USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1367 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 GLN : amide:sc= -0.268 K(o=-1.3,f=-3.1) USER MOD Set 1.2: B 81 HIS : no HE2:sc= -1.06 K(o=-1.3,f=-4!) USER MOD Set 2.1: A 102 CYS SG : rot -79:sc= 0.98 USER MOD Set 2.2: B 57 CYS SG : rot -64:sc= 1.15 USER MOD Set 2.3: B 61 CYS SG : rot -2:sc= 0.774 USER MOD Set 3.1: A 81 HIS : no HE2:sc= 0.321 K(o=0.73,f=-5.3!) USER MOD Set 3.2: B 91 GLN : amide:sc= 0.409 K(o=0.73,f=-3.3) USER MOD Set 4.1: A 57 CYS SG : rot -59:sc= 0.0698 USER MOD Set 4.2: A 61 CYS SG : rot -110:sc= 0.634 USER MOD Set 5.1: A 39 GLN : amide:sc= -2.02 K(o=-2.2,f=-7.1!) USER MOD Set 5.2: A 43 HIS : no HD1:sc= -0.146 K(o=-2.2,f=-4.2) USER MOD Set 6.1: A 22 THR OG1 : rot 115:sc= 0.576 USER MOD Set 6.2: A 54 HIS : no HD1:sc= -0.735 K(o=-0.16,f=-3.4!) USER MOD Single : A 24 CYS SG : rot -168:sc= 0.446 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0.00299 USER MOD Single : A 50 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.4!) USER MOD Single : A 52 SER OG : rot 88:sc= 1.25 USER MOD Single : A 53 ASN : amide:sc=-0.00179 K(o=-0.0018,f=-0.76) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 130:sc= 0.602 USER MOD Single : A 68 TYR OH : rot -124:sc= 0.376 USER MOD Single : A 72 GLN : amide:sc= -0.152 K(o=-0.15,f=-5.3!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 80:sc= 1.17 USER MOD Single : A 98 THR OG1 : rot 97:sc= 0.667 USER MOD Single : A 100 GLN : amide:sc= -0.0438 K(o=-0.044,f=-0.88) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 CYS SG : rot -168:sc= 0.277 USER MOD Single : B 35 CYS SG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 GLN : amide:sc= 0.374 K(o=0.37,f=-7.5!) USER MOD Single : B 43 HIS : no HE2:sc= -0.458 X(o=-0.46,f=-0.58) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 50 ASN : amide:sc= -0.201 K(o=-0.2,f=-1.4!) USER MOD Single : B 52 SER OG : rot 75:sc= 1.24 USER MOD Single : B 53 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : B 54 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-3.5!) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 130:sc= 0.389 USER MOD Single : B 68 TYR OH : rot -131:sc= 0.409 USER MOD Single : B 72 GLN : amide:sc= -0.197 K(o=-0.2,f=-5.2!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0.0313 USER MOD Single : B 80 SER OG : rot 92:sc= 1.35 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 6.323 1.458 -8.786 1.00 0.00 N ATOM 12 CA LEU A 11 5.030 1.627 -8.112 1.00 0.00 C ATOM 13 C LEU A 11 4.584 0.372 -7.334 1.00 0.00 C ATOM 14 O LEU A 11 3.929 0.488 -6.295 1.00 0.00 O ATOM 15 CB LEU A 11 3.993 2.078 -9.163 1.00 0.00 C ATOM 16 CG LEU A 11 4.099 3.555 -9.624 1.00 0.00 C ATOM 17 CD1 LEU A 11 5.450 3.961 -10.243 1.00 0.00 C ATOM 18 CD2 LEU A 11 3.006 3.828 -10.662 1.00 0.00 C ATOM 0 HA LEU A 11 5.127 2.395 -7.345 1.00 0.00 H new ATOM 0 HB2 LEU A 11 4.088 1.436 -10.039 1.00 0.00 H new ATOM 0 HB3 LEU A 11 2.995 1.915 -8.755 1.00 0.00 H new ATOM 0 HG LEU A 11 3.989 4.148 -8.716 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.417 5.012 -10.531 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.245 3.809 -9.513 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.645 3.350 -11.124 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.070 4.864 -10.994 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.141 3.164 -11.516 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.028 3.650 -10.216 1.00 0.00 H new ATOM 30 N ALA A 12 5.026 -0.823 -7.752 1.00 0.00 N ATOM 31 CA ALA A 12 4.861 -2.045 -6.963 1.00 0.00 C ATOM 32 C ALA A 12 5.788 -2.042 -5.735 1.00 0.00 C ATOM 33 O ALA A 12 5.334 -2.214 -4.603 1.00 0.00 O ATOM 34 CB ALA A 12 5.087 -3.265 -7.866 1.00 0.00 C ATOM 0 H ALA A 12 5.505 -0.966 -8.641 1.00 0.00 H new ATOM 0 HA ALA A 12 3.844 -2.094 -6.575 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.965 -4.177 -7.282 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.361 -3.255 -8.679 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.095 -3.230 -8.279 1.00 0.00 H new ATOM 40 N ARG A 13 7.089 -1.766 -5.906 1.00 0.00 N ATOM 41 CA ARG A 13 8.014 -1.637 -4.764 1.00 0.00 C ATOM 42 C ARG A 13 7.605 -0.515 -3.798 1.00 0.00 C ATOM 43 O ARG A 13 7.739 -0.711 -2.597 1.00 0.00 O ATOM 44 CB ARG A 13 9.467 -1.433 -5.224 1.00 0.00 C ATOM 45 CG ARG A 13 10.073 -2.653 -5.937 1.00 0.00 C ATOM 46 CD ARG A 13 10.363 -3.822 -4.980 1.00 0.00 C ATOM 47 NE ARG A 13 10.706 -5.045 -5.721 1.00 0.00 N ATOM 48 CZ ARG A 13 11.857 -5.700 -5.753 1.00 0.00 C ATOM 49 NH1 ARG A 13 12.907 -5.342 -5.043 1.00 0.00 N ATOM 50 NH2 ARG A 13 11.955 -6.748 -6.535 1.00 0.00 N ATOM 0 H ARG A 13 7.525 -1.628 -6.818 1.00 0.00 H new ATOM 0 HA ARG A 13 7.951 -2.581 -4.223 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.508 -0.575 -5.895 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.081 -1.189 -4.357 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.389 -2.989 -6.716 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.998 -2.356 -6.431 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.184 -3.555 -4.314 1.00 0.00 H new ATOM 0 HD3 ARG A 13 9.491 -4.007 -4.353 1.00 0.00 H new ATOM 0 HE ARG A 13 9.956 -5.443 -6.287 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.856 -4.526 -4.433 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.771 -5.881 -5.103 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.157 -7.040 -7.099 1.00 0.00 H new ATOM 0 HH22 ARG A 13 12.829 -7.271 -6.579 1.00 0.00 H new ATOM 64 N LEU A 14 7.057 0.599 -4.294 1.00 0.00 N ATOM 65 CA LEU A 14 6.582 1.749 -3.530 1.00 0.00 C ATOM 66 C LEU A 14 5.542 1.319 -2.496 1.00 0.00 C ATOM 67 O LEU A 14 5.762 1.520 -1.305 1.00 0.00 O ATOM 68 CB LEU A 14 6.046 2.787 -4.544 1.00 0.00 C ATOM 69 CG LEU A 14 5.708 4.206 -4.040 1.00 0.00 C ATOM 70 CD1 LEU A 14 4.593 4.265 -2.983 1.00 0.00 C ATOM 71 CD2 LEU A 14 6.970 4.894 -3.519 1.00 0.00 C ATOM 0 H LEU A 14 6.927 0.726 -5.298 1.00 0.00 H new ATOM 0 HA LEU A 14 7.387 2.206 -2.954 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.785 2.885 -5.339 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.145 2.373 -4.996 1.00 0.00 H new ATOM 0 HG LEU A 14 5.314 4.738 -4.906 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.425 5.301 -2.689 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.674 3.852 -3.400 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.888 3.683 -2.110 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.720 5.894 -3.166 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.388 4.313 -2.697 1.00 0.00 H new ATOM 0 HD23 LEU A 14 7.703 4.966 -4.322 1.00 0.00 H new ATOM 83 N GLY A 15 4.445 0.674 -2.902 1.00 0.00 N ATOM 84 CA GLY A 15 3.414 0.268 -1.943 1.00 0.00 C ATOM 85 C GLY A 15 3.834 -0.945 -1.108 1.00 0.00 C ATOM 86 O GLY A 15 3.484 -1.016 0.070 1.00 0.00 O ATOM 0 H GLY A 15 4.249 0.425 -3.872 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.192 1.103 -1.278 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.495 0.034 -2.480 1.00 0.00 H new ATOM 90 N ARG A 16 4.657 -1.849 -1.661 1.00 0.00 N ATOM 91 CA ARG A 16 5.303 -2.925 -0.891 1.00 0.00 C ATOM 92 C ARG A 16 6.236 -2.371 0.208 1.00 0.00 C ATOM 93 O ARG A 16 6.384 -3.003 1.253 1.00 0.00 O ATOM 94 CB ARG A 16 6.055 -3.865 -1.857 1.00 0.00 C ATOM 95 CG ARG A 16 5.113 -4.801 -2.643 1.00 0.00 C ATOM 96 CD ARG A 16 5.782 -5.414 -3.883 1.00 0.00 C ATOM 97 NE ARG A 16 4.986 -6.517 -4.451 1.00 0.00 N ATOM 98 CZ ARG A 16 5.345 -7.288 -5.473 1.00 0.00 C ATOM 99 NH1 ARG A 16 6.423 -7.067 -6.201 1.00 0.00 N ATOM 100 NH2 ARG A 16 4.626 -8.342 -5.790 1.00 0.00 N ATOM 0 H ARG A 16 4.894 -1.855 -2.653 1.00 0.00 H new ATOM 0 HA ARG A 16 4.530 -3.494 -0.373 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.634 -3.267 -2.561 1.00 0.00 H new ATOM 0 HB3 ARG A 16 6.766 -4.466 -1.290 1.00 0.00 H new ATOM 0 HG2 ARG A 16 4.773 -5.602 -1.986 1.00 0.00 H new ATOM 0 HG3 ARG A 16 4.228 -4.244 -2.951 1.00 0.00 H new ATOM 0 HD2 ARG A 16 5.922 -4.641 -4.639 1.00 0.00 H new ATOM 0 HD3 ARG A 16 6.773 -5.782 -3.616 1.00 0.00 H new ATOM 0 HE ARG A 16 4.080 -6.705 -4.022 1.00 0.00 H new ATOM 0 HH11 ARG A 16 7.027 -6.273 -5.990 1.00 0.00 H new ATOM 0 HH12 ARG A 16 6.652 -7.691 -6.975 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.790 -8.570 -5.251 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.904 -8.932 -6.575 1.00 0.00 H new ATOM 114 N ALA A 17 6.808 -1.183 -0.008 1.00 0.00 N ATOM 115 CA ALA A 17 7.612 -0.398 0.937 1.00 0.00 C ATOM 116 C ALA A 17 6.790 0.507 1.870 1.00 0.00 C ATOM 117 O ALA A 17 7.313 0.922 2.909 1.00 0.00 O ATOM 118 CB ALA A 17 8.566 0.479 0.109 1.00 0.00 C ATOM 0 H ALA A 17 6.716 -0.711 -0.908 1.00 0.00 H new ATOM 0 HA ALA A 17 8.133 -1.102 1.586 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.182 1.079 0.779 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.207 -0.157 -0.502 1.00 0.00 H new ATOM 0 HB3 ALA A 17 7.986 1.137 -0.538 1.00 0.00 H new ATOM 124 N LEU A 18 5.554 0.842 1.482 1.00 0.00 N ATOM 125 CA LEU A 18 4.598 1.647 2.246 1.00 0.00 C ATOM 126 C LEU A 18 3.940 0.787 3.337 1.00 0.00 C ATOM 127 O LEU A 18 3.641 1.285 4.417 1.00 0.00 O ATOM 128 CB LEU A 18 3.602 2.282 1.234 1.00 0.00 C ATOM 129 CG LEU A 18 2.788 3.524 1.668 1.00 0.00 C ATOM 130 CD1 LEU A 18 3.667 4.543 2.380 1.00 0.00 C ATOM 131 CD2 LEU A 18 2.202 4.266 0.449 1.00 0.00 C ATOM 0 H LEU A 18 5.176 0.544 0.583 1.00 0.00 H new ATOM 0 HA LEU A 18 5.082 2.462 2.784 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.166 2.553 0.342 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.892 1.509 0.940 1.00 0.00 H new ATOM 0 HG LEU A 18 2.002 3.147 2.323 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.064 5.403 2.671 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.104 4.088 3.269 1.00 0.00 H new ATOM 0 HD13 LEU A 18 4.463 4.868 1.710 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.636 5.133 0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.013 4.594 -0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.543 3.596 -0.102 1.00 0.00 H new ATOM 143 N ALA A 19 3.817 -0.525 3.108 1.00 0.00 N ATOM 144 CA ALA A 19 3.439 -1.515 4.121 1.00 0.00 C ATOM 145 C ALA A 19 4.628 -2.408 4.536 1.00 0.00 C ATOM 146 O ALA A 19 4.636 -3.623 4.347 1.00 0.00 O ATOM 147 CB ALA A 19 2.231 -2.278 3.585 1.00 0.00 C ATOM 0 H ALA A 19 3.982 -0.938 2.190 1.00 0.00 H new ATOM 0 HA ALA A 19 3.154 -1.029 5.054 1.00 0.00 H new ATOM 0 HB1 ALA A 19 1.920 -3.026 4.314 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.411 -1.582 3.407 1.00 0.00 H new ATOM 0 HB3 ALA A 19 2.498 -2.771 2.650 1.00 0.00 H new ATOM 153 N ASP A 20 5.649 -1.776 5.114 1.00 0.00 N ATOM 154 CA ASP A 20 6.891 -2.361 5.624 1.00 0.00 C ATOM 155 C ASP A 20 7.030 -1.914 7.109 1.00 0.00 C ATOM 156 O ASP A 20 6.678 -0.766 7.402 1.00 0.00 O ATOM 157 CB ASP A 20 7.996 -1.894 4.656 1.00 0.00 C ATOM 158 CG ASP A 20 9.363 -2.542 4.839 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.586 -3.598 4.216 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.210 -1.988 5.577 1.00 0.00 O ATOM 0 H ASP A 20 5.629 -0.765 5.249 1.00 0.00 H new ATOM 0 HA ASP A 20 6.937 -3.450 5.649 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.661 -2.082 3.636 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.111 -0.815 4.760 1.00 0.00 H new ATOM 165 N PRO A 21 7.513 -2.769 8.044 1.00 0.00 N ATOM 166 CA PRO A 21 7.411 -2.650 9.519 1.00 0.00 C ATOM 167 C PRO A 21 7.730 -1.275 10.135 1.00 0.00 C ATOM 168 O PRO A 21 6.844 -0.429 10.283 1.00 0.00 O ATOM 169 CB PRO A 21 8.303 -3.781 10.075 1.00 0.00 C ATOM 170 CG PRO A 21 9.329 -3.931 8.959 1.00 0.00 C ATOM 171 CD PRO A 21 8.385 -3.901 7.764 1.00 0.00 C ATOM 0 HA PRO A 21 6.364 -2.748 9.806 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.765 -3.510 11.024 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.743 -4.701 10.244 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.055 -3.119 8.943 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.893 -4.861 9.027 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.927 -3.767 6.828 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.821 -4.829 7.676 1.00 0.00 H new ATOM 179 N THR A 22 9.000 -1.044 10.493 1.00 0.00 N ATOM 180 CA THR A 22 9.570 0.246 10.902 1.00 0.00 C ATOM 181 C THR A 22 9.172 1.369 9.958 1.00 0.00 C ATOM 182 O THR A 22 9.157 2.531 10.350 1.00 0.00 O ATOM 183 CB THR A 22 11.100 0.147 10.845 1.00 0.00 C ATOM 184 OG1 THR A 22 11.538 -1.064 11.411 1.00 0.00 O ATOM 185 CG2 THR A 22 11.809 1.326 11.519 1.00 0.00 C ATOM 0 H THR A 22 9.694 -1.792 10.506 1.00 0.00 H new ATOM 0 HA THR A 22 9.199 0.464 11.903 1.00 0.00 H new ATOM 0 HB THR A 22 11.368 0.179 9.789 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.953 -1.618 10.717 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.888 1.193 11.443 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.522 2.254 11.025 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.522 1.371 12.570 1.00 0.00 H new ATOM 193 N ARG A 23 8.906 1.021 8.697 1.00 0.00 N ATOM 194 CA ARG A 23 8.742 1.931 7.576 1.00 0.00 C ATOM 195 C ARG A 23 7.426 2.705 7.603 1.00 0.00 C ATOM 196 O ARG A 23 7.494 3.926 7.489 1.00 0.00 O ATOM 197 CB ARG A 23 8.995 1.149 6.281 1.00 0.00 C ATOM 198 CG ARG A 23 10.078 1.819 5.435 1.00 0.00 C ATOM 199 CD ARG A 23 11.018 0.896 4.667 1.00 0.00 C ATOM 200 NE ARG A 23 10.479 0.389 3.393 1.00 0.00 N ATOM 201 CZ ARG A 23 11.168 -0.489 2.667 1.00 0.00 C ATOM 202 NH1 ARG A 23 11.944 -1.383 3.234 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.147 -0.471 1.359 1.00 0.00 N ATOM 0 H ARG A 23 8.795 0.045 8.423 1.00 0.00 H new ATOM 0 HA ARG A 23 9.482 2.728 7.646 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.296 0.129 6.521 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.071 1.082 5.707 1.00 0.00 H new ATOM 0 HG2 ARG A 23 9.590 2.479 4.718 1.00 0.00 H new ATOM 0 HG3 ARG A 23 10.680 2.449 6.090 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.946 1.431 4.466 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.271 0.047 5.302 1.00 0.00 H new ATOM 0 HE ARG A 23 9.570 0.714 3.064 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.028 -1.414 4.250 1.00 0.00 H new ATOM 0 HH12 ARG A 23 12.463 -2.046 2.659 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.592 0.229 0.867 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.686 -1.157 0.831 1.00 0.00 H new ATOM 217 N CYS A 24 6.279 2.072 7.861 1.00 0.00 N ATOM 218 CA CYS A 24 5.029 2.793 8.134 1.00 0.00 C ATOM 219 C CYS A 24 5.230 3.794 9.284 1.00 0.00 C ATOM 220 O CYS A 24 4.964 4.991 9.144 1.00 0.00 O ATOM 221 CB CYS A 24 3.954 1.748 8.461 1.00 0.00 C ATOM 222 SG CYS A 24 2.417 2.602 8.893 1.00 0.00 S ATOM 0 H CYS A 24 6.188 1.056 7.887 1.00 0.00 H new ATOM 0 HA CYS A 24 4.715 3.375 7.268 1.00 0.00 H new ATOM 0 HB2 CYS A 24 3.793 1.092 7.605 1.00 0.00 H new ATOM 0 HB3 CYS A 24 4.280 1.118 9.288 1.00 0.00 H new ATOM 0 HG CYS A 24 1.579 1.753 9.409 1.00 0.00 H new ATOM 228 N ARG A 25 5.827 3.307 10.379 1.00 0.00 N ATOM 229 CA ARG A 25 6.231 4.126 11.518 1.00 0.00 C ATOM 230 C ARG A 25 7.101 5.330 11.090 1.00 0.00 C ATOM 231 O ARG A 25 6.708 6.455 11.380 1.00 0.00 O ATOM 232 CB ARG A 25 6.838 3.233 12.612 1.00 0.00 C ATOM 233 CG ARG A 25 5.734 2.509 13.415 1.00 0.00 C ATOM 234 CD ARG A 25 6.179 2.030 14.806 1.00 0.00 C ATOM 235 NE ARG A 25 6.198 3.137 15.786 1.00 0.00 N ATOM 236 CZ ARG A 25 6.865 3.148 16.937 1.00 0.00 C ATOM 237 NH1 ARG A 25 7.601 2.142 17.346 1.00 0.00 N ATOM 238 NH2 ARG A 25 6.820 4.195 17.729 1.00 0.00 N ATOM 0 H ARG A 25 6.044 2.317 10.496 1.00 0.00 H new ATOM 0 HA ARG A 25 5.353 4.594 11.963 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.503 2.498 12.158 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.444 3.839 13.286 1.00 0.00 H new ATOM 0 HG2 ARG A 25 4.883 3.181 13.529 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.387 1.650 12.841 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.505 1.247 15.154 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.173 1.587 14.738 1.00 0.00 H new ATOM 0 HE ARG A 25 5.650 3.967 15.559 1.00 0.00 H new ATOM 0 HH11 ARG A 25 7.681 1.302 16.773 1.00 0.00 H new ATOM 0 HH12 ARG A 25 8.093 2.200 18.237 1.00 0.00 H new ATOM 0 HH21 ARG A 25 6.269 5.012 17.464 1.00 0.00 H new ATOM 0 HH22 ARG A 25 7.336 4.191 18.609 1.00 0.00 H new ATOM 252 N ILE A 26 8.191 5.159 10.327 1.00 0.00 N ATOM 253 CA ILE A 26 8.963 6.301 9.754 1.00 0.00 C ATOM 254 C ILE A 26 8.056 7.290 9.030 1.00 0.00 C ATOM 255 O ILE A 26 8.158 8.490 9.236 1.00 0.00 O ATOM 256 CB ILE A 26 10.085 5.885 8.755 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.016 4.780 9.290 1.00 0.00 C ATOM 258 CG2 ILE A 26 10.851 7.157 8.354 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.501 4.787 8.904 1.00 0.00 C ATOM 0 H ILE A 26 8.568 4.243 10.085 1.00 0.00 H new ATOM 0 HA ILE A 26 9.430 6.758 10.626 1.00 0.00 H new ATOM 0 HB ILE A 26 9.624 5.431 7.878 1.00 0.00 H new ATOM 0 HG12 ILE A 26 10.962 4.807 10.378 1.00 0.00 H new ATOM 0 HG13 ILE A 26 10.601 3.823 8.974 1.00 0.00 H new ATOM 0 HG21 ILE A 26 11.645 6.898 7.654 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.166 7.861 7.882 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.286 7.615 9.242 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.002 3.938 9.370 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.596 4.714 7.821 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.962 5.713 9.247 1.00 0.00 H new ATOM 271 N LEU A 27 7.215 6.773 8.145 1.00 0.00 N ATOM 272 CA LEU A 27 6.424 7.575 7.214 1.00 0.00 C ATOM 273 C LEU A 27 5.323 8.380 7.917 1.00 0.00 C ATOM 274 O LEU A 27 5.122 9.535 7.550 1.00 0.00 O ATOM 275 CB LEU A 27 5.896 6.658 6.095 1.00 0.00 C ATOM 276 CG LEU A 27 7.012 6.099 5.180 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.444 5.029 4.250 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.629 7.182 4.292 1.00 0.00 C ATOM 0 H LEU A 27 7.059 5.770 8.050 1.00 0.00 H new ATOM 0 HA LEU A 27 7.061 8.335 6.762 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.353 5.826 6.543 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.182 7.214 5.487 1.00 0.00 H new ATOM 0 HG LEU A 27 7.776 5.691 5.842 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.238 4.643 3.611 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.028 4.215 4.843 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.660 5.464 3.631 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.407 6.742 3.668 1.00 0.00 H new ATOM 0 HD22 LEU A 27 6.857 7.615 3.657 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.064 7.962 4.918 1.00 0.00 H new ATOM 290 N VAL A 28 4.670 7.831 8.945 1.00 0.00 N ATOM 291 CA VAL A 28 3.682 8.572 9.762 1.00 0.00 C ATOM 292 C VAL A 28 4.355 9.562 10.717 1.00 0.00 C ATOM 293 O VAL A 28 3.736 10.541 11.125 1.00 0.00 O ATOM 294 CB VAL A 28 2.682 7.626 10.467 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.287 6.858 11.650 1.00 0.00 C ATOM 296 CG2 VAL A 28 1.405 8.345 10.924 1.00 0.00 C ATOM 0 H VAL A 28 4.805 6.864 9.240 1.00 0.00 H new ATOM 0 HA VAL A 28 3.086 9.176 9.078 1.00 0.00 H new ATOM 0 HB VAL A 28 2.420 6.899 9.698 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.527 6.216 12.094 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.119 6.247 11.300 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.646 7.565 12.398 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.741 7.632 11.412 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.665 9.137 11.626 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.901 8.777 10.059 1.00 0.00 H new ATOM 306 N ALA A 29 5.638 9.344 11.024 1.00 0.00 N ATOM 307 CA ALA A 29 6.456 10.329 11.711 1.00 0.00 C ATOM 308 C ALA A 29 6.916 11.428 10.740 1.00 0.00 C ATOM 309 O ALA A 29 6.778 12.591 11.082 1.00 0.00 O ATOM 310 CB ALA A 29 7.606 9.599 12.404 1.00 0.00 C ATOM 0 H ALA A 29 6.131 8.479 10.801 1.00 0.00 H new ATOM 0 HA ALA A 29 5.880 10.848 12.478 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.233 10.321 12.926 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.203 8.883 13.120 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.203 9.071 11.660 1.00 0.00 H new ATOM 316 N LEU A 30 7.378 11.114 9.519 1.00 0.00 N ATOM 317 CA LEU A 30 7.919 12.068 8.530 1.00 0.00 C ATOM 318 C LEU A 30 6.944 13.124 8.042 1.00 0.00 C ATOM 319 O LEU A 30 7.358 14.140 7.500 1.00 0.00 O ATOM 320 CB LEU A 30 8.448 11.333 7.288 1.00 0.00 C ATOM 321 CG LEU A 30 9.907 10.862 7.394 1.00 0.00 C ATOM 322 CD1 LEU A 30 10.359 10.238 6.065 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.784 12.065 7.741 1.00 0.00 C ATOM 0 H LEU A 30 7.386 10.153 9.178 1.00 0.00 H new ATOM 0 HA LEU A 30 8.711 12.579 9.078 1.00 0.00 H new ATOM 0 HB2 LEU A 30 7.814 10.467 7.097 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.355 11.992 6.425 1.00 0.00 H new ATOM 0 HG LEU A 30 9.997 10.105 8.173 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.394 9.908 6.152 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.724 9.384 5.830 1.00 0.00 H new ATOM 0 HD13 LEU A 30 10.280 10.979 5.270 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.824 11.747 7.820 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.694 12.819 6.959 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.461 12.488 8.692 1.00 0.00 H new ATOM 335 N LEU A 31 5.671 12.858 8.232 1.00 0.00 N ATOM 336 CA LEU A 31 4.591 13.835 8.098 1.00 0.00 C ATOM 337 C LEU A 31 4.854 15.105 8.961 1.00 0.00 C ATOM 338 O LEU A 31 4.357 16.170 8.611 1.00 0.00 O ATOM 339 CB LEU A 31 3.259 13.108 8.413 1.00 0.00 C ATOM 340 CG LEU A 31 2.399 12.794 7.173 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.248 11.880 7.602 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.846 14.063 6.506 1.00 0.00 C ATOM 0 H LEU A 31 5.339 11.929 8.492 1.00 0.00 H new ATOM 0 HA LEU A 31 4.534 14.221 7.080 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.481 12.176 8.932 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.676 13.723 9.099 1.00 0.00 H new ATOM 0 HG LEU A 31 3.029 12.302 6.432 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.627 11.646 6.737 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.652 10.957 8.019 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.644 12.385 8.356 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.248 13.787 5.638 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.224 14.606 7.217 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.674 14.698 6.189 1.00 0.00 H new ATOM 354 N ASP A 32 5.694 15.000 10.006 1.00 0.00 N ATOM 355 CA ASP A 32 6.275 16.076 10.842 1.00 0.00 C ATOM 356 C ASP A 32 7.818 15.979 10.995 1.00 0.00 C ATOM 357 O ASP A 32 8.526 16.980 11.068 1.00 0.00 O ATOM 358 CB ASP A 32 5.639 15.943 12.240 1.00 0.00 C ATOM 359 CG ASP A 32 6.369 16.734 13.338 1.00 0.00 C ATOM 360 OD1 ASP A 32 6.119 17.951 13.447 1.00 0.00 O ATOM 361 OD2 ASP A 32 7.164 16.101 14.078 1.00 0.00 O ATOM 0 H ASP A 32 6.014 14.083 10.317 1.00 0.00 H new ATOM 0 HA ASP A 32 6.069 17.032 10.360 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.604 16.281 12.190 1.00 0.00 H new ATOM 0 HB3 ASP A 32 5.617 14.890 12.519 1.00 0.00 H new ATOM 366 N GLY A 33 8.378 14.766 10.933 1.00 0.00 N ATOM 367 CA GLY A 33 9.738 14.353 11.321 1.00 0.00 C ATOM 368 C GLY A 33 10.865 14.833 10.419 1.00 0.00 C ATOM 369 O GLY A 33 12.021 14.431 10.529 1.00 0.00 O ATOM 0 H GLY A 33 7.844 13.973 10.578 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.931 14.712 12.332 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.768 13.264 11.359 1.00 0.00 H new ATOM 373 N VAL A 34 10.525 15.746 9.534 1.00 0.00 N ATOM 374 CA VAL A 34 11.395 16.502 8.635 1.00 0.00 C ATOM 375 C VAL A 34 12.363 17.490 9.315 1.00 0.00 C ATOM 376 O VAL A 34 12.592 18.588 8.805 1.00 0.00 O ATOM 377 CB VAL A 34 10.530 17.194 7.567 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.727 16.158 6.793 1.00 0.00 C ATOM 379 CG2 VAL A 34 9.528 18.232 8.104 1.00 0.00 C ATOM 0 H VAL A 34 9.547 16.007 9.408 1.00 0.00 H new ATOM 0 HA VAL A 34 12.066 15.775 8.176 1.00 0.00 H new ATOM 0 HB VAL A 34 11.249 17.726 6.944 1.00 0.00 H new ATOM 0 HG11 VAL A 34 9.118 16.658 6.040 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.408 15.460 6.305 1.00 0.00 H new ATOM 0 HG13 VAL A 34 9.079 15.613 7.479 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.968 18.661 7.273 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.838 17.748 8.795 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.068 19.023 8.625 1.00 0.00 H new ATOM 389 N CYS A 35 12.946 17.107 10.458 1.00 0.00 N ATOM 390 CA CYS A 35 13.864 17.940 11.239 1.00 0.00 C ATOM 391 C CYS A 35 15.344 17.576 11.018 1.00 0.00 C ATOM 392 O CYS A 35 16.087 18.406 10.502 1.00 0.00 O ATOM 393 CB CYS A 35 13.426 17.900 12.713 1.00 0.00 C ATOM 394 SG CYS A 35 14.081 19.363 13.560 1.00 0.00 S ATOM 0 H CYS A 35 12.788 16.189 10.873 1.00 0.00 H new ATOM 0 HA CYS A 35 13.802 18.971 10.890 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.338 17.879 12.783 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.793 16.992 13.191 1.00 0.00 H new ATOM 0 HG CYS A 35 13.716 19.342 14.807 1.00 0.00 H new ATOM 400 N TYR A 36 15.774 16.342 11.320 1.00 0.00 N ATOM 401 CA TYR A 36 17.184 15.930 11.161 1.00 0.00 C ATOM 402 C TYR A 36 17.398 14.405 11.042 1.00 0.00 C ATOM 403 O TYR A 36 16.575 13.641 11.556 1.00 0.00 O ATOM 404 CB TYR A 36 18.053 16.526 12.295 1.00 0.00 C ATOM 405 CG TYR A 36 17.711 16.140 13.715 1.00 0.00 C ATOM 406 CD1 TYR A 36 18.287 15.006 14.320 1.00 0.00 C ATOM 407 CD2 TYR A 36 16.835 16.958 14.448 1.00 0.00 C ATOM 408 CE1 TYR A 36 17.935 14.654 15.641 1.00 0.00 C ATOM 409 CE2 TYR A 36 16.485 16.618 15.768 1.00 0.00 C ATOM 410 CZ TYR A 36 17.015 15.451 16.362 1.00 0.00 C ATOM 411 OH TYR A 36 16.609 15.094 17.610 1.00 0.00 O ATOM 0 H TYR A 36 15.165 15.606 11.678 1.00 0.00 H new ATOM 0 HA TYR A 36 17.504 16.337 10.202 1.00 0.00 H new ATOM 0 HB2 TYR A 36 19.089 16.241 12.110 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.003 17.612 12.221 1.00 0.00 H new ATOM 0 HD1 TYR A 36 18.998 14.405 13.773 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.429 17.851 13.997 1.00 0.00 H new ATOM 0 HE1 TYR A 36 18.367 13.778 16.101 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.811 17.250 16.327 1.00 0.00 H new ATOM 0 HH TYR A 36 15.977 15.761 17.952 1.00 0.00 H new ATOM 421 N PRO A 37 18.496 13.934 10.407 1.00 0.00 N ATOM 422 CA PRO A 37 18.817 12.514 10.346 1.00 0.00 C ATOM 423 C PRO A 37 19.017 11.975 11.759 1.00 0.00 C ATOM 424 O PRO A 37 19.910 12.413 12.477 1.00 0.00 O ATOM 425 CB PRO A 37 20.089 12.394 9.497 1.00 0.00 C ATOM 426 CG PRO A 37 20.750 13.758 9.660 1.00 0.00 C ATOM 427 CD PRO A 37 19.544 14.693 9.732 1.00 0.00 C ATOM 0 HA PRO A 37 18.016 11.926 9.897 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.734 11.590 9.851 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.857 12.181 8.453 1.00 0.00 H new ATOM 0 HG2 PRO A 37 21.360 13.810 10.562 1.00 0.00 H new ATOM 0 HG3 PRO A 37 21.402 13.998 8.820 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.786 15.602 10.283 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.226 14.999 8.735 1.00 0.00 H new ATOM 435 N GLY A 38 18.154 11.037 12.157 1.00 0.00 N ATOM 436 CA GLY A 38 18.139 10.485 13.508 1.00 0.00 C ATOM 437 C GLY A 38 17.065 11.065 14.423 1.00 0.00 C ATOM 438 O GLY A 38 16.813 10.420 15.427 1.00 0.00 O ATOM 0 H GLY A 38 17.442 10.639 11.544 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.998 9.406 13.443 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.115 10.652 13.965 1.00 0.00 H new ATOM 442 N GLN A 39 16.385 12.167 14.067 1.00 0.00 N ATOM 443 CA GLN A 39 15.263 12.731 14.855 1.00 0.00 C ATOM 444 C GLN A 39 14.106 11.736 14.992 1.00 0.00 C ATOM 445 O GLN A 39 13.341 11.763 15.952 1.00 0.00 O ATOM 446 CB GLN A 39 14.741 14.036 14.226 1.00 0.00 C ATOM 447 CG GLN A 39 13.743 13.902 13.060 1.00 0.00 C ATOM 448 CD GLN A 39 12.296 13.592 13.452 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.684 12.675 12.935 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.691 14.317 14.367 1.00 0.00 N ATOM 0 H GLN A 39 16.594 12.698 13.222 1.00 0.00 H new ATOM 0 HA GLN A 39 15.657 12.944 15.849 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.267 14.624 15.012 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.599 14.608 13.873 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.754 14.831 12.489 1.00 0.00 H new ATOM 0 HG3 GLN A 39 14.095 13.114 12.394 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.184 15.090 14.813 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.728 14.106 14.630 1.00 0.00 H new ATOM 459 N LEU A 40 13.961 10.864 13.989 1.00 0.00 N ATOM 460 CA LEU A 40 12.952 9.819 13.980 1.00 0.00 C ATOM 461 C LEU A 40 13.182 8.832 15.128 1.00 0.00 C ATOM 462 O LEU A 40 12.266 8.104 15.489 1.00 0.00 O ATOM 463 CB LEU A 40 12.988 9.113 12.615 1.00 0.00 C ATOM 464 CG LEU A 40 12.518 9.980 11.435 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.162 9.452 10.152 1.00 0.00 C ATOM 466 CD2 LEU A 40 10.987 9.976 11.329 1.00 0.00 C ATOM 0 H LEU A 40 14.550 10.870 13.156 1.00 0.00 H new ATOM 0 HA LEU A 40 11.965 10.256 14.130 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.007 8.778 12.420 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.364 8.221 12.665 1.00 0.00 H new ATOM 0 HG LEU A 40 12.825 11.014 11.594 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.837 10.058 9.306 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.247 9.505 10.241 1.00 0.00 H new ATOM 0 HD13 LEU A 40 12.861 8.416 9.993 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.679 10.596 10.487 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.636 8.956 11.176 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.558 10.373 12.249 1.00 0.00 H new ATOM 478 N ALA A 41 14.379 8.776 15.715 1.00 0.00 N ATOM 479 CA ALA A 41 14.610 7.876 16.836 1.00 0.00 C ATOM 480 C ALA A 41 13.677 8.223 18.004 1.00 0.00 C ATOM 481 O ALA A 41 13.086 7.307 18.572 1.00 0.00 O ATOM 482 CB ALA A 41 16.092 7.909 17.206 1.00 0.00 C ATOM 0 H ALA A 41 15.187 9.333 15.437 1.00 0.00 H new ATOM 0 HA ALA A 41 14.369 6.850 16.559 1.00 0.00 H new ATOM 0 HB1 ALA A 41 16.273 7.237 18.045 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.688 7.590 16.351 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.374 8.924 17.486 1.00 0.00 H new ATOM 488 N ALA A 42 13.475 9.506 18.328 1.00 0.00 N ATOM 489 CA ALA A 42 12.496 9.917 19.336 1.00 0.00 C ATOM 490 C ALA A 42 11.052 9.559 18.931 1.00 0.00 C ATOM 491 O ALA A 42 10.355 8.887 19.690 1.00 0.00 O ATOM 492 CB ALA A 42 12.673 11.418 19.601 1.00 0.00 C ATOM 0 H ALA A 42 13.982 10.281 17.901 1.00 0.00 H new ATOM 0 HA ALA A 42 12.677 9.366 20.259 1.00 0.00 H new ATOM 0 HB1 ALA A 42 11.951 11.743 20.350 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.683 11.607 19.964 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.511 11.972 18.677 1.00 0.00 H new ATOM 498 N HIS A 43 10.619 9.930 17.719 1.00 0.00 N ATOM 499 CA HIS A 43 9.268 9.607 17.229 1.00 0.00 C ATOM 500 C HIS A 43 8.951 8.093 17.221 1.00 0.00 C ATOM 501 O HIS A 43 7.802 7.686 17.432 1.00 0.00 O ATOM 502 CB HIS A 43 9.096 10.166 15.804 1.00 0.00 C ATOM 503 CG HIS A 43 8.772 11.634 15.697 1.00 0.00 C ATOM 504 ND1 HIS A 43 8.055 12.375 16.636 1.00 0.00 N ATOM 505 CD2 HIS A 43 8.930 12.386 14.566 1.00 0.00 C ATOM 506 CE1 HIS A 43 7.814 13.561 16.056 1.00 0.00 C ATOM 507 NE2 HIS A 43 8.322 13.599 14.812 1.00 0.00 N ATOM 0 H HIS A 43 11.186 10.457 17.055 1.00 0.00 H new ATOM 0 HA HIS A 43 8.568 10.069 17.925 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.015 9.977 15.249 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.304 9.604 15.309 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.433 12.088 13.658 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.283 14.376 16.526 1.00 0.00 H new ATOM 0 HE2 HIS A 43 8.267 14.386 14.165 1.00 0.00 H new ATOM 515 N LEU A 44 9.936 7.241 16.902 1.00 0.00 N ATOM 516 CA LEU A 44 9.724 5.804 16.663 1.00 0.00 C ATOM 517 C LEU A 44 10.125 4.913 17.836 1.00 0.00 C ATOM 518 O LEU A 44 9.816 3.726 17.820 1.00 0.00 O ATOM 519 CB LEU A 44 10.478 5.358 15.397 1.00 0.00 C ATOM 520 CG LEU A 44 10.169 6.183 14.138 1.00 0.00 C ATOM 521 CD1 LEU A 44 10.719 5.507 12.892 1.00 0.00 C ATOM 522 CD2 LEU A 44 8.695 6.532 13.940 1.00 0.00 C ATOM 0 H LEU A 44 10.909 7.530 16.802 1.00 0.00 H new ATOM 0 HA LEU A 44 8.649 5.681 16.533 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.549 5.408 15.593 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.238 4.314 15.198 1.00 0.00 H new ATOM 0 HG LEU A 44 10.677 7.134 14.302 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.486 6.113 12.016 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.800 5.401 12.983 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.266 4.522 12.783 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.579 7.114 13.026 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.111 5.615 13.863 1.00 0.00 H new ATOM 0 HD23 LEU A 44 8.342 7.116 14.790 1.00 0.00 H new ATOM 534 N GLY A 45 10.873 5.436 18.803 1.00 0.00 N ATOM 535 CA GLY A 45 11.442 4.651 19.893 1.00 0.00 C ATOM 536 C GLY A 45 12.444 3.587 19.456 1.00 0.00 C ATOM 537 O GLY A 45 12.814 2.722 20.245 1.00 0.00 O ATOM 0 H GLY A 45 11.104 6.428 18.852 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.933 5.328 20.592 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.631 4.166 20.435 1.00 0.00 H new ATOM 541 N LEU A 46 12.872 3.618 18.190 1.00 0.00 N ATOM 542 CA LEU A 46 13.925 2.755 17.670 1.00 0.00 C ATOM 543 C LEU A 46 15.219 3.569 17.600 1.00 0.00 C ATOM 544 O LEU A 46 15.214 4.745 17.242 1.00 0.00 O ATOM 545 CB LEU A 46 13.508 2.159 16.317 1.00 0.00 C ATOM 546 CG LEU A 46 12.813 0.785 16.429 1.00 0.00 C ATOM 547 CD1 LEU A 46 11.523 0.793 17.261 1.00 0.00 C ATOM 548 CD2 LEU A 46 12.486 0.312 15.015 1.00 0.00 C ATOM 0 H LEU A 46 12.488 4.254 17.491 1.00 0.00 H new ATOM 0 HA LEU A 46 14.097 1.904 18.329 1.00 0.00 H new ATOM 0 HB2 LEU A 46 12.836 2.856 15.815 1.00 0.00 H new ATOM 0 HB3 LEU A 46 14.392 2.058 15.687 1.00 0.00 H new ATOM 0 HG LEU A 46 13.501 0.119 16.949 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.101 -0.212 17.287 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.747 1.119 18.277 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.804 1.477 16.811 1.00 0.00 H new ATOM 0 HD21 LEU A 46 11.993 -0.659 15.061 1.00 0.00 H new ATOM 0 HD22 LEU A 46 11.824 1.033 14.534 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.407 0.224 14.439 1.00 0.00 H new ATOM 560 N THR A 47 16.349 2.935 17.927 1.00 0.00 N ATOM 561 CA THR A 47 17.652 3.611 17.970 1.00 0.00 C ATOM 562 C THR A 47 18.009 4.215 16.611 1.00 0.00 C ATOM 563 O THR A 47 17.652 3.665 15.559 1.00 0.00 O ATOM 564 CB THR A 47 18.735 2.692 18.540 1.00 0.00 C ATOM 565 OG1 THR A 47 19.922 3.438 18.652 1.00 0.00 O ATOM 566 CG2 THR A 47 19.013 1.452 17.688 1.00 0.00 C ATOM 0 H THR A 47 16.388 1.945 18.168 1.00 0.00 H new ATOM 0 HA THR A 47 17.584 4.453 18.659 1.00 0.00 H new ATOM 0 HB THR A 47 18.375 2.329 19.503 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.632 2.870 19.018 1.00 0.00 H new ATOM 0 HG21 THR A 47 19.792 0.853 18.160 1.00 0.00 H new ATOM 0 HG22 THR A 47 18.103 0.859 17.601 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.343 1.759 16.695 1.00 0.00 H new ATOM 574 N ARG A 48 18.735 5.343 16.634 1.00 0.00 N ATOM 575 CA ARG A 48 19.021 6.167 15.451 1.00 0.00 C ATOM 576 C ARG A 48 19.724 5.393 14.321 1.00 0.00 C ATOM 577 O ARG A 48 19.514 5.699 13.147 1.00 0.00 O ATOM 578 CB ARG A 48 19.748 7.478 15.854 1.00 0.00 C ATOM 579 CG ARG A 48 21.128 7.312 16.524 1.00 0.00 C ATOM 580 CD ARG A 48 21.873 8.647 16.768 1.00 0.00 C ATOM 581 NE ARG A 48 21.502 9.332 18.026 1.00 0.00 N ATOM 582 CZ ARG A 48 22.076 10.420 18.542 1.00 0.00 C ATOM 583 NH1 ARG A 48 23.071 11.052 17.953 1.00 0.00 N ATOM 584 NH2 ARG A 48 21.647 10.894 19.689 1.00 0.00 N ATOM 0 H ARG A 48 19.147 5.714 17.490 1.00 0.00 H new ATOM 0 HA ARG A 48 18.063 6.454 15.017 1.00 0.00 H new ATOM 0 HB2 ARG A 48 19.872 8.090 14.960 1.00 0.00 H new ATOM 0 HB3 ARG A 48 19.102 8.034 16.533 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.998 6.800 17.478 1.00 0.00 H new ATOM 0 HG3 ARG A 48 21.749 6.670 15.899 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.946 8.454 16.776 1.00 0.00 H new ATOM 0 HD3 ARG A 48 21.676 9.317 15.931 1.00 0.00 H new ATOM 0 HE ARG A 48 20.727 8.931 18.553 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.435 10.713 17.063 1.00 0.00 H new ATOM 0 HH12 ARG A 48 23.477 11.881 18.387 1.00 0.00 H new ATOM 0 HH21 ARG A 48 20.881 10.431 20.178 1.00 0.00 H new ATOM 0 HH22 ARG A 48 22.080 11.725 20.091 1.00 0.00 H new ATOM 598 N SER A 49 20.492 4.347 14.638 1.00 0.00 N ATOM 599 CA SER A 49 21.046 3.408 13.646 1.00 0.00 C ATOM 600 C SER A 49 19.966 2.525 12.993 1.00 0.00 C ATOM 601 O SER A 49 19.820 2.569 11.774 1.00 0.00 O ATOM 602 CB SER A 49 22.146 2.549 14.287 1.00 0.00 C ATOM 603 OG SER A 49 21.718 1.974 15.514 1.00 0.00 O ATOM 0 H SER A 49 20.752 4.122 15.598 1.00 0.00 H new ATOM 0 HA SER A 49 21.480 4.005 12.844 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.438 1.757 13.597 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.030 3.162 14.462 1.00 0.00 H new ATOM 0 HG SER A 49 22.443 1.433 15.892 1.00 0.00 H new ATOM 609 N ASN A 50 19.165 1.791 13.780 1.00 0.00 N ATOM 610 CA ASN A 50 18.067 0.946 13.281 1.00 0.00 C ATOM 611 C ASN A 50 17.079 1.738 12.399 1.00 0.00 C ATOM 612 O ASN A 50 16.815 1.339 11.264 1.00 0.00 O ATOM 613 CB ASN A 50 17.359 0.285 14.483 1.00 0.00 C ATOM 614 CG ASN A 50 16.284 -0.732 14.088 1.00 0.00 C ATOM 615 OD1 ASN A 50 15.981 -0.940 12.928 1.00 0.00 O ATOM 616 ND2 ASN A 50 15.686 -1.426 15.041 1.00 0.00 N ATOM 0 H ASN A 50 19.262 1.767 14.795 1.00 0.00 H new ATOM 0 HA ASN A 50 18.483 0.170 12.638 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.105 -0.212 15.103 1.00 0.00 H new ATOM 0 HB3 ASN A 50 16.902 1.062 15.095 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.982 -2.124 14.799 1.00 0.00 H new ATOM 0 HD22 ASN A 50 15.928 -1.264 16.018 1.00 0.00 H new ATOM 623 N VAL A 51 16.612 2.906 12.864 1.00 0.00 N ATOM 624 CA VAL A 51 15.710 3.747 12.058 1.00 0.00 C ATOM 625 C VAL A 51 16.373 4.157 10.735 1.00 0.00 C ATOM 626 O VAL A 51 15.738 4.084 9.684 1.00 0.00 O ATOM 627 CB VAL A 51 15.221 4.992 12.828 1.00 0.00 C ATOM 628 CG1 VAL A 51 14.338 5.873 11.938 1.00 0.00 C ATOM 629 CG2 VAL A 51 14.384 4.585 14.046 1.00 0.00 C ATOM 0 H VAL A 51 16.839 3.288 13.782 1.00 0.00 H new ATOM 0 HA VAL A 51 14.832 3.140 11.835 1.00 0.00 H new ATOM 0 HB VAL A 51 16.109 5.540 13.142 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.006 6.744 12.503 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.909 6.200 11.069 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.470 5.302 11.608 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.050 5.479 14.573 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.517 4.013 13.717 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.989 3.974 14.715 1.00 0.00 H new ATOM 639 N SER A 52 17.664 4.501 10.746 1.00 0.00 N ATOM 640 CA SER A 52 18.374 4.883 9.522 1.00 0.00 C ATOM 641 C SER A 52 18.614 3.723 8.547 1.00 0.00 C ATOM 642 O SER A 52 18.628 3.955 7.338 1.00 0.00 O ATOM 643 CB SER A 52 19.681 5.600 9.849 1.00 0.00 C ATOM 644 OG SER A 52 19.429 6.752 10.644 1.00 0.00 O ATOM 0 H SER A 52 18.239 4.523 11.589 1.00 0.00 H new ATOM 0 HA SER A 52 17.709 5.572 9.001 1.00 0.00 H new ATOM 0 HB2 SER A 52 20.351 4.924 10.380 1.00 0.00 H new ATOM 0 HB3 SER A 52 20.185 5.890 8.927 1.00 0.00 H new ATOM 0 HG SER A 52 19.431 6.502 11.592 1.00 0.00 H new ATOM 650 N ASN A 53 18.704 2.478 9.029 1.00 0.00 N ATOM 651 CA ASN A 53 18.723 1.280 8.186 1.00 0.00 C ATOM 652 C ASN A 53 17.445 1.191 7.325 1.00 0.00 C ATOM 653 O ASN A 53 17.509 1.056 6.106 1.00 0.00 O ATOM 654 CB ASN A 53 18.923 0.049 9.091 1.00 0.00 C ATOM 655 CG ASN A 53 19.411 -1.194 8.351 1.00 0.00 C ATOM 656 OD1 ASN A 53 19.644 -1.193 7.152 1.00 0.00 O ATOM 657 ND2 ASN A 53 19.600 -2.289 9.066 1.00 0.00 N ATOM 0 H ASN A 53 18.766 2.273 10.026 1.00 0.00 H new ATOM 0 HA ASN A 53 19.553 1.325 7.480 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.640 0.299 9.873 1.00 0.00 H new ATOM 0 HB3 ASN A 53 17.980 -0.182 9.586 1.00 0.00 H new ATOM 0 HD21 ASN A 53 19.942 -3.139 8.617 1.00 0.00 H new ATOM 0 HD22 ASN A 53 19.404 -2.285 10.067 1.00 0.00 H new ATOM 664 N HIS A 54 16.267 1.427 7.914 1.00 0.00 N ATOM 665 CA HIS A 54 15.029 1.559 7.132 1.00 0.00 C ATOM 666 C HIS A 54 14.932 2.870 6.308 1.00 0.00 C ATOM 667 O HIS A 54 14.225 2.872 5.292 1.00 0.00 O ATOM 668 CB HIS A 54 13.805 1.328 8.032 1.00 0.00 C ATOM 669 CG HIS A 54 13.444 -0.131 8.217 1.00 0.00 C ATOM 670 ND1 HIS A 54 12.634 -0.890 7.396 1.00 0.00 N ATOM 671 CD2 HIS A 54 13.740 -0.921 9.296 1.00 0.00 C ATOM 672 CE1 HIS A 54 12.437 -2.082 7.970 1.00 0.00 C ATOM 673 NE2 HIS A 54 13.058 -2.132 9.154 1.00 0.00 N ATOM 0 H HIS A 54 16.143 1.530 8.921 1.00 0.00 H new ATOM 0 HA HIS A 54 15.051 0.777 6.373 1.00 0.00 H new ATOM 0 HB2 HIS A 54 13.996 1.771 9.009 1.00 0.00 H new ATOM 0 HB3 HIS A 54 12.949 1.852 7.606 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.390 -0.654 10.116 1.00 0.00 H new ATOM 0 HE1 HIS A 54 11.860 -2.887 7.540 1.00 0.00 H new ATOM 0 HE2 HIS A 54 13.038 -2.903 9.822 1.00 0.00 H new ATOM 681 N LEU A 55 15.652 3.957 6.658 1.00 0.00 N ATOM 682 CA LEU A 55 15.776 5.125 5.759 1.00 0.00 C ATOM 683 C LEU A 55 16.640 4.811 4.543 1.00 0.00 C ATOM 684 O LEU A 55 16.490 5.474 3.523 1.00 0.00 O ATOM 685 CB LEU A 55 16.351 6.396 6.415 1.00 0.00 C ATOM 686 CG LEU A 55 15.533 6.984 7.575 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.356 8.067 8.284 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.249 7.609 7.023 1.00 0.00 C ATOM 0 H LEU A 55 16.150 4.051 7.543 1.00 0.00 H new ATOM 0 HA LEU A 55 14.744 5.331 5.475 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.353 6.171 6.781 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.457 7.162 5.646 1.00 0.00 H new ATOM 0 HG LEU A 55 15.284 6.193 8.282 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.776 8.484 9.107 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.275 7.629 8.673 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.603 8.858 7.576 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.666 8.027 7.844 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.503 8.401 6.318 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.662 6.845 6.514 1.00 0.00 H new ATOM 700 N SER A 56 17.552 3.849 4.629 1.00 0.00 N ATOM 701 CA SER A 56 18.273 3.345 3.460 1.00 0.00 C ATOM 702 C SER A 56 17.313 2.934 2.333 1.00 0.00 C ATOM 703 O SER A 56 17.528 3.347 1.192 1.00 0.00 O ATOM 704 CB SER A 56 19.216 2.209 3.878 1.00 0.00 C ATOM 705 OG SER A 56 20.500 2.427 3.331 1.00 0.00 O ATOM 0 H SER A 56 17.813 3.397 5.505 1.00 0.00 H new ATOM 0 HA SER A 56 18.883 4.150 3.050 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.278 2.157 4.965 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.822 1.252 3.535 1.00 0.00 H new ATOM 0 HG SER A 56 21.099 1.700 3.602 1.00 0.00 H new ATOM 711 N CYS A 57 16.189 2.259 2.634 1.00 0.00 N ATOM 712 CA CYS A 57 15.283 1.834 1.576 1.00 0.00 C ATOM 713 C CYS A 57 14.310 2.963 1.162 1.00 0.00 C ATOM 714 O CYS A 57 14.081 3.163 -0.024 1.00 0.00 O ATOM 715 CB CYS A 57 14.598 0.543 2.027 1.00 0.00 C ATOM 716 SG CYS A 57 14.107 -0.514 0.618 1.00 0.00 S ATOM 0 H CYS A 57 15.900 2.006 3.579 1.00 0.00 H new ATOM 0 HA CYS A 57 15.835 1.618 0.661 1.00 0.00 H new ATOM 0 HB2 CYS A 57 15.271 -0.014 2.678 1.00 0.00 H new ATOM 0 HB3 CYS A 57 13.716 0.790 2.617 1.00 0.00 H new ATOM 0 HG CYS A 57 13.297 0.144 -0.157 1.00 0.00 H new ATOM 721 N LEU A 58 13.793 3.752 2.112 1.00 0.00 N ATOM 722 CA LEU A 58 12.934 4.935 1.877 1.00 0.00 C ATOM 723 C LEU A 58 13.537 5.939 0.885 1.00 0.00 C ATOM 724 O LEU A 58 12.853 6.475 0.006 1.00 0.00 O ATOM 725 CB LEU A 58 12.710 5.628 3.245 1.00 0.00 C ATOM 726 CG LEU A 58 11.254 5.759 3.722 1.00 0.00 C ATOM 727 CD1 LEU A 58 10.572 4.428 3.672 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.202 6.239 5.176 1.00 0.00 C ATOM 0 H LEU A 58 13.963 3.584 3.104 1.00 0.00 H new ATOM 0 HA LEU A 58 12.000 4.594 1.431 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.268 5.076 4.002 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.143 6.627 3.195 1.00 0.00 H new ATOM 0 HG LEU A 58 10.759 6.475 3.066 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.542 4.534 4.012 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.579 4.054 2.648 1.00 0.00 H new ATOM 0 HD13 LEU A 58 11.097 3.726 4.319 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.163 6.325 5.494 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.719 5.522 5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.687 7.212 5.256 1.00 0.00 H new ATOM 740 N ARG A 59 14.837 6.174 1.035 1.00 0.00 N ATOM 741 CA ARG A 59 15.609 7.104 0.216 1.00 0.00 C ATOM 742 C ARG A 59 16.114 6.445 -1.092 1.00 0.00 C ATOM 743 O ARG A 59 16.748 7.122 -1.891 1.00 0.00 O ATOM 744 CB ARG A 59 16.744 7.655 1.079 1.00 0.00 C ATOM 745 CG ARG A 59 16.191 8.384 2.329 1.00 0.00 C ATOM 746 CD ARG A 59 17.313 8.888 3.218 1.00 0.00 C ATOM 747 NE ARG A 59 18.139 7.780 3.723 1.00 0.00 N ATOM 748 CZ ARG A 59 19.458 7.747 3.832 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.191 8.820 3.631 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.056 6.614 4.133 1.00 0.00 N ATOM 0 H ARG A 59 15.398 5.710 1.749 1.00 0.00 H new ATOM 0 HA ARG A 59 14.976 7.928 -0.114 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.398 6.840 1.389 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.350 8.344 0.491 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.568 9.222 2.017 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.553 7.705 2.895 1.00 0.00 H new ATOM 0 HD2 ARG A 59 17.938 9.583 2.658 1.00 0.00 H new ATOM 0 HD3 ARG A 59 16.893 9.442 4.057 1.00 0.00 H new ATOM 0 HE ARG A 59 17.639 6.943 4.023 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.745 9.704 3.385 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.206 8.769 3.721 1.00 0.00 H new ATOM 0 HH21 ARG A 59 19.504 5.769 4.281 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.072 6.581 4.219 1.00 0.00 H new ATOM 764 N GLY A 60 15.832 5.150 -1.328 1.00 0.00 N ATOM 765 CA GLY A 60 16.154 4.398 -2.558 1.00 0.00 C ATOM 766 C GLY A 60 14.919 4.062 -3.401 1.00 0.00 C ATOM 767 O GLY A 60 14.927 4.229 -4.614 1.00 0.00 O ATOM 0 H GLY A 60 15.352 4.573 -0.637 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.850 4.981 -3.161 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.664 3.473 -2.288 1.00 0.00 H new ATOM 771 N CYS A 61 13.828 3.653 -2.743 1.00 0.00 N ATOM 772 CA CYS A 61 12.475 3.486 -3.277 1.00 0.00 C ATOM 773 C CYS A 61 11.887 4.810 -3.859 1.00 0.00 C ATOM 774 O CYS A 61 10.871 4.796 -4.554 1.00 0.00 O ATOM 775 CB CYS A 61 11.620 2.938 -2.103 1.00 0.00 C ATOM 776 SG CYS A 61 11.825 1.174 -1.683 1.00 0.00 S ATOM 0 H CYS A 61 13.873 3.413 -1.753 1.00 0.00 H new ATOM 0 HA CYS A 61 12.479 2.798 -4.122 1.00 0.00 H new ATOM 0 HB2 CYS A 61 11.848 3.527 -1.214 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.570 3.110 -2.339 1.00 0.00 H new ATOM 0 HG CYS A 61 10.750 0.521 -2.014 1.00 0.00 H new ATOM 781 N GLY A 62 12.494 5.955 -3.506 1.00 0.00 N ATOM 782 CA GLY A 62 12.058 7.304 -3.877 1.00 0.00 C ATOM 783 C GLY A 62 10.879 7.824 -3.055 1.00 0.00 C ATOM 784 O GLY A 62 10.228 8.773 -3.474 1.00 0.00 O ATOM 0 H GLY A 62 13.336 5.962 -2.931 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.897 7.990 -3.764 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.783 7.309 -4.932 1.00 0.00 H new ATOM 788 N LEU A 63 10.630 7.245 -1.873 1.00 0.00 N ATOM 789 CA LEU A 63 9.655 7.723 -0.881 1.00 0.00 C ATOM 790 C LEU A 63 10.089 9.011 -0.186 1.00 0.00 C ATOM 791 O LEU A 63 9.233 9.721 0.335 1.00 0.00 O ATOM 792 CB LEU A 63 9.439 6.639 0.177 1.00 0.00 C ATOM 793 CG LEU A 63 8.539 5.529 -0.374 1.00 0.00 C ATOM 794 CD1 LEU A 63 8.723 4.300 0.483 1.00 0.00 C ATOM 795 CD2 LEU A 63 7.051 5.919 -0.347 1.00 0.00 C ATOM 0 H LEU A 63 11.118 6.402 -1.570 1.00 0.00 H new ATOM 0 HA LEU A 63 8.733 7.940 -1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.399 6.221 0.480 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.986 7.075 1.067 1.00 0.00 H new ATOM 0 HG LEU A 63 8.822 5.349 -1.411 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.090 3.496 0.107 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.766 3.986 0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.446 4.529 1.512 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.453 5.100 -0.747 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.747 6.122 0.680 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.898 6.811 -0.954 1.00 0.00 H new ATOM 807 N VAL A 64 11.396 9.290 -0.142 1.00 0.00 N ATOM 808 CA VAL A 64 11.972 10.330 0.731 1.00 0.00 C ATOM 809 C VAL A 64 13.114 11.084 0.076 1.00 0.00 C ATOM 810 O VAL A 64 13.915 10.498 -0.649 1.00 0.00 O ATOM 811 CB VAL A 64 12.521 9.703 2.028 1.00 0.00 C ATOM 812 CG1 VAL A 64 12.921 10.648 3.159 1.00 0.00 C ATOM 813 CG2 VAL A 64 11.481 8.805 2.655 1.00 0.00 C ATOM 0 H VAL A 64 12.089 8.803 -0.710 1.00 0.00 H new ATOM 0 HA VAL A 64 11.159 11.026 0.937 1.00 0.00 H new ATOM 0 HB VAL A 64 13.422 9.207 1.666 1.00 0.00 H new ATOM 0 HG11 VAL A 64 13.288 10.068 4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 64 13.706 11.320 2.812 1.00 0.00 H new ATOM 0 HG13 VAL A 64 12.054 11.232 3.469 1.00 0.00 H new ATOM 0 HG21 VAL A 64 11.881 8.368 3.570 1.00 0.00 H new ATOM 0 HG22 VAL A 64 10.591 9.388 2.890 1.00 0.00 H new ATOM 0 HG23 VAL A 64 11.219 8.009 1.958 1.00 0.00 H new ATOM 823 N VAL A 65 13.195 12.375 0.393 1.00 0.00 N ATOM 824 CA VAL A 65 14.172 13.320 -0.152 1.00 0.00 C ATOM 825 C VAL A 65 14.779 14.142 0.989 1.00 0.00 C ATOM 826 O VAL A 65 14.095 14.505 1.943 1.00 0.00 O ATOM 827 CB VAL A 65 13.492 14.255 -1.183 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.530 15.041 -2.000 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.590 13.450 -2.136 1.00 0.00 C ATOM 0 H VAL A 65 12.559 12.809 1.061 1.00 0.00 H new ATOM 0 HA VAL A 65 14.965 12.767 -0.656 1.00 0.00 H new ATOM 0 HB VAL A 65 12.883 14.965 -0.623 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.018 15.687 -2.713 1.00 0.00 H new ATOM 0 HG12 VAL A 65 15.136 15.650 -1.329 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.173 14.344 -2.538 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.122 14.126 -2.852 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.191 12.714 -2.671 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.818 12.939 -1.561 1.00 0.00 H new ATOM 839 N ALA A 66 16.080 14.422 0.904 1.00 0.00 N ATOM 840 CA ALA A 66 16.808 15.266 1.854 1.00 0.00 C ATOM 841 C ALA A 66 16.944 16.717 1.368 1.00 0.00 C ATOM 842 O ALA A 66 17.085 16.980 0.173 1.00 0.00 O ATOM 843 CB ALA A 66 18.183 14.630 2.087 1.00 0.00 C ATOM 0 H ALA A 66 16.671 14.060 0.156 1.00 0.00 H new ATOM 0 HA ALA A 66 16.247 15.320 2.787 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.750 15.238 2.792 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.056 13.627 2.493 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.722 14.573 1.142 1.00 0.00 H new ATOM 849 N THR A 67 16.970 17.657 2.321 1.00 0.00 N ATOM 850 CA THR A 67 17.262 19.076 2.059 1.00 0.00 C ATOM 851 C THR A 67 18.255 19.588 3.078 1.00 0.00 C ATOM 852 O THR A 67 18.142 19.265 4.257 1.00 0.00 O ATOM 853 CB THR A 67 16.015 19.977 2.067 1.00 0.00 C ATOM 854 OG1 THR A 67 15.642 20.263 3.391 1.00 0.00 O ATOM 855 CG2 THR A 67 14.800 19.370 1.372 1.00 0.00 C ATOM 0 H THR A 67 16.788 17.455 3.304 1.00 0.00 H new ATOM 0 HA THR A 67 17.676 19.123 1.052 1.00 0.00 H new ATOM 0 HB THR A 67 16.303 20.871 1.515 1.00 0.00 H new ATOM 0 HG1 THR A 67 15.516 21.229 3.494 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.965 20.069 1.423 1.00 0.00 H new ATOM 0 HG22 THR A 67 15.041 19.168 0.328 1.00 0.00 H new ATOM 0 HG23 THR A 67 14.525 18.439 1.868 1.00 0.00 H new ATOM 863 N TYR A 68 19.128 20.479 2.641 1.00 0.00 N ATOM 864 CA TYR A 68 20.030 21.257 3.479 1.00 0.00 C ATOM 865 C TYR A 68 19.384 22.618 3.779 1.00 0.00 C ATOM 866 O TYR A 68 19.314 23.454 2.879 1.00 0.00 O ATOM 867 CB TYR A 68 21.340 21.388 2.694 1.00 0.00 C ATOM 868 CG TYR A 68 22.422 22.244 3.308 1.00 0.00 C ATOM 869 CD1 TYR A 68 23.315 21.678 4.235 1.00 0.00 C ATOM 870 CD2 TYR A 68 22.611 23.569 2.867 1.00 0.00 C ATOM 871 CE1 TYR A 68 24.390 22.431 4.735 1.00 0.00 C ATOM 872 CE2 TYR A 68 23.689 24.326 3.360 1.00 0.00 C ATOM 873 CZ TYR A 68 24.574 23.762 4.306 1.00 0.00 C ATOM 874 OH TYR A 68 25.595 24.493 4.821 1.00 0.00 O ATOM 0 H TYR A 68 19.234 20.691 1.649 1.00 0.00 H new ATOM 0 HA TYR A 68 20.230 20.785 4.441 1.00 0.00 H new ATOM 0 HB2 TYR A 68 21.745 20.388 2.541 1.00 0.00 H new ATOM 0 HB3 TYR A 68 21.106 21.792 1.709 1.00 0.00 H new ATOM 0 HD1 TYR A 68 23.174 20.659 4.564 1.00 0.00 H new ATOM 0 HD2 TYR A 68 21.929 24.003 2.151 1.00 0.00 H new ATOM 0 HE1 TYR A 68 25.074 21.992 5.446 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.840 25.338 3.015 1.00 0.00 H new ATOM 0 HH TYR A 68 25.241 25.319 5.211 1.00 0.00 H new ATOM 884 N GLU A 69 18.923 22.859 5.011 1.00 0.00 N ATOM 885 CA GLU A 69 18.224 24.104 5.400 1.00 0.00 C ATOM 886 C GLU A 69 19.129 25.355 5.490 1.00 0.00 C ATOM 887 O GLU A 69 18.726 26.388 6.016 1.00 0.00 O ATOM 888 CB GLU A 69 17.334 23.871 6.644 1.00 0.00 C ATOM 889 CG GLU A 69 18.004 23.375 7.930 1.00 0.00 C ATOM 890 CD GLU A 69 18.883 24.412 8.620 1.00 0.00 C ATOM 891 OE1 GLU A 69 20.057 24.526 8.208 1.00 0.00 O ATOM 892 OE2 GLU A 69 18.464 24.996 9.646 1.00 0.00 O ATOM 0 H GLU A 69 19.022 22.194 5.778 1.00 0.00 H new ATOM 0 HA GLU A 69 17.559 24.356 4.574 1.00 0.00 H new ATOM 0 HB2 GLU A 69 16.828 24.809 6.872 1.00 0.00 H new ATOM 0 HB3 GLU A 69 16.562 23.151 6.371 1.00 0.00 H new ATOM 0 HG2 GLU A 69 17.231 23.050 8.626 1.00 0.00 H new ATOM 0 HG3 GLU A 69 18.610 22.500 7.696 1.00 0.00 H new ATOM 899 N GLY A 70 20.348 25.276 4.942 1.00 0.00 N ATOM 900 CA GLY A 70 21.375 26.321 4.971 1.00 0.00 C ATOM 901 C GLY A 70 22.581 25.956 5.837 1.00 0.00 C ATOM 902 O GLY A 70 23.643 26.549 5.658 1.00 0.00 O ATOM 0 H GLY A 70 20.658 24.442 4.443 1.00 0.00 H new ATOM 0 HA2 GLY A 70 21.713 26.518 3.954 1.00 0.00 H new ATOM 0 HA3 GLY A 70 20.934 27.245 5.345 1.00 0.00 H new ATOM 906 N ARG A 71 22.446 24.964 6.726 1.00 0.00 N ATOM 907 CA ARG A 71 23.423 24.645 7.778 1.00 0.00 C ATOM 908 C ARG A 71 23.286 23.191 8.276 1.00 0.00 C ATOM 909 O ARG A 71 24.276 22.468 8.359 1.00 0.00 O ATOM 910 CB ARG A 71 23.117 25.654 8.892 1.00 0.00 C ATOM 911 CG ARG A 71 23.961 25.665 10.167 1.00 0.00 C ATOM 912 CD ARG A 71 23.328 26.647 11.179 1.00 0.00 C ATOM 913 NE ARG A 71 22.098 26.104 11.793 1.00 0.00 N ATOM 914 CZ ARG A 71 20.841 26.184 11.356 1.00 0.00 C ATOM 915 NH1 ARG A 71 20.450 26.902 10.326 1.00 0.00 N ATOM 916 NH2 ARG A 71 19.915 25.452 11.921 1.00 0.00 N ATOM 0 H ARG A 71 21.635 24.345 6.735 1.00 0.00 H new ATOM 0 HA ARG A 71 24.449 24.718 7.418 1.00 0.00 H new ATOM 0 HB2 ARG A 71 23.179 26.650 8.453 1.00 0.00 H new ATOM 0 HB3 ARG A 71 22.080 25.502 9.191 1.00 0.00 H new ATOM 0 HG2 ARG A 71 24.011 24.664 10.594 1.00 0.00 H new ATOM 0 HG3 ARG A 71 24.984 25.966 9.939 1.00 0.00 H new ATOM 0 HD2 ARG A 71 24.052 26.876 11.961 1.00 0.00 H new ATOM 0 HD3 ARG A 71 23.096 27.585 10.675 1.00 0.00 H new ATOM 0 HE ARG A 71 22.229 25.600 12.670 1.00 0.00 H new ATOM 0 HH11 ARG A 71 21.130 27.450 9.799 1.00 0.00 H new ATOM 0 HH12 ARG A 71 19.467 26.910 10.054 1.00 0.00 H new ATOM 0 HH21 ARG A 71 20.158 24.827 12.689 1.00 0.00 H new ATOM 0 HH22 ARG A 71 18.951 25.507 11.593 1.00 0.00 H new ATOM 930 N GLN A 72 22.070 22.744 8.586 1.00 0.00 N ATOM 931 CA GLN A 72 21.715 21.360 8.903 1.00 0.00 C ATOM 932 C GLN A 72 21.233 20.629 7.638 1.00 0.00 C ATOM 933 O GLN A 72 21.011 21.241 6.596 1.00 0.00 O ATOM 934 CB GLN A 72 20.575 21.305 9.947 1.00 0.00 C ATOM 935 CG GLN A 72 20.621 22.314 11.103 1.00 0.00 C ATOM 936 CD GLN A 72 21.884 22.330 11.962 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.336 23.378 12.395 1.00 0.00 O ATOM 938 NE2 GLN A 72 22.484 21.209 12.300 1.00 0.00 N ATOM 0 H GLN A 72 21.264 23.368 8.625 1.00 0.00 H new ATOM 0 HA GLN A 72 22.607 20.880 9.305 1.00 0.00 H new ATOM 0 HB2 GLN A 72 19.630 21.440 9.420 1.00 0.00 H new ATOM 0 HB3 GLN A 72 20.560 20.303 10.376 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.482 23.312 10.687 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.770 22.120 11.756 1.00 0.00 H new ATOM 0 HE21 GLN A 72 22.130 20.317 11.954 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.303 21.232 12.908 1.00 0.00 H new ATOM 947 N VAL A 73 21.000 19.322 7.762 1.00 0.00 N ATOM 948 CA VAL A 73 20.299 18.493 6.772 1.00 0.00 C ATOM 949 C VAL A 73 19.097 17.828 7.452 1.00 0.00 C ATOM 950 O VAL A 73 19.148 17.542 8.651 1.00 0.00 O ATOM 951 CB VAL A 73 21.215 17.437 6.109 1.00 0.00 C ATOM 952 CG1 VAL A 73 22.277 18.110 5.231 1.00 0.00 C ATOM 953 CG2 VAL A 73 21.905 16.507 7.120 1.00 0.00 C ATOM 0 H VAL A 73 21.302 18.791 8.579 1.00 0.00 H new ATOM 0 HA VAL A 73 19.964 19.142 5.963 1.00 0.00 H new ATOM 0 HB VAL A 73 20.559 16.820 5.495 1.00 0.00 H new ATOM 0 HG11 VAL A 73 22.909 17.348 4.776 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.788 18.691 4.449 1.00 0.00 H new ATOM 0 HG13 VAL A 73 22.890 18.771 5.844 1.00 0.00 H new ATOM 0 HG21 VAL A 73 22.532 15.792 6.587 1.00 0.00 H new ATOM 0 HG22 VAL A 73 22.523 17.098 7.795 1.00 0.00 H new ATOM 0 HG23 VAL A 73 21.150 15.971 7.695 1.00 0.00 H new ATOM 963 N ARG A 74 18.028 17.580 6.689 1.00 0.00 N ATOM 964 CA ARG A 74 16.777 16.952 7.137 1.00 0.00 C ATOM 965 C ARG A 74 16.303 15.954 6.079 1.00 0.00 C ATOM 966 O ARG A 74 16.881 15.892 4.997 1.00 0.00 O ATOM 967 CB ARG A 74 15.718 18.041 7.390 1.00 0.00 C ATOM 968 CG ARG A 74 14.995 18.513 6.119 1.00 0.00 C ATOM 969 CD ARG A 74 14.335 19.874 6.332 1.00 0.00 C ATOM 970 NE ARG A 74 13.461 20.223 5.198 1.00 0.00 N ATOM 971 CZ ARG A 74 12.134 20.313 5.185 1.00 0.00 C ATOM 972 NH1 ARG A 74 11.411 20.188 6.280 1.00 0.00 N ATOM 973 NH2 ARG A 74 11.513 20.511 4.038 1.00 0.00 N ATOM 0 H ARG A 74 18.008 17.821 5.698 1.00 0.00 H new ATOM 0 HA ARG A 74 16.941 16.412 8.069 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.980 17.659 8.096 1.00 0.00 H new ATOM 0 HB3 ARG A 74 16.198 18.898 7.863 1.00 0.00 H new ATOM 0 HG2 ARG A 74 15.706 18.576 5.295 1.00 0.00 H new ATOM 0 HG3 ARG A 74 14.240 17.780 5.834 1.00 0.00 H new ATOM 0 HD2 ARG A 74 13.752 19.859 7.253 1.00 0.00 H new ATOM 0 HD3 ARG A 74 15.102 20.639 6.453 1.00 0.00 H new ATOM 0 HE ARG A 74 13.931 20.420 4.315 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.868 20.016 7.176 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.395 20.263 6.232 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.050 20.593 3.175 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.496 20.582 4.014 1.00 0.00 H new ATOM 987 N TYR A 75 15.211 15.245 6.342 1.00 0.00 N ATOM 988 CA TYR A 75 14.496 14.427 5.342 1.00 0.00 C ATOM 989 C TYR A 75 13.068 14.955 5.121 1.00 0.00 C ATOM 990 O TYR A 75 12.656 15.876 5.812 1.00 0.00 O ATOM 991 CB TYR A 75 14.510 12.948 5.763 1.00 0.00 C ATOM 992 CG TYR A 75 15.899 12.342 5.838 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.734 12.363 4.704 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.365 11.766 7.035 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.042 11.849 4.772 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.663 11.223 7.101 1.00 0.00 C ATOM 997 CZ TYR A 75 18.509 11.271 5.970 1.00 0.00 C ATOM 998 OH TYR A 75 19.774 10.770 6.026 1.00 0.00 O ATOM 0 H TYR A 75 14.783 15.215 7.267 1.00 0.00 H new ATOM 0 HA TYR A 75 15.012 14.504 4.385 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.030 12.853 6.737 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.912 12.374 5.056 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.368 12.776 3.776 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.726 11.740 7.905 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.687 11.897 3.907 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.012 10.769 8.017 1.00 0.00 H new ATOM 0 HH TYR A 75 19.943 10.408 6.921 1.00 0.00 H new ATOM 1008 N ALA A 76 12.320 14.396 4.170 1.00 0.00 N ATOM 1009 CA ALA A 76 10.934 14.733 3.846 1.00 0.00 C ATOM 1010 C ALA A 76 10.357 13.692 2.896 1.00 0.00 C ATOM 1011 O ALA A 76 11.096 13.175 2.058 1.00 0.00 O ATOM 1012 CB ALA A 76 10.858 16.139 3.229 1.00 0.00 C ATOM 0 H ALA A 76 12.685 13.655 3.572 1.00 0.00 H new ATOM 0 HA ALA A 76 10.342 14.732 4.762 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.821 16.377 2.993 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.245 16.869 3.939 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.454 16.169 2.317 1.00 0.00 H new ATOM 1018 N LEU A 77 9.059 13.395 3.019 1.00 0.00 N ATOM 1019 CA LEU A 77 8.338 12.584 2.042 1.00 0.00 C ATOM 1020 C LEU A 77 8.456 13.197 0.639 1.00 0.00 C ATOM 1021 O LEU A 77 8.577 14.411 0.490 1.00 0.00 O ATOM 1022 CB LEU A 77 6.879 12.474 2.491 1.00 0.00 C ATOM 1023 CG LEU A 77 6.681 11.826 3.865 1.00 0.00 C ATOM 1024 CD1 LEU A 77 5.189 11.885 4.158 1.00 0.00 C ATOM 1025 CD2 LEU A 77 7.173 10.382 3.900 1.00 0.00 C ATOM 0 H LEU A 77 8.483 13.711 3.799 1.00 0.00 H new ATOM 0 HA LEU A 77 8.771 11.585 1.987 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.442 13.472 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.327 11.897 1.749 1.00 0.00 H new ATOM 0 HG LEU A 77 7.264 12.360 4.616 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.991 11.434 5.130 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.861 12.924 4.166 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.645 11.339 3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.011 9.966 4.895 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.623 9.792 3.166 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.237 10.354 3.664 1.00 0.00 H new ATOM 1037 N ALA A 78 8.447 12.353 -0.389 1.00 0.00 N ATOM 1038 CA ALA A 78 8.800 12.775 -1.755 1.00 0.00 C ATOM 1039 C ALA A 78 7.737 13.600 -2.498 1.00 0.00 C ATOM 1040 O ALA A 78 8.104 14.444 -3.310 1.00 0.00 O ATOM 1041 CB ALA A 78 9.238 11.551 -2.563 1.00 0.00 C ATOM 0 H ALA A 78 8.199 11.367 -0.308 1.00 0.00 H new ATOM 0 HA ALA A 78 9.626 13.478 -1.648 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.500 11.858 -3.575 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.104 11.092 -2.087 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.421 10.830 -2.603 1.00 0.00 H new ATOM 1047 N ASP A 79 6.449 13.415 -2.192 1.00 0.00 N ATOM 1048 CA ASP A 79 5.373 14.279 -2.690 1.00 0.00 C ATOM 1049 C ASP A 79 4.122 14.258 -1.794 1.00 0.00 C ATOM 1050 O ASP A 79 3.837 13.338 -1.022 1.00 0.00 O ATOM 1051 CB ASP A 79 5.021 13.948 -4.169 1.00 0.00 C ATOM 1052 CG ASP A 79 3.802 14.722 -4.721 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.746 15.973 -4.598 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.807 14.047 -5.063 1.00 0.00 O ATOM 0 H ASP A 79 6.122 12.659 -1.590 1.00 0.00 H new ATOM 0 HA ASP A 79 5.755 15.299 -2.654 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.888 14.165 -4.794 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.826 12.879 -4.253 1.00 0.00 H new ATOM 1059 N SER A 80 3.346 15.315 -1.991 1.00 0.00 N ATOM 1060 CA SER A 80 1.971 15.565 -1.589 1.00 0.00 C ATOM 1061 C SER A 80 1.050 14.345 -1.736 1.00 0.00 C ATOM 1062 O SER A 80 0.068 14.259 -0.994 1.00 0.00 O ATOM 1063 CB SER A 80 1.393 16.651 -2.520 1.00 0.00 C ATOM 1064 OG SER A 80 2.337 17.610 -2.954 1.00 0.00 O ATOM 0 H SER A 80 3.715 16.118 -2.501 1.00 0.00 H new ATOM 0 HA SER A 80 2.002 15.848 -0.537 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.955 16.168 -3.394 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.584 17.164 -2.001 1.00 0.00 H new ATOM 0 HG SER A 80 2.861 17.241 -3.696 1.00 0.00 H new ATOM 1070 N HIS A 81 1.337 13.437 -2.689 1.00 0.00 N ATOM 1071 CA HIS A 81 0.695 12.132 -2.871 1.00 0.00 C ATOM 1072 C HIS A 81 0.882 11.262 -1.630 1.00 0.00 C ATOM 1073 O HIS A 81 -0.116 10.891 -1.008 1.00 0.00 O ATOM 1074 CB HIS A 81 1.287 11.406 -4.106 1.00 0.00 C ATOM 1075 CG HIS A 81 0.561 11.563 -5.421 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.766 11.896 -5.613 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.022 11.057 -6.604 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -1.115 11.552 -6.866 1.00 0.00 C ATOM 1079 NE2 HIS A 81 -0.025 11.086 -7.509 1.00 0.00 N ATOM 0 H HIS A 81 2.062 13.609 -3.386 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.370 12.299 -3.029 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.310 11.755 -4.243 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.341 10.342 -3.877 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -1.378 12.329 -4.922 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.022 10.699 -6.798 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -2.106 11.635 -7.288 1.00 0.00 H new ATOM 1088 N LEU A 82 2.127 10.925 -1.270 1.00 0.00 N ATOM 1089 CA LEU A 82 2.400 10.033 -0.136 1.00 0.00 C ATOM 1090 C LEU A 82 1.880 10.686 1.140 1.00 0.00 C ATOM 1091 O LEU A 82 1.105 10.061 1.852 1.00 0.00 O ATOM 1092 CB LEU A 82 3.894 9.656 0.005 1.00 0.00 C ATOM 1093 CG LEU A 82 4.720 9.534 -1.290 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.201 9.452 -0.914 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.281 8.316 -2.114 1.00 0.00 C ATOM 0 H LEU A 82 2.964 11.258 -1.749 1.00 0.00 H new ATOM 0 HA LEU A 82 1.880 9.093 -0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.371 10.403 0.640 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.953 8.704 0.533 1.00 0.00 H new ATOM 0 HG LEU A 82 4.554 10.410 -1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.802 9.365 -1.819 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.489 10.353 -0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.368 8.580 -0.282 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.881 8.255 -3.022 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.421 7.409 -1.526 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.229 8.417 -2.381 1.00 0.00 H new ATOM 1107 N ALA A 83 2.194 11.969 1.356 1.00 0.00 N ATOM 1108 CA ALA A 83 1.767 12.723 2.534 1.00 0.00 C ATOM 1109 C ALA A 83 0.247 12.666 2.781 1.00 0.00 C ATOM 1110 O ALA A 83 -0.160 12.369 3.899 1.00 0.00 O ATOM 1111 CB ALA A 83 2.269 14.163 2.376 1.00 0.00 C ATOM 0 H ALA A 83 2.759 12.517 0.707 1.00 0.00 H new ATOM 0 HA ALA A 83 2.202 12.264 3.422 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.965 14.751 3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.356 14.163 2.301 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.843 14.600 1.473 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.605 12.898 1.766 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.067 12.962 1.974 1.00 0.00 C ATOM 1119 C ARG A 84 -2.763 11.609 2.178 1.00 0.00 C ATOM 1120 O ARG A 84 -3.680 11.543 2.985 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.756 13.780 0.875 1.00 0.00 C ATOM 1122 CG ARG A 84 -2.872 13.078 -0.493 1.00 0.00 C ATOM 1123 CD ARG A 84 -3.433 14.014 -1.567 1.00 0.00 C ATOM 1124 NE ARG A 84 -2.599 15.225 -1.708 1.00 0.00 N ATOM 1125 CZ ARG A 84 -3.037 16.473 -1.833 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -4.321 16.738 -1.943 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -2.189 17.478 -1.839 1.00 0.00 N ATOM 0 H ARG A 84 -0.312 13.044 0.800 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.181 13.477 2.928 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -3.757 14.045 1.215 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.208 14.713 0.741 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.890 12.718 -0.801 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.517 12.204 -0.400 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -3.481 13.489 -2.521 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.453 14.299 -1.308 1.00 0.00 H new ATOM 0 HE ARG A 84 -1.588 15.090 -1.710 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.001 15.978 -1.933 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -4.636 17.703 -2.038 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -1.189 17.302 -1.747 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -2.532 18.434 -1.935 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.346 10.543 1.484 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.941 9.213 1.702 1.00 0.00 C ATOM 1143 C ALA A 85 -2.406 8.586 2.992 1.00 0.00 C ATOM 1144 O ALA A 85 -3.167 8.054 3.795 1.00 0.00 O ATOM 1145 CB ALA A 85 -2.698 8.323 0.481 1.00 0.00 C ATOM 0 H ALA A 85 -1.611 10.570 0.777 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.019 9.317 1.824 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.141 7.342 0.652 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.153 8.779 -0.398 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.626 8.213 0.318 1.00 0.00 H new ATOM 1151 N LEU A 86 -1.113 8.758 3.274 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.557 8.406 4.579 1.00 0.00 C ATOM 1153 C LEU A 86 -1.254 9.217 5.690 1.00 0.00 C ATOM 1154 O LEU A 86 -1.515 8.672 6.759 1.00 0.00 O ATOM 1155 CB LEU A 86 0.979 8.555 4.504 1.00 0.00 C ATOM 1156 CG LEU A 86 1.831 7.695 5.454 1.00 0.00 C ATOM 1157 CD1 LEU A 86 1.951 8.313 6.837 1.00 0.00 C ATOM 1158 CD2 LEU A 86 1.358 6.242 5.581 1.00 0.00 C ATOM 0 H LEU A 86 -0.433 9.139 2.616 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.752 7.367 4.845 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.288 8.332 3.483 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.223 9.601 4.689 1.00 0.00 H new ATOM 0 HG LEU A 86 2.814 7.672 4.983 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.561 7.670 7.471 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.419 9.294 6.758 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.959 8.419 7.276 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.012 5.705 6.268 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.337 6.224 5.963 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.388 5.763 4.603 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.676 10.455 5.394 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.507 11.307 6.256 1.00 0.00 C ATOM 1172 C GLY A 87 -3.972 10.861 6.410 1.00 0.00 C ATOM 1173 O GLY A 87 -4.606 11.270 7.379 1.00 0.00 O ATOM 0 H GLY A 87 -1.438 10.908 4.512 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -2.051 11.348 7.245 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.494 12.321 5.857 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.514 10.012 5.520 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.804 9.315 5.738 1.00 0.00 C ATOM 1179 C GLU A 88 -5.659 8.258 6.857 1.00 0.00 C ATOM 1180 O GLU A 88 -6.653 7.793 7.418 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.344 8.678 4.419 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.238 7.136 4.329 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.632 6.522 2.983 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -6.031 6.923 1.962 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -7.440 5.561 3.007 1.00 0.00 O ATOM 0 H GLU A 88 -4.074 9.786 4.628 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.539 10.054 6.057 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.390 8.960 4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.802 9.111 3.579 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.211 6.847 4.553 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.868 6.701 5.105 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.408 7.848 7.123 1.00 0.00 N ATOM 1193 CA LEU A 89 -3.985 6.729 7.963 1.00 0.00 C ATOM 1194 C LEU A 89 -4.416 5.402 7.321 1.00 0.00 C ATOM 1195 O LEU A 89 -5.230 4.658 7.866 1.00 0.00 O ATOM 1196 CB LEU A 89 -4.442 6.922 9.422 1.00 0.00 C ATOM 1197 CG LEU A 89 -3.686 5.997 10.397 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -2.246 6.480 10.641 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -4.437 5.927 11.734 1.00 0.00 C ATOM 0 H LEU A 89 -3.606 8.334 6.721 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.897 6.695 8.021 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.287 7.960 9.715 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -5.512 6.727 9.495 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.636 5.007 9.944 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.747 5.802 11.333 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.703 6.498 9.696 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.266 7.483 11.067 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.899 5.272 12.420 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.506 6.926 12.165 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -5.440 5.533 11.568 1.00 0.00 H new ATOM 1211 N VAL A 90 -3.878 5.157 6.119 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.205 4.063 5.181 1.00 0.00 C ATOM 1213 C VAL A 90 -4.775 2.815 5.839 1.00 0.00 C ATOM 1214 O VAL A 90 -4.256 2.239 6.795 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.036 3.687 4.251 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -3.391 2.569 3.249 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -2.621 4.927 3.463 1.00 0.00 C ATOM 0 H VAL A 90 -3.147 5.761 5.744 1.00 0.00 H new ATOM 0 HA VAL A 90 -5.002 4.489 4.571 1.00 0.00 H new ATOM 0 HB VAL A 90 -2.230 3.314 4.883 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -2.525 2.352 2.624 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -3.680 1.670 3.794 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -4.220 2.894 2.620 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.793 4.676 2.799 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -3.465 5.282 2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -2.308 5.709 4.154 1.00 0.00 H new ATOM 1227 N GLN A 91 -5.910 2.415 5.283 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.166 2.546 6.001 1.00 0.00 C ATOM 1229 C GLN A 91 -7.514 1.259 6.749 1.00 0.00 C ATOM 1230 O GLN A 91 -8.536 1.197 7.418 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.141 3.054 4.923 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.663 2.984 5.054 1.00 0.00 C ATOM 1233 CD GLN A 91 -10.369 3.956 6.011 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.591 3.973 6.089 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.692 4.777 6.785 1.00 0.00 N ATOM 0 H GLN A 91 -5.986 2.004 4.353 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.170 3.254 6.830 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -7.896 4.103 4.759 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.888 2.521 4.006 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -10.087 3.133 4.061 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.921 1.971 5.363 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.673 4.790 6.747 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.186 5.400 7.423 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.585 0.296 6.755 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.512 -0.953 7.537 1.00 0.00 C ATOM 1246 C VAL A 92 -6.398 -0.718 9.055 1.00 0.00 C ATOM 1247 O VAL A 92 -5.741 -1.438 9.795 1.00 0.00 O ATOM 1248 CB VAL A 92 -5.396 -1.861 6.961 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -3.998 -1.244 7.157 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -5.493 -3.316 7.448 1.00 0.00 C ATOM 0 H VAL A 92 -5.772 0.379 6.144 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.461 -1.479 7.430 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.560 -1.914 5.885 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.244 -1.911 6.740 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.951 -0.281 6.649 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.809 -1.103 8.221 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -4.684 -3.901 7.010 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.412 -3.342 8.535 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.451 -3.738 7.145 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.048 0.337 9.533 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.273 0.628 10.952 1.00 0.00 C ATOM 1262 C VAL A 93 -5.961 1.019 11.680 1.00 0.00 C ATOM 1263 O VAL A 93 -5.904 0.962 12.903 1.00 0.00 O ATOM 1264 CB VAL A 93 -8.067 -0.525 11.653 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -8.874 0.012 12.851 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -9.109 -1.207 10.716 1.00 0.00 C ATOM 0 H VAL A 93 -7.451 1.045 8.920 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.910 1.510 11.018 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.306 -1.244 11.955 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -9.417 -0.808 13.321 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -8.194 0.460 13.576 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -9.582 0.764 12.505 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.626 -1.997 11.261 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.833 -0.466 10.377 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -8.598 -1.635 9.854 1.00 0.00 H new ATOM 1276 N LEU A 94 -4.927 1.405 10.904 1.00 0.00 N ATOM 1277 CA LEU A 94 -3.521 1.715 11.235 1.00 0.00 C ATOM 1278 C LEU A 94 -2.642 0.525 10.820 1.00 0.00 C ATOM 1279 O LEU A 94 -2.588 -0.496 11.498 1.00 0.00 O ATOM 1280 CB LEU A 94 -3.301 2.137 12.708 1.00 0.00 C ATOM 1281 CG LEU A 94 -1.964 2.848 13.015 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -2.018 3.419 14.440 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -0.719 1.955 12.891 1.00 0.00 C ATOM 0 H LEU A 94 -5.079 1.521 9.902 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.226 2.598 10.668 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -4.117 2.797 13.002 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.369 1.248 13.334 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.859 3.627 12.260 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.078 3.923 14.666 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.839 4.132 14.516 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.175 2.608 15.151 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.172 2.538 13.124 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.799 1.120 13.587 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.646 1.572 11.873 1.00 0.00 H new ATOM 1295 N ALA A 95 -1.936 0.656 9.694 1.00 0.00 N ATOM 1296 CA ALA A 95 -0.986 -0.335 9.176 1.00 0.00 C ATOM 1297 C ALA A 95 0.214 -0.659 10.111 1.00 0.00 C ATOM 1298 O ALA A 95 1.334 -0.214 9.870 1.00 0.00 O ATOM 1299 CB ALA A 95 -0.546 0.121 7.776 1.00 0.00 C ATOM 0 H ALA A 95 -2.011 1.480 9.098 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.501 -1.294 9.122 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.162 -0.598 7.365 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -1.417 0.186 7.124 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.071 1.100 7.845 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.034 -1.447 11.159 1.00 0.00 N ATOM 1306 CA VAL A 96 0.952 -2.080 12.060 1.00 0.00 C ATOM 1307 C VAL A 96 1.917 -2.995 11.278 1.00 0.00 C ATOM 1308 O VAL A 96 1.571 -3.571 10.243 1.00 0.00 O ATOM 1309 CB VAL A 96 0.239 -2.886 13.185 1.00 0.00 C ATOM 1310 CG1 VAL A 96 1.187 -3.614 14.154 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -0.659 -1.983 14.046 1.00 0.00 C ATOM 0 H VAL A 96 -0.991 -1.680 11.425 1.00 0.00 H new ATOM 0 HA VAL A 96 1.536 -1.283 12.520 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.338 -3.630 12.635 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.602 -4.148 14.903 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.800 -4.324 13.599 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.831 -2.887 14.648 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.140 -2.580 14.820 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -0.054 -1.205 14.511 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.421 -1.522 13.418 1.00 0.00 H new ATOM 1321 N ASP A 97 3.128 -3.182 11.814 1.00 0.00 N ATOM 1322 CA ASP A 97 4.227 -4.007 11.290 1.00 0.00 C ATOM 1323 C ASP A 97 3.939 -5.510 11.100 1.00 0.00 C ATOM 1324 O ASP A 97 4.817 -6.229 10.623 1.00 0.00 O ATOM 1325 CB ASP A 97 5.452 -3.805 12.203 1.00 0.00 C ATOM 1326 CG ASP A 97 5.168 -4.099 13.674 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.578 -3.194 14.307 1.00 0.00 O ATOM 1328 OD2 ASP A 97 5.565 -5.182 14.159 1.00 0.00 O ATOM 0 H ASP A 97 3.387 -2.728 12.690 1.00 0.00 H new ATOM 0 HA ASP A 97 4.399 -3.658 10.272 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.261 -4.450 11.861 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.802 -2.777 12.107 1.00 0.00 H new ATOM 1333 N THR A 98 2.722 -5.976 11.423 1.00 0.00 N ATOM 1334 CA THR A 98 2.277 -7.371 11.264 1.00 0.00 C ATOM 1335 C THR A 98 2.574 -7.948 9.883 1.00 0.00 C ATOM 1336 O THR A 98 1.832 -7.715 8.925 1.00 0.00 O ATOM 1337 CB THR A 98 0.774 -7.569 11.531 1.00 0.00 C ATOM 1338 OG1 THR A 98 0.048 -6.645 10.771 1.00 0.00 O ATOM 1339 CG2 THR A 98 0.360 -7.380 12.984 1.00 0.00 C ATOM 0 H THR A 98 1.998 -5.374 11.814 1.00 0.00 H new ATOM 0 HA THR A 98 2.857 -7.903 12.018 1.00 0.00 H new ATOM 0 HB THR A 98 0.563 -8.604 11.261 1.00 0.00 H new ATOM 0 HG1 THR A 98 -0.256 -7.070 9.942 1.00 0.00 H new ATOM 0 HG21 THR A 98 -0.714 -7.538 13.080 1.00 0.00 H new ATOM 0 HG22 THR A 98 0.890 -8.098 13.610 1.00 0.00 H new ATOM 0 HG23 THR A 98 0.608 -6.368 13.304 1.00 0.00 H new ATOM 1347 N ASP A 99 3.627 -8.752 9.791 1.00 0.00 N ATOM 1348 CA ASP A 99 3.862 -9.639 8.653 1.00 0.00 C ATOM 1349 C ASP A 99 3.381 -11.035 9.090 1.00 0.00 C ATOM 1350 O ASP A 99 3.479 -11.436 10.254 1.00 0.00 O ATOM 1351 CB ASP A 99 5.323 -9.589 8.158 1.00 0.00 C ATOM 1352 CG ASP A 99 5.481 -10.059 6.697 1.00 0.00 C ATOM 1353 OD1 ASP A 99 4.884 -9.433 5.786 1.00 0.00 O ATOM 1354 OD2 ASP A 99 6.200 -11.051 6.441 1.00 0.00 O ATOM 0 H ASP A 99 4.349 -8.809 10.509 1.00 0.00 H new ATOM 0 HA ASP A 99 3.301 -9.322 7.774 1.00 0.00 H new ATOM 0 HB2 ASP A 99 5.697 -8.569 8.248 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.941 -10.213 8.803 1.00 0.00 H new ATOM 1359 N GLN A 100 2.757 -11.743 8.165 1.00 0.00 N ATOM 1360 CA GLN A 100 2.039 -12.984 8.389 1.00 0.00 C ATOM 1361 C GLN A 100 2.404 -13.901 7.214 1.00 0.00 C ATOM 1362 O GLN A 100 2.528 -13.368 6.111 1.00 0.00 O ATOM 1363 CB GLN A 100 0.549 -12.607 8.383 1.00 0.00 C ATOM 1364 CG GLN A 100 -0.384 -13.632 9.029 1.00 0.00 C ATOM 1365 CD GLN A 100 -0.253 -13.588 10.549 1.00 0.00 C ATOM 1366 OE1 GLN A 100 0.270 -14.486 11.192 1.00 0.00 O ATOM 1367 NE2 GLN A 100 -0.672 -12.499 11.162 1.00 0.00 N ATOM 0 H GLN A 100 2.737 -11.452 7.188 1.00 0.00 H new ATOM 0 HA GLN A 100 2.278 -13.492 9.323 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.429 -11.654 8.899 1.00 0.00 H new ATOM 0 HB3 GLN A 100 0.234 -12.452 7.351 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -1.415 -13.427 8.741 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -0.144 -14.631 8.666 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -1.109 -11.749 10.627 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -0.559 -12.407 12.172 1.00 0.00 H new ATOM 1376 N PRO A 101 2.595 -15.222 7.399 1.00 0.00 N ATOM 1377 CA PRO A 101 3.112 -16.115 6.357 1.00 0.00 C ATOM 1378 C PRO A 101 2.325 -16.090 5.040 1.00 0.00 C ATOM 1379 O PRO A 101 2.944 -16.266 3.988 1.00 0.00 O ATOM 1380 CB PRO A 101 3.162 -17.516 6.980 1.00 0.00 C ATOM 1381 CG PRO A 101 2.320 -17.395 8.248 1.00 0.00 C ATOM 1382 CD PRO A 101 2.495 -15.942 8.657 1.00 0.00 C ATOM 0 HA PRO A 101 4.101 -15.773 6.050 1.00 0.00 H new ATOM 0 HB2 PRO A 101 2.756 -18.267 6.303 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.185 -17.813 7.209 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.274 -17.635 8.059 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.667 -18.075 9.026 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.650 -15.591 9.249 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.389 -15.805 9.265 1.00 0.00 H new ATOM 1390 N CYS A 102 1.012 -15.807 5.097 1.00 0.00 N ATOM 1391 CA CYS A 102 0.130 -15.516 3.971 1.00 0.00 C ATOM 1392 C CYS A 102 -0.226 -16.778 3.172 1.00 0.00 C ATOM 1393 O CYS A 102 -0.175 -17.908 3.648 1.00 0.00 O ATOM 1394 CB CYS A 102 0.768 -14.379 3.144 1.00 0.00 C ATOM 1395 SG CYS A 102 -0.173 -13.417 1.906 1.00 0.00 S ATOM 0 H CYS A 102 0.516 -15.775 5.988 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.840 -15.164 4.322 1.00 0.00 H new ATOM 0 HB2 CYS A 102 1.168 -13.660 3.859 1.00 0.00 H new ATOM 0 HB3 CYS A 102 1.619 -14.814 2.620 1.00 0.00 H new ATOM 0 HG CYS A 102 -0.271 -14.103 0.806 1.00 0.00 H new ATOM 1476 N LEU B 11 -1.384 -6.607 8.234 1.00 0.00 N ATOM 1477 CA LEU B 11 -1.367 -5.202 7.838 1.00 0.00 C ATOM 1478 C LEU B 11 -0.129 -4.781 7.016 1.00 0.00 C ATOM 1479 O LEU B 11 -0.201 -3.791 6.286 1.00 0.00 O ATOM 1480 CB LEU B 11 -1.607 -4.337 9.086 1.00 0.00 C ATOM 1481 CG LEU B 11 -2.940 -4.599 9.837 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -2.961 -5.773 10.834 1.00 0.00 C ATOM 1483 CD2 LEU B 11 -3.297 -3.349 10.643 1.00 0.00 C ATOM 0 HA LEU B 11 -2.180 -5.039 7.131 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -0.782 -4.496 9.781 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -1.577 -3.288 8.790 1.00 0.00 H new ATOM 0 HG LEU B 11 -3.642 -4.856 9.044 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -3.949 -5.846 11.289 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -2.734 -6.701 10.309 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -2.215 -5.604 11.611 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.232 -3.516 11.178 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -2.502 -3.138 11.359 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.411 -2.501 9.968 1.00 0.00 H new ATOM 1495 N ALA B 12 0.970 -5.550 7.057 1.00 0.00 N ATOM 1496 CA ALA B 12 2.069 -5.399 6.096 1.00 0.00 C ATOM 1497 C ALA B 12 1.746 -6.132 4.777 1.00 0.00 C ATOM 1498 O ALA B 12 1.912 -5.588 3.685 1.00 0.00 O ATOM 1499 CB ALA B 12 3.372 -5.900 6.734 1.00 0.00 C ATOM 0 H ALA B 12 1.120 -6.285 7.749 1.00 0.00 H new ATOM 0 HA ALA B 12 2.196 -4.346 5.845 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.191 -5.790 6.023 1.00 0.00 H new ATOM 0 HB2 ALA B 12 3.587 -5.316 7.629 1.00 0.00 H new ATOM 0 HB3 ALA B 12 3.265 -6.951 7.003 1.00 0.00 H new ATOM 1505 N ARG B 13 1.214 -7.363 4.849 1.00 0.00 N ATOM 1506 CA ARG B 13 0.835 -8.127 3.648 1.00 0.00 C ATOM 1507 C ARG B 13 -0.269 -7.429 2.833 1.00 0.00 C ATOM 1508 O ARG B 13 -0.216 -7.506 1.615 1.00 0.00 O ATOM 1509 CB ARG B 13 0.449 -9.577 3.990 1.00 0.00 C ATOM 1510 CG ARG B 13 1.607 -10.427 4.553 1.00 0.00 C ATOM 1511 CD ARG B 13 2.639 -10.823 3.481 1.00 0.00 C ATOM 1512 NE ARG B 13 3.853 -11.417 4.077 1.00 0.00 N ATOM 1513 CZ ARG B 13 4.337 -12.649 3.941 1.00 0.00 C ATOM 1514 NH1 ARG B 13 3.767 -13.546 3.168 1.00 0.00 N ATOM 1515 NH2 ARG B 13 5.426 -12.990 4.592 1.00 0.00 N ATOM 0 H ARG B 13 1.036 -7.851 5.727 1.00 0.00 H new ATOM 0 HA ARG B 13 1.721 -8.164 3.014 1.00 0.00 H new ATOM 0 HB2 ARG B 13 -0.362 -9.562 4.718 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.063 -10.059 3.092 1.00 0.00 H new ATOM 0 HG2 ARG B 13 2.109 -9.869 5.344 1.00 0.00 H new ATOM 0 HG3 ARG B 13 1.200 -11.330 5.008 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.189 -11.535 2.789 1.00 0.00 H new ATOM 0 HD3 ARG B 13 2.914 -9.943 2.899 1.00 0.00 H new ATOM 0 HE ARG B 13 4.396 -10.796 4.677 1.00 0.00 H new ATOM 0 HH11 ARG B 13 2.924 -13.308 2.646 1.00 0.00 H new ATOM 0 HH12 ARG B 13 4.168 -14.481 3.090 1.00 0.00 H new ATOM 0 HH21 ARG B 13 5.893 -12.313 5.195 1.00 0.00 H new ATOM 0 HH22 ARG B 13 5.805 -13.932 4.494 1.00 0.00 H new ATOM 1529 N LEU B 14 -1.186 -6.693 3.478 1.00 0.00 N ATOM 1530 CA LEU B 14 -2.193 -5.797 2.898 1.00 0.00 C ATOM 1531 C LEU B 14 -1.569 -4.903 1.828 1.00 0.00 C ATOM 1532 O LEU B 14 -1.895 -5.040 0.651 1.00 0.00 O ATOM 1533 CB LEU B 14 -2.834 -5.025 4.082 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.803 -3.840 3.844 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -3.119 -2.498 3.540 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.862 -4.121 2.785 1.00 0.00 C ATOM 0 H LEU B 14 -1.246 -6.711 4.496 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.978 -6.340 2.371 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -3.371 -5.758 4.685 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -2.015 -4.647 4.694 1.00 0.00 H new ATOM 0 HG LEU B 14 -4.295 -3.740 4.812 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.877 -1.729 3.388 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -2.480 -2.217 4.377 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.514 -2.594 2.638 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.504 -3.248 2.672 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -4.376 -4.340 1.834 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -5.464 -4.977 3.091 1.00 0.00 H new ATOM 1548 N GLY B 15 -0.627 -4.028 2.199 1.00 0.00 N ATOM 1549 CA GLY B 15 -0.103 -3.067 1.225 1.00 0.00 C ATOM 1550 C GLY B 15 0.809 -3.722 0.191 1.00 0.00 C ATOM 1551 O GLY B 15 0.812 -3.326 -0.976 1.00 0.00 O ATOM 0 H GLY B 15 -0.224 -3.965 3.134 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.935 -2.581 0.715 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.449 -2.287 1.750 1.00 0.00 H new ATOM 1555 N ARG B 16 1.515 -4.781 0.600 1.00 0.00 N ATOM 1556 CA ARG B 16 2.355 -5.604 -0.273 1.00 0.00 C ATOM 1557 C ARG B 16 1.527 -6.389 -1.311 1.00 0.00 C ATOM 1558 O ARG B 16 2.042 -6.670 -2.391 1.00 0.00 O ATOM 1559 CB ARG B 16 3.225 -6.524 0.607 1.00 0.00 C ATOM 1560 CG ARG B 16 4.310 -5.753 1.386 1.00 0.00 C ATOM 1561 CD ARG B 16 4.925 -6.587 2.519 1.00 0.00 C ATOM 1562 NE ARG B 16 6.076 -5.900 3.131 1.00 0.00 N ATOM 1563 CZ ARG B 16 6.881 -6.409 4.060 1.00 0.00 C ATOM 1564 NH1 ARG B 16 6.655 -7.570 4.638 1.00 0.00 N ATOM 1565 NH2 ARG B 16 7.965 -5.771 4.439 1.00 0.00 N ATOM 0 H ARG B 16 1.518 -5.096 1.570 1.00 0.00 H new ATOM 0 HA ARG B 16 3.005 -4.957 -0.861 1.00 0.00 H new ATOM 0 HB2 ARG B 16 2.586 -7.055 1.312 1.00 0.00 H new ATOM 0 HB3 ARG B 16 3.701 -7.277 -0.021 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.097 -5.445 0.698 1.00 0.00 H new ATOM 0 HG3 ARG B 16 3.877 -4.844 1.803 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.170 -6.782 3.280 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.242 -7.554 2.129 1.00 0.00 H new ATOM 0 HE ARG B 16 6.273 -4.951 2.815 1.00 0.00 H new ATOM 0 HH11 ARG B 16 5.835 -8.118 4.378 1.00 0.00 H new ATOM 0 HH12 ARG B 16 7.300 -7.921 5.346 1.00 0.00 H new ATOM 0 HH21 ARG B 16 8.200 -4.871 4.020 1.00 0.00 H new ATOM 0 HH22 ARG B 16 8.571 -6.175 5.153 1.00 0.00 H new ATOM 1579 N ALA B 17 0.265 -6.709 -0.990 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.733 -7.365 -1.838 1.00 0.00 C ATOM 1581 C ALA B 17 -1.529 -6.394 -2.718 1.00 0.00 C ATOM 1582 O ALA B 17 -2.105 -6.844 -3.708 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.719 -8.109 -0.925 1.00 0.00 C ATOM 0 H ALA B 17 -0.109 -6.500 -0.064 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.195 -8.034 -2.510 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.474 -8.607 -1.534 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.180 -8.851 -0.336 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.204 -7.397 -0.256 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.598 -5.104 -2.365 1.00 0.00 N ATOM 1590 CA LEU B 18 -2.225 -4.077 -3.206 1.00 0.00 C ATOM 1591 C LEU B 18 -1.219 -3.567 -4.244 1.00 0.00 C ATOM 1592 O LEU B 18 -1.535 -3.555 -5.431 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.864 -2.975 -2.326 1.00 0.00 C ATOM 1594 CG LEU B 18 -4.370 -3.225 -2.060 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.658 -4.570 -1.378 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.994 -2.108 -1.208 1.00 0.00 C ATOM 0 H LEU B 18 -1.221 -4.743 -1.489 1.00 0.00 H new ATOM 0 HA LEU B 18 -3.051 -4.502 -3.777 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -2.335 -2.922 -1.375 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.740 -2.008 -2.814 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.823 -3.239 -3.051 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.732 -4.677 -1.223 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.300 -5.383 -2.010 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -4.147 -4.607 -0.416 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -6.050 -2.322 -1.045 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.482 -2.054 -0.247 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.893 -1.155 -1.727 1.00 0.00 H new ATOM 1608 N ALA B 19 0.024 -3.278 -3.857 1.00 0.00 N ATOM 1609 CA ALA B 19 1.111 -2.998 -4.799 1.00 0.00 C ATOM 1610 C ALA B 19 1.747 -4.293 -5.358 1.00 0.00 C ATOM 1611 O ALA B 19 2.962 -4.471 -5.363 1.00 0.00 O ATOM 1612 CB ALA B 19 2.063 -2.038 -4.096 1.00 0.00 C ATOM 0 H ALA B 19 0.307 -3.231 -2.878 1.00 0.00 H new ATOM 0 HA ALA B 19 0.752 -2.512 -5.706 1.00 0.00 H new ATOM 0 HB1 ALA B 19 2.894 -1.798 -4.760 1.00 0.00 H new ATOM 0 HB2 ALA B 19 1.531 -1.123 -3.835 1.00 0.00 H new ATOM 0 HB3 ALA B 19 2.447 -2.505 -3.189 1.00 0.00 H new ATOM 1618 N ASP B 20 0.890 -5.204 -5.824 1.00 0.00 N ATOM 1619 CA ASP B 20 1.179 -6.514 -6.409 1.00 0.00 C ATOM 1620 C ASP B 20 0.657 -6.472 -7.864 1.00 0.00 C ATOM 1621 O ASP B 20 -0.478 -6.029 -8.059 1.00 0.00 O ATOM 1622 CB ASP B 20 0.472 -7.567 -5.537 1.00 0.00 C ATOM 1623 CG ASP B 20 0.956 -8.999 -5.744 1.00 0.00 C ATOM 1624 OD1 ASP B 20 2.125 -9.266 -5.395 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.167 -9.862 -6.196 1.00 0.00 O ATOM 0 H ASP B 20 -0.114 -5.027 -5.799 1.00 0.00 H new ATOM 0 HA ASP B 20 2.239 -6.768 -6.436 1.00 0.00 H new ATOM 0 HB2 ASP B 20 0.608 -7.301 -4.489 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.598 -7.527 -5.740 1.00 0.00 H new ATOM 1630 N PRO B 21 1.426 -6.949 -8.865 1.00 0.00 N ATOM 1631 CA PRO B 21 1.243 -6.702 -10.306 1.00 0.00 C ATOM 1632 C PRO B 21 -0.193 -6.860 -10.832 1.00 0.00 C ATOM 1633 O PRO B 21 -0.972 -5.904 -10.842 1.00 0.00 O ATOM 1634 CB PRO B 21 2.267 -7.623 -10.999 1.00 0.00 C ATOM 1635 CG PRO B 21 2.384 -8.772 -10.004 1.00 0.00 C ATOM 1636 CD PRO B 21 2.437 -7.984 -8.701 1.00 0.00 C ATOM 0 HA PRO B 21 1.420 -5.650 -10.532 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.917 -7.962 -11.974 1.00 0.00 H new ATOM 0 HB3 PRO B 21 3.222 -7.123 -11.159 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.532 -9.450 -10.047 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.279 -9.374 -10.165 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.220 -8.620 -7.843 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.425 -7.553 -8.537 1.00 0.00 H new ATOM 1644 N THR B 22 -0.551 -8.072 -11.266 1.00 0.00 N ATOM 1645 CA THR B 22 -1.901 -8.440 -11.693 1.00 0.00 C ATOM 1646 C THR B 22 -2.927 -8.127 -10.611 1.00 0.00 C ATOM 1647 O THR B 22 -4.086 -7.911 -10.937 1.00 0.00 O ATOM 1648 CB THR B 22 -1.913 -9.935 -12.022 1.00 0.00 C ATOM 1649 OG1 THR B 22 -0.974 -10.167 -13.049 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.275 -10.479 -12.465 1.00 0.00 C ATOM 0 H THR B 22 0.111 -8.845 -11.331 1.00 0.00 H new ATOM 0 HA THR B 22 -2.171 -7.858 -12.574 1.00 0.00 H new ATOM 0 HB THR B 22 -1.665 -10.460 -11.100 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.964 -11.121 -13.274 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.190 -11.545 -12.677 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.005 -10.325 -11.670 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.601 -9.955 -13.363 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.538 -8.110 -9.331 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.456 -7.990 -8.194 1.00 0.00 C ATOM 1660 C ARG B 23 -4.037 -6.585 -7.996 1.00 0.00 C ATOM 1661 O ARG B 23 -5.226 -6.509 -7.695 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.797 -8.550 -6.926 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.539 -9.806 -6.455 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.775 -10.704 -5.483 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.344 -10.092 -4.216 1.00 0.00 N ATOM 1666 CZ ARG B 23 -1.529 -10.794 -3.440 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -0.483 -11.417 -3.936 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -1.775 -10.957 -2.163 1.00 0.00 N ATOM 0 H ARG B 23 -1.559 -8.181 -9.052 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.331 -8.597 -8.427 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.752 -8.789 -7.125 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.807 -7.796 -6.139 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.471 -9.498 -5.980 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.808 -10.396 -7.331 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.403 -11.564 -5.249 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -1.891 -11.085 -5.995 1.00 0.00 H new ATOM 0 HE ARG B 23 -2.661 -9.161 -3.944 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -0.285 -11.366 -4.935 1.00 0.00 H new ATOM 0 HH12 ARG B 23 0.131 -11.951 -3.321 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -2.608 -10.540 -1.747 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -1.134 -11.501 -1.586 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.290 -5.503 -8.230 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.858 -4.148 -8.307 1.00 0.00 C ATOM 1684 C CYS B 24 -4.927 -4.106 -9.408 1.00 0.00 C ATOM 1685 O CYS B 24 -6.086 -3.756 -9.160 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.724 -3.157 -8.607 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.418 -1.490 -8.768 1.00 0.00 S ATOM 0 H CYS B 24 -2.280 -5.537 -8.371 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.328 -3.875 -7.362 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.983 -3.180 -7.808 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.210 -3.441 -9.526 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.523 -0.694 -9.273 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.528 -4.589 -10.599 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.398 -4.775 -11.759 1.00 0.00 C ATOM 1695 C ARG B 25 -6.655 -5.582 -11.406 1.00 0.00 C ATOM 1696 O ARG B 25 -7.742 -5.144 -11.765 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.625 -5.400 -12.936 1.00 0.00 C ATOM 1698 CG ARG B 25 -3.802 -4.372 -13.738 1.00 0.00 C ATOM 1699 CD ARG B 25 -3.519 -4.830 -15.181 1.00 0.00 C ATOM 1700 NE ARG B 25 -4.736 -4.701 -16.010 1.00 0.00 N ATOM 1701 CZ ARG B 25 -4.966 -5.242 -17.205 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -4.105 -5.994 -17.850 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -6.107 -5.025 -17.814 1.00 0.00 N ATOM 0 H ARG B 25 -3.563 -4.866 -10.779 1.00 0.00 H new ATOM 0 HA ARG B 25 -5.739 -3.790 -12.077 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.957 -6.172 -12.554 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.331 -5.892 -13.605 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.338 -3.423 -13.761 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -2.856 -4.192 -13.227 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -2.715 -4.231 -15.608 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -3.179 -5.866 -15.181 1.00 0.00 H new ATOM 0 HE ARG B 25 -5.487 -4.131 -15.621 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -3.194 -6.195 -17.437 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -4.347 -6.377 -18.764 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -6.818 -4.442 -17.372 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -6.283 -5.439 -18.729 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.555 -6.696 -10.665 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.731 -7.397 -10.094 1.00 0.00 C ATOM 1719 C ILE B 26 -8.583 -6.427 -9.309 1.00 0.00 C ATOM 1720 O ILE B 26 -9.713 -6.173 -9.691 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.408 -8.616 -9.178 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.666 -9.679 -9.986 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.709 -9.186 -8.568 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -6.606 -11.095 -9.405 1.00 0.00 C ATOM 0 H ILE B 26 -5.664 -7.140 -10.442 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.255 -7.797 -10.962 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.767 -8.295 -8.357 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -7.131 -9.739 -10.970 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.643 -9.334 -10.137 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.470 -10.037 -7.930 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.201 -8.415 -7.975 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.375 -9.508 -9.368 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.050 -11.743 -10.083 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -6.107 -11.070 -8.436 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -7.618 -11.481 -9.282 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.049 -5.932 -8.201 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.819 -5.174 -7.212 1.00 0.00 C ATOM 1738 C LEU B 27 -9.583 -3.985 -7.811 1.00 0.00 C ATOM 1739 O LEU B 27 -10.729 -3.773 -7.422 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.917 -4.760 -6.038 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.439 -5.935 -5.157 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.489 -5.404 -4.080 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.588 -6.662 -4.446 1.00 0.00 C ATOM 0 H LEU B 27 -7.065 -6.043 -7.957 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.595 -5.838 -6.831 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.045 -4.239 -6.432 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.458 -4.049 -5.413 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.949 -6.644 -5.824 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -6.149 -6.230 -3.455 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.630 -4.930 -4.554 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -7.011 -4.673 -3.462 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.186 -7.476 -3.844 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -9.118 -5.961 -3.801 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.277 -7.066 -5.188 1.00 0.00 H new ATOM 1755 N VAL B 28 -9.017 -3.261 -8.782 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.714 -2.122 -9.425 1.00 0.00 C ATOM 1757 C VAL B 28 -10.858 -2.545 -10.362 1.00 0.00 C ATOM 1758 O VAL B 28 -11.800 -1.786 -10.566 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.699 -1.172 -10.095 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -8.014 -1.772 -11.333 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -9.280 0.200 -10.452 1.00 0.00 C ATOM 0 H VAL B 28 -8.080 -3.436 -9.145 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.214 -1.565 -8.632 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.943 -1.031 -9.322 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -7.315 -1.047 -11.749 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.473 -2.675 -11.048 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -8.767 -2.021 -12.081 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.508 0.812 -10.919 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -10.112 0.074 -11.145 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.634 0.692 -9.546 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.801 -3.773 -10.888 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.856 -4.392 -11.694 1.00 0.00 C ATOM 1773 C ALA B 29 -12.810 -5.290 -10.874 1.00 0.00 C ATOM 1774 O ALA B 29 -13.915 -5.593 -11.318 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.143 -5.179 -12.795 1.00 0.00 C ATOM 0 H ALA B 29 -9.993 -4.382 -10.760 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.507 -3.622 -12.107 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.882 -5.665 -13.432 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -10.539 -4.499 -13.395 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.500 -5.934 -12.344 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.396 -5.718 -9.676 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.194 -6.488 -8.714 1.00 0.00 C ATOM 1783 C LEU B 30 -14.382 -5.648 -8.267 1.00 0.00 C ATOM 1784 O LEU B 30 -15.516 -6.115 -8.321 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.298 -6.825 -7.493 1.00 0.00 C ATOM 1786 CG LEU B 30 -12.655 -8.026 -6.614 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -13.981 -7.865 -5.881 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -12.666 -9.303 -7.447 1.00 0.00 C ATOM 0 H LEU B 30 -11.453 -5.529 -9.335 1.00 0.00 H new ATOM 0 HA LEU B 30 -13.559 -7.408 -9.170 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.284 -6.979 -7.862 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.273 -5.944 -6.851 1.00 0.00 H new ATOM 0 HG LEU B 30 -11.883 -8.089 -5.847 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -14.173 -8.752 -5.277 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -13.935 -6.988 -5.235 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -14.785 -7.740 -6.606 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -12.921 -10.150 -6.811 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -13.405 -9.212 -8.243 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -11.680 -9.461 -7.884 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.048 -4.420 -7.866 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.860 -3.363 -7.274 1.00 0.00 C ATOM 1802 C LEU B 31 -16.266 -3.248 -7.888 1.00 0.00 C ATOM 1803 O LEU B 31 -17.245 -3.318 -7.152 1.00 0.00 O ATOM 1804 CB LEU B 31 -14.016 -2.065 -7.403 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.892 -1.239 -6.109 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.908 -0.103 -6.392 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -15.237 -0.682 -5.621 1.00 0.00 C ATOM 0 H LEU B 31 -13.082 -4.108 -7.962 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.079 -3.581 -6.229 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -13.015 -2.332 -7.743 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -14.458 -1.437 -8.176 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.537 -1.885 -5.306 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -12.791 0.509 -5.497 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.942 -0.521 -6.675 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -13.289 0.514 -7.206 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -15.083 -0.110 -4.706 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -15.662 -0.034 -6.387 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.922 -1.506 -5.422 1.00 0.00 H new ATOM 1819 N ASP B 32 -16.336 -3.128 -9.217 1.00 0.00 N ATOM 1820 CA ASP B 32 -17.565 -3.004 -10.025 1.00 0.00 C ATOM 1821 C ASP B 32 -17.963 -4.334 -10.712 1.00 0.00 C ATOM 1822 O ASP B 32 -19.093 -4.515 -11.156 1.00 0.00 O ATOM 1823 CB ASP B 32 -17.298 -1.896 -11.064 1.00 0.00 C ATOM 1824 CG ASP B 32 -18.542 -1.419 -11.827 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -19.427 -0.817 -11.173 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -18.552 -1.586 -13.069 1.00 0.00 O ATOM 0 H ASP B 32 -15.495 -3.113 -9.794 1.00 0.00 H new ATOM 0 HA ASP B 32 -18.409 -2.751 -9.383 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -16.850 -1.042 -10.557 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -16.565 -2.260 -11.783 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.030 -5.295 -10.767 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.215 -6.626 -11.343 1.00 0.00 C ATOM 1833 C GLY B 33 -18.048 -7.523 -10.446 1.00 0.00 C ATOM 1834 O GLY B 33 -19.125 -7.945 -10.857 1.00 0.00 O ATOM 0 H GLY B 33 -16.090 -5.157 -10.396 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.699 -6.536 -12.316 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.242 -7.086 -11.513 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.526 -7.855 -9.257 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.086 -8.815 -8.278 1.00 0.00 C ATOM 1840 C VAL B 34 -18.968 -9.947 -8.845 1.00 0.00 C ATOM 1841 O VAL B 34 -19.987 -10.304 -8.253 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.793 -8.090 -7.111 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.785 -7.284 -6.300 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.952 -7.171 -7.545 1.00 0.00 C ATOM 0 H VAL B 34 -16.653 -7.442 -8.928 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.203 -9.336 -7.907 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.235 -8.880 -6.503 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.297 -6.779 -5.481 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.026 -7.953 -5.895 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.310 -6.543 -6.943 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.393 -6.701 -6.666 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.573 -6.400 -8.216 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.710 -7.760 -8.060 1.00 0.00 H new ATOM 1854 N CYS B 35 -18.588 -10.526 -9.990 1.00 0.00 N ATOM 1855 CA CYS B 35 -19.483 -11.415 -10.735 1.00 0.00 C ATOM 1856 C CYS B 35 -19.305 -12.883 -10.342 1.00 0.00 C ATOM 1857 O CYS B 35 -20.114 -13.436 -9.606 1.00 0.00 O ATOM 1858 CB CYS B 35 -19.376 -11.087 -12.235 1.00 0.00 C ATOM 1859 SG CYS B 35 -20.991 -11.336 -13.018 1.00 0.00 S ATOM 0 H CYS B 35 -17.671 -10.395 -10.418 1.00 0.00 H new ATOM 0 HA CYS B 35 -20.522 -11.233 -10.462 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.048 -10.057 -12.371 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -18.628 -11.725 -12.706 1.00 0.00 H new ATOM 0 HG CYS B 35 -20.906 -11.058 -14.285 1.00 0.00 H new ATOM 1865 N TYR B 36 -18.209 -13.501 -10.774 1.00 0.00 N ATOM 1866 CA TYR B 36 -17.901 -14.915 -10.513 1.00 0.00 C ATOM 1867 C TYR B 36 -16.385 -15.216 -10.467 1.00 0.00 C ATOM 1868 O TYR B 36 -15.593 -14.414 -10.970 1.00 0.00 O ATOM 1869 CB TYR B 36 -18.629 -15.780 -11.566 1.00 0.00 C ATOM 1870 CG TYR B 36 -18.395 -15.404 -13.018 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -19.208 -14.424 -13.615 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -17.373 -16.013 -13.769 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -18.975 -14.019 -14.943 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -17.135 -15.620 -15.102 1.00 0.00 C ATOM 1875 CZ TYR B 36 -17.930 -14.609 -15.690 1.00 0.00 C ATOM 1876 OH TYR B 36 -17.685 -14.187 -16.962 1.00 0.00 O ATOM 0 H TYR B 36 -17.493 -13.029 -11.326 1.00 0.00 H new ATOM 0 HA TYR B 36 -18.262 -15.164 -9.515 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -18.325 -16.817 -11.427 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -19.700 -15.733 -11.368 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -20.015 -13.980 -13.052 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -16.767 -16.787 -13.321 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -19.595 -13.257 -15.391 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -16.348 -16.090 -15.673 1.00 0.00 H new ATOM 0 HH TYR B 36 -16.934 -14.693 -17.336 1.00 0.00 H new ATOM 1886 N PRO B 37 -15.946 -16.370 -9.917 1.00 0.00 N ATOM 1887 CA PRO B 37 -14.555 -16.810 -10.019 1.00 0.00 C ATOM 1888 C PRO B 37 -14.080 -16.794 -11.478 1.00 0.00 C ATOM 1889 O PRO B 37 -14.633 -17.490 -12.325 1.00 0.00 O ATOM 1890 CB PRO B 37 -14.502 -18.216 -9.401 1.00 0.00 C ATOM 1891 CG PRO B 37 -15.956 -18.680 -9.399 1.00 0.00 C ATOM 1892 CD PRO B 37 -16.718 -17.374 -9.196 1.00 0.00 C ATOM 0 HA PRO B 37 -13.880 -16.139 -9.487 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -13.871 -18.885 -9.987 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -14.090 -18.192 -8.392 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -16.228 -19.167 -10.335 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -16.153 -19.394 -8.599 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -17.734 -17.445 -9.585 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -16.799 -17.125 -8.138 1.00 0.00 H new ATOM 1900 N GLY B 38 -13.076 -15.961 -11.773 1.00 0.00 N ATOM 1901 CA GLY B 38 -12.526 -15.813 -13.124 1.00 0.00 C ATOM 1902 C GLY B 38 -13.211 -14.753 -13.994 1.00 0.00 C ATOM 1903 O GLY B 38 -12.703 -14.466 -15.068 1.00 0.00 O ATOM 0 H GLY B 38 -12.621 -15.369 -11.079 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -11.468 -15.565 -13.043 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -12.590 -16.775 -13.633 1.00 0.00 H new ATOM 1907 N GLN B 39 -14.291 -14.103 -13.544 1.00 0.00 N ATOM 1908 CA GLN B 39 -14.984 -13.002 -14.259 1.00 0.00 C ATOM 1909 C GLN B 39 -14.098 -11.815 -14.620 1.00 0.00 C ATOM 1910 O GLN B 39 -14.479 -10.977 -15.431 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.123 -12.476 -13.377 1.00 0.00 C ATOM 1912 CG GLN B 39 -15.618 -11.691 -12.140 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.814 -10.185 -12.170 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.018 -9.598 -11.128 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -15.801 -9.513 -13.294 1.00 0.00 N ATOM 0 H GLN B 39 -14.726 -14.327 -12.649 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.333 -13.436 -15.196 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -16.767 -11.829 -13.973 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -16.734 -13.315 -13.044 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -16.122 -12.084 -11.257 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -14.554 -11.895 -12.017 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -15.630 -9.997 -14.176 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -15.961 -8.506 -13.288 1.00 0.00 H new ATOM 1924 N LEU B 40 -12.954 -11.705 -13.956 1.00 0.00 N ATOM 1925 CA LEU B 40 -11.978 -10.663 -14.181 1.00 0.00 C ATOM 1926 C LEU B 40 -11.195 -10.919 -15.465 1.00 0.00 C ATOM 1927 O LEU B 40 -10.548 -10.006 -15.952 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.070 -10.641 -12.953 1.00 0.00 C ATOM 1929 CG LEU B 40 -11.805 -10.195 -11.672 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -11.444 -11.171 -10.547 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.463 -8.744 -11.324 1.00 0.00 C ATOM 0 H LEU B 40 -12.678 -12.361 -13.226 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.458 -9.693 -14.312 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.652 -11.636 -12.798 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.233 -9.968 -13.138 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.884 -10.220 -11.823 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.954 -10.874 -9.630 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -11.755 -12.178 -10.825 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -10.366 -11.156 -10.384 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.993 -8.453 -10.417 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.389 -8.652 -11.162 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.763 -8.093 -12.145 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.231 -12.131 -16.024 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.507 -12.440 -17.247 1.00 0.00 C ATOM 1945 C ALA B 41 -10.956 -11.583 -18.431 1.00 0.00 C ATOM 1946 O ALA B 41 -10.110 -11.117 -19.189 1.00 0.00 O ATOM 1947 CB ALA B 41 -10.670 -13.927 -17.528 1.00 0.00 C ATOM 0 H ALA B 41 -11.759 -12.915 -15.642 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.453 -12.201 -17.108 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.135 -14.185 -18.442 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -10.264 -14.501 -16.695 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -11.728 -14.161 -17.648 1.00 0.00 H new ATOM 1953 N ALA B 42 -12.260 -11.319 -18.551 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.781 -10.350 -19.510 1.00 0.00 C ATOM 1955 C ALA B 42 -12.393 -8.910 -19.135 1.00 0.00 C ATOM 1956 O ALA B 42 -11.974 -8.158 -20.008 1.00 0.00 O ATOM 1957 CB ALA B 42 -14.302 -10.539 -19.599 1.00 0.00 C ATOM 0 H ALA B 42 -12.979 -11.771 -17.987 1.00 0.00 H new ATOM 0 HA ALA B 42 -12.337 -10.524 -20.490 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -14.716 -9.825 -20.311 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -14.524 -11.553 -19.931 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.747 -10.373 -18.618 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.462 -8.526 -17.853 1.00 0.00 N ATOM 1964 CA HIS B 43 -12.022 -7.179 -17.440 1.00 0.00 C ATOM 1965 C HIS B 43 -10.521 -6.886 -17.690 1.00 0.00 C ATOM 1966 O HIS B 43 -10.147 -5.748 -17.980 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.303 -6.980 -15.944 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.721 -6.670 -15.548 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.664 -6.004 -16.329 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -14.172 -6.723 -14.262 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -15.654 -5.659 -15.488 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -15.381 -6.063 -14.236 1.00 0.00 N ATOM 0 H HIS B 43 -12.810 -9.113 -17.095 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.590 -6.487 -18.062 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -11.995 -7.884 -15.419 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.667 -6.171 -15.585 1.00 0.00 H new ATOM 0 HD1 HIS B 43 -14.613 -5.817 -17.330 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.677 -7.192 -13.425 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -16.548 -5.128 -15.779 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.643 -7.883 -17.509 1.00 0.00 N ATOM 1981 CA LEU B 44 -8.184 -7.697 -17.484 1.00 0.00 C ATOM 1982 C LEU B 44 -7.477 -8.097 -18.781 1.00 0.00 C ATOM 1983 O LEU B 44 -6.304 -7.762 -18.939 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.550 -8.477 -16.310 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.084 -8.158 -14.902 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.195 -8.789 -13.832 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.216 -6.665 -14.603 1.00 0.00 C ATOM 0 H LEU B 44 -9.929 -8.853 -17.374 1.00 0.00 H new ATOM 0 HA LEU B 44 -8.040 -6.624 -17.358 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.690 -9.542 -16.494 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.476 -8.290 -16.317 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.088 -8.583 -14.880 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.590 -8.551 -12.844 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.177 -9.871 -13.965 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.182 -8.396 -13.922 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.598 -6.529 -13.591 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.239 -6.189 -14.689 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.905 -6.211 -15.315 1.00 0.00 H new ATOM 1999 N GLY B 45 -8.126 -8.876 -19.648 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.494 -9.508 -20.806 1.00 0.00 C ATOM 2001 C GLY B 45 -6.399 -10.515 -20.441 1.00 0.00 C ATOM 2002 O GLY B 45 -5.609 -10.945 -21.274 1.00 0.00 O ATOM 0 H GLY B 45 -9.120 -9.088 -19.564 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.259 -10.015 -21.394 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -7.065 -8.733 -21.442 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.333 -10.899 -19.166 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.507 -11.992 -18.672 1.00 0.00 C ATOM 2008 C LEU B 46 -6.426 -13.203 -18.522 1.00 0.00 C ATOM 2009 O LEU B 46 -7.492 -13.095 -17.922 1.00 0.00 O ATOM 2010 CB LEU B 46 -4.840 -11.598 -17.347 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.495 -10.864 -17.521 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -3.591 -9.516 -18.247 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -2.917 -10.632 -16.126 1.00 0.00 C ATOM 0 H LEU B 46 -6.870 -10.442 -18.429 1.00 0.00 H new ATOM 0 HA LEU B 46 -4.695 -12.229 -19.360 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.521 -10.960 -16.784 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -4.679 -12.496 -16.751 1.00 0.00 H new ATOM 0 HG LEU B 46 -2.864 -11.493 -18.148 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.598 -9.072 -18.324 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -3.998 -9.669 -19.246 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -4.245 -8.847 -17.687 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.962 -10.113 -16.209 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.609 -10.026 -15.541 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -2.767 -11.591 -15.630 1.00 0.00 H new ATOM 2025 N THR B 47 -6.015 -14.360 -19.047 1.00 0.00 N ATOM 2026 CA THR B 47 -6.838 -15.579 -19.040 1.00 0.00 C ATOM 2027 C THR B 47 -7.277 -15.988 -17.630 1.00 0.00 C ATOM 2028 O THR B 47 -6.554 -15.780 -16.646 1.00 0.00 O ATOM 2029 CB THR B 47 -6.136 -16.707 -19.800 1.00 0.00 C ATOM 2030 OG1 THR B 47 -7.009 -17.807 -19.867 1.00 0.00 O ATOM 2031 CG2 THR B 47 -4.827 -17.166 -19.155 1.00 0.00 C ATOM 0 H THR B 47 -5.104 -14.481 -19.489 1.00 0.00 H new ATOM 0 HA THR B 47 -7.764 -15.357 -19.570 1.00 0.00 H new ATOM 0 HB THR B 47 -5.883 -16.316 -20.785 1.00 0.00 H new ATOM 0 HG1 THR B 47 -6.576 -18.539 -20.353 1.00 0.00 H new ATOM 0 HG21 THR B 47 -4.389 -17.967 -19.751 1.00 0.00 H new ATOM 0 HG22 THR B 47 -4.132 -16.328 -19.107 1.00 0.00 H new ATOM 0 HG23 THR B 47 -5.026 -17.531 -18.147 1.00 0.00 H new ATOM 2039 N ARG B 48 -8.463 -16.608 -17.551 1.00 0.00 N ATOM 2040 CA ARG B 48 -9.133 -17.011 -16.308 1.00 0.00 C ATOM 2041 C ARG B 48 -8.285 -17.906 -15.392 1.00 0.00 C ATOM 2042 O ARG B 48 -8.491 -17.873 -14.180 1.00 0.00 O ATOM 2043 CB ARG B 48 -10.529 -17.604 -16.620 1.00 0.00 C ATOM 2044 CG ARG B 48 -10.537 -18.767 -17.633 1.00 0.00 C ATOM 2045 CD ARG B 48 -11.927 -19.394 -17.853 1.00 0.00 C ATOM 2046 NE ARG B 48 -12.876 -18.507 -18.555 1.00 0.00 N ATOM 2047 CZ ARG B 48 -14.067 -18.841 -19.051 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -14.507 -20.084 -19.076 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -14.856 -17.911 -19.534 1.00 0.00 N ATOM 0 H ARG B 48 -9.001 -16.851 -18.382 1.00 0.00 H new ATOM 0 HA ARG B 48 -9.273 -16.106 -15.717 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -10.975 -17.952 -15.688 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -11.168 -16.807 -17.001 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -10.157 -18.406 -18.589 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -9.851 -19.541 -17.289 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -11.814 -20.315 -18.425 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -12.348 -19.669 -16.886 1.00 0.00 H new ATOM 0 HE ARG B 48 -12.590 -17.535 -18.673 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -13.928 -20.838 -18.705 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -15.426 -20.292 -19.466 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -14.557 -16.936 -19.529 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -15.768 -18.163 -19.914 1.00 0.00 H new ATOM 2063 N SER B 49 -7.290 -18.638 -15.899 1.00 0.00 N ATOM 2064 CA SER B 49 -6.312 -19.319 -15.034 1.00 0.00 C ATOM 2065 C SER B 49 -5.319 -18.334 -14.383 1.00 0.00 C ATOM 2066 O SER B 49 -5.214 -18.302 -13.159 1.00 0.00 O ATOM 2067 CB SER B 49 -5.576 -20.420 -15.810 1.00 0.00 C ATOM 2068 OG SER B 49 -4.940 -19.923 -16.977 1.00 0.00 O ATOM 0 H SER B 49 -7.137 -18.777 -16.898 1.00 0.00 H new ATOM 0 HA SER B 49 -6.869 -19.784 -14.220 1.00 0.00 H new ATOM 0 HB2 SER B 49 -4.831 -20.882 -15.162 1.00 0.00 H new ATOM 0 HB3 SER B 49 -6.284 -21.200 -16.089 1.00 0.00 H new ATOM 0 HG SER B 49 -4.483 -20.657 -17.438 1.00 0.00 H new ATOM 2074 N ASN B 50 -4.644 -17.485 -15.172 1.00 0.00 N ATOM 2075 CA ASN B 50 -3.648 -16.514 -14.688 1.00 0.00 C ATOM 2076 C ASN B 50 -4.243 -15.554 -13.638 1.00 0.00 C ATOM 2077 O ASN B 50 -3.686 -15.394 -12.551 1.00 0.00 O ATOM 2078 CB ASN B 50 -3.075 -15.757 -15.907 1.00 0.00 C ATOM 2079 CG ASN B 50 -1.948 -14.777 -15.572 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -1.599 -14.543 -14.432 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -1.341 -14.155 -16.564 1.00 0.00 N ATOM 0 H ASN B 50 -4.777 -17.452 -16.183 1.00 0.00 H new ATOM 0 HA ASN B 50 -2.842 -17.042 -14.179 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -2.704 -16.484 -16.629 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -3.883 -15.210 -16.392 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.592 -13.491 -16.367 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -1.620 -14.338 -17.528 1.00 0.00 H new ATOM 2088 N VAL B 51 -5.424 -14.982 -13.903 1.00 0.00 N ATOM 2089 CA VAL B 51 -6.081 -14.104 -12.916 1.00 0.00 C ATOM 2090 C VAL B 51 -6.440 -14.868 -11.632 1.00 0.00 C ATOM 2091 O VAL B 51 -6.278 -14.334 -10.538 1.00 0.00 O ATOM 2092 CB VAL B 51 -7.322 -13.377 -13.480 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -7.853 -12.368 -12.453 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -6.965 -12.585 -14.745 1.00 0.00 C ATOM 0 H VAL B 51 -5.940 -15.105 -14.774 1.00 0.00 H new ATOM 0 HA VAL B 51 -5.349 -13.335 -12.670 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.069 -14.138 -13.707 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -8.728 -11.861 -12.860 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -8.130 -12.892 -11.538 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -7.079 -11.634 -12.230 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -7.855 -12.082 -15.123 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -6.203 -11.843 -14.507 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -6.583 -13.266 -15.505 1.00 0.00 H new ATOM 2104 N SER B 52 -6.850 -16.137 -11.731 1.00 0.00 N ATOM 2105 CA SER B 52 -7.220 -16.933 -10.553 1.00 0.00 C ATOM 2106 C SER B 52 -6.026 -17.341 -9.689 1.00 0.00 C ATOM 2107 O SER B 52 -6.172 -17.426 -8.472 1.00 0.00 O ATOM 2108 CB SER B 52 -8.015 -18.177 -10.938 1.00 0.00 C ATOM 2109 OG SER B 52 -9.212 -17.810 -11.601 1.00 0.00 O ATOM 0 H SER B 52 -6.935 -16.637 -12.616 1.00 0.00 H new ATOM 0 HA SER B 52 -7.846 -16.272 -9.954 1.00 0.00 H new ATOM 0 HB2 SER B 52 -7.414 -18.815 -11.585 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.249 -18.758 -10.046 1.00 0.00 H new ATOM 0 HG SER B 52 -9.005 -17.521 -12.514 1.00 0.00 H new ATOM 2115 N ASN B 53 -4.840 -17.516 -10.278 1.00 0.00 N ATOM 2116 CA ASN B 53 -3.586 -17.714 -9.542 1.00 0.00 C ATOM 2117 C ASN B 53 -3.351 -16.554 -8.550 1.00 0.00 C ATOM 2118 O ASN B 53 -3.153 -16.749 -7.351 1.00 0.00 O ATOM 2119 CB ASN B 53 -2.460 -17.846 -10.583 1.00 0.00 C ATOM 2120 CG ASN B 53 -1.167 -18.440 -10.043 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.052 -18.831 -8.893 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -0.164 -18.556 -10.893 1.00 0.00 N ATOM 0 H ASN B 53 -4.721 -17.524 -11.291 1.00 0.00 H new ATOM 0 HA ASN B 53 -3.619 -18.619 -8.936 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -2.814 -18.467 -11.406 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.247 -16.860 -10.996 1.00 0.00 H new ATOM 0 HD21 ASN B 53 0.715 -18.975 -10.590 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -0.268 -18.227 -11.853 1.00 0.00 H new ATOM 2129 N HIS B 54 -3.548 -15.320 -9.019 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.557 -14.120 -8.182 1.00 0.00 C ATOM 2131 C HIS B 54 -4.809 -13.983 -7.268 1.00 0.00 C ATOM 2132 O HIS B 54 -4.703 -13.328 -6.226 1.00 0.00 O ATOM 2133 CB HIS B 54 -3.333 -12.900 -9.090 1.00 0.00 C ATOM 2134 CG HIS B 54 -1.876 -12.519 -9.265 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -1.104 -11.775 -8.392 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -1.079 -12.786 -10.349 1.00 0.00 C ATOM 2137 CE1 HIS B 54 0.108 -11.606 -8.933 1.00 0.00 C ATOM 2138 NE2 HIS B 54 0.160 -12.171 -10.144 1.00 0.00 N ATOM 0 H HIS B 54 -3.708 -15.124 -10.007 1.00 0.00 H new ATOM 0 HA HIS B 54 -2.741 -14.197 -7.463 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -3.764 -13.106 -10.070 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -3.873 -12.048 -8.676 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.360 -13.371 -11.212 1.00 0.00 H new ATOM 0 HE1 HIS B 54 0.928 -11.087 -8.459 1.00 0.00 H new ATOM 0 HE2 HIS B 54 0.948 -12.156 -10.791 1.00 0.00 H new ATOM 2146 N LEU B 55 -5.966 -14.607 -7.570 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.083 -14.707 -6.599 1.00 0.00 C ATOM 2148 C LEU B 55 -6.804 -15.740 -5.500 1.00 0.00 C ATOM 2149 O LEU B 55 -7.445 -15.692 -4.452 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.441 -15.053 -7.252 1.00 0.00 C ATOM 2151 CG LEU B 55 -8.965 -14.019 -8.266 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.138 -14.590 -9.074 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -9.422 -12.749 -7.538 1.00 0.00 C ATOM 0 H LEU B 55 -6.154 -15.047 -8.471 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.151 -13.709 -6.166 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.349 -16.016 -7.754 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.184 -15.174 -6.464 1.00 0.00 H new ATOM 0 HG LEU B 55 -8.151 -13.776 -8.949 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -10.490 -13.841 -9.783 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -9.809 -15.476 -9.616 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -10.949 -14.859 -8.397 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -9.790 -12.025 -8.265 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.219 -12.998 -6.838 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -8.581 -12.320 -6.993 1.00 0.00 H new ATOM 2165 N SER B 56 -5.868 -16.664 -5.700 1.00 0.00 N ATOM 2166 CA SER B 56 -5.430 -17.587 -4.656 1.00 0.00 C ATOM 2167 C SER B 56 -4.962 -16.815 -3.415 1.00 0.00 C ATOM 2168 O SER B 56 -5.508 -17.038 -2.332 1.00 0.00 O ATOM 2169 CB SER B 56 -4.362 -18.550 -5.196 1.00 0.00 C ATOM 2170 OG SER B 56 -4.432 -19.792 -4.514 1.00 0.00 O ATOM 0 H SER B 56 -5.391 -16.794 -6.592 1.00 0.00 H new ATOM 0 HA SER B 56 -6.276 -18.200 -4.345 1.00 0.00 H new ATOM 0 HB2 SER B 56 -4.509 -18.705 -6.265 1.00 0.00 H new ATOM 0 HB3 SER B 56 -3.371 -18.113 -5.070 1.00 0.00 H new ATOM 0 HG SER B 56 -3.748 -20.398 -4.868 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.078 -15.814 -3.576 1.00 0.00 N ATOM 2177 CA CYS B 57 -3.544 -15.074 -2.442 1.00 0.00 C ATOM 2178 C CYS B 57 -4.558 -14.069 -1.874 1.00 0.00 C ATOM 2179 O CYS B 57 -4.644 -13.922 -0.662 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.251 -14.372 -2.861 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.219 -13.934 -1.419 1.00 0.00 S ATOM 0 H CYS B 57 -3.725 -15.507 -4.482 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.331 -15.782 -1.641 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -1.685 -15.021 -3.529 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.493 -13.470 -3.422 1.00 0.00 H new ATOM 0 HG CYS B 57 -1.849 -13.068 -0.682 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.320 -13.388 -2.742 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.276 -12.318 -2.398 1.00 0.00 C ATOM 2188 C LEU B 58 -7.322 -12.777 -1.376 1.00 0.00 C ATOM 2189 O LEU B 58 -7.663 -12.054 -0.436 1.00 0.00 O ATOM 2190 CB LEU B 58 -6.961 -11.861 -3.709 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.133 -10.342 -3.903 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.806 -9.611 -3.731 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.696 -10.112 -5.310 1.00 0.00 C ATOM 0 H LEU B 58 -5.288 -13.573 -3.745 1.00 0.00 H new ATOM 0 HA LEU B 58 -5.737 -11.494 -1.931 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.384 -12.249 -4.548 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -7.946 -12.325 -3.758 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.815 -9.947 -3.150 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -5.959 -8.541 -3.874 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.418 -9.792 -2.728 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.091 -9.977 -4.468 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.829 -9.043 -5.478 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.002 -10.512 -6.049 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.657 -10.617 -5.404 1.00 0.00 H new ATOM 2205 N ARG B 59 -7.796 -14.010 -1.570 1.00 0.00 N ATOM 2206 CA ARG B 59 -8.786 -14.668 -0.713 1.00 0.00 C ATOM 2207 C ARG B 59 -8.151 -15.281 0.552 1.00 0.00 C ATOM 2208 O ARG B 59 -8.880 -15.694 1.445 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.534 -15.741 -1.515 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.145 -15.271 -2.864 1.00 0.00 C ATOM 2211 CD ARG B 59 -10.651 -16.434 -3.722 1.00 0.00 C ATOM 2212 NE ARG B 59 -9.644 -17.507 -3.831 1.00 0.00 N ATOM 2213 CZ ARG B 59 -9.838 -18.769 -3.465 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -11.040 -19.312 -3.489 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -8.817 -19.489 -3.053 1.00 0.00 N ATOM 0 H ARG B 59 -7.494 -14.595 -2.349 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.490 -13.907 -0.376 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -8.847 -16.563 -1.715 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.336 -16.140 -0.894 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -10.969 -14.586 -2.665 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.394 -14.713 -3.423 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -11.566 -16.836 -3.288 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -10.904 -16.069 -4.717 1.00 0.00 H new ATOM 0 HE ARG B 59 -8.732 -17.262 -4.216 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -11.843 -18.761 -3.793 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -11.167 -20.283 -3.204 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -7.884 -19.077 -3.016 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -8.958 -20.459 -2.770 1.00 0.00 H new ATOM 2229 N GLY B 60 -6.815 -15.336 0.643 1.00 0.00 N ATOM 2230 CA GLY B 60 -6.065 -15.691 1.856 1.00 0.00 C ATOM 2231 C GLY B 60 -5.677 -14.454 2.667 1.00 0.00 C ATOM 2232 O GLY B 60 -5.774 -14.454 3.888 1.00 0.00 O ATOM 0 H GLY B 60 -6.208 -15.128 -0.150 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -6.668 -16.356 2.474 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -5.165 -16.241 1.579 1.00 0.00 H new ATOM 2236 N CYS B 61 -5.288 -13.379 1.975 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.071 -12.031 2.479 1.00 0.00 C ATOM 2238 C CYS B 61 -6.332 -11.419 3.158 1.00 0.00 C ATOM 2239 O CYS B 61 -6.237 -10.422 3.874 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.606 -11.231 1.239 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.884 -11.502 0.742 1.00 0.00 S ATOM 0 H CYS B 61 -5.104 -13.439 0.973 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.331 -12.013 3.279 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -5.253 -11.485 0.400 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.746 -10.169 1.439 1.00 0.00 H new ATOM 0 HG CYS B 61 -2.316 -12.323 1.575 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.517 -11.982 2.889 1.00 0.00 N ATOM 2247 CA GLY B 62 -8.819 -11.504 3.364 1.00 0.00 C ATOM 2248 C GLY B 62 -9.395 -10.355 2.536 1.00 0.00 C ATOM 2249 O GLY B 62 -10.566 -10.048 2.697 1.00 0.00 O ATOM 0 H GLY B 62 -7.596 -12.818 2.310 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.525 -12.334 3.356 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -8.720 -11.179 4.400 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.614 -9.772 1.615 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.947 -8.644 0.719 1.00 0.00 C ATOM 2255 C LEU B 63 -10.249 -8.827 -0.069 1.00 0.00 C ATOM 2256 O LEU B 63 -10.932 -7.854 -0.391 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.782 -8.463 -0.252 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.531 -7.949 0.476 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.384 -7.937 -0.508 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.689 -6.538 1.041 1.00 0.00 C ATOM 0 H LEU B 63 -7.660 -10.098 1.462 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.106 -7.766 1.344 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.559 -9.413 -0.739 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -8.064 -7.761 -1.037 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.353 -8.616 1.320 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.483 -7.575 -0.012 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.213 -8.947 -0.879 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.628 -7.280 -1.343 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.767 -6.241 1.541 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.902 -5.843 0.229 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.511 -6.523 1.757 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.558 -10.076 -0.389 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.764 -10.519 -1.079 1.00 0.00 C ATOM 2274 C VAL B 64 -12.398 -11.667 -0.305 1.00 0.00 C ATOM 2275 O VAL B 64 -11.706 -12.559 0.181 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.506 -10.949 -2.540 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.493 -9.732 -3.474 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.229 -11.756 -2.700 1.00 0.00 C ATOM 0 H VAL B 64 -9.938 -10.853 -0.161 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.441 -9.666 -1.121 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.332 -11.603 -2.820 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.310 -10.060 -4.497 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.456 -9.224 -3.423 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.704 -9.046 -3.166 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.100 -12.030 -3.747 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.378 -11.158 -2.374 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.291 -12.660 -2.094 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.724 -11.608 -0.229 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.612 -12.533 0.481 1.00 0.00 C ATOM 2290 C VAL B 65 -15.607 -13.124 -0.520 1.00 0.00 C ATOM 2291 O VAL B 65 -16.156 -12.415 -1.365 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.368 -11.797 1.616 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.267 -12.755 2.419 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.379 -11.120 2.579 1.00 0.00 C ATOM 0 H VAL B 65 -14.245 -10.864 -0.692 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.022 -13.331 0.931 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.996 -11.044 1.140 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -16.779 -12.200 3.205 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.004 -13.206 1.754 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -15.655 -13.538 2.867 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.931 -10.609 3.368 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.728 -11.874 3.021 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.776 -10.396 2.031 1.00 0.00 H new ATOM 2304 N ALA B 66 -15.832 -14.437 -0.441 1.00 0.00 N ATOM 2305 CA ALA B 66 -16.766 -15.153 -1.313 1.00 0.00 C ATOM 2306 C ALA B 66 -18.200 -15.152 -0.762 1.00 0.00 C ATOM 2307 O ALA B 66 -18.431 -15.419 0.417 1.00 0.00 O ATOM 2308 CB ALA B 66 -16.230 -16.576 -1.518 1.00 0.00 C ATOM 0 H ALA B 66 -15.366 -15.040 0.237 1.00 0.00 H new ATOM 0 HA ALA B 66 -16.829 -14.641 -2.273 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -16.909 -17.131 -2.165 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -15.244 -16.530 -1.981 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -16.155 -17.079 -0.554 1.00 0.00 H new ATOM 2314 N THR B 67 -19.183 -14.902 -1.641 1.00 0.00 N ATOM 2315 CA THR B 67 -20.613 -14.877 -1.278 1.00 0.00 C ATOM 2316 C THR B 67 -21.438 -15.597 -2.320 1.00 0.00 C ATOM 2317 O THR B 67 -21.148 -15.484 -3.508 1.00 0.00 O ATOM 2318 CB THR B 67 -21.168 -13.458 -1.094 1.00 0.00 C ATOM 2319 OG1 THR B 67 -21.364 -12.864 -2.348 1.00 0.00 O ATOM 2320 CG2 THR B 67 -20.242 -12.517 -0.339 1.00 0.00 C ATOM 0 H THR B 67 -19.010 -14.710 -2.628 1.00 0.00 H new ATOM 0 HA THR B 67 -20.686 -15.385 -0.317 1.00 0.00 H new ATOM 0 HB THR B 67 -22.086 -13.588 -0.521 1.00 0.00 H new ATOM 0 HG1 THR B 67 -22.268 -12.489 -2.395 1.00 0.00 H new ATOM 0 HG21 THR B 67 -20.710 -11.537 -0.253 1.00 0.00 H new ATOM 0 HG22 THR B 67 -20.051 -12.916 0.657 1.00 0.00 H new ATOM 0 HG23 THR B 67 -19.300 -12.423 -0.879 1.00 0.00 H new ATOM 2328 N TYR B 68 -22.523 -16.215 -1.881 1.00 0.00 N ATOM 2329 CA TYR B 68 -23.505 -16.883 -2.728 1.00 0.00 C ATOM 2330 C TYR B 68 -24.735 -15.973 -2.938 1.00 0.00 C ATOM 2331 O TYR B 68 -25.511 -15.791 -2.003 1.00 0.00 O ATOM 2332 CB TYR B 68 -23.842 -18.200 -2.011 1.00 0.00 C ATOM 2333 CG TYR B 68 -24.905 -19.059 -2.654 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -24.543 -20.012 -3.621 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -26.243 -18.953 -2.233 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -25.516 -20.862 -4.177 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.222 -19.795 -2.790 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.860 -20.752 -3.765 1.00 0.00 C ATOM 2339 OH TYR B 68 -27.805 -21.548 -4.326 1.00 0.00 O ATOM 0 H TYR B 68 -22.755 -16.268 -0.889 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.129 -17.092 -3.729 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -22.928 -18.789 -1.931 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -24.160 -17.965 -0.995 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -23.514 -20.092 -3.939 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -26.518 -18.226 -1.483 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.235 -21.597 -4.917 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.251 -19.710 -2.473 1.00 0.00 H new ATOM 0 HH TYR B 68 -28.570 -21.002 -4.604 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.914 -15.394 -4.135 1.00 0.00 N ATOM 2350 CA GLU B 69 -26.019 -14.456 -4.455 1.00 0.00 C ATOM 2351 C GLU B 69 -27.444 -15.068 -4.506 1.00 0.00 C ATOM 2352 O GLU B 69 -28.392 -14.394 -4.901 1.00 0.00 O ATOM 2353 CB GLU B 69 -25.675 -13.603 -5.700 1.00 0.00 C ATOM 2354 CG GLU B 69 -25.443 -14.311 -7.043 1.00 0.00 C ATOM 2355 CD GLU B 69 -26.692 -14.926 -7.672 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -26.987 -16.081 -7.306 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -27.278 -14.350 -8.618 1.00 0.00 O ATOM 0 H GLU B 69 -24.290 -15.562 -4.924 1.00 0.00 H new ATOM 0 HA GLU B 69 -26.086 -13.795 -3.591 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -26.483 -12.885 -5.841 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.776 -13.031 -5.469 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -25.016 -13.595 -7.745 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -24.702 -15.097 -6.899 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.603 -16.326 -4.076 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.858 -17.091 -4.093 1.00 0.00 C ATOM 2366 C GLY B 70 -28.799 -18.320 -5.002 1.00 0.00 C ATOM 2367 O GLY B 70 -29.595 -19.243 -4.826 1.00 0.00 O ATOM 0 H GLY B 70 -26.827 -16.863 -3.690 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.097 -17.408 -3.078 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.668 -16.441 -4.423 1.00 0.00 H new ATOM 2371 N ARG B 71 -27.830 -18.368 -5.923 1.00 0.00 N ATOM 2372 CA ARG B 71 -27.743 -19.344 -7.019 1.00 0.00 C ATOM 2373 C ARG B 71 -26.302 -19.489 -7.549 1.00 0.00 C ATOM 2374 O ARG B 71 -25.838 -20.600 -7.791 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.674 -18.782 -8.098 1.00 0.00 C ATOM 2376 CG ARG B 71 -28.963 -19.595 -9.361 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.852 -18.755 -10.307 1.00 0.00 C ATOM 2378 NE ARG B 71 -29.118 -17.621 -10.908 1.00 0.00 N ATOM 2379 CZ ARG B 71 -28.924 -16.401 -10.410 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -29.520 -15.925 -9.339 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -28.022 -15.618 -10.948 1.00 0.00 N ATOM 0 H ARG B 71 -27.055 -17.704 -5.927 1.00 0.00 H new ATOM 0 HA ARG B 71 -28.029 -20.345 -6.696 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.632 -18.572 -7.622 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.260 -17.825 -8.417 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -28.031 -19.862 -9.859 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -29.465 -20.528 -9.102 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -30.240 -19.394 -11.100 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -30.711 -18.376 -9.753 1.00 0.00 H new ATOM 0 HE ARG B 71 -28.706 -17.796 -11.825 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -30.186 -16.503 -8.826 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -29.317 -14.977 -9.021 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -27.473 -15.944 -11.744 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -27.869 -14.683 -10.571 1.00 0.00 H new ATOM 2395 N GLN B 72 -25.580 -18.379 -7.725 1.00 0.00 N ATOM 2396 CA GLN B 72 -24.173 -18.315 -8.138 1.00 0.00 C ATOM 2397 C GLN B 72 -23.254 -18.031 -6.936 1.00 0.00 C ATOM 2398 O GLN B 72 -23.730 -17.674 -5.862 1.00 0.00 O ATOM 2399 CB GLN B 72 -23.949 -17.190 -9.177 1.00 0.00 C ATOM 2400 CG GLN B 72 -25.030 -16.964 -10.247 1.00 0.00 C ATOM 2401 CD GLN B 72 -25.373 -18.152 -11.143 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -26.489 -18.278 -11.621 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -24.457 -19.043 -11.456 1.00 0.00 N ATOM 0 H GLN B 72 -25.980 -17.453 -7.576 1.00 0.00 H new ATOM 0 HA GLN B 72 -23.931 -19.284 -8.574 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -23.819 -16.255 -8.632 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.009 -17.393 -9.691 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -25.943 -16.643 -9.745 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -24.710 -16.140 -10.884 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -23.516 -18.963 -11.072 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -24.688 -19.814 -12.083 1.00 0.00 H new ATOM 2412 N VAL B 73 -21.933 -18.116 -7.137 1.00 0.00 N ATOM 2413 CA VAL B 73 -20.901 -17.661 -6.186 1.00 0.00 C ATOM 2414 C VAL B 73 -20.021 -16.580 -6.829 1.00 0.00 C ATOM 2415 O VAL B 73 -19.714 -16.664 -8.020 1.00 0.00 O ATOM 2416 CB VAL B 73 -20.019 -18.817 -5.657 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -20.844 -19.776 -4.788 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -19.306 -19.614 -6.764 1.00 0.00 C ATOM 0 H VAL B 73 -21.537 -18.514 -7.989 1.00 0.00 H new ATOM 0 HA VAL B 73 -21.428 -17.243 -5.328 1.00 0.00 H new ATOM 0 HB VAL B 73 -19.242 -18.340 -5.060 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -20.204 -20.581 -4.427 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -21.258 -19.233 -3.939 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -21.656 -20.196 -5.381 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -18.708 -20.406 -6.314 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -20.048 -20.054 -7.431 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -18.657 -18.947 -7.332 1.00 0.00 H new ATOM 2428 N ARG B 74 -19.613 -15.583 -6.032 1.00 0.00 N ATOM 2429 CA ARG B 74 -18.813 -14.427 -6.467 1.00 0.00 C ATOM 2430 C ARG B 74 -17.637 -14.195 -5.522 1.00 0.00 C ATOM 2431 O ARG B 74 -17.564 -14.800 -4.454 1.00 0.00 O ATOM 2432 CB ARG B 74 -19.700 -13.171 -6.533 1.00 0.00 C ATOM 2433 CG ARG B 74 -19.876 -12.430 -5.195 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.029 -11.427 -5.296 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.157 -10.610 -4.075 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.379 -9.303 -3.986 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.465 -8.532 -5.051 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -21.513 -8.756 -2.791 1.00 0.00 N ATOM 0 H ARG B 74 -19.836 -15.557 -5.037 1.00 0.00 H new ATOM 0 HA ARG B 74 -18.415 -14.635 -7.460 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.273 -12.481 -7.260 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -20.684 -13.458 -6.905 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -20.075 -13.146 -4.398 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -18.954 -11.911 -4.934 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.868 -10.774 -6.154 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -21.961 -11.963 -5.474 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.064 -11.109 -3.191 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -21.360 -8.935 -5.982 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -21.636 -7.532 -4.944 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -21.446 -9.336 -1.954 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -21.684 -7.754 -2.705 1.00 0.00 H new ATOM 2452 N TYR B 75 -16.785 -13.236 -5.874 1.00 0.00 N ATOM 2453 CA TYR B 75 -15.755 -12.673 -4.993 1.00 0.00 C ATOM 2454 C TYR B 75 -15.975 -11.159 -4.889 1.00 0.00 C ATOM 2455 O TYR B 75 -16.068 -10.486 -5.912 1.00 0.00 O ATOM 2456 CB TYR B 75 -14.350 -12.978 -5.536 1.00 0.00 C ATOM 2457 CG TYR B 75 -13.972 -14.449 -5.627 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.282 -15.345 -4.583 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -13.273 -14.919 -6.756 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -13.919 -16.701 -4.675 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -12.873 -16.268 -6.839 1.00 0.00 C ATOM 2462 CZ TYR B 75 -13.206 -17.166 -5.800 1.00 0.00 C ATOM 2463 OH TYR B 75 -12.821 -18.469 -5.861 1.00 0.00 O ATOM 0 H TYR B 75 -16.788 -12.815 -6.803 1.00 0.00 H new ATOM 0 HA TYR B 75 -15.832 -13.125 -4.004 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.264 -12.540 -6.530 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -13.620 -12.475 -4.901 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -14.802 -14.988 -3.706 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.042 -14.241 -7.564 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -14.186 -17.386 -3.884 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -12.313 -16.615 -7.695 1.00 0.00 H new ATOM 0 HH TYR B 75 -12.341 -18.629 -6.700 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.095 -10.631 -3.672 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.307 -9.207 -3.404 1.00 0.00 C ATOM 2475 C ALA B 76 -15.209 -8.669 -2.482 1.00 0.00 C ATOM 2476 O ALA B 76 -14.684 -9.434 -1.674 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.708 -9.029 -2.806 1.00 0.00 C ATOM 0 H ALA B 76 -16.046 -11.194 -2.823 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.248 -8.631 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.884 -7.973 -2.600 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.454 -9.390 -3.514 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.783 -9.597 -1.879 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.872 -7.380 -2.604 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.960 -6.669 -1.702 1.00 0.00 C ATOM 2485 C LEU B 77 -14.412 -6.839 -0.243 1.00 0.00 C ATOM 2486 O LEU B 77 -15.612 -6.891 0.022 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.934 -5.180 -2.092 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.523 -4.595 -2.100 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.639 -5.137 -3.212 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -12.665 -3.101 -2.336 1.00 0.00 C ATOM 0 H LEU B 77 -15.235 -6.788 -3.351 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.956 -7.084 -1.792 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.378 -5.060 -3.080 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -14.553 -4.615 -1.394 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.054 -4.857 -1.152 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.654 -4.674 -3.152 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -11.540 -6.217 -3.104 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.089 -4.908 -4.178 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -11.678 -2.639 -2.350 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -13.159 -2.929 -3.292 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -13.260 -2.661 -1.536 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.462 -6.919 0.690 1.00 0.00 N ATOM 2503 CA ALA B 78 -13.736 -7.217 2.100 1.00 0.00 C ATOM 2504 C ALA B 78 -14.634 -6.195 2.809 1.00 0.00 C ATOM 2505 O ALA B 78 -15.469 -6.577 3.623 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.392 -7.327 2.827 1.00 0.00 C ATOM 0 H ALA B 78 -12.472 -6.778 0.488 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.297 -8.151 2.129 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.565 -7.549 3.880 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -11.801 -8.127 2.380 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.852 -6.384 2.739 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.462 -4.910 2.495 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.149 -3.800 3.158 1.00 0.00 C ATOM 2514 C ASP B 79 -14.962 -2.463 2.419 1.00 0.00 C ATOM 2515 O ASP B 79 -14.035 -2.237 1.637 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.688 -3.669 4.640 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.265 -2.438 5.363 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.509 -2.277 5.383 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.470 -1.530 5.710 1.00 0.00 O ATOM 0 H ASP B 79 -13.828 -4.605 1.757 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.213 -4.034 3.136 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -14.981 -4.568 5.183 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.600 -3.619 4.669 1.00 0.00 H new ATOM 2524 N SER B 80 -15.872 -1.562 2.768 1.00 0.00 N ATOM 2525 CA SER B 80 -15.914 -0.121 2.551 1.00 0.00 C ATOM 2526 C SER B 80 -14.527 0.541 2.614 1.00 0.00 C ATOM 2527 O SER B 80 -14.239 1.421 1.805 1.00 0.00 O ATOM 2528 CB SER B 80 -16.788 0.495 3.669 1.00 0.00 C ATOM 2529 OG SER B 80 -17.835 -0.360 4.116 1.00 0.00 O ATOM 0 H SER B 80 -16.704 -1.864 3.275 1.00 0.00 H new ATOM 0 HA SER B 80 -16.314 0.054 1.552 1.00 0.00 H new ATOM 0 HB2 SER B 80 -16.152 0.749 4.517 1.00 0.00 H new ATOM 0 HB3 SER B 80 -17.222 1.427 3.306 1.00 0.00 H new ATOM 0 HG SER B 80 -17.518 -0.898 4.872 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.661 0.105 3.546 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.255 0.490 3.693 1.00 0.00 C ATOM 2537 C HIS B 81 -11.488 0.355 2.380 1.00 0.00 C ATOM 2538 O HIS B 81 -11.059 1.362 1.814 1.00 0.00 O ATOM 2539 CB HIS B 81 -11.605 -0.394 4.784 1.00 0.00 C ATOM 2540 CG HIS B 81 -11.751 0.105 6.197 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.385 1.264 6.607 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -10.973 -0.327 7.233 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -11.939 1.566 7.840 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -11.153 0.564 8.276 1.00 0.00 N ATOM 0 H HIS B 81 -13.947 -0.567 4.258 1.00 0.00 H new ATOM 0 HA HIS B 81 -12.213 1.540 3.984 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.038 -1.392 4.724 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.543 -0.494 4.561 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -13.070 1.796 6.070 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -10.337 -1.200 7.237 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -12.173 2.465 8.390 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.307 -0.884 1.907 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.607 -1.157 0.651 1.00 0.00 C ATOM 2555 C LEU B 82 -11.378 -0.512 -0.502 1.00 0.00 C ATOM 2556 O LEU B 82 -10.762 0.029 -1.409 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.431 -2.674 0.405 1.00 0.00 C ATOM 2558 CG LEU B 82 -9.993 -3.554 1.592 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -9.903 -5.009 1.130 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -8.652 -3.088 2.179 1.00 0.00 C ATOM 0 H LEU B 82 -11.641 -1.721 2.384 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.607 -0.728 0.714 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -11.378 -3.064 0.032 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.698 -2.800 -0.392 1.00 0.00 H new ATOM 0 HG LEU B 82 -10.736 -3.465 2.384 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -9.593 -5.637 1.965 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -10.878 -5.338 0.771 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.173 -5.091 0.325 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -8.376 -3.733 3.014 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -7.881 -3.140 1.410 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -8.746 -2.060 2.530 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.714 -0.524 -0.458 1.00 0.00 N ATOM 2573 CA ALA B 83 -13.544 -0.035 -1.558 1.00 0.00 C ATOM 2574 C ALA B 83 -13.348 1.465 -1.812 1.00 0.00 C ATOM 2575 O ALA B 83 -13.219 1.851 -2.972 1.00 0.00 O ATOM 2576 CB ALA B 83 -15.001 -0.404 -1.271 1.00 0.00 C ATOM 0 H ALA B 83 -13.247 -0.872 0.339 1.00 0.00 H new ATOM 0 HA ALA B 83 -13.236 -0.517 -2.486 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -15.634 -0.046 -2.083 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -15.093 -1.487 -1.190 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -15.316 0.058 -0.335 1.00 0.00 H new ATOM 2582 N ARG B 84 -13.260 2.292 -0.756 1.00 0.00 N ATOM 2583 CA ARG B 84 -12.965 3.719 -0.918 1.00 0.00 C ATOM 2584 C ARG B 84 -11.514 3.954 -1.333 1.00 0.00 C ATOM 2585 O ARG B 84 -11.309 4.552 -2.375 1.00 0.00 O ATOM 2586 CB ARG B 84 -13.407 4.585 0.280 1.00 0.00 C ATOM 2587 CG ARG B 84 -12.614 4.467 1.602 1.00 0.00 C ATOM 2588 CD ARG B 84 -12.905 5.635 2.557 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.349 6.887 2.025 1.00 0.00 N ATOM 2590 CZ ARG B 84 -12.549 8.136 2.412 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -13.339 8.432 3.419 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -11.956 9.106 1.766 1.00 0.00 N ATOM 0 H ARG B 84 -13.389 1.996 0.211 1.00 0.00 H new ATOM 0 HA ARG B 84 -13.586 4.066 -1.744 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.376 5.628 -0.034 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -14.449 4.348 0.495 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.866 3.527 2.093 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -11.547 4.436 1.383 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -13.981 5.739 2.697 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -12.475 5.427 3.537 1.00 0.00 H new ATOM 0 HE ARG B 84 -11.711 6.776 1.237 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -13.819 7.689 3.927 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -13.473 9.405 3.693 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -11.348 8.895 0.975 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -12.101 10.074 2.054 1.00 0.00 H new ATOM 2606 N ALA B 85 -10.518 3.405 -0.630 1.00 0.00 N ATOM 2607 CA ALA B 85 -9.105 3.709 -0.902 1.00 0.00 C ATOM 2608 C ALA B 85 -8.665 3.244 -2.309 1.00 0.00 C ATOM 2609 O ALA B 85 -7.918 3.927 -3.021 1.00 0.00 O ATOM 2610 CB ALA B 85 -8.273 3.072 0.218 1.00 0.00 C ATOM 0 H ALA B 85 -10.663 2.745 0.134 1.00 0.00 H new ATOM 0 HA ALA B 85 -8.949 4.788 -0.908 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -7.216 3.278 0.048 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -8.575 3.490 1.178 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -8.436 1.994 0.225 1.00 0.00 H new ATOM 2616 N LEU B 86 -9.168 2.085 -2.740 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.967 1.569 -4.094 1.00 0.00 C ATOM 2618 C LEU B 86 -9.770 2.365 -5.144 1.00 0.00 C ATOM 2619 O LEU B 86 -9.305 2.508 -6.272 1.00 0.00 O ATOM 2620 CB LEU B 86 -9.270 0.049 -4.070 1.00 0.00 C ATOM 2621 CG LEU B 86 -8.420 -0.863 -4.972 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -8.759 -0.771 -6.452 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -6.921 -0.617 -4.792 1.00 0.00 C ATOM 0 H LEU B 86 -9.732 1.472 -2.151 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.933 1.705 -4.410 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -9.161 -0.299 -3.043 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -10.316 -0.089 -4.344 1.00 0.00 H new ATOM 0 HG LEU B 86 -8.673 -1.870 -4.639 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -8.114 -1.445 -7.016 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -9.801 -1.053 -6.605 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -8.606 0.251 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -6.362 -1.283 -5.449 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -6.689 0.418 -5.043 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -6.642 -0.810 -3.756 1.00 0.00 H new ATOM 2635 N GLY B 87 -10.916 2.945 -4.766 1.00 0.00 N ATOM 2636 CA GLY B 87 -11.782 3.740 -5.643 1.00 0.00 C ATOM 2637 C GLY B 87 -11.442 5.241 -5.750 1.00 0.00 C ATOM 2638 O GLY B 87 -11.672 5.834 -6.800 1.00 0.00 O ATOM 0 H GLY B 87 -11.276 2.872 -3.814 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -11.748 3.308 -6.643 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -12.809 3.645 -5.290 1.00 0.00 H new ATOM 2642 N GLU B 88 -10.875 5.855 -4.709 1.00 0.00 N ATOM 2643 CA GLU B 88 -10.331 7.225 -4.703 1.00 0.00 C ATOM 2644 C GLU B 88 -8.849 7.281 -5.118 1.00 0.00 C ATOM 2645 O GLU B 88 -8.299 8.361 -5.330 1.00 0.00 O ATOM 2646 CB GLU B 88 -10.588 7.887 -3.341 1.00 0.00 C ATOM 2647 CG GLU B 88 -9.653 7.451 -2.205 1.00 0.00 C ATOM 2648 CD GLU B 88 -10.347 7.696 -0.871 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -10.430 8.873 -0.453 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -10.887 6.737 -0.277 1.00 0.00 O ATOM 0 H GLU B 88 -10.776 5.395 -3.804 1.00 0.00 H new ATOM 0 HA GLU B 88 -10.860 7.799 -5.464 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -10.506 8.967 -3.461 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -11.615 7.677 -3.043 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -9.400 6.396 -2.310 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -8.718 8.009 -2.251 1.00 0.00 H new ATOM 2657 N LEU B 89 -8.228 6.100 -5.243 1.00 0.00 N ATOM 2658 CA LEU B 89 -6.932 5.805 -5.859 1.00 0.00 C ATOM 2659 C LEU B 89 -5.731 5.982 -4.915 1.00 0.00 C ATOM 2660 O LEU B 89 -5.012 6.989 -4.977 1.00 0.00 O ATOM 2661 CB LEU B 89 -6.774 6.589 -7.183 1.00 0.00 C ATOM 2662 CG LEU B 89 -5.673 6.038 -8.104 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -6.115 4.712 -8.736 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -5.364 7.073 -9.195 1.00 0.00 C ATOM 0 H LEU B 89 -8.662 5.251 -4.881 1.00 0.00 H new ATOM 0 HA LEU B 89 -6.930 4.740 -6.090 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -7.723 6.574 -7.718 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -6.554 7.631 -6.953 1.00 0.00 H new ATOM 0 HG LEU B 89 -4.774 5.850 -7.518 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -5.324 4.336 -9.385 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -6.316 3.984 -7.950 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -7.020 4.872 -9.323 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -4.584 6.688 -9.851 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -6.265 7.268 -9.777 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -5.024 7.999 -8.732 1.00 0.00 H new ATOM 2676 N VAL B 90 -5.431 4.936 -4.132 1.00 0.00 N ATOM 2677 CA VAL B 90 -4.186 4.838 -3.342 1.00 0.00 C ATOM 2678 C VAL B 90 -2.988 5.208 -4.203 1.00 0.00 C ATOM 2679 O VAL B 90 -2.813 4.825 -5.359 1.00 0.00 O ATOM 2680 CB VAL B 90 -3.914 3.481 -2.662 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -2.621 3.490 -1.822 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -5.063 3.128 -1.722 1.00 0.00 C ATOM 0 H VAL B 90 -6.045 4.128 -4.025 1.00 0.00 H new ATOM 0 HA VAL B 90 -4.336 5.544 -2.525 1.00 0.00 H new ATOM 0 HB VAL B 90 -3.813 2.751 -3.465 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -2.477 2.511 -1.365 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -1.771 3.719 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -2.700 4.246 -1.041 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -4.862 2.168 -1.246 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -5.158 3.899 -0.957 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -5.991 3.064 -2.290 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.199 6.079 -3.601 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.955 7.375 -4.216 1.00 0.00 C ATOM 2694 C GLN B 91 -0.605 7.433 -4.951 1.00 0.00 C ATOM 2695 O GLN B 91 -0.199 8.466 -5.474 1.00 0.00 O ATOM 2696 CB GLN B 91 -2.215 8.309 -3.040 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.154 9.818 -3.207 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.201 10.510 -4.086 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -3.161 11.727 -4.207 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -4.130 9.854 -4.752 1.00 0.00 N ATOM 0 H GLN B 91 -1.726 5.922 -2.711 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.588 7.657 -5.057 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -3.207 8.071 -2.657 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -1.501 8.046 -2.260 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -2.213 10.262 -2.213 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -1.171 10.065 -3.609 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.192 8.839 -4.674 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.787 10.361 -5.345 1.00 0.00 H new ATOM 2709 N VAL B 92 -0.004 6.255 -5.096 1.00 0.00 N ATOM 2710 CA VAL B 92 1.131 5.808 -5.922 1.00 0.00 C ATOM 2711 C VAL B 92 0.769 5.849 -7.421 1.00 0.00 C ATOM 2712 O VAL B 92 0.990 4.922 -8.191 1.00 0.00 O ATOM 2713 CB VAL B 92 1.530 4.399 -5.414 1.00 0.00 C ATOM 2714 CG1 VAL B 92 0.324 3.441 -5.451 1.00 0.00 C ATOM 2715 CG2 VAL B 92 2.730 3.737 -6.088 1.00 0.00 C ATOM 0 H VAL B 92 -0.354 5.465 -4.553 1.00 0.00 H new ATOM 0 HA VAL B 92 1.989 6.473 -5.826 1.00 0.00 H new ATOM 0 HB VAL B 92 1.858 4.588 -4.392 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.628 2.459 -5.090 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.470 3.831 -4.815 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.041 3.354 -6.475 1.00 0.00 H new ATOM 0 HG21 VAL B 92 2.904 2.758 -5.642 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.530 3.620 -7.153 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.614 4.360 -5.951 1.00 0.00 H new ATOM 2725 N VAL B 93 0.093 6.935 -7.788 1.00 0.00 N ATOM 2726 CA VAL B 93 -0.376 7.334 -9.124 1.00 0.00 C ATOM 2727 C VAL B 93 -1.294 6.324 -9.858 1.00 0.00 C ATOM 2728 O VAL B 93 -1.608 6.546 -11.024 1.00 0.00 O ATOM 2729 CB VAL B 93 0.793 7.792 -10.056 1.00 0.00 C ATOM 2730 CG1 VAL B 93 0.344 9.026 -10.861 1.00 0.00 C ATOM 2731 CG2 VAL B 93 2.087 8.215 -9.327 1.00 0.00 C ATOM 0 H VAL B 93 -0.169 7.632 -7.091 1.00 0.00 H new ATOM 0 HA VAL B 93 -1.018 8.187 -8.905 1.00 0.00 H new ATOM 0 HB VAL B 93 1.018 6.917 -10.666 1.00 0.00 H new ATOM 0 HG11 VAL B 93 1.155 9.350 -11.513 1.00 0.00 H new ATOM 0 HG12 VAL B 93 -0.526 8.769 -11.465 1.00 0.00 H new ATOM 0 HG13 VAL B 93 0.085 9.833 -10.176 1.00 0.00 H new ATOM 0 HG21 VAL B 93 2.836 8.515 -10.060 1.00 0.00 H new ATOM 0 HG22 VAL B 93 1.873 9.053 -8.663 1.00 0.00 H new ATOM 0 HG23 VAL B 93 2.466 7.376 -8.743 1.00 0.00 H new ATOM 2741 N LEU B 94 -1.742 5.267 -9.158 1.00 0.00 N ATOM 2742 CA LEU B 94 -2.373 4.017 -9.629 1.00 0.00 C ATOM 2743 C LEU B 94 -1.228 3.006 -9.673 1.00 0.00 C ATOM 2744 O LEU B 94 -0.374 3.087 -10.551 1.00 0.00 O ATOM 2745 CB LEU B 94 -3.092 4.105 -11.001 1.00 0.00 C ATOM 2746 CG LEU B 94 -3.947 2.870 -11.382 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -4.923 3.263 -12.501 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -3.129 1.655 -11.851 1.00 0.00 C ATOM 0 H LEU B 94 -1.664 5.265 -8.141 1.00 0.00 H new ATOM 0 HA LEU B 94 -3.183 3.743 -8.954 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -3.735 4.985 -11.000 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -2.342 4.260 -11.776 1.00 0.00 H new ATOM 0 HG LEU B 94 -4.465 2.566 -10.472 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -5.529 2.399 -12.775 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -5.573 4.066 -12.152 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -4.361 3.603 -13.371 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -3.804 0.835 -12.098 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -2.549 1.926 -12.733 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -2.454 1.342 -11.055 1.00 0.00 H new ATOM 2760 N ALA B 95 -1.185 2.069 -8.723 1.00 0.00 N ATOM 2761 CA ALA B 95 -0.111 1.082 -8.615 1.00 0.00 C ATOM 2762 C ALA B 95 0.016 0.183 -9.864 1.00 0.00 C ATOM 2763 O ALA B 95 -0.570 -0.895 -9.912 1.00 0.00 O ATOM 2764 CB ALA B 95 -0.291 0.263 -7.324 1.00 0.00 C ATOM 0 H ALA B 95 -1.900 1.974 -8.002 1.00 0.00 H new ATOM 0 HA ALA B 95 0.834 1.622 -8.561 1.00 0.00 H new ATOM 0 HB1 ALA B 95 0.510 -0.472 -7.245 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -0.258 0.930 -6.462 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -1.253 -0.250 -7.349 1.00 0.00 H new