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 81 HIS : no HE2:sc= 0.109 K(o=0.25,f=-5.2!) USER MOD Set 1.2: B 91 GLN : amide:sc= 0.146 K(o=0.25,f=-3.2) USER MOD Set 2.1: A 91 GLN : amide:sc= 0.347 K(o=-1,f=-4.2) USER MOD Set 2.2: B 81 HIS : no HE2:sc= -1.38 K(o=-1,f=-2.7) USER MOD Set 3.1: A 102 CYS SG : rot 179:sc= 0.306 USER MOD Set 3.2: B 57 CYS SG : rot -46:sc= 0.974 USER MOD Set 3.3: B 61 CYS SG : rot 7:sc= 0.828 USER MOD Set 4.1: B 39 GLN : amide:sc= 0.975 K(o=0.74,f=-2.8!) USER MOD Set 4.2: B 43 HIS : no HE2:sc= -0.236 K(o=0.74,f=-0.093) USER MOD Set 5.1: A 57 CYS SG : rot 180:sc= 1.45 USER MOD Set 5.2: A 61 CYS SG : rot 104:sc= 0.615 USER MOD Set 6.1: A 39 GLN : amide:sc= -0.329 K(o=-0.38,f=-8!) USER MOD Set 6.2: A 43 HIS : no HE2:sc= -0.0463 K(o=-0.38,f=-2.2) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 44:sc= 0.732 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.0305 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.0466 K(o=-0.047,f=-1.6) USER MOD Single : A 52 SER OG : rot 92:sc= 1.28 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 HIS : no HD1:sc= -0.418 K(o=-0.42,f=-1.1) USER MOD Single : A 56 SER OG : rot 63:sc= 1.44 USER MOD Single : A 67 THR OG1 : rot 79:sc= 0.827 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.368 K(o=0.37,f=-3.6!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -65:sc= 1.26 USER MOD Single : A 98 THR OG1 : rot 72:sc= 0.834 USER MOD Single : A 100 GLN : amide:sc= -0.361 K(o=-0.36,f=-1) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 CYS SG : rot 180:sc= 0 USER MOD Single : B 35 CYS SG : rot 60:sc= 0.755 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 47 THR OG1 : rot 180:sc= -0.0328 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 ASN : amide:sc= 0.0102 K(o=0.01,f=-3.3!) USER MOD Single : B 52 SER OG : rot 77:sc= 1.2 USER MOD Single : B 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 54 HIS : no HD1:sc= -0.841 X(o=-0.84,f=-0.62) USER MOD Single : B 56 SER OG : rot 72:sc= 1.44 USER MOD Single : B 67 THR OG1 : rot 145:sc= 0.583 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot -80:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 7.600 -1.163 -8.728 1.00 0.00 N ATOM 12 CA LEU A 11 6.532 -0.619 -7.891 1.00 0.00 C ATOM 13 C LEU A 11 6.113 -1.641 -6.811 1.00 0.00 C ATOM 14 O LEU A 11 5.638 -1.256 -5.744 1.00 0.00 O ATOM 15 CB LEU A 11 5.383 -0.121 -8.782 1.00 0.00 C ATOM 16 CG LEU A 11 5.537 1.319 -9.325 1.00 0.00 C ATOM 17 CD1 LEU A 11 5.572 2.376 -8.210 1.00 0.00 C ATOM 18 CD2 LEU A 11 6.747 1.508 -10.252 1.00 0.00 C ATOM 0 HA LEU A 11 6.885 0.250 -7.336 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.282 -0.801 -9.628 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.455 -0.179 -8.214 1.00 0.00 H new ATOM 0 HG LEU A 11 4.638 1.471 -9.923 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.681 3.367 -8.651 1.00 0.00 H new ATOM 0 HD12 LEU A 11 4.644 2.333 -7.639 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.415 2.179 -7.548 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.787 2.543 -10.592 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.662 1.268 -9.710 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.652 0.847 -11.113 1.00 0.00 H new ATOM 30 N ALA A 12 6.421 -2.929 -6.995 1.00 0.00 N ATOM 31 CA ALA A 12 6.286 -3.942 -5.943 1.00 0.00 C ATOM 32 C ALA A 12 7.221 -3.699 -4.733 1.00 0.00 C ATOM 33 O ALA A 12 6.790 -3.811 -3.581 1.00 0.00 O ATOM 34 CB ALA A 12 6.555 -5.296 -6.589 1.00 0.00 C ATOM 0 H ALA A 12 6.771 -3.299 -7.879 1.00 0.00 H new ATOM 0 HA ALA A 12 5.279 -3.895 -5.528 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.465 -6.081 -5.839 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.831 -5.470 -7.385 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.562 -5.307 -7.006 1.00 0.00 H new ATOM 40 N ARG A 13 8.491 -3.318 -4.975 1.00 0.00 N ATOM 41 CA ARG A 13 9.425 -2.916 -3.896 1.00 0.00 C ATOM 42 C ARG A 13 8.866 -1.699 -3.127 1.00 0.00 C ATOM 43 O ARG A 13 8.876 -1.696 -1.892 1.00 0.00 O ATOM 44 CB ARG A 13 10.837 -2.580 -4.435 1.00 0.00 C ATOM 45 CG ARG A 13 11.689 -3.751 -4.978 1.00 0.00 C ATOM 46 CD ARG A 13 12.747 -4.323 -4.014 1.00 0.00 C ATOM 47 NE ARG A 13 13.745 -5.139 -4.746 1.00 0.00 N ATOM 48 CZ ARG A 13 15.078 -5.085 -4.625 1.00 0.00 C ATOM 49 NH1 ARG A 13 15.695 -4.400 -3.698 1.00 0.00 N ATOM 50 NH2 ARG A 13 15.879 -5.709 -5.458 1.00 0.00 N ATOM 0 H ARG A 13 8.897 -3.279 -5.910 1.00 0.00 H new ATOM 0 HA ARG A 13 9.518 -3.769 -3.224 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.727 -1.845 -5.233 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.398 -2.099 -3.634 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.017 -4.559 -5.268 1.00 0.00 H new ATOM 0 HG3 ARG A 13 12.195 -3.416 -5.884 1.00 0.00 H new ATOM 0 HD2 ARG A 13 13.249 -3.507 -3.494 1.00 0.00 H new ATOM 0 HD3 ARG A 13 12.260 -4.933 -3.254 1.00 0.00 H new ATOM 0 HE ARG A 13 13.376 -5.815 -5.415 1.00 0.00 H new ATOM 0 HH11 ARG A 13 15.157 -3.867 -3.015 1.00 0.00 H new ATOM 0 HH12 ARG A 13 16.714 -4.399 -3.658 1.00 0.00 H new ATOM 0 HH21 ARG A 13 15.490 -6.256 -6.226 1.00 0.00 H new ATOM 0 HH22 ARG A 13 16.890 -5.647 -5.337 1.00 0.00 H new ATOM 64 N LEU A 14 8.339 -0.705 -3.857 1.00 0.00 N ATOM 65 CA LEU A 14 7.683 0.507 -3.339 1.00 0.00 C ATOM 66 C LEU A 14 6.462 0.186 -2.453 1.00 0.00 C ATOM 67 O LEU A 14 6.332 0.764 -1.376 1.00 0.00 O ATOM 68 CB LEU A 14 7.377 1.405 -4.563 1.00 0.00 C ATOM 69 CG LEU A 14 6.586 2.719 -4.392 1.00 0.00 C ATOM 70 CD1 LEU A 14 5.072 2.490 -4.242 1.00 0.00 C ATOM 71 CD2 LEU A 14 7.130 3.580 -3.253 1.00 0.00 C ATOM 0 H LEU A 14 8.359 -0.725 -4.877 1.00 0.00 H new ATOM 0 HA LEU A 14 8.337 1.050 -2.656 1.00 0.00 H new ATOM 0 HB2 LEU A 14 8.332 1.662 -5.020 1.00 0.00 H new ATOM 0 HB3 LEU A 14 6.833 0.793 -5.283 1.00 0.00 H new ATOM 0 HG LEU A 14 6.732 3.272 -5.320 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.569 3.450 -4.125 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.691 1.986 -5.130 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.883 1.872 -3.364 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.540 4.493 -3.173 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.069 3.026 -2.317 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.170 3.837 -3.455 1.00 0.00 H new ATOM 83 N GLY A 15 5.605 -0.773 -2.821 1.00 0.00 N ATOM 84 CA GLY A 15 4.454 -1.176 -2.001 1.00 0.00 C ATOM 85 C GLY A 15 4.861 -1.824 -0.678 1.00 0.00 C ATOM 86 O GLY A 15 4.184 -1.650 0.336 1.00 0.00 O ATOM 0 H GLY A 15 5.689 -1.292 -3.695 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.837 -0.301 -1.796 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.838 -1.875 -2.567 1.00 0.00 H new ATOM 90 N ARG A 16 6.016 -2.501 -0.646 1.00 0.00 N ATOM 91 CA ARG A 16 6.621 -2.983 0.599 1.00 0.00 C ATOM 92 C ARG A 16 7.225 -1.821 1.397 1.00 0.00 C ATOM 93 O ARG A 16 7.032 -1.734 2.600 1.00 0.00 O ATOM 94 CB ARG A 16 7.687 -4.049 0.308 1.00 0.00 C ATOM 95 CG ARG A 16 7.760 -5.082 1.448 1.00 0.00 C ATOM 96 CD ARG A 16 9.191 -5.602 1.632 1.00 0.00 C ATOM 97 NE ARG A 16 9.226 -6.901 2.320 1.00 0.00 N ATOM 98 CZ ARG A 16 9.109 -7.135 3.628 1.00 0.00 C ATOM 99 NH1 ARG A 16 8.919 -6.219 4.546 1.00 0.00 N ATOM 100 NH2 ARG A 16 9.185 -8.368 4.059 1.00 0.00 N ATOM 0 H ARG A 16 6.555 -2.729 -1.481 1.00 0.00 H new ATOM 0 HA ARG A 16 5.836 -3.439 1.202 1.00 0.00 H new ATOM 0 HB2 ARG A 16 7.456 -4.553 -0.630 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.659 -3.572 0.182 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.412 -4.629 2.376 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.092 -5.916 1.231 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.670 -5.696 0.657 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.769 -4.875 2.202 1.00 0.00 H new ATOM 0 HE ARG A 16 9.355 -7.721 1.727 1.00 0.00 H new ATOM 0 HH11 ARG A 16 8.849 -5.237 4.280 1.00 0.00 H new ATOM 0 HH12 ARG A 16 8.841 -6.488 5.527 1.00 0.00 H new ATOM 0 HH21 ARG A 16 9.331 -9.131 3.398 1.00 0.00 H new ATOM 0 HH22 ARG A 16 9.098 -8.566 5.056 1.00 0.00 H new ATOM 114 N ALA A 17 7.894 -0.874 0.731 1.00 0.00 N ATOM 115 CA ALA A 17 8.453 0.319 1.363 1.00 0.00 C ATOM 116 C ALA A 17 7.411 1.157 2.115 1.00 0.00 C ATOM 117 O ALA A 17 7.747 1.742 3.142 1.00 0.00 O ATOM 118 CB ALA A 17 9.196 1.143 0.301 1.00 0.00 C ATOM 0 H ALA A 17 8.063 -0.918 -0.274 1.00 0.00 H new ATOM 0 HA ALA A 17 9.154 -0.004 2.132 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.617 2.036 0.762 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.999 0.544 -0.129 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.500 1.435 -0.486 1.00 0.00 H new ATOM 124 N LEU A 18 6.169 1.181 1.632 1.00 0.00 N ATOM 125 CA LEU A 18 5.026 1.793 2.318 1.00 0.00 C ATOM 126 C LEU A 18 4.514 0.945 3.494 1.00 0.00 C ATOM 127 O LEU A 18 4.262 1.504 4.559 1.00 0.00 O ATOM 128 CB LEU A 18 3.915 2.036 1.284 1.00 0.00 C ATOM 129 CG LEU A 18 4.211 3.228 0.347 1.00 0.00 C ATOM 130 CD1 LEU A 18 3.441 3.046 -0.963 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.814 4.567 0.994 1.00 0.00 C ATOM 0 H LEU A 18 5.922 0.767 0.733 1.00 0.00 H new ATOM 0 HA LEU A 18 5.348 2.738 2.756 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.781 1.135 0.685 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.975 2.216 1.805 1.00 0.00 H new ATOM 0 HG LEU A 18 5.284 3.251 0.155 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.648 3.886 -1.626 1.00 0.00 H new ATOM 0 HD12 LEU A 18 3.754 2.119 -1.443 1.00 0.00 H new ATOM 0 HD13 LEU A 18 2.372 3.004 -0.754 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.036 5.383 0.307 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.747 4.561 1.217 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.377 4.706 1.917 1.00 0.00 H new ATOM 143 N ALA A 19 4.365 -0.376 3.326 1.00 0.00 N ATOM 144 CA ALA A 19 3.792 -1.271 4.352 1.00 0.00 C ATOM 145 C ALA A 19 4.767 -1.792 5.441 1.00 0.00 C ATOM 146 O ALA A 19 4.318 -2.343 6.441 1.00 0.00 O ATOM 147 CB ALA A 19 3.126 -2.443 3.621 1.00 0.00 C ATOM 0 H ALA A 19 4.639 -0.861 2.471 1.00 0.00 H new ATOM 0 HA ALA A 19 3.084 -0.670 4.923 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.691 -3.126 4.350 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.342 -2.064 2.965 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.871 -2.972 3.027 1.00 0.00 H new ATOM 153 N ASP A 20 6.078 -1.652 5.233 1.00 0.00 N ATOM 154 CA ASP A 20 7.156 -2.232 6.030 1.00 0.00 C ATOM 155 C ASP A 20 7.051 -1.987 7.547 1.00 0.00 C ATOM 156 O ASP A 20 6.685 -0.881 7.964 1.00 0.00 O ATOM 157 CB ASP A 20 8.481 -1.609 5.568 1.00 0.00 C ATOM 158 CG ASP A 20 9.341 -2.404 4.596 1.00 0.00 C ATOM 159 OD1 ASP A 20 8.955 -3.491 4.122 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.461 -1.898 4.344 1.00 0.00 O ATOM 0 H ASP A 20 6.435 -1.096 4.456 1.00 0.00 H new ATOM 0 HA ASP A 20 7.092 -3.309 5.875 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.255 -0.648 5.106 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.081 -1.404 6.454 1.00 0.00 H new ATOM 165 N PRO A 21 7.549 -2.942 8.362 1.00 0.00 N ATOM 166 CA PRO A 21 7.433 -2.971 9.823 1.00 0.00 C ATOM 167 C PRO A 21 7.833 -1.643 10.473 1.00 0.00 C ATOM 168 O PRO A 21 7.010 -0.935 11.054 1.00 0.00 O ATOM 169 CB PRO A 21 8.345 -4.135 10.264 1.00 0.00 C ATOM 170 CG PRO A 21 9.355 -4.243 9.117 1.00 0.00 C ATOM 171 CD PRO A 21 8.428 -4.026 7.935 1.00 0.00 C ATOM 0 HA PRO A 21 6.401 -3.118 10.141 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.836 -3.924 11.214 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.783 -5.060 10.394 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.138 -3.487 9.178 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.850 -5.214 9.087 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.984 -3.757 7.037 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.863 -4.928 7.702 1.00 0.00 H new ATOM 179 N THR A 22 9.111 -1.282 10.341 1.00 0.00 N ATOM 180 CA THR A 22 9.641 -0.003 10.805 1.00 0.00 C ATOM 181 C THR A 22 9.385 1.113 9.799 1.00 0.00 C ATOM 182 O THR A 22 9.188 2.247 10.222 1.00 0.00 O ATOM 183 CB THR A 22 11.125 -0.175 11.136 1.00 0.00 C ATOM 184 OG1 THR A 22 11.189 -1.052 12.234 1.00 0.00 O ATOM 185 CG2 THR A 22 11.829 1.121 11.541 1.00 0.00 C ATOM 0 H THR A 22 9.813 -1.878 9.903 1.00 0.00 H new ATOM 0 HA THR A 22 9.118 0.302 11.712 1.00 0.00 H new ATOM 0 HB THR A 22 11.627 -0.539 10.239 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.126 -1.196 12.484 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.877 0.913 11.759 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.764 1.841 10.725 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.349 1.534 12.428 1.00 0.00 H new ATOM 193 N ARG A 23 9.349 0.845 8.485 1.00 0.00 N ATOM 194 CA ARG A 23 9.293 1.924 7.482 1.00 0.00 C ATOM 195 C ARG A 23 7.933 2.641 7.394 1.00 0.00 C ATOM 196 O ARG A 23 7.918 3.851 7.179 1.00 0.00 O ATOM 197 CB ARG A 23 9.726 1.432 6.098 1.00 0.00 C ATOM 198 CG ARG A 23 10.841 2.292 5.504 1.00 0.00 C ATOM 199 CD ARG A 23 11.007 2.069 3.998 1.00 0.00 C ATOM 200 NE ARG A 23 11.275 0.673 3.622 1.00 0.00 N ATOM 201 CZ ARG A 23 11.778 0.271 2.465 1.00 0.00 C ATOM 202 NH1 ARG A 23 12.162 1.118 1.539 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.861 -1.014 2.212 1.00 0.00 N ATOM 0 H ARG A 23 9.357 -0.097 8.094 1.00 0.00 H new ATOM 0 HA ARG A 23 10.005 2.668 7.837 1.00 0.00 H new ATOM 0 HB2 ARG A 23 10.066 0.399 6.171 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.867 1.438 5.427 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.625 3.344 5.692 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.780 2.065 6.008 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.102 2.403 3.491 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.824 2.694 3.637 1.00 0.00 H new ATOM 0 HE ARG A 23 11.055 -0.047 4.311 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.077 2.122 1.699 1.00 0.00 H new ATOM 0 HH12 ARG A 23 12.545 0.773 0.659 1.00 0.00 H new ATOM 0 HH21 ARG A 23 11.540 -1.692 2.903 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.247 -1.335 1.324 1.00 0.00 H new ATOM 217 N CYS A 24 6.818 1.948 7.643 1.00 0.00 N ATOM 218 CA CYS A 24 5.493 2.562 7.788 1.00 0.00 C ATOM 219 C CYS A 24 5.482 3.539 8.977 1.00 0.00 C ATOM 220 O CYS A 24 5.175 4.722 8.836 1.00 0.00 O ATOM 221 CB CYS A 24 4.466 1.425 7.936 1.00 0.00 C ATOM 222 SG CYS A 24 2.792 2.114 7.864 1.00 0.00 S ATOM 0 H CYS A 24 6.809 0.934 7.751 1.00 0.00 H new ATOM 0 HA CYS A 24 5.233 3.156 6.912 1.00 0.00 H new ATOM 0 HB2 CYS A 24 4.603 0.690 7.143 1.00 0.00 H new ATOM 0 HB3 CYS A 24 4.617 0.905 8.882 1.00 0.00 H new ATOM 0 HG CYS A 24 1.923 1.155 7.987 1.00 0.00 H new ATOM 228 N ARG A 25 5.954 3.071 10.134 1.00 0.00 N ATOM 229 CA ARG A 25 6.139 3.874 11.351 1.00 0.00 C ATOM 230 C ARG A 25 7.071 5.087 11.139 1.00 0.00 C ATOM 231 O ARG A 25 6.727 6.200 11.520 1.00 0.00 O ATOM 232 CB ARG A 25 6.631 2.940 12.463 1.00 0.00 C ATOM 233 CG ARG A 25 5.470 2.049 12.959 1.00 0.00 C ATOM 234 CD ARG A 25 5.901 0.955 13.944 1.00 0.00 C ATOM 235 NE ARG A 25 4.791 0.016 14.205 1.00 0.00 N ATOM 236 CZ ARG A 25 4.897 -1.189 14.755 1.00 0.00 C ATOM 237 NH1 ARG A 25 6.038 -1.628 15.242 1.00 0.00 N ATOM 238 NH2 ARG A 25 3.844 -1.978 14.796 1.00 0.00 N ATOM 0 H ARG A 25 6.227 2.096 10.257 1.00 0.00 H new ATOM 0 HA ARG A 25 5.185 4.316 11.638 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.445 2.317 12.092 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.030 3.526 13.291 1.00 0.00 H new ATOM 0 HG2 ARG A 25 4.720 2.679 13.437 1.00 0.00 H new ATOM 0 HG3 ARG A 25 4.991 1.581 12.099 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.755 0.412 13.540 1.00 0.00 H new ATOM 0 HD3 ARG A 25 6.226 1.410 14.880 1.00 0.00 H new ATOM 0 HE ARG A 25 3.855 0.321 13.938 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.870 -1.039 15.203 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.091 -2.557 15.659 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.955 -1.663 14.407 1.00 0.00 H new ATOM 0 HH22 ARG A 25 3.917 -2.904 15.216 1.00 0.00 H new ATOM 252 N ILE A 26 8.210 4.891 10.472 1.00 0.00 N ATOM 253 CA ILE A 26 9.100 5.980 9.993 1.00 0.00 C ATOM 254 C ILE A 26 8.307 7.009 9.194 1.00 0.00 C ATOM 255 O ILE A 26 8.371 8.186 9.528 1.00 0.00 O ATOM 256 CB ILE A 26 10.263 5.419 9.137 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.241 4.605 10.002 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.004 6.464 8.277 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.417 5.370 10.611 1.00 0.00 C ATOM 0 H ILE A 26 8.556 3.960 10.240 1.00 0.00 H new ATOM 0 HA ILE A 26 9.528 6.468 10.869 1.00 0.00 H new ATOM 0 HB ILE A 26 9.789 4.756 8.413 1.00 0.00 H new ATOM 0 HG12 ILE A 26 10.677 4.146 10.814 1.00 0.00 H new ATOM 0 HG13 ILE A 26 11.641 3.794 9.393 1.00 0.00 H new ATOM 0 HG21 ILE A 26 11.800 5.975 7.715 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.303 6.928 7.584 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.434 7.229 8.924 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.031 4.686 11.197 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.019 5.806 9.814 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.040 6.163 11.257 1.00 0.00 H new ATOM 271 N LEU A 27 7.560 6.573 8.173 1.00 0.00 N ATOM 272 CA LEU A 27 6.745 7.483 7.359 1.00 0.00 C ATOM 273 C LEU A 27 5.764 8.285 8.216 1.00 0.00 C ATOM 274 O LEU A 27 5.781 9.508 8.107 1.00 0.00 O ATOM 275 CB LEU A 27 6.017 6.729 6.225 1.00 0.00 C ATOM 276 CG LEU A 27 6.885 6.391 4.998 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.090 5.477 4.057 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.281 7.643 4.198 1.00 0.00 C ATOM 0 H LEU A 27 7.503 5.595 7.890 1.00 0.00 H new ATOM 0 HA LEU A 27 7.426 8.196 6.894 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.611 5.802 6.629 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.170 7.331 5.896 1.00 0.00 H new ATOM 0 HG LEU A 27 7.790 5.910 5.368 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.699 5.234 3.186 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.823 4.559 4.581 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.183 5.988 3.734 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.892 7.351 3.344 1.00 0.00 H new ATOM 0 HD22 LEU A 27 6.382 8.149 3.845 1.00 0.00 H new ATOM 0 HD23 LEU A 27 7.850 8.318 4.837 1.00 0.00 H new ATOM 290 N VAL A 28 4.956 7.643 9.071 1.00 0.00 N ATOM 291 CA VAL A 28 3.970 8.383 9.898 1.00 0.00 C ATOM 292 C VAL A 28 4.636 9.387 10.840 1.00 0.00 C ATOM 293 O VAL A 28 4.149 10.505 10.990 1.00 0.00 O ATOM 294 CB VAL A 28 2.925 7.525 10.662 1.00 0.00 C ATOM 295 CG1 VAL A 28 2.389 6.360 9.818 1.00 0.00 C ATOM 296 CG2 VAL A 28 3.386 6.952 12.015 1.00 0.00 C ATOM 0 H VAL A 28 4.958 6.633 9.213 1.00 0.00 H new ATOM 0 HA VAL A 28 3.389 8.920 9.148 1.00 0.00 H new ATOM 0 HB VAL A 28 2.140 8.253 10.867 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.662 5.793 10.400 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.909 6.751 8.921 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.214 5.707 9.533 1.00 0.00 H new ATOM 0 HG21 VAL A 28 2.577 6.371 12.459 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.253 6.309 11.862 1.00 0.00 H new ATOM 0 HG23 VAL A 28 3.655 7.770 12.684 1.00 0.00 H new ATOM 306 N ALA A 29 5.786 9.024 11.411 1.00 0.00 N ATOM 307 CA ALA A 29 6.551 9.921 12.262 1.00 0.00 C ATOM 308 C ALA A 29 7.280 11.025 11.478 1.00 0.00 C ATOM 309 O ALA A 29 7.714 11.998 12.092 1.00 0.00 O ATOM 310 CB ALA A 29 7.490 9.055 13.107 1.00 0.00 C ATOM 0 H ALA A 29 6.207 8.102 11.294 1.00 0.00 H new ATOM 0 HA ALA A 29 5.878 10.478 12.914 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.083 9.694 13.761 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.902 8.363 13.711 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.153 8.491 12.451 1.00 0.00 H new ATOM 316 N LEU A 30 7.440 10.932 10.149 1.00 0.00 N ATOM 317 CA LEU A 30 8.036 12.002 9.383 1.00 0.00 C ATOM 318 C LEU A 30 7.102 13.193 9.206 1.00 0.00 C ATOM 319 O LEU A 30 7.604 14.312 9.295 1.00 0.00 O ATOM 320 CB LEU A 30 8.452 11.430 8.043 1.00 0.00 C ATOM 321 CG LEU A 30 9.466 12.325 7.331 1.00 0.00 C ATOM 322 CD1 LEU A 30 10.740 12.638 8.134 1.00 0.00 C ATOM 323 CD2 LEU A 30 9.838 11.499 6.123 1.00 0.00 C ATOM 0 H LEU A 30 7.161 10.122 9.596 1.00 0.00 H new ATOM 0 HA LEU A 30 8.900 12.389 9.924 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.882 10.439 8.189 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.572 11.306 7.412 1.00 0.00 H new ATOM 0 HG LEU A 30 9.032 13.305 7.133 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.394 13.279 7.543 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.471 13.149 9.059 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.259 11.709 8.370 1.00 0.00 H new ATOM 0 HD21 LEU A 30 10.570 12.040 5.523 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.266 10.551 6.448 1.00 0.00 H new ATOM 0 HD23 LEU A 30 8.947 11.309 5.524 1.00 0.00 H new ATOM 335 N LEU A 31 5.800 12.947 8.965 1.00 0.00 N ATOM 336 CA LEU A 31 4.743 13.960 8.869 1.00 0.00 C ATOM 337 C LEU A 31 4.760 14.895 10.098 1.00 0.00 C ATOM 338 O LEU A 31 4.777 16.107 9.918 1.00 0.00 O ATOM 339 CB LEU A 31 3.390 13.225 8.709 1.00 0.00 C ATOM 340 CG LEU A 31 2.665 13.272 7.337 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.355 12.518 7.548 1.00 0.00 C ATOM 342 CD2 LEU A 31 2.378 14.700 6.850 1.00 0.00 C ATOM 0 H LEU A 31 5.447 12.000 8.827 1.00 0.00 H new ATOM 0 HA LEU A 31 4.906 14.600 8.002 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.554 12.177 8.959 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.706 13.628 9.456 1.00 0.00 H new ATOM 0 HG LEU A 31 3.297 12.829 6.567 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.786 12.509 6.618 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.570 11.493 7.852 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.772 13.012 8.325 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.870 14.661 5.886 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.743 15.211 7.574 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.317 15.244 6.744 1.00 0.00 H new ATOM 354 N ASP A 32 4.855 14.336 11.310 1.00 0.00 N ATOM 355 CA ASP A 32 4.964 15.048 12.602 1.00 0.00 C ATOM 356 C ASP A 32 6.430 15.421 12.978 1.00 0.00 C ATOM 357 O ASP A 32 6.742 15.769 14.120 1.00 0.00 O ATOM 358 CB ASP A 32 4.293 14.176 13.687 1.00 0.00 C ATOM 359 CG ASP A 32 2.756 14.118 13.568 1.00 0.00 C ATOM 360 OD1 ASP A 32 2.257 13.303 12.758 1.00 0.00 O ATOM 361 OD2 ASP A 32 2.090 14.871 14.315 1.00 0.00 O ATOM 0 H ASP A 32 4.859 13.323 11.429 1.00 0.00 H new ATOM 0 HA ASP A 32 4.450 16.006 12.519 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.692 13.164 13.626 1.00 0.00 H new ATOM 0 HB3 ASP A 32 4.559 14.565 14.670 1.00 0.00 H new ATOM 366 N GLY A 33 7.363 15.296 12.028 1.00 0.00 N ATOM 367 CA GLY A 33 8.811 15.477 12.187 1.00 0.00 C ATOM 368 C GLY A 33 9.430 16.483 11.225 1.00 0.00 C ATOM 369 O GLY A 33 9.561 17.659 11.549 1.00 0.00 O ATOM 0 H GLY A 33 7.113 15.051 11.070 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.015 15.797 13.209 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.302 14.513 12.051 1.00 0.00 H new ATOM 373 N VAL A 34 9.915 15.973 10.089 1.00 0.00 N ATOM 374 CA VAL A 34 10.789 16.652 9.104 1.00 0.00 C ATOM 375 C VAL A 34 11.823 17.612 9.715 1.00 0.00 C ATOM 376 O VAL A 34 12.074 18.693 9.185 1.00 0.00 O ATOM 377 CB VAL A 34 10.000 17.260 7.928 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.360 16.138 7.117 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.919 18.258 8.364 1.00 0.00 C ATOM 0 H VAL A 34 9.700 15.017 9.807 1.00 0.00 H new ATOM 0 HA VAL A 34 11.399 15.855 8.679 1.00 0.00 H new ATOM 0 HB VAL A 34 10.715 17.820 7.326 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.801 16.564 6.284 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.138 15.478 6.732 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.684 15.569 7.754 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.405 18.645 7.484 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.201 17.756 9.012 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.382 19.083 8.906 1.00 0.00 H new ATOM 389 N CYS A 35 12.429 17.186 10.830 1.00 0.00 N ATOM 390 CA CYS A 35 13.503 17.912 11.510 1.00 0.00 C ATOM 391 C CYS A 35 14.864 17.535 10.925 1.00 0.00 C ATOM 392 O CYS A 35 15.193 17.950 9.836 1.00 0.00 O ATOM 393 CB CYS A 35 13.379 17.718 13.031 1.00 0.00 C ATOM 394 SG CYS A 35 11.858 18.484 13.650 1.00 0.00 S ATOM 0 H CYS A 35 12.180 16.311 11.291 1.00 0.00 H new ATOM 0 HA CYS A 35 13.409 18.984 11.335 1.00 0.00 H new ATOM 0 HB2 CYS A 35 13.380 16.654 13.269 1.00 0.00 H new ATOM 0 HB3 CYS A 35 14.243 18.157 13.531 1.00 0.00 H new ATOM 0 HG CYS A 35 10.873 18.200 12.851 1.00 0.00 H new ATOM 400 N TYR A 36 15.658 16.700 11.586 1.00 0.00 N ATOM 401 CA TYR A 36 17.060 16.466 11.182 1.00 0.00 C ATOM 402 C TYR A 36 17.341 15.039 10.645 1.00 0.00 C ATOM 403 O TYR A 36 16.498 14.146 10.787 1.00 0.00 O ATOM 404 CB TYR A 36 18.002 16.901 12.329 1.00 0.00 C ATOM 405 CG TYR A 36 17.343 17.655 13.472 1.00 0.00 C ATOM 406 CD1 TYR A 36 17.021 19.018 13.324 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.960 16.964 14.639 1.00 0.00 C ATOM 408 CE1 TYR A 36 16.328 19.694 14.341 1.00 0.00 C ATOM 409 CE2 TYR A 36 16.246 17.629 15.652 1.00 0.00 C ATOM 410 CZ TYR A 36 15.932 19.001 15.508 1.00 0.00 C ATOM 411 OH TYR A 36 15.224 19.646 16.472 1.00 0.00 O ATOM 0 H TYR A 36 15.365 16.169 12.406 1.00 0.00 H new ATOM 0 HA TYR A 36 17.266 17.091 10.313 1.00 0.00 H new ATOM 0 HB2 TYR A 36 18.485 16.012 12.735 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.789 17.528 11.910 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.308 19.545 12.426 1.00 0.00 H new ATOM 0 HD2 TYR A 36 17.215 15.921 14.756 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.097 20.743 14.232 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.938 17.093 16.538 1.00 0.00 H new ATOM 0 HH TYR A 36 15.031 19.026 17.206 1.00 0.00 H new ATOM 421 N PRO A 37 18.514 14.755 10.035 1.00 0.00 N ATOM 422 CA PRO A 37 18.784 13.449 9.440 1.00 0.00 C ATOM 423 C PRO A 37 18.873 12.385 10.537 1.00 0.00 C ATOM 424 O PRO A 37 19.782 12.410 11.360 1.00 0.00 O ATOM 425 CB PRO A 37 20.082 13.607 8.642 1.00 0.00 C ATOM 426 CG PRO A 37 20.807 14.737 9.367 1.00 0.00 C ATOM 427 CD PRO A 37 19.660 15.631 9.835 1.00 0.00 C ATOM 0 HA PRO A 37 17.988 13.115 8.774 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.668 12.688 8.642 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.885 13.859 7.600 1.00 0.00 H new ATOM 0 HG2 PRO A 37 21.398 14.366 10.204 1.00 0.00 H new ATOM 0 HG3 PRO A 37 21.490 15.269 8.705 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.921 16.147 10.759 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.438 16.399 9.094 1.00 0.00 H new ATOM 435 N GLY A 38 17.888 11.481 10.569 1.00 0.00 N ATOM 436 CA GLY A 38 17.768 10.446 11.600 1.00 0.00 C ATOM 437 C GLY A 38 16.998 10.885 12.849 1.00 0.00 C ATOM 438 O GLY A 38 16.917 10.117 13.802 1.00 0.00 O ATOM 0 H GLY A 38 17.144 11.448 9.872 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.272 9.576 11.169 1.00 0.00 H new ATOM 0 HA3 GLY A 38 18.767 10.128 11.897 1.00 0.00 H new ATOM 442 N GLN A 39 16.383 12.074 12.859 1.00 0.00 N ATOM 443 CA GLN A 39 15.571 12.611 13.971 1.00 0.00 C ATOM 444 C GLN A 39 14.410 11.721 14.414 1.00 0.00 C ATOM 445 O GLN A 39 13.945 11.858 15.543 1.00 0.00 O ATOM 446 CB GLN A 39 15.017 13.984 13.563 1.00 0.00 C ATOM 447 CG GLN A 39 13.990 13.897 12.401 1.00 0.00 C ATOM 448 CD GLN A 39 12.532 14.179 12.733 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.766 14.483 11.843 1.00 0.00 O ATOM 450 NE2 GLN A 39 12.091 14.113 13.966 1.00 0.00 N ATOM 0 H GLN A 39 16.436 12.715 12.068 1.00 0.00 H new ATOM 0 HA GLN A 39 16.242 12.672 14.828 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.543 14.451 14.427 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.843 14.630 13.265 1.00 0.00 H new ATOM 0 HG2 GLN A 39 14.300 14.596 11.624 1.00 0.00 H new ATOM 0 HG3 GLN A 39 14.050 12.897 11.972 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.727 13.858 14.722 1.00 0.00 H new ATOM 0 HE22 GLN A 39 11.112 14.316 14.169 1.00 0.00 H new ATOM 459 N LEU A 40 13.949 10.819 13.544 1.00 0.00 N ATOM 460 CA LEU A 40 12.906 9.853 13.867 1.00 0.00 C ATOM 461 C LEU A 40 13.349 8.882 14.964 1.00 0.00 C ATOM 462 O LEU A 40 12.498 8.264 15.583 1.00 0.00 O ATOM 463 CB LEU A 40 12.477 9.084 12.612 1.00 0.00 C ATOM 464 CG LEU A 40 12.106 9.983 11.411 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.184 9.880 10.324 1.00 0.00 C ATOM 466 CD2 LEU A 40 10.745 9.558 10.864 1.00 0.00 C ATOM 0 H LEU A 40 14.295 10.741 12.588 1.00 0.00 H new ATOM 0 HA LEU A 40 12.051 10.411 14.248 1.00 0.00 H new ATOM 0 HB2 LEU A 40 13.286 8.416 12.315 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.621 8.457 12.859 1.00 0.00 H new ATOM 0 HG LEU A 40 12.048 11.022 11.735 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.914 10.517 9.482 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.142 10.203 10.730 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.263 8.847 9.987 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.480 10.190 10.017 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.791 8.518 10.541 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.991 9.662 11.644 1.00 0.00 H new ATOM 478 N ALA A 41 14.651 8.773 15.243 1.00 0.00 N ATOM 479 CA ALA A 41 15.156 7.979 16.359 1.00 0.00 C ATOM 480 C ALA A 41 14.674 8.487 17.721 1.00 0.00 C ATOM 481 O ALA A 41 14.562 7.688 18.643 1.00 0.00 O ATOM 482 CB ALA A 41 16.685 7.927 16.257 1.00 0.00 C ATOM 0 H ALA A 41 15.382 9.234 14.700 1.00 0.00 H new ATOM 0 HA ALA A 41 14.752 6.969 16.289 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.085 7.338 17.082 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.971 7.467 15.311 1.00 0.00 H new ATOM 0 HB3 ALA A 41 17.087 8.939 16.305 1.00 0.00 H new ATOM 488 N ALA A 42 14.331 9.776 17.841 1.00 0.00 N ATOM 489 CA ALA A 42 13.638 10.284 19.024 1.00 0.00 C ATOM 490 C ALA A 42 12.155 9.888 18.979 1.00 0.00 C ATOM 491 O ALA A 42 11.651 9.295 19.926 1.00 0.00 O ATOM 492 CB ALA A 42 13.841 11.803 19.112 1.00 0.00 C ATOM 0 H ALA A 42 14.524 10.483 17.132 1.00 0.00 H new ATOM 0 HA ALA A 42 14.054 9.839 19.928 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.327 12.188 19.992 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.906 12.024 19.188 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.435 12.277 18.218 1.00 0.00 H new ATOM 498 N HIS A 43 11.478 10.147 17.853 1.00 0.00 N ATOM 499 CA HIS A 43 10.056 9.813 17.680 1.00 0.00 C ATOM 500 C HIS A 43 9.720 8.319 17.908 1.00 0.00 C ATOM 501 O HIS A 43 8.646 7.998 18.418 1.00 0.00 O ATOM 502 CB HIS A 43 9.633 10.193 16.255 1.00 0.00 C ATOM 503 CG HIS A 43 9.497 11.657 15.943 1.00 0.00 C ATOM 504 ND1 HIS A 43 9.208 12.681 16.846 1.00 0.00 N ATOM 505 CD2 HIS A 43 9.302 12.117 14.678 1.00 0.00 C ATOM 506 CE1 HIS A 43 8.790 13.716 16.097 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.818 13.402 14.791 1.00 0.00 N ATOM 0 H HIS A 43 11.898 10.593 17.037 1.00 0.00 H new ATOM 0 HA HIS A 43 9.513 10.374 18.440 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.359 9.767 15.563 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.676 9.714 16.048 1.00 0.00 H new ATOM 0 HD1 HIS A 43 9.296 12.650 17.862 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.490 11.578 13.761 1.00 0.00 H new ATOM 0 HE1 HIS A 43 8.474 14.671 16.492 1.00 0.00 H new ATOM 515 N LEU A 44 10.597 7.413 17.459 1.00 0.00 N ATOM 516 CA LEU A 44 10.363 5.968 17.451 1.00 0.00 C ATOM 517 C LEU A 44 11.024 5.236 18.627 1.00 0.00 C ATOM 518 O LEU A 44 10.670 4.085 18.866 1.00 0.00 O ATOM 519 CB LEU A 44 10.881 5.368 16.122 1.00 0.00 C ATOM 520 CG LEU A 44 10.278 5.908 14.809 1.00 0.00 C ATOM 521 CD1 LEU A 44 10.682 5.007 13.644 1.00 0.00 C ATOM 522 CD2 LEU A 44 8.746 5.998 14.827 1.00 0.00 C ATOM 0 H LEU A 44 11.509 7.672 17.083 1.00 0.00 H new ATOM 0 HA LEU A 44 9.287 5.826 17.552 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.960 5.520 16.083 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.712 4.292 16.151 1.00 0.00 H new ATOM 0 HG LEU A 44 10.671 6.918 14.694 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.253 5.393 12.719 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.769 4.987 13.559 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.313 3.997 13.821 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.393 6.386 13.871 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.325 5.006 14.994 1.00 0.00 H new ATOM 0 HD23 LEU A 44 8.430 6.666 15.628 1.00 0.00 H new ATOM 534 N GLY A 45 12.031 5.829 19.283 1.00 0.00 N ATOM 535 CA GLY A 45 12.908 5.152 20.256 1.00 0.00 C ATOM 536 C GLY A 45 13.887 4.160 19.604 1.00 0.00 C ATOM 537 O GLY A 45 14.845 3.712 20.234 1.00 0.00 O ATOM 0 H GLY A 45 12.266 6.813 19.151 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.475 5.902 20.807 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.292 4.621 20.982 1.00 0.00 H new ATOM 541 N LEU A 46 13.693 3.852 18.311 1.00 0.00 N ATOM 542 CA LEU A 46 14.571 3.009 17.508 1.00 0.00 C ATOM 543 C LEU A 46 15.823 3.811 17.178 1.00 0.00 C ATOM 544 O LEU A 46 15.735 4.912 16.645 1.00 0.00 O ATOM 545 CB LEU A 46 13.860 2.553 16.211 1.00 0.00 C ATOM 546 CG LEU A 46 13.020 1.261 16.287 1.00 0.00 C ATOM 547 CD1 LEU A 46 13.888 0.050 16.658 1.00 0.00 C ATOM 548 CD2 LEU A 46 11.831 1.365 17.248 1.00 0.00 C ATOM 0 H LEU A 46 12.891 4.199 17.785 1.00 0.00 H new ATOM 0 HA LEU A 46 14.836 2.111 18.066 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.208 3.361 15.881 1.00 0.00 H new ATOM 0 HB3 LEU A 46 14.618 2.419 15.439 1.00 0.00 H new ATOM 0 HG LEU A 46 12.612 1.119 15.286 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.266 -0.844 16.703 1.00 0.00 H new ATOM 0 HD12 LEU A 46 14.664 -0.086 15.905 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.352 0.219 17.630 1.00 0.00 H new ATOM 0 HD21 LEU A 46 11.284 0.422 17.253 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.193 1.580 18.253 1.00 0.00 H new ATOM 0 HD23 LEU A 46 11.169 2.167 16.922 1.00 0.00 H new ATOM 560 N THR A 47 17.001 3.244 17.451 1.00 0.00 N ATOM 561 CA THR A 47 18.281 3.931 17.251 1.00 0.00 C ATOM 562 C THR A 47 18.453 4.416 15.809 1.00 0.00 C ATOM 563 O THR A 47 17.930 3.835 14.849 1.00 0.00 O ATOM 564 CB THR A 47 19.442 3.060 17.752 1.00 0.00 C ATOM 565 OG1 THR A 47 20.668 3.678 17.435 1.00 0.00 O ATOM 566 CG2 THR A 47 19.467 1.657 17.145 1.00 0.00 C ATOM 0 H THR A 47 17.095 2.296 17.817 1.00 0.00 H new ATOM 0 HA THR A 47 18.287 4.838 17.855 1.00 0.00 H new ATOM 0 HB THR A 47 19.294 2.960 18.827 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.408 3.122 17.757 1.00 0.00 H new ATOM 0 HG21 THR A 47 20.315 1.102 17.547 1.00 0.00 H new ATOM 0 HG22 THR A 47 18.542 1.137 17.393 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.562 1.731 16.062 1.00 0.00 H new ATOM 574 N ARG A 48 19.281 5.457 15.650 1.00 0.00 N ATOM 575 CA ARG A 48 19.667 6.009 14.349 1.00 0.00 C ATOM 576 C ARG A 48 20.267 4.962 13.398 1.00 0.00 C ATOM 577 O ARG A 48 20.324 5.217 12.202 1.00 0.00 O ATOM 578 CB ARG A 48 20.579 7.238 14.513 1.00 0.00 C ATOM 579 CG ARG A 48 21.997 6.915 15.013 1.00 0.00 C ATOM 580 CD ARG A 48 22.863 8.182 15.027 1.00 0.00 C ATOM 581 NE ARG A 48 24.274 7.868 15.320 1.00 0.00 N ATOM 582 CZ ARG A 48 24.851 7.783 16.516 1.00 0.00 C ATOM 583 NH1 ARG A 48 24.169 7.937 17.633 1.00 0.00 N ATOM 584 NH2 ARG A 48 26.142 7.534 16.606 1.00 0.00 N ATOM 0 H ARG A 48 19.708 5.946 16.437 1.00 0.00 H new ATOM 0 HA ARG A 48 18.747 6.341 13.869 1.00 0.00 H new ATOM 0 HB2 ARG A 48 20.653 7.751 13.554 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.110 7.932 15.210 1.00 0.00 H new ATOM 0 HG2 ARG A 48 21.948 6.490 16.015 1.00 0.00 H new ATOM 0 HG3 ARG A 48 22.453 6.162 14.370 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.793 8.682 14.061 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.481 8.877 15.775 1.00 0.00 H new ATOM 0 HE ARG A 48 24.876 7.697 14.514 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.168 8.128 17.597 1.00 0.00 H new ATOM 0 HH12 ARG A 48 24.642 7.866 18.534 1.00 0.00 H new ATOM 0 HH21 ARG A 48 26.697 7.407 15.760 1.00 0.00 H new ATOM 0 HH22 ARG A 48 26.586 7.468 17.522 1.00 0.00 H new ATOM 598 N SER A 49 20.693 3.796 13.891 1.00 0.00 N ATOM 599 CA SER A 49 21.035 2.644 13.047 1.00 0.00 C ATOM 600 C SER A 49 19.771 2.139 12.332 1.00 0.00 C ATOM 601 O SER A 49 19.645 2.367 11.135 1.00 0.00 O ATOM 602 CB SER A 49 21.717 1.552 13.887 1.00 0.00 C ATOM 603 OG SER A 49 21.832 0.337 13.174 1.00 0.00 O ATOM 0 H SER A 49 20.811 3.622 14.889 1.00 0.00 H new ATOM 0 HA SER A 49 21.750 2.941 12.280 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.708 1.891 14.189 1.00 0.00 H new ATOM 0 HB3 SER A 49 21.145 1.385 14.800 1.00 0.00 H new ATOM 0 HG SER A 49 22.271 -0.333 13.738 1.00 0.00 H new ATOM 609 N ASN A 50 18.788 1.572 13.046 1.00 0.00 N ATOM 610 CA ASN A 50 17.517 1.118 12.465 1.00 0.00 C ATOM 611 C ASN A 50 16.791 2.224 11.678 1.00 0.00 C ATOM 612 O ASN A 50 16.301 1.965 10.576 1.00 0.00 O ATOM 613 CB ASN A 50 16.601 0.597 13.582 1.00 0.00 C ATOM 614 CG ASN A 50 17.206 -0.569 14.351 1.00 0.00 C ATOM 615 OD1 ASN A 50 17.813 -0.376 15.393 1.00 0.00 O ATOM 616 ND2 ASN A 50 17.072 -1.788 13.859 1.00 0.00 N ATOM 0 H ASN A 50 18.854 1.414 14.052 1.00 0.00 H new ATOM 0 HA ASN A 50 17.752 0.322 11.758 1.00 0.00 H new ATOM 0 HB2 ASN A 50 16.385 1.409 14.276 1.00 0.00 H new ATOM 0 HB3 ASN A 50 15.650 0.286 13.149 1.00 0.00 H new ATOM 0 HD21 ASN A 50 17.478 -2.584 14.351 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.562 -1.933 12.988 1.00 0.00 H new ATOM 623 N VAL A 51 16.745 3.454 12.201 1.00 0.00 N ATOM 624 CA VAL A 51 16.130 4.588 11.492 1.00 0.00 C ATOM 625 C VAL A 51 16.880 4.908 10.187 1.00 0.00 C ATOM 626 O VAL A 51 16.229 5.023 9.153 1.00 0.00 O ATOM 627 CB VAL A 51 15.974 5.817 12.416 1.00 0.00 C ATOM 628 CG1 VAL A 51 15.717 7.137 11.671 1.00 0.00 C ATOM 629 CG2 VAL A 51 14.854 5.580 13.444 1.00 0.00 C ATOM 0 H VAL A 51 17.127 3.693 13.116 1.00 0.00 H new ATOM 0 HA VAL A 51 15.121 4.296 11.202 1.00 0.00 H new ATOM 0 HB VAL A 51 16.935 5.927 12.918 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.620 7.949 12.392 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.551 7.345 11.001 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.798 7.055 11.091 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.758 6.456 14.086 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.912 5.408 12.923 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.097 4.709 14.052 1.00 0.00 H new ATOM 639 N SER A 52 18.219 4.968 10.162 1.00 0.00 N ATOM 640 CA SER A 52 18.946 5.238 8.906 1.00 0.00 C ATOM 641 C SER A 52 18.905 4.057 7.929 1.00 0.00 C ATOM 642 O SER A 52 18.795 4.274 6.719 1.00 0.00 O ATOM 643 CB SER A 52 20.408 5.616 9.145 1.00 0.00 C ATOM 644 OG SER A 52 20.505 6.720 10.024 1.00 0.00 O ATOM 0 H SER A 52 18.815 4.836 10.979 1.00 0.00 H new ATOM 0 HA SER A 52 18.422 6.085 8.462 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.945 4.764 9.563 1.00 0.00 H new ATOM 0 HB3 SER A 52 20.885 5.859 8.196 1.00 0.00 H new ATOM 0 HG SER A 52 20.587 6.398 10.946 1.00 0.00 H new ATOM 650 N ASN A 53 18.936 2.821 8.440 1.00 0.00 N ATOM 651 CA ASN A 53 18.776 1.581 7.680 1.00 0.00 C ATOM 652 C ASN A 53 17.451 1.603 6.909 1.00 0.00 C ATOM 653 O ASN A 53 17.441 1.547 5.681 1.00 0.00 O ATOM 654 CB ASN A 53 18.900 0.391 8.652 1.00 0.00 C ATOM 655 CG ASN A 53 19.042 -0.961 7.960 1.00 0.00 C ATOM 656 OD1 ASN A 53 20.134 -1.486 7.810 1.00 0.00 O ATOM 657 ND2 ASN A 53 17.951 -1.579 7.551 1.00 0.00 N ATOM 0 H ASN A 53 19.079 2.653 9.436 1.00 0.00 H new ATOM 0 HA ASN A 53 19.559 1.477 6.929 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.764 0.550 9.297 1.00 0.00 H new ATOM 0 HB3 ASN A 53 18.021 0.368 9.296 1.00 0.00 H new ATOM 0 HD21 ASN A 53 18.019 -2.496 7.109 1.00 0.00 H new ATOM 0 HD22 ASN A 53 17.039 -1.140 7.676 1.00 0.00 H new ATOM 664 N HIS A 54 16.329 1.785 7.612 1.00 0.00 N ATOM 665 CA HIS A 54 15.015 1.818 6.964 1.00 0.00 C ATOM 666 C HIS A 54 14.742 3.104 6.156 1.00 0.00 C ATOM 667 O HIS A 54 14.027 3.026 5.153 1.00 0.00 O ATOM 668 CB HIS A 54 13.912 1.506 7.987 1.00 0.00 C ATOM 669 CG HIS A 54 13.398 0.096 7.844 1.00 0.00 C ATOM 670 ND1 HIS A 54 12.573 -0.375 6.845 1.00 0.00 N ATOM 671 CD2 HIS A 54 13.710 -0.978 8.632 1.00 0.00 C ATOM 672 CE1 HIS A 54 12.362 -1.685 7.048 1.00 0.00 C ATOM 673 NE2 HIS A 54 13.020 -2.086 8.142 1.00 0.00 N ATOM 0 H HIS A 54 16.304 1.911 8.624 1.00 0.00 H new ATOM 0 HA HIS A 54 15.013 1.032 6.209 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.300 1.651 8.995 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.088 2.208 7.859 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.374 -0.969 9.484 1.00 0.00 H new ATOM 0 HE1 HIS A 54 11.753 -2.320 6.422 1.00 0.00 H new ATOM 0 HE2 HIS A 54 13.017 -3.024 8.542 1.00 0.00 H new ATOM 681 N LEU A 55 15.329 4.259 6.516 1.00 0.00 N ATOM 682 CA LEU A 55 15.284 5.455 5.661 1.00 0.00 C ATOM 683 C LEU A 55 16.018 5.234 4.342 1.00 0.00 C ATOM 684 O LEU A 55 15.619 5.826 3.351 1.00 0.00 O ATOM 685 CB LEU A 55 15.916 6.697 6.325 1.00 0.00 C ATOM 686 CG LEU A 55 15.064 7.409 7.394 1.00 0.00 C ATOM 687 CD1 LEU A 55 15.960 8.408 8.137 1.00 0.00 C ATOM 688 CD2 LEU A 55 13.881 8.148 6.754 1.00 0.00 C ATOM 0 H LEU A 55 15.838 4.388 7.390 1.00 0.00 H new ATOM 0 HA LEU A 55 14.222 5.632 5.492 1.00 0.00 H new ATOM 0 HB2 LEU A 55 16.859 6.397 6.783 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.156 7.418 5.543 1.00 0.00 H new ATOM 0 HG LEU A 55 14.660 6.669 8.085 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.376 8.924 8.899 1.00 0.00 H new ATOM 0 HD12 LEU A 55 16.785 7.875 8.610 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.357 9.136 7.430 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.297 8.641 7.531 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.254 8.894 6.052 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.250 7.435 6.224 1.00 0.00 H new ATOM 700 N SER A 56 17.099 4.458 4.295 1.00 0.00 N ATOM 701 CA SER A 56 17.937 4.388 3.088 1.00 0.00 C ATOM 702 C SER A 56 17.200 3.852 1.858 1.00 0.00 C ATOM 703 O SER A 56 17.240 4.499 0.815 1.00 0.00 O ATOM 704 CB SER A 56 19.242 3.641 3.374 1.00 0.00 C ATOM 705 OG SER A 56 19.992 4.376 4.335 1.00 0.00 O ATOM 0 H SER A 56 17.417 3.873 5.067 1.00 0.00 H new ATOM 0 HA SER A 56 18.195 5.414 2.824 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.029 2.639 3.748 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.818 3.523 2.456 1.00 0.00 H new ATOM 0 HG SER A 56 19.488 4.427 5.174 1.00 0.00 H new ATOM 711 N CYS A 57 16.428 2.770 1.976 1.00 0.00 N ATOM 712 CA CYS A 57 15.556 2.341 0.889 1.00 0.00 C ATOM 713 C CYS A 57 14.338 3.278 0.709 1.00 0.00 C ATOM 714 O CYS A 57 13.757 3.285 -0.366 1.00 0.00 O ATOM 715 CB CYS A 57 15.189 0.878 1.149 1.00 0.00 C ATOM 716 SG CYS A 57 14.396 0.052 -0.277 1.00 0.00 S ATOM 0 H CYS A 57 16.391 2.181 2.808 1.00 0.00 H new ATOM 0 HA CYS A 57 16.071 2.408 -0.070 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.091 0.329 1.419 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.517 0.828 2.006 1.00 0.00 H new ATOM 0 HG CYS A 57 14.123 -1.181 0.033 1.00 0.00 H new ATOM 721 N LEU A 58 13.932 4.070 1.715 1.00 0.00 N ATOM 722 CA LEU A 58 12.901 5.120 1.582 1.00 0.00 C ATOM 723 C LEU A 58 13.409 6.263 0.676 1.00 0.00 C ATOM 724 O LEU A 58 12.639 6.805 -0.119 1.00 0.00 O ATOM 725 CB LEU A 58 12.504 5.622 2.999 1.00 0.00 C ATOM 726 CG LEU A 58 11.052 6.108 3.203 1.00 0.00 C ATOM 727 CD1 LEU A 58 9.987 5.021 3.079 1.00 0.00 C ATOM 728 CD2 LEU A 58 10.939 6.748 4.592 1.00 0.00 C ATOM 0 H LEU A 58 14.314 4.000 2.658 1.00 0.00 H new ATOM 0 HA LEU A 58 12.010 4.713 1.103 1.00 0.00 H new ATOM 0 HB2 LEU A 58 12.691 4.814 3.706 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.173 6.440 3.266 1.00 0.00 H new ATOM 0 HG LEU A 58 10.856 6.816 2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.001 5.458 3.238 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.032 4.579 2.084 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.166 4.249 3.827 1.00 0.00 H new ATOM 0 HD21 LEU A 58 9.918 7.096 4.750 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.193 6.011 5.354 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.625 7.592 4.661 1.00 0.00 H new ATOM 740 N ARG A 59 14.700 6.614 0.786 1.00 0.00 N ATOM 741 CA ARG A 59 15.394 7.570 -0.091 1.00 0.00 C ATOM 742 C ARG A 59 15.682 6.984 -1.478 1.00 0.00 C ATOM 743 O ARG A 59 16.023 7.732 -2.384 1.00 0.00 O ATOM 744 CB ARG A 59 16.725 8.019 0.516 1.00 0.00 C ATOM 745 CG ARG A 59 16.602 8.703 1.884 1.00 0.00 C ATOM 746 CD ARG A 59 17.901 9.408 2.241 1.00 0.00 C ATOM 747 NE ARG A 59 19.079 8.517 2.226 1.00 0.00 N ATOM 748 CZ ARG A 59 19.486 7.684 3.177 1.00 0.00 C ATOM 749 NH1 ARG A 59 18.899 7.606 4.353 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.505 6.885 2.941 1.00 0.00 N ATOM 0 H ARG A 59 15.308 6.229 1.509 1.00 0.00 H new ATOM 0 HA ARG A 59 14.719 8.420 -0.192 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.376 7.150 0.615 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.213 8.705 -0.177 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.783 9.422 1.866 1.00 0.00 H new ATOM 0 HG3 ARG A 59 16.360 7.963 2.647 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.065 10.226 1.540 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.804 9.852 3.232 1.00 0.00 H new ATOM 0 HE ARG A 59 19.650 8.545 1.381 1.00 0.00 H new ATOM 0 HH11 ARG A 59 18.097 8.200 4.563 1.00 0.00 H new ATOM 0 HH12 ARG A 59 19.246 6.951 5.054 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.973 6.910 2.035 1.00 0.00 H new ATOM 0 HH22 ARG A 59 20.826 6.241 3.664 1.00 0.00 H new ATOM 764 N GLY A 60 15.579 5.658 -1.628 1.00 0.00 N ATOM 765 CA GLY A 60 15.811 4.950 -2.888 1.00 0.00 C ATOM 766 C GLY A 60 14.507 4.849 -3.654 1.00 0.00 C ATOM 767 O GLY A 60 14.386 5.425 -4.726 1.00 0.00 O ATOM 0 H GLY A 60 15.327 5.036 -0.860 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.556 5.478 -3.483 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.208 3.954 -2.691 1.00 0.00 H new ATOM 771 N CYS A 61 13.500 4.225 -3.027 1.00 0.00 N ATOM 772 CA CYS A 61 12.106 4.100 -3.458 1.00 0.00 C ATOM 773 C CYS A 61 11.358 5.459 -3.620 1.00 0.00 C ATOM 774 O CYS A 61 10.132 5.482 -3.708 1.00 0.00 O ATOM 775 CB CYS A 61 11.444 3.090 -2.486 1.00 0.00 C ATOM 776 SG CYS A 61 11.994 1.367 -2.732 1.00 0.00 S ATOM 0 H CYS A 61 13.655 3.758 -2.134 1.00 0.00 H new ATOM 0 HA CYS A 61 12.050 3.719 -4.478 1.00 0.00 H new ATOM 0 HB2 CYS A 61 11.663 3.389 -1.461 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.362 3.138 -2.608 1.00 0.00 H new ATOM 0 HG CYS A 61 12.837 1.043 -1.797 1.00 0.00 H new ATOM 781 N GLY A 62 12.082 6.587 -3.577 1.00 0.00 N ATOM 782 CA GLY A 62 11.612 7.955 -3.833 1.00 0.00 C ATOM 783 C GLY A 62 10.551 8.480 -2.869 1.00 0.00 C ATOM 784 O GLY A 62 9.908 9.477 -3.168 1.00 0.00 O ATOM 0 H GLY A 62 13.076 6.566 -3.348 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.470 8.627 -3.801 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.211 7.998 -4.845 1.00 0.00 H new ATOM 788 N LEU A 63 10.366 7.838 -1.713 1.00 0.00 N ATOM 789 CA LEU A 63 9.380 8.224 -0.701 1.00 0.00 C ATOM 790 C LEU A 63 9.836 9.418 0.156 1.00 0.00 C ATOM 791 O LEU A 63 9.006 10.181 0.649 1.00 0.00 O ATOM 792 CB LEU A 63 9.058 6.992 0.134 1.00 0.00 C ATOM 793 CG LEU A 63 8.242 5.966 -0.674 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.194 4.703 0.155 1.00 0.00 C ATOM 795 CD2 LEU A 63 6.805 6.424 -0.977 1.00 0.00 C ATOM 0 H LEU A 63 10.910 7.017 -1.449 1.00 0.00 H new ATOM 0 HA LEU A 63 8.475 8.578 -1.195 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.984 6.532 0.480 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.498 7.288 1.021 1.00 0.00 H new ATOM 0 HG LEU A 63 8.723 5.824 -1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.624 3.941 -0.376 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.208 4.343 0.328 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.715 4.913 1.111 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.290 5.652 -1.549 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.274 6.598 -0.041 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.832 7.347 -1.556 1.00 0.00 H new ATOM 807 N VAL A 64 11.152 9.593 0.298 1.00 0.00 N ATOM 808 CA VAL A 64 11.778 10.699 1.049 1.00 0.00 C ATOM 809 C VAL A 64 12.912 11.391 0.292 1.00 0.00 C ATOM 810 O VAL A 64 13.708 10.747 -0.389 1.00 0.00 O ATOM 811 CB VAL A 64 12.287 10.258 2.442 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.126 10.170 3.433 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.043 8.952 2.406 1.00 0.00 C ATOM 0 H VAL A 64 11.834 8.957 -0.114 1.00 0.00 H new ATOM 0 HA VAL A 64 10.973 11.423 1.178 1.00 0.00 H new ATOM 0 HB VAL A 64 12.991 11.022 2.773 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.502 9.858 4.407 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.650 11.146 3.523 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.397 9.442 3.076 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.374 8.696 3.412 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.391 8.165 2.027 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.910 9.051 1.753 1.00 0.00 H new ATOM 823 N VAL A 65 12.983 12.712 0.467 1.00 0.00 N ATOM 824 CA VAL A 65 13.939 13.640 -0.164 1.00 0.00 C ATOM 825 C VAL A 65 14.592 14.527 0.908 1.00 0.00 C ATOM 826 O VAL A 65 13.922 14.972 1.838 1.00 0.00 O ATOM 827 CB VAL A 65 13.192 14.502 -1.218 1.00 0.00 C ATOM 828 CG1 VAL A 65 13.948 15.771 -1.648 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.901 13.655 -2.469 1.00 0.00 C ATOM 0 H VAL A 65 12.338 13.197 1.090 1.00 0.00 H new ATOM 0 HA VAL A 65 14.727 13.078 -0.664 1.00 0.00 H new ATOM 0 HB VAL A 65 12.273 14.831 -0.732 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.357 16.314 -2.385 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.117 16.406 -0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.907 15.493 -2.086 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.377 14.263 -3.206 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.840 13.299 -2.894 1.00 0.00 H new ATOM 0 HG23 VAL A 65 12.280 12.802 -2.195 1.00 0.00 H new ATOM 839 N ALA A 66 15.898 14.788 0.787 1.00 0.00 N ATOM 840 CA ALA A 66 16.603 15.771 1.618 1.00 0.00 C ATOM 841 C ALA A 66 16.270 17.214 1.220 1.00 0.00 C ATOM 842 O ALA A 66 16.269 17.546 0.034 1.00 0.00 O ATOM 843 CB ALA A 66 18.115 15.545 1.527 1.00 0.00 C ATOM 0 H ALA A 66 16.499 14.322 0.107 1.00 0.00 H new ATOM 0 HA ALA A 66 16.267 15.628 2.645 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.631 16.279 2.147 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.355 14.541 1.878 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.437 15.654 0.492 1.00 0.00 H new ATOM 849 N THR A 67 16.071 18.087 2.216 1.00 0.00 N ATOM 850 CA THR A 67 15.946 19.533 1.999 1.00 0.00 C ATOM 851 C THR A 67 16.751 20.286 3.030 1.00 0.00 C ATOM 852 O THR A 67 17.039 19.788 4.111 1.00 0.00 O ATOM 853 CB THR A 67 14.488 20.056 1.980 1.00 0.00 C ATOM 854 OG1 THR A 67 14.073 20.610 3.204 1.00 0.00 O ATOM 855 CG2 THR A 67 13.432 19.027 1.583 1.00 0.00 C ATOM 0 H THR A 67 15.992 17.810 3.195 1.00 0.00 H new ATOM 0 HA THR A 67 16.340 19.715 0.999 1.00 0.00 H new ATOM 0 HB THR A 67 14.544 20.822 1.207 1.00 0.00 H new ATOM 0 HG1 THR A 67 14.434 21.517 3.292 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.446 19.492 1.600 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.642 18.659 0.579 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.453 18.194 2.286 1.00 0.00 H new ATOM 863 N TYR A 68 17.027 21.541 2.720 1.00 0.00 N ATOM 864 CA TYR A 68 17.506 22.498 3.702 1.00 0.00 C ATOM 865 C TYR A 68 16.288 22.850 4.577 1.00 0.00 C ATOM 866 O TYR A 68 15.246 23.226 4.029 1.00 0.00 O ATOM 867 CB TYR A 68 18.048 23.702 2.915 1.00 0.00 C ATOM 868 CG TYR A 68 18.943 24.658 3.673 1.00 0.00 C ATOM 869 CD1 TYR A 68 20.161 24.190 4.197 1.00 0.00 C ATOM 870 CD2 TYR A 68 18.626 26.029 3.743 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.072 25.086 4.780 1.00 0.00 C ATOM 872 CE2 TYR A 68 19.541 26.936 4.311 1.00 0.00 C ATOM 873 CZ TYR A 68 20.773 26.465 4.820 1.00 0.00 C ATOM 874 OH TYR A 68 21.663 27.338 5.359 1.00 0.00 O ATOM 0 H TYR A 68 16.925 21.925 1.781 1.00 0.00 H new ATOM 0 HA TYR A 68 18.305 22.131 4.347 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.602 23.326 2.055 1.00 0.00 H new ATOM 0 HB3 TYR A 68 17.200 24.265 2.526 1.00 0.00 H new ATOM 0 HD1 TYR A 68 20.397 23.137 4.151 1.00 0.00 H new ATOM 0 HD2 TYR A 68 17.681 26.384 3.361 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.999 24.721 5.197 1.00 0.00 H new ATOM 0 HE2 TYR A 68 19.302 27.988 4.358 1.00 0.00 H new ATOM 0 HH TYR A 68 21.302 28.248 5.306 1.00 0.00 H new ATOM 884 N GLU A 69 16.342 22.657 5.897 1.00 0.00 N ATOM 885 CA GLU A 69 15.289 23.186 6.783 1.00 0.00 C ATOM 886 C GLU A 69 15.405 24.701 6.995 1.00 0.00 C ATOM 887 O GLU A 69 14.403 25.356 7.270 1.00 0.00 O ATOM 888 CB GLU A 69 15.214 22.442 8.127 1.00 0.00 C ATOM 889 CG GLU A 69 16.491 22.479 8.971 1.00 0.00 C ATOM 890 CD GLU A 69 16.271 21.970 10.402 1.00 0.00 C ATOM 891 OE1 GLU A 69 15.356 21.145 10.604 1.00 0.00 O ATOM 892 OE2 GLU A 69 17.074 22.374 11.271 1.00 0.00 O ATOM 0 H GLU A 69 17.087 22.149 6.374 1.00 0.00 H new ATOM 0 HA GLU A 69 14.349 23.002 6.262 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.399 22.867 8.713 1.00 0.00 H new ATOM 0 HB3 GLU A 69 14.957 21.401 7.933 1.00 0.00 H new ATOM 0 HG2 GLU A 69 17.258 21.873 8.488 1.00 0.00 H new ATOM 0 HG3 GLU A 69 16.868 23.501 9.007 1.00 0.00 H new ATOM 899 N GLY A 70 16.609 25.246 6.796 1.00 0.00 N ATOM 900 CA GLY A 70 16.997 26.605 7.169 1.00 0.00 C ATOM 901 C GLY A 70 18.136 26.478 8.171 1.00 0.00 C ATOM 902 O GLY A 70 17.926 26.050 9.300 1.00 0.00 O ATOM 0 H GLY A 70 17.369 24.730 6.353 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.314 27.171 6.293 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.155 27.141 7.607 1.00 0.00 H new ATOM 906 N ARG A 71 19.363 26.762 7.723 1.00 0.00 N ATOM 907 CA ARG A 71 20.633 26.505 8.420 1.00 0.00 C ATOM 908 C ARG A 71 21.023 25.012 8.360 1.00 0.00 C ATOM 909 O ARG A 71 22.120 24.710 7.893 1.00 0.00 O ATOM 910 CB ARG A 71 20.628 27.038 9.869 1.00 0.00 C ATOM 911 CG ARG A 71 22.051 27.115 10.436 1.00 0.00 C ATOM 912 CD ARG A 71 22.037 27.298 11.958 1.00 0.00 C ATOM 913 NE ARG A 71 23.246 26.705 12.550 1.00 0.00 N ATOM 914 CZ ARG A 71 24.365 27.315 12.924 1.00 0.00 C ATOM 915 NH1 ARG A 71 24.511 28.621 12.830 1.00 0.00 N ATOM 916 NH2 ARG A 71 25.363 26.599 13.396 1.00 0.00 N ATOM 0 H ARG A 71 19.508 27.202 6.814 1.00 0.00 H new ATOM 0 HA ARG A 71 21.402 27.065 7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.170 28.027 9.894 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.018 26.388 10.496 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.595 26.205 10.182 1.00 0.00 H new ATOM 0 HG3 ARG A 71 22.584 27.945 9.973 1.00 0.00 H new ATOM 0 HD2 ARG A 71 21.985 28.359 12.204 1.00 0.00 H new ATOM 0 HD3 ARG A 71 21.148 26.829 12.380 1.00 0.00 H new ATOM 0 HE ARG A 71 23.222 25.695 12.692 1.00 0.00 H new ATOM 0 HH11 ARG A 71 23.752 29.194 12.461 1.00 0.00 H new ATOM 0 HH12 ARG A 71 25.383 29.059 13.126 1.00 0.00 H new ATOM 0 HH21 ARG A 71 25.273 25.586 13.472 1.00 0.00 H new ATOM 0 HH22 ARG A 71 26.227 27.057 13.686 1.00 0.00 H new ATOM 930 N GLN A 72 20.173 24.097 8.840 1.00 0.00 N ATOM 931 CA GLN A 72 20.462 22.659 8.837 1.00 0.00 C ATOM 932 C GLN A 72 19.793 21.957 7.638 1.00 0.00 C ATOM 933 O GLN A 72 19.304 22.596 6.708 1.00 0.00 O ATOM 934 CB GLN A 72 20.079 21.984 10.173 1.00 0.00 C ATOM 935 CG GLN A 72 20.243 22.822 11.452 1.00 0.00 C ATOM 936 CD GLN A 72 21.704 23.040 11.835 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.267 24.127 11.789 1.00 0.00 O ATOM 938 NE2 GLN A 72 22.403 21.995 12.222 1.00 0.00 N ATOM 0 H GLN A 72 19.265 24.333 9.241 1.00 0.00 H new ATOM 0 HA GLN A 72 21.541 22.551 8.727 1.00 0.00 H new ATOM 0 HB2 GLN A 72 19.038 21.668 10.106 1.00 0.00 H new ATOM 0 HB3 GLN A 72 20.680 21.081 10.281 1.00 0.00 H new ATOM 0 HG2 GLN A 72 19.761 23.790 11.311 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.727 22.326 12.274 1.00 0.00 H new ATOM 0 HE21 GLN A 72 21.962 21.076 12.271 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.386 22.103 12.473 1.00 0.00 H new ATOM 947 N VAL A 73 19.758 20.623 7.676 1.00 0.00 N ATOM 948 CA VAL A 73 19.236 19.737 6.626 1.00 0.00 C ATOM 949 C VAL A 73 18.241 18.759 7.260 1.00 0.00 C ATOM 950 O VAL A 73 18.413 18.389 8.422 1.00 0.00 O ATOM 951 CB VAL A 73 20.389 18.991 5.903 1.00 0.00 C ATOM 952 CG1 VAL A 73 21.110 17.972 6.809 1.00 0.00 C ATOM 953 CG2 VAL A 73 19.930 18.284 4.614 1.00 0.00 C ATOM 0 H VAL A 73 20.110 20.103 8.479 1.00 0.00 H new ATOM 0 HA VAL A 73 18.722 20.328 5.868 1.00 0.00 H new ATOM 0 HB VAL A 73 21.095 19.778 5.637 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.905 17.483 6.246 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.538 18.488 7.668 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.397 17.223 7.154 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.780 17.780 4.153 1.00 0.00 H new ATOM 0 HG22 VAL A 73 19.161 17.551 4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.525 19.020 3.920 1.00 0.00 H new ATOM 963 N ARG A 74 17.242 18.330 6.488 1.00 0.00 N ATOM 964 CA ARG A 74 16.159 17.438 6.893 1.00 0.00 C ATOM 965 C ARG A 74 15.904 16.379 5.838 1.00 0.00 C ATOM 966 O ARG A 74 16.408 16.467 4.722 1.00 0.00 O ATOM 967 CB ARG A 74 14.871 18.247 7.107 1.00 0.00 C ATOM 968 CG ARG A 74 14.146 18.833 5.897 1.00 0.00 C ATOM 969 CD ARG A 74 12.982 19.652 6.455 1.00 0.00 C ATOM 970 NE ARG A 74 12.535 20.726 5.570 1.00 0.00 N ATOM 971 CZ ARG A 74 12.065 21.893 5.992 1.00 0.00 C ATOM 972 NH1 ARG A 74 11.789 22.119 7.265 1.00 0.00 N ATOM 973 NH2 ARG A 74 11.921 22.878 5.132 1.00 0.00 N ATOM 0 H ARG A 74 17.164 18.612 5.511 1.00 0.00 H new ATOM 0 HA ARG A 74 16.454 16.949 7.821 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.164 17.605 7.633 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.110 19.073 7.777 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.816 19.459 5.307 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.786 18.043 5.238 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.143 18.985 6.653 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.279 20.083 7.411 1.00 0.00 H new ATOM 0 HE ARG A 74 12.588 20.568 4.564 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.936 21.384 7.957 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.429 23.028 7.555 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.170 22.740 4.152 1.00 0.00 H new ATOM 0 HH22 ARG A 74 11.561 23.780 5.445 1.00 0.00 H new ATOM 987 N TYR A 75 15.091 15.392 6.190 1.00 0.00 N ATOM 988 CA TYR A 75 14.454 14.471 5.252 1.00 0.00 C ATOM 989 C TYR A 75 12.953 14.770 5.293 1.00 0.00 C ATOM 990 O TYR A 75 12.423 15.047 6.364 1.00 0.00 O ATOM 991 CB TYR A 75 14.762 13.012 5.620 1.00 0.00 C ATOM 992 CG TYR A 75 16.176 12.615 5.239 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.568 12.661 3.889 1.00 0.00 C ATOM 994 CD2 TYR A 75 17.114 12.251 6.224 1.00 0.00 C ATOM 995 CE1 TYR A 75 17.901 12.399 3.524 1.00 0.00 C ATOM 996 CE2 TYR A 75 18.447 11.970 5.864 1.00 0.00 C ATOM 997 CZ TYR A 75 18.848 12.054 4.510 1.00 0.00 C ATOM 998 OH TYR A 75 20.131 11.777 4.144 1.00 0.00 O ATOM 0 H TYR A 75 14.848 15.203 7.162 1.00 0.00 H new ATOM 0 HA TYR A 75 14.837 14.609 4.241 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.623 12.871 6.692 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.053 12.354 5.117 1.00 0.00 H new ATOM 0 HD1 TYR A 75 15.840 12.899 3.127 1.00 0.00 H new ATOM 0 HD2 TYR A 75 16.811 12.187 7.259 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.199 12.462 2.488 1.00 0.00 H new ATOM 0 HE2 TYR A 75 19.163 11.690 6.622 1.00 0.00 H new ATOM 0 HH TYR A 75 20.658 11.558 4.940 1.00 0.00 H new ATOM 1008 N ALA A 76 12.283 14.763 4.148 1.00 0.00 N ATOM 1009 CA ALA A 76 10.866 15.065 4.020 1.00 0.00 C ATOM 1010 C ALA A 76 10.210 14.121 3.019 1.00 0.00 C ATOM 1011 O ALA A 76 10.866 13.666 2.075 1.00 0.00 O ATOM 1012 CB ALA A 76 10.708 16.533 3.599 1.00 0.00 C ATOM 0 H ALA A 76 12.725 14.540 3.256 1.00 0.00 H new ATOM 0 HA ALA A 76 10.365 14.918 4.977 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.649 16.771 3.500 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.156 17.178 4.355 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.207 16.693 2.643 1.00 0.00 H new ATOM 1018 N LEU A 77 8.917 13.861 3.230 1.00 0.00 N ATOM 1019 CA LEU A 77 8.056 13.160 2.286 1.00 0.00 C ATOM 1020 C LEU A 77 8.218 13.818 0.903 1.00 0.00 C ATOM 1021 O LEU A 77 8.134 15.041 0.808 1.00 0.00 O ATOM 1022 CB LEU A 77 6.593 13.249 2.779 1.00 0.00 C ATOM 1023 CG LEU A 77 5.891 11.906 2.921 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.400 11.028 4.047 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.440 12.207 3.254 1.00 0.00 C ATOM 0 H LEU A 77 8.433 14.140 4.083 1.00 0.00 H new ATOM 0 HA LEU A 77 8.329 12.107 2.211 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.578 13.756 3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.026 13.869 2.085 1.00 0.00 H new ATOM 0 HG LEU A 77 6.061 11.368 1.988 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.836 10.095 4.064 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.456 10.811 3.890 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.274 11.546 4.998 1.00 0.00 H new ATOM 0 HD21 LEU A 77 3.891 11.272 3.366 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.390 12.772 4.185 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.996 12.794 2.450 1.00 0.00 H new ATOM 1037 N ALA A 78 8.472 13.028 -0.143 1.00 0.00 N ATOM 1038 CA ALA A 78 8.843 13.568 -1.457 1.00 0.00 C ATOM 1039 C ALA A 78 7.735 14.380 -2.161 1.00 0.00 C ATOM 1040 O ALA A 78 8.053 15.243 -2.974 1.00 0.00 O ATOM 1041 CB ALA A 78 9.328 12.403 -2.326 1.00 0.00 C ATOM 0 H ALA A 78 8.428 12.010 -0.107 1.00 0.00 H new ATOM 0 HA ALA A 78 9.637 14.299 -1.301 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.611 12.776 -3.310 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.191 11.932 -1.855 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.528 11.670 -2.432 1.00 0.00 H new ATOM 1047 N ASP A 79 6.461 14.137 -1.833 1.00 0.00 N ATOM 1048 CA ASP A 79 5.304 14.822 -2.416 1.00 0.00 C ATOM 1049 C ASP A 79 4.032 14.691 -1.554 1.00 0.00 C ATOM 1050 O ASP A 79 3.828 13.743 -0.788 1.00 0.00 O ATOM 1051 CB ASP A 79 5.058 14.339 -3.868 1.00 0.00 C ATOM 1052 CG ASP A 79 3.749 14.866 -4.481 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.495 16.095 -4.432 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.899 14.020 -4.831 1.00 0.00 O ATOM 0 H ASP A 79 6.200 13.440 -1.136 1.00 0.00 H new ATOM 0 HA ASP A 79 5.543 15.885 -2.441 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.894 14.653 -4.493 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.042 13.249 -3.881 1.00 0.00 H new ATOM 1059 N SER A 80 3.142 15.659 -1.766 1.00 0.00 N ATOM 1060 CA SER A 80 1.752 15.742 -1.315 1.00 0.00 C ATOM 1061 C SER A 80 0.947 14.435 -1.452 1.00 0.00 C ATOM 1062 O SER A 80 0.156 14.104 -0.561 1.00 0.00 O ATOM 1063 CB SER A 80 1.076 16.856 -2.132 1.00 0.00 C ATOM 1064 OG SER A 80 0.992 16.545 -3.517 1.00 0.00 O ATOM 0 H SER A 80 3.399 16.483 -2.309 1.00 0.00 H new ATOM 0 HA SER A 80 1.766 15.950 -0.245 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.074 17.031 -1.741 1.00 0.00 H new ATOM 0 HB3 SER A 80 1.634 17.784 -2.005 1.00 0.00 H new ATOM 0 HG SER A 80 1.894 16.489 -3.895 1.00 0.00 H new ATOM 1070 N HIS A 81 1.169 13.641 -2.512 1.00 0.00 N ATOM 1071 CA HIS A 81 0.522 12.339 -2.691 1.00 0.00 C ATOM 1072 C HIS A 81 0.809 11.379 -1.539 1.00 0.00 C ATOM 1073 O HIS A 81 -0.115 10.697 -1.085 1.00 0.00 O ATOM 1074 CB HIS A 81 0.983 11.701 -4.011 1.00 0.00 C ATOM 1075 CG HIS A 81 0.237 12.155 -5.237 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -1.115 12.423 -5.320 1.00 0.00 N ATOM 1077 CD2 HIS A 81 0.689 11.959 -6.508 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -1.500 12.289 -6.599 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -0.403 12.073 -7.357 1.00 0.00 N ATOM 0 H HIS A 81 1.805 13.889 -3.270 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.553 12.518 -2.712 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.043 11.916 -4.149 1.00 0.00 H new ATOM 0 HB3 HIS A 81 0.886 10.619 -3.926 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -1.720 12.680 -4.540 1.00 0.00 H new ATOM 0 HD2 HIS A 81 1.708 11.753 -6.800 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -2.516 12.345 -6.961 1.00 0.00 H new ATOM 1088 N LEU A 82 2.054 11.310 -1.056 1.00 0.00 N ATOM 1089 CA LEU A 82 2.405 10.428 0.062 1.00 0.00 C ATOM 1090 C LEU A 82 1.842 11.001 1.353 1.00 0.00 C ATOM 1091 O LEU A 82 1.354 10.238 2.171 1.00 0.00 O ATOM 1092 CB LEU A 82 3.923 10.238 0.227 1.00 0.00 C ATOM 1093 CG LEU A 82 4.771 10.185 -1.049 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.247 10.048 -0.690 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.335 9.056 -1.998 1.00 0.00 C ATOM 0 H LEU A 82 2.835 11.854 -1.422 1.00 0.00 H new ATOM 0 HA LEU A 82 1.974 9.452 -0.160 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.299 11.052 0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.088 9.313 0.780 1.00 0.00 H new ATOM 0 HG LEU A 82 4.615 11.122 -1.584 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.842 10.011 -1.603 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.556 10.904 -0.090 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.399 9.131 -0.121 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.967 9.062 -2.886 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.432 8.096 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.296 9.208 -2.291 1.00 0.00 H new ATOM 1107 N ALA A 83 1.867 12.329 1.529 1.00 0.00 N ATOM 1108 CA ALA A 83 1.362 12.996 2.737 1.00 0.00 C ATOM 1109 C ALA A 83 -0.130 12.670 2.909 1.00 0.00 C ATOM 1110 O ALA A 83 -0.576 12.358 4.008 1.00 0.00 O ATOM 1111 CB ALA A 83 1.600 14.505 2.597 1.00 0.00 C ATOM 0 H ALA A 83 2.240 12.975 0.833 1.00 0.00 H new ATOM 0 HA ALA A 83 1.885 12.644 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.230 15.016 3.486 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.667 14.696 2.486 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.072 14.877 1.719 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.871 12.666 1.789 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.284 12.297 1.695 1.00 0.00 C ATOM 1119 C ARG A 84 -2.538 10.795 1.883 1.00 0.00 C ATOM 1120 O ARG A 84 -3.363 10.450 2.720 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.821 12.798 0.336 1.00 0.00 C ATOM 1122 CG ARG A 84 -4.277 12.413 0.029 1.00 0.00 C ATOM 1123 CD ARG A 84 -5.259 12.999 1.047 1.00 0.00 C ATOM 1124 NE ARG A 84 -6.585 12.393 0.904 1.00 0.00 N ATOM 1125 CZ ARG A 84 -7.367 11.973 1.886 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -7.071 12.053 3.164 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -8.491 11.402 1.564 1.00 0.00 N ATOM 0 H ARG A 84 -0.479 12.933 0.886 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.820 12.773 2.516 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.735 13.884 0.307 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.183 12.406 -0.456 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -4.540 12.762 -0.969 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.370 11.327 0.021 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.885 12.831 2.057 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.331 14.078 0.909 1.00 0.00 H new ATOM 0 HE ARG A 84 -6.941 12.284 -0.046 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -6.184 12.462 3.457 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -7.728 11.706 3.862 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -8.744 11.291 0.582 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -9.119 11.066 2.294 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.852 9.909 1.151 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.040 8.454 1.264 1.00 0.00 C ATOM 1143 C ALA A 85 -1.715 7.923 2.660 1.00 0.00 C ATOM 1144 O ALA A 85 -2.487 7.153 3.225 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.153 7.756 0.232 1.00 0.00 C ATOM 0 H ALA A 85 -1.150 10.179 0.462 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.093 8.242 1.079 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.286 6.677 0.309 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.431 8.086 -0.769 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.109 8.007 0.420 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.591 8.377 3.217 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.233 8.161 4.609 1.00 0.00 C ATOM 1153 C LEU A 86 -1.355 8.704 5.503 1.00 0.00 C ATOM 1154 O LEU A 86 -1.911 7.953 6.300 1.00 0.00 O ATOM 1155 CB LEU A 86 1.113 8.879 4.835 1.00 0.00 C ATOM 1156 CG LEU A 86 1.844 8.622 6.164 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.063 9.552 6.151 1.00 0.00 C ATOM 1158 CD2 LEU A 86 0.970 8.869 7.403 1.00 0.00 C ATOM 0 H LEU A 86 0.105 8.914 2.699 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.119 7.106 4.858 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.784 8.598 4.023 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.940 9.952 4.749 1.00 0.00 H new ATOM 0 HG LEU A 86 2.124 7.571 6.238 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.631 9.420 7.072 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.696 9.311 5.297 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.730 10.587 6.075 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.550 8.668 8.304 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.635 9.906 7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.104 8.208 7.375 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.696 9.986 5.326 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.547 10.771 6.218 1.00 0.00 C ATOM 1172 C GLY A 87 -4.050 10.422 6.184 1.00 0.00 C ATOM 1173 O GLY A 87 -4.757 10.756 7.127 1.00 0.00 O ATOM 0 H GLY A 87 -1.371 10.524 4.523 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.186 10.645 7.239 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.431 11.825 5.967 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.540 9.726 5.148 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.877 9.090 5.107 1.00 0.00 C ATOM 1179 C GLU A 88 -5.900 7.831 5.998 1.00 0.00 C ATOM 1180 O GLU A 88 -6.964 7.371 6.416 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.182 8.681 3.647 1.00 0.00 C ATOM 1182 CG GLU A 88 -7.551 8.020 3.361 1.00 0.00 C ATOM 1183 CD GLU A 88 -8.750 8.975 3.372 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -8.692 10.045 4.016 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -9.702 8.729 2.593 1.00 0.00 O ATOM 0 H GLU A 88 -4.008 9.583 4.290 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.624 9.794 5.473 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.102 9.572 3.025 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.402 7.993 3.320 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.505 7.531 2.388 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.722 7.239 4.102 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.705 7.264 6.232 1.00 0.00 N ATOM 1193 CA LEU A 89 -4.396 5.995 6.887 1.00 0.00 C ATOM 1194 C LEU A 89 -4.785 4.874 5.931 1.00 0.00 C ATOM 1195 O LEU A 89 -5.961 4.670 5.649 1.00 0.00 O ATOM 1196 CB LEU A 89 -5.042 5.869 8.286 1.00 0.00 C ATOM 1197 CG LEU A 89 -4.751 4.540 9.014 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -3.249 4.272 9.196 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -5.440 4.545 10.386 1.00 0.00 C ATOM 0 H LEU A 89 -3.850 7.735 5.935 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.328 5.933 7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.692 6.693 8.908 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.121 5.983 8.184 1.00 0.00 H new ATOM 0 HG LEU A 89 -5.145 3.740 8.388 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.109 3.323 9.714 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.767 4.227 8.220 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.805 5.075 9.784 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.234 3.606 10.900 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.060 5.375 10.981 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.516 4.657 10.252 1.00 0.00 H new ATOM 1211 N VAL A 90 -3.806 4.073 5.507 1.00 0.00 N ATOM 1212 CA VAL A 90 -3.910 3.076 4.414 1.00 0.00 C ATOM 1213 C VAL A 90 -4.812 1.867 4.762 1.00 0.00 C ATOM 1214 O VAL A 90 -4.818 0.835 4.100 1.00 0.00 O ATOM 1215 CB VAL A 90 -2.496 2.718 3.870 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -2.460 1.837 2.605 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -1.748 4.011 3.497 1.00 0.00 C ATOM 0 H VAL A 90 -2.876 4.094 5.926 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.447 3.535 3.584 1.00 0.00 H new ATOM 0 HB VAL A 90 -2.042 2.150 4.682 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.424 1.653 2.319 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.954 0.887 2.809 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.976 2.347 1.792 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.758 3.761 3.116 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.307 4.547 2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -1.648 4.642 4.381 1.00 0.00 H new ATOM 1227 N GLN A 91 -5.678 2.006 5.775 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.111 1.733 5.626 1.00 0.00 C ATOM 1229 C GLN A 91 -7.415 0.271 5.978 1.00 0.00 C ATOM 1230 O GLN A 91 -8.498 -0.018 6.461 1.00 0.00 O ATOM 1231 CB GLN A 91 -7.598 2.251 4.251 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.050 2.740 4.119 1.00 0.00 C ATOM 1233 CD GLN A 91 -9.573 3.905 4.980 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -10.770 4.151 4.978 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -8.802 4.609 5.780 1.00 0.00 N ATOM 0 H GLN A 91 -5.407 2.308 6.711 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.711 2.291 6.345 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -6.944 3.072 3.957 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.451 1.451 3.525 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -9.199 3.021 3.076 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.695 1.883 4.314 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -7.798 4.431 5.808 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -9.208 5.333 6.373 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.419 -0.617 5.922 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.394 -1.983 6.489 1.00 0.00 C ATOM 1246 C VAL A 92 -6.280 -1.953 8.017 1.00 0.00 C ATOM 1247 O VAL A 92 -5.504 -2.655 8.652 1.00 0.00 O ATOM 1248 CB VAL A 92 -5.293 -2.808 5.784 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -3.884 -2.303 6.159 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -5.456 -4.321 5.982 1.00 0.00 C ATOM 0 H VAL A 92 -5.544 -0.392 5.448 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.341 -2.487 6.295 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.416 -2.646 4.713 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.133 -2.905 5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.780 -1.260 5.860 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.742 -2.387 7.236 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -4.653 -4.844 5.463 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.414 -4.555 7.046 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.417 -4.639 5.578 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.036 -1.023 8.588 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.097 -0.600 9.988 1.00 0.00 C ATOM 1262 C VAL A 93 -5.824 0.134 10.468 1.00 0.00 C ATOM 1263 O VAL A 93 -5.910 0.993 11.338 1.00 0.00 O ATOM 1264 CB VAL A 93 -7.474 -1.763 10.949 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -8.260 -1.161 12.115 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -8.405 -2.834 10.334 1.00 0.00 C ATOM 0 H VAL A 93 -7.694 -0.487 8.022 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.906 0.130 10.024 1.00 0.00 H new ATOM 0 HB VAL A 93 -6.535 -2.246 11.221 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.541 -1.951 12.811 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.641 -0.427 12.631 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -9.159 -0.675 11.735 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -8.614 -3.604 11.076 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.340 -2.368 10.022 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.919 -3.286 9.469 1.00 0.00 H new ATOM 1276 N LEU A 94 -4.683 -0.177 9.834 1.00 0.00 N ATOM 1277 CA LEU A 94 -3.274 0.129 10.099 1.00 0.00 C ATOM 1278 C LEU A 94 -2.499 -1.164 9.815 1.00 0.00 C ATOM 1279 O LEU A 94 -2.659 -2.160 10.518 1.00 0.00 O ATOM 1280 CB LEU A 94 -3.004 0.659 11.528 1.00 0.00 C ATOM 1281 CG LEU A 94 -1.509 0.785 11.903 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -0.745 1.758 10.990 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -1.384 1.253 13.360 1.00 0.00 C ATOM 0 H LEU A 94 -4.745 -0.741 8.986 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.949 0.947 9.456 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.474 1.637 11.632 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.489 -0.005 12.244 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.062 -0.201 11.773 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.299 1.805 11.301 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.801 1.409 9.959 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.190 2.750 11.062 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.330 1.342 13.624 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.870 2.222 13.474 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.863 0.528 14.018 1.00 0.00 H new ATOM 1295 N ALA A 95 -1.669 -1.171 8.773 1.00 0.00 N ATOM 1296 CA ALA A 95 -0.709 -2.244 8.518 1.00 0.00 C ATOM 1297 C ALA A 95 0.217 -2.472 9.735 1.00 0.00 C ATOM 1298 O ALA A 95 1.084 -1.654 10.033 1.00 0.00 O ATOM 1299 CB ALA A 95 0.075 -1.912 7.240 1.00 0.00 C ATOM 0 H ALA A 95 -1.644 -0.426 8.076 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.239 -3.184 8.367 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.795 -2.705 7.038 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.616 -1.827 6.401 1.00 0.00 H new ATOM 0 HB3 ALA A 95 0.603 -0.968 7.372 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.026 -3.581 10.434 1.00 0.00 N ATOM 1306 CA VAL A 96 0.806 -4.170 11.507 1.00 0.00 C ATOM 1307 C VAL A 96 2.220 -4.499 10.989 1.00 0.00 C ATOM 1308 O VAL A 96 2.419 -4.681 9.791 1.00 0.00 O ATOM 1309 CB VAL A 96 0.151 -5.455 12.095 1.00 0.00 C ATOM 1310 CG1 VAL A 96 0.800 -5.931 13.408 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.350 -5.271 12.384 1.00 0.00 C ATOM 0 H VAL A 96 -0.864 -4.136 10.261 1.00 0.00 H new ATOM 0 HA VAL A 96 0.882 -3.427 12.300 1.00 0.00 H new ATOM 0 HB VAL A 96 0.307 -6.202 11.316 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.293 -6.830 13.759 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.853 -6.153 13.234 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.714 -5.148 14.161 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.758 -6.196 12.792 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.486 -4.465 13.105 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.871 -5.022 11.459 1.00 0.00 H new ATOM 1321 N ASP A 97 3.197 -4.620 11.889 1.00 0.00 N ATOM 1322 CA ASP A 97 4.606 -4.919 11.606 1.00 0.00 C ATOM 1323 C ASP A 97 4.943 -6.417 11.489 1.00 0.00 C ATOM 1324 O ASP A 97 6.108 -6.796 11.598 1.00 0.00 O ATOM 1325 CB ASP A 97 5.482 -4.205 12.655 1.00 0.00 C ATOM 1326 CG ASP A 97 5.199 -4.556 14.125 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.018 -4.749 14.500 1.00 0.00 O ATOM 1328 OD2 ASP A 97 6.114 -4.328 14.943 1.00 0.00 O ATOM 0 H ASP A 97 3.020 -4.507 12.887 1.00 0.00 H new ATOM 0 HA ASP A 97 4.822 -4.536 10.609 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.526 -4.434 12.443 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.359 -3.129 12.529 1.00 0.00 H new ATOM 1333 N THR A 98 3.942 -7.279 11.265 1.00 0.00 N ATOM 1334 CA THR A 98 4.123 -8.733 11.168 1.00 0.00 C ATOM 1335 C THR A 98 4.748 -9.142 9.835 1.00 0.00 C ATOM 1336 O THR A 98 4.068 -9.345 8.824 1.00 0.00 O ATOM 1337 CB THR A 98 2.828 -9.487 11.472 1.00 0.00 C ATOM 1338 OG1 THR A 98 1.729 -8.875 10.824 1.00 0.00 O ATOM 1339 CG2 THR A 98 2.548 -9.520 12.974 1.00 0.00 C ATOM 0 H THR A 98 2.973 -6.983 11.145 1.00 0.00 H new ATOM 0 HA THR A 98 4.836 -9.024 11.940 1.00 0.00 H new ATOM 0 HB THR A 98 2.955 -10.505 11.105 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.779 -9.049 9.861 1.00 0.00 H new ATOM 0 HG21 THR A 98 1.621 -10.063 13.159 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.370 -10.020 13.486 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.453 -8.501 13.349 1.00 0.00 H new ATOM 1347 N ASP A 99 6.065 -9.329 9.867 1.00 0.00 N ATOM 1348 CA ASP A 99 6.897 -9.908 8.799 1.00 0.00 C ATOM 1349 C ASP A 99 6.978 -11.452 8.948 1.00 0.00 C ATOM 1350 O ASP A 99 8.035 -12.081 8.989 1.00 0.00 O ATOM 1351 CB ASP A 99 8.244 -9.146 8.715 1.00 0.00 C ATOM 1352 CG ASP A 99 8.615 -8.795 7.267 1.00 0.00 C ATOM 1353 OD1 ASP A 99 8.479 -9.665 6.377 1.00 0.00 O ATOM 1354 OD2 ASP A 99 8.990 -7.634 6.971 1.00 0.00 O ATOM 0 H ASP A 99 6.618 -9.068 10.683 1.00 0.00 H new ATOM 0 HA ASP A 99 6.442 -9.768 7.819 1.00 0.00 H new ATOM 0 HB2 ASP A 99 8.181 -8.232 9.305 1.00 0.00 H new ATOM 0 HB3 ASP A 99 9.034 -9.755 9.154 1.00 0.00 H new ATOM 1359 N GLN A 100 5.794 -12.050 9.110 1.00 0.00 N ATOM 1360 CA GLN A 100 5.537 -13.451 9.483 1.00 0.00 C ATOM 1361 C GLN A 100 5.111 -14.316 8.272 1.00 0.00 C ATOM 1362 O GLN A 100 5.117 -13.831 7.136 1.00 0.00 O ATOM 1363 CB GLN A 100 4.408 -13.412 10.554 1.00 0.00 C ATOM 1364 CG GLN A 100 4.882 -13.012 11.957 1.00 0.00 C ATOM 1365 CD GLN A 100 6.114 -13.791 12.436 1.00 0.00 C ATOM 1366 OE1 GLN A 100 6.126 -15.021 12.541 1.00 0.00 O ATOM 1367 NE2 GLN A 100 7.228 -13.121 12.633 1.00 0.00 N ATOM 0 H GLN A 100 4.925 -11.533 8.975 1.00 0.00 H new ATOM 0 HA GLN A 100 6.448 -13.912 9.866 1.00 0.00 H new ATOM 0 HB2 GLN A 100 3.639 -12.711 10.229 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.940 -14.395 10.608 1.00 0.00 H new ATOM 0 HG2 GLN A 100 5.111 -11.946 11.964 1.00 0.00 H new ATOM 0 HG3 GLN A 100 4.067 -13.167 12.664 1.00 0.00 H new ATOM 0 HE21 GLN A 100 7.233 -12.104 12.550 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.087 -13.618 12.869 1.00 0.00 H new ATOM 1376 N PRO A 101 4.729 -15.598 8.464 1.00 0.00 N ATOM 1377 CA PRO A 101 4.004 -16.373 7.456 1.00 0.00 C ATOM 1378 C PRO A 101 2.614 -15.772 7.214 1.00 0.00 C ATOM 1379 O PRO A 101 2.033 -15.186 8.128 1.00 0.00 O ATOM 1380 CB PRO A 101 3.922 -17.802 8.004 1.00 0.00 C ATOM 1381 CG PRO A 101 4.087 -17.623 9.505 1.00 0.00 C ATOM 1382 CD PRO A 101 5.093 -16.482 9.567 1.00 0.00 C ATOM 0 HA PRO A 101 4.509 -16.361 6.490 1.00 0.00 H new ATOM 0 HB2 PRO A 101 2.969 -18.271 7.759 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.705 -18.436 7.588 1.00 0.00 H new ATOM 0 HG2 PRO A 101 3.147 -17.367 9.993 1.00 0.00 H new ATOM 0 HG3 PRO A 101 4.461 -18.526 9.987 1.00 0.00 H new ATOM 0 HD2 PRO A 101 5.041 -15.962 10.523 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.114 -16.849 9.458 1.00 0.00 H new ATOM 1390 N CYS A 102 2.072 -15.903 5.995 1.00 0.00 N ATOM 1391 CA CYS A 102 0.862 -15.201 5.600 1.00 0.00 C ATOM 1392 C CYS A 102 -0.384 -15.538 6.431 1.00 0.00 C ATOM 1393 O CYS A 102 -0.451 -16.465 7.232 1.00 0.00 O ATOM 1394 CB CYS A 102 0.619 -15.360 4.091 1.00 0.00 C ATOM 1395 SG CYS A 102 -0.383 -13.982 3.413 1.00 0.00 S ATOM 0 H CYS A 102 2.464 -16.497 5.265 1.00 0.00 H new ATOM 0 HA CYS A 102 1.041 -14.149 5.821 1.00 0.00 H new ATOM 0 HB2 CYS A 102 1.576 -15.403 3.571 1.00 0.00 H new ATOM 0 HB3 CYS A 102 0.111 -16.306 3.902 1.00 0.00 H new ATOM 0 HG CYS A 102 -0.549 -14.154 2.135 1.00 0.00 H new ATOM 1476 N LEU B 11 1.153 -8.942 7.898 1.00 0.00 N ATOM 1477 CA LEU B 11 0.831 -7.727 7.151 1.00 0.00 C ATOM 1478 C LEU B 11 1.956 -7.318 6.175 1.00 0.00 C ATOM 1479 O LEU B 11 1.679 -6.639 5.192 1.00 0.00 O ATOM 1480 CB LEU B 11 0.465 -6.609 8.148 1.00 0.00 C ATOM 1481 CG LEU B 11 -1.020 -6.547 8.575 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -1.936 -6.123 7.418 1.00 0.00 C ATOM 1483 CD2 LEU B 11 -1.545 -7.844 9.207 1.00 0.00 C ATOM 0 HA LEU B 11 -0.032 -7.920 6.513 1.00 0.00 H new ATOM 0 HB2 LEU B 11 1.076 -6.732 9.042 1.00 0.00 H new ATOM 0 HB3 LEU B 11 0.737 -5.651 7.706 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.047 -5.782 9.351 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -2.969 -6.093 7.764 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -1.643 -5.134 7.065 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -1.847 -6.840 6.602 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -2.593 -7.718 9.478 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -1.451 -8.661 8.492 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -0.964 -8.075 10.100 1.00 0.00 H new ATOM 1495 N ALA B 12 3.195 -7.808 6.313 1.00 0.00 N ATOM 1496 CA ALA B 12 4.224 -7.596 5.278 1.00 0.00 C ATOM 1497 C ALA B 12 3.833 -8.222 3.920 1.00 0.00 C ATOM 1498 O ALA B 12 4.187 -7.708 2.858 1.00 0.00 O ATOM 1499 CB ALA B 12 5.557 -8.147 5.782 1.00 0.00 C ATOM 0 H ALA B 12 3.510 -8.348 7.119 1.00 0.00 H new ATOM 0 HA ALA B 12 4.316 -6.525 5.098 1.00 0.00 H new ATOM 0 HB1 ALA B 12 6.324 -7.995 5.023 1.00 0.00 H new ATOM 0 HB2 ALA B 12 5.843 -7.627 6.696 1.00 0.00 H new ATOM 0 HB3 ALA B 12 5.456 -9.213 5.987 1.00 0.00 H new ATOM 1505 N ARG B 13 3.040 -9.302 3.951 1.00 0.00 N ATOM 1506 CA ARG B 13 2.413 -9.894 2.761 1.00 0.00 C ATOM 1507 C ARG B 13 1.374 -8.945 2.133 1.00 0.00 C ATOM 1508 O ARG B 13 1.309 -8.843 0.905 1.00 0.00 O ATOM 1509 CB ARG B 13 1.742 -11.223 3.144 1.00 0.00 C ATOM 1510 CG ARG B 13 2.714 -12.336 3.592 1.00 0.00 C ATOM 1511 CD ARG B 13 3.321 -13.141 2.428 1.00 0.00 C ATOM 1512 NE ARG B 13 3.771 -14.490 2.833 1.00 0.00 N ATOM 1513 CZ ARG B 13 4.665 -14.808 3.759 1.00 0.00 C ATOM 1514 NH1 ARG B 13 5.370 -13.897 4.389 1.00 0.00 N ATOM 1515 NH2 ARG B 13 4.842 -16.073 4.065 1.00 0.00 N ATOM 0 H ARG B 13 2.813 -9.795 4.814 1.00 0.00 H new ATOM 0 HA ARG B 13 3.192 -10.070 2.019 1.00 0.00 H new ATOM 0 HB2 ARG B 13 1.031 -11.036 3.949 1.00 0.00 H new ATOM 0 HB3 ARG B 13 1.169 -11.583 2.290 1.00 0.00 H new ATOM 0 HG2 ARG B 13 3.522 -11.888 4.171 1.00 0.00 H new ATOM 0 HG3 ARG B 13 2.186 -13.020 4.257 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.581 -13.234 1.633 1.00 0.00 H new ATOM 0 HD3 ARG B 13 4.166 -12.591 2.014 1.00 0.00 H new ATOM 0 HE ARG B 13 3.341 -15.272 2.339 1.00 0.00 H new ATOM 0 HH11 ARG B 13 5.238 -12.909 4.171 1.00 0.00 H new ATOM 0 HH12 ARG B 13 6.050 -14.177 5.096 1.00 0.00 H new ATOM 0 HH21 ARG B 13 4.296 -16.793 3.593 1.00 0.00 H new ATOM 0 HH22 ARG B 13 5.526 -16.335 4.775 1.00 0.00 H new ATOM 1529 N LEU B 14 0.585 -8.238 2.957 1.00 0.00 N ATOM 1530 CA LEU B 14 -0.474 -7.314 2.528 1.00 0.00 C ATOM 1531 C LEU B 14 0.068 -6.209 1.611 1.00 0.00 C ATOM 1532 O LEU B 14 -0.555 -5.929 0.590 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.230 -6.815 3.784 1.00 0.00 C ATOM 1534 CG LEU B 14 -2.249 -5.664 3.678 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -1.602 -4.274 3.565 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -3.296 -5.889 2.590 1.00 0.00 C ATOM 0 H LEU B 14 0.670 -8.296 3.972 1.00 0.00 H new ATOM 0 HA LEU B 14 -1.202 -7.828 1.900 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -1.756 -7.672 4.205 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -0.478 -6.513 4.513 1.00 0.00 H new ATOM 0 HG LEU B 14 -2.776 -5.677 4.632 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -2.381 -3.515 3.494 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -0.990 -4.085 4.447 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -0.976 -4.236 2.674 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -3.984 -5.044 2.566 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -2.802 -5.982 1.623 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.851 -6.802 2.803 1.00 0.00 H new ATOM 1548 N GLY B 15 1.242 -5.620 1.881 1.00 0.00 N ATOM 1549 CA GLY B 15 1.761 -4.532 1.030 1.00 0.00 C ATOM 1550 C GLY B 15 2.018 -4.958 -0.418 1.00 0.00 C ATOM 1551 O GLY B 15 1.707 -4.208 -1.340 1.00 0.00 O ATOM 0 H GLY B 15 1.843 -5.870 2.666 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.050 -3.706 1.036 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.690 -4.157 1.460 1.00 0.00 H new ATOM 1555 N ARG B 16 2.502 -6.191 -0.637 1.00 0.00 N ATOM 1556 CA ARG B 16 2.592 -6.767 -1.986 1.00 0.00 C ATOM 1557 C ARG B 16 1.244 -7.329 -2.461 1.00 0.00 C ATOM 1558 O ARG B 16 1.011 -7.377 -3.652 1.00 0.00 O ATOM 1559 CB ARG B 16 3.715 -7.819 -2.112 1.00 0.00 C ATOM 1560 CG ARG B 16 4.380 -7.733 -3.504 1.00 0.00 C ATOM 1561 CD ARG B 16 5.161 -9.002 -3.891 1.00 0.00 C ATOM 1562 NE ARG B 16 6.047 -8.812 -5.063 1.00 0.00 N ATOM 1563 CZ ARG B 16 5.670 -8.536 -6.308 1.00 0.00 C ATOM 1564 NH1 ARG B 16 4.425 -8.402 -6.671 1.00 0.00 N ATOM 1565 NH2 ARG B 16 6.555 -8.365 -7.254 1.00 0.00 N ATOM 0 H ARG B 16 2.837 -6.807 0.104 1.00 0.00 H new ATOM 0 HA ARG B 16 2.858 -5.943 -2.648 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.462 -7.658 -1.335 1.00 0.00 H new ATOM 0 HB3 ARG B 16 3.306 -8.817 -1.959 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.612 -7.546 -4.254 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.057 -6.879 -3.522 1.00 0.00 H new ATOM 0 HD2 ARG B 16 5.761 -9.325 -3.040 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.454 -9.804 -4.105 1.00 0.00 H new ATOM 0 HE ARG B 16 7.050 -8.902 -4.898 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.679 -8.509 -5.984 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.197 -8.190 -7.642 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.550 -8.443 -7.042 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.251 -8.154 -8.205 1.00 0.00 H new ATOM 1579 N ALA B 17 0.312 -7.708 -1.578 1.00 0.00 N ATOM 1580 CA ALA B 17 -1.057 -8.052 -1.978 1.00 0.00 C ATOM 1581 C ALA B 17 -1.789 -6.876 -2.637 1.00 0.00 C ATOM 1582 O ALA B 17 -2.592 -7.094 -3.542 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.837 -8.582 -0.766 1.00 0.00 C ATOM 0 H ALA B 17 0.483 -7.784 -0.575 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.995 -8.836 -2.733 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.853 -8.836 -1.070 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.342 -9.471 -0.375 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -1.870 -7.816 0.009 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.500 -5.653 -2.188 1.00 0.00 N ATOM 1590 CA LEU B 18 -2.014 -4.419 -2.779 1.00 0.00 C ATOM 1591 C LEU B 18 -1.163 -3.981 -3.982 1.00 0.00 C ATOM 1592 O LEU B 18 -1.745 -3.644 -5.011 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.150 -3.369 -1.656 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.445 -3.590 -0.829 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.320 -2.935 0.548 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.714 -3.037 -1.510 1.00 0.00 C ATOM 0 H LEU B 18 -0.890 -5.491 -1.387 1.00 0.00 H new ATOM 0 HA LEU B 18 -3.007 -4.566 -3.204 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.283 -3.423 -0.998 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.159 -2.369 -2.090 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.554 -4.671 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.237 -3.100 1.114 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -2.479 -3.373 1.084 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.155 -1.864 0.428 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.580 -3.227 -0.875 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.606 -1.963 -1.664 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.855 -3.529 -2.472 1.00 0.00 H new ATOM 1608 N ALA B 19 0.171 -4.059 -3.916 1.00 0.00 N ATOM 1609 CA ALA B 19 1.085 -3.805 -5.042 1.00 0.00 C ATOM 1610 C ALA B 19 1.590 -5.107 -5.708 1.00 0.00 C ATOM 1611 O ALA B 19 2.782 -5.422 -5.677 1.00 0.00 O ATOM 1612 CB ALA B 19 2.221 -2.899 -4.544 1.00 0.00 C ATOM 0 H ALA B 19 0.660 -4.307 -3.056 1.00 0.00 H new ATOM 0 HA ALA B 19 0.546 -3.292 -5.839 1.00 0.00 H new ATOM 0 HB1 ALA B 19 2.911 -2.697 -5.363 1.00 0.00 H new ATOM 0 HB2 ALA B 19 1.804 -1.959 -4.181 1.00 0.00 H new ATOM 0 HB3 ALA B 19 2.755 -3.396 -3.734 1.00 0.00 H new ATOM 1618 N ASP B 20 0.670 -5.855 -6.319 1.00 0.00 N ATOM 1619 CA ASP B 20 0.920 -7.089 -7.069 1.00 0.00 C ATOM 1620 C ASP B 20 0.428 -6.903 -8.519 1.00 0.00 C ATOM 1621 O ASP B 20 -0.594 -6.240 -8.724 1.00 0.00 O ATOM 1622 CB ASP B 20 0.132 -8.257 -6.444 1.00 0.00 C ATOM 1623 CG ASP B 20 0.912 -9.455 -5.891 1.00 0.00 C ATOM 1624 OD1 ASP B 20 2.136 -9.384 -5.667 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.253 -10.512 -5.722 1.00 0.00 O ATOM 0 H ASP B 20 -0.319 -5.605 -6.304 1.00 0.00 H new ATOM 0 HA ASP B 20 1.988 -7.308 -7.045 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.472 -7.852 -5.632 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.559 -8.632 -7.199 1.00 0.00 H new ATOM 1630 N PRO B 21 1.054 -7.567 -9.508 1.00 0.00 N ATOM 1631 CA PRO B 21 0.808 -7.357 -10.936 1.00 0.00 C ATOM 1632 C PRO B 21 -0.648 -7.631 -11.333 1.00 0.00 C ATOM 1633 O PRO B 21 -1.372 -6.727 -11.757 1.00 0.00 O ATOM 1634 CB PRO B 21 1.801 -8.289 -11.652 1.00 0.00 C ATOM 1635 CG PRO B 21 2.077 -9.383 -10.618 1.00 0.00 C ATOM 1636 CD PRO B 21 2.075 -8.585 -9.324 1.00 0.00 C ATOM 0 HA PRO B 21 0.961 -6.315 -11.218 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.376 -8.701 -12.567 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.714 -7.763 -11.933 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.309 -10.156 -10.624 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.031 -9.880 -10.792 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.847 -9.221 -8.469 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.050 -8.136 -9.136 1.00 0.00 H new ATOM 1644 N THR B 22 -1.098 -8.882 -11.184 1.00 0.00 N ATOM 1645 CA THR B 22 -2.495 -9.245 -11.423 1.00 0.00 C ATOM 1646 C THR B 22 -3.354 -8.825 -10.238 1.00 0.00 C ATOM 1647 O THR B 22 -4.462 -8.356 -10.453 1.00 0.00 O ATOM 1648 CB THR B 22 -2.637 -10.742 -11.723 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.582 -11.152 -12.557 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.946 -11.076 -12.439 1.00 0.00 C ATOM 0 H THR B 22 -0.508 -9.663 -10.897 1.00 0.00 H new ATOM 0 HA THR B 22 -2.847 -8.710 -12.305 1.00 0.00 H new ATOM 0 HB THR B 22 -2.622 -11.259 -10.763 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.670 -12.109 -12.749 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.995 -12.149 -12.627 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.788 -10.779 -11.815 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.990 -10.539 -13.387 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.865 -8.942 -8.995 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.710 -8.770 -7.802 1.00 0.00 C ATOM 1660 C ARG B 23 -4.230 -7.334 -7.606 1.00 0.00 C ATOM 1661 O ARG B 23 -5.399 -7.174 -7.256 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.984 -9.254 -6.538 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.882 -10.118 -5.662 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.354 -10.303 -4.226 1.00 0.00 C ATOM 1665 NE ARG B 23 -1.988 -10.824 -4.144 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.391 -11.373 -3.094 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -1.964 -11.510 -1.917 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.149 -11.766 -3.233 1.00 0.00 N ATOM 0 H ARG B 23 -1.889 -9.155 -8.789 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.589 -9.391 -7.975 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.099 -9.823 -6.823 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.639 -8.393 -5.966 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.874 -9.669 -5.620 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.995 -11.097 -6.127 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.395 -9.343 -3.711 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -4.020 -10.980 -3.692 1.00 0.00 H new ATOM 0 HE ARG B 23 -1.429 -10.757 -4.995 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -2.920 -11.185 -1.774 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -1.452 -11.941 -1.147 1.00 0.00 H new ATOM 0 HH21 ARG B 23 0.327 -11.646 -4.127 1.00 0.00 H new ATOM 0 HH22 ARG B 23 0.342 -12.192 -2.447 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.439 -6.295 -7.910 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.923 -4.902 -7.917 1.00 0.00 C ATOM 1684 C CYS B 24 -5.025 -4.702 -8.975 1.00 0.00 C ATOM 1685 O CYS B 24 -6.139 -4.274 -8.671 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.729 -3.962 -8.157 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.250 -2.254 -7.842 1.00 0.00 S ATOM 0 H CYS B 24 -2.454 -6.392 -8.156 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.371 -4.667 -6.952 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.901 -4.230 -7.501 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.370 -4.063 -9.181 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.247 -1.451 -8.040 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.757 -5.157 -10.204 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.730 -5.195 -11.300 1.00 0.00 C ATOM 1695 C ARG B 25 -7.034 -5.935 -10.924 1.00 0.00 C ATOM 1696 O ARG B 25 -8.120 -5.413 -11.139 1.00 0.00 O ATOM 1697 CB ARG B 25 -5.060 -5.816 -12.530 1.00 0.00 C ATOM 1698 CG ARG B 25 -4.097 -4.841 -13.227 1.00 0.00 C ATOM 1699 CD ARG B 25 -3.360 -5.503 -14.399 1.00 0.00 C ATOM 1700 NE ARG B 25 -2.489 -4.529 -15.082 1.00 0.00 N ATOM 1701 CZ ARG B 25 -1.216 -4.684 -15.430 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -0.573 -5.827 -15.343 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -0.544 -3.649 -15.875 1.00 0.00 N ATOM 0 H ARG B 25 -3.840 -5.516 -10.469 1.00 0.00 H new ATOM 0 HA ARG B 25 -6.036 -4.173 -11.524 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.514 -6.710 -12.230 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.827 -6.133 -13.237 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.655 -3.978 -13.590 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -3.370 -4.470 -12.504 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -2.763 -6.339 -14.034 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -4.082 -5.911 -15.106 1.00 0.00 H new ATOM 0 HE ARG B 25 -2.913 -3.631 -15.315 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -1.052 -6.656 -14.993 1.00 0.00 H new ATOM 0 HH12 ARG B 25 0.405 -5.885 -15.626 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -0.999 -2.739 -15.950 1.00 0.00 H new ATOM 0 HH22 ARG B 25 0.434 -3.754 -16.146 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.938 -7.116 -10.306 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.081 -7.849 -9.704 1.00 0.00 C ATOM 1719 C ILE B 26 -8.863 -6.948 -8.759 1.00 0.00 C ATOM 1720 O ILE B 26 -10.073 -6.829 -8.915 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.617 -9.127 -8.956 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -7.149 -10.212 -9.935 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.661 -9.705 -7.981 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -8.265 -10.961 -10.670 1.00 0.00 C ATOM 0 H ILE B 26 -6.051 -7.608 -10.202 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.732 -8.156 -10.523 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.775 -8.803 -8.345 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.495 -9.751 -10.676 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.548 -10.937 -9.387 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.256 -10.596 -7.501 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -8.901 -8.961 -7.222 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.565 -9.968 -8.530 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.827 -11.704 -11.336 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.909 -11.458 -9.944 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.855 -10.254 -11.253 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.187 -6.319 -7.792 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.829 -5.413 -6.836 1.00 0.00 C ATOM 1738 C LEU B 27 -9.546 -4.257 -7.545 1.00 0.00 C ATOM 1739 O LEU B 27 -10.712 -4.031 -7.237 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.816 -4.904 -5.786 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.369 -5.944 -4.736 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.243 -5.358 -3.874 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.515 -6.338 -3.798 1.00 0.00 C ATOM 0 H LEU B 27 -7.182 -6.424 -7.651 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.593 -5.980 -6.305 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.932 -4.537 -6.307 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.255 -4.053 -5.265 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.034 -6.826 -5.282 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.930 -6.095 -3.134 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.396 -5.099 -4.509 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.602 -4.463 -3.366 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.158 -7.071 -3.075 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.874 -5.454 -3.271 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.330 -6.769 -4.380 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.919 -3.575 -8.512 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.584 -2.451 -9.218 1.00 0.00 C ATOM 1757 C VAL B 28 -10.807 -2.898 -10.028 1.00 0.00 C ATOM 1758 O VAL B 28 -11.826 -2.213 -10.024 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.670 -1.527 -10.066 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.351 -1.189 -9.357 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.345 -2.017 -11.487 1.00 0.00 C ATOM 0 H VAL B 28 -7.968 -3.770 -8.826 1.00 0.00 H new ATOM 0 HA VAL B 28 -9.915 -1.824 -8.390 1.00 0.00 H new ATOM 0 HB VAL B 28 -9.288 -0.636 -10.174 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.751 -0.540 -9.995 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.563 -0.678 -8.418 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -6.801 -2.108 -9.154 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -7.701 -1.292 -11.984 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -7.834 -2.978 -11.432 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.269 -2.129 -12.054 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.724 -4.060 -10.689 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.808 -4.599 -11.512 1.00 0.00 C ATOM 1773 C ALA B 29 -12.902 -5.328 -10.707 1.00 0.00 C ATOM 1774 O ALA B 29 -13.950 -5.672 -11.254 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.177 -5.478 -12.595 1.00 0.00 C ATOM 0 H ALA B 29 -9.896 -4.655 -10.666 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.348 -3.771 -11.972 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.961 -5.896 -13.227 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -10.502 -4.877 -13.204 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.618 -6.288 -12.126 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.684 -5.554 -9.407 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.729 -6.023 -8.503 1.00 0.00 C ATOM 1783 C LEU B 30 -14.798 -4.974 -8.239 1.00 0.00 C ATOM 1784 O LEU B 30 -15.979 -5.321 -8.281 1.00 0.00 O ATOM 1785 CB LEU B 30 -13.089 -6.483 -7.178 1.00 0.00 C ATOM 1786 CG LEU B 30 -12.680 -7.959 -7.225 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -12.003 -8.358 -5.922 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.929 -8.803 -7.440 1.00 0.00 C ATOM 0 H LEU B 30 -11.779 -5.416 -8.957 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.232 -6.860 -8.988 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.213 -5.870 -6.965 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -13.793 -6.327 -6.361 1.00 0.00 H new ATOM 0 HG LEU B 30 -11.976 -8.120 -8.042 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -11.717 -9.409 -5.967 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -11.114 -7.746 -5.772 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -12.693 -8.205 -5.092 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.654 -9.857 -7.476 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -14.626 -8.637 -6.618 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -14.402 -8.519 -8.380 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.359 -3.745 -7.980 1.00 0.00 N ATOM 1801 CA LEU B 31 -15.138 -2.563 -7.624 1.00 0.00 C ATOM 1802 C LEU B 31 -16.393 -2.396 -8.501 1.00 0.00 C ATOM 1803 O LEU B 31 -17.499 -2.509 -7.983 1.00 0.00 O ATOM 1804 CB LEU B 31 -14.146 -1.395 -7.749 1.00 0.00 C ATOM 1805 CG LEU B 31 -14.337 -0.176 -6.830 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -13.302 0.829 -7.326 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -15.749 0.420 -6.841 1.00 0.00 C ATOM 0 H LEU B 31 -13.362 -3.533 -8.017 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.548 -2.629 -6.616 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -13.145 -1.789 -7.575 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -14.175 -1.042 -8.780 1.00 0.00 H new ATOM 0 HG LEU B 31 -14.204 -0.463 -5.787 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -13.362 1.738 -6.728 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -12.305 0.399 -7.234 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -13.499 1.069 -8.371 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -15.789 1.274 -6.165 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -15.999 0.745 -7.851 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -16.465 -0.335 -6.515 1.00 0.00 H new ATOM 1819 N ASP B 32 -16.201 -2.196 -9.810 1.00 0.00 N ATOM 1820 CA ASP B 32 -17.247 -1.957 -10.826 1.00 0.00 C ATOM 1821 C ASP B 32 -17.672 -3.252 -11.567 1.00 0.00 C ATOM 1822 O ASP B 32 -18.424 -3.228 -12.542 1.00 0.00 O ATOM 1823 CB ASP B 32 -16.739 -0.877 -11.801 1.00 0.00 C ATOM 1824 CG ASP B 32 -16.617 0.510 -11.150 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -15.548 0.781 -10.554 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -17.583 1.296 -11.276 1.00 0.00 O ATOM 0 H ASP B 32 -15.265 -2.195 -10.216 1.00 0.00 H new ATOM 0 HA ASP B 32 -18.150 -1.607 -10.326 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -15.766 -1.176 -12.191 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -17.418 -0.815 -12.651 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.179 -4.396 -11.079 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.514 -5.764 -11.484 1.00 0.00 C ATOM 1833 C GLY B 33 -18.529 -6.361 -10.537 1.00 0.00 C ATOM 1834 O GLY B 33 -19.722 -6.360 -10.827 1.00 0.00 O ATOM 0 H GLY B 33 -16.482 -4.388 -10.334 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.911 -5.762 -12.499 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.613 -6.377 -11.495 1.00 0.00 H new ATOM 1838 N VAL B 34 -18.028 -6.937 -9.442 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.772 -7.802 -8.505 1.00 0.00 C ATOM 1840 C VAL B 34 -19.838 -8.664 -9.184 1.00 0.00 C ATOM 1841 O VAL B 34 -20.973 -8.792 -8.721 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.312 -7.065 -7.263 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.236 -7.088 -6.190 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.843 -5.662 -7.569 1.00 0.00 C ATOM 0 H VAL B 34 -17.054 -6.813 -9.167 1.00 0.00 H new ATOM 0 HA VAL B 34 -18.020 -8.495 -8.127 1.00 0.00 H new ATOM 0 HB VAL B 34 -20.193 -7.589 -6.892 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.598 -6.571 -5.301 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.996 -8.121 -5.937 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.341 -6.589 -6.561 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.207 -5.202 -6.650 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.042 -5.053 -7.987 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.659 -5.731 -8.288 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.438 -9.251 -10.307 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.212 -10.265 -10.988 1.00 0.00 C ATOM 1856 C CYS B 35 -19.579 -11.644 -10.751 1.00 0.00 C ATOM 1857 O CYS B 35 -18.890 -11.918 -9.765 1.00 0.00 O ATOM 1858 CB CYS B 35 -20.437 -9.841 -12.458 1.00 0.00 C ATOM 1859 SG CYS B 35 -21.505 -8.377 -12.531 1.00 0.00 S ATOM 0 H CYS B 35 -18.556 -9.029 -10.770 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.218 -10.362 -10.580 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.480 -9.626 -12.933 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.892 -10.660 -13.015 1.00 0.00 H new ATOM 0 HG CYS B 35 -20.940 -7.396 -11.893 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.686 -12.462 -11.777 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.551 -13.914 -11.693 1.00 0.00 C ATOM 1867 C TYR B 36 -18.175 -14.482 -11.286 1.00 0.00 C ATOM 1868 O TYR B 36 -17.161 -13.771 -11.323 1.00 0.00 O ATOM 1869 CB TYR B 36 -20.105 -14.557 -12.987 1.00 0.00 C ATOM 1870 CG TYR B 36 -20.895 -13.658 -13.917 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -22.213 -13.313 -13.582 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -20.304 -13.133 -15.084 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -22.955 -12.451 -14.409 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -21.040 -12.271 -15.921 1.00 0.00 C ATOM 1875 CZ TYR B 36 -22.373 -11.933 -15.587 1.00 0.00 C ATOM 1876 OH TYR B 36 -23.091 -11.104 -16.393 1.00 0.00 O ATOM 0 H TYR B 36 -19.875 -12.132 -12.724 1.00 0.00 H new ATOM 0 HA TYR B 36 -20.154 -14.202 -10.832 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -19.266 -14.970 -13.547 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -20.742 -15.395 -12.703 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -22.660 -13.712 -12.684 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -19.286 -13.392 -15.337 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -23.968 -12.186 -14.144 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -20.588 -11.869 -16.816 1.00 0.00 H new ATOM 0 HH TYR B 36 -22.542 -10.837 -17.160 1.00 0.00 H new ATOM 1886 N PRO B 37 -18.095 -15.783 -10.924 1.00 0.00 N ATOM 1887 CA PRO B 37 -16.862 -16.379 -10.446 1.00 0.00 C ATOM 1888 C PRO B 37 -15.919 -16.524 -11.641 1.00 0.00 C ATOM 1889 O PRO B 37 -16.196 -17.283 -12.563 1.00 0.00 O ATOM 1890 CB PRO B 37 -17.281 -17.708 -9.813 1.00 0.00 C ATOM 1891 CG PRO B 37 -18.505 -18.139 -10.616 1.00 0.00 C ATOM 1892 CD PRO B 37 -19.099 -16.827 -11.128 1.00 0.00 C ATOM 0 HA PRO B 37 -16.322 -15.791 -9.704 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -16.483 -18.448 -9.876 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -17.521 -17.587 -8.757 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -18.229 -18.799 -11.438 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -19.217 -18.683 -9.995 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -19.358 -16.909 -12.184 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -20.017 -16.586 -10.592 1.00 0.00 H new ATOM 1900 N GLY B 38 -14.840 -15.735 -11.653 1.00 0.00 N ATOM 1901 CA GLY B 38 -13.945 -15.633 -12.809 1.00 0.00 C ATOM 1902 C GLY B 38 -14.400 -14.649 -13.893 1.00 0.00 C ATOM 1903 O GLY B 38 -13.801 -14.649 -14.967 1.00 0.00 O ATOM 0 H GLY B 38 -14.563 -15.151 -10.864 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -12.957 -15.334 -12.460 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -13.840 -16.621 -13.257 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.387 -13.772 -13.624 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.749 -12.671 -14.540 1.00 0.00 C ATOM 1909 C GLN B 39 -14.537 -11.808 -14.875 1.00 0.00 C ATOM 1910 O GLN B 39 -14.382 -11.405 -16.022 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.946 -11.815 -14.043 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.730 -10.360 -13.533 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.602 -10.096 -12.029 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.744 -8.968 -11.588 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.383 -11.056 -11.160 1.00 0.00 N ATOM 0 H GLN B 39 -15.951 -13.805 -12.775 1.00 0.00 H new ATOM 0 HA GLN B 39 -16.092 -13.145 -15.459 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.664 -11.764 -14.861 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.422 -12.370 -13.235 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -15.827 -9.978 -14.009 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -17.562 -9.759 -13.900 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -16.258 -12.016 -11.481 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -16.338 -10.842 -10.164 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.653 -11.601 -13.889 1.00 0.00 N ATOM 1925 CA LEU B 40 -12.437 -10.800 -14.018 1.00 0.00 C ATOM 1926 C LEU B 40 -11.510 -11.257 -15.145 1.00 0.00 C ATOM 1927 O LEU B 40 -10.657 -10.479 -15.553 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.677 -10.743 -12.679 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.557 -10.205 -11.526 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -12.847 -11.312 -10.502 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.895 -9.005 -10.846 1.00 0.00 C ATOM 0 H LEU B 40 -13.771 -11.998 -12.957 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.768 -9.798 -14.291 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -11.319 -11.741 -12.424 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.798 -10.107 -12.789 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.504 -9.874 -11.952 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -13.467 -10.912 -9.700 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -13.372 -12.132 -10.992 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.908 -11.678 -10.087 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.534 -8.646 -10.039 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.930 -9.305 -10.438 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.749 -8.208 -11.575 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.684 -12.466 -15.682 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.929 -12.886 -16.855 1.00 0.00 C ATOM 1945 C ALA B 41 -11.176 -11.949 -18.050 1.00 0.00 C ATOM 1946 O ALA B 41 -10.224 -11.526 -18.692 1.00 0.00 O ATOM 1947 CB ALA B 41 -11.276 -14.347 -17.172 1.00 0.00 C ATOM 0 H ALA B 41 -12.336 -13.164 -15.324 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.861 -12.822 -16.645 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.716 -14.672 -18.049 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -11.015 -14.976 -16.321 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -12.344 -14.432 -17.372 1.00 0.00 H new ATOM 1953 N ALA B 42 -12.433 -11.564 -18.297 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.800 -10.599 -19.338 1.00 0.00 C ATOM 1955 C ALA B 42 -12.494 -9.140 -18.946 1.00 0.00 C ATOM 1956 O ALA B 42 -12.269 -8.306 -19.816 1.00 0.00 O ATOM 1957 CB ALA B 42 -14.287 -10.794 -19.659 1.00 0.00 C ATOM 0 H ALA B 42 -13.233 -11.918 -17.773 1.00 0.00 H new ATOM 0 HA ALA B 42 -12.191 -10.788 -20.222 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -14.588 -10.087 -20.432 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -14.452 -11.812 -20.013 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.879 -10.622 -18.760 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.441 -8.824 -17.645 1.00 0.00 N ATOM 1964 CA HIS B 43 -11.993 -7.501 -17.192 1.00 0.00 C ATOM 1965 C HIS B 43 -10.481 -7.275 -17.407 1.00 0.00 C ATOM 1966 O HIS B 43 -10.043 -6.137 -17.574 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.285 -7.322 -15.695 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.729 -7.292 -15.264 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.828 -6.948 -16.053 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -14.141 -7.416 -13.968 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -15.866 -6.851 -15.208 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -15.483 -7.124 -13.948 1.00 0.00 N ATOM 0 H HIS B 43 -12.701 -9.462 -16.893 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.543 -6.776 -17.791 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -11.791 -8.131 -15.157 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.818 -6.392 -15.371 1.00 0.00 H new ATOM 0 HD1 HIS B 43 -14.840 -6.801 -17.062 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.529 -7.691 -13.121 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -16.872 -6.589 -15.500 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.675 -8.344 -17.302 1.00 0.00 N ATOM 1981 CA LEU B 44 -8.210 -8.277 -17.255 1.00 0.00 C ATOM 1982 C LEU B 44 -7.490 -8.835 -18.489 1.00 0.00 C ATOM 1983 O LEU B 44 -6.300 -8.561 -18.634 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.703 -9.065 -16.028 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.125 -8.601 -14.621 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.160 -9.214 -13.597 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.131 -7.081 -14.443 1.00 0.00 C ATOM 0 H LEU B 44 -10.034 -9.297 -17.246 1.00 0.00 H new ATOM 0 HA LEU B 44 -7.978 -7.213 -17.207 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -8.025 -10.100 -16.144 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.614 -9.064 -16.063 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.152 -8.935 -14.473 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.444 -8.896 -12.594 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.206 -10.301 -13.659 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.144 -8.881 -13.809 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.439 -6.835 -13.427 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.130 -6.690 -14.624 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.829 -6.634 -15.151 1.00 0.00 H new ATOM 1999 N GLY B 45 -8.126 -9.681 -19.307 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.456 -10.432 -20.382 1.00 0.00 C ATOM 2001 C GLY B 45 -6.631 -11.625 -19.881 1.00 0.00 C ATOM 2002 O GLY B 45 -5.933 -12.277 -20.656 1.00 0.00 O ATOM 0 H GLY B 45 -9.127 -9.867 -19.244 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.208 -10.791 -21.085 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -6.802 -9.755 -20.933 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.677 -11.923 -18.574 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.978 -13.042 -17.942 1.00 0.00 C ATOM 2008 C LEU B 46 -6.931 -14.217 -17.709 1.00 0.00 C ATOM 2009 O LEU B 46 -8.013 -14.053 -17.156 1.00 0.00 O ATOM 2010 CB LEU B 46 -5.347 -12.591 -16.603 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.954 -11.929 -16.668 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -2.941 -12.804 -17.418 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -3.968 -10.524 -17.283 1.00 0.00 C ATOM 0 H LEU B 46 -7.220 -11.371 -17.910 1.00 0.00 H new ATOM 0 HA LEU B 46 -5.185 -13.373 -18.613 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -6.032 -11.890 -16.126 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -5.277 -13.462 -15.952 1.00 0.00 H new ATOM 0 HG LEU B 46 -3.646 -11.827 -15.628 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -1.974 -12.302 -17.441 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -2.840 -13.762 -16.908 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -3.288 -12.970 -18.438 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -2.955 -10.122 -17.295 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -4.350 -10.577 -18.302 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -4.609 -9.873 -16.689 1.00 0.00 H new ATOM 2025 N THR B 47 -6.486 -15.440 -18.021 1.00 0.00 N ATOM 2026 CA THR B 47 -7.273 -16.667 -17.807 1.00 0.00 C ATOM 2027 C THR B 47 -7.723 -16.830 -16.351 1.00 0.00 C ATOM 2028 O THR B 47 -7.062 -16.377 -15.410 1.00 0.00 O ATOM 2029 CB THR B 47 -6.526 -17.897 -18.344 1.00 0.00 C ATOM 2030 OG1 THR B 47 -7.269 -19.068 -18.082 1.00 0.00 O ATOM 2031 CG2 THR B 47 -5.144 -18.084 -17.720 1.00 0.00 C ATOM 0 H THR B 47 -5.567 -15.610 -18.430 1.00 0.00 H new ATOM 0 HA THR B 47 -8.193 -16.573 -18.383 1.00 0.00 H new ATOM 0 HB THR B 47 -6.403 -17.726 -19.413 1.00 0.00 H new ATOM 0 HG1 THR B 47 -6.786 -19.847 -18.429 1.00 0.00 H new ATOM 0 HG21 THR B 47 -4.671 -18.970 -18.143 1.00 0.00 H new ATOM 0 HG22 THR B 47 -4.529 -17.209 -17.930 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.245 -18.206 -16.642 1.00 0.00 H new ATOM 2039 N ARG B 48 -8.828 -17.565 -16.170 1.00 0.00 N ATOM 2040 CA ARG B 48 -9.388 -17.948 -14.866 1.00 0.00 C ATOM 2041 C ARG B 48 -8.360 -18.602 -13.923 1.00 0.00 C ATOM 2042 O ARG B 48 -8.528 -18.533 -12.709 1.00 0.00 O ATOM 2043 CB ARG B 48 -10.634 -18.837 -15.059 1.00 0.00 C ATOM 2044 CG ARG B 48 -10.379 -20.168 -15.794 1.00 0.00 C ATOM 2045 CD ARG B 48 -11.670 -20.994 -15.915 1.00 0.00 C ATOM 2046 NE ARG B 48 -11.443 -22.282 -16.605 1.00 0.00 N ATOM 2047 CZ ARG B 48 -11.505 -22.516 -17.914 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -11.757 -21.560 -18.786 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -11.309 -23.736 -18.375 1.00 0.00 N ATOM 0 H ARG B 48 -9.376 -17.922 -16.953 1.00 0.00 H new ATOM 0 HA ARG B 48 -9.688 -17.026 -14.368 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -11.060 -19.056 -14.080 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -11.383 -18.271 -15.613 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -9.979 -19.967 -16.788 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -9.625 -20.744 -15.257 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -12.074 -21.182 -14.920 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -12.419 -20.418 -16.459 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.213 -23.080 -16.012 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -11.912 -20.604 -18.465 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -11.797 -21.776 -19.782 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.110 -24.500 -17.729 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -11.356 -23.916 -19.378 1.00 0.00 H new ATOM 2063 N SER B 49 -7.289 -19.191 -14.458 1.00 0.00 N ATOM 2064 CA SER B 49 -6.143 -19.644 -13.656 1.00 0.00 C ATOM 2065 C SER B 49 -5.447 -18.451 -12.977 1.00 0.00 C ATOM 2066 O SER B 49 -5.559 -18.287 -11.766 1.00 0.00 O ATOM 2067 CB SER B 49 -5.172 -20.455 -14.525 1.00 0.00 C ATOM 2068 OG SER B 49 -4.155 -20.989 -13.708 1.00 0.00 O ATOM 0 H SER B 49 -7.188 -19.369 -15.457 1.00 0.00 H new ATOM 0 HA SER B 49 -6.504 -20.300 -12.864 1.00 0.00 H new ATOM 0 HB2 SER B 49 -5.705 -21.258 -15.035 1.00 0.00 H new ATOM 0 HB3 SER B 49 -4.739 -19.820 -15.297 1.00 0.00 H new ATOM 0 HG SER B 49 -3.533 -21.509 -14.258 1.00 0.00 H new ATOM 2074 N ASN B 50 -4.814 -17.557 -13.744 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.110 -16.378 -13.227 1.00 0.00 C ATOM 2076 C ASN B 50 -5.012 -15.438 -12.398 1.00 0.00 C ATOM 2077 O ASN B 50 -4.546 -14.896 -11.390 1.00 0.00 O ATOM 2078 CB ASN B 50 -3.473 -15.637 -14.413 1.00 0.00 C ATOM 2079 CG ASN B 50 -2.416 -16.487 -15.111 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -2.727 -17.416 -15.844 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -1.144 -16.212 -14.892 1.00 0.00 N ATOM 0 H ASN B 50 -4.776 -17.634 -14.760 1.00 0.00 H new ATOM 0 HA ASN B 50 -3.342 -16.718 -12.532 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -4.248 -15.362 -15.128 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.020 -14.710 -14.061 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.417 -16.775 -15.334 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -0.888 -15.437 -14.280 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.294 -15.282 -12.766 1.00 0.00 N ATOM 2089 CA VAL B 51 -7.297 -14.588 -11.935 1.00 0.00 C ATOM 2090 C VAL B 51 -7.466 -15.263 -10.558 1.00 0.00 C ATOM 2091 O VAL B 51 -7.396 -14.579 -9.539 1.00 0.00 O ATOM 2092 CB VAL B 51 -8.646 -14.463 -12.691 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -9.873 -14.169 -11.813 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -8.541 -13.407 -13.805 1.00 0.00 C ATOM 0 H VAL B 51 -6.667 -15.633 -13.648 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.932 -13.579 -11.743 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.820 -15.455 -13.107 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -10.762 -14.102 -12.441 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -10.002 -14.972 -11.087 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -9.727 -13.225 -11.288 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -9.496 -13.331 -14.326 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -8.289 -12.441 -13.368 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -7.764 -13.700 -14.512 1.00 0.00 H new ATOM 2104 N SER B 52 -7.622 -16.592 -10.493 1.00 0.00 N ATOM 2105 CA SER B 52 -7.884 -17.310 -9.225 1.00 0.00 C ATOM 2106 C SER B 52 -6.641 -17.517 -8.353 1.00 0.00 C ATOM 2107 O SER B 52 -6.727 -17.510 -7.121 1.00 0.00 O ATOM 2108 CB SER B 52 -8.492 -18.690 -9.475 1.00 0.00 C ATOM 2109 OG SER B 52 -9.677 -18.590 -10.238 1.00 0.00 O ATOM 0 H SER B 52 -7.572 -17.202 -11.309 1.00 0.00 H new ATOM 0 HA SER B 52 -8.579 -16.659 -8.694 1.00 0.00 H new ATOM 0 HB2 SER B 52 -7.771 -19.320 -9.997 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.708 -19.174 -8.523 1.00 0.00 H new ATOM 0 HG SER B 52 -9.449 -18.427 -11.177 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.480 -17.684 -8.988 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.193 -17.819 -8.315 1.00 0.00 C ATOM 2117 C ASN B 53 -3.898 -16.565 -7.480 1.00 0.00 C ATOM 2118 O ASN B 53 -3.664 -16.645 -6.276 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.122 -18.087 -9.380 1.00 0.00 C ATOM 2120 CG ASN B 53 -1.781 -18.415 -8.744 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.630 -19.419 -8.069 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -0.781 -17.573 -8.924 1.00 0.00 N ATOM 0 H ASN B 53 -5.410 -17.730 -10.005 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.202 -18.657 -7.618 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.437 -18.914 -10.016 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -3.018 -17.213 -10.022 1.00 0.00 H new ATOM 0 HD21 ASN B 53 0.126 -17.760 -8.497 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -0.915 -16.735 -9.490 1.00 0.00 H new ATOM 2129 N HIS B 54 -4.035 -15.385 -8.091 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.878 -14.125 -7.368 1.00 0.00 C ATOM 2131 C HIS B 54 -5.053 -13.803 -6.422 1.00 0.00 C ATOM 2132 O HIS B 54 -4.794 -13.287 -5.333 1.00 0.00 O ATOM 2133 CB HIS B 54 -3.562 -13.005 -8.369 1.00 0.00 C ATOM 2134 CG HIS B 54 -2.076 -12.827 -8.572 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -1.181 -12.244 -7.696 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -1.351 -13.225 -9.662 1.00 0.00 C ATOM 2137 CE1 HIS B 54 0.036 -12.269 -8.257 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -0.023 -12.838 -9.470 1.00 0.00 N ATOM 0 H HIS B 54 -4.254 -15.278 -9.082 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.032 -14.222 -6.687 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -4.034 -13.231 -9.325 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -3.994 -12.069 -8.014 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.739 -13.749 -10.523 1.00 0.00 H new ATOM 0 HE1 HIS B 54 0.935 -11.886 -7.798 1.00 0.00 H new ATOM 0 HE2 HIS B 54 0.750 -12.963 -10.124 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.313 -14.157 -6.746 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.423 -14.070 -5.773 1.00 0.00 C ATOM 2148 C LEU B 55 -7.147 -14.868 -4.495 1.00 0.00 C ATOM 2149 O LEU B 55 -7.651 -14.491 -3.448 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.757 -14.591 -6.356 1.00 0.00 C ATOM 2151 CG LEU B 55 -9.520 -13.622 -7.279 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.586 -14.382 -8.080 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.221 -12.529 -6.465 1.00 0.00 C ATOM 0 H LEU B 55 -6.587 -14.503 -7.666 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.502 -13.008 -5.540 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.554 -15.506 -6.913 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.411 -14.861 -5.527 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.793 -13.167 -7.952 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.118 -13.686 -8.729 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.106 -15.150 -8.687 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.291 -14.851 -7.394 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -10.753 -11.858 -7.139 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.930 -12.987 -5.776 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.479 -11.964 -5.900 1.00 0.00 H new ATOM 2165 N SER B 56 -6.398 -15.967 -4.542 1.00 0.00 N ATOM 2166 CA SER B 56 -6.279 -16.862 -3.380 1.00 0.00 C ATOM 2167 C SER B 56 -5.496 -16.276 -2.203 1.00 0.00 C ATOM 2168 O SER B 56 -6.040 -16.233 -1.097 1.00 0.00 O ATOM 2169 CB SER B 56 -5.792 -18.245 -3.816 1.00 0.00 C ATOM 2170 OG SER B 56 -6.775 -18.823 -4.668 1.00 0.00 O ATOM 0 H SER B 56 -5.867 -16.263 -5.361 1.00 0.00 H new ATOM 0 HA SER B 56 -7.282 -16.979 -2.971 1.00 0.00 H new ATOM 0 HB2 SER B 56 -4.839 -18.163 -4.338 1.00 0.00 H new ATOM 0 HB3 SER B 56 -5.625 -18.879 -2.946 1.00 0.00 H new ATOM 0 HG SER B 56 -6.767 -18.365 -5.535 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.299 -15.724 -2.414 1.00 0.00 N ATOM 2177 CA CYS B 57 -3.610 -14.997 -1.350 1.00 0.00 C ATOM 2178 C CYS B 57 -4.402 -13.746 -0.908 1.00 0.00 C ATOM 2179 O CYS B 57 -4.280 -13.355 0.246 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.196 -14.662 -1.832 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.089 -14.081 -0.492 1.00 0.00 S ATOM 0 H CYS B 57 -3.794 -15.766 -3.299 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.539 -15.622 -0.460 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -1.759 -15.546 -2.296 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.255 -13.894 -2.603 1.00 0.00 H new ATOM 0 HG CYS B 57 -1.710 -13.196 0.231 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.213 -13.150 -1.798 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.092 -11.988 -1.563 1.00 0.00 C ATOM 2188 C LEU B 58 -7.234 -12.307 -0.582 1.00 0.00 C ATOM 2189 O LEU B 58 -7.552 -11.459 0.255 1.00 0.00 O ATOM 2190 CB LEU B 58 -6.654 -11.520 -2.932 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.062 -10.045 -3.108 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.947 -9.018 -2.922 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.695 -9.895 -4.498 1.00 0.00 C ATOM 0 H LEU B 58 -5.278 -13.485 -2.759 1.00 0.00 H new ATOM 0 HA LEU B 58 -5.508 -11.193 -1.100 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -5.904 -11.747 -3.690 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -7.528 -12.132 -3.155 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.762 -9.820 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.348 -8.015 -3.069 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.539 -9.102 -1.915 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.157 -9.203 -3.650 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.995 -8.858 -4.651 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -6.970 -10.180 -5.261 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.571 -10.540 -4.571 1.00 0.00 H new ATOM 2205 N ARG B 59 -7.851 -13.498 -0.661 1.00 0.00 N ATOM 2206 CA ARG B 59 -8.853 -13.940 0.331 1.00 0.00 C ATOM 2207 C ARG B 59 -8.186 -14.178 1.693 1.00 0.00 C ATOM 2208 O ARG B 59 -8.774 -13.877 2.730 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.601 -15.223 -0.100 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.283 -15.262 -1.490 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.159 -16.509 -1.664 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.426 -17.776 -1.522 1.00 0.00 N ATOM 2213 CZ ARG B 59 -9.658 -18.417 -2.388 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -9.391 -17.948 -3.586 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -9.155 -19.574 -2.039 1.00 0.00 N ATOM 0 H ARG B 59 -7.675 -14.176 -1.403 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.588 -13.139 0.404 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -8.890 -16.048 -0.059 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.367 -15.425 0.649 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -10.894 -14.369 -1.620 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.521 -15.243 -2.269 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -11.963 -16.481 -0.929 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -11.626 -16.479 -2.649 1.00 0.00 H new ATOM 0 HE ARG B 59 -10.525 -18.231 -0.615 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -9.782 -17.054 -3.882 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -8.793 -18.478 -4.220 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -9.358 -19.961 -1.118 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -8.560 -20.088 -2.688 1.00 0.00 H new ATOM 2229 N GLY B 60 -6.931 -14.639 1.686 1.00 0.00 N ATOM 2230 CA GLY B 60 -6.153 -14.901 2.900 1.00 0.00 C ATOM 2231 C GLY B 60 -5.758 -13.590 3.566 1.00 0.00 C ATOM 2232 O GLY B 60 -6.124 -13.374 4.712 1.00 0.00 O ATOM 0 H GLY B 60 -6.421 -14.843 0.826 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -6.738 -15.507 3.592 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -5.260 -15.474 2.651 1.00 0.00 H new ATOM 2236 N CYS B 61 -5.121 -12.684 2.810 1.00 0.00 N ATOM 2237 CA CYS B 61 -4.746 -11.314 3.165 1.00 0.00 C ATOM 2238 C CYS B 61 -5.943 -10.431 3.634 1.00 0.00 C ATOM 2239 O CYS B 61 -5.751 -9.276 4.020 1.00 0.00 O ATOM 2240 CB CYS B 61 -3.963 -10.747 1.944 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.256 -11.380 1.760 1.00 0.00 S ATOM 0 H CYS B 61 -4.833 -12.912 1.858 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.110 -11.307 4.051 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.520 -10.977 1.036 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -3.925 -9.661 2.028 1.00 0.00 H new ATOM 0 HG CYS B 61 -2.050 -12.330 2.623 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.169 -10.976 3.571 1.00 0.00 N ATOM 2247 CA GLY B 62 -8.412 -10.437 4.132 1.00 0.00 C ATOM 2248 C GLY B 62 -9.095 -9.414 3.233 1.00 0.00 C ATOM 2249 O GLY B 62 -9.948 -8.660 3.689 1.00 0.00 O ATOM 0 H GLY B 62 -7.325 -11.864 3.094 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.102 -11.260 4.321 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -8.195 -9.975 5.095 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.720 -9.370 1.951 1.00 0.00 N ATOM 2254 CA LEU B 63 -9.119 -8.308 1.021 1.00 0.00 C ATOM 2255 C LEU B 63 -10.361 -8.607 0.170 1.00 0.00 C ATOM 2256 O LEU B 63 -10.986 -7.686 -0.354 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.917 -7.983 0.153 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.729 -7.476 0.991 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.587 -7.325 0.021 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.999 -6.148 1.713 1.00 0.00 C ATOM 0 H LEU B 63 -8.124 -10.079 1.524 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.429 -7.451 1.620 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.618 -8.872 -0.402 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -8.193 -7.227 -0.582 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.518 -8.185 1.792 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.705 -6.966 0.551 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.368 -8.290 -0.436 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.861 -6.610 -0.755 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -6.116 -5.857 2.282 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -7.229 -5.375 0.979 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.844 -6.268 2.391 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.697 -9.886 0.016 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.779 -10.370 -0.873 1.00 0.00 C ATOM 2274 C VAL B 64 -12.613 -11.515 -0.298 1.00 0.00 C ATOM 2275 O VAL B 64 -12.144 -12.270 0.551 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.239 -10.812 -2.251 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -10.901 -9.595 -3.113 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.030 -11.709 -2.133 1.00 0.00 C ATOM 0 H VAL B 64 -10.221 -10.640 0.512 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.432 -9.504 -0.976 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.031 -11.387 -2.730 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -10.522 -9.928 -4.079 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -11.798 -8.994 -3.262 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.141 -8.994 -2.613 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -9.688 -11.992 -3.129 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.232 -11.178 -1.613 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.295 -12.605 -1.572 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.847 -11.642 -0.803 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.889 -12.573 -0.314 1.00 0.00 C ATOM 2290 C VAL B 65 -15.781 -13.062 -1.472 1.00 0.00 C ATOM 2291 O VAL B 65 -15.984 -12.321 -2.436 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.771 -11.876 0.765 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.940 -12.751 1.253 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.953 -11.445 1.997 1.00 0.00 C ATOM 0 H VAL B 65 -14.165 -11.081 -1.593 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.388 -13.435 0.128 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.174 -10.999 0.259 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -17.514 -12.206 2.003 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.586 -12.998 0.411 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.549 -13.669 1.692 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -15.611 -10.964 2.721 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -14.492 -12.321 2.452 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.176 -10.744 1.691 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.321 -14.291 -1.387 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.365 -14.797 -2.295 1.00 0.00 C ATOM 2306 C ALA B 66 -18.774 -14.655 -1.687 1.00 0.00 C ATOM 2307 O ALA B 66 -19.042 -15.174 -0.601 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.053 -16.253 -2.654 1.00 0.00 C ATOM 0 H ALA B 66 -16.041 -14.968 -0.677 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.363 -14.195 -3.203 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -17.822 -16.635 -3.326 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -16.082 -16.306 -3.146 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.033 -16.855 -1.746 1.00 0.00 H new ATOM 2314 N THR B 67 -19.690 -13.991 -2.413 1.00 0.00 N ATOM 2315 CA THR B 67 -21.060 -13.692 -1.950 1.00 0.00 C ATOM 2316 C THR B 67 -22.071 -14.232 -2.926 1.00 0.00 C ATOM 2317 O THR B 67 -21.767 -14.494 -4.079 1.00 0.00 O ATOM 2318 CB THR B 67 -21.342 -12.193 -1.688 1.00 0.00 C ATOM 2319 OG1 THR B 67 -22.016 -11.531 -2.740 1.00 0.00 O ATOM 2320 CG2 THR B 67 -20.092 -11.352 -1.455 1.00 0.00 C ATOM 0 H THR B 67 -19.499 -13.641 -3.352 1.00 0.00 H new ATOM 0 HA THR B 67 -21.150 -14.189 -0.984 1.00 0.00 H new ATOM 0 HB THR B 67 -21.961 -12.253 -0.793 1.00 0.00 H new ATOM 0 HG1 THR B 67 -22.626 -10.861 -2.367 1.00 0.00 H new ATOM 0 HG21 THR B 67 -20.379 -10.315 -1.279 1.00 0.00 H new ATOM 0 HG22 THR B 67 -19.555 -11.732 -0.586 1.00 0.00 H new ATOM 0 HG23 THR B 67 -19.448 -11.407 -2.333 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.318 -14.288 -2.491 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.426 -14.554 -3.391 1.00 0.00 C ATOM 2330 C TYR B 68 -24.744 -13.293 -4.214 1.00 0.00 C ATOM 2331 O TYR B 68 -24.965 -12.232 -3.628 1.00 0.00 O ATOM 2332 CB TYR B 68 -25.610 -14.995 -2.523 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.596 -15.892 -3.223 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -26.153 -17.129 -3.723 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.956 -15.542 -3.297 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -27.066 -18.027 -4.289 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -28.881 -16.448 -3.843 1.00 0.00 C ATOM 2338 CZ TYR B 68 -28.439 -17.699 -4.329 1.00 0.00 C ATOM 2339 OH TYR B 68 -29.333 -18.585 -4.840 1.00 0.00 O ATOM 0 H TYR B 68 -23.589 -14.152 -1.517 1.00 0.00 H new ATOM 0 HA TYR B 68 -24.188 -15.340 -4.107 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -25.227 -15.513 -1.644 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -26.134 -14.108 -2.167 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -25.106 -17.387 -3.670 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -28.288 -14.580 -2.935 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -26.721 -18.967 -4.694 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -29.928 -16.189 -3.891 1.00 0.00 H new ATOM 0 HH TYR B 68 -30.235 -18.204 -4.792 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.703 -13.379 -5.547 1.00 0.00 N ATOM 2350 CA GLU B 69 -25.250 -12.335 -6.433 1.00 0.00 C ATOM 2351 C GLU B 69 -26.756 -12.543 -6.682 1.00 0.00 C ATOM 2352 O GLU B 69 -27.471 -11.576 -6.931 1.00 0.00 O ATOM 2353 CB GLU B 69 -24.474 -12.237 -7.764 1.00 0.00 C ATOM 2354 CG GLU B 69 -24.215 -13.563 -8.481 1.00 0.00 C ATOM 2355 CD GLU B 69 -23.513 -13.357 -9.826 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -22.282 -13.129 -9.822 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -24.198 -13.524 -10.854 1.00 0.00 O ATOM 0 H GLU B 69 -24.293 -14.169 -6.045 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.123 -11.383 -5.917 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -25.027 -11.583 -8.438 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -23.515 -11.757 -7.569 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -23.604 -14.205 -7.847 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -25.161 -14.080 -8.641 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.243 -13.785 -6.556 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.616 -14.187 -6.871 1.00 0.00 C ATOM 2366 C GLY B 70 -28.593 -15.355 -7.848 1.00 0.00 C ATOM 2367 O GLY B 70 -28.254 -15.185 -9.016 1.00 0.00 O ATOM 0 H GLY B 70 -26.672 -14.561 -6.221 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.141 -14.472 -5.959 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.161 -13.348 -7.303 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.886 -16.564 -7.353 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.727 -17.865 -8.033 1.00 0.00 C ATOM 2373 C ARG B 71 -27.244 -18.247 -8.174 1.00 0.00 C ATOM 2374 O ARG B 71 -26.861 -19.348 -7.782 1.00 0.00 O ATOM 2375 CB ARG B 71 -29.438 -17.902 -9.401 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.621 -19.342 -9.904 1.00 0.00 C ATOM 2377 CD ARG B 71 -30.103 -19.347 -11.358 1.00 0.00 C ATOM 2378 NE ARG B 71 -30.260 -20.724 -11.859 1.00 0.00 N ATOM 2379 CZ ARG B 71 -30.671 -21.076 -13.071 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -30.981 -20.180 -13.986 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -30.775 -22.350 -13.385 1.00 0.00 N ATOM 0 H ARG B 71 -29.263 -16.672 -6.411 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.210 -18.609 -7.400 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -30.411 -17.418 -9.319 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.859 -17.333 -10.128 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -28.678 -19.883 -9.826 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -30.341 -19.864 -9.274 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -31.054 -18.819 -11.431 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -29.391 -18.808 -11.983 1.00 0.00 H new ATOM 0 HE ARG B 71 -30.031 -21.479 -11.212 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -30.908 -19.186 -13.771 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -31.294 -20.481 -14.909 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -30.540 -23.066 -12.697 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -31.091 -22.622 -14.316 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.426 -17.348 -8.722 1.00 0.00 N ATOM 2396 CA GLN B 72 -24.988 -17.526 -8.884 1.00 0.00 C ATOM 2397 C GLN B 72 -24.234 -16.966 -7.659 1.00 0.00 C ATOM 2398 O GLN B 72 -24.831 -16.464 -6.705 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.504 -16.872 -10.197 1.00 0.00 C ATOM 2400 CG GLN B 72 -25.444 -16.972 -11.412 1.00 0.00 C ATOM 2401 CD GLN B 72 -25.739 -18.411 -11.822 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -26.785 -18.973 -11.535 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -24.819 -19.073 -12.494 1.00 0.00 N ATOM 0 H GLN B 72 -26.758 -16.450 -9.075 1.00 0.00 H new ATOM 0 HA GLN B 72 -24.771 -18.592 -8.948 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -24.314 -15.817 -10.001 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.549 -17.322 -10.469 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -26.382 -16.467 -11.181 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -24.997 -16.445 -12.255 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -23.941 -18.617 -12.741 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -24.985 -20.042 -12.767 1.00 0.00 H new ATOM 2412 N VAL B 73 -22.903 -17.037 -7.713 1.00 0.00 N ATOM 2413 CA VAL B 73 -21.971 -16.571 -6.677 1.00 0.00 C ATOM 2414 C VAL B 73 -20.971 -15.604 -7.310 1.00 0.00 C ATOM 2415 O VAL B 73 -20.476 -15.884 -8.403 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.261 -17.766 -5.998 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -20.302 -18.543 -6.925 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.497 -17.347 -4.729 1.00 0.00 C ATOM 0 H VAL B 73 -22.420 -17.439 -8.516 1.00 0.00 H new ATOM 0 HA VAL B 73 -22.521 -16.046 -5.896 1.00 0.00 H new ATOM 0 HB VAL B 73 -22.078 -18.437 -5.731 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -19.846 -19.364 -6.371 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -20.859 -18.942 -7.772 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -19.523 -17.872 -7.287 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -20.016 -18.220 -4.289 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -19.739 -16.607 -4.988 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -21.194 -16.916 -4.010 1.00 0.00 H new ATOM 2428 N ARG B 74 -20.654 -14.507 -6.623 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.776 -13.455 -7.104 1.00 0.00 C ATOM 2430 C ARG B 74 -18.539 -13.401 -6.242 1.00 0.00 C ATOM 2431 O ARG B 74 -18.501 -13.961 -5.148 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.482 -12.087 -7.114 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.845 -11.478 -5.751 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.468 -10.114 -6.000 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.870 -9.427 -4.762 1.00 0.00 N ATOM 2436 CZ ARG B 74 -22.294 -8.169 -4.685 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -22.471 -7.434 -5.767 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -22.531 -7.634 -3.504 1.00 0.00 N ATOM 0 H ARG B 74 -21.016 -14.326 -5.687 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.497 -13.685 -8.132 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.842 -11.380 -7.641 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.398 -12.183 -7.697 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.542 -12.124 -5.218 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.957 -11.383 -5.127 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.756 -9.490 -6.540 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -22.341 -10.232 -6.643 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.819 -9.959 -3.893 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -22.282 -7.829 -6.688 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -22.797 -6.471 -5.682 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -22.389 -8.184 -2.657 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -22.856 -6.670 -3.437 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.532 -12.692 -6.722 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.353 -12.336 -5.931 1.00 0.00 C ATOM 2454 C TYR B 75 -16.305 -10.816 -5.776 1.00 0.00 C ATOM 2455 O TYR B 75 -16.581 -10.092 -6.728 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.087 -12.951 -6.544 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.968 -14.433 -6.223 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -15.823 -15.359 -6.851 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.067 -14.877 -5.232 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -15.807 -16.715 -6.474 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.030 -16.236 -4.867 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.915 -17.157 -5.477 1.00 0.00 C ATOM 2463 OH TYR B 75 -14.935 -18.458 -5.073 1.00 0.00 O ATOM 0 H TYR B 75 -17.504 -12.341 -7.679 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.414 -12.756 -4.927 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.103 -12.813 -7.625 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.209 -12.426 -6.168 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -16.496 -15.026 -7.628 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.404 -14.172 -4.752 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -16.478 -17.416 -6.948 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -13.326 -16.576 -4.122 1.00 0.00 H new ATOM 0 HH TYR B 75 -14.256 -18.596 -4.380 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.015 -10.355 -4.559 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.131 -8.966 -4.119 1.00 0.00 C ATOM 2475 C ALA B 76 -14.984 -8.560 -3.185 1.00 0.00 C ATOM 2476 O ALA B 76 -14.353 -9.434 -2.587 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.469 -8.847 -3.366 1.00 0.00 C ATOM 0 H ALA B 76 -15.677 -10.970 -3.819 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.086 -8.305 -4.985 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.600 -7.823 -3.017 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.288 -9.110 -4.036 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.467 -9.524 -2.512 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.754 -7.249 -3.032 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.888 -6.689 -1.990 1.00 0.00 C ATOM 2485 C LEU B 77 -14.541 -6.903 -0.621 1.00 0.00 C ATOM 2486 O LEU B 77 -15.766 -6.980 -0.527 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.652 -5.191 -2.242 1.00 0.00 C ATOM 2488 CG LEU B 77 -13.034 -4.869 -3.605 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -13.135 -3.365 -3.793 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -11.581 -5.321 -3.682 1.00 0.00 C ATOM 0 H LEU B 77 -15.170 -6.540 -3.636 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.923 -7.195 -2.011 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.603 -4.666 -2.155 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.000 -4.802 -1.460 1.00 0.00 H new ATOM 0 HG LEU B 77 -13.566 -5.401 -4.394 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -12.705 -3.089 -4.756 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -14.182 -3.064 -3.764 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.591 -2.861 -2.994 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -11.175 -5.076 -4.664 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -11.000 -4.812 -2.912 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -11.526 -6.398 -3.525 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.722 -6.988 0.425 1.00 0.00 N ATOM 2503 CA ALA B 78 -14.184 -7.414 1.754 1.00 0.00 C ATOM 2504 C ALA B 78 -14.866 -6.318 2.598 1.00 0.00 C ATOM 2505 O ALA B 78 -15.653 -6.656 3.477 1.00 0.00 O ATOM 2506 CB ALA B 78 -13.010 -8.050 2.505 1.00 0.00 C ATOM 0 H ALA B 78 -12.727 -6.767 0.382 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.978 -8.142 1.588 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -13.341 -8.370 3.493 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.646 -8.913 1.947 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -12.207 -7.320 2.610 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.607 -5.032 2.322 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.191 -3.877 3.020 1.00 0.00 C ATOM 2514 C ASP B 79 -14.949 -2.545 2.277 1.00 0.00 C ATOM 2515 O ASP B 79 -14.005 -2.376 1.500 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.684 -3.802 4.485 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.070 -2.496 5.203 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.272 -2.129 5.218 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.141 -1.743 5.565 1.00 0.00 O ATOM 0 H ASP B 79 -13.963 -4.757 1.581 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.270 -4.031 3.035 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.086 -4.647 5.044 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.599 -3.903 4.491 1.00 0.00 H new ATOM 2524 N SER B 80 -15.812 -1.581 2.597 1.00 0.00 N ATOM 2525 CA SER B 80 -15.751 -0.153 2.281 1.00 0.00 C ATOM 2526 C SER B 80 -14.349 0.477 2.388 1.00 0.00 C ATOM 2527 O SER B 80 -13.972 1.264 1.515 1.00 0.00 O ATOM 2528 CB SER B 80 -16.707 0.575 3.242 1.00 0.00 C ATOM 2529 OG SER B 80 -16.286 0.489 4.598 1.00 0.00 O ATOM 0 H SER B 80 -16.651 -1.800 3.135 1.00 0.00 H new ATOM 0 HA SER B 80 -16.035 -0.045 1.234 1.00 0.00 H new ATOM 0 HB2 SER B 80 -16.779 1.624 2.953 1.00 0.00 H new ATOM 0 HB3 SER B 80 -17.706 0.149 3.147 1.00 0.00 H new ATOM 0 HG SER B 80 -16.547 -0.381 4.967 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.549 0.107 3.401 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.169 0.570 3.557 1.00 0.00 C ATOM 2537 C HIS B 81 -11.327 0.261 2.314 1.00 0.00 C ATOM 2538 O HIS B 81 -10.566 1.128 1.877 1.00 0.00 O ATOM 2539 CB HIS B 81 -11.536 -0.062 4.820 1.00 0.00 C ATOM 2540 CG HIS B 81 -11.692 0.721 6.107 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -11.998 2.065 6.230 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -11.183 0.319 7.310 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -11.599 2.480 7.447 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -11.169 1.415 8.153 1.00 0.00 N ATOM 0 H HIS B 81 -13.849 -0.529 4.140 1.00 0.00 H new ATOM 0 HA HIS B 81 -12.187 1.653 3.676 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -11.973 -1.050 4.965 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.472 -0.208 4.634 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -12.449 2.642 5.520 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -10.851 -0.678 7.558 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -11.620 3.500 7.800 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.432 -0.936 1.732 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.596 -1.314 0.587 1.00 0.00 C ATOM 2555 C LEU B 82 -11.130 -0.674 -0.688 1.00 0.00 C ATOM 2556 O LEU B 82 -10.343 -0.114 -1.437 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.469 -2.834 0.415 1.00 0.00 C ATOM 2558 CG LEU B 82 -10.583 -3.660 1.712 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -10.623 -5.130 1.331 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -9.414 -3.385 2.674 1.00 0.00 C ATOM 0 H LEU B 82 -12.085 -1.659 2.033 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.592 -0.940 0.789 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -11.241 -3.170 -0.278 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.507 -3.051 -0.050 1.00 0.00 H new ATOM 0 HG LEU B 82 -11.494 -3.374 2.239 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -10.704 -5.737 2.232 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -11.484 -5.316 0.690 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.710 -5.392 0.797 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -9.534 -3.987 3.574 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -8.474 -3.644 2.187 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -9.405 -2.329 2.943 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.455 -0.665 -0.887 1.00 0.00 N ATOM 2573 CA ALA B 83 -13.112 0.064 -1.975 1.00 0.00 C ATOM 2574 C ALA B 83 -12.685 1.554 -1.984 1.00 0.00 C ATOM 2575 O ALA B 83 -12.433 2.122 -3.043 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.627 -0.098 -1.797 1.00 0.00 C ATOM 0 H ALA B 83 -13.107 -1.171 -0.288 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.813 -0.342 -2.941 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -15.146 0.435 -2.594 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.887 -1.156 -1.838 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.926 0.312 -0.832 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.539 2.169 -0.799 1.00 0.00 N ATOM 2583 CA ARG B 84 -12.083 3.554 -0.604 1.00 0.00 C ATOM 2584 C ARG B 84 -10.588 3.762 -0.913 1.00 0.00 C ATOM 2585 O ARG B 84 -10.269 4.638 -1.715 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.440 3.992 0.833 1.00 0.00 C ATOM 2587 CG ARG B 84 -11.889 5.364 1.252 1.00 0.00 C ATOM 2588 CD ARG B 84 -12.379 6.503 0.354 1.00 0.00 C ATOM 2589 NE ARG B 84 -11.603 7.722 0.596 1.00 0.00 N ATOM 2590 CZ ARG B 84 -11.187 8.590 -0.312 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -11.463 8.527 -1.595 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -10.418 9.559 0.091 1.00 0.00 N ATOM 0 H ARG B 84 -12.743 1.697 0.082 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.601 4.185 -1.326 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.525 4.008 0.932 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -12.067 3.240 1.529 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.182 5.568 2.282 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -10.800 5.334 1.231 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -12.291 6.211 -0.693 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -13.435 6.694 0.544 1.00 0.00 H new ATOM 0 HE ARG B 84 -11.358 7.922 1.566 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -12.038 7.766 -1.956 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -11.102 9.239 -2.230 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -10.158 9.628 1.075 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -10.075 10.250 -0.577 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.688 2.967 -0.320 1.00 0.00 N ATOM 2607 CA ALA B 85 -8.241 3.042 -0.579 1.00 0.00 C ATOM 2608 C ALA B 85 -7.895 2.786 -2.056 1.00 0.00 C ATOM 2609 O ALA B 85 -7.065 3.484 -2.633 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.527 2.033 0.328 1.00 0.00 C ATOM 0 H ALA B 85 -9.943 2.249 0.358 1.00 0.00 H new ATOM 0 HA ALA B 85 -7.903 4.054 -0.356 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.453 2.077 0.147 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -7.729 2.275 1.371 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.890 1.028 0.111 1.00 0.00 H new ATOM 2616 N LEU B 86 -8.576 1.818 -2.674 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.554 1.566 -4.114 1.00 0.00 C ATOM 2618 C LEU B 86 -9.008 2.826 -4.873 1.00 0.00 C ATOM 2619 O LEU B 86 -8.323 3.269 -5.786 1.00 0.00 O ATOM 2620 CB LEU B 86 -9.492 0.362 -4.337 1.00 0.00 C ATOM 2621 CG LEU B 86 -9.569 -0.294 -5.727 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -10.765 -1.253 -5.651 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -9.724 0.687 -6.898 1.00 0.00 C ATOM 0 H LEU B 86 -9.177 1.168 -2.168 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.557 1.338 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -9.203 -0.412 -3.626 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -10.500 0.680 -4.070 1.00 0.00 H new ATOM 0 HG LEU B 86 -8.625 -0.795 -5.943 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -10.886 -1.761 -6.608 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -10.590 -1.991 -4.868 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -11.670 -0.689 -5.423 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -9.769 0.131 -7.835 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -10.642 1.262 -6.772 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -8.871 1.366 -6.920 1.00 0.00 H new ATOM 2635 N GLY B 87 -10.137 3.415 -4.467 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.849 4.482 -5.180 1.00 0.00 C ATOM 2637 C GLY B 87 -10.166 5.857 -5.129 1.00 0.00 C ATOM 2638 O GLY B 87 -10.278 6.619 -6.083 1.00 0.00 O ATOM 0 H GLY B 87 -10.599 3.151 -3.597 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.965 4.188 -6.223 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.851 4.574 -4.761 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.422 6.173 -4.060 1.00 0.00 N ATOM 2643 CA GLU B 88 -8.502 7.334 -4.007 1.00 0.00 C ATOM 2644 C GLU B 88 -7.227 7.075 -4.848 1.00 0.00 C ATOM 2645 O GLU B 88 -6.429 7.979 -5.122 1.00 0.00 O ATOM 2646 CB GLU B 88 -8.081 7.544 -2.536 1.00 0.00 C ATOM 2647 CG GLU B 88 -7.370 8.874 -2.210 1.00 0.00 C ATOM 2648 CD GLU B 88 -8.323 10.047 -1.985 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -9.429 10.073 -2.569 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -8.042 10.873 -1.086 1.00 0.00 O ATOM 0 H GLU B 88 -9.437 5.630 -3.197 1.00 0.00 H new ATOM 0 HA GLU B 88 -9.012 8.209 -4.409 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -8.972 7.471 -1.912 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -7.422 6.725 -2.249 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -6.759 8.739 -1.318 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -6.691 9.121 -3.026 1.00 0.00 H new ATOM 2657 N LEU B 89 -7.029 5.798 -5.202 1.00 0.00 N ATOM 2658 CA LEU B 89 -5.835 5.175 -5.752 1.00 0.00 C ATOM 2659 C LEU B 89 -4.783 5.110 -4.641 1.00 0.00 C ATOM 2660 O LEU B 89 -4.723 5.942 -3.741 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.367 5.882 -7.050 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.241 5.190 -7.848 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -4.586 3.751 -8.258 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -3.916 6.017 -9.099 1.00 0.00 C ATOM 0 H LEU B 89 -7.780 5.115 -5.097 1.00 0.00 H new ATOM 0 HA LEU B 89 -6.039 4.154 -6.075 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.230 5.995 -7.706 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -5.032 6.886 -6.789 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.375 5.132 -7.188 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -3.753 3.322 -8.815 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -4.772 3.153 -7.366 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -5.478 3.755 -8.884 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.121 5.528 -9.662 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -4.806 6.098 -9.723 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -3.590 7.014 -8.802 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.837 4.187 -4.786 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.595 4.137 -3.978 1.00 0.00 C ATOM 2678 C VAL B 90 -1.812 5.466 -4.009 1.00 0.00 C ATOM 2679 O VAL B 90 -0.820 5.626 -3.302 1.00 0.00 O ATOM 2680 CB VAL B 90 -1.638 3.045 -4.489 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -2.220 1.636 -4.333 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -1.285 3.316 -5.961 1.00 0.00 C ATOM 0 H VAL B 90 -3.900 3.437 -5.474 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.925 3.926 -2.961 1.00 0.00 H new ATOM 0 HB VAL B 90 -0.736 3.084 -3.878 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -1.505 0.904 -4.708 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -2.421 1.440 -3.280 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -3.148 1.561 -4.900 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -0.607 2.542 -6.321 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -2.195 3.309 -6.561 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -0.802 4.289 -6.046 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.197 6.375 -4.922 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.907 7.805 -4.936 1.00 0.00 C ATOM 2694 C GLN B 91 -0.470 8.103 -5.384 1.00 0.00 C ATOM 2695 O GLN B 91 -0.223 9.176 -5.918 1.00 0.00 O ATOM 2696 CB GLN B 91 -2.278 8.353 -3.559 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.392 9.858 -3.378 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.496 10.627 -4.121 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -3.478 11.847 -4.102 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -4.423 10.049 -4.854 1.00 0.00 N ATOM 0 H GLN B 91 -2.761 6.100 -5.726 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.506 8.322 -5.685 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -3.234 7.913 -3.275 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -1.536 7.990 -2.848 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -2.520 10.050 -2.313 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -1.437 10.295 -3.668 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.476 9.031 -4.900 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -5.089 10.618 -5.377 1.00 0.00 H new ATOM 2709 N VAL B 92 0.448 7.131 -5.313 1.00 0.00 N ATOM 2710 CA VAL B 92 1.822 7.112 -5.875 1.00 0.00 C ATOM 2711 C VAL B 92 1.866 7.072 -7.405 1.00 0.00 C ATOM 2712 O VAL B 92 2.659 6.391 -8.044 1.00 0.00 O ATOM 2713 CB VAL B 92 2.641 5.985 -5.194 1.00 0.00 C ATOM 2714 CG1 VAL B 92 2.292 4.606 -5.785 1.00 0.00 C ATOM 2715 CG2 VAL B 92 4.144 6.299 -5.201 1.00 0.00 C ATOM 0 H VAL B 92 0.241 6.261 -4.822 1.00 0.00 H new ATOM 0 HA VAL B 92 2.297 8.065 -5.641 1.00 0.00 H new ATOM 0 HB VAL B 92 2.356 5.939 -4.143 1.00 0.00 H new ATOM 0 HG11 VAL B 92 2.882 3.837 -5.287 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.232 4.404 -5.635 1.00 0.00 H new ATOM 0 HG13 VAL B 92 2.515 4.600 -6.852 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.687 5.488 -4.716 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.489 6.403 -6.230 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.324 7.229 -4.662 1.00 0.00 H new ATOM 2725 N VAL B 93 0.931 7.815 -7.975 1.00 0.00 N ATOM 2726 CA VAL B 93 0.628 8.020 -9.382 1.00 0.00 C ATOM 2727 C VAL B 93 -0.079 6.806 -10.010 1.00 0.00 C ATOM 2728 O VAL B 93 -0.992 6.985 -10.808 1.00 0.00 O ATOM 2729 CB VAL B 93 1.868 8.479 -10.191 1.00 0.00 C ATOM 2730 CG1 VAL B 93 1.376 9.181 -11.453 1.00 0.00 C ATOM 2731 CG2 VAL B 93 2.745 9.508 -9.442 1.00 0.00 C ATOM 0 H VAL B 93 0.290 8.353 -7.392 1.00 0.00 H new ATOM 0 HA VAL B 93 -0.085 8.843 -9.431 1.00 0.00 H new ATOM 0 HB VAL B 93 2.464 7.587 -10.384 1.00 0.00 H new ATOM 0 HG11 VAL B 93 2.231 9.514 -12.041 1.00 0.00 H new ATOM 0 HG12 VAL B 93 0.777 8.489 -12.044 1.00 0.00 H new ATOM 0 HG13 VAL B 93 0.768 10.042 -11.177 1.00 0.00 H new ATOM 0 HG21 VAL B 93 3.594 9.785 -10.066 1.00 0.00 H new ATOM 0 HG22 VAL B 93 2.154 10.396 -9.219 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.106 9.070 -8.512 1.00 0.00 H new ATOM 2741 N LEU B 94 0.291 5.603 -9.546 1.00 0.00 N ATOM 2742 CA LEU B 94 -0.173 4.253 -9.865 1.00 0.00 C ATOM 2743 C LEU B 94 0.956 3.272 -9.539 1.00 0.00 C ATOM 2744 O LEU B 94 1.980 3.243 -10.216 1.00 0.00 O ATOM 2745 CB LEU B 94 -0.641 4.093 -11.332 1.00 0.00 C ATOM 2746 CG LEU B 94 -0.921 2.640 -11.777 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -2.004 1.957 -10.927 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -1.353 2.634 -13.248 1.00 0.00 C ATOM 0 H LEU B 94 1.026 5.554 -8.840 1.00 0.00 H new ATOM 0 HA LEU B 94 -1.055 4.044 -9.260 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -1.548 4.681 -11.474 1.00 0.00 H new ATOM 0 HB3 LEU B 94 0.119 4.517 -11.988 1.00 0.00 H new ATOM 0 HG LEU B 94 0.002 2.076 -11.641 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -2.159 0.939 -11.285 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -1.686 1.931 -9.885 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -2.936 2.516 -11.008 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -1.551 1.610 -13.565 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -2.257 3.231 -13.364 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -0.558 3.056 -13.862 1.00 0.00 H new ATOM 2760 N ALA B 95 0.775 2.446 -8.511 1.00 0.00 N ATOM 2761 CA ALA B 95 1.621 1.276 -8.275 1.00 0.00 C ATOM 2762 C ALA B 95 1.454 0.273 -9.440 1.00 0.00 C ATOM 2763 O ALA B 95 0.597 -0.608 -9.403 1.00 0.00 O ATOM 2764 CB ALA B 95 1.300 0.657 -6.909 1.00 0.00 C ATOM 0 H ALA B 95 0.037 2.568 -7.817 1.00 0.00 H new ATOM 0 HA ALA B 95 2.670 1.572 -8.247 1.00 0.00 H new ATOM 0 HB1 ALA B 95 1.936 -0.213 -6.745 1.00 0.00 H new ATOM 0 HB2 ALA B 95 1.481 1.392 -6.125 1.00 0.00 H new ATOM 0 HB3 ALA B 95 0.254 0.351 -6.885 1.00 0.00 H new