USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 923 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 65 HIS : no HE2:sc= -0.0875! C(o=-0.62!,f=-8.1!) USER MOD Set 1.2: A 77 MET CE :methyl -149:sc= -0.537 (180deg=-2.07!) USER MOD Set 2.1: A 61 THR OG1 : rot 180:sc= 0.00136 USER MOD Set 2.2: A 62 SER OG : rot -34:sc= 0.0881! USER MOD Set 3.1: A 14 SER OG : rot -28:sc= -0.416 USER MOD Set 3.2: A 36 GLN : amide:sc= -0.312 K(o=-0.73,f=-2.1!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot -16:sc= -0.0487 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 180:sc= 0.0076 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= -0.0025 X(o=-0.0025,f=-0.081) USER MOD Single : A 43 HIS : no HD1:sc= -0.058 X(o=-0.058,f=-0.25) USER MOD Single : A 44 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.296) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 53 GLN : amide:sc= -0.136 K(o=-0.14,f=-1.7!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0.00659 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.185 X(o=-0.19,f=-0.0053) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 13:sc= 0.553 USER MOD Single : A 79 CYS SG : rot 180:sc= -1.16 USER MOD Single : A 82 SER OG : rot 150:sc= -1.97! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.432 X(o=-0.43,f=0) USER MOD Single : A 98 CYS SG : rot 109:sc= 0.441 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.0122 X(o=-0.012,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.590 3.123 40.035 1.00 0.00 N ATOM 2 CA GLY A 1 5.873 1.897 39.727 1.00 0.00 C ATOM 3 C GLY A 1 6.093 1.485 38.269 1.00 0.00 C ATOM 4 O GLY A 1 7.231 1.360 37.821 1.00 0.00 O ATOM 0 H1 GLY A 1 6.425 3.381 41.029 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.608 2.978 39.879 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.251 3.888 39.418 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.209 1.099 40.389 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.808 2.038 39.912 1.00 0.00 H new ATOM 8 N SER A 2 4.985 1.287 37.571 1.00 0.00 N ATOM 9 CA SER A 2 5.042 0.892 36.174 1.00 0.00 C ATOM 10 C SER A 2 5.279 2.120 35.292 1.00 0.00 C ATOM 11 O SER A 2 5.161 3.253 35.755 1.00 0.00 O ATOM 12 CB SER A 2 3.758 0.175 35.751 1.00 0.00 C ATOM 13 OG SER A 2 3.868 -1.239 35.885 1.00 0.00 O ATOM 0 H SER A 2 4.043 1.393 37.947 1.00 0.00 H new ATOM 0 HA SER A 2 5.872 0.197 36.049 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.926 0.533 36.357 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.528 0.424 34.715 1.00 0.00 H new ATOM 0 HG SER A 2 3.028 -1.660 35.607 1.00 0.00 H new ATOM 19 N SER A 3 5.610 1.852 34.037 1.00 0.00 N ATOM 20 CA SER A 3 5.865 2.921 33.086 1.00 0.00 C ATOM 21 C SER A 3 5.569 2.439 31.665 1.00 0.00 C ATOM 22 O SER A 3 5.586 1.239 31.397 1.00 0.00 O ATOM 23 CB SER A 3 7.309 3.417 33.189 1.00 0.00 C ATOM 24 OG SER A 3 8.247 2.409 32.823 1.00 0.00 O ATOM 0 H SER A 3 5.707 0.911 33.657 1.00 0.00 H new ATOM 0 HA SER A 3 5.205 3.755 33.324 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.441 4.286 32.544 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.508 3.744 34.210 1.00 0.00 H new ATOM 0 HG SER A 3 9.157 2.765 32.900 1.00 0.00 H new ATOM 30 N GLY A 4 5.306 3.400 30.791 1.00 0.00 N ATOM 31 CA GLY A 4 5.007 3.088 29.404 1.00 0.00 C ATOM 32 C GLY A 4 4.221 4.223 28.744 1.00 0.00 C ATOM 33 O GLY A 4 3.466 4.929 29.410 1.00 0.00 O ATOM 0 H GLY A 4 5.294 4.395 31.017 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.935 2.918 28.858 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.432 2.164 29.351 1.00 0.00 H new ATOM 37 N SER A 5 4.426 4.363 27.442 1.00 0.00 N ATOM 38 CA SER A 5 3.747 5.400 26.685 1.00 0.00 C ATOM 39 C SER A 5 3.913 5.147 25.185 1.00 0.00 C ATOM 40 O SER A 5 5.034 5.047 24.689 1.00 0.00 O ATOM 41 CB SER A 5 4.278 6.787 27.051 1.00 0.00 C ATOM 42 OG SER A 5 3.760 7.801 26.194 1.00 0.00 O ATOM 0 H SER A 5 5.053 3.775 26.893 1.00 0.00 H new ATOM 0 HA SER A 5 2.687 5.368 26.937 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.014 7.015 28.084 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.366 6.785 26.994 1.00 0.00 H new ATOM 0 HG SER A 5 4.122 8.672 26.462 1.00 0.00 H new ATOM 48 N SER A 6 2.780 5.050 24.505 1.00 0.00 N ATOM 49 CA SER A 6 2.785 4.810 23.072 1.00 0.00 C ATOM 50 C SER A 6 2.187 6.012 22.338 1.00 0.00 C ATOM 51 O SER A 6 1.228 6.619 22.813 1.00 0.00 O ATOM 52 CB SER A 6 2.013 3.537 22.724 1.00 0.00 C ATOM 53 OG SER A 6 2.851 2.550 22.127 1.00 0.00 O ATOM 0 H SER A 6 1.852 5.133 24.920 1.00 0.00 H new ATOM 0 HA SER A 6 3.818 4.674 22.752 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.560 3.129 23.628 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.199 3.782 22.042 1.00 0.00 H new ATOM 0 HG SER A 6 2.321 1.752 21.921 1.00 0.00 H new ATOM 59 N GLY A 7 2.777 6.320 21.193 1.00 0.00 N ATOM 60 CA GLY A 7 2.314 7.438 20.388 1.00 0.00 C ATOM 61 C GLY A 7 0.819 7.314 20.087 1.00 0.00 C ATOM 62 O GLY A 7 0.253 6.225 20.170 1.00 0.00 O ATOM 0 H GLY A 7 3.572 5.815 20.803 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.507 8.373 20.913 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.875 7.475 19.454 1.00 0.00 H new ATOM 66 N TYR A 8 0.221 8.446 19.744 1.00 0.00 N ATOM 67 CA TYR A 8 -1.197 8.478 19.430 1.00 0.00 C ATOM 68 C TYR A 8 -1.444 8.090 17.970 1.00 0.00 C ATOM 69 O TYR A 8 -0.574 8.272 17.120 1.00 0.00 O ATOM 70 CB TYR A 8 -1.643 9.926 19.643 1.00 0.00 C ATOM 71 CG TYR A 8 -0.917 10.938 18.754 1.00 0.00 C ATOM 72 CD1 TYR A 8 -1.280 11.078 17.430 1.00 0.00 C ATOM 73 CD2 TYR A 8 0.100 11.710 19.277 1.00 0.00 C ATOM 74 CE1 TYR A 8 -0.597 12.031 16.594 1.00 0.00 C ATOM 75 CE2 TYR A 8 0.783 12.663 18.441 1.00 0.00 C ATOM 76 CZ TYR A 8 0.401 12.776 17.141 1.00 0.00 C ATOM 77 OH TYR A 8 1.046 13.676 16.351 1.00 0.00 O ATOM 0 H TYR A 8 0.693 9.348 19.677 1.00 0.00 H new ATOM 0 HA TYR A 8 -1.745 7.775 20.057 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -2.715 9.997 19.456 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -1.483 10.195 20.687 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -2.076 10.473 17.021 1.00 0.00 H new ATOM 0 HD2 TYR A 8 0.384 11.600 20.313 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -0.871 12.151 15.556 1.00 0.00 H new ATOM 0 HE2 TYR A 8 1.580 13.274 18.838 1.00 0.00 H new ATOM 0 HH TYR A 8 0.858 13.479 15.410 1.00 0.00 H new ATOM 87 N PRO A 9 -2.666 7.549 17.719 1.00 0.00 N ATOM 88 CA PRO A 9 -3.039 7.134 16.377 1.00 0.00 C ATOM 89 C PRO A 9 -3.356 8.345 15.497 1.00 0.00 C ATOM 90 O PRO A 9 -4.170 9.190 15.866 1.00 0.00 O ATOM 91 CB PRO A 9 -4.232 6.211 16.568 1.00 0.00 C ATOM 92 CG PRO A 9 -4.771 6.508 17.958 1.00 0.00 C ATOM 93 CD PRO A 9 -3.722 7.319 18.701 1.00 0.00 C ATOM 0 HA PRO A 9 -2.232 6.618 15.857 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.992 6.392 15.808 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -3.935 5.166 16.479 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -5.707 7.062 17.894 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -4.985 5.581 18.491 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.134 8.259 19.066 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.345 6.778 19.569 1.00 0.00 H new ATOM 101 N ILE A 10 -2.695 8.390 14.349 1.00 0.00 N ATOM 102 CA ILE A 10 -2.896 9.483 13.413 1.00 0.00 C ATOM 103 C ILE A 10 -4.196 9.255 12.640 1.00 0.00 C ATOM 104 O ILE A 10 -5.006 10.170 12.497 1.00 0.00 O ATOM 105 CB ILE A 10 -1.668 9.652 12.515 1.00 0.00 C ATOM 106 CG1 ILE A 10 -0.385 9.704 13.346 1.00 0.00 C ATOM 107 CG2 ILE A 10 -1.815 10.877 11.610 1.00 0.00 C ATOM 108 CD1 ILE A 10 0.803 9.150 12.555 1.00 0.00 C ATOM 0 H ILE A 10 -2.020 7.687 14.046 1.00 0.00 H new ATOM 0 HA ILE A 10 -3.004 10.427 13.947 1.00 0.00 H new ATOM 0 HB ILE A 10 -1.596 8.779 11.866 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -0.181 10.733 13.643 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -0.517 9.128 14.262 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -0.929 10.974 10.982 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -2.696 10.759 10.979 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.925 11.771 12.223 1.00 0.00 H new ATOM 0 HD11 ILE A 10 1.703 9.198 13.168 1.00 0.00 H new ATOM 0 HD12 ILE A 10 0.606 8.114 12.281 1.00 0.00 H new ATOM 0 HD13 ILE A 10 0.947 9.743 11.652 1.00 0.00 H new ATOM 120 N GLY A 11 -4.356 8.030 12.162 1.00 0.00 N ATOM 121 CA GLY A 11 -5.544 7.670 11.408 1.00 0.00 C ATOM 122 C GLY A 11 -5.629 6.156 11.207 1.00 0.00 C ATOM 123 O GLY A 11 -4.620 5.504 10.943 1.00 0.00 O ATOM 0 H GLY A 11 -3.682 7.274 12.282 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -6.432 8.021 11.933 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -5.529 8.169 10.439 1.00 0.00 H new ATOM 127 N GLU A 12 -6.842 5.640 11.339 1.00 0.00 N ATOM 128 CA GLU A 12 -7.071 4.215 11.175 1.00 0.00 C ATOM 129 C GLU A 12 -7.758 3.938 9.837 1.00 0.00 C ATOM 130 O GLU A 12 -8.815 4.498 9.549 1.00 0.00 O ATOM 131 CB GLU A 12 -7.891 3.654 12.339 1.00 0.00 C ATOM 132 CG GLU A 12 -8.239 2.182 12.106 1.00 0.00 C ATOM 133 CD GLU A 12 -9.538 2.045 11.309 1.00 0.00 C ATOM 134 OE1 GLU A 12 -10.597 2.366 11.891 1.00 0.00 O ATOM 135 OE2 GLU A 12 -9.443 1.623 10.136 1.00 0.00 O ATOM 0 H GLU A 12 -7.677 6.184 11.558 1.00 0.00 H new ATOM 0 HA GLU A 12 -6.105 3.709 11.177 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -7.328 3.756 13.267 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -8.807 4.234 12.456 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -7.426 1.693 11.570 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -8.341 1.673 13.064 1.00 0.00 H new ATOM 142 N ALA A 13 -7.130 3.073 9.053 1.00 0.00 N ATOM 143 CA ALA A 13 -7.667 2.715 7.752 1.00 0.00 C ATOM 144 C ALA A 13 -8.142 1.261 7.783 1.00 0.00 C ATOM 145 O ALA A 13 -7.418 0.377 8.238 1.00 0.00 O ATOM 146 CB ALA A 13 -6.607 2.959 6.676 1.00 0.00 C ATOM 0 H ALA A 13 -6.254 2.610 9.295 1.00 0.00 H new ATOM 0 HA ALA A 13 -8.528 3.338 7.508 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -7.011 2.690 5.700 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.326 4.012 6.675 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -5.728 2.349 6.886 1.00 0.00 H new ATOM 152 N SER A 14 -9.356 1.058 7.293 1.00 0.00 N ATOM 153 CA SER A 14 -9.936 -0.274 7.259 1.00 0.00 C ATOM 154 C SER A 14 -9.724 -0.903 5.881 1.00 0.00 C ATOM 155 O SER A 14 -9.805 -0.217 4.863 1.00 0.00 O ATOM 156 CB SER A 14 -11.427 -0.235 7.601 1.00 0.00 C ATOM 157 OG SER A 14 -11.723 0.750 8.588 1.00 0.00 O ATOM 0 H SER A 14 -9.954 1.793 6.916 1.00 0.00 H new ATOM 0 HA SER A 14 -9.434 -0.884 8.010 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.001 -0.027 6.698 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.742 -1.215 7.960 1.00 0.00 H new ATOM 0 HG SER A 14 -10.939 0.885 9.161 1.00 0.00 H new ATOM 163 N ILE A 15 -9.457 -2.200 5.892 1.00 0.00 N ATOM 164 CA ILE A 15 -9.233 -2.929 4.655 1.00 0.00 C ATOM 165 C ILE A 15 -10.580 -3.349 4.064 1.00 0.00 C ATOM 166 O ILE A 15 -11.342 -4.074 4.701 1.00 0.00 O ATOM 167 CB ILE A 15 -8.272 -4.097 4.888 1.00 0.00 C ATOM 168 CG1 ILE A 15 -6.838 -3.598 5.078 1.00 0.00 C ATOM 169 CG2 ILE A 15 -8.376 -5.125 3.760 1.00 0.00 C ATOM 170 CD1 ILE A 15 -5.895 -4.755 5.415 1.00 0.00 C ATOM 0 H ILE A 15 -9.391 -2.766 6.738 1.00 0.00 H new ATOM 0 HA ILE A 15 -8.747 -2.289 3.918 1.00 0.00 H new ATOM 0 HB ILE A 15 -8.563 -4.600 5.810 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -6.499 -3.101 4.169 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.810 -2.857 5.877 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.683 -5.945 3.950 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -9.393 -5.513 3.714 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.126 -4.651 2.811 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.882 -4.373 5.545 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.223 -5.235 6.337 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.907 -5.482 4.603 1.00 0.00 H new ATOM 182 N LEU A 16 -10.832 -2.875 2.853 1.00 0.00 N ATOM 183 CA LEU A 16 -12.075 -3.193 2.169 1.00 0.00 C ATOM 184 C LEU A 16 -11.870 -4.435 1.299 1.00 0.00 C ATOM 185 O LEU A 16 -12.736 -5.306 1.241 1.00 0.00 O ATOM 186 CB LEU A 16 -12.585 -1.976 1.394 1.00 0.00 C ATOM 187 CG LEU A 16 -12.411 -0.621 2.081 1.00 0.00 C ATOM 188 CD1 LEU A 16 -12.894 0.517 1.180 1.00 0.00 C ATOM 189 CD2 LEU A 16 -13.103 -0.605 3.446 1.00 0.00 C ATOM 0 H LEU A 16 -10.197 -2.274 2.328 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.856 -3.434 2.890 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.072 -1.942 0.433 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.645 -2.121 1.185 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.347 -0.462 2.258 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -12.759 1.469 1.693 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -12.318 0.518 0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.950 0.375 0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -12.964 0.370 3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.168 -0.796 3.316 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -12.670 -1.377 4.082 1.00 0.00 H new ATOM 201 N ALA A 17 -10.719 -4.476 0.645 1.00 0.00 N ATOM 202 CA ALA A 17 -10.389 -5.597 -0.219 1.00 0.00 C ATOM 203 C ALA A 17 -8.905 -5.935 -0.065 1.00 0.00 C ATOM 204 O ALA A 17 -8.118 -5.103 0.385 1.00 0.00 O ATOM 205 CB ALA A 17 -10.762 -5.256 -1.663 1.00 0.00 C ATOM 0 H ALA A 17 -10.003 -3.751 0.696 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.960 -6.481 0.065 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -10.514 -6.097 -2.311 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.831 -5.053 -1.724 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.206 -4.375 -1.984 1.00 0.00 H new ATOM 211 N THR A 18 -8.567 -7.158 -0.447 1.00 0.00 N ATOM 212 CA THR A 18 -7.191 -7.617 -0.356 1.00 0.00 C ATOM 213 C THR A 18 -6.833 -8.472 -1.573 1.00 0.00 C ATOM 214 O THR A 18 -7.661 -9.239 -2.063 1.00 0.00 O ATOM 215 CB THR A 18 -7.024 -8.353 0.974 1.00 0.00 C ATOM 216 OG1 THR A 18 -7.682 -9.600 0.766 1.00 0.00 O ATOM 217 CG2 THR A 18 -7.816 -7.699 2.109 1.00 0.00 C ATOM 0 H THR A 18 -9.222 -7.845 -0.820 1.00 0.00 H new ATOM 0 HA THR A 18 -6.493 -6.780 -0.369 1.00 0.00 H new ATOM 0 HB THR A 18 -5.968 -8.386 1.240 1.00 0.00 H new ATOM 0 HG1 THR A 18 -7.620 -10.142 1.580 1.00 0.00 H new ATOM 0 HG21 THR A 18 -7.663 -8.261 3.030 1.00 0.00 H new ATOM 0 HG22 THR A 18 -7.474 -6.674 2.248 1.00 0.00 H new ATOM 0 HG23 THR A 18 -8.877 -7.696 1.858 1.00 0.00 H new ATOM 225 N PHE A 19 -5.598 -8.312 -2.026 1.00 0.00 N ATOM 226 CA PHE A 19 -5.120 -9.060 -3.177 1.00 0.00 C ATOM 227 C PHE A 19 -3.592 -9.047 -3.243 1.00 0.00 C ATOM 228 O PHE A 19 -2.935 -8.452 -2.390 1.00 0.00 O ATOM 229 CB PHE A 19 -5.678 -8.369 -4.423 1.00 0.00 C ATOM 230 CG PHE A 19 -5.218 -6.920 -4.589 1.00 0.00 C ATOM 231 CD1 PHE A 19 -3.927 -6.649 -4.920 1.00 0.00 C ATOM 232 CD2 PHE A 19 -6.101 -5.901 -4.406 1.00 0.00 C ATOM 233 CE1 PHE A 19 -3.500 -5.304 -5.074 1.00 0.00 C ATOM 234 CE2 PHE A 19 -5.674 -4.556 -4.561 1.00 0.00 C ATOM 235 CZ PHE A 19 -4.383 -4.285 -4.891 1.00 0.00 C ATOM 0 H PHE A 19 -4.914 -7.676 -1.617 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.445 -10.098 -3.107 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.381 -8.937 -5.305 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -6.767 -8.391 -4.381 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.226 -7.458 -5.066 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.126 -6.115 -4.143 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -2.475 -5.090 -5.336 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -6.375 -3.747 -4.417 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.059 -3.262 -5.008 1.00 0.00 H new ATOM 245 N THR A 20 -3.070 -9.712 -4.263 1.00 0.00 N ATOM 246 CA THR A 20 -1.631 -9.785 -4.451 1.00 0.00 C ATOM 247 C THR A 20 -1.241 -9.204 -5.813 1.00 0.00 C ATOM 248 O THR A 20 -2.084 -9.066 -6.697 1.00 0.00 O ATOM 249 CB THR A 20 -1.203 -11.242 -4.267 1.00 0.00 C ATOM 250 OG1 THR A 20 -2.067 -11.731 -3.245 1.00 0.00 O ATOM 251 CG2 THR A 20 0.197 -11.369 -3.663 1.00 0.00 C ATOM 0 H THR A 20 -3.618 -10.205 -4.968 1.00 0.00 H new ATOM 0 HA THR A 20 -1.104 -9.181 -3.712 1.00 0.00 H new ATOM 0 HB THR A 20 -1.231 -11.753 -5.230 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.859 -12.671 -3.063 1.00 0.00 H new ATOM 0 HG21 THR A 20 0.452 -12.423 -3.554 1.00 0.00 H new ATOM 0 HG22 THR A 20 0.922 -10.887 -4.319 1.00 0.00 H new ATOM 0 HG23 THR A 20 0.216 -10.888 -2.685 1.00 0.00 H new ATOM 259 N VAL A 21 0.038 -8.880 -5.938 1.00 0.00 N ATOM 260 CA VAL A 21 0.549 -8.318 -7.176 1.00 0.00 C ATOM 261 C VAL A 21 1.813 -9.074 -7.590 1.00 0.00 C ATOM 262 O VAL A 21 2.457 -9.715 -6.761 1.00 0.00 O ATOM 263 CB VAL A 21 0.779 -6.814 -7.012 1.00 0.00 C ATOM 264 CG1 VAL A 21 -0.548 -6.054 -7.013 1.00 0.00 C ATOM 265 CG2 VAL A 21 1.581 -6.517 -5.744 1.00 0.00 C ATOM 0 H VAL A 21 0.735 -8.996 -5.202 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.179 -8.437 -7.979 1.00 0.00 H new ATOM 0 HB VAL A 21 1.363 -6.469 -7.865 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.357 -4.987 -6.895 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.066 -6.228 -7.956 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -1.169 -6.405 -6.188 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.730 -5.441 -5.652 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.036 -6.884 -4.874 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.549 -7.014 -5.801 1.00 0.00 H new ATOM 275 N THR A 22 2.131 -8.975 -8.872 1.00 0.00 N ATOM 276 CA THR A 22 3.306 -9.641 -9.407 1.00 0.00 C ATOM 277 C THR A 22 4.349 -8.612 -9.848 1.00 0.00 C ATOM 278 O THR A 22 4.021 -7.647 -10.536 1.00 0.00 O ATOM 279 CB THR A 22 2.851 -10.568 -10.536 1.00 0.00 C ATOM 280 OG1 THR A 22 1.725 -11.251 -9.993 1.00 0.00 O ATOM 281 CG2 THR A 22 3.860 -11.682 -10.822 1.00 0.00 C ATOM 0 H THR A 22 1.594 -8.443 -9.557 1.00 0.00 H new ATOM 0 HA THR A 22 3.797 -10.248 -8.646 1.00 0.00 H new ATOM 0 HB THR A 22 2.689 -9.983 -11.442 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.366 -11.872 -10.661 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.488 -12.311 -11.631 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.814 -11.243 -11.113 1.00 0.00 H new ATOM 0 HG23 THR A 22 3.997 -12.287 -9.926 1.00 0.00 H new ATOM 289 N GLU A 23 5.583 -8.853 -9.432 1.00 0.00 N ATOM 290 CA GLU A 23 6.676 -7.959 -9.776 1.00 0.00 C ATOM 291 C GLU A 23 7.931 -8.764 -10.124 1.00 0.00 C ATOM 292 O GLU A 23 8.651 -9.212 -9.234 1.00 0.00 O ATOM 293 CB GLU A 23 6.955 -6.973 -8.640 1.00 0.00 C ATOM 294 CG GLU A 23 5.756 -6.053 -8.405 1.00 0.00 C ATOM 295 CD GLU A 23 6.046 -4.636 -8.904 1.00 0.00 C ATOM 296 OE1 GLU A 23 6.651 -4.530 -9.993 1.00 0.00 O ATOM 297 OE2 GLU A 23 5.656 -3.690 -8.185 1.00 0.00 O ATOM 0 H GLU A 23 5.851 -9.654 -8.860 1.00 0.00 H new ATOM 0 HA GLU A 23 6.385 -7.380 -10.653 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.182 -7.521 -7.726 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.835 -6.376 -8.880 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.881 -6.451 -8.919 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.517 -6.026 -7.342 1.00 0.00 H new ATOM 304 N GLY A 24 8.152 -8.921 -11.421 1.00 0.00 N ATOM 305 CA GLY A 24 9.307 -9.663 -11.897 1.00 0.00 C ATOM 306 C GLY A 24 9.295 -11.098 -11.364 1.00 0.00 C ATOM 307 O GLY A 24 10.308 -11.588 -10.869 1.00 0.00 O ATOM 0 H GLY A 24 7.552 -8.548 -12.156 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.311 -9.676 -12.987 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.222 -9.161 -11.581 1.00 0.00 H new ATOM 311 N LYS A 25 8.137 -11.730 -11.484 1.00 0.00 N ATOM 312 CA LYS A 25 7.980 -13.098 -11.021 1.00 0.00 C ATOM 313 C LYS A 25 7.541 -13.088 -9.555 1.00 0.00 C ATOM 314 O LYS A 25 6.657 -13.849 -9.163 1.00 0.00 O ATOM 315 CB LYS A 25 9.258 -13.900 -11.274 1.00 0.00 C ATOM 316 CG LYS A 25 8.932 -15.345 -11.655 1.00 0.00 C ATOM 317 CD LYS A 25 9.014 -16.266 -10.436 1.00 0.00 C ATOM 318 CE LYS A 25 10.278 -17.126 -10.482 1.00 0.00 C ATOM 319 NZ LYS A 25 10.456 -17.855 -9.206 1.00 0.00 N ATOM 0 H LYS A 25 7.298 -11.320 -11.895 1.00 0.00 H new ATOM 0 HA LYS A 25 7.197 -13.604 -11.586 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.834 -13.431 -12.072 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.882 -13.888 -10.381 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.932 -15.394 -12.086 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.627 -15.688 -12.422 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.009 -15.669 -9.524 1.00 0.00 H new ATOM 0 HD3 LYS A 25 8.134 -16.908 -10.401 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.212 -17.836 -11.307 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.147 -16.496 -10.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 11.319 -18.434 -9.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 10.540 -17.173 -8.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 9.635 -18.471 -9.041 1.00 0.00 H new ATOM 333 N LYS A 26 8.178 -12.218 -8.786 1.00 0.00 N ATOM 334 CA LYS A 26 7.864 -12.099 -7.372 1.00 0.00 C ATOM 335 C LYS A 26 6.370 -11.811 -7.208 1.00 0.00 C ATOM 336 O LYS A 26 5.715 -11.359 -8.146 1.00 0.00 O ATOM 337 CB LYS A 26 8.767 -11.058 -6.708 1.00 0.00 C ATOM 338 CG LYS A 26 9.673 -11.707 -5.660 1.00 0.00 C ATOM 339 CD LYS A 26 9.163 -11.426 -4.245 1.00 0.00 C ATOM 340 CE LYS A 26 9.763 -10.132 -3.693 1.00 0.00 C ATOM 341 NZ LYS A 26 9.392 -9.954 -2.271 1.00 0.00 N ATOM 0 H LYS A 26 8.910 -11.589 -9.115 1.00 0.00 H new ATOM 0 HA LYS A 26 8.067 -13.038 -6.857 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.376 -10.564 -7.465 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.156 -10.287 -6.238 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.716 -12.783 -5.828 1.00 0.00 H new ATOM 0 HG3 LYS A 26 10.689 -11.327 -5.767 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.076 -11.352 -4.255 1.00 0.00 H new ATOM 0 HD3 LYS A 26 9.420 -12.259 -3.590 1.00 0.00 H new ATOM 0 HE2 LYS A 26 10.848 -10.156 -3.792 1.00 0.00 H new ATOM 0 HE3 LYS A 26 9.409 -9.282 -4.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 9.807 -9.071 -1.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 8.356 -9.909 -2.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 9.751 -10.756 -1.715 1.00 0.00 H new ATOM 355 N LYS A 27 5.875 -12.084 -6.010 1.00 0.00 N ATOM 356 CA LYS A 27 4.471 -11.860 -5.711 1.00 0.00 C ATOM 357 C LYS A 27 4.350 -11.114 -4.381 1.00 0.00 C ATOM 358 O LYS A 27 4.469 -11.716 -3.315 1.00 0.00 O ATOM 359 CB LYS A 27 3.698 -13.180 -5.749 1.00 0.00 C ATOM 360 CG LYS A 27 3.724 -13.791 -7.151 1.00 0.00 C ATOM 361 CD LYS A 27 2.554 -14.756 -7.351 1.00 0.00 C ATOM 362 CE LYS A 27 1.373 -14.054 -8.025 1.00 0.00 C ATOM 363 NZ LYS A 27 0.141 -14.862 -7.884 1.00 0.00 N ATOM 0 H LYS A 27 6.422 -12.459 -5.234 1.00 0.00 H new ATOM 0 HA LYS A 27 4.015 -11.228 -6.473 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.132 -13.880 -5.035 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.666 -13.010 -5.442 1.00 0.00 H new ATOM 0 HG2 LYS A 27 3.678 -12.998 -7.898 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.665 -14.319 -7.304 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.875 -15.601 -7.960 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.241 -15.158 -6.388 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.223 -13.071 -7.578 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.592 -13.894 -9.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.651 -14.371 -8.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.282 -15.790 -8.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -0.075 -14.993 -6.875 1.00 0.00 H new ATOM 377 N ILE A 28 4.115 -9.814 -4.487 1.00 0.00 N ATOM 378 CA ILE A 28 3.976 -8.980 -3.306 1.00 0.00 C ATOM 379 C ILE A 28 2.491 -8.812 -2.977 1.00 0.00 C ATOM 380 O ILE A 28 1.710 -8.376 -3.822 1.00 0.00 O ATOM 381 CB ILE A 28 4.718 -7.656 -3.495 1.00 0.00 C ATOM 382 CG1 ILE A 28 6.171 -7.896 -3.909 1.00 0.00 C ATOM 383 CG2 ILE A 28 4.615 -6.785 -2.241 1.00 0.00 C ATOM 384 CD1 ILE A 28 6.254 -8.421 -5.343 1.00 0.00 C ATOM 0 H ILE A 28 4.017 -9.318 -5.373 1.00 0.00 H new ATOM 0 HA ILE A 28 4.441 -9.459 -2.444 1.00 0.00 H new ATOM 0 HB ILE A 28 4.238 -7.109 -4.307 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.735 -6.967 -3.825 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.633 -8.612 -3.229 1.00 0.00 H new ATOM 0 HG21 ILE A 28 5.151 -5.850 -2.403 1.00 0.00 H new ATOM 0 HG22 ILE A 28 3.567 -6.571 -2.032 1.00 0.00 H new ATOM 0 HG23 ILE A 28 5.054 -7.313 -1.394 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.298 -8.583 -5.611 1.00 0.00 H new ATOM 0 HD12 ILE A 28 5.710 -9.363 -5.418 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.813 -7.692 -6.023 1.00 0.00 H new ATOM 396 N PRO A 29 2.137 -9.175 -1.715 1.00 0.00 N ATOM 397 CA PRO A 29 0.760 -9.068 -1.265 1.00 0.00 C ATOM 398 C PRO A 29 0.385 -7.611 -0.987 1.00 0.00 C ATOM 399 O PRO A 29 1.093 -6.911 -0.265 1.00 0.00 O ATOM 400 CB PRO A 29 0.682 -9.947 -0.027 1.00 0.00 C ATOM 401 CG PRO A 29 2.116 -10.142 0.437 1.00 0.00 C ATOM 402 CD PRO A 29 3.035 -9.695 -0.688 1.00 0.00 C ATOM 0 HA PRO A 29 0.045 -9.398 -2.018 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.081 -9.475 0.750 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.212 -10.903 -0.256 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.307 -9.562 1.340 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.298 -11.188 0.686 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.734 -8.930 -0.349 1.00 0.00 H new ATOM 0 HD3 PRO A 29 3.631 -10.526 -1.066 1.00 0.00 H new ATOM 410 N VAL A 30 -0.728 -7.197 -1.576 1.00 0.00 N ATOM 411 CA VAL A 30 -1.205 -5.836 -1.401 1.00 0.00 C ATOM 412 C VAL A 30 -2.523 -5.858 -0.623 1.00 0.00 C ATOM 413 O VAL A 30 -3.225 -6.868 -0.613 1.00 0.00 O ATOM 414 CB VAL A 30 -1.325 -5.145 -2.761 1.00 0.00 C ATOM 415 CG1 VAL A 30 -2.091 -3.826 -2.640 1.00 0.00 C ATOM 416 CG2 VAL A 30 0.053 -4.924 -3.386 1.00 0.00 C ATOM 0 H VAL A 30 -1.313 -7.780 -2.175 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.492 -5.253 -0.817 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.891 -5.801 -3.422 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.162 -3.355 -3.621 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.093 -4.021 -2.258 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.564 -3.161 -1.956 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -0.060 -4.431 -4.352 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.655 -4.298 -2.728 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.548 -5.885 -3.525 1.00 0.00 H new ATOM 426 N ALA A 31 -2.819 -4.732 0.009 1.00 0.00 N ATOM 427 CA ALA A 31 -4.040 -4.610 0.787 1.00 0.00 C ATOM 428 C ALA A 31 -4.651 -3.227 0.554 1.00 0.00 C ATOM 429 O ALA A 31 -4.021 -2.210 0.839 1.00 0.00 O ATOM 430 CB ALA A 31 -3.733 -4.870 2.263 1.00 0.00 C ATOM 0 H ALA A 31 -2.235 -3.896 -0.002 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.773 -5.352 0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.649 -4.778 2.847 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.328 -5.875 2.379 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.003 -4.142 2.617 1.00 0.00 H new ATOM 436 N ASP A 32 -5.872 -3.234 0.038 1.00 0.00 N ATOM 437 CA ASP A 32 -6.576 -1.993 -0.236 1.00 0.00 C ATOM 438 C ASP A 32 -7.409 -1.603 0.986 1.00 0.00 C ATOM 439 O ASP A 32 -8.309 -2.338 1.389 1.00 0.00 O ATOM 440 CB ASP A 32 -7.526 -2.150 -1.425 1.00 0.00 C ATOM 441 CG ASP A 32 -7.146 -1.341 -2.668 1.00 0.00 C ATOM 442 OD1 ASP A 32 -6.147 -0.596 -2.576 1.00 0.00 O ATOM 443 OD2 ASP A 32 -7.864 -1.487 -3.680 1.00 0.00 O ATOM 0 H ASP A 32 -6.391 -4.080 -0.197 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.834 -1.228 -0.465 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.573 -3.205 -1.697 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.528 -1.857 -1.111 1.00 0.00 H new ATOM 448 N CYS A 33 -7.079 -0.446 1.543 1.00 0.00 N ATOM 449 CA CYS A 33 -7.785 0.050 2.711 1.00 0.00 C ATOM 450 C CYS A 33 -8.177 1.507 2.453 1.00 0.00 C ATOM 451 O CYS A 33 -7.398 2.271 1.884 1.00 0.00 O ATOM 452 CB CYS A 33 -6.949 -0.099 3.984 1.00 0.00 C ATOM 453 SG CYS A 33 -5.193 0.275 3.626 1.00 0.00 S ATOM 0 H CYS A 33 -6.332 0.161 1.206 1.00 0.00 H new ATOM 0 HA CYS A 33 -8.684 -0.544 2.874 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -7.323 0.574 4.756 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -7.042 -1.113 4.373 1.00 0.00 H new ATOM 0 HG CYS A 33 -4.492 0.148 4.713 1.00 0.00 H new ATOM 459 N ARG A 34 -9.383 1.847 2.883 1.00 0.00 N ATOM 460 CA ARG A 34 -9.887 3.198 2.705 1.00 0.00 C ATOM 461 C ARG A 34 -9.833 3.963 4.029 1.00 0.00 C ATOM 462 O ARG A 34 -10.422 3.537 5.021 1.00 0.00 O ATOM 463 CB ARG A 34 -11.328 3.185 2.190 1.00 0.00 C ATOM 464 CG ARG A 34 -11.700 4.532 1.568 1.00 0.00 C ATOM 465 CD ARG A 34 -12.886 5.165 2.299 1.00 0.00 C ATOM 466 NE ARG A 34 -13.744 5.892 1.337 1.00 0.00 N ATOM 467 CZ ARG A 34 -14.858 6.555 1.675 1.00 0.00 C ATOM 468 NH1 ARG A 34 -15.257 6.585 2.954 1.00 0.00 N ATOM 469 NH2 ARG A 34 -15.574 7.186 0.735 1.00 0.00 N ATOM 0 H ARG A 34 -10.026 1.210 3.354 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.254 3.694 1.969 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -11.446 2.394 1.450 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -12.009 2.959 3.010 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -10.843 5.204 1.608 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -11.948 4.394 0.516 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -13.466 4.393 2.805 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -12.527 5.849 3.068 1.00 0.00 H new ATOM 0 HE ARG A 34 -13.470 5.888 0.355 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -14.713 6.103 3.669 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -16.105 7.090 3.212 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -15.271 7.162 -0.239 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -16.422 7.691 0.993 1.00 0.00 H new ATOM 483 N VAL A 35 -9.120 5.080 4.002 1.00 0.00 N ATOM 484 CA VAL A 35 -8.981 5.908 5.187 1.00 0.00 C ATOM 485 C VAL A 35 -10.368 6.206 5.761 1.00 0.00 C ATOM 486 O VAL A 35 -11.249 6.684 5.048 1.00 0.00 O ATOM 487 CB VAL A 35 -8.188 7.173 4.852 1.00 0.00 C ATOM 488 CG1 VAL A 35 -8.016 8.056 6.089 1.00 0.00 C ATOM 489 CG2 VAL A 35 -6.833 6.823 4.235 1.00 0.00 C ATOM 0 H VAL A 35 -8.632 5.430 3.177 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.417 5.382 5.957 1.00 0.00 H new ATOM 0 HB VAL A 35 -8.756 7.739 4.114 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.449 8.948 5.823 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.996 8.348 6.467 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.480 7.502 6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.290 7.740 4.006 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.256 6.225 4.940 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -6.987 6.254 3.318 1.00 0.00 H new ATOM 499 N GLN A 36 -10.518 5.912 7.044 1.00 0.00 N ATOM 500 CA GLN A 36 -11.783 6.143 7.722 1.00 0.00 C ATOM 501 C GLN A 36 -11.728 7.449 8.517 1.00 0.00 C ATOM 502 O GLN A 36 -12.710 8.187 8.573 1.00 0.00 O ATOM 503 CB GLN A 36 -12.143 4.964 8.627 1.00 0.00 C ATOM 504 CG GLN A 36 -12.120 3.647 7.848 1.00 0.00 C ATOM 505 CD GLN A 36 -13.519 3.032 7.771 1.00 0.00 C ATOM 506 OE1 GLN A 36 -14.369 3.249 8.619 1.00 0.00 O ATOM 507 NE2 GLN A 36 -13.710 2.253 6.710 1.00 0.00 N ATOM 0 H GLN A 36 -9.785 5.516 7.632 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.566 6.232 6.969 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.440 4.911 9.458 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -13.133 5.119 9.056 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -11.740 3.822 6.842 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -11.437 2.947 8.330 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -12.956 2.113 6.038 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -14.611 1.795 6.569 1.00 0.00 H new ATOM 516 N LYS A 37 -10.570 7.693 9.113 1.00 0.00 N ATOM 517 CA LYS A 37 -10.375 8.897 9.903 1.00 0.00 C ATOM 518 C LYS A 37 -8.925 9.365 9.761 1.00 0.00 C ATOM 519 O LYS A 37 -8.021 8.551 9.581 1.00 0.00 O ATOM 520 CB LYS A 37 -10.806 8.663 11.352 1.00 0.00 C ATOM 521 CG LYS A 37 -9.653 8.095 12.182 1.00 0.00 C ATOM 522 CD LYS A 37 -10.150 7.012 13.143 1.00 0.00 C ATOM 523 CE LYS A 37 -9.426 7.098 14.488 1.00 0.00 C ATOM 524 NZ LYS A 37 -9.668 5.874 15.285 1.00 0.00 N ATOM 0 H LYS A 37 -9.758 7.078 9.065 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.009 9.703 9.532 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.146 9.601 11.790 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.651 7.975 11.377 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.894 7.678 11.520 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.177 8.897 12.747 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.224 7.122 13.296 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -9.990 6.028 12.702 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.356 7.227 14.324 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -9.772 7.972 15.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -9.170 5.948 16.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.688 5.767 15.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -9.316 5.045 14.764 1.00 0.00 H new ATOM 538 N GLY A 38 -8.749 10.676 9.847 1.00 0.00 N ATOM 539 CA GLY A 38 -7.425 11.262 9.730 1.00 0.00 C ATOM 540 C GLY A 38 -6.805 10.949 8.367 1.00 0.00 C ATOM 541 O GLY A 38 -7.470 11.058 7.339 1.00 0.00 O ATOM 0 H GLY A 38 -9.501 11.348 9.996 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.488 12.342 9.865 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.782 10.878 10.522 1.00 0.00 H new ATOM 545 N GLN A 39 -5.537 10.566 8.403 1.00 0.00 N ATOM 546 CA GLN A 39 -4.819 10.236 7.184 1.00 0.00 C ATOM 547 C GLN A 39 -3.655 9.293 7.491 1.00 0.00 C ATOM 548 O GLN A 39 -3.390 8.986 8.653 1.00 0.00 O ATOM 549 CB GLN A 39 -4.328 11.501 6.477 1.00 0.00 C ATOM 550 CG GLN A 39 -3.670 12.462 7.469 1.00 0.00 C ATOM 551 CD GLN A 39 -3.648 13.889 6.918 1.00 0.00 C ATOM 552 OE1 GLN A 39 -4.663 14.453 6.543 1.00 0.00 O ATOM 553 NE2 GLN A 39 -2.437 14.440 6.889 1.00 0.00 N ATOM 0 H GLN A 39 -4.988 10.477 9.258 1.00 0.00 H new ATOM 0 HA GLN A 39 -5.506 9.725 6.509 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -3.615 11.233 5.697 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -5.166 11.996 5.986 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -4.212 12.442 8.414 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -2.652 12.133 7.678 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -1.629 13.912 7.218 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -2.317 15.390 6.538 1.00 0.00 H new ATOM 562 N LEU A 40 -2.990 8.858 6.430 1.00 0.00 N ATOM 563 CA LEU A 40 -1.860 7.956 6.573 1.00 0.00 C ATOM 564 C LEU A 40 -0.596 8.643 6.052 1.00 0.00 C ATOM 565 O LEU A 40 -0.557 9.096 4.910 1.00 0.00 O ATOM 566 CB LEU A 40 -2.155 6.617 5.895 1.00 0.00 C ATOM 567 CG LEU A 40 -3.420 5.893 6.361 1.00 0.00 C ATOM 568 CD1 LEU A 40 -3.608 4.575 5.607 1.00 0.00 C ATOM 569 CD2 LEU A 40 -3.408 5.689 7.877 1.00 0.00 C ATOM 0 H LEU A 40 -3.212 9.114 5.468 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.688 7.724 7.624 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.232 6.785 4.821 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.303 5.956 6.054 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.279 6.522 6.127 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.514 4.081 5.958 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.694 4.776 4.539 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.750 3.928 5.786 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.318 5.172 8.182 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.540 5.091 8.157 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.357 6.658 8.374 1.00 0.00 H new ATOM 581 N GLU A 41 0.407 8.699 6.917 1.00 0.00 N ATOM 582 CA GLU A 41 1.669 9.324 6.559 1.00 0.00 C ATOM 583 C GLU A 41 2.733 8.256 6.296 1.00 0.00 C ATOM 584 O GLU A 41 3.076 7.483 7.190 1.00 0.00 O ATOM 585 CB GLU A 41 2.126 10.298 7.646 1.00 0.00 C ATOM 586 CG GLU A 41 1.048 11.345 7.933 1.00 0.00 C ATOM 587 CD GLU A 41 1.400 12.170 9.172 1.00 0.00 C ATOM 588 OE1 GLU A 41 2.587 12.547 9.284 1.00 0.00 O ATOM 589 OE2 GLU A 41 0.476 12.405 9.979 1.00 0.00 O ATOM 0 H GLU A 41 0.371 8.322 7.864 1.00 0.00 H new ATOM 0 HA GLU A 41 1.523 9.897 5.643 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.356 9.748 8.559 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.045 10.793 7.332 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.938 12.004 7.072 1.00 0.00 H new ATOM 0 HG3 GLU A 41 0.087 10.852 8.081 1.00 0.00 H new ATOM 596 N ARG A 42 3.227 8.248 5.067 1.00 0.00 N ATOM 597 CA ARG A 42 4.245 7.288 4.676 1.00 0.00 C ATOM 598 C ARG A 42 5.489 7.447 5.552 1.00 0.00 C ATOM 599 O ARG A 42 5.750 8.530 6.075 1.00 0.00 O ATOM 600 CB ARG A 42 4.638 7.469 3.208 1.00 0.00 C ATOM 601 CG ARG A 42 4.218 6.256 2.375 1.00 0.00 C ATOM 602 CD ARG A 42 5.171 5.080 2.600 1.00 0.00 C ATOM 603 NE ARG A 42 6.545 5.460 2.204 1.00 0.00 N ATOM 604 CZ ARG A 42 7.652 4.857 2.659 1.00 0.00 C ATOM 605 NH1 ARG A 42 7.552 3.843 3.530 1.00 0.00 N ATOM 606 NH2 ARG A 42 8.858 5.268 2.245 1.00 0.00 N ATOM 0 H ARG A 42 2.941 8.891 4.329 1.00 0.00 H new ATOM 0 HA ARG A 42 3.828 6.290 4.809 1.00 0.00 H new ATOM 0 HB2 ARG A 42 4.168 8.368 2.810 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.716 7.612 3.131 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.203 5.962 2.641 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.207 6.522 1.318 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.155 4.783 3.649 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.842 4.218 2.020 1.00 0.00 H new ATOM 0 HE ARG A 42 6.657 6.229 1.543 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.634 3.531 3.846 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.394 3.384 3.877 1.00 0.00 H new ATOM 0 HH21 ARG A 42 8.934 6.040 1.583 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.700 4.809 2.592 1.00 0.00 H new ATOM 620 N HIS A 43 6.224 6.353 5.686 1.00 0.00 N ATOM 621 CA HIS A 43 7.434 6.357 6.490 1.00 0.00 C ATOM 622 C HIS A 43 7.088 6.014 7.940 1.00 0.00 C ATOM 623 O HIS A 43 7.799 5.246 8.587 1.00 0.00 O ATOM 624 CB HIS A 43 8.170 7.692 6.356 1.00 0.00 C ATOM 625 CG HIS A 43 9.665 7.589 6.540 1.00 0.00 C ATOM 626 ND1 HIS A 43 10.458 6.746 5.782 1.00 0.00 N ATOM 627 CD2 HIS A 43 10.503 8.233 7.403 1.00 0.00 C ATOM 628 CE1 HIS A 43 11.715 6.883 6.179 1.00 0.00 C ATOM 629 NE2 HIS A 43 11.741 7.805 7.184 1.00 0.00 N ATOM 0 H HIS A 43 6.005 5.457 5.251 1.00 0.00 H new ATOM 0 HA HIS A 43 8.120 5.592 6.126 1.00 0.00 H new ATOM 0 HB2 HIS A 43 7.963 8.112 5.372 1.00 0.00 H new ATOM 0 HB3 HIS A 43 7.771 8.391 7.091 1.00 0.00 H new ATOM 0 HD2 HIS A 43 10.209 8.966 8.139 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.569 6.357 5.777 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.574 8.115 7.685 1.00 0.00 H new ATOM 637 N LYS A 44 5.996 6.600 8.409 1.00 0.00 N ATOM 638 CA LYS A 44 5.546 6.365 9.770 1.00 0.00 C ATOM 639 C LYS A 44 5.449 4.859 10.019 1.00 0.00 C ATOM 640 O LYS A 44 5.791 4.059 9.149 1.00 0.00 O ATOM 641 CB LYS A 44 4.243 7.119 10.042 1.00 0.00 C ATOM 642 CG LYS A 44 4.478 8.630 10.069 1.00 0.00 C ATOM 643 CD LYS A 44 5.362 9.026 11.254 1.00 0.00 C ATOM 644 CE LYS A 44 5.367 10.543 11.452 1.00 0.00 C ATOM 645 NZ LYS A 44 6.546 10.958 12.245 1.00 0.00 N ATOM 0 H LYS A 44 5.410 7.237 7.870 1.00 0.00 H new ATOM 0 HA LYS A 44 6.270 6.760 10.483 1.00 0.00 H new ATOM 0 HB2 LYS A 44 3.510 6.875 9.273 1.00 0.00 H new ATOM 0 HB3 LYS A 44 3.824 6.796 10.995 1.00 0.00 H new ATOM 0 HG2 LYS A 44 4.949 8.945 9.138 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.522 9.149 10.134 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.002 8.539 12.160 1.00 0.00 H new ATOM 0 HD3 LYS A 44 6.380 8.674 11.086 1.00 0.00 H new ATOM 0 HE2 LYS A 44 5.379 11.042 10.483 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.453 10.853 11.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 6.368 11.890 12.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.721 10.262 12.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 7.379 11.014 11.625 1.00 0.00 H new ATOM 659 N LYS A 45 4.981 4.516 11.210 1.00 0.00 N ATOM 660 CA LYS A 45 4.835 3.120 11.584 1.00 0.00 C ATOM 661 C LYS A 45 3.374 2.699 11.406 1.00 0.00 C ATOM 662 O LYS A 45 2.468 3.523 11.526 1.00 0.00 O ATOM 663 CB LYS A 45 5.375 2.883 12.995 1.00 0.00 C ATOM 664 CG LYS A 45 6.903 2.802 12.991 1.00 0.00 C ATOM 665 CD LYS A 45 7.384 1.494 13.622 1.00 0.00 C ATOM 666 CE LYS A 45 8.506 1.752 14.630 1.00 0.00 C ATOM 667 NZ LYS A 45 9.041 0.473 15.148 1.00 0.00 N ATOM 0 H LYS A 45 4.698 5.182 11.929 1.00 0.00 H new ATOM 0 HA LYS A 45 5.433 2.486 10.929 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.052 3.690 13.652 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.959 1.959 13.397 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.272 2.874 11.968 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.317 3.648 13.539 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.551 0.998 14.119 1.00 0.00 H new ATOM 0 HD3 LYS A 45 7.738 0.819 12.843 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.305 2.322 14.156 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.130 2.357 15.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.801 0.666 15.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 8.280 -0.057 15.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.418 -0.090 14.359 1.00 0.00 H new ATOM 681 N PHE A 46 3.191 1.418 11.122 1.00 0.00 N ATOM 682 CA PHE A 46 1.856 0.878 10.926 1.00 0.00 C ATOM 683 C PHE A 46 1.743 -0.530 11.513 1.00 0.00 C ATOM 684 O PHE A 46 2.734 -1.096 11.974 1.00 0.00 O ATOM 685 CB PHE A 46 1.618 0.810 9.417 1.00 0.00 C ATOM 686 CG PHE A 46 1.732 2.161 8.707 1.00 0.00 C ATOM 687 CD1 PHE A 46 2.946 2.762 8.580 1.00 0.00 C ATOM 688 CD2 PHE A 46 0.620 2.760 8.204 1.00 0.00 C ATOM 689 CE1 PHE A 46 3.051 4.016 7.922 1.00 0.00 C ATOM 690 CE2 PHE A 46 0.726 4.014 7.545 1.00 0.00 C ATOM 691 CZ PHE A 46 1.939 4.615 7.418 1.00 0.00 C ATOM 0 H PHE A 46 3.945 0.738 11.023 1.00 0.00 H new ATOM 0 HA PHE A 46 1.122 1.510 11.425 1.00 0.00 H new ATOM 0 HB2 PHE A 46 2.336 0.118 8.977 1.00 0.00 H new ATOM 0 HB3 PHE A 46 0.626 0.398 9.234 1.00 0.00 H new ATOM 0 HD1 PHE A 46 3.829 2.286 8.979 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.343 2.283 8.305 1.00 0.00 H new ATOM 0 HE1 PHE A 46 4.014 4.494 7.822 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.157 4.490 7.145 1.00 0.00 H new ATOM 0 HZ PHE A 46 2.019 5.568 6.917 1.00 0.00 H new ATOM 701 N LYS A 47 0.528 -1.056 11.476 1.00 0.00 N ATOM 702 CA LYS A 47 0.272 -2.388 11.998 1.00 0.00 C ATOM 703 C LYS A 47 -1.072 -2.889 11.468 1.00 0.00 C ATOM 704 O LYS A 47 -1.988 -2.100 11.241 1.00 0.00 O ATOM 705 CB LYS A 47 0.372 -2.393 13.525 1.00 0.00 C ATOM 706 CG LYS A 47 -0.405 -1.222 14.129 1.00 0.00 C ATOM 707 CD LYS A 47 -0.711 -1.472 15.607 1.00 0.00 C ATOM 708 CE LYS A 47 -1.337 -0.234 16.254 1.00 0.00 C ATOM 709 NZ LYS A 47 -1.081 -0.226 17.712 1.00 0.00 N ATOM 0 H LYS A 47 -0.291 -0.584 11.092 1.00 0.00 H new ATOM 0 HA LYS A 47 1.033 -3.087 11.649 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -0.018 -3.333 13.915 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.418 -2.333 13.825 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.173 -0.304 14.024 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -1.336 -1.077 13.581 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.389 -2.320 15.703 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.207 -1.737 16.132 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.925 0.668 15.801 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.411 -0.222 16.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -1.512 0.620 18.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -1.495 -1.078 18.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.055 -0.215 17.884 1.00 0.00 H new ATOM 723 N LEU A 48 -1.149 -4.200 11.287 1.00 0.00 N ATOM 724 CA LEU A 48 -2.367 -4.816 10.788 1.00 0.00 C ATOM 725 C LEU A 48 -3.095 -5.506 11.943 1.00 0.00 C ATOM 726 O LEU A 48 -2.549 -6.411 12.573 1.00 0.00 O ATOM 727 CB LEU A 48 -2.054 -5.747 9.615 1.00 0.00 C ATOM 728 CG LEU A 48 -3.255 -6.448 8.976 1.00 0.00 C ATOM 729 CD1 LEU A 48 -4.039 -5.486 8.081 1.00 0.00 C ATOM 730 CD2 LEU A 48 -2.819 -7.706 8.222 1.00 0.00 C ATOM 0 H LEU A 48 -0.388 -4.852 11.477 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.043 -4.058 10.392 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.544 -5.169 8.845 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.354 -6.509 9.958 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.927 -6.767 9.772 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -4.887 -6.009 7.639 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.400 -4.648 8.677 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.389 -5.115 7.289 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.692 -8.185 7.778 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -2.115 -7.433 7.436 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.339 -8.397 8.915 1.00 0.00 H new ATOM 742 N ILE A 49 -4.315 -5.052 12.187 1.00 0.00 N ATOM 743 CA ILE A 49 -5.124 -5.615 13.255 1.00 0.00 C ATOM 744 C ILE A 49 -6.255 -6.447 12.649 1.00 0.00 C ATOM 745 O ILE A 49 -7.099 -5.920 11.925 1.00 0.00 O ATOM 746 CB ILE A 49 -5.608 -4.511 14.198 1.00 0.00 C ATOM 747 CG1 ILE A 49 -4.433 -3.858 14.928 1.00 0.00 C ATOM 748 CG2 ILE A 49 -6.662 -5.045 15.171 1.00 0.00 C ATOM 749 CD1 ILE A 49 -3.491 -3.166 13.940 1.00 0.00 C ATOM 0 H ILE A 49 -4.764 -4.300 11.663 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.528 -6.289 13.870 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.085 -3.735 13.599 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -4.807 -3.132 15.650 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.885 -4.613 15.491 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.989 -4.241 15.830 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -7.516 -5.425 14.610 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.232 -5.850 15.767 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -2.664 -2.710 14.484 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -3.100 -3.900 13.235 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -4.037 -2.395 13.396 1.00 0.00 H new ATOM 761 N ARG A 50 -6.238 -7.733 12.968 1.00 0.00 N ATOM 762 CA ARG A 50 -7.252 -8.642 12.463 1.00 0.00 C ATOM 763 C ARG A 50 -7.962 -9.342 13.624 1.00 0.00 C ATOM 764 O ARG A 50 -7.355 -10.137 14.340 1.00 0.00 O ATOM 765 CB ARG A 50 -6.637 -9.697 11.541 1.00 0.00 C ATOM 766 CG ARG A 50 -7.719 -10.591 10.932 1.00 0.00 C ATOM 767 CD ARG A 50 -7.404 -10.914 9.470 1.00 0.00 C ATOM 768 NE ARG A 50 -6.021 -11.428 9.352 1.00 0.00 N ATOM 769 CZ ARG A 50 -5.680 -12.713 9.522 1.00 0.00 C ATOM 770 NH1 ARG A 50 -6.619 -13.622 9.819 1.00 0.00 N ATOM 771 NH2 ARG A 50 -4.400 -13.089 9.395 1.00 0.00 N ATOM 0 H ARG A 50 -5.538 -8.167 13.570 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.971 -8.053 11.894 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.075 -9.207 10.746 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -5.929 -10.307 12.102 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -7.796 -11.516 11.504 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.687 -10.093 10.998 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.109 -11.654 9.092 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -7.522 -10.020 8.858 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.281 -10.763 9.127 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -7.593 -13.336 9.916 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -6.359 -14.600 9.948 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -3.685 -12.397 9.169 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.140 -14.067 9.524 1.00 0.00 H new ATOM 785 N ASN A 51 -9.239 -9.020 13.775 1.00 0.00 N ATOM 786 CA ASN A 51 -10.038 -9.607 14.837 1.00 0.00 C ATOM 787 C ASN A 51 -9.699 -8.923 16.163 1.00 0.00 C ATOM 788 O ASN A 51 -10.243 -9.280 17.206 1.00 0.00 O ATOM 789 CB ASN A 51 -9.742 -11.101 14.987 1.00 0.00 C ATOM 790 CG ASN A 51 -11.022 -11.887 15.277 1.00 0.00 C ATOM 791 OD1 ASN A 51 -11.929 -11.421 15.947 1.00 0.00 O ATOM 792 ND2 ASN A 51 -11.045 -13.102 14.737 1.00 0.00 N ATOM 0 H ASN A 51 -9.740 -8.360 13.179 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.089 -9.471 14.582 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -9.279 -11.477 14.075 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -9.026 -11.254 15.794 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.856 -13.705 14.873 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -10.252 -13.431 14.187 1.00 0.00 H new ATOM 799 N GLY A 52 -8.802 -7.951 16.078 1.00 0.00 N ATOM 800 CA GLY A 52 -8.385 -7.213 17.258 1.00 0.00 C ATOM 801 C GLY A 52 -6.926 -7.517 17.607 1.00 0.00 C ATOM 802 O GLY A 52 -6.312 -6.802 18.397 1.00 0.00 O ATOM 0 H GLY A 52 -8.353 -7.658 15.210 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.506 -6.144 17.084 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.026 -7.474 18.100 1.00 0.00 H new ATOM 806 N GLN A 53 -6.415 -8.578 17.001 1.00 0.00 N ATOM 807 CA GLN A 53 -5.040 -8.985 17.238 1.00 0.00 C ATOM 808 C GLN A 53 -4.127 -8.436 16.139 1.00 0.00 C ATOM 809 O GLN A 53 -4.560 -8.250 15.003 1.00 0.00 O ATOM 810 CB GLN A 53 -4.928 -10.508 17.333 1.00 0.00 C ATOM 811 CG GLN A 53 -4.778 -11.135 15.946 1.00 0.00 C ATOM 812 CD GLN A 53 -5.166 -12.615 15.968 1.00 0.00 C ATOM 813 OE1 GLN A 53 -5.921 -13.073 16.809 1.00 0.00 O ATOM 814 NE2 GLN A 53 -4.609 -13.334 14.998 1.00 0.00 N ATOM 0 H GLN A 53 -6.928 -9.168 16.346 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.718 -8.569 18.193 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -4.071 -10.775 17.951 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -5.813 -10.911 17.824 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -5.406 -10.602 15.232 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -3.748 -11.031 15.605 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -3.985 -12.887 14.326 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -4.805 -14.332 14.926 1.00 0.00 H new ATOM 823 N VAL A 54 -2.881 -8.192 16.517 1.00 0.00 N ATOM 824 CA VAL A 54 -1.904 -7.667 15.579 1.00 0.00 C ATOM 825 C VAL A 54 -1.170 -8.831 14.910 1.00 0.00 C ATOM 826 O VAL A 54 -0.728 -9.761 15.584 1.00 0.00 O ATOM 827 CB VAL A 54 -0.960 -6.697 16.293 1.00 0.00 C ATOM 828 CG1 VAL A 54 0.356 -6.549 15.527 1.00 0.00 C ATOM 829 CG2 VAL A 54 -1.629 -5.337 16.504 1.00 0.00 C ATOM 0 H VAL A 54 -2.526 -8.348 17.460 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.398 -7.098 14.792 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.731 -7.113 17.274 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.009 -5.854 16.056 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.845 -7.520 15.452 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.154 -6.167 14.527 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.937 -4.666 17.013 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.902 -4.912 15.538 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.525 -5.463 17.111 1.00 0.00 H new ATOM 839 N ILE A 55 -1.063 -8.743 13.592 1.00 0.00 N ATOM 840 CA ILE A 55 -0.391 -9.777 12.825 1.00 0.00 C ATOM 841 C ILE A 55 0.968 -9.255 12.355 1.00 0.00 C ATOM 842 O ILE A 55 1.967 -9.971 12.413 1.00 0.00 O ATOM 843 CB ILE A 55 -1.288 -10.269 11.687 1.00 0.00 C ATOM 844 CG1 ILE A 55 -2.088 -9.114 11.081 1.00 0.00 C ATOM 845 CG2 ILE A 55 -2.193 -11.409 12.156 1.00 0.00 C ATOM 846 CD1 ILE A 55 -3.411 -8.914 11.824 1.00 0.00 C ATOM 0 H ILE A 55 -1.431 -7.971 13.036 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.199 -10.650 13.449 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.651 -10.668 10.898 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.500 -8.197 11.125 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -2.285 -9.316 10.028 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -2.820 -11.740 11.328 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -1.580 -12.241 12.502 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -2.825 -11.060 12.972 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -3.960 -8.087 11.373 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -4.007 -9.824 11.758 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -3.210 -8.688 12.871 1.00 0.00 H new ATOM 858 N TRP A 56 0.963 -8.011 11.899 1.00 0.00 N ATOM 859 CA TRP A 56 2.183 -7.385 11.419 1.00 0.00 C ATOM 860 C TRP A 56 2.309 -6.017 12.093 1.00 0.00 C ATOM 861 O TRP A 56 1.323 -5.295 12.228 1.00 0.00 O ATOM 862 CB TRP A 56 2.192 -7.301 9.891 1.00 0.00 C ATOM 863 CG TRP A 56 3.350 -6.479 9.320 1.00 0.00 C ATOM 864 CD1 TRP A 56 4.528 -6.922 8.861 1.00 0.00 C ATOM 865 CD2 TRP A 56 3.390 -5.045 9.163 1.00 0.00 C ATOM 866 NE1 TRP A 56 5.323 -5.882 8.423 1.00 0.00 N ATOM 867 CE2 TRP A 56 4.609 -4.705 8.612 1.00 0.00 C ATOM 868 CE3 TRP A 56 2.430 -4.068 9.477 1.00 0.00 C ATOM 869 CZ2 TRP A 56 4.980 -3.385 8.327 1.00 0.00 C ATOM 870 CZ3 TRP A 56 2.815 -2.754 9.186 1.00 0.00 C ATOM 871 CH2 TRP A 56 4.038 -2.395 8.632 1.00 0.00 C ATOM 0 H TRP A 56 0.133 -7.420 11.852 1.00 0.00 H new ATOM 0 HA TRP A 56 3.054 -7.985 11.683 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.240 -8.310 9.482 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.251 -6.866 9.556 1.00 0.00 H new ATOM 0 HD1 TRP A 56 4.819 -7.962 8.837 1.00 0.00 H new ATOM 0 HE1 TRP A 56 6.262 -5.963 8.032 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.471 -4.312 9.909 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 5.940 -3.144 7.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 2.113 -1.964 9.407 1.00 0.00 H new ATOM 0 HH2 TRP A 56 4.261 -1.356 8.437 1.00 0.00 H new ATOM 882 N LYS A 57 3.531 -5.703 12.498 1.00 0.00 N ATOM 883 CA LYS A 57 3.799 -4.435 13.154 1.00 0.00 C ATOM 884 C LYS A 57 5.106 -3.851 12.613 1.00 0.00 C ATOM 885 O LYS A 57 6.144 -4.510 12.646 1.00 0.00 O ATOM 886 CB LYS A 57 3.784 -4.605 14.675 1.00 0.00 C ATOM 887 CG LYS A 57 4.802 -5.658 15.118 1.00 0.00 C ATOM 888 CD LYS A 57 4.128 -6.761 15.937 1.00 0.00 C ATOM 889 CE LYS A 57 3.927 -8.023 15.096 1.00 0.00 C ATOM 890 NZ LYS A 57 4.007 -9.231 15.947 1.00 0.00 N ATOM 0 H LYS A 57 4.346 -6.305 12.384 1.00 0.00 H new ATOM 0 HA LYS A 57 3.011 -3.716 12.929 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.009 -3.652 15.153 1.00 0.00 H new ATOM 0 HB3 LYS A 57 2.786 -4.898 15.002 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.285 -6.093 14.243 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.584 -5.186 15.712 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.737 -6.995 16.810 1.00 0.00 H new ATOM 0 HD3 LYS A 57 3.165 -6.408 16.306 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.958 -7.985 14.598 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.685 -8.071 14.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.868 -10.079 15.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 4.941 -9.274 16.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 3.268 -9.191 16.677 1.00 0.00 H new ATOM 904 N GLY A 58 5.012 -2.622 12.129 1.00 0.00 N ATOM 905 CA GLY A 58 6.174 -1.942 11.582 1.00 0.00 C ATOM 906 C GLY A 58 5.759 -0.888 10.553 1.00 0.00 C ATOM 907 O GLY A 58 4.583 -0.541 10.455 1.00 0.00 O ATOM 0 H GLY A 58 4.149 -2.079 12.104 1.00 0.00 H new ATOM 0 HA2 GLY A 58 6.735 -1.468 12.387 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.839 -2.669 11.115 1.00 0.00 H new ATOM 911 N SER A 59 6.748 -0.408 9.813 1.00 0.00 N ATOM 912 CA SER A 59 6.500 0.599 8.796 1.00 0.00 C ATOM 913 C SER A 59 6.285 -0.071 7.437 1.00 0.00 C ATOM 914 O SER A 59 6.725 -1.199 7.221 1.00 0.00 O ATOM 915 CB SER A 59 7.655 1.599 8.718 1.00 0.00 C ATOM 916 OG SER A 59 8.924 0.955 8.789 1.00 0.00 O ATOM 0 H SER A 59 7.722 -0.698 9.898 1.00 0.00 H new ATOM 0 HA SER A 59 5.599 1.147 9.070 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.585 2.161 7.787 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.567 2.318 9.532 1.00 0.00 H new ATOM 0 HG SER A 59 9.635 1.627 8.734 1.00 0.00 H new ATOM 922 N LEU A 60 5.608 0.653 6.557 1.00 0.00 N ATOM 923 CA LEU A 60 5.329 0.143 5.225 1.00 0.00 C ATOM 924 C LEU A 60 6.572 0.312 4.349 1.00 0.00 C ATOM 925 O LEU A 60 7.474 1.078 4.686 1.00 0.00 O ATOM 926 CB LEU A 60 4.075 0.804 4.650 1.00 0.00 C ATOM 927 CG LEU A 60 2.834 0.780 5.544 1.00 0.00 C ATOM 928 CD1 LEU A 60 1.804 1.810 5.079 1.00 0.00 C ATOM 929 CD2 LEU A 60 2.242 -0.628 5.623 1.00 0.00 C ATOM 0 H LEU A 60 5.245 1.588 6.740 1.00 0.00 H new ATOM 0 HA LEU A 60 5.109 -0.924 5.263 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.310 1.842 4.417 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.829 0.314 3.708 1.00 0.00 H new ATOM 0 HG LEU A 60 3.135 1.059 6.554 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.932 1.772 5.731 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.243 2.807 5.118 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.502 1.586 4.056 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.361 -0.617 6.265 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.959 -0.960 4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.983 -1.312 6.037 1.00 0.00 H new ATOM 941 N THR A 61 6.579 -0.414 3.240 1.00 0.00 N ATOM 942 CA THR A 61 7.695 -0.353 2.313 1.00 0.00 C ATOM 943 C THR A 61 7.343 0.525 1.110 1.00 0.00 C ATOM 944 O THR A 61 8.229 0.996 0.400 1.00 0.00 O ATOM 945 CB THR A 61 8.070 -1.786 1.930 1.00 0.00 C ATOM 946 OG1 THR A 61 6.910 -2.283 1.268 1.00 0.00 O ATOM 947 CG2 THR A 61 8.223 -2.697 3.149 1.00 0.00 C ATOM 0 H THR A 61 5.829 -1.047 2.963 1.00 0.00 H new ATOM 0 HA THR A 61 8.566 0.115 2.773 1.00 0.00 H new ATOM 0 HB THR A 61 9.001 -1.778 1.364 1.00 0.00 H new ATOM 0 HG1 THR A 61 7.066 -3.208 0.984 1.00 0.00 H new ATOM 0 HG21 THR A 61 8.489 -3.702 2.821 1.00 0.00 H new ATOM 0 HG22 THR A 61 9.007 -2.307 3.798 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.282 -2.732 3.698 1.00 0.00 H new ATOM 955 N SER A 62 6.046 0.719 0.920 1.00 0.00 N ATOM 956 CA SER A 62 5.565 1.532 -0.184 1.00 0.00 C ATOM 957 C SER A 62 4.102 1.915 0.047 1.00 0.00 C ATOM 958 O SER A 62 3.407 1.278 0.837 1.00 0.00 O ATOM 959 CB SER A 62 5.717 0.796 -1.517 1.00 0.00 C ATOM 960 OG SER A 62 6.957 0.100 -1.604 1.00 0.00 O ATOM 0 H SER A 62 5.314 0.327 1.512 1.00 0.00 H new ATOM 0 HA SER A 62 6.168 2.439 -0.230 1.00 0.00 H new ATOM 0 HB2 SER A 62 4.896 0.090 -1.637 1.00 0.00 H new ATOM 0 HB3 SER A 62 5.644 1.511 -2.336 1.00 0.00 H new ATOM 0 HG SER A 62 7.650 0.606 -1.130 1.00 0.00 H new ATOM 966 N LEU A 63 3.677 2.954 -0.657 1.00 0.00 N ATOM 967 CA LEU A 63 2.310 3.430 -0.539 1.00 0.00 C ATOM 968 C LEU A 63 1.945 4.238 -1.786 1.00 0.00 C ATOM 969 O LEU A 63 2.635 5.196 -2.132 1.00 0.00 O ATOM 970 CB LEU A 63 2.121 4.200 0.770 1.00 0.00 C ATOM 971 CG LEU A 63 0.780 4.916 0.940 1.00 0.00 C ATOM 972 CD1 LEU A 63 -0.300 3.949 1.429 1.00 0.00 C ATOM 973 CD2 LEU A 63 0.919 6.131 1.859 1.00 0.00 C ATOM 0 H LEU A 63 4.256 3.480 -1.312 1.00 0.00 H new ATOM 0 HA LEU A 63 1.618 2.589 -0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.246 3.504 1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.918 4.939 0.852 1.00 0.00 H new ATOM 0 HG LEU A 63 0.465 5.285 -0.036 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.243 4.484 1.542 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.423 3.144 0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.004 3.529 2.390 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.049 6.621 1.963 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.269 5.808 2.839 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.636 6.831 1.431 1.00 0.00 H new ATOM 985 N LYS A 64 0.863 3.822 -2.426 1.00 0.00 N ATOM 986 CA LYS A 64 0.399 4.495 -3.627 1.00 0.00 C ATOM 987 C LYS A 64 -1.110 4.727 -3.526 1.00 0.00 C ATOM 988 O LYS A 64 -1.857 3.823 -3.155 1.00 0.00 O ATOM 989 CB LYS A 64 0.819 3.715 -4.875 1.00 0.00 C ATOM 990 CG LYS A 64 2.339 3.541 -4.926 1.00 0.00 C ATOM 991 CD LYS A 64 2.831 3.441 -6.371 1.00 0.00 C ATOM 992 CE LYS A 64 3.897 2.354 -6.514 1.00 0.00 C ATOM 993 NZ LYS A 64 4.846 2.697 -7.597 1.00 0.00 N ATOM 0 H LYS A 64 0.294 3.027 -2.136 1.00 0.00 H new ATOM 0 HA LYS A 64 0.867 5.475 -3.719 1.00 0.00 H new ATOM 0 HB2 LYS A 64 0.337 2.737 -4.877 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.479 4.240 -5.768 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.822 4.384 -4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.624 2.643 -4.378 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.991 3.221 -7.030 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.241 4.401 -6.687 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.436 2.239 -5.573 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.422 1.397 -6.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 5.563 1.948 -7.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.330 2.784 -8.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.312 3.600 -7.377 1.00 0.00 H new ATOM 1007 N HIS A 65 -1.514 5.943 -3.864 1.00 0.00 N ATOM 1008 CA HIS A 65 -2.920 6.304 -3.816 1.00 0.00 C ATOM 1009 C HIS A 65 -3.662 5.634 -4.974 1.00 0.00 C ATOM 1010 O HIS A 65 -4.764 5.117 -4.795 1.00 0.00 O ATOM 1011 CB HIS A 65 -3.090 7.825 -3.804 1.00 0.00 C ATOM 1012 CG HIS A 65 -4.403 8.301 -4.378 1.00 0.00 C ATOM 1013 ND1 HIS A 65 -5.576 7.573 -4.272 1.00 0.00 N ATOM 1014 CD2 HIS A 65 -4.716 9.438 -5.064 1.00 0.00 C ATOM 1015 CE1 HIS A 65 -6.544 8.251 -4.871 1.00 0.00 C ATOM 1016 NE2 HIS A 65 -6.009 9.406 -5.361 1.00 0.00 N ATOM 0 H HIS A 65 -0.892 6.690 -4.172 1.00 0.00 H new ATOM 0 HA HIS A 65 -3.361 5.940 -2.888 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -3.003 8.182 -2.778 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -2.274 8.276 -4.368 1.00 0.00 H new ATOM 0 HD1 HIS A 65 -5.678 6.669 -3.811 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -4.028 10.230 -5.322 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -7.576 7.943 -4.956 1.00 0.00 H new ATOM 1024 N HIS A 66 -3.029 5.666 -6.138 1.00 0.00 N ATOM 1025 CA HIS A 66 -3.615 5.068 -7.325 1.00 0.00 C ATOM 1026 C HIS A 66 -2.679 5.272 -8.518 1.00 0.00 C ATOM 1027 O HIS A 66 -2.188 4.305 -9.099 1.00 0.00 O ATOM 1028 CB HIS A 66 -5.020 5.619 -7.574 1.00 0.00 C ATOM 1029 CG HIS A 66 -6.064 4.554 -7.816 1.00 0.00 C ATOM 1030 ND1 HIS A 66 -6.962 4.611 -8.867 1.00 0.00 N ATOM 1031 CD2 HIS A 66 -6.341 3.407 -7.133 1.00 0.00 C ATOM 1032 CE1 HIS A 66 -7.741 3.540 -8.809 1.00 0.00 C ATOM 1033 NE2 HIS A 66 -7.355 2.796 -7.733 1.00 0.00 N ATOM 0 H HIS A 66 -2.116 6.097 -6.284 1.00 0.00 H new ATOM 0 HA HIS A 66 -3.730 3.994 -7.176 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -5.321 6.220 -6.716 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -4.990 6.286 -8.435 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -5.823 3.055 -6.253 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -8.541 3.299 -9.494 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -7.776 1.915 -7.438 1.00 0.00 H new ATOM 1041 N LYS A 67 -2.460 6.536 -8.848 1.00 0.00 N ATOM 1042 CA LYS A 67 -1.591 6.880 -9.961 1.00 0.00 C ATOM 1043 C LYS A 67 -0.743 8.096 -9.584 1.00 0.00 C ATOM 1044 O LYS A 67 -0.728 9.094 -10.304 1.00 0.00 O ATOM 1045 CB LYS A 67 -2.409 7.072 -11.240 1.00 0.00 C ATOM 1046 CG LYS A 67 -1.970 6.087 -12.325 1.00 0.00 C ATOM 1047 CD LYS A 67 -0.934 6.722 -13.254 1.00 0.00 C ATOM 1048 CE LYS A 67 -1.023 6.129 -14.662 1.00 0.00 C ATOM 1049 NZ LYS A 67 0.051 5.134 -14.874 1.00 0.00 N ATOM 0 H LYS A 67 -2.869 7.335 -8.364 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.901 6.063 -10.172 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.468 6.931 -11.023 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.291 8.093 -11.602 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.550 5.194 -11.862 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.837 5.768 -12.904 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -1.092 7.799 -13.299 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.066 6.563 -12.851 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.996 5.658 -14.804 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.942 6.924 -15.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.024 4.742 -15.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 0.977 5.593 -14.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -0.044 4.367 -14.178 1.00 0.00 H new ATOM 1063 N ASP A 68 -0.058 7.974 -8.457 1.00 0.00 N ATOM 1064 CA ASP A 68 0.790 9.051 -7.976 1.00 0.00 C ATOM 1065 C ASP A 68 1.457 8.624 -6.667 1.00 0.00 C ATOM 1066 O ASP A 68 0.776 8.319 -5.690 1.00 0.00 O ATOM 1067 CB ASP A 68 -0.028 10.314 -7.699 1.00 0.00 C ATOM 1068 CG ASP A 68 0.602 11.615 -8.201 1.00 0.00 C ATOM 1069 OD1 ASP A 68 1.785 11.556 -8.600 1.00 0.00 O ATOM 1070 OD2 ASP A 68 -0.114 12.640 -8.174 1.00 0.00 O ATOM 0 H ASP A 68 -0.073 7.145 -7.863 1.00 0.00 H new ATOM 0 HA ASP A 68 1.533 9.263 -8.744 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.009 10.202 -8.160 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.188 10.397 -6.624 1.00 0.00 H new ATOM 1075 N ASP A 69 2.782 8.615 -6.691 1.00 0.00 N ATOM 1076 CA ASP A 69 3.549 8.230 -5.518 1.00 0.00 C ATOM 1077 C ASP A 69 3.356 9.279 -4.421 1.00 0.00 C ATOM 1078 O ASP A 69 4.222 10.126 -4.208 1.00 0.00 O ATOM 1079 CB ASP A 69 5.042 8.150 -5.839 1.00 0.00 C ATOM 1080 CG ASP A 69 5.383 7.473 -7.167 1.00 0.00 C ATOM 1081 OD1 ASP A 69 4.567 6.631 -7.601 1.00 0.00 O ATOM 1082 OD2 ASP A 69 6.452 7.812 -7.719 1.00 0.00 O ATOM 0 H ASP A 69 3.344 8.868 -7.504 1.00 0.00 H new ATOM 0 HA ASP A 69 3.198 7.251 -5.191 1.00 0.00 H new ATOM 0 HB2 ASP A 69 5.451 9.160 -5.848 1.00 0.00 H new ATOM 0 HB3 ASP A 69 5.543 7.611 -5.035 1.00 0.00 H new ATOM 1087 N ILE A 70 2.215 9.189 -3.754 1.00 0.00 N ATOM 1088 CA ILE A 70 1.897 10.119 -2.684 1.00 0.00 C ATOM 1089 C ILE A 70 2.467 9.589 -1.367 1.00 0.00 C ATOM 1090 O ILE A 70 2.856 8.426 -1.279 1.00 0.00 O ATOM 1091 CB ILE A 70 0.392 10.390 -2.639 1.00 0.00 C ATOM 1092 CG1 ILE A 70 0.073 11.558 -1.703 1.00 0.00 C ATOM 1093 CG2 ILE A 70 -0.382 9.125 -2.261 1.00 0.00 C ATOM 1094 CD1 ILE A 70 -1.301 12.153 -2.017 1.00 0.00 C ATOM 0 H ILE A 70 1.499 8.486 -3.934 1.00 0.00 H new ATOM 0 HA ILE A 70 2.366 11.086 -2.868 1.00 0.00 H new ATOM 0 HB ILE A 70 0.067 10.680 -3.638 1.00 0.00 H new ATOM 0 HG12 ILE A 70 0.097 11.216 -0.668 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.838 12.328 -1.803 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.449 9.345 -2.236 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.189 8.346 -2.999 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.060 8.781 -1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.503 12.981 -1.338 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.314 12.516 -3.045 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.066 11.387 -1.893 1.00 0.00 H new ATOM 1106 N SER A 71 2.498 10.468 -0.376 1.00 0.00 N ATOM 1107 CA SER A 71 3.013 10.103 0.932 1.00 0.00 C ATOM 1108 C SER A 71 1.897 10.185 1.976 1.00 0.00 C ATOM 1109 O SER A 71 1.861 9.391 2.915 1.00 0.00 O ATOM 1110 CB SER A 71 4.183 11.003 1.334 1.00 0.00 C ATOM 1111 OG SER A 71 3.779 12.359 1.508 1.00 0.00 O ATOM 0 H SER A 71 2.175 11.432 -0.453 1.00 0.00 H new ATOM 0 HA SER A 71 3.379 9.078 0.881 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.622 10.634 2.261 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.959 10.951 0.570 1.00 0.00 H new ATOM 0 HG SER A 71 4.554 12.901 1.766 1.00 0.00 H new ATOM 1117 N VAL A 72 1.015 11.153 1.777 1.00 0.00 N ATOM 1118 CA VAL A 72 -0.099 11.349 2.689 1.00 0.00 C ATOM 1119 C VAL A 72 -1.398 10.925 2.000 1.00 0.00 C ATOM 1120 O VAL A 72 -1.549 11.098 0.792 1.00 0.00 O ATOM 1121 CB VAL A 72 -0.127 12.800 3.176 1.00 0.00 C ATOM 1122 CG1 VAL A 72 -1.491 13.151 3.774 1.00 0.00 C ATOM 1123 CG2 VAL A 72 0.996 13.062 4.181 1.00 0.00 C ATOM 0 H VAL A 72 1.049 11.810 0.998 1.00 0.00 H new ATOM 0 HA VAL A 72 0.018 10.724 3.575 1.00 0.00 H new ATOM 0 HB VAL A 72 0.037 13.446 2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -1.484 14.187 4.112 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -2.264 13.022 3.017 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -1.697 12.495 4.619 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.954 14.100 4.511 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.876 12.402 5.041 1.00 0.00 H new ATOM 0 HG23 VAL A 72 1.959 12.871 3.708 1.00 0.00 H new ATOM 1133 N ILE A 73 -2.302 10.377 2.799 1.00 0.00 N ATOM 1134 CA ILE A 73 -3.582 9.926 2.281 1.00 0.00 C ATOM 1135 C ILE A 73 -4.708 10.508 3.139 1.00 0.00 C ATOM 1136 O ILE A 73 -4.882 10.115 4.291 1.00 0.00 O ATOM 1137 CB ILE A 73 -3.612 8.399 2.181 1.00 0.00 C ATOM 1138 CG1 ILE A 73 -2.520 7.890 1.238 1.00 0.00 C ATOM 1139 CG2 ILE A 73 -5.001 7.904 1.771 1.00 0.00 C ATOM 1140 CD1 ILE A 73 -2.698 8.466 -0.168 1.00 0.00 C ATOM 0 H ILE A 73 -2.173 10.235 3.801 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.732 10.292 1.265 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.402 7.987 3.168 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -1.540 8.167 1.627 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.550 6.801 1.195 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.995 6.816 1.707 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.734 8.220 2.514 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -5.265 8.323 0.800 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.909 8.088 -0.818 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.669 8.167 -0.564 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.643 9.554 -0.125 1.00 0.00 H new ATOM 1152 N LYS A 74 -5.442 11.437 2.544 1.00 0.00 N ATOM 1153 CA LYS A 74 -6.545 12.077 3.239 1.00 0.00 C ATOM 1154 C LYS A 74 -7.674 11.064 3.437 1.00 0.00 C ATOM 1155 O LYS A 74 -7.530 9.893 3.090 1.00 0.00 O ATOM 1156 CB LYS A 74 -6.980 13.345 2.501 1.00 0.00 C ATOM 1157 CG LYS A 74 -5.795 14.291 2.291 1.00 0.00 C ATOM 1158 CD LYS A 74 -6.208 15.514 1.471 1.00 0.00 C ATOM 1159 CE LYS A 74 -4.993 16.165 0.807 1.00 0.00 C ATOM 1160 NZ LYS A 74 -5.041 17.636 0.966 1.00 0.00 N ATOM 0 H LYS A 74 -5.294 11.761 1.588 1.00 0.00 H new ATOM 0 HA LYS A 74 -6.232 12.404 4.230 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.413 13.079 1.537 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.759 13.852 3.070 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.405 14.611 3.257 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.989 13.763 1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -6.929 15.219 0.709 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -6.706 16.238 2.116 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -4.077 15.775 1.250 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.969 15.908 -0.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.209 18.062 0.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -5.906 18.005 0.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -5.041 17.876 1.978 1.00 0.00 H new ATOM 1174 N THR A 75 -8.773 11.552 3.994 1.00 0.00 N ATOM 1175 CA THR A 75 -9.926 10.703 4.243 1.00 0.00 C ATOM 1176 C THR A 75 -10.721 10.493 2.953 1.00 0.00 C ATOM 1177 O THR A 75 -10.810 11.394 2.120 1.00 0.00 O ATOM 1178 CB THR A 75 -10.748 11.339 5.366 1.00 0.00 C ATOM 1179 OG1 THR A 75 -9.885 11.290 6.498 1.00 0.00 O ATOM 1180 CG2 THR A 75 -11.946 10.480 5.773 1.00 0.00 C ATOM 0 H THR A 75 -8.889 12.524 4.280 1.00 0.00 H new ATOM 0 HA THR A 75 -9.622 9.708 4.567 1.00 0.00 H new ATOM 0 HB THR A 75 -11.097 12.321 5.048 1.00 0.00 H new ATOM 0 HG1 THR A 75 -8.977 11.063 6.208 1.00 0.00 H new ATOM 0 HG21 THR A 75 -12.495 10.977 6.573 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.603 10.341 4.914 1.00 0.00 H new ATOM 0 HG23 THR A 75 -11.595 9.509 6.123 1.00 0.00 H new ATOM 1188 N GLY A 76 -11.279 9.297 2.827 1.00 0.00 N ATOM 1189 CA GLY A 76 -12.064 8.957 1.653 1.00 0.00 C ATOM 1190 C GLY A 76 -11.158 8.626 0.465 1.00 0.00 C ATOM 1191 O GLY A 76 -11.642 8.311 -0.621 1.00 0.00 O ATOM 0 H GLY A 76 -11.203 8.552 3.519 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.705 8.104 1.875 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.718 9.790 1.395 1.00 0.00 H new ATOM 1195 N MET A 77 -9.858 8.709 0.712 1.00 0.00 N ATOM 1196 CA MET A 77 -8.880 8.422 -0.323 1.00 0.00 C ATOM 1197 C MET A 77 -8.428 6.961 -0.262 1.00 0.00 C ATOM 1198 O MET A 77 -8.039 6.473 0.798 1.00 0.00 O ATOM 1199 CB MET A 77 -7.668 9.339 -0.149 1.00 0.00 C ATOM 1200 CG MET A 77 -7.899 10.688 -0.833 1.00 0.00 C ATOM 1201 SD MET A 77 -7.062 10.725 -2.409 1.00 0.00 S ATOM 1202 CE MET A 77 -5.380 10.463 -1.873 1.00 0.00 C ATOM 0 H MET A 77 -9.460 8.971 1.614 1.00 0.00 H new ATOM 0 HA MET A 77 -9.344 8.598 -1.293 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.474 9.494 0.912 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.783 8.861 -0.569 1.00 0.00 H new ATOM 0 HG2 MET A 77 -8.967 10.855 -0.975 1.00 0.00 H new ATOM 0 HG3 MET A 77 -7.532 11.494 -0.198 1.00 0.00 H new ATOM 0 HE1 MET A 77 -4.698 10.974 -2.553 1.00 0.00 H new ATOM 0 HE2 MET A 77 -5.253 10.859 -0.866 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.160 9.395 -1.873 1.00 0.00 H new ATOM 1212 N ASP A 78 -8.496 6.305 -1.411 1.00 0.00 N ATOM 1213 CA ASP A 78 -8.098 4.911 -1.500 1.00 0.00 C ATOM 1214 C ASP A 78 -6.583 4.828 -1.698 1.00 0.00 C ATOM 1215 O ASP A 78 -5.990 5.690 -2.344 1.00 0.00 O ATOM 1216 CB ASP A 78 -8.768 4.223 -2.692 1.00 0.00 C ATOM 1217 CG ASP A 78 -10.281 4.428 -2.790 1.00 0.00 C ATOM 1218 OD1 ASP A 78 -10.866 4.836 -1.764 1.00 0.00 O ATOM 1219 OD2 ASP A 78 -10.818 4.173 -3.890 1.00 0.00 O ATOM 0 H ASP A 78 -8.821 6.713 -2.288 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.401 4.415 -0.578 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.307 4.588 -3.610 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.564 3.154 -2.637 1.00 0.00 H new ATOM 1224 N CYS A 79 -6.001 3.783 -1.128 1.00 0.00 N ATOM 1225 CA CYS A 79 -4.566 3.577 -1.233 1.00 0.00 C ATOM 1226 C CYS A 79 -4.270 2.105 -0.937 1.00 0.00 C ATOM 1227 O CYS A 79 -5.071 1.423 -0.300 1.00 0.00 O ATOM 1228 CB CYS A 79 -3.791 4.514 -0.305 1.00 0.00 C ATOM 1229 SG CYS A 79 -4.350 4.288 1.422 1.00 0.00 S ATOM 0 H CYS A 79 -6.496 3.070 -0.592 1.00 0.00 H new ATOM 0 HA CYS A 79 -4.234 3.817 -2.243 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -2.723 4.311 -0.380 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -3.941 5.549 -0.612 1.00 0.00 H new ATOM 0 HG CYS A 79 -3.684 5.087 2.202 1.00 0.00 H new ATOM 1235 N GLY A 80 -3.116 1.660 -1.413 1.00 0.00 N ATOM 1236 CA GLY A 80 -2.704 0.282 -1.206 1.00 0.00 C ATOM 1237 C GLY A 80 -1.299 0.214 -0.603 1.00 0.00 C ATOM 1238 O GLY A 80 -0.398 0.928 -1.039 1.00 0.00 O ATOM 0 H GLY A 80 -2.454 2.229 -1.941 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -3.412 -0.217 -0.545 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.722 -0.253 -2.155 1.00 0.00 H new ATOM 1242 N LEU A 81 -1.158 -0.650 0.391 1.00 0.00 N ATOM 1243 CA LEU A 81 0.121 -0.820 1.059 1.00 0.00 C ATOM 1244 C LEU A 81 0.511 -2.300 1.035 1.00 0.00 C ATOM 1245 O LEU A 81 -0.332 -3.164 0.801 1.00 0.00 O ATOM 1246 CB LEU A 81 0.076 -0.219 2.465 1.00 0.00 C ATOM 1247 CG LEU A 81 -1.020 -0.755 3.388 1.00 0.00 C ATOM 1248 CD1 LEU A 81 -0.518 -1.952 4.197 1.00 0.00 C ATOM 1249 CD2 LEU A 81 -1.570 0.354 4.288 1.00 0.00 C ATOM 0 H LEU A 81 -1.908 -1.240 0.750 1.00 0.00 H new ATOM 0 HA LEU A 81 0.902 -0.275 0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 81 1.041 -0.389 2.942 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.049 0.860 2.374 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.845 -1.107 2.769 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.316 -2.314 4.845 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.213 -2.748 3.518 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.334 -1.648 4.806 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.348 -0.054 4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -0.764 0.758 4.901 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.990 1.148 3.671 1.00 0.00 H new ATOM 1261 N SER A 82 1.790 -2.546 1.280 1.00 0.00 N ATOM 1262 CA SER A 82 2.302 -3.905 1.290 1.00 0.00 C ATOM 1263 C SER A 82 3.376 -4.052 2.370 1.00 0.00 C ATOM 1264 O SER A 82 4.208 -3.165 2.547 1.00 0.00 O ATOM 1265 CB SER A 82 2.869 -4.290 -0.078 1.00 0.00 C ATOM 1266 OG SER A 82 1.964 -3.988 -1.136 1.00 0.00 O ATOM 0 H SER A 82 2.487 -1.826 1.473 1.00 0.00 H new ATOM 0 HA SER A 82 1.476 -4.580 1.514 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.808 -3.762 -0.243 1.00 0.00 H new ATOM 0 HB3 SER A 82 3.097 -5.356 -0.089 1.00 0.00 H new ATOM 0 HG SER A 82 2.469 -3.783 -1.950 1.00 0.00 H new ATOM 1272 N LEU A 83 3.321 -5.180 3.063 1.00 0.00 N ATOM 1273 CA LEU A 83 4.279 -5.455 4.121 1.00 0.00 C ATOM 1274 C LEU A 83 5.464 -6.230 3.542 1.00 0.00 C ATOM 1275 O LEU A 83 5.301 -7.011 2.606 1.00 0.00 O ATOM 1276 CB LEU A 83 3.594 -6.163 5.292 1.00 0.00 C ATOM 1277 CG LEU A 83 2.198 -5.656 5.659 1.00 0.00 C ATOM 1278 CD1 LEU A 83 1.510 -6.606 6.641 1.00 0.00 C ATOM 1279 CD2 LEU A 83 2.258 -4.224 6.195 1.00 0.00 C ATOM 0 H LEU A 83 2.629 -5.914 2.913 1.00 0.00 H new ATOM 0 HA LEU A 83 4.675 -4.525 4.528 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.523 -7.225 5.057 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.234 -6.073 6.170 1.00 0.00 H new ATOM 0 HG LEU A 83 1.593 -5.636 4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.520 -6.222 6.885 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.415 -7.592 6.187 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.105 -6.681 7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.253 -3.888 6.448 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.885 -4.195 7.086 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.679 -3.568 5.433 1.00 0.00 H new ATOM 1291 N ASP A 84 6.630 -5.986 4.122 1.00 0.00 N ATOM 1292 CA ASP A 84 7.842 -6.651 3.676 1.00 0.00 C ATOM 1293 C ASP A 84 7.758 -8.140 4.019 1.00 0.00 C ATOM 1294 O ASP A 84 8.488 -8.953 3.455 1.00 0.00 O ATOM 1295 CB ASP A 84 9.075 -6.074 4.372 1.00 0.00 C ATOM 1296 CG ASP A 84 10.292 -7.002 4.407 1.00 0.00 C ATOM 1297 OD1 ASP A 84 10.223 -8.000 5.156 1.00 0.00 O ATOM 1298 OD2 ASP A 84 11.262 -6.692 3.683 1.00 0.00 O ATOM 0 H ASP A 84 6.761 -5.336 4.897 1.00 0.00 H new ATOM 0 HA ASP A 84 7.932 -6.501 2.600 1.00 0.00 H new ATOM 0 HB2 ASP A 84 9.357 -5.148 3.870 1.00 0.00 H new ATOM 0 HB3 ASP A 84 8.807 -5.813 5.396 1.00 0.00 H new ATOM 1303 N GLU A 85 6.861 -8.451 4.944 1.00 0.00 N ATOM 1304 CA GLU A 85 6.672 -9.828 5.369 1.00 0.00 C ATOM 1305 C GLU A 85 5.444 -10.431 4.684 1.00 0.00 C ATOM 1306 O GLU A 85 4.374 -10.518 5.284 1.00 0.00 O ATOM 1307 CB GLU A 85 6.551 -9.919 6.892 1.00 0.00 C ATOM 1308 CG GLU A 85 6.948 -11.310 7.391 1.00 0.00 C ATOM 1309 CD GLU A 85 8.419 -11.342 7.812 1.00 0.00 C ATOM 1310 OE1 GLU A 85 8.902 -10.282 8.265 1.00 0.00 O ATOM 1311 OE2 GLU A 85 9.026 -12.425 7.670 1.00 0.00 O ATOM 0 H GLU A 85 6.258 -7.774 5.411 1.00 0.00 H new ATOM 0 HA GLU A 85 7.548 -10.404 5.072 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.188 -9.166 7.357 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.527 -9.699 7.193 1.00 0.00 H new ATOM 0 HG2 GLU A 85 6.318 -11.591 8.235 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.775 -12.045 6.605 1.00 0.00 H new ATOM 1318 N GLU A 86 5.640 -10.833 3.437 1.00 0.00 N ATOM 1319 CA GLU A 86 4.562 -11.426 2.664 1.00 0.00 C ATOM 1320 C GLU A 86 3.782 -12.426 3.520 1.00 0.00 C ATOM 1321 O GLU A 86 2.597 -12.656 3.287 1.00 0.00 O ATOM 1322 CB GLU A 86 5.099 -12.092 1.395 1.00 0.00 C ATOM 1323 CG GLU A 86 6.104 -13.194 1.738 1.00 0.00 C ATOM 1324 CD GLU A 86 7.270 -13.200 0.748 1.00 0.00 C ATOM 1325 OE1 GLU A 86 8.157 -12.334 0.911 1.00 0.00 O ATOM 1326 OE2 GLU A 86 7.249 -14.070 -0.149 1.00 0.00 O ATOM 0 H GLU A 86 6.529 -10.760 2.943 1.00 0.00 H new ATOM 0 HA GLU A 86 3.881 -10.632 2.358 1.00 0.00 H new ATOM 0 HB2 GLU A 86 4.272 -12.514 0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.576 -11.344 0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.482 -13.045 2.749 1.00 0.00 H new ATOM 0 HG3 GLU A 86 5.605 -14.163 1.724 1.00 0.00 H new ATOM 1333 N LYS A 87 4.479 -12.992 4.494 1.00 0.00 N ATOM 1334 CA LYS A 87 3.867 -13.962 5.387 1.00 0.00 C ATOM 1335 C LYS A 87 2.543 -13.402 5.909 1.00 0.00 C ATOM 1336 O LYS A 87 1.525 -14.092 5.896 1.00 0.00 O ATOM 1337 CB LYS A 87 4.844 -14.363 6.493 1.00 0.00 C ATOM 1338 CG LYS A 87 5.907 -15.328 5.963 1.00 0.00 C ATOM 1339 CD LYS A 87 6.130 -16.486 6.938 1.00 0.00 C ATOM 1340 CE LYS A 87 6.843 -17.652 6.250 1.00 0.00 C ATOM 1341 NZ LYS A 87 8.266 -17.702 6.656 1.00 0.00 N ATOM 0 H LYS A 87 5.462 -12.798 4.685 1.00 0.00 H new ATOM 0 HA LYS A 87 3.635 -14.882 4.850 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.325 -13.473 6.898 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.299 -14.831 7.312 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.598 -15.718 4.993 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.844 -14.793 5.807 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.722 -16.143 7.787 1.00 0.00 H new ATOM 0 HD3 LYS A 87 5.172 -16.823 7.333 1.00 0.00 H new ATOM 0 HE2 LYS A 87 6.352 -18.590 6.509 1.00 0.00 H new ATOM 0 HE3 LYS A 87 6.771 -17.542 5.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 8.735 -18.499 6.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 8.735 -16.814 6.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 8.329 -17.829 7.686 1.00 0.00 H new ATOM 1355 N VAL A 88 2.599 -12.156 6.357 1.00 0.00 N ATOM 1356 CA VAL A 88 1.416 -11.496 6.883 1.00 0.00 C ATOM 1357 C VAL A 88 0.421 -11.260 5.745 1.00 0.00 C ATOM 1358 O VAL A 88 0.760 -10.642 4.737 1.00 0.00 O ATOM 1359 CB VAL A 88 1.814 -10.208 7.606 1.00 0.00 C ATOM 1360 CG1 VAL A 88 0.588 -9.510 8.197 1.00 0.00 C ATOM 1361 CG2 VAL A 88 2.860 -10.486 8.687 1.00 0.00 C ATOM 0 H VAL A 88 3.445 -11.586 6.367 1.00 0.00 H new ATOM 0 HA VAL A 88 0.922 -12.128 7.621 1.00 0.00 H new ATOM 0 HB VAL A 88 2.261 -9.537 6.872 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.899 -8.597 8.705 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.109 -9.260 7.397 1.00 0.00 H new ATOM 0 HG13 VAL A 88 0.100 -10.174 8.910 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.125 -9.553 9.185 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.452 -11.184 9.418 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.750 -10.919 8.230 1.00 0.00 H new ATOM 1371 N GLU A 89 -0.788 -11.765 5.945 1.00 0.00 N ATOM 1372 CA GLU A 89 -1.835 -11.616 4.949 1.00 0.00 C ATOM 1373 C GLU A 89 -2.983 -10.773 5.507 1.00 0.00 C ATOM 1374 O GLU A 89 -3.387 -10.950 6.655 1.00 0.00 O ATOM 1375 CB GLU A 89 -2.337 -12.981 4.474 1.00 0.00 C ATOM 1376 CG GLU A 89 -1.643 -13.400 3.177 1.00 0.00 C ATOM 1377 CD GLU A 89 -1.472 -14.919 3.112 1.00 0.00 C ATOM 1378 OE1 GLU A 89 -1.310 -15.519 4.196 1.00 0.00 O ATOM 1379 OE2 GLU A 89 -1.509 -15.446 1.979 1.00 0.00 O ATOM 0 H GLU A 89 -1.065 -12.278 6.782 1.00 0.00 H new ATOM 0 HA GLU A 89 -1.417 -11.098 4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -2.154 -13.728 5.246 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -3.415 -12.942 4.317 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -2.227 -13.059 2.322 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.668 -12.918 3.110 1.00 0.00 H new ATOM 1386 N PHE A 90 -3.477 -9.875 4.668 1.00 0.00 N ATOM 1387 CA PHE A 90 -4.571 -9.004 5.063 1.00 0.00 C ATOM 1388 C PHE A 90 -5.924 -9.652 4.763 1.00 0.00 C ATOM 1389 O PHE A 90 -5.981 -10.767 4.245 1.00 0.00 O ATOM 1390 CB PHE A 90 -4.441 -7.720 4.241 1.00 0.00 C ATOM 1391 CG PHE A 90 -2.997 -7.337 3.911 1.00 0.00 C ATOM 1392 CD1 PHE A 90 -2.289 -6.554 4.768 1.00 0.00 C ATOM 1393 CD2 PHE A 90 -2.421 -7.779 2.761 1.00 0.00 C ATOM 1394 CE1 PHE A 90 -0.949 -6.198 4.462 1.00 0.00 C ATOM 1395 CE2 PHE A 90 -1.081 -7.423 2.455 1.00 0.00 C ATOM 1396 CZ PHE A 90 -0.373 -6.640 3.312 1.00 0.00 C ATOM 0 H PHE A 90 -3.140 -9.732 3.716 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.521 -8.808 6.134 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.997 -7.838 3.311 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.907 -6.901 4.789 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.746 -6.203 5.681 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.983 -8.401 2.080 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.387 -5.576 5.143 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.624 -7.774 1.542 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.646 -6.369 3.080 1.00 0.00 H new ATOM 1406 N LYS A 91 -6.980 -8.927 5.100 1.00 0.00 N ATOM 1407 CA LYS A 91 -8.329 -9.418 4.874 1.00 0.00 C ATOM 1408 C LYS A 91 -9.318 -8.258 5.008 1.00 0.00 C ATOM 1409 O LYS A 91 -9.022 -7.257 5.657 1.00 0.00 O ATOM 1410 CB LYS A 91 -8.633 -10.596 5.800 1.00 0.00 C ATOM 1411 CG LYS A 91 -8.190 -11.918 5.170 1.00 0.00 C ATOM 1412 CD LYS A 91 -9.150 -13.051 5.538 1.00 0.00 C ATOM 1413 CE LYS A 91 -8.387 -14.267 6.065 1.00 0.00 C ATOM 1414 NZ LYS A 91 -9.070 -14.836 7.248 1.00 0.00 N ATOM 0 H LYS A 91 -6.929 -8.003 5.528 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.428 -9.807 3.860 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.123 -10.455 6.753 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.702 -10.630 6.012 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.146 -11.812 4.086 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -7.183 -12.166 5.507 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.855 -12.704 6.294 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -9.735 -13.335 4.663 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -8.311 -15.023 5.283 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -7.370 -13.979 6.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.538 -15.661 7.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.120 -14.118 7.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.032 -15.130 6.985 1.00 0.00 H new ATOM 1428 N PRO A 92 -10.504 -8.437 4.367 1.00 0.00 N ATOM 1429 CA PRO A 92 -11.539 -7.418 4.409 1.00 0.00 C ATOM 1430 C PRO A 92 -12.237 -7.402 5.770 1.00 0.00 C ATOM 1431 O PRO A 92 -13.459 -7.523 5.847 1.00 0.00 O ATOM 1432 CB PRO A 92 -12.478 -7.763 3.264 1.00 0.00 C ATOM 1433 CG PRO A 92 -12.196 -9.216 2.918 1.00 0.00 C ATOM 1434 CD PRO A 92 -10.890 -9.611 3.589 1.00 0.00 C ATOM 0 HA PRO A 92 -11.142 -6.410 4.291 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -13.519 -7.626 3.558 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.301 -7.115 2.405 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -13.010 -9.855 3.261 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.124 -9.344 1.838 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.021 -10.484 4.228 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.128 -9.867 2.853 1.00 0.00 H new ATOM 1442 N GLY A 93 -11.432 -7.250 6.811 1.00 0.00 N ATOM 1443 CA GLY A 93 -11.957 -7.216 8.166 1.00 0.00 C ATOM 1444 C GLY A 93 -10.839 -6.974 9.181 1.00 0.00 C ATOM 1445 O GLY A 93 -10.883 -7.496 10.294 1.00 0.00 O ATOM 0 H GLY A 93 -10.419 -7.149 6.744 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.706 -6.429 8.250 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.458 -8.158 8.389 1.00 0.00 H new ATOM 1449 N ASP A 94 -9.863 -6.182 8.762 1.00 0.00 N ATOM 1450 CA ASP A 94 -8.735 -5.864 9.622 1.00 0.00 C ATOM 1451 C ASP A 94 -8.691 -4.354 9.861 1.00 0.00 C ATOM 1452 O ASP A 94 -9.639 -3.642 9.532 1.00 0.00 O ATOM 1453 CB ASP A 94 -7.414 -6.279 8.972 1.00 0.00 C ATOM 1454 CG ASP A 94 -7.408 -7.678 8.353 1.00 0.00 C ATOM 1455 OD1 ASP A 94 -8.520 -8.198 8.115 1.00 0.00 O ATOM 1456 OD2 ASP A 94 -6.292 -8.196 8.132 1.00 0.00 O ATOM 0 H ASP A 94 -9.830 -5.751 7.838 1.00 0.00 H new ATOM 0 HA ASP A 94 -8.862 -6.406 10.559 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.165 -5.554 8.197 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -6.625 -6.227 9.723 1.00 0.00 H new ATOM 1461 N GLN A 95 -7.581 -3.909 10.432 1.00 0.00 N ATOM 1462 CA GLN A 95 -7.401 -2.496 10.719 1.00 0.00 C ATOM 1463 C GLN A 95 -5.938 -2.097 10.522 1.00 0.00 C ATOM 1464 O GLN A 95 -5.040 -2.926 10.662 1.00 0.00 O ATOM 1465 CB GLN A 95 -7.876 -2.160 12.134 1.00 0.00 C ATOM 1466 CG GLN A 95 -9.344 -1.727 12.131 1.00 0.00 C ATOM 1467 CD GLN A 95 -9.873 -1.572 13.559 1.00 0.00 C ATOM 1468 OE1 GLN A 95 -10.782 -2.262 13.989 1.00 0.00 O ATOM 1469 NE2 GLN A 95 -9.254 -0.630 14.265 1.00 0.00 N ATOM 0 H GLN A 95 -6.797 -4.502 10.704 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.010 -1.922 10.021 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -7.751 -3.029 12.780 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.259 -1.363 12.549 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.447 -0.783 11.597 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -9.943 -2.463 11.595 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.500 -0.089 13.842 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -9.533 -0.449 15.229 1.00 0.00 H new ATOM 1478 N VAL A 96 -5.742 -0.827 10.201 1.00 0.00 N ATOM 1479 CA VAL A 96 -4.402 -0.307 9.984 1.00 0.00 C ATOM 1480 C VAL A 96 -4.218 0.973 10.801 1.00 0.00 C ATOM 1481 O VAL A 96 -4.719 2.032 10.425 1.00 0.00 O ATOM 1482 CB VAL A 96 -4.157 -0.102 8.488 1.00 0.00 C ATOM 1483 CG1 VAL A 96 -2.953 0.812 8.250 1.00 0.00 C ATOM 1484 CG2 VAL A 96 -3.977 -1.443 7.773 1.00 0.00 C ATOM 0 H VAL A 96 -6.489 -0.142 10.086 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.654 -1.022 10.327 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.037 0.386 8.068 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.801 0.941 7.178 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.137 1.783 8.710 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.063 0.364 8.692 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.804 -1.269 6.711 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.123 -1.970 8.198 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.876 -2.047 7.900 1.00 0.00 H new ATOM 1494 N ILE A 97 -3.497 0.835 11.904 1.00 0.00 N ATOM 1495 CA ILE A 97 -3.240 1.967 12.777 1.00 0.00 C ATOM 1496 C ILE A 97 -1.942 2.653 12.347 1.00 0.00 C ATOM 1497 O ILE A 97 -0.895 2.013 12.264 1.00 0.00 O ATOM 1498 CB ILE A 97 -3.246 1.526 14.242 1.00 0.00 C ATOM 1499 CG1 ILE A 97 -4.487 0.689 14.558 1.00 0.00 C ATOM 1500 CG2 ILE A 97 -3.112 2.730 15.178 1.00 0.00 C ATOM 1501 CD1 ILE A 97 -5.754 1.544 14.500 1.00 0.00 C ATOM 0 H ILE A 97 -3.083 -0.044 12.213 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.036 2.706 12.687 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.377 0.889 14.410 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.566 -0.133 13.847 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -4.388 0.245 15.549 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.119 2.389 16.213 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.175 3.248 14.973 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.947 3.412 15.015 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.622 0.925 14.728 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.682 2.351 15.229 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.863 1.966 13.501 1.00 0.00 H new ATOM 1513 N CYS A 98 -2.054 3.947 12.084 1.00 0.00 N ATOM 1514 CA CYS A 98 -0.902 4.728 11.664 1.00 0.00 C ATOM 1515 C CYS A 98 -0.601 5.762 12.750 1.00 0.00 C ATOM 1516 O CYS A 98 -1.268 6.793 12.832 1.00 0.00 O ATOM 1517 CB CYS A 98 -1.129 5.381 10.299 1.00 0.00 C ATOM 1518 SG CYS A 98 0.221 6.564 9.940 1.00 0.00 S ATOM 0 H CYS A 98 -2.924 4.474 12.154 1.00 0.00 H new ATOM 0 HA CYS A 98 -0.040 4.073 11.540 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -1.170 4.617 9.523 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -2.089 5.897 10.289 1.00 0.00 H new ATOM 0 HG CYS A 98 0.979 6.085 8.998 1.00 0.00 H new ATOM 1524 N TYR A 99 0.404 5.452 13.556 1.00 0.00 N ATOM 1525 CA TYR A 99 0.802 6.343 14.633 1.00 0.00 C ATOM 1526 C TYR A 99 2.281 6.715 14.519 1.00 0.00 C ATOM 1527 O TYR A 99 3.031 6.075 13.784 1.00 0.00 O ATOM 1528 CB TYR A 99 0.584 5.560 15.929 1.00 0.00 C ATOM 1529 CG TYR A 99 1.588 4.427 16.148 1.00 0.00 C ATOM 1530 CD1 TYR A 99 1.458 3.244 15.448 1.00 0.00 C ATOM 1531 CD2 TYR A 99 2.624 4.586 17.046 1.00 0.00 C ATOM 1532 CE1 TYR A 99 2.403 2.178 15.654 1.00 0.00 C ATOM 1533 CE2 TYR A 99 3.569 3.520 17.252 1.00 0.00 C ATOM 1534 CZ TYR A 99 3.412 2.368 16.546 1.00 0.00 C ATOM 1535 OH TYR A 99 4.305 1.361 16.740 1.00 0.00 O ATOM 0 H TYR A 99 0.955 4.596 13.485 1.00 0.00 H new ATOM 0 HA TYR A 99 0.225 7.267 14.600 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.640 6.249 16.772 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.423 5.143 15.925 1.00 0.00 H new ATOM 0 HD1 TYR A 99 0.647 3.118 14.746 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.726 5.511 17.594 1.00 0.00 H new ATOM 0 HE1 TYR A 99 2.313 1.248 15.112 1.00 0.00 H new ATOM 0 HE2 TYR A 99 4.384 3.632 17.951 1.00 0.00 H new ATOM 0 HH TYR A 99 4.971 1.638 17.404 1.00 0.00 H new ATOM 1545 N GLU A 100 2.657 7.749 15.257 1.00 0.00 N ATOM 1546 CA GLU A 100 4.033 8.214 15.248 1.00 0.00 C ATOM 1547 C GLU A 100 4.620 8.164 16.660 1.00 0.00 C ATOM 1548 O GLU A 100 4.053 8.732 17.592 1.00 0.00 O ATOM 1549 CB GLU A 100 4.132 9.625 14.663 1.00 0.00 C ATOM 1550 CG GLU A 100 3.508 10.654 15.608 1.00 0.00 C ATOM 1551 CD GLU A 100 2.862 11.798 14.823 1.00 0.00 C ATOM 1552 OE1 GLU A 100 1.722 11.592 14.355 1.00 0.00 O ATOM 1553 OE2 GLU A 100 3.524 12.852 14.708 1.00 0.00 O ATOM 0 H GLU A 100 2.032 8.278 15.865 1.00 0.00 H new ATOM 0 HA GLU A 100 4.616 7.550 14.610 1.00 0.00 H new ATOM 0 HB2 GLU A 100 5.178 9.876 14.485 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.627 9.659 13.698 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.759 10.170 16.235 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.273 11.052 16.275 1.00 0.00 H new ATOM 1560 N GLU A 101 5.749 7.479 16.773 1.00 0.00 N ATOM 1561 CA GLU A 101 6.418 7.347 18.056 1.00 0.00 C ATOM 1562 C GLU A 101 7.130 8.652 18.420 1.00 0.00 C ATOM 1563 O GLU A 101 8.241 8.907 17.959 1.00 0.00 O ATOM 1564 CB GLU A 101 7.399 6.173 18.044 1.00 0.00 C ATOM 1565 CG GLU A 101 6.710 4.879 18.483 1.00 0.00 C ATOM 1566 CD GLU A 101 7.313 4.352 19.787 1.00 0.00 C ATOM 1567 OE1 GLU A 101 7.394 5.156 20.740 1.00 0.00 O ATOM 1568 OE2 GLU A 101 7.679 3.157 19.800 1.00 0.00 O ATOM 0 H GLU A 101 6.217 7.010 15.997 1.00 0.00 H new ATOM 0 HA GLU A 101 5.665 7.142 18.817 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.811 6.048 17.042 1.00 0.00 H new ATOM 0 HB3 GLU A 101 8.236 6.387 18.708 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.643 5.058 18.618 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.810 4.126 17.701 1.00 0.00 H new ATOM 1575 N ASN A 102 6.459 9.444 19.244 1.00 0.00 N ATOM 1576 CA ASN A 102 7.013 10.717 19.675 1.00 0.00 C ATOM 1577 C ASN A 102 6.180 11.263 20.836 1.00 0.00 C ATOM 1578 O ASN A 102 4.952 11.194 20.811 1.00 0.00 O ATOM 1579 CB ASN A 102 6.977 11.745 18.542 1.00 0.00 C ATOM 1580 CG ASN A 102 8.337 12.427 18.378 1.00 0.00 C ATOM 1581 OD1 ASN A 102 8.866 13.043 19.289 1.00 0.00 O ATOM 1582 ND2 ASN A 102 8.872 12.283 17.169 1.00 0.00 N ATOM 0 H ASN A 102 5.537 9.229 19.624 1.00 0.00 H new ATOM 0 HA ASN A 102 8.047 10.550 19.978 1.00 0.00 H new ATOM 0 HB2 ASN A 102 6.697 11.254 17.610 1.00 0.00 H new ATOM 0 HB3 ASN A 102 6.213 12.494 18.750 1.00 0.00 H new ATOM 0 HD21 ASN A 102 9.778 12.701 16.959 1.00 0.00 H new ATOM 0 HD22 ASN A 102 8.376 11.754 16.451 1.00 0.00 H new ATOM 1589 N LYS A 103 6.882 11.795 21.826 1.00 0.00 N ATOM 1590 CA LYS A 103 6.222 12.353 22.995 1.00 0.00 C ATOM 1591 C LYS A 103 6.820 13.727 23.304 1.00 0.00 C ATOM 1592 O LYS A 103 8.011 13.840 23.588 1.00 0.00 O ATOM 1593 CB LYS A 103 6.292 11.374 24.168 1.00 0.00 C ATOM 1594 CG LYS A 103 7.714 11.285 24.725 1.00 0.00 C ATOM 1595 CD LYS A 103 7.825 10.173 25.770 1.00 0.00 C ATOM 1596 CE LYS A 103 9.277 9.983 26.215 1.00 0.00 C ATOM 1597 NZ LYS A 103 9.497 10.602 27.541 1.00 0.00 N ATOM 0 H LYS A 103 7.900 11.852 21.843 1.00 0.00 H new ATOM 0 HA LYS A 103 5.160 12.503 22.799 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.609 11.694 24.955 1.00 0.00 H new ATOM 0 HB3 LYS A 103 5.963 10.387 23.843 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.416 11.097 23.912 1.00 0.00 H new ATOM 0 HG3 LYS A 103 7.993 12.239 25.173 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.205 10.417 26.633 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.443 9.240 25.356 1.00 0.00 H new ATOM 0 HE2 LYS A 103 9.514 8.920 26.259 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.950 10.429 25.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 10.487 10.464 27.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 9.290 11.620 27.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.868 10.157 28.240 1.00 0.00 H new ATOM 1611 N VAL A 104 5.965 14.737 23.239 1.00 0.00 N ATOM 1612 CA VAL A 104 6.393 16.099 23.509 1.00 0.00 C ATOM 1613 C VAL A 104 5.226 16.888 24.105 1.00 0.00 C ATOM 1614 O VAL A 104 4.112 16.845 23.584 1.00 0.00 O ATOM 1615 CB VAL A 104 6.954 16.733 22.234 1.00 0.00 C ATOM 1616 CG1 VAL A 104 6.168 16.278 21.003 1.00 0.00 C ATOM 1617 CG2 VAL A 104 6.969 18.260 22.342 1.00 0.00 C ATOM 0 H VAL A 104 4.977 14.639 23.003 1.00 0.00 H new ATOM 0 HA VAL A 104 7.199 16.108 24.243 1.00 0.00 H new ATOM 0 HB VAL A 104 7.984 16.395 22.117 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.587 16.743 20.111 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.232 15.194 20.911 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.124 16.572 21.109 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.372 18.686 21.423 1.00 0.00 H new ATOM 0 HG22 VAL A 104 5.953 18.624 22.495 1.00 0.00 H new ATOM 0 HG23 VAL A 104 7.593 18.559 23.185 1.00 0.00 H new ATOM 1627 N PRO A 105 5.528 17.609 25.218 1.00 0.00 N ATOM 1628 CA PRO A 105 4.517 18.406 25.891 1.00 0.00 C ATOM 1629 C PRO A 105 4.212 19.683 25.105 1.00 0.00 C ATOM 1630 O PRO A 105 4.803 20.731 25.363 1.00 0.00 O ATOM 1631 CB PRO A 105 5.087 18.681 27.273 1.00 0.00 C ATOM 1632 CG PRO A 105 6.582 18.428 27.164 1.00 0.00 C ATOM 1633 CD PRO A 105 6.836 17.683 25.863 1.00 0.00 C ATOM 0 HA PRO A 105 3.558 17.893 25.965 1.00 0.00 H new ATOM 0 HB2 PRO A 105 4.886 19.707 27.582 1.00 0.00 H new ATOM 0 HB3 PRO A 105 4.634 18.029 28.020 1.00 0.00 H new ATOM 0 HG2 PRO A 105 7.130 19.370 27.178 1.00 0.00 H new ATOM 0 HG3 PRO A 105 6.933 17.842 28.014 1.00 0.00 H new ATOM 0 HD2 PRO A 105 7.556 18.211 25.238 1.00 0.00 H new ATOM 0 HD3 PRO A 105 7.243 16.689 26.049 1.00 0.00 H new ATOM 1641 N THR A 106 3.292 19.553 24.161 1.00 0.00 N ATOM 1642 CA THR A 106 2.902 20.684 23.335 1.00 0.00 C ATOM 1643 C THR A 106 2.763 21.945 24.190 1.00 0.00 C ATOM 1644 O THR A 106 2.354 21.873 25.348 1.00 0.00 O ATOM 1645 CB THR A 106 1.618 20.307 22.594 1.00 0.00 C ATOM 1646 OG1 THR A 106 1.418 21.380 21.678 1.00 0.00 O ATOM 1647 CG2 THR A 106 0.384 20.355 23.498 1.00 0.00 C ATOM 0 H THR A 106 2.805 18.682 23.949 1.00 0.00 H new ATOM 0 HA THR A 106 3.666 20.915 22.593 1.00 0.00 H new ATOM 0 HB THR A 106 1.722 19.306 22.174 1.00 0.00 H new ATOM 0 HG1 THR A 106 0.606 21.216 21.154 1.00 0.00 H new ATOM 0 HG21 THR A 106 -0.500 20.079 22.923 1.00 0.00 H new ATOM 0 HG22 THR A 106 0.511 19.656 24.325 1.00 0.00 H new ATOM 0 HG23 THR A 106 0.260 21.364 23.891 1.00 0.00 H new ATOM 1655 N LYS A 107 3.110 23.072 23.586 1.00 0.00 N ATOM 1656 CA LYS A 107 3.029 24.347 24.277 1.00 0.00 C ATOM 1657 C LYS A 107 2.762 25.458 23.259 1.00 0.00 C ATOM 1658 O LYS A 107 3.687 26.144 22.826 1.00 0.00 O ATOM 1659 CB LYS A 107 4.282 24.578 25.124 1.00 0.00 C ATOM 1660 CG LYS A 107 3.912 25.024 26.540 1.00 0.00 C ATOM 1661 CD LYS A 107 5.154 25.459 27.320 1.00 0.00 C ATOM 1662 CE LYS A 107 5.488 24.453 28.424 1.00 0.00 C ATOM 1663 NZ LYS A 107 6.930 24.506 28.753 1.00 0.00 N ATOM 0 H LYS A 107 3.448 23.128 22.625 1.00 0.00 H new ATOM 0 HA LYS A 107 2.194 24.348 24.977 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.869 23.661 25.170 1.00 0.00 H new ATOM 0 HB3 LYS A 107 4.909 25.335 24.653 1.00 0.00 H new ATOM 0 HG2 LYS A 107 3.201 25.849 26.491 1.00 0.00 H new ATOM 0 HG3 LYS A 107 3.416 24.207 27.065 1.00 0.00 H new ATOM 0 HD2 LYS A 107 6.001 25.553 26.640 1.00 0.00 H new ATOM 0 HD3 LYS A 107 4.987 26.443 27.758 1.00 0.00 H new ATOM 0 HE2 LYS A 107 4.897 24.671 29.314 1.00 0.00 H new ATOM 0 HE3 LYS A 107 5.219 23.447 28.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 7.140 23.818 29.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 7.488 24.276 27.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 7.176 25.462 29.081 1.00 0.00 H new ATOM 1677 N THR A 108 1.493 25.600 22.905 1.00 0.00 N ATOM 1678 CA THR A 108 1.092 26.616 21.946 1.00 0.00 C ATOM 1679 C THR A 108 1.812 26.404 20.613 1.00 0.00 C ATOM 1680 O THR A 108 2.469 27.312 20.107 1.00 0.00 O ATOM 1681 CB THR A 108 1.360 27.987 22.570 1.00 0.00 C ATOM 1682 OG1 THR A 108 0.305 28.151 23.514 1.00 0.00 O ATOM 1683 CG2 THR A 108 1.153 29.132 21.577 1.00 0.00 C ATOM 0 H THR A 108 0.729 25.028 23.265 1.00 0.00 H new ATOM 0 HA THR A 108 0.028 26.548 21.719 1.00 0.00 H new ATOM 0 HB THR A 108 2.380 28.019 22.953 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.402 29.015 23.967 1.00 0.00 H new ATOM 0 HG21 THR A 108 1.356 30.083 22.070 1.00 0.00 H new ATOM 0 HG22 THR A 108 1.832 29.009 20.733 1.00 0.00 H new ATOM 0 HG23 THR A 108 0.123 29.122 21.219 1.00 0.00 H new ATOM 1691 N SER A 109 1.665 25.199 20.082 1.00 0.00 N ATOM 1692 CA SER A 109 2.293 24.856 18.818 1.00 0.00 C ATOM 1693 C SER A 109 1.236 24.373 17.823 1.00 0.00 C ATOM 1694 O SER A 109 0.281 23.697 18.204 1.00 0.00 O ATOM 1695 CB SER A 109 3.369 23.786 19.010 1.00 0.00 C ATOM 1696 OG SER A 109 4.626 24.351 19.370 1.00 0.00 O ATOM 0 H SER A 109 1.120 24.448 20.505 1.00 0.00 H new ATOM 0 HA SER A 109 2.775 25.750 18.422 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.051 23.087 19.784 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.479 23.214 18.089 1.00 0.00 H new ATOM 0 HG SER A 109 5.285 23.635 19.485 1.00 0.00 H new ATOM 1702 N TRP A 110 1.441 24.739 16.566 1.00 0.00 N ATOM 1703 CA TRP A 110 0.518 24.352 15.513 1.00 0.00 C ATOM 1704 C TRP A 110 -0.700 25.276 15.589 1.00 0.00 C ATOM 1705 O TRP A 110 -1.360 25.355 16.624 1.00 0.00 O ATOM 1706 CB TRP A 110 0.152 22.871 15.622 1.00 0.00 C ATOM 1707 CG TRP A 110 -0.106 22.193 14.275 1.00 0.00 C ATOM 1708 CD1 TRP A 110 -1.139 22.379 13.442 1.00 0.00 C ATOM 1709 CD2 TRP A 110 0.730 21.206 13.635 1.00 0.00 C ATOM 1710 NE1 TRP A 110 -1.031 21.588 12.316 1.00 0.00 N ATOM 1711 CE2 TRP A 110 0.142 20.852 12.438 1.00 0.00 C ATOM 1712 CE3 TRP A 110 1.943 20.631 14.054 1.00 0.00 C ATOM 1713 CZ2 TRP A 110 0.695 19.911 11.561 1.00 0.00 C ATOM 1714 CZ3 TRP A 110 2.483 19.692 13.166 1.00 0.00 C ATOM 1715 CH2 TRP A 110 1.903 19.325 11.957 1.00 0.00 C ATOM 0 H TRP A 110 2.233 25.300 16.253 1.00 0.00 H new ATOM 0 HA TRP A 110 0.981 24.466 14.533 1.00 0.00 H new ATOM 0 HB2 TRP A 110 0.958 22.345 16.134 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -0.738 22.772 16.243 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -1.954 23.062 13.628 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -1.690 21.550 11.538 1.00 0.00 H new ATOM 0 HE3 TRP A 110 2.420 20.893 14.987 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 0.215 19.651 10.629 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 3.415 19.220 13.440 1.00 0.00 H new ATOM 0 HH2 TRP A 110 2.382 18.591 11.326 1.00 0.00 H new ATOM 1726 N ASP A 111 -0.960 25.951 14.479 1.00 0.00 N ATOM 1727 CA ASP A 111 -2.087 26.866 14.407 1.00 0.00 C ATOM 1728 C ASP A 111 -1.910 27.792 13.202 1.00 0.00 C ATOM 1729 O ASP A 111 -2.811 27.922 12.376 1.00 0.00 O ATOM 1730 CB ASP A 111 -2.172 27.735 15.663 1.00 0.00 C ATOM 1731 CG ASP A 111 -3.438 27.540 16.499 1.00 0.00 C ATOM 1732 OD1 ASP A 111 -4.531 27.759 15.934 1.00 0.00 O ATOM 1733 OD2 ASP A 111 -3.285 27.176 17.685 1.00 0.00 O ATOM 0 H ASP A 111 -0.410 25.883 13.623 1.00 0.00 H new ATOM 0 HA ASP A 111 -2.997 26.273 14.317 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.305 27.527 16.290 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.108 28.782 15.367 1.00 0.00 H new ATOM 1738 N PRO A 112 -0.710 28.429 13.139 1.00 0.00 N ATOM 1739 CA PRO A 112 -0.402 29.340 12.049 1.00 0.00 C ATOM 1740 C PRO A 112 -0.101 28.572 10.761 1.00 0.00 C ATOM 1741 O PRO A 112 0.948 27.941 10.640 1.00 0.00 O ATOM 1742 CB PRO A 112 0.779 30.159 12.542 1.00 0.00 C ATOM 1743 CG PRO A 112 1.383 29.369 13.692 1.00 0.00 C ATOM 1744 CD PRO A 112 0.382 28.300 14.099 1.00 0.00 C ATOM 0 HA PRO A 112 -1.240 29.989 11.794 1.00 0.00 H new ATOM 0 HB2 PRO A 112 1.509 30.310 11.746 1.00 0.00 H new ATOM 0 HB3 PRO A 112 0.458 31.147 12.873 1.00 0.00 H new ATOM 0 HG2 PRO A 112 2.326 28.914 13.389 1.00 0.00 H new ATOM 0 HG3 PRO A 112 1.603 30.027 14.533 1.00 0.00 H new ATOM 0 HD2 PRO A 112 0.827 27.306 14.061 1.00 0.00 H new ATOM 0 HD3 PRO A 112 0.032 28.454 15.120 1.00 0.00 H new ATOM 1752 N GLY A 113 -1.041 28.649 9.830 1.00 0.00 N ATOM 1753 CA GLY A 113 -0.890 27.969 8.555 1.00 0.00 C ATOM 1754 C GLY A 113 -2.226 27.396 8.078 1.00 0.00 C ATOM 1755 O GLY A 113 -2.608 26.295 8.470 1.00 0.00 O ATOM 0 H GLY A 113 -1.910 29.172 9.934 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -0.502 28.665 7.811 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -0.159 27.166 8.651 1.00 0.00 H new ATOM 1759 N PHE A 114 -2.898 28.168 7.237 1.00 0.00 N ATOM 1760 CA PHE A 114 -4.183 27.751 6.702 1.00 0.00 C ATOM 1761 C PHE A 114 -4.268 28.032 5.200 1.00 0.00 C ATOM 1762 O PHE A 114 -4.535 27.127 4.410 1.00 0.00 O ATOM 1763 CB PHE A 114 -5.255 28.570 7.423 1.00 0.00 C ATOM 1764 CG PHE A 114 -6.390 27.728 8.011 1.00 0.00 C ATOM 1765 CD1 PHE A 114 -6.136 26.859 9.026 1.00 0.00 C ATOM 1766 CD2 PHE A 114 -7.652 27.849 7.519 1.00 0.00 C ATOM 1767 CE1 PHE A 114 -7.189 26.078 9.572 1.00 0.00 C ATOM 1768 CE2 PHE A 114 -8.705 27.069 8.065 1.00 0.00 C ATOM 1769 CZ PHE A 114 -8.451 26.199 9.079 1.00 0.00 C ATOM 0 H PHE A 114 -2.577 29.080 6.913 1.00 0.00 H new ATOM 0 HA PHE A 114 -4.319 26.680 6.853 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -4.785 29.139 8.225 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -5.677 29.293 6.725 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -5.134 26.763 9.417 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -7.853 28.539 6.713 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -6.988 25.388 10.378 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -9.707 27.166 7.675 1.00 0.00 H new ATOM 0 HZ PHE A 114 -9.252 25.604 9.493 1.00 0.00 H new ATOM 1779 N SER A 115 -4.038 29.289 4.851 1.00 0.00 N ATOM 1780 CA SER A 115 -4.085 29.700 3.459 1.00 0.00 C ATOM 1781 C SER A 115 -3.156 28.819 2.621 1.00 0.00 C ATOM 1782 O SER A 115 -1.937 28.971 2.672 1.00 0.00 O ATOM 1783 CB SER A 115 -3.700 31.173 3.305 1.00 0.00 C ATOM 1784 OG SER A 115 -4.087 31.696 2.038 1.00 0.00 O ATOM 0 H SER A 115 -3.818 30.037 5.509 1.00 0.00 H new ATOM 0 HA SER A 115 -5.108 29.581 3.103 1.00 0.00 H new ATOM 0 HB2 SER A 115 -4.171 31.755 4.097 1.00 0.00 H new ATOM 0 HB3 SER A 115 -2.622 31.281 3.428 1.00 0.00 H new ATOM 0 HG SER A 115 -3.825 32.639 1.979 1.00 0.00 H new ATOM 1790 N GLY A 116 -3.769 27.916 1.869 1.00 0.00 N ATOM 1791 CA GLY A 116 -3.012 27.010 1.021 1.00 0.00 C ATOM 1792 C GLY A 116 -2.352 27.764 -0.135 1.00 0.00 C ATOM 1793 O GLY A 116 -2.055 28.952 -0.018 1.00 0.00 O ATOM 0 H GLY A 116 -4.781 27.792 1.829 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -2.249 26.504 1.613 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.673 26.238 0.626 1.00 0.00 H new ATOM 1797 N PRO A 117 -2.137 27.024 -1.256 1.00 0.00 N ATOM 1798 CA PRO A 117 -1.518 27.610 -2.433 1.00 0.00 C ATOM 1799 C PRO A 117 -2.503 28.514 -3.177 1.00 0.00 C ATOM 1800 O PRO A 117 -3.669 28.613 -2.798 1.00 0.00 O ATOM 1801 CB PRO A 117 -1.055 26.425 -3.264 1.00 0.00 C ATOM 1802 CG PRO A 117 -1.837 25.226 -2.754 1.00 0.00 C ATOM 1803 CD PRO A 117 -2.476 25.615 -1.431 1.00 0.00 C ATOM 0 HA PRO A 117 -0.678 28.260 -2.188 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -1.246 26.593 -4.324 1.00 0.00 H new ATOM 0 HB3 PRO A 117 0.018 26.267 -3.154 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -2.600 24.933 -3.475 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -1.178 24.368 -2.622 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -3.556 25.467 -1.454 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -2.089 25.010 -0.611 1.00 0.00 H new ATOM 1811 N SER A 118 -1.998 29.149 -4.224 1.00 0.00 N ATOM 1812 CA SER A 118 -2.818 30.042 -5.025 1.00 0.00 C ATOM 1813 C SER A 118 -3.552 31.033 -4.119 1.00 0.00 C ATOM 1814 O SER A 118 -4.619 30.724 -3.592 1.00 0.00 O ATOM 1815 CB SER A 118 -3.820 29.256 -5.874 1.00 0.00 C ATOM 1816 OG SER A 118 -3.248 28.813 -7.101 1.00 0.00 O ATOM 0 H SER A 118 -1.031 29.063 -4.536 1.00 0.00 H new ATOM 0 HA SER A 118 -2.164 30.593 -5.700 1.00 0.00 H new ATOM 0 HB2 SER A 118 -4.177 28.395 -5.309 1.00 0.00 H new ATOM 0 HB3 SER A 118 -4.687 29.882 -6.083 1.00 0.00 H new ATOM 0 HG SER A 118 -3.918 28.314 -7.613 1.00 0.00 H new ATOM 1822 N SER A 119 -2.950 32.203 -3.967 1.00 0.00 N ATOM 1823 CA SER A 119 -3.533 33.241 -3.134 1.00 0.00 C ATOM 1824 C SER A 119 -4.043 34.389 -4.008 1.00 0.00 C ATOM 1825 O SER A 119 -3.505 34.640 -5.085 1.00 0.00 O ATOM 1826 CB SER A 119 -2.520 33.761 -2.112 1.00 0.00 C ATOM 1827 OG SER A 119 -3.127 34.613 -1.144 1.00 0.00 O ATOM 0 H SER A 119 -2.065 32.455 -4.406 1.00 0.00 H new ATOM 0 HA SER A 119 -4.371 32.810 -2.587 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.048 32.918 -1.608 1.00 0.00 H new ATOM 0 HB3 SER A 119 -1.730 34.305 -2.629 1.00 0.00 H new ATOM 0 HG SER A 119 -2.448 34.923 -0.509 1.00 0.00 H new ATOM 1833 N GLY A 120 -5.075 35.055 -3.511 1.00 0.00 N ATOM 1834 CA GLY A 120 -5.663 36.170 -4.233 1.00 0.00 C ATOM 1835 C GLY A 120 -4.784 37.418 -4.126 1.00 0.00 C ATOM 1836 O GLY A 120 -5.265 38.537 -4.298 1.00 0.00 O ATOM 0 H GLY A 120 -5.519 34.844 -2.617 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -5.793 35.901 -5.281 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -6.654 36.384 -3.834 1.00 0.00 H new TER 1840 GLY A 120