 1.00 0.00 O0 ATOM 2024 CB TRP D 23 23.770 9.266 1.345 1.00 0.00 C0 ATOM 2025 CG TRP D 23 22.840 9.625 2.457 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 22.643 8.879 3.567 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 21.976 10.789 2.586 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 21.718 9.514 4.373 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 21.276 10.695 3.811 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 21.735 11.908 1.768 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 20.368 11.676 4.213 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 20.821 12.896 2.168 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 20.140 12.781 3.388 1.00 0.00 C0 ATOM 0 H TRP D 23 24.847 7.864 -0.357 1.00 0.00 H new ATOM 0 HA TRP D 23 22.196 7.996 0.599 1.00 0.00 H new ATOM 0 HB2 TRP D 23 24.526 8.566 1.701 1.00 0.00 H new ATOM 0 HB3 TRP D 23 24.297 10.154 0.997 1.00 0.00 H new ATOM 0 HD1 TRP D 23 23.129 7.940 3.788 1.00 0.00 H new ATOM 0 HE1 TRP D 23 21.400 9.154 5.273 1.00 0.00 H new ATOM 0 HE3 TRP D 23 22.256 12.008 0.827 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 19.846 11.582 5.154 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 20.641 13.750 1.532 1.00 0.00 H new ATOM 0 HH2 TRP D 23 19.440 13.546 3.690 1.00 0.00 H new ATOM 2044 N THR D 24 23.097 10.375 -1.505 1.00 0.00 N0 ATOM 2045 CA THR D 24 22.569 11.439 -2.353 1.00 0.00 C0 ATOM 2046 C THR D 24 21.574 10.880 -3.362 1.00 0.00 C0 ATOM 2047 O THR D 24 20.560 11.511 -3.659 1.00 0.00 O0 ATOM 2048 CB THR D 24 23.715 12.141 -3.092 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 24.579 11.167 -3.660 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 24.497 13.029 -2.119 1.00 0.00 C0 ATOM 0 H THR D 24 24.086 10.169 -1.646 1.00 0.00 H new ATOM 0 HA THR D 24 22.054 12.160 -1.717 1.00 0.00 H new ATOM 0 HB THR D 24 23.304 12.765 -3.886 1.00 0.00 H new ATOM 0 HG1 THR D 24 25.434 11.170 -3.182 1.00 0.00 H new ATOM 0 HG21 THR D 24 25.309 13.524 -2.651 1.00 0.00 H new ATOM 0 HG22 THR D 24 23.830 13.780 -1.695 1.00 0.00 H new ATOM 0 HG23 THR D 24 24.909 12.416 -1.318 1.00 0.00 H new ATOM 2058 N ILE D 25 21.858 9.690 -3.878 1.00 0.00 N0 ATOM 2059 CA ILE D 25 20.964 9.061 -4.841 1.00 0.00 C0 ATOM 2060 C ILE D 25 19.603 8.785 -4.210 1.00 0.00 C0 ATOM 2061 O ILE D 25 18.567 9.054 -4.812 1.00 0.00 O0 ATOM 2062 CB ILE D 25 21.576 7.753 -5.339 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 22.789 8.064 -6.220 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 20.540 6.978 -6.154 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 23.596 6.784 -6.450 1.00 0.00 C0 ATOM 0 H ILE D 25 22.690 9.147 -3.649 1.00 0.00 H new ATOM 0 HA ILE D 25 20.827 9.741 -5.682 1.00 0.00 H new ATOM 0 HB ILE D 25 21.888 7.150 -4.486 1.00 0.00 H new ATOM 0 HG12 ILE D 25 22.462 8.477 -7.174 1.00 0.00 H new ATOM 0 HG13 ILE D 25 23.414 8.819 -5.743 1.00 0.00 H new ATOM 0 HG21 ILE D 25 20.979 6.045 -6.508 1.00 0.00 H new ATOM 0 HG22 ILE D 25 19.676 6.757 -5.528 1.00 0.00 H new ATOM 0 HG23 ILE D 25 20.226 7.578 -7.008 1.00 0.00 H new ATOM 0 HD11 ILE D 25 24.459 7.006 -7.077 1.00 0.00 H new ATOM 0 HD12 ILE D 25 23.935 6.391 -5.492 1.00 0.00 H new ATOM 0 HD13 ILE D 25 22.969 6.043 -6.945 1.00 0.00 H new ATOM 2077 N GLY D 26 19.612 8.243 -2.995 1.00 0.00 N0 ATOM 2078 CA GLY D 26 18.366 7.937 -2.298 1.00 0.00 C0 ATOM 2079 C GLY D 26 17.571 9.209 -2.025 1.00 0.00 C0 ATOM 2080 O GLY D 26 16.351 9.241 -2.194 1.00 0.00 O0 ATOM 0 H GLY D 26 20.459 8.009 -2.477 1.00 0.00 H new ATOM 0 HA2 GLY D 26 17.768 7.251 -2.898 1.00 0.00 H new ATOM 0 HA3 GLY D 26 18.585 7.431 -1.358 1.00 0.00 H new ATOM 2084 N HIS D 27 18.272 10.257 -1.608 1.00 0.00 N0 ATOM 2085 CA HIS D 27 17.627 11.533 -1.322 1.00 0.00 C0 ATOM 2086 C HIS D 27 16.939 12.083 -2.567 1.00 0.00 C0 ATOM 2087 O HIS D 27 15.821 12.594 -2.495 1.00 0.00 O0 ATOM 2088 CB HIS D 27 18.660 12.541 -0.819 1.00 0.00 C0 ATOM 2089 CG HIS D 27 18.055 13.917 -0.813 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 17.084 14.301 0.100 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 18.273 15.012 -1.612 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 16.758 15.579 -0.171 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 17.453 16.060 -1.205 1.00 0.00 N0 ATOM 0 H HIS D 27 19.281 10.249 -1.461 1.00 0.00 H new ATOM 0 HA HIS D 27 16.874 11.369 -0.551 1.00 0.00 H new ATOM 0 HB2 HIS D 27 18.988 12.272 0.185 1.00 0.00 H new ATOM 0 HB3 HIS D 27 19.543 12.523 -1.458 1.00 0.00 H new ATOM 0 HD2 HIS D 27 18.975 15.054 -2.432 1.00 0.00 H new ATOM 0 HE1 HIS D 27 16.023 16.146 0.381 1.00 0.00 H new ATOM 0 HE2 HIS D 27 17.395 16.995 -1.609 1.00 0.00 H new ATOM 2101 N LEU D 28 17.611 11.974 -3.706 1.00 0.00 N0 ATOM 2102 CA LEU D 28 17.053 12.466 -4.960 1.00 0.00 C0 ATOM 2103 C LEU D 28 16.181 11.400 -5.617 1.00 0.00 C0 ATOM 2104 O LEU D 28 16.555 10.231 -5.687 1.00 0.00 O0 ATOM 2105 CB LEU D 28 18.188 12.857 -5.910 1.00 0.00 C0 ATOM 2106 CG LEU D 28 19.019 13.981 -5.283 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 20.254 14.245 -6.146 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 18.174 15.256 -5.200 1.00 0.00 C0 ATOM 0 H LEU D 28 18.536 11.553 -3.788 1.00 0.00 H new ATOM 0 HA LEU D 28 16.435 13.338 -4.746 1.00 0.00 H new ATOM 0 HB2 LEU D 28 18.821 11.993 -6.112 1.00 0.00 H new ATOM 0 HB3 LEU D 28 17.779 13.183 -6.866 1.00 0.00 H new ATOM 0 HG LEU D 28 19.331 13.685 -4.281 1.00 0.00 H new ATOM 0 HD11 LEU D 28 20.845 15.045 -5.700 1.00 0.00 H new ATOM 0 HD12 LEU D 28 20.856 13.339 -6.206 1.00 0.00 H new ATOM 0 HD13 LEU D 28 19.942 14.540 -7.148 1.00 0.00 H new ATOM 0 HD21 LEU D 28 18.765 16.056 -4.754 1.00 0.00 H new ATOM 0 HD22 LEU D 28 17.861 15.551 -6.202 1.00 0.00 H new ATOM 0 HD23 LEU D 28 17.293 15.070 -4.585 1.00 0.00 H new