USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 828 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 31 CYS SG : rot 36:sc= -5.83! USER MOD Set 1.2: A 52 SER OG : rot -95:sc= 0.742 USER MOD Set 1.3: A 54 SER OG : rot -133:sc= -0.601 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 SER OG : rot 180:sc=-2.96e-05 USER MOD Single : A 11 ASN : amide:sc= -0.301 K(o=-0.3,f=-4.1!) USER MOD Single : A 14 ASN : amide:sc= -0.556 K(o=-0.56,f=-2.2!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.00741) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -156:sc= 0.466 USER MOD Single : A 35 SER OG : rot 34:sc= 0.0688 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= -1.25 USER MOD Single : A 47 HIS : no HD1:sc= -0.532 K(o=-0.53,f=-1.6) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -3.18 K(o=-3.2,f=-4.7!) USER MOD Single : A 69 ASN : amide:sc= -6.67! C(o=-6.7!,f=-7.3!) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0877 USER MOD Single : A 75 ASN : amide:sc= -0.232 X(o=-0.23,f=-0.34) USER MOD Single : A 78 HIS : no HD1:sc= -0.464 K(o=-0.46,f=-1.4) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= -0.0626 X(o=-0.063,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -40:sc= -2.97! USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot -16:sc= 0.521 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.432 -11.091 -44.796 1.00 0.00 N ATOM 2 CA GLY A 1 17.832 -10.806 -43.504 1.00 0.00 C ATOM 3 C GLY A 1 16.317 -10.632 -43.629 1.00 0.00 C ATOM 4 O GLY A 1 15.848 -9.739 -44.333 1.00 0.00 O ATOM 0 H1 GLY A 1 19.460 -11.205 -44.684 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.027 -11.968 -45.181 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.240 -10.305 -45.449 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.052 -11.617 -42.810 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.272 -9.901 -43.086 1.00 0.00 H new ATOM 8 N SER A 2 15.594 -11.500 -42.936 1.00 0.00 N ATOM 9 CA SER A 2 14.142 -11.453 -42.961 1.00 0.00 C ATOM 10 C SER A 2 13.579 -11.994 -41.645 1.00 0.00 C ATOM 11 O SER A 2 13.760 -13.167 -41.324 1.00 0.00 O ATOM 12 CB SER A 2 13.586 -12.249 -44.144 1.00 0.00 C ATOM 13 OG SER A 2 12.185 -12.050 -44.309 1.00 0.00 O ATOM 0 H SER A 2 15.987 -12.240 -42.354 1.00 0.00 H new ATOM 0 HA SER A 2 13.835 -10.414 -43.081 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.104 -11.953 -45.056 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.786 -13.310 -43.994 1.00 0.00 H new ATOM 0 HG SER A 2 11.868 -12.573 -45.075 1.00 0.00 H new ATOM 19 N SER A 3 12.906 -11.112 -40.920 1.00 0.00 N ATOM 20 CA SER A 3 12.315 -11.486 -39.647 1.00 0.00 C ATOM 21 C SER A 3 11.057 -10.654 -39.390 1.00 0.00 C ATOM 22 O SER A 3 10.943 -9.529 -39.872 1.00 0.00 O ATOM 23 CB SER A 3 13.313 -11.305 -38.502 1.00 0.00 C ATOM 24 OG SER A 3 12.972 -12.096 -37.366 1.00 0.00 O ATOM 0 H SER A 3 12.757 -10.140 -41.190 1.00 0.00 H new ATOM 0 HA SER A 3 12.043 -12.541 -39.693 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.312 -11.575 -38.845 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.348 -10.254 -38.215 1.00 0.00 H new ATOM 0 HG SER A 3 13.634 -11.954 -36.658 1.00 0.00 H new ATOM 30 N GLY A 4 10.143 -11.241 -38.631 1.00 0.00 N ATOM 31 CA GLY A 4 8.897 -10.569 -38.304 1.00 0.00 C ATOM 32 C GLY A 4 7.903 -11.538 -37.662 1.00 0.00 C ATOM 33 O GLY A 4 8.125 -12.748 -37.656 1.00 0.00 O ATOM 0 H GLY A 4 10.241 -12.175 -38.233 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.094 -9.741 -37.623 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.462 -10.142 -39.208 1.00 0.00 H new ATOM 37 N SER A 5 6.826 -10.971 -37.138 1.00 0.00 N ATOM 38 CA SER A 5 5.796 -11.769 -36.496 1.00 0.00 C ATOM 39 C SER A 5 6.366 -12.454 -35.252 1.00 0.00 C ATOM 40 O SER A 5 7.143 -13.401 -35.361 1.00 0.00 O ATOM 41 CB SER A 5 5.225 -12.811 -37.460 1.00 0.00 C ATOM 42 OG SER A 5 4.543 -12.207 -38.556 1.00 0.00 O ATOM 0 H SER A 5 6.645 -9.967 -37.145 1.00 0.00 H new ATOM 0 HA SER A 5 4.984 -11.105 -36.199 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.033 -13.438 -37.837 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.539 -13.465 -36.922 1.00 0.00 H new ATOM 0 HG SER A 5 4.195 -12.905 -39.149 1.00 0.00 H new ATOM 48 N SER A 6 5.957 -11.948 -34.097 1.00 0.00 N ATOM 49 CA SER A 6 6.416 -12.499 -32.834 1.00 0.00 C ATOM 50 C SER A 6 5.346 -13.420 -32.244 1.00 0.00 C ATOM 51 O SER A 6 5.653 -14.301 -31.443 1.00 0.00 O ATOM 52 CB SER A 6 6.765 -11.387 -31.843 1.00 0.00 C ATOM 53 OG SER A 6 8.090 -10.899 -32.032 1.00 0.00 O ATOM 0 H SER A 6 5.313 -11.162 -34.010 1.00 0.00 H new ATOM 0 HA SER A 6 7.320 -13.078 -33.022 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.057 -10.566 -31.956 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.659 -11.762 -30.825 1.00 0.00 H new ATOM 0 HG SER A 6 8.273 -10.189 -31.381 1.00 0.00 H new ATOM 59 N GLY A 7 4.111 -13.184 -32.664 1.00 0.00 N ATOM 60 CA GLY A 7 2.994 -13.981 -32.187 1.00 0.00 C ATOM 61 C GLY A 7 2.784 -13.787 -30.684 1.00 0.00 C ATOM 62 O GLY A 7 3.548 -14.311 -29.875 1.00 0.00 O ATOM 0 H GLY A 7 3.860 -12.452 -33.329 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.087 -13.701 -32.724 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.177 -15.034 -32.399 1.00 0.00 H new ATOM 66 N SER A 8 1.745 -13.034 -30.356 1.00 0.00 N ATOM 67 CA SER A 8 1.425 -12.765 -28.964 1.00 0.00 C ATOM 68 C SER A 8 -0.082 -12.902 -28.738 1.00 0.00 C ATOM 69 O SER A 8 -0.865 -12.824 -29.683 1.00 0.00 O ATOM 70 CB SER A 8 1.900 -11.371 -28.550 1.00 0.00 C ATOM 71 OG SER A 8 2.885 -11.426 -27.521 1.00 0.00 O ATOM 0 H SER A 8 1.113 -12.601 -31.030 1.00 0.00 H new ATOM 0 HA SER A 8 1.946 -13.495 -28.345 1.00 0.00 H new ATOM 0 HB2 SER A 8 2.311 -10.855 -29.418 1.00 0.00 H new ATOM 0 HB3 SER A 8 1.048 -10.785 -28.205 1.00 0.00 H new ATOM 0 HG SER A 8 3.164 -10.516 -27.286 1.00 0.00 H new ATOM 77 N PRO A 9 -0.452 -13.109 -27.446 1.00 0.00 N ATOM 78 CA PRO A 9 -1.851 -13.257 -27.083 1.00 0.00 C ATOM 79 C PRO A 9 -2.571 -11.907 -27.109 1.00 0.00 C ATOM 80 O PRO A 9 -1.975 -10.889 -27.456 1.00 0.00 O ATOM 81 CB PRO A 9 -1.834 -13.894 -25.703 1.00 0.00 C ATOM 82 CG PRO A 9 -0.439 -13.653 -25.150 1.00 0.00 C ATOM 83 CD PRO A 9 0.448 -13.206 -26.300 1.00 0.00 C ATOM 0 HA PRO A 9 -2.404 -13.878 -27.787 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -2.592 -13.449 -25.058 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -2.052 -14.960 -25.762 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -0.464 -12.893 -24.369 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -0.046 -14.563 -24.696 1.00 0.00 H new ATOM 0 HD2 PRO A 9 0.921 -12.248 -26.086 1.00 0.00 H new ATOM 0 HD3 PRO A 9 1.248 -13.923 -26.485 1.00 0.00 H new ATOM 91 N GLY A 10 -3.842 -11.943 -26.739 1.00 0.00 N ATOM 92 CA GLY A 10 -4.650 -10.735 -26.716 1.00 0.00 C ATOM 93 C GLY A 10 -5.233 -10.492 -25.322 1.00 0.00 C ATOM 94 O GLY A 10 -6.203 -11.140 -24.930 1.00 0.00 O ATOM 0 H GLY A 10 -4.333 -12.790 -26.452 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -4.042 -9.881 -27.014 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -5.458 -10.820 -27.442 1.00 0.00 H new ATOM 98 N ASN A 11 -4.618 -9.557 -24.613 1.00 0.00 N ATOM 99 CA ASN A 11 -5.065 -9.221 -23.272 1.00 0.00 C ATOM 100 C ASN A 11 -4.219 -8.066 -22.732 1.00 0.00 C ATOM 101 O ASN A 11 -3.028 -8.233 -22.471 1.00 0.00 O ATOM 102 CB ASN A 11 -4.902 -10.410 -22.322 1.00 0.00 C ATOM 103 CG ASN A 11 -5.558 -10.126 -20.970 1.00 0.00 C ATOM 104 OD1 ASN A 11 -5.949 -9.012 -20.662 1.00 0.00 O ATOM 105 ND2 ASN A 11 -5.657 -11.193 -20.182 1.00 0.00 N ATOM 0 H ASN A 11 -3.814 -9.022 -24.942 1.00 0.00 H new ATOM 0 HA ASN A 11 -6.118 -8.945 -23.327 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -5.348 -11.299 -22.767 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -3.843 -10.623 -22.179 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -6.081 -11.107 -19.258 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -5.309 -12.097 -20.502 1.00 0.00 H new ATOM 112 N ARG A 12 -4.867 -6.920 -22.581 1.00 0.00 N ATOM 113 CA ARG A 12 -4.189 -5.738 -22.077 1.00 0.00 C ATOM 114 C ARG A 12 -5.205 -4.640 -21.755 1.00 0.00 C ATOM 115 O ARG A 12 -6.276 -4.585 -22.358 1.00 0.00 O ATOM 116 CB ARG A 12 -3.179 -5.206 -23.096 1.00 0.00 C ATOM 117 CG ARG A 12 -1.910 -4.707 -22.401 1.00 0.00 C ATOM 118 CD ARG A 12 -0.844 -4.311 -23.425 1.00 0.00 C ATOM 119 NE ARG A 12 0.502 -4.640 -22.907 1.00 0.00 N ATOM 120 CZ ARG A 12 1.645 -4.340 -23.539 1.00 0.00 C ATOM 121 NH1 ARG A 12 1.611 -3.701 -24.717 1.00 0.00 N ATOM 122 NH2 ARG A 12 2.821 -4.677 -22.994 1.00 0.00 N ATOM 0 H ARG A 12 -5.854 -6.785 -22.799 1.00 0.00 H new ATOM 0 HA ARG A 12 -3.657 -6.023 -21.169 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -2.924 -5.993 -23.805 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -3.628 -4.394 -23.668 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -2.149 -3.851 -21.770 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -1.519 -5.486 -21.746 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -1.019 -4.834 -24.365 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -0.910 -3.244 -23.637 1.00 0.00 H new ATOM 0 HE ARG A 12 0.564 -5.126 -22.012 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.715 -3.443 -25.132 1.00 0.00 H new ATOM 0 HH12 ARG A 12 2.481 -3.472 -25.198 1.00 0.00 H new ATOM 0 HH21 ARG A 12 2.847 -5.162 -22.097 1.00 0.00 H new ATOM 0 HH22 ARG A 12 3.691 -4.448 -23.476 1.00 0.00 H new ATOM 136 N GLU A 13 -4.833 -3.793 -20.807 1.00 0.00 N ATOM 137 CA GLU A 13 -5.698 -2.700 -20.398 1.00 0.00 C ATOM 138 C GLU A 13 -7.019 -3.245 -19.850 1.00 0.00 C ATOM 139 O GLU A 13 -7.987 -3.399 -20.593 1.00 0.00 O ATOM 140 CB GLU A 13 -5.944 -1.732 -21.557 1.00 0.00 C ATOM 141 CG GLU A 13 -4.801 -0.723 -21.679 1.00 0.00 C ATOM 142 CD GLU A 13 -5.326 0.712 -21.603 1.00 0.00 C ATOM 143 OE1 GLU A 13 -5.936 1.039 -20.562 1.00 0.00 O ATOM 144 OE2 GLU A 13 -5.106 1.450 -22.588 1.00 0.00 O ATOM 0 H GLU A 13 -3.944 -3.842 -20.310 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.198 -2.145 -19.604 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -6.042 -2.291 -22.488 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -6.885 -1.204 -21.402 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -4.076 -0.891 -20.883 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -4.278 -0.873 -22.623 1.00 0.00 H new ATOM 151 N ASN A 14 -7.016 -3.523 -18.554 1.00 0.00 N ATOM 152 CA ASN A 14 -8.201 -4.047 -17.898 1.00 0.00 C ATOM 153 C ASN A 14 -7.841 -4.484 -16.477 1.00 0.00 C ATOM 154 O ASN A 14 -8.393 -3.968 -15.506 1.00 0.00 O ATOM 155 CB ASN A 14 -8.749 -5.266 -18.643 1.00 0.00 C ATOM 156 CG ASN A 14 -10.109 -4.959 -19.272 1.00 0.00 C ATOM 157 OD1 ASN A 14 -10.820 -4.055 -18.865 1.00 0.00 O ATOM 158 ND2 ASN A 14 -10.431 -5.760 -20.283 1.00 0.00 N ATOM 0 H ASN A 14 -6.211 -3.395 -17.941 1.00 0.00 H new ATOM 0 HA ASN A 14 -8.956 -3.261 -17.888 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.046 -5.569 -19.419 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.844 -6.105 -17.954 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -11.320 -5.637 -20.768 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -9.789 -6.498 -20.573 1.00 0.00 H new ATOM 165 N LYS A 15 -6.917 -5.431 -16.399 1.00 0.00 N ATOM 166 CA LYS A 15 -6.477 -5.943 -15.112 1.00 0.00 C ATOM 167 C LYS A 15 -5.027 -5.521 -14.870 1.00 0.00 C ATOM 168 O LYS A 15 -4.371 -4.996 -15.768 1.00 0.00 O ATOM 169 CB LYS A 15 -6.699 -7.455 -15.033 1.00 0.00 C ATOM 170 CG LYS A 15 -8.187 -7.784 -14.893 1.00 0.00 C ATOM 171 CD LYS A 15 -8.595 -8.898 -15.859 1.00 0.00 C ATOM 172 CE LYS A 15 -10.112 -8.921 -16.060 1.00 0.00 C ATOM 173 NZ LYS A 15 -10.458 -9.625 -17.315 1.00 0.00 N ATOM 0 H LYS A 15 -6.461 -5.857 -17.206 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.073 -5.514 -14.307 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -6.300 -7.932 -15.928 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -6.151 -7.863 -14.183 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -8.401 -8.089 -13.869 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -8.781 -6.891 -15.090 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -8.100 -8.752 -16.819 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -8.261 -9.861 -15.472 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -10.589 -9.417 -15.215 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -10.496 -7.901 -16.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -11.491 -9.631 -17.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.018 -9.135 -18.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -10.108 -10.604 -17.272 1.00 0.00 H new ATOM 187 N GLU A 16 -4.569 -5.767 -13.651 1.00 0.00 N ATOM 188 CA GLU A 16 -3.208 -5.419 -13.279 1.00 0.00 C ATOM 189 C GLU A 16 -2.873 -4.004 -13.754 1.00 0.00 C ATOM 190 O GLU A 16 -2.393 -3.818 -14.871 1.00 0.00 O ATOM 191 CB GLU A 16 -2.210 -6.435 -13.837 1.00 0.00 C ATOM 192 CG GLU A 16 -2.123 -7.670 -12.937 1.00 0.00 C ATOM 193 CD GLU A 16 -1.511 -8.854 -13.688 1.00 0.00 C ATOM 194 OE1 GLU A 16 -1.993 -9.125 -14.809 1.00 0.00 O ATOM 195 OE2 GLU A 16 -0.575 -9.461 -13.124 1.00 0.00 O ATOM 0 H GLU A 16 -5.116 -6.203 -12.909 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.132 -5.444 -12.192 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.512 -6.733 -14.841 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.226 -5.974 -13.924 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.520 -7.442 -12.058 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.118 -7.936 -12.581 1.00 0.00 H new ATOM 202 N LYS A 17 -3.139 -3.042 -12.882 1.00 0.00 N ATOM 203 CA LYS A 17 -2.872 -1.650 -13.199 1.00 0.00 C ATOM 204 C LYS A 17 -1.736 -1.138 -12.310 1.00 0.00 C ATOM 205 O LYS A 17 -1.585 -1.582 -11.173 1.00 0.00 O ATOM 206 CB LYS A 17 -4.154 -0.822 -13.096 1.00 0.00 C ATOM 207 CG LYS A 17 -4.657 -0.766 -11.652 1.00 0.00 C ATOM 208 CD LYS A 17 -6.005 -0.047 -11.568 1.00 0.00 C ATOM 209 CE LYS A 17 -5.933 1.144 -10.610 1.00 0.00 C ATOM 210 NZ LYS A 17 -5.840 2.413 -11.367 1.00 0.00 N ATOM 0 H LYS A 17 -3.537 -3.200 -11.956 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.538 -1.551 -14.232 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.968 0.189 -13.459 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -4.923 -1.255 -13.736 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.755 -1.778 -11.258 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.926 -0.251 -11.028 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.300 0.297 -12.559 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -6.772 -0.744 -11.231 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.816 1.159 -9.971 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -5.068 1.040 -9.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -5.792 3.211 -10.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -4.984 2.403 -11.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -6.678 2.518 -11.973 1.00 0.00 H new ATOM 224 N LYS A 18 -0.967 -0.211 -12.862 1.00 0.00 N ATOM 225 CA LYS A 18 0.150 0.366 -12.134 1.00 0.00 C ATOM 226 C LYS A 18 -0.278 1.705 -11.530 1.00 0.00 C ATOM 227 O LYS A 18 -0.680 2.615 -12.253 1.00 0.00 O ATOM 228 CB LYS A 18 1.383 0.463 -13.034 1.00 0.00 C ATOM 229 CG LYS A 18 2.595 0.972 -12.251 1.00 0.00 C ATOM 230 CD LYS A 18 3.004 2.369 -12.721 1.00 0.00 C ATOM 231 CE LYS A 18 3.738 2.303 -14.061 1.00 0.00 C ATOM 232 NZ LYS A 18 2.966 3.006 -15.110 1.00 0.00 N ATOM 0 H LYS A 18 -1.096 0.155 -13.805 1.00 0.00 H new ATOM 0 HA LYS A 18 0.439 -0.280 -11.305 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.605 -0.516 -13.459 1.00 0.00 H new ATOM 0 HB3 LYS A 18 1.177 1.134 -13.868 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.361 0.997 -11.187 1.00 0.00 H new ATOM 0 HG3 LYS A 18 3.430 0.283 -12.378 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.119 2.998 -12.818 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.646 2.835 -11.973 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.726 2.754 -13.964 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.890 1.263 -14.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.253 2.655 -16.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.951 2.830 -14.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 3.152 4.028 -15.052 1.00 0.00 H new ATOM 246 N VAL A 19 -0.176 1.782 -10.212 1.00 0.00 N ATOM 247 CA VAL A 19 -0.548 2.995 -9.502 1.00 0.00 C ATOM 248 C VAL A 19 0.622 3.445 -8.624 1.00 0.00 C ATOM 249 O VAL A 19 1.142 2.664 -7.829 1.00 0.00 O ATOM 250 CB VAL A 19 -1.836 2.764 -8.710 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.068 2.987 -9.590 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.853 1.367 -8.086 1.00 0.00 C ATOM 0 H VAL A 19 0.159 1.025 -9.616 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.756 3.801 -10.205 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.867 3.493 -7.900 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.970 2.816 -9.003 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.067 4.011 -9.965 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.045 2.293 -10.430 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.779 1.229 -7.529 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.788 0.616 -8.873 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -1.004 1.260 -7.411 1.00 0.00 H new ATOM 262 N PHE A 20 1.000 4.703 -8.798 1.00 0.00 N ATOM 263 CA PHE A 20 2.098 5.266 -8.031 1.00 0.00 C ATOM 264 C PHE A 20 1.582 6.233 -6.963 1.00 0.00 C ATOM 265 O PHE A 20 1.005 7.270 -7.286 1.00 0.00 O ATOM 266 CB PHE A 20 2.982 6.036 -9.014 1.00 0.00 C ATOM 267 CG PHE A 20 4.483 5.858 -8.773 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.982 5.932 -7.510 1.00 0.00 C ATOM 269 CD2 PHE A 20 5.317 5.626 -9.822 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.375 5.767 -7.287 1.00 0.00 C ATOM 271 CE2 PHE A 20 6.709 5.460 -9.598 1.00 0.00 C ATOM 272 CZ PHE A 20 7.209 5.534 -8.335 1.00 0.00 C ATOM 0 H PHE A 20 0.566 5.348 -9.458 1.00 0.00 H new ATOM 0 HA PHE A 20 2.647 4.470 -7.528 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.747 5.713 -10.028 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.738 7.097 -8.952 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.320 6.116 -6.677 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.920 5.568 -10.825 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.772 5.827 -6.284 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.371 5.275 -10.431 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.268 5.408 -8.165 1.00 0.00 H new ATOM 282 N ILE A 21 1.809 5.858 -5.712 1.00 0.00 N ATOM 283 CA ILE A 21 1.374 6.679 -4.595 1.00 0.00 C ATOM 284 C ILE A 21 2.532 7.569 -4.140 1.00 0.00 C ATOM 285 O ILE A 21 3.492 7.086 -3.541 1.00 0.00 O ATOM 286 CB ILE A 21 0.795 5.804 -3.481 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.489 5.110 -3.939 1.00 0.00 C ATOM 288 CG2 ILE A 21 0.582 6.616 -2.201 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.655 6.098 -4.000 1.00 0.00 C ATOM 0 H ILE A 21 2.288 4.997 -5.448 1.00 0.00 H new ATOM 0 HA ILE A 21 0.565 7.342 -4.901 1.00 0.00 H new ATOM 0 HB ILE A 21 1.519 5.022 -3.251 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.335 4.663 -4.921 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -0.732 4.298 -3.254 1.00 0.00 H new ATOM 0 HG21 ILE A 21 0.170 5.971 -1.425 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.536 7.023 -1.865 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.112 7.433 -2.400 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.555 5.579 -4.328 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.823 6.525 -3.011 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.419 6.896 -4.704 1.00 0.00 H new ATOM 301 N SER A 22 2.404 8.852 -4.440 1.00 0.00 N ATOM 302 CA SER A 22 3.429 9.814 -4.070 1.00 0.00 C ATOM 303 C SER A 22 2.990 10.594 -2.829 1.00 0.00 C ATOM 304 O SER A 22 1.973 11.286 -2.853 1.00 0.00 O ATOM 305 CB SER A 22 3.725 10.775 -5.223 1.00 0.00 C ATOM 306 OG SER A 22 4.666 10.229 -6.144 1.00 0.00 O ATOM 0 H SER A 22 1.606 9.249 -4.935 1.00 0.00 H new ATOM 0 HA SER A 22 4.345 9.268 -3.844 1.00 0.00 H new ATOM 0 HB2 SER A 22 2.798 11.009 -5.747 1.00 0.00 H new ATOM 0 HB3 SER A 22 4.111 11.713 -4.824 1.00 0.00 H new ATOM 0 HG SER A 22 4.827 10.871 -6.866 1.00 0.00 H new ATOM 312 N LEU A 23 3.778 10.455 -1.773 1.00 0.00 N ATOM 313 CA LEU A 23 3.484 11.138 -0.524 1.00 0.00 C ATOM 314 C LEU A 23 4.272 12.448 -0.466 1.00 0.00 C ATOM 315 O LEU A 23 5.286 12.536 0.225 1.00 0.00 O ATOM 316 CB LEU A 23 3.740 10.212 0.666 1.00 0.00 C ATOM 317 CG LEU A 23 2.631 9.208 0.987 1.00 0.00 C ATOM 318 CD1 LEU A 23 2.957 7.829 0.411 1.00 0.00 C ATOM 319 CD2 LEU A 23 2.360 9.152 2.492 1.00 0.00 C ATOM 0 H LEU A 23 4.620 9.879 -1.756 1.00 0.00 H new ATOM 0 HA LEU A 23 2.427 11.400 -0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.660 9.659 0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.912 10.827 1.549 1.00 0.00 H new ATOM 0 HG LEU A 23 1.713 9.548 0.508 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.153 7.134 0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.060 7.902 -0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.891 7.467 0.840 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.568 8.431 2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.267 8.849 3.014 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.052 10.137 2.843 1.00 0.00 H new ATOM 331 N VAL A 24 3.777 13.433 -1.201 1.00 0.00 N ATOM 332 CA VAL A 24 4.423 14.734 -1.242 1.00 0.00 C ATOM 333 C VAL A 24 3.386 15.802 -1.593 1.00 0.00 C ATOM 334 O VAL A 24 2.362 15.502 -2.205 1.00 0.00 O ATOM 335 CB VAL A 24 5.602 14.702 -2.216 1.00 0.00 C ATOM 336 CG1 VAL A 24 6.927 14.539 -1.468 1.00 0.00 C ATOM 337 CG2 VAL A 24 5.422 13.598 -3.260 1.00 0.00 C ATOM 0 H VAL A 24 2.936 13.356 -1.773 1.00 0.00 H new ATOM 0 HA VAL A 24 4.833 14.988 -0.265 1.00 0.00 H new ATOM 0 HB VAL A 24 5.629 15.657 -2.741 1.00 0.00 H new ATOM 0 HG11 VAL A 24 7.749 14.519 -2.184 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.063 15.375 -0.782 1.00 0.00 H new ATOM 0 HG13 VAL A 24 6.914 13.606 -0.904 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.274 13.598 -3.940 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.356 12.632 -2.760 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.507 13.777 -3.825 1.00 0.00 H new ATOM 347 N GLY A 25 3.687 17.028 -1.191 1.00 0.00 N ATOM 348 CA GLY A 25 2.793 18.143 -1.455 1.00 0.00 C ATOM 349 C GLY A 25 1.603 18.132 -0.495 1.00 0.00 C ATOM 350 O GLY A 25 0.451 18.100 -0.927 1.00 0.00 O ATOM 0 H GLY A 25 4.537 17.274 -0.684 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.337 19.082 -1.354 1.00 0.00 H new ATOM 0 HA3 GLY A 25 2.435 18.091 -2.483 1.00 0.00 H new ATOM 354 N SER A 26 1.920 18.158 0.792 1.00 0.00 N ATOM 355 CA SER A 26 0.891 18.151 1.817 1.00 0.00 C ATOM 356 C SER A 26 -0.153 17.078 1.503 1.00 0.00 C ATOM 357 O SER A 26 -1.151 17.353 0.837 1.00 0.00 O ATOM 358 CB SER A 26 0.224 19.522 1.937 1.00 0.00 C ATOM 359 OG SER A 26 0.378 20.079 3.240 1.00 0.00 O ATOM 0 H SER A 26 2.876 18.184 1.148 1.00 0.00 H new ATOM 0 HA SER A 26 1.362 17.922 2.773 1.00 0.00 H new ATOM 0 HB2 SER A 26 0.654 20.200 1.200 1.00 0.00 H new ATOM 0 HB3 SER A 26 -0.837 19.430 1.705 1.00 0.00 H new ATOM 0 HG SER A 26 -0.060 20.955 3.275 1.00 0.00 H new ATOM 365 N ARG A 27 0.111 15.877 1.996 1.00 0.00 N ATOM 366 CA ARG A 27 -0.794 14.761 1.776 1.00 0.00 C ATOM 367 C ARG A 27 -0.333 13.540 2.573 1.00 0.00 C ATOM 368 O ARG A 27 0.766 13.532 3.125 1.00 0.00 O ATOM 369 CB ARG A 27 -0.866 14.396 0.292 1.00 0.00 C ATOM 370 CG ARG A 27 -2.287 14.574 -0.248 1.00 0.00 C ATOM 371 CD ARG A 27 -2.281 14.705 -1.772 1.00 0.00 C ATOM 372 NE ARG A 27 -2.712 16.066 -2.165 1.00 0.00 N ATOM 373 CZ ARG A 27 -3.944 16.551 -1.964 1.00 0.00 C ATOM 374 NH1 ARG A 27 -4.876 15.790 -1.373 1.00 0.00 N ATOM 375 NH2 ARG A 27 -4.245 17.798 -2.353 1.00 0.00 N ATOM 0 H ARG A 27 0.939 15.652 2.547 1.00 0.00 H new ATOM 0 HA ARG A 27 -1.785 15.065 2.112 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -0.177 15.023 -0.274 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -0.546 13.363 0.152 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -2.901 13.722 0.045 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -2.740 15.461 0.195 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -1.282 14.505 -2.158 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -2.947 13.963 -2.212 1.00 0.00 H new ATOM 0 HE ARG A 27 -2.028 16.672 -2.617 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -4.647 14.841 -1.076 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -5.814 16.160 -1.220 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -3.536 18.377 -2.802 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -5.183 18.167 -2.200 1.00 0.00 H new ATOM 389 N GLY A 28 -1.198 12.536 2.608 1.00 0.00 N ATOM 390 CA GLY A 28 -0.894 11.311 3.329 1.00 0.00 C ATOM 391 C GLY A 28 -1.964 10.247 3.078 1.00 0.00 C ATOM 392 O GLY A 28 -3.158 10.533 3.156 1.00 0.00 O ATOM 0 H GLY A 28 -2.109 12.546 2.149 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.080 10.933 3.017 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.828 11.520 4.397 1.00 0.00 H new ATOM 396 N LEU A 29 -1.498 9.043 2.784 1.00 0.00 N ATOM 397 CA LEU A 29 -2.401 7.935 2.521 1.00 0.00 C ATOM 398 C LEU A 29 -3.573 7.994 3.503 1.00 0.00 C ATOM 399 O LEU A 29 -3.376 8.215 4.697 1.00 0.00 O ATOM 400 CB LEU A 29 -1.642 6.607 2.549 1.00 0.00 C ATOM 401 CG LEU A 29 -2.425 5.376 2.086 1.00 0.00 C ATOM 402 CD1 LEU A 29 -1.930 4.893 0.722 1.00 0.00 C ATOM 403 CD2 LEU A 29 -2.376 4.267 3.139 1.00 0.00 C ATOM 0 H LEU A 29 -0.507 8.810 2.722 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.820 8.015 1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.755 6.705 1.923 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.296 6.431 3.567 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.470 5.661 1.967 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.503 4.017 0.416 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.060 5.687 -0.014 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.874 4.630 0.790 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.940 3.404 2.785 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.340 3.977 3.314 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.813 4.629 4.070 1.00 0.00 H new ATOM 415 N GLY A 30 -4.766 7.792 2.964 1.00 0.00 N ATOM 416 CA GLY A 30 -5.970 7.820 3.778 1.00 0.00 C ATOM 417 C GLY A 30 -6.866 6.618 3.472 1.00 0.00 C ATOM 418 O GLY A 30 -8.076 6.672 3.685 1.00 0.00 O ATOM 0 H GLY A 30 -4.925 7.608 1.973 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.700 7.817 4.834 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.518 8.744 3.592 1.00 0.00 H new ATOM 422 N CYS A 31 -6.238 5.563 2.976 1.00 0.00 N ATOM 423 CA CYS A 31 -6.964 4.350 2.638 1.00 0.00 C ATOM 424 C CYS A 31 -6.589 3.267 3.652 1.00 0.00 C ATOM 425 O CYS A 31 -5.457 3.227 4.131 1.00 0.00 O ATOM 426 CB CYS A 31 -6.686 3.907 1.200 1.00 0.00 C ATOM 427 SG CYS A 31 -4.887 3.683 0.951 1.00 0.00 S ATOM 0 H CYS A 31 -5.234 5.522 2.800 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.036 4.538 2.690 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.209 2.974 0.990 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.068 4.651 0.501 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.355 3.203 2.036 1.00 0.00 H new ATOM 433 N SER A 32 -7.560 2.417 3.948 1.00 0.00 N ATOM 434 CA SER A 32 -7.346 1.337 4.896 1.00 0.00 C ATOM 435 C SER A 32 -7.111 0.023 4.148 1.00 0.00 C ATOM 436 O SER A 32 -7.786 -0.263 3.160 1.00 0.00 O ATOM 437 CB SER A 32 -8.534 1.199 5.851 1.00 0.00 C ATOM 438 OG SER A 32 -8.134 1.284 7.216 1.00 0.00 O ATOM 0 H SER A 32 -8.498 2.454 3.548 1.00 0.00 H new ATOM 0 HA SER A 32 -6.463 1.573 5.490 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.263 1.980 5.638 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.030 0.244 5.677 1.00 0.00 H new ATOM 0 HG SER A 32 -8.920 1.193 7.794 1.00 0.00 H new ATOM 444 N ILE A 33 -6.151 -0.741 4.648 1.00 0.00 N ATOM 445 CA ILE A 33 -5.818 -2.018 4.040 1.00 0.00 C ATOM 446 C ILE A 33 -6.249 -3.151 4.973 1.00 0.00 C ATOM 447 O ILE A 33 -6.184 -3.013 6.194 1.00 0.00 O ATOM 448 CB ILE A 33 -4.336 -2.062 3.663 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.451 -1.834 4.891 1.00 0.00 C ATOM 450 CG2 ILE A 33 -4.025 -1.070 2.541 1.00 0.00 C ATOM 451 CD1 ILE A 33 -2.087 -2.504 4.716 1.00 0.00 C ATOM 0 H ILE A 33 -5.593 -0.500 5.467 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.365 -2.149 3.106 1.00 0.00 H new ATOM 0 HB ILE A 33 -4.110 -3.058 3.283 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.317 -0.765 5.053 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.944 -2.232 5.778 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.965 -1.122 2.293 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.617 -1.320 1.660 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.272 -0.060 2.869 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.478 -2.327 5.602 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -2.223 -3.577 4.578 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.586 -2.087 3.842 1.00 0.00 H new ATOM 463 N SER A 34 -6.680 -4.246 4.364 1.00 0.00 N ATOM 464 CA SER A 34 -7.122 -5.402 5.125 1.00 0.00 C ATOM 465 C SER A 34 -6.317 -6.637 4.715 1.00 0.00 C ATOM 466 O SER A 34 -5.756 -6.682 3.621 1.00 0.00 O ATOM 467 CB SER A 34 -8.618 -5.653 4.927 1.00 0.00 C ATOM 468 OG SER A 34 -8.906 -6.166 3.629 1.00 0.00 O ATOM 0 H SER A 34 -6.732 -4.357 3.351 1.00 0.00 H new ATOM 0 HA SER A 34 -6.953 -5.200 6.183 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.971 -6.356 5.681 1.00 0.00 H new ATOM 0 HB3 SER A 34 -9.165 -4.722 5.079 1.00 0.00 H new ATOM 0 HG SER A 34 -9.836 -5.964 3.396 1.00 0.00 H new ATOM 474 N SER A 35 -6.287 -7.609 5.614 1.00 0.00 N ATOM 475 CA SER A 35 -5.561 -8.842 5.360 1.00 0.00 C ATOM 476 C SER A 35 -6.521 -9.920 4.854 1.00 0.00 C ATOM 477 O SER A 35 -7.552 -10.178 5.474 1.00 0.00 O ATOM 478 CB SER A 35 -4.836 -9.324 6.618 1.00 0.00 C ATOM 479 OG SER A 35 -5.712 -9.415 7.737 1.00 0.00 O ATOM 0 H SER A 35 -6.754 -7.568 6.520 1.00 0.00 H new ATOM 0 HA SER A 35 -4.810 -8.645 4.595 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.389 -10.300 6.427 1.00 0.00 H new ATOM 0 HB3 SER A 35 -4.020 -8.640 6.851 1.00 0.00 H new ATOM 0 HG SER A 35 -6.604 -9.685 7.433 1.00 0.00 H new ATOM 485 N GLY A 36 -6.148 -10.522 3.734 1.00 0.00 N ATOM 486 CA GLY A 36 -6.964 -11.567 3.139 1.00 0.00 C ATOM 487 C GLY A 36 -6.771 -12.897 3.871 1.00 0.00 C ATOM 488 O GLY A 36 -5.848 -13.041 4.670 1.00 0.00 O ATOM 0 H GLY A 36 -5.292 -10.306 3.223 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.014 -11.278 3.174 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.701 -11.685 2.088 1.00 0.00 H new ATOM 492 N PRO A 37 -7.681 -13.859 3.563 1.00 0.00 N ATOM 493 CA PRO A 37 -7.620 -15.172 4.182 1.00 0.00 C ATOM 494 C PRO A 37 -6.484 -16.007 3.587 1.00 0.00 C ATOM 495 O PRO A 37 -5.655 -15.490 2.839 1.00 0.00 O ATOM 496 CB PRO A 37 -8.992 -15.782 3.946 1.00 0.00 C ATOM 497 CG PRO A 37 -9.613 -14.986 2.809 1.00 0.00 C ATOM 498 CD PRO A 37 -8.788 -13.724 2.620 1.00 0.00 C ATOM 0 HA PRO A 37 -7.398 -15.124 5.248 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -8.910 -16.837 3.685 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.606 -15.723 4.845 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -9.625 -15.575 1.892 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -10.648 -14.735 3.040 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.427 -13.637 1.595 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.378 -12.831 2.827 1.00 0.00 H new ATOM 506 N ILE A 38 -6.483 -17.284 3.941 1.00 0.00 N ATOM 507 CA ILE A 38 -5.463 -18.195 3.451 1.00 0.00 C ATOM 508 C ILE A 38 -5.743 -18.527 1.984 1.00 0.00 C ATOM 509 O ILE A 38 -4.819 -18.782 1.214 1.00 0.00 O ATOM 510 CB ILE A 38 -5.367 -19.427 4.353 1.00 0.00 C ATOM 511 CG1 ILE A 38 -4.381 -20.449 3.783 1.00 0.00 C ATOM 512 CG2 ILE A 38 -6.749 -20.037 4.597 1.00 0.00 C ATOM 513 CD1 ILE A 38 -3.038 -20.382 4.512 1.00 0.00 C ATOM 0 H ILE A 38 -7.172 -17.709 4.561 1.00 0.00 H new ATOM 0 HA ILE A 38 -4.481 -17.723 3.489 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.979 -19.112 5.322 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -4.798 -21.452 3.874 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.231 -20.261 2.720 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -6.652 -20.911 5.241 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -7.392 -19.300 5.079 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.189 -20.335 3.645 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.356 -21.119 4.087 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -2.612 -19.385 4.399 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.188 -20.594 5.571 1.00 0.00 H new ATOM 525 N GLN A 39 -7.023 -18.514 1.642 1.00 0.00 N ATOM 526 CA GLN A 39 -7.437 -18.811 0.281 1.00 0.00 C ATOM 527 C GLN A 39 -7.205 -17.597 -0.621 1.00 0.00 C ATOM 528 O GLN A 39 -6.970 -17.746 -1.819 1.00 0.00 O ATOM 529 CB GLN A 39 -8.901 -19.255 0.238 1.00 0.00 C ATOM 530 CG GLN A 39 -9.828 -18.135 0.716 1.00 0.00 C ATOM 531 CD GLN A 39 -11.055 -18.706 1.429 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.116 -18.878 0.853 1.00 0.00 O ATOM 533 NE2 GLN A 39 -10.851 -18.990 2.713 1.00 0.00 N ATOM 0 H GLN A 39 -7.787 -18.302 2.284 1.00 0.00 H new ATOM 0 HA GLN A 39 -6.830 -19.637 -0.091 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.168 -19.543 -0.779 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -9.036 -20.136 0.865 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -9.286 -17.473 1.391 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.145 -17.532 -0.135 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.937 -18.821 3.134 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -11.608 -19.376 3.276 1.00 0.00 H new ATOM 542 N LYS A 40 -7.280 -16.424 -0.011 1.00 0.00 N ATOM 543 CA LYS A 40 -7.081 -15.185 -0.744 1.00 0.00 C ATOM 544 C LYS A 40 -6.206 -14.242 0.084 1.00 0.00 C ATOM 545 O LYS A 40 -6.642 -13.156 0.463 1.00 0.00 O ATOM 546 CB LYS A 40 -8.427 -14.579 -1.147 1.00 0.00 C ATOM 547 CG LYS A 40 -8.293 -13.749 -2.425 1.00 0.00 C ATOM 548 CD LYS A 40 -9.631 -13.113 -2.808 1.00 0.00 C ATOM 549 CE LYS A 40 -9.467 -12.166 -3.999 1.00 0.00 C ATOM 550 NZ LYS A 40 -9.499 -12.922 -5.270 1.00 0.00 N ATOM 0 H LYS A 40 -7.476 -16.305 0.983 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.551 -15.376 -1.677 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.157 -15.374 -1.300 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -8.804 -13.952 -0.339 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -7.544 -12.970 -2.280 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.941 -14.382 -3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.351 -13.893 -3.056 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.035 -12.565 -1.956 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.263 -11.422 -3.992 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.524 -11.625 -3.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.386 -12.265 -6.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.724 -13.616 -5.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.409 -13.418 -5.356 1.00 0.00 H new ATOM 564 N PRO A 41 -4.954 -14.704 0.349 1.00 0.00 N ATOM 565 CA PRO A 41 -4.013 -13.914 1.125 1.00 0.00 C ATOM 566 C PRO A 41 -3.450 -12.759 0.294 1.00 0.00 C ATOM 567 O PRO A 41 -3.257 -12.895 -0.913 1.00 0.00 O ATOM 568 CB PRO A 41 -2.946 -14.900 1.572 1.00 0.00 C ATOM 569 CG PRO A 41 -3.076 -16.101 0.650 1.00 0.00 C ATOM 570 CD PRO A 41 -4.403 -15.985 -0.083 1.00 0.00 C ATOM 0 HA PRO A 41 -4.477 -13.433 1.986 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -1.952 -14.459 1.501 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.093 -15.189 2.613 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.249 -16.129 -0.060 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.036 -17.028 1.222 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -4.262 -16.011 -1.164 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.070 -16.809 0.172 1.00 0.00 H new ATOM 578 N GLY A 42 -3.202 -11.649 0.973 1.00 0.00 N ATOM 579 CA GLY A 42 -2.664 -10.472 0.313 1.00 0.00 C ATOM 580 C GLY A 42 -3.067 -9.195 1.054 1.00 0.00 C ATOM 581 O GLY A 42 -3.352 -9.232 2.250 1.00 0.00 O ATOM 0 H GLY A 42 -3.364 -11.540 1.974 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.577 -10.542 0.266 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.025 -10.430 -0.715 1.00 0.00 H new ATOM 585 N ILE A 43 -3.076 -8.097 0.313 1.00 0.00 N ATOM 586 CA ILE A 43 -3.439 -6.812 0.885 1.00 0.00 C ATOM 587 C ILE A 43 -4.509 -6.153 0.011 1.00 0.00 C ATOM 588 O ILE A 43 -4.270 -5.873 -1.163 1.00 0.00 O ATOM 589 CB ILE A 43 -2.195 -5.946 1.090 1.00 0.00 C ATOM 590 CG1 ILE A 43 -1.153 -6.676 1.941 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.565 -4.584 1.681 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.543 -6.656 3.421 1.00 0.00 C ATOM 0 H ILE A 43 -2.838 -8.071 -0.678 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.873 -6.946 1.876 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.743 -5.762 0.115 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.057 -7.707 1.600 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -0.178 -6.206 1.812 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.662 -3.989 1.816 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.243 -4.065 1.003 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -3.054 -4.726 2.645 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.786 -7.181 4.004 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.614 -5.624 3.765 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.507 -7.149 3.550 1.00 0.00 H new ATOM 604 N PHE A 44 -5.665 -5.925 0.617 1.00 0.00 N ATOM 605 CA PHE A 44 -6.771 -5.305 -0.091 1.00 0.00 C ATOM 606 C PHE A 44 -7.259 -4.053 0.642 1.00 0.00 C ATOM 607 O PHE A 44 -7.230 -3.999 1.871 1.00 0.00 O ATOM 608 CB PHE A 44 -7.906 -6.331 -0.134 1.00 0.00 C ATOM 609 CG PHE A 44 -7.458 -7.737 -0.537 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.656 -8.459 0.291 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.861 -8.266 -1.724 1.00 0.00 C ATOM 612 CE1 PHE A 44 -6.240 -9.764 -0.082 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.445 -9.571 -2.097 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.644 -10.292 -1.269 1.00 0.00 C ATOM 0 H PHE A 44 -5.859 -6.159 1.591 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.453 -5.008 -1.090 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.377 -6.378 0.848 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.666 -5.988 -0.836 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.335 -8.039 1.233 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.497 -7.693 -2.382 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.603 -10.337 0.576 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.765 -9.991 -3.039 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.328 -11.285 -1.553 1.00 0.00 H new ATOM 624 N ILE A 45 -7.696 -3.079 -0.142 1.00 0.00 N ATOM 625 CA ILE A 45 -8.189 -1.832 0.417 1.00 0.00 C ATOM 626 C ILE A 45 -9.577 -2.062 1.019 1.00 0.00 C ATOM 627 O ILE A 45 -10.410 -2.746 0.426 1.00 0.00 O ATOM 628 CB ILE A 45 -8.152 -0.722 -0.635 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.715 -0.272 -0.906 1.00 0.00 C ATOM 630 CG2 ILE A 45 -9.051 0.448 -0.229 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.688 0.965 -1.807 1.00 0.00 C ATOM 0 H ILE A 45 -7.719 -3.128 -1.161 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.541 -1.495 1.226 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.546 -1.123 -1.569 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.216 -0.050 0.037 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -6.159 -1.082 -1.378 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.007 1.223 -0.994 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -10.078 0.099 -0.126 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.709 0.856 0.722 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.655 1.264 -1.984 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.166 0.733 -2.758 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.224 1.781 -1.321 1.00 0.00 H new ATOM 643 N SER A 46 -9.782 -1.478 2.191 1.00 0.00 N ATOM 644 CA SER A 46 -11.055 -1.610 2.880 1.00 0.00 C ATOM 645 C SER A 46 -11.851 -0.309 2.763 1.00 0.00 C ATOM 646 O SER A 46 -13.074 -0.335 2.631 1.00 0.00 O ATOM 647 CB SER A 46 -10.849 -1.977 4.351 1.00 0.00 C ATOM 648 OG SER A 46 -10.877 -0.830 5.196 1.00 0.00 O ATOM 0 H SER A 46 -9.088 -0.913 2.681 1.00 0.00 H new ATOM 0 HA SER A 46 -11.618 -2.415 2.408 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.625 -2.676 4.662 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.894 -2.489 4.467 1.00 0.00 H new ATOM 0 HG SER A 46 -10.744 -1.106 6.127 1.00 0.00 H new ATOM 654 N HIS A 47 -11.125 0.798 2.817 1.00 0.00 N ATOM 655 CA HIS A 47 -11.749 2.107 2.719 1.00 0.00 C ATOM 656 C HIS A 47 -10.739 3.116 2.169 1.00 0.00 C ATOM 657 O HIS A 47 -9.533 2.947 2.336 1.00 0.00 O ATOM 658 CB HIS A 47 -12.337 2.531 4.067 1.00 0.00 C ATOM 659 CG HIS A 47 -13.078 3.845 4.027 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.434 5.070 4.028 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.415 4.114 3.984 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.351 6.026 3.988 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.578 5.431 3.961 1.00 0.00 N ATOM 0 H HIS A 47 -10.111 0.816 2.927 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.585 2.064 2.021 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -13.016 1.753 4.416 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.531 2.602 4.797 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.207 3.380 3.971 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.160 7.089 3.978 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.474 5.918 3.928 1.00 0.00 H new ATOM 671 N VAL A 48 -11.271 4.144 1.523 1.00 0.00 N ATOM 672 CA VAL A 48 -10.431 5.181 0.947 1.00 0.00 C ATOM 673 C VAL A 48 -10.985 6.553 1.335 1.00 0.00 C ATOM 674 O VAL A 48 -12.167 6.828 1.135 1.00 0.00 O ATOM 675 CB VAL A 48 -10.323 4.985 -0.567 1.00 0.00 C ATOM 676 CG1 VAL A 48 -9.812 6.256 -1.248 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.434 3.787 -0.903 1.00 0.00 C ATOM 0 H VAL A 48 -12.272 4.281 1.386 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.417 5.116 1.343 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.322 4.778 -0.951 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -9.744 6.091 -2.323 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -10.501 7.077 -1.050 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.826 6.507 -0.857 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.374 3.670 -1.985 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -8.435 3.951 -0.500 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -9.859 2.884 -0.464 1.00 0.00 H new ATOM 687 N LYS A 49 -10.104 7.378 1.881 1.00 0.00 N ATOM 688 CA LYS A 49 -10.490 8.716 2.299 1.00 0.00 C ATOM 689 C LYS A 49 -10.696 9.592 1.061 1.00 0.00 C ATOM 690 O LYS A 49 -10.122 9.327 0.006 1.00 0.00 O ATOM 691 CB LYS A 49 -9.473 9.282 3.291 1.00 0.00 C ATOM 692 CG LYS A 49 -9.874 8.958 4.732 1.00 0.00 C ATOM 693 CD LYS A 49 -8.688 9.132 5.683 1.00 0.00 C ATOM 694 CE LYS A 49 -8.832 10.412 6.510 1.00 0.00 C ATOM 695 NZ LYS A 49 -8.066 10.303 7.771 1.00 0.00 N ATOM 0 H LYS A 49 -9.124 7.146 2.044 1.00 0.00 H new ATOM 0 HA LYS A 49 -11.440 8.689 2.833 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.487 8.868 3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.398 10.362 3.165 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -10.691 9.610 5.041 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.243 7.934 4.789 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.621 8.271 6.348 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.761 9.166 5.111 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -8.476 11.266 5.934 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.884 10.593 6.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -8.174 11.180 8.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.424 9.500 8.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -7.060 10.153 7.554 1.00 0.00 H new ATOM 709 N PRO A 50 -11.539 10.645 1.236 1.00 0.00 N ATOM 710 CA PRO A 50 -11.827 11.562 0.147 1.00 0.00 C ATOM 711 C PRO A 50 -10.647 12.503 -0.105 1.00 0.00 C ATOM 712 O PRO A 50 -10.210 13.212 0.800 1.00 0.00 O ATOM 713 CB PRO A 50 -13.090 12.293 0.572 1.00 0.00 C ATOM 714 CG PRO A 50 -13.200 12.096 2.075 1.00 0.00 C ATOM 715 CD PRO A 50 -12.236 10.990 2.472 1.00 0.00 C ATOM 0 HA PRO A 50 -11.979 11.051 -0.804 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -13.032 13.352 0.320 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -13.965 11.891 0.060 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.958 13.020 2.600 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.220 11.830 2.352 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.539 11.328 3.239 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.766 10.130 2.881 1.00 0.00 H new ATOM 723 N GLY A 51 -10.166 12.479 -1.339 1.00 0.00 N ATOM 724 CA GLY A 51 -9.045 13.322 -1.721 1.00 0.00 C ATOM 725 C GLY A 51 -7.745 12.827 -1.084 1.00 0.00 C ATOM 726 O GLY A 51 -6.835 13.615 -0.830 1.00 0.00 O ATOM 0 H GLY A 51 -10.531 11.890 -2.087 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.943 13.328 -2.806 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.237 14.350 -1.413 1.00 0.00 H new ATOM 730 N SER A 52 -7.699 11.525 -0.843 1.00 0.00 N ATOM 731 CA SER A 52 -6.526 10.916 -0.241 1.00 0.00 C ATOM 732 C SER A 52 -5.479 10.619 -1.317 1.00 0.00 C ATOM 733 O SER A 52 -5.587 11.103 -2.442 1.00 0.00 O ATOM 734 CB SER A 52 -6.894 9.634 0.509 1.00 0.00 C ATOM 735 OG SER A 52 -7.319 8.601 -0.376 1.00 0.00 O ATOM 0 H SER A 52 -8.456 10.875 -1.054 1.00 0.00 H new ATOM 0 HA SER A 52 -6.108 11.619 0.479 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.033 9.289 1.082 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.688 9.848 1.225 1.00 0.00 H new ATOM 0 HG SER A 52 -8.297 8.609 -0.443 1.00 0.00 H new ATOM 741 N LEU A 53 -4.490 9.826 -0.932 1.00 0.00 N ATOM 742 CA LEU A 53 -3.425 9.459 -1.850 1.00 0.00 C ATOM 743 C LEU A 53 -3.928 8.368 -2.798 1.00 0.00 C ATOM 744 O LEU A 53 -3.402 8.206 -3.898 1.00 0.00 O ATOM 745 CB LEU A 53 -2.163 9.069 -1.078 1.00 0.00 C ATOM 746 CG LEU A 53 -0.875 9.782 -1.494 1.00 0.00 C ATOM 747 CD1 LEU A 53 -0.822 9.977 -3.011 1.00 0.00 C ATOM 748 CD2 LEU A 53 -0.711 11.103 -0.740 1.00 0.00 C ATOM 0 H LEU A 53 -4.404 9.427 0.003 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.143 10.312 -2.467 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.335 9.261 -0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.012 7.995 -1.187 1.00 0.00 H new ATOM 0 HG LEU A 53 -0.031 9.149 -1.221 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.103 10.486 -3.280 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.859 9.006 -3.504 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.673 10.578 -3.330 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.212 11.589 -1.055 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.557 11.754 -0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.671 10.908 0.332 1.00 0.00 H new ATOM 760 N SER A 54 -4.940 7.648 -2.337 1.00 0.00 N ATOM 761 CA SER A 54 -5.519 6.578 -3.131 1.00 0.00 C ATOM 762 C SER A 54 -6.722 7.102 -3.918 1.00 0.00 C ATOM 763 O SER A 54 -7.058 6.568 -4.974 1.00 0.00 O ATOM 764 CB SER A 54 -5.935 5.400 -2.247 1.00 0.00 C ATOM 765 OG SER A 54 -5.678 5.651 -0.868 1.00 0.00 O ATOM 0 H SER A 54 -5.374 7.785 -1.424 1.00 0.00 H new ATOM 0 HA SER A 54 -4.762 6.223 -3.831 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.997 5.199 -2.387 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.397 4.505 -2.559 1.00 0.00 H new ATOM 0 HG SER A 54 -5.237 4.871 -0.470 1.00 0.00 H new ATOM 771 N ALA A 55 -7.338 8.141 -3.373 1.00 0.00 N ATOM 772 CA ALA A 55 -8.497 8.743 -4.011 1.00 0.00 C ATOM 773 C ALA A 55 -8.039 9.569 -5.214 1.00 0.00 C ATOM 774 O ALA A 55 -8.790 9.748 -6.171 1.00 0.00 O ATOM 775 CB ALA A 55 -9.266 9.580 -2.987 1.00 0.00 C ATOM 0 H ALA A 55 -7.057 8.581 -2.497 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.176 7.974 -4.379 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.135 10.032 -3.465 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.594 8.941 -2.167 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.617 10.365 -2.598 1.00 0.00 H new ATOM 781 N GLU A 56 -6.808 10.052 -5.126 1.00 0.00 N ATOM 782 CA GLU A 56 -6.241 10.855 -6.196 1.00 0.00 C ATOM 783 C GLU A 56 -5.956 9.984 -7.421 1.00 0.00 C ATOM 784 O GLU A 56 -6.128 10.427 -8.555 1.00 0.00 O ATOM 785 CB GLU A 56 -4.974 11.575 -5.728 1.00 0.00 C ATOM 786 CG GLU A 56 -3.970 10.587 -5.133 1.00 0.00 C ATOM 787 CD GLU A 56 -2.555 11.169 -5.144 1.00 0.00 C ATOM 788 OE1 GLU A 56 -2.436 12.377 -4.847 1.00 0.00 O ATOM 789 OE2 GLU A 56 -1.624 10.392 -5.450 1.00 0.00 O ATOM 0 H GLU A 56 -6.188 9.903 -4.330 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.969 11.616 -6.478 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.519 12.100 -6.568 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.233 12.328 -4.984 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.258 10.342 -4.111 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -3.989 9.657 -5.701 1.00 0.00 H new ATOM 796 N VAL A 57 -5.525 8.761 -7.150 1.00 0.00 N ATOM 797 CA VAL A 57 -5.214 7.823 -8.215 1.00 0.00 C ATOM 798 C VAL A 57 -6.507 7.164 -8.701 1.00 0.00 C ATOM 799 O VAL A 57 -6.576 6.685 -9.832 1.00 0.00 O ATOM 800 CB VAL A 57 -4.171 6.812 -7.736 1.00 0.00 C ATOM 801 CG1 VAL A 57 -2.919 7.522 -7.214 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.757 5.882 -6.672 1.00 0.00 C ATOM 0 H VAL A 57 -5.384 8.398 -6.207 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.774 8.344 -9.066 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.879 6.201 -8.590 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.193 6.781 -6.880 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.483 8.123 -8.012 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.189 8.168 -6.379 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.995 5.173 -6.349 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -5.091 6.471 -5.818 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.604 5.338 -7.091 1.00 0.00 H new ATOM 812 N GLY A 58 -7.498 7.160 -7.822 1.00 0.00 N ATOM 813 CA GLY A 58 -8.784 6.567 -8.147 1.00 0.00 C ATOM 814 C GLY A 58 -8.905 5.161 -7.556 1.00 0.00 C ATOM 815 O GLY A 58 -9.724 4.362 -8.007 1.00 0.00 O ATOM 0 H GLY A 58 -7.436 7.558 -6.885 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.586 7.197 -7.763 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.904 6.522 -9.229 1.00 0.00 H new ATOM 819 N LEU A 59 -8.077 4.902 -6.554 1.00 0.00 N ATOM 820 CA LEU A 59 -8.081 3.606 -5.896 1.00 0.00 C ATOM 821 C LEU A 59 -9.374 3.451 -5.094 1.00 0.00 C ATOM 822 O LEU A 59 -9.815 4.389 -4.431 1.00 0.00 O ATOM 823 CB LEU A 59 -6.813 3.427 -5.059 1.00 0.00 C ATOM 824 CG LEU A 59 -5.603 2.843 -5.791 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.376 2.804 -4.878 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.927 1.466 -6.375 1.00 0.00 C ATOM 0 H LEU A 59 -7.399 5.567 -6.182 1.00 0.00 H new ATOM 0 HA LEU A 59 -8.065 2.804 -6.633 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.532 4.397 -4.650 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.048 2.781 -4.213 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.361 3.499 -6.628 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.530 2.385 -5.423 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.132 3.815 -4.552 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.590 2.184 -4.007 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.050 1.074 -6.890 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.210 0.787 -5.571 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.753 1.555 -7.081 1.00 0.00 H new ATOM 838 N GLU A 60 -9.947 2.259 -5.181 1.00 0.00 N ATOM 839 CA GLU A 60 -11.181 1.968 -4.471 1.00 0.00 C ATOM 840 C GLU A 60 -11.078 0.618 -3.758 1.00 0.00 C ATOM 841 O GLU A 60 -10.103 -0.110 -3.938 1.00 0.00 O ATOM 842 CB GLU A 60 -12.380 1.997 -5.422 1.00 0.00 C ATOM 843 CG GLU A 60 -12.370 3.264 -6.278 1.00 0.00 C ATOM 844 CD GLU A 60 -13.484 3.226 -7.326 1.00 0.00 C ATOM 845 OE1 GLU A 60 -14.611 3.635 -6.972 1.00 0.00 O ATOM 846 OE2 GLU A 60 -13.184 2.789 -8.458 1.00 0.00 O ATOM 0 H GLU A 60 -9.579 1.484 -5.732 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.336 2.742 -3.719 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.359 1.118 -6.067 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.305 1.949 -4.848 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.495 4.139 -5.640 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.404 3.366 -6.772 1.00 0.00 H new ATOM 853 N ILE A 61 -12.098 0.325 -2.965 1.00 0.00 N ATOM 854 CA ILE A 61 -12.134 -0.924 -2.224 1.00 0.00 C ATOM 855 C ILE A 61 -12.085 -2.096 -3.207 1.00 0.00 C ATOM 856 O ILE A 61 -12.800 -2.102 -4.208 1.00 0.00 O ATOM 857 CB ILE A 61 -13.344 -0.957 -1.288 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.323 0.230 -0.323 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.430 -2.295 -0.550 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.686 0.418 0.345 1.00 0.00 C ATOM 0 H ILE A 61 -12.906 0.931 -2.820 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.259 -1.010 -1.580 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.246 -0.864 -1.892 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.560 0.070 0.439 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -13.050 1.137 -0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.299 -2.292 0.109 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.526 -3.104 -1.274 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.527 -2.443 0.042 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.643 1.268 1.026 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.443 0.601 -0.418 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -14.945 -0.482 0.904 1.00 0.00 H new ATOM 872 N GLY A 62 -11.235 -3.060 -2.886 1.00 0.00 N ATOM 873 CA GLY A 62 -11.083 -4.235 -3.728 1.00 0.00 C ATOM 874 C GLY A 62 -9.686 -4.288 -4.350 1.00 0.00 C ATOM 875 O GLY A 62 -9.129 -5.367 -4.543 1.00 0.00 O ATOM 0 H GLY A 62 -10.644 -3.052 -2.055 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.256 -5.135 -3.137 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.836 -4.221 -4.516 1.00 0.00 H new ATOM 879 N ASP A 63 -9.160 -3.108 -4.645 1.00 0.00 N ATOM 880 CA ASP A 63 -7.838 -3.006 -5.240 1.00 0.00 C ATOM 881 C ASP A 63 -6.822 -3.710 -4.338 1.00 0.00 C ATOM 882 O ASP A 63 -6.343 -3.129 -3.365 1.00 0.00 O ATOM 883 CB ASP A 63 -7.410 -1.544 -5.384 1.00 0.00 C ATOM 884 CG ASP A 63 -8.208 -0.734 -6.407 1.00 0.00 C ATOM 885 OD1 ASP A 63 -8.518 -1.312 -7.471 1.00 0.00 O ATOM 886 OD2 ASP A 63 -8.491 0.444 -6.102 1.00 0.00 O ATOM 0 H ASP A 63 -9.625 -2.215 -4.483 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.875 -3.469 -6.226 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.496 -1.059 -4.412 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.357 -1.515 -5.662 1.00 0.00 H new ATOM 891 N GLN A 64 -6.523 -4.951 -4.694 1.00 0.00 N ATOM 892 CA GLN A 64 -5.572 -5.740 -3.929 1.00 0.00 C ATOM 893 C GLN A 64 -4.141 -5.411 -4.359 1.00 0.00 C ATOM 894 O GLN A 64 -3.849 -5.341 -5.552 1.00 0.00 O ATOM 895 CB GLN A 64 -5.858 -7.236 -4.075 1.00 0.00 C ATOM 896 CG GLN A 64 -4.801 -8.070 -3.348 1.00 0.00 C ATOM 897 CD GLN A 64 -4.885 -9.541 -3.761 1.00 0.00 C ATOM 898 OE1 GLN A 64 -5.811 -9.974 -4.427 1.00 0.00 O ATOM 899 NE2 GLN A 64 -3.868 -10.282 -3.330 1.00 0.00 N ATOM 0 H GLN A 64 -6.922 -5.429 -5.502 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.682 -5.483 -2.875 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.845 -7.462 -3.672 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.876 -7.505 -5.131 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.808 -7.681 -3.573 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.941 -7.982 -2.271 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.125 -9.856 -2.776 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.831 -11.277 -3.553 1.00 0.00 H new ATOM 908 N ILE A 65 -3.288 -5.217 -3.364 1.00 0.00 N ATOM 909 CA ILE A 65 -1.895 -4.896 -3.625 1.00 0.00 C ATOM 910 C ILE A 65 -1.098 -6.193 -3.775 1.00 0.00 C ATOM 911 O ILE A 65 -0.895 -6.918 -2.802 1.00 0.00 O ATOM 912 CB ILE A 65 -1.349 -3.960 -2.544 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.279 -2.763 -2.336 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.082 -3.526 -2.867 1.00 0.00 C ATOM 915 CD1 ILE A 65 -2.158 -2.216 -0.912 1.00 0.00 C ATOM 0 H ILE A 65 -3.534 -5.276 -2.376 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.799 -4.351 -4.564 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.314 -4.508 -1.602 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.034 -1.979 -3.053 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.310 -3.061 -2.529 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.446 -2.862 -2.083 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.724 -4.405 -2.925 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.096 -3.002 -3.823 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.829 -1.366 -0.791 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.427 -2.995 -0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.132 -1.897 -0.731 1.00 0.00 H new ATOM 927 N VAL A 66 -0.667 -6.447 -5.002 1.00 0.00 N ATOM 928 CA VAL A 66 0.104 -7.644 -5.292 1.00 0.00 C ATOM 929 C VAL A 66 1.590 -7.286 -5.351 1.00 0.00 C ATOM 930 O VAL A 66 2.448 -8.150 -5.176 1.00 0.00 O ATOM 931 CB VAL A 66 -0.405 -8.295 -6.580 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.905 -8.583 -6.492 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.084 -7.426 -7.798 1.00 0.00 C ATOM 0 H VAL A 66 -0.837 -5.844 -5.807 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.022 -8.381 -4.499 1.00 0.00 H new ATOM 0 HB VAL A 66 0.113 -9.246 -6.702 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.242 -9.045 -7.420 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.097 -9.259 -5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.446 -7.650 -6.334 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.457 -7.912 -8.700 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.562 -6.453 -7.686 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.995 -7.294 -7.876 1.00 0.00 H new ATOM 943 N GLU A 67 1.850 -6.010 -5.597 1.00 0.00 N ATOM 944 CA GLU A 67 3.218 -5.528 -5.681 1.00 0.00 C ATOM 945 C GLU A 67 3.279 -4.040 -5.329 1.00 0.00 C ATOM 946 O GLU A 67 2.304 -3.314 -5.518 1.00 0.00 O ATOM 947 CB GLU A 67 3.807 -5.787 -7.069 1.00 0.00 C ATOM 948 CG GLU A 67 5.163 -5.096 -7.227 1.00 0.00 C ATOM 949 CD GLU A 67 5.687 -5.238 -8.658 1.00 0.00 C ATOM 950 OE1 GLU A 67 5.345 -4.357 -9.477 1.00 0.00 O ATOM 951 OE2 GLU A 67 6.417 -6.223 -8.900 1.00 0.00 O ATOM 0 H GLU A 67 1.136 -5.296 -5.741 1.00 0.00 H new ATOM 0 HA GLU A 67 3.821 -6.078 -4.958 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.921 -6.860 -7.225 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.119 -5.425 -7.833 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.069 -4.040 -6.973 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.879 -5.529 -6.529 1.00 0.00 H new ATOM 958 N VAL A 68 4.433 -3.631 -4.824 1.00 0.00 N ATOM 959 CA VAL A 68 4.633 -2.243 -4.444 1.00 0.00 C ATOM 960 C VAL A 68 6.116 -1.889 -4.583 1.00 0.00 C ATOM 961 O VAL A 68 6.961 -2.466 -3.901 1.00 0.00 O ATOM 962 CB VAL A 68 4.091 -2.002 -3.034 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.360 -0.566 -2.580 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.598 -2.331 -2.958 1.00 0.00 C ATOM 0 H VAL A 68 5.239 -4.236 -4.669 1.00 0.00 H new ATOM 0 HA VAL A 68 4.077 -1.582 -5.108 1.00 0.00 H new ATOM 0 HB VAL A 68 4.617 -2.671 -2.354 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.964 -0.422 -1.575 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.434 -0.380 -2.577 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.873 0.129 -3.264 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.237 -2.151 -1.945 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.050 -1.698 -3.656 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.442 -3.378 -3.218 1.00 0.00 H new ATOM 974 N ASN A 69 6.385 -0.943 -5.470 1.00 0.00 N ATOM 975 CA ASN A 69 7.751 -0.506 -5.706 1.00 0.00 C ATOM 976 C ASN A 69 8.607 -1.712 -6.098 1.00 0.00 C ATOM 977 O ASN A 69 9.830 -1.675 -5.977 1.00 0.00 O ATOM 978 CB ASN A 69 8.357 0.114 -4.445 1.00 0.00 C ATOM 979 CG ASN A 69 8.925 1.504 -4.737 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.979 1.957 -5.869 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.345 2.155 -3.655 1.00 0.00 N ATOM 0 H ASN A 69 5.681 -0.467 -6.034 1.00 0.00 H new ATOM 0 HA ASN A 69 7.734 0.239 -6.502 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.596 0.184 -3.668 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.146 -0.532 -4.061 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.741 3.091 -3.744 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.271 1.718 -2.736 1.00 0.00 H new ATOM 988 N GLY A 70 7.930 -2.753 -6.561 1.00 0.00 N ATOM 989 CA GLY A 70 8.613 -3.967 -6.971 1.00 0.00 C ATOM 990 C GLY A 70 8.692 -4.969 -5.818 1.00 0.00 C ATOM 991 O GLY A 70 9.412 -5.963 -5.902 1.00 0.00 O ATOM 0 H GLY A 70 6.915 -2.780 -6.661 1.00 0.00 H new ATOM 0 HA2 GLY A 70 8.087 -4.417 -7.813 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.618 -3.724 -7.316 1.00 0.00 H new ATOM 995 N VAL A 71 7.941 -4.673 -4.767 1.00 0.00 N ATOM 996 CA VAL A 71 7.916 -5.535 -3.598 1.00 0.00 C ATOM 997 C VAL A 71 6.856 -6.621 -3.792 1.00 0.00 C ATOM 998 O VAL A 71 5.894 -6.428 -4.535 1.00 0.00 O ATOM 999 CB VAL A 71 7.692 -4.700 -2.336 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.713 -5.580 -1.085 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.724 -3.575 -2.232 1.00 0.00 C ATOM 0 H VAL A 71 7.345 -3.848 -4.701 1.00 0.00 H new ATOM 0 HA VAL A 71 8.876 -6.036 -3.474 1.00 0.00 H new ATOM 0 HB VAL A 71 6.705 -4.243 -2.408 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.551 -4.961 -0.202 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.923 -6.328 -1.153 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.679 -6.078 -1.007 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.542 -2.997 -1.326 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.726 -4.003 -2.194 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.640 -2.923 -3.101 1.00 0.00 H new ATOM 1011 N ASP A 72 7.067 -7.738 -3.112 1.00 0.00 N ATOM 1012 CA ASP A 72 6.141 -8.855 -3.201 1.00 0.00 C ATOM 1013 C ASP A 72 5.066 -8.707 -2.122 1.00 0.00 C ATOM 1014 O ASP A 72 5.237 -9.182 -1.001 1.00 0.00 O ATOM 1015 CB ASP A 72 6.860 -10.186 -2.973 1.00 0.00 C ATOM 1016 CG ASP A 72 6.657 -11.227 -4.075 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.883 -10.923 -5.008 1.00 0.00 O ATOM 1018 OD2 ASP A 72 7.281 -12.305 -3.959 1.00 0.00 O ATOM 0 H ASP A 72 7.866 -7.894 -2.497 1.00 0.00 H new ATOM 0 HA ASP A 72 5.700 -8.850 -4.198 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.928 -9.992 -2.869 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.520 -10.608 -2.028 1.00 0.00 H new ATOM 1023 N PHE A 73 3.981 -8.046 -2.500 1.00 0.00 N ATOM 1024 CA PHE A 73 2.879 -7.830 -1.579 1.00 0.00 C ATOM 1025 C PHE A 73 1.807 -8.910 -1.743 1.00 0.00 C ATOM 1026 O PHE A 73 0.702 -8.778 -1.219 1.00 0.00 O ATOM 1027 CB PHE A 73 2.270 -6.468 -1.921 1.00 0.00 C ATOM 1028 CG PHE A 73 2.860 -5.304 -1.122 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.195 -5.054 -1.170 1.00 0.00 C ATOM 1030 CD2 PHE A 73 2.048 -4.521 -0.363 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.742 -3.974 -0.428 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.595 -3.441 0.379 1.00 0.00 C ATOM 1033 CZ PHE A 73 3.931 -3.190 0.331 1.00 0.00 C ATOM 0 H PHE A 73 3.842 -7.653 -3.431 1.00 0.00 H new ATOM 0 HA PHE A 73 3.241 -7.868 -0.551 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.412 -6.275 -2.984 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.195 -6.508 -1.745 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.840 -5.677 -1.772 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.987 -4.720 -0.324 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.803 -3.775 -0.467 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.950 -2.819 0.982 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.347 -2.369 0.895 1.00 0.00 H new ATOM 1043 N SER A 74 2.172 -9.953 -2.473 1.00 0.00 N ATOM 1044 CA SER A 74 1.256 -11.055 -2.713 1.00 0.00 C ATOM 1045 C SER A 74 1.106 -11.897 -1.444 1.00 0.00 C ATOM 1046 O SER A 74 0.088 -12.561 -1.252 1.00 0.00 O ATOM 1047 CB SER A 74 1.735 -11.927 -3.875 1.00 0.00 C ATOM 1048 OG SER A 74 2.879 -11.375 -4.520 1.00 0.00 O ATOM 0 H SER A 74 3.089 -10.059 -2.906 1.00 0.00 H new ATOM 0 HA SER A 74 0.285 -10.640 -2.983 1.00 0.00 H new ATOM 0 HB2 SER A 74 1.973 -12.924 -3.506 1.00 0.00 H new ATOM 0 HB3 SER A 74 0.929 -12.040 -4.600 1.00 0.00 H new ATOM 0 HG SER A 74 3.155 -11.962 -5.255 1.00 0.00 H new ATOM 1054 N ASN A 75 2.135 -11.843 -0.612 1.00 0.00 N ATOM 1055 CA ASN A 75 2.131 -12.592 0.633 1.00 0.00 C ATOM 1056 C ASN A 75 2.796 -11.756 1.729 1.00 0.00 C ATOM 1057 O ASN A 75 3.693 -12.234 2.421 1.00 0.00 O ATOM 1058 CB ASN A 75 2.916 -13.898 0.493 1.00 0.00 C ATOM 1059 CG ASN A 75 2.437 -14.698 -0.720 1.00 0.00 C ATOM 1060 OD1 ASN A 75 1.288 -15.097 -0.818 1.00 0.00 O ATOM 1061 ND2 ASN A 75 3.378 -14.910 -1.635 1.00 0.00 N ATOM 0 H ASN A 75 2.978 -11.292 -0.775 1.00 0.00 H new ATOM 0 HA ASN A 75 1.095 -12.819 0.886 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.979 -13.679 0.392 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.799 -14.496 1.397 1.00 0.00 H new ATOM 0 HD21 ASN A 75 3.157 -15.435 -2.481 1.00 0.00 H new ATOM 0 HD22 ASN A 75 4.321 -14.548 -1.491 1.00 0.00 H new ATOM 1068 N LEU A 76 2.330 -10.522 1.852 1.00 0.00 N ATOM 1069 CA LEU A 76 2.868 -9.615 2.852 1.00 0.00 C ATOM 1070 C LEU A 76 2.005 -9.683 4.113 1.00 0.00 C ATOM 1071 O LEU A 76 1.186 -10.588 4.261 1.00 0.00 O ATOM 1072 CB LEU A 76 3.006 -8.204 2.276 1.00 0.00 C ATOM 1073 CG LEU A 76 4.412 -7.796 1.831 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.452 -6.322 1.425 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.445 -8.121 2.912 1.00 0.00 C ATOM 0 H LEU A 76 1.586 -10.129 1.276 1.00 0.00 H new ATOM 0 HA LEU A 76 3.875 -9.917 3.138 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.336 -8.115 1.421 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.663 -7.492 3.026 1.00 0.00 H new ATOM 0 HG LEU A 76 4.674 -8.380 0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.462 -6.058 1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.761 -6.153 0.599 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.161 -5.703 2.273 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.436 -7.821 2.570 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.197 -7.581 3.826 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.439 -9.193 3.111 1.00 0.00 H new ATOM 1087 N ASP A 77 2.218 -8.714 4.990 1.00 0.00 N ATOM 1088 CA ASP A 77 1.470 -8.652 6.234 1.00 0.00 C ATOM 1089 C ASP A 77 0.942 -7.230 6.437 1.00 0.00 C ATOM 1090 O ASP A 77 1.317 -6.315 5.706 1.00 0.00 O ATOM 1091 CB ASP A 77 2.359 -9.001 7.430 1.00 0.00 C ATOM 1092 CG ASP A 77 1.633 -9.079 8.774 1.00 0.00 C ATOM 1093 OD1 ASP A 77 1.110 -10.175 9.074 1.00 0.00 O ATOM 1094 OD2 ASP A 77 1.617 -8.043 9.472 1.00 0.00 O ATOM 0 H ASP A 77 2.898 -7.965 4.864 1.00 0.00 H new ATOM 0 HA ASP A 77 0.652 -9.370 6.171 1.00 0.00 H new ATOM 0 HB2 ASP A 77 2.841 -9.960 7.238 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.151 -8.256 7.505 1.00 0.00 H new ATOM 1099 N HIS A 78 0.080 -7.090 7.433 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.503 -5.795 7.741 1.00 0.00 C ATOM 1101 C HIS A 78 0.557 -4.892 8.375 1.00 0.00 C ATOM 1102 O HIS A 78 0.315 -3.708 8.601 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.747 -5.954 8.618 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.516 -4.672 8.831 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -2.158 -3.732 9.782 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.626 -4.184 8.206 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -3.022 -2.729 9.723 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.931 -3.011 8.746 1.00 0.00 N ATOM 0 H HIS A 78 -0.229 -7.852 8.037 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.836 -5.315 6.821 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.408 -6.691 8.162 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.447 -6.351 9.588 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.165 -4.670 7.407 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -3.009 -1.843 10.341 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -4.716 -2.418 8.475 1.00 0.00 H new ATOM 1116 N LYS A 79 1.710 -5.487 8.644 1.00 0.00 N ATOM 1117 CA LYS A 79 2.809 -4.751 9.248 1.00 0.00 C ATOM 1118 C LYS A 79 3.906 -4.534 8.204 1.00 0.00 C ATOM 1119 O LYS A 79 4.557 -3.491 8.191 1.00 0.00 O ATOM 1120 CB LYS A 79 3.296 -5.459 10.514 1.00 0.00 C ATOM 1121 CG LYS A 79 2.143 -5.685 11.494 1.00 0.00 C ATOM 1122 CD LYS A 79 2.386 -4.938 12.807 1.00 0.00 C ATOM 1123 CE LYS A 79 2.032 -5.815 14.010 1.00 0.00 C ATOM 1124 NZ LYS A 79 2.289 -5.089 15.274 1.00 0.00 N ATOM 0 H LYS A 79 1.907 -6.470 8.455 1.00 0.00 H new ATOM 0 HA LYS A 79 2.476 -3.765 9.571 1.00 0.00 H new ATOM 0 HB2 LYS A 79 3.746 -6.416 10.250 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.073 -4.863 10.992 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.209 -5.346 11.046 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.033 -6.751 11.693 1.00 0.00 H new ATOM 0 HD2 LYS A 79 3.431 -4.634 12.869 1.00 0.00 H new ATOM 0 HD3 LYS A 79 1.788 -4.027 12.828 1.00 0.00 H new ATOM 0 HE2 LYS A 79 0.983 -6.107 13.958 1.00 0.00 H new ATOM 0 HE3 LYS A 79 2.620 -6.732 13.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.044 -5.698 16.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.295 -4.832 15.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 1.709 -4.226 15.303 1.00 0.00 H new ATOM 1138 N GLU A 80 4.076 -5.536 7.354 1.00 0.00 N ATOM 1139 CA GLU A 80 5.083 -5.467 6.308 1.00 0.00 C ATOM 1140 C GLU A 80 4.573 -4.628 5.135 1.00 0.00 C ATOM 1141 O GLU A 80 5.331 -3.866 4.536 1.00 0.00 O ATOM 1142 CB GLU A 80 5.489 -6.867 5.845 1.00 0.00 C ATOM 1143 CG GLU A 80 6.100 -7.670 6.996 1.00 0.00 C ATOM 1144 CD GLU A 80 7.626 -7.696 6.897 1.00 0.00 C ATOM 1145 OE1 GLU A 80 8.248 -6.772 7.465 1.00 0.00 O ATOM 1146 OE2 GLU A 80 8.137 -8.639 6.254 1.00 0.00 O ATOM 0 H GLU A 80 3.534 -6.400 7.368 1.00 0.00 H new ATOM 0 HA GLU A 80 5.971 -4.984 6.716 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.617 -7.391 5.454 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.208 -6.790 5.029 1.00 0.00 H new ATOM 0 HG2 GLU A 80 5.801 -7.232 7.948 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.713 -8.689 6.979 1.00 0.00 H new ATOM 1153 N ALA A 81 3.292 -4.796 4.841 1.00 0.00 N ATOM 1154 CA ALA A 81 2.673 -4.063 3.750 1.00 0.00 C ATOM 1155 C ALA A 81 2.553 -2.588 4.135 1.00 0.00 C ATOM 1156 O ALA A 81 2.504 -1.718 3.266 1.00 0.00 O ATOM 1157 CB ALA A 81 1.317 -4.691 3.418 1.00 0.00 C ATOM 0 H ALA A 81 2.666 -5.429 5.339 1.00 0.00 H new ATOM 0 HA ALA A 81 3.288 -4.120 2.852 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.852 -4.141 2.600 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.460 -5.730 3.122 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.672 -4.649 4.296 1.00 0.00 H new ATOM 1163 N VAL A 82 2.510 -2.350 5.437 1.00 0.00 N ATOM 1164 CA VAL A 82 2.397 -0.995 5.948 1.00 0.00 C ATOM 1165 C VAL A 82 3.794 -0.383 6.072 1.00 0.00 C ATOM 1166 O VAL A 82 3.991 0.791 5.762 1.00 0.00 O ATOM 1167 CB VAL A 82 1.626 -0.996 7.270 1.00 0.00 C ATOM 1168 CG1 VAL A 82 1.829 0.320 8.024 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.139 -1.270 7.036 1.00 0.00 C ATOM 0 H VAL A 82 2.551 -3.074 6.155 1.00 0.00 H new ATOM 0 HA VAL A 82 1.829 -0.373 5.256 1.00 0.00 H new ATOM 0 HB VAL A 82 2.022 -1.801 7.889 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.271 0.293 8.960 1.00 0.00 H new ATOM 0 HG12 VAL A 82 2.889 0.457 8.238 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.472 1.149 7.412 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.386 -1.265 7.991 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -0.276 -0.497 6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.019 -2.243 6.560 1.00 0.00 H new ATOM 1179 N ASN A 83 4.728 -1.206 6.524 1.00 0.00 N ATOM 1180 CA ASN A 83 6.100 -0.761 6.693 1.00 0.00 C ATOM 1181 C ASN A 83 6.691 -0.416 5.324 1.00 0.00 C ATOM 1182 O ASN A 83 7.363 0.604 5.174 1.00 0.00 O ATOM 1183 CB ASN A 83 6.963 -1.860 7.317 1.00 0.00 C ATOM 1184 CG ASN A 83 8.404 -1.382 7.509 1.00 0.00 C ATOM 1185 OD1 ASN A 83 8.743 -0.725 8.480 1.00 0.00 O ATOM 1186 ND2 ASN A 83 9.230 -1.748 6.533 1.00 0.00 N ATOM 0 H ASN A 83 4.561 -2.180 6.779 1.00 0.00 H new ATOM 0 HA ASN A 83 6.094 0.109 7.350 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.543 -2.156 8.278 1.00 0.00 H new ATOM 0 HB3 ASN A 83 6.951 -2.743 6.679 1.00 0.00 H new ATOM 0 HD21 ASN A 83 10.213 -1.479 6.569 1.00 0.00 H new ATOM 0 HD22 ASN A 83 8.880 -2.298 5.748 1.00 0.00 H new ATOM 1193 N VAL A 84 6.420 -1.285 4.362 1.00 0.00 N ATOM 1194 CA VAL A 84 6.916 -1.084 3.011 1.00 0.00 C ATOM 1195 C VAL A 84 6.169 0.084 2.366 1.00 0.00 C ATOM 1196 O VAL A 84 6.705 0.761 1.489 1.00 0.00 O ATOM 1197 CB VAL A 84 6.798 -2.384 2.212 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.145 -2.155 0.739 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.674 -3.482 2.818 1.00 0.00 C ATOM 0 H VAL A 84 5.863 -2.130 4.491 1.00 0.00 H new ATOM 0 HA VAL A 84 7.974 -0.823 3.028 1.00 0.00 H new ATOM 0 HB VAL A 84 5.761 -2.717 2.264 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.053 -3.094 0.193 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.461 -1.420 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.168 -1.787 0.659 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.571 -4.395 2.231 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.716 -3.161 2.811 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.360 -3.673 3.844 1.00 0.00 H new ATOM 1209 N LEU A 85 4.942 0.287 2.824 1.00 0.00 N ATOM 1210 CA LEU A 85 4.116 1.362 2.303 1.00 0.00 C ATOM 1211 C LEU A 85 4.513 2.677 2.977 1.00 0.00 C ATOM 1212 O LEU A 85 4.519 3.729 2.338 1.00 0.00 O ATOM 1213 CB LEU A 85 2.632 1.018 2.452 1.00 0.00 C ATOM 1214 CG LEU A 85 2.022 0.180 1.326 1.00 0.00 C ATOM 1215 CD1 LEU A 85 0.582 -0.217 1.657 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.122 0.909 -0.016 1.00 0.00 C ATOM 0 H LEU A 85 4.500 -0.276 3.551 1.00 0.00 H new ATOM 0 HA LEU A 85 4.285 1.488 1.233 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.496 0.482 3.391 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.070 1.948 2.531 1.00 0.00 H new ATOM 0 HG LEU A 85 2.597 -0.741 1.235 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.172 -0.812 0.841 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.568 -0.803 2.576 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.021 0.681 1.791 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.681 0.292 -0.799 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.586 1.856 0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.170 1.099 -0.250 1.00 0.00 H new ATOM 1228 N LYS A 86 4.835 2.575 4.258 1.00 0.00 N ATOM 1229 CA LYS A 86 5.232 3.743 5.025 1.00 0.00 C ATOM 1230 C LYS A 86 6.747 3.928 4.916 1.00 0.00 C ATOM 1231 O LYS A 86 7.301 4.876 5.471 1.00 0.00 O ATOM 1232 CB LYS A 86 4.727 3.636 6.465 1.00 0.00 C ATOM 1233 CG LYS A 86 5.740 2.903 7.348 1.00 0.00 C ATOM 1234 CD LYS A 86 5.033 2.018 8.376 1.00 0.00 C ATOM 1235 CE LYS A 86 4.269 2.865 9.396 1.00 0.00 C ATOM 1236 NZ LYS A 86 4.984 2.885 10.692 1.00 0.00 N ATOM 0 H LYS A 86 4.829 1.701 4.784 1.00 0.00 H new ATOM 0 HA LYS A 86 4.770 4.642 4.617 1.00 0.00 H new ATOM 0 HB2 LYS A 86 4.545 4.633 6.865 1.00 0.00 H new ATOM 0 HB3 LYS A 86 3.774 3.107 6.482 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.395 2.292 6.726 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.372 3.628 7.861 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.343 1.344 7.868 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.765 1.396 8.890 1.00 0.00 H new ATOM 0 HE2 LYS A 86 4.155 3.882 9.021 1.00 0.00 H new ATOM 0 HE3 LYS A 86 3.266 2.462 9.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 4.452 3.464 11.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.070 1.915 11.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 5.932 3.291 10.559 1.00 0.00 H new ATOM 1250 N SER A 87 7.373 3.008 4.198 1.00 0.00 N ATOM 1251 CA SER A 87 8.813 3.058 4.010 1.00 0.00 C ATOM 1252 C SER A 87 9.207 4.372 3.331 1.00 0.00 C ATOM 1253 O SER A 87 9.884 5.206 3.931 1.00 0.00 O ATOM 1254 CB SER A 87 9.302 1.867 3.183 1.00 0.00 C ATOM 1255 OG SER A 87 10.534 1.345 3.676 1.00 0.00 O ATOM 0 H SER A 87 6.910 2.224 3.739 1.00 0.00 H new ATOM 0 HA SER A 87 9.288 3.006 4.990 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.545 1.083 3.194 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.428 2.174 2.145 1.00 0.00 H new ATOM 0 HG SER A 87 10.812 0.585 3.123 1.00 0.00 H new ATOM 1261 N SER A 88 8.766 4.515 2.090 1.00 0.00 N ATOM 1262 CA SER A 88 9.064 5.714 1.324 1.00 0.00 C ATOM 1263 C SER A 88 7.765 6.421 0.932 1.00 0.00 C ATOM 1264 O SER A 88 6.677 5.887 1.141 1.00 0.00 O ATOM 1265 CB SER A 88 9.884 5.380 0.076 1.00 0.00 C ATOM 1266 OG SER A 88 10.841 6.393 -0.221 1.00 0.00 O ATOM 0 H SER A 88 8.205 3.821 1.596 1.00 0.00 H new ATOM 0 HA SER A 88 9.658 6.380 1.949 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.396 4.429 0.223 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.214 5.253 -0.775 1.00 0.00 H new ATOM 0 HG SER A 88 11.345 6.142 -1.023 1.00 0.00 H new ATOM 1272 N ARG A 89 7.923 7.611 0.371 1.00 0.00 N ATOM 1273 CA ARG A 89 6.776 8.396 -0.052 1.00 0.00 C ATOM 1274 C ARG A 89 6.283 7.921 -1.420 1.00 0.00 C ATOM 1275 O ARG A 89 5.140 7.487 -1.556 1.00 0.00 O ATOM 1276 CB ARG A 89 7.126 9.883 -0.132 1.00 0.00 C ATOM 1277 CG ARG A 89 7.648 10.397 1.212 1.00 0.00 C ATOM 1278 CD ARG A 89 6.514 10.513 2.232 1.00 0.00 C ATOM 1279 NE ARG A 89 7.069 10.560 3.603 1.00 0.00 N ATOM 1280 CZ ARG A 89 6.429 11.089 4.655 1.00 0.00 C ATOM 1281 NH1 ARG A 89 5.208 11.618 4.500 1.00 0.00 N ATOM 1282 NH2 ARG A 89 7.010 11.088 5.863 1.00 0.00 N ATOM 0 H ARG A 89 8.827 8.050 0.200 1.00 0.00 H new ATOM 0 HA ARG A 89 5.989 8.259 0.689 1.00 0.00 H new ATOM 0 HB2 ARG A 89 7.879 10.042 -0.904 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.244 10.453 -0.425 1.00 0.00 H new ATOM 0 HG2 ARG A 89 8.415 9.721 1.591 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.120 11.370 1.075 1.00 0.00 H new ATOM 0 HD2 ARG A 89 5.929 11.412 2.037 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.837 9.664 2.134 1.00 0.00 H new ATOM 0 HE ARG A 89 7.997 10.165 3.757 1.00 0.00 H new ATOM 0 HH11 ARG A 89 4.765 11.618 3.581 1.00 0.00 H new ATOM 0 HH12 ARG A 89 4.721 12.021 5.301 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.939 10.685 5.982 1.00 0.00 H new ATOM 0 HH22 ARG A 89 6.523 11.491 6.664 1.00 0.00 H new ATOM 1296 N SER A 90 7.169 8.020 -2.400 1.00 0.00 N ATOM 1297 CA SER A 90 6.838 7.605 -3.753 1.00 0.00 C ATOM 1298 C SER A 90 7.022 6.093 -3.897 1.00 0.00 C ATOM 1299 O SER A 90 8.137 5.586 -3.788 1.00 0.00 O ATOM 1300 CB SER A 90 7.698 8.344 -4.781 1.00 0.00 C ATOM 1301 OG SER A 90 8.018 9.667 -4.357 1.00 0.00 O ATOM 0 H SER A 90 8.116 8.381 -2.284 1.00 0.00 H new ATOM 0 HA SER A 90 5.795 7.857 -3.942 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.618 7.786 -4.952 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.169 8.386 -5.733 1.00 0.00 H new ATOM 0 HG SER A 90 8.569 10.105 -5.039 1.00 0.00 H new ATOM 1307 N LEU A 91 5.909 5.415 -4.139 1.00 0.00 N ATOM 1308 CA LEU A 91 5.933 3.971 -4.299 1.00 0.00 C ATOM 1309 C LEU A 91 5.007 3.574 -5.450 1.00 0.00 C ATOM 1310 O LEU A 91 3.968 4.199 -5.659 1.00 0.00 O ATOM 1311 CB LEU A 91 5.600 3.280 -2.975 1.00 0.00 C ATOM 1312 CG LEU A 91 6.461 3.678 -1.775 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.591 3.997 -0.558 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.505 2.602 -1.468 1.00 0.00 C ATOM 0 H LEU A 91 4.986 5.839 -4.228 1.00 0.00 H new ATOM 0 HA LEU A 91 6.935 3.634 -4.565 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.557 3.486 -2.733 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.687 2.203 -3.118 1.00 0.00 H new ATOM 0 HG LEU A 91 7.003 4.588 -2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.228 4.277 0.281 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.921 4.823 -0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.004 3.119 -0.290 1.00 0.00 H new ATOM 0 HD21 LEU A 91 8.104 2.910 -0.611 1.00 0.00 H new ATOM 0 HD22 LEU A 91 7.003 1.662 -1.241 1.00 0.00 H new ATOM 0 HD23 LEU A 91 8.154 2.467 -2.334 1.00 0.00 H new ATOM 1326 N THR A 92 5.417 2.538 -6.167 1.00 0.00 N ATOM 1327 CA THR A 92 4.637 2.051 -7.292 1.00 0.00 C ATOM 1328 C THR A 92 3.851 0.800 -6.894 1.00 0.00 C ATOM 1329 O THR A 92 4.406 -0.296 -6.840 1.00 0.00 O ATOM 1330 CB THR A 92 5.592 1.821 -8.465 1.00 0.00 C ATOM 1331 OG1 THR A 92 6.024 3.130 -8.823 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.871 1.311 -9.715 1.00 0.00 C ATOM 0 H THR A 92 6.279 2.022 -5.991 1.00 0.00 H new ATOM 0 HA THR A 92 3.890 2.782 -7.601 1.00 0.00 H new ATOM 0 HB THR A 92 6.361 1.106 -8.172 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.267 3.750 -8.771 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.594 1.164 -10.518 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.380 0.364 -9.491 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.125 2.041 -10.028 1.00 0.00 H new ATOM 1340 N ILE A 93 2.570 1.006 -6.624 1.00 0.00 N ATOM 1341 CA ILE A 93 1.702 -0.091 -6.233 1.00 0.00 C ATOM 1342 C ILE A 93 1.079 -0.715 -7.483 1.00 0.00 C ATOM 1343 O ILE A 93 0.615 -0.001 -8.372 1.00 0.00 O ATOM 1344 CB ILE A 93 0.673 0.381 -5.203 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.359 1.034 -4.002 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.248 -0.766 -4.783 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.468 2.111 -3.380 1.00 0.00 C ATOM 0 H ILE A 93 2.113 1.917 -6.668 1.00 0.00 H new ATOM 0 HA ILE A 93 2.278 -0.874 -5.739 1.00 0.00 H new ATOM 0 HB ILE A 93 0.047 1.142 -5.669 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.593 0.275 -3.256 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.305 1.476 -4.315 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -0.970 -0.404 -4.051 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.777 -1.146 -5.657 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.346 -1.567 -4.342 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.980 2.559 -2.528 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.256 2.881 -4.122 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.467 1.661 -3.046 1.00 0.00 H new ATOM 1359 N SER A 94 1.088 -2.039 -7.513 1.00 0.00 N ATOM 1360 CA SER A 94 0.530 -2.767 -8.640 1.00 0.00 C ATOM 1361 C SER A 94 -0.705 -3.553 -8.196 1.00 0.00 C ATOM 1362 O SER A 94 -0.584 -4.637 -7.627 1.00 0.00 O ATOM 1363 CB SER A 94 1.566 -3.710 -9.255 1.00 0.00 C ATOM 1364 OG SER A 94 1.928 -3.317 -10.576 1.00 0.00 O ATOM 0 H SER A 94 1.473 -2.627 -6.774 1.00 0.00 H new ATOM 0 HA SER A 94 0.239 -2.045 -9.402 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.456 -3.730 -8.626 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.167 -4.724 -9.275 1.00 0.00 H new ATOM 0 HG SER A 94 2.592 -3.943 -10.933 1.00 0.00 H new ATOM 1370 N ILE A 95 -1.865 -2.975 -8.471 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.122 -3.608 -8.107 1.00 0.00 C ATOM 1372 C ILE A 95 -3.721 -4.288 -9.340 1.00 0.00 C ATOM 1373 O ILE A 95 -3.246 -4.088 -10.456 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.059 -2.596 -7.446 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.233 -1.355 -8.323 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.577 -2.241 -6.038 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -5.709 -0.974 -8.449 1.00 0.00 C ATOM 0 H ILE A 95 -1.961 -2.075 -8.942 1.00 0.00 H new ATOM 0 HA ILE A 95 -2.956 -4.387 -7.363 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.041 -3.057 -7.343 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.674 -0.522 -7.896 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -3.817 -1.544 -9.313 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.261 -1.520 -5.590 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.548 -3.142 -5.425 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.578 -1.808 -6.094 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.804 -0.089 -9.078 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.261 -1.799 -8.899 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.116 -0.762 -7.460 1.00 0.00 H new ATOM 1389 N VAL A 96 -4.757 -5.078 -9.095 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.426 -5.788 -10.171 1.00 0.00 C ATOM 1391 C VAL A 96 -6.811 -5.178 -10.395 1.00 0.00 C ATOM 1392 O VAL A 96 -7.752 -5.882 -10.761 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.476 -7.285 -9.859 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.297 -8.038 -10.908 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -4.066 -7.868 -9.743 1.00 0.00 C ATOM 0 H VAL A 96 -5.149 -5.241 -8.167 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.869 -5.682 -11.102 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.970 -7.410 -8.896 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.316 -9.100 -10.662 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.316 -7.650 -10.920 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.845 -7.901 -11.890 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.130 -8.933 -9.521 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.535 -7.725 -10.684 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.528 -7.362 -8.942 1.00 0.00 H new ATOM 1405 N ALA A 97 -6.893 -3.876 -10.167 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.147 -3.163 -10.339 1.00 0.00 C ATOM 1407 C ALA A 97 -9.279 -3.968 -9.697 1.00 0.00 C ATOM 1408 O ALA A 97 -9.855 -4.850 -10.332 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.387 -2.904 -11.828 1.00 0.00 C ATOM 0 H ALA A 97 -6.111 -3.296 -9.864 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.109 -2.194 -9.842 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.328 -2.369 -11.957 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.570 -2.304 -12.229 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.434 -3.854 -12.360 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.563 -3.636 -8.447 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.616 -4.317 -7.712 1.00 0.00 C ATOM 1417 C ALA A 98 -10.426 -5.830 -7.842 1.00 0.00 C ATOM 1418 O ALA A 98 -11.325 -6.535 -8.295 1.00 0.00 O ATOM 1419 CB ALA A 98 -11.980 -3.855 -8.228 1.00 0.00 C ATOM 0 H ALA A 98 -9.082 -2.904 -7.924 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.567 -4.068 -6.652 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -12.770 -4.366 -7.677 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.077 -2.779 -8.087 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.067 -4.091 -9.289 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.248 -6.283 -7.437 1.00 0.00 N ATOM 1426 CA ALA A 99 -8.928 -7.698 -7.502 1.00 0.00 C ATOM 1427 C ALA A 99 -9.921 -8.482 -6.641 1.00 0.00 C ATOM 1428 O ALA A 99 -10.761 -9.212 -7.164 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.479 -7.915 -7.064 1.00 0.00 C ATOM 0 H ALA A 99 -8.504 -5.694 -7.063 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.018 -8.064 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.239 -8.977 -7.113 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.812 -7.362 -7.725 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.351 -7.561 -6.041 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.792 -8.302 -5.334 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.668 -8.983 -4.396 1.00 0.00 C ATOM 1437 C GLY A 100 -11.760 -8.042 -3.884 1.00 0.00 C ATOM 1438 O GLY A 100 -11.883 -7.825 -2.679 1.00 0.00 O ATOM 0 H GLY A 100 -9.095 -7.695 -4.903 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.124 -9.846 -4.880 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.085 -9.360 -3.556 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.526 -7.509 -4.824 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.604 -6.596 -4.483 1.00 0.00 C ATOM 1444 C ARG A 101 -14.735 -7.350 -3.781 1.00 0.00 C ATOM 1445 O ARG A 101 -15.495 -6.761 -3.013 1.00 0.00 O ATOM 1446 CB ARG A 101 -14.158 -5.907 -5.732 1.00 0.00 C ATOM 1447 CG ARG A 101 -13.992 -4.389 -5.641 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.153 -3.668 -6.328 1.00 0.00 C ATOM 1449 NE ARG A 101 -14.682 -2.390 -6.909 1.00 0.00 N ATOM 1450 CZ ARG A 101 -15.429 -1.601 -7.692 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -16.687 -1.953 -7.994 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -14.919 -0.459 -8.174 1.00 0.00 N ATOM 0 H ARG A 101 -12.422 -7.692 -5.822 1.00 0.00 H new ATOM 0 HA ARG A 101 -13.198 -5.838 -3.814 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -13.642 -6.280 -6.617 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -15.213 -6.154 -5.850 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -13.940 -4.087 -4.595 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -13.051 -4.094 -6.105 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -15.573 -4.300 -7.111 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -15.951 -3.478 -5.610 1.00 0.00 H new ATOM 0 HE ARG A 101 -13.729 -2.092 -6.700 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.075 -2.822 -7.627 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -17.256 -1.352 -8.590 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -13.962 -0.191 -7.944 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -15.488 0.142 -8.770 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.811 -8.641 -4.068 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.836 -9.481 -3.473 1.00 0.00 C ATOM 1468 C GLU A 102 -15.557 -9.685 -1.983 1.00 0.00 C ATOM 1469 O GLU A 102 -16.462 -10.012 -1.217 1.00 0.00 O ATOM 1470 CB GLU A 102 -15.936 -10.823 -4.201 1.00 0.00 C ATOM 1471 CG GLU A 102 -14.656 -11.641 -4.022 1.00 0.00 C ATOM 1472 CD GLU A 102 -14.089 -12.076 -5.374 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -13.325 -11.275 -5.954 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -14.434 -13.201 -5.799 1.00 0.00 O ATOM 0 H GLU A 102 -14.179 -9.126 -4.705 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.797 -8.976 -3.577 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -16.788 -11.386 -3.819 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -16.117 -10.652 -5.262 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.914 -11.049 -3.486 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.864 -12.520 -3.411 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.299 -9.484 -1.616 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.889 -9.642 -0.232 1.00 0.00 C ATOM 1483 C LEU A 103 -14.655 -8.646 0.640 1.00 0.00 C ATOM 1484 O LEU A 103 -14.779 -8.839 1.848 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.368 -9.527 -0.107 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.560 -10.715 -0.632 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -10.057 -10.459 -0.495 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.985 -12.014 0.056 1.00 0.00 C ATOM 0 H LEU A 103 -13.551 -9.213 -2.254 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.141 -10.640 0.128 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.046 -8.631 -0.638 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.120 -9.380 0.944 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.772 -10.829 -1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.505 -11.319 -0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.785 -9.572 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.809 -10.304 0.555 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.395 -12.843 -0.335 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.821 -11.927 1.130 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.042 -12.198 -0.136 1.00 0.00 H new ATOM 1500 N PHE A 104 -15.150 -7.601 -0.007 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.901 -6.573 0.694 1.00 0.00 C ATOM 1502 C PHE A 104 -17.325 -6.466 0.147 1.00 0.00 C ATOM 1503 O PHE A 104 -17.734 -5.408 -0.330 1.00 0.00 O ATOM 1504 CB PHE A 104 -15.175 -5.247 0.455 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.703 -5.259 0.875 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -13.370 -5.127 2.187 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -12.729 -5.402 -0.063 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -12.004 -5.138 2.577 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.364 -5.413 0.327 1.00 0.00 C ATOM 1510 CZ PHE A 104 -11.030 -5.281 1.638 1.00 0.00 C ATOM 0 H PHE A 104 -15.046 -7.444 -1.009 1.00 0.00 H new ATOM 0 HA PHE A 104 -15.965 -6.817 1.754 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -15.238 -4.996 -0.604 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.692 -4.458 1.001 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.144 -5.014 2.932 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.994 -5.507 -1.105 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -11.739 -5.033 3.619 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -10.591 -5.526 -0.418 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.991 -5.290 1.934 1.00 0.00 H new ATOM 1520 N MET A 105 -18.043 -7.576 0.234 1.00 0.00 N ATOM 1521 CA MET A 105 -19.414 -7.620 -0.246 1.00 0.00 C ATOM 1522 C MET A 105 -20.403 -7.371 0.894 1.00 0.00 C ATOM 1523 O MET A 105 -20.942 -8.314 1.471 1.00 0.00 O ATOM 1524 CB MET A 105 -19.692 -8.988 -0.873 1.00 0.00 C ATOM 1525 CG MET A 105 -19.520 -8.940 -2.393 1.00 0.00 C ATOM 1526 SD MET A 105 -21.114 -8.794 -3.183 1.00 0.00 S ATOM 1527 CE MET A 105 -21.439 -10.512 -3.545 1.00 0.00 C ATOM 0 H MET A 105 -17.701 -8.452 0.630 1.00 0.00 H new ATOM 0 HA MET A 105 -19.543 -6.835 -0.991 1.00 0.00 H new ATOM 0 HB2 MET A 105 -19.015 -9.730 -0.450 1.00 0.00 H new ATOM 0 HB3 MET A 105 -20.706 -9.305 -0.628 1.00 0.00 H new ATOM 0 HG2 MET A 105 -18.889 -8.095 -2.669 1.00 0.00 H new ATOM 0 HG3 MET A 105 -19.015 -9.842 -2.739 1.00 0.00 H new ATOM 0 HE1 MET A 105 -22.404 -10.603 -4.044 1.00 0.00 H new ATOM 0 HE2 MET A 105 -20.656 -10.901 -4.196 1.00 0.00 H new ATOM 0 HE3 MET A 105 -21.456 -11.083 -2.616 1.00 0.00 H new ATOM 1537 N THR A 106 -20.611 -6.095 1.186 1.00 0.00 N ATOM 1538 CA THR A 106 -21.525 -5.710 2.247 1.00 0.00 C ATOM 1539 C THR A 106 -22.050 -4.292 2.011 1.00 0.00 C ATOM 1540 O THR A 106 -21.270 -3.345 1.922 1.00 0.00 O ATOM 1541 CB THR A 106 -20.796 -5.873 3.582 1.00 0.00 C ATOM 1542 OG1 THR A 106 -20.585 -7.278 3.693 1.00 0.00 O ATOM 1543 CG2 THR A 106 -21.685 -5.534 4.781 1.00 0.00 C ATOM 0 H THR A 106 -20.162 -5.315 0.706 1.00 0.00 H new ATOM 0 HA THR A 106 -22.406 -6.351 2.261 1.00 0.00 H new ATOM 0 HB THR A 106 -19.913 -5.234 3.593 1.00 0.00 H new ATOM 0 HG1 THR A 106 -21.170 -7.747 3.062 1.00 0.00 H new ATOM 0 HG21 THR A 106 -21.119 -5.666 5.703 1.00 0.00 H new ATOM 0 HG22 THR A 106 -22.019 -4.499 4.706 1.00 0.00 H new ATOM 0 HG23 THR A 106 -22.552 -6.195 4.790 1.00 0.00 H new ATOM 1551 N ASP A 107 -23.368 -4.192 1.915 1.00 0.00 N ATOM 1552 CA ASP A 107 -24.005 -2.905 1.691 1.00 0.00 C ATOM 1553 C ASP A 107 -23.852 -2.040 2.943 1.00 0.00 C ATOM 1554 O ASP A 107 -23.433 -2.527 3.992 1.00 0.00 O ATOM 1555 CB ASP A 107 -25.500 -3.073 1.412 1.00 0.00 C ATOM 1556 CG ASP A 107 -26.276 -3.840 2.484 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -25.745 -4.877 2.937 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -27.383 -3.372 2.827 1.00 0.00 O ATOM 0 H ASP A 107 -24.011 -4.980 1.988 1.00 0.00 H new ATOM 0 HA ASP A 107 -23.527 -2.437 0.830 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.946 -2.085 1.299 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -25.621 -3.588 0.459 1.00 0.00 H new ATOM 1563 N ARG A 108 -24.201 -0.770 2.792 1.00 0.00 N ATOM 1564 CA ARG A 108 -24.107 0.168 3.897 1.00 0.00 C ATOM 1565 C ARG A 108 -25.466 0.823 4.153 1.00 0.00 C ATOM 1566 O ARG A 108 -26.313 0.873 3.263 1.00 0.00 O ATOM 1567 CB ARG A 108 -23.070 1.256 3.611 1.00 0.00 C ATOM 1568 CG ARG A 108 -23.485 2.106 2.409 1.00 0.00 C ATOM 1569 CD ARG A 108 -22.879 3.508 2.493 1.00 0.00 C ATOM 1570 NE ARG A 108 -23.792 4.412 3.228 1.00 0.00 N ATOM 1571 CZ ARG A 108 -23.437 5.612 3.706 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -22.187 6.061 3.529 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -24.333 6.364 4.361 1.00 0.00 N ATOM 0 H ARG A 108 -24.549 -0.369 1.921 1.00 0.00 H new ATOM 0 HA ARG A 108 -23.796 -0.390 4.780 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -22.954 1.892 4.488 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -22.100 0.797 3.419 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -23.162 1.621 1.488 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -24.572 2.178 2.368 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -21.913 3.466 2.996 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -22.699 3.896 1.490 1.00 0.00 H new ATOM 0 HE ARG A 108 -24.752 4.102 3.380 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -21.506 5.489 3.030 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -21.917 6.975 3.893 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -25.285 6.022 4.495 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -24.063 7.278 4.725 1.00 0.00 H new ATOM 1587 N SER A 109 -25.631 1.311 5.374 1.00 0.00 N ATOM 1588 CA SER A 109 -26.872 1.961 5.759 1.00 0.00 C ATOM 1589 C SER A 109 -26.599 3.408 6.172 1.00 0.00 C ATOM 1590 O SER A 109 -27.155 4.339 5.592 1.00 0.00 O ATOM 1591 CB SER A 109 -27.561 1.205 6.897 1.00 0.00 C ATOM 1592 OG SER A 109 -28.951 1.506 6.974 1.00 0.00 O ATOM 0 H SER A 109 -24.926 1.269 6.110 1.00 0.00 H new ATOM 0 HA SER A 109 -27.541 1.956 4.899 1.00 0.00 H new ATOM 0 HB2 SER A 109 -27.430 0.133 6.751 1.00 0.00 H new ATOM 0 HB3 SER A 109 -27.082 1.459 7.843 1.00 0.00 H new ATOM 0 HG SER A 109 -29.354 1.002 7.712 1.00 0.00 H new ATOM 1598 N GLY A 110 -25.741 3.553 7.172 1.00 0.00 N ATOM 1599 CA GLY A 110 -25.387 4.871 7.669 1.00 0.00 C ATOM 1600 C GLY A 110 -25.352 4.889 9.199 1.00 0.00 C ATOM 1601 O GLY A 110 -26.356 5.190 9.843 1.00 0.00 O ATOM 0 H GLY A 110 -25.281 2.779 7.651 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -24.413 5.162 7.276 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -26.108 5.605 7.310 1.00 0.00 H new ATOM 1605 N PRO A 111 -24.155 4.553 9.750 1.00 0.00 N ATOM 1606 CA PRO A 111 -23.976 4.528 11.192 1.00 0.00 C ATOM 1607 C PRO A 111 -23.878 5.946 11.758 1.00 0.00 C ATOM 1608 O PRO A 111 -24.549 6.276 12.735 1.00 0.00 O ATOM 1609 CB PRO A 111 -22.715 3.710 11.418 1.00 0.00 C ATOM 1610 CG PRO A 111 -21.980 3.701 10.087 1.00 0.00 C ATOM 1611 CD PRO A 111 -22.945 4.191 9.019 1.00 0.00 C ATOM 0 HA PRO A 111 -24.823 4.082 11.713 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -22.099 4.151 12.202 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -22.959 2.696 11.736 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -21.101 4.344 10.132 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -21.628 2.697 9.852 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -22.538 5.046 8.480 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -23.146 3.415 8.281 1.00 0.00 H new ATOM 1619 N SER A 112 -23.038 6.747 11.119 1.00 0.00 N ATOM 1620 CA SER A 112 -22.844 8.122 11.546 1.00 0.00 C ATOM 1621 C SER A 112 -23.640 9.067 10.644 1.00 0.00 C ATOM 1622 O SER A 112 -23.542 8.993 9.420 1.00 0.00 O ATOM 1623 CB SER A 112 -21.361 8.499 11.532 1.00 0.00 C ATOM 1624 OG SER A 112 -21.029 9.398 12.587 1.00 0.00 O ATOM 0 H SER A 112 -22.484 6.470 10.309 1.00 0.00 H new ATOM 0 HA SER A 112 -23.206 8.216 12.570 1.00 0.00 H new ATOM 0 HB2 SER A 112 -20.757 7.596 11.621 1.00 0.00 H new ATOM 0 HB3 SER A 112 -21.112 8.956 10.574 1.00 0.00 H new ATOM 0 HG SER A 112 -20.074 9.613 12.545 1.00 0.00 H new ATOM 1630 N SER A 113 -24.410 9.935 11.283 1.00 0.00 N ATOM 1631 CA SER A 113 -25.222 10.894 10.554 1.00 0.00 C ATOM 1632 C SER A 113 -24.902 12.315 11.023 1.00 0.00 C ATOM 1633 O SER A 113 -24.709 12.551 12.215 1.00 0.00 O ATOM 1634 CB SER A 113 -26.713 10.601 10.731 1.00 0.00 C ATOM 1635 OG SER A 113 -27.388 10.489 9.481 1.00 0.00 O ATOM 0 H SER A 113 -24.489 9.994 12.298 1.00 0.00 H new ATOM 0 HA SER A 113 -24.985 10.806 9.494 1.00 0.00 H new ATOM 0 HB2 SER A 113 -26.836 9.676 11.293 1.00 0.00 H new ATOM 0 HB3 SER A 113 -27.171 11.395 11.320 1.00 0.00 H new ATOM 0 HG SER A 113 -28.337 10.300 9.637 1.00 0.00 H new ATOM 1641 N GLY A 114 -24.854 13.225 10.061 1.00 0.00 N ATOM 1642 CA GLY A 114 -24.561 14.616 10.360 1.00 0.00 C ATOM 1643 C GLY A 114 -25.848 15.413 10.579 1.00 0.00 C ATOM 1644 O GLY A 114 -25.966 16.152 11.556 1.00 0.00 O ATOM 0 H GLY A 114 -25.013 13.026 9.073 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -23.936 14.676 11.251 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -23.992 15.056 9.541 1.00 0.00 H new TER 1648 GLY A 114