USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1367 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 GLN : amide:sc= -0.178 K(o=-2.5,f=-7.7) USER MOD Set 1.2: B 81 HIS : no HD1:sc= -2.32 K(o=-2.5,f=-3.7!) USER MOD Set 2.1: A 102 CYS SG : rot 29:sc= -0.362 USER MOD Set 2.2: B 57 CYS SG : rot 112:sc= -0.166 USER MOD Set 2.3: B 61 CYS SG : rot 125:sc= 1.68 USER MOD Set 3.1: B 47 THR OG1 : rot -101:sc= 1.39 USER MOD Set 3.2: B 50 ASN : amide:sc= 1.05 X(o=2.4,f=2.1) USER MOD Set 4.1: B 39 GLN : amide:sc= -0.151 K(o=-0.18,f=-2.7!) USER MOD Set 4.2: B 43 HIS : no HE2:sc= -0.034 X(o=-0.18,f=-0.56) USER MOD Set 5.1: B 22 THR OG1 : rot 79:sc= 1.34 USER MOD Set 5.2: B 54 HIS : no HE2:sc= 0.0911 K(o=1.4,f=-3.4) USER MOD Set 6.1: A 81 HIS : no HD1:sc= -2.13 K(o=-2.5,f=-3.7!) USER MOD Set 6.2: B 91 GLN : amide:sc= -0.406 K(o=-2.5,f=-8.4!) USER MOD Set 7.1: A 57 CYS SG : rot 160:sc= -0.617 USER MOD Set 7.2: A 61 CYS SG : rot 126:sc= 0.696 USER MOD Set 8.1: A 47 THR OG1 : rot -91:sc= 1.31 USER MOD Set 8.2: A 50 ASN : amide:sc= 1.07 K(o=2.4,f=1.8) USER MOD Set 9.1: A 22 THR OG1 : rot 81:sc= 1.29 USER MOD Set 9.2: A 54 HIS : no HE2:sc= 0.151 K(o=1.4,f=-3.3) USER MOD Single : A 24 CYS SG : rot 128:sc= 0.246 USER MOD Single : A 35 CYS SG : rot 50:sc= 0.888 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= 0.574 K(o=0.57,f=-6.5!) USER MOD Single : A 43 HIS : no HE2:sc= -0.227 K(o=-0.23,f=-2.2!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 97:sc= 1.21 USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 101:sc= 0.449 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.844 K(o=0.84,f=0) USER MOD Single : A 75 TYR OH : rot 180:sc=-0.00715 USER MOD Single : A 80 SER OG : rot 180:sc=0.000287 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -1.03 K(o=-1,f=-4.1!) USER MOD Single : B 24 CYS SG : rot 119:sc= 0.0464 USER MOD Single : B 35 CYS SG : rot -28:sc= 0.367 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 98:sc= 1.26 USER MOD Single : B 53 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : B 56 SER OG : rot 180:sc= 0.0358 USER MOD Single : B 67 THR OG1 : rot 130:sc= 0.793 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0.857 K(o=0.86,f=0) USER MOD Single : B 75 TYR OH : rot 130:sc= 0 USER MOD Single : B 80 SER OG : rot 78:sc= 1.41 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 5.451 -1.286 -8.789 1.00 0.00 N ATOM 12 CA LEU A 11 4.471 -1.566 -7.721 1.00 0.00 C ATOM 13 C LEU A 11 4.981 -2.577 -6.695 1.00 0.00 C ATOM 14 O LEU A 11 4.667 -2.440 -5.515 1.00 0.00 O ATOM 15 CB LEU A 11 3.078 -1.948 -8.273 1.00 0.00 C ATOM 16 CG LEU A 11 2.805 -3.444 -8.561 1.00 0.00 C ATOM 17 CD1 LEU A 11 1.302 -3.666 -8.766 1.00 0.00 C ATOM 18 CD2 LEU A 11 3.556 -3.928 -9.801 1.00 0.00 C ATOM 0 HA LEU A 11 4.344 -0.625 -7.186 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.328 -1.601 -7.562 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.920 -1.394 -9.198 1.00 0.00 H new ATOM 0 HG LEU A 11 3.159 -4.015 -7.703 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.114 -4.720 -8.969 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.764 -3.368 -7.866 1.00 0.00 H new ATOM 0 HD13 LEU A 11 0.958 -3.068 -9.609 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.338 -4.983 -9.970 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.238 -3.349 -10.668 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.628 -3.798 -9.651 1.00 0.00 H new ATOM 30 N ALA A 12 5.810 -3.528 -7.132 1.00 0.00 N ATOM 31 CA ALA A 12 6.402 -4.541 -6.277 1.00 0.00 C ATOM 32 C ALA A 12 7.338 -3.897 -5.250 1.00 0.00 C ATOM 33 O ALA A 12 7.132 -4.078 -4.054 1.00 0.00 O ATOM 34 CB ALA A 12 7.098 -5.582 -7.167 1.00 0.00 C ATOM 0 H ALA A 12 6.089 -3.611 -8.110 1.00 0.00 H new ATOM 0 HA ALA A 12 5.636 -5.055 -5.696 1.00 0.00 H new ATOM 0 HB1 ALA A 12 7.549 -6.352 -6.541 1.00 0.00 H new ATOM 0 HB2 ALA A 12 6.366 -6.039 -7.833 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.873 -5.095 -7.759 1.00 0.00 H new ATOM 40 N ARG A 13 8.325 -3.090 -5.674 1.00 0.00 N ATOM 41 CA ARG A 13 9.215 -2.381 -4.737 1.00 0.00 C ATOM 42 C ARG A 13 8.482 -1.291 -3.936 1.00 0.00 C ATOM 43 O ARG A 13 8.792 -1.111 -2.762 1.00 0.00 O ATOM 44 CB ARG A 13 10.500 -1.875 -5.431 1.00 0.00 C ATOM 45 CG ARG A 13 10.345 -0.654 -6.354 1.00 0.00 C ATOM 46 CD ARG A 13 10.415 0.701 -5.625 1.00 0.00 C ATOM 47 NE ARG A 13 9.396 1.646 -6.121 1.00 0.00 N ATOM 48 CZ ARG A 13 9.348 2.942 -5.847 1.00 0.00 C ATOM 49 NH1 ARG A 13 10.244 3.536 -5.093 1.00 0.00 N ATOM 50 NH2 ARG A 13 8.369 3.674 -6.325 1.00 0.00 N ATOM 0 H ARG A 13 8.527 -2.912 -6.658 1.00 0.00 H new ATOM 0 HA ARG A 13 9.542 -3.110 -3.996 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.230 -1.630 -4.660 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.917 -2.694 -6.016 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.126 -0.686 -7.114 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.390 -0.725 -6.875 1.00 0.00 H new ATOM 0 HD2 ARG A 13 10.276 0.545 -4.555 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.407 1.134 -5.758 1.00 0.00 H new ATOM 0 HE ARG A 13 8.666 1.270 -6.726 1.00 0.00 H new ATOM 0 HH11 ARG A 13 11.013 2.997 -4.694 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.171 4.536 -4.906 1.00 0.00 H new ATOM 0 HH21 ARG A 13 7.648 3.245 -6.905 1.00 0.00 H new ATOM 0 HH22 ARG A 13 8.329 4.672 -6.116 1.00 0.00 H new ATOM 64 N LEU A 14 7.492 -0.600 -4.521 1.00 0.00 N ATOM 65 CA LEU A 14 6.742 0.471 -3.851 1.00 0.00 C ATOM 66 C LEU A 14 5.862 -0.090 -2.735 1.00 0.00 C ATOM 67 O LEU A 14 6.023 0.293 -1.579 1.00 0.00 O ATOM 68 CB LEU A 14 5.926 1.245 -4.908 1.00 0.00 C ATOM 69 CG LEU A 14 5.147 2.493 -4.441 1.00 0.00 C ATOM 70 CD1 LEU A 14 3.795 2.173 -3.786 1.00 0.00 C ATOM 71 CD2 LEU A 14 5.973 3.399 -3.521 1.00 0.00 C ATOM 0 H LEU A 14 7.188 -0.771 -5.480 1.00 0.00 H new ATOM 0 HA LEU A 14 7.434 1.164 -3.373 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.609 1.553 -5.699 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.213 0.552 -5.354 1.00 0.00 H new ATOM 0 HG LEU A 14 4.939 3.035 -5.363 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.308 3.100 -3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.161 1.645 -4.499 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.955 1.546 -2.909 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.374 4.260 -3.225 1.00 0.00 H new ATOM 0 HD22 LEU A 14 6.271 2.841 -2.633 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.863 3.741 -4.050 1.00 0.00 H new ATOM 83 N GLY A 15 4.978 -1.036 -3.060 1.00 0.00 N ATOM 84 CA GLY A 15 4.074 -1.654 -2.096 1.00 0.00 C ATOM 85 C GLY A 15 4.844 -2.469 -1.065 1.00 0.00 C ATOM 86 O GLY A 15 4.433 -2.513 0.088 1.00 0.00 O ATOM 0 H GLY A 15 4.871 -1.395 -4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.492 -0.882 -1.593 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.366 -2.298 -2.618 1.00 0.00 H new ATOM 90 N ARG A 16 6.004 -3.031 -1.435 1.00 0.00 N ATOM 91 CA ARG A 16 6.930 -3.649 -0.485 1.00 0.00 C ATOM 92 C ARG A 16 7.503 -2.602 0.467 1.00 0.00 C ATOM 93 O ARG A 16 7.466 -2.824 1.670 1.00 0.00 O ATOM 94 CB ARG A 16 8.062 -4.377 -1.217 1.00 0.00 C ATOM 95 CG ARG A 16 9.065 -5.011 -0.245 1.00 0.00 C ATOM 96 CD ARG A 16 10.279 -5.526 -1.007 1.00 0.00 C ATOM 97 NE ARG A 16 11.287 -6.036 -0.065 1.00 0.00 N ATOM 98 CZ ARG A 16 12.427 -6.623 -0.400 1.00 0.00 C ATOM 99 NH1 ARG A 16 12.776 -6.773 -1.660 1.00 0.00 N ATOM 100 NH2 ARG A 16 13.240 -7.067 0.535 1.00 0.00 N ATOM 0 H ARG A 16 6.323 -3.068 -2.403 1.00 0.00 H new ATOM 0 HA ARG A 16 6.372 -4.382 0.098 1.00 0.00 H new ATOM 0 HB2 ARG A 16 7.640 -5.151 -1.857 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.583 -3.674 -1.867 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.377 -4.277 0.498 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.591 -5.830 0.296 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.978 -6.317 -1.694 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.706 -4.725 -1.611 1.00 0.00 H new ATOM 0 HE ARG A 16 11.092 -5.929 0.930 1.00 0.00 H new ATOM 0 HH11 ARG A 16 12.164 -6.434 -2.402 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.658 -7.228 -1.894 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.993 -6.960 1.519 1.00 0.00 H new ATOM 0 HH22 ARG A 16 14.117 -7.519 0.276 1.00 0.00 H new ATOM 114 N ALA A 17 7.997 -1.461 -0.019 1.00 0.00 N ATOM 115 CA ALA A 17 8.571 -0.409 0.820 1.00 0.00 C ATOM 116 C ALA A 17 7.557 0.191 1.808 1.00 0.00 C ATOM 117 O ALA A 17 7.980 0.679 2.861 1.00 0.00 O ATOM 118 CB ALA A 17 9.199 0.656 -0.088 1.00 0.00 C ATOM 0 H ALA A 17 8.009 -1.240 -1.015 1.00 0.00 H new ATOM 0 HA ALA A 17 9.344 -0.849 1.450 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.631 1.447 0.524 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.980 0.201 -0.697 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.432 1.078 -0.738 1.00 0.00 H new ATOM 124 N LEU A 18 6.249 0.125 1.508 1.00 0.00 N ATOM 125 CA LEU A 18 5.179 0.498 2.451 1.00 0.00 C ATOM 126 C LEU A 18 4.620 -0.706 3.253 1.00 0.00 C ATOM 127 O LEU A 18 3.841 -0.491 4.181 1.00 0.00 O ATOM 128 CB LEU A 18 4.105 1.371 1.747 1.00 0.00 C ATOM 129 CG LEU A 18 4.573 2.837 1.512 1.00 0.00 C ATOM 130 CD1 LEU A 18 5.290 3.005 0.165 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.436 3.882 1.577 1.00 0.00 C ATOM 0 H LEU A 18 5.902 -0.189 0.602 1.00 0.00 H new ATOM 0 HA LEU A 18 5.618 1.126 3.226 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.848 0.919 0.789 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.197 1.377 2.350 1.00 0.00 H new ATOM 0 HG LEU A 18 5.259 3.025 2.337 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.599 4.043 0.044 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.168 2.360 0.137 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.613 2.731 -0.644 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.846 4.877 1.403 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.691 3.658 0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.968 3.850 2.561 1.00 0.00 H new ATOM 143 N ALA A 19 5.072 -1.936 2.967 1.00 0.00 N ATOM 144 CA ALA A 19 4.848 -3.159 3.760 1.00 0.00 C ATOM 145 C ALA A 19 6.042 -3.554 4.672 1.00 0.00 C ATOM 146 O ALA A 19 5.891 -4.394 5.555 1.00 0.00 O ATOM 147 CB ALA A 19 4.544 -4.291 2.770 1.00 0.00 C ATOM 0 H ALA A 19 5.633 -2.116 2.134 1.00 0.00 H new ATOM 0 HA ALA A 19 4.020 -2.972 4.443 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.371 -5.217 3.318 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.654 -4.040 2.192 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.390 -4.421 2.095 1.00 0.00 H new ATOM 153 N ASP A 20 7.232 -2.990 4.450 1.00 0.00 N ATOM 154 CA ASP A 20 8.441 -3.132 5.255 1.00 0.00 C ATOM 155 C ASP A 20 8.269 -2.585 6.689 1.00 0.00 C ATOM 156 O ASP A 20 7.549 -1.604 6.879 1.00 0.00 O ATOM 157 CB ASP A 20 9.571 -2.345 4.572 1.00 0.00 C ATOM 158 CG ASP A 20 10.502 -3.163 3.687 1.00 0.00 C ATOM 159 OD1 ASP A 20 11.399 -3.850 4.217 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.550 -2.885 2.473 1.00 0.00 O ATOM 0 H ASP A 20 7.383 -2.380 3.646 1.00 0.00 H new ATOM 0 HA ASP A 20 8.667 -4.196 5.329 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.125 -1.555 3.967 1.00 0.00 H new ATOM 0 HB3 ASP A 20 10.167 -1.858 5.343 1.00 0.00 H new ATOM 165 N PRO A 21 9.023 -3.131 7.665 1.00 0.00 N ATOM 166 CA PRO A 21 8.892 -2.931 9.117 1.00 0.00 C ATOM 167 C PRO A 21 9.194 -1.477 9.538 1.00 0.00 C ATOM 168 O PRO A 21 8.375 -0.573 9.362 1.00 0.00 O ATOM 169 CB PRO A 21 9.884 -3.960 9.708 1.00 0.00 C ATOM 170 CG PRO A 21 10.999 -3.944 8.654 1.00 0.00 C ATOM 171 CD PRO A 21 10.157 -4.009 7.402 1.00 0.00 C ATOM 0 HA PRO A 21 7.876 -3.085 9.481 1.00 0.00 H new ATOM 0 HB2 PRO A 21 10.245 -3.664 10.693 1.00 0.00 H new ATOM 0 HB3 PRO A 21 9.436 -4.947 9.817 1.00 0.00 H new ATOM 0 HG2 PRO A 21 11.609 -3.042 8.703 1.00 0.00 H new ATOM 0 HG3 PRO A 21 11.677 -4.792 8.748 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.720 -3.676 6.530 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.828 -5.028 7.200 1.00 0.00 H new ATOM 179 N THR A 22 10.404 -1.238 10.063 1.00 0.00 N ATOM 180 CA THR A 22 10.997 0.072 10.319 1.00 0.00 C ATOM 181 C THR A 22 10.795 1.011 9.140 1.00 0.00 C ATOM 182 O THR A 22 10.548 2.182 9.375 1.00 0.00 O ATOM 183 CB THR A 22 12.500 -0.049 10.646 1.00 0.00 C ATOM 184 OG1 THR A 22 12.997 -1.341 10.360 1.00 0.00 O ATOM 185 CG2 THR A 22 12.755 0.200 12.132 1.00 0.00 C ATOM 0 H THR A 22 11.026 -2.000 10.334 1.00 0.00 H new ATOM 0 HA THR A 22 10.486 0.492 11.186 1.00 0.00 H new ATOM 0 HB THR A 22 13.004 0.695 10.029 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.186 -1.414 9.401 1.00 0.00 H new ATOM 0 HG21 THR A 22 13.821 0.109 12.338 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.418 1.203 12.396 1.00 0.00 H new ATOM 0 HG23 THR A 22 12.207 -0.534 12.723 1.00 0.00 H new ATOM 193 N ARG A 23 10.824 0.539 7.890 1.00 0.00 N ATOM 194 CA ARG A 23 10.645 1.415 6.729 1.00 0.00 C ATOM 195 C ARG A 23 9.253 2.071 6.649 1.00 0.00 C ATOM 196 O ARG A 23 9.183 3.295 6.530 1.00 0.00 O ATOM 197 CB ARG A 23 10.954 0.664 5.436 1.00 0.00 C ATOM 198 CG ARG A 23 11.699 1.567 4.451 1.00 0.00 C ATOM 199 CD ARG A 23 11.586 1.019 3.010 1.00 0.00 C ATOM 200 NE ARG A 23 11.988 -0.398 2.892 1.00 0.00 N ATOM 201 CZ ARG A 23 13.218 -0.888 2.886 1.00 0.00 C ATOM 202 NH1 ARG A 23 14.283 -0.117 2.793 1.00 0.00 N ATOM 203 NH2 ARG A 23 13.389 -2.185 2.996 1.00 0.00 N ATOM 0 H ARG A 23 10.970 -0.443 7.657 1.00 0.00 H new ATOM 0 HA ARG A 23 11.356 2.231 6.860 1.00 0.00 H new ATOM 0 HB2 ARG A 23 11.557 -0.217 5.657 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.027 0.311 4.984 1.00 0.00 H new ATOM 0 HG2 ARG A 23 11.289 2.576 4.494 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.748 1.637 4.737 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.557 1.128 2.667 1.00 0.00 H new ATOM 0 HD3 ARG A 23 12.208 1.623 2.349 1.00 0.00 H new ATOM 0 HE ARG A 23 11.231 -1.076 2.805 1.00 0.00 H new ATOM 0 HH11 ARG A 23 14.175 0.895 2.722 1.00 0.00 H new ATOM 0 HH12 ARG A 23 15.215 -0.532 2.792 1.00 0.00 H new ATOM 0 HH21 ARG A 23 12.580 -2.800 3.084 1.00 0.00 H new ATOM 0 HH22 ARG A 23 14.331 -2.577 2.993 1.00 0.00 H new ATOM 217 N CYS A 24 8.149 1.319 6.758 1.00 0.00 N ATOM 218 CA CYS A 24 6.813 1.928 6.808 1.00 0.00 C ATOM 219 C CYS A 24 6.689 2.827 8.050 1.00 0.00 C ATOM 220 O CYS A 24 6.251 3.977 7.956 1.00 0.00 O ATOM 221 CB CYS A 24 5.760 0.812 6.753 1.00 0.00 C ATOM 222 SG CYS A 24 4.100 1.536 6.644 1.00 0.00 S ATOM 0 H CYS A 24 8.153 0.300 6.813 1.00 0.00 H new ATOM 0 HA CYS A 24 6.646 2.577 5.948 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.943 0.169 5.892 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.835 0.185 7.641 1.00 0.00 H new ATOM 0 HG CYS A 24 3.461 1.008 5.642 1.00 0.00 H new ATOM 228 N ARG A 25 7.192 2.365 9.203 1.00 0.00 N ATOM 229 CA ARG A 25 7.242 3.165 10.434 1.00 0.00 C ATOM 230 C ARG A 25 7.949 4.516 10.265 1.00 0.00 C ATOM 231 O ARG A 25 7.428 5.532 10.720 1.00 0.00 O ATOM 232 CB ARG A 25 7.927 2.371 11.548 1.00 0.00 C ATOM 233 CG ARG A 25 7.091 1.191 12.063 1.00 0.00 C ATOM 234 CD ARG A 25 5.804 1.598 12.798 1.00 0.00 C ATOM 235 NE ARG A 25 4.762 0.589 12.576 1.00 0.00 N ATOM 236 CZ ARG A 25 3.792 0.588 11.673 1.00 0.00 C ATOM 237 NH1 ARG A 25 3.461 1.653 10.969 1.00 0.00 N ATOM 238 NH2 ARG A 25 3.142 -0.531 11.471 1.00 0.00 N ATOM 0 H ARG A 25 7.576 1.426 9.308 1.00 0.00 H new ATOM 0 HA ARG A 25 6.206 3.382 10.695 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.883 1.996 11.181 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.145 3.041 12.379 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.827 0.553 11.220 1.00 0.00 H new ATOM 0 HG3 ARG A 25 7.705 0.592 12.736 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.001 1.701 13.865 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.463 2.570 12.442 1.00 0.00 H new ATOM 0 HE ARG A 25 4.788 -0.218 13.199 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.960 2.531 11.108 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.706 1.598 10.286 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.388 -1.367 12.002 1.00 0.00 H new ATOM 0 HH22 ARG A 25 2.390 -0.567 10.783 1.00 0.00 H new ATOM 252 N ILE A 26 9.092 4.545 9.578 1.00 0.00 N ATOM 253 CA ILE A 26 9.765 5.800 9.176 1.00 0.00 C ATOM 254 C ILE A 26 8.764 6.727 8.492 1.00 0.00 C ATOM 255 O ILE A 26 8.621 7.863 8.921 1.00 0.00 O ATOM 256 CB ILE A 26 10.988 5.583 8.240 1.00 0.00 C ATOM 257 CG1 ILE A 26 12.168 4.841 8.896 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.474 6.906 7.622 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.181 5.670 9.689 1.00 0.00 C ATOM 0 H ILE A 26 9.585 3.703 9.280 1.00 0.00 H new ATOM 0 HA ILE A 26 10.147 6.248 10.093 1.00 0.00 H new ATOM 0 HB ILE A 26 10.615 4.930 7.450 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.758 4.085 9.565 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.709 4.313 8.111 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.329 6.713 6.975 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.669 7.351 7.037 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.768 7.592 8.416 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.953 5.014 10.091 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.639 6.409 9.032 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.673 6.178 10.509 1.00 0.00 H new ATOM 271 N LEU A 27 8.068 6.258 7.451 1.00 0.00 N ATOM 272 CA LEU A 27 7.128 7.103 6.699 1.00 0.00 C ATOM 273 C LEU A 27 6.001 7.651 7.589 1.00 0.00 C ATOM 274 O LEU A 27 5.769 8.857 7.564 1.00 0.00 O ATOM 275 CB LEU A 27 6.555 6.341 5.490 1.00 0.00 C ATOM 276 CG LEU A 27 7.587 5.898 4.435 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.899 4.984 3.419 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.226 7.070 3.678 1.00 0.00 C ATOM 0 H LEU A 27 8.136 5.300 7.109 1.00 0.00 H new ATOM 0 HA LEU A 27 7.690 7.962 6.331 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.032 5.457 5.855 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.812 6.973 5.003 1.00 0.00 H new ATOM 0 HG LEU A 27 8.384 5.383 4.971 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.622 4.665 2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.497 4.109 3.930 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.087 5.525 2.934 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.942 6.687 2.951 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.451 7.635 3.160 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.740 7.722 4.384 1.00 0.00 H new ATOM 290 N VAL A 28 5.348 6.804 8.399 1.00 0.00 N ATOM 291 CA VAL A 28 4.202 7.238 9.236 1.00 0.00 C ATOM 292 C VAL A 28 4.648 8.244 10.303 1.00 0.00 C ATOM 293 O VAL A 28 3.908 9.171 10.623 1.00 0.00 O ATOM 294 CB VAL A 28 3.372 6.101 9.905 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.074 4.909 8.986 1.00 0.00 C ATOM 296 CG2 VAL A 28 3.984 5.518 11.190 1.00 0.00 C ATOM 0 H VAL A 28 5.587 5.817 8.497 1.00 0.00 H new ATOM 0 HA VAL A 28 3.525 7.704 8.520 1.00 0.00 H new ATOM 0 HB VAL A 28 2.452 6.634 10.146 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.493 4.165 9.531 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.506 5.250 8.121 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.011 4.464 8.652 1.00 0.00 H new ATOM 0 HG21 VAL A 28 3.334 4.735 11.580 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.965 5.098 10.968 1.00 0.00 H new ATOM 0 HG23 VAL A 28 4.087 6.307 11.934 1.00 0.00 H new ATOM 306 N ALA A 29 5.857 8.061 10.851 1.00 0.00 N ATOM 307 CA ALA A 29 6.391 8.925 11.891 1.00 0.00 C ATOM 308 C ALA A 29 7.011 10.208 11.327 1.00 0.00 C ATOM 309 O ALA A 29 7.016 11.226 12.017 1.00 0.00 O ATOM 310 CB ALA A 29 7.392 8.112 12.711 1.00 0.00 C ATOM 0 H ALA A 29 6.487 7.306 10.579 1.00 0.00 H new ATOM 0 HA ALA A 29 5.578 9.264 12.533 1.00 0.00 H new ATOM 0 HB1 ALA A 29 7.809 8.738 13.500 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.887 7.255 13.156 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.195 7.763 12.062 1.00 0.00 H new ATOM 316 N LEU A 30 7.502 10.210 10.080 1.00 0.00 N ATOM 317 CA LEU A 30 7.984 11.421 9.464 1.00 0.00 C ATOM 318 C LEU A 30 6.858 12.399 9.170 1.00 0.00 C ATOM 319 O LEU A 30 7.099 13.593 9.320 1.00 0.00 O ATOM 320 CB LEU A 30 8.685 11.033 8.181 1.00 0.00 C ATOM 321 CG LEU A 30 9.517 12.186 7.617 1.00 0.00 C ATOM 322 CD1 LEU A 30 10.583 12.744 8.576 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.174 11.550 6.417 1.00 0.00 C ATOM 0 H LEU A 30 7.569 9.380 9.491 1.00 0.00 H new ATOM 0 HA LEU A 30 8.666 11.926 10.149 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.331 10.175 8.365 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.946 10.723 7.442 1.00 0.00 H new ATOM 0 HG LEU A 30 8.893 13.054 7.407 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.121 13.557 8.089 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.100 13.118 9.479 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.284 11.952 8.841 1.00 0.00 H new ATOM 0 HD21 LEU A 30 10.807 12.283 5.918 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.783 10.705 6.740 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.408 11.201 5.725 1.00 0.00 H new ATOM 335 N LEU A 31 5.684 11.892 8.761 1.00 0.00 N ATOM 336 CA LEU A 31 4.520 12.633 8.293 1.00 0.00 C ATOM 337 C LEU A 31 4.181 13.842 9.185 1.00 0.00 C ATOM 338 O LEU A 31 4.091 14.952 8.672 1.00 0.00 O ATOM 339 CB LEU A 31 3.385 11.592 8.231 1.00 0.00 C ATOM 340 CG LEU A 31 2.384 11.707 7.075 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.308 10.674 7.404 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.760 13.098 6.904 1.00 0.00 C ATOM 0 H LEU A 31 5.520 10.885 8.751 1.00 0.00 H new ATOM 0 HA LEU A 31 4.699 13.085 7.318 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.838 10.602 8.187 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.827 11.646 9.166 1.00 0.00 H new ATOM 0 HG LEU A 31 2.891 11.535 6.126 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.544 10.684 6.627 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.759 9.683 7.456 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.852 10.916 8.364 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.066 13.085 6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.224 13.371 7.813 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.546 13.829 6.714 1.00 0.00 H new ATOM 354 N ASP A 32 4.082 13.616 10.502 1.00 0.00 N ATOM 355 CA ASP A 32 3.794 14.624 11.549 1.00 0.00 C ATOM 356 C ASP A 32 5.069 15.015 12.353 1.00 0.00 C ATOM 357 O ASP A 32 5.013 15.708 13.364 1.00 0.00 O ATOM 358 CB ASP A 32 2.663 14.057 12.440 1.00 0.00 C ATOM 359 CG ASP A 32 1.751 15.097 13.124 1.00 0.00 C ATOM 360 OD1 ASP A 32 1.328 16.062 12.441 1.00 0.00 O ATOM 361 OD2 ASP A 32 1.375 14.843 14.293 1.00 0.00 O ATOM 0 H ASP A 32 4.205 12.682 10.892 1.00 0.00 H new ATOM 0 HA ASP A 32 3.462 15.558 11.096 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.040 13.404 11.829 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.114 13.435 13.213 1.00 0.00 H new ATOM 366 N GLY A 33 6.241 14.552 11.893 1.00 0.00 N ATOM 367 CA GLY A 33 7.586 14.901 12.369 1.00 0.00 C ATOM 368 C GLY A 33 8.179 16.048 11.570 1.00 0.00 C ATOM 369 O GLY A 33 8.322 17.150 12.085 1.00 0.00 O ATOM 0 H GLY A 33 6.275 13.879 11.127 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.540 15.176 13.423 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.237 14.030 12.295 1.00 0.00 H new ATOM 373 N VAL A 34 8.584 15.739 10.339 1.00 0.00 N ATOM 374 CA VAL A 34 9.325 16.581 9.379 1.00 0.00 C ATOM 375 C VAL A 34 10.178 17.719 9.994 1.00 0.00 C ATOM 376 O VAL A 34 10.113 18.873 9.569 1.00 0.00 O ATOM 377 CB VAL A 34 8.402 17.069 8.240 1.00 0.00 C ATOM 378 CG1 VAL A 34 7.916 15.930 7.338 1.00 0.00 C ATOM 379 CG2 VAL A 34 7.163 17.775 8.804 1.00 0.00 C ATOM 0 H VAL A 34 8.390 14.817 9.947 1.00 0.00 H new ATOM 0 HA VAL A 34 10.080 15.921 8.952 1.00 0.00 H new ATOM 0 HB VAL A 34 9.007 17.756 7.648 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.272 16.334 6.557 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.774 15.436 6.882 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.356 15.208 7.933 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.529 18.109 7.983 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.605 17.083 9.434 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.473 18.636 9.397 1.00 0.00 H new ATOM 389 N CYS A 35 10.995 17.385 10.997 1.00 0.00 N ATOM 390 CA CYS A 35 11.923 18.292 11.677 1.00 0.00 C ATOM 391 C CYS A 35 13.342 18.205 11.123 1.00 0.00 C ATOM 392 O CYS A 35 13.806 19.166 10.526 1.00 0.00 O ATOM 393 CB CYS A 35 11.921 18.047 13.195 1.00 0.00 C ATOM 394 SG CYS A 35 10.380 18.607 13.962 1.00 0.00 S ATOM 0 H CYS A 35 11.029 16.437 11.372 1.00 0.00 H new ATOM 0 HA CYS A 35 11.566 19.303 11.483 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.060 16.984 13.392 1.00 0.00 H new ATOM 0 HB3 CYS A 35 12.764 18.568 13.649 1.00 0.00 H new ATOM 0 HG CYS A 35 9.368 18.123 13.306 1.00 0.00 H new ATOM 400 N TYR A 36 14.044 17.077 11.300 1.00 0.00 N ATOM 401 CA TYR A 36 15.501 17.038 11.009 1.00 0.00 C ATOM 402 C TYR A 36 16.020 15.693 10.456 1.00 0.00 C ATOM 403 O TYR A 36 15.383 14.660 10.684 1.00 0.00 O ATOM 404 CB TYR A 36 16.335 17.480 12.240 1.00 0.00 C ATOM 405 CG TYR A 36 15.721 18.463 13.216 1.00 0.00 C ATOM 406 CD1 TYR A 36 15.599 19.820 12.870 1.00 0.00 C ATOM 407 CD2 TYR A 36 15.306 18.022 14.489 1.00 0.00 C ATOM 408 CE1 TYR A 36 15.044 20.738 13.782 1.00 0.00 C ATOM 409 CE2 TYR A 36 14.766 18.937 15.410 1.00 0.00 C ATOM 410 CZ TYR A 36 14.638 20.303 15.062 1.00 0.00 C ATOM 411 OH TYR A 36 14.128 21.190 15.961 1.00 0.00 O ATOM 0 H TYR A 36 13.649 16.198 11.633 1.00 0.00 H new ATOM 0 HA TYR A 36 15.638 17.756 10.200 1.00 0.00 H new ATOM 0 HB2 TYR A 36 16.603 16.583 12.798 1.00 0.00 H new ATOM 0 HB3 TYR A 36 17.264 17.915 11.872 1.00 0.00 H new ATOM 0 HD1 TYR A 36 15.932 20.160 11.901 1.00 0.00 H new ATOM 0 HD2 TYR A 36 15.403 16.980 14.757 1.00 0.00 H new ATOM 0 HE1 TYR A 36 14.929 21.775 13.502 1.00 0.00 H new ATOM 0 HE2 TYR A 36 14.448 18.597 16.385 1.00 0.00 H new ATOM 0 HH TYR A 36 13.899 20.720 16.790 1.00 0.00 H new ATOM 421 N PRO A 37 17.186 15.648 9.768 1.00 0.00 N ATOM 422 CA PRO A 37 17.811 14.401 9.333 1.00 0.00 C ATOM 423 C PRO A 37 18.035 13.458 10.514 1.00 0.00 C ATOM 424 O PRO A 37 18.613 13.838 11.529 1.00 0.00 O ATOM 425 CB PRO A 37 19.132 14.795 8.655 1.00 0.00 C ATOM 426 CG PRO A 37 19.433 16.177 9.221 1.00 0.00 C ATOM 427 CD PRO A 37 18.031 16.759 9.351 1.00 0.00 C ATOM 0 HA PRO A 37 17.172 13.857 8.638 1.00 0.00 H new ATOM 0 HB2 PRO A 37 19.927 14.086 8.886 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.033 14.820 7.570 1.00 0.00 H new ATOM 0 HG2 PRO A 37 19.947 16.125 10.181 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.062 16.766 8.554 1.00 0.00 H new ATOM 0 HD2 PRO A 37 18.007 17.566 10.083 1.00 0.00 H new ATOM 0 HD3 PRO A 37 17.690 17.177 8.404 1.00 0.00 H new ATOM 435 N GLY A 38 17.533 12.225 10.390 1.00 0.00 N ATOM 436 CA GLY A 38 17.666 11.208 11.434 1.00 0.00 C ATOM 437 C GLY A 38 16.834 11.461 12.696 1.00 0.00 C ATOM 438 O GLY A 38 17.003 10.713 13.656 1.00 0.00 O ATOM 0 H GLY A 38 17.025 11.906 9.565 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.381 10.242 11.017 1.00 0.00 H new ATOM 0 HA3 GLY A 38 18.716 11.136 11.718 1.00 0.00 H new ATOM 442 N GLN A 39 15.929 12.458 12.726 1.00 0.00 N ATOM 443 CA GLN A 39 15.054 12.713 13.887 1.00 0.00 C ATOM 444 C GLN A 39 14.240 11.483 14.301 1.00 0.00 C ATOM 445 O GLN A 39 13.826 11.366 15.449 1.00 0.00 O ATOM 446 CB GLN A 39 14.080 13.875 13.612 1.00 0.00 C ATOM 447 CG GLN A 39 12.969 13.547 12.583 1.00 0.00 C ATOM 448 CD GLN A 39 11.682 14.314 12.778 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.106 14.787 11.824 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.157 14.457 13.973 1.00 0.00 N ATOM 0 H GLN A 39 15.784 13.106 11.951 1.00 0.00 H new ATOM 0 HA GLN A 39 15.726 12.974 14.705 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.613 14.172 14.551 1.00 0.00 H new ATOM 0 HB3 GLN A 39 14.649 14.733 13.254 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.349 13.750 11.582 1.00 0.00 H new ATOM 0 HG3 GLN A 39 12.751 12.480 12.631 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.629 14.065 14.788 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.277 14.960 14.087 1.00 0.00 H new ATOM 459 N LEU A 40 14.015 10.579 13.346 1.00 0.00 N ATOM 460 CA LEU A 40 13.216 9.375 13.485 1.00 0.00 C ATOM 461 C LEU A 40 13.814 8.418 14.513 1.00 0.00 C ATOM 462 O LEU A 40 13.115 7.532 14.978 1.00 0.00 O ATOM 463 CB LEU A 40 13.114 8.718 12.105 1.00 0.00 C ATOM 464 CG LEU A 40 12.410 9.621 11.068 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.166 9.584 9.734 1.00 0.00 C ATOM 466 CD2 LEU A 40 10.946 9.209 10.934 1.00 0.00 C ATOM 0 H LEU A 40 14.408 10.678 12.410 1.00 0.00 H new ATOM 0 HA LEU A 40 12.222 9.632 13.852 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.114 8.473 11.748 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.568 7.779 12.193 1.00 0.00 H new ATOM 0 HG LEU A 40 12.422 10.657 11.406 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.660 10.224 9.011 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.185 9.940 9.883 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.191 8.561 9.358 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.454 9.849 10.202 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.889 8.171 10.606 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.449 9.313 11.899 1.00 0.00 H new ATOM 478 N ALA A 41 15.078 8.606 14.894 1.00 0.00 N ATOM 479 CA ALA A 41 15.683 7.893 16.005 1.00 0.00 C ATOM 480 C ALA A 41 14.977 8.168 17.342 1.00 0.00 C ATOM 481 O ALA A 41 14.930 7.284 18.189 1.00 0.00 O ATOM 482 CB ALA A 41 17.169 8.274 16.044 1.00 0.00 C ATOM 0 H ALA A 41 15.709 9.262 14.434 1.00 0.00 H new ATOM 0 HA ALA A 41 15.575 6.819 15.853 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.656 7.755 16.869 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.643 7.988 15.105 1.00 0.00 H new ATOM 0 HB3 ALA A 41 17.265 9.351 16.185 1.00 0.00 H new ATOM 488 N ALA A 42 14.383 9.354 17.518 1.00 0.00 N ATOM 489 CA ALA A 42 13.507 9.640 18.656 1.00 0.00 C ATOM 490 C ALA A 42 12.125 9.003 18.451 1.00 0.00 C ATOM 491 O ALA A 42 11.640 8.292 19.322 1.00 0.00 O ATOM 492 CB ALA A 42 13.422 11.162 18.846 1.00 0.00 C ATOM 0 H ALA A 42 14.497 10.139 16.877 1.00 0.00 H new ATOM 0 HA ALA A 42 13.919 9.201 19.564 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.772 11.387 19.691 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.418 11.561 19.038 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.016 11.619 17.944 1.00 0.00 H new ATOM 498 N HIS A 43 11.517 9.208 17.278 1.00 0.00 N ATOM 499 CA HIS A 43 10.188 8.672 16.967 1.00 0.00 C ATOM 500 C HIS A 43 10.075 7.135 17.047 1.00 0.00 C ATOM 501 O HIS A 43 9.020 6.608 17.399 1.00 0.00 O ATOM 502 CB HIS A 43 9.826 9.086 15.542 1.00 0.00 C ATOM 503 CG HIS A 43 9.549 10.546 15.309 1.00 0.00 C ATOM 504 ND1 HIS A 43 9.309 11.515 16.286 1.00 0.00 N ATOM 505 CD2 HIS A 43 9.213 11.051 14.090 1.00 0.00 C ATOM 506 CE1 HIS A 43 8.767 12.555 15.633 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.686 12.301 14.316 1.00 0.00 N ATOM 0 H HIS A 43 11.931 9.749 16.519 1.00 0.00 H new ATOM 0 HA HIS A 43 9.515 9.078 17.722 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.641 8.786 14.884 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.945 8.520 15.237 1.00 0.00 H new ATOM 0 HD1 HIS A 43 9.504 11.447 17.285 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.336 10.565 13.133 1.00 0.00 H new ATOM 0 HE1 HIS A 43 8.440 13.471 16.102 1.00 0.00 H new ATOM 515 N LEU A 44 11.133 6.423 16.642 1.00 0.00 N ATOM 516 CA LEU A 44 11.188 4.962 16.560 1.00 0.00 C ATOM 517 C LEU A 44 11.940 4.335 17.745 1.00 0.00 C ATOM 518 O LEU A 44 11.898 3.118 17.902 1.00 0.00 O ATOM 519 CB LEU A 44 11.854 4.551 15.223 1.00 0.00 C ATOM 520 CG LEU A 44 11.208 5.090 13.925 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.713 4.349 12.689 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.673 5.045 13.898 1.00 0.00 C ATOM 0 H LEU A 44 12.005 6.866 16.352 1.00 0.00 H new ATOM 0 HA LEU A 44 10.166 4.586 16.602 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.893 4.879 15.247 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.865 3.462 15.170 1.00 0.00 H new ATOM 0 HG LEU A 44 11.512 6.137 13.910 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.235 4.758 11.799 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.793 4.470 12.608 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.472 3.290 12.776 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.314 5.443 12.949 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.337 4.014 14.009 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.277 5.646 14.717 1.00 0.00 H new ATOM 534 N GLY A 45 12.689 5.115 18.536 1.00 0.00 N ATOM 535 CA GLY A 45 13.583 4.609 19.590 1.00 0.00 C ATOM 536 C GLY A 45 14.821 3.863 19.071 1.00 0.00 C ATOM 537 O GLY A 45 15.639 3.408 19.879 1.00 0.00 O ATOM 0 H GLY A 45 12.692 6.132 18.461 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.911 5.448 20.204 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.017 3.941 20.239 1.00 0.00 H new ATOM 541 N LEU A 46 14.966 3.703 17.746 1.00 0.00 N ATOM 542 CA LEU A 46 16.111 3.047 17.099 1.00 0.00 C ATOM 543 C LEU A 46 17.257 4.044 16.882 1.00 0.00 C ATOM 544 O LEU A 46 17.015 5.224 16.665 1.00 0.00 O ATOM 545 CB LEU A 46 15.656 2.420 15.759 1.00 0.00 C ATOM 546 CG LEU A 46 15.106 0.978 15.813 1.00 0.00 C ATOM 547 CD1 LEU A 46 16.108 0.001 16.446 1.00 0.00 C ATOM 548 CD2 LEU A 46 13.760 0.876 16.535 1.00 0.00 C ATOM 0 H LEU A 46 14.271 4.036 17.078 1.00 0.00 H new ATOM 0 HA LEU A 46 16.485 2.255 17.748 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.886 3.061 15.329 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.503 2.435 15.073 1.00 0.00 H new ATOM 0 HG LEU A 46 14.948 0.695 14.772 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.678 -1.001 16.463 1.00 0.00 H new ATOM 0 HD12 LEU A 46 17.027 -0.008 15.860 1.00 0.00 H new ATOM 0 HD13 LEU A 46 16.331 0.318 17.465 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.427 -0.162 16.539 1.00 0.00 H new ATOM 0 HD22 LEU A 46 13.870 1.226 17.561 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.023 1.491 16.019 1.00 0.00 H new ATOM 560 N THR A 47 18.521 3.592 16.873 1.00 0.00 N ATOM 561 CA THR A 47 19.669 4.511 16.723 1.00 0.00 C ATOM 562 C THR A 47 19.671 5.202 15.359 1.00 0.00 C ATOM 563 O THR A 47 19.121 4.679 14.382 1.00 0.00 O ATOM 564 CB THR A 47 21.037 3.866 17.013 1.00 0.00 C ATOM 565 OG1 THR A 47 21.551 3.279 15.845 1.00 0.00 O ATOM 566 CG2 THR A 47 21.020 2.824 18.133 1.00 0.00 C ATOM 0 H THR A 47 18.776 2.609 16.966 1.00 0.00 H new ATOM 0 HA THR A 47 19.524 5.266 17.496 1.00 0.00 H new ATOM 0 HB THR A 47 21.675 4.680 17.357 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.260 2.345 15.793 1.00 0.00 H new ATOM 0 HG21 THR A 47 22.023 2.421 18.270 1.00 0.00 H new ATOM 0 HG22 THR A 47 20.686 3.291 19.060 1.00 0.00 H new ATOM 0 HG23 THR A 47 20.338 2.016 17.868 1.00 0.00 H new ATOM 574 N ARG A 48 20.382 6.338 15.269 1.00 0.00 N ATOM 575 CA ARG A 48 20.574 7.072 14.009 1.00 0.00 C ATOM 576 C ARG A 48 21.127 6.154 12.903 1.00 0.00 C ATOM 577 O ARG A 48 20.729 6.299 11.751 1.00 0.00 O ATOM 578 CB ARG A 48 21.482 8.304 14.222 1.00 0.00 C ATOM 579 CG ARG A 48 21.393 9.298 13.042 1.00 0.00 C ATOM 580 CD ARG A 48 22.451 10.417 13.044 1.00 0.00 C ATOM 581 NE ARG A 48 22.262 11.410 14.123 1.00 0.00 N ATOM 582 CZ ARG A 48 22.916 12.564 14.259 1.00 0.00 C ATOM 583 NH1 ARG A 48 23.818 12.975 13.386 1.00 0.00 N ATOM 584 NH2 ARG A 48 22.672 13.338 15.296 1.00 0.00 N ATOM 0 H ARG A 48 20.840 6.773 16.070 1.00 0.00 H new ATOM 0 HA ARG A 48 19.598 7.428 13.679 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.197 8.810 15.145 1.00 0.00 H new ATOM 0 HB3 ARG A 48 22.515 7.977 14.344 1.00 0.00 H new ATOM 0 HG2 ARG A 48 21.481 8.739 12.110 1.00 0.00 H new ATOM 0 HG3 ARG A 48 20.404 9.756 13.048 1.00 0.00 H new ATOM 0 HD2 ARG A 48 23.440 9.970 13.143 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.427 10.929 12.082 1.00 0.00 H new ATOM 0 HE ARG A 48 21.563 11.191 14.833 1.00 0.00 H new ATOM 0 HH11 ARG A 48 24.037 12.402 12.571 1.00 0.00 H new ATOM 0 HH12 ARG A 48 24.296 13.865 13.527 1.00 0.00 H new ATOM 0 HH21 ARG A 48 21.984 13.054 15.993 1.00 0.00 H new ATOM 0 HH22 ARG A 48 23.171 14.221 15.402 1.00 0.00 H new ATOM 598 N SER A 49 21.975 5.180 13.235 1.00 0.00 N ATOM 599 CA SER A 49 22.447 4.157 12.291 1.00 0.00 C ATOM 600 C SER A 49 21.300 3.238 11.841 1.00 0.00 C ATOM 601 O SER A 49 21.004 3.187 10.654 1.00 0.00 O ATOM 602 CB SER A 49 23.591 3.342 12.914 1.00 0.00 C ATOM 603 OG SER A 49 24.594 4.207 13.422 1.00 0.00 O ATOM 0 H SER A 49 22.359 5.075 14.174 1.00 0.00 H new ATOM 0 HA SER A 49 22.826 4.665 11.404 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.204 2.713 13.716 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.021 2.676 12.166 1.00 0.00 H new ATOM 0 HG SER A 49 25.316 3.675 13.817 1.00 0.00 H new ATOM 609 N ASN A 50 20.580 2.597 12.771 1.00 0.00 N ATOM 610 CA ASN A 50 19.452 1.706 12.444 1.00 0.00 C ATOM 611 C ASN A 50 18.346 2.411 11.631 1.00 0.00 C ATOM 612 O ASN A 50 17.731 1.792 10.764 1.00 0.00 O ATOM 613 CB ASN A 50 18.859 1.130 13.738 1.00 0.00 C ATOM 614 CG ASN A 50 19.854 0.305 14.542 1.00 0.00 C ATOM 615 OD1 ASN A 50 20.594 0.845 15.352 1.00 0.00 O ATOM 616 ND2 ASN A 50 19.907 -1.001 14.360 1.00 0.00 N ATOM 0 H ASN A 50 20.761 2.679 13.771 1.00 0.00 H new ATOM 0 HA ASN A 50 19.846 0.906 11.817 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.492 1.949 14.357 1.00 0.00 H new ATOM 0 HB3 ASN A 50 17.999 0.508 13.490 1.00 0.00 H new ATOM 0 HD21 ASN A 50 20.567 -1.564 14.896 1.00 0.00 H new ATOM 0 HD22 ASN A 50 19.288 -1.447 13.683 1.00 0.00 H new ATOM 623 N VAL A 51 18.126 3.704 11.879 1.00 0.00 N ATOM 624 CA VAL A 51 17.227 4.571 11.098 1.00 0.00 C ATOM 625 C VAL A 51 17.801 4.912 9.716 1.00 0.00 C ATOM 626 O VAL A 51 17.104 4.748 8.714 1.00 0.00 O ATOM 627 CB VAL A 51 16.906 5.848 11.912 1.00 0.00 C ATOM 628 CG1 VAL A 51 16.464 7.075 11.096 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.839 5.510 12.962 1.00 0.00 C ATOM 0 H VAL A 51 18.579 4.195 12.650 1.00 0.00 H new ATOM 0 HA VAL A 51 16.302 4.025 10.913 1.00 0.00 H new ATOM 0 HB VAL A 51 17.850 6.150 12.365 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.266 7.908 11.770 1.00 0.00 H new ATOM 0 HG12 VAL A 51 17.254 7.352 10.398 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.557 6.835 10.540 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.604 6.402 13.542 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.938 5.154 12.463 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.216 4.733 13.627 1.00 0.00 H new ATOM 639 N SER A 52 19.057 5.360 9.629 1.00 0.00 N ATOM 640 CA SER A 52 19.669 5.748 8.346 1.00 0.00 C ATOM 641 C SER A 52 19.809 4.559 7.384 1.00 0.00 C ATOM 642 O SER A 52 19.626 4.728 6.177 1.00 0.00 O ATOM 643 CB SER A 52 21.018 6.442 8.565 1.00 0.00 C ATOM 644 OG SER A 52 20.856 7.574 9.408 1.00 0.00 O ATOM 0 H SER A 52 19.675 5.465 10.433 1.00 0.00 H new ATOM 0 HA SER A 52 18.992 6.460 7.874 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.726 5.744 9.013 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.437 6.750 7.607 1.00 0.00 H new ATOM 0 HG SER A 52 21.073 7.328 10.331 1.00 0.00 H new ATOM 650 N ASN A 53 19.989 3.344 7.919 1.00 0.00 N ATOM 651 CA ASN A 53 19.946 2.080 7.180 1.00 0.00 C ATOM 652 C ASN A 53 18.689 1.920 6.311 1.00 0.00 C ATOM 653 O ASN A 53 18.767 1.373 5.214 1.00 0.00 O ATOM 654 CB ASN A 53 20.060 0.915 8.176 1.00 0.00 C ATOM 655 CG ASN A 53 21.462 0.699 8.746 1.00 0.00 C ATOM 656 OD1 ASN A 53 22.437 1.347 8.395 1.00 0.00 O ATOM 657 ND2 ASN A 53 21.604 -0.258 9.644 1.00 0.00 N ATOM 0 H ASN A 53 20.175 3.212 8.913 1.00 0.00 H new ATOM 0 HA ASN A 53 20.788 2.079 6.488 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.370 1.091 9.001 1.00 0.00 H new ATOM 0 HB3 ASN A 53 19.738 -0.001 7.681 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.523 -0.453 10.041 1.00 0.00 H new ATOM 0 HD22 ASN A 53 20.794 -0.803 9.941 1.00 0.00 H new ATOM 664 N HIS A 54 17.528 2.412 6.758 1.00 0.00 N ATOM 665 CA HIS A 54 16.318 2.408 5.934 1.00 0.00 C ATOM 666 C HIS A 54 16.141 3.674 5.075 1.00 0.00 C ATOM 667 O HIS A 54 15.556 3.554 3.998 1.00 0.00 O ATOM 668 CB HIS A 54 15.092 2.147 6.819 1.00 0.00 C ATOM 669 CG HIS A 54 14.784 0.678 6.994 1.00 0.00 C ATOM 670 ND1 HIS A 54 14.252 -0.163 6.040 1.00 0.00 N ATOM 671 CD2 HIS A 54 14.922 -0.064 8.135 1.00 0.00 C ATOM 672 CE1 HIS A 54 14.020 -1.357 6.613 1.00 0.00 C ATOM 673 NE2 HIS A 54 14.392 -1.331 7.899 1.00 0.00 N ATOM 0 H HIS A 54 17.403 2.817 7.686 1.00 0.00 H new ATOM 0 HA HIS A 54 16.426 1.597 5.213 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.257 2.596 7.798 1.00 0.00 H new ATOM 0 HB3 HIS A 54 14.225 2.644 6.383 1.00 0.00 H new ATOM 0 HD1 HIS A 54 14.066 0.079 5.067 1.00 0.00 H new ATOM 0 HD2 HIS A 54 15.366 0.274 9.060 1.00 0.00 H new ATOM 0 HE1 HIS A 54 13.595 -2.213 6.109 1.00 0.00 H new ATOM 681 N LEU A 55 16.637 4.850 5.496 1.00 0.00 N ATOM 682 CA LEU A 55 16.579 6.083 4.688 1.00 0.00 C ATOM 683 C LEU A 55 17.440 5.995 3.430 1.00 0.00 C ATOM 684 O LEU A 55 17.107 6.644 2.444 1.00 0.00 O ATOM 685 CB LEU A 55 16.995 7.337 5.485 1.00 0.00 C ATOM 686 CG LEU A 55 16.126 7.653 6.721 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.781 8.745 7.581 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.723 8.098 6.293 1.00 0.00 C ATOM 0 H LEU A 55 17.088 4.974 6.402 1.00 0.00 H new ATOM 0 HA LEU A 55 15.532 6.180 4.400 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.028 7.214 5.810 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.971 8.197 4.816 1.00 0.00 H new ATOM 0 HG LEU A 55 16.042 6.743 7.315 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.152 8.952 8.447 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.760 8.405 7.917 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.896 9.654 6.990 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.125 8.316 7.178 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.798 8.993 5.675 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.247 7.301 5.721 1.00 0.00 H new ATOM 700 N SER A 56 18.507 5.198 3.448 1.00 0.00 N ATOM 701 CA SER A 56 19.328 4.926 2.259 1.00 0.00 C ATOM 702 C SER A 56 18.467 4.495 1.051 1.00 0.00 C ATOM 703 O SER A 56 18.491 5.138 -0.001 1.00 0.00 O ATOM 704 CB SER A 56 20.380 3.869 2.634 1.00 0.00 C ATOM 705 OG SER A 56 21.353 3.736 1.619 1.00 0.00 O ATOM 0 H SER A 56 18.831 4.719 4.288 1.00 0.00 H new ATOM 0 HA SER A 56 19.832 5.839 1.943 1.00 0.00 H new ATOM 0 HB2 SER A 56 20.863 4.149 3.570 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.892 2.909 2.802 1.00 0.00 H new ATOM 0 HG SER A 56 22.011 3.059 1.883 1.00 0.00 H new ATOM 711 N CYS A 57 17.591 3.500 1.253 1.00 0.00 N ATOM 712 CA CYS A 57 16.568 3.094 0.309 1.00 0.00 C ATOM 713 C CYS A 57 15.473 4.167 0.167 1.00 0.00 C ATOM 714 O CYS A 57 15.077 4.500 -0.942 1.00 0.00 O ATOM 715 CB CYS A 57 16.010 1.772 0.855 1.00 0.00 C ATOM 716 SG CYS A 57 14.504 1.202 -0.018 1.00 0.00 S ATOM 0 H CYS A 57 17.584 2.945 2.109 1.00 0.00 H new ATOM 0 HA CYS A 57 16.973 2.967 -0.695 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.778 1.003 0.778 1.00 0.00 H new ATOM 0 HB3 CYS A 57 15.783 1.892 1.914 1.00 0.00 H new ATOM 0 HG CYS A 57 14.340 -0.071 0.186 1.00 0.00 H new ATOM 721 N LEU A 58 14.981 4.721 1.281 1.00 0.00 N ATOM 722 CA LEU A 58 13.788 5.570 1.285 1.00 0.00 C ATOM 723 C LEU A 58 13.940 6.857 0.462 1.00 0.00 C ATOM 724 O LEU A 58 12.949 7.305 -0.125 1.00 0.00 O ATOM 725 CB LEU A 58 13.359 5.820 2.745 1.00 0.00 C ATOM 726 CG LEU A 58 11.838 5.849 2.988 1.00 0.00 C ATOM 727 CD1 LEU A 58 11.178 4.548 2.534 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.619 6.050 4.488 1.00 0.00 C ATOM 0 H LEU A 58 15.399 4.593 2.203 1.00 0.00 H new ATOM 0 HA LEU A 58 12.987 5.040 0.771 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.796 5.044 3.373 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.781 6.770 3.073 1.00 0.00 H new ATOM 0 HG LEU A 58 11.387 6.657 2.412 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.105 4.600 2.719 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.356 4.402 1.469 1.00 0.00 H new ATOM 0 HD13 LEU A 58 11.602 3.712 3.090 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.550 6.076 4.699 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.077 5.227 5.036 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.073 6.991 4.799 1.00 0.00 H new ATOM 740 N ARG A 59 15.147 7.440 0.392 1.00 0.00 N ATOM 741 CA ARG A 59 15.436 8.521 -0.549 1.00 0.00 C ATOM 742 C ARG A 59 15.617 8.017 -1.985 1.00 0.00 C ATOM 743 O ARG A 59 15.177 8.686 -2.911 1.00 0.00 O ATOM 744 CB ARG A 59 16.697 9.285 -0.158 1.00 0.00 C ATOM 745 CG ARG A 59 16.665 9.971 1.222 1.00 0.00 C ATOM 746 CD ARG A 59 17.749 11.058 1.261 1.00 0.00 C ATOM 747 NE ARG A 59 17.457 12.158 0.310 1.00 0.00 N ATOM 748 CZ ARG A 59 18.099 12.458 -0.817 1.00 0.00 C ATOM 749 NH1 ARG A 59 19.178 11.817 -1.222 1.00 0.00 N ATOM 750 NH2 ARG A 59 17.635 13.415 -1.578 1.00 0.00 N ATOM 0 H ARG A 59 15.937 7.176 0.980 1.00 0.00 H new ATOM 0 HA ARG A 59 14.569 9.180 -0.506 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.539 8.594 -0.180 1.00 0.00 H new ATOM 0 HB3 ARG A 59 16.889 10.045 -0.916 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.684 10.410 1.402 1.00 0.00 H new ATOM 0 HG3 ARG A 59 16.836 9.239 2.011 1.00 0.00 H new ATOM 0 HD2 ARG A 59 17.824 11.461 2.271 1.00 0.00 H new ATOM 0 HD3 ARG A 59 18.716 10.616 1.021 1.00 0.00 H new ATOM 0 HE ARG A 59 16.668 12.758 0.549 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.557 11.053 -0.663 1.00 0.00 H new ATOM 0 HH12 ARG A 59 19.634 12.086 -2.094 1.00 0.00 H new ATOM 0 HH21 ARG A 59 16.792 13.920 -1.305 1.00 0.00 H new ATOM 0 HH22 ARG A 59 18.116 13.656 -2.444 1.00 0.00 H new ATOM 764 N GLY A 60 16.242 6.852 -2.176 1.00 0.00 N ATOM 765 CA GLY A 60 16.510 6.270 -3.498 1.00 0.00 C ATOM 766 C GLY A 60 15.233 5.862 -4.231 1.00 0.00 C ATOM 767 O GLY A 60 15.040 6.208 -5.389 1.00 0.00 O ATOM 0 H GLY A 60 16.582 6.276 -1.406 1.00 0.00 H new ATOM 0 HA2 GLY A 60 17.058 6.992 -4.104 1.00 0.00 H new ATOM 0 HA3 GLY A 60 17.153 5.397 -3.383 1.00 0.00 H new ATOM 771 N CYS A 61 14.324 5.194 -3.522 1.00 0.00 N ATOM 772 CA CYS A 61 12.952 4.914 -3.919 1.00 0.00 C ATOM 773 C CYS A 61 12.087 6.208 -4.015 1.00 0.00 C ATOM 774 O CYS A 61 10.906 6.153 -4.378 1.00 0.00 O ATOM 775 CB CYS A 61 12.431 3.877 -2.896 1.00 0.00 C ATOM 776 SG CYS A 61 12.728 2.140 -3.372 1.00 0.00 S ATOM 0 H CYS A 61 14.542 4.813 -2.601 1.00 0.00 H new ATOM 0 HA CYS A 61 12.893 4.507 -4.928 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.905 4.064 -1.933 1.00 0.00 H new ATOM 0 HB3 CYS A 61 11.360 4.026 -2.758 1.00 0.00 H new ATOM 0 HG CYS A 61 13.362 1.530 -2.415 1.00 0.00 H new ATOM 781 N GLY A 62 12.643 7.361 -3.625 1.00 0.00 N ATOM 782 CA GLY A 62 12.023 8.682 -3.718 1.00 0.00 C ATOM 783 C GLY A 62 11.029 9.015 -2.611 1.00 0.00 C ATOM 784 O GLY A 62 10.551 10.138 -2.529 1.00 0.00 O ATOM 0 H GLY A 62 13.578 7.397 -3.219 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.810 9.436 -3.715 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.512 8.758 -4.678 1.00 0.00 H new ATOM 788 N LEU A 63 10.688 8.049 -1.753 1.00 0.00 N ATOM 789 CA LEU A 63 9.592 8.135 -0.786 1.00 0.00 C ATOM 790 C LEU A 63 9.823 9.195 0.293 1.00 0.00 C ATOM 791 O LEU A 63 8.855 9.728 0.834 1.00 0.00 O ATOM 792 CB LEU A 63 9.331 6.744 -0.229 1.00 0.00 C ATOM 793 CG LEU A 63 9.170 5.702 -1.357 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.830 4.394 -0.689 1.00 0.00 C ATOM 795 CD2 LEU A 63 8.119 6.021 -2.430 1.00 0.00 C ATOM 0 H LEU A 63 11.183 7.158 -1.712 1.00 0.00 H new ATOM 0 HA LEU A 63 8.692 8.482 -1.294 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.155 6.452 0.422 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.430 6.760 0.384 1.00 0.00 H new ATOM 0 HG LEU A 63 10.109 5.685 -1.910 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.705 3.620 -1.447 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.635 4.112 -0.011 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.903 4.503 -0.126 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.097 5.219 -3.167 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.138 6.112 -1.963 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.375 6.959 -2.922 1.00 0.00 H new ATOM 807 N VAL A 64 11.088 9.510 0.567 1.00 0.00 N ATOM 808 CA VAL A 64 11.520 10.675 1.364 1.00 0.00 C ATOM 809 C VAL A 64 12.410 11.629 0.568 1.00 0.00 C ATOM 810 O VAL A 64 13.308 11.206 -0.150 1.00 0.00 O ATOM 811 CB VAL A 64 12.258 10.310 2.668 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.252 9.914 3.751 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.247 9.185 2.501 1.00 0.00 C ATOM 0 H VAL A 64 11.871 8.948 0.233 1.00 0.00 H new ATOM 0 HA VAL A 64 10.583 11.165 1.627 1.00 0.00 H new ATOM 0 HB VAL A 64 12.815 11.202 2.956 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.785 9.658 4.667 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.578 10.749 3.944 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.675 9.052 3.414 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.730 8.980 3.457 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.726 8.291 2.158 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.001 9.469 1.767 1.00 0.00 H new ATOM 823 N VAL A 65 12.175 12.925 0.766 1.00 0.00 N ATOM 824 CA VAL A 65 12.833 14.056 0.098 1.00 0.00 C ATOM 825 C VAL A 65 13.315 15.065 1.146 1.00 0.00 C ATOM 826 O VAL A 65 12.682 15.242 2.186 1.00 0.00 O ATOM 827 CB VAL A 65 11.835 14.708 -0.892 1.00 0.00 C ATOM 828 CG1 VAL A 65 12.239 16.112 -1.365 1.00 0.00 C ATOM 829 CG2 VAL A 65 11.650 13.800 -2.117 1.00 0.00 C ATOM 0 H VAL A 65 11.476 13.237 1.440 1.00 0.00 H new ATOM 0 HA VAL A 65 13.703 13.710 -0.461 1.00 0.00 H new ATOM 0 HB VAL A 65 10.903 14.824 -0.339 1.00 0.00 H new ATOM 0 HG11 VAL A 65 11.486 16.494 -2.054 1.00 0.00 H new ATOM 0 HG12 VAL A 65 12.315 16.778 -0.505 1.00 0.00 H new ATOM 0 HG13 VAL A 65 13.203 16.062 -1.872 1.00 0.00 H new ATOM 0 HG21 VAL A 65 10.947 14.263 -2.810 1.00 0.00 H new ATOM 0 HG22 VAL A 65 12.610 13.659 -2.614 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.261 12.833 -1.798 1.00 0.00 H new ATOM 839 N ALA A 66 14.449 15.723 0.894 1.00 0.00 N ATOM 840 CA ALA A 66 14.985 16.786 1.763 1.00 0.00 C ATOM 841 C ALA A 66 14.369 18.177 1.496 1.00 0.00 C ATOM 842 O ALA A 66 14.063 18.537 0.357 1.00 0.00 O ATOM 843 CB ALA A 66 16.511 16.811 1.609 1.00 0.00 C ATOM 0 H ALA A 66 15.029 15.535 0.076 1.00 0.00 H new ATOM 0 HA ALA A 66 14.708 16.553 2.791 1.00 0.00 H new ATOM 0 HB1 ALA A 66 16.928 17.592 2.245 1.00 0.00 H new ATOM 0 HB2 ALA A 66 16.922 15.845 1.903 1.00 0.00 H new ATOM 0 HB3 ALA A 66 16.769 17.013 0.569 1.00 0.00 H new ATOM 849 N THR A 67 14.234 18.990 2.556 1.00 0.00 N ATOM 850 CA THR A 67 13.817 20.410 2.501 1.00 0.00 C ATOM 851 C THR A 67 14.534 21.209 3.576 1.00 0.00 C ATOM 852 O THR A 67 15.061 20.631 4.511 1.00 0.00 O ATOM 853 CB THR A 67 12.280 20.605 2.601 1.00 0.00 C ATOM 854 OG1 THR A 67 11.857 21.378 3.705 1.00 0.00 O ATOM 855 CG2 THR A 67 11.425 19.334 2.676 1.00 0.00 C ATOM 0 H THR A 67 14.417 18.672 3.508 1.00 0.00 H new ATOM 0 HA THR A 67 14.104 20.783 1.518 1.00 0.00 H new ATOM 0 HB THR A 67 12.115 21.111 1.650 1.00 0.00 H new ATOM 0 HG1 THR A 67 11.655 22.290 3.408 1.00 0.00 H new ATOM 0 HG21 THR A 67 10.372 19.607 2.743 1.00 0.00 H new ATOM 0 HG22 THR A 67 11.588 18.733 1.782 1.00 0.00 H new ATOM 0 HG23 THR A 67 11.707 18.758 3.557 1.00 0.00 H new ATOM 863 N TYR A 68 14.509 22.537 3.486 1.00 0.00 N ATOM 864 CA TYR A 68 14.883 23.407 4.611 1.00 0.00 C ATOM 865 C TYR A 68 13.636 23.707 5.466 1.00 0.00 C ATOM 866 O TYR A 68 12.563 23.915 4.888 1.00 0.00 O ATOM 867 CB TYR A 68 15.514 24.709 4.087 1.00 0.00 C ATOM 868 CG TYR A 68 16.953 24.867 4.520 1.00 0.00 C ATOM 869 CD1 TYR A 68 17.252 25.429 5.775 1.00 0.00 C ATOM 870 CD2 TYR A 68 17.992 24.398 3.695 1.00 0.00 C ATOM 871 CE1 TYR A 68 18.584 25.502 6.217 1.00 0.00 C ATOM 872 CE2 TYR A 68 19.328 24.472 4.128 1.00 0.00 C ATOM 873 CZ TYR A 68 19.629 25.019 5.397 1.00 0.00 C ATOM 874 OH TYR A 68 20.917 25.073 5.838 1.00 0.00 O ATOM 0 H TYR A 68 14.233 23.041 2.643 1.00 0.00 H new ATOM 0 HA TYR A 68 15.621 22.900 5.233 1.00 0.00 H new ATOM 0 HB2 TYR A 68 15.462 24.722 2.998 1.00 0.00 H new ATOM 0 HB3 TYR A 68 14.934 25.560 4.445 1.00 0.00 H new ATOM 0 HD1 TYR A 68 16.456 25.805 6.400 1.00 0.00 H new ATOM 0 HD2 TYR A 68 17.763 23.980 2.726 1.00 0.00 H new ATOM 0 HE1 TYR A 68 18.809 25.927 7.184 1.00 0.00 H new ATOM 0 HE2 TYR A 68 20.123 24.112 3.492 1.00 0.00 H new ATOM 0 HH TYR A 68 21.513 24.700 5.155 1.00 0.00 H new ATOM 884 N GLU A 69 13.738 23.690 6.802 1.00 0.00 N ATOM 885 CA GLU A 69 12.684 24.226 7.681 1.00 0.00 C ATOM 886 C GLU A 69 12.969 25.680 8.112 1.00 0.00 C ATOM 887 O GLU A 69 12.034 26.476 8.166 1.00 0.00 O ATOM 888 CB GLU A 69 12.309 23.242 8.809 1.00 0.00 C ATOM 889 CG GLU A 69 13.373 22.632 9.724 1.00 0.00 C ATOM 890 CD GLU A 69 13.992 23.640 10.683 1.00 0.00 C ATOM 891 OE1 GLU A 69 14.996 24.238 10.259 1.00 0.00 O ATOM 892 OE2 GLU A 69 13.512 23.842 11.819 1.00 0.00 O ATOM 0 H GLU A 69 14.542 23.310 7.301 1.00 0.00 H new ATOM 0 HA GLU A 69 11.764 24.309 7.102 1.00 0.00 H new ATOM 0 HB2 GLU A 69 11.594 23.755 9.452 1.00 0.00 H new ATOM 0 HB3 GLU A 69 11.779 22.412 8.342 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.926 21.821 10.299 1.00 0.00 H new ATOM 0 HG3 GLU A 69 14.160 22.193 9.112 1.00 0.00 H new ATOM 899 N GLY A 70 14.244 26.063 8.277 1.00 0.00 N ATOM 900 CA GLY A 70 14.713 27.450 8.468 1.00 0.00 C ATOM 901 C GLY A 70 15.943 27.588 9.376 1.00 0.00 C ATOM 902 O GLY A 70 16.792 28.444 9.146 1.00 0.00 O ATOM 0 H GLY A 70 15.010 25.390 8.282 1.00 0.00 H new ATOM 0 HA2 GLY A 70 14.947 27.878 7.493 1.00 0.00 H new ATOM 0 HA3 GLY A 70 13.899 28.041 8.888 1.00 0.00 H new ATOM 906 N ARG A 71 16.055 26.712 10.375 1.00 0.00 N ATOM 907 CA ARG A 71 17.206 26.493 11.265 1.00 0.00 C ATOM 908 C ARG A 71 18.181 25.450 10.687 1.00 0.00 C ATOM 909 O ARG A 71 19.389 25.510 10.915 1.00 0.00 O ATOM 910 CB ARG A 71 16.618 25.971 12.587 1.00 0.00 C ATOM 911 CG ARG A 71 17.626 25.720 13.721 1.00 0.00 C ATOM 912 CD ARG A 71 16.976 24.906 14.853 1.00 0.00 C ATOM 913 NE ARG A 71 15.734 25.526 15.349 1.00 0.00 N ATOM 914 CZ ARG A 71 15.636 26.594 16.131 1.00 0.00 C ATOM 915 NH1 ARG A 71 16.696 27.169 16.667 1.00 0.00 N ATOM 916 NH2 ARG A 71 14.455 27.114 16.381 1.00 0.00 N ATOM 0 H ARG A 71 15.284 26.085 10.605 1.00 0.00 H new ATOM 0 HA ARG A 71 17.771 27.416 11.393 1.00 0.00 H new ATOM 0 HB2 ARG A 71 15.876 26.687 12.939 1.00 0.00 H new ATOM 0 HB3 ARG A 71 16.090 25.039 12.384 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.493 25.185 13.333 1.00 0.00 H new ATOM 0 HG3 ARG A 71 17.987 26.672 14.111 1.00 0.00 H new ATOM 0 HD2 ARG A 71 16.759 23.900 14.495 1.00 0.00 H new ATOM 0 HD3 ARG A 71 17.683 24.805 15.677 1.00 0.00 H new ATOM 0 HE ARG A 71 14.859 25.089 15.061 1.00 0.00 H new ATOM 0 HH11 ARG A 71 17.627 26.794 16.485 1.00 0.00 H new ATOM 0 HH12 ARG A 71 16.585 27.989 17.264 1.00 0.00 H new ATOM 0 HH21 ARG A 71 13.618 26.697 15.975 1.00 0.00 H new ATOM 0 HH22 ARG A 71 14.376 27.935 16.982 1.00 0.00 H new ATOM 930 N GLN A 72 17.658 24.449 9.987 1.00 0.00 N ATOM 931 CA GLN A 72 18.331 23.271 9.468 1.00 0.00 C ATOM 932 C GLN A 72 17.556 22.718 8.261 1.00 0.00 C ATOM 933 O GLN A 72 16.504 23.219 7.855 1.00 0.00 O ATOM 934 CB GLN A 72 18.422 22.180 10.578 1.00 0.00 C ATOM 935 CG GLN A 72 19.779 21.449 10.628 1.00 0.00 C ATOM 936 CD GLN A 72 20.780 21.999 11.653 1.00 0.00 C ATOM 937 OE1 GLN A 72 21.433 21.247 12.355 1.00 0.00 O ATOM 938 NE2 GLN A 72 20.959 23.299 11.790 1.00 0.00 N ATOM 0 H GLN A 72 16.666 24.444 9.750 1.00 0.00 H new ATOM 0 HA GLN A 72 19.338 23.546 9.153 1.00 0.00 H new ATOM 0 HB2 GLN A 72 18.235 22.645 11.546 1.00 0.00 H new ATOM 0 HB3 GLN A 72 17.631 21.447 10.418 1.00 0.00 H new ATOM 0 HG2 GLN A 72 19.599 20.397 10.848 1.00 0.00 H new ATOM 0 HG3 GLN A 72 20.235 21.494 9.639 1.00 0.00 H new ATOM 0 HE21 GLN A 72 20.425 23.951 11.215 1.00 0.00 H new ATOM 0 HE22 GLN A 72 21.631 23.652 12.471 1.00 0.00 H new ATOM 947 N VAL A 73 18.090 21.636 7.705 1.00 0.00 N ATOM 948 CA VAL A 73 17.386 20.792 6.742 1.00 0.00 C ATOM 949 C VAL A 73 16.549 19.751 7.492 1.00 0.00 C ATOM 950 O VAL A 73 16.810 19.442 8.656 1.00 0.00 O ATOM 951 CB VAL A 73 18.344 20.103 5.746 1.00 0.00 C ATOM 952 CG1 VAL A 73 18.962 21.115 4.774 1.00 0.00 C ATOM 953 CG2 VAL A 73 19.462 19.308 6.446 1.00 0.00 C ATOM 0 H VAL A 73 19.036 21.315 7.912 1.00 0.00 H new ATOM 0 HA VAL A 73 16.734 21.435 6.151 1.00 0.00 H new ATOM 0 HB VAL A 73 17.733 19.394 5.187 1.00 0.00 H new ATOM 0 HG11 VAL A 73 19.631 20.597 4.087 1.00 0.00 H new ATOM 0 HG12 VAL A 73 18.170 21.607 4.209 1.00 0.00 H new ATOM 0 HG13 VAL A 73 19.525 21.861 5.335 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.104 18.846 5.696 1.00 0.00 H new ATOM 0 HG22 VAL A 73 20.054 19.981 7.065 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.020 18.533 7.072 1.00 0.00 H new ATOM 963 N ARG A 74 15.578 19.179 6.786 1.00 0.00 N ATOM 964 CA ARG A 74 14.636 18.190 7.275 1.00 0.00 C ATOM 965 C ARG A 74 14.444 17.114 6.224 1.00 0.00 C ATOM 966 O ARG A 74 14.646 17.332 5.030 1.00 0.00 O ATOM 967 CB ARG A 74 13.291 18.848 7.602 1.00 0.00 C ATOM 968 CG ARG A 74 12.419 19.256 6.408 1.00 0.00 C ATOM 969 CD ARG A 74 11.130 19.834 6.971 1.00 0.00 C ATOM 970 NE ARG A 74 10.475 20.761 6.056 1.00 0.00 N ATOM 971 CZ ARG A 74 9.709 21.769 6.438 1.00 0.00 C ATOM 972 NH1 ARG A 74 9.103 21.769 7.610 1.00 0.00 N ATOM 973 NH2 ARG A 74 9.600 22.814 5.650 1.00 0.00 N ATOM 0 H ARG A 74 15.423 19.409 5.804 1.00 0.00 H new ATOM 0 HA ARG A 74 15.032 17.742 8.186 1.00 0.00 H new ATOM 0 HB2 ARG A 74 12.717 18.161 8.224 1.00 0.00 H new ATOM 0 HB3 ARG A 74 13.483 19.737 8.203 1.00 0.00 H new ATOM 0 HG2 ARG A 74 12.933 19.992 5.790 1.00 0.00 H new ATOM 0 HG3 ARG A 74 12.210 18.396 5.772 1.00 0.00 H new ATOM 0 HD2 ARG A 74 10.445 19.019 7.206 1.00 0.00 H new ATOM 0 HD3 ARG A 74 11.347 20.348 7.907 1.00 0.00 H new ATOM 0 HE ARG A 74 10.617 20.623 5.055 1.00 0.00 H new ATOM 0 HH11 ARG A 74 9.220 20.979 8.245 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.517 22.559 7.881 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.101 22.838 4.762 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.014 23.602 5.926 1.00 0.00 H new ATOM 987 N TYR A 75 14.033 15.946 6.687 1.00 0.00 N ATOM 988 CA TYR A 75 13.484 14.920 5.810 1.00 0.00 C ATOM 989 C TYR A 75 11.973 15.154 5.765 1.00 0.00 C ATOM 990 O TYR A 75 11.384 15.597 6.751 1.00 0.00 O ATOM 991 CB TYR A 75 13.815 13.520 6.341 1.00 0.00 C ATOM 992 CG TYR A 75 15.139 12.971 5.850 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.338 13.667 6.091 1.00 0.00 C ATOM 994 CD2 TYR A 75 15.169 11.752 5.146 1.00 0.00 C ATOM 995 CE1 TYR A 75 17.569 13.130 5.676 1.00 0.00 C ATOM 996 CE2 TYR A 75 16.395 11.212 4.722 1.00 0.00 C ATOM 997 CZ TYR A 75 17.602 11.889 5.005 1.00 0.00 C ATOM 998 OH TYR A 75 18.789 11.344 4.625 1.00 0.00 O ATOM 0 H TYR A 75 14.069 15.681 7.671 1.00 0.00 H new ATOM 0 HA TYR A 75 13.914 14.981 4.810 1.00 0.00 H new ATOM 0 HB2 TYR A 75 13.827 13.550 7.431 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.019 12.835 6.050 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.312 14.620 6.598 1.00 0.00 H new ATOM 0 HD2 TYR A 75 14.248 11.231 4.931 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.487 13.665 5.870 1.00 0.00 H new ATOM 0 HE2 TYR A 75 16.414 10.278 4.179 1.00 0.00 H new ATOM 0 HH TYR A 75 18.627 10.488 4.177 1.00 0.00 H new ATOM 1008 N ALA A 76 11.344 14.837 4.649 1.00 0.00 N ATOM 1009 CA ALA A 76 9.902 14.859 4.505 1.00 0.00 C ATOM 1010 C ALA A 76 9.483 13.784 3.514 1.00 0.00 C ATOM 1011 O ALA A 76 10.323 13.270 2.783 1.00 0.00 O ATOM 1012 CB ALA A 76 9.479 16.262 4.070 1.00 0.00 C ATOM 0 H ALA A 76 11.832 14.551 3.800 1.00 0.00 H new ATOM 0 HA ALA A 76 9.403 14.638 5.448 1.00 0.00 H new ATOM 0 HB1 ALA A 76 8.395 16.297 3.957 1.00 0.00 H new ATOM 0 HB2 ALA A 76 9.788 16.986 4.824 1.00 0.00 H new ATOM 0 HB3 ALA A 76 9.951 16.506 3.118 1.00 0.00 H new ATOM 1018 N LEU A 77 8.201 13.441 3.481 1.00 0.00 N ATOM 1019 CA LEU A 77 7.644 12.591 2.443 1.00 0.00 C ATOM 1020 C LEU A 77 7.843 13.194 1.040 1.00 0.00 C ATOM 1021 O LEU A 77 7.965 14.409 0.914 1.00 0.00 O ATOM 1022 CB LEU A 77 6.163 12.414 2.782 1.00 0.00 C ATOM 1023 CG LEU A 77 5.687 10.993 2.533 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.228 10.022 3.574 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.180 11.054 2.673 1.00 0.00 C ATOM 0 H LEU A 77 7.519 13.746 4.176 1.00 0.00 H new ATOM 0 HA LEU A 77 8.154 11.628 2.415 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.997 12.674 3.828 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.569 13.105 2.184 1.00 0.00 H new ATOM 0 HG LEU A 77 6.025 10.642 1.558 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.863 9.018 3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.318 10.027 3.544 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.891 10.326 4.565 1.00 0.00 H new ATOM 0 HD21 LEU A 77 3.759 10.063 2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 77 3.921 11.395 3.675 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.774 11.749 1.938 1.00 0.00 H new ATOM 1037 N ALA A 78 7.824 12.349 0.000 1.00 0.00 N ATOM 1038 CA ALA A 78 8.100 12.731 -1.394 1.00 0.00 C ATOM 1039 C ALA A 78 7.278 13.912 -1.940 1.00 0.00 C ATOM 1040 O ALA A 78 7.724 14.615 -2.839 1.00 0.00 O ATOM 1041 CB ALA A 78 7.826 11.501 -2.264 1.00 0.00 C ATOM 0 H ALA A 78 7.611 11.357 0.106 1.00 0.00 H new ATOM 0 HA ALA A 78 9.135 13.071 -1.422 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.020 11.744 -3.309 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.478 10.684 -1.955 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.785 11.198 -2.149 1.00 0.00 H new ATOM 1047 N ASP A 79 6.058 14.050 -1.415 1.00 0.00 N ATOM 1048 CA ASP A 79 5.023 15.050 -1.689 1.00 0.00 C ATOM 1049 C ASP A 79 3.744 14.692 -0.906 1.00 0.00 C ATOM 1050 O ASP A 79 3.553 13.565 -0.440 1.00 0.00 O ATOM 1051 CB ASP A 79 4.749 15.201 -3.201 1.00 0.00 C ATOM 1052 CG ASP A 79 3.647 16.203 -3.565 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.537 17.273 -2.907 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.855 15.849 -4.467 1.00 0.00 O ATOM 0 H ASP A 79 5.736 13.389 -0.708 1.00 0.00 H new ATOM 0 HA ASP A 79 5.381 16.022 -1.351 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.673 15.506 -3.693 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.479 14.225 -3.605 1.00 0.00 H new ATOM 1059 N SER A 80 2.810 15.642 -0.848 1.00 0.00 N ATOM 1060 CA SER A 80 1.437 15.479 -0.366 1.00 0.00 C ATOM 1061 C SER A 80 0.703 14.303 -1.021 1.00 0.00 C ATOM 1062 O SER A 80 -0.225 13.764 -0.422 1.00 0.00 O ATOM 1063 CB SER A 80 0.640 16.759 -0.654 1.00 0.00 C ATOM 1064 OG SER A 80 1.285 17.899 -0.115 1.00 0.00 O ATOM 0 H SER A 80 3.001 16.597 -1.152 1.00 0.00 H new ATOM 0 HA SER A 80 1.505 15.277 0.703 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.521 16.881 -1.731 1.00 0.00 H new ATOM 0 HB3 SER A 80 -0.360 16.670 -0.230 1.00 0.00 H new ATOM 0 HG SER A 80 0.756 18.699 -0.315 1.00 0.00 H new ATOM 1070 N HIS A 81 1.141 13.875 -2.215 1.00 0.00 N ATOM 1071 CA HIS A 81 0.679 12.658 -2.873 1.00 0.00 C ATOM 1072 C HIS A 81 0.878 11.420 -1.985 1.00 0.00 C ATOM 1073 O HIS A 81 -0.109 10.773 -1.653 1.00 0.00 O ATOM 1074 CB HIS A 81 1.349 12.539 -4.264 1.00 0.00 C ATOM 1075 CG HIS A 81 0.419 12.726 -5.441 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.901 13.135 -5.400 1.00 0.00 N ATOM 1077 CD2 HIS A 81 0.631 12.169 -6.668 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -1.501 12.720 -6.529 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -0.577 12.180 -7.344 1.00 0.00 N ATOM 0 H HIS A 81 1.842 14.381 -2.756 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.398 12.717 -3.033 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.147 13.278 -4.330 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.816 11.557 -4.342 1.00 0.00 H new ATOM 0 HD2 HIS A 81 1.570 11.789 -7.043 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -2.555 12.806 -6.747 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -0.738 11.839 -8.292 1.00 0.00 H new ATOM 1088 N LEU A 82 2.103 11.090 -1.543 1.00 0.00 N ATOM 1089 CA LEU A 82 2.272 9.951 -0.620 1.00 0.00 C ATOM 1090 C LEU A 82 1.597 10.233 0.720 1.00 0.00 C ATOM 1091 O LEU A 82 1.036 9.309 1.292 1.00 0.00 O ATOM 1092 CB LEU A 82 3.739 9.536 -0.397 1.00 0.00 C ATOM 1093 CG LEU A 82 4.588 9.274 -1.646 1.00 0.00 C ATOM 1094 CD1 LEU A 82 5.919 8.643 -1.227 1.00 0.00 C ATOM 1095 CD2 LEU A 82 3.900 8.387 -2.695 1.00 0.00 C ATOM 0 H LEU A 82 2.964 11.575 -1.797 1.00 0.00 H new ATOM 0 HA LEU A 82 1.786 9.106 -1.108 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.227 10.317 0.186 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.746 8.632 0.213 1.00 0.00 H new ATOM 0 HG LEU A 82 4.745 10.240 -2.125 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.527 8.455 -2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.450 9.322 -0.560 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.729 7.702 -0.710 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.565 8.249 -3.547 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.668 7.417 -2.255 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.978 8.865 -3.027 1.00 0.00 H new ATOM 1107 N ALA A 83 1.562 11.493 1.174 1.00 0.00 N ATOM 1108 CA ALA A 83 0.995 11.868 2.477 1.00 0.00 C ATOM 1109 C ALA A 83 -0.497 11.507 2.555 1.00 0.00 C ATOM 1110 O ALA A 83 -0.973 11.193 3.639 1.00 0.00 O ATOM 1111 CB ALA A 83 1.221 13.367 2.709 1.00 0.00 C ATOM 0 H ALA A 83 1.928 12.285 0.645 1.00 0.00 H new ATOM 0 HA ALA A 83 1.498 11.307 3.265 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.803 13.653 3.674 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.290 13.580 2.699 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.731 13.935 1.919 1.00 0.00 H new ATOM 1117 N ARG A 84 -1.213 11.498 1.419 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.589 11.002 1.302 1.00 0.00 C ATOM 1119 C ARG A 84 -2.677 9.478 1.434 1.00 0.00 C ATOM 1120 O ARG A 84 -3.416 9.019 2.292 1.00 0.00 O ATOM 1121 CB ARG A 84 -3.205 11.462 -0.035 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.655 12.930 -0.016 1.00 0.00 C ATOM 1123 CD ARG A 84 -5.058 13.113 0.580 1.00 0.00 C ATOM 1124 NE ARG A 84 -6.094 12.654 -0.358 1.00 0.00 N ATOM 1125 CZ ARG A 84 -7.319 13.125 -0.528 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -7.828 14.090 0.213 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -8.053 12.608 -1.482 1.00 0.00 N ATOM 0 H ARG A 84 -0.839 11.845 0.536 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.157 11.425 2.130 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.475 11.322 -0.832 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -4.060 10.829 -0.271 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.940 13.517 0.561 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.643 13.322 -1.033 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.136 12.556 1.514 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.220 14.164 0.821 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.834 11.870 -0.956 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.271 14.509 0.958 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.779 14.418 0.041 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.676 11.864 -2.069 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -9.001 12.950 -1.638 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.935 8.683 0.656 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.006 7.209 0.732 1.00 0.00 C ATOM 1143 C ALA A 85 -1.551 6.663 2.104 1.00 0.00 C ATOM 1144 O ALA A 85 -2.160 5.760 2.672 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.170 6.628 -0.415 1.00 0.00 C ATOM 0 H ALA A 85 -1.274 9.032 -0.038 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.046 6.898 0.628 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.208 5.539 -0.378 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.571 6.973 -1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.136 6.958 -0.315 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.497 7.259 2.657 1.00 0.00 N ATOM 1152 CA LEU A 86 0.000 7.076 4.019 1.00 0.00 C ATOM 1153 C LEU A 86 -1.008 7.531 5.101 1.00 0.00 C ATOM 1154 O LEU A 86 -1.151 6.851 6.115 1.00 0.00 O ATOM 1155 CB LEU A 86 1.292 7.908 4.044 1.00 0.00 C ATOM 1156 CG LEU A 86 2.090 7.903 5.344 1.00 0.00 C ATOM 1157 CD1 LEU A 86 2.723 6.571 5.695 1.00 0.00 C ATOM 1158 CD2 LEU A 86 3.240 8.893 5.200 1.00 0.00 C ATOM 0 H LEU A 86 0.069 7.926 2.132 1.00 0.00 H new ATOM 0 HA LEU A 86 0.165 6.025 4.256 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.942 7.550 3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.035 8.941 3.807 1.00 0.00 H new ATOM 0 HG LEU A 86 1.377 8.151 6.130 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.269 6.664 6.634 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.945 5.815 5.801 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.411 6.275 4.903 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.826 8.907 6.119 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.877 8.592 4.368 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.841 9.889 5.009 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.693 8.662 4.869 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.528 9.413 5.827 1.00 0.00 C ATOM 1172 C GLY A 87 -3.981 8.939 5.918 1.00 0.00 C ATOM 1173 O GLY A 87 -4.494 8.778 7.020 1.00 0.00 O ATOM 0 H GLY A 87 -1.679 9.106 3.951 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.075 9.343 6.816 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.521 10.466 5.547 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.636 8.693 4.780 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.909 7.944 4.702 1.00 0.00 C ATOM 1179 C GLU A 88 -5.667 6.506 5.211 1.00 0.00 C ATOM 1180 O GLU A 88 -6.582 5.831 5.704 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.350 7.923 3.223 1.00 0.00 C ATOM 1182 CG GLU A 88 -7.554 7.042 2.842 1.00 0.00 C ATOM 1183 CD GLU A 88 -8.926 7.543 3.294 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -9.100 8.740 3.604 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -9.888 6.750 3.207 1.00 0.00 O ATOM 0 H GLU A 88 -4.299 9.009 3.871 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.684 8.408 5.312 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.578 8.947 2.928 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.498 7.601 2.625 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.569 6.933 1.758 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.397 6.048 3.260 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.399 6.078 5.087 1.00 0.00 N ATOM 1193 CA LEU A 89 -3.780 4.841 5.531 1.00 0.00 C ATOM 1194 C LEU A 89 -4.242 3.691 4.635 1.00 0.00 C ATOM 1195 O LEU A 89 -5.212 3.776 3.889 1.00 0.00 O ATOM 1196 CB LEU A 89 -4.045 4.645 7.051 1.00 0.00 C ATOM 1197 CG LEU A 89 -3.263 3.538 7.790 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -1.741 3.661 7.618 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -3.619 3.552 9.283 1.00 0.00 C ATOM 0 H LEU A 89 -3.713 6.668 4.617 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.695 4.873 5.427 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.835 5.591 7.550 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.109 4.445 7.181 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.559 2.590 7.341 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.247 2.855 8.160 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.488 3.595 6.560 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.407 4.621 8.012 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.063 2.768 9.797 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.359 4.521 9.710 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.688 3.377 9.404 1.00 0.00 H new ATOM 1211 N VAL A 90 -3.615 2.535 4.784 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.093 1.274 4.194 1.00 0.00 C ATOM 1213 C VAL A 90 -5.510 0.885 4.641 1.00 0.00 C ATOM 1214 O VAL A 90 -6.043 -0.135 4.204 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.168 0.109 4.548 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -1.842 0.254 3.778 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -2.905 0.040 6.065 1.00 0.00 C ATOM 0 H VAL A 90 -2.753 2.434 5.320 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.101 1.458 3.120 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.657 -0.821 4.258 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.182 -0.576 4.030 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.041 0.247 2.706 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.363 1.194 4.052 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.244 -0.799 6.282 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.435 0.967 6.395 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.849 -0.096 6.592 1.00 0.00 H new ATOM 1227 N GLN A 91 -6.108 1.637 5.574 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.510 1.638 5.924 1.00 0.00 C ATOM 1229 C GLN A 91 -7.883 0.429 6.780 1.00 0.00 C ATOM 1230 O GLN A 91 -8.775 0.571 7.600 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.373 1.803 4.660 1.00 0.00 C ATOM 1232 CG GLN A 91 -8.682 3.264 4.270 1.00 0.00 C ATOM 1233 CD GLN A 91 -9.673 3.984 5.174 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -10.878 3.796 5.082 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.209 4.782 6.111 1.00 0.00 N ATOM 0 H GLN A 91 -5.577 2.302 6.136 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.718 2.500 6.557 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -7.865 1.319 3.826 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -9.315 1.275 4.809 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.748 3.826 4.263 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.070 3.276 3.251 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.205 4.943 6.193 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -9.853 5.240 6.756 1.00 0.00 H new ATOM 1244 N VAL A 92 -7.159 -0.692 6.721 1.00 0.00 N ATOM 1245 CA VAL A 92 -7.257 -1.901 7.571 1.00 0.00 C ATOM 1246 C VAL A 92 -6.950 -1.669 9.068 1.00 0.00 C ATOM 1247 O VAL A 92 -6.469 -2.540 9.781 1.00 0.00 O ATOM 1248 CB VAL A 92 -6.409 -3.026 6.918 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -4.916 -2.921 7.252 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -6.974 -4.419 7.186 1.00 0.00 C ATOM 0 H VAL A 92 -6.424 -0.795 6.021 1.00 0.00 H new ATOM 0 HA VAL A 92 -8.301 -2.212 7.604 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.485 -2.868 5.842 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.377 -3.735 6.767 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.530 -1.966 6.895 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.779 -2.988 8.331 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.342 -5.166 6.706 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -6.999 -4.601 8.260 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -7.984 -4.486 6.783 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.227 -0.451 9.534 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.280 0.046 10.913 1.00 0.00 C ATOM 1262 C VAL A 93 -5.885 0.345 11.498 1.00 0.00 C ATOM 1263 O VAL A 93 -5.757 1.184 12.385 1.00 0.00 O ATOM 1264 CB VAL A 93 -8.151 -0.870 11.816 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -8.616 -0.092 13.049 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -9.443 -1.353 11.102 1.00 0.00 C ATOM 0 H VAL A 93 -7.445 0.300 8.879 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.781 1.014 10.886 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.526 -1.726 12.072 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -9.226 -0.739 13.679 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.748 0.249 13.613 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -9.206 0.769 12.735 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -10.015 -1.990 11.777 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -10.046 -0.490 10.818 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -9.176 -1.918 10.209 1.00 0.00 H new ATOM 1276 N LEU A 94 -4.867 -0.295 10.901 1.00 0.00 N ATOM 1277 CA LEU A 94 -3.419 -0.352 11.173 1.00 0.00 C ATOM 1278 C LEU A 94 -2.997 -1.828 11.144 1.00 0.00 C ATOM 1279 O LEU A 94 -3.194 -2.547 12.117 1.00 0.00 O ATOM 1280 CB LEU A 94 -2.988 0.345 12.486 1.00 0.00 C ATOM 1281 CG LEU A 94 -1.493 0.196 12.849 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -0.563 0.746 11.754 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -1.215 0.929 14.169 1.00 0.00 C ATOM 0 H LEU A 94 -5.075 -0.875 10.089 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.904 0.216 10.398 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.223 1.407 12.409 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.586 -0.055 13.305 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.285 -0.869 12.948 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.475 0.617 12.060 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.737 0.206 10.823 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.767 1.806 11.602 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.161 0.826 14.428 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.459 1.985 14.057 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.827 0.497 14.961 1.00 0.00 H new ATOM 1295 N ALA A 95 -2.419 -2.282 10.028 1.00 0.00 N ATOM 1296 CA ALA A 95 -1.877 -3.638 9.930 1.00 0.00 C ATOM 1297 C ALA A 95 -0.664 -3.855 10.861 1.00 0.00 C ATOM 1298 O ALA A 95 0.196 -2.976 10.957 1.00 0.00 O ATOM 1299 CB ALA A 95 -1.551 -3.957 8.468 1.00 0.00 C ATOM 0 H ALA A 95 -2.315 -1.728 9.178 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.638 -4.338 10.275 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -1.148 -4.967 8.397 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.459 -3.886 7.869 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.814 -3.245 8.096 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.595 -5.024 11.512 1.00 0.00 N ATOM 1306 CA VAL A 96 0.357 -5.323 12.615 1.00 0.00 C ATOM 1307 C VAL A 96 1.819 -5.504 12.143 1.00 0.00 C ATOM 1308 O VAL A 96 2.058 -6.082 11.088 1.00 0.00 O ATOM 1309 CB VAL A 96 -0.102 -6.575 13.410 1.00 0.00 C ATOM 1310 CG1 VAL A 96 0.770 -6.844 14.647 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.540 -6.448 13.933 1.00 0.00 C ATOM 0 H VAL A 96 -1.206 -5.810 11.290 1.00 0.00 H new ATOM 0 HA VAL A 96 0.346 -4.447 13.263 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.018 -7.388 12.689 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.404 -7.731 15.165 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.802 -7.006 14.336 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.723 -5.987 15.318 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.809 -7.351 14.481 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.611 -5.586 14.596 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.222 -6.317 13.093 1.00 0.00 H new ATOM 1321 N ASP A 97 2.804 -5.100 12.959 1.00 0.00 N ATOM 1322 CA ASP A 97 4.254 -5.316 12.749 1.00 0.00 C ATOM 1323 C ASP A 97 4.715 -6.763 13.084 1.00 0.00 C ATOM 1324 O ASP A 97 5.657 -6.970 13.852 1.00 0.00 O ATOM 1325 CB ASP A 97 5.058 -4.246 13.524 1.00 0.00 C ATOM 1326 CG ASP A 97 4.890 -2.820 12.986 1.00 0.00 C ATOM 1327 OD1 ASP A 97 5.070 -2.594 11.768 1.00 0.00 O ATOM 1328 OD2 ASP A 97 4.574 -1.899 13.775 1.00 0.00 O ATOM 0 H ASP A 97 2.610 -4.592 13.822 1.00 0.00 H new ATOM 0 HA ASP A 97 4.456 -5.201 11.684 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.753 -4.266 14.570 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.115 -4.511 13.495 1.00 0.00 H new ATOM 1333 N THR A 98 4.032 -7.773 12.523 1.00 0.00 N ATOM 1334 CA THR A 98 4.256 -9.217 12.777 1.00 0.00 C ATOM 1335 C THR A 98 4.580 -10.009 11.520 1.00 0.00 C ATOM 1336 O THR A 98 4.113 -9.687 10.431 1.00 0.00 O ATOM 1337 CB THR A 98 3.052 -9.879 13.462 1.00 0.00 C ATOM 1338 OG1 THR A 98 1.853 -9.459 12.867 1.00 0.00 O ATOM 1339 CG2 THR A 98 3.033 -9.544 14.952 1.00 0.00 C ATOM 0 H THR A 98 3.280 -7.607 11.855 1.00 0.00 H new ATOM 0 HA THR A 98 5.122 -9.243 13.439 1.00 0.00 H new ATOM 0 HB THR A 98 3.146 -10.958 13.342 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.096 -9.892 13.315 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.173 -10.022 15.421 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.949 -9.907 15.418 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.964 -8.464 15.081 1.00 0.00 H new ATOM 1347 N ASP A 99 5.338 -11.089 11.700 1.00 0.00 N ATOM 1348 CA ASP A 99 5.503 -12.127 10.686 1.00 0.00 C ATOM 1349 C ASP A 99 4.372 -13.135 10.905 1.00 0.00 C ATOM 1350 O ASP A 99 4.303 -13.779 11.952 1.00 0.00 O ATOM 1351 CB ASP A 99 6.874 -12.814 10.792 1.00 0.00 C ATOM 1352 CG ASP A 99 6.964 -14.031 9.856 1.00 0.00 C ATOM 1353 OD1 ASP A 99 6.715 -13.846 8.642 1.00 0.00 O ATOM 1354 OD2 ASP A 99 7.265 -15.137 10.362 1.00 0.00 O ATOM 0 H ASP A 99 5.858 -11.269 12.559 1.00 0.00 H new ATOM 0 HA ASP A 99 5.459 -11.692 9.687 1.00 0.00 H new ATOM 0 HB2 ASP A 99 7.660 -12.102 10.542 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.046 -13.130 11.821 1.00 0.00 H new ATOM 1359 N GLN A 100 3.469 -13.253 9.934 1.00 0.00 N ATOM 1360 CA GLN A 100 2.443 -14.285 9.894 1.00 0.00 C ATOM 1361 C GLN A 100 2.269 -14.788 8.453 1.00 0.00 C ATOM 1362 O GLN A 100 2.326 -13.981 7.519 1.00 0.00 O ATOM 1363 CB GLN A 100 1.108 -13.796 10.500 1.00 0.00 C ATOM 1364 CG GLN A 100 1.126 -13.559 12.020 1.00 0.00 C ATOM 1365 CD GLN A 100 1.687 -14.733 12.828 1.00 0.00 C ATOM 1366 OE1 GLN A 100 1.744 -15.888 12.413 1.00 0.00 O ATOM 1367 NE2 GLN A 100 2.185 -14.480 14.016 1.00 0.00 N ATOM 0 H GLN A 100 3.432 -12.618 9.137 1.00 0.00 H new ATOM 0 HA GLN A 100 2.769 -15.120 10.514 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.823 -12.867 10.007 1.00 0.00 H new ATOM 0 HB3 GLN A 100 0.334 -14.529 10.272 1.00 0.00 H new ATOM 0 HG2 GLN A 100 1.719 -12.670 12.231 1.00 0.00 H new ATOM 0 HG3 GLN A 100 0.110 -13.352 12.357 1.00 0.00 H new ATOM 0 HE21 GLN A 100 2.154 -13.532 14.391 1.00 0.00 H new ATOM 0 HE22 GLN A 100 2.603 -15.232 14.564 1.00 0.00 H new ATOM 1376 N PRO A 101 2.082 -16.111 8.265 1.00 0.00 N ATOM 1377 CA PRO A 101 2.148 -16.760 6.963 1.00 0.00 C ATOM 1378 C PRO A 101 0.952 -16.456 6.062 1.00 0.00 C ATOM 1379 O PRO A 101 -0.198 -16.396 6.496 1.00 0.00 O ATOM 1380 CB PRO A 101 2.253 -18.261 7.253 1.00 0.00 C ATOM 1381 CG PRO A 101 1.552 -18.408 8.603 1.00 0.00 C ATOM 1382 CD PRO A 101 1.938 -17.116 9.310 1.00 0.00 C ATOM 0 HA PRO A 101 3.005 -16.382 6.406 1.00 0.00 H new ATOM 0 HB2 PRO A 101 1.766 -18.855 6.480 1.00 0.00 H new ATOM 0 HB3 PRO A 101 3.291 -18.590 7.301 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.472 -18.504 8.492 1.00 0.00 H new ATOM 0 HG3 PRO A 101 1.896 -19.288 9.147 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.174 -16.823 10.030 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.869 -17.238 9.864 1.00 0.00 H new ATOM 1390 N CYS A 102 1.238 -16.373 4.762 1.00 0.00 N ATOM 1391 CA CYS A 102 0.264 -16.278 3.693 1.00 0.00 C ATOM 1392 C CYS A 102 -0.500 -17.617 3.505 1.00 0.00 C ATOM 1393 O CYS A 102 -0.317 -18.326 2.514 1.00 0.00 O ATOM 1394 CB CYS A 102 1.042 -15.784 2.464 1.00 0.00 C ATOM 1395 SG CYS A 102 -0.045 -15.221 1.111 1.00 0.00 S ATOM 0 H CYS A 102 2.199 -16.371 4.419 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.537 -15.571 3.907 1.00 0.00 H new ATOM 0 HB2 CYS A 102 1.697 -14.965 2.761 1.00 0.00 H new ATOM 0 HB3 CYS A 102 1.681 -16.588 2.099 1.00 0.00 H new ATOM 0 HG CYS A 102 -1.158 -14.769 1.608 1.00 0.00 H new ATOM 1476 N LEU B 11 1.293 -6.157 8.363 1.00 0.00 N ATOM 1477 CA LEU B 11 1.602 -5.243 7.249 1.00 0.00 C ATOM 1478 C LEU B 11 2.515 -5.864 6.183 1.00 0.00 C ATOM 1479 O LEU B 11 2.206 -5.744 5.001 1.00 0.00 O ATOM 1480 CB LEU B 11 2.046 -3.843 7.727 1.00 0.00 C ATOM 1481 CG LEU B 11 3.545 -3.606 7.989 1.00 0.00 C ATOM 1482 CD1 LEU B 11 3.810 -2.107 8.173 1.00 0.00 C ATOM 1483 CD2 LEU B 11 4.046 -4.365 9.216 1.00 0.00 C ATOM 0 HA LEU B 11 0.659 -5.077 6.729 1.00 0.00 H new ATOM 0 HB2 LEU B 11 1.719 -3.118 6.982 1.00 0.00 H new ATOM 0 HB3 LEU B 11 1.507 -3.619 8.648 1.00 0.00 H new ATOM 0 HG LEU B 11 4.089 -3.982 7.122 1.00 0.00 H new ATOM 0 HD11 LEU B 11 4.872 -1.945 8.358 1.00 0.00 H new ATOM 0 HD12 LEU B 11 3.513 -1.572 7.271 1.00 0.00 H new ATOM 0 HD13 LEU B 11 3.234 -1.737 9.021 1.00 0.00 H new ATOM 0 HD21 LEU B 11 5.108 -4.165 9.359 1.00 0.00 H new ATOM 0 HD22 LEU B 11 3.494 -4.038 10.097 1.00 0.00 H new ATOM 0 HD23 LEU B 11 3.894 -5.434 9.069 1.00 0.00 H new ATOM 1495 N ALA B 12 3.550 -6.622 6.559 1.00 0.00 N ATOM 1496 CA ALA B 12 4.446 -7.265 5.592 1.00 0.00 C ATOM 1497 C ALA B 12 3.751 -8.342 4.742 1.00 0.00 C ATOM 1498 O ALA B 12 4.180 -8.604 3.617 1.00 0.00 O ATOM 1499 CB ALA B 12 5.662 -7.817 6.351 1.00 0.00 C ATOM 0 H ALA B 12 3.789 -6.806 7.533 1.00 0.00 H new ATOM 0 HA ALA B 12 4.772 -6.517 4.869 1.00 0.00 H new ATOM 0 HB1 ALA B 12 6.341 -8.300 5.648 1.00 0.00 H new ATOM 0 HB2 ALA B 12 6.180 -6.999 6.853 1.00 0.00 H new ATOM 0 HB3 ALA B 12 5.329 -8.544 7.092 1.00 0.00 H new ATOM 1505 N ARG B 13 2.649 -8.904 5.250 1.00 0.00 N ATOM 1506 CA ARG B 13 1.719 -9.768 4.529 1.00 0.00 C ATOM 1507 C ARG B 13 0.716 -8.929 3.710 1.00 0.00 C ATOM 1508 O ARG B 13 0.666 -9.085 2.490 1.00 0.00 O ATOM 1509 CB ARG B 13 1.043 -10.686 5.568 1.00 0.00 C ATOM 1510 CG ARG B 13 -0.167 -11.475 5.054 1.00 0.00 C ATOM 1511 CD ARG B 13 0.178 -12.442 3.920 1.00 0.00 C ATOM 1512 NE ARG B 13 -0.923 -12.510 2.949 1.00 0.00 N ATOM 1513 CZ ARG B 13 -0.912 -12.138 1.673 1.00 0.00 C ATOM 1514 NH1 ARG B 13 0.117 -11.547 1.100 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -1.973 -12.361 0.935 1.00 0.00 N ATOM 0 H ARG B 13 2.372 -8.760 6.221 1.00 0.00 H new ATOM 0 HA ARG B 13 2.237 -10.389 3.798 1.00 0.00 H new ATOM 0 HB2 ARG B 13 1.784 -11.392 5.942 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.726 -10.078 6.415 1.00 0.00 H new ATOM 0 HG2 ARG B 13 -0.604 -12.036 5.880 1.00 0.00 H new ATOM 0 HG3 ARG B 13 -0.927 -10.775 4.707 1.00 0.00 H new ATOM 0 HD2 ARG B 13 1.091 -12.116 3.421 1.00 0.00 H new ATOM 0 HD3 ARG B 13 0.374 -13.434 4.327 1.00 0.00 H new ATOM 0 HE ARG B 13 -1.804 -12.889 3.297 1.00 0.00 H new ATOM 0 HH11 ARG B 13 0.960 -11.354 1.641 1.00 0.00 H new ATOM 0 HH12 ARG B 13 0.070 -11.283 0.116 1.00 0.00 H new ATOM 0 HH21 ARG B 13 -2.791 -12.814 1.342 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -1.980 -12.081 -0.046 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.056 -8.044 4.349 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.165 -7.244 3.806 1.00 0.00 C ATOM 1531 C LEU B 14 -0.704 -6.240 2.745 1.00 0.00 C ATOM 1532 O LEU B 14 -1.237 -6.243 1.639 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.876 -6.571 5.006 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.164 -5.755 4.752 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.898 -4.358 4.165 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.178 -6.510 3.884 1.00 0.00 C ATOM 0 H LEU B 14 0.088 -7.851 5.340 1.00 0.00 H new ATOM 0 HA LEU B 14 -1.866 -7.887 3.275 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.118 -7.353 5.726 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.156 -5.908 5.486 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.600 -5.613 5.741 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.845 -3.841 4.012 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -2.279 -3.785 4.856 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.381 -4.457 3.211 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.063 -5.891 3.737 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.730 -6.738 2.917 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -4.462 -7.438 4.380 1.00 0.00 H new ATOM 1548 N GLY B 15 0.318 -5.424 3.019 1.00 0.00 N ATOM 1549 CA GLY B 15 0.868 -4.470 2.054 1.00 0.00 C ATOM 1550 C GLY B 15 1.457 -5.180 0.839 1.00 0.00 C ATOM 1551 O GLY B 15 1.210 -4.790 -0.298 1.00 0.00 O ATOM 0 H GLY B 15 0.790 -5.407 3.923 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.084 -3.784 1.732 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.640 -3.869 2.535 1.00 0.00 H new ATOM 1555 N ARG B 16 2.124 -6.316 1.075 1.00 0.00 N ATOM 1556 CA ARG B 16 2.649 -7.182 0.019 1.00 0.00 C ATOM 1557 C ARG B 16 1.526 -7.809 -0.814 1.00 0.00 C ATOM 1558 O ARG B 16 1.693 -7.934 -2.021 1.00 0.00 O ATOM 1559 CB ARG B 16 3.565 -8.249 0.624 1.00 0.00 C ATOM 1560 CG ARG B 16 4.142 -9.194 -0.438 1.00 0.00 C ATOM 1561 CD ARG B 16 5.104 -10.190 0.206 1.00 0.00 C ATOM 1562 NE ARG B 16 5.446 -11.273 -0.735 1.00 0.00 N ATOM 1563 CZ ARG B 16 5.971 -12.449 -0.406 1.00 0.00 C ATOM 1564 NH1 ARG B 16 6.259 -12.755 0.845 1.00 0.00 N ATOM 1565 NH2 ARG B 16 6.207 -13.343 -1.341 1.00 0.00 N ATOM 0 H ARG B 16 2.315 -6.661 2.016 1.00 0.00 H new ATOM 0 HA ARG B 16 3.237 -6.569 -0.664 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.382 -7.763 1.157 1.00 0.00 H new ATOM 0 HB3 ARG B 16 3.007 -8.830 1.358 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.334 -9.729 -0.936 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.662 -8.618 -1.203 1.00 0.00 H new ATOM 0 HD2 ARG B 16 6.012 -9.675 0.519 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.651 -10.612 1.103 1.00 0.00 H new ATOM 0 HE ARG B 16 5.264 -11.105 -1.724 1.00 0.00 H new ATOM 0 HH11 ARG B 16 6.079 -12.081 1.589 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.661 -13.665 1.068 1.00 0.00 H new ATOM 0 HH21 ARG B 16 5.987 -13.133 -2.315 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.610 -14.247 -1.093 1.00 0.00 H new ATOM 1579 N ALA B 17 0.375 -8.138 -0.223 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.798 -8.610 -0.958 1.00 0.00 C ATOM 1581 C ALA B 17 -1.308 -7.584 -1.979 1.00 0.00 C ATOM 1582 O ALA B 17 -1.967 -7.984 -2.942 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.916 -8.970 0.025 1.00 0.00 C ATOM 0 H ALA B 17 0.231 -8.084 0.785 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.494 -9.494 -1.518 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.787 -9.321 -0.528 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.571 -9.757 0.696 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.186 -8.089 0.607 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.029 -6.288 -1.759 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.351 -5.208 -2.705 1.00 0.00 C ATOM 1591 C LEU B 18 -0.128 -4.734 -3.523 1.00 0.00 C ATOM 1592 O LEU B 18 -0.320 -4.011 -4.498 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.112 -4.071 -1.980 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.647 -4.303 -1.940 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.055 -5.441 -0.989 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.426 -3.033 -1.546 1.00 0.00 C ATOM 0 H LEU B 18 -0.569 -5.958 -0.910 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.026 -5.607 -3.462 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.736 -3.981 -0.961 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.905 -3.125 -2.481 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.909 -4.584 -2.960 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.139 -5.556 -1.003 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.587 -6.371 -1.312 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.729 -5.204 0.024 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.494 -3.251 -1.533 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.111 -2.705 -0.555 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.225 -2.244 -2.270 1.00 0.00 H new ATOM 1608 N ALA B 19 1.088 -5.183 -3.180 1.00 0.00 N ATOM 1609 CA ALA B 19 2.312 -5.056 -3.989 1.00 0.00 C ATOM 1610 C ALA B 19 2.475 -6.188 -5.032 1.00 0.00 C ATOM 1611 O ALA B 19 3.258 -6.058 -5.967 1.00 0.00 O ATOM 1612 CB ALA B 19 3.517 -5.075 -3.039 1.00 0.00 C ATOM 0 H ALA B 19 1.254 -5.664 -2.296 1.00 0.00 H new ATOM 0 HA ALA B 19 2.245 -4.121 -4.546 1.00 0.00 H new ATOM 0 HB1 ALA B 19 4.437 -4.982 -3.616 1.00 0.00 H new ATOM 0 HB2 ALA B 19 3.442 -4.242 -2.339 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.529 -6.014 -2.486 1.00 0.00 H new ATOM 1618 N ASP B 20 1.786 -7.318 -4.840 1.00 0.00 N ATOM 1619 CA ASP B 20 1.673 -8.451 -5.750 1.00 0.00 C ATOM 1620 C ASP B 20 1.191 -8.060 -7.169 1.00 0.00 C ATOM 1621 O ASP B 20 0.346 -7.174 -7.297 1.00 0.00 O ATOM 1622 CB ASP B 20 0.630 -9.411 -5.162 1.00 0.00 C ATOM 1623 CG ASP B 20 1.140 -10.551 -4.291 1.00 0.00 C ATOM 1624 OD1 ASP B 20 1.840 -11.434 -4.828 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.570 -10.743 -3.194 1.00 0.00 O ATOM 0 H ASP B 20 1.257 -7.470 -3.982 1.00 0.00 H new ATOM 0 HA ASP B 20 2.666 -8.890 -5.849 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.073 -8.824 -4.571 1.00 0.00 H new ATOM 0 HB3 ASP B 20 0.067 -9.844 -5.989 1.00 0.00 H new ATOM 1630 N PRO B 21 1.591 -8.821 -8.207 1.00 0.00 N ATOM 1631 CA PRO B 21 1.395 -8.546 -9.639 1.00 0.00 C ATOM 1632 C PRO B 21 -0.093 -8.604 -10.059 1.00 0.00 C ATOM 1633 O PRO B 21 -0.872 -7.681 -9.807 1.00 0.00 O ATOM 1634 CB PRO B 21 2.272 -9.616 -10.331 1.00 0.00 C ATOM 1635 CG PRO B 21 2.117 -10.806 -9.375 1.00 0.00 C ATOM 1636 CD PRO B 21 2.273 -10.099 -8.045 1.00 0.00 C ATOM 0 HA PRO B 21 1.684 -7.533 -9.920 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.919 -9.849 -11.336 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.310 -9.297 -10.424 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.149 -11.297 -9.475 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.879 -11.569 -9.533 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.831 -10.681 -7.236 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.325 -9.955 -7.797 1.00 0.00 H new ATOM 1644 N THR B 22 -0.509 -9.723 -10.671 1.00 0.00 N ATOM 1645 CA THR B 22 -1.894 -10.087 -10.970 1.00 0.00 C ATOM 1646 C THR B 22 -2.827 -9.899 -9.781 1.00 0.00 C ATOM 1647 O THR B 22 -3.999 -9.615 -10.007 1.00 0.00 O ATOM 1648 CB THR B 22 -1.991 -11.532 -11.502 1.00 0.00 C ATOM 1649 OG1 THR B 22 -0.766 -12.226 -11.379 1.00 0.00 O ATOM 1650 CG2 THR B 22 -2.368 -11.527 -12.984 1.00 0.00 C ATOM 0 H THR B 22 0.151 -10.434 -10.986 1.00 0.00 H new ATOM 0 HA THR B 22 -2.224 -9.400 -11.749 1.00 0.00 H new ATOM 0 HB THR B 22 -2.752 -12.032 -10.903 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.655 -12.533 -10.455 1.00 0.00 H new ATOM 0 HG21 THR B 22 -2.433 -12.553 -13.346 1.00 0.00 H new ATOM 0 HG22 THR B 22 -3.332 -11.035 -13.113 1.00 0.00 H new ATOM 0 HG23 THR B 22 -1.608 -10.989 -13.551 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.342 -9.999 -8.535 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.166 -9.786 -7.342 1.00 0.00 C ATOM 1660 C ARG B 23 -3.609 -8.324 -7.150 1.00 0.00 C ATOM 1661 O ARG B 23 -4.805 -8.088 -6.977 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.484 -10.328 -6.086 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.505 -11.033 -5.192 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.919 -11.299 -3.786 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.727 -12.738 -3.509 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.660 -13.481 -3.796 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -0.578 -12.980 -4.333 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -1.666 -14.768 -3.550 1.00 0.00 N ATOM 0 H ARG B 23 -1.370 -10.229 -8.329 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.080 -10.356 -7.510 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.692 -11.024 -6.365 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.013 -9.512 -5.538 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.403 -10.421 -5.106 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.805 -11.976 -5.649 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -1.962 -10.785 -3.693 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -3.584 -10.874 -3.034 1.00 0.00 H new ATOM 0 HE ARG B 23 -3.500 -13.216 -3.045 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -0.529 -11.984 -4.548 1.00 0.00 H new ATOM 0 HH12 ARG B 23 0.217 -13.585 -4.537 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -2.490 -15.204 -3.137 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -0.846 -15.333 -3.771 1.00 0.00 H new ATOM 1682 N CYS B 24 -2.708 -7.333 -7.253 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.096 -5.912 -7.235 1.00 0.00 C ATOM 1684 C CYS B 24 -4.043 -5.592 -8.402 1.00 0.00 C ATOM 1685 O CYS B 24 -5.090 -4.958 -8.231 1.00 0.00 O ATOM 1686 CB CYS B 24 -1.815 -5.070 -7.295 1.00 0.00 C ATOM 1687 SG CYS B 24 -2.207 -3.314 -7.066 1.00 0.00 S ATOM 0 H CYS B 24 -1.705 -7.490 -7.350 1.00 0.00 H new ATOM 0 HA CYS B 24 -3.640 -5.678 -6.320 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.119 -5.398 -6.523 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -1.319 -5.217 -8.254 1.00 0.00 H new ATOM 0 HG CYS B 24 -1.603 -2.869 -6.004 1.00 0.00 H new ATOM 1693 N ARG B 25 -3.731 -6.137 -9.583 1.00 0.00 N ATOM 1694 CA ARG B 25 -4.578 -6.038 -10.771 1.00 0.00 C ATOM 1695 C ARG B 25 -5.989 -6.600 -10.575 1.00 0.00 C ATOM 1696 O ARG B 25 -6.945 -5.933 -10.962 1.00 0.00 O ATOM 1697 CB ARG B 25 -3.880 -6.721 -11.944 1.00 0.00 C ATOM 1698 CG ARG B 25 -2.637 -5.956 -12.432 1.00 0.00 C ATOM 1699 CD ARG B 25 -2.925 -4.559 -13.013 1.00 0.00 C ATOM 1700 NE ARG B 25 -1.809 -3.641 -12.752 1.00 0.00 N ATOM 1701 CZ ARG B 25 -1.631 -2.815 -11.730 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -2.515 -2.659 -10.761 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -0.517 -2.129 -11.698 1.00 0.00 N ATOM 0 H ARG B 25 -2.872 -6.665 -9.740 1.00 0.00 H new ATOM 0 HA ARG B 25 -4.716 -4.977 -10.978 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.587 -7.729 -11.649 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -4.584 -6.823 -12.770 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -1.942 -5.851 -11.599 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -2.135 -6.554 -13.193 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -3.094 -4.636 -14.087 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -3.839 -4.160 -12.574 1.00 0.00 H new ATOM 0 HE ARG B 25 -1.069 -3.638 -13.454 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -3.387 -3.189 -10.776 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -2.326 -2.009 -9.998 1.00 0.00 H new ATOM 0 HH21 ARG B 25 0.173 -2.242 -12.441 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -0.339 -1.482 -10.930 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.136 -7.762 -9.924 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.464 -8.262 -9.483 1.00 0.00 C ATOM 1719 C ILE B 26 -8.215 -7.139 -8.790 1.00 0.00 C ATOM 1720 O ILE B 26 -9.312 -6.793 -9.206 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.451 -9.480 -8.502 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.694 -10.705 -9.052 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.907 -9.798 -8.095 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.277 -12.108 -8.842 1.00 0.00 C ATOM 0 H ILE B 26 -5.359 -8.379 -9.687 1.00 0.00 H new ATOM 0 HA ILE B 26 -7.939 -8.609 -10.401 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.884 -9.206 -7.613 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.572 -10.559 -10.125 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.696 -10.697 -8.614 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.916 -10.646 -7.410 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.345 -8.930 -7.603 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.488 -10.043 -8.984 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.616 -12.848 -9.293 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -7.371 -12.307 -7.774 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.260 -12.167 -9.310 1.00 0.00 H new ATOM 1736 N LEU B 27 -7.616 -6.591 -7.738 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.300 -5.641 -6.871 1.00 0.00 C ATOM 1738 C LEU B 27 -8.719 -4.369 -7.608 1.00 0.00 C ATOM 1739 O LEU B 27 -9.888 -4.008 -7.492 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.468 -5.404 -5.601 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.343 -6.659 -4.707 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.582 -6.292 -3.431 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.711 -7.261 -4.349 1.00 0.00 C ATOM 0 H LEU B 27 -6.654 -6.790 -7.465 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.248 -6.071 -6.548 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.471 -5.069 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -7.922 -4.599 -5.023 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.798 -7.418 -5.269 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.490 -7.173 -2.796 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.588 -5.928 -3.692 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -7.125 -5.513 -2.895 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.568 -8.140 -3.720 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -9.304 -6.522 -3.810 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.232 -7.549 -5.262 1.00 0.00 H new ATOM 1755 N VAL B 28 -7.867 -3.757 -8.443 1.00 0.00 N ATOM 1756 CA VAL B 28 -8.287 -2.567 -9.227 1.00 0.00 C ATOM 1757 C VAL B 28 -9.448 -2.896 -10.183 1.00 0.00 C ATOM 1758 O VAL B 28 -10.321 -2.064 -10.411 1.00 0.00 O ATOM 1759 CB VAL B 28 -7.153 -1.843 -10.005 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -5.867 -1.688 -9.183 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -6.749 -2.500 -11.334 1.00 0.00 C ATOM 0 H VAL B 28 -6.903 -4.051 -8.597 1.00 0.00 H new ATOM 0 HA VAL B 28 -8.619 -1.862 -8.464 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.607 -0.875 -10.215 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -5.113 -1.175 -9.780 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -6.077 -1.106 -8.286 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.496 -2.673 -8.898 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -5.952 -1.920 -11.799 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -6.397 -3.515 -11.146 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -7.611 -2.532 -12.001 1.00 0.00 H new ATOM 1771 N ALA B 29 -9.479 -4.125 -10.713 1.00 0.00 N ATOM 1772 CA ALA B 29 -10.535 -4.604 -11.592 1.00 0.00 C ATOM 1773 C ALA B 29 -11.786 -5.093 -10.835 1.00 0.00 C ATOM 1774 O ALA B 29 -12.857 -5.208 -11.436 1.00 0.00 O ATOM 1775 CB ALA B 29 -9.921 -5.684 -12.491 1.00 0.00 C ATOM 0 H ALA B 29 -8.755 -4.821 -10.535 1.00 0.00 H new ATOM 0 HA ALA B 29 -10.910 -3.779 -12.198 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -10.683 -6.071 -13.168 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.105 -5.254 -13.071 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -9.538 -6.497 -11.874 1.00 0.00 H new ATOM 1781 N LEU B 30 -11.703 -5.375 -9.528 1.00 0.00 N ATOM 1782 CA LEU B 30 -12.873 -5.614 -8.710 1.00 0.00 C ATOM 1783 C LEU B 30 -13.637 -4.330 -8.446 1.00 0.00 C ATOM 1784 O LEU B 30 -14.861 -4.377 -8.518 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.430 -6.240 -7.395 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.335 -7.418 -7.037 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -13.206 -8.622 -7.978 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -12.829 -7.816 -5.673 1.00 0.00 C ATOM 0 H LEU B 30 -10.821 -5.441 -9.021 1.00 0.00 H new ATOM 0 HA LEU B 30 -13.543 -6.289 -9.242 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.397 -6.578 -7.475 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.461 -5.494 -6.601 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.385 -7.130 -7.096 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -13.882 -9.412 -7.652 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -13.463 -8.320 -8.993 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -12.181 -8.991 -7.958 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.407 -8.663 -5.304 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -11.778 -8.096 -5.742 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.936 -6.977 -4.986 1.00 0.00 H new ATOM 1800 N LEU B 31 -12.908 -3.244 -8.158 1.00 0.00 N ATOM 1801 CA LEU B 31 -13.408 -1.945 -7.737 1.00 0.00 C ATOM 1802 C LEU B 31 -14.560 -1.440 -8.628 1.00 0.00 C ATOM 1803 O LEU B 31 -15.622 -1.117 -8.108 1.00 0.00 O ATOM 1804 CB LEU B 31 -12.179 -1.018 -7.786 1.00 0.00 C ATOM 1805 CG LEU B 31 -12.016 -0.037 -6.626 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -10.811 0.822 -7.001 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -13.247 0.831 -6.338 1.00 0.00 C ATOM 0 H LEU B 31 -11.890 -3.259 -8.219 1.00 0.00 H new ATOM 0 HA LEU B 31 -13.845 -1.985 -6.739 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -11.285 -1.640 -7.835 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -12.220 -0.446 -8.713 1.00 0.00 H new ATOM 0 HG LEU B 31 -11.879 -0.590 -5.697 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -10.628 1.555 -6.215 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -9.933 0.187 -7.116 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -11.011 1.339 -7.940 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -13.036 1.495 -5.499 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -13.487 1.425 -7.219 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -14.094 0.191 -6.090 1.00 0.00 H new ATOM 1819 N ASP B 32 -14.345 -1.450 -9.947 1.00 0.00 N ATOM 1820 CA ASP B 32 -15.279 -0.985 -10.995 1.00 0.00 C ATOM 1821 C ASP B 32 -16.053 -2.153 -11.665 1.00 0.00 C ATOM 1822 O ASP B 32 -16.680 -2.008 -12.711 1.00 0.00 O ATOM 1823 CB ASP B 32 -14.449 -0.169 -12.012 1.00 0.00 C ATOM 1824 CG ASP B 32 -15.265 0.787 -12.898 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -16.236 1.381 -12.378 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -14.839 0.993 -14.060 1.00 0.00 O ATOM 0 H ASP B 32 -13.471 -1.800 -10.340 1.00 0.00 H new ATOM 0 HA ASP B 32 -16.056 -0.361 -10.554 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -13.704 0.411 -11.468 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -13.906 -0.862 -12.655 1.00 0.00 H new ATOM 1831 N GLY B 33 -15.949 -3.351 -11.073 1.00 0.00 N ATOM 1832 CA GLY B 33 -16.469 -4.624 -11.584 1.00 0.00 C ATOM 1833 C GLY B 33 -17.491 -5.258 -10.656 1.00 0.00 C ATOM 1834 O GLY B 33 -18.686 -5.232 -10.933 1.00 0.00 O ATOM 0 H GLY B 33 -15.474 -3.462 -10.177 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -16.925 -4.459 -12.560 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -15.640 -5.317 -11.732 1.00 0.00 H new ATOM 1838 N VAL B 34 -16.993 -5.928 -9.613 1.00 0.00 N ATOM 1839 CA VAL B 34 -17.748 -6.804 -8.683 1.00 0.00 C ATOM 1840 C VAL B 34 -18.890 -7.618 -9.329 1.00 0.00 C ATOM 1841 O VAL B 34 -19.948 -7.765 -8.723 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.259 -6.025 -7.443 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.132 -5.679 -6.475 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.052 -4.771 -7.827 1.00 0.00 C ATOM 0 H VAL B 34 -16.003 -5.878 -9.373 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.015 -7.544 -8.362 1.00 0.00 H new ATOM 0 HB VAL B 34 -18.943 -6.699 -6.927 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -17.539 -5.134 -5.623 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -16.657 -6.596 -6.126 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -16.393 -5.059 -6.983 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -19.387 -4.262 -6.924 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -18.416 -4.102 -8.406 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -19.918 -5.057 -8.425 1.00 0.00 H new ATOM 1854 N CYS B 35 -18.726 -8.126 -10.559 1.00 0.00 N ATOM 1855 CA CYS B 35 -19.851 -8.745 -11.265 1.00 0.00 C ATOM 1856 C CYS B 35 -20.076 -10.195 -10.841 1.00 0.00 C ATOM 1857 O CYS B 35 -21.033 -10.477 -10.134 1.00 0.00 O ATOM 1858 CB CYS B 35 -19.756 -8.566 -12.797 1.00 0.00 C ATOM 1859 SG CYS B 35 -18.785 -7.123 -13.333 1.00 0.00 S ATOM 0 H CYS B 35 -17.846 -8.121 -11.074 1.00 0.00 H new ATOM 0 HA CYS B 35 -20.747 -8.205 -10.960 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.315 -9.465 -13.228 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.764 -8.480 -13.203 1.00 0.00 H new ATOM 0 HG CYS B 35 -18.843 -6.198 -12.422 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.185 -11.107 -11.247 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.448 -12.554 -11.102 1.00 0.00 C ATOM 1867 C TYR B 36 -18.239 -13.373 -10.572 1.00 0.00 C ATOM 1868 O TYR B 36 -17.220 -12.769 -10.223 1.00 0.00 O ATOM 1869 CB TYR B 36 -20.071 -13.097 -12.416 1.00 0.00 C ATOM 1870 CG TYR B 36 -20.846 -12.115 -13.277 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -22.097 -11.633 -12.848 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -20.310 -11.671 -14.501 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -22.796 -10.687 -13.617 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -20.998 -10.718 -15.274 1.00 0.00 C ATOM 1875 CZ TYR B 36 -22.244 -10.220 -14.830 1.00 0.00 C ATOM 1876 OH TYR B 36 -22.900 -9.283 -15.562 1.00 0.00 O ATOM 0 H TYR B 36 -18.287 -10.880 -11.673 1.00 0.00 H new ATOM 0 HA TYR B 36 -20.180 -12.689 -10.306 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -19.268 -13.516 -13.022 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -20.738 -13.919 -12.158 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -22.522 -11.992 -11.922 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -19.366 -12.064 -14.848 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -23.754 -10.318 -13.281 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -20.575 -10.368 -16.204 1.00 0.00 H new ATOM 0 HH TYR B 36 -22.381 -9.073 -16.366 1.00 0.00 H new ATOM 1886 N PRO B 37 -18.295 -14.726 -10.456 1.00 0.00 N ATOM 1887 CA PRO B 37 -17.213 -15.488 -9.849 1.00 0.00 C ATOM 1888 C PRO B 37 -16.090 -15.660 -10.874 1.00 0.00 C ATOM 1889 O PRO B 37 -16.133 -16.545 -11.727 1.00 0.00 O ATOM 1890 CB PRO B 37 -17.840 -16.805 -9.389 1.00 0.00 C ATOM 1891 CG PRO B 37 -18.953 -17.051 -10.406 1.00 0.00 C ATOM 1892 CD PRO B 37 -19.331 -15.655 -10.906 1.00 0.00 C ATOM 0 HA PRO B 37 -16.755 -14.996 -8.991 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -17.112 -17.616 -9.388 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -18.233 -16.729 -8.375 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -18.611 -17.686 -11.223 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -19.805 -17.553 -9.948 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -19.407 -15.646 -11.993 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -20.305 -15.360 -10.516 1.00 0.00 H new ATOM 1900 N GLY B 38 -15.091 -14.777 -10.807 1.00 0.00 N ATOM 1901 CA GLY B 38 -13.967 -14.775 -11.748 1.00 0.00 C ATOM 1902 C GLY B 38 -14.280 -14.102 -13.088 1.00 0.00 C ATOM 1903 O GLY B 38 -13.668 -14.456 -14.094 1.00 0.00 O ATOM 0 H GLY B 38 -15.038 -14.044 -10.100 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.120 -14.267 -11.286 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -13.659 -15.804 -11.933 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.183 -13.109 -13.130 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.380 -12.268 -14.331 1.00 0.00 C ATOM 1909 C GLN B 39 -14.108 -11.505 -14.712 1.00 0.00 C ATOM 1910 O GLN B 39 -13.910 -11.163 -15.874 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.584 -11.325 -14.165 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.285 -9.903 -13.652 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.616 -9.822 -12.291 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -15.616 -10.754 -11.507 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -14.983 -8.720 -11.965 1.00 0.00 N ATOM 0 H GLN B 39 -15.791 -12.866 -12.348 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.604 -12.939 -15.160 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.085 -11.240 -15.129 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.290 -11.793 -13.479 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -15.648 -9.400 -14.380 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -17.222 -9.347 -13.610 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -14.972 -7.929 -12.609 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -14.502 -8.655 -11.068 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.222 -11.322 -13.728 1.00 0.00 N ATOM 1925 CA LEU B 40 -11.868 -10.800 -13.844 1.00 0.00 C ATOM 1926 C LEU B 40 -11.053 -11.461 -14.961 1.00 0.00 C ATOM 1927 O LEU B 40 -10.079 -10.876 -15.413 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.174 -11.082 -12.509 1.00 0.00 C ATOM 1929 CG LEU B 40 -11.783 -10.365 -11.297 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -11.569 -11.267 -10.077 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.173 -8.965 -11.156 1.00 0.00 C ATOM 0 H LEU B 40 -13.455 -11.553 -12.762 1.00 0.00 H new ATOM 0 HA LEU B 40 -11.928 -9.739 -14.087 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.196 -12.156 -12.325 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.126 -10.794 -12.594 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.855 -10.201 -11.410 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.990 -10.789 -9.193 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -12.063 -12.225 -10.242 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -10.502 -11.430 -9.928 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.611 -8.463 -10.293 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.095 -9.050 -11.018 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.379 -8.386 -12.056 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.429 -12.656 -15.413 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.740 -13.318 -16.520 1.00 0.00 C ATOM 1945 C ALA B 41 -10.876 -12.533 -17.838 1.00 0.00 C ATOM 1946 O ALA B 41 -9.974 -12.574 -18.671 1.00 0.00 O ATOM 1947 CB ALA B 41 -11.275 -14.751 -16.624 1.00 0.00 C ATOM 0 H ALA B 41 -12.210 -13.187 -15.028 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.668 -13.351 -16.323 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.776 -15.267 -17.444 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -11.082 -15.280 -15.691 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -12.349 -14.726 -16.811 1.00 0.00 H new ATOM 1953 N ALA B 42 -11.970 -11.784 -18.012 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.116 -10.816 -19.097 1.00 0.00 C ATOM 1955 C ALA B 42 -11.320 -9.535 -18.789 1.00 0.00 C ATOM 1956 O ALA B 42 -10.505 -9.107 -19.599 1.00 0.00 O ATOM 1957 CB ALA B 42 -13.613 -10.544 -19.308 1.00 0.00 C ATOM 0 H ALA B 42 -12.783 -11.835 -17.398 1.00 0.00 H new ATOM 0 HA ALA B 42 -11.704 -11.215 -20.024 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -13.742 -9.823 -20.115 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -14.119 -11.474 -19.568 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.043 -10.142 -18.390 1.00 0.00 H new ATOM 1963 N HIS B 43 -11.511 -8.960 -17.595 1.00 0.00 N ATOM 1964 CA HIS B 43 -10.867 -7.701 -17.179 1.00 0.00 C ATOM 1965 C HIS B 43 -9.322 -7.723 -17.239 1.00 0.00 C ATOM 1966 O HIS B 43 -8.685 -6.712 -17.533 1.00 0.00 O ATOM 1967 CB HIS B 43 -11.266 -7.396 -15.728 1.00 0.00 C ATOM 1968 CG HIS B 43 -12.704 -7.025 -15.463 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -13.666 -6.695 -16.417 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -13.207 -6.752 -14.223 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -14.699 -6.178 -15.735 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -14.446 -6.179 -14.415 1.00 0.00 N ATOM 0 H HIS B 43 -12.122 -9.357 -16.881 1.00 0.00 H new ATOM 0 HA HIS B 43 -11.209 -6.944 -17.885 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -11.028 -8.271 -15.123 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -10.637 -6.580 -15.371 1.00 0.00 H new ATOM 0 HD1 HIS B 43 -13.598 -6.821 -17.427 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -12.727 -6.947 -13.275 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -15.610 -5.811 -16.185 1.00 0.00 H new ATOM 1980 N LEU B 44 -8.729 -8.868 -16.885 1.00 0.00 N ATOM 1981 CA LEU B 44 -7.282 -9.088 -16.820 1.00 0.00 C ATOM 1982 C LEU B 44 -6.740 -9.769 -18.083 1.00 0.00 C ATOM 1983 O LEU B 44 -5.527 -9.852 -18.238 1.00 0.00 O ATOM 1984 CB LEU B 44 -6.969 -9.948 -15.573 1.00 0.00 C ATOM 1985 CG LEU B 44 -7.461 -9.377 -14.228 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -6.857 -10.121 -13.041 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -7.203 -7.873 -14.050 1.00 0.00 C ATOM 0 H LEU B 44 -9.264 -9.697 -16.627 1.00 0.00 H new ATOM 0 HA LEU B 44 -6.789 -8.118 -16.750 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.413 -10.933 -15.713 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -5.890 -10.090 -15.514 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.541 -9.525 -14.254 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.229 -9.688 -12.113 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.139 -11.173 -13.089 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.771 -10.035 -13.072 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -7.579 -7.552 -13.079 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.132 -7.678 -14.107 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -7.715 -7.320 -14.838 1.00 0.00 H new ATOM 1999 N GLY B 45 -7.611 -10.327 -18.936 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.238 -11.164 -20.082 1.00 0.00 C ATOM 2001 C GLY B 45 -6.657 -12.534 -19.708 1.00 0.00 C ATOM 2002 O GLY B 45 -6.406 -13.345 -20.600 1.00 0.00 O ATOM 0 H GLY B 45 -8.619 -10.205 -18.844 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.118 -11.315 -20.707 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -6.507 -10.626 -20.686 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.412 -12.804 -18.417 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.851 -14.068 -17.939 1.00 0.00 C ATOM 2008 C LEU B 46 -6.966 -15.106 -17.767 1.00 0.00 C ATOM 2009 O LEU B 46 -8.087 -14.765 -17.399 1.00 0.00 O ATOM 2010 CB LEU B 46 -5.070 -13.845 -16.621 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.583 -13.444 -16.742 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -2.780 -14.472 -17.552 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -3.381 -12.043 -17.326 1.00 0.00 C ATOM 0 H LEU B 46 -6.602 -12.138 -17.668 1.00 0.00 H new ATOM 0 HA LEU B 46 -5.148 -14.452 -18.678 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.583 -13.071 -16.051 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.126 -14.763 -16.035 1.00 0.00 H new ATOM 0 HG LEU B 46 -3.204 -13.427 -15.720 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -1.739 -14.154 -17.614 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -2.833 -15.444 -17.061 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.196 -14.549 -18.556 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -2.315 -11.823 -17.384 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.816 -11.999 -18.325 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -3.868 -11.308 -16.685 1.00 0.00 H new ATOM 2025 N THR B 47 -6.659 -16.392 -17.990 1.00 0.00 N ATOM 2026 CA THR B 47 -7.665 -17.465 -17.898 1.00 0.00 C ATOM 2027 C THR B 47 -8.279 -17.532 -16.501 1.00 0.00 C ATOM 2028 O THR B 47 -7.634 -17.176 -15.504 1.00 0.00 O ATOM 2029 CB THR B 47 -7.156 -18.849 -18.341 1.00 0.00 C ATOM 2030 OG1 THR B 47 -6.523 -19.513 -17.275 1.00 0.00 O ATOM 2031 CG2 THR B 47 -6.210 -18.816 -19.543 1.00 0.00 C ATOM 0 H THR B 47 -5.724 -16.716 -18.235 1.00 0.00 H new ATOM 0 HA THR B 47 -8.440 -17.193 -18.614 1.00 0.00 H new ATOM 0 HB THR B 47 -8.048 -19.391 -18.655 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.551 -19.439 -17.375 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.899 -19.831 -19.789 1.00 0.00 H new ATOM 0 HG22 THR B 47 -6.723 -18.376 -20.398 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.333 -18.217 -19.299 1.00 0.00 H new ATOM 2039 N ARG B 48 -9.506 -18.071 -16.421 1.00 0.00 N ATOM 2040 CA ARG B 48 -10.214 -18.245 -15.147 1.00 0.00 C ATOM 2041 C ARG B 48 -9.350 -19.006 -14.135 1.00 0.00 C ATOM 2042 O ARG B 48 -9.367 -18.660 -12.958 1.00 0.00 O ATOM 2043 CB ARG B 48 -11.572 -18.947 -15.350 1.00 0.00 C ATOM 2044 CG ARG B 48 -12.542 -18.643 -14.188 1.00 0.00 C ATOM 2045 CD ARG B 48 -13.725 -19.617 -14.074 1.00 0.00 C ATOM 2046 NE ARG B 48 -14.542 -19.684 -15.302 1.00 0.00 N ATOM 2047 CZ ARG B 48 -15.561 -20.510 -15.524 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -15.991 -21.354 -14.606 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -16.165 -20.496 -16.694 1.00 0.00 N ATOM 0 H ARG B 48 -10.031 -18.396 -17.233 1.00 0.00 H new ATOM 0 HA ARG B 48 -10.411 -17.252 -14.743 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -12.015 -18.621 -16.291 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -11.419 -20.024 -15.426 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.984 -18.658 -13.252 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -12.931 -17.632 -14.311 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -13.347 -20.613 -13.842 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -14.358 -19.314 -13.240 1.00 0.00 H new ATOM 0 HE ARG B 48 -14.302 -19.035 -16.052 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -15.539 -21.387 -13.692 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -16.775 -21.973 -14.810 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -15.851 -19.855 -17.422 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -16.947 -21.126 -16.872 1.00 0.00 H new ATOM 2063 N SER B 49 -8.550 -19.977 -14.575 1.00 0.00 N ATOM 2064 CA SER B 49 -7.558 -20.664 -13.741 1.00 0.00 C ATOM 2065 C SER B 49 -6.460 -19.702 -13.264 1.00 0.00 C ATOM 2066 O SER B 49 -6.338 -19.494 -12.062 1.00 0.00 O ATOM 2067 CB SER B 49 -6.958 -21.850 -14.511 1.00 0.00 C ATOM 2068 OG SER B 49 -7.988 -22.642 -15.082 1.00 0.00 O ATOM 0 H SER B 49 -8.572 -20.316 -15.537 1.00 0.00 H new ATOM 0 HA SER B 49 -8.061 -21.042 -12.851 1.00 0.00 H new ATOM 0 HB2 SER B 49 -6.295 -21.484 -15.295 1.00 0.00 H new ATOM 0 HB3 SER B 49 -6.353 -22.459 -13.839 1.00 0.00 H new ATOM 0 HG SER B 49 -7.591 -23.393 -15.571 1.00 0.00 H new ATOM 2074 N ASN B 50 -5.721 -19.043 -14.170 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.622 -18.129 -13.809 1.00 0.00 C ATOM 2076 C ASN B 50 -5.054 -17.010 -12.842 1.00 0.00 C ATOM 2077 O ASN B 50 -4.288 -16.647 -11.950 1.00 0.00 O ATOM 2078 CB ASN B 50 -4.029 -17.494 -15.076 1.00 0.00 C ATOM 2079 CG ASN B 50 -3.322 -18.499 -15.970 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -3.925 -19.064 -16.870 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -2.043 -18.750 -15.767 1.00 0.00 N ATOM 0 H ASN B 50 -5.868 -19.128 -15.176 1.00 0.00 H new ATOM 0 HA ASN B 50 -3.876 -18.735 -13.294 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -4.827 -17.012 -15.641 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.325 -16.713 -14.789 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -1.554 -19.418 -16.363 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -1.543 -18.276 -15.015 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.278 -16.496 -12.997 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.867 -15.508 -12.076 1.00 0.00 C ATOM 2090 C VAL B 51 -7.353 -16.149 -10.762 1.00 0.00 C ATOM 2091 O VAL B 51 -7.069 -15.612 -9.691 1.00 0.00 O ATOM 2092 CB VAL B 51 -7.995 -14.694 -12.754 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -8.583 -13.655 -11.795 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -7.468 -13.932 -13.984 1.00 0.00 C ATOM 0 H VAL B 51 -6.895 -16.752 -13.768 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.068 -14.814 -11.815 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.759 -15.413 -13.049 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -9.373 -13.099 -12.300 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -8.996 -14.159 -10.921 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -7.799 -12.966 -11.480 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -8.283 -13.369 -14.440 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -6.680 -13.245 -13.676 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -7.068 -14.642 -14.708 1.00 0.00 H new ATOM 2104 N SER B 52 -8.026 -17.307 -10.796 1.00 0.00 N ATOM 2105 CA SER B 52 -8.499 -17.983 -9.569 1.00 0.00 C ATOM 2106 C SER B 52 -7.352 -18.405 -8.640 1.00 0.00 C ATOM 2107 O SER B 52 -7.506 -18.349 -7.418 1.00 0.00 O ATOM 2108 CB SER B 52 -9.369 -19.203 -9.889 1.00 0.00 C ATOM 2109 OG SER B 52 -10.536 -18.810 -10.588 1.00 0.00 O ATOM 0 H SER B 52 -8.258 -17.800 -11.658 1.00 0.00 H new ATOM 0 HA SER B 52 -9.102 -17.241 -9.045 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.801 -19.915 -10.488 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.645 -19.712 -8.966 1.00 0.00 H new ATOM 0 HG SER B 52 -10.404 -18.950 -11.549 1.00 0.00 H new ATOM 2115 N ASN B 53 -6.183 -18.721 -9.208 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.938 -18.974 -8.478 1.00 0.00 C ATOM 2117 C ASN B 53 -4.523 -17.808 -7.566 1.00 0.00 C ATOM 2118 O ASN B 53 -3.915 -18.028 -6.521 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.826 -19.297 -9.490 1.00 0.00 C ATOM 2120 CG ASN B 53 -3.998 -20.635 -10.207 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -4.876 -21.435 -9.922 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -3.134 -20.927 -11.161 1.00 0.00 N ATOM 0 H ASN B 53 -6.075 -18.810 -10.218 1.00 0.00 H new ATOM 0 HA ASN B 53 -5.107 -19.823 -7.815 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.786 -18.502 -10.234 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.867 -19.297 -8.971 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -3.202 -21.816 -11.656 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -2.399 -20.263 -11.404 1.00 0.00 H new ATOM 2129 N HIS B 54 -4.884 -16.569 -7.910 1.00 0.00 N ATOM 2130 CA HIS B 54 -4.739 -15.420 -7.017 1.00 0.00 C ATOM 2131 C HIS B 54 -5.977 -15.153 -6.127 1.00 0.00 C ATOM 2132 O HIS B 54 -5.781 -14.674 -5.007 1.00 0.00 O ATOM 2133 CB HIS B 54 -4.359 -14.188 -7.853 1.00 0.00 C ATOM 2134 CG HIS B 54 -2.870 -14.008 -8.049 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -1.979 -13.528 -7.117 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -2.159 -14.191 -9.204 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -0.784 -13.370 -7.710 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -0.853 -13.740 -8.994 1.00 0.00 N ATOM 0 H HIS B 54 -5.286 -16.336 -8.818 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.943 -15.650 -6.309 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -4.836 -14.264 -8.830 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.761 -13.297 -7.371 1.00 0.00 H new ATOM 0 HD1 HIS B 54 -2.190 -13.326 -6.140 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -2.542 -14.612 -10.122 1.00 0.00 H new ATOM 0 HE1 HIS B 54 0.104 -12.998 -7.221 1.00 0.00 H new ATOM 2146 N LEU B 55 -7.216 -15.466 -6.560 1.00 0.00 N ATOM 2147 CA LEU B 55 -8.425 -15.275 -5.731 1.00 0.00 C ATOM 2148 C LEU B 55 -8.441 -16.157 -4.487 1.00 0.00 C ATOM 2149 O LEU B 55 -8.898 -15.705 -3.442 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.742 -15.541 -6.491 1.00 0.00 C ATOM 2151 CG LEU B 55 -10.056 -14.560 -7.634 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -11.254 -15.056 -8.455 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.362 -13.170 -7.063 1.00 0.00 C ATOM 0 H LEU B 55 -7.406 -15.854 -7.484 1.00 0.00 H new ATOM 0 HA LEU B 55 -8.370 -14.224 -5.447 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -9.707 -16.550 -6.901 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -10.565 -15.515 -5.777 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.184 -14.499 -8.286 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.462 -14.350 -9.259 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -11.024 -16.033 -8.881 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -12.128 -15.138 -7.809 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -10.583 -12.482 -7.879 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.223 -13.232 -6.397 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.498 -12.807 -6.506 1.00 0.00 H new ATOM 2165 N SER B 56 -7.977 -17.402 -4.571 1.00 0.00 N ATOM 2166 CA SER B 56 -7.969 -18.288 -3.397 1.00 0.00 C ATOM 2167 C SER B 56 -7.132 -17.769 -2.216 1.00 0.00 C ATOM 2168 O SER B 56 -7.527 -17.990 -1.073 1.00 0.00 O ATOM 2169 CB SER B 56 -7.595 -19.718 -3.803 1.00 0.00 C ATOM 2170 OG SER B 56 -8.781 -20.461 -4.072 1.00 0.00 O ATOM 0 H SER B 56 -7.606 -17.821 -5.424 1.00 0.00 H new ATOM 0 HA SER B 56 -8.989 -18.297 -3.013 1.00 0.00 H new ATOM 0 HB2 SER B 56 -6.955 -19.701 -4.686 1.00 0.00 H new ATOM 0 HB3 SER B 56 -7.026 -20.197 -3.006 1.00 0.00 H new ATOM 0 HG SER B 56 -8.542 -21.375 -4.333 1.00 0.00 H new ATOM 2176 N CYS B 57 -6.064 -16.996 -2.458 1.00 0.00 N ATOM 2177 CA CYS B 57 -5.367 -16.282 -1.407 1.00 0.00 C ATOM 2178 C CYS B 57 -6.171 -15.042 -0.965 1.00 0.00 C ATOM 2179 O CYS B 57 -6.276 -14.741 0.217 1.00 0.00 O ATOM 2180 CB CYS B 57 -4.027 -15.890 -2.021 1.00 0.00 C ATOM 2181 SG CYS B 57 -3.061 -14.858 -0.871 1.00 0.00 S ATOM 0 H CYS B 57 -5.669 -16.856 -3.388 1.00 0.00 H new ATOM 0 HA CYS B 57 -5.235 -16.888 -0.510 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -3.462 -16.787 -2.273 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -4.194 -15.347 -2.951 1.00 0.00 H new ATOM 0 HG CYS B 57 -2.024 -15.524 -0.457 1.00 0.00 H new ATOM 2186 N LEU B 58 -6.750 -14.334 -1.938 1.00 0.00 N ATOM 2187 CA LEU B 58 -7.465 -13.071 -1.760 1.00 0.00 C ATOM 2188 C LEU B 58 -8.633 -13.190 -0.780 1.00 0.00 C ATOM 2189 O LEU B 58 -8.852 -12.279 0.016 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.920 -12.594 -3.156 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.802 -11.084 -3.430 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.348 -10.645 -3.319 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.282 -10.831 -4.860 1.00 0.00 C ATOM 0 H LEU B 58 -6.732 -14.639 -2.911 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.801 -12.333 -1.311 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -7.335 -13.125 -3.907 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.960 -12.887 -3.296 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.398 -10.527 -2.707 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.275 -9.575 -3.515 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.980 -10.856 -2.315 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.747 -11.189 -4.048 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.210 -9.767 -5.085 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.660 -11.392 -5.557 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.319 -11.154 -4.958 1.00 0.00 H new ATOM 2205 N ARG B 59 -9.374 -14.304 -0.803 1.00 0.00 N ATOM 2206 CA ARG B 59 -10.432 -14.535 0.188 1.00 0.00 C ATOM 2207 C ARG B 59 -9.862 -14.876 1.573 1.00 0.00 C ATOM 2208 O ARG B 59 -10.412 -14.459 2.584 1.00 0.00 O ATOM 2209 CB ARG B 59 -11.413 -15.632 -0.256 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.920 -15.612 -1.718 1.00 0.00 C ATOM 2211 CD ARG B 59 -13.002 -16.691 -1.900 1.00 0.00 C ATOM 2212 NE ARG B 59 -12.485 -18.053 -1.629 1.00 0.00 N ATOM 2213 CZ ARG B 59 -11.702 -18.785 -2.418 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -11.482 -18.491 -3.684 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -11.098 -19.855 -1.942 1.00 0.00 N ATOM 0 H ARG B 59 -9.263 -15.052 -1.488 1.00 0.00 H new ATOM 0 HA ARG B 59 -10.980 -13.596 0.263 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -10.935 -16.596 -0.083 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -12.283 -15.585 0.399 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -12.326 -14.630 -1.960 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -11.092 -15.792 -2.404 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -13.837 -16.482 -1.232 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -13.389 -16.647 -2.918 1.00 0.00 H new ATOM 0 HE ARG B 59 -12.759 -18.475 -0.742 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -11.921 -17.670 -4.101 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -10.873 -19.085 -4.247 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -11.230 -20.124 -0.967 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -10.498 -20.414 -2.549 1.00 0.00 H new ATOM 2229 N GLY B 60 -8.741 -15.602 1.623 1.00 0.00 N ATOM 2230 CA GLY B 60 -8.187 -16.180 2.853 1.00 0.00 C ATOM 2231 C GLY B 60 -7.374 -15.177 3.665 1.00 0.00 C ATOM 2232 O GLY B 60 -7.559 -15.061 4.870 1.00 0.00 O ATOM 0 H GLY B 60 -8.182 -15.809 0.795 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -9.002 -16.563 3.468 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -7.555 -17.030 2.597 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.525 -14.398 2.994 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.818 -13.240 3.534 1.00 0.00 C ATOM 2238 C CYS B 61 -6.765 -12.002 3.722 1.00 0.00 C ATOM 2239 O CYS B 61 -6.322 -10.856 3.827 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.558 -13.049 2.654 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.369 -14.446 2.833 1.00 0.00 S ATOM 0 H CYS B 61 -6.302 -14.567 2.013 1.00 0.00 H new ATOM 0 HA CYS B 61 -5.475 -13.389 4.558 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.856 -12.959 1.609 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.064 -12.116 2.926 1.00 0.00 H new ATOM 0 HG CYS B 61 -3.103 -14.943 1.661 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.085 -12.248 3.701 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.168 -11.337 4.093 1.00 0.00 C ATOM 2248 C GLY B 62 -9.426 -10.130 3.200 1.00 0.00 C ATOM 2249 O GLY B 62 -9.856 -9.084 3.688 1.00 0.00 O ATOM 0 H GLY B 62 -8.446 -13.149 3.389 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.090 -11.915 4.152 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -8.955 -10.973 5.098 1.00 0.00 H new ATOM 2253 N LEU B 63 -9.121 -10.228 1.903 1.00 0.00 N ATOM 2254 CA LEU B 63 -9.282 -9.118 0.963 1.00 0.00 C ATOM 2255 C LEU B 63 -10.637 -9.125 0.243 1.00 0.00 C ATOM 2256 O LEU B 63 -11.173 -8.052 -0.005 1.00 0.00 O ATOM 2257 CB LEU B 63 -8.084 -9.075 0.023 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.814 -8.755 0.837 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.625 -9.092 -0.030 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.738 -7.286 1.282 1.00 0.00 C ATOM 0 H LEU B 63 -8.756 -11.079 1.476 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.299 -8.185 1.527 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.972 -10.032 -0.487 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -8.237 -8.319 -0.747 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.829 -9.347 1.752 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.705 -8.878 0.514 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.654 -10.150 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.656 -8.492 -0.940 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.822 -7.125 1.850 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.739 -6.639 0.404 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.599 -7.050 1.907 1.00 0.00 H new ATOM 2272 N VAL B 64 -11.227 -10.291 -0.036 1.00 0.00 N ATOM 2273 CA VAL B 64 -12.487 -10.457 -0.803 1.00 0.00 C ATOM 2274 C VAL B 64 -13.469 -11.438 -0.162 1.00 0.00 C ATOM 2275 O VAL B 64 -13.083 -12.520 0.263 1.00 0.00 O ATOM 2276 CB VAL B 64 -12.247 -10.931 -2.256 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.941 -9.737 -3.165 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -11.124 -11.933 -2.396 1.00 0.00 C ATOM 0 H VAL B 64 -10.836 -11.181 0.272 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.920 -9.457 -0.799 1.00 0.00 H new ATOM 0 HB VAL B 64 -13.171 -11.427 -2.553 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.775 -10.088 -4.183 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.783 -9.045 -3.153 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -11.047 -9.227 -2.807 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -11.018 -12.217 -3.443 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -10.193 -11.488 -2.044 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -11.350 -12.818 -1.802 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.749 -11.065 -0.185 1.00 0.00 N ATOM 2289 CA VAL B 65 -15.896 -11.810 0.352 1.00 0.00 C ATOM 2290 C VAL B 65 -16.945 -11.969 -0.755 1.00 0.00 C ATOM 2291 O VAL B 65 -17.230 -11.035 -1.509 1.00 0.00 O ATOM 2292 CB VAL B 65 -16.492 -11.077 1.584 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -17.755 -11.766 2.129 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -15.460 -10.962 2.722 1.00 0.00 C ATOM 0 H VAL B 65 -15.034 -10.180 -0.605 1.00 0.00 H new ATOM 0 HA VAL B 65 -15.572 -12.797 0.683 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.766 -10.083 1.232 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -18.129 -11.212 2.990 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -18.520 -11.791 1.353 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -17.512 -12.785 2.431 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -15.909 -10.444 3.569 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -15.146 -11.959 3.031 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.593 -10.401 2.372 1.00 0.00 H new ATOM 2304 N ALA B 66 -17.514 -13.169 -0.879 1.00 0.00 N ATOM 2305 CA ALA B 66 -18.572 -13.473 -1.846 1.00 0.00 C ATOM 2306 C ALA B 66 -19.942 -12.947 -1.390 1.00 0.00 C ATOM 2307 O ALA B 66 -20.302 -13.041 -0.218 1.00 0.00 O ATOM 2308 CB ALA B 66 -18.596 -14.987 -2.096 1.00 0.00 C ATOM 0 H ALA B 66 -17.250 -13.968 -0.303 1.00 0.00 H new ATOM 0 HA ALA B 66 -18.354 -12.958 -2.782 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -19.380 -15.225 -2.815 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -17.632 -15.306 -2.492 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -18.793 -15.507 -1.159 1.00 0.00 H new ATOM 2314 N THR B 67 -20.734 -12.429 -2.336 1.00 0.00 N ATOM 2315 CA THR B 67 -22.142 -12.039 -2.110 1.00 0.00 C ATOM 2316 C THR B 67 -22.950 -12.398 -3.335 1.00 0.00 C ATOM 2317 O THR B 67 -22.405 -12.427 -4.431 1.00 0.00 O ATOM 2318 CB THR B 67 -22.337 -10.556 -1.702 1.00 0.00 C ATOM 2319 OG1 THR B 67 -23.044 -9.770 -2.647 1.00 0.00 O ATOM 2320 CG2 THR B 67 -21.044 -9.778 -1.458 1.00 0.00 C ATOM 0 H THR B 67 -20.418 -12.265 -3.292 1.00 0.00 H new ATOM 0 HA THR B 67 -22.501 -12.600 -1.247 1.00 0.00 H new ATOM 0 HB THR B 67 -22.904 -10.684 -0.780 1.00 0.00 H new ATOM 0 HG1 THR B 67 -23.764 -9.283 -2.194 1.00 0.00 H new ATOM 0 HG21 THR B 67 -21.284 -8.752 -1.178 1.00 0.00 H new ATOM 0 HG22 THR B 67 -20.481 -10.251 -0.654 1.00 0.00 H new ATOM 0 HG23 THR B 67 -20.444 -9.775 -2.368 1.00 0.00 H new ATOM 2328 N TYR B 68 -24.251 -12.615 -3.175 1.00 0.00 N ATOM 2329 CA TYR B 68 -25.147 -12.703 -4.329 1.00 0.00 C ATOM 2330 C TYR B 68 -25.361 -11.293 -4.905 1.00 0.00 C ATOM 2331 O TYR B 68 -25.578 -10.353 -4.136 1.00 0.00 O ATOM 2332 CB TYR B 68 -26.483 -13.359 -3.932 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.703 -14.706 -4.591 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -26.179 -15.869 -3.998 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.396 -14.795 -5.814 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -26.309 -17.114 -4.641 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.528 -16.036 -6.464 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.970 -17.197 -5.888 1.00 0.00 C ATOM 2339 OH TYR B 68 -27.055 -18.387 -6.543 1.00 0.00 O ATOM 0 H TYR B 68 -24.707 -12.732 -2.270 1.00 0.00 H new ATOM 0 HA TYR B 68 -24.697 -13.333 -5.096 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -26.513 -13.482 -2.849 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -27.302 -12.692 -4.200 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -25.675 -15.806 -3.045 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -27.827 -13.908 -6.254 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.905 -18.004 -4.183 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.056 -16.100 -7.404 1.00 0.00 H new ATOM 0 HH TYR B 68 -27.543 -18.263 -7.384 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.242 -11.136 -6.224 1.00 0.00 N ATOM 2350 CA GLU B 69 -25.685 -9.932 -6.940 1.00 0.00 C ATOM 2351 C GLU B 69 -27.214 -9.957 -7.167 1.00 0.00 C ATOM 2352 O GLU B 69 -27.862 -8.916 -7.082 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.857 -9.671 -8.222 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.229 -10.835 -9.015 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.174 -11.607 -9.931 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -26.402 -11.556 -9.734 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -24.708 -12.362 -10.806 1.00 0.00 O ATOM 0 H GLU B 69 -24.833 -11.844 -6.833 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.487 -9.067 -6.308 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -25.501 -9.126 -8.912 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.045 -8.999 -7.946 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.413 -10.438 -9.619 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -23.789 -11.536 -8.306 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.795 -11.153 -7.335 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.238 -11.418 -7.439 1.00 0.00 C ATOM 2366 C GLY B 70 -29.581 -12.570 -8.390 1.00 0.00 C ATOM 2367 O GLY B 70 -30.492 -13.346 -8.116 1.00 0.00 O ATOM 0 H GLY B 70 -27.242 -12.007 -7.406 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.630 -11.647 -6.448 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.742 -10.514 -7.780 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.828 -12.710 -9.484 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.829 -13.841 -10.424 1.00 0.00 C ATOM 2373 C ARG B 71 -27.720 -14.857 -10.100 1.00 0.00 C ATOM 2374 O ARG B 71 -27.916 -16.060 -10.279 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.644 -13.274 -11.842 1.00 0.00 C ATOM 2376 CG ARG B 71 -28.553 -14.368 -12.920 1.00 0.00 C ATOM 2377 CD ARG B 71 -28.511 -13.790 -14.340 1.00 0.00 C ATOM 2378 NE ARG B 71 -29.818 -13.249 -14.776 1.00 0.00 N ATOM 2379 CZ ARG B 71 -30.864 -13.946 -15.217 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -30.851 -15.263 -15.263 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -31.954 -13.321 -15.618 1.00 0.00 N ATOM 0 H ARG B 71 -28.157 -11.992 -9.757 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.775 -14.377 -10.343 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.478 -12.612 -12.074 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -27.738 -12.668 -11.870 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -27.660 -14.969 -12.749 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -29.409 -15.036 -12.828 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -27.762 -12.999 -14.384 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -28.194 -14.568 -15.035 1.00 0.00 H new ATOM 0 HE ARG B 71 -29.929 -12.236 -14.734 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -30.025 -15.776 -14.956 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -31.667 -15.769 -15.606 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -31.997 -12.302 -15.591 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -32.754 -13.856 -15.955 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.553 -14.409 -9.647 1.00 0.00 N ATOM 2396 CA GLN B 72 -25.393 -15.240 -9.319 1.00 0.00 C ATOM 2397 C GLN B 72 -24.594 -14.627 -8.153 1.00 0.00 C ATOM 2398 O GLN B 72 -25.035 -13.678 -7.506 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.516 -15.427 -10.584 1.00 0.00 C ATOM 2400 CG GLN B 72 -23.900 -16.834 -10.716 1.00 0.00 C ATOM 2401 CD GLN B 72 -24.717 -17.834 -11.542 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -24.167 -18.644 -12.268 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -26.033 -17.853 -11.477 1.00 0.00 N ATOM 0 H GLN B 72 -26.380 -13.416 -9.491 1.00 0.00 H new ATOM 0 HA GLN B 72 -25.732 -16.222 -8.990 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -25.121 -15.222 -11.467 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.713 -14.690 -10.570 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -22.912 -16.739 -11.166 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -23.757 -17.245 -9.717 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -26.524 -17.188 -10.879 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -26.561 -18.532 -12.025 1.00 0.00 H new ATOM 2412 N VAL B 73 -23.413 -15.181 -7.870 1.00 0.00 N ATOM 2413 CA VAL B 73 -22.485 -14.686 -6.847 1.00 0.00 C ATOM 2414 C VAL B 73 -21.356 -13.873 -7.476 1.00 0.00 C ATOM 2415 O VAL B 73 -20.881 -14.195 -8.562 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.892 -15.817 -5.979 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -22.972 -16.445 -5.089 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -21.200 -16.924 -6.798 1.00 0.00 C ATOM 0 H VAL B 73 -23.066 -16.007 -8.357 1.00 0.00 H new ATOM 0 HA VAL B 73 -23.073 -14.043 -6.192 1.00 0.00 H new ATOM 0 HB VAL B 73 -21.127 -15.344 -5.364 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -22.531 -17.239 -4.487 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -23.391 -15.682 -4.433 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -23.762 -16.860 -5.714 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -20.807 -17.684 -6.123 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -21.921 -17.379 -7.477 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -20.381 -16.493 -7.374 1.00 0.00 H new ATOM 2428 N ARG B 74 -20.900 -12.850 -6.755 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.803 -11.956 -7.112 1.00 0.00 C ATOM 2430 C ARG B 74 -18.667 -12.105 -6.104 1.00 0.00 C ATOM 2431 O ARG B 74 -18.828 -12.699 -5.039 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.309 -10.511 -7.132 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.505 -9.853 -5.759 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.302 -8.563 -5.928 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.825 -8.099 -4.636 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.708 -6.906 -4.076 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.023 -5.921 -4.627 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -22.297 -6.721 -2.917 1.00 0.00 N ATOM 0 H ARG B 74 -21.312 -12.610 -5.853 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.428 -12.215 -8.102 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.606 -9.908 -7.706 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.260 -10.486 -7.665 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.030 -10.533 -5.088 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.538 -9.640 -5.304 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.667 -7.793 -6.366 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -22.127 -8.728 -6.621 1.00 0.00 H new ATOM 0 HE ARG B 74 -22.349 -8.790 -4.098 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -20.556 -6.063 -5.522 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -20.961 -5.018 -4.157 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -22.820 -7.482 -2.483 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -22.232 -5.816 -2.451 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.544 -11.466 -6.401 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.436 -11.269 -5.463 1.00 0.00 C ATOM 2454 C TYR B 75 -16.373 -9.776 -5.136 1.00 0.00 C ATOM 2455 O TYR B 75 -16.038 -8.987 -6.017 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.116 -11.735 -6.100 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.799 -13.208 -5.929 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -15.593 -14.186 -6.556 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -13.679 -13.603 -5.174 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -15.269 -15.551 -6.443 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -13.333 -14.962 -5.071 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.125 -15.944 -5.709 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.782 -17.261 -5.622 1.00 0.00 O ATOM 0 H TYR B 75 -17.369 -11.059 -7.320 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.591 -11.851 -4.554 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.146 -11.508 -7.166 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.300 -11.152 -5.673 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -16.458 -13.887 -7.129 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.081 -12.858 -4.670 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -15.892 -16.296 -6.915 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -12.462 -15.256 -4.504 1.00 0.00 H new ATOM 0 HH TYR B 75 -12.835 -17.368 -5.850 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.709 -9.379 -3.909 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.605 -7.992 -3.466 1.00 0.00 C ATOM 2475 C ALA B 76 -15.446 -7.858 -2.474 1.00 0.00 C ATOM 2476 O ALA B 76 -15.229 -8.766 -1.672 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.947 -7.575 -2.846 1.00 0.00 C ATOM 0 H ALA B 76 -17.062 -10.014 -3.193 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.394 -7.329 -4.305 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.886 -6.540 -2.509 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.737 -7.668 -3.591 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -18.172 -8.220 -1.997 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.718 -6.739 -2.503 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.738 -6.398 -1.467 1.00 0.00 C ATOM 2485 C LEU B 77 -14.377 -6.458 -0.066 1.00 0.00 C ATOM 2486 O LEU B 77 -15.542 -6.097 0.095 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.127 -5.027 -1.802 1.00 0.00 C ATOM 2488 CG LEU B 77 -11.858 -5.165 -2.651 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.579 -3.803 -3.258 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -10.630 -5.641 -1.864 1.00 0.00 C ATOM 0 H LEU B 77 -14.791 -6.043 -3.245 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.930 -7.129 -1.449 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -13.859 -4.423 -2.338 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -12.892 -4.498 -0.879 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.035 -5.932 -3.405 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.680 -3.856 -3.873 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -12.424 -3.500 -3.876 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -11.432 -3.073 -2.462 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.774 -5.713 -2.535 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -10.409 -4.929 -1.069 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -10.834 -6.619 -1.429 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.602 -6.899 0.926 1.00 0.00 N ATOM 2503 CA ALA B 78 -14.107 -7.260 2.265 1.00 0.00 C ATOM 2504 C ALA B 78 -14.771 -6.093 3.011 1.00 0.00 C ATOM 2505 O ALA B 78 -15.702 -6.292 3.783 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.966 -7.890 3.076 1.00 0.00 C ATOM 0 H ALA B 78 -12.594 -7.019 0.828 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.908 -7.988 2.134 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -13.330 -8.160 4.067 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.607 -8.784 2.565 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -12.150 -7.174 3.172 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.318 -4.866 2.748 1.00 0.00 N ATOM 2513 CA ASP B 79 -14.995 -3.638 3.155 1.00 0.00 C ATOM 2514 C ASP B 79 -14.572 -2.448 2.291 1.00 0.00 C ATOM 2515 O ASP B 79 -13.471 -2.379 1.747 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.809 -3.342 4.656 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.482 -2.035 5.122 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.628 -1.731 4.696 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.780 -1.271 5.827 1.00 0.00 O ATOM 0 H ASP B 79 -13.452 -4.697 2.236 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.061 -3.797 2.993 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.213 -4.173 5.233 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.743 -3.289 4.877 1.00 0.00 H new ATOM 2524 N SER B 80 -15.478 -1.477 2.256 1.00 0.00 N ATOM 2525 CA SER B 80 -15.358 -0.101 1.768 1.00 0.00 C ATOM 2526 C SER B 80 -14.013 0.558 2.130 1.00 0.00 C ATOM 2527 O SER B 80 -13.488 1.344 1.344 1.00 0.00 O ATOM 2528 CB SER B 80 -16.508 0.738 2.384 1.00 0.00 C ATOM 2529 OG SER B 80 -17.611 -0.042 2.856 1.00 0.00 O ATOM 0 H SER B 80 -16.420 -1.651 2.607 1.00 0.00 H new ATOM 0 HA SER B 80 -15.414 -0.134 0.680 1.00 0.00 H new ATOM 0 HB2 SER B 80 -16.112 1.326 3.212 1.00 0.00 H new ATOM 0 HB3 SER B 80 -16.869 1.444 1.636 1.00 0.00 H new ATOM 0 HG SER B 80 -17.379 -0.449 3.717 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.430 0.196 3.285 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.069 0.539 3.696 1.00 0.00 C ATOM 2537 C HIS B 81 -11.014 0.162 2.642 1.00 0.00 C ATOM 2538 O HIS B 81 -10.203 1.009 2.269 1.00 0.00 O ATOM 2539 CB HIS B 81 -11.782 -0.157 5.049 1.00 0.00 C ATOM 2540 CG HIS B 81 -12.053 0.676 6.284 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.447 2.000 6.310 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -11.522 0.393 7.511 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -12.048 2.532 7.478 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -11.546 1.557 8.258 1.00 0.00 N ATOM 0 H HIS B 81 -13.918 -0.366 3.982 1.00 0.00 H new ATOM 0 HA HIS B 81 -12.000 1.621 3.804 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.384 -1.064 5.105 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.737 -0.466 5.063 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -11.150 -0.567 7.839 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -12.119 3.575 7.748 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -11.239 1.658 9.225 1.00 0.00 H new ATOM 2553 N LEU B 82 -10.998 -1.081 2.150 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.002 -1.516 1.158 1.00 0.00 C ATOM 2555 C LEU B 82 -10.256 -0.820 -0.180 1.00 0.00 C ATOM 2556 O LEU B 82 -9.325 -0.254 -0.738 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.964 -3.047 0.989 1.00 0.00 C ATOM 2558 CG LEU B 82 -10.090 -3.885 2.287 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -10.095 -5.380 1.953 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -8.944 -3.579 3.265 1.00 0.00 C ATOM 0 H LEU B 82 -11.663 -1.806 2.421 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.020 -1.224 1.530 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.770 -3.337 0.315 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.028 -3.314 0.499 1.00 0.00 H new ATOM 0 HG LEU B 82 -11.031 -3.615 2.766 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -10.184 -5.958 2.873 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -10.939 -5.604 1.301 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.166 -5.643 1.448 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -9.062 -4.183 4.165 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -7.990 -3.814 2.793 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -8.966 -2.522 3.532 1.00 0.00 H new ATOM 2572 N ALA B 83 -11.519 -0.748 -0.619 1.00 0.00 N ATOM 2573 CA ALA B 83 -11.939 0.003 -1.810 1.00 0.00 C ATOM 2574 C ALA B 83 -11.479 1.480 -1.775 1.00 0.00 C ATOM 2575 O ALA B 83 -11.132 2.018 -2.821 1.00 0.00 O ATOM 2576 CB ALA B 83 -13.464 -0.116 -1.941 1.00 0.00 C ATOM 0 H ALA B 83 -12.292 -1.218 -0.148 1.00 0.00 H new ATOM 0 HA ALA B 83 -11.457 -0.427 -2.688 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -13.798 0.435 -2.820 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -13.740 -1.166 -2.044 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -13.939 0.298 -1.051 1.00 0.00 H new ATOM 2582 N ARG B 84 -11.414 2.113 -0.590 1.00 0.00 N ATOM 2583 CA ARG B 84 -10.862 3.466 -0.390 1.00 0.00 C ATOM 2584 C ARG B 84 -9.341 3.539 -0.575 1.00 0.00 C ATOM 2585 O ARG B 84 -8.896 4.338 -1.393 1.00 0.00 O ATOM 2586 CB ARG B 84 -11.252 4.014 0.999 1.00 0.00 C ATOM 2587 CG ARG B 84 -12.635 4.680 1.005 1.00 0.00 C ATOM 2588 CD ARG B 84 -12.597 6.126 0.487 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.010 7.038 1.485 1.00 0.00 N ATOM 2590 CZ ARG B 84 -12.401 8.259 1.819 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -13.395 8.875 1.210 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -11.767 8.873 2.788 1.00 0.00 N ATOM 0 H ARG B 84 -11.751 1.689 0.274 1.00 0.00 H new ATOM 0 HA ARG B 84 -11.303 4.088 -1.169 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -11.242 3.199 1.723 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -10.503 4.737 1.323 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -13.318 4.095 0.389 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -13.034 4.672 2.019 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -12.016 6.169 -0.434 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -13.607 6.453 0.242 1.00 0.00 H new ATOM 0 HE ARG B 84 -11.195 6.682 1.985 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -13.894 8.411 0.451 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -13.665 9.816 1.498 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -10.993 8.410 3.265 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -12.047 9.814 3.065 1.00 0.00 H new ATOM 2606 N ALA B 85 -8.538 2.724 0.118 1.00 0.00 N ATOM 2607 CA ALA B 85 -7.069 2.728 -0.040 1.00 0.00 C ATOM 2608 C ALA B 85 -6.622 2.318 -1.460 1.00 0.00 C ATOM 2609 O ALA B 85 -5.699 2.891 -2.036 1.00 0.00 O ATOM 2610 CB ALA B 85 -6.469 1.813 1.036 1.00 0.00 C ATOM 0 H ALA B 85 -8.879 2.046 0.800 1.00 0.00 H new ATOM 0 HA ALA B 85 -6.700 3.745 0.091 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -5.383 1.800 0.939 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -6.740 2.186 2.024 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -6.856 0.802 0.911 1.00 0.00 H new ATOM 2616 N LEU B 86 -7.315 1.346 -2.049 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.220 0.950 -3.450 1.00 0.00 C ATOM 2618 C LEU B 86 -7.596 2.091 -4.424 1.00 0.00 C ATOM 2619 O LEU B 86 -6.933 2.259 -5.445 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.188 -0.239 -3.580 1.00 0.00 C ATOM 2621 CG LEU B 86 -8.310 -0.826 -4.987 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.053 -1.485 -5.532 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -9.416 -1.871 -4.950 1.00 0.00 C ATOM 0 H LEU B 86 -7.993 0.785 -1.534 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.196 0.692 -3.719 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -7.863 -1.028 -2.901 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.177 0.080 -3.249 1.00 0.00 H new ATOM 0 HG LEU B 86 -8.515 0.012 -5.654 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -7.248 -1.867 -6.534 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -6.247 -0.752 -5.573 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -6.762 -2.308 -4.880 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -9.532 -2.313 -5.940 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -9.157 -2.650 -4.233 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -10.352 -1.400 -4.651 1.00 0.00 H new ATOM 2635 N GLY B 87 -8.657 2.848 -4.097 1.00 0.00 N ATOM 2636 CA GLY B 87 -9.344 3.834 -4.950 1.00 0.00 C ATOM 2637 C GLY B 87 -8.717 5.226 -4.969 1.00 0.00 C ATOM 2638 O GLY B 87 -8.558 5.795 -6.044 1.00 0.00 O ATOM 0 H GLY B 87 -9.085 2.784 -3.173 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -9.371 3.451 -5.970 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -10.377 3.923 -4.615 1.00 0.00 H new ATOM 2642 N GLU B 88 -8.343 5.769 -3.805 1.00 0.00 N ATOM 2643 CA GLU B 88 -7.478 6.963 -3.701 1.00 0.00 C ATOM 2644 C GLU B 88 -6.094 6.640 -4.304 1.00 0.00 C ATOM 2645 O GLU B 88 -5.385 7.526 -4.802 1.00 0.00 O ATOM 2646 CB GLU B 88 -7.351 7.342 -2.211 1.00 0.00 C ATOM 2647 CG GLU B 88 -6.357 8.468 -1.864 1.00 0.00 C ATOM 2648 CD GLU B 88 -6.738 9.861 -2.369 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -7.928 10.128 -2.643 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -5.859 10.754 -2.349 1.00 0.00 O ATOM 0 H GLU B 88 -8.630 5.395 -2.901 1.00 0.00 H new ATOM 0 HA GLU B 88 -7.906 7.802 -4.250 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -8.337 7.635 -1.850 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -7.061 6.449 -1.657 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -6.247 8.511 -0.780 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -5.381 8.206 -2.273 1.00 0.00 H new ATOM 2657 N LEU B 89 -5.750 5.341 -4.253 1.00 0.00 N ATOM 2658 CA LEU B 89 -4.603 4.654 -4.829 1.00 0.00 C ATOM 2659 C LEU B 89 -3.364 4.930 -3.979 1.00 0.00 C ATOM 2660 O LEU B 89 -3.272 5.911 -3.252 1.00 0.00 O ATOM 2661 CB LEU B 89 -4.445 5.047 -6.321 1.00 0.00 C ATOM 2662 CG LEU B 89 -3.416 4.271 -7.160 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -3.689 2.760 -7.200 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -3.388 4.841 -8.583 1.00 0.00 C ATOM 0 H LEU B 89 -6.343 4.682 -3.748 1.00 0.00 H new ATOM 0 HA LEU B 89 -4.752 3.574 -4.817 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -5.418 4.940 -6.801 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -4.183 6.104 -6.363 1.00 0.00 H new ATOM 0 HG LEU B 89 -2.445 4.397 -6.681 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -2.929 2.269 -7.807 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -3.660 2.358 -6.187 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -4.672 2.579 -7.634 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -2.659 4.293 -9.180 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -4.375 4.742 -9.034 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -3.109 5.894 -8.548 1.00 0.00 H new ATOM 2676 N VAL B 90 -2.326 4.126 -4.147 1.00 0.00 N ATOM 2677 CA VAL B 90 -0.984 4.398 -3.605 1.00 0.00 C ATOM 2678 C VAL B 90 -0.401 5.768 -3.997 1.00 0.00 C ATOM 2679 O VAL B 90 0.694 6.113 -3.553 1.00 0.00 O ATOM 2680 CB VAL B 90 0.031 3.351 -4.070 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -0.249 2.002 -3.385 1.00 0.00 C ATOM 2682 CG2 VAL B 90 0.026 3.193 -5.603 1.00 0.00 C ATOM 0 H VAL B 90 -2.382 3.252 -4.669 1.00 0.00 H new ATOM 0 HA VAL B 90 -1.136 4.373 -2.526 1.00 0.00 H new ATOM 0 HB VAL B 90 1.024 3.697 -3.782 1.00 0.00 H new ATOM 0 HG11 VAL B 90 0.479 1.264 -3.723 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -0.171 2.120 -2.304 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -1.253 1.665 -3.642 1.00 0.00 H new ATOM 0 HG21 VAL B 90 0.760 2.441 -5.894 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -0.965 2.880 -5.933 1.00 0.00 H new ATOM 0 HG23 VAL B 90 0.279 4.146 -6.068 1.00 0.00 H new ATOM 2692 N GLN B 91 -1.079 6.532 -4.868 1.00 0.00 N ATOM 2693 CA GLN B 91 -0.875 7.960 -5.125 1.00 0.00 C ATOM 2694 C GLN B 91 0.415 8.284 -5.895 1.00 0.00 C ATOM 2695 O GLN B 91 0.493 9.337 -6.517 1.00 0.00 O ATOM 2696 CB GLN B 91 -0.931 8.736 -3.800 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.347 9.195 -3.396 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.961 10.303 -4.240 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.582 11.460 -4.160 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.904 9.985 -5.101 1.00 0.00 N ATOM 0 H GLN B 91 -1.827 6.144 -5.443 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.686 8.276 -5.781 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.524 8.109 -3.007 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.286 9.611 -3.877 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -3.010 8.331 -3.431 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.315 9.531 -2.360 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.225 9.019 -5.172 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.314 10.704 -5.697 1.00 0.00 H new ATOM 2709 N VAL B 92 1.399 7.387 -5.901 1.00 0.00 N ATOM 2710 CA VAL B 92 2.747 7.429 -6.506 1.00 0.00 C ATOM 2711 C VAL B 92 2.749 7.472 -8.043 1.00 0.00 C ATOM 2712 O VAL B 92 3.541 6.828 -8.716 1.00 0.00 O ATOM 2713 CB VAL B 92 3.538 6.228 -5.923 1.00 0.00 C ATOM 2714 CG1 VAL B 92 3.031 4.909 -6.531 1.00 0.00 C ATOM 2715 CG2 VAL B 92 5.066 6.349 -5.988 1.00 0.00 C ATOM 0 H VAL B 92 1.261 6.497 -5.423 1.00 0.00 H new ATOM 0 HA VAL B 92 3.234 8.369 -6.246 1.00 0.00 H new ATOM 0 HB VAL B 92 3.332 6.234 -4.853 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.595 4.075 -6.113 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.973 4.784 -6.299 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.165 4.932 -7.612 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.520 5.458 -5.555 1.00 0.00 H new ATOM 0 HG22 VAL B 92 5.379 6.447 -7.027 1.00 0.00 H new ATOM 0 HG23 VAL B 92 5.386 7.228 -5.428 1.00 0.00 H new ATOM 2725 N VAL B 93 1.806 8.223 -8.604 1.00 0.00 N ATOM 2726 CA VAL B 93 1.657 8.508 -10.037 1.00 0.00 C ATOM 2727 C VAL B 93 1.184 7.262 -10.828 1.00 0.00 C ATOM 2728 O VAL B 93 1.294 7.220 -12.047 1.00 0.00 O ATOM 2729 CB VAL B 93 2.932 9.178 -10.643 1.00 0.00 C ATOM 2730 CG1 VAL B 93 2.527 10.096 -11.807 1.00 0.00 C ATOM 2731 CG2 VAL B 93 3.677 10.117 -9.659 1.00 0.00 C ATOM 0 H VAL B 93 1.083 8.676 -8.045 1.00 0.00 H new ATOM 0 HA VAL B 93 0.862 9.247 -10.138 1.00 0.00 H new ATOM 0 HB VAL B 93 3.576 8.346 -10.928 1.00 0.00 H new ATOM 0 HG11 VAL B 93 3.417 10.563 -12.229 1.00 0.00 H new ATOM 0 HG12 VAL B 93 2.026 9.508 -12.576 1.00 0.00 H new ATOM 0 HG13 VAL B 93 1.850 10.869 -11.442 1.00 0.00 H new ATOM 0 HG21 VAL B 93 4.550 10.543 -10.153 1.00 0.00 H new ATOM 0 HG22 VAL B 93 3.009 10.920 -9.346 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.996 9.549 -8.785 1.00 0.00 H new ATOM 2741 N LEU B 94 0.644 6.271 -10.094 1.00 0.00 N ATOM 2742 CA LEU B 94 0.311 4.890 -10.482 1.00 0.00 C ATOM 2743 C LEU B 94 1.603 4.071 -10.608 1.00 0.00 C ATOM 2744 O LEU B 94 2.373 4.249 -11.544 1.00 0.00 O ATOM 2745 CB LEU B 94 -0.586 4.805 -11.740 1.00 0.00 C ATOM 2746 CG LEU B 94 -0.887 3.369 -12.227 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -1.582 2.486 -11.178 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -1.769 3.436 -13.483 1.00 0.00 C ATOM 0 H LEU B 94 0.407 6.436 -9.116 1.00 0.00 H new ATOM 0 HA LEU B 94 -0.300 4.453 -9.692 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -1.530 5.308 -11.530 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -0.105 5.355 -12.549 1.00 0.00 H new ATOM 0 HG LEU B 94 0.078 2.907 -12.436 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -1.759 1.495 -11.596 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -0.947 2.400 -10.296 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -2.534 2.936 -10.897 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -1.984 2.426 -13.831 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -2.703 3.945 -13.245 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -1.246 3.985 -14.266 1.00 0.00 H new ATOM 2760 N ALA B 95 1.836 3.161 -9.659 1.00 0.00 N ATOM 2761 CA ALA B 95 2.979 2.255 -9.707 1.00 0.00 C ATOM 2762 C ALA B 95 2.869 1.194 -10.822 1.00 0.00 C ATOM 2763 O ALA B 95 1.808 0.585 -10.990 1.00 0.00 O ATOM 2764 CB ALA B 95 3.205 1.634 -8.328 1.00 0.00 C ATOM 0 H ALA B 95 1.240 3.034 -8.841 1.00 0.00 H new ATOM 0 HA ALA B 95 3.858 2.843 -9.971 1.00 0.00 H new ATOM 0 HB1 ALA B 95 4.059 0.958 -8.369 1.00 0.00 H new ATOM 0 HB2 ALA B 95 3.400 2.423 -7.601 1.00 0.00 H new ATOM 0 HB3 ALA B 95 2.316 1.078 -8.029 1.00 0.00 H new