USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 832 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 70 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 11 ASN : amide:sc= -0.232 K(o=-0.78,f=-2.4) USER MOD Set 2.2: A 32 ASN : amide:sc= -0.549 K(o=-0.78,f=-3.9!) USER MOD Set 3.1: A 5 SER OG : rot 180:sc= -0.0824 USER MOD Set 3.2: A 14 HIS : no HD1:sc= -12! C(o=-12!,f=-16!) USER MOD Single : A 1 VAL N :NH3+ 154:sc= -1.16 (180deg=-2.43!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -0.031 X(o=-0.031,f=-0.5!) USER MOD Single : A 8 SER OG : rot 180:sc= 0.157 USER MOD Single : A 10 SER OG : rot 180:sc= 0.0797 USER MOD Single : A 15 ASN : amide:sc= 0.316 K(o=0.32,f=-0.33) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 47:sc= 0.596 USER MOD Single : A 22 THR OG1 : rot 51:sc= 0.499 USER MOD Single : A 25 SER OG : rot 76:sc= -0.837 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.188 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.44 USER MOD Single : A 30 SER OG : rot 81:sc= -0.629 USER MOD Single : A 33 SER OG : rot 102:sc= 0.109 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -90:sc= -0.372 USER MOD Single : A 40 ASN : amide:sc= -2.78 K(o=-2.8,f=-3.7!) USER MOD Single : A 41 SER OG : rot 180:sc= -0.824 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot -90:sc= -5.69! USER MOD Single : A 57 GLN : amide:sc= -6.25! C(o=-6.3!,f=-17!) USER MOD Single : A 60 LYS NZ :NH3+ -149:sc= -0.0499 (180deg=-0.475) USER MOD Single : A 63 HIS : no HD1:sc= -4.39! C(o=-4.4!,f=-3.6!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -24:sc= 0.347 USER MOD Single : A 68 ASN : amide:sc= -0.0296 K(o=-0.03,f=-1.5) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= -0.0242 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -4:sc= 0.465! USER MOD Single : A 79 TYR OH : rot 154:sc= -7.53! USER MOD Single : A 80 SER OG : rot 18:sc= 0.963 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -2.4 K(o=-2.4,f=-11!) USER MOD Single : A 84 ASN : amide:sc= -0.834 K(o=-0.83,f=-5.8!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -116:sc= 0.371 (180deg=0) USER MOD Single : A 96 SER OG : rot -60:sc= 0.409 USER MOD Single : A 98 SER OG : rot 62:sc= -1.47 USER MOD Single : A 99 SER OG : rot 180:sc= -0.21 USER MOD Single : A 100 SER OG : rot -5:sc= 0.695! USER MOD Single : A 101 SER OG : rot -114:sc= 0.501 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 160:sc= -0.0241 USER MOD Single : A 107 ASN : amide:sc= -6.22! C(o=-6.2!,f=-3.6!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.959! USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 15.546 -16.645 -36.929 1.00 0.00 N ATOM 2 CA VAL A 1 15.190 -15.564 -35.965 1.00 0.00 C ATOM 3 C VAL A 1 16.341 -15.334 -34.983 1.00 0.00 C ATOM 4 O VAL A 1 17.143 -16.212 -34.733 1.00 0.00 O ATOM 5 CB VAL A 1 13.952 -16.078 -35.231 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.739 -16.007 -36.160 1.00 0.00 C ATOM 7 CG2 VAL A 1 14.180 -17.529 -34.801 1.00 0.00 C ATOM 0 H1 VAL A 1 14.678 -17.096 -37.281 1.00 0.00 H new ATOM 0 H2 VAL A 1 16.073 -16.238 -37.728 1.00 0.00 H new ATOM 0 H3 VAL A 1 16.136 -17.356 -36.451 1.00 0.00 H new ATOM 0 HA VAL A 1 15.001 -14.612 -36.462 1.00 0.00 H new ATOM 0 HB VAL A 1 13.771 -15.461 -34.351 1.00 0.00 H new ATOM 0 HG11 VAL A 1 11.857 -16.374 -35.635 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.575 -14.974 -36.466 1.00 0.00 H new ATOM 0 HG13 VAL A 1 12.919 -16.623 -37.041 1.00 0.00 H new ATOM 0 HG21 VAL A 1 13.297 -17.896 -34.277 1.00 0.00 H new ATOM 0 HG22 VAL A 1 14.362 -18.145 -35.682 1.00 0.00 H new ATOM 0 HG23 VAL A 1 15.043 -17.580 -34.137 1.00 0.00 H new ATOM 19 N LYS A 2 16.427 -14.158 -34.422 1.00 0.00 N ATOM 20 CA LYS A 2 17.525 -13.872 -33.454 1.00 0.00 C ATOM 21 C LYS A 2 16.970 -13.155 -32.219 1.00 0.00 C ATOM 22 O LYS A 2 16.132 -12.281 -32.321 1.00 0.00 O ATOM 23 CB LYS A 2 18.500 -12.967 -34.211 1.00 0.00 C ATOM 24 CG LYS A 2 17.764 -11.723 -34.714 1.00 0.00 C ATOM 25 CD LYS A 2 18.089 -11.497 -36.192 1.00 0.00 C ATOM 26 CE LYS A 2 17.679 -10.077 -36.594 1.00 0.00 C ATOM 27 NZ LYS A 2 18.962 -9.336 -36.748 1.00 0.00 N ATOM 0 H LYS A 2 15.785 -13.384 -34.592 1.00 0.00 H new ATOM 0 HA LYS A 2 18.009 -14.782 -33.100 1.00 0.00 H new ATOM 0 HB2 LYS A 2 19.323 -12.676 -33.558 1.00 0.00 H new ATOM 0 HB3 LYS A 2 18.936 -13.508 -35.051 1.00 0.00 H new ATOM 0 HG2 LYS A 2 16.689 -11.846 -34.582 1.00 0.00 H new ATOM 0 HG3 LYS A 2 18.059 -10.852 -34.129 1.00 0.00 H new ATOM 0 HD2 LYS A 2 19.155 -11.643 -36.367 1.00 0.00 H new ATOM 0 HD3 LYS A 2 17.562 -12.227 -36.807 1.00 0.00 H new ATOM 0 HE2 LYS A 2 17.110 -10.079 -37.524 1.00 0.00 H new ATOM 0 HE3 LYS A 2 17.047 -9.618 -35.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 18.764 -8.353 -37.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 19.479 -9.346 -35.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 19.540 -9.792 -37.483 1.00 0.00 H new ATOM 41 N CYS A 3 17.431 -13.521 -31.054 1.00 0.00 N ATOM 42 CA CYS A 3 16.931 -12.864 -29.811 1.00 0.00 C ATOM 43 C CYS A 3 18.014 -11.951 -29.225 1.00 0.00 C ATOM 44 O CYS A 3 18.919 -12.397 -28.550 1.00 0.00 O ATOM 45 CB CYS A 3 16.616 -14.017 -28.855 1.00 0.00 C ATOM 46 SG CYS A 3 14.823 -14.199 -28.691 1.00 0.00 S ATOM 0 H CYS A 3 18.133 -14.247 -30.908 1.00 0.00 H new ATOM 0 HA CYS A 3 16.057 -12.239 -29.993 1.00 0.00 H new ATOM 0 HB2 CYS A 3 17.053 -14.943 -29.230 1.00 0.00 H new ATOM 0 HB3 CYS A 3 17.063 -13.826 -27.879 1.00 0.00 H new ATOM 51 N GLN A 4 17.929 -10.675 -29.476 1.00 0.00 N ATOM 52 CA GLN A 4 18.955 -9.741 -28.929 1.00 0.00 C ATOM 53 C GLN A 4 18.539 -9.265 -27.536 1.00 0.00 C ATOM 54 O GLN A 4 17.484 -9.610 -27.042 1.00 0.00 O ATOM 55 CB GLN A 4 18.995 -8.571 -29.913 1.00 0.00 C ATOM 56 CG GLN A 4 19.155 -9.107 -31.338 1.00 0.00 C ATOM 57 CD GLN A 4 19.757 -8.021 -32.232 1.00 0.00 C ATOM 58 OE1 GLN A 4 20.655 -8.285 -33.007 1.00 0.00 O ATOM 59 NE2 GLN A 4 19.295 -6.803 -32.160 1.00 0.00 N ATOM 0 H GLN A 4 17.196 -10.238 -30.035 1.00 0.00 H new ATOM 0 HA GLN A 4 19.932 -10.212 -28.825 1.00 0.00 H new ATOM 0 HB2 GLN A 4 18.080 -7.985 -29.834 1.00 0.00 H new ATOM 0 HB3 GLN A 4 19.822 -7.905 -29.669 1.00 0.00 H new ATOM 0 HG2 GLN A 4 19.798 -9.987 -31.336 1.00 0.00 H new ATOM 0 HG3 GLN A 4 18.187 -9.420 -31.730 1.00 0.00 H new ATOM 0 HE21 GLN A 4 18.541 -6.581 -31.510 1.00 0.00 H new ATOM 0 HE22 GLN A 4 19.688 -6.073 -32.754 1.00 0.00 H new ATOM 68 N SER A 5 19.367 -8.482 -26.900 1.00 0.00 N ATOM 69 CA SER A 5 19.035 -7.980 -25.533 1.00 0.00 C ATOM 70 C SER A 5 17.546 -7.631 -25.434 1.00 0.00 C ATOM 71 O SER A 5 16.985 -7.039 -26.334 1.00 0.00 O ATOM 72 CB SER A 5 19.895 -6.730 -25.356 1.00 0.00 C ATOM 73 OG SER A 5 19.093 -5.575 -25.567 1.00 0.00 O ATOM 0 H SER A 5 20.264 -8.166 -27.269 1.00 0.00 H new ATOM 0 HA SER A 5 19.231 -8.725 -24.762 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.326 -6.710 -24.355 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.726 -6.744 -26.061 1.00 0.00 H new ATOM 0 HG SER A 5 19.641 -4.771 -25.453 1.00 0.00 H new ATOM 79 N PRO A 6 16.955 -8.024 -24.336 1.00 0.00 N ATOM 80 CA PRO A 6 15.508 -7.767 -24.104 1.00 0.00 C ATOM 81 C PRO A 6 15.254 -6.281 -23.840 1.00 0.00 C ATOM 82 O PRO A 6 16.144 -5.560 -23.441 1.00 0.00 O ATOM 83 CB PRO A 6 15.203 -8.583 -22.851 1.00 0.00 C ATOM 84 CG PRO A 6 16.512 -8.696 -22.143 1.00 0.00 C ATOM 85 CD PRO A 6 17.571 -8.741 -23.213 1.00 0.00 C ATOM 0 HA PRO A 6 14.888 -8.036 -24.959 1.00 0.00 H new ATOM 0 HB2 PRO A 6 14.458 -8.088 -22.228 1.00 0.00 H new ATOM 0 HB3 PRO A 6 14.805 -9.565 -23.106 1.00 0.00 H new ATOM 0 HG2 PRO A 6 16.668 -7.847 -21.477 1.00 0.00 H new ATOM 0 HG3 PRO A 6 16.544 -9.594 -21.527 1.00 0.00 H new ATOM 0 HD2 PRO A 6 18.492 -8.259 -22.886 1.00 0.00 H new ATOM 0 HD3 PRO A 6 17.826 -9.766 -23.483 1.00 0.00 H new ATOM 93 N PRO A 7 14.036 -5.874 -24.059 1.00 0.00 N ATOM 94 CA PRO A 7 13.656 -4.463 -23.823 1.00 0.00 C ATOM 95 C PRO A 7 13.525 -4.204 -22.320 1.00 0.00 C ATOM 96 O PRO A 7 13.556 -5.118 -21.519 1.00 0.00 O ATOM 97 CB PRO A 7 12.304 -4.333 -24.515 1.00 0.00 C ATOM 98 CG PRO A 7 11.743 -5.721 -24.542 1.00 0.00 C ATOM 99 CD PRO A 7 12.910 -6.679 -24.545 1.00 0.00 C ATOM 0 HA PRO A 7 14.388 -3.749 -24.200 1.00 0.00 H new ATOM 0 HB2 PRO A 7 11.647 -3.653 -23.972 1.00 0.00 H new ATOM 0 HB3 PRO A 7 12.414 -3.933 -25.523 1.00 0.00 H new ATOM 0 HG2 PRO A 7 11.106 -5.895 -23.675 1.00 0.00 H new ATOM 0 HG3 PRO A 7 11.124 -5.868 -25.427 1.00 0.00 H new ATOM 0 HD2 PRO A 7 12.724 -7.536 -23.897 1.00 0.00 H new ATOM 0 HD3 PRO A 7 13.102 -7.070 -25.544 1.00 0.00 H new ATOM 107 N SER A 8 13.373 -2.970 -21.930 1.00 0.00 N ATOM 108 CA SER A 8 13.234 -2.666 -20.477 1.00 0.00 C ATOM 109 C SER A 8 11.889 -3.183 -19.970 1.00 0.00 C ATOM 110 O SER A 8 11.074 -3.667 -20.729 1.00 0.00 O ATOM 111 CB SER A 8 13.301 -1.142 -20.373 1.00 0.00 C ATOM 112 OG SER A 8 13.661 -0.594 -21.636 1.00 0.00 O ATOM 0 H SER A 8 13.339 -2.161 -22.550 1.00 0.00 H new ATOM 0 HA SER A 8 14.010 -3.141 -19.877 1.00 0.00 H new ATOM 0 HB2 SER A 8 12.337 -0.746 -20.055 1.00 0.00 H new ATOM 0 HB3 SER A 8 14.030 -0.850 -19.617 1.00 0.00 H new ATOM 0 HG SER A 8 13.702 0.383 -21.569 1.00 0.00 H new ATOM 118 N ILE A 9 11.645 -3.082 -18.694 1.00 0.00 N ATOM 119 CA ILE A 9 10.342 -3.571 -18.152 1.00 0.00 C ATOM 120 C ILE A 9 9.778 -2.617 -17.121 1.00 0.00 C ATOM 121 O ILE A 9 10.244 -1.510 -16.942 1.00 0.00 O ATOM 122 CB ILE A 9 10.597 -4.929 -17.496 1.00 0.00 C ATOM 123 CG1 ILE A 9 12.019 -5.023 -16.928 1.00 0.00 C ATOM 124 CG2 ILE A 9 10.378 -6.020 -18.530 1.00 0.00 C ATOM 125 CD1 ILE A 9 11.939 -5.469 -15.467 1.00 0.00 C ATOM 0 H ILE A 9 12.284 -2.686 -18.005 1.00 0.00 H new ATOM 0 HA ILE A 9 9.618 -3.647 -18.963 1.00 0.00 H new ATOM 0 HB ILE A 9 9.904 -5.051 -16.664 1.00 0.00 H new ATOM 0 HG12 ILE A 9 12.610 -5.732 -17.507 1.00 0.00 H new ATOM 0 HG13 ILE A 9 12.519 -4.057 -17.001 1.00 0.00 H new ATOM 0 HG21 ILE A 9 10.557 -6.994 -18.075 1.00 0.00 H new ATOM 0 HG22 ILE A 9 9.352 -5.973 -18.896 1.00 0.00 H new ATOM 0 HG23 ILE A 9 11.067 -5.876 -19.362 1.00 0.00 H new ATOM 0 HD11 ILE A 9 12.945 -5.539 -15.052 1.00 0.00 H new ATOM 0 HD12 ILE A 9 11.361 -4.742 -14.896 1.00 0.00 H new ATOM 0 HD13 ILE A 9 11.454 -6.444 -15.410 1.00 0.00 H new ATOM 137 N SER A 10 8.756 -3.054 -16.457 1.00 0.00 N ATOM 138 CA SER A 10 8.107 -2.203 -15.437 1.00 0.00 C ATOM 139 C SER A 10 9.152 -1.550 -14.528 1.00 0.00 C ATOM 140 O SER A 10 9.526 -2.094 -13.509 1.00 0.00 O ATOM 141 CB SER A 10 7.209 -3.147 -14.638 1.00 0.00 C ATOM 142 OG SER A 10 7.753 -4.460 -14.681 1.00 0.00 O ATOM 0 H SER A 10 8.337 -3.976 -16.579 1.00 0.00 H new ATOM 0 HA SER A 10 7.540 -1.389 -15.890 1.00 0.00 H new ATOM 0 HB2 SER A 10 7.131 -2.807 -13.605 1.00 0.00 H new ATOM 0 HB3 SER A 10 6.200 -3.145 -15.051 1.00 0.00 H new ATOM 0 HG SER A 10 7.181 -5.068 -14.168 1.00 0.00 H new ATOM 148 N ASN A 11 9.621 -0.386 -14.885 1.00 0.00 N ATOM 149 CA ASN A 11 10.637 0.298 -14.035 1.00 0.00 C ATOM 150 C ASN A 11 11.758 -0.677 -13.663 1.00 0.00 C ATOM 151 O ASN A 11 12.137 -0.791 -12.515 1.00 0.00 O ATOM 152 CB ASN A 11 9.874 0.734 -12.784 1.00 0.00 C ATOM 153 CG ASN A 11 9.937 2.256 -12.649 1.00 0.00 C ATOM 154 OD1 ASN A 11 10.359 2.770 -11.632 1.00 0.00 O ATOM 155 ND2 ASN A 11 9.532 3.003 -13.638 1.00 0.00 N ATOM 0 H ASN A 11 9.346 0.120 -15.727 1.00 0.00 H new ATOM 0 HA ASN A 11 11.104 1.140 -14.546 1.00 0.00 H new ATOM 0 HB2 ASN A 11 8.836 0.407 -12.846 1.00 0.00 H new ATOM 0 HB3 ASN A 11 10.304 0.262 -11.901 1.00 0.00 H new ATOM 0 HD21 ASN A 11 9.569 4.019 -13.558 1.00 0.00 H new ATOM 0 HD22 ASN A 11 9.178 2.571 -14.492 1.00 0.00 H new ATOM 162 N GLY A 12 12.290 -1.382 -14.624 1.00 0.00 N ATOM 163 CA GLY A 12 13.383 -2.347 -14.317 1.00 0.00 C ATOM 164 C GLY A 12 14.344 -2.433 -15.504 1.00 0.00 C ATOM 165 O GLY A 12 14.038 -2.002 -16.598 1.00 0.00 O ATOM 0 H GLY A 12 12.016 -1.332 -15.605 1.00 0.00 H new ATOM 0 HA2 GLY A 12 13.921 -2.030 -13.424 1.00 0.00 H new ATOM 0 HA3 GLY A 12 12.964 -3.330 -14.104 1.00 0.00 H new ATOM 169 N ARG A 13 15.507 -2.988 -15.293 1.00 0.00 N ATOM 170 CA ARG A 13 16.495 -3.105 -16.403 1.00 0.00 C ATOM 171 C ARG A 13 16.655 -4.559 -16.824 1.00 0.00 C ATOM 172 O ARG A 13 15.909 -5.431 -16.425 1.00 0.00 O ATOM 173 CB ARG A 13 17.808 -2.574 -15.830 1.00 0.00 C ATOM 174 CG ARG A 13 18.101 -1.191 -16.414 1.00 0.00 C ATOM 175 CD ARG A 13 18.069 -0.144 -15.297 1.00 0.00 C ATOM 176 NE ARG A 13 17.461 1.064 -15.921 1.00 0.00 N ATOM 177 CZ ARG A 13 18.128 1.746 -16.812 1.00 0.00 C ATOM 178 NH1 ARG A 13 18.942 2.695 -16.434 1.00 0.00 N ATOM 179 NH2 ARG A 13 17.979 1.482 -18.081 1.00 0.00 N ATOM 0 H ARG A 13 15.816 -3.366 -14.397 1.00 0.00 H new ATOM 0 HA ARG A 13 16.179 -2.550 -17.287 1.00 0.00 H new ATOM 0 HB2 ARG A 13 17.745 -2.515 -14.743 1.00 0.00 H new ATOM 0 HB3 ARG A 13 18.622 -3.259 -16.065 1.00 0.00 H new ATOM 0 HG2 ARG A 13 19.077 -1.190 -16.900 1.00 0.00 H new ATOM 0 HG3 ARG A 13 17.364 -0.944 -17.178 1.00 0.00 H new ATOM 0 HD2 ARG A 13 17.479 -0.490 -14.448 1.00 0.00 H new ATOM 0 HD3 ARG A 13 19.071 0.066 -14.924 1.00 0.00 H new ATOM 0 HE ARG A 13 16.522 1.359 -15.652 1.00 0.00 H new ATOM 0 HH11 ARG A 13 19.057 2.903 -15.442 1.00 0.00 H new ATOM 0 HH12 ARG A 13 19.463 3.228 -17.131 1.00 0.00 H new ATOM 0 HH21 ARG A 13 17.341 0.743 -18.377 1.00 0.00 H new ATOM 0 HH22 ARG A 13 18.500 2.015 -18.777 1.00 0.00 H new ATOM 193 N HIS A 14 17.630 -4.811 -17.638 1.00 0.00 N ATOM 194 CA HIS A 14 17.876 -6.198 -18.122 1.00 0.00 C ATOM 195 C HIS A 14 19.322 -6.333 -18.612 1.00 0.00 C ATOM 196 O HIS A 14 19.755 -5.627 -19.502 1.00 0.00 O ATOM 197 CB HIS A 14 16.881 -6.388 -19.268 1.00 0.00 C ATOM 198 CG HIS A 14 17.397 -5.722 -20.511 1.00 0.00 C ATOM 199 ND1 HIS A 14 18.213 -6.385 -21.409 1.00 0.00 N ATOM 200 CD2 HIS A 14 17.204 -4.467 -21.032 1.00 0.00 C ATOM 201 CE1 HIS A 14 18.473 -5.544 -22.421 1.00 0.00 C ATOM 202 NE2 HIS A 14 17.886 -4.356 -22.242 1.00 0.00 N ATOM 0 H HIS A 14 18.278 -4.110 -17.996 1.00 0.00 H new ATOM 0 HA HIS A 14 17.742 -6.950 -17.344 1.00 0.00 H new ATOM 0 HB2 HIS A 14 16.725 -7.451 -19.453 1.00 0.00 H new ATOM 0 HB3 HIS A 14 15.914 -5.967 -18.994 1.00 0.00 H new ATOM 0 HD2 HIS A 14 16.615 -3.686 -20.575 1.00 0.00 H new ATOM 0 HE1 HIS A 14 19.082 -5.796 -23.276 1.00 0.00 H new ATOM 0 HE2 HIS A 14 17.928 -3.544 -22.858 1.00 0.00 H new ATOM 210 N ASN A 15 20.075 -7.229 -18.035 1.00 0.00 N ATOM 211 CA ASN A 15 21.492 -7.401 -18.468 1.00 0.00 C ATOM 212 C ASN A 15 22.025 -8.757 -18.000 1.00 0.00 C ATOM 213 O ASN A 15 22.735 -8.852 -17.018 1.00 0.00 O ATOM 214 CB ASN A 15 22.252 -6.260 -17.791 1.00 0.00 C ATOM 215 CG ASN A 15 23.679 -6.198 -18.339 1.00 0.00 C ATOM 216 OD1 ASN A 15 24.036 -5.266 -19.031 1.00 0.00 O ATOM 217 ND2 ASN A 15 24.516 -7.158 -18.056 1.00 0.00 N ATOM 0 H ASN A 15 19.772 -7.849 -17.284 1.00 0.00 H new ATOM 0 HA ASN A 15 21.601 -7.375 -19.552 1.00 0.00 H new ATOM 0 HB2 ASN A 15 21.742 -5.313 -17.969 1.00 0.00 H new ATOM 0 HB3 ASN A 15 22.272 -6.413 -16.712 1.00 0.00 H new ATOM 0 HD21 ASN A 15 25.470 -7.126 -18.416 1.00 0.00 H new ATOM 0 HD22 ASN A 15 24.217 -7.941 -17.475 1.00 0.00 H new ATOM 224 N GLY A 16 21.686 -9.808 -18.695 1.00 0.00 N ATOM 225 CA GLY A 16 22.169 -11.158 -18.290 1.00 0.00 C ATOM 226 C GLY A 16 23.680 -11.250 -18.503 1.00 0.00 C ATOM 227 O GLY A 16 24.461 -10.814 -17.681 1.00 0.00 O ATOM 0 H GLY A 16 21.095 -9.790 -19.526 1.00 0.00 H new ATOM 0 HA2 GLY A 16 21.928 -11.342 -17.243 1.00 0.00 H new ATOM 0 HA3 GLY A 16 21.662 -11.926 -18.874 1.00 0.00 H new ATOM 231 N TYR A 17 24.100 -11.820 -19.599 1.00 0.00 N ATOM 232 CA TYR A 17 25.563 -11.944 -19.859 1.00 0.00 C ATOM 233 C TYR A 17 25.835 -11.938 -21.365 1.00 0.00 C ATOM 234 O TYR A 17 26.734 -12.600 -21.843 1.00 0.00 O ATOM 235 CB TYR A 17 25.956 -13.291 -19.251 1.00 0.00 C ATOM 236 CG TYR A 17 27.302 -13.172 -18.576 1.00 0.00 C ATOM 237 CD1 TYR A 17 28.475 -13.378 -19.313 1.00 0.00 C ATOM 238 CD2 TYR A 17 27.377 -12.857 -17.214 1.00 0.00 C ATOM 239 CE1 TYR A 17 29.722 -13.269 -18.687 1.00 0.00 C ATOM 240 CE2 TYR A 17 28.625 -12.748 -16.589 1.00 0.00 C ATOM 241 CZ TYR A 17 29.798 -12.954 -17.325 1.00 0.00 C ATOM 242 OH TYR A 17 31.029 -12.846 -16.709 1.00 0.00 O ATOM 0 H TYR A 17 23.495 -12.205 -20.325 1.00 0.00 H new ATOM 0 HA TYR A 17 26.131 -11.118 -19.430 1.00 0.00 H new ATOM 0 HB2 TYR A 17 25.203 -13.609 -18.529 1.00 0.00 H new ATOM 0 HB3 TYR A 17 25.994 -14.054 -20.028 1.00 0.00 H new ATOM 0 HD1 TYR A 17 28.417 -13.621 -20.364 1.00 0.00 H new ATOM 0 HD2 TYR A 17 26.472 -12.698 -16.646 1.00 0.00 H new ATOM 0 HE1 TYR A 17 30.627 -13.428 -19.255 1.00 0.00 H new ATOM 0 HE2 TYR A 17 28.683 -12.505 -15.538 1.00 0.00 H new ATOM 0 HH TYR A 17 30.903 -12.621 -15.764 1.00 0.00 H new ATOM 252 N GLU A 18 25.069 -11.198 -22.120 1.00 0.00 N ATOM 253 CA GLU A 18 25.297 -11.162 -23.593 1.00 0.00 C ATOM 254 C GLU A 18 24.322 -10.193 -24.263 1.00 0.00 C ATOM 255 O GLU A 18 23.770 -9.312 -23.632 1.00 0.00 O ATOM 256 CB GLU A 18 25.035 -12.591 -24.068 1.00 0.00 C ATOM 257 CG GLU A 18 23.575 -12.963 -23.800 1.00 0.00 C ATOM 258 CD GLU A 18 23.494 -14.433 -23.390 1.00 0.00 C ATOM 259 OE1 GLU A 18 23.595 -15.278 -24.264 1.00 0.00 O ATOM 260 OE2 GLU A 18 23.332 -14.690 -22.208 1.00 0.00 O ATOM 0 H GLU A 18 24.299 -10.620 -21.783 1.00 0.00 H new ATOM 0 HA GLU A 18 26.302 -10.822 -23.843 1.00 0.00 H new ATOM 0 HB2 GLU A 18 25.253 -12.677 -25.133 1.00 0.00 H new ATOM 0 HB3 GLU A 18 25.698 -13.284 -23.550 1.00 0.00 H new ATOM 0 HG2 GLU A 18 23.166 -12.331 -23.012 1.00 0.00 H new ATOM 0 HG3 GLU A 18 22.974 -12.789 -24.693 1.00 0.00 H new ATOM 267 N ASP A 19 24.108 -10.351 -25.540 1.00 0.00 N ATOM 268 CA ASP A 19 23.171 -9.444 -26.262 1.00 0.00 C ATOM 269 C ASP A 19 22.746 -10.076 -27.590 1.00 0.00 C ATOM 270 O ASP A 19 22.373 -9.393 -28.523 1.00 0.00 O ATOM 271 CB ASP A 19 23.971 -8.165 -26.510 1.00 0.00 C ATOM 272 CG ASP A 19 23.358 -7.017 -25.707 1.00 0.00 C ATOM 273 OD1 ASP A 19 23.174 -7.186 -24.514 1.00 0.00 O ATOM 274 OD2 ASP A 19 23.083 -5.987 -26.301 1.00 0.00 O ATOM 0 H ASP A 19 24.543 -11.071 -26.117 1.00 0.00 H new ATOM 0 HA ASP A 19 22.261 -9.252 -25.694 1.00 0.00 H new ATOM 0 HB2 ASP A 19 25.011 -8.312 -26.219 1.00 0.00 H new ATOM 0 HB3 ASP A 19 23.968 -7.922 -27.573 1.00 0.00 H new ATOM 279 N PHE A 20 22.801 -11.377 -27.683 1.00 0.00 N ATOM 280 CA PHE A 20 22.401 -12.051 -28.952 1.00 0.00 C ATOM 281 C PHE A 20 21.626 -13.333 -28.647 1.00 0.00 C ATOM 282 O PHE A 20 21.658 -14.283 -29.401 1.00 0.00 O ATOM 283 CB PHE A 20 23.716 -12.382 -29.658 1.00 0.00 C ATOM 284 CG PHE A 20 23.934 -11.415 -30.797 1.00 0.00 C ATOM 285 CD1 PHE A 20 22.898 -11.154 -31.702 1.00 0.00 C ATOM 286 CD2 PHE A 20 25.173 -10.781 -30.950 1.00 0.00 C ATOM 287 CE1 PHE A 20 23.101 -10.259 -32.759 1.00 0.00 C ATOM 288 CE2 PHE A 20 25.375 -9.885 -32.007 1.00 0.00 C ATOM 289 CZ PHE A 20 24.339 -9.624 -32.911 1.00 0.00 C ATOM 0 H PHE A 20 23.105 -12.002 -26.936 1.00 0.00 H new ATOM 0 HA PHE A 20 21.754 -11.423 -29.565 1.00 0.00 H new ATOM 0 HB2 PHE A 20 24.545 -12.322 -28.953 1.00 0.00 H new ATOM 0 HB3 PHE A 20 23.691 -13.405 -30.035 1.00 0.00 H new ATOM 0 HD1 PHE A 20 21.942 -11.643 -31.585 1.00 0.00 H new ATOM 0 HD2 PHE A 20 25.973 -10.983 -30.253 1.00 0.00 H new ATOM 0 HE1 PHE A 20 22.302 -10.058 -33.457 1.00 0.00 H new ATOM 0 HE2 PHE A 20 26.330 -9.395 -32.125 1.00 0.00 H new ATOM 0 HZ PHE A 20 24.495 -8.933 -33.726 1.00 0.00 H new ATOM 299 N TYR A 21 20.932 -13.361 -27.543 1.00 0.00 N ATOM 300 CA TYR A 21 20.145 -14.572 -27.168 1.00 0.00 C ATOM 301 C TYR A 21 19.522 -15.226 -28.398 1.00 0.00 C ATOM 302 O TYR A 21 19.070 -14.563 -29.308 1.00 0.00 O ATOM 303 CB TYR A 21 19.064 -14.045 -26.226 1.00 0.00 C ATOM 304 CG TYR A 21 19.669 -13.803 -24.863 1.00 0.00 C ATOM 305 CD1 TYR A 21 20.191 -14.874 -24.127 1.00 0.00 C ATOM 306 CD2 TYR A 21 19.707 -12.507 -24.334 1.00 0.00 C ATOM 307 CE1 TYR A 21 20.751 -14.650 -22.864 1.00 0.00 C ATOM 308 CE2 TYR A 21 20.267 -12.283 -23.071 1.00 0.00 C ATOM 309 CZ TYR A 21 20.788 -13.354 -22.336 1.00 0.00 C ATOM 310 OH TYR A 21 21.340 -13.132 -21.090 1.00 0.00 O ATOM 0 H TYR A 21 20.875 -12.590 -26.878 1.00 0.00 H new ATOM 0 HA TYR A 21 20.765 -15.339 -26.704 1.00 0.00 H new ATOM 0 HB2 TYR A 21 18.641 -13.120 -26.619 1.00 0.00 H new ATOM 0 HB3 TYR A 21 18.247 -14.763 -26.152 1.00 0.00 H new ATOM 0 HD1 TYR A 21 20.161 -15.874 -24.534 1.00 0.00 H new ATOM 0 HD2 TYR A 21 19.304 -11.680 -24.901 1.00 0.00 H new ATOM 0 HE1 TYR A 21 21.154 -15.476 -22.297 1.00 0.00 H new ATOM 0 HE2 TYR A 21 20.297 -11.283 -22.663 1.00 0.00 H new ATOM 0 HH TYR A 21 22.201 -13.596 -21.026 1.00 0.00 H new ATOM 320 N THR A 22 19.487 -16.529 -28.431 1.00 0.00 N ATOM 321 CA THR A 22 18.876 -17.216 -29.598 1.00 0.00 C ATOM 322 C THR A 22 17.945 -18.321 -29.136 1.00 0.00 C ATOM 323 O THR A 22 18.323 -19.465 -28.984 1.00 0.00 O ATOM 324 CB THR A 22 20.001 -17.817 -30.403 1.00 0.00 C ATOM 325 OG1 THR A 22 20.846 -18.578 -29.553 1.00 0.00 O ATOM 326 CG2 THR A 22 20.805 -16.713 -31.089 1.00 0.00 C ATOM 0 H THR A 22 19.853 -17.143 -27.704 1.00 0.00 H new ATOM 0 HA THR A 22 18.297 -16.508 -30.191 1.00 0.00 H new ATOM 0 HB THR A 22 19.581 -18.471 -31.167 1.00 0.00 H new ATOM 0 HG1 THR A 22 20.304 -19.201 -29.026 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.615 -17.158 -31.667 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.152 -16.147 -31.754 1.00 0.00 H new ATOM 0 HG23 THR A 22 21.222 -16.045 -30.336 1.00 0.00 H new ATOM 334 N ASP A 23 16.729 -17.968 -28.941 1.00 0.00 N ATOM 335 CA ASP A 23 15.698 -18.958 -28.503 1.00 0.00 C ATOM 336 C ASP A 23 16.137 -19.670 -27.218 1.00 0.00 C ATOM 337 O ASP A 23 17.310 -19.817 -26.944 1.00 0.00 O ATOM 338 CB ASP A 23 15.605 -19.954 -29.658 1.00 0.00 C ATOM 339 CG ASP A 23 14.308 -19.720 -30.434 1.00 0.00 C ATOM 340 OD1 ASP A 23 14.122 -18.617 -30.920 1.00 0.00 O ATOM 341 OD2 ASP A 23 13.522 -20.649 -30.530 1.00 0.00 O ATOM 0 H ASP A 23 16.381 -17.017 -29.065 1.00 0.00 H new ATOM 0 HA ASP A 23 14.742 -18.484 -28.283 1.00 0.00 H new ATOM 0 HB2 ASP A 23 16.463 -19.839 -30.321 1.00 0.00 H new ATOM 0 HB3 ASP A 23 15.632 -20.974 -29.275 1.00 0.00 H new ATOM 346 N GLY A 24 15.199 -20.112 -26.426 1.00 0.00 N ATOM 347 CA GLY A 24 15.562 -20.813 -25.162 1.00 0.00 C ATOM 348 C GLY A 24 16.518 -19.937 -24.356 1.00 0.00 C ATOM 349 O GLY A 24 17.223 -20.406 -23.485 1.00 0.00 O ATOM 0 H GLY A 24 14.198 -20.018 -26.599 1.00 0.00 H new ATOM 0 HA2 GLY A 24 14.665 -21.024 -24.579 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.030 -21.772 -25.386 1.00 0.00 H new ATOM 353 N SER A 25 16.544 -18.665 -24.639 1.00 0.00 N ATOM 354 CA SER A 25 17.449 -17.753 -23.889 1.00 0.00 C ATOM 355 C SER A 25 16.755 -17.250 -22.633 1.00 0.00 C ATOM 356 O SER A 25 15.609 -17.557 -22.380 1.00 0.00 O ATOM 357 CB SER A 25 17.713 -16.589 -24.837 1.00 0.00 C ATOM 358 OG SER A 25 18.698 -16.967 -25.790 1.00 0.00 O ATOM 0 H SER A 25 15.976 -18.217 -25.359 1.00 0.00 H new ATOM 0 HA SER A 25 18.369 -18.250 -23.579 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.792 -16.303 -25.344 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.051 -15.718 -24.275 1.00 0.00 H new ATOM 0 HG SER A 25 18.295 -17.556 -26.461 1.00 0.00 H new ATOM 364 N VAL A 26 17.439 -16.473 -21.849 1.00 0.00 N ATOM 365 CA VAL A 26 16.811 -15.941 -20.613 1.00 0.00 C ATOM 366 C VAL A 26 17.546 -14.688 -20.151 1.00 0.00 C ATOM 367 O VAL A 26 18.697 -14.477 -20.477 1.00 0.00 O ATOM 368 CB VAL A 26 16.942 -17.062 -19.582 1.00 0.00 C ATOM 369 CG1 VAL A 26 16.684 -16.507 -18.180 1.00 0.00 C ATOM 370 CG2 VAL A 26 15.920 -18.153 -19.893 1.00 0.00 C ATOM 0 H VAL A 26 18.404 -16.183 -22.009 1.00 0.00 H new ATOM 0 HA VAL A 26 15.770 -15.658 -20.766 1.00 0.00 H new ATOM 0 HB VAL A 26 17.949 -17.478 -19.624 1.00 0.00 H new ATOM 0 HG11 VAL A 26 16.778 -17.309 -17.448 1.00 0.00 H new ATOM 0 HG12 VAL A 26 17.411 -15.726 -17.958 1.00 0.00 H new ATOM 0 HG13 VAL A 26 15.678 -16.090 -18.133 1.00 0.00 H new ATOM 0 HG21 VAL A 26 16.010 -18.955 -19.160 1.00 0.00 H new ATOM 0 HG22 VAL A 26 14.915 -17.733 -19.850 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.105 -18.551 -20.891 1.00 0.00 H new ATOM 380 N VAL A 27 16.893 -13.847 -19.402 1.00 0.00 N ATOM 381 CA VAL A 27 17.578 -12.605 -18.943 1.00 0.00 C ATOM 382 C VAL A 27 17.140 -12.204 -17.547 1.00 0.00 C ATOM 383 O VAL A 27 15.976 -11.985 -17.286 1.00 0.00 O ATOM 384 CB VAL A 27 17.160 -11.535 -19.944 1.00 0.00 C ATOM 385 CG1 VAL A 27 17.481 -10.143 -19.392 1.00 0.00 C ATOM 386 CG2 VAL A 27 17.927 -11.754 -21.229 1.00 0.00 C ATOM 0 H VAL A 27 15.929 -13.961 -19.090 1.00 0.00 H new ATOM 0 HA VAL A 27 18.658 -12.746 -18.896 1.00 0.00 H new ATOM 0 HB VAL A 27 16.087 -11.602 -20.126 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.178 -9.386 -20.115 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.941 -9.989 -18.458 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.553 -10.062 -19.209 1.00 0.00 H new ATOM 0 HG21 VAL A 27 17.640 -10.996 -21.958 1.00 0.00 H new ATOM 0 HG22 VAL A 27 18.996 -11.681 -21.031 1.00 0.00 H new ATOM 0 HG23 VAL A 27 17.698 -12.743 -21.625 1.00 0.00 H new ATOM 396 N THR A 28 18.064 -12.062 -16.651 1.00 0.00 N ATOM 397 CA THR A 28 17.669 -11.627 -15.300 1.00 0.00 C ATOM 398 C THR A 28 17.371 -10.136 -15.362 1.00 0.00 C ATOM 399 O THR A 28 18.263 -9.311 -15.399 1.00 0.00 O ATOM 400 CB THR A 28 18.858 -11.921 -14.388 1.00 0.00 C ATOM 401 OG1 THR A 28 19.871 -12.591 -15.126 1.00 0.00 O ATOM 402 CG2 THR A 28 18.394 -12.804 -13.233 1.00 0.00 C ATOM 0 H THR A 28 19.061 -12.226 -16.794 1.00 0.00 H new ATOM 0 HA THR A 28 16.783 -12.139 -14.925 1.00 0.00 H new ATOM 0 HB THR A 28 19.261 -10.987 -13.996 1.00 0.00 H new ATOM 0 HG1 THR A 28 20.634 -12.777 -14.540 1.00 0.00 H new ATOM 0 HG21 THR A 28 19.238 -13.018 -12.577 1.00 0.00 H new ATOM 0 HG22 THR A 28 17.618 -12.287 -12.669 1.00 0.00 H new ATOM 0 HG23 THR A 28 17.994 -13.738 -13.627 1.00 0.00 H new ATOM 410 N TYR A 29 16.122 -9.787 -15.408 1.00 0.00 N ATOM 411 CA TYR A 29 15.759 -8.351 -15.510 1.00 0.00 C ATOM 412 C TYR A 29 16.125 -7.615 -14.220 1.00 0.00 C ATOM 413 O TYR A 29 15.742 -8.015 -13.140 1.00 0.00 O ATOM 414 CB TYR A 29 14.238 -8.345 -15.680 1.00 0.00 C ATOM 415 CG TYR A 29 13.837 -8.386 -17.140 1.00 0.00 C ATOM 416 CD1 TYR A 29 14.797 -8.359 -18.164 1.00 0.00 C ATOM 417 CD2 TYR A 29 12.476 -8.453 -17.465 1.00 0.00 C ATOM 418 CE1 TYR A 29 14.392 -8.396 -19.501 1.00 0.00 C ATOM 419 CE2 TYR A 29 12.073 -8.489 -18.802 1.00 0.00 C ATOM 420 CZ TYR A 29 13.030 -8.460 -19.822 1.00 0.00 C ATOM 421 OH TYR A 29 12.633 -8.495 -21.143 1.00 0.00 O ATOM 0 H TYR A 29 15.334 -10.434 -15.379 1.00 0.00 H new ATOM 0 HA TYR A 29 16.281 -7.858 -16.330 1.00 0.00 H new ATOM 0 HB2 TYR A 29 13.811 -9.203 -15.161 1.00 0.00 H new ATOM 0 HB3 TYR A 29 13.823 -7.451 -15.214 1.00 0.00 H new ATOM 0 HD1 TYR A 29 15.848 -8.310 -17.919 1.00 0.00 H new ATOM 0 HD2 TYR A 29 11.736 -8.477 -16.679 1.00 0.00 H new ATOM 0 HE1 TYR A 29 15.131 -8.375 -20.289 1.00 0.00 H new ATOM 0 HE2 TYR A 29 11.023 -8.539 -19.048 1.00 0.00 H new ATOM 0 HH TYR A 29 11.655 -8.540 -21.190 1.00 0.00 H new ATOM 431 N SER A 30 16.843 -6.532 -14.323 1.00 0.00 N ATOM 432 CA SER A 30 17.201 -5.769 -13.096 1.00 0.00 C ATOM 433 C SER A 30 15.990 -4.948 -12.653 1.00 0.00 C ATOM 434 O SER A 30 14.918 -5.067 -13.211 1.00 0.00 O ATOM 435 CB SER A 30 18.352 -4.853 -13.508 1.00 0.00 C ATOM 436 OG SER A 30 18.404 -3.738 -12.626 1.00 0.00 O ATOM 0 H SER A 30 17.195 -6.144 -15.198 1.00 0.00 H new ATOM 0 HA SER A 30 17.489 -6.413 -12.266 1.00 0.00 H new ATOM 0 HB2 SER A 30 19.295 -5.399 -13.478 1.00 0.00 H new ATOM 0 HB3 SER A 30 18.212 -4.513 -14.534 1.00 0.00 H new ATOM 0 HG SER A 30 18.865 -3.995 -11.800 1.00 0.00 H new ATOM 442 N CYS A 31 16.145 -4.115 -11.666 1.00 0.00 N ATOM 443 CA CYS A 31 14.988 -3.292 -11.206 1.00 0.00 C ATOM 444 C CYS A 31 15.474 -1.931 -10.700 1.00 0.00 C ATOM 445 O CYS A 31 16.654 -1.713 -10.511 1.00 0.00 O ATOM 446 CB CYS A 31 14.352 -4.092 -10.068 1.00 0.00 C ATOM 447 SG CYS A 31 13.542 -5.569 -10.736 1.00 0.00 S ATOM 0 H CYS A 31 17.017 -3.966 -11.158 1.00 0.00 H new ATOM 0 HA CYS A 31 14.278 -3.097 -12.010 1.00 0.00 H new ATOM 0 HB2 CYS A 31 15.114 -4.380 -9.343 1.00 0.00 H new ATOM 0 HB3 CYS A 31 13.626 -3.475 -9.539 1.00 0.00 H new ATOM 452 N ASN A 32 14.572 -1.012 -10.484 1.00 0.00 N ATOM 453 CA ASN A 32 14.982 0.336 -9.994 1.00 0.00 C ATOM 454 C ASN A 32 15.677 0.222 -8.636 1.00 0.00 C ATOM 455 O ASN A 32 15.373 -0.646 -7.841 1.00 0.00 O ATOM 456 CB ASN A 32 13.680 1.126 -9.863 1.00 0.00 C ATOM 457 CG ASN A 32 13.816 2.458 -10.601 1.00 0.00 C ATOM 458 OD1 ASN A 32 14.798 2.695 -11.275 1.00 0.00 O ATOM 459 ND2 ASN A 32 12.864 3.345 -10.501 1.00 0.00 N ATOM 0 H ASN A 32 13.569 -1.136 -10.625 1.00 0.00 H new ATOM 0 HA ASN A 32 15.687 0.820 -10.670 1.00 0.00 H new ATOM 0 HB2 ASN A 32 12.851 0.552 -10.276 1.00 0.00 H new ATOM 0 HB3 ASN A 32 13.453 1.302 -8.812 1.00 0.00 H new ATOM 0 HD21 ASN A 32 12.945 4.237 -10.989 1.00 0.00 H new ATOM 0 HD22 ASN A 32 12.039 3.146 -9.935 1.00 0.00 H new ATOM 466 N SER A 33 16.605 1.096 -8.363 1.00 0.00 N ATOM 467 CA SER A 33 17.317 1.044 -7.055 1.00 0.00 C ATOM 468 C SER A 33 16.312 1.172 -5.907 1.00 0.00 C ATOM 469 O SER A 33 15.955 2.260 -5.501 1.00 0.00 O ATOM 470 CB SER A 33 18.266 2.242 -7.073 1.00 0.00 C ATOM 471 OG SER A 33 18.632 2.532 -8.416 1.00 0.00 O ATOM 0 H SER A 33 16.902 1.845 -8.989 1.00 0.00 H new ATOM 0 HA SER A 33 17.851 0.105 -6.910 1.00 0.00 H new ATOM 0 HB2 SER A 33 17.785 3.109 -6.620 1.00 0.00 H new ATOM 0 HB3 SER A 33 19.155 2.025 -6.481 1.00 0.00 H new ATOM 0 HG SER A 33 18.117 3.302 -8.736 1.00 0.00 H new ATOM 477 N GLY A 34 15.851 0.069 -5.382 1.00 0.00 N ATOM 478 CA GLY A 34 14.869 0.131 -4.261 1.00 0.00 C ATOM 479 C GLY A 34 13.632 -0.697 -4.615 1.00 0.00 C ATOM 480 O GLY A 34 12.692 -0.784 -3.849 1.00 0.00 O ATOM 0 H GLY A 34 16.111 -0.871 -5.680 1.00 0.00 H new ATOM 0 HA2 GLY A 34 15.323 -0.248 -3.345 1.00 0.00 H new ATOM 0 HA3 GLY A 34 14.584 1.166 -4.071 1.00 0.00 H new ATOM 484 N TYR A 35 13.622 -1.302 -5.770 1.00 0.00 N ATOM 485 CA TYR A 35 12.445 -2.121 -6.177 1.00 0.00 C ATOM 486 C TYR A 35 12.816 -3.608 -6.203 1.00 0.00 C ATOM 487 O TYR A 35 13.898 -3.981 -6.612 1.00 0.00 O ATOM 488 CB TYR A 35 12.095 -1.626 -7.581 1.00 0.00 C ATOM 489 CG TYR A 35 11.172 -0.435 -7.478 1.00 0.00 C ATOM 490 CD1 TYR A 35 11.674 0.808 -7.073 1.00 0.00 C ATOM 491 CD2 TYR A 35 9.815 -0.575 -7.784 1.00 0.00 C ATOM 492 CE1 TYR A 35 10.816 1.911 -6.976 1.00 0.00 C ATOM 493 CE2 TYR A 35 8.957 0.527 -7.687 1.00 0.00 C ATOM 494 CZ TYR A 35 9.457 1.770 -7.283 1.00 0.00 C ATOM 495 OH TYR A 35 8.612 2.856 -7.186 1.00 0.00 O ATOM 0 H TYR A 35 14.380 -1.265 -6.452 1.00 0.00 H new ATOM 0 HA TYR A 35 11.608 -2.020 -5.487 1.00 0.00 H new ATOM 0 HB2 TYR A 35 13.003 -1.351 -8.118 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.616 -2.423 -8.151 1.00 0.00 H new ATOM 0 HD1 TYR A 35 12.722 0.916 -6.836 1.00 0.00 H new ATOM 0 HD2 TYR A 35 9.428 -1.534 -8.095 1.00 0.00 H new ATOM 0 HE1 TYR A 35 11.203 2.870 -6.664 1.00 0.00 H new ATOM 0 HE2 TYR A 35 7.909 0.418 -7.924 1.00 0.00 H new ATOM 0 HH TYR A 35 7.703 2.587 -7.435 1.00 0.00 H new ATOM 505 N SER A 36 11.926 -4.459 -5.768 1.00 0.00 N ATOM 506 CA SER A 36 12.227 -5.921 -5.766 1.00 0.00 C ATOM 507 C SER A 36 11.851 -6.549 -7.105 1.00 0.00 C ATOM 508 O SER A 36 10.889 -6.161 -7.738 1.00 0.00 O ATOM 509 CB SER A 36 11.365 -6.500 -4.654 1.00 0.00 C ATOM 510 OG SER A 36 12.154 -7.371 -3.854 1.00 0.00 O ATOM 0 H SER A 36 11.004 -4.206 -5.414 1.00 0.00 H new ATOM 0 HA SER A 36 13.288 -6.117 -5.611 1.00 0.00 H new ATOM 0 HB2 SER A 36 10.954 -5.698 -4.042 1.00 0.00 H new ATOM 0 HB3 SER A 36 10.520 -7.042 -5.078 1.00 0.00 H new ATOM 0 HG SER A 36 12.106 -8.281 -4.215 1.00 0.00 H new ATOM 516 N LEU A 37 12.598 -7.525 -7.538 1.00 0.00 N ATOM 517 CA LEU A 37 12.275 -8.183 -8.832 1.00 0.00 C ATOM 518 C LEU A 37 11.367 -9.390 -8.591 1.00 0.00 C ATOM 519 O LEU A 37 11.814 -10.441 -8.177 1.00 0.00 O ATOM 520 CB LEU A 37 13.617 -8.635 -9.411 1.00 0.00 C ATOM 521 CG LEU A 37 13.366 -9.469 -10.670 1.00 0.00 C ATOM 522 CD1 LEU A 37 13.554 -8.593 -11.908 1.00 0.00 C ATOM 523 CD2 LEU A 37 14.353 -10.637 -10.718 1.00 0.00 C ATOM 0 H LEU A 37 13.416 -7.894 -7.053 1.00 0.00 H new ATOM 0 HA LEU A 37 11.751 -7.511 -9.511 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.234 -7.769 -9.651 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.165 -9.222 -8.674 1.00 0.00 H new ATOM 0 HG LEU A 37 12.347 -9.856 -10.649 1.00 0.00 H new ATOM 0 HD11 LEU A 37 13.375 -9.187 -12.804 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.849 -7.762 -11.876 1.00 0.00 H new ATOM 0 HD13 LEU A 37 14.572 -8.204 -11.927 1.00 0.00 H new ATOM 0 HD21 LEU A 37 14.172 -11.229 -11.615 1.00 0.00 H new ATOM 0 HD22 LEU A 37 15.372 -10.251 -10.737 1.00 0.00 H new ATOM 0 HD23 LEU A 37 14.218 -11.264 -9.836 1.00 0.00 H new ATOM 535 N ILE A 38 10.099 -9.255 -8.864 1.00 0.00 N ATOM 536 CA ILE A 38 9.176 -10.411 -8.664 1.00 0.00 C ATOM 537 C ILE A 38 8.977 -11.120 -10.002 1.00 0.00 C ATOM 538 O ILE A 38 9.395 -10.638 -11.034 1.00 0.00 O ATOM 539 CB ILE A 38 7.829 -9.857 -8.154 1.00 0.00 C ATOM 540 CG1 ILE A 38 7.948 -8.395 -7.692 1.00 0.00 C ATOM 541 CG2 ILE A 38 7.359 -10.702 -6.976 1.00 0.00 C ATOM 542 CD1 ILE A 38 8.977 -8.291 -6.565 1.00 0.00 C ATOM 0 H ILE A 38 9.663 -8.402 -9.214 1.00 0.00 H new ATOM 0 HA ILE A 38 9.584 -11.120 -7.944 1.00 0.00 H new ATOM 0 HB ILE A 38 7.117 -9.898 -8.978 1.00 0.00 H new ATOM 0 HG12 ILE A 38 8.246 -7.763 -8.528 1.00 0.00 H new ATOM 0 HG13 ILE A 38 6.979 -8.033 -7.347 1.00 0.00 H new ATOM 0 HG21 ILE A 38 6.407 -10.317 -6.609 1.00 0.00 H new ATOM 0 HG22 ILE A 38 7.233 -11.736 -7.297 1.00 0.00 H new ATOM 0 HG23 ILE A 38 8.100 -10.658 -6.178 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.058 -7.253 -6.241 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.661 -8.910 -5.725 1.00 0.00 H new ATOM 0 HD13 ILE A 38 9.947 -8.635 -6.925 1.00 0.00 H new ATOM 554 N GLY A 39 8.348 -12.257 -10.002 1.00 0.00 N ATOM 555 CA GLY A 39 8.137 -12.978 -11.287 1.00 0.00 C ATOM 556 C GLY A 39 9.348 -13.861 -11.583 1.00 0.00 C ATOM 557 O GLY A 39 10.200 -14.067 -10.743 1.00 0.00 O ATOM 0 H GLY A 39 7.972 -12.718 -9.174 1.00 0.00 H new ATOM 0 HA2 GLY A 39 7.235 -13.587 -11.230 1.00 0.00 H new ATOM 0 HA3 GLY A 39 7.988 -12.263 -12.097 1.00 0.00 H new ATOM 561 N ASN A 40 9.431 -14.385 -12.775 1.00 0.00 N ATOM 562 CA ASN A 40 10.589 -15.254 -13.126 1.00 0.00 C ATOM 563 C ASN A 40 11.879 -14.432 -13.128 1.00 0.00 C ATOM 564 O ASN A 40 12.035 -13.510 -13.904 1.00 0.00 O ATOM 565 CB ASN A 40 10.285 -15.772 -14.532 1.00 0.00 C ATOM 566 CG ASN A 40 8.987 -16.587 -14.524 1.00 0.00 C ATOM 567 OD1 ASN A 40 8.481 -16.947 -15.568 1.00 0.00 O ATOM 568 ND2 ASN A 40 8.419 -16.897 -13.388 1.00 0.00 N ATOM 0 H ASN A 40 8.748 -14.249 -13.520 1.00 0.00 H new ATOM 0 HA ASN A 40 10.727 -16.067 -12.413 1.00 0.00 H new ATOM 0 HB2 ASN A 40 10.194 -14.935 -15.224 1.00 0.00 H new ATOM 0 HB3 ASN A 40 11.110 -16.390 -14.886 1.00 0.00 H new ATOM 0 HD21 ASN A 40 7.555 -17.439 -13.381 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.840 -16.597 -12.509 1.00 0.00 H new ATOM 575 N SER A 41 12.809 -14.760 -12.276 1.00 0.00 N ATOM 576 CA SER A 41 14.089 -13.998 -12.244 1.00 0.00 C ATOM 577 C SER A 41 14.928 -14.351 -13.472 1.00 0.00 C ATOM 578 O SER A 41 16.058 -14.786 -13.364 1.00 0.00 O ATOM 579 CB SER A 41 14.789 -14.449 -10.964 1.00 0.00 C ATOM 580 OG SER A 41 14.519 -13.516 -9.927 1.00 0.00 O ATOM 0 H SER A 41 12.739 -15.522 -11.601 1.00 0.00 H new ATOM 0 HA SER A 41 13.935 -12.919 -12.258 1.00 0.00 H new ATOM 0 HB2 SER A 41 14.441 -15.441 -10.676 1.00 0.00 H new ATOM 0 HB3 SER A 41 15.864 -14.524 -11.131 1.00 0.00 H new ATOM 0 HG SER A 41 14.966 -13.804 -9.104 1.00 0.00 H new ATOM 586 N GLY A 42 14.375 -14.174 -14.639 1.00 0.00 N ATOM 587 CA GLY A 42 15.126 -14.504 -15.882 1.00 0.00 C ATOM 588 C GLY A 42 14.142 -14.682 -17.038 1.00 0.00 C ATOM 589 O GLY A 42 13.601 -15.751 -17.239 1.00 0.00 O ATOM 0 H GLY A 42 13.432 -13.814 -14.786 1.00 0.00 H new ATOM 0 HA2 GLY A 42 15.836 -13.709 -16.113 1.00 0.00 H new ATOM 0 HA3 GLY A 42 15.705 -15.416 -15.739 1.00 0.00 H new ATOM 593 N VAL A 43 13.901 -13.644 -17.797 1.00 0.00 N ATOM 594 CA VAL A 43 12.942 -13.782 -18.945 1.00 0.00 C ATOM 595 C VAL A 43 13.302 -15.032 -19.740 1.00 0.00 C ATOM 596 O VAL A 43 14.261 -15.712 -19.436 1.00 0.00 O ATOM 597 CB VAL A 43 13.090 -12.565 -19.878 1.00 0.00 C ATOM 598 CG1 VAL A 43 11.702 -12.100 -20.316 1.00 0.00 C ATOM 599 CG2 VAL A 43 13.806 -11.400 -19.205 1.00 0.00 C ATOM 0 H VAL A 43 14.316 -12.720 -17.679 1.00 0.00 H new ATOM 0 HA VAL A 43 11.923 -13.847 -18.564 1.00 0.00 H new ATOM 0 HB VAL A 43 13.690 -12.878 -20.732 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.799 -11.239 -20.977 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.198 -12.909 -20.845 1.00 0.00 H new ATOM 0 HG13 VAL A 43 11.118 -11.821 -19.439 1.00 0.00 H new ATOM 0 HG21 VAL A 43 13.884 -10.568 -19.905 1.00 0.00 H new ATOM 0 HG22 VAL A 43 13.242 -11.084 -18.328 1.00 0.00 H new ATOM 0 HG23 VAL A 43 14.805 -11.714 -18.901 1.00 0.00 H new ATOM 609 N LEU A 44 12.561 -15.322 -20.772 1.00 0.00 N ATOM 610 CA LEU A 44 12.880 -16.515 -21.603 1.00 0.00 C ATOM 611 C LEU A 44 12.615 -16.210 -23.080 1.00 0.00 C ATOM 612 O LEU A 44 11.486 -16.220 -23.529 1.00 0.00 O ATOM 613 CB LEU A 44 11.945 -17.620 -21.109 1.00 0.00 C ATOM 614 CG LEU A 44 12.035 -18.820 -22.055 1.00 0.00 C ATOM 615 CD1 LEU A 44 13.253 -19.671 -21.698 1.00 0.00 C ATOM 616 CD2 LEU A 44 10.767 -19.670 -21.929 1.00 0.00 C ATOM 0 H LEU A 44 11.749 -14.785 -21.076 1.00 0.00 H new ATOM 0 HA LEU A 44 13.927 -16.807 -21.516 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.219 -17.919 -20.097 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.920 -17.252 -21.066 1.00 0.00 H new ATOM 0 HG LEU A 44 12.133 -18.460 -23.079 1.00 0.00 H new ATOM 0 HD11 LEU A 44 13.312 -20.524 -22.374 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.157 -19.070 -21.792 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.160 -20.028 -20.672 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.833 -20.524 -22.603 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.667 -20.025 -20.903 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.897 -19.067 -22.191 1.00 0.00 H new ATOM 628 N CYS A 45 13.642 -15.947 -23.842 1.00 0.00 N ATOM 629 CA CYS A 45 13.429 -15.653 -25.289 1.00 0.00 C ATOM 630 C CYS A 45 13.083 -16.940 -26.036 1.00 0.00 C ATOM 631 O CYS A 45 13.862 -17.871 -26.082 1.00 0.00 O ATOM 632 CB CYS A 45 14.756 -15.093 -25.796 1.00 0.00 C ATOM 633 SG CYS A 45 14.438 -13.618 -26.796 1.00 0.00 S ATOM 0 H CYS A 45 14.612 -15.923 -23.529 1.00 0.00 H new ATOM 0 HA CYS A 45 12.610 -14.951 -25.444 1.00 0.00 H new ATOM 0 HB2 CYS A 45 15.404 -14.844 -24.956 1.00 0.00 H new ATOM 0 HB3 CYS A 45 15.278 -15.844 -26.390 1.00 0.00 H new ATOM 638 N SER A 46 11.922 -17.004 -26.620 1.00 0.00 N ATOM 639 CA SER A 46 11.536 -18.237 -27.359 1.00 0.00 C ATOM 640 C SER A 46 10.936 -17.871 -28.721 1.00 0.00 C ATOM 641 O SER A 46 10.015 -17.085 -28.813 1.00 0.00 O ATOM 642 CB SER A 46 10.489 -18.914 -26.476 1.00 0.00 C ATOM 643 OG SER A 46 10.441 -20.301 -26.782 1.00 0.00 O ATOM 0 H SER A 46 11.225 -16.259 -26.619 1.00 0.00 H new ATOM 0 HA SER A 46 12.389 -18.888 -27.553 1.00 0.00 H new ATOM 0 HB2 SER A 46 10.736 -18.770 -25.424 1.00 0.00 H new ATOM 0 HB3 SER A 46 9.511 -18.460 -26.638 1.00 0.00 H new ATOM 0 HG SER A 46 9.771 -20.738 -26.216 1.00 0.00 H new ATOM 649 N GLY A 47 11.452 -18.436 -29.778 1.00 0.00 N ATOM 650 CA GLY A 47 10.911 -18.120 -31.131 1.00 0.00 C ATOM 651 C GLY A 47 11.301 -16.693 -31.518 1.00 0.00 C ATOM 652 O GLY A 47 10.705 -16.091 -32.390 1.00 0.00 O ATOM 0 H GLY A 47 12.224 -19.102 -29.764 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.301 -18.826 -31.864 1.00 0.00 H new ATOM 0 HA3 GLY A 47 9.826 -18.225 -31.134 1.00 0.00 H new ATOM 656 N GLY A 48 12.298 -16.146 -30.879 1.00 0.00 N ATOM 657 CA GLY A 48 12.727 -14.757 -31.212 1.00 0.00 C ATOM 658 C GLY A 48 11.850 -13.756 -30.459 1.00 0.00 C ATOM 659 O GLY A 48 11.676 -12.629 -30.879 1.00 0.00 O ATOM 0 H GLY A 48 12.835 -16.600 -30.140 1.00 0.00 H new ATOM 0 HA2 GLY A 48 13.773 -14.614 -30.942 1.00 0.00 H new ATOM 0 HA3 GLY A 48 12.649 -14.589 -32.286 1.00 0.00 H new ATOM 663 N GLU A 49 11.295 -14.157 -29.348 1.00 0.00 N ATOM 664 CA GLU A 49 10.429 -13.227 -28.568 1.00 0.00 C ATOM 665 C GLU A 49 10.644 -13.435 -27.066 1.00 0.00 C ATOM 666 O GLU A 49 10.671 -14.549 -26.581 1.00 0.00 O ATOM 667 CB GLU A 49 8.999 -13.596 -28.960 1.00 0.00 C ATOM 668 CG GLU A 49 8.355 -12.422 -29.698 1.00 0.00 C ATOM 669 CD GLU A 49 7.105 -12.905 -30.436 1.00 0.00 C ATOM 670 OE1 GLU A 49 6.424 -13.767 -29.905 1.00 0.00 O ATOM 671 OE2 GLU A 49 6.851 -12.406 -31.520 1.00 0.00 O ATOM 0 H GLU A 49 11.404 -15.088 -28.946 1.00 0.00 H new ATOM 0 HA GLU A 49 10.653 -12.181 -28.778 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.002 -14.482 -29.595 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.419 -13.843 -28.071 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.091 -11.635 -28.991 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.064 -11.991 -30.405 1.00 0.00 H new ATOM 678 N TRP A 50 10.797 -12.371 -26.327 1.00 0.00 N ATOM 679 CA TRP A 50 11.010 -12.506 -24.858 1.00 0.00 C ATOM 680 C TRP A 50 9.669 -12.744 -24.154 1.00 0.00 C ATOM 681 O TRP A 50 8.696 -12.063 -24.410 1.00 0.00 O ATOM 682 CB TRP A 50 11.619 -11.171 -24.425 1.00 0.00 C ATOM 683 CG TRP A 50 13.054 -11.118 -24.848 1.00 0.00 C ATOM 684 CD1 TRP A 50 13.535 -10.396 -25.888 1.00 0.00 C ATOM 685 CD2 TRP A 50 14.197 -11.802 -24.261 1.00 0.00 C ATOM 686 NE1 TRP A 50 14.902 -10.595 -25.974 1.00 0.00 N ATOM 687 CE2 TRP A 50 15.357 -11.454 -24.993 1.00 0.00 C ATOM 688 CE3 TRP A 50 14.337 -12.681 -23.175 1.00 0.00 C ATOM 689 CZ2 TRP A 50 16.613 -11.963 -24.658 1.00 0.00 C ATOM 690 CZ3 TRP A 50 15.597 -13.195 -22.834 1.00 0.00 C ATOM 691 CH2 TRP A 50 16.733 -12.837 -23.573 1.00 0.00 C ATOM 0 H TRP A 50 10.784 -11.413 -26.677 1.00 0.00 H new ATOM 0 HA TRP A 50 11.655 -13.347 -24.605 1.00 0.00 H new ATOM 0 HB2 TRP A 50 11.066 -10.345 -24.872 1.00 0.00 H new ATOM 0 HB3 TRP A 50 11.543 -11.058 -23.344 1.00 0.00 H new ATOM 0 HD1 TRP A 50 12.948 -9.768 -26.542 1.00 0.00 H new ATOM 0 HE1 TRP A 50 15.500 -10.160 -26.676 1.00 0.00 H new ATOM 0 HE3 TRP A 50 13.469 -12.963 -22.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 17.484 -11.684 -25.232 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 15.692 -13.871 -21.997 1.00 0.00 H new ATOM 0 HH2 TRP A 50 17.700 -13.236 -23.305 1.00 0.00 H new ATOM 702 N SER A 51 9.607 -13.708 -23.275 1.00 0.00 N ATOM 703 CA SER A 51 8.321 -13.985 -22.569 1.00 0.00 C ATOM 704 C SER A 51 8.557 -14.219 -21.073 1.00 0.00 C ATOM 705 O SER A 51 9.658 -14.496 -20.639 1.00 0.00 O ATOM 706 CB SER A 51 7.779 -15.253 -23.227 1.00 0.00 C ATOM 707 OG SER A 51 6.423 -15.045 -23.601 1.00 0.00 O ATOM 0 H SER A 51 10.386 -14.313 -23.016 1.00 0.00 H new ATOM 0 HA SER A 51 7.627 -13.148 -22.645 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.376 -15.505 -24.104 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.853 -16.094 -22.538 1.00 0.00 H new ATOM 0 HG SER A 51 6.073 -15.856 -24.025 1.00 0.00 H new ATOM 713 N ASP A 52 7.520 -14.116 -20.287 1.00 0.00 N ATOM 714 CA ASP A 52 7.652 -14.336 -18.816 1.00 0.00 C ATOM 715 C ASP A 52 8.627 -13.333 -18.197 1.00 0.00 C ATOM 716 O ASP A 52 9.679 -13.697 -17.710 1.00 0.00 O ATOM 717 CB ASP A 52 8.181 -15.764 -18.670 1.00 0.00 C ATOM 718 CG ASP A 52 7.124 -16.640 -17.992 1.00 0.00 C ATOM 719 OD1 ASP A 52 6.086 -16.112 -17.629 1.00 0.00 O ATOM 720 OD2 ASP A 52 7.372 -17.826 -17.846 1.00 0.00 O ATOM 0 H ASP A 52 6.578 -13.887 -20.603 1.00 0.00 H new ATOM 0 HA ASP A 52 6.701 -14.197 -18.301 1.00 0.00 H new ATOM 0 HB2 ASP A 52 8.431 -16.171 -19.650 1.00 0.00 H new ATOM 0 HB3 ASP A 52 9.099 -15.764 -18.082 1.00 0.00 H new ATOM 725 N PRO A 53 8.224 -12.098 -18.232 1.00 0.00 N ATOM 726 CA PRO A 53 9.029 -10.999 -17.667 1.00 0.00 C ATOM 727 C PRO A 53 8.651 -10.771 -16.198 1.00 0.00 C ATOM 728 O PRO A 53 7.491 -10.593 -15.882 1.00 0.00 O ATOM 729 CB PRO A 53 8.611 -9.805 -18.518 1.00 0.00 C ATOM 730 CG PRO A 53 7.232 -10.131 -19.029 1.00 0.00 C ATOM 731 CD PRO A 53 6.979 -11.607 -18.809 1.00 0.00 C ATOM 0 HA PRO A 53 10.103 -11.187 -17.684 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.604 -8.888 -17.929 1.00 0.00 H new ATOM 0 HB3 PRO A 53 9.307 -9.649 -19.342 1.00 0.00 H new ATOM 0 HG2 PRO A 53 6.483 -9.536 -18.507 1.00 0.00 H new ATOM 0 HG3 PRO A 53 7.152 -9.886 -20.088 1.00 0.00 H new ATOM 0 HD2 PRO A 53 6.136 -11.771 -18.138 1.00 0.00 H new ATOM 0 HD3 PRO A 53 6.745 -12.115 -19.744 1.00 0.00 H new ATOM 739 N PRO A 54 9.641 -10.776 -15.346 1.00 0.00 N ATOM 740 CA PRO A 54 9.394 -10.559 -13.900 1.00 0.00 C ATOM 741 C PRO A 54 9.008 -9.099 -13.645 1.00 0.00 C ATOM 742 O PRO A 54 8.971 -8.290 -14.551 1.00 0.00 O ATOM 743 CB PRO A 54 10.728 -10.906 -13.249 1.00 0.00 C ATOM 744 CG PRO A 54 11.747 -10.691 -14.323 1.00 0.00 C ATOM 745 CD PRO A 54 11.065 -10.979 -15.638 1.00 0.00 C ATOM 0 HA PRO A 54 8.575 -11.160 -13.504 1.00 0.00 H new ATOM 0 HB2 PRO A 54 10.924 -10.270 -12.386 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.739 -11.937 -12.895 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.123 -9.668 -14.299 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.604 -11.349 -14.180 1.00 0.00 H new ATOM 0 HD2 PRO A 54 11.412 -10.308 -16.424 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.263 -11.996 -15.977 1.00 0.00 H new ATOM 753 N THR A 55 8.697 -8.761 -12.424 1.00 0.00 N ATOM 754 CA THR A 55 8.286 -7.357 -12.118 1.00 0.00 C ATOM 755 C THR A 55 9.304 -6.646 -11.231 1.00 0.00 C ATOM 756 O THR A 55 9.961 -7.247 -10.408 1.00 0.00 O ATOM 757 CB THR A 55 6.983 -7.495 -11.334 1.00 0.00 C ATOM 758 OG1 THR A 55 7.166 -8.446 -10.302 1.00 0.00 O ATOM 759 CG2 THR A 55 5.864 -7.960 -12.255 1.00 0.00 C ATOM 0 H THR A 55 8.709 -9.394 -11.624 1.00 0.00 H new ATOM 0 HA THR A 55 8.194 -6.776 -13.036 1.00 0.00 H new ATOM 0 HB THR A 55 6.713 -6.528 -10.910 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.934 -9.338 -10.634 1.00 0.00 H new ATOM 0 HG21 THR A 55 4.940 -8.055 -11.685 1.00 0.00 H new ATOM 0 HG22 THR A 55 5.724 -7.232 -13.054 1.00 0.00 H new ATOM 0 HG23 THR A 55 6.125 -8.926 -12.686 1.00 0.00 H new ATOM 767 N CYS A 56 9.385 -5.352 -11.359 1.00 0.00 N ATOM 768 CA CYS A 56 10.297 -4.565 -10.490 1.00 0.00 C ATOM 769 C CYS A 56 9.434 -3.645 -9.646 1.00 0.00 C ATOM 770 O CYS A 56 9.241 -2.486 -9.954 1.00 0.00 O ATOM 771 CB CYS A 56 11.202 -3.768 -11.429 1.00 0.00 C ATOM 772 SG CYS A 56 12.376 -4.883 -12.238 1.00 0.00 S ATOM 0 H CYS A 56 8.853 -4.803 -12.034 1.00 0.00 H new ATOM 0 HA CYS A 56 10.905 -5.181 -9.827 1.00 0.00 H new ATOM 0 HB2 CYS A 56 10.601 -3.252 -12.178 1.00 0.00 H new ATOM 0 HB3 CYS A 56 11.739 -3.003 -10.869 1.00 0.00 H new ATOM 777 N GLN A 57 8.882 -4.177 -8.599 1.00 0.00 N ATOM 778 CA GLN A 57 7.987 -3.369 -7.738 1.00 0.00 C ATOM 779 C GLN A 57 8.575 -3.234 -6.338 1.00 0.00 C ATOM 780 O GLN A 57 9.744 -3.475 -6.115 1.00 0.00 O ATOM 781 CB GLN A 57 6.658 -4.139 -7.670 1.00 0.00 C ATOM 782 CG GLN A 57 6.514 -5.132 -8.834 1.00 0.00 C ATOM 783 CD GLN A 57 6.311 -4.360 -10.137 1.00 0.00 C ATOM 784 OE1 GLN A 57 7.172 -4.351 -10.994 1.00 0.00 O ATOM 785 NE2 GLN A 57 5.199 -3.704 -10.324 1.00 0.00 N ATOM 0 H GLN A 57 9.013 -5.144 -8.301 1.00 0.00 H new ATOM 0 HA GLN A 57 7.855 -2.364 -8.138 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.597 -4.677 -6.724 1.00 0.00 H new ATOM 0 HB3 GLN A 57 5.828 -3.433 -7.689 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.403 -5.758 -8.904 1.00 0.00 H new ATOM 0 HG3 GLN A 57 5.669 -5.797 -8.657 1.00 0.00 H new ATOM 0 HE21 GLN A 57 4.476 -3.711 -9.605 1.00 0.00 H new ATOM 0 HE22 GLN A 57 5.053 -3.184 -11.189 1.00 0.00 H new ATOM 794 N ILE A 58 7.764 -2.866 -5.392 1.00 0.00 N ATOM 795 CA ILE A 58 8.263 -2.731 -3.997 1.00 0.00 C ATOM 796 C ILE A 58 7.733 -3.904 -3.175 1.00 0.00 C ATOM 797 O ILE A 58 6.585 -4.284 -3.293 1.00 0.00 O ATOM 798 CB ILE A 58 7.718 -1.399 -3.451 1.00 0.00 C ATOM 799 CG1 ILE A 58 7.173 -0.507 -4.579 1.00 0.00 C ATOM 800 CG2 ILE A 58 8.849 -0.657 -2.742 1.00 0.00 C ATOM 801 CD1 ILE A 58 5.691 -0.816 -4.808 1.00 0.00 C ATOM 0 H ILE A 58 6.775 -2.652 -5.523 1.00 0.00 H new ATOM 0 HA ILE A 58 9.352 -2.738 -3.950 1.00 0.00 H new ATOM 0 HB ILE A 58 6.902 -1.620 -2.763 1.00 0.00 H new ATOM 0 HG12 ILE A 58 7.300 0.544 -4.319 1.00 0.00 H new ATOM 0 HG13 ILE A 58 7.736 -0.678 -5.496 1.00 0.00 H new ATOM 0 HG21 ILE A 58 8.474 0.289 -2.351 1.00 0.00 H new ATOM 0 HG22 ILE A 58 9.225 -1.266 -1.920 1.00 0.00 H new ATOM 0 HG23 ILE A 58 9.656 -0.463 -3.449 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.307 -0.183 -5.608 1.00 0.00 H new ATOM 0 HD12 ILE A 58 5.577 -1.863 -5.088 1.00 0.00 H new ATOM 0 HD13 ILE A 58 5.133 -0.622 -3.892 1.00 0.00 H new ATOM 813 N VAL A 59 8.554 -4.492 -2.355 1.00 0.00 N ATOM 814 CA VAL A 59 8.075 -5.651 -1.549 1.00 0.00 C ATOM 815 C VAL A 59 8.166 -5.358 -0.072 1.00 0.00 C ATOM 816 O VAL A 59 8.551 -6.194 0.717 1.00 0.00 O ATOM 817 CB VAL A 59 8.997 -6.806 -1.905 1.00 0.00 C ATOM 818 CG1 VAL A 59 8.931 -7.054 -3.410 1.00 0.00 C ATOM 819 CG2 VAL A 59 10.426 -6.448 -1.486 1.00 0.00 C ATOM 0 H VAL A 59 9.527 -4.226 -2.207 1.00 0.00 H new ATOM 0 HA VAL A 59 7.030 -5.875 -1.765 1.00 0.00 H new ATOM 0 HB VAL A 59 8.688 -7.712 -1.384 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.590 -7.882 -3.672 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.908 -7.302 -3.693 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.247 -6.156 -3.941 1.00 0.00 H new ATOM 0 HG21 VAL A 59 11.096 -7.271 -1.737 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.744 -5.548 -2.011 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.456 -6.271 -0.411 1.00 0.00 H new ATOM 829 N LYS A 60 7.784 -4.196 0.312 1.00 0.00 N ATOM 830 CA LYS A 60 7.827 -3.871 1.755 1.00 0.00 C ATOM 831 C LYS A 60 6.549 -4.416 2.396 1.00 0.00 C ATOM 832 O LYS A 60 5.491 -3.825 2.299 1.00 0.00 O ATOM 833 CB LYS A 60 7.880 -2.343 1.834 1.00 0.00 C ATOM 834 CG LYS A 60 9.214 -1.905 2.442 1.00 0.00 C ATOM 835 CD LYS A 60 9.980 -1.048 1.431 1.00 0.00 C ATOM 836 CE LYS A 60 10.377 0.282 2.078 1.00 0.00 C ATOM 837 NZ LYS A 60 9.094 1.011 2.280 1.00 0.00 N ATOM 0 H LYS A 60 7.444 -3.454 -0.299 1.00 0.00 H new ATOM 0 HA LYS A 60 8.681 -4.306 2.274 1.00 0.00 H new ATOM 0 HB2 LYS A 60 7.764 -1.913 0.839 1.00 0.00 H new ATOM 0 HB3 LYS A 60 7.054 -1.971 2.440 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.040 -1.339 3.357 1.00 0.00 H new ATOM 0 HG3 LYS A 60 9.805 -2.779 2.716 1.00 0.00 H new ATOM 0 HD2 LYS A 60 10.870 -1.578 1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 60 9.362 -0.866 0.552 1.00 0.00 H new ATOM 0 HE2 LYS A 60 10.893 0.122 3.025 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.055 0.846 1.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 9.261 2.035 2.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 8.410 0.719 1.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 8.713 0.789 3.222 1.00 0.00 H new ATOM 851 N CYS A 61 6.633 -5.559 3.010 1.00 0.00 N ATOM 852 CA CYS A 61 5.420 -6.179 3.617 1.00 0.00 C ATOM 853 C CYS A 61 4.923 -5.389 4.821 1.00 0.00 C ATOM 854 O CYS A 61 5.626 -4.563 5.369 1.00 0.00 O ATOM 855 CB CYS A 61 5.884 -7.567 4.036 1.00 0.00 C ATOM 856 SG CYS A 61 6.615 -8.382 2.604 1.00 0.00 S ATOM 0 H CYS A 61 7.493 -6.096 3.120 1.00 0.00 H new ATOM 0 HA CYS A 61 4.582 -6.203 2.920 1.00 0.00 H new ATOM 0 HB2 CYS A 61 6.612 -7.495 4.844 1.00 0.00 H new ATOM 0 HB3 CYS A 61 5.044 -8.149 4.415 1.00 0.00 H new ATOM 861 N PRO A 62 3.709 -5.686 5.189 1.00 0.00 N ATOM 862 CA PRO A 62 3.067 -5.014 6.343 1.00 0.00 C ATOM 863 C PRO A 62 3.777 -5.393 7.638 1.00 0.00 C ATOM 864 O PRO A 62 4.675 -4.716 8.097 1.00 0.00 O ATOM 865 CB PRO A 62 1.638 -5.566 6.322 1.00 0.00 C ATOM 866 CG PRO A 62 1.738 -6.864 5.593 1.00 0.00 C ATOM 867 CD PRO A 62 2.821 -6.680 4.570 1.00 0.00 C ATOM 0 HA PRO A 62 3.102 -3.926 6.285 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.255 -5.709 7.332 1.00 0.00 H new ATOM 0 HB3 PRO A 62 0.957 -4.881 5.817 1.00 0.00 H new ATOM 0 HG2 PRO A 62 1.981 -7.678 6.276 1.00 0.00 H new ATOM 0 HG3 PRO A 62 0.791 -7.119 5.117 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.344 -7.614 4.366 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.421 -6.325 3.620 1.00 0.00 H new ATOM 875 N HIS A 63 3.372 -6.475 8.224 1.00 0.00 N ATOM 876 CA HIS A 63 3.993 -6.932 9.486 1.00 0.00 C ATOM 877 C HIS A 63 3.577 -8.376 9.722 1.00 0.00 C ATOM 878 O HIS A 63 2.421 -8.717 9.567 1.00 0.00 O ATOM 879 CB HIS A 63 3.406 -6.021 10.556 1.00 0.00 C ATOM 880 CG HIS A 63 4.452 -5.054 11.031 1.00 0.00 C ATOM 881 ND1 HIS A 63 4.243 -4.224 12.119 1.00 0.00 N ATOM 882 CD2 HIS A 63 5.713 -4.765 10.574 1.00 0.00 C ATOM 883 CE1 HIS A 63 5.351 -3.480 12.280 1.00 0.00 C ATOM 884 NE2 HIS A 63 6.279 -3.769 11.364 1.00 0.00 N ATOM 0 H HIS A 63 2.623 -7.073 7.875 1.00 0.00 H new ATOM 0 HA HIS A 63 5.082 -6.890 9.482 1.00 0.00 H new ATOM 0 HB2 HIS A 63 2.551 -5.477 10.155 1.00 0.00 H new ATOM 0 HB3 HIS A 63 3.041 -6.616 11.393 1.00 0.00 H new ATOM 0 HD2 HIS A 63 6.193 -5.238 9.730 1.00 0.00 H new ATOM 0 HE1 HIS A 63 5.476 -2.739 13.056 1.00 0.00 H new ATOM 0 HE2 HIS A 63 7.204 -3.350 11.265 1.00 0.00 H new ATOM 892 N PRO A 64 4.525 -9.187 10.068 1.00 0.00 N ATOM 893 CA PRO A 64 4.225 -10.609 10.296 1.00 0.00 C ATOM 894 C PRO A 64 3.537 -10.788 11.648 1.00 0.00 C ATOM 895 O PRO A 64 4.096 -11.339 12.575 1.00 0.00 O ATOM 896 CB PRO A 64 5.593 -11.267 10.281 1.00 0.00 C ATOM 897 CG PRO A 64 6.557 -10.188 10.672 1.00 0.00 C ATOM 898 CD PRO A 64 5.941 -8.869 10.285 1.00 0.00 C ATOM 0 HA PRO A 64 3.551 -11.037 9.554 1.00 0.00 H new ATOM 0 HB2 PRO A 64 5.635 -12.103 10.979 1.00 0.00 H new ATOM 0 HB3 PRO A 64 5.827 -11.664 9.293 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.754 -10.220 11.744 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.513 -10.327 10.168 1.00 0.00 H new ATOM 0 HD2 PRO A 64 6.067 -8.124 11.071 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.401 -8.463 9.384 1.00 0.00 H new ATOM 906 N THR A 65 2.324 -10.327 11.763 1.00 0.00 N ATOM 907 CA THR A 65 1.589 -10.474 13.052 1.00 0.00 C ATOM 908 C THR A 65 0.780 -11.758 13.018 1.00 0.00 C ATOM 909 O THR A 65 0.833 -12.509 12.064 1.00 0.00 O ATOM 910 CB THR A 65 0.639 -9.275 13.151 1.00 0.00 C ATOM 911 OG1 THR A 65 -0.603 -9.614 12.551 1.00 0.00 O ATOM 912 CG2 THR A 65 1.234 -8.067 12.436 1.00 0.00 C ATOM 0 H THR A 65 1.808 -9.854 11.021 1.00 0.00 H new ATOM 0 HA THR A 65 2.271 -10.510 13.902 1.00 0.00 H new ATOM 0 HB THR A 65 0.490 -9.024 14.201 1.00 0.00 H new ATOM 0 HG1 THR A 65 -1.215 -8.851 12.613 1.00 0.00 H new ATOM 0 HG21 THR A 65 0.548 -7.223 12.515 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.187 -7.805 12.896 1.00 0.00 H new ATOM 0 HG23 THR A 65 1.393 -8.308 11.385 1.00 0.00 H new ATOM 920 N ILE A 66 0.022 -12.022 14.038 1.00 0.00 N ATOM 921 CA ILE A 66 -0.786 -13.264 14.023 1.00 0.00 C ATOM 922 C ILE A 66 -1.705 -13.324 15.248 1.00 0.00 C ATOM 923 O ILE A 66 -1.517 -12.616 16.218 1.00 0.00 O ATOM 924 CB ILE A 66 0.234 -14.426 14.004 1.00 0.00 C ATOM 925 CG1 ILE A 66 -0.280 -15.617 14.814 1.00 0.00 C ATOM 926 CG2 ILE A 66 1.581 -13.986 14.578 1.00 0.00 C ATOM 927 CD1 ILE A 66 0.693 -16.780 14.639 1.00 0.00 C ATOM 0 H ILE A 66 -0.073 -11.441 14.871 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.444 -13.316 13.156 1.00 0.00 H new ATOM 0 HB ILE A 66 0.364 -14.722 12.963 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.365 -15.350 15.867 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.276 -15.903 14.476 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.278 -14.823 14.552 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.979 -13.164 13.983 1.00 0.00 H new ATOM 0 HG23 ILE A 66 1.447 -13.657 15.608 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.341 -17.638 15.211 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.754 -17.047 13.584 1.00 0.00 H new ATOM 0 HD13 ILE A 66 1.680 -16.486 14.997 1.00 0.00 H new ATOM 939 N SER A 67 -2.703 -14.165 15.199 1.00 0.00 N ATOM 940 CA SER A 67 -3.647 -14.277 16.346 1.00 0.00 C ATOM 941 C SER A 67 -2.950 -14.914 17.550 1.00 0.00 C ATOM 942 O SER A 67 -2.774 -16.114 17.616 1.00 0.00 O ATOM 943 CB SER A 67 -4.784 -15.167 15.839 1.00 0.00 C ATOM 944 OG SER A 67 -4.480 -16.529 16.112 1.00 0.00 O ATOM 0 H SER A 67 -2.905 -14.781 14.411 1.00 0.00 H new ATOM 0 HA SER A 67 -4.012 -13.305 16.677 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.721 -14.889 16.322 1.00 0.00 H new ATOM 0 HB3 SER A 67 -4.923 -15.022 14.768 1.00 0.00 H new ATOM 0 HG SER A 67 -3.509 -16.638 16.192 1.00 0.00 H new ATOM 950 N ASN A 68 -2.553 -14.115 18.502 1.00 0.00 N ATOM 951 CA ASN A 68 -1.868 -14.670 19.704 1.00 0.00 C ATOM 952 C ASN A 68 -0.878 -15.758 19.291 1.00 0.00 C ATOM 953 O ASN A 68 -0.963 -16.881 19.735 1.00 0.00 O ATOM 954 CB ASN A 68 -2.989 -15.269 20.553 1.00 0.00 C ATOM 955 CG ASN A 68 -3.539 -14.203 21.501 1.00 0.00 C ATOM 956 OD1 ASN A 68 -2.791 -13.568 22.218 1.00 0.00 O ATOM 957 ND2 ASN A 68 -4.823 -13.978 21.535 1.00 0.00 N ATOM 0 H ASN A 68 -2.673 -13.102 18.500 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.303 -13.911 20.245 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.785 -15.644 19.910 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.613 -16.118 21.123 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -5.200 -13.269 22.164 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -5.450 -14.511 20.933 1.00 0.00 H new ATOM 964 N GLY A 69 0.058 -15.440 18.441 1.00 0.00 N ATOM 965 CA GLY A 69 1.041 -16.471 18.007 1.00 0.00 C ATOM 966 C GLY A 69 2.167 -15.806 17.215 1.00 0.00 C ATOM 967 O GLY A 69 2.656 -16.346 16.244 1.00 0.00 O ATOM 0 H GLY A 69 0.185 -14.515 18.030 1.00 0.00 H new ATOM 0 HA2 GLY A 69 1.450 -16.987 18.876 1.00 0.00 H new ATOM 0 HA3 GLY A 69 0.546 -17.224 17.393 1.00 0.00 H new ATOM 971 N TYR A 70 2.559 -14.629 17.623 1.00 0.00 N ATOM 972 CA TYR A 70 3.643 -13.882 16.916 1.00 0.00 C ATOM 973 C TYR A 70 4.825 -14.760 16.553 1.00 0.00 C ATOM 974 O TYR A 70 4.824 -15.964 16.677 1.00 0.00 O ATOM 975 CB TYR A 70 4.139 -12.813 17.891 1.00 0.00 C ATOM 976 CG TYR A 70 4.270 -13.407 19.275 1.00 0.00 C ATOM 977 CD1 TYR A 70 5.180 -14.450 19.496 1.00 0.00 C ATOM 978 CD2 TYR A 70 3.503 -12.916 20.338 1.00 0.00 C ATOM 979 CE1 TYR A 70 5.323 -15.001 20.772 1.00 0.00 C ATOM 980 CE2 TYR A 70 3.649 -13.468 21.617 1.00 0.00 C ATOM 981 CZ TYR A 70 4.558 -14.510 21.833 1.00 0.00 C ATOM 982 OH TYR A 70 4.698 -15.052 23.095 1.00 0.00 O ATOM 0 H TYR A 70 2.168 -14.144 18.431 1.00 0.00 H new ATOM 0 HA TYR A 70 3.240 -13.477 15.988 1.00 0.00 H new ATOM 0 HB2 TYR A 70 5.101 -12.423 17.560 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.444 -11.973 17.909 1.00 0.00 H new ATOM 0 HD1 TYR A 70 5.773 -14.829 18.677 1.00 0.00 H new ATOM 0 HD2 TYR A 70 2.800 -12.113 20.172 1.00 0.00 H new ATOM 0 HE1 TYR A 70 6.024 -15.806 20.938 1.00 0.00 H new ATOM 0 HE2 TYR A 70 3.059 -13.089 22.438 1.00 0.00 H new ATOM 0 HH TYR A 70 4.094 -14.595 23.716 1.00 0.00 H new ATOM 992 N LEU A 71 5.844 -14.106 16.117 1.00 0.00 N ATOM 993 CA LEU A 71 7.099 -14.782 15.721 1.00 0.00 C ATOM 994 C LEU A 71 8.178 -14.511 16.768 1.00 0.00 C ATOM 995 O LEU A 71 8.587 -13.389 16.983 1.00 0.00 O ATOM 996 CB LEU A 71 7.462 -14.162 14.364 1.00 0.00 C ATOM 997 CG LEU A 71 7.300 -12.632 14.406 1.00 0.00 C ATOM 998 CD1 LEU A 71 8.611 -11.980 14.819 1.00 0.00 C ATOM 999 CD2 LEU A 71 6.884 -12.132 13.028 1.00 0.00 C ATOM 0 H LEU A 71 5.864 -13.092 16.013 1.00 0.00 H new ATOM 0 HA LEU A 71 7.000 -15.865 15.649 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.490 -14.417 14.105 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.824 -14.579 13.585 1.00 0.00 H new ATOM 0 HG LEU A 71 6.533 -12.370 15.135 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.486 -10.897 14.846 1.00 0.00 H new ATOM 0 HD12 LEU A 71 8.899 -12.337 15.808 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.388 -12.238 14.100 1.00 0.00 H new ATOM 0 HD21 LEU A 71 6.768 -11.048 13.054 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.649 -12.398 12.298 1.00 0.00 H new ATOM 0 HD23 LEU A 71 5.937 -12.591 12.745 1.00 0.00 H new ATOM 1011 N SER A 72 8.634 -15.537 17.426 1.00 0.00 N ATOM 1012 CA SER A 72 9.681 -15.349 18.465 1.00 0.00 C ATOM 1013 C SER A 72 11.059 -15.277 17.799 1.00 0.00 C ATOM 1014 O SER A 72 12.075 -15.158 18.455 1.00 0.00 O ATOM 1015 CB SER A 72 9.570 -16.588 19.352 1.00 0.00 C ATOM 1016 OG SER A 72 10.681 -17.443 19.115 1.00 0.00 O ATOM 0 H SER A 72 8.326 -16.500 17.289 1.00 0.00 H new ATOM 0 HA SER A 72 9.554 -14.429 19.036 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.540 -16.295 20.402 1.00 0.00 H new ATOM 0 HB3 SER A 72 8.640 -17.116 19.142 1.00 0.00 H new ATOM 0 HG SER A 72 10.610 -18.237 19.685 1.00 0.00 H new ATOM 1022 N SER A 73 11.094 -15.358 16.495 1.00 0.00 N ATOM 1023 CA SER A 73 12.396 -15.305 15.769 1.00 0.00 C ATOM 1024 C SER A 73 12.945 -13.877 15.746 1.00 0.00 C ATOM 1025 O SER A 73 13.726 -13.490 16.593 1.00 0.00 O ATOM 1026 CB SER A 73 12.071 -15.773 14.351 1.00 0.00 C ATOM 1027 OG SER A 73 13.193 -15.538 13.511 1.00 0.00 O ATOM 0 H SER A 73 10.272 -15.459 15.899 1.00 0.00 H new ATOM 0 HA SER A 73 13.156 -15.924 16.246 1.00 0.00 H new ATOM 0 HB2 SER A 73 11.820 -16.834 14.354 1.00 0.00 H new ATOM 0 HB3 SER A 73 11.199 -15.240 13.971 1.00 0.00 H new ATOM 0 HG SER A 73 12.989 -15.839 12.601 1.00 0.00 H new ATOM 1033 N GLY A 74 12.551 -13.092 14.780 1.00 0.00 N ATOM 1034 CA GLY A 74 13.062 -11.695 14.709 1.00 0.00 C ATOM 1035 C GLY A 74 12.178 -10.857 13.786 1.00 0.00 C ATOM 1036 O GLY A 74 12.367 -10.823 12.586 1.00 0.00 O ATOM 0 H GLY A 74 11.900 -13.357 14.040 1.00 0.00 H new ATOM 0 HA2 GLY A 74 13.079 -11.255 15.706 1.00 0.00 H new ATOM 0 HA3 GLY A 74 14.088 -11.693 14.342 1.00 0.00 H new ATOM 1040 N PHE A 75 11.221 -10.169 14.342 1.00 0.00 N ATOM 1041 CA PHE A 75 10.328 -9.316 13.507 1.00 0.00 C ATOM 1042 C PHE A 75 11.029 -7.981 13.215 1.00 0.00 C ATOM 1043 O PHE A 75 11.127 -7.118 14.064 1.00 0.00 O ATOM 1044 CB PHE A 75 9.053 -9.146 14.359 1.00 0.00 C ATOM 1045 CG PHE A 75 8.590 -7.703 14.389 1.00 0.00 C ATOM 1046 CD1 PHE A 75 7.763 -7.212 13.373 1.00 0.00 C ATOM 1047 CD2 PHE A 75 8.985 -6.863 15.438 1.00 0.00 C ATOM 1048 CE1 PHE A 75 7.331 -5.881 13.404 1.00 0.00 C ATOM 1049 CE2 PHE A 75 8.552 -5.532 15.469 1.00 0.00 C ATOM 1050 CZ PHE A 75 7.726 -5.041 14.452 1.00 0.00 C ATOM 0 H PHE A 75 11.017 -10.160 15.341 1.00 0.00 H new ATOM 0 HA PHE A 75 10.086 -9.745 12.535 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.259 -9.775 13.956 1.00 0.00 H new ATOM 0 HB3 PHE A 75 9.246 -9.488 15.376 1.00 0.00 H new ATOM 0 HD1 PHE A 75 7.458 -7.860 12.565 1.00 0.00 H new ATOM 0 HD2 PHE A 75 9.623 -7.242 16.223 1.00 0.00 H new ATOM 0 HE1 PHE A 75 6.693 -5.502 12.619 1.00 0.00 H new ATOM 0 HE2 PHE A 75 8.856 -4.884 16.278 1.00 0.00 H new ATOM 0 HZ PHE A 75 7.393 -4.014 14.475 1.00 0.00 H new ATOM 1060 N LYS A 76 11.525 -7.813 12.020 1.00 0.00 N ATOM 1061 CA LYS A 76 12.227 -6.544 11.670 1.00 0.00 C ATOM 1062 C LYS A 76 11.210 -5.424 11.424 1.00 0.00 C ATOM 1063 O LYS A 76 10.135 -5.648 10.904 1.00 0.00 O ATOM 1064 CB LYS A 76 13.006 -6.869 10.390 1.00 0.00 C ATOM 1065 CG LYS A 76 13.328 -5.579 9.627 1.00 0.00 C ATOM 1066 CD LYS A 76 14.299 -4.730 10.448 1.00 0.00 C ATOM 1067 CE LYS A 76 15.575 -4.488 9.641 1.00 0.00 C ATOM 1068 NZ LYS A 76 16.383 -3.552 10.471 1.00 0.00 N ATOM 0 H LYS A 76 11.475 -8.501 11.269 1.00 0.00 H new ATOM 0 HA LYS A 76 12.883 -6.196 12.468 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.929 -7.393 10.640 1.00 0.00 H new ATOM 0 HB3 LYS A 76 12.421 -7.538 9.759 1.00 0.00 H new ATOM 0 HG2 LYS A 76 13.766 -5.817 8.658 1.00 0.00 H new ATOM 0 HG3 LYS A 76 12.413 -5.020 9.434 1.00 0.00 H new ATOM 0 HD2 LYS A 76 13.835 -3.779 10.709 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.538 -5.235 11.384 1.00 0.00 H new ATOM 0 HE2 LYS A 76 16.111 -5.420 9.461 1.00 0.00 H new ATOM 0 HE3 LYS A 76 15.350 -4.057 8.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.276 -3.338 9.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 15.850 -2.671 10.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.588 -3.992 11.391 1.00 0.00 H new ATOM 1082 N ARG A 77 11.544 -4.218 11.789 1.00 0.00 N ATOM 1083 CA ARG A 77 10.601 -3.085 11.572 1.00 0.00 C ATOM 1084 C ARG A 77 10.178 -3.029 10.103 1.00 0.00 C ATOM 1085 O ARG A 77 9.011 -2.926 9.782 1.00 0.00 O ATOM 1086 CB ARG A 77 11.394 -1.835 11.947 1.00 0.00 C ATOM 1087 CG ARG A 77 11.201 -1.533 13.435 1.00 0.00 C ATOM 1088 CD ARG A 77 12.564 -1.293 14.088 1.00 0.00 C ATOM 1089 NE ARG A 77 12.295 -0.335 15.195 1.00 0.00 N ATOM 1090 CZ ARG A 77 13.179 0.575 15.499 1.00 0.00 C ATOM 1091 NH1 ARG A 77 14.394 0.223 15.820 1.00 0.00 N ATOM 1092 NH2 ARG A 77 12.847 1.836 15.484 1.00 0.00 N ATOM 0 H ARG A 77 12.430 -3.967 12.229 1.00 0.00 H new ATOM 0 HA ARG A 77 9.691 -3.183 12.164 1.00 0.00 H new ATOM 0 HB2 ARG A 77 12.452 -1.984 11.730 1.00 0.00 H new ATOM 0 HB3 ARG A 77 11.062 -0.988 11.347 1.00 0.00 H new ATOM 0 HG2 ARG A 77 10.567 -0.655 13.560 1.00 0.00 H new ATOM 0 HG3 ARG A 77 10.693 -2.365 13.923 1.00 0.00 H new ATOM 0 HD2 ARG A 77 12.991 -2.223 14.465 1.00 0.00 H new ATOM 0 HD3 ARG A 77 13.277 -0.881 13.374 1.00 0.00 H new ATOM 0 HE ARG A 77 11.420 -0.390 15.716 1.00 0.00 H new ATOM 0 HH11 ARG A 77 14.652 -0.764 15.833 1.00 0.00 H new ATOM 0 HH12 ARG A 77 15.085 0.935 16.058 1.00 0.00 H new ATOM 0 HH21 ARG A 77 11.897 2.110 15.235 1.00 0.00 H new ATOM 0 HH22 ARG A 77 13.538 2.548 15.722 1.00 0.00 H new ATOM 1106 N SER A 78 11.125 -3.097 9.212 1.00 0.00 N ATOM 1107 CA SER A 78 10.791 -3.050 7.761 1.00 0.00 C ATOM 1108 C SER A 78 11.209 -4.357 7.085 1.00 0.00 C ATOM 1109 O SER A 78 12.288 -4.868 7.312 1.00 0.00 O ATOM 1110 CB SER A 78 11.596 -1.876 7.206 1.00 0.00 C ATOM 1111 OG SER A 78 12.949 -2.274 7.035 1.00 0.00 O ATOM 0 H SER A 78 12.119 -3.183 9.425 1.00 0.00 H new ATOM 0 HA SER A 78 9.722 -2.927 7.585 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.177 -1.551 6.254 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.538 -1.026 7.886 1.00 0.00 H new ATOM 0 HG SER A 78 13.067 -3.187 7.372 1.00 0.00 H new ATOM 1117 N TYR A 79 10.363 -4.904 6.258 1.00 0.00 N ATOM 1118 CA TYR A 79 10.710 -6.180 5.572 1.00 0.00 C ATOM 1119 C TYR A 79 10.852 -5.946 4.061 1.00 0.00 C ATOM 1120 O TYR A 79 10.691 -4.841 3.582 1.00 0.00 O ATOM 1121 CB TYR A 79 9.534 -7.109 5.861 1.00 0.00 C ATOM 1122 CG TYR A 79 9.442 -7.384 7.344 1.00 0.00 C ATOM 1123 CD1 TYR A 79 10.301 -8.318 7.933 1.00 0.00 C ATOM 1124 CD2 TYR A 79 8.495 -6.712 8.130 1.00 0.00 C ATOM 1125 CE1 TYR A 79 10.218 -8.582 9.304 1.00 0.00 C ATOM 1126 CE2 TYR A 79 8.412 -6.977 9.503 1.00 0.00 C ATOM 1127 CZ TYR A 79 9.273 -7.912 10.088 1.00 0.00 C ATOM 1128 OH TYR A 79 9.191 -8.172 11.440 1.00 0.00 O ATOM 0 H TYR A 79 9.446 -4.523 6.027 1.00 0.00 H new ATOM 0 HA TYR A 79 11.656 -6.596 5.919 1.00 0.00 H new ATOM 0 HB2 TYR A 79 8.607 -6.656 5.509 1.00 0.00 H new ATOM 0 HB3 TYR A 79 9.658 -8.045 5.317 1.00 0.00 H new ATOM 0 HD1 TYR A 79 11.030 -8.836 7.328 1.00 0.00 H new ATOM 0 HD2 TYR A 79 7.830 -5.991 7.677 1.00 0.00 H new ATOM 0 HE1 TYR A 79 10.883 -9.303 9.757 1.00 0.00 H new ATOM 0 HE2 TYR A 79 7.684 -6.460 10.110 1.00 0.00 H new ATOM 0 HH TYR A 79 8.826 -7.389 11.902 1.00 0.00 H new ATOM 1138 N SER A 80 11.149 -6.973 3.303 1.00 0.00 N ATOM 1139 CA SER A 80 11.293 -6.781 1.828 1.00 0.00 C ATOM 1140 C SER A 80 11.409 -8.136 1.094 1.00 0.00 C ATOM 1141 O SER A 80 12.420 -8.804 1.170 1.00 0.00 O ATOM 1142 CB SER A 80 12.585 -5.982 1.665 1.00 0.00 C ATOM 1143 OG SER A 80 12.296 -4.594 1.767 1.00 0.00 O ATOM 0 H SER A 80 11.296 -7.925 3.638 1.00 0.00 H new ATOM 0 HA SER A 80 10.427 -6.274 1.402 1.00 0.00 H new ATOM 0 HB2 SER A 80 13.305 -6.272 2.431 1.00 0.00 H new ATOM 0 HB3 SER A 80 13.041 -6.200 0.699 1.00 0.00 H new ATOM 0 HG SER A 80 11.422 -4.472 2.194 1.00 0.00 H new ATOM 1149 N TYR A 81 10.389 -8.522 0.365 1.00 0.00 N ATOM 1150 CA TYR A 81 10.418 -9.811 -0.408 1.00 0.00 C ATOM 1151 C TYR A 81 11.195 -10.932 0.313 1.00 0.00 C ATOM 1152 O TYR A 81 11.663 -11.861 -0.314 1.00 0.00 O ATOM 1153 CB TYR A 81 11.090 -9.447 -1.734 1.00 0.00 C ATOM 1154 CG TYR A 81 11.382 -10.696 -2.533 1.00 0.00 C ATOM 1155 CD1 TYR A 81 10.410 -11.696 -2.649 1.00 0.00 C ATOM 1156 CD2 TYR A 81 12.624 -10.851 -3.158 1.00 0.00 C ATOM 1157 CE1 TYR A 81 10.680 -12.852 -3.392 1.00 0.00 C ATOM 1158 CE2 TYR A 81 12.895 -12.006 -3.901 1.00 0.00 C ATOM 1159 CZ TYR A 81 11.923 -13.006 -4.018 1.00 0.00 C ATOM 1160 OH TYR A 81 12.190 -14.144 -4.751 1.00 0.00 O ATOM 0 H TYR A 81 9.523 -7.992 0.270 1.00 0.00 H new ATOM 0 HA TYR A 81 9.412 -10.212 -0.533 1.00 0.00 H new ATOM 0 HB2 TYR A 81 10.443 -8.783 -2.307 1.00 0.00 H new ATOM 0 HB3 TYR A 81 12.016 -8.904 -1.544 1.00 0.00 H new ATOM 0 HD1 TYR A 81 9.452 -11.576 -2.166 1.00 0.00 H new ATOM 0 HD2 TYR A 81 13.374 -10.079 -3.067 1.00 0.00 H new ATOM 0 HE1 TYR A 81 9.930 -13.624 -3.482 1.00 0.00 H new ATOM 0 HE2 TYR A 81 13.854 -12.125 -4.384 1.00 0.00 H new ATOM 0 HH TYR A 81 13.097 -14.091 -5.119 1.00 0.00 H new ATOM 1170 N ASN A 82 11.314 -10.894 1.613 1.00 0.00 N ATOM 1171 CA ASN A 82 12.038 -12.005 2.305 1.00 0.00 C ATOM 1172 C ASN A 82 12.003 -11.835 3.825 1.00 0.00 C ATOM 1173 O ASN A 82 10.950 -11.746 4.419 1.00 0.00 O ATOM 1174 CB ASN A 82 13.470 -11.957 1.785 1.00 0.00 C ATOM 1175 CG ASN A 82 14.170 -13.282 2.096 1.00 0.00 C ATOM 1176 OD1 ASN A 82 13.651 -14.099 2.830 1.00 0.00 O ATOM 1177 ND2 ASN A 82 15.334 -13.533 1.562 1.00 0.00 N ATOM 0 H ASN A 82 10.950 -10.158 2.218 1.00 0.00 H new ATOM 0 HA ASN A 82 11.568 -12.967 2.099 1.00 0.00 H new ATOM 0 HB2 ASN A 82 13.472 -11.776 0.710 1.00 0.00 H new ATOM 0 HB3 ASN A 82 14.009 -11.131 2.249 1.00 0.00 H new ATOM 0 HD21 ASN A 82 15.807 -14.414 1.761 1.00 0.00 H new ATOM 0 HD22 ASN A 82 15.771 -12.848 0.946 1.00 0.00 H new ATOM 1184 N ASP A 83 13.137 -11.828 4.475 1.00 0.00 N ATOM 1185 CA ASP A 83 13.122 -11.701 5.955 1.00 0.00 C ATOM 1186 C ASP A 83 12.129 -12.710 6.526 1.00 0.00 C ATOM 1187 O ASP A 83 11.033 -12.365 6.923 1.00 0.00 O ATOM 1188 CB ASP A 83 12.668 -10.269 6.235 1.00 0.00 C ATOM 1189 CG ASP A 83 13.177 -9.828 7.609 1.00 0.00 C ATOM 1190 OD1 ASP A 83 13.123 -10.632 8.525 1.00 0.00 O ATOM 1191 OD2 ASP A 83 13.614 -8.694 7.722 1.00 0.00 O ATOM 0 H ASP A 83 14.060 -11.904 4.048 1.00 0.00 H new ATOM 0 HA ASP A 83 14.093 -11.898 6.410 1.00 0.00 H new ATOM 0 HB2 ASP A 83 13.047 -9.599 5.463 1.00 0.00 H new ATOM 0 HB3 ASP A 83 11.580 -10.209 6.203 1.00 0.00 H new ATOM 1196 N ASN A 84 12.500 -13.959 6.552 1.00 0.00 N ATOM 1197 CA ASN A 84 11.573 -14.998 7.076 1.00 0.00 C ATOM 1198 C ASN A 84 11.397 -14.846 8.586 1.00 0.00 C ATOM 1199 O ASN A 84 12.338 -14.589 9.310 1.00 0.00 O ATOM 1200 CB ASN A 84 12.243 -16.333 6.753 1.00 0.00 C ATOM 1201 CG ASN A 84 13.501 -16.493 7.607 1.00 0.00 C ATOM 1202 OD1 ASN A 84 14.231 -15.545 7.816 1.00 0.00 O ATOM 1203 ND2 ASN A 84 13.787 -17.661 8.113 1.00 0.00 N ATOM 0 H ASN A 84 13.405 -14.305 6.233 1.00 0.00 H new ATOM 0 HA ASN A 84 10.581 -14.919 6.631 1.00 0.00 H new ATOM 0 HB2 ASN A 84 11.553 -17.154 6.946 1.00 0.00 H new ATOM 0 HB3 ASN A 84 12.501 -16.376 5.695 1.00 0.00 H new ATOM 0 HD21 ASN A 84 14.624 -17.778 8.684 1.00 0.00 H new ATOM 0 HD22 ASN A 84 13.174 -18.457 7.937 1.00 0.00 H new ATOM 1210 N VAL A 85 10.199 -15.022 9.068 1.00 0.00 N ATOM 1211 CA VAL A 85 9.968 -14.908 10.532 1.00 0.00 C ATOM 1212 C VAL A 85 9.274 -16.170 11.044 1.00 0.00 C ATOM 1213 O VAL A 85 8.189 -16.510 10.614 1.00 0.00 O ATOM 1214 CB VAL A 85 9.058 -13.697 10.730 1.00 0.00 C ATOM 1215 CG1 VAL A 85 9.865 -12.410 10.555 1.00 0.00 C ATOM 1216 CG2 VAL A 85 7.920 -13.730 9.710 1.00 0.00 C ATOM 0 H VAL A 85 9.372 -15.239 8.512 1.00 0.00 H new ATOM 0 HA VAL A 85 10.905 -14.793 11.077 1.00 0.00 H new ATOM 0 HB VAL A 85 8.640 -13.727 11.736 1.00 0.00 H new ATOM 0 HG11 VAL A 85 9.212 -11.549 10.697 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.668 -12.381 11.291 1.00 0.00 H new ATOM 0 HG13 VAL A 85 10.291 -12.381 9.552 1.00 0.00 H new ATOM 0 HG21 VAL A 85 7.275 -12.864 9.857 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.334 -13.708 8.702 1.00 0.00 H new ATOM 0 HG23 VAL A 85 7.338 -14.642 9.843 1.00 0.00 H new ATOM 1226 N ASP A 86 9.878 -16.862 11.964 1.00 0.00 N ATOM 1227 CA ASP A 86 9.232 -18.092 12.503 1.00 0.00 C ATOM 1228 C ASP A 86 8.103 -17.683 13.448 1.00 0.00 C ATOM 1229 O ASP A 86 8.251 -16.778 14.244 1.00 0.00 O ATOM 1230 CB ASP A 86 10.337 -18.832 13.259 1.00 0.00 C ATOM 1231 CG ASP A 86 9.866 -20.249 13.591 1.00 0.00 C ATOM 1232 OD1 ASP A 86 8.823 -20.375 14.210 1.00 0.00 O ATOM 1233 OD2 ASP A 86 10.557 -21.184 13.220 1.00 0.00 O ATOM 0 H ASP A 86 10.787 -16.633 12.366 1.00 0.00 H new ATOM 0 HA ASP A 86 8.800 -18.723 11.726 1.00 0.00 H new ATOM 0 HB2 ASP A 86 11.243 -18.871 12.654 1.00 0.00 H new ATOM 0 HB3 ASP A 86 10.587 -18.296 14.175 1.00 0.00 H new ATOM 1238 N PHE A 87 6.967 -18.316 13.356 1.00 0.00 N ATOM 1239 CA PHE A 87 5.841 -17.915 14.243 1.00 0.00 C ATOM 1240 C PHE A 87 5.710 -18.840 15.450 1.00 0.00 C ATOM 1241 O PHE A 87 5.762 -20.049 15.341 1.00 0.00 O ATOM 1242 CB PHE A 87 4.594 -17.981 13.367 1.00 0.00 C ATOM 1243 CG PHE A 87 4.484 -16.688 12.605 1.00 0.00 C ATOM 1244 CD1 PHE A 87 4.405 -15.480 13.304 1.00 0.00 C ATOM 1245 CD2 PHE A 87 4.481 -16.690 11.206 1.00 0.00 C ATOM 1246 CE1 PHE A 87 4.323 -14.272 12.607 1.00 0.00 C ATOM 1247 CE2 PHE A 87 4.394 -15.481 10.508 1.00 0.00 C ATOM 1248 CZ PHE A 87 4.317 -14.272 11.209 1.00 0.00 C ATOM 0 H PHE A 87 6.771 -19.084 12.714 1.00 0.00 H new ATOM 0 HA PHE A 87 6.000 -16.918 14.655 1.00 0.00 H new ATOM 0 HB2 PHE A 87 4.658 -18.824 12.678 1.00 0.00 H new ATOM 0 HB3 PHE A 87 3.707 -18.137 13.980 1.00 0.00 H new ATOM 0 HD1 PHE A 87 4.407 -15.481 14.384 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.546 -17.623 10.666 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.264 -13.339 13.148 1.00 0.00 H new ATOM 0 HE2 PHE A 87 4.386 -15.480 9.428 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.253 -13.339 10.670 1.00 0.00 H new ATOM 1258 N LYS A 88 5.524 -18.257 16.599 1.00 0.00 N ATOM 1259 CA LYS A 88 5.366 -19.052 17.844 1.00 0.00 C ATOM 1260 C LYS A 88 3.918 -18.954 18.321 1.00 0.00 C ATOM 1261 O LYS A 88 3.224 -18.002 18.024 1.00 0.00 O ATOM 1262 CB LYS A 88 6.302 -18.386 18.851 1.00 0.00 C ATOM 1263 CG LYS A 88 6.966 -19.456 19.721 1.00 0.00 C ATOM 1264 CD LYS A 88 7.030 -18.970 21.170 1.00 0.00 C ATOM 1265 CE LYS A 88 5.611 -18.825 21.726 1.00 0.00 C ATOM 1266 NZ LYS A 88 5.792 -18.642 23.193 1.00 0.00 N ATOM 0 H LYS A 88 5.474 -17.247 16.729 1.00 0.00 H new ATOM 0 HA LYS A 88 5.599 -20.108 17.708 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.062 -17.806 18.328 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.743 -17.690 19.476 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.403 -20.387 19.663 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.970 -19.667 19.353 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.599 -19.675 21.776 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.551 -18.014 21.221 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.098 -17.972 21.282 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.009 -19.708 21.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.862 -18.535 23.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 6.277 -19.472 23.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.363 -17.791 23.369 1.00 0.00 H new ATOM 1280 N CYS A 89 3.450 -19.918 19.056 1.00 0.00 N ATOM 1281 CA CYS A 89 2.044 -19.850 19.538 1.00 0.00 C ATOM 1282 C CYS A 89 2.009 -19.374 20.989 1.00 0.00 C ATOM 1283 O CYS A 89 2.690 -19.905 21.845 1.00 0.00 O ATOM 1284 CB CYS A 89 1.510 -21.275 19.420 1.00 0.00 C ATOM 1285 SG CYS A 89 -0.144 -21.225 18.695 1.00 0.00 S ATOM 0 H CYS A 89 3.974 -20.745 19.343 1.00 0.00 H new ATOM 0 HA CYS A 89 1.442 -19.148 18.961 1.00 0.00 H new ATOM 0 HB2 CYS A 89 2.175 -21.876 18.800 1.00 0.00 H new ATOM 0 HB3 CYS A 89 1.477 -21.747 20.402 1.00 0.00 H new ATOM 1290 N LYS A 90 1.226 -18.372 21.272 1.00 0.00 N ATOM 1291 CA LYS A 90 1.156 -17.860 22.671 1.00 0.00 C ATOM 1292 C LYS A 90 1.058 -19.028 23.661 1.00 0.00 C ATOM 1293 O LYS A 90 2.028 -19.418 24.280 1.00 0.00 O ATOM 1294 CB LYS A 90 -0.116 -17.015 22.724 1.00 0.00 C ATOM 1295 CG LYS A 90 0.249 -15.563 23.043 1.00 0.00 C ATOM 1296 CD LYS A 90 0.361 -15.388 24.559 1.00 0.00 C ATOM 1297 CE LYS A 90 -0.218 -14.029 24.963 1.00 0.00 C ATOM 1298 NZ LYS A 90 -0.979 -14.287 26.218 1.00 0.00 N ATOM 0 H LYS A 90 0.633 -17.886 20.599 1.00 0.00 H new ATOM 0 HA LYS A 90 2.042 -17.285 22.940 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.641 -17.068 21.770 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.794 -17.406 23.483 1.00 0.00 H new ATOM 0 HG2 LYS A 90 1.193 -15.300 22.565 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.509 -14.890 22.643 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.175 -16.189 25.068 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.404 -15.456 24.867 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.573 -13.296 25.125 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.867 -13.630 24.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.405 -13.400 26.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.730 -14.982 26.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -0.335 -14.659 26.944 1.00 0.00 H new ATOM 1312 N TYR A 91 -0.114 -19.584 23.810 1.00 0.00 N ATOM 1313 CA TYR A 91 -0.301 -20.727 24.756 1.00 0.00 C ATOM 1314 C TYR A 91 -0.205 -22.056 24.016 1.00 0.00 C ATOM 1315 O TYR A 91 0.273 -22.131 22.902 1.00 0.00 O ATOM 1316 CB TYR A 91 -1.711 -20.541 25.319 1.00 0.00 C ATOM 1317 CG TYR A 91 -1.629 -19.995 26.724 1.00 0.00 C ATOM 1318 CD1 TYR A 91 -1.224 -20.824 27.778 1.00 0.00 C ATOM 1319 CD2 TYR A 91 -1.961 -18.658 26.974 1.00 0.00 C ATOM 1320 CE1 TYR A 91 -1.151 -20.315 29.080 1.00 0.00 C ATOM 1321 CE2 TYR A 91 -1.888 -18.150 28.276 1.00 0.00 C ATOM 1322 CZ TYR A 91 -1.483 -18.979 29.329 1.00 0.00 C ATOM 1323 OH TYR A 91 -1.410 -18.478 30.613 1.00 0.00 O ATOM 0 H TYR A 91 -0.957 -19.295 23.314 1.00 0.00 H new ATOM 0 HA TYR A 91 0.461 -20.742 25.535 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -2.279 -19.859 24.686 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -2.242 -21.493 25.319 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -0.968 -21.856 27.586 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -2.274 -18.018 26.162 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -0.838 -20.954 29.893 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -2.144 -17.119 28.468 1.00 0.00 H new ATOM 0 HH TYR A 91 -1.673 -17.534 30.611 1.00 0.00 H new ATOM 1333 N GLY A 92 -0.664 -23.101 24.639 1.00 0.00 N ATOM 1334 CA GLY A 92 -0.627 -24.452 24.001 1.00 0.00 C ATOM 1335 C GLY A 92 -1.566 -24.459 22.793 1.00 0.00 C ATOM 1336 O GLY A 92 -2.509 -25.221 22.721 1.00 0.00 O ATOM 0 H GLY A 92 -1.069 -23.081 25.575 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.389 -24.693 23.689 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -0.930 -25.215 24.718 1.00 0.00 H new ATOM 1340 N TYR A 93 -1.308 -23.600 21.855 1.00 0.00 N ATOM 1341 CA TYR A 93 -2.161 -23.503 20.638 1.00 0.00 C ATOM 1342 C TYR A 93 -1.400 -24.033 19.422 1.00 0.00 C ATOM 1343 O TYR A 93 -0.209 -24.269 19.479 1.00 0.00 O ATOM 1344 CB TYR A 93 -2.421 -22.010 20.515 1.00 0.00 C ATOM 1345 CG TYR A 93 -3.623 -21.633 21.350 1.00 0.00 C ATOM 1346 CD1 TYR A 93 -3.593 -21.815 22.738 1.00 0.00 C ATOM 1347 CD2 TYR A 93 -4.764 -21.101 20.741 1.00 0.00 C ATOM 1348 CE1 TYR A 93 -4.704 -21.465 23.515 1.00 0.00 C ATOM 1349 CE2 TYR A 93 -5.875 -20.751 21.516 1.00 0.00 C ATOM 1350 CZ TYR A 93 -5.846 -20.933 22.903 1.00 0.00 C ATOM 1351 OH TYR A 93 -6.941 -20.587 23.668 1.00 0.00 O ATOM 0 H TYR A 93 -0.526 -22.946 21.878 1.00 0.00 H new ATOM 0 HA TYR A 93 -3.080 -24.086 20.698 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -1.546 -21.450 20.846 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -2.593 -21.746 19.472 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -2.712 -22.226 23.210 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -4.788 -20.960 19.670 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -4.680 -21.605 24.586 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -6.755 -20.340 21.044 1.00 0.00 H new ATOM 0 HH TYR A 93 -7.647 -20.232 23.088 1.00 0.00 H new ATOM 1361 N LYS A 94 -2.074 -24.224 18.324 1.00 0.00 N ATOM 1362 CA LYS A 94 -1.380 -24.742 17.111 1.00 0.00 C ATOM 1363 C LYS A 94 -1.450 -23.707 15.988 1.00 0.00 C ATOM 1364 O LYS A 94 -2.498 -23.445 15.438 1.00 0.00 O ATOM 1365 CB LYS A 94 -2.143 -26.010 16.723 1.00 0.00 C ATOM 1366 CG LYS A 94 -2.261 -26.933 17.938 1.00 0.00 C ATOM 1367 CD LYS A 94 -3.559 -27.737 17.843 1.00 0.00 C ATOM 1368 CE LYS A 94 -4.062 -28.066 19.251 1.00 0.00 C ATOM 1369 NZ LYS A 94 -5.242 -28.950 19.040 1.00 0.00 N ATOM 0 H LYS A 94 -3.072 -24.045 18.213 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.325 -24.946 17.293 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -3.135 -25.750 16.354 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.626 -26.524 15.913 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.405 -27.607 17.981 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.251 -26.346 18.856 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.313 -27.167 17.300 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -3.389 -28.656 17.282 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.293 -28.568 19.838 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.338 -27.162 19.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.098 -28.477 19.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -5.350 -29.148 18.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.103 -29.843 19.554 1.00 0.00 H new ATOM 1383 N LEU A 95 -0.342 -23.114 15.644 1.00 0.00 N ATOM 1384 CA LEU A 95 -0.355 -22.095 14.557 1.00 0.00 C ATOM 1385 C LEU A 95 -1.095 -22.640 13.335 1.00 0.00 C ATOM 1386 O LEU A 95 -0.518 -23.296 12.491 1.00 0.00 O ATOM 1387 CB LEU A 95 1.117 -21.853 14.225 1.00 0.00 C ATOM 1388 CG LEU A 95 1.767 -21.021 15.329 1.00 0.00 C ATOM 1389 CD1 LEU A 95 3.109 -21.646 15.719 1.00 0.00 C ATOM 1390 CD2 LEU A 95 1.998 -19.599 14.819 1.00 0.00 C ATOM 0 H LEU A 95 0.570 -23.289 16.066 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.863 -21.178 14.855 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.637 -22.805 14.121 1.00 0.00 H new ATOM 0 HB3 LEU A 95 1.203 -21.336 13.269 1.00 0.00 H new ATOM 0 HG LEU A 95 1.112 -20.997 16.200 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.572 -21.052 16.507 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.946 -22.662 16.079 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.766 -21.670 14.849 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.462 -19.002 15.604 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.654 -19.627 13.949 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.043 -19.153 14.540 1.00 0.00 H new ATOM 1402 N SER A 96 -2.366 -22.371 13.230 1.00 0.00 N ATOM 1403 CA SER A 96 -3.136 -22.873 12.058 1.00 0.00 C ATOM 1404 C SER A 96 -2.785 -22.057 10.811 1.00 0.00 C ATOM 1405 O SER A 96 -3.341 -21.003 10.574 1.00 0.00 O ATOM 1406 CB SER A 96 -4.605 -22.677 12.435 1.00 0.00 C ATOM 1407 OG SER A 96 -5.304 -22.124 11.328 1.00 0.00 O ATOM 0 H SER A 96 -2.904 -21.826 13.904 1.00 0.00 H new ATOM 0 HA SER A 96 -2.912 -23.915 11.829 1.00 0.00 H new ATOM 0 HB2 SER A 96 -5.049 -23.630 12.721 1.00 0.00 H new ATOM 0 HB3 SER A 96 -4.686 -22.016 13.298 1.00 0.00 H new ATOM 0 HG SER A 96 -4.909 -21.259 11.091 1.00 0.00 H new ATOM 1413 N GLY A 97 -1.869 -22.533 10.010 1.00 0.00 N ATOM 1414 CA GLY A 97 -1.496 -21.776 8.782 1.00 0.00 C ATOM 1415 C GLY A 97 -0.028 -22.024 8.430 1.00 0.00 C ATOM 1416 O GLY A 97 0.285 -22.644 7.434 1.00 0.00 O ATOM 0 H GLY A 97 -1.366 -23.409 10.153 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -2.133 -22.081 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -1.664 -20.710 8.938 1.00 0.00 H new ATOM 1420 N SER A 98 0.874 -21.531 9.230 1.00 0.00 N ATOM 1421 CA SER A 98 2.323 -21.726 8.925 1.00 0.00 C ATOM 1422 C SER A 98 3.203 -21.154 10.044 1.00 0.00 C ATOM 1423 O SER A 98 3.171 -19.975 10.327 1.00 0.00 O ATOM 1424 CB SER A 98 2.543 -20.943 7.636 1.00 0.00 C ATOM 1425 OG SER A 98 2.908 -21.839 6.595 1.00 0.00 O ATOM 0 H SER A 98 0.675 -21.003 10.080 1.00 0.00 H new ATOM 0 HA SER A 98 2.584 -22.780 8.834 1.00 0.00 H new ATOM 0 HB2 SER A 98 1.635 -20.404 7.365 1.00 0.00 H new ATOM 0 HB3 SER A 98 3.325 -20.197 7.780 1.00 0.00 H new ATOM 0 HG SER A 98 2.182 -22.480 6.446 1.00 0.00 H new ATOM 1431 N SER A 99 4.004 -21.976 10.672 1.00 0.00 N ATOM 1432 CA SER A 99 4.890 -21.471 11.767 1.00 0.00 C ATOM 1433 C SER A 99 6.145 -20.789 11.201 1.00 0.00 C ATOM 1434 O SER A 99 7.161 -20.697 11.862 1.00 0.00 O ATOM 1435 CB SER A 99 5.274 -22.716 12.567 1.00 0.00 C ATOM 1436 OG SER A 99 6.593 -23.113 12.215 1.00 0.00 O ATOM 0 H SER A 99 4.084 -22.974 10.475 1.00 0.00 H new ATOM 0 HA SER A 99 4.386 -20.722 12.378 1.00 0.00 H new ATOM 0 HB2 SER A 99 5.218 -22.507 13.635 1.00 0.00 H new ATOM 0 HB3 SER A 99 4.572 -23.524 12.363 1.00 0.00 H new ATOM 0 HG SER A 99 6.843 -23.910 12.728 1.00 0.00 H new ATOM 1442 N SER A 100 6.085 -20.303 9.991 1.00 0.00 N ATOM 1443 CA SER A 100 7.268 -19.621 9.393 1.00 0.00 C ATOM 1444 C SER A 100 6.837 -18.881 8.126 1.00 0.00 C ATOM 1445 O SER A 100 6.187 -19.438 7.264 1.00 0.00 O ATOM 1446 CB SER A 100 8.253 -20.740 9.058 1.00 0.00 C ATOM 1447 OG SER A 100 7.841 -21.389 7.863 1.00 0.00 O ATOM 0 H SER A 100 5.263 -20.349 9.388 1.00 0.00 H new ATOM 0 HA SER A 100 7.715 -18.888 10.064 1.00 0.00 H new ATOM 0 HB2 SER A 100 9.256 -20.332 8.936 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.298 -21.457 9.878 1.00 0.00 H new ATOM 0 HG SER A 100 6.977 -21.027 7.575 1.00 0.00 H new ATOM 1453 N SER A 101 7.175 -17.627 8.010 1.00 0.00 N ATOM 1454 CA SER A 101 6.759 -16.861 6.799 1.00 0.00 C ATOM 1455 C SER A 101 7.839 -15.876 6.373 1.00 0.00 C ATOM 1456 O SER A 101 8.701 -15.508 7.143 1.00 0.00 O ATOM 1457 CB SER A 101 5.505 -16.104 7.229 1.00 0.00 C ATOM 1458 OG SER A 101 4.454 -17.030 7.471 1.00 0.00 O ATOM 0 H SER A 101 7.717 -17.101 8.695 1.00 0.00 H new ATOM 0 HA SER A 101 6.585 -17.519 5.948 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.708 -15.524 8.129 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.210 -15.397 6.454 1.00 0.00 H new ATOM 0 HG SER A 101 3.742 -16.897 6.811 1.00 0.00 H new ATOM 1464 N THR A 102 7.785 -15.436 5.148 1.00 0.00 N ATOM 1465 CA THR A 102 8.795 -14.461 4.665 1.00 0.00 C ATOM 1466 C THR A 102 8.100 -13.286 3.986 1.00 0.00 C ATOM 1467 O THR A 102 7.155 -13.451 3.236 1.00 0.00 O ATOM 1468 CB THR A 102 9.666 -15.230 3.668 1.00 0.00 C ATOM 1469 OG1 THR A 102 9.593 -16.621 3.949 1.00 0.00 O ATOM 1470 CG2 THR A 102 11.115 -14.755 3.791 1.00 0.00 C ATOM 0 H THR A 102 7.083 -15.711 4.461 1.00 0.00 H new ATOM 0 HA THR A 102 9.393 -14.051 5.479 1.00 0.00 H new ATOM 0 HB THR A 102 9.309 -15.049 2.654 1.00 0.00 H new ATOM 0 HG1 THR A 102 10.149 -17.113 3.310 1.00 0.00 H new ATOM 0 HG21 THR A 102 11.738 -15.301 3.082 1.00 0.00 H new ATOM 0 HG22 THR A 102 11.168 -13.688 3.574 1.00 0.00 H new ATOM 0 HG23 THR A 102 11.473 -14.937 4.804 1.00 0.00 H new ATOM 1478 N CYS A 103 8.563 -12.100 4.249 1.00 0.00 N ATOM 1479 CA CYS A 103 7.944 -10.902 3.629 1.00 0.00 C ATOM 1480 C CYS A 103 7.959 -11.043 2.107 1.00 0.00 C ATOM 1481 O CYS A 103 8.913 -10.681 1.456 1.00 0.00 O ATOM 1482 CB CYS A 103 8.834 -9.742 4.079 1.00 0.00 C ATOM 1483 SG CYS A 103 8.589 -8.318 2.993 1.00 0.00 S ATOM 0 H CYS A 103 9.349 -11.908 4.871 1.00 0.00 H new ATOM 0 HA CYS A 103 6.904 -10.756 3.922 1.00 0.00 H new ATOM 0 HB2 CYS A 103 8.598 -9.470 5.108 1.00 0.00 H new ATOM 0 HB3 CYS A 103 9.880 -10.047 4.062 1.00 0.00 H new ATOM 1488 N SER A 104 6.914 -11.561 1.534 1.00 0.00 N ATOM 1489 CA SER A 104 6.895 -11.714 0.052 1.00 0.00 C ATOM 1490 C SER A 104 6.762 -10.348 -0.615 1.00 0.00 C ATOM 1491 O SER A 104 6.692 -9.335 0.050 1.00 0.00 O ATOM 1492 CB SER A 104 5.679 -12.589 -0.249 1.00 0.00 C ATOM 1493 OG SER A 104 4.584 -11.761 -0.619 1.00 0.00 O ATOM 0 H SER A 104 6.077 -11.884 2.020 1.00 0.00 H new ATOM 0 HA SER A 104 7.813 -12.162 -0.328 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.910 -13.288 -1.053 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.420 -13.185 0.626 1.00 0.00 H new ATOM 0 HG SER A 104 3.923 -12.293 -1.110 1.00 0.00 H new ATOM 1499 N PRO A 105 6.750 -10.367 -1.915 1.00 0.00 N ATOM 1500 CA PRO A 105 6.648 -9.114 -2.683 1.00 0.00 C ATOM 1501 C PRO A 105 5.215 -8.597 -2.718 1.00 0.00 C ATOM 1502 O PRO A 105 4.288 -9.256 -2.291 1.00 0.00 O ATOM 1503 CB PRO A 105 7.137 -9.500 -4.068 1.00 0.00 C ATOM 1504 CG PRO A 105 6.915 -10.976 -4.181 1.00 0.00 C ATOM 1505 CD PRO A 105 6.827 -11.544 -2.784 1.00 0.00 C ATOM 0 HA PRO A 105 7.230 -8.303 -2.245 1.00 0.00 H new ATOM 0 HB2 PRO A 105 6.588 -8.962 -4.841 1.00 0.00 H new ATOM 0 HB3 PRO A 105 8.191 -9.252 -4.194 1.00 0.00 H new ATOM 0 HG2 PRO A 105 5.999 -11.182 -4.734 1.00 0.00 H new ATOM 0 HG3 PRO A 105 7.732 -11.443 -4.731 1.00 0.00 H new ATOM 0 HD2 PRO A 105 5.950 -12.181 -2.669 1.00 0.00 H new ATOM 0 HD3 PRO A 105 7.698 -12.155 -2.548 1.00 0.00 H new ATOM 1513 N GLY A 106 5.036 -7.405 -3.208 1.00 0.00 N ATOM 1514 CA GLY A 106 3.676 -6.820 -3.255 1.00 0.00 C ATOM 1515 C GLY A 106 3.401 -6.143 -1.917 1.00 0.00 C ATOM 1516 O GLY A 106 3.134 -4.961 -1.870 1.00 0.00 O ATOM 0 H GLY A 106 5.777 -6.811 -3.579 1.00 0.00 H new ATOM 0 HA2 GLY A 106 3.601 -6.098 -4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.935 -7.596 -3.448 1.00 0.00 H new ATOM 1520 N ASN A 107 3.498 -6.905 -0.842 1.00 0.00 N ATOM 1521 CA ASN A 107 3.270 -6.383 0.560 1.00 0.00 C ATOM 1522 C ASN A 107 2.534 -7.438 1.387 1.00 0.00 C ATOM 1523 O ASN A 107 1.384 -7.260 1.734 1.00 0.00 O ATOM 1524 CB ASN A 107 2.380 -5.136 0.470 1.00 0.00 C ATOM 1525 CG ASN A 107 3.255 -3.879 0.414 1.00 0.00 C ATOM 1526 OD1 ASN A 107 2.806 -2.797 0.738 1.00 0.00 O ATOM 1527 ND2 ASN A 107 4.493 -3.979 0.014 1.00 0.00 N ATOM 0 H ASN A 107 3.733 -7.897 -0.879 1.00 0.00 H new ATOM 0 HA ASN A 107 4.227 -6.149 1.027 1.00 0.00 H new ATOM 0 HB2 ASN A 107 1.749 -5.191 -0.417 1.00 0.00 H new ATOM 0 HB3 ASN A 107 1.715 -5.089 1.332 1.00 0.00 H new ATOM 0 HD21 ASN A 107 5.084 -3.149 -0.027 1.00 0.00 H new ATOM 0 HD22 ASN A 107 4.869 -4.887 -0.258 1.00 0.00 H new ATOM 1534 N THR A 108 3.162 -8.537 1.704 1.00 0.00 N ATOM 1535 CA THR A 108 2.436 -9.569 2.501 1.00 0.00 C ATOM 1536 C THR A 108 3.392 -10.583 3.134 1.00 0.00 C ATOM 1537 O THR A 108 4.550 -10.681 2.778 1.00 0.00 O ATOM 1538 CB THR A 108 1.514 -10.264 1.498 1.00 0.00 C ATOM 1539 OG1 THR A 108 1.553 -9.574 0.254 1.00 0.00 O ATOM 1540 CG2 THR A 108 0.090 -10.260 2.045 1.00 0.00 C ATOM 0 H THR A 108 4.124 -8.764 1.453 1.00 0.00 H new ATOM 0 HA THR A 108 1.893 -9.115 3.330 1.00 0.00 H new ATOM 0 HB THR A 108 1.845 -11.291 1.345 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.963 -10.022 -0.387 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.574 -10.754 1.335 1.00 0.00 H new ATOM 0 HG22 THR A 108 0.064 -10.791 2.996 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.239 -9.232 2.195 1.00 0.00 H new ATOM 1548 N TRP A 109 2.893 -11.342 4.074 1.00 0.00 N ATOM 1549 CA TRP A 109 3.728 -12.370 4.759 1.00 0.00 C ATOM 1550 C TRP A 109 3.338 -13.766 4.270 1.00 0.00 C ATOM 1551 O TRP A 109 2.375 -14.348 4.726 1.00 0.00 O ATOM 1552 CB TRP A 109 3.409 -12.189 6.237 1.00 0.00 C ATOM 1553 CG TRP A 109 4.362 -11.187 6.799 1.00 0.00 C ATOM 1554 CD1 TRP A 109 4.043 -9.937 7.221 1.00 0.00 C ATOM 1555 CD2 TRP A 109 5.794 -11.333 6.995 1.00 0.00 C ATOM 1556 NE1 TRP A 109 5.196 -9.309 7.651 1.00 0.00 N ATOM 1557 CE2 TRP A 109 6.303 -10.134 7.542 1.00 0.00 C ATOM 1558 CE3 TRP A 109 6.690 -12.387 6.752 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 7.661 -9.988 7.841 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 8.051 -12.246 7.052 1.00 0.00 C ATOM 1561 CH2 TRP A 109 8.539 -11.052 7.597 1.00 0.00 C ATOM 0 H TRP A 109 1.928 -11.291 4.400 1.00 0.00 H new ATOM 0 HA TRP A 109 4.794 -12.261 4.560 1.00 0.00 H new ATOM 0 HB2 TRP A 109 2.381 -11.850 6.366 1.00 0.00 H new ATOM 0 HB3 TRP A 109 3.500 -13.138 6.765 1.00 0.00 H new ATOM 0 HD1 TRP A 109 3.053 -9.505 7.221 1.00 0.00 H new ATOM 0 HE1 TRP A 109 5.228 -8.353 8.006 1.00 0.00 H new ATOM 0 HE3 TRP A 109 6.327 -13.313 6.331 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 8.030 -9.062 8.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 8.729 -13.065 6.861 1.00 0.00 H new ATOM 0 HH2 TRP A 109 9.589 -10.952 7.829 1.00 0.00 H new ATOM 1572 N LYS A 110 4.076 -14.301 3.333 1.00 0.00 N ATOM 1573 CA LYS A 110 3.739 -15.654 2.803 1.00 0.00 C ATOM 1574 C LYS A 110 4.626 -16.725 3.455 1.00 0.00 C ATOM 1575 O LYS A 110 5.810 -16.516 3.631 1.00 0.00 O ATOM 1576 CB LYS A 110 4.017 -15.568 1.301 1.00 0.00 C ATOM 1577 CG LYS A 110 3.148 -14.470 0.683 1.00 0.00 C ATOM 1578 CD LYS A 110 1.674 -14.871 0.770 1.00 0.00 C ATOM 1579 CE LYS A 110 1.214 -15.432 -0.577 1.00 0.00 C ATOM 1580 NZ LYS A 110 -0.173 -14.918 -0.750 1.00 0.00 N ATOM 0 H LYS A 110 4.895 -13.861 2.913 1.00 0.00 H new ATOM 0 HA LYS A 110 2.707 -15.933 3.015 1.00 0.00 H new ATOM 0 HB2 LYS A 110 5.071 -15.353 1.127 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.804 -16.526 0.826 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.310 -13.527 1.205 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.431 -14.311 -0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 110 1.535 -15.617 1.552 1.00 0.00 H new ATOM 0 HD3 LYS A 110 1.067 -14.007 1.042 1.00 0.00 H new ATOM 0 HE2 LYS A 110 1.863 -15.099 -1.387 1.00 0.00 H new ATOM 0 HE3 LYS A 110 1.235 -16.522 -0.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.560 -15.260 -1.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.769 -15.257 0.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -0.160 -13.878 -0.750 1.00 0.00 H new ATOM 1594 N PRO A 111 4.032 -17.850 3.789 1.00 0.00 N ATOM 1595 CA PRO A 111 2.577 -18.072 3.559 1.00 0.00 C ATOM 1596 C PRO A 111 1.739 -17.239 4.534 1.00 0.00 C ATOM 1597 O PRO A 111 2.247 -16.684 5.488 1.00 0.00 O ATOM 1598 CB PRO A 111 2.394 -19.561 3.826 1.00 0.00 C ATOM 1599 CG PRO A 111 3.518 -19.927 4.739 1.00 0.00 C ATOM 1600 CD PRO A 111 4.670 -19.018 4.407 1.00 0.00 C ATOM 0 HA PRO A 111 2.257 -17.778 2.560 1.00 0.00 H new ATOM 0 HB2 PRO A 111 1.428 -19.764 4.288 1.00 0.00 H new ATOM 0 HB3 PRO A 111 2.433 -20.136 2.901 1.00 0.00 H new ATOM 0 HG2 PRO A 111 3.222 -19.809 5.781 1.00 0.00 H new ATOM 0 HG3 PRO A 111 3.800 -20.971 4.604 1.00 0.00 H new ATOM 0 HD2 PRO A 111 5.230 -18.741 5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 111 5.373 -19.497 3.725 1.00 0.00 H new ATOM 1608 N GLU A 112 0.459 -17.144 4.293 1.00 0.00 N ATOM 1609 CA GLU A 112 -0.416 -16.343 5.197 1.00 0.00 C ATOM 1610 C GLU A 112 -0.032 -16.583 6.658 1.00 0.00 C ATOM 1611 O GLU A 112 0.168 -17.704 7.083 1.00 0.00 O ATOM 1612 CB GLU A 112 -1.836 -16.839 4.923 1.00 0.00 C ATOM 1613 CG GLU A 112 -2.733 -15.647 4.584 1.00 0.00 C ATOM 1614 CD GLU A 112 -4.032 -16.147 3.949 1.00 0.00 C ATOM 1615 OE1 GLU A 112 -3.949 -16.886 2.982 1.00 0.00 O ATOM 1616 OE2 GLU A 112 -5.087 -15.783 4.442 1.00 0.00 O ATOM 0 H GLU A 112 -0.019 -17.587 3.508 1.00 0.00 H new ATOM 0 HA GLU A 112 -0.320 -15.272 5.018 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.832 -17.551 4.098 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -2.224 -17.364 5.796 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -2.953 -15.077 5.486 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -2.217 -14.974 3.899 1.00 0.00 H new ATOM 1623 N LEU A 113 0.079 -15.535 7.427 1.00 0.00 N ATOM 1624 CA LEU A 113 0.456 -15.696 8.860 1.00 0.00 C ATOM 1625 C LEU A 113 -0.285 -16.877 9.484 1.00 0.00 C ATOM 1626 O LEU A 113 -1.370 -17.231 9.069 1.00 0.00 O ATOM 1627 CB LEU A 113 0.046 -14.386 9.538 1.00 0.00 C ATOM 1628 CG LEU A 113 0.933 -13.215 9.069 1.00 0.00 C ATOM 1629 CD1 LEU A 113 2.308 -13.714 8.604 1.00 0.00 C ATOM 1630 CD2 LEU A 113 0.241 -12.488 7.914 1.00 0.00 C ATOM 0 H LEU A 113 -0.075 -14.573 7.125 1.00 0.00 H new ATOM 0 HA LEU A 113 1.521 -15.898 8.977 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.998 -14.168 9.313 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.123 -14.494 10.620 1.00 0.00 H new ATOM 0 HG LEU A 113 1.080 -12.536 9.909 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.912 -12.867 8.279 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.809 -14.221 9.428 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.181 -14.409 7.774 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.865 -11.659 7.580 1.00 0.00 H new ATOM 0 HD22 LEU A 113 0.086 -13.182 7.088 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -0.722 -12.104 8.251 1.00 0.00 H new ATOM 1642 N PRO A 114 0.348 -17.442 10.470 1.00 0.00 N ATOM 1643 CA PRO A 114 -0.221 -18.600 11.190 1.00 0.00 C ATOM 1644 C PRO A 114 -1.276 -18.163 12.210 1.00 0.00 C ATOM 1645 O PRO A 114 -1.317 -17.025 12.631 1.00 0.00 O ATOM 1646 CB PRO A 114 0.989 -19.216 11.880 1.00 0.00 C ATOM 1647 CG PRO A 114 2.000 -18.117 12.005 1.00 0.00 C ATOM 1648 CD PRO A 114 1.654 -17.046 11.002 1.00 0.00 C ATOM 0 HA PRO A 114 -0.735 -19.297 10.528 1.00 0.00 H new ATOM 0 HB2 PRO A 114 0.720 -19.611 12.860 1.00 0.00 H new ATOM 0 HB3 PRO A 114 1.387 -20.048 11.299 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.995 -17.708 13.015 1.00 0.00 H new ATOM 0 HG3 PRO A 114 3.004 -18.500 11.821 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.609 -16.063 11.472 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.402 -16.987 10.212 1.00 0.00 H new ATOM 1656 N LYS A 115 -2.133 -19.068 12.603 1.00 0.00 N ATOM 1657 CA LYS A 115 -3.192 -18.717 13.591 1.00 0.00 C ATOM 1658 C LYS A 115 -3.050 -19.559 14.857 1.00 0.00 C ATOM 1659 O LYS A 115 -3.368 -20.728 14.871 1.00 0.00 O ATOM 1660 CB LYS A 115 -4.511 -19.031 12.888 1.00 0.00 C ATOM 1661 CG LYS A 115 -5.660 -18.932 13.893 1.00 0.00 C ATOM 1662 CD LYS A 115 -6.637 -17.843 13.446 1.00 0.00 C ATOM 1663 CE LYS A 115 -7.432 -17.344 14.653 1.00 0.00 C ATOM 1664 NZ LYS A 115 -8.386 -16.344 14.099 1.00 0.00 N ATOM 0 H LYS A 115 -2.144 -20.036 12.281 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.129 -17.674 13.900 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.672 -18.334 12.065 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.476 -20.031 12.456 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.175 -19.890 13.967 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.271 -18.701 14.885 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -6.093 -17.017 12.989 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -7.315 -18.236 12.688 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.959 -18.162 15.144 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.777 -16.894 15.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.968 -15.956 14.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -7.856 -15.574 13.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -9.001 -16.803 13.397 1.00 0.00 H new ATOM 1678 N CYS A 116 -2.592 -18.972 15.927 1.00 0.00 N ATOM 1679 CA CYS A 116 -2.456 -19.741 17.193 1.00 0.00 C ATOM 1680 C CYS A 116 -3.840 -20.210 17.634 1.00 0.00 C ATOM 1681 O CYS A 116 -4.600 -19.473 18.229 1.00 0.00 O ATOM 1682 CB CYS A 116 -1.860 -18.737 18.180 1.00 0.00 C ATOM 1683 SG CYS A 116 -0.989 -19.585 19.524 1.00 0.00 S ATOM 0 H CYS A 116 -2.307 -17.994 15.979 1.00 0.00 H new ATOM 0 HA CYS A 116 -1.832 -20.630 17.107 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -1.171 -18.073 17.657 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -2.653 -18.113 18.593 1.00 0.00 H new ATOM 1688 N VAL A 117 -4.173 -21.432 17.327 1.00 0.00 N ATOM 1689 CA VAL A 117 -5.513 -21.962 17.710 1.00 0.00 C ATOM 1690 C VAL A 117 -5.378 -23.038 18.764 1.00 0.00 C ATOM 1691 O VAL A 117 -4.291 -23.400 19.167 1.00 0.00 O ATOM 1692 CB VAL A 117 -6.112 -22.558 16.438 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -6.737 -21.442 15.634 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -5.029 -23.233 15.595 1.00 0.00 C ATOM 0 H VAL A 117 -3.574 -22.089 16.826 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.142 -21.174 18.125 1.00 0.00 H new ATOM 0 HB VAL A 117 -6.858 -23.305 16.710 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.170 -21.850 14.721 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.518 -20.962 16.224 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.974 -20.707 15.377 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.477 -23.651 14.694 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.273 -22.498 15.317 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.563 -24.032 16.172 1.00 0.00 H new ATOM 1704 N ARG A 118 -6.478 -23.561 19.212 1.00 0.00 N ATOM 1705 CA ARG A 118 -6.403 -24.621 20.237 1.00 0.00 C ATOM 1706 C ARG A 118 -7.390 -25.748 19.917 1.00 0.00 C ATOM 1707 O ARG A 118 -8.424 -25.458 19.338 1.00 0.00 O ATOM 1708 CB ARG A 118 -6.772 -23.934 21.552 1.00 0.00 C ATOM 1709 CG ARG A 118 -8.177 -23.338 21.439 1.00 0.00 C ATOM 1710 CD ARG A 118 -9.038 -23.828 22.607 1.00 0.00 C ATOM 1711 NE ARG A 118 -10.309 -24.290 21.982 1.00 0.00 N ATOM 1712 CZ ARG A 118 -11.289 -23.447 21.796 1.00 0.00 C ATOM 1713 NH1 ARG A 118 -11.112 -22.401 21.037 1.00 0.00 N ATOM 1714 NH2 ARG A 118 -12.444 -23.651 22.370 1.00 0.00 N ATOM 1715 OXT ARG A 118 -7.093 -26.882 20.256 1.00 0.00 O ATOM 0 H ARG A 118 -7.418 -23.301 18.914 1.00 0.00 H new ATOM 0 HA ARG A 118 -5.414 -25.077 20.282 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -6.734 -24.651 22.372 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -6.050 -23.150 21.780 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -8.123 -22.249 21.446 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -8.631 -23.629 20.492 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -8.547 -24.637 23.147 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -9.219 -23.029 23.326 1.00 0.00 H new ATOM 0 HE ARG A 118 -10.414 -25.264 21.699 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -10.209 -22.242 20.590 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -11.876 -21.742 20.891 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -12.581 -24.469 22.964 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -13.209 -22.992 22.225 1.00 0.00 H new