USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 895 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 82 TYR OH : rot 69:sc= 0.845 USER MOD Set 1.2: A 99 HIS : no HD1:sc= -3.2! C(o=-1.1!,f=-6.2!) USER MOD Set 1.3: A 114 SER OG : rot -64:sc= 1.24 USER MOD Set 2.1: A 74 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.54) USER MOD Set 2.2: A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc=-0.00825 K(o=-0.0082,f=-0.56) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 65:sc= 1.3 USER MOD Single : A 22 TYR OH : rot -46:sc= 0.161 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0362 USER MOD Single : A 42 SER OG : rot -96:sc= 1.23 USER MOD Single : A 46 ASN : amide:sc= 0.176 K(o=0.18,f=-4.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 58:sc= 1.13 USER MOD Single : A 60 LYS NZ :NH3+ -152:sc= 1.71 (180deg=-1.82) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.918 K(o=-0.92,f=-9.9!) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HD1:sc= 1.11 K(o=1.1,f=-4.8!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 85:sc= 0.0479 USER MOD Single : A 105 ASN : amide:sc= 0.988 K(o=0.99,f=0) USER MOD Single : A 115 TYR OH : rot 18:sc= -0.715 USER MOD Single : A 118 SER OG : rot 73:sc= 0.825 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot -75:sc= 1.18 USER MOD Single : A 123 ASN : amide:sc= 0.00332! X(o=0.0033!,f=-0.21) USER MOD Single : A 124 SER OG : rot 70:sc= 1.2 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -8.810 5.282 -13.352 1.00 0.00 N ATOM 21 CA PRO A 2 -8.155 4.785 -12.141 1.00 0.00 C ATOM 22 C PRO A 2 -8.902 5.216 -10.881 1.00 0.00 C ATOM 23 O PRO A 2 -9.316 6.371 -10.758 1.00 0.00 O ATOM 24 CB PRO A 2 -6.761 5.421 -12.190 1.00 0.00 C ATOM 25 CG PRO A 2 -6.545 5.756 -13.625 1.00 0.00 C ATOM 26 CD PRO A 2 -7.900 6.109 -14.166 1.00 0.00 C ATOM 0 HA PRO A 2 -8.126 3.696 -12.105 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.711 6.312 -11.564 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.999 4.732 -11.826 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -5.851 6.589 -13.733 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -6.116 4.912 -14.164 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.114 7.172 -14.056 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.984 5.876 -15.227 1.00 0.00 H new ATOM 34 N VAL A 3 -9.100 4.279 -9.965 1.00 0.00 N ATOM 35 CA VAL A 3 -9.801 4.565 -8.723 1.00 0.00 C ATOM 36 C VAL A 3 -8.954 5.463 -7.830 1.00 0.00 C ATOM 37 O VAL A 3 -7.859 5.088 -7.417 1.00 0.00 O ATOM 38 CB VAL A 3 -10.158 3.269 -7.966 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.950 3.577 -6.706 1.00 0.00 C ATOM 40 CG2 VAL A 3 -10.933 2.317 -8.866 1.00 0.00 C ATOM 0 H VAL A 3 -8.785 3.314 -10.059 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.728 5.079 -8.979 1.00 0.00 H new ATOM 0 HB VAL A 3 -9.228 2.783 -7.672 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -11.189 2.647 -6.190 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.357 4.213 -6.050 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.873 4.092 -6.973 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -11.175 1.409 -8.313 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.854 2.797 -9.196 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -10.326 2.062 -9.734 1.00 0.00 H new ATOM 50 N GLU A 4 -9.460 6.651 -7.553 1.00 0.00 N ATOM 51 CA GLU A 4 -8.734 7.616 -6.747 1.00 0.00 C ATOM 52 C GLU A 4 -9.673 8.347 -5.804 1.00 0.00 C ATOM 53 O GLU A 4 -10.885 8.390 -6.023 1.00 0.00 O ATOM 54 CB GLU A 4 -8.021 8.633 -7.640 1.00 0.00 C ATOM 55 CG GLU A 4 -8.953 9.339 -8.611 1.00 0.00 C ATOM 56 CD GLU A 4 -8.356 10.602 -9.188 1.00 0.00 C ATOM 57 OE1 GLU A 4 -7.285 10.532 -9.825 1.00 0.00 O ATOM 58 OE2 GLU A 4 -8.969 11.675 -9.022 1.00 0.00 O ATOM 0 H GLU A 4 -10.373 6.971 -7.875 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.995 7.070 -6.160 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.531 9.377 -7.012 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.238 8.125 -8.203 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.205 8.658 -9.424 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.884 9.584 -8.100 1.00 0.00 H new ATOM 65 N LEU A 5 -9.107 8.909 -4.751 1.00 0.00 N ATOM 66 CA LEU A 5 -9.857 9.775 -3.863 1.00 0.00 C ATOM 67 C LEU A 5 -9.665 11.220 -4.311 1.00 0.00 C ATOM 68 O LEU A 5 -8.610 11.816 -4.098 1.00 0.00 O ATOM 69 CB LEU A 5 -9.403 9.593 -2.412 1.00 0.00 C ATOM 70 CG LEU A 5 -10.209 10.383 -1.377 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.642 9.877 -1.316 1.00 0.00 C ATOM 72 CD2 LEU A 5 -9.551 10.291 -0.012 1.00 0.00 C ATOM 0 H LEU A 5 -8.129 8.780 -4.491 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.914 9.515 -3.909 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.457 8.534 -2.161 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.356 9.886 -2.335 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.229 11.430 -1.680 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.199 10.450 -0.575 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.111 9.994 -2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.644 8.824 -1.036 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.136 10.858 0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.501 9.247 0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.543 10.702 -0.066 1.00 0.00 H new ATOM 84 N ARG A 6 -10.677 11.758 -4.973 1.00 0.00 N ATOM 85 CA ARG A 6 -10.587 13.089 -5.560 1.00 0.00 C ATOM 86 C ARG A 6 -11.093 14.145 -4.579 1.00 0.00 C ATOM 87 O ARG A 6 -11.759 13.819 -3.596 1.00 0.00 O ATOM 88 CB ARG A 6 -11.409 13.137 -6.851 1.00 0.00 C ATOM 89 CG ARG A 6 -12.909 13.088 -6.611 1.00 0.00 C ATOM 90 CD ARG A 6 -13.690 12.893 -7.899 1.00 0.00 C ATOM 91 NE ARG A 6 -13.549 11.535 -8.424 1.00 0.00 N ATOM 92 CZ ARG A 6 -14.487 10.597 -8.296 1.00 0.00 C ATOM 93 NH1 ARG A 6 -15.621 10.883 -7.665 1.00 0.00 N ATOM 94 NH2 ARG A 6 -14.293 9.379 -8.792 1.00 0.00 N ATOM 0 H ARG A 6 -11.573 11.293 -5.118 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.543 13.303 -5.787 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -11.165 14.049 -7.395 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -11.122 12.300 -7.487 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -13.139 12.275 -5.922 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -13.229 14.013 -6.131 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -14.744 13.105 -7.720 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -13.344 13.608 -8.645 1.00 0.00 H new ATOM 0 HE ARG A 6 -12.688 11.293 -8.914 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -15.770 11.816 -7.282 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -16.342 10.169 -7.564 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -13.422 9.157 -9.274 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -15.015 8.666 -8.690 1.00 0.00 H new ATOM 108 N ALA A 7 -10.788 15.406 -4.861 1.00 0.00 N ATOM 109 CA ALA A 7 -11.243 16.524 -4.038 1.00 0.00 C ATOM 110 C ALA A 7 -12.701 16.871 -4.344 1.00 0.00 C ATOM 111 O ALA A 7 -13.041 18.026 -4.612 1.00 0.00 O ATOM 112 CB ALA A 7 -10.348 17.735 -4.265 1.00 0.00 C ATOM 0 H ALA A 7 -10.221 15.683 -5.662 1.00 0.00 H new ATOM 0 HA ALA A 7 -11.181 16.229 -2.990 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.694 18.564 -3.648 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.322 17.485 -3.995 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.386 18.024 -5.315 1.00 0.00 H new ATOM 118 N ASN A 8 -13.541 15.844 -4.299 1.00 0.00 N ATOM 119 CA ASN A 8 -14.975 15.950 -4.554 1.00 0.00 C ATOM 120 C ASN A 8 -15.553 14.544 -4.561 1.00 0.00 C ATOM 121 O ASN A 8 -15.821 13.969 -5.618 1.00 0.00 O ATOM 122 CB ASN A 8 -15.265 16.644 -5.893 1.00 0.00 C ATOM 123 CG ASN A 8 -16.752 16.815 -6.157 1.00 0.00 C ATOM 124 OD1 ASN A 8 -17.547 17.006 -5.234 1.00 0.00 O ATOM 125 ND2 ASN A 8 -17.133 16.741 -7.421 1.00 0.00 N ATOM 0 H ASN A 8 -13.240 14.894 -4.080 1.00 0.00 H new ATOM 0 HA ASN A 8 -15.434 16.557 -3.774 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.784 17.622 -5.902 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -14.821 16.063 -6.702 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -18.118 16.843 -7.663 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -16.441 16.582 -8.154 1.00 0.00 H new ATOM 132 N TRP A 9 -15.676 13.963 -3.382 1.00 0.00 N ATOM 133 CA TRP A 9 -16.094 12.577 -3.268 1.00 0.00 C ATOM 134 C TRP A 9 -17.363 12.439 -2.445 1.00 0.00 C ATOM 135 O TRP A 9 -17.698 13.308 -1.636 1.00 0.00 O ATOM 136 CB TRP A 9 -14.972 11.730 -2.652 1.00 0.00 C ATOM 137 CG TRP A 9 -14.519 12.203 -1.300 1.00 0.00 C ATOM 138 CD1 TRP A 9 -13.506 13.079 -1.037 1.00 0.00 C ATOM 139 CD2 TRP A 9 -15.059 11.820 -0.028 1.00 0.00 C ATOM 140 NE1 TRP A 9 -13.388 13.271 0.318 1.00 0.00 N ATOM 141 CE2 TRP A 9 -14.327 12.507 0.959 1.00 0.00 C ATOM 142 CE3 TRP A 9 -16.089 10.965 0.372 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -14.594 12.366 2.319 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.353 10.825 1.721 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.609 11.523 2.679 1.00 0.00 C ATOM 0 H TRP A 9 -15.493 14.427 -2.492 1.00 0.00 H new ATOM 0 HA TRP A 9 -16.307 12.214 -4.274 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -15.314 10.698 -2.568 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -14.118 11.729 -3.330 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -12.887 13.552 -1.785 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -12.711 13.883 0.773 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.669 10.423 -0.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -14.021 12.902 3.061 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.147 10.166 2.041 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -15.841 11.393 3.726 1.00 0.00 H new ATOM 156 N SER A 10 -18.071 11.348 -2.675 1.00 0.00 N ATOM 157 CA SER A 10 -19.245 11.009 -1.898 1.00 0.00 C ATOM 158 C SER A 10 -19.050 9.631 -1.271 1.00 0.00 C ATOM 159 O SER A 10 -18.001 9.006 -1.457 1.00 0.00 O ATOM 160 CB SER A 10 -20.474 11.026 -2.805 1.00 0.00 C ATOM 161 OG SER A 10 -20.439 12.155 -3.664 1.00 0.00 O ATOM 0 H SER A 10 -17.847 10.673 -3.406 1.00 0.00 H new ATOM 0 HA SER A 10 -19.393 11.737 -1.101 1.00 0.00 H new ATOM 0 HB2 SER A 10 -20.510 10.112 -3.397 1.00 0.00 H new ATOM 0 HB3 SER A 10 -21.380 11.049 -2.200 1.00 0.00 H new ATOM 0 HG SER A 10 -21.231 12.152 -4.241 1.00 0.00 H new ATOM 167 N GLU A 11 -20.051 9.153 -0.540 1.00 0.00 N ATOM 168 CA GLU A 11 -19.960 7.860 0.128 1.00 0.00 C ATOM 169 C GLU A 11 -19.711 6.739 -0.880 1.00 0.00 C ATOM 170 O GLU A 11 -18.939 5.818 -0.618 1.00 0.00 O ATOM 171 CB GLU A 11 -21.239 7.580 0.916 1.00 0.00 C ATOM 172 CG GLU A 11 -21.456 8.533 2.081 1.00 0.00 C ATOM 173 CD GLU A 11 -20.429 8.354 3.178 1.00 0.00 C ATOM 174 OE1 GLU A 11 -19.377 9.018 3.131 1.00 0.00 O ATOM 175 OE2 GLU A 11 -20.675 7.546 4.098 1.00 0.00 O ATOM 0 H GLU A 11 -20.935 9.641 -0.395 1.00 0.00 H new ATOM 0 HA GLU A 11 -19.117 7.895 0.818 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -22.093 7.643 0.241 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -21.207 6.558 1.294 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.419 9.560 1.717 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -22.453 8.377 2.493 1.00 0.00 H new ATOM 182 N GLU A 12 -20.359 6.837 -2.038 1.00 0.00 N ATOM 183 CA GLU A 12 -20.200 5.844 -3.094 1.00 0.00 C ATOM 184 C GLU A 12 -18.759 5.824 -3.591 1.00 0.00 C ATOM 185 O GLU A 12 -18.168 4.759 -3.775 1.00 0.00 O ATOM 186 CB GLU A 12 -21.133 6.138 -4.274 1.00 0.00 C ATOM 187 CG GLU A 12 -22.553 6.506 -3.876 1.00 0.00 C ATOM 188 CD GLU A 12 -22.725 7.995 -3.656 1.00 0.00 C ATOM 189 OE1 GLU A 12 -22.418 8.478 -2.549 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.163 8.689 -4.599 1.00 0.00 O ATOM 0 H GLU A 12 -21.000 7.596 -2.268 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.457 4.872 -2.674 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -20.710 6.953 -4.861 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -21.166 5.262 -4.922 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -23.242 6.174 -4.653 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.821 5.974 -2.963 1.00 0.00 H new ATOM 197 N ASP A 13 -18.201 7.011 -3.802 1.00 0.00 N ATOM 198 CA ASP A 13 -16.838 7.141 -4.307 1.00 0.00 C ATOM 199 C ASP A 13 -15.849 6.579 -3.303 1.00 0.00 C ATOM 200 O ASP A 13 -14.938 5.836 -3.662 1.00 0.00 O ATOM 201 CB ASP A 13 -16.487 8.604 -4.589 1.00 0.00 C ATOM 202 CG ASP A 13 -17.440 9.263 -5.560 1.00 0.00 C ATOM 203 OD1 ASP A 13 -17.305 9.046 -6.782 1.00 0.00 O ATOM 204 OD2 ASP A 13 -18.325 10.013 -5.101 1.00 0.00 O ATOM 0 H ASP A 13 -18.672 7.899 -3.631 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.778 6.579 -5.239 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -16.490 9.160 -3.651 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -15.474 8.659 -4.989 1.00 0.00 H new ATOM 209 N LEU A 14 -16.043 6.934 -2.041 1.00 0.00 N ATOM 210 CA LEU A 14 -15.163 6.479 -0.978 1.00 0.00 C ATOM 211 C LEU A 14 -15.238 4.964 -0.829 1.00 0.00 C ATOM 212 O LEU A 14 -14.211 4.302 -0.714 1.00 0.00 O ATOM 213 CB LEU A 14 -15.519 7.161 0.343 1.00 0.00 C ATOM 214 CG LEU A 14 -14.559 6.879 1.500 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.144 7.302 1.141 1.00 0.00 C ATOM 216 CD2 LEU A 14 -15.023 7.596 2.751 1.00 0.00 C ATOM 0 H LEU A 14 -16.804 7.537 -1.729 1.00 0.00 H new ATOM 0 HA LEU A 14 -14.141 6.749 -1.243 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.558 8.238 0.179 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.520 6.847 0.638 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.556 5.806 1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.478 7.092 1.978 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.810 6.748 0.264 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.128 8.370 0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -14.332 7.387 3.567 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.052 8.670 2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.020 7.247 3.022 1.00 0.00 H new ATOM 228 N GLU A 15 -16.453 4.421 -0.851 1.00 0.00 N ATOM 229 CA GLU A 15 -16.660 2.976 -0.776 1.00 0.00 C ATOM 230 C GLU A 15 -15.956 2.277 -1.938 1.00 0.00 C ATOM 231 O GLU A 15 -15.398 1.187 -1.782 1.00 0.00 O ATOM 232 CB GLU A 15 -18.157 2.669 -0.802 1.00 0.00 C ATOM 233 CG GLU A 15 -18.492 1.188 -0.774 1.00 0.00 C ATOM 234 CD GLU A 15 -18.287 0.559 0.590 1.00 0.00 C ATOM 235 OE1 GLU A 15 -19.236 0.589 1.408 1.00 0.00 O ATOM 236 OE2 GLU A 15 -17.193 0.024 0.847 1.00 0.00 O ATOM 0 H GLU A 15 -17.314 4.963 -0.921 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.236 2.604 0.157 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.630 3.153 0.053 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.591 3.111 -1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -19.529 1.050 -1.079 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.873 0.667 -1.505 1.00 0.00 H new ATOM 243 N THR A 16 -15.975 2.920 -3.100 1.00 0.00 N ATOM 244 CA THR A 16 -15.266 2.415 -4.265 1.00 0.00 C ATOM 245 C THR A 16 -13.768 2.319 -3.968 1.00 0.00 C ATOM 246 O THR A 16 -13.112 1.348 -4.346 1.00 0.00 O ATOM 247 CB THR A 16 -15.510 3.317 -5.495 1.00 0.00 C ATOM 248 OG1 THR A 16 -16.921 3.393 -5.764 1.00 0.00 O ATOM 249 CG2 THR A 16 -14.788 2.788 -6.727 1.00 0.00 C ATOM 0 H THR A 16 -16.476 3.794 -3.258 1.00 0.00 H new ATOM 0 HA THR A 16 -15.648 1.420 -4.493 1.00 0.00 H new ATOM 0 HB THR A 16 -15.116 4.308 -5.270 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.372 3.843 -5.020 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.982 3.447 -7.573 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.716 2.752 -6.533 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.149 1.786 -6.958 1.00 0.00 H new ATOM 257 N VAL A 17 -13.248 3.318 -3.260 1.00 0.00 N ATOM 258 CA VAL A 17 -11.851 3.325 -2.841 1.00 0.00 C ATOM 259 C VAL A 17 -11.605 2.232 -1.798 1.00 0.00 C ATOM 260 O VAL A 17 -10.605 1.516 -1.862 1.00 0.00 O ATOM 261 CB VAL A 17 -11.450 4.705 -2.265 1.00 0.00 C ATOM 262 CG1 VAL A 17 -9.996 4.715 -1.813 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.697 5.805 -3.287 1.00 0.00 C ATOM 0 H VAL A 17 -13.778 4.138 -2.963 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.235 3.128 -3.718 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.074 4.894 -1.392 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.746 5.698 -1.414 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.850 3.961 -1.039 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.350 4.493 -2.662 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.409 6.767 -2.863 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -11.105 5.611 -4.181 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.755 5.827 -3.550 1.00 0.00 H new ATOM 273 N ILE A 18 -12.539 2.099 -0.856 1.00 0.00 N ATOM 274 CA ILE A 18 -12.455 1.078 0.190 1.00 0.00 C ATOM 275 C ILE A 18 -12.284 -0.307 -0.427 1.00 0.00 C ATOM 276 O ILE A 18 -11.290 -0.996 -0.186 1.00 0.00 O ATOM 277 CB ILE A 18 -13.725 1.058 1.078 1.00 0.00 C ATOM 278 CG1 ILE A 18 -14.047 2.452 1.625 1.00 0.00 C ATOM 279 CG2 ILE A 18 -13.569 0.067 2.224 1.00 0.00 C ATOM 280 CD1 ILE A 18 -12.957 3.051 2.484 1.00 0.00 C ATOM 0 H ILE A 18 -13.368 2.690 -0.796 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.592 1.330 0.806 1.00 0.00 H new ATOM 0 HB ILE A 18 -14.557 0.739 0.450 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -14.243 3.122 0.788 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -14.965 2.397 2.210 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -14.473 0.070 2.834 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -13.407 -0.933 1.821 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -12.716 0.353 2.839 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -13.267 4.037 2.829 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -12.775 2.406 3.344 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -12.042 3.142 1.899 1.00 0.00 H new ATOM 292 N ARG A 19 -13.249 -0.695 -1.251 1.00 0.00 N ATOM 293 CA ARG A 19 -13.263 -2.025 -1.844 1.00 0.00 C ATOM 294 C ARG A 19 -12.147 -2.205 -2.869 1.00 0.00 C ATOM 295 O ARG A 19 -11.729 -3.327 -3.136 1.00 0.00 O ATOM 296 CB ARG A 19 -14.628 -2.322 -2.471 1.00 0.00 C ATOM 297 CG ARG A 19 -15.702 -2.632 -1.443 1.00 0.00 C ATOM 298 CD ARG A 19 -17.030 -2.968 -2.099 1.00 0.00 C ATOM 299 NE ARG A 19 -17.971 -3.534 -1.136 1.00 0.00 N ATOM 300 CZ ARG A 19 -19.293 -3.415 -1.220 1.00 0.00 C ATOM 301 NH1 ARG A 19 -19.846 -2.727 -2.210 1.00 0.00 N ATOM 302 NH2 ARG A 19 -20.068 -3.987 -0.311 1.00 0.00 N ATOM 0 H ARG A 19 -14.035 -0.105 -1.524 1.00 0.00 H new ATOM 0 HA ARG A 19 -13.084 -2.741 -1.042 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -14.941 -1.465 -3.067 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -14.532 -3.167 -3.153 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -15.381 -3.469 -0.823 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -15.830 -1.775 -0.781 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -17.457 -2.068 -2.542 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -16.868 -3.677 -2.911 1.00 0.00 H new ATOM 0 HE ARG A 19 -17.589 -4.055 -0.347 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -19.256 -2.284 -2.915 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -20.861 -2.641 -2.267 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -19.651 -4.519 0.453 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -21.082 -3.896 -0.375 1.00 0.00 H new ATOM 316 N ALA A 20 -11.654 -1.105 -3.427 1.00 0.00 N ATOM 317 CA ALA A 20 -10.556 -1.171 -4.387 1.00 0.00 C ATOM 318 C ALA A 20 -9.252 -1.560 -3.698 1.00 0.00 C ATOM 319 O ALA A 20 -8.384 -2.188 -4.303 1.00 0.00 O ATOM 320 CB ALA A 20 -10.392 0.156 -5.112 1.00 0.00 C ATOM 0 H ALA A 20 -11.994 -0.163 -3.234 1.00 0.00 H new ATOM 0 HA ALA A 20 -10.800 -1.939 -5.121 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.568 0.083 -5.822 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -11.312 0.395 -5.646 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.178 0.942 -4.388 1.00 0.00 H new ATOM 326 N VAL A 21 -9.116 -1.175 -2.433 1.00 0.00 N ATOM 327 CA VAL A 21 -7.932 -1.516 -1.656 1.00 0.00 C ATOM 328 C VAL A 21 -8.114 -2.868 -0.967 1.00 0.00 C ATOM 329 O VAL A 21 -7.190 -3.678 -0.911 1.00 0.00 O ATOM 330 CB VAL A 21 -7.611 -0.434 -0.601 1.00 0.00 C ATOM 331 CG1 VAL A 21 -6.350 -0.788 0.177 1.00 0.00 C ATOM 332 CG2 VAL A 21 -7.460 0.929 -1.259 1.00 0.00 C ATOM 0 H VAL A 21 -9.811 -0.627 -1.926 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.094 -1.574 -2.351 1.00 0.00 H new ATOM 0 HB VAL A 21 -8.445 -0.392 0.100 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.146 -0.010 0.913 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -6.492 -1.741 0.686 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -5.508 -0.866 -0.511 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.234 1.677 -0.499 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -6.649 0.894 -1.986 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -8.389 1.194 -1.764 1.00 0.00 H new ATOM 342 N TYR A 22 -9.314 -3.107 -0.447 1.00 0.00 N ATOM 343 CA TYR A 22 -9.608 -4.353 0.257 1.00 0.00 C ATOM 344 C TYR A 22 -9.801 -5.523 -0.705 1.00 0.00 C ATOM 345 O TYR A 22 -9.002 -6.460 -0.731 1.00 0.00 O ATOM 346 CB TYR A 22 -10.859 -4.201 1.129 1.00 0.00 C ATOM 347 CG TYR A 22 -10.605 -3.560 2.475 1.00 0.00 C ATOM 348 CD1 TYR A 22 -10.213 -4.330 3.561 1.00 0.00 C ATOM 349 CD2 TYR A 22 -10.762 -2.194 2.661 1.00 0.00 C ATOM 350 CE1 TYR A 22 -9.984 -3.757 4.795 1.00 0.00 C ATOM 351 CE2 TYR A 22 -10.533 -1.612 3.895 1.00 0.00 C ATOM 352 CZ TYR A 22 -10.146 -2.398 4.958 1.00 0.00 C ATOM 353 OH TYR A 22 -9.916 -1.827 6.189 1.00 0.00 O ATOM 0 H TYR A 22 -10.098 -2.456 -0.499 1.00 0.00 H new ATOM 0 HA TYR A 22 -8.746 -4.569 0.888 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -11.594 -3.605 0.589 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -11.300 -5.185 1.286 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -10.085 -5.395 3.438 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -11.068 -1.576 1.830 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -9.679 -4.371 5.630 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -10.657 -0.547 4.024 1.00 0.00 H new ATOM 0 HH TYR A 22 -10.351 -2.363 6.885 1.00 0.00 H new ATOM 586 N LEU A 37 -10.610 -2.282 9.198 1.00 0.00 N ATOM 587 CA LEU A 37 -9.848 -1.266 9.906 1.00 0.00 C ATOM 588 C LEU A 37 -10.686 -0.010 10.087 1.00 0.00 C ATOM 589 O LEU A 37 -10.657 0.899 9.255 1.00 0.00 O ATOM 590 CB LEU A 37 -8.532 -0.929 9.191 1.00 0.00 C ATOM 591 CG LEU A 37 -7.440 -2.001 9.273 1.00 0.00 C ATOM 592 CD1 LEU A 37 -7.700 -3.130 8.292 1.00 0.00 C ATOM 593 CD2 LEU A 37 -6.077 -1.378 9.023 1.00 0.00 C ATOM 0 HA LEU A 37 -9.592 -1.673 10.884 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.749 -0.737 8.140 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.139 -0.003 9.610 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.455 -2.426 10.277 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.908 -3.874 8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.659 -3.595 8.518 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.720 -2.733 7.277 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.308 -2.148 9.084 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.060 -0.926 8.031 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.884 -0.612 9.774 1.00 0.00 H new ATOM 605 N VAL A 38 -11.451 0.013 11.170 1.00 0.00 N ATOM 606 CA VAL A 38 -12.301 1.146 11.498 1.00 0.00 C ATOM 607 C VAL A 38 -11.446 2.382 11.729 1.00 0.00 C ATOM 608 O VAL A 38 -11.848 3.501 11.408 1.00 0.00 O ATOM 609 CB VAL A 38 -13.150 0.865 12.758 1.00 0.00 C ATOM 610 CG1 VAL A 38 -14.104 2.016 13.038 1.00 0.00 C ATOM 611 CG2 VAL A 38 -13.918 -0.437 12.604 1.00 0.00 C ATOM 0 H VAL A 38 -11.499 -0.752 11.843 1.00 0.00 H new ATOM 0 HA VAL A 38 -12.977 1.314 10.659 1.00 0.00 H new ATOM 0 HB VAL A 38 -12.474 0.770 13.608 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -14.690 1.794 13.930 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -13.533 2.931 13.197 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -14.773 2.149 12.188 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -14.510 -0.618 13.501 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -14.579 -0.369 11.740 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -13.216 -1.259 12.460 1.00 0.00 H new ATOM 621 N SER A 39 -10.252 2.158 12.263 1.00 0.00 N ATOM 622 CA SER A 39 -9.294 3.226 12.492 1.00 0.00 C ATOM 623 C SER A 39 -8.966 3.937 11.181 1.00 0.00 C ATOM 624 O SER A 39 -9.174 5.141 11.046 1.00 0.00 O ATOM 625 CB SER A 39 -8.025 2.639 13.111 1.00 0.00 C ATOM 626 OG SER A 39 -7.578 1.517 12.363 1.00 0.00 O ATOM 0 H SER A 39 -9.924 1.235 12.547 1.00 0.00 H new ATOM 0 HA SER A 39 -9.725 3.957 13.176 1.00 0.00 H new ATOM 0 HB2 SER A 39 -7.243 3.398 13.141 1.00 0.00 H new ATOM 0 HB3 SER A 39 -8.220 2.342 14.141 1.00 0.00 H new ATOM 0 HG SER A 39 -6.764 1.155 12.772 1.00 0.00 H new ATOM 632 N ALA A 40 -8.483 3.169 10.211 1.00 0.00 N ATOM 633 CA ALA A 40 -8.110 3.706 8.911 1.00 0.00 C ATOM 634 C ALA A 40 -9.315 4.280 8.179 1.00 0.00 C ATOM 635 O ALA A 40 -9.229 5.356 7.587 1.00 0.00 O ATOM 636 CB ALA A 40 -7.446 2.629 8.069 1.00 0.00 C ATOM 0 H ALA A 40 -8.340 2.163 10.304 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.402 4.518 9.075 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.172 3.043 7.099 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.551 2.271 8.577 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.139 1.800 7.927 1.00 0.00 H new ATOM 642 N GLU A 41 -10.439 3.569 8.237 1.00 0.00 N ATOM 643 CA GLU A 41 -11.644 3.995 7.537 1.00 0.00 C ATOM 644 C GLU A 41 -12.094 5.368 8.015 1.00 0.00 C ATOM 645 O GLU A 41 -12.264 6.278 7.214 1.00 0.00 O ATOM 646 CB GLU A 41 -12.787 3.001 7.728 1.00 0.00 C ATOM 647 CG GLU A 41 -13.980 3.302 6.833 1.00 0.00 C ATOM 648 CD GLU A 41 -15.288 2.802 7.401 1.00 0.00 C ATOM 649 OE1 GLU A 41 -15.482 1.572 7.468 1.00 0.00 O ATOM 650 OE2 GLU A 41 -16.133 3.645 7.771 1.00 0.00 O ATOM 0 H GLU A 41 -10.538 2.699 8.760 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.393 4.043 6.477 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.426 1.994 7.520 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.106 3.016 8.770 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -14.047 4.379 6.676 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.818 2.847 5.856 1.00 0.00 H new ATOM 657 N SER A 42 -12.268 5.520 9.325 1.00 0.00 N ATOM 658 CA SER A 42 -12.770 6.770 9.885 1.00 0.00 C ATOM 659 C SER A 42 -11.824 7.934 9.584 1.00 0.00 C ATOM 660 O SER A 42 -12.268 9.041 9.270 1.00 0.00 O ATOM 661 CB SER A 42 -12.994 6.623 11.396 1.00 0.00 C ATOM 662 OG SER A 42 -11.846 6.094 12.039 1.00 0.00 O ATOM 0 H SER A 42 -12.070 4.796 10.016 1.00 0.00 H new ATOM 0 HA SER A 42 -13.726 6.995 9.412 1.00 0.00 H new ATOM 0 HB2 SER A 42 -13.239 7.594 11.826 1.00 0.00 H new ATOM 0 HB3 SER A 42 -13.848 5.970 11.577 1.00 0.00 H new ATOM 0 HG SER A 42 -11.947 5.125 12.144 1.00 0.00 H new ATOM 668 N LEU A 43 -10.521 7.668 9.648 1.00 0.00 N ATOM 669 CA LEU A 43 -9.518 8.693 9.376 1.00 0.00 C ATOM 670 C LEU A 43 -9.600 9.171 7.928 1.00 0.00 C ATOM 671 O LEU A 43 -9.395 10.352 7.642 1.00 0.00 O ATOM 672 CB LEU A 43 -8.110 8.163 9.668 1.00 0.00 C ATOM 673 CG LEU A 43 -7.837 7.778 11.123 1.00 0.00 C ATOM 674 CD1 LEU A 43 -6.435 7.207 11.267 1.00 0.00 C ATOM 675 CD2 LEU A 43 -8.014 8.977 12.040 1.00 0.00 C ATOM 0 H LEU A 43 -10.137 6.753 9.885 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.723 9.538 10.033 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.933 7.290 9.040 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.387 8.922 9.370 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.558 7.014 11.414 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.257 6.938 12.308 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -6.337 6.320 10.641 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.704 7.953 10.955 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.815 8.680 13.070 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.318 9.764 11.748 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.036 9.348 11.961 1.00 0.00 H new ATOM 687 N LEU A 44 -9.905 8.256 7.022 1.00 0.00 N ATOM 688 CA LEU A 44 -10.018 8.593 5.610 1.00 0.00 C ATOM 689 C LEU A 44 -11.400 9.168 5.308 1.00 0.00 C ATOM 690 O LEU A 44 -11.549 10.067 4.484 1.00 0.00 O ATOM 691 CB LEU A 44 -9.772 7.349 4.752 1.00 0.00 C ATOM 692 CG LEU A 44 -9.691 7.605 3.245 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.471 8.452 2.913 1.00 0.00 C ATOM 694 CD2 LEU A 44 -9.656 6.293 2.476 1.00 0.00 C ATOM 0 H LEU A 44 -10.079 7.274 7.238 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.266 9.345 5.371 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -8.842 6.881 5.076 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.572 6.633 4.941 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.584 8.152 2.943 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.429 8.624 1.837 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.540 9.408 3.431 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.568 7.931 3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -9.598 6.499 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.784 5.715 2.782 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.561 5.723 2.687 1.00 0.00 H new ATOM 706 N ARG A 45 -12.401 8.654 6.010 1.00 0.00 N ATOM 707 CA ARG A 45 -13.794 9.013 5.772 1.00 0.00 C ATOM 708 C ARG A 45 -14.078 10.459 6.173 1.00 0.00 C ATOM 709 O ARG A 45 -15.021 11.071 5.678 1.00 0.00 O ATOM 710 CB ARG A 45 -14.715 8.046 6.528 1.00 0.00 C ATOM 711 CG ARG A 45 -16.139 8.000 5.997 1.00 0.00 C ATOM 712 CD ARG A 45 -16.886 6.790 6.531 1.00 0.00 C ATOM 713 NE ARG A 45 -18.139 6.555 5.811 1.00 0.00 N ATOM 714 CZ ARG A 45 -18.782 5.386 5.789 1.00 0.00 C ATOM 715 NH1 ARG A 45 -18.308 4.334 6.441 1.00 0.00 N ATOM 716 NH2 ARG A 45 -19.910 5.268 5.103 1.00 0.00 N ATOM 0 H ARG A 45 -12.271 7.976 6.761 1.00 0.00 H new ATOM 0 HA ARG A 45 -13.991 8.931 4.703 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.289 7.044 6.481 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.740 8.333 7.579 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.666 8.911 6.282 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.123 7.969 4.908 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -16.251 5.908 6.450 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -17.099 6.934 7.590 1.00 0.00 H new ATOM 0 HE ARG A 45 -18.546 7.334 5.294 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -17.439 4.411 6.970 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -18.812 3.448 6.414 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.284 6.069 4.594 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -20.404 4.376 5.084 1.00 0.00 H new ATOM 730 N ASN A 46 -13.262 11.008 7.067 1.00 0.00 N ATOM 731 CA ASN A 46 -13.406 12.411 7.444 1.00 0.00 C ATOM 732 C ASN A 46 -12.402 13.266 6.673 1.00 0.00 C ATOM 733 O ASN A 46 -12.460 14.495 6.702 1.00 0.00 O ATOM 734 CB ASN A 46 -13.241 12.610 8.961 1.00 0.00 C ATOM 735 CG ASN A 46 -11.797 12.676 9.420 1.00 0.00 C ATOM 736 OD1 ASN A 46 -11.189 13.746 9.434 1.00 0.00 O ATOM 737 ND2 ASN A 46 -11.246 11.545 9.821 1.00 0.00 N ATOM 0 H ASN A 46 -12.505 10.513 7.538 1.00 0.00 H new ATOM 0 HA ASN A 46 -14.415 12.729 7.183 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -13.747 13.530 9.254 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -13.740 11.792 9.481 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -10.283 11.538 10.158 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -11.783 10.678 9.794 1.00 0.00 H new ATOM 744 N GLY A 47 -11.497 12.605 5.962 1.00 0.00 N ATOM 745 CA GLY A 47 -10.514 13.311 5.164 1.00 0.00 C ATOM 746 C GLY A 47 -9.336 13.805 5.980 1.00 0.00 C ATOM 747 O GLY A 47 -8.775 14.860 5.689 1.00 0.00 O ATOM 0 H GLY A 47 -11.427 11.588 5.924 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.152 12.651 4.375 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.992 14.160 4.675 1.00 0.00 H new ATOM 751 N LYS A 48 -8.959 13.049 7.000 1.00 0.00 N ATOM 752 CA LYS A 48 -7.834 13.415 7.844 1.00 0.00 C ATOM 753 C LYS A 48 -6.531 12.876 7.260 1.00 0.00 C ATOM 754 O LYS A 48 -5.500 13.552 7.281 1.00 0.00 O ATOM 755 CB LYS A 48 -8.055 12.872 9.255 1.00 0.00 C ATOM 756 CG LYS A 48 -6.880 13.073 10.191 1.00 0.00 C ATOM 757 CD LYS A 48 -7.167 12.480 11.555 1.00 0.00 C ATOM 758 CE LYS A 48 -5.896 12.317 12.367 1.00 0.00 C ATOM 759 NZ LYS A 48 -5.284 13.623 12.727 1.00 0.00 N ATOM 0 H LYS A 48 -9.417 12.177 7.263 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.760 14.502 7.889 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.933 13.355 9.684 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -8.276 11.807 9.191 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.990 12.608 9.768 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.667 14.137 10.290 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.864 13.122 12.093 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.652 11.511 11.437 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.118 11.759 13.277 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.178 11.726 11.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.419 13.460 13.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.047 14.146 11.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -5.958 14.178 13.292 1.00 0.00 H new ATOM 773 N ILE A 49 -6.585 11.659 6.735 1.00 0.00 N ATOM 774 CA ILE A 49 -5.416 11.044 6.121 1.00 0.00 C ATOM 775 C ILE A 49 -5.616 10.916 4.618 1.00 0.00 C ATOM 776 O ILE A 49 -6.682 11.248 4.093 1.00 0.00 O ATOM 777 CB ILE A 49 -5.116 9.641 6.704 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.279 8.681 6.428 1.00 0.00 C ATOM 779 CG2 ILE A 49 -4.832 9.730 8.198 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.001 7.248 6.835 1.00 0.00 C ATOM 0 H ILE A 49 -7.424 11.079 6.722 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.569 11.694 6.338 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.227 9.248 6.211 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.163 9.034 6.959 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.514 8.707 5.364 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.624 8.734 8.589 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.969 10.374 8.367 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.700 10.146 8.709 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.870 6.630 6.608 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -5.137 6.875 6.285 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -5.796 7.207 7.905 1.00 0.00 H new ATOM 792 N THR A 50 -4.595 10.435 3.932 1.00 0.00 N ATOM 793 CA THR A 50 -4.675 10.211 2.501 1.00 0.00 C ATOM 794 C THR A 50 -4.752 8.720 2.192 1.00 0.00 C ATOM 795 O THR A 50 -4.777 7.884 3.100 1.00 0.00 O ATOM 796 CB THR A 50 -3.467 10.824 1.765 1.00 0.00 C ATOM 797 OG1 THR A 50 -2.417 11.137 2.692 1.00 0.00 O ATOM 798 CG2 THR A 50 -3.871 12.078 1.009 1.00 0.00 C ATOM 0 H THR A 50 -3.696 10.191 4.347 1.00 0.00 H new ATOM 0 HA THR A 50 -5.582 10.701 2.148 1.00 0.00 H new ATOM 0 HB THR A 50 -3.104 10.086 1.050 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.148 10.324 3.168 1.00 0.00 H new ATOM 0 HG21 THR A 50 -3.001 12.491 0.498 1.00 0.00 H new ATOM 0 HG22 THR A 50 -4.638 11.829 0.276 1.00 0.00 H new ATOM 0 HG23 THR A 50 -4.264 12.815 1.710 1.00 0.00 H new ATOM 806 N VAL A 51 -4.785 8.388 0.909 1.00 0.00 N ATOM 807 CA VAL A 51 -4.835 6.997 0.488 1.00 0.00 C ATOM 808 C VAL A 51 -3.503 6.319 0.802 1.00 0.00 C ATOM 809 O VAL A 51 -3.446 5.115 1.037 1.00 0.00 O ATOM 810 CB VAL A 51 -5.155 6.881 -1.020 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.311 5.428 -1.442 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.408 7.674 -1.359 1.00 0.00 C ATOM 0 H VAL A 51 -4.778 9.062 0.144 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.634 6.497 1.036 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.315 7.300 -1.575 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.536 5.381 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.385 4.890 -1.242 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.125 4.971 -0.879 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.620 7.582 -2.424 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.250 7.285 -0.787 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.253 8.724 -1.109 1.00 0.00 H new ATOM 822 N ARG A 52 -2.444 7.124 0.839 1.00 0.00 N ATOM 823 CA ARG A 52 -1.112 6.656 1.213 1.00 0.00 C ATOM 824 C ARG A 52 -1.148 5.900 2.546 1.00 0.00 C ATOM 825 O ARG A 52 -0.673 4.764 2.639 1.00 0.00 O ATOM 826 CB ARG A 52 -0.150 7.852 1.286 1.00 0.00 C ATOM 827 CG ARG A 52 1.214 7.527 1.884 1.00 0.00 C ATOM 828 CD ARG A 52 2.205 8.668 1.690 1.00 0.00 C ATOM 829 NE ARG A 52 1.664 9.955 2.117 1.00 0.00 N ATOM 830 CZ ARG A 52 2.347 10.862 2.818 1.00 0.00 C ATOM 831 NH1 ARG A 52 3.605 10.631 3.178 1.00 0.00 N ATOM 832 NH2 ARG A 52 1.777 12.013 3.139 1.00 0.00 N ATOM 0 H ARG A 52 -2.485 8.117 0.611 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.756 5.960 0.453 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.007 8.250 0.281 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.614 8.641 1.878 1.00 0.00 H new ATOM 0 HG2 ARG A 52 1.104 7.319 2.948 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.607 6.622 1.421 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.114 8.455 2.252 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.486 8.726 0.639 1.00 0.00 H new ATOM 0 HE ARG A 52 0.701 10.175 1.863 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.057 9.754 2.919 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.119 11.331 3.714 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.818 12.205 2.851 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.297 12.708 3.675 1.00 0.00 H new ATOM 846 N GLU A 53 -1.734 6.519 3.568 1.00 0.00 N ATOM 847 CA GLU A 53 -1.850 5.883 4.876 1.00 0.00 C ATOM 848 C GLU A 53 -2.822 4.715 4.819 1.00 0.00 C ATOM 849 O GLU A 53 -2.571 3.661 5.402 1.00 0.00 O ATOM 850 CB GLU A 53 -2.323 6.876 5.947 1.00 0.00 C ATOM 851 CG GLU A 53 -1.333 7.986 6.265 1.00 0.00 C ATOM 852 CD GLU A 53 -1.150 8.951 5.117 1.00 0.00 C ATOM 853 OE1 GLU A 53 -2.161 9.508 4.645 1.00 0.00 O ATOM 854 OE2 GLU A 53 0.000 9.149 4.685 1.00 0.00 O ATOM 0 H GLU A 53 -2.134 7.456 3.516 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.857 5.523 5.146 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.259 7.326 5.618 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.538 6.326 6.863 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.677 8.533 7.143 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.369 7.545 6.521 1.00 0.00 H new ATOM 861 N PHE A 54 -3.924 4.912 4.103 1.00 0.00 N ATOM 862 CA PHE A 54 -4.980 3.910 4.016 1.00 0.00 C ATOM 863 C PHE A 54 -4.461 2.611 3.402 1.00 0.00 C ATOM 864 O PHE A 54 -4.695 1.530 3.942 1.00 0.00 O ATOM 865 CB PHE A 54 -6.158 4.454 3.198 1.00 0.00 C ATOM 866 CG PHE A 54 -7.347 3.534 3.163 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.132 3.354 4.289 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.684 2.861 2.000 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.230 2.518 4.257 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.780 2.023 1.963 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.554 1.851 3.093 1.00 0.00 C ATOM 0 H PHE A 54 -4.110 5.762 3.571 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.322 3.689 5.027 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.465 5.414 3.614 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.824 4.641 2.177 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.883 3.873 5.203 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.083 2.993 1.113 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.835 2.386 5.142 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -9.032 1.502 1.051 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.412 1.195 3.066 1.00 0.00 H new ATOM 881 N VAL A 55 -3.745 2.720 2.288 1.00 0.00 N ATOM 882 CA VAL A 55 -3.181 1.550 1.629 1.00 0.00 C ATOM 883 C VAL A 55 -2.210 0.832 2.557 1.00 0.00 C ATOM 884 O VAL A 55 -2.286 -0.383 2.718 1.00 0.00 O ATOM 885 CB VAL A 55 -2.466 1.915 0.308 1.00 0.00 C ATOM 886 CG1 VAL A 55 -1.785 0.696 -0.299 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.452 2.509 -0.683 1.00 0.00 C ATOM 0 H VAL A 55 -3.542 3.605 1.824 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.012 0.888 1.387 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.701 2.658 0.534 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.290 0.981 -1.227 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.047 0.305 0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.530 -0.072 -0.506 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.932 2.760 -1.607 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.237 1.783 -0.894 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.895 3.410 -0.259 1.00 0.00 H new ATOM 897 N ARG A 56 -1.316 1.592 3.189 1.00 0.00 N ATOM 898 CA ARG A 56 -0.354 1.016 4.124 1.00 0.00 C ATOM 899 C ARG A 56 -1.080 0.317 5.268 1.00 0.00 C ATOM 900 O ARG A 56 -0.700 -0.778 5.689 1.00 0.00 O ATOM 901 CB ARG A 56 0.557 2.105 4.695 1.00 0.00 C ATOM 902 CG ARG A 56 1.781 1.558 5.413 1.00 0.00 C ATOM 903 CD ARG A 56 1.970 2.192 6.783 1.00 0.00 C ATOM 904 NE ARG A 56 1.024 1.667 7.772 1.00 0.00 N ATOM 905 CZ ARG A 56 1.357 1.374 9.034 1.00 0.00 C ATOM 906 NH1 ARG A 56 2.608 1.535 9.449 1.00 0.00 N ATOM 907 NH2 ARG A 56 0.448 0.894 9.872 1.00 0.00 N ATOM 0 H ARG A 56 -1.239 2.602 3.071 1.00 0.00 H new ATOM 0 HA ARG A 56 0.252 0.289 3.582 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.882 2.757 3.884 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.016 2.720 5.388 1.00 0.00 H new ATOM 0 HG2 ARG A 56 1.684 0.478 5.524 1.00 0.00 H new ATOM 0 HG3 ARG A 56 2.668 1.737 4.805 1.00 0.00 H new ATOM 0 HD2 ARG A 56 2.989 2.013 7.127 1.00 0.00 H new ATOM 0 HD3 ARG A 56 1.846 3.272 6.702 1.00 0.00 H new ATOM 0 HE ARG A 56 0.058 1.517 7.482 1.00 0.00 H new ATOM 0 HH11 ARG A 56 3.318 1.883 8.805 1.00 0.00 H new ATOM 0 HH12 ARG A 56 2.859 1.311 10.412 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -0.510 0.747 9.555 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.707 0.672 10.833 1.00 0.00 H new ATOM 921 N ALA A 57 -2.127 0.968 5.762 1.00 0.00 N ATOM 922 CA ALA A 57 -2.910 0.445 6.869 1.00 0.00 C ATOM 923 C ALA A 57 -3.554 -0.883 6.504 1.00 0.00 C ATOM 924 O ALA A 57 -3.354 -1.880 7.190 1.00 0.00 O ATOM 925 CB ALA A 57 -3.969 1.452 7.289 1.00 0.00 C ATOM 0 H ALA A 57 -2.453 1.867 5.407 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.237 0.273 7.709 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.548 1.047 8.119 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.487 2.378 7.601 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.633 1.654 6.448 1.00 0.00 H new ATOM 931 N VAL A 58 -4.310 -0.893 5.411 1.00 0.00 N ATOM 932 CA VAL A 58 -4.995 -2.100 4.960 1.00 0.00 C ATOM 933 C VAL A 58 -3.995 -3.191 4.585 1.00 0.00 C ATOM 934 O VAL A 58 -4.227 -4.373 4.841 1.00 0.00 O ATOM 935 CB VAL A 58 -5.916 -1.802 3.755 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.606 -3.068 3.267 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.946 -0.746 4.123 1.00 0.00 C ATOM 0 H VAL A 58 -4.464 -0.077 4.819 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.607 -2.454 5.790 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.297 -1.420 2.943 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.248 -2.829 2.419 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.855 -3.796 2.960 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -7.210 -3.487 4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.587 -0.548 3.264 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.554 -1.105 4.954 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.437 0.172 4.416 1.00 0.00 H new ATOM 947 N ALA A 59 -2.871 -2.786 3.997 1.00 0.00 N ATOM 948 CA ALA A 59 -1.837 -3.727 3.581 1.00 0.00 C ATOM 949 C ALA A 59 -1.290 -4.513 4.768 1.00 0.00 C ATOM 950 O ALA A 59 -0.900 -5.671 4.625 1.00 0.00 O ATOM 951 CB ALA A 59 -0.705 -3.002 2.873 1.00 0.00 C ATOM 0 H ALA A 59 -2.654 -1.809 3.798 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.295 -4.432 2.887 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.056 -3.722 2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.094 -2.494 1.991 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.263 -2.269 3.549 1.00 0.00 H new ATOM 957 N LYS A 60 -1.253 -3.871 5.929 1.00 0.00 N ATOM 958 CA LYS A 60 -0.795 -4.524 7.150 1.00 0.00 C ATOM 959 C LYS A 60 -1.960 -5.097 7.945 1.00 0.00 C ATOM 960 O LYS A 60 -1.799 -6.077 8.678 1.00 0.00 O ATOM 961 CB LYS A 60 -0.076 -3.523 8.051 1.00 0.00 C ATOM 962 CG LYS A 60 1.295 -3.090 7.576 1.00 0.00 C ATOM 963 CD LYS A 60 1.843 -2.007 8.486 1.00 0.00 C ATOM 964 CE LYS A 60 3.347 -1.895 8.386 1.00 0.00 C ATOM 965 NZ LYS A 60 3.799 -1.497 7.030 1.00 0.00 N ATOM 0 H LYS A 60 -1.535 -2.898 6.051 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.123 -5.327 6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.703 -2.637 8.154 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.024 -3.960 9.044 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.972 -3.944 7.566 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.234 -2.720 6.553 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.390 -1.050 8.226 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.563 -2.223 9.517 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.703 -1.165 9.113 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.798 -2.852 8.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.753 -1.874 6.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.142 -1.878 6.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.819 -0.459 6.961 1.00 0.00 H new ATOM 979 N SER A 61 -3.131 -4.489 7.774 1.00 0.00 N ATOM 980 CA SER A 61 -4.247 -4.699 8.683 1.00 0.00 C ATOM 981 C SER A 61 -3.756 -4.472 10.118 1.00 0.00 C ATOM 982 O SER A 61 -3.403 -3.346 10.475 1.00 0.00 O ATOM 983 CB SER A 61 -4.846 -6.097 8.495 1.00 0.00 C ATOM 984 OG SER A 61 -5.240 -6.296 7.149 1.00 0.00 O ATOM 0 H SER A 61 -3.329 -3.844 7.009 1.00 0.00 H new ATOM 0 HA SER A 61 -5.045 -3.989 8.467 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.114 -6.853 8.781 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.706 -6.221 9.153 1.00 0.00 H new ATOM 0 HG SER A 61 -5.618 -7.194 7.048 1.00 0.00 H new ATOM 990 N GLU A 62 -3.706 -5.535 10.915 1.00 0.00 N ATOM 991 CA GLU A 62 -3.028 -5.507 12.207 1.00 0.00 C ATOM 992 C GLU A 62 -2.997 -6.904 12.817 1.00 0.00 C ATOM 993 O GLU A 62 -4.012 -7.416 13.286 1.00 0.00 O ATOM 994 CB GLU A 62 -3.658 -4.494 13.179 1.00 0.00 C ATOM 995 CG GLU A 62 -5.124 -4.729 13.502 1.00 0.00 C ATOM 996 CD GLU A 62 -5.651 -3.721 14.501 1.00 0.00 C ATOM 997 OE1 GLU A 62 -4.919 -3.385 15.460 1.00 0.00 O ATOM 998 OE2 GLU A 62 -6.797 -3.257 14.341 1.00 0.00 O ATOM 0 H GLU A 62 -4.131 -6.434 10.686 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.005 -5.175 12.031 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.091 -4.508 14.110 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.552 -3.495 12.756 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.711 -4.673 12.585 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.251 -5.736 13.901 1.00 0.00 H new ATOM 1005 N LEU A 63 -1.824 -7.533 12.758 1.00 0.00 N ATOM 1006 CA LEU A 63 -1.614 -8.866 13.325 1.00 0.00 C ATOM 1007 C LEU A 63 -2.588 -9.888 12.722 1.00 0.00 C ATOM 1008 O LEU A 63 -2.874 -10.922 13.322 1.00 0.00 O ATOM 1009 CB LEU A 63 -1.763 -8.809 14.855 1.00 0.00 C ATOM 1010 CG LEU A 63 -1.296 -10.056 15.613 1.00 0.00 C ATOM 1011 CD1 LEU A 63 0.197 -10.274 15.413 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -1.626 -9.931 17.093 1.00 0.00 C ATOM 0 H LEU A 63 -0.994 -7.135 12.318 1.00 0.00 H new ATOM 0 HA LEU A 63 -0.604 -9.192 13.077 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -1.203 -7.950 15.225 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.812 -8.632 15.094 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.824 -10.922 15.214 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.511 -11.164 15.958 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.406 -10.406 14.352 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.744 -9.408 15.786 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.288 -10.825 17.618 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.123 -9.056 17.505 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.703 -9.823 17.218 1.00 0.00 H new ATOM 1024 N TYR A 64 -3.061 -9.620 11.510 1.00 0.00 N ATOM 1025 CA TYR A 64 -4.033 -10.492 10.854 1.00 0.00 C ATOM 1026 C TYR A 64 -3.305 -11.555 10.031 1.00 0.00 C ATOM 1027 O TYR A 64 -3.797 -12.028 9.008 1.00 0.00 O ATOM 1028 CB TYR A 64 -4.958 -9.660 9.961 1.00 0.00 C ATOM 1029 CG TYR A 64 -6.380 -10.178 9.899 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -7.269 -9.927 10.935 1.00 0.00 C ATOM 1031 CD2 TYR A 64 -6.838 -10.902 8.804 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -8.572 -10.382 10.886 1.00 0.00 C ATOM 1033 CE2 TYR A 64 -8.141 -11.363 8.748 1.00 0.00 C ATOM 1034 CZ TYR A 64 -9.004 -11.098 9.792 1.00 0.00 C ATOM 1035 OH TYR A 64 -10.306 -11.549 9.741 1.00 0.00 O ATOM 0 H TYR A 64 -2.788 -8.806 10.960 1.00 0.00 H new ATOM 0 HA TYR A 64 -4.637 -10.992 11.611 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.971 -8.633 10.326 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -4.547 -9.635 8.952 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -6.936 -9.366 11.795 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -6.166 -11.108 7.984 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -9.249 -10.177 11.702 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -8.481 -11.927 7.892 1.00 0.00 H new ATOM 0 HH TYR A 64 -10.451 -12.036 8.903 1.00 0.00 H new ATOM 1045 N LYS A 65 -2.140 -11.957 10.525 1.00 0.00 N ATOM 1046 CA LYS A 65 -1.259 -12.890 9.826 1.00 0.00 C ATOM 1047 C LYS A 65 -1.741 -14.333 9.972 1.00 0.00 C ATOM 1048 O LYS A 65 -1.043 -15.271 9.581 1.00 0.00 O ATOM 1049 CB LYS A 65 0.159 -12.774 10.393 1.00 0.00 C ATOM 1050 CG LYS A 65 0.226 -13.067 11.883 1.00 0.00 C ATOM 1051 CD LYS A 65 1.656 -13.162 12.379 1.00 0.00 C ATOM 1052 CE LYS A 65 1.700 -13.535 13.851 1.00 0.00 C ATOM 1053 NZ LYS A 65 3.085 -13.787 14.319 1.00 0.00 N ATOM 0 H LYS A 65 -1.777 -11.645 11.425 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.267 -12.632 8.767 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.815 -13.464 9.862 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.538 -11.769 10.208 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.296 -12.283 12.431 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.293 -14.002 12.092 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.198 -13.906 11.796 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.161 -12.208 12.227 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.258 -12.733 14.442 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.093 -14.425 14.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.070 -14.038 15.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.499 -14.570 13.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.658 -12.930 14.184 1.00 0.00 H new ATOM 1185 N PHE A 73 5.335 -19.592 1.559 1.00 0.00 N ATOM 1186 CA PHE A 73 6.709 -19.188 1.816 1.00 0.00 C ATOM 1187 C PHE A 73 6.819 -17.675 1.731 1.00 0.00 C ATOM 1188 O PHE A 73 5.969 -17.025 1.118 1.00 0.00 O ATOM 1189 CB PHE A 73 7.675 -19.847 0.824 1.00 0.00 C ATOM 1190 CG PHE A 73 8.024 -21.263 1.175 1.00 0.00 C ATOM 1191 CD1 PHE A 73 7.239 -22.316 0.738 1.00 0.00 C ATOM 1192 CD2 PHE A 73 9.140 -21.540 1.945 1.00 0.00 C ATOM 1193 CE1 PHE A 73 7.560 -23.618 1.064 1.00 0.00 C ATOM 1194 CE2 PHE A 73 9.466 -22.841 2.274 1.00 0.00 C ATOM 1195 CZ PHE A 73 8.675 -23.881 1.833 1.00 0.00 C ATOM 0 HA PHE A 73 6.985 -19.517 2.818 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.230 -19.827 -0.171 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.591 -19.257 0.775 1.00 0.00 H new ATOM 0 HD1 PHE A 73 6.365 -22.116 0.135 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.763 -20.729 2.293 1.00 0.00 H new ATOM 0 HE1 PHE A 73 6.939 -24.431 0.717 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.339 -23.044 2.876 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.928 -24.899 2.089 1.00 0.00 H new ATOM 1205 N GLN A 74 7.864 -17.123 2.334 1.00 0.00 N ATOM 1206 CA GLN A 74 8.043 -15.673 2.393 1.00 0.00 C ATOM 1207 C GLN A 74 8.077 -15.047 1.005 1.00 0.00 C ATOM 1208 O GLN A 74 7.538 -13.962 0.798 1.00 0.00 O ATOM 1209 CB GLN A 74 9.316 -15.323 3.163 1.00 0.00 C ATOM 1210 CG GLN A 74 9.215 -15.628 4.644 1.00 0.00 C ATOM 1211 CD GLN A 74 8.112 -14.838 5.326 1.00 0.00 C ATOM 1212 OE1 GLN A 74 7.798 -13.716 4.930 1.00 0.00 O ATOM 1213 NE2 GLN A 74 7.515 -15.422 6.352 1.00 0.00 N ATOM 0 H GLN A 74 8.604 -17.657 2.791 1.00 0.00 H new ATOM 0 HA GLN A 74 7.182 -15.260 2.919 1.00 0.00 H new ATOM 0 HB2 GLN A 74 10.154 -15.877 2.740 1.00 0.00 H new ATOM 0 HB3 GLN A 74 9.535 -14.264 3.030 1.00 0.00 H new ATOM 0 HG2 GLN A 74 9.032 -16.694 4.781 1.00 0.00 H new ATOM 0 HG3 GLN A 74 10.168 -15.404 5.124 1.00 0.00 H new ATOM 0 HE21 GLN A 74 7.806 -16.354 6.648 1.00 0.00 H new ATOM 0 HE22 GLN A 74 6.764 -14.941 6.847 1.00 0.00 H new ATOM 1222 N THR A 75 8.689 -15.740 0.054 1.00 0.00 N ATOM 1223 CA THR A 75 8.765 -15.251 -1.316 1.00 0.00 C ATOM 1224 C THR A 75 7.365 -15.110 -1.923 1.00 0.00 C ATOM 1225 O THR A 75 7.074 -14.142 -2.628 1.00 0.00 O ATOM 1226 CB THR A 75 9.617 -16.191 -2.185 1.00 0.00 C ATOM 1227 OG1 THR A 75 9.144 -17.539 -2.053 1.00 0.00 O ATOM 1228 CG2 THR A 75 11.082 -16.122 -1.786 1.00 0.00 C ATOM 0 H THR A 75 9.140 -16.642 0.206 1.00 0.00 H new ATOM 0 HA THR A 75 9.238 -14.269 -1.292 1.00 0.00 H new ATOM 0 HB THR A 75 9.527 -15.872 -3.223 1.00 0.00 H new ATOM 0 HG1 THR A 75 9.689 -18.133 -2.610 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.663 -16.796 -2.416 1.00 0.00 H new ATOM 0 HG22 THR A 75 11.446 -15.103 -1.913 1.00 0.00 H new ATOM 0 HG23 THR A 75 11.189 -16.418 -0.742 1.00 0.00 H new ATOM 1236 N ARG A 76 6.500 -16.075 -1.612 1.00 0.00 N ATOM 1237 CA ARG A 76 5.109 -16.060 -2.063 1.00 0.00 C ATOM 1238 C ARG A 76 4.389 -14.854 -1.462 1.00 0.00 C ATOM 1239 O ARG A 76 3.560 -14.220 -2.113 1.00 0.00 O ATOM 1240 CB ARG A 76 4.410 -17.358 -1.629 1.00 0.00 C ATOM 1241 CG ARG A 76 3.541 -18.023 -2.696 1.00 0.00 C ATOM 1242 CD ARG A 76 2.341 -17.174 -3.092 1.00 0.00 C ATOM 1243 NE ARG A 76 2.589 -16.389 -4.300 1.00 0.00 N ATOM 1244 CZ ARG A 76 1.630 -15.795 -5.015 1.00 0.00 C ATOM 1245 NH1 ARG A 76 0.355 -15.915 -4.661 1.00 0.00 N ATOM 1246 NH2 ARG A 76 1.943 -15.101 -6.096 1.00 0.00 N ATOM 0 H ARG A 76 6.742 -16.886 -1.043 1.00 0.00 H new ATOM 0 HA ARG A 76 5.081 -15.988 -3.150 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.170 -18.070 -1.308 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.788 -17.143 -0.760 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.147 -18.222 -3.580 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.192 -18.987 -2.325 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.479 -17.821 -3.253 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.087 -16.503 -2.271 1.00 0.00 H new ATOM 0 HE ARG A 76 3.554 -16.289 -4.616 1.00 0.00 H new ATOM 0 HH11 ARG A 76 0.104 -16.463 -3.839 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -0.372 -15.459 -5.212 1.00 0.00 H new ATOM 0 HH21 ARG A 76 2.918 -15.019 -6.385 1.00 0.00 H new ATOM 0 HH22 ARG A 76 1.210 -14.648 -6.641 1.00 0.00 H new ATOM 1260 N VAL A 77 4.730 -14.540 -0.217 1.00 0.00 N ATOM 1261 CA VAL A 77 4.148 -13.401 0.483 1.00 0.00 C ATOM 1262 C VAL A 77 4.610 -12.090 -0.150 1.00 0.00 C ATOM 1263 O VAL A 77 3.830 -11.146 -0.278 1.00 0.00 O ATOM 1264 CB VAL A 77 4.517 -13.408 1.986 1.00 0.00 C ATOM 1265 CG1 VAL A 77 3.860 -12.243 2.713 1.00 0.00 C ATOM 1266 CG2 VAL A 77 4.120 -14.729 2.628 1.00 0.00 C ATOM 0 H VAL A 77 5.412 -15.063 0.332 1.00 0.00 H new ATOM 0 HA VAL A 77 3.065 -13.485 0.395 1.00 0.00 H new ATOM 0 HB VAL A 77 5.598 -13.294 2.069 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.135 -12.270 3.767 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.197 -11.304 2.274 1.00 0.00 H new ATOM 0 HG13 VAL A 77 2.777 -12.319 2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 77 4.387 -14.715 3.685 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.044 -14.873 2.528 1.00 0.00 H new ATOM 0 HG23 VAL A 77 4.644 -15.546 2.132 1.00 0.00 H new ATOM 1276 N ILE A 78 5.878 -12.048 -0.555 1.00 0.00 N ATOM 1277 CA ILE A 78 6.431 -10.887 -1.251 1.00 0.00 C ATOM 1278 C ILE A 78 5.666 -10.634 -2.549 1.00 0.00 C ATOM 1279 O ILE A 78 5.393 -9.491 -2.918 1.00 0.00 O ATOM 1280 CB ILE A 78 7.933 -11.082 -1.567 1.00 0.00 C ATOM 1281 CG1 ILE A 78 8.726 -11.278 -0.273 1.00 0.00 C ATOM 1282 CG2 ILE A 78 8.480 -9.892 -2.350 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.196 -11.563 -0.495 1.00 0.00 C ATOM 0 H ILE A 78 6.544 -12.807 -0.413 1.00 0.00 H new ATOM 0 HA ILE A 78 6.326 -10.026 -0.591 1.00 0.00 H new ATOM 0 HB ILE A 78 8.041 -11.975 -2.183 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.628 -10.383 0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 78 8.287 -12.101 0.290 1.00 0.00 H new ATOM 0 HG21 ILE A 78 9.538 -10.051 -2.561 1.00 0.00 H new ATOM 0 HG22 ILE A 78 7.934 -9.791 -3.288 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.360 -8.983 -1.761 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.691 -11.690 0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.305 -12.475 -1.082 1.00 0.00 H new ATOM 0 HD13 ILE A 78 10.651 -10.730 -1.030 1.00 0.00 H new ATOM 1295 N GLU A 79 5.314 -11.711 -3.237 1.00 0.00 N ATOM 1296 CA GLU A 79 4.502 -11.609 -4.437 1.00 0.00 C ATOM 1297 C GLU A 79 3.132 -11.033 -4.101 1.00 0.00 C ATOM 1298 O GLU A 79 2.596 -10.211 -4.837 1.00 0.00 O ATOM 1299 CB GLU A 79 4.335 -12.976 -5.091 1.00 0.00 C ATOM 1300 CG GLU A 79 5.632 -13.581 -5.600 1.00 0.00 C ATOM 1301 CD GLU A 79 5.417 -14.950 -6.202 1.00 0.00 C ATOM 1302 OE1 GLU A 79 4.444 -15.115 -6.964 1.00 0.00 O ATOM 1303 OE2 GLU A 79 6.202 -15.873 -5.905 1.00 0.00 O ATOM 0 H GLU A 79 5.578 -12.663 -2.984 1.00 0.00 H new ATOM 0 HA GLU A 79 5.010 -10.944 -5.135 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.886 -13.659 -4.370 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.637 -12.886 -5.923 1.00 0.00 H new ATOM 0 HG2 GLU A 79 6.072 -12.921 -6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 79 6.346 -13.653 -4.779 1.00 0.00 H new ATOM 1310 N LEU A 80 2.585 -11.467 -2.971 1.00 0.00 N ATOM 1311 CA LEU A 80 1.265 -11.033 -2.529 1.00 0.00 C ATOM 1312 C LEU A 80 1.244 -9.549 -2.174 1.00 0.00 C ATOM 1313 O LEU A 80 0.498 -8.768 -2.775 1.00 0.00 O ATOM 1314 CB LEU A 80 0.816 -11.855 -1.315 1.00 0.00 C ATOM 1315 CG LEU A 80 0.545 -13.334 -1.588 1.00 0.00 C ATOM 1316 CD1 LEU A 80 0.341 -14.089 -0.285 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -0.674 -13.493 -2.483 1.00 0.00 C ATOM 0 H LEU A 80 3.041 -12.125 -2.339 1.00 0.00 H new ATOM 0 HA LEU A 80 0.576 -11.193 -3.359 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.582 -11.780 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -0.090 -11.406 -0.909 1.00 0.00 H new ATOM 0 HG LEU A 80 1.412 -13.753 -2.099 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.149 -15.140 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.237 -14.002 0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.509 -13.667 0.251 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.854 -14.552 -2.668 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.545 -13.057 -1.993 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.499 -12.984 -3.431 1.00 0.00 H new ATOM 1329 N ASN A 81 2.075 -9.156 -1.211 1.00 0.00 N ATOM 1330 CA ASN A 81 2.007 -7.808 -0.661 1.00 0.00 C ATOM 1331 C ASN A 81 2.346 -6.744 -1.701 1.00 0.00 C ATOM 1332 O ASN A 81 1.702 -5.699 -1.739 1.00 0.00 O ATOM 1333 CB ASN A 81 2.879 -7.653 0.606 1.00 0.00 C ATOM 1334 CG ASN A 81 4.342 -8.041 0.433 1.00 0.00 C ATOM 1335 OD1 ASN A 81 4.899 -7.973 -0.654 1.00 0.00 O ATOM 1336 ND2 ASN A 81 4.980 -8.444 1.523 1.00 0.00 N ATOM 0 H ASN A 81 2.797 -9.748 -0.800 1.00 0.00 H new ATOM 0 HA ASN A 81 0.971 -7.650 -0.363 1.00 0.00 H new ATOM 0 HB2 ASN A 81 2.831 -6.616 0.937 1.00 0.00 H new ATOM 0 HB3 ASN A 81 2.449 -8.262 1.401 1.00 0.00 H new ATOM 0 HD21 ASN A 81 5.964 -8.708 1.470 1.00 0.00 H new ATOM 0 HD22 ASN A 81 4.487 -8.490 2.415 1.00 0.00 H new ATOM 1343 N TYR A 82 3.315 -7.009 -2.566 1.00 0.00 N ATOM 1344 CA TYR A 82 3.714 -6.024 -3.561 1.00 0.00 C ATOM 1345 C TYR A 82 2.781 -6.013 -4.762 1.00 0.00 C ATOM 1346 O TYR A 82 2.653 -4.994 -5.437 1.00 0.00 O ATOM 1347 CB TYR A 82 5.160 -6.232 -3.997 1.00 0.00 C ATOM 1348 CG TYR A 82 6.143 -5.719 -2.974 1.00 0.00 C ATOM 1349 CD1 TYR A 82 6.154 -4.376 -2.624 1.00 0.00 C ATOM 1350 CD2 TYR A 82 7.036 -6.571 -2.344 1.00 0.00 C ATOM 1351 CE1 TYR A 82 7.031 -3.892 -1.677 1.00 0.00 C ATOM 1352 CE2 TYR A 82 7.915 -6.097 -1.392 1.00 0.00 C ATOM 1353 CZ TYR A 82 7.911 -4.757 -1.064 1.00 0.00 C ATOM 1354 OH TYR A 82 8.786 -4.280 -0.117 1.00 0.00 O ATOM 0 H TYR A 82 3.834 -7.887 -2.600 1.00 0.00 H new ATOM 0 HA TYR A 82 3.640 -5.046 -3.085 1.00 0.00 H new ATOM 0 HB2 TYR A 82 5.337 -7.294 -4.168 1.00 0.00 H new ATOM 0 HB3 TYR A 82 5.328 -5.724 -4.947 1.00 0.00 H new ATOM 0 HD1 TYR A 82 5.463 -3.698 -3.102 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.044 -7.620 -2.602 1.00 0.00 H new ATOM 0 HE1 TYR A 82 7.028 -2.844 -1.418 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.603 -6.772 -0.906 1.00 0.00 H new ATOM 0 HH TYR A 82 8.289 -4.020 0.686 1.00 0.00 H new ATOM 1364 N LYS A 83 2.108 -7.125 -5.020 1.00 0.00 N ATOM 1365 CA LYS A 83 1.095 -7.147 -6.065 1.00 0.00 C ATOM 1366 C LYS A 83 -0.156 -6.428 -5.560 1.00 0.00 C ATOM 1367 O LYS A 83 -1.042 -6.067 -6.331 1.00 0.00 O ATOM 1368 CB LYS A 83 0.782 -8.588 -6.488 1.00 0.00 C ATOM 1369 CG LYS A 83 0.023 -8.690 -7.803 1.00 0.00 C ATOM 1370 CD LYS A 83 -0.016 -10.120 -8.328 1.00 0.00 C ATOM 1371 CE LYS A 83 1.385 -10.652 -8.603 1.00 0.00 C ATOM 1372 NZ LYS A 83 1.366 -12.050 -9.108 1.00 0.00 N ATOM 0 H LYS A 83 2.241 -8.010 -4.530 1.00 0.00 H new ATOM 0 HA LYS A 83 1.468 -6.628 -6.948 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.716 -9.143 -6.574 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.197 -9.068 -5.703 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.995 -8.327 -7.663 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.493 -8.044 -8.544 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -0.514 -10.762 -7.601 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.607 -10.157 -9.243 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.878 -10.011 -9.333 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.975 -10.606 -7.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.340 -12.370 -9.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.919 -12.668 -8.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.825 -12.091 -9.995 1.00 0.00 H new ATOM 1386 N HIS A 84 -0.203 -6.226 -4.248 1.00 0.00 N ATOM 1387 CA HIS A 84 -1.272 -5.460 -3.617 1.00 0.00 C ATOM 1388 C HIS A 84 -0.856 -3.993 -3.424 1.00 0.00 C ATOM 1389 O HIS A 84 -1.702 -3.106 -3.345 1.00 0.00 O ATOM 1390 CB HIS A 84 -1.632 -6.098 -2.268 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.771 -5.437 -1.548 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -2.804 -5.273 -0.177 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -3.931 -4.916 -2.012 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -3.932 -4.680 0.164 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -4.632 -4.452 -0.929 1.00 0.00 N ATOM 0 H HIS A 84 0.494 -6.586 -3.595 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.147 -5.476 -4.267 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -1.883 -7.146 -2.432 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -0.752 -6.077 -1.625 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -4.246 -4.874 -3.044 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -4.231 -4.424 1.170 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -5.547 -4.003 -0.964 1.00 0.00 H new ATOM 1404 N LEU A 85 0.450 -3.750 -3.338 1.00 0.00 N ATOM 1405 CA LEU A 85 0.968 -2.397 -3.111 1.00 0.00 C ATOM 1406 C LEU A 85 1.331 -1.703 -4.419 1.00 0.00 C ATOM 1407 O LEU A 85 0.931 -0.572 -4.663 1.00 0.00 O ATOM 1408 CB LEU A 85 2.198 -2.433 -2.198 1.00 0.00 C ATOM 1409 CG LEU A 85 1.931 -2.863 -0.755 1.00 0.00 C ATOM 1410 CD1 LEU A 85 3.236 -2.977 0.019 1.00 0.00 C ATOM 1411 CD2 LEU A 85 0.987 -1.883 -0.073 1.00 0.00 C ATOM 0 H LEU A 85 1.170 -4.468 -3.421 1.00 0.00 H new ATOM 0 HA LEU A 85 0.172 -1.829 -2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.932 -3.112 -2.632 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.650 -1.441 -2.186 1.00 0.00 H new ATOM 0 HG LEU A 85 1.456 -3.844 -0.770 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.026 -3.284 1.044 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.878 -3.718 -0.457 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.740 -2.011 0.026 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.808 -2.204 0.953 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.435 -0.889 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.041 -1.853 -0.614 1.00 0.00 H new ATOM 1423 N LEU A 86 2.109 -2.379 -5.248 1.00 0.00 N ATOM 1424 CA LEU A 86 2.527 -1.824 -6.528 1.00 0.00 C ATOM 1425 C LEU A 86 1.633 -2.348 -7.641 1.00 0.00 C ATOM 1426 O LEU A 86 1.575 -1.780 -8.733 1.00 0.00 O ATOM 1427 CB LEU A 86 3.983 -2.202 -6.822 1.00 0.00 C ATOM 1428 CG LEU A 86 5.016 -1.677 -5.823 1.00 0.00 C ATOM 1429 CD1 LEU A 86 6.387 -2.268 -6.115 1.00 0.00 C ATOM 1430 CD2 LEU A 86 5.078 -0.160 -5.867 1.00 0.00 C ATOM 0 H LEU A 86 2.466 -3.316 -5.058 1.00 0.00 H new ATOM 0 HA LEU A 86 2.443 -0.738 -6.478 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.058 -3.289 -6.857 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.243 -1.832 -7.814 1.00 0.00 H new ATOM 0 HG LEU A 86 4.710 -1.983 -4.822 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.110 -1.884 -5.395 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.339 -3.354 -6.037 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.696 -1.990 -7.123 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.818 0.195 -5.150 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.359 0.164 -6.869 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.101 0.252 -5.614 1.00 0.00 H new ATOM 1442 N GLY A 87 0.936 -3.436 -7.349 1.00 0.00 N ATOM 1443 CA GLY A 87 0.130 -4.091 -8.354 1.00 0.00 C ATOM 1444 C GLY A 87 0.975 -4.971 -9.252 1.00 0.00 C ATOM 1445 O GLY A 87 0.588 -5.280 -10.374 1.00 0.00 O ATOM 0 H GLY A 87 0.915 -3.877 -6.430 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -0.639 -4.694 -7.870 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -0.384 -3.342 -8.956 1.00 0.00 H new ATOM 1449 N ARG A 88 2.135 -5.372 -8.752 1.00 0.00 N ATOM 1450 CA ARG A 88 3.079 -6.141 -9.544 1.00 0.00 C ATOM 1451 C ARG A 88 3.942 -7.017 -8.643 1.00 0.00 C ATOM 1452 O ARG A 88 4.250 -6.640 -7.514 1.00 0.00 O ATOM 1453 CB ARG A 88 3.957 -5.187 -10.362 1.00 0.00 C ATOM 1454 CG ARG A 88 4.982 -5.886 -11.236 1.00 0.00 C ATOM 1455 CD ARG A 88 5.819 -4.885 -12.009 1.00 0.00 C ATOM 1456 NE ARG A 88 5.008 -4.085 -12.923 1.00 0.00 N ATOM 1457 CZ ARG A 88 5.474 -3.051 -13.618 1.00 0.00 C ATOM 1458 NH1 ARG A 88 6.719 -2.628 -13.434 1.00 0.00 N ATOM 1459 NH2 ARG A 88 4.684 -2.416 -14.471 1.00 0.00 N ATOM 0 H ARG A 88 2.444 -5.176 -7.800 1.00 0.00 H new ATOM 0 HA ARG A 88 2.528 -6.791 -10.223 1.00 0.00 H new ATOM 0 HB2 ARG A 88 3.316 -4.571 -10.993 1.00 0.00 H new ATOM 0 HB3 ARG A 88 4.476 -4.513 -9.680 1.00 0.00 H new ATOM 0 HG2 ARG A 88 5.631 -6.504 -10.616 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.475 -6.554 -11.932 1.00 0.00 H new ATOM 0 HD2 ARG A 88 6.334 -4.226 -11.310 1.00 0.00 H new ATOM 0 HD3 ARG A 88 6.587 -5.414 -12.574 1.00 0.00 H new ATOM 0 HE ARG A 88 4.025 -4.334 -13.035 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.322 -3.096 -12.758 1.00 0.00 H new ATOM 0 HH12 ARG A 88 7.072 -1.835 -13.969 1.00 0.00 H new ATOM 0 HH21 ARG A 88 3.718 -2.720 -14.595 1.00 0.00 H new ATOM 0 HH22 ARG A 88 5.041 -1.623 -15.004 1.00 0.00 H new ATOM 1473 N ALA A 89 4.302 -8.194 -9.136 1.00 0.00 N ATOM 1474 CA ALA A 89 5.200 -9.083 -8.417 1.00 0.00 C ATOM 1475 C ALA A 89 6.635 -8.564 -8.487 1.00 0.00 C ATOM 1476 O ALA A 89 6.954 -7.751 -9.356 1.00 0.00 O ATOM 1477 CB ALA A 89 5.112 -10.486 -8.999 1.00 0.00 C ATOM 0 H ALA A 89 3.984 -8.555 -10.035 1.00 0.00 H new ATOM 0 HA ALA A 89 4.900 -9.116 -7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.787 -11.148 -8.456 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.090 -10.855 -8.907 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.396 -10.462 -10.051 1.00 0.00 H new ATOM 1483 N PRO A 90 7.508 -9.014 -7.565 1.00 0.00 N ATOM 1484 CA PRO A 90 8.930 -8.647 -7.559 1.00 0.00 C ATOM 1485 C PRO A 90 9.588 -8.845 -8.925 1.00 0.00 C ATOM 1486 O PRO A 90 9.208 -9.740 -9.691 1.00 0.00 O ATOM 1487 CB PRO A 90 9.553 -9.589 -6.516 1.00 0.00 C ATOM 1488 CG PRO A 90 8.489 -10.580 -6.173 1.00 0.00 C ATOM 1489 CD PRO A 90 7.182 -9.896 -6.440 1.00 0.00 C ATOM 0 HA PRO A 90 9.071 -7.592 -7.326 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.436 -10.087 -6.917 1.00 0.00 H new ATOM 0 HB3 PRO A 90 9.872 -9.037 -5.632 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.587 -11.482 -6.777 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.563 -10.886 -5.129 1.00 0.00 H new ATOM 0 HD2 PRO A 90 6.397 -10.607 -6.697 1.00 0.00 H new ATOM 0 HD3 PRO A 90 6.833 -9.335 -5.573 1.00 0.00 H new ATOM 1497 N TYR A 91 10.584 -8.027 -9.214 1.00 0.00 N ATOM 1498 CA TYR A 91 11.179 -7.989 -10.541 1.00 0.00 C ATOM 1499 C TYR A 91 12.563 -8.631 -10.559 1.00 0.00 C ATOM 1500 O TYR A 91 12.908 -9.342 -11.503 1.00 0.00 O ATOM 1501 CB TYR A 91 11.257 -6.540 -11.031 1.00 0.00 C ATOM 1502 CG TYR A 91 11.919 -6.374 -12.383 1.00 0.00 C ATOM 1503 CD1 TYR A 91 11.260 -6.730 -13.554 1.00 0.00 C ATOM 1504 CD2 TYR A 91 13.203 -5.856 -12.485 1.00 0.00 C ATOM 1505 CE1 TYR A 91 11.864 -6.576 -14.789 1.00 0.00 C ATOM 1506 CE2 TYR A 91 13.814 -5.698 -13.714 1.00 0.00 C ATOM 1507 CZ TYR A 91 13.142 -6.059 -14.863 1.00 0.00 C ATOM 1508 OH TYR A 91 13.750 -5.903 -16.091 1.00 0.00 O ATOM 0 H TYR A 91 11.000 -7.378 -8.546 1.00 0.00 H new ATOM 0 HA TYR A 91 10.544 -8.567 -11.213 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.248 -6.131 -11.081 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.804 -5.949 -10.296 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.260 -7.134 -13.499 1.00 0.00 H new ATOM 0 HD2 TYR A 91 13.733 -5.572 -11.588 1.00 0.00 H new ATOM 0 HE1 TYR A 91 11.339 -6.858 -15.690 1.00 0.00 H new ATOM 0 HE2 TYR A 91 14.814 -5.294 -13.775 1.00 0.00 H new ATOM 0 HH TYR A 91 14.646 -5.526 -15.967 1.00 0.00 H new ATOM 1518 N ASP A 92 13.348 -8.397 -9.517 1.00 0.00 N ATOM 1519 CA ASP A 92 14.726 -8.867 -9.502 1.00 0.00 C ATOM 1520 C ASP A 92 15.013 -9.666 -8.238 1.00 0.00 C ATOM 1521 O ASP A 92 14.507 -9.348 -7.166 1.00 0.00 O ATOM 1522 CB ASP A 92 15.696 -7.689 -9.617 1.00 0.00 C ATOM 1523 CG ASP A 92 17.143 -8.133 -9.616 1.00 0.00 C ATOM 1524 OD1 ASP A 92 17.631 -8.600 -10.663 1.00 0.00 O ATOM 1525 OD2 ASP A 92 17.794 -8.027 -8.558 1.00 0.00 O ATOM 0 H ASP A 92 13.059 -7.891 -8.680 1.00 0.00 H new ATOM 0 HA ASP A 92 14.869 -9.522 -10.361 1.00 0.00 H new ATOM 0 HB2 ASP A 92 15.488 -7.138 -10.534 1.00 0.00 H new ATOM 0 HB3 ASP A 92 15.529 -7.001 -8.788 1.00 0.00 H new ATOM 1530 N GLU A 93 15.828 -10.702 -8.368 1.00 0.00 N ATOM 1531 CA GLU A 93 16.125 -11.590 -7.252 1.00 0.00 C ATOM 1532 C GLU A 93 16.836 -10.852 -6.119 1.00 0.00 C ATOM 1533 O GLU A 93 16.577 -11.110 -4.942 1.00 0.00 O ATOM 1534 CB GLU A 93 16.980 -12.758 -7.730 1.00 0.00 C ATOM 1535 CG GLU A 93 17.311 -13.763 -6.643 1.00 0.00 C ATOM 1536 CD GLU A 93 18.159 -14.903 -7.156 1.00 0.00 C ATOM 1537 OE1 GLU A 93 17.584 -15.906 -7.632 1.00 0.00 O ATOM 1538 OE2 GLU A 93 19.402 -14.799 -7.100 1.00 0.00 O ATOM 0 H GLU A 93 16.298 -10.950 -9.239 1.00 0.00 H new ATOM 0 HA GLU A 93 15.179 -11.966 -6.863 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.458 -13.270 -8.538 1.00 0.00 H new ATOM 0 HB3 GLU A 93 17.909 -12.369 -8.146 1.00 0.00 H new ATOM 0 HG2 GLU A 93 17.836 -13.258 -5.832 1.00 0.00 H new ATOM 0 HG3 GLU A 93 16.386 -14.160 -6.225 1.00 0.00 H new ATOM 1545 N SER A 94 17.709 -9.922 -6.474 1.00 0.00 N ATOM 1546 CA SER A 94 18.516 -9.219 -5.490 1.00 0.00 C ATOM 1547 C SER A 94 17.643 -8.352 -4.586 1.00 0.00 C ATOM 1548 O SER A 94 17.871 -8.273 -3.375 1.00 0.00 O ATOM 1549 CB SER A 94 19.573 -8.370 -6.193 1.00 0.00 C ATOM 1550 OG SER A 94 20.246 -9.132 -7.183 1.00 0.00 O ATOM 0 H SER A 94 17.877 -9.636 -7.439 1.00 0.00 H new ATOM 0 HA SER A 94 19.017 -9.956 -4.862 1.00 0.00 H new ATOM 0 HB2 SER A 94 19.103 -7.501 -6.652 1.00 0.00 H new ATOM 0 HB3 SER A 94 20.291 -7.996 -5.463 1.00 0.00 H new ATOM 0 HG SER A 94 19.734 -9.108 -8.019 1.00 0.00 H new ATOM 1556 N GLU A 95 16.627 -7.718 -5.161 1.00 0.00 N ATOM 1557 CA GLU A 95 15.721 -6.903 -4.369 1.00 0.00 C ATOM 1558 C GLU A 95 14.770 -7.791 -3.573 1.00 0.00 C ATOM 1559 O GLU A 95 14.352 -7.426 -2.475 1.00 0.00 O ATOM 1560 CB GLU A 95 14.976 -5.872 -5.237 1.00 0.00 C ATOM 1561 CG GLU A 95 14.243 -6.438 -6.445 1.00 0.00 C ATOM 1562 CD GLU A 95 12.778 -6.736 -6.173 1.00 0.00 C ATOM 1563 OE1 GLU A 95 12.301 -6.437 -5.055 1.00 0.00 O ATOM 1564 OE2 GLU A 95 12.100 -7.258 -7.085 1.00 0.00 O ATOM 0 H GLU A 95 16.414 -7.753 -6.158 1.00 0.00 H new ATOM 0 HA GLU A 95 16.310 -6.327 -3.655 1.00 0.00 H new ATOM 0 HB2 GLU A 95 14.255 -5.348 -4.609 1.00 0.00 H new ATOM 0 HB3 GLU A 95 15.694 -5.130 -5.585 1.00 0.00 H new ATOM 0 HG2 GLU A 95 14.315 -5.730 -7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 95 14.739 -7.354 -6.766 1.00 0.00 H new ATOM 1571 N VAL A 96 14.464 -8.977 -4.103 1.00 0.00 N ATOM 1572 CA VAL A 96 13.697 -9.972 -3.354 1.00 0.00 C ATOM 1573 C VAL A 96 14.444 -10.355 -2.078 1.00 0.00 C ATOM 1574 O VAL A 96 13.855 -10.431 -0.997 1.00 0.00 O ATOM 1575 CB VAL A 96 13.427 -11.250 -4.187 1.00 0.00 C ATOM 1576 CG1 VAL A 96 12.729 -12.312 -3.346 1.00 0.00 C ATOM 1577 CG2 VAL A 96 12.598 -10.929 -5.419 1.00 0.00 C ATOM 0 H VAL A 96 14.734 -9.270 -5.042 1.00 0.00 H new ATOM 0 HA VAL A 96 12.736 -9.519 -3.109 1.00 0.00 H new ATOM 0 HB VAL A 96 14.390 -11.644 -4.511 1.00 0.00 H new ATOM 0 HG11 VAL A 96 12.551 -13.199 -3.954 1.00 0.00 H new ATOM 0 HG12 VAL A 96 13.359 -12.575 -2.496 1.00 0.00 H new ATOM 0 HG13 VAL A 96 11.777 -11.923 -2.985 1.00 0.00 H new ATOM 0 HG21 VAL A 96 12.422 -11.842 -5.987 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.643 -10.502 -5.114 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.134 -10.212 -6.041 1.00 0.00 H new ATOM 1587 N ILE A 97 15.748 -10.577 -2.214 1.00 0.00 N ATOM 1588 CA ILE A 97 16.603 -10.890 -1.075 1.00 0.00 C ATOM 1589 C ILE A 97 16.557 -9.759 -0.050 1.00 0.00 C ATOM 1590 O ILE A 97 16.565 -9.999 1.158 1.00 0.00 O ATOM 1591 CB ILE A 97 18.067 -11.131 -1.508 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.148 -12.270 -2.532 1.00 0.00 C ATOM 1593 CG2 ILE A 97 18.945 -11.432 -0.301 1.00 0.00 C ATOM 1594 CD1 ILE A 97 17.577 -13.584 -2.042 1.00 0.00 C ATOM 0 H ILE A 97 16.238 -10.545 -3.108 1.00 0.00 H new ATOM 0 HA ILE A 97 16.223 -11.808 -0.627 1.00 0.00 H new ATOM 0 HB ILE A 97 18.436 -10.220 -1.979 1.00 0.00 H new ATOM 0 HG12 ILE A 97 17.617 -11.970 -3.436 1.00 0.00 H new ATOM 0 HG13 ILE A 97 19.191 -12.421 -2.810 1.00 0.00 H new ATOM 0 HG21 ILE A 97 19.971 -11.598 -0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 97 18.917 -10.588 0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 97 18.576 -12.325 0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 97 17.673 -14.337 -2.825 1.00 0.00 H new ATOM 0 HD12 ILE A 97 18.122 -13.910 -1.156 1.00 0.00 H new ATOM 0 HD13 ILE A 97 16.524 -13.453 -1.792 1.00 0.00 H new ATOM 1606 N PHE A 98 16.486 -8.527 -0.543 1.00 0.00 N ATOM 1607 CA PHE A 98 16.377 -7.357 0.320 1.00 0.00 C ATOM 1608 C PHE A 98 15.128 -7.441 1.198 1.00 0.00 C ATOM 1609 O PHE A 98 15.179 -7.125 2.384 1.00 0.00 O ATOM 1610 CB PHE A 98 16.353 -6.076 -0.520 1.00 0.00 C ATOM 1611 CG PHE A 98 16.100 -4.826 0.276 1.00 0.00 C ATOM 1612 CD1 PHE A 98 17.106 -4.265 1.045 1.00 0.00 C ATOM 1613 CD2 PHE A 98 14.859 -4.209 0.246 1.00 0.00 C ATOM 1614 CE1 PHE A 98 16.879 -3.112 1.769 1.00 0.00 C ATOM 1615 CE2 PHE A 98 14.626 -3.056 0.970 1.00 0.00 C ATOM 1616 CZ PHE A 98 15.637 -2.506 1.732 1.00 0.00 C ATOM 0 H PHE A 98 16.502 -8.313 -1.540 1.00 0.00 H new ATOM 0 HA PHE A 98 17.250 -7.332 0.972 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.306 -5.977 -1.039 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.582 -6.170 -1.284 1.00 0.00 H new ATOM 0 HD1 PHE A 98 18.078 -4.735 1.079 1.00 0.00 H new ATOM 0 HD2 PHE A 98 14.065 -4.635 -0.350 1.00 0.00 H new ATOM 0 HE1 PHE A 98 17.672 -2.683 2.364 1.00 0.00 H new ATOM 0 HE2 PHE A 98 13.654 -2.586 0.940 1.00 0.00 H new ATOM 0 HZ PHE A 98 15.458 -1.604 2.298 1.00 0.00 H new ATOM 1626 N HIS A 99 14.019 -7.889 0.615 1.00 0.00 N ATOM 1627 CA HIS A 99 12.763 -8.011 1.359 1.00 0.00 C ATOM 1628 C HIS A 99 12.898 -9.062 2.450 1.00 0.00 C ATOM 1629 O HIS A 99 12.458 -8.859 3.578 1.00 0.00 O ATOM 1630 CB HIS A 99 11.596 -8.373 0.433 1.00 0.00 C ATOM 1631 CG HIS A 99 11.410 -7.412 -0.695 1.00 0.00 C ATOM 1632 ND1 HIS A 99 11.172 -6.073 -0.508 1.00 0.00 N ATOM 1633 CD2 HIS A 99 11.493 -7.595 -2.032 1.00 0.00 C ATOM 1634 CE1 HIS A 99 11.126 -5.469 -1.683 1.00 0.00 C ATOM 1635 NE2 HIS A 99 11.319 -6.373 -2.627 1.00 0.00 N ATOM 0 H HIS A 99 13.961 -8.172 -0.363 1.00 0.00 H new ATOM 0 HA HIS A 99 12.551 -7.042 1.812 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.761 -9.371 0.026 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.678 -8.416 1.019 1.00 0.00 H new ATOM 0 HD2 HIS A 99 11.665 -8.533 -2.539 1.00 0.00 H new ATOM 0 HE1 HIS A 99 10.959 -4.414 -1.844 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.336 -6.192 -3.631 1.00 0.00 H new ATOM 1644 N LEU A 100 13.530 -10.179 2.107 1.00 0.00 N ATOM 1645 CA LEU A 100 13.771 -11.249 3.069 1.00 0.00 C ATOM 1646 C LEU A 100 14.655 -10.750 4.208 1.00 0.00 C ATOM 1647 O LEU A 100 14.403 -11.032 5.379 1.00 0.00 O ATOM 1648 CB LEU A 100 14.432 -12.443 2.378 1.00 0.00 C ATOM 1649 CG LEU A 100 13.611 -13.080 1.254 1.00 0.00 C ATOM 1650 CD1 LEU A 100 14.404 -14.176 0.561 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.303 -13.637 1.800 1.00 0.00 C ATOM 0 H LEU A 100 13.885 -10.367 1.170 1.00 0.00 H new ATOM 0 HA LEU A 100 12.813 -11.566 3.482 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.390 -12.122 1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 100 14.645 -13.205 3.128 1.00 0.00 H new ATOM 0 HG LEU A 100 13.382 -12.307 0.520 1.00 0.00 H new ATOM 0 HD11 LEU A 100 13.801 -14.614 -0.234 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.314 -13.753 0.135 1.00 0.00 H new ATOM 0 HD13 LEU A 100 14.667 -14.948 1.284 1.00 0.00 H new ATOM 0 HD21 LEU A 100 11.732 -14.086 0.988 1.00 0.00 H new ATOM 0 HD22 LEU A 100 12.517 -14.394 2.555 1.00 0.00 H new ATOM 0 HD23 LEU A 100 11.723 -12.830 2.249 1.00 0.00 H new ATOM 1663 N ASP A 101 15.684 -9.995 3.846 1.00 0.00 N ATOM 1664 CA ASP A 101 16.599 -9.411 4.819 1.00 0.00 C ATOM 1665 C ASP A 101 15.873 -8.425 5.731 1.00 0.00 C ATOM 1666 O ASP A 101 16.026 -8.467 6.951 1.00 0.00 O ATOM 1667 CB ASP A 101 17.749 -8.706 4.099 1.00 0.00 C ATOM 1668 CG ASP A 101 18.637 -7.920 5.045 1.00 0.00 C ATOM 1669 OD1 ASP A 101 19.414 -8.542 5.799 1.00 0.00 O ATOM 1670 OD2 ASP A 101 18.565 -6.676 5.028 1.00 0.00 O ATOM 0 H ASP A 101 15.907 -9.771 2.876 1.00 0.00 H new ATOM 0 HA ASP A 101 16.999 -10.216 5.436 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.351 -9.447 3.573 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.342 -8.032 3.345 1.00 0.00 H new ATOM 1675 N LEU A 102 15.075 -7.550 5.133 1.00 0.00 N ATOM 1676 CA LEU A 102 14.328 -6.548 5.885 1.00 0.00 C ATOM 1677 C LEU A 102 13.277 -7.217 6.772 1.00 0.00 C ATOM 1678 O LEU A 102 13.016 -6.770 7.893 1.00 0.00 O ATOM 1679 CB LEU A 102 13.674 -5.550 4.918 1.00 0.00 C ATOM 1680 CG LEU A 102 12.990 -4.342 5.568 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.949 -3.623 6.504 1.00 0.00 C ATOM 1682 CD2 LEU A 102 12.494 -3.382 4.496 1.00 0.00 C ATOM 0 H LEU A 102 14.927 -7.513 4.124 1.00 0.00 H new ATOM 0 HA LEU A 102 15.016 -6.004 6.532 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.438 -5.185 4.231 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.935 -6.083 4.320 1.00 0.00 H new ATOM 0 HG LEU A 102 12.140 -4.699 6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 102 13.445 -2.769 6.955 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.275 -4.308 7.287 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.816 -3.277 5.941 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.010 -2.527 4.969 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.338 -3.036 3.899 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.779 -3.894 3.852 1.00 0.00 H new ATOM 1694 N TYR A 103 12.698 -8.306 6.273 1.00 0.00 N ATOM 1695 CA TYR A 103 11.726 -9.089 7.030 1.00 0.00 C ATOM 1696 C TYR A 103 12.369 -9.695 8.274 1.00 0.00 C ATOM 1697 O TYR A 103 11.765 -9.734 9.344 1.00 0.00 O ATOM 1698 CB TYR A 103 11.140 -10.199 6.151 1.00 0.00 C ATOM 1699 CG TYR A 103 10.127 -11.077 6.853 1.00 0.00 C ATOM 1700 CD1 TYR A 103 8.801 -10.684 6.963 1.00 0.00 C ATOM 1701 CD2 TYR A 103 10.494 -12.300 7.404 1.00 0.00 C ATOM 1702 CE1 TYR A 103 7.868 -11.478 7.601 1.00 0.00 C ATOM 1703 CE2 TYR A 103 9.565 -13.102 8.044 1.00 0.00 C ATOM 1704 CZ TYR A 103 8.253 -12.684 8.140 1.00 0.00 C ATOM 1705 OH TYR A 103 7.322 -13.476 8.772 1.00 0.00 O ATOM 0 H TYR A 103 12.888 -8.669 5.339 1.00 0.00 H new ATOM 0 HA TYR A 103 10.923 -8.423 7.345 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.669 -9.746 5.279 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.954 -10.824 5.784 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.492 -9.739 6.542 1.00 0.00 H new ATOM 0 HD2 TYR A 103 11.520 -12.629 7.331 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.841 -11.154 7.676 1.00 0.00 H new ATOM 0 HE2 TYR A 103 9.865 -14.050 8.466 1.00 0.00 H new ATOM 0 HH TYR A 103 7.754 -14.294 9.096 1.00 0.00 H new ATOM 1715 N GLU A 104 13.600 -10.164 8.128 1.00 0.00 N ATOM 1716 CA GLU A 104 14.309 -10.791 9.234 1.00 0.00 C ATOM 1717 C GLU A 104 14.974 -9.749 10.130 1.00 0.00 C ATOM 1718 O GLU A 104 15.334 -10.039 11.268 1.00 0.00 O ATOM 1719 CB GLU A 104 15.334 -11.797 8.711 1.00 0.00 C ATOM 1720 CG GLU A 104 14.687 -12.991 8.030 1.00 0.00 C ATOM 1721 CD GLU A 104 15.684 -14.037 7.578 1.00 0.00 C ATOM 1722 OE1 GLU A 104 16.787 -14.115 8.160 1.00 0.00 O ATOM 1723 OE2 GLU A 104 15.355 -14.808 6.653 1.00 0.00 O ATOM 0 H GLU A 104 14.128 -10.122 7.256 1.00 0.00 H new ATOM 0 HA GLU A 104 13.579 -11.327 9.841 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.000 -11.299 8.006 1.00 0.00 H new ATOM 0 HB3 GLU A 104 15.950 -12.146 9.540 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.976 -13.450 8.716 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.119 -12.644 7.167 1.00 0.00 H new ATOM 1730 N ASN A 105 15.139 -8.537 9.614 1.00 0.00 N ATOM 1731 CA ASN A 105 15.693 -7.443 10.408 1.00 0.00 C ATOM 1732 C ASN A 105 14.620 -6.787 11.262 1.00 0.00 C ATOM 1733 O ASN A 105 14.730 -6.748 12.488 1.00 0.00 O ATOM 1734 CB ASN A 105 16.336 -6.381 9.517 1.00 0.00 C ATOM 1735 CG ASN A 105 17.828 -6.577 9.354 1.00 0.00 C ATOM 1736 OD1 ASN A 105 18.619 -6.084 10.158 1.00 0.00 O ATOM 1737 ND2 ASN A 105 18.227 -7.287 8.316 1.00 0.00 N ATOM 0 H ASN A 105 14.899 -8.286 8.655 1.00 0.00 H new ATOM 0 HA ASN A 105 16.455 -7.876 11.056 1.00 0.00 H new ATOM 0 HB2 ASN A 105 15.862 -6.401 8.536 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.148 -5.395 9.941 1.00 0.00 H new ATOM 0 HD21 ASN A 105 19.222 -7.444 8.158 1.00 0.00 H new ATOM 0 HD22 ASN A 105 17.540 -7.679 7.672 1.00 0.00 H new ATOM 1744 N GLU A 106 13.579 -6.286 10.613 1.00 0.00 N ATOM 1745 CA GLU A 106 12.542 -5.531 11.304 1.00 0.00 C ATOM 1746 C GLU A 106 11.208 -6.266 11.278 1.00 0.00 C ATOM 1747 O GLU A 106 10.460 -6.238 12.255 1.00 0.00 O ATOM 1748 CB GLU A 106 12.379 -4.159 10.653 1.00 0.00 C ATOM 1749 CG GLU A 106 13.622 -3.290 10.728 1.00 0.00 C ATOM 1750 CD GLU A 106 13.904 -2.800 12.130 1.00 0.00 C ATOM 1751 OE1 GLU A 106 14.533 -3.540 12.910 1.00 0.00 O ATOM 1752 OE2 GLU A 106 13.505 -1.662 12.456 1.00 0.00 O ATOM 0 H GLU A 106 13.429 -6.388 9.609 1.00 0.00 H new ATOM 0 HA GLU A 106 12.849 -5.415 12.344 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.105 -4.295 9.607 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.552 -3.636 11.134 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.480 -3.857 10.366 1.00 0.00 H new ATOM 0 HG3 GLU A 106 13.503 -2.433 10.065 1.00 0.00 H new ATOM 1759 N GLY A 107 10.920 -6.929 10.167 1.00 0.00 N ATOM 1760 CA GLY A 107 9.661 -7.634 10.036 1.00 0.00 C ATOM 1761 C GLY A 107 8.934 -7.274 8.758 1.00 0.00 C ATOM 1762 O GLY A 107 9.422 -6.461 7.962 1.00 0.00 O ATOM 0 H GLY A 107 11.534 -6.991 9.355 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.844 -8.708 10.057 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.026 -7.402 10.891 1.00 0.00 H new ATOM 1766 N PHE A 108 7.760 -7.865 8.558 1.00 0.00 N ATOM 1767 CA PHE A 108 6.976 -7.593 7.361 1.00 0.00 C ATOM 1768 C PHE A 108 6.401 -6.188 7.420 1.00 0.00 C ATOM 1769 O PHE A 108 6.060 -5.601 6.395 1.00 0.00 O ATOM 1770 CB PHE A 108 5.855 -8.632 7.162 1.00 0.00 C ATOM 1771 CG PHE A 108 4.913 -8.795 8.330 1.00 0.00 C ATOM 1772 CD1 PHE A 108 3.815 -7.960 8.480 1.00 0.00 C ATOM 1773 CD2 PHE A 108 5.120 -9.796 9.271 1.00 0.00 C ATOM 1774 CE1 PHE A 108 2.946 -8.116 9.544 1.00 0.00 C ATOM 1775 CE2 PHE A 108 4.254 -9.958 10.334 1.00 0.00 C ATOM 1776 CZ PHE A 108 3.166 -9.116 10.472 1.00 0.00 C ATOM 0 H PHE A 108 7.334 -8.530 9.204 1.00 0.00 H new ATOM 0 HA PHE A 108 7.643 -7.668 6.502 1.00 0.00 H new ATOM 0 HB2 PHE A 108 5.274 -8.351 6.284 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.311 -9.598 6.947 1.00 0.00 H new ATOM 0 HD1 PHE A 108 3.637 -7.178 7.756 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.969 -10.456 9.170 1.00 0.00 H new ATOM 0 HE1 PHE A 108 2.097 -7.457 9.650 1.00 0.00 H new ATOM 0 HE2 PHE A 108 4.426 -10.742 11.057 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.489 -9.240 11.304 1.00 0.00 H new ATOM 1786 N ASP A 109 6.304 -5.647 8.628 1.00 0.00 N ATOM 1787 CA ASP A 109 5.861 -4.273 8.805 1.00 0.00 C ATOM 1788 C ASP A 109 6.780 -3.311 8.057 1.00 0.00 C ATOM 1789 O ASP A 109 6.318 -2.527 7.226 1.00 0.00 O ATOM 1790 CB ASP A 109 5.759 -3.887 10.295 1.00 0.00 C ATOM 1791 CG ASP A 109 6.895 -4.413 11.157 1.00 0.00 C ATOM 1792 OD1 ASP A 109 8.069 -4.128 10.855 1.00 0.00 O ATOM 1793 OD2 ASP A 109 6.609 -5.131 12.143 1.00 0.00 O ATOM 0 H ASP A 109 6.525 -6.137 9.495 1.00 0.00 H new ATOM 0 HA ASP A 109 4.859 -4.197 8.383 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.731 -2.800 10.376 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.815 -4.261 10.691 1.00 0.00 H new ATOM 1798 N ALA A 110 8.074 -3.398 8.327 1.00 0.00 N ATOM 1799 CA ALA A 110 9.061 -2.541 7.681 1.00 0.00 C ATOM 1800 C ALA A 110 9.124 -2.778 6.177 1.00 0.00 C ATOM 1801 O ALA A 110 9.231 -1.827 5.403 1.00 0.00 O ATOM 1802 CB ALA A 110 10.429 -2.755 8.300 1.00 0.00 C ATOM 0 H ALA A 110 8.469 -4.060 8.995 1.00 0.00 H new ATOM 0 HA ALA A 110 8.750 -1.508 7.840 1.00 0.00 H new ATOM 0 HB1 ALA A 110 11.156 -2.109 7.808 1.00 0.00 H new ATOM 0 HB2 ALA A 110 10.389 -2.514 9.362 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.726 -3.796 8.175 1.00 0.00 H new ATOM 1808 N ASP A 111 9.056 -4.041 5.761 1.00 0.00 N ATOM 1809 CA ASP A 111 9.133 -4.366 4.336 1.00 0.00 C ATOM 1810 C ASP A 111 7.939 -3.786 3.580 1.00 0.00 C ATOM 1811 O ASP A 111 8.064 -3.355 2.436 1.00 0.00 O ATOM 1812 CB ASP A 111 9.225 -5.878 4.115 1.00 0.00 C ATOM 1813 CG ASP A 111 9.495 -6.226 2.661 1.00 0.00 C ATOM 1814 OD1 ASP A 111 10.536 -5.780 2.122 1.00 0.00 O ATOM 1815 OD2 ASP A 111 8.668 -6.937 2.055 1.00 0.00 O ATOM 0 H ASP A 111 8.949 -4.846 6.378 1.00 0.00 H new ATOM 0 HA ASP A 111 10.043 -3.912 3.943 1.00 0.00 H new ATOM 0 HB2 ASP A 111 10.019 -6.288 4.739 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.295 -6.348 4.433 1.00 0.00 H new ATOM 1820 N ILE A 112 6.784 -3.750 4.235 1.00 0.00 N ATOM 1821 CA ILE A 112 5.606 -3.118 3.656 1.00 0.00 C ATOM 1822 C ILE A 112 5.721 -1.591 3.729 1.00 0.00 C ATOM 1823 O ILE A 112 5.222 -0.875 2.858 1.00 0.00 O ATOM 1824 CB ILE A 112 4.308 -3.587 4.362 1.00 0.00 C ATOM 1825 CG1 ILE A 112 4.088 -5.086 4.131 1.00 0.00 C ATOM 1826 CG2 ILE A 112 3.101 -2.792 3.876 1.00 0.00 C ATOM 1827 CD1 ILE A 112 2.874 -5.643 4.845 1.00 0.00 C ATOM 0 H ILE A 112 6.639 -4.149 5.162 1.00 0.00 H new ATOM 0 HA ILE A 112 5.552 -3.420 2.610 1.00 0.00 H new ATOM 0 HB ILE A 112 4.421 -3.409 5.431 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.984 -5.268 3.061 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.973 -5.629 4.462 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.205 -3.142 4.388 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.252 -1.734 4.091 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.983 -2.931 2.801 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.785 -6.709 4.633 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.984 -5.494 5.919 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.979 -5.128 4.497 1.00 0.00 H new ATOM 1839 N ASP A 113 6.401 -1.094 4.762 1.00 0.00 N ATOM 1840 CA ASP A 113 6.560 0.349 4.950 1.00 0.00 C ATOM 1841 C ASP A 113 7.481 0.951 3.895 1.00 0.00 C ATOM 1842 O ASP A 113 7.414 2.144 3.628 1.00 0.00 O ATOM 1843 CB ASP A 113 7.093 0.689 6.350 1.00 0.00 C ATOM 1844 CG ASP A 113 6.016 0.655 7.420 1.00 0.00 C ATOM 1845 OD1 ASP A 113 4.831 0.890 7.089 1.00 0.00 O ATOM 1846 OD2 ASP A 113 6.340 0.371 8.590 1.00 0.00 O ATOM 0 H ASP A 113 6.849 -1.665 5.479 1.00 0.00 H new ATOM 0 HA ASP A 113 5.567 0.785 4.843 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.881 -0.016 6.614 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.546 1.680 6.329 1.00 0.00 H new ATOM 1851 N SER A 114 8.322 0.120 3.286 1.00 0.00 N ATOM 1852 CA SER A 114 9.269 0.589 2.275 1.00 0.00 C ATOM 1853 C SER A 114 8.536 1.264 1.109 1.00 0.00 C ATOM 1854 O SER A 114 9.025 2.237 0.527 1.00 0.00 O ATOM 1855 CB SER A 114 10.113 -0.578 1.758 1.00 0.00 C ATOM 1856 OG SER A 114 9.309 -1.515 1.066 1.00 0.00 O ATOM 0 H SER A 114 8.368 -0.881 3.474 1.00 0.00 H new ATOM 0 HA SER A 114 9.925 1.325 2.740 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.893 -0.203 1.095 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.613 -1.068 2.593 1.00 0.00 H new ATOM 0 HG SER A 114 8.662 -1.912 1.686 1.00 0.00 H new ATOM 1862 N TYR A 115 7.349 0.743 0.790 1.00 0.00 N ATOM 1863 CA TYR A 115 6.523 1.292 -0.282 1.00 0.00 C ATOM 1864 C TYR A 115 6.075 2.713 0.048 1.00 0.00 C ATOM 1865 O TYR A 115 5.887 3.536 -0.845 1.00 0.00 O ATOM 1866 CB TYR A 115 5.303 0.391 -0.532 1.00 0.00 C ATOM 1867 CG TYR A 115 4.222 1.038 -1.374 1.00 0.00 C ATOM 1868 CD1 TYR A 115 4.456 1.404 -2.694 1.00 0.00 C ATOM 1869 CD2 TYR A 115 2.968 1.295 -0.835 1.00 0.00 C ATOM 1870 CE1 TYR A 115 3.470 2.010 -3.451 1.00 0.00 C ATOM 1871 CE2 TYR A 115 1.977 1.894 -1.586 1.00 0.00 C ATOM 1872 CZ TYR A 115 2.233 2.251 -2.892 1.00 0.00 C ATOM 1873 OH TYR A 115 1.251 2.857 -3.642 1.00 0.00 O ATOM 0 H TYR A 115 6.939 -0.062 1.263 1.00 0.00 H new ATOM 0 HA TYR A 115 7.125 1.328 -1.190 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.634 -0.523 -1.024 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.876 0.100 0.428 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.423 1.212 -3.136 1.00 0.00 H new ATOM 0 HD2 TYR A 115 2.765 1.021 0.190 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.668 2.293 -4.474 1.00 0.00 H new ATOM 0 HE2 TYR A 115 1.006 2.082 -1.152 1.00 0.00 H new ATOM 0 HH TYR A 115 1.477 2.789 -4.593 1.00 0.00 H new ATOM 1883 N ILE A 116 5.914 2.997 1.332 1.00 0.00 N ATOM 1884 CA ILE A 116 5.489 4.319 1.775 1.00 0.00 C ATOM 1885 C ILE A 116 6.708 5.191 2.067 1.00 0.00 C ATOM 1886 O ILE A 116 6.641 6.421 2.029 1.00 0.00 O ATOM 1887 CB ILE A 116 4.601 4.221 3.038 1.00 0.00 C ATOM 1888 CG1 ILE A 116 3.409 3.294 2.780 1.00 0.00 C ATOM 1889 CG2 ILE A 116 4.112 5.596 3.476 1.00 0.00 C ATOM 1890 CD1 ILE A 116 2.483 3.771 1.680 1.00 0.00 C ATOM 0 H ILE A 116 6.071 2.330 2.087 1.00 0.00 H new ATOM 0 HA ILE A 116 4.903 4.773 0.976 1.00 0.00 H new ATOM 0 HB ILE A 116 5.207 3.805 3.843 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.782 2.303 2.522 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.837 3.189 3.702 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.491 5.495 4.366 1.00 0.00 H new ATOM 0 HG22 ILE A 116 4.968 6.232 3.702 1.00 0.00 H new ATOM 0 HG23 ILE A 116 3.527 6.047 2.674 1.00 0.00 H new ATOM 0 HD11 ILE A 116 1.665 3.060 1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.078 4.748 1.943 1.00 0.00 H new ATOM 0 HD13 ILE A 116 3.038 3.848 0.745 1.00 0.00 H new ATOM 1902 N ASP A 117 7.829 4.535 2.326 1.00 0.00 N ATOM 1903 CA ASP A 117 9.065 5.218 2.675 1.00 0.00 C ATOM 1904 C ASP A 117 9.701 5.853 1.445 1.00 0.00 C ATOM 1905 O ASP A 117 10.413 6.849 1.551 1.00 0.00 O ATOM 1906 CB ASP A 117 10.041 4.230 3.318 1.00 0.00 C ATOM 1907 CG ASP A 117 11.369 4.863 3.672 1.00 0.00 C ATOM 1908 OD1 ASP A 117 11.465 5.484 4.751 1.00 0.00 O ATOM 1909 OD2 ASP A 117 12.324 4.736 2.880 1.00 0.00 O ATOM 0 H ASP A 117 7.907 3.518 2.300 1.00 0.00 H new ATOM 0 HA ASP A 117 8.832 6.010 3.387 1.00 0.00 H new ATOM 0 HB2 ASP A 117 9.590 3.815 4.219 1.00 0.00 H new ATOM 0 HB3 ASP A 117 10.211 3.398 2.635 1.00 0.00 H new ATOM 1914 N SER A 118 9.425 5.282 0.283 1.00 0.00 N ATOM 1915 CA SER A 118 9.950 5.802 -0.972 1.00 0.00 C ATOM 1916 C SER A 118 9.051 6.925 -1.499 1.00 0.00 C ATOM 1917 O SER A 118 8.051 6.662 -2.168 1.00 0.00 O ATOM 1918 CB SER A 118 10.042 4.669 -1.994 1.00 0.00 C ATOM 1919 OG SER A 118 10.677 3.530 -1.432 1.00 0.00 O ATOM 0 H SER A 118 8.838 4.454 0.182 1.00 0.00 H new ATOM 0 HA SER A 118 10.946 6.212 -0.803 1.00 0.00 H new ATOM 0 HB2 SER A 118 9.043 4.401 -2.337 1.00 0.00 H new ATOM 0 HB3 SER A 118 10.599 5.007 -2.868 1.00 0.00 H new ATOM 0 HG SER A 118 10.066 3.091 -0.804 1.00 0.00 H new ATOM 1925 N PRO A 119 9.422 8.194 -1.236 1.00 0.00 N ATOM 1926 CA PRO A 119 8.533 9.344 -1.443 1.00 0.00 C ATOM 1927 C PRO A 119 8.054 9.484 -2.884 1.00 0.00 C ATOM 1928 O PRO A 119 6.858 9.652 -3.132 1.00 0.00 O ATOM 1929 CB PRO A 119 9.386 10.554 -1.041 1.00 0.00 C ATOM 1930 CG PRO A 119 10.797 10.072 -1.077 1.00 0.00 C ATOM 1931 CD PRO A 119 10.746 8.610 -0.745 1.00 0.00 C ATOM 0 HA PRO A 119 7.619 9.239 -0.859 1.00 0.00 H new ATOM 0 HB2 PRO A 119 9.237 11.386 -1.729 1.00 0.00 H new ATOM 0 HB3 PRO A 119 9.118 10.911 -0.047 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.239 10.233 -2.060 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.412 10.614 -0.358 1.00 0.00 H new ATOM 0 HD2 PRO A 119 11.548 8.058 -1.236 1.00 0.00 H new ATOM 0 HD3 PRO A 119 10.850 8.437 0.326 1.00 0.00 H new ATOM 1939 N GLU A 120 8.989 9.408 -3.827 1.00 0.00 N ATOM 1940 CA GLU A 120 8.668 9.559 -5.239 1.00 0.00 C ATOM 1941 C GLU A 120 7.631 8.532 -5.679 1.00 0.00 C ATOM 1942 O GLU A 120 6.617 8.883 -6.279 1.00 0.00 O ATOM 1943 CB GLU A 120 9.932 9.437 -6.093 1.00 0.00 C ATOM 1944 CG GLU A 120 9.674 9.564 -7.588 1.00 0.00 C ATOM 1945 CD GLU A 120 10.947 9.547 -8.407 1.00 0.00 C ATOM 1946 OE1 GLU A 120 11.480 8.452 -8.670 1.00 0.00 O ATOM 1947 OE2 GLU A 120 11.427 10.640 -8.784 1.00 0.00 O ATOM 0 H GLU A 120 9.977 9.242 -3.636 1.00 0.00 H new ATOM 0 HA GLU A 120 8.243 10.553 -5.382 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.641 10.207 -5.789 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.402 8.474 -5.895 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.029 8.747 -7.911 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.135 10.492 -7.782 1.00 0.00 H new ATOM 1954 N TYR A 121 7.868 7.271 -5.348 1.00 0.00 N ATOM 1955 CA TYR A 121 6.995 6.194 -5.791 1.00 0.00 C ATOM 1956 C TYR A 121 5.607 6.311 -5.172 1.00 0.00 C ATOM 1957 O TYR A 121 4.602 6.223 -5.880 1.00 0.00 O ATOM 1958 CB TYR A 121 7.616 4.833 -5.479 1.00 0.00 C ATOM 1959 CG TYR A 121 8.866 4.554 -6.289 1.00 0.00 C ATOM 1960 CD1 TYR A 121 8.781 4.280 -7.648 1.00 0.00 C ATOM 1961 CD2 TYR A 121 10.125 4.571 -5.702 1.00 0.00 C ATOM 1962 CE1 TYR A 121 9.913 4.034 -8.400 1.00 0.00 C ATOM 1963 CE2 TYR A 121 11.263 4.322 -6.447 1.00 0.00 C ATOM 1964 CZ TYR A 121 11.150 4.056 -7.796 1.00 0.00 C ATOM 1965 OH TYR A 121 12.279 3.814 -8.549 1.00 0.00 O ATOM 0 H TYR A 121 8.656 6.969 -4.775 1.00 0.00 H new ATOM 0 HA TYR A 121 6.882 6.281 -6.872 1.00 0.00 H new ATOM 0 HB2 TYR A 121 7.859 4.785 -4.418 1.00 0.00 H new ATOM 0 HB3 TYR A 121 6.882 4.051 -5.673 1.00 0.00 H new ATOM 0 HD1 TYR A 121 7.812 4.259 -8.125 1.00 0.00 H new ATOM 0 HD2 TYR A 121 10.216 4.782 -4.647 1.00 0.00 H new ATOM 0 HE1 TYR A 121 9.828 3.825 -9.456 1.00 0.00 H new ATOM 0 HE2 TYR A 121 12.235 4.336 -5.976 1.00 0.00 H new ATOM 0 HH TYR A 121 13.072 3.867 -7.976 1.00 0.00 H new ATOM 1975 N THR A 122 5.546 6.533 -3.865 1.00 0.00 N ATOM 1976 CA THR A 122 4.270 6.629 -3.173 1.00 0.00 C ATOM 1977 C THR A 122 3.440 7.795 -3.703 1.00 0.00 C ATOM 1978 O THR A 122 2.308 7.616 -4.149 1.00 0.00 O ATOM 1979 CB THR A 122 4.465 6.826 -1.659 1.00 0.00 C ATOM 1980 OG1 THR A 122 5.596 6.078 -1.206 1.00 0.00 O ATOM 1981 CG2 THR A 122 3.228 6.381 -0.898 1.00 0.00 C ATOM 0 H THR A 122 6.363 6.649 -3.266 1.00 0.00 H new ATOM 0 HA THR A 122 3.747 5.690 -3.356 1.00 0.00 H new ATOM 0 HB THR A 122 4.633 7.887 -1.473 1.00 0.00 H new ATOM 0 HG1 THR A 122 5.364 5.127 -1.166 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.386 6.528 0.170 1.00 0.00 H new ATOM 0 HG22 THR A 122 2.370 6.969 -1.223 1.00 0.00 H new ATOM 0 HG23 THR A 122 3.040 5.326 -1.095 1.00 0.00 H new ATOM 1989 N ASN A 123 4.024 8.987 -3.679 1.00 0.00 N ATOM 1990 CA ASN A 123 3.295 10.210 -4.011 1.00 0.00 C ATOM 1991 C ASN A 123 2.839 10.205 -5.473 1.00 0.00 C ATOM 1992 O ASN A 123 1.826 10.813 -5.815 1.00 0.00 O ATOM 1993 CB ASN A 123 4.180 11.436 -3.737 1.00 0.00 C ATOM 1994 CG ASN A 123 3.404 12.735 -3.533 1.00 0.00 C ATOM 1995 OD1 ASN A 123 3.851 13.621 -2.802 1.00 0.00 O ATOM 1996 ND2 ASN A 123 2.256 12.877 -4.174 1.00 0.00 N ATOM 0 H ASN A 123 5.003 9.135 -3.433 1.00 0.00 H new ATOM 0 HA ASN A 123 2.406 10.258 -3.382 1.00 0.00 H new ATOM 0 HB2 ASN A 123 4.784 11.243 -2.850 1.00 0.00 H new ATOM 0 HB3 ASN A 123 4.870 11.565 -4.571 1.00 0.00 H new ATOM 0 HD21 ASN A 123 1.717 13.736 -4.070 1.00 0.00 H new ATOM 0 HD22 ASN A 123 1.910 12.127 -4.773 1.00 0.00 H new ATOM 2003 N SER A 124 3.571 9.512 -6.333 1.00 0.00 N ATOM 2004 CA SER A 124 3.255 9.500 -7.754 1.00 0.00 C ATOM 2005 C SER A 124 1.915 8.821 -8.048 1.00 0.00 C ATOM 2006 O SER A 124 1.058 9.409 -8.706 1.00 0.00 O ATOM 2007 CB SER A 124 4.379 8.838 -8.550 1.00 0.00 C ATOM 2008 OG SER A 124 5.556 9.631 -8.508 1.00 0.00 O ATOM 0 H SER A 124 4.384 8.953 -6.074 1.00 0.00 H new ATOM 0 HA SER A 124 3.163 10.539 -8.069 1.00 0.00 H new ATOM 0 HB2 SER A 124 4.586 7.848 -8.143 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.065 8.698 -9.584 1.00 0.00 H new ATOM 0 HG SER A 124 5.935 9.606 -7.605 1.00 0.00 H new ATOM 2014 N PHE A 125 1.708 7.604 -7.556 1.00 0.00 N ATOM 2015 CA PHE A 125 0.511 6.863 -7.948 1.00 0.00 C ATOM 2016 C PHE A 125 -0.276 6.317 -6.758 1.00 0.00 C ATOM 2017 O PHE A 125 -1.419 5.897 -6.919 1.00 0.00 O ATOM 2018 CB PHE A 125 0.884 5.723 -8.905 1.00 0.00 C ATOM 2019 CG PHE A 125 1.502 4.522 -8.241 1.00 0.00 C ATOM 2020 CD1 PHE A 125 2.845 4.503 -7.905 1.00 0.00 C ATOM 2021 CD2 PHE A 125 0.731 3.404 -7.962 1.00 0.00 C ATOM 2022 CE1 PHE A 125 3.406 3.394 -7.300 1.00 0.00 C ATOM 2023 CE2 PHE A 125 1.284 2.295 -7.358 1.00 0.00 C ATOM 2024 CZ PHE A 125 2.624 2.288 -7.025 1.00 0.00 C ATOM 0 H PHE A 125 2.329 7.121 -6.907 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.143 7.573 -8.455 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.013 5.406 -9.437 1.00 0.00 H new ATOM 0 HB3 PHE A 125 1.579 6.106 -9.652 1.00 0.00 H new ATOM 0 HD1 PHE A 125 3.461 5.364 -8.118 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.317 3.402 -8.221 1.00 0.00 H new ATOM 0 HE1 PHE A 125 4.455 3.392 -7.042 1.00 0.00 H new ATOM 0 HE2 PHE A 125 0.670 1.433 -7.145 1.00 0.00 H new ATOM 0 HZ PHE A 125 3.060 1.421 -6.551 1.00 0.00 H new ATOM 2034 N GLY A 126 0.313 6.331 -5.571 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.343 5.709 -4.431 1.00 0.00 C ATOM 2036 C GLY A 126 -0.561 6.654 -3.265 1.00 0.00 C ATOM 2037 O GLY A 126 -0.581 6.228 -2.112 1.00 0.00 O ATOM 0 H GLY A 126 1.220 6.754 -5.374 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -1.306 5.311 -4.750 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.256 4.863 -4.095 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.720 7.938 -3.556 1.00 0.00 N ATOM 2042 CA ASP A 127 -0.988 8.920 -2.511 1.00 0.00 C ATOM 2043 C ASP A 127 -2.471 9.273 -2.485 1.00 0.00 C ATOM 2044 O ASP A 127 -3.113 9.239 -1.434 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.145 10.177 -2.730 1.00 0.00 C ATOM 2046 CG ASP A 127 -0.223 11.141 -1.561 1.00 0.00 C ATOM 2047 OD1 ASP A 127 0.455 10.905 -0.539 1.00 0.00 O ATOM 2048 OD2 ASP A 127 -0.944 12.147 -1.663 1.00 0.00 O ATOM 0 H ASP A 127 -0.669 8.323 -4.499 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.717 8.486 -1.549 1.00 0.00 H new ATOM 0 HB2 ASP A 127 0.894 9.890 -2.891 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.480 10.682 -3.636 1.00 0.00 H new ATOM 2053 N TRP A 128 -3.012 9.604 -3.653 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.439 9.874 -3.789 1.00 0.00 C ATOM 2055 C TRP A 128 -5.126 8.786 -4.606 1.00 0.00 C ATOM 2056 O TRP A 128 -6.348 8.637 -4.560 1.00 0.00 O ATOM 2057 CB TRP A 128 -4.673 11.230 -4.459 1.00 0.00 C ATOM 2058 CG TRP A 128 -4.338 12.413 -3.597 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -3.197 13.164 -3.641 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.157 12.987 -2.570 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.262 14.172 -2.709 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.450 14.081 -2.035 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.420 12.682 -2.050 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -4.965 14.870 -1.008 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -6.928 13.465 -1.030 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.202 14.547 -0.518 1.00 0.00 C ATOM 0 H TRP A 128 -2.483 9.692 -4.520 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.866 9.889 -2.786 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -4.077 11.279 -5.370 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -5.719 11.298 -4.758 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -2.367 12.991 -4.310 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -2.541 14.875 -2.546 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -6.988 11.850 -2.439 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.408 15.707 -0.613 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.902 13.238 -0.621 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.626 15.139 0.280 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.339 8.026 -5.351 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.885 7.011 -6.244 1.00 0.00 C ATOM 2079 C VAL A 129 -4.697 5.623 -5.643 1.00 0.00 C ATOM 2080 O VAL A 129 -3.737 5.382 -4.912 1.00 0.00 O ATOM 2081 CB VAL A 129 -4.209 7.070 -7.637 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.884 6.123 -8.627 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -4.213 8.494 -8.173 1.00 0.00 C ATOM 0 H VAL A 129 -3.321 8.091 -5.357 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.949 7.212 -6.367 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.176 6.744 -7.518 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -4.384 6.190 -9.593 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.818 5.101 -8.255 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.932 6.401 -8.740 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.734 8.516 -9.152 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -5.241 8.846 -8.264 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.667 9.142 -7.488 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.627 4.726 -5.936 1.00 0.00 N ATOM 2094 CA VAL A 130 -5.540 3.350 -5.474 1.00 0.00 C ATOM 2095 C VAL A 130 -4.705 2.517 -6.441 1.00 0.00 C ATOM 2096 O VAL A 130 -5.008 2.443 -7.634 1.00 0.00 O ATOM 2097 CB VAL A 130 -6.940 2.711 -5.333 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -6.835 1.263 -4.883 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.801 3.508 -4.366 1.00 0.00 C ATOM 0 H VAL A 130 -6.455 4.929 -6.495 1.00 0.00 H new ATOM 0 HA VAL A 130 -5.064 3.365 -4.494 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.416 2.728 -6.313 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.834 0.837 -4.792 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -6.264 0.694 -5.617 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.332 1.218 -3.917 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.782 3.040 -4.282 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -7.324 3.529 -3.386 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.915 4.527 -4.736 1.00 0.00 H new ATOM 2109 N PRO A 131 -3.628 1.900 -5.944 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.765 1.041 -6.749 1.00 0.00 C ATOM 2111 C PRO A 131 -3.477 -0.231 -7.202 1.00 0.00 C ATOM 2112 O PRO A 131 -3.861 -1.069 -6.385 1.00 0.00 O ATOM 2113 CB PRO A 131 -1.603 0.696 -5.811 1.00 0.00 C ATOM 2114 CG PRO A 131 -1.704 1.661 -4.678 1.00 0.00 C ATOM 2115 CD PRO A 131 -3.158 2.001 -4.556 1.00 0.00 C ATOM 0 HA PRO A 131 -2.448 1.538 -7.666 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.676 -0.333 -5.458 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -0.645 0.790 -6.322 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -1.327 1.220 -3.755 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.109 2.554 -4.871 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -3.683 1.308 -3.899 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -3.308 3.001 -4.149 1.00 0.00 H new ATOM 2123 N TYR A 132 -3.669 -0.359 -8.504 1.00 0.00 N ATOM 2124 CA TYR A 132 -4.265 -1.558 -9.069 1.00 0.00 C ATOM 2125 C TYR A 132 -3.207 -2.348 -9.825 1.00 0.00 C ATOM 2126 O TYR A 132 -2.164 -1.796 -10.193 1.00 0.00 O ATOM 2127 CB TYR A 132 -5.447 -1.203 -9.981 1.00 0.00 C ATOM 2128 CG TYR A 132 -5.101 -0.269 -11.123 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -5.092 1.110 -10.943 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -4.792 -0.768 -12.383 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -4.781 1.962 -11.984 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -4.482 0.077 -13.428 1.00 0.00 C ATOM 2133 CZ TYR A 132 -4.478 1.442 -13.224 1.00 0.00 C ATOM 2134 OH TYR A 132 -4.164 2.288 -14.262 1.00 0.00 O ATOM 0 H TYR A 132 -3.421 0.353 -9.190 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.651 -2.177 -8.259 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -5.860 -2.123 -10.394 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.230 -0.744 -9.378 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -5.332 1.521 -9.974 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -4.795 -1.836 -12.546 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -4.775 3.031 -11.827 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -4.244 -0.327 -14.401 1.00 0.00 H new ATOM 0 HH TYR A 132 -3.975 1.762 -15.067 1.00 0.00 H new ATOM 2144 N TYR A 133 -3.471 -3.631 -10.051 1.00 0.00 N ATOM 2145 CA TYR A 133 -2.486 -4.515 -10.657 1.00 0.00 C ATOM 2146 C TYR A 133 -2.104 -4.060 -12.063 1.00 0.00 C ATOM 2147 O TYR A 133 -2.955 -3.820 -12.921 1.00 0.00 O ATOM 2148 CB TYR A 133 -2.974 -5.975 -10.657 1.00 0.00 C ATOM 2149 CG TYR A 133 -4.191 -6.258 -11.517 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -5.476 -6.006 -11.051 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -4.051 -6.802 -12.790 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -6.585 -6.284 -11.830 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -5.156 -7.085 -13.572 1.00 0.00 C ATOM 2154 CZ TYR A 133 -6.419 -6.825 -13.091 1.00 0.00 C ATOM 2155 OH TYR A 133 -7.521 -7.116 -13.868 1.00 0.00 O ATOM 0 H TYR A 133 -4.358 -4.080 -9.823 1.00 0.00 H new ATOM 0 HA TYR A 133 -1.585 -4.463 -10.045 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -2.157 -6.613 -10.994 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -3.201 -6.264 -9.631 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -5.611 -5.586 -10.065 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -3.063 -7.007 -13.174 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -7.577 -6.079 -11.454 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -5.028 -7.509 -14.557 1.00 0.00 H new ATOM 0 HH TYR A 133 -7.227 -7.489 -14.725 1.00 0.00 H new ATOM 2165 N ARG A 134 -0.804 -3.927 -12.267 1.00 0.00 N ATOM 2166 CA ARG A 134 -0.238 -3.521 -13.541 1.00 0.00 C ATOM 2167 C ARG A 134 1.050 -4.299 -13.792 1.00 0.00 C ATOM 2168 O ARG A 134 2.153 -3.747 -13.731 1.00 0.00 O ATOM 2169 CB ARG A 134 0.038 -2.015 -13.555 1.00 0.00 C ATOM 2170 CG ARG A 134 -1.198 -1.171 -13.820 1.00 0.00 C ATOM 2171 CD ARG A 134 -0.974 0.286 -13.457 1.00 0.00 C ATOM 2172 NE ARG A 134 -0.875 0.469 -12.007 1.00 0.00 N ATOM 2173 CZ ARG A 134 -1.054 1.635 -11.384 1.00 0.00 C ATOM 2174 NH1 ARG A 134 -1.323 2.733 -12.082 1.00 0.00 N ATOM 2175 NH2 ARG A 134 -0.961 1.701 -10.063 1.00 0.00 N ATOM 0 H ARG A 134 -0.105 -4.100 -11.544 1.00 0.00 H new ATOM 0 HA ARG A 134 -0.953 -3.740 -14.334 1.00 0.00 H new ATOM 0 HB2 ARG A 134 0.467 -1.724 -12.596 1.00 0.00 H new ATOM 0 HB3 ARG A 134 0.786 -1.798 -14.318 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -1.470 -1.246 -14.873 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -2.037 -1.564 -13.245 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -0.061 0.644 -13.933 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -1.794 0.889 -13.846 1.00 0.00 H new ATOM 0 HE ARG A 134 -0.655 -0.348 -11.437 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -1.393 2.687 -13.099 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -1.459 3.622 -11.601 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -0.753 0.861 -9.524 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -1.098 2.592 -9.586 1.00 0.00 H new