USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 943 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 63 THR OG1 : rot -32:sc= 1.12 USER MOD Set 1.2: A 65 THR OG1 : rot -14:sc= 0.303 USER MOD Single : A 12 THR OG1 : rot 41:sc= 0.0659 USER MOD Single : A 15 GLN :FLIP amide:sc= -0.536 F(o=-1.9,f=-0.54) USER MOD Single : A 17 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.18) USER MOD Single : A 20 SER OG : rot 180:sc= 0.00543 USER MOD Single : A 44 SER OG : rot 180:sc= -0.13 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 42:sc= 0 USER MOD Single : A 60 SER OG : rot 59:sc= -0.308 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.34 K(o=-0.34,f=-2.6!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot -62:sc= 1.19 USER MOD Single : A 90 SER OG : rot 180:sc= 0.0319 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -143:sc= 1.74 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.187 K(o=-0.19,f=-1.2!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 111 THR OG1 : rot 160:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 133 HIS : no HD1:sc= -0.11 X(o=-0.11,f=-0.59) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 8:sc= 0.249 USER MOD Single : A 141 ASN : amide:sc= -0.259 K(o=-0.26,f=-2.5) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -20.880 6.199 2.396 1.00 0.00 N ATOM 32 CA GLY A 4 -19.809 7.082 2.822 1.00 0.00 C ATOM 33 C GLY A 4 -19.934 8.428 2.098 1.00 0.00 C ATOM 34 O GLY A 4 -20.698 8.543 1.130 1.00 0.00 O ATOM 0 HA2 GLY A 4 -19.855 7.232 3.901 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.842 6.629 2.604 1.00 0.00 H new ATOM 38 N GLU A 5 -19.187 9.449 2.521 1.00 0.00 N ATOM 39 CA GLU A 5 -19.177 10.782 1.909 1.00 0.00 C ATOM 40 C GLU A 5 -17.740 11.169 1.524 1.00 0.00 C ATOM 41 O GLU A 5 -16.797 10.567 2.042 1.00 0.00 O ATOM 42 CB GLU A 5 -19.894 11.810 2.809 1.00 0.00 C ATOM 43 CG GLU A 5 -21.353 11.904 2.339 1.00 0.00 C ATOM 44 CD GLU A 5 -22.171 13.001 3.021 1.00 0.00 C ATOM 45 OE1 GLU A 5 -21.931 14.194 2.739 1.00 0.00 O ATOM 46 OE2 GLU A 5 -23.151 12.669 3.733 1.00 0.00 O ATOM 0 H GLU A 5 -18.556 9.372 3.319 1.00 0.00 H new ATOM 0 HA GLU A 5 -19.750 10.771 0.982 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -19.848 11.502 3.854 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -19.407 12.783 2.742 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -21.364 12.076 1.263 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -21.840 10.944 2.513 1.00 0.00 H new ATOM 53 N PRO A 6 -17.559 12.123 0.590 1.00 0.00 N ATOM 54 CA PRO A 6 -16.253 12.572 0.132 1.00 0.00 C ATOM 55 C PRO A 6 -15.621 13.634 1.042 1.00 0.00 C ATOM 56 O PRO A 6 -16.280 14.581 1.476 1.00 0.00 O ATOM 57 CB PRO A 6 -16.534 13.159 -1.255 1.00 0.00 C ATOM 58 CG PRO A 6 -17.916 13.797 -1.090 1.00 0.00 C ATOM 59 CD PRO A 6 -18.612 12.862 -0.098 1.00 0.00 C ATOM 0 HA PRO A 6 -15.536 11.751 0.129 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -15.782 13.895 -1.541 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -16.535 12.388 -2.026 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -17.847 14.814 -0.705 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -18.451 13.850 -2.038 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -19.214 13.429 0.612 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -19.288 12.181 -0.616 1.00 0.00 H new ATOM 67 N LEU A 7 -14.316 13.511 1.271 1.00 0.00 N ATOM 68 CA LEU A 7 -13.452 14.354 2.056 1.00 0.00 C ATOM 69 C LEU A 7 -12.339 14.718 1.089 1.00 0.00 C ATOM 70 O LEU A 7 -11.783 13.854 0.413 1.00 0.00 O ATOM 71 CB LEU A 7 -12.960 13.626 3.323 1.00 0.00 C ATOM 72 CG LEU A 7 -13.073 14.472 4.605 1.00 0.00 C ATOM 73 CD1 LEU A 7 -12.342 15.813 4.492 1.00 0.00 C ATOM 74 CD2 LEU A 7 -14.534 14.729 4.994 1.00 0.00 C ATOM 0 H LEU A 7 -13.795 12.734 0.864 1.00 0.00 H new ATOM 0 HA LEU A 7 -13.944 15.244 2.448 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -13.535 12.709 3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -11.920 13.333 3.182 1.00 0.00 H new ATOM 0 HG LEU A 7 -12.592 13.882 5.385 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -12.454 16.368 5.423 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -11.284 15.636 4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -12.767 16.391 3.671 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -14.568 15.329 5.903 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -15.037 15.263 4.188 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -15.037 13.778 5.168 1.00 0.00 H new ATOM 86 N VAL A 8 -12.044 16.000 0.983 1.00 0.00 N ATOM 87 CA VAL A 8 -11.026 16.531 0.086 1.00 0.00 C ATOM 88 C VAL A 8 -10.166 17.557 0.823 1.00 0.00 C ATOM 89 O VAL A 8 -10.701 18.495 1.426 1.00 0.00 O ATOM 90 CB VAL A 8 -11.712 17.143 -1.160 1.00 0.00 C ATOM 91 CG1 VAL A 8 -10.682 17.591 -2.203 1.00 0.00 C ATOM 92 CG2 VAL A 8 -12.702 16.183 -1.849 1.00 0.00 C ATOM 0 H VAL A 8 -12.515 16.721 1.530 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.366 15.731 -0.248 1.00 0.00 H new ATOM 0 HB VAL A 8 -12.270 17.999 -0.779 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -11.198 18.016 -3.064 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.025 18.343 -1.766 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.090 16.733 -2.521 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.146 16.677 -2.714 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.173 15.287 -2.174 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -13.488 15.905 -1.147 1.00 0.00 H new ATOM 102 N GLY A 9 -8.846 17.366 0.795 1.00 0.00 N ATOM 103 CA GLY A 9 -7.862 18.250 1.407 1.00 0.00 C ATOM 104 C GLY A 9 -7.797 19.513 0.557 1.00 0.00 C ATOM 105 O GLY A 9 -8.244 20.577 0.990 1.00 0.00 O ATOM 0 H GLY A 9 -8.422 16.564 0.329 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.146 18.490 2.431 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -6.886 17.766 1.452 1.00 0.00 H new ATOM 109 N GLY A 10 -7.325 19.373 -0.683 1.00 0.00 N ATOM 110 CA GLY A 10 -7.207 20.452 -1.649 1.00 0.00 C ATOM 111 C GLY A 10 -5.773 20.573 -2.124 1.00 0.00 C ATOM 112 O GLY A 10 -5.413 19.995 -3.148 1.00 0.00 O ATOM 0 H GLY A 10 -7.006 18.476 -1.048 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -7.864 20.264 -2.498 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -7.529 21.391 -1.198 1.00 0.00 H new ATOM 116 N ASP A 11 -4.976 21.355 -1.410 1.00 0.00 N ATOM 117 CA ASP A 11 -3.566 21.602 -1.682 1.00 0.00 C ATOM 118 C ASP A 11 -3.063 22.424 -0.513 1.00 0.00 C ATOM 119 O ASP A 11 -3.161 23.655 -0.526 1.00 0.00 O ATOM 120 CB ASP A 11 -3.261 22.235 -3.052 1.00 0.00 C ATOM 121 CG ASP A 11 -4.149 23.378 -3.558 1.00 0.00 C ATOM 122 OD1 ASP A 11 -5.255 23.124 -4.098 1.00 0.00 O ATOM 123 OD2 ASP A 11 -3.715 24.557 -3.573 1.00 0.00 O ATOM 0 H ASP A 11 -5.309 21.858 -0.588 1.00 0.00 H new ATOM 0 HA ASP A 11 -3.036 20.653 -1.765 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -2.236 22.603 -3.023 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -3.293 21.439 -3.796 1.00 0.00 H new ATOM 128 N THR A 12 -2.678 21.700 0.535 1.00 0.00 N ATOM 129 CA THR A 12 -2.140 22.174 1.811 1.00 0.00 C ATOM 130 C THR A 12 -1.530 20.981 2.562 1.00 0.00 C ATOM 131 O THR A 12 -2.242 20.013 2.838 1.00 0.00 O ATOM 132 CB THR A 12 -3.217 22.802 2.719 1.00 0.00 C ATOM 133 OG1 THR A 12 -4.428 22.062 2.746 1.00 0.00 O ATOM 134 CG2 THR A 12 -3.614 24.242 2.382 1.00 0.00 C ATOM 0 H THR A 12 -2.739 20.682 0.513 1.00 0.00 H new ATOM 0 HA THR A 12 -1.400 22.941 1.583 1.00 0.00 H new ATOM 0 HB THR A 12 -2.711 22.787 3.684 1.00 0.00 H new ATOM 0 HG1 THR A 12 -4.225 21.104 2.785 1.00 0.00 H new ATOM 0 HG21 THR A 12 -4.376 24.583 3.083 1.00 0.00 H new ATOM 0 HG22 THR A 12 -2.739 24.888 2.456 1.00 0.00 H new ATOM 0 HG23 THR A 12 -4.010 24.282 1.367 1.00 0.00 H new ATOM 142 N ASP A 13 -0.260 21.066 2.962 1.00 0.00 N ATOM 143 CA ASP A 13 0.437 19.997 3.668 1.00 0.00 C ATOM 144 C ASP A 13 -0.172 19.711 5.023 1.00 0.00 C ATOM 145 O ASP A 13 -0.269 20.586 5.890 1.00 0.00 O ATOM 146 CB ASP A 13 1.930 20.262 3.811 1.00 0.00 C ATOM 147 CG ASP A 13 2.305 21.533 4.567 1.00 0.00 C ATOM 148 OD1 ASP A 13 2.262 22.614 3.938 1.00 0.00 O ATOM 149 OD2 ASP A 13 2.776 21.463 5.729 1.00 0.00 O ATOM 0 H ASP A 13 0.318 21.891 2.801 1.00 0.00 H new ATOM 0 HA ASP A 13 0.314 19.111 3.045 1.00 0.00 H new ATOM 0 HB2 ASP A 13 2.385 19.411 4.319 1.00 0.00 H new ATOM 0 HB3 ASP A 13 2.369 20.311 2.815 1.00 0.00 H new ATOM 154 N ASP A 14 -0.601 18.464 5.186 1.00 0.00 N ATOM 155 CA ASP A 14 -1.223 17.962 6.406 1.00 0.00 C ATOM 156 C ASP A 14 -1.283 16.438 6.334 1.00 0.00 C ATOM 157 O ASP A 14 -0.661 15.839 5.452 1.00 0.00 O ATOM 158 CB ASP A 14 -2.610 18.618 6.656 1.00 0.00 C ATOM 159 CG ASP A 14 -2.566 19.519 7.893 1.00 0.00 C ATOM 160 OD1 ASP A 14 -2.064 19.063 8.947 1.00 0.00 O ATOM 161 OD2 ASP A 14 -2.991 20.699 7.865 1.00 0.00 O ATOM 0 H ASP A 14 -0.524 17.757 4.455 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.619 18.239 7.270 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.904 19.202 5.784 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -3.365 17.844 6.790 1.00 0.00 H new ATOM 166 N GLN A 15 -1.966 15.808 7.290 1.00 0.00 N ATOM 167 CA GLN A 15 -2.138 14.371 7.371 1.00 0.00 C ATOM 168 C GLN A 15 -3.643 14.097 7.423 1.00 0.00 C ATOM 169 O GLN A 15 -4.313 14.427 8.409 1.00 0.00 O ATOM 170 CB GLN A 15 -1.314 13.802 8.535 1.00 0.00 C ATOM 171 CG GLN A 15 -1.353 12.268 8.549 1.00 0.00 C ATOM 172 CD GLN A 15 -2.526 11.724 9.358 1.00 0.00 C ATOM 173 OE1 GLN A 15 -3.320 10.851 8.769 1.00 0.00 O flip ATOM 174 NE2 GLN A 15 -2.754 12.093 10.507 1.00 0.00 N flip ATOM 0 H GLN A 15 -2.427 16.307 8.051 1.00 0.00 H new ATOM 0 HA GLN A 15 -1.749 13.847 6.498 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -0.281 14.141 8.452 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -1.701 14.186 9.479 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -1.419 11.900 7.525 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -0.420 11.887 8.965 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -2.137 12.768 10.958 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -3.561 11.724 11.011 1.00 0.00 H new ATOM 183 N LEU A 16 -4.190 13.584 6.321 1.00 0.00 N ATOM 184 CA LEU A 16 -5.597 13.264 6.150 1.00 0.00 C ATOM 185 C LEU A 16 -5.813 11.899 6.793 1.00 0.00 C ATOM 186 O LEU A 16 -5.302 10.888 6.309 1.00 0.00 O ATOM 187 CB LEU A 16 -6.000 13.270 4.667 1.00 0.00 C ATOM 188 CG LEU A 16 -5.750 14.567 3.863 1.00 0.00 C ATOM 189 CD1 LEU A 16 -4.320 14.681 3.307 1.00 0.00 C ATOM 190 CD2 LEU A 16 -6.719 14.589 2.676 1.00 0.00 C ATOM 0 H LEU A 16 -3.636 13.373 5.491 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.228 14.015 6.626 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.467 12.459 4.171 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.063 13.037 4.607 1.00 0.00 H new ATOM 0 HG LEU A 16 -5.901 15.401 4.548 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.218 15.615 2.755 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.607 14.667 4.131 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.121 13.842 2.641 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.560 15.497 2.094 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.542 13.718 2.045 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.745 14.568 3.043 1.00 0.00 H new ATOM 202 N GLN A 17 -6.517 11.862 7.922 1.00 0.00 N ATOM 203 CA GLN A 17 -6.785 10.635 8.660 1.00 0.00 C ATOM 204 C GLN A 17 -8.272 10.310 8.644 1.00 0.00 C ATOM 205 O GLN A 17 -9.103 11.167 8.341 1.00 0.00 O ATOM 206 CB GLN A 17 -6.292 10.841 10.107 1.00 0.00 C ATOM 207 CG GLN A 17 -5.892 9.550 10.835 1.00 0.00 C ATOM 208 CD GLN A 17 -4.990 9.867 12.028 1.00 0.00 C ATOM 209 OE1 GLN A 17 -5.381 10.564 12.964 1.00 0.00 O ATOM 210 NE2 GLN A 17 -3.763 9.374 12.037 1.00 0.00 N ATOM 0 H GLN A 17 -6.921 12.694 8.353 1.00 0.00 H new ATOM 0 HA GLN A 17 -6.265 9.797 8.197 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -5.435 11.515 10.093 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -7.078 11.336 10.678 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -6.785 9.026 11.176 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -5.374 8.883 10.147 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -3.440 8.796 11.261 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -3.140 9.571 12.820 1.00 0.00 H new ATOM 219 N GLY A 18 -8.601 9.078 9.028 1.00 0.00 N ATOM 220 CA GLY A 18 -9.966 8.605 9.112 1.00 0.00 C ATOM 221 C GLY A 18 -10.545 8.156 7.783 1.00 0.00 C ATOM 222 O GLY A 18 -11.170 8.945 7.070 1.00 0.00 O ATOM 0 H GLY A 18 -7.910 8.376 9.292 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.009 7.773 9.815 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.591 9.400 9.519 1.00 0.00 H new ATOM 226 N GLY A 19 -10.353 6.874 7.482 1.00 0.00 N ATOM 227 CA GLY A 19 -10.839 6.199 6.283 1.00 0.00 C ATOM 228 C GLY A 19 -11.652 4.945 6.646 1.00 0.00 C ATOM 229 O GLY A 19 -12.163 4.247 5.777 1.00 0.00 O ATOM 0 H GLY A 19 -9.830 6.249 8.096 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.459 6.883 5.703 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -9.995 5.919 5.652 1.00 0.00 H new ATOM 233 N SER A 20 -11.764 4.644 7.945 1.00 0.00 N ATOM 234 CA SER A 20 -12.477 3.513 8.518 1.00 0.00 C ATOM 235 C SER A 20 -13.901 3.388 7.954 1.00 0.00 C ATOM 236 O SER A 20 -14.564 4.389 7.675 1.00 0.00 O ATOM 237 CB SER A 20 -12.484 3.712 10.044 1.00 0.00 C ATOM 238 OG SER A 20 -12.814 5.040 10.440 1.00 0.00 O ATOM 0 H SER A 20 -11.330 5.224 8.663 1.00 0.00 H new ATOM 0 HA SER A 20 -11.978 2.580 8.257 1.00 0.00 H new ATOM 0 HB2 SER A 20 -13.198 3.020 10.490 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.502 3.456 10.441 1.00 0.00 H new ATOM 0 HG SER A 20 -12.803 5.102 11.418 1.00 0.00 H new ATOM 244 N GLY A 21 -14.410 2.157 7.866 1.00 0.00 N ATOM 245 CA GLY A 21 -15.742 1.876 7.361 1.00 0.00 C ATOM 246 C GLY A 21 -15.832 2.250 5.885 1.00 0.00 C ATOM 247 O GLY A 21 -15.264 1.522 5.068 1.00 0.00 O ATOM 0 H GLY A 21 -13.897 1.322 8.149 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.973 0.819 7.491 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -16.482 2.437 7.932 1.00 0.00 H new ATOM 251 N ALA A 22 -16.698 3.204 5.519 1.00 0.00 N ATOM 252 CA ALA A 22 -16.858 3.689 4.162 1.00 0.00 C ATOM 253 C ALA A 22 -16.600 5.193 4.189 1.00 0.00 C ATOM 254 O ALA A 22 -17.488 5.955 4.592 1.00 0.00 O ATOM 255 CB ALA A 22 -18.223 3.324 3.571 1.00 0.00 C ATOM 0 H ALA A 22 -17.318 3.665 6.184 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.142 3.206 3.497 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -18.294 3.709 2.554 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -18.335 2.240 3.557 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -19.013 3.763 4.181 1.00 0.00 H new ATOM 261 N ASP A 23 -15.400 5.611 3.815 1.00 0.00 N ATOM 262 CA ASP A 23 -14.962 7.004 3.747 1.00 0.00 C ATOM 263 C ASP A 23 -14.274 7.174 2.389 1.00 0.00 C ATOM 264 O ASP A 23 -14.069 6.193 1.666 1.00 0.00 O ATOM 265 CB ASP A 23 -14.055 7.379 4.929 1.00 0.00 C ATOM 266 CG ASP A 23 -14.598 8.575 5.713 1.00 0.00 C ATOM 267 OD1 ASP A 23 -14.673 9.690 5.159 1.00 0.00 O ATOM 268 OD2 ASP A 23 -14.948 8.411 6.910 1.00 0.00 O ATOM 0 H ASP A 23 -14.667 4.959 3.536 1.00 0.00 H new ATOM 0 HA ASP A 23 -15.807 7.687 3.828 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.957 6.523 5.596 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.056 7.611 4.560 1.00 0.00 H new ATOM 273 N ARG A 24 -14.015 8.405 1.960 1.00 0.00 N ATOM 274 CA ARG A 24 -13.365 8.693 0.681 1.00 0.00 C ATOM 275 C ARG A 24 -12.558 9.938 0.961 1.00 0.00 C ATOM 276 O ARG A 24 -13.168 10.995 1.097 1.00 0.00 O ATOM 277 CB ARG A 24 -14.447 8.857 -0.411 1.00 0.00 C ATOM 278 CG ARG A 24 -14.014 9.277 -1.824 1.00 0.00 C ATOM 279 CD ARG A 24 -13.514 10.719 -1.932 1.00 0.00 C ATOM 280 NE ARG A 24 -13.143 11.089 -3.295 1.00 0.00 N ATOM 281 CZ ARG A 24 -13.898 11.446 -4.328 1.00 0.00 C ATOM 282 NH1 ARG A 24 -15.221 11.306 -4.273 1.00 0.00 N ATOM 283 NH2 ARG A 24 -13.303 11.928 -5.407 1.00 0.00 N ATOM 0 H ARG A 24 -14.252 9.241 2.494 1.00 0.00 H new ATOM 0 HA ARG A 24 -12.712 7.907 0.303 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -14.976 7.908 -0.496 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.167 9.593 -0.054 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -13.225 8.606 -2.163 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -14.857 9.146 -2.503 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -14.291 11.396 -1.575 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.652 10.850 -1.278 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.141 11.070 -3.485 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -15.659 10.923 -3.435 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -15.797 11.582 -5.069 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -12.287 12.018 -5.432 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -13.860 12.209 -6.214 1.00 0.00 H new ATOM 297 N LEU A 25 -11.238 9.829 1.101 1.00 0.00 N ATOM 298 CA LEU A 25 -10.378 10.974 1.380 1.00 0.00 C ATOM 299 C LEU A 25 -9.440 11.210 0.196 1.00 0.00 C ATOM 300 O LEU A 25 -8.762 10.295 -0.277 1.00 0.00 O ATOM 301 CB LEU A 25 -9.687 10.842 2.748 1.00 0.00 C ATOM 302 CG LEU A 25 -8.415 9.982 2.855 1.00 0.00 C ATOM 303 CD1 LEU A 25 -7.943 10.018 4.315 1.00 0.00 C ATOM 304 CD2 LEU A 25 -8.591 8.514 2.448 1.00 0.00 C ATOM 0 H LEU A 25 -10.736 8.944 1.024 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.977 11.880 1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -9.436 11.846 3.090 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -10.418 10.440 3.450 1.00 0.00 H new ATOM 0 HG LEU A 25 -7.696 10.408 2.155 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.041 9.415 4.421 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -7.728 11.047 4.603 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.725 9.617 4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.642 7.990 2.557 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -9.339 8.046 3.088 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -8.918 8.461 1.409 1.00 0.00 H new ATOM 316 N ASP A 26 -9.396 12.455 -0.267 1.00 0.00 N ATOM 317 CA ASP A 26 -8.593 12.895 -1.398 1.00 0.00 C ATOM 318 C ASP A 26 -7.562 13.892 -0.913 1.00 0.00 C ATOM 319 O ASP A 26 -7.937 14.948 -0.400 1.00 0.00 O ATOM 320 CB ASP A 26 -9.471 13.556 -2.481 1.00 0.00 C ATOM 321 CG ASP A 26 -10.379 12.628 -3.289 1.00 0.00 C ATOM 322 OD1 ASP A 26 -10.447 11.407 -3.040 1.00 0.00 O ATOM 323 OD2 ASP A 26 -11.093 13.129 -4.193 1.00 0.00 O ATOM 0 H ASP A 26 -9.939 13.211 0.151 1.00 0.00 H new ATOM 0 HA ASP A 26 -8.105 12.025 -1.837 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.095 14.309 -2.000 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -8.816 14.081 -3.176 1.00 0.00 H new ATOM 328 N GLY A 27 -6.280 13.537 -1.046 1.00 0.00 N ATOM 329 CA GLY A 27 -5.148 14.376 -0.663 1.00 0.00 C ATOM 330 C GLY A 27 -5.271 15.717 -1.376 1.00 0.00 C ATOM 331 O GLY A 27 -5.518 16.750 -0.744 1.00 0.00 O ATOM 0 H GLY A 27 -5.998 12.636 -1.432 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.134 14.522 0.417 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.210 13.890 -0.931 1.00 0.00 H new ATOM 335 N GLY A 28 -5.162 15.685 -2.704 1.00 0.00 N ATOM 336 CA GLY A 28 -5.266 16.853 -3.552 1.00 0.00 C ATOM 337 C GLY A 28 -4.069 17.017 -4.481 1.00 0.00 C ATOM 338 O GLY A 28 -4.086 16.475 -5.594 1.00 0.00 O ATOM 0 H GLY A 28 -4.995 14.823 -3.223 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.176 16.784 -4.148 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -5.361 17.742 -2.928 1.00 0.00 H new ATOM 342 N ALA A 29 -3.079 17.813 -4.066 1.00 0.00 N ATOM 343 CA ALA A 29 -1.859 18.109 -4.807 1.00 0.00 C ATOM 344 C ALA A 29 -0.802 18.620 -3.826 1.00 0.00 C ATOM 345 O ALA A 29 -1.105 19.515 -3.031 1.00 0.00 O ATOM 346 CB ALA A 29 -2.153 19.218 -5.828 1.00 0.00 C ATOM 0 H ALA A 29 -3.112 18.287 -3.164 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.504 17.213 -5.316 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -1.246 19.447 -6.388 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -2.929 18.883 -6.516 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.493 20.113 -5.306 1.00 0.00 H new ATOM 352 N GLY A 30 0.438 18.140 -3.939 1.00 0.00 N ATOM 353 CA GLY A 30 1.540 18.524 -3.069 1.00 0.00 C ATOM 354 C GLY A 30 2.304 17.284 -2.649 1.00 0.00 C ATOM 355 O GLY A 30 2.480 16.335 -3.418 1.00 0.00 O ATOM 0 H GLY A 30 0.704 17.461 -4.652 1.00 0.00 H new ATOM 0 HA2 GLY A 30 2.204 19.215 -3.588 1.00 0.00 H new ATOM 0 HA3 GLY A 30 1.160 19.046 -2.191 1.00 0.00 H new ATOM 359 N ASP A 31 2.794 17.361 -1.427 1.00 0.00 N ATOM 360 CA ASP A 31 3.532 16.401 -0.652 1.00 0.00 C ATOM 361 C ASP A 31 2.758 16.344 0.668 1.00 0.00 C ATOM 362 O ASP A 31 3.176 16.897 1.689 1.00 0.00 O ATOM 363 CB ASP A 31 4.986 16.855 -0.530 1.00 0.00 C ATOM 364 CG ASP A 31 5.913 15.770 0.021 1.00 0.00 C ATOM 365 OD1 ASP A 31 5.895 15.479 1.241 1.00 0.00 O ATOM 366 OD2 ASP A 31 6.791 15.285 -0.729 1.00 0.00 O ATOM 0 H ASP A 31 2.661 18.218 -0.889 1.00 0.00 H new ATOM 0 HA ASP A 31 3.604 15.403 -1.085 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.346 17.167 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 31 5.034 17.729 0.120 1.00 0.00 H new ATOM 371 N ASP A 32 1.531 15.835 0.575 1.00 0.00 N ATOM 372 CA ASP A 32 0.561 15.650 1.652 1.00 0.00 C ATOM 373 C ASP A 32 0.529 14.137 1.885 1.00 0.00 C ATOM 374 O ASP A 32 1.054 13.352 1.090 1.00 0.00 O ATOM 375 CB ASP A 32 -0.847 16.196 1.348 1.00 0.00 C ATOM 376 CG ASP A 32 -0.944 17.625 0.770 1.00 0.00 C ATOM 377 OD1 ASP A 32 0.059 18.378 0.781 1.00 0.00 O ATOM 378 OD2 ASP A 32 -2.059 18.015 0.355 1.00 0.00 O ATOM 0 H ASP A 32 1.162 15.518 -0.321 1.00 0.00 H new ATOM 0 HA ASP A 32 0.865 16.219 2.530 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.328 15.515 0.646 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -1.427 16.165 2.270 1.00 0.00 H new ATOM 383 N ILE A 33 -0.025 13.697 3.006 1.00 0.00 N ATOM 384 CA ILE A 33 -0.078 12.278 3.354 1.00 0.00 C ATOM 385 C ILE A 33 -1.494 11.905 3.807 1.00 0.00 C ATOM 386 O ILE A 33 -2.114 12.649 4.564 1.00 0.00 O ATOM 387 CB ILE A 33 1.062 11.985 4.363 1.00 0.00 C ATOM 388 CG1 ILE A 33 0.978 12.806 5.664 1.00 0.00 C ATOM 389 CG2 ILE A 33 2.437 12.211 3.703 1.00 0.00 C ATOM 390 CD1 ILE A 33 2.122 12.549 6.652 1.00 0.00 C ATOM 0 H ILE A 33 -0.451 14.310 3.701 1.00 0.00 H new ATOM 0 HA ILE A 33 0.106 11.628 2.499 1.00 0.00 H new ATOM 0 HB ILE A 33 0.939 10.939 4.645 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.965 13.866 5.410 1.00 0.00 H new ATOM 0 HG13 ILE A 33 0.032 12.585 6.158 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.226 12.001 4.425 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.543 11.546 2.846 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.515 13.246 3.371 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.983 13.168 7.538 1.00 0.00 H new ATOM 0 HD12 ILE A 33 2.125 11.498 6.940 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.073 12.798 6.181 1.00 0.00 H new ATOM 402 N LEU A 34 -2.019 10.758 3.357 1.00 0.00 N ATOM 403 CA LEU A 34 -3.368 10.284 3.690 1.00 0.00 C ATOM 404 C LEU A 34 -3.370 8.815 4.134 1.00 0.00 C ATOM 405 O LEU A 34 -2.447 8.059 3.815 1.00 0.00 O ATOM 406 CB LEU A 34 -4.375 10.576 2.555 1.00 0.00 C ATOM 407 CG LEU A 34 -3.948 9.982 1.217 1.00 0.00 C ATOM 408 CD1 LEU A 34 -5.147 9.411 0.449 1.00 0.00 C ATOM 409 CD2 LEU A 34 -3.226 11.015 0.345 1.00 0.00 C ATOM 0 H LEU A 34 -1.510 10.123 2.742 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.709 10.856 4.553 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.351 10.176 2.830 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.491 11.654 2.448 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.255 9.171 1.442 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.807 8.996 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -5.618 8.626 1.041 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.869 10.205 0.259 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.937 10.555 -0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.892 11.856 0.151 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.335 11.370 0.863 1.00 0.00 H new ATOM 421 N ASP A 35 -4.407 8.401 4.860 1.00 0.00 N ATOM 422 CA ASP A 35 -4.607 7.051 5.400 1.00 0.00 C ATOM 423 C ASP A 35 -6.053 6.603 5.184 1.00 0.00 C ATOM 424 O ASP A 35 -6.976 7.167 5.772 1.00 0.00 O ATOM 425 CB ASP A 35 -4.215 7.023 6.886 1.00 0.00 C ATOM 426 CG ASP A 35 -4.816 5.882 7.720 1.00 0.00 C ATOM 427 OD1 ASP A 35 -5.013 4.748 7.233 1.00 0.00 O ATOM 428 OD2 ASP A 35 -5.027 6.139 8.931 1.00 0.00 O ATOM 0 H ASP A 35 -5.173 9.029 5.102 1.00 0.00 H new ATOM 0 HA ASP A 35 -3.965 6.347 4.870 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.129 6.963 6.954 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -4.510 7.970 7.337 1.00 0.00 H new ATOM 433 N GLY A 36 -6.233 5.604 4.314 1.00 0.00 N ATOM 434 CA GLY A 36 -7.511 5.007 3.935 1.00 0.00 C ATOM 435 C GLY A 36 -8.177 4.189 5.041 1.00 0.00 C ATOM 436 O GLY A 36 -9.288 3.707 4.845 1.00 0.00 O ATOM 0 H GLY A 36 -5.447 5.169 3.831 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.192 5.800 3.626 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.356 4.365 3.068 1.00 0.00 H new ATOM 440 N GLY A 37 -7.563 4.040 6.217 1.00 0.00 N ATOM 441 CA GLY A 37 -8.157 3.290 7.307 1.00 0.00 C ATOM 442 C GLY A 37 -8.295 1.810 6.969 1.00 0.00 C ATOM 443 O GLY A 37 -7.448 1.234 6.291 1.00 0.00 O ATOM 0 H GLY A 37 -6.648 4.435 6.432 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.544 3.403 8.202 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.139 3.703 7.539 1.00 0.00 H new ATOM 447 N ALA A 38 -9.282 1.168 7.593 1.00 0.00 N ATOM 448 CA ALA A 38 -9.635 -0.235 7.438 1.00 0.00 C ATOM 449 C ALA A 38 -11.077 -0.293 6.941 1.00 0.00 C ATOM 450 O ALA A 38 -12.005 -0.076 7.738 1.00 0.00 O ATOM 451 CB ALA A 38 -9.475 -0.907 8.805 1.00 0.00 C ATOM 0 H ALA A 38 -9.890 1.645 8.259 1.00 0.00 H new ATOM 0 HA ALA A 38 -8.999 -0.754 6.721 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -9.733 -1.963 8.724 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -8.442 -0.810 9.139 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -10.136 -0.427 9.526 1.00 0.00 H new ATOM 457 N GLY A 39 -11.294 -0.656 5.682 1.00 0.00 N ATOM 458 CA GLY A 39 -12.598 -0.756 5.069 1.00 0.00 C ATOM 459 C GLY A 39 -12.539 -0.414 3.589 1.00 0.00 C ATOM 460 O GLY A 39 -11.483 -0.050 3.083 1.00 0.00 O ATOM 0 H GLY A 39 -10.535 -0.896 5.044 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -12.986 -1.767 5.196 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.292 -0.083 5.573 1.00 0.00 H new ATOM 464 N ARG A 40 -13.648 -0.621 2.863 1.00 0.00 N ATOM 465 CA ARG A 40 -13.673 -0.303 1.450 1.00 0.00 C ATOM 466 C ARG A 40 -13.869 1.201 1.319 1.00 0.00 C ATOM 467 O ARG A 40 -14.981 1.728 1.414 1.00 0.00 O ATOM 468 CB ARG A 40 -14.666 -1.155 0.650 1.00 0.00 C ATOM 469 CG ARG A 40 -16.154 -1.152 1.011 1.00 0.00 C ATOM 470 CD ARG A 40 -16.497 -2.191 2.071 1.00 0.00 C ATOM 471 NE ARG A 40 -17.939 -2.182 2.335 1.00 0.00 N ATOM 472 CZ ARG A 40 -18.582 -2.948 3.215 1.00 0.00 C ATOM 473 NH1 ARG A 40 -17.930 -3.844 3.951 1.00 0.00 N ATOM 474 NH2 ARG A 40 -19.894 -2.792 3.328 1.00 0.00 N ATOM 0 H ARG A 40 -14.519 -1.001 3.234 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.722 -0.570 0.989 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.587 -0.849 -0.393 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -14.323 -2.188 0.706 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -16.436 -0.163 1.372 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -16.743 -1.344 0.114 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -16.187 -3.181 1.736 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -15.950 -1.980 2.990 1.00 0.00 H new ATOM 0 HE ARG A 40 -18.503 -1.527 1.794 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -16.921 -3.953 3.846 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -18.439 -4.422 4.620 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -20.377 -2.103 2.752 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -20.420 -3.361 3.991 1.00 0.00 H new ATOM 488 N ASP A 41 -12.754 1.877 1.118 1.00 0.00 N ATOM 489 CA ASP A 41 -12.591 3.304 0.934 1.00 0.00 C ATOM 490 C ASP A 41 -12.162 3.487 -0.517 1.00 0.00 C ATOM 491 O ASP A 41 -11.932 2.518 -1.257 1.00 0.00 O ATOM 492 CB ASP A 41 -11.601 3.924 1.949 1.00 0.00 C ATOM 493 CG ASP A 41 -10.444 4.693 1.292 1.00 0.00 C ATOM 494 OD1 ASP A 41 -9.425 4.035 0.976 1.00 0.00 O ATOM 495 OD2 ASP A 41 -10.621 5.902 1.009 1.00 0.00 O ATOM 0 H ASP A 41 -11.856 1.394 1.076 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.521 3.838 1.128 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.146 4.599 2.609 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -11.190 3.131 2.573 1.00 0.00 H new ATOM 500 N ARG A 42 -12.303 4.708 -1.013 1.00 0.00 N ATOM 501 CA ARG A 42 -11.889 5.034 -2.354 1.00 0.00 C ATOM 502 C ARG A 42 -10.895 6.159 -2.161 1.00 0.00 C ATOM 503 O ARG A 42 -11.284 7.320 -2.060 1.00 0.00 O ATOM 504 CB ARG A 42 -13.132 5.376 -3.157 1.00 0.00 C ATOM 505 CG ARG A 42 -12.829 5.393 -4.660 1.00 0.00 C ATOM 506 CD ARG A 42 -14.120 5.317 -5.476 1.00 0.00 C ATOM 507 NE ARG A 42 -15.041 6.409 -5.142 1.00 0.00 N ATOM 508 CZ ARG A 42 -15.194 7.560 -5.794 1.00 0.00 C ATOM 509 NH1 ARG A 42 -14.479 7.828 -6.879 1.00 0.00 N ATOM 510 NH2 ARG A 42 -16.092 8.429 -5.351 1.00 0.00 N ATOM 0 H ARG A 42 -12.705 5.489 -0.495 1.00 0.00 H new ATOM 0 HA ARG A 42 -11.407 4.238 -2.922 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.915 4.647 -2.949 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.512 6.350 -2.848 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -12.285 6.302 -4.915 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.183 4.553 -4.915 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.881 5.355 -6.539 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.609 4.360 -5.294 1.00 0.00 H new ATOM 0 HE ARG A 42 -15.629 6.271 -4.320 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.801 7.148 -7.224 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.607 8.714 -7.368 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -16.650 8.210 -4.526 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -16.225 9.317 -5.836 1.00 0.00 H new ATOM 524 N LEU A 43 -9.616 5.819 -2.210 1.00 0.00 N ATOM 525 CA LEU A 43 -8.545 6.764 -2.019 1.00 0.00 C ATOM 526 C LEU A 43 -8.116 7.335 -3.360 1.00 0.00 C ATOM 527 O LEU A 43 -8.039 6.603 -4.348 1.00 0.00 O ATOM 528 CB LEU A 43 -7.419 6.046 -1.260 1.00 0.00 C ATOM 529 CG LEU A 43 -6.681 4.894 -1.971 1.00 0.00 C ATOM 530 CD1 LEU A 43 -5.366 5.408 -2.568 1.00 0.00 C ATOM 531 CD2 LEU A 43 -6.355 3.751 -0.998 1.00 0.00 C ATOM 0 H LEU A 43 -9.297 4.866 -2.386 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.857 7.621 -1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.677 6.794 -0.979 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.840 5.651 -0.335 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.338 4.518 -2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.849 4.589 -3.069 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.578 6.198 -3.288 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.735 5.802 -1.772 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.835 2.956 -1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.719 4.126 -0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.280 3.359 -0.574 1.00 0.00 H new ATOM 543 N SER A 44 -7.846 8.638 -3.393 1.00 0.00 N ATOM 544 CA SER A 44 -7.401 9.349 -4.580 1.00 0.00 C ATOM 545 C SER A 44 -6.437 10.404 -4.057 1.00 0.00 C ATOM 546 O SER A 44 -6.857 11.515 -3.728 1.00 0.00 O ATOM 547 CB SER A 44 -8.628 9.963 -5.290 1.00 0.00 C ATOM 548 OG SER A 44 -8.425 10.365 -6.639 1.00 0.00 O ATOM 0 H SER A 44 -7.934 9.239 -2.574 1.00 0.00 H new ATOM 0 HA SER A 44 -6.909 8.715 -5.318 1.00 0.00 H new ATOM 0 HB2 SER A 44 -9.440 9.236 -5.265 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.959 10.830 -4.718 1.00 0.00 H new ATOM 0 HG SER A 44 -9.257 10.737 -6.998 1.00 0.00 H new ATOM 554 N GLY A 45 -5.152 10.060 -3.940 1.00 0.00 N ATOM 555 CA GLY A 45 -4.130 10.997 -3.474 1.00 0.00 C ATOM 556 C GLY A 45 -4.167 12.190 -4.411 1.00 0.00 C ATOM 557 O GLY A 45 -4.510 13.308 -4.025 1.00 0.00 O ATOM 0 H GLY A 45 -4.794 9.132 -4.164 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -4.328 11.306 -2.448 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.145 10.530 -3.482 1.00 0.00 H new ATOM 561 N GLY A 46 -4.064 11.886 -5.699 1.00 0.00 N ATOM 562 CA GLY A 46 -4.078 12.837 -6.783 1.00 0.00 C ATOM 563 C GLY A 46 -2.727 12.763 -7.473 1.00 0.00 C ATOM 564 O GLY A 46 -1.938 11.857 -7.198 1.00 0.00 O ATOM 0 H GLY A 46 -3.964 10.924 -6.022 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.880 12.607 -7.485 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -4.262 13.844 -6.408 1.00 0.00 H new ATOM 568 N ALA A 47 -2.490 13.637 -8.448 1.00 0.00 N ATOM 569 CA ALA A 47 -1.200 13.644 -9.107 1.00 0.00 C ATOM 570 C ALA A 47 -0.334 14.418 -8.117 1.00 0.00 C ATOM 571 O ALA A 47 -0.429 15.652 -8.053 1.00 0.00 O ATOM 572 CB ALA A 47 -1.311 14.324 -10.473 1.00 0.00 C ATOM 0 H ALA A 47 -3.158 14.329 -8.788 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.788 12.659 -9.326 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.336 14.324 -10.960 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.026 13.782 -11.092 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.651 15.351 -10.341 1.00 0.00 H new ATOM 578 N GLY A 48 0.503 13.722 -7.361 1.00 0.00 N ATOM 579 CA GLY A 48 1.368 14.315 -6.363 1.00 0.00 C ATOM 580 C GLY A 48 2.301 13.258 -5.803 1.00 0.00 C ATOM 581 O GLY A 48 2.317 12.126 -6.288 1.00 0.00 O ATOM 0 H GLY A 48 0.598 12.709 -7.429 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.946 15.127 -6.805 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.771 14.748 -5.561 1.00 0.00 H new ATOM 585 N ALA A 49 3.156 13.659 -4.865 1.00 0.00 N ATOM 586 CA ALA A 49 4.115 12.786 -4.214 1.00 0.00 C ATOM 587 C ALA A 49 3.535 12.457 -2.841 1.00 0.00 C ATOM 588 O ALA A 49 4.137 12.748 -1.801 1.00 0.00 O ATOM 589 CB ALA A 49 5.484 13.482 -4.159 1.00 0.00 C ATOM 0 H ALA A 49 3.198 14.622 -4.533 1.00 0.00 H new ATOM 0 HA ALA A 49 4.282 11.854 -4.755 1.00 0.00 H new ATOM 0 HB1 ALA A 49 6.206 12.827 -3.670 1.00 0.00 H new ATOM 0 HB2 ALA A 49 5.821 13.702 -5.172 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.397 14.411 -3.596 1.00 0.00 H new ATOM 595 N ASP A 50 2.337 11.895 -2.858 1.00 0.00 N ATOM 596 CA ASP A 50 1.582 11.538 -1.668 1.00 0.00 C ATOM 597 C ASP A 50 2.147 10.261 -1.056 1.00 0.00 C ATOM 598 O ASP A 50 2.937 9.546 -1.671 1.00 0.00 O ATOM 599 CB ASP A 50 0.082 11.338 -1.963 1.00 0.00 C ATOM 600 CG ASP A 50 -0.711 12.579 -2.404 1.00 0.00 C ATOM 601 OD1 ASP A 50 -0.152 13.452 -3.108 1.00 0.00 O ATOM 602 OD2 ASP A 50 -1.911 12.623 -2.041 1.00 0.00 O ATOM 0 H ASP A 50 1.849 11.668 -3.725 1.00 0.00 H new ATOM 0 HA ASP A 50 1.677 12.368 -0.968 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.013 10.581 -2.741 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.389 10.935 -1.067 1.00 0.00 H new ATOM 607 N THR A 51 1.776 9.977 0.189 1.00 0.00 N ATOM 608 CA THR A 51 2.194 8.782 0.915 1.00 0.00 C ATOM 609 C THR A 51 0.934 8.167 1.521 1.00 0.00 C ATOM 610 O THR A 51 0.326 8.769 2.407 1.00 0.00 O ATOM 611 CB THR A 51 3.282 9.076 1.962 1.00 0.00 C ATOM 612 OG1 THR A 51 4.427 9.678 1.389 1.00 0.00 O ATOM 613 CG2 THR A 51 3.778 7.784 2.626 1.00 0.00 C ATOM 0 H THR A 51 1.163 10.584 0.733 1.00 0.00 H new ATOM 0 HA THR A 51 2.667 8.072 0.237 1.00 0.00 H new ATOM 0 HB THR A 51 2.813 9.746 2.682 1.00 0.00 H new ATOM 0 HG1 THR A 51 5.091 9.849 2.089 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.546 8.024 3.361 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.944 7.287 3.122 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.196 7.122 1.867 1.00 0.00 H new ATOM 621 N PHE A 52 0.538 6.977 1.065 1.00 0.00 N ATOM 622 CA PHE A 52 -0.642 6.251 1.528 1.00 0.00 C ATOM 623 C PHE A 52 -0.286 5.371 2.726 1.00 0.00 C ATOM 624 O PHE A 52 0.493 4.426 2.583 1.00 0.00 O ATOM 625 CB PHE A 52 -1.192 5.371 0.394 1.00 0.00 C ATOM 626 CG PHE A 52 -1.443 6.103 -0.904 1.00 0.00 C ATOM 627 CD1 PHE A 52 -2.293 7.221 -0.938 1.00 0.00 C ATOM 628 CD2 PHE A 52 -0.774 5.699 -2.072 1.00 0.00 C ATOM 629 CE1 PHE A 52 -2.405 7.977 -2.116 1.00 0.00 C ATOM 630 CE2 PHE A 52 -0.906 6.445 -3.250 1.00 0.00 C ATOM 631 CZ PHE A 52 -1.686 7.606 -3.262 1.00 0.00 C ATOM 0 H PHE A 52 1.049 6.477 0.338 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.400 6.974 1.829 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.489 4.559 0.208 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.125 4.915 0.725 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.859 7.498 -0.061 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.157 4.812 -2.061 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -3.046 8.846 -2.140 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.405 6.123 -4.151 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.735 8.216 -4.152 1.00 0.00 H new ATOM 641 N VAL A 53 -0.762 5.693 3.927 1.00 0.00 N ATOM 642 CA VAL A 53 -0.491 4.883 5.112 1.00 0.00 C ATOM 643 C VAL A 53 -1.517 3.762 5.125 1.00 0.00 C ATOM 644 O VAL A 53 -2.713 4.028 5.015 1.00 0.00 O ATOM 645 CB VAL A 53 -0.539 5.730 6.409 1.00 0.00 C ATOM 646 CG1 VAL A 53 -1.055 4.996 7.661 1.00 0.00 C ATOM 647 CG2 VAL A 53 0.879 6.204 6.754 1.00 0.00 C ATOM 0 H VAL A 53 -1.340 6.514 4.105 1.00 0.00 H new ATOM 0 HA VAL A 53 0.518 4.472 5.073 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.238 6.535 6.183 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.048 5.678 8.511 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.072 4.646 7.484 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.410 4.143 7.874 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.851 6.801 7.666 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.525 5.339 6.906 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.269 6.809 5.936 1.00 0.00 H new ATOM 657 N PHE A 54 -1.057 2.515 5.227 1.00 0.00 N ATOM 658 CA PHE A 54 -1.960 1.378 5.300 1.00 0.00 C ATOM 659 C PHE A 54 -2.153 1.075 6.779 1.00 0.00 C ATOM 660 O PHE A 54 -1.232 1.219 7.598 1.00 0.00 O ATOM 661 CB PHE A 54 -1.488 0.195 4.455 1.00 0.00 C ATOM 662 CG PHE A 54 -2.070 0.301 3.057 1.00 0.00 C ATOM 663 CD1 PHE A 54 -1.666 1.349 2.207 1.00 0.00 C ATOM 664 CD2 PHE A 54 -3.145 -0.525 2.676 1.00 0.00 C ATOM 665 CE1 PHE A 54 -2.337 1.575 0.995 1.00 0.00 C ATOM 666 CE2 PHE A 54 -3.810 -0.300 1.459 1.00 0.00 C ATOM 667 CZ PHE A 54 -3.411 0.750 0.616 1.00 0.00 C ATOM 0 H PHE A 54 -0.067 2.272 5.260 1.00 0.00 H new ATOM 0 HA PHE A 54 -2.928 1.608 4.855 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -0.399 0.182 4.406 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -1.798 -0.742 4.918 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -0.837 1.981 2.489 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -3.459 -1.333 3.320 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.027 2.385 0.351 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -4.632 -0.938 1.170 1.00 0.00 H new ATOM 0 HZ PHE A 54 -3.926 0.923 -0.318 1.00 0.00 H new ATOM 677 N SER A 55 -3.345 0.619 7.135 1.00 0.00 N ATOM 678 CA SER A 55 -3.677 0.336 8.513 1.00 0.00 C ATOM 679 C SER A 55 -3.096 -0.934 9.119 1.00 0.00 C ATOM 680 O SER A 55 -2.310 -0.840 10.071 1.00 0.00 O ATOM 681 CB SER A 55 -5.186 0.478 8.699 1.00 0.00 C ATOM 682 OG SER A 55 -5.533 1.854 8.683 1.00 0.00 O ATOM 0 H SER A 55 -4.102 0.437 6.476 1.00 0.00 H new ATOM 0 HA SER A 55 -3.158 1.087 9.110 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.713 -0.051 7.905 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.492 0.025 9.642 1.00 0.00 H new ATOM 0 HG SER A 55 -5.028 2.310 7.978 1.00 0.00 H new ATOM 688 N ALA A 56 -3.519 -2.109 8.670 1.00 0.00 N ATOM 689 CA ALA A 56 -3.052 -3.381 9.199 1.00 0.00 C ATOM 690 C ALA A 56 -3.353 -4.465 8.181 1.00 0.00 C ATOM 691 O ALA A 56 -3.948 -4.175 7.147 1.00 0.00 O ATOM 692 CB ALA A 56 -3.807 -3.666 10.510 1.00 0.00 C ATOM 0 H ALA A 56 -4.204 -2.205 7.920 1.00 0.00 H new ATOM 0 HA ALA A 56 -1.980 -3.354 9.393 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -3.471 -4.617 10.924 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -3.608 -2.868 11.225 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.877 -3.715 10.310 1.00 0.00 H new ATOM 698 N ARG A 57 -3.010 -5.719 8.496 1.00 0.00 N ATOM 699 CA ARG A 57 -3.274 -6.845 7.605 1.00 0.00 C ATOM 700 C ARG A 57 -4.753 -6.889 7.225 1.00 0.00 C ATOM 701 O ARG A 57 -5.053 -7.274 6.103 1.00 0.00 O ATOM 702 CB ARG A 57 -2.838 -8.180 8.233 1.00 0.00 C ATOM 703 CG ARG A 57 -1.312 -8.350 8.296 1.00 0.00 C ATOM 704 CD ARG A 57 -0.913 -9.823 8.447 1.00 0.00 C ATOM 705 NE ARG A 57 -1.202 -10.355 9.791 1.00 0.00 N ATOM 706 CZ ARG A 57 -1.117 -11.638 10.160 1.00 0.00 C ATOM 707 NH1 ARG A 57 -0.984 -12.610 9.259 1.00 0.00 N ATOM 708 NH2 ARG A 57 -1.160 -11.935 11.450 1.00 0.00 N ATOM 0 H ARG A 57 -2.546 -5.976 9.367 1.00 0.00 H new ATOM 0 HA ARG A 57 -2.682 -6.698 6.701 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -3.247 -8.251 9.241 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.265 -9.001 7.658 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.862 -7.942 7.391 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.916 -7.778 9.135 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.444 -10.417 7.703 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.152 -9.930 8.239 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.493 -9.685 10.503 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.945 -12.383 8.265 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.921 -13.582 9.563 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -1.256 -11.191 12.142 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -1.097 -12.907 11.752 1.00 0.00 H new ATOM 722 N GLU A 58 -5.656 -6.487 8.130 1.00 0.00 N ATOM 723 CA GLU A 58 -7.087 -6.478 7.859 1.00 0.00 C ATOM 724 C GLU A 58 -7.416 -5.608 6.645 1.00 0.00 C ATOM 725 O GLU A 58 -8.285 -5.978 5.859 1.00 0.00 O ATOM 726 CB GLU A 58 -7.842 -6.013 9.116 1.00 0.00 C ATOM 727 CG GLU A 58 -9.359 -6.022 8.879 1.00 0.00 C ATOM 728 CD GLU A 58 -10.160 -6.133 10.173 1.00 0.00 C ATOM 729 OE1 GLU A 58 -10.279 -5.139 10.933 1.00 0.00 O ATOM 730 OE2 GLU A 58 -10.732 -7.222 10.420 1.00 0.00 O ATOM 0 H GLU A 58 -5.409 -6.162 9.065 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.410 -7.490 7.614 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -7.597 -6.665 9.954 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.518 -5.008 9.389 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -9.646 -5.109 8.357 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.615 -6.856 8.226 1.00 0.00 H new ATOM 737 N ASP A 59 -6.731 -4.475 6.469 1.00 0.00 N ATOM 738 CA ASP A 59 -6.958 -3.588 5.333 1.00 0.00 C ATOM 739 C ASP A 59 -6.040 -4.062 4.199 1.00 0.00 C ATOM 740 O ASP A 59 -5.099 -3.396 3.765 1.00 0.00 O ATOM 741 CB ASP A 59 -6.755 -2.115 5.668 1.00 0.00 C ATOM 742 CG ASP A 59 -7.424 -1.356 4.519 1.00 0.00 C ATOM 743 OD1 ASP A 59 -8.674 -1.421 4.447 1.00 0.00 O ATOM 744 OD2 ASP A 59 -6.689 -0.859 3.635 1.00 0.00 O ATOM 0 H ASP A 59 -6.007 -4.151 7.110 1.00 0.00 H new ATOM 0 HA ASP A 59 -8.003 -3.646 5.028 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -7.208 -1.861 6.626 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -5.696 -1.868 5.741 1.00 0.00 H new ATOM 749 N SER A 60 -6.251 -5.299 3.758 1.00 0.00 N ATOM 750 CA SER A 60 -5.447 -5.909 2.707 1.00 0.00 C ATOM 751 C SER A 60 -6.098 -7.149 2.095 1.00 0.00 C ATOM 752 O SER A 60 -5.467 -7.892 1.335 1.00 0.00 O ATOM 753 CB SER A 60 -4.098 -6.278 3.340 1.00 0.00 C ATOM 754 OG SER A 60 -3.052 -5.691 2.607 1.00 0.00 O ATOM 0 H SER A 60 -6.986 -5.906 4.121 1.00 0.00 H new ATOM 0 HA SER A 60 -5.336 -5.200 1.886 1.00 0.00 H new ATOM 0 HB2 SER A 60 -4.066 -5.936 4.375 1.00 0.00 H new ATOM 0 HB3 SER A 60 -3.978 -7.361 3.358 1.00 0.00 H new ATOM 0 HG SER A 60 -3.164 -4.717 2.600 1.00 0.00 H new ATOM 760 N TYR A 61 -7.323 -7.463 2.487 1.00 0.00 N ATOM 761 CA TYR A 61 -8.079 -8.602 2.026 1.00 0.00 C ATOM 762 C TYR A 61 -9.528 -8.372 2.427 1.00 0.00 C ATOM 763 O TYR A 61 -9.921 -7.327 2.946 1.00 0.00 O ATOM 764 CB TYR A 61 -7.506 -9.898 2.632 1.00 0.00 C ATOM 765 CG TYR A 61 -7.217 -9.877 4.119 1.00 0.00 C ATOM 766 CD1 TYR A 61 -8.275 -9.819 5.045 1.00 0.00 C ATOM 767 CD2 TYR A 61 -5.890 -9.983 4.579 1.00 0.00 C ATOM 768 CE1 TYR A 61 -8.012 -9.829 6.422 1.00 0.00 C ATOM 769 CE2 TYR A 61 -5.628 -10.071 5.957 1.00 0.00 C ATOM 770 CZ TYR A 61 -6.686 -9.945 6.883 1.00 0.00 C ATOM 771 OH TYR A 61 -6.437 -9.921 8.220 1.00 0.00 O ATOM 0 H TYR A 61 -7.835 -6.900 3.167 1.00 0.00 H new ATOM 0 HA TYR A 61 -8.016 -8.713 0.943 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -8.208 -10.708 2.432 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -6.582 -10.140 2.108 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -9.295 -9.767 4.693 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -5.073 -9.997 3.872 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -8.825 -9.748 7.128 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.619 -10.235 6.307 1.00 0.00 H new ATOM 0 HH TYR A 61 -5.474 -10.013 8.375 1.00 0.00 H new ATOM 781 N ARG A 62 -10.352 -9.353 2.109 1.00 0.00 N ATOM 782 CA ARG A 62 -11.762 -9.372 2.412 1.00 0.00 C ATOM 783 C ARG A 62 -11.946 -10.530 3.374 1.00 0.00 C ATOM 784 O ARG A 62 -11.187 -11.505 3.310 1.00 0.00 O ATOM 785 CB ARG A 62 -12.548 -9.618 1.128 1.00 0.00 C ATOM 786 CG ARG A 62 -12.099 -8.750 -0.062 1.00 0.00 C ATOM 787 CD ARG A 62 -13.074 -8.982 -1.211 1.00 0.00 C ATOM 788 NE ARG A 62 -12.935 -8.004 -2.301 1.00 0.00 N ATOM 789 CZ ARG A 62 -13.861 -7.826 -3.252 1.00 0.00 C ATOM 790 NH1 ARG A 62 -14.978 -8.545 -3.226 1.00 0.00 N ATOM 791 NH2 ARG A 62 -13.681 -6.935 -4.223 1.00 0.00 N ATOM 0 H ARG A 62 -10.041 -10.188 1.614 1.00 0.00 H new ATOM 0 HA ARG A 62 -12.113 -8.434 2.842 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -12.454 -10.669 0.853 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -13.605 -9.432 1.321 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -12.085 -7.697 0.219 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -11.085 -9.013 -0.364 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.921 -9.985 -1.611 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -14.093 -8.944 -0.826 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.091 -7.433 -2.334 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -15.127 -9.229 -2.484 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -15.686 -8.413 -3.948 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -12.828 -6.376 -4.250 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.396 -6.811 -4.940 1.00 0.00 H new ATOM 805 N THR A 63 -12.929 -10.452 4.252 1.00 0.00 N ATOM 806 CA THR A 63 -13.198 -11.515 5.201 1.00 0.00 C ATOM 807 C THR A 63 -14.655 -11.908 4.974 1.00 0.00 C ATOM 808 O THR A 63 -15.403 -11.195 4.294 1.00 0.00 O ATOM 809 CB THR A 63 -12.852 -11.061 6.634 1.00 0.00 C ATOM 810 OG1 THR A 63 -13.674 -10.017 7.085 1.00 0.00 O ATOM 811 CG2 THR A 63 -11.402 -10.580 6.750 1.00 0.00 C ATOM 0 H THR A 63 -13.560 -9.654 4.327 1.00 0.00 H new ATOM 0 HA THR A 63 -12.574 -12.397 5.057 1.00 0.00 H new ATOM 0 HB THR A 63 -13.010 -11.946 7.250 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.926 -9.449 6.328 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.202 -10.270 7.776 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.727 -11.391 6.478 1.00 0.00 H new ATOM 0 HG23 THR A 63 -11.244 -9.736 6.079 1.00 0.00 H new ATOM 819 N ASP A 64 -15.068 -13.072 5.468 1.00 0.00 N ATOM 820 CA ASP A 64 -16.457 -13.479 5.298 1.00 0.00 C ATOM 821 C ASP A 64 -17.349 -12.531 6.109 1.00 0.00 C ATOM 822 O ASP A 64 -18.475 -12.235 5.698 1.00 0.00 O ATOM 823 CB ASP A 64 -16.659 -14.943 5.682 1.00 0.00 C ATOM 824 CG ASP A 64 -18.133 -15.316 5.588 1.00 0.00 C ATOM 825 OD1 ASP A 64 -18.716 -15.247 4.483 1.00 0.00 O ATOM 826 OD2 ASP A 64 -18.734 -15.639 6.640 1.00 0.00 O ATOM 0 H ASP A 64 -14.479 -13.733 5.975 1.00 0.00 H new ATOM 0 HA ASP A 64 -16.737 -13.407 4.247 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.072 -15.583 5.023 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.298 -15.113 6.696 1.00 0.00 H new ATOM 831 N THR A 65 -16.846 -12.014 7.238 1.00 0.00 N ATOM 832 CA THR A 65 -17.586 -11.087 8.080 1.00 0.00 C ATOM 833 C THR A 65 -17.822 -9.789 7.303 1.00 0.00 C ATOM 834 O THR A 65 -18.943 -9.278 7.332 1.00 0.00 O ATOM 835 CB THR A 65 -16.881 -10.860 9.429 1.00 0.00 C ATOM 836 OG1 THR A 65 -15.582 -10.329 9.284 1.00 0.00 O ATOM 837 CG2 THR A 65 -16.743 -12.162 10.214 1.00 0.00 C ATOM 0 H THR A 65 -15.913 -12.232 7.587 1.00 0.00 H new ATOM 0 HA THR A 65 -18.557 -11.515 8.331 1.00 0.00 H new ATOM 0 HB THR A 65 -17.512 -10.148 9.960 1.00 0.00 H new ATOM 0 HG1 THR A 65 -15.298 -10.409 8.349 1.00 0.00 H new ATOM 0 HG21 THR A 65 -16.241 -11.964 11.161 1.00 0.00 H new ATOM 0 HG22 THR A 65 -17.732 -12.577 10.407 1.00 0.00 H new ATOM 0 HG23 THR A 65 -16.157 -12.876 9.635 1.00 0.00 H new ATOM 845 N ALA A 66 -16.810 -9.251 6.606 1.00 0.00 N ATOM 846 CA ALA A 66 -16.948 -8.034 5.825 1.00 0.00 C ATOM 847 C ALA A 66 -15.807 -7.866 4.819 1.00 0.00 C ATOM 848 O ALA A 66 -14.669 -8.277 5.022 1.00 0.00 O ATOM 849 CB ALA A 66 -16.991 -6.818 6.757 1.00 0.00 C ATOM 0 H ALA A 66 -15.874 -9.656 6.574 1.00 0.00 H new ATOM 0 HA ALA A 66 -17.880 -8.109 5.265 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.095 -5.909 6.165 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -17.840 -6.908 7.434 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -16.069 -6.771 7.336 1.00 0.00 H new ATOM 855 N VAL A 67 -16.117 -7.229 3.700 1.00 0.00 N ATOM 856 CA VAL A 67 -15.177 -6.934 2.635 1.00 0.00 C ATOM 857 C VAL A 67 -14.569 -5.568 2.953 1.00 0.00 C ATOM 858 O VAL A 67 -15.276 -4.662 3.399 1.00 0.00 O ATOM 859 CB VAL A 67 -15.937 -6.902 1.295 1.00 0.00 C ATOM 860 CG1 VAL A 67 -15.101 -6.379 0.130 1.00 0.00 C ATOM 861 CG2 VAL A 67 -16.506 -8.285 0.934 1.00 0.00 C ATOM 0 H VAL A 67 -17.060 -6.894 3.504 1.00 0.00 H new ATOM 0 HA VAL A 67 -14.391 -7.686 2.558 1.00 0.00 H new ATOM 0 HB VAL A 67 -16.755 -6.199 1.451 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -15.701 -6.385 -0.780 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -14.776 -5.361 0.344 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -14.228 -7.017 -0.007 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -17.035 -8.224 -0.017 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -15.690 -9.003 0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -17.196 -8.609 1.713 1.00 0.00 H new ATOM 871 N PHE A 68 -13.282 -5.403 2.660 1.00 0.00 N ATOM 872 CA PHE A 68 -12.523 -4.173 2.859 1.00 0.00 C ATOM 873 C PHE A 68 -11.764 -3.925 1.549 1.00 0.00 C ATOM 874 O PHE A 68 -10.562 -3.672 1.537 1.00 0.00 O ATOM 875 CB PHE A 68 -11.590 -4.313 4.081 1.00 0.00 C ATOM 876 CG PHE A 68 -12.206 -4.974 5.305 1.00 0.00 C ATOM 877 CD1 PHE A 68 -13.397 -4.480 5.871 1.00 0.00 C ATOM 878 CD2 PHE A 68 -11.615 -6.132 5.845 1.00 0.00 C ATOM 879 CE1 PHE A 68 -13.996 -5.140 6.955 1.00 0.00 C ATOM 880 CE2 PHE A 68 -12.216 -6.796 6.927 1.00 0.00 C ATOM 881 CZ PHE A 68 -13.414 -6.309 7.470 1.00 0.00 C ATOM 0 H PHE A 68 -12.717 -6.153 2.261 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.163 -3.319 3.079 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.713 -4.888 3.782 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.240 -3.320 4.364 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -13.852 -3.587 5.468 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -10.695 -6.512 5.425 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -14.903 -4.749 7.392 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -11.756 -7.681 7.341 1.00 0.00 H new ATOM 0 HZ PHE A 68 -13.889 -6.834 8.285 1.00 0.00 H new ATOM 891 N ASN A 69 -12.450 -4.131 0.418 1.00 0.00 N ATOM 892 CA ASN A 69 -11.881 -3.968 -0.903 1.00 0.00 C ATOM 893 C ASN A 69 -11.454 -2.533 -1.203 1.00 0.00 C ATOM 894 O ASN A 69 -12.292 -1.647 -1.322 1.00 0.00 O ATOM 895 CB ASN A 69 -12.794 -4.540 -1.996 1.00 0.00 C ATOM 896 CG ASN A 69 -13.982 -3.674 -2.414 1.00 0.00 C ATOM 897 OD1 ASN A 69 -15.081 -3.821 -1.885 1.00 0.00 O ATOM 898 ND2 ASN A 69 -13.834 -2.852 -3.438 1.00 0.00 N ATOM 0 H ASN A 69 -13.428 -4.419 0.407 1.00 0.00 H new ATOM 0 HA ASN A 69 -10.964 -4.557 -0.908 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -12.187 -4.736 -2.880 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -13.176 -5.501 -1.653 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -14.636 -2.333 -3.796 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -12.918 -2.736 -3.871 1.00 0.00 H new ATOM 905 N ASP A 70 -10.153 -2.319 -1.333 1.00 0.00 N ATOM 906 CA ASP A 70 -9.557 -1.033 -1.647 1.00 0.00 C ATOM 907 C ASP A 70 -9.688 -0.820 -3.142 1.00 0.00 C ATOM 908 O ASP A 70 -9.620 -1.773 -3.941 1.00 0.00 O ATOM 909 CB ASP A 70 -8.095 -1.055 -1.178 1.00 0.00 C ATOM 910 CG ASP A 70 -6.987 -0.499 -2.087 1.00 0.00 C ATOM 911 OD1 ASP A 70 -7.181 0.491 -2.816 1.00 0.00 O ATOM 912 OD2 ASP A 70 -5.893 -1.122 -2.072 1.00 0.00 O ATOM 0 H ASP A 70 -9.463 -3.061 -1.219 1.00 0.00 H new ATOM 0 HA ASP A 70 -10.053 -0.205 -1.141 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.048 -0.506 -0.237 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -7.842 -2.092 -0.955 1.00 0.00 H new ATOM 917 N LEU A 71 -9.961 0.428 -3.505 1.00 0.00 N ATOM 918 CA LEU A 71 -10.100 0.878 -4.847 1.00 0.00 C ATOM 919 C LEU A 71 -9.380 2.213 -4.947 1.00 0.00 C ATOM 920 O LEU A 71 -9.908 3.251 -4.546 1.00 0.00 O ATOM 921 CB LEU A 71 -11.565 1.043 -5.196 1.00 0.00 C ATOM 922 CG LEU A 71 -12.413 -0.228 -5.204 1.00 0.00 C ATOM 923 CD1 LEU A 71 -13.888 0.135 -5.408 1.00 0.00 C ATOM 924 CD2 LEU A 71 -12.013 -1.198 -6.313 1.00 0.00 C ATOM 0 H LEU A 71 -10.094 1.175 -2.823 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.674 0.156 -5.544 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -12.007 1.743 -4.488 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.631 1.503 -6.182 1.00 0.00 H new ATOM 0 HG LEU A 71 -12.249 -0.716 -4.243 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -14.489 -0.774 -5.413 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -14.219 0.784 -4.597 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -14.007 0.654 -6.359 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -12.649 -2.082 -6.270 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.132 -0.712 -7.282 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -10.972 -1.493 -6.180 1.00 0.00 H new ATOM 936 N ILE A 72 -8.206 2.190 -5.557 1.00 0.00 N ATOM 937 CA ILE A 72 -7.383 3.387 -5.738 1.00 0.00 C ATOM 938 C ILE A 72 -7.871 4.094 -6.999 1.00 0.00 C ATOM 939 O ILE A 72 -8.168 3.432 -8.006 1.00 0.00 O ATOM 940 CB ILE A 72 -5.885 3.033 -5.901 1.00 0.00 C ATOM 941 CG1 ILE A 72 -5.403 2.158 -4.727 1.00 0.00 C ATOM 942 CG2 ILE A 72 -5.044 4.309 -6.092 1.00 0.00 C ATOM 943 CD1 ILE A 72 -3.895 1.920 -4.644 1.00 0.00 C ATOM 0 H ILE A 72 -7.791 1.342 -5.943 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.476 4.022 -4.857 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.752 2.438 -6.804 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.729 2.622 -3.796 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.901 1.190 -4.793 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.994 4.039 -6.205 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.381 4.837 -6.984 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.161 4.956 -5.222 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.673 1.293 -3.781 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.555 1.422 -5.552 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.381 2.876 -4.540 1.00 0.00 H new ATOM 955 N LEU A 73 -8.064 5.404 -6.911 1.00 0.00 N ATOM 956 CA LEU A 73 -8.466 6.307 -7.976 1.00 0.00 C ATOM 957 C LEU A 73 -7.245 7.185 -8.319 1.00 0.00 C ATOM 958 O LEU A 73 -6.394 7.391 -7.464 1.00 0.00 O ATOM 959 CB LEU A 73 -9.651 7.159 -7.483 1.00 0.00 C ATOM 960 CG LEU A 73 -10.802 7.387 -8.472 1.00 0.00 C ATOM 961 CD1 LEU A 73 -10.349 7.910 -9.834 1.00 0.00 C ATOM 962 CD2 LEU A 73 -11.622 6.111 -8.655 1.00 0.00 C ATOM 0 H LEU A 73 -7.933 5.897 -6.027 1.00 0.00 H new ATOM 0 HA LEU A 73 -8.787 5.769 -8.868 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -10.060 6.687 -6.590 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.266 8.133 -7.181 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.421 8.166 -8.027 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.217 8.046 -10.479 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -9.839 8.865 -9.706 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -9.667 7.193 -10.291 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -12.432 6.297 -9.360 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -10.980 5.318 -9.040 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.039 5.806 -7.695 1.00 0.00 H new ATOM 974 N ASP A 74 -7.177 7.720 -9.541 1.00 0.00 N ATOM 975 CA ASP A 74 -6.145 8.617 -10.096 1.00 0.00 C ATOM 976 C ASP A 74 -4.691 8.393 -9.636 1.00 0.00 C ATOM 977 O ASP A 74 -3.942 9.354 -9.453 1.00 0.00 O ATOM 978 CB ASP A 74 -6.565 10.089 -9.866 1.00 0.00 C ATOM 979 CG ASP A 74 -7.884 10.532 -10.498 1.00 0.00 C ATOM 980 OD1 ASP A 74 -8.233 10.067 -11.609 1.00 0.00 O ATOM 981 OD2 ASP A 74 -8.581 11.398 -9.915 1.00 0.00 O ATOM 0 H ASP A 74 -7.902 7.523 -10.231 1.00 0.00 H new ATOM 0 HA ASP A 74 -6.110 8.362 -11.155 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.627 10.261 -8.792 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.772 10.733 -10.246 1.00 0.00 H new ATOM 986 N PHE A 75 -4.277 7.133 -9.511 1.00 0.00 N ATOM 987 CA PHE A 75 -2.932 6.742 -9.067 1.00 0.00 C ATOM 988 C PHE A 75 -1.856 7.325 -9.984 1.00 0.00 C ATOM 989 O PHE A 75 -1.989 7.213 -11.207 1.00 0.00 O ATOM 990 CB PHE A 75 -2.825 5.209 -9.056 1.00 0.00 C ATOM 991 CG PHE A 75 -1.563 4.632 -8.429 1.00 0.00 C ATOM 992 CD1 PHE A 75 -1.306 4.815 -7.057 1.00 0.00 C ATOM 993 CD2 PHE A 75 -0.669 3.860 -9.199 1.00 0.00 C ATOM 994 CE1 PHE A 75 -0.186 4.211 -6.457 1.00 0.00 C ATOM 995 CE2 PHE A 75 0.433 3.231 -8.590 1.00 0.00 C ATOM 996 CZ PHE A 75 0.681 3.413 -7.220 1.00 0.00 C ATOM 0 H PHE A 75 -4.877 6.335 -9.719 1.00 0.00 H new ATOM 0 HA PHE A 75 -2.773 7.135 -8.063 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -3.687 4.808 -8.523 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -2.892 4.853 -10.084 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -1.972 5.422 -6.462 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.831 3.751 -10.261 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.008 4.362 -5.405 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.090 2.607 -9.178 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.534 2.941 -6.756 1.00 0.00 H new ATOM 1006 N GLU A 76 -0.772 7.871 -9.429 1.00 0.00 N ATOM 1007 CA GLU A 76 0.345 8.471 -10.154 1.00 0.00 C ATOM 1008 C GLU A 76 1.622 7.875 -9.550 1.00 0.00 C ATOM 1009 O GLU A 76 2.356 8.526 -8.808 1.00 0.00 O ATOM 1010 CB GLU A 76 0.230 10.015 -10.104 1.00 0.00 C ATOM 1011 CG GLU A 76 0.621 10.733 -11.411 1.00 0.00 C ATOM 1012 CD GLU A 76 2.115 10.767 -11.748 1.00 0.00 C ATOM 1013 OE1 GLU A 76 2.941 11.144 -10.890 1.00 0.00 O ATOM 1014 OE2 GLU A 76 2.477 10.535 -12.927 1.00 0.00 O ATOM 0 H GLU A 76 -0.645 7.908 -8.418 1.00 0.00 H new ATOM 0 HA GLU A 76 0.352 8.243 -11.220 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.797 10.281 -9.852 1.00 0.00 H new ATOM 0 HB3 GLU A 76 0.863 10.387 -9.298 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.095 10.252 -12.236 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.259 11.760 -11.358 1.00 0.00 H new ATOM 1021 N ALA A 77 1.904 6.609 -9.899 1.00 0.00 N ATOM 1022 CA ALA A 77 3.058 5.841 -9.413 1.00 0.00 C ATOM 1023 C ALA A 77 4.405 6.548 -9.554 1.00 0.00 C ATOM 1024 O ALA A 77 5.347 6.196 -8.843 1.00 0.00 O ATOM 1025 CB ALA A 77 3.159 4.492 -10.123 1.00 0.00 C ATOM 0 H ALA A 77 1.319 6.079 -10.544 1.00 0.00 H new ATOM 0 HA ALA A 77 2.863 5.718 -8.348 1.00 0.00 H new ATOM 0 HB1 ALA A 77 4.022 3.945 -9.744 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.253 3.915 -9.938 1.00 0.00 H new ATOM 0 HB3 ALA A 77 3.274 4.653 -11.195 1.00 0.00 H new ATOM 1031 N SER A 78 4.500 7.509 -10.471 1.00 0.00 N ATOM 1032 CA SER A 78 5.710 8.280 -10.697 1.00 0.00 C ATOM 1033 C SER A 78 6.172 8.911 -9.373 1.00 0.00 C ATOM 1034 O SER A 78 7.329 8.707 -8.989 1.00 0.00 O ATOM 1035 CB SER A 78 5.444 9.344 -11.771 1.00 0.00 C ATOM 1036 OG SER A 78 6.233 9.116 -12.923 1.00 0.00 O ATOM 0 H SER A 78 3.727 7.773 -11.082 1.00 0.00 H new ATOM 0 HA SER A 78 6.509 7.632 -11.056 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.388 9.335 -12.042 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.661 10.333 -11.368 1.00 0.00 H new ATOM 0 HG SER A 78 6.043 9.807 -13.592 1.00 0.00 H new ATOM 1042 N GLU A 79 5.291 9.588 -8.628 1.00 0.00 N ATOM 1043 CA GLU A 79 5.609 10.227 -7.359 1.00 0.00 C ATOM 1044 C GLU A 79 4.909 9.615 -6.138 1.00 0.00 C ATOM 1045 O GLU A 79 5.471 9.731 -5.046 1.00 0.00 O ATOM 1046 CB GLU A 79 5.240 11.691 -7.525 1.00 0.00 C ATOM 1047 CG GLU A 79 6.031 12.389 -8.628 1.00 0.00 C ATOM 1048 CD GLU A 79 7.343 13.014 -8.130 1.00 0.00 C ATOM 1049 OE1 GLU A 79 7.346 14.063 -7.444 1.00 0.00 O ATOM 1050 OE2 GLU A 79 8.417 12.434 -8.427 1.00 0.00 O ATOM 0 H GLU A 79 4.316 9.706 -8.903 1.00 0.00 H new ATOM 0 HA GLU A 79 6.668 10.081 -7.145 1.00 0.00 H new ATOM 0 HB2 GLU A 79 4.175 11.768 -7.746 1.00 0.00 H new ATOM 0 HB3 GLU A 79 5.408 12.211 -6.582 1.00 0.00 H new ATOM 0 HG2 GLU A 79 6.255 11.670 -9.416 1.00 0.00 H new ATOM 0 HG3 GLU A 79 5.411 13.167 -9.073 1.00 0.00 H new ATOM 1057 N ASP A 80 3.780 8.914 -6.293 1.00 0.00 N ATOM 1058 CA ASP A 80 3.030 8.311 -5.178 1.00 0.00 C ATOM 1059 C ASP A 80 3.886 7.347 -4.351 1.00 0.00 C ATOM 1060 O ASP A 80 4.717 6.613 -4.897 1.00 0.00 O ATOM 1061 CB ASP A 80 1.796 7.526 -5.679 1.00 0.00 C ATOM 1062 CG ASP A 80 0.509 8.331 -5.807 1.00 0.00 C ATOM 1063 OD1 ASP A 80 0.321 9.290 -5.038 1.00 0.00 O ATOM 1064 OD2 ASP A 80 -0.377 7.897 -6.583 1.00 0.00 O ATOM 0 H ASP A 80 3.354 8.746 -7.205 1.00 0.00 H new ATOM 0 HA ASP A 80 2.719 9.149 -4.555 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.032 7.096 -6.652 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.616 6.694 -4.998 1.00 0.00 H new ATOM 1069 N ARG A 81 3.619 7.252 -3.041 1.00 0.00 N ATOM 1070 CA ARG A 81 4.329 6.382 -2.087 1.00 0.00 C ATOM 1071 C ARG A 81 3.376 5.622 -1.177 1.00 0.00 C ATOM 1072 O ARG A 81 2.198 5.970 -1.077 1.00 0.00 O ATOM 1073 CB ARG A 81 5.338 7.196 -1.275 1.00 0.00 C ATOM 1074 CG ARG A 81 6.349 7.841 -2.223 1.00 0.00 C ATOM 1075 CD ARG A 81 7.634 8.206 -1.504 1.00 0.00 C ATOM 1076 NE ARG A 81 7.583 9.553 -0.933 1.00 0.00 N ATOM 1077 CZ ARG A 81 8.410 9.989 0.013 1.00 0.00 C ATOM 1078 NH1 ARG A 81 9.202 9.149 0.675 1.00 0.00 N ATOM 1079 NH2 ARG A 81 8.445 11.277 0.305 1.00 0.00 N ATOM 0 H ARG A 81 2.878 7.796 -2.599 1.00 0.00 H new ATOM 0 HA ARG A 81 4.869 5.633 -2.666 1.00 0.00 H new ATOM 0 HB2 ARG A 81 4.823 7.964 -0.698 1.00 0.00 H new ATOM 0 HB3 ARG A 81 5.852 6.552 -0.561 1.00 0.00 H new ATOM 0 HG2 ARG A 81 6.571 7.155 -3.041 1.00 0.00 H new ATOM 0 HG3 ARG A 81 5.913 8.736 -2.667 1.00 0.00 H new ATOM 0 HD2 ARG A 81 7.822 7.483 -0.710 1.00 0.00 H new ATOM 0 HD3 ARG A 81 8.470 8.140 -2.200 1.00 0.00 H new ATOM 0 HE ARG A 81 6.871 10.195 -1.281 1.00 0.00 H new ATOM 0 HH11 ARG A 81 9.181 8.152 0.460 1.00 0.00 H new ATOM 0 HH12 ARG A 81 9.830 9.502 1.397 1.00 0.00 H new ATOM 0 HH21 ARG A 81 7.840 11.930 -0.194 1.00 0.00 H new ATOM 0 HH22 ARG A 81 9.077 11.619 1.029 1.00 0.00 H new ATOM 1093 N ILE A 82 3.866 4.617 -0.440 1.00 0.00 N ATOM 1094 CA ILE A 82 3.032 3.796 0.419 1.00 0.00 C ATOM 1095 C ILE A 82 3.767 3.322 1.689 1.00 0.00 C ATOM 1096 O ILE A 82 4.884 2.802 1.622 1.00 0.00 O ATOM 1097 CB ILE A 82 2.586 2.556 -0.406 1.00 0.00 C ATOM 1098 CG1 ILE A 82 2.360 2.749 -1.928 1.00 0.00 C ATOM 1099 CG2 ILE A 82 1.285 2.011 0.195 1.00 0.00 C ATOM 1100 CD1 ILE A 82 2.126 1.443 -2.690 1.00 0.00 C ATOM 0 H ILE A 82 4.852 4.358 -0.429 1.00 0.00 H new ATOM 0 HA ILE A 82 2.184 4.395 0.751 1.00 0.00 H new ATOM 0 HB ILE A 82 3.435 1.876 -0.335 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.502 3.404 -2.078 1.00 0.00 H new ATOM 0 HG13 ILE A 82 3.226 3.256 -2.353 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.959 1.140 -0.373 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.456 1.724 1.233 1.00 0.00 H new ATOM 0 HG23 ILE A 82 0.514 2.781 0.153 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.976 1.661 -3.747 1.00 0.00 H new ATOM 0 HD12 ILE A 82 2.993 0.793 -2.573 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.242 0.944 -2.293 1.00 0.00 H new ATOM 1112 N ASP A 83 3.140 3.480 2.862 1.00 0.00 N ATOM 1113 CA ASP A 83 3.670 3.040 4.155 1.00 0.00 C ATOM 1114 C ASP A 83 2.903 1.768 4.504 1.00 0.00 C ATOM 1115 O ASP A 83 1.795 1.807 5.049 1.00 0.00 O ATOM 1116 CB ASP A 83 3.560 4.118 5.244 1.00 0.00 C ATOM 1117 CG ASP A 83 4.106 3.705 6.631 1.00 0.00 C ATOM 1118 OD1 ASP A 83 3.871 2.574 7.123 1.00 0.00 O ATOM 1119 OD2 ASP A 83 4.741 4.555 7.308 1.00 0.00 O ATOM 0 H ASP A 83 2.227 3.929 2.938 1.00 0.00 H new ATOM 0 HA ASP A 83 4.741 2.847 4.092 1.00 0.00 H new ATOM 0 HB2 ASP A 83 4.095 5.007 4.910 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.512 4.399 5.352 1.00 0.00 H new ATOM 1124 N LEU A 84 3.501 0.625 4.167 1.00 0.00 N ATOM 1125 CA LEU A 84 2.956 -0.714 4.376 1.00 0.00 C ATOM 1126 C LEU A 84 3.589 -1.391 5.593 1.00 0.00 C ATOM 1127 O LEU A 84 3.645 -2.620 5.635 1.00 0.00 O ATOM 1128 CB LEU A 84 3.158 -1.561 3.097 1.00 0.00 C ATOM 1129 CG LEU A 84 2.530 -0.988 1.816 1.00 0.00 C ATOM 1130 CD1 LEU A 84 2.731 -1.964 0.653 1.00 0.00 C ATOM 1131 CD2 LEU A 84 1.045 -0.691 2.034 1.00 0.00 C ATOM 0 H LEU A 84 4.418 0.608 3.722 1.00 0.00 H new ATOM 0 HA LEU A 84 1.888 -0.629 4.579 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.228 -1.687 2.931 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.744 -2.554 3.271 1.00 0.00 H new ATOM 0 HG LEU A 84 3.026 -0.050 1.567 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.283 -1.550 -0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.797 -2.121 0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.256 -2.916 0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.617 -0.286 1.117 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.525 -1.611 2.302 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.934 0.036 2.838 1.00 0.00 H new ATOM 1143 N SER A 85 4.095 -0.632 6.575 1.00 0.00 N ATOM 1144 CA SER A 85 4.737 -1.199 7.761 1.00 0.00 C ATOM 1145 C SER A 85 3.874 -2.223 8.522 1.00 0.00 C ATOM 1146 O SER A 85 4.432 -3.082 9.212 1.00 0.00 O ATOM 1147 CB SER A 85 5.297 -0.084 8.659 1.00 0.00 C ATOM 1148 OG SER A 85 4.352 0.906 9.045 1.00 0.00 O ATOM 0 H SER A 85 4.069 0.388 6.567 1.00 0.00 H new ATOM 0 HA SER A 85 5.579 -1.793 7.406 1.00 0.00 H new ATOM 0 HB2 SER A 85 5.714 -0.537 9.558 1.00 0.00 H new ATOM 0 HB3 SER A 85 6.120 0.404 8.137 1.00 0.00 H new ATOM 0 HG SER A 85 4.016 1.366 8.248 1.00 0.00 H new ATOM 1154 N ALA A 86 2.545 -2.187 8.369 1.00 0.00 N ATOM 1155 CA ALA A 86 1.597 -3.094 9.011 1.00 0.00 C ATOM 1156 C ALA A 86 1.046 -4.173 8.123 1.00 0.00 C ATOM 1157 O ALA A 86 0.203 -4.953 8.579 1.00 0.00 O ATOM 1158 CB ALA A 86 0.529 -2.268 9.730 1.00 0.00 C ATOM 0 H ALA A 86 2.087 -1.498 7.772 1.00 0.00 H new ATOM 0 HA ALA A 86 2.146 -3.678 9.750 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -0.184 -2.936 10.213 1.00 0.00 H new ATOM 0 HB2 ALA A 86 1.002 -1.637 10.483 1.00 0.00 H new ATOM 0 HB3 ALA A 86 0.007 -1.641 9.008 1.00 0.00 H new ATOM 1164 N LEU A 87 1.453 -4.206 6.865 1.00 0.00 N ATOM 1165 CA LEU A 87 1.011 -5.277 6.015 1.00 0.00 C ATOM 1166 C LEU A 87 2.072 -6.355 6.230 1.00 0.00 C ATOM 1167 O LEU A 87 3.238 -6.065 6.483 1.00 0.00 O ATOM 1168 CB LEU A 87 0.898 -4.859 4.554 1.00 0.00 C ATOM 1169 CG LEU A 87 -0.108 -3.723 4.265 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -0.426 -3.783 2.766 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -1.406 -3.763 5.092 1.00 0.00 C ATOM 0 H LEU A 87 2.070 -3.522 6.428 1.00 0.00 H new ATOM 0 HA LEU A 87 0.005 -5.617 6.261 1.00 0.00 H new ATOM 0 HB2 LEU A 87 1.883 -4.546 4.206 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.614 -5.731 3.965 1.00 0.00 H new ATOM 0 HG LEU A 87 0.360 -2.784 4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.136 -2.996 2.513 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.491 -3.642 2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.859 -4.754 2.525 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.042 -2.923 4.812 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -1.933 -4.697 4.898 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.164 -3.697 6.153 1.00 0.00 H new ATOM 1183 N GLY A 88 1.661 -7.598 6.035 1.00 0.00 N ATOM 1184 CA GLY A 88 2.396 -8.859 6.133 1.00 0.00 C ATOM 1185 C GLY A 88 3.821 -8.878 5.554 1.00 0.00 C ATOM 1186 O GLY A 88 4.526 -9.863 5.797 1.00 0.00 O ATOM 0 H GLY A 88 0.691 -7.772 5.773 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.453 -9.138 7.185 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.814 -9.631 5.630 1.00 0.00 H new ATOM 1190 N PHE A 89 4.205 -7.906 4.721 1.00 0.00 N ATOM 1191 CA PHE A 89 5.518 -7.702 4.129 1.00 0.00 C ATOM 1192 C PHE A 89 5.695 -6.194 4.010 1.00 0.00 C ATOM 1193 O PHE A 89 4.734 -5.421 4.042 1.00 0.00 O ATOM 1194 CB PHE A 89 5.751 -8.318 2.743 1.00 0.00 C ATOM 1195 CG PHE A 89 7.208 -8.358 2.287 1.00 0.00 C ATOM 1196 CD1 PHE A 89 8.239 -8.695 3.179 1.00 0.00 C ATOM 1197 CD2 PHE A 89 7.547 -7.990 0.973 1.00 0.00 C ATOM 1198 CE1 PHE A 89 9.587 -8.604 2.798 1.00 0.00 C ATOM 1199 CE2 PHE A 89 8.897 -7.892 0.589 1.00 0.00 C ATOM 1200 CZ PHE A 89 9.920 -8.191 1.501 1.00 0.00 C ATOM 0 H PHE A 89 3.547 -7.186 4.423 1.00 0.00 H new ATOM 0 HA PHE A 89 6.234 -8.208 4.777 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.359 -9.335 2.744 1.00 0.00 H new ATOM 0 HB3 PHE A 89 5.173 -7.755 2.011 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.991 -9.030 4.175 1.00 0.00 H new ATOM 0 HD2 PHE A 89 6.768 -7.782 0.255 1.00 0.00 H new ATOM 0 HE1 PHE A 89 10.366 -8.852 3.503 1.00 0.00 H new ATOM 0 HE2 PHE A 89 9.148 -7.584 -0.415 1.00 0.00 H new ATOM 0 HZ PHE A 89 10.955 -8.104 1.206 1.00 0.00 H new ATOM 1210 N SER A 90 6.938 -5.801 3.810 1.00 0.00 N ATOM 1211 CA SER A 90 7.349 -4.420 3.690 1.00 0.00 C ATOM 1212 C SER A 90 7.249 -3.899 2.263 1.00 0.00 C ATOM 1213 O SER A 90 6.777 -2.778 2.075 1.00 0.00 O ATOM 1214 CB SER A 90 8.767 -4.278 4.250 1.00 0.00 C ATOM 1215 OG SER A 90 9.607 -5.310 3.765 1.00 0.00 O ATOM 0 H SER A 90 7.714 -6.458 3.724 1.00 0.00 H new ATOM 0 HA SER A 90 6.664 -3.802 4.271 1.00 0.00 H new ATOM 0 HB2 SER A 90 9.177 -3.308 3.970 1.00 0.00 H new ATOM 0 HB3 SER A 90 8.737 -4.309 5.339 1.00 0.00 H new ATOM 0 HG SER A 90 10.508 -5.199 4.134 1.00 0.00 H new ATOM 1221 N GLY A 91 7.677 -4.691 1.278 1.00 0.00 N ATOM 1222 CA GLY A 91 7.675 -4.328 -0.134 1.00 0.00 C ATOM 1223 C GLY A 91 6.908 -5.352 -0.949 1.00 0.00 C ATOM 1224 O GLY A 91 5.773 -5.690 -0.600 1.00 0.00 O ATOM 0 H GLY A 91 8.044 -5.627 1.449 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.225 -3.343 -0.261 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.700 -4.259 -0.499 1.00 0.00 H new ATOM 1228 N LEU A 92 7.507 -5.848 -2.034 1.00 0.00 N ATOM 1229 CA LEU A 92 6.938 -6.824 -2.935 1.00 0.00 C ATOM 1230 C LEU A 92 7.837 -8.037 -3.105 1.00 0.00 C ATOM 1231 O LEU A 92 9.012 -8.046 -2.746 1.00 0.00 O ATOM 1232 CB LEU A 92 6.636 -6.196 -4.301 1.00 0.00 C ATOM 1233 CG LEU A 92 7.832 -5.706 -5.157 1.00 0.00 C ATOM 1234 CD1 LEU A 92 7.367 -5.508 -6.606 1.00 0.00 C ATOM 1235 CD2 LEU A 92 8.448 -4.389 -4.663 1.00 0.00 C ATOM 0 H LEU A 92 8.445 -5.560 -2.312 1.00 0.00 H new ATOM 0 HA LEU A 92 6.004 -7.163 -2.486 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.082 -6.927 -4.889 1.00 0.00 H new ATOM 0 HB3 LEU A 92 5.972 -5.347 -4.139 1.00 0.00 H new ATOM 0 HG LEU A 92 8.602 -6.473 -5.077 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.204 -5.163 -7.213 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.997 -6.454 -7.002 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.569 -4.766 -6.634 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.279 -4.110 -5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.692 -3.604 -4.683 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.811 -4.517 -3.643 1.00 0.00 H new ATOM 1247 N GLY A 93 7.241 -9.063 -3.686 1.00 0.00 N ATOM 1248 CA GLY A 93 7.855 -10.334 -3.974 1.00 0.00 C ATOM 1249 C GLY A 93 6.866 -11.260 -4.669 1.00 0.00 C ATOM 1250 O GLY A 93 6.499 -11.004 -5.816 1.00 0.00 O ATOM 0 H GLY A 93 6.266 -9.024 -3.982 1.00 0.00 H new ATOM 0 HA2 GLY A 93 8.730 -10.186 -4.607 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.204 -10.794 -3.049 1.00 0.00 H new ATOM 1254 N ASP A 94 6.351 -12.259 -3.951 1.00 0.00 N ATOM 1255 CA ASP A 94 5.436 -13.289 -4.471 1.00 0.00 C ATOM 1256 C ASP A 94 4.106 -13.453 -3.735 1.00 0.00 C ATOM 1257 O ASP A 94 3.290 -14.283 -4.132 1.00 0.00 O ATOM 1258 CB ASP A 94 6.174 -14.634 -4.604 1.00 0.00 C ATOM 1259 CG ASP A 94 6.560 -15.296 -3.276 1.00 0.00 C ATOM 1260 OD1 ASP A 94 7.437 -14.746 -2.561 1.00 0.00 O ATOM 1261 OD2 ASP A 94 6.032 -16.384 -2.974 1.00 0.00 O ATOM 0 H ASP A 94 6.562 -12.382 -2.961 1.00 0.00 H new ATOM 0 HA ASP A 94 5.134 -12.920 -5.451 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.544 -15.323 -5.166 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.079 -14.478 -5.191 1.00 0.00 H new ATOM 1266 N GLY A 95 3.812 -12.599 -2.752 1.00 0.00 N ATOM 1267 CA GLY A 95 2.567 -12.631 -1.987 1.00 0.00 C ATOM 1268 C GLY A 95 2.265 -13.980 -1.405 1.00 0.00 C ATOM 1269 O GLY A 95 1.121 -14.403 -1.489 1.00 0.00 O ATOM 0 H GLY A 95 4.445 -11.853 -2.462 1.00 0.00 H new ATOM 0 HA2 GLY A 95 2.625 -11.899 -1.181 1.00 0.00 H new ATOM 0 HA3 GLY A 95 1.743 -12.329 -2.633 1.00 0.00 H new ATOM 1273 N TYR A 96 3.284 -14.643 -0.884 1.00 0.00 N ATOM 1274 CA TYR A 96 3.261 -15.924 -0.213 1.00 0.00 C ATOM 1275 C TYR A 96 4.507 -15.912 0.656 1.00 0.00 C ATOM 1276 O TYR A 96 5.344 -15.018 0.547 1.00 0.00 O ATOM 1277 CB TYR A 96 3.210 -17.128 -1.144 1.00 0.00 C ATOM 1278 CG TYR A 96 3.265 -18.475 -0.456 1.00 0.00 C ATOM 1279 CD1 TYR A 96 2.324 -18.785 0.543 1.00 0.00 C ATOM 1280 CD2 TYR A 96 4.296 -19.384 -0.761 1.00 0.00 C ATOM 1281 CE1 TYR A 96 2.382 -20.016 1.210 1.00 0.00 C ATOM 1282 CE2 TYR A 96 4.371 -20.614 -0.087 1.00 0.00 C ATOM 1283 CZ TYR A 96 3.396 -20.940 0.883 1.00 0.00 C ATOM 1284 OH TYR A 96 3.426 -22.145 1.503 1.00 0.00 O ATOM 0 H TYR A 96 4.229 -14.262 -0.926 1.00 0.00 H new ATOM 0 HA TYR A 96 2.343 -16.042 0.363 1.00 0.00 H new ATOM 0 HB2 TYR A 96 2.293 -17.075 -1.731 1.00 0.00 H new ATOM 0 HB3 TYR A 96 4.042 -17.061 -1.845 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.554 -18.071 0.797 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.030 -19.135 -1.514 1.00 0.00 H new ATOM 0 HE1 TYR A 96 1.654 -20.256 1.971 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.169 -21.307 -0.309 1.00 0.00 H new ATOM 0 HH TYR A 96 4.184 -22.667 1.167 1.00 0.00 H new ATOM 1294 N GLY A 97 4.518 -16.822 1.613 1.00 0.00 N ATOM 1295 CA GLY A 97 5.527 -17.083 2.639 1.00 0.00 C ATOM 1296 C GLY A 97 5.914 -15.898 3.545 1.00 0.00 C ATOM 1297 O GLY A 97 6.396 -16.118 4.656 1.00 0.00 O ATOM 0 H GLY A 97 3.736 -17.471 1.705 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.166 -17.893 3.273 1.00 0.00 H new ATOM 0 HA3 GLY A 97 6.430 -17.443 2.145 1.00 0.00 H new ATOM 1301 N GLY A 98 5.616 -14.659 3.167 1.00 0.00 N ATOM 1302 CA GLY A 98 5.907 -13.424 3.869 1.00 0.00 C ATOM 1303 C GLY A 98 6.249 -12.294 2.894 1.00 0.00 C ATOM 1304 O GLY A 98 7.004 -11.411 3.280 1.00 0.00 O ATOM 0 H GLY A 98 5.125 -14.484 2.290 1.00 0.00 H new ATOM 0 HA2 GLY A 98 5.047 -13.137 4.474 1.00 0.00 H new ATOM 0 HA3 GLY A 98 6.741 -13.581 4.554 1.00 0.00 H new ATOM 1308 N THR A 99 5.754 -12.307 1.651 1.00 0.00 N ATOM 1309 CA THR A 99 5.999 -11.291 0.623 1.00 0.00 C ATOM 1310 C THR A 99 4.652 -10.683 0.169 1.00 0.00 C ATOM 1311 O THR A 99 3.628 -10.898 0.825 1.00 0.00 O ATOM 1312 CB THR A 99 6.871 -11.875 -0.492 1.00 0.00 C ATOM 1313 OG1 THR A 99 6.146 -12.879 -1.150 1.00 0.00 O ATOM 1314 CG2 THR A 99 8.213 -12.417 0.009 1.00 0.00 C ATOM 0 H THR A 99 5.147 -13.057 1.321 1.00 0.00 H new ATOM 0 HA THR A 99 6.575 -10.454 1.017 1.00 0.00 H new ATOM 0 HB THR A 99 7.118 -11.067 -1.180 1.00 0.00 H new ATOM 0 HG1 THR A 99 6.750 -13.610 -1.398 1.00 0.00 H new ATOM 0 HG21 THR A 99 8.781 -12.816 -0.832 1.00 0.00 H new ATOM 0 HG22 THR A 99 8.778 -11.612 0.479 1.00 0.00 H new ATOM 0 HG23 THR A 99 8.037 -13.209 0.736 1.00 0.00 H new ATOM 1322 N LEU A 100 4.610 -9.899 -0.920 1.00 0.00 N ATOM 1323 CA LEU A 100 3.389 -9.271 -1.453 1.00 0.00 C ATOM 1324 C LEU A 100 3.458 -9.338 -2.984 1.00 0.00 C ATOM 1325 O LEU A 100 4.505 -9.017 -3.547 1.00 0.00 O ATOM 1326 CB LEU A 100 3.282 -7.828 -0.924 1.00 0.00 C ATOM 1327 CG LEU A 100 1.833 -7.345 -0.719 1.00 0.00 C ATOM 1328 CD1 LEU A 100 1.834 -6.074 0.138 1.00 0.00 C ATOM 1329 CD2 LEU A 100 1.102 -7.078 -2.037 1.00 0.00 C ATOM 0 H LEU A 100 5.442 -9.679 -1.467 1.00 0.00 H new ATOM 0 HA LEU A 100 2.490 -9.793 -1.126 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.816 -7.758 0.024 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.783 -7.157 -1.622 1.00 0.00 H new ATOM 0 HG LEU A 100 1.295 -8.147 -0.214 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.809 -5.732 0.283 1.00 0.00 H new ATOM 0 HD12 LEU A 100 2.286 -6.289 1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.408 -5.296 -0.365 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.087 -6.741 -1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 100 1.632 -6.308 -2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.066 -7.995 -2.625 1.00 0.00 H new ATOM 1341 N LEU A 101 2.418 -9.820 -3.672 1.00 0.00 N ATOM 1342 CA LEU A 101 2.410 -9.930 -5.133 1.00 0.00 C ATOM 1343 C LEU A 101 1.470 -8.910 -5.722 1.00 0.00 C ATOM 1344 O LEU A 101 0.380 -8.703 -5.202 1.00 0.00 O ATOM 1345 CB LEU A 101 2.012 -11.341 -5.595 1.00 0.00 C ATOM 1346 CG LEU A 101 2.002 -11.575 -7.125 1.00 0.00 C ATOM 1347 CD1 LEU A 101 2.409 -13.021 -7.435 1.00 0.00 C ATOM 1348 CD2 LEU A 101 0.623 -11.342 -7.762 1.00 0.00 C ATOM 0 H LEU A 101 1.558 -10.145 -3.231 1.00 0.00 H new ATOM 0 HA LEU A 101 3.423 -9.738 -5.486 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.698 -12.057 -5.142 1.00 0.00 H new ATOM 0 HB3 LEU A 101 1.018 -11.562 -5.207 1.00 0.00 H new ATOM 0 HG LEU A 101 2.706 -10.855 -7.543 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.400 -13.178 -8.514 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.411 -13.207 -7.050 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.705 -13.706 -6.962 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.683 -11.522 -8.835 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.102 -12.025 -7.319 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.309 -10.314 -7.584 1.00 0.00 H new ATOM 1360 N LEU A 102 1.886 -8.291 -6.817 1.00 0.00 N ATOM 1361 CA LEU A 102 1.136 -7.307 -7.568 1.00 0.00 C ATOM 1362 C LEU A 102 1.095 -7.823 -9.000 1.00 0.00 C ATOM 1363 O LEU A 102 2.080 -8.384 -9.488 1.00 0.00 O ATOM 1364 CB LEU A 102 1.731 -5.896 -7.398 1.00 0.00 C ATOM 1365 CG LEU A 102 2.724 -5.407 -8.475 1.00 0.00 C ATOM 1366 CD1 LEU A 102 1.985 -4.762 -9.658 1.00 0.00 C ATOM 1367 CD2 LEU A 102 3.664 -4.364 -7.870 1.00 0.00 C ATOM 0 H LEU A 102 2.804 -8.474 -7.223 1.00 0.00 H new ATOM 0 HA LEU A 102 0.115 -7.187 -7.206 1.00 0.00 H new ATOM 0 HB2 LEU A 102 0.905 -5.186 -7.354 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.236 -5.858 -6.433 1.00 0.00 H new ATOM 0 HG LEU A 102 3.284 -6.272 -8.831 1.00 0.00 H new ATOM 0 HD11 LEU A 102 2.709 -4.427 -10.401 1.00 0.00 H new ATOM 0 HD12 LEU A 102 1.314 -5.492 -10.110 1.00 0.00 H new ATOM 0 HD13 LEU A 102 1.407 -3.908 -9.304 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.364 -4.020 -8.631 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.082 -3.518 -7.504 1.00 0.00 H new ATOM 0 HD23 LEU A 102 4.217 -4.809 -7.043 1.00 0.00 H new ATOM 1379 N LYS A 103 -0.052 -7.694 -9.660 1.00 0.00 N ATOM 1380 CA LYS A 103 -0.245 -8.115 -11.038 1.00 0.00 C ATOM 1381 C LYS A 103 -1.065 -7.051 -11.745 1.00 0.00 C ATOM 1382 O LYS A 103 -1.624 -6.158 -11.107 1.00 0.00 O ATOM 1383 CB LYS A 103 -0.860 -9.527 -11.122 1.00 0.00 C ATOM 1384 CG LYS A 103 0.169 -10.541 -11.638 1.00 0.00 C ATOM 1385 CD LYS A 103 0.554 -10.324 -13.112 1.00 0.00 C ATOM 1386 CE LYS A 103 1.878 -11.035 -13.368 1.00 0.00 C ATOM 1387 NZ LYS A 103 2.332 -10.930 -14.764 1.00 0.00 N ATOM 0 H LYS A 103 -0.888 -7.286 -9.241 1.00 0.00 H new ATOM 0 HA LYS A 103 0.715 -8.204 -11.547 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -1.216 -9.832 -10.138 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.726 -9.512 -11.784 1.00 0.00 H new ATOM 0 HG2 LYS A 103 1.067 -10.481 -11.023 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -0.232 -11.547 -11.519 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.222 -10.717 -13.769 1.00 0.00 H new ATOM 0 HD3 LYS A 103 0.646 -9.260 -13.328 1.00 0.00 H new ATOM 0 HE2 LYS A 103 2.641 -10.616 -12.712 1.00 0.00 H new ATOM 0 HE3 LYS A 103 1.775 -12.088 -13.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 3.236 -11.433 -14.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 1.621 -11.355 -15.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 2.460 -9.928 -15.013 1.00 0.00 H new ATOM 1401 N THR A 104 -1.198 -7.164 -13.056 1.00 0.00 N ATOM 1402 CA THR A 104 -1.913 -6.201 -13.867 1.00 0.00 C ATOM 1403 C THR A 104 -2.931 -6.870 -14.788 1.00 0.00 C ATOM 1404 O THR A 104 -2.913 -8.093 -14.977 1.00 0.00 O ATOM 1405 CB THR A 104 -0.833 -5.416 -14.641 1.00 0.00 C ATOM 1406 OG1 THR A 104 0.143 -6.292 -15.181 1.00 0.00 O ATOM 1407 CG2 THR A 104 -0.101 -4.410 -13.750 1.00 0.00 C ATOM 0 H THR A 104 -0.806 -7.939 -13.591 1.00 0.00 H new ATOM 0 HA THR A 104 -2.509 -5.528 -13.251 1.00 0.00 H new ATOM 0 HB THR A 104 -1.360 -4.887 -15.435 1.00 0.00 H new ATOM 0 HG1 THR A 104 0.816 -5.772 -15.668 1.00 0.00 H new ATOM 0 HG21 THR A 104 0.649 -3.882 -14.338 1.00 0.00 H new ATOM 0 HG22 THR A 104 -0.816 -3.693 -13.346 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.386 -4.937 -12.930 1.00 0.00 H new ATOM 1415 N ASN A 105 -3.849 -6.056 -15.318 1.00 0.00 N ATOM 1416 CA ASN A 105 -4.908 -6.438 -16.264 1.00 0.00 C ATOM 1417 C ASN A 105 -4.262 -6.889 -17.585 1.00 0.00 C ATOM 1418 O ASN A 105 -3.051 -6.758 -17.733 1.00 0.00 O ATOM 1419 CB ASN A 105 -5.880 -5.286 -16.483 1.00 0.00 C ATOM 1420 CG ASN A 105 -7.358 -5.612 -16.282 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -7.741 -6.551 -15.587 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -8.217 -4.785 -16.839 1.00 0.00 N ATOM 0 H ASN A 105 -3.877 -5.062 -15.089 1.00 0.00 H new ATOM 0 HA ASN A 105 -5.484 -7.267 -15.852 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -5.611 -4.476 -15.805 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -5.745 -4.911 -17.497 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -9.218 -4.918 -16.697 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -7.881 -4.011 -17.413 1.00 0.00 H new ATOM 1429 N ALA A 106 -5.039 -7.349 -18.575 1.00 0.00 N ATOM 1430 CA ALA A 106 -4.474 -7.797 -19.850 1.00 0.00 C ATOM 1431 C ALA A 106 -3.594 -6.719 -20.488 1.00 0.00 C ATOM 1432 O ALA A 106 -2.488 -7.020 -20.936 1.00 0.00 O ATOM 1433 CB ALA A 106 -5.587 -8.216 -20.813 1.00 0.00 C ATOM 0 H ALA A 106 -6.055 -7.420 -18.516 1.00 0.00 H new ATOM 0 HA ALA A 106 -3.842 -8.661 -19.644 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -5.148 -8.546 -21.755 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -6.160 -9.033 -20.374 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -6.247 -7.368 -20.997 1.00 0.00 H new ATOM 1439 N GLU A 107 -4.072 -5.475 -20.510 1.00 0.00 N ATOM 1440 CA GLU A 107 -3.353 -4.337 -21.073 1.00 0.00 C ATOM 1441 C GLU A 107 -2.572 -3.543 -20.015 1.00 0.00 C ATOM 1442 O GLU A 107 -1.658 -2.800 -20.367 1.00 0.00 O ATOM 1443 CB GLU A 107 -4.388 -3.451 -21.766 1.00 0.00 C ATOM 1444 CG GLU A 107 -3.767 -2.353 -22.634 1.00 0.00 C ATOM 1445 CD GLU A 107 -4.852 -1.571 -23.362 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -5.626 -2.202 -24.122 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -4.932 -0.330 -23.203 1.00 0.00 O ATOM 0 H GLU A 107 -4.986 -5.228 -20.130 1.00 0.00 H new ATOM 0 HA GLU A 107 -2.603 -4.696 -21.778 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -5.031 -4.074 -22.387 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.024 -2.990 -21.011 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -3.179 -1.678 -22.012 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -3.083 -2.796 -23.357 1.00 0.00 H new ATOM 1454 N GLY A 108 -2.926 -3.681 -18.732 1.00 0.00 N ATOM 1455 CA GLY A 108 -2.282 -2.983 -17.618 1.00 0.00 C ATOM 1456 C GLY A 108 -3.046 -1.749 -17.123 1.00 0.00 C ATOM 1457 O GLY A 108 -2.585 -1.078 -16.201 1.00 0.00 O ATOM 0 H GLY A 108 -3.685 -4.295 -18.435 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.163 -3.679 -16.788 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.282 -2.678 -17.925 1.00 0.00 H new ATOM 1461 N THR A 109 -4.249 -1.497 -17.651 1.00 0.00 N ATOM 1462 CA THR A 109 -5.153 -0.376 -17.359 1.00 0.00 C ATOM 1463 C THR A 109 -5.629 -0.373 -15.905 1.00 0.00 C ATOM 1464 O THR A 109 -6.163 0.605 -15.377 1.00 0.00 O ATOM 1465 CB THR A 109 -6.387 -0.538 -18.273 1.00 0.00 C ATOM 1466 OG1 THR A 109 -6.073 -1.222 -19.474 1.00 0.00 O ATOM 1467 CG2 THR A 109 -7.066 0.783 -18.622 1.00 0.00 C ATOM 0 H THR A 109 -4.649 -2.122 -18.351 1.00 0.00 H new ATOM 0 HA THR A 109 -4.619 0.558 -17.531 1.00 0.00 H new ATOM 0 HB THR A 109 -7.087 -1.131 -17.684 1.00 0.00 H new ATOM 0 HG1 THR A 109 -6.880 -1.306 -20.024 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.924 0.592 -19.266 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.401 1.273 -17.708 1.00 0.00 H new ATOM 0 HG23 THR A 109 -6.359 1.429 -19.142 1.00 0.00 H new ATOM 1475 N ARG A 110 -5.487 -1.532 -15.275 1.00 0.00 N ATOM 1476 CA ARG A 110 -5.852 -1.807 -13.904 1.00 0.00 C ATOM 1477 C ARG A 110 -4.777 -2.684 -13.295 1.00 0.00 C ATOM 1478 O ARG A 110 -4.272 -3.586 -13.969 1.00 0.00 O ATOM 1479 CB ARG A 110 -7.187 -2.576 -13.897 1.00 0.00 C ATOM 1480 CG ARG A 110 -8.461 -1.728 -13.826 1.00 0.00 C ATOM 1481 CD ARG A 110 -8.599 -1.082 -12.447 1.00 0.00 C ATOM 1482 NE ARG A 110 -9.980 -0.706 -12.105 1.00 0.00 N ATOM 1483 CZ ARG A 110 -10.322 -0.047 -10.992 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -9.405 0.184 -10.059 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -11.559 0.379 -10.783 1.00 0.00 N ATOM 0 H ARG A 110 -5.090 -2.348 -15.740 1.00 0.00 H new ATOM 0 HA ARG A 110 -5.952 -0.881 -13.338 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -7.234 -3.188 -14.798 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -7.183 -3.259 -13.048 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -8.434 -0.956 -14.595 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -9.331 -2.351 -14.031 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -8.223 -1.773 -11.693 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -7.969 -0.193 -12.407 1.00 0.00 H new ATOM 0 HE ARG A 110 -10.722 -0.963 -12.756 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -8.447 -0.140 -10.194 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -9.659 0.686 -9.208 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -12.282 0.207 -11.481 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -11.788 0.879 -9.924 1.00 0.00 H new ATOM 1499 N THR A 111 -4.493 -2.475 -12.018 1.00 0.00 N ATOM 1500 CA THR A 111 -3.520 -3.271 -11.293 1.00 0.00 C ATOM 1501 C THR A 111 -4.318 -4.026 -10.226 1.00 0.00 C ATOM 1502 O THR A 111 -5.186 -3.453 -9.563 1.00 0.00 O ATOM 1503 CB THR A 111 -2.410 -2.367 -10.763 1.00 0.00 C ATOM 1504 OG1 THR A 111 -1.678 -1.809 -11.833 1.00 0.00 O ATOM 1505 CG2 THR A 111 -1.423 -3.105 -9.860 1.00 0.00 C ATOM 0 H THR A 111 -4.933 -1.746 -11.456 1.00 0.00 H new ATOM 0 HA THR A 111 -2.996 -4.003 -11.908 1.00 0.00 H new ATOM 0 HB THR A 111 -2.908 -1.594 -10.178 1.00 0.00 H new ATOM 0 HG1 THR A 111 -1.201 -1.011 -11.522 1.00 0.00 H new ATOM 0 HG21 THR A 111 -0.657 -2.411 -9.514 1.00 0.00 H new ATOM 0 HG22 THR A 111 -1.953 -3.517 -9.002 1.00 0.00 H new ATOM 0 HG23 THR A 111 -0.953 -3.914 -10.419 1.00 0.00 H new ATOM 1513 N TYR A 112 -4.110 -5.340 -10.134 1.00 0.00 N ATOM 1514 CA TYR A 112 -4.764 -6.227 -9.181 1.00 0.00 C ATOM 1515 C TYR A 112 -3.668 -7.039 -8.495 1.00 0.00 C ATOM 1516 O TYR A 112 -3.012 -7.885 -9.107 1.00 0.00 O ATOM 1517 CB TYR A 112 -5.727 -7.163 -9.923 1.00 0.00 C ATOM 1518 CG TYR A 112 -7.126 -6.625 -10.161 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -7.345 -5.464 -10.930 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -8.228 -7.339 -9.661 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -8.651 -5.012 -11.178 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -9.534 -6.926 -9.952 1.00 0.00 C ATOM 1523 CZ TYR A 112 -9.748 -5.753 -10.700 1.00 0.00 C ATOM 1524 OH TYR A 112 -11.013 -5.368 -11.006 1.00 0.00 O ATOM 0 H TYR A 112 -3.457 -5.830 -10.745 1.00 0.00 H new ATOM 0 HA TYR A 112 -5.338 -5.660 -8.448 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -5.287 -7.414 -10.888 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -5.807 -8.092 -9.358 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -6.503 -4.919 -11.331 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -8.067 -8.213 -9.048 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -8.813 -4.100 -11.733 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.375 -7.506 -9.603 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.652 -5.989 -10.598 1.00 0.00 H new ATOM 1534 N LEU A 113 -3.541 -6.858 -7.188 1.00 0.00 N ATOM 1535 CA LEU A 113 -2.566 -7.500 -6.313 1.00 0.00 C ATOM 1536 C LEU A 113 -3.167 -8.679 -5.539 1.00 0.00 C ATOM 1537 O LEU A 113 -4.375 -8.930 -5.604 1.00 0.00 O ATOM 1538 CB LEU A 113 -1.911 -6.455 -5.384 1.00 0.00 C ATOM 1539 CG LEU A 113 -2.873 -5.554 -4.579 1.00 0.00 C ATOM 1540 CD1 LEU A 113 -3.881 -6.319 -3.722 1.00 0.00 C ATOM 1541 CD2 LEU A 113 -2.082 -4.624 -3.661 1.00 0.00 C ATOM 0 H LEU A 113 -4.152 -6.221 -6.678 1.00 0.00 H new ATOM 0 HA LEU A 113 -1.782 -7.929 -6.937 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.265 -6.980 -4.680 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -1.269 -5.815 -5.989 1.00 0.00 H new ATOM 0 HG LEU A 113 -3.436 -4.998 -5.329 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.517 -5.612 -3.190 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -4.497 -6.951 -4.362 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -3.349 -6.940 -3.002 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.772 -3.994 -3.099 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.486 -5.218 -2.968 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.423 -3.996 -4.260 1.00 0.00 H new ATOM 1553 N LYS A 114 -2.302 -9.492 -4.935 1.00 0.00 N ATOM 1554 CA LYS A 114 -2.644 -10.643 -4.104 1.00 0.00 C ATOM 1555 C LYS A 114 -2.065 -10.365 -2.712 1.00 0.00 C ATOM 1556 O LYS A 114 -1.426 -9.334 -2.493 1.00 0.00 O ATOM 1557 CB LYS A 114 -2.144 -11.974 -4.693 1.00 0.00 C ATOM 1558 CG LYS A 114 -2.781 -12.288 -6.053 1.00 0.00 C ATOM 1559 CD LYS A 114 -2.447 -13.714 -6.521 1.00 0.00 C ATOM 1560 CE LYS A 114 -3.268 -14.125 -7.751 1.00 0.00 C ATOM 1561 NZ LYS A 114 -3.069 -13.245 -8.921 1.00 0.00 N ATOM 0 H LYS A 114 -1.294 -9.358 -5.017 1.00 0.00 H new ATOM 0 HA LYS A 114 -3.726 -10.764 -4.053 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -1.060 -11.935 -4.803 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -2.365 -12.782 -3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.863 -12.171 -5.984 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.430 -11.570 -6.794 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -1.385 -13.778 -6.757 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -2.636 -14.415 -5.708 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.005 -15.146 -8.027 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.325 -14.128 -7.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.653 -13.582 -9.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.346 -12.273 -8.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -2.067 -13.259 -9.200 1.00 0.00 H new ATOM 1575 N SER A 115 -2.315 -11.236 -1.743 1.00 0.00 N ATOM 1576 CA SER A 115 -1.829 -11.131 -0.372 1.00 0.00 C ATOM 1577 C SER A 115 -1.404 -12.543 0.035 1.00 0.00 C ATOM 1578 O SER A 115 -1.936 -13.497 -0.531 1.00 0.00 O ATOM 1579 CB SER A 115 -2.946 -10.534 0.497 1.00 0.00 C ATOM 1580 OG SER A 115 -2.579 -10.384 1.852 1.00 0.00 O ATOM 0 H SER A 115 -2.884 -12.068 -1.896 1.00 0.00 H new ATOM 0 HA SER A 115 -0.972 -10.467 -0.254 1.00 0.00 H new ATOM 0 HB2 SER A 115 -3.229 -9.561 0.095 1.00 0.00 H new ATOM 0 HB3 SER A 115 -3.826 -11.174 0.435 1.00 0.00 H new ATOM 0 HG SER A 115 -3.328 -9.999 2.353 1.00 0.00 H new ATOM 1586 N PHE A 116 -0.494 -12.648 1.014 1.00 0.00 N ATOM 1587 CA PHE A 116 0.098 -13.862 1.579 1.00 0.00 C ATOM 1588 C PHE A 116 -0.648 -15.162 1.204 1.00 0.00 C ATOM 1589 O PHE A 116 -0.183 -15.890 0.332 1.00 0.00 O ATOM 1590 CB PHE A 116 0.304 -13.719 3.107 1.00 0.00 C ATOM 1591 CG PHE A 116 0.640 -15.050 3.774 1.00 0.00 C ATOM 1592 CD1 PHE A 116 1.737 -15.807 3.318 1.00 0.00 C ATOM 1593 CD2 PHE A 116 -0.226 -15.609 4.735 1.00 0.00 C ATOM 1594 CE1 PHE A 116 1.931 -17.126 3.773 1.00 0.00 C ATOM 1595 CE2 PHE A 116 -0.015 -16.916 5.208 1.00 0.00 C ATOM 1596 CZ PHE A 116 1.051 -17.682 4.713 1.00 0.00 C ATOM 0 H PHE A 116 -0.124 -11.812 1.467 1.00 0.00 H new ATOM 0 HA PHE A 116 1.078 -13.966 1.114 1.00 0.00 H new ATOM 0 HB2 PHE A 116 1.107 -13.007 3.298 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -0.600 -13.308 3.556 1.00 0.00 H new ATOM 0 HD1 PHE A 116 2.433 -15.374 2.615 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -1.057 -15.030 5.110 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.758 -17.710 3.398 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -0.675 -17.332 5.955 1.00 0.00 H new ATOM 0 HZ PHE A 116 1.194 -18.697 5.055 1.00 0.00 H new ATOM 1606 N GLU A 117 -1.758 -15.496 1.868 1.00 0.00 N ATOM 1607 CA GLU A 117 -2.557 -16.687 1.589 1.00 0.00 C ATOM 1608 C GLU A 117 -3.785 -16.701 2.484 1.00 0.00 C ATOM 1609 O GLU A 117 -3.751 -16.132 3.586 1.00 0.00 O ATOM 1610 CB GLU A 117 -1.772 -18.013 1.783 1.00 0.00 C ATOM 1611 CG GLU A 117 -1.398 -18.649 0.433 1.00 0.00 C ATOM 1612 CD GLU A 117 -1.535 -20.165 0.393 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -0.894 -20.870 1.203 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -2.309 -20.625 -0.483 1.00 0.00 O ATOM 0 H GLU A 117 -2.132 -14.932 2.631 1.00 0.00 H new ATOM 0 HA GLU A 117 -2.841 -16.631 0.538 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -0.867 -17.820 2.359 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -2.375 -18.713 2.362 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.029 -18.219 -0.345 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -0.369 -18.383 0.192 1.00 0.00 H new ATOM 1621 N ALA A 118 -4.833 -17.377 1.991 1.00 0.00 N ATOM 1622 CA ALA A 118 -6.148 -17.602 2.571 1.00 0.00 C ATOM 1623 C ALA A 118 -7.183 -18.004 1.548 1.00 0.00 C ATOM 1624 O ALA A 118 -7.025 -17.865 0.337 1.00 0.00 O ATOM 1625 CB ALA A 118 -6.646 -16.434 3.409 1.00 0.00 C ATOM 0 H ALA A 118 -4.763 -17.824 1.077 1.00 0.00 H new ATOM 0 HA ALA A 118 -6.008 -18.446 3.247 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -7.632 -16.669 3.811 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.953 -16.254 4.230 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.711 -15.541 2.787 1.00 0.00 H new ATOM 1631 N ASP A 119 -8.239 -18.536 2.137 1.00 0.00 N ATOM 1632 CA ASP A 119 -9.475 -19.029 1.592 1.00 0.00 C ATOM 1633 C ASP A 119 -10.487 -17.933 1.917 1.00 0.00 C ATOM 1634 O ASP A 119 -10.275 -17.167 2.866 1.00 0.00 O ATOM 1635 CB ASP A 119 -9.821 -20.346 2.286 1.00 0.00 C ATOM 1636 CG ASP A 119 -11.053 -20.970 1.660 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -11.026 -21.179 0.428 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -12.033 -21.208 2.405 1.00 0.00 O ATOM 0 H ASP A 119 -8.240 -18.643 3.151 1.00 0.00 H new ATOM 0 HA ASP A 119 -9.445 -19.233 0.522 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -8.980 -21.035 2.211 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -9.995 -20.169 3.347 1.00 0.00 H new ATOM 1643 N ALA A 120 -11.583 -17.838 1.162 1.00 0.00 N ATOM 1644 CA ALA A 120 -12.613 -16.799 1.351 1.00 0.00 C ATOM 1645 C ALA A 120 -13.279 -16.779 2.733 1.00 0.00 C ATOM 1646 O ALA A 120 -14.179 -15.981 2.986 1.00 0.00 O ATOM 1647 CB ALA A 120 -13.638 -16.840 0.219 1.00 0.00 C ATOM 0 H ALA A 120 -11.788 -18.480 0.397 1.00 0.00 H new ATOM 0 HA ALA A 120 -12.076 -15.851 1.309 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -14.388 -16.065 0.379 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -13.136 -16.668 -0.733 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -14.123 -17.816 0.202 1.00 0.00 H new ATOM 1653 N GLU A 121 -12.908 -17.722 3.583 1.00 0.00 N ATOM 1654 CA GLU A 121 -13.373 -17.934 4.935 1.00 0.00 C ATOM 1655 C GLU A 121 -12.439 -17.242 5.936 1.00 0.00 C ATOM 1656 O GLU A 121 -12.553 -17.460 7.144 1.00 0.00 O ATOM 1657 CB GLU A 121 -13.371 -19.448 5.165 1.00 0.00 C ATOM 1658 CG GLU A 121 -14.496 -19.887 6.100 1.00 0.00 C ATOM 1659 CD GLU A 121 -14.163 -21.215 6.770 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -13.702 -22.165 6.089 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -14.316 -21.295 8.011 1.00 0.00 O ATOM 0 H GLU A 121 -12.212 -18.418 3.316 1.00 0.00 H new ATOM 0 HA GLU A 121 -14.370 -17.516 5.077 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -13.474 -19.960 4.208 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.412 -19.749 5.586 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -14.661 -19.123 6.860 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -15.425 -19.982 5.538 1.00 0.00 H new ATOM 1668 N GLY A 122 -11.475 -16.453 5.447 1.00 0.00 N ATOM 1669 CA GLY A 122 -10.553 -15.775 6.332 1.00 0.00 C ATOM 1670 C GLY A 122 -9.793 -14.569 5.798 1.00 0.00 C ATOM 1671 O GLY A 122 -9.744 -13.591 6.539 1.00 0.00 O ATOM 0 H GLY A 122 -11.323 -16.277 4.454 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -11.112 -15.453 7.211 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -9.819 -16.506 6.671 1.00 0.00 H new ATOM 1675 N ARG A 123 -9.118 -14.619 4.633 1.00 0.00 N ATOM 1676 CA ARG A 123 -8.331 -13.438 4.163 1.00 0.00 C ATOM 1677 C ARG A 123 -8.035 -13.364 2.657 1.00 0.00 C ATOM 1678 O ARG A 123 -6.886 -13.161 2.228 1.00 0.00 O ATOM 1679 CB ARG A 123 -6.940 -13.337 4.871 1.00 0.00 C ATOM 1680 CG ARG A 123 -6.744 -13.379 6.387 1.00 0.00 C ATOM 1681 CD ARG A 123 -6.605 -14.819 6.902 1.00 0.00 C ATOM 1682 NE ARG A 123 -6.305 -14.857 8.335 1.00 0.00 N ATOM 1683 CZ ARG A 123 -5.138 -14.534 8.902 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -4.096 -14.169 8.158 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -5.016 -14.576 10.223 1.00 0.00 N ATOM 0 H ARG A 123 -9.094 -15.428 4.012 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.003 -12.619 4.421 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -6.332 -14.145 4.464 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -6.494 -12.402 4.533 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -5.854 -12.809 6.655 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -7.590 -12.897 6.877 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -7.529 -15.365 6.709 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -5.814 -15.327 6.351 1.00 0.00 H new ATOM 0 HE ARG A 123 -7.055 -15.157 8.958 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -4.182 -14.133 7.142 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -3.212 -13.925 8.604 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -5.810 -14.854 10.800 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -4.128 -14.331 10.661 1.00 0.00 H new ATOM 1699 N ARG A 124 -9.026 -13.541 1.802 1.00 0.00 N ATOM 1700 CA ARG A 124 -8.776 -13.505 0.369 1.00 0.00 C ATOM 1701 C ARG A 124 -8.601 -12.090 -0.154 1.00 0.00 C ATOM 1702 O ARG A 124 -9.283 -11.155 0.247 1.00 0.00 O ATOM 1703 CB ARG A 124 -9.881 -14.276 -0.305 1.00 0.00 C ATOM 1704 CG ARG A 124 -9.544 -15.772 -0.219 1.00 0.00 C ATOM 1705 CD ARG A 124 -8.946 -16.416 -1.456 1.00 0.00 C ATOM 1706 NE ARG A 124 -9.766 -16.192 -2.658 1.00 0.00 N ATOM 1707 CZ ARG A 124 -9.985 -17.106 -3.605 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -9.287 -18.234 -3.622 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -10.913 -16.875 -4.521 1.00 0.00 N ATOM 0 H ARG A 124 -9.997 -13.709 2.067 1.00 0.00 H new ATOM 0 HA ARG A 124 -7.824 -13.981 0.136 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -10.836 -14.073 0.179 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -9.979 -13.968 -1.346 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -8.848 -15.915 0.608 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -10.457 -16.311 0.036 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -7.946 -16.017 -1.623 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -8.838 -17.488 -1.288 1.00 0.00 H new ATOM 0 HE ARG A 124 -10.196 -15.275 -2.775 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -8.579 -18.406 -2.909 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.459 -18.929 -4.348 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -11.449 -16.008 -4.496 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -11.092 -17.564 -5.251 1.00 0.00 H new ATOM 1723 N PHE A 125 -7.655 -11.957 -1.070 1.00 0.00 N ATOM 1724 CA PHE A 125 -7.204 -10.780 -1.732 1.00 0.00 C ATOM 1725 C PHE A 125 -7.979 -10.398 -2.993 1.00 0.00 C ATOM 1726 O PHE A 125 -7.859 -11.061 -4.027 1.00 0.00 O ATOM 1727 CB PHE A 125 -5.741 -11.091 -2.077 1.00 0.00 C ATOM 1728 CG PHE A 125 -5.368 -12.532 -2.432 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -5.480 -13.003 -3.755 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -4.922 -13.412 -1.426 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -5.155 -14.334 -4.069 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -4.583 -14.738 -1.744 1.00 0.00 C ATOM 1733 CZ PHE A 125 -4.696 -15.200 -3.064 1.00 0.00 C ATOM 0 H PHE A 125 -7.137 -12.775 -1.392 1.00 0.00 H new ATOM 0 HA PHE A 125 -7.347 -9.916 -1.084 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.456 -10.458 -2.917 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -5.128 -10.789 -1.228 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.818 -12.336 -4.534 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.840 -13.066 -0.406 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -5.258 -14.690 -5.083 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -4.234 -15.404 -0.969 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.431 -16.219 -3.306 1.00 0.00 H new ATOM 1743 N GLU A 126 -8.794 -9.350 -2.920 1.00 0.00 N ATOM 1744 CA GLU A 126 -9.526 -8.839 -4.075 1.00 0.00 C ATOM 1745 C GLU A 126 -9.591 -7.334 -3.824 1.00 0.00 C ATOM 1746 O GLU A 126 -10.342 -6.879 -2.956 1.00 0.00 O ATOM 1747 CB GLU A 126 -10.898 -9.509 -4.254 1.00 0.00 C ATOM 1748 CG GLU A 126 -10.830 -10.765 -5.132 1.00 0.00 C ATOM 1749 CD GLU A 126 -12.203 -11.182 -5.663 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -12.639 -10.613 -6.691 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -12.810 -12.117 -5.086 1.00 0.00 O ATOM 0 H GLU A 126 -8.966 -8.831 -2.059 1.00 0.00 H new ATOM 0 HA GLU A 126 -9.036 -9.064 -5.022 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.299 -9.775 -3.276 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.591 -8.796 -4.699 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -10.159 -10.582 -5.972 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -10.402 -11.585 -4.555 1.00 0.00 H new ATOM 1758 N VAL A 127 -8.841 -6.581 -4.632 1.00 0.00 N ATOM 1759 CA VAL A 127 -8.652 -5.128 -4.613 1.00 0.00 C ATOM 1760 C VAL A 127 -8.505 -4.647 -6.066 1.00 0.00 C ATOM 1761 O VAL A 127 -8.368 -5.482 -6.967 1.00 0.00 O ATOM 1762 CB VAL A 127 -7.359 -4.908 -3.779 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -6.642 -3.569 -3.967 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -7.623 -5.116 -2.279 1.00 0.00 C ATOM 0 H VAL A 127 -8.302 -7.011 -5.384 1.00 0.00 H new ATOM 0 HA VAL A 127 -9.480 -4.571 -4.176 1.00 0.00 H new ATOM 0 HB VAL A 127 -6.683 -5.664 -4.179 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -5.757 -3.538 -3.332 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -6.345 -3.459 -5.010 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -7.313 -2.755 -3.693 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -6.700 -4.955 -1.721 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -8.379 -4.408 -1.941 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -7.977 -6.133 -2.109 1.00 0.00 H new ATOM 1774 N ALA A 128 -8.602 -3.337 -6.336 1.00 0.00 N ATOM 1775 CA ALA A 128 -8.435 -2.828 -7.705 1.00 0.00 C ATOM 1776 C ALA A 128 -7.813 -1.428 -7.741 1.00 0.00 C ATOM 1777 O ALA A 128 -8.414 -0.462 -7.284 1.00 0.00 O ATOM 1778 CB ALA A 128 -9.785 -2.794 -8.442 1.00 0.00 C ATOM 0 H ALA A 128 -8.792 -2.620 -5.636 1.00 0.00 H new ATOM 0 HA ALA A 128 -7.753 -3.515 -8.205 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -9.638 -2.414 -9.453 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -10.199 -3.801 -8.489 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -10.476 -2.143 -7.906 1.00 0.00 H new ATOM 1784 N LEU A 129 -6.669 -1.273 -8.400 1.00 0.00 N ATOM 1785 CA LEU A 129 -5.963 0.001 -8.541 1.00 0.00 C ATOM 1786 C LEU A 129 -6.220 0.513 -9.948 1.00 0.00 C ATOM 1787 O LEU A 129 -6.071 -0.258 -10.898 1.00 0.00 O ATOM 1788 CB LEU A 129 -4.474 -0.234 -8.247 1.00 0.00 C ATOM 1789 CG LEU A 129 -3.481 0.916 -8.532 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -2.141 0.579 -7.858 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -3.137 1.257 -9.994 1.00 0.00 C ATOM 0 H LEU A 129 -6.193 -2.047 -8.863 1.00 0.00 H new ATOM 0 HA LEU A 129 -6.313 0.757 -7.838 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -4.381 -0.501 -7.194 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.154 -1.101 -8.825 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.013 1.787 -8.149 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -1.426 1.380 -8.048 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -2.291 0.474 -6.783 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.755 -0.356 -8.264 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.429 2.085 -10.017 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.693 0.386 -10.476 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -4.046 1.542 -10.525 1.00 0.00 H new ATOM 1803 N ASP A 130 -6.686 1.755 -10.095 1.00 0.00 N ATOM 1804 CA ASP A 130 -6.960 2.382 -11.387 1.00 0.00 C ATOM 1805 C ASP A 130 -5.787 3.289 -11.732 1.00 0.00 C ATOM 1806 O ASP A 130 -5.477 4.203 -10.967 1.00 0.00 O ATOM 1807 CB ASP A 130 -8.239 3.238 -11.342 1.00 0.00 C ATOM 1808 CG ASP A 130 -9.368 2.782 -12.262 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -9.120 2.164 -13.326 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -10.532 3.009 -11.858 1.00 0.00 O ATOM 0 H ASP A 130 -6.887 2.364 -9.302 1.00 0.00 H new ATOM 0 HA ASP A 130 -7.098 1.598 -12.131 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -8.611 3.250 -10.318 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -7.977 4.265 -11.598 1.00 0.00 H new ATOM 1815 N GLY A 131 -5.121 3.036 -12.855 1.00 0.00 N ATOM 1816 CA GLY A 131 -3.999 3.843 -13.308 1.00 0.00 C ATOM 1817 C GLY A 131 -3.369 3.200 -14.535 1.00 0.00 C ATOM 1818 O GLY A 131 -3.624 2.027 -14.809 1.00 0.00 O ATOM 0 H GLY A 131 -5.348 2.261 -13.478 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -4.337 4.852 -13.547 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -3.259 3.934 -12.513 1.00 0.00 H new ATOM 1822 N ASP A 132 -2.501 3.934 -15.225 1.00 0.00 N ATOM 1823 CA ASP A 132 -1.793 3.491 -16.435 1.00 0.00 C ATOM 1824 C ASP A 132 -0.280 3.381 -16.174 1.00 0.00 C ATOM 1825 O ASP A 132 0.530 3.309 -17.094 1.00 0.00 O ATOM 1826 CB ASP A 132 -2.130 4.472 -17.567 1.00 0.00 C ATOM 1827 CG ASP A 132 -1.686 3.972 -18.940 1.00 0.00 C ATOM 1828 OD1 ASP A 132 -2.211 2.925 -19.377 1.00 0.00 O ATOM 1829 OD2 ASP A 132 -0.889 4.662 -19.621 1.00 0.00 O ATOM 0 H ASP A 132 -2.259 4.887 -14.953 1.00 0.00 H new ATOM 0 HA ASP A 132 -2.117 2.492 -16.728 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -3.206 4.647 -17.580 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -1.653 5.431 -17.364 1.00 0.00 H new ATOM 1834 N HIS A 133 0.112 3.381 -14.896 1.00 0.00 N ATOM 1835 CA HIS A 133 1.484 3.310 -14.399 1.00 0.00 C ATOM 1836 C HIS A 133 1.937 1.874 -14.088 1.00 0.00 C ATOM 1837 O HIS A 133 2.881 1.679 -13.323 1.00 0.00 O ATOM 1838 CB HIS A 133 1.595 4.219 -13.163 1.00 0.00 C ATOM 1839 CG HIS A 133 1.266 5.655 -13.443 1.00 0.00 C ATOM 1840 ND1 HIS A 133 2.182 6.595 -13.835 1.00 0.00 N ATOM 1841 CD2 HIS A 133 0.041 6.259 -13.374 1.00 0.00 C ATOM 1842 CE1 HIS A 133 1.532 7.751 -13.998 1.00 0.00 C ATOM 1843 NE2 HIS A 133 0.217 7.592 -13.758 1.00 0.00 N ATOM 0 H HIS A 133 -0.566 3.434 -14.135 1.00 0.00 H new ATOM 0 HA HIS A 133 2.158 3.657 -15.183 1.00 0.00 H new ATOM 0 HB2 HIS A 133 0.926 3.846 -12.387 1.00 0.00 H new ATOM 0 HB3 HIS A 133 2.609 4.158 -12.767 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.888 5.794 -13.078 1.00 0.00 H new ATOM 0 HE1 HIS A 133 1.997 8.683 -14.283 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -0.509 8.304 -13.840 1.00 0.00 H new ATOM 1851 N THR A 134 1.227 0.853 -14.589 1.00 0.00 N ATOM 1852 CA THR A 134 1.541 -0.566 -14.381 1.00 0.00 C ATOM 1853 C THR A 134 1.693 -0.955 -12.885 1.00 0.00 C ATOM 1854 O THR A 134 2.263 -1.995 -12.548 1.00 0.00 O ATOM 1855 CB THR A 134 2.636 -0.964 -15.347 1.00 0.00 C ATOM 1856 OG1 THR A 134 2.307 -0.569 -16.671 1.00 0.00 O ATOM 1857 CG2 THR A 134 3.062 -2.436 -15.453 1.00 0.00 C ATOM 0 H THR A 134 0.397 0.996 -15.165 1.00 0.00 H new ATOM 0 HA THR A 134 0.692 -1.199 -14.637 1.00 0.00 H new ATOM 0 HB THR A 134 3.481 -0.444 -14.895 1.00 0.00 H new ATOM 0 HG1 THR A 134 3.028 -0.834 -17.280 1.00 0.00 H new ATOM 0 HG21 THR A 134 3.856 -2.533 -16.193 1.00 0.00 H new ATOM 0 HG22 THR A 134 3.425 -2.780 -14.485 1.00 0.00 H new ATOM 0 HG23 THR A 134 2.208 -3.041 -15.757 1.00 0.00 H new ATOM 1865 N GLY A 135 1.171 -0.137 -11.957 1.00 0.00 N ATOM 1866 CA GLY A 135 1.261 -0.381 -10.522 1.00 0.00 C ATOM 1867 C GLY A 135 2.713 -0.459 -10.046 1.00 0.00 C ATOM 1868 O GLY A 135 2.993 -1.170 -9.083 1.00 0.00 O ATOM 0 H GLY A 135 0.670 0.720 -12.192 1.00 0.00 H new ATOM 0 HA2 GLY A 135 0.745 0.415 -9.985 1.00 0.00 H new ATOM 0 HA3 GLY A 135 0.749 -1.312 -10.279 1.00 0.00 H new ATOM 1872 N ASP A 136 3.620 0.243 -10.728 1.00 0.00 N ATOM 1873 CA ASP A 136 5.054 0.285 -10.464 1.00 0.00 C ATOM 1874 C ASP A 136 5.395 0.773 -9.055 1.00 0.00 C ATOM 1875 O ASP A 136 4.862 1.776 -8.591 1.00 0.00 O ATOM 1876 CB ASP A 136 5.714 1.206 -11.505 1.00 0.00 C ATOM 1877 CG ASP A 136 6.039 0.534 -12.841 1.00 0.00 C ATOM 1878 OD1 ASP A 136 6.000 -0.720 -12.958 1.00 0.00 O ATOM 1879 OD2 ASP A 136 6.446 1.249 -13.778 1.00 0.00 O ATOM 0 H ASP A 136 3.357 0.828 -11.521 1.00 0.00 H new ATOM 0 HA ASP A 136 5.434 -0.734 -10.537 1.00 0.00 H new ATOM 0 HB2 ASP A 136 5.053 2.053 -11.691 1.00 0.00 H new ATOM 0 HB3 ASP A 136 6.635 1.607 -11.082 1.00 0.00 H new ATOM 1884 N LEU A 137 6.321 0.083 -8.381 1.00 0.00 N ATOM 1885 CA LEU A 137 6.824 0.356 -7.039 1.00 0.00 C ATOM 1886 C LEU A 137 8.349 0.335 -7.141 1.00 0.00 C ATOM 1887 O LEU A 137 8.893 -0.417 -7.961 1.00 0.00 O ATOM 1888 CB LEU A 137 6.372 -0.748 -6.067 1.00 0.00 C ATOM 1889 CG LEU A 137 4.879 -1.133 -6.092 1.00 0.00 C ATOM 1890 CD1 LEU A 137 4.649 -2.297 -5.125 1.00 0.00 C ATOM 1891 CD2 LEU A 137 3.929 0.009 -5.723 1.00 0.00 C ATOM 0 H LEU A 137 6.767 -0.737 -8.791 1.00 0.00 H new ATOM 0 HA LEU A 137 6.450 1.311 -6.670 1.00 0.00 H new ATOM 0 HB2 LEU A 137 6.957 -1.644 -6.276 1.00 0.00 H new ATOM 0 HB3 LEU A 137 6.624 -0.432 -5.055 1.00 0.00 H new ATOM 0 HG LEU A 137 4.650 -1.406 -7.122 1.00 0.00 H new ATOM 0 HD11 LEU A 137 3.595 -2.576 -5.136 1.00 0.00 H new ATOM 0 HD12 LEU A 137 5.254 -3.150 -5.432 1.00 0.00 H new ATOM 0 HD13 LEU A 137 4.934 -1.995 -4.117 1.00 0.00 H new ATOM 0 HD21 LEU A 137 2.899 -0.346 -5.765 1.00 0.00 H new ATOM 0 HD22 LEU A 137 4.152 0.356 -4.714 1.00 0.00 H new ATOM 0 HD23 LEU A 137 4.058 0.831 -6.427 1.00 0.00 H new ATOM 1903 N SER A 138 9.055 1.126 -6.335 1.00 0.00 N ATOM 1904 CA SER A 138 10.486 1.221 -6.302 1.00 0.00 C ATOM 1905 C SER A 138 10.921 1.558 -4.870 1.00 0.00 C ATOM 1906 O SER A 138 10.125 1.611 -3.932 1.00 0.00 O ATOM 1907 CB SER A 138 10.950 2.247 -7.349 1.00 0.00 C ATOM 1908 OG SER A 138 10.756 1.729 -8.649 1.00 0.00 O ATOM 0 H SER A 138 8.607 1.744 -5.658 1.00 0.00 H new ATOM 0 HA SER A 138 10.961 0.276 -6.566 1.00 0.00 H new ATOM 0 HB2 SER A 138 10.393 3.177 -7.232 1.00 0.00 H new ATOM 0 HB3 SER A 138 12.003 2.485 -7.196 1.00 0.00 H new ATOM 0 HG SER A 138 10.254 0.889 -8.595 1.00 0.00 H new ATOM 1914 N ALA A 139 12.218 1.761 -4.733 1.00 0.00 N ATOM 1915 CA ALA A 139 12.973 2.074 -3.528 1.00 0.00 C ATOM 1916 C ALA A 139 12.367 3.207 -2.699 1.00 0.00 C ATOM 1917 O ALA A 139 12.320 3.089 -1.471 1.00 0.00 O ATOM 1918 CB ALA A 139 14.413 2.412 -3.924 1.00 0.00 C ATOM 0 H ALA A 139 12.834 1.706 -5.544 1.00 0.00 H new ATOM 0 HA ALA A 139 12.943 1.193 -2.886 1.00 0.00 H new ATOM 0 HB1 ALA A 139 14.990 2.649 -3.030 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.862 1.557 -4.430 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.414 3.271 -4.594 1.00 0.00 H new ATOM 1924 N ALA A 140 11.945 4.295 -3.350 1.00 0.00 N ATOM 1925 CA ALA A 140 11.337 5.451 -2.703 1.00 0.00 C ATOM 1926 C ALA A 140 9.857 5.204 -2.410 1.00 0.00 C ATOM 1927 O ALA A 140 9.366 5.676 -1.390 1.00 0.00 O ATOM 1928 CB ALA A 140 11.495 6.687 -3.593 1.00 0.00 C ATOM 0 H ALA A 140 12.020 4.394 -4.362 1.00 0.00 H new ATOM 0 HA ALA A 140 11.847 5.619 -1.754 1.00 0.00 H new ATOM 0 HB1 ALA A 140 11.039 7.548 -3.104 1.00 0.00 H new ATOM 0 HB2 ALA A 140 12.554 6.883 -3.759 1.00 0.00 H new ATOM 0 HB3 ALA A 140 11.005 6.511 -4.550 1.00 0.00 H new ATOM 1934 N ASN A 141 9.169 4.457 -3.287 1.00 0.00 N ATOM 1935 CA ASN A 141 7.747 4.131 -3.162 1.00 0.00 C ATOM 1936 C ASN A 141 7.440 3.487 -1.821 1.00 0.00 C ATOM 1937 O ASN A 141 6.530 3.896 -1.102 1.00 0.00 O ATOM 1938 CB ASN A 141 7.275 3.182 -4.280 1.00 0.00 C ATOM 1939 CG ASN A 141 5.785 2.903 -4.152 1.00 0.00 C ATOM 1940 OD1 ASN A 141 5.382 1.978 -3.458 1.00 0.00 O ATOM 1941 ND2 ASN A 141 4.950 3.670 -4.822 1.00 0.00 N ATOM 0 H ASN A 141 9.599 4.056 -4.120 1.00 0.00 H new ATOM 0 HA ASN A 141 7.212 5.077 -3.245 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.485 3.625 -5.253 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.831 2.246 -4.229 1.00 0.00 H new ATOM 0 HD21 ASN A 141 3.946 3.499 -4.769 1.00 0.00 H new ATOM 0 HD22 ASN A 141 5.307 4.435 -5.394 1.00 0.00 H new ATOM 1948 N VAL A 142 8.204 2.446 -1.534 1.00 0.00 N ATOM 1949 CA VAL A 142 8.102 1.645 -0.333 1.00 0.00 C ATOM 1950 C VAL A 142 8.758 2.374 0.845 1.00 0.00 C ATOM 1951 O VAL A 142 9.817 3.002 0.730 1.00 0.00 O ATOM 1952 CB VAL A 142 8.743 0.267 -0.605 1.00 0.00 C ATOM 1953 CG1 VAL A 142 8.604 -0.681 0.587 1.00 0.00 C ATOM 1954 CG2 VAL A 142 8.113 -0.439 -1.823 1.00 0.00 C ATOM 0 H VAL A 142 8.942 2.125 -2.160 1.00 0.00 H new ATOM 0 HA VAL A 142 7.058 1.489 -0.062 1.00 0.00 H new ATOM 0 HB VAL A 142 9.795 0.480 -0.796 1.00 0.00 H new ATOM 0 HG11 VAL A 142 9.070 -1.637 0.348 1.00 0.00 H new ATOM 0 HG12 VAL A 142 9.095 -0.246 1.457 1.00 0.00 H new ATOM 0 HG13 VAL A 142 7.548 -0.837 0.807 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.597 -1.404 -1.974 1.00 0.00 H new ATOM 0 HG22 VAL A 142 7.048 -0.591 -1.645 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.248 0.178 -2.711 1.00 0.00 H new ATOM 1964 N VAL A 143 8.118 2.290 2.006 1.00 0.00 N ATOM 1965 CA VAL A 143 8.599 2.892 3.241 1.00 0.00 C ATOM 1966 C VAL A 143 9.758 2.042 3.788 1.00 0.00 C ATOM 1967 O VAL A 143 9.889 0.855 3.481 1.00 0.00 O ATOM 1968 CB VAL A 143 7.419 3.010 4.229 1.00 0.00 C ATOM 1969 CG1 VAL A 143 6.874 1.645 4.666 1.00 0.00 C ATOM 1970 CG2 VAL A 143 7.726 3.828 5.486 1.00 0.00 C ATOM 0 H VAL A 143 7.234 1.792 2.116 1.00 0.00 H new ATOM 0 HA VAL A 143 8.985 3.898 3.074 1.00 0.00 H new ATOM 0 HB VAL A 143 6.665 3.545 3.652 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.046 1.789 5.360 1.00 0.00 H new ATOM 0 HG12 VAL A 143 6.523 1.096 3.792 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.665 1.078 5.157 1.00 0.00 H new ATOM 0 HG21 VAL A 143 6.843 3.860 6.124 1.00 0.00 H new ATOM 0 HG22 VAL A 143 8.550 3.365 6.029 1.00 0.00 H new ATOM 0 HG23 VAL A 143 8.004 4.843 5.201 1.00 0.00 H new ATOM 1980 N PHE A 144 10.593 2.626 4.647 1.00 0.00 N ATOM 1981 CA PHE A 144 11.708 1.904 5.254 1.00 0.00 C ATOM 1982 C PHE A 144 11.211 0.797 6.192 1.00 0.00 C ATOM 1983 O PHE A 144 11.854 -0.237 6.317 1.00 0.00 O ATOM 1984 CB PHE A 144 12.626 2.885 5.983 1.00 0.00 C ATOM 1985 CG PHE A 144 13.952 3.044 5.259 1.00 0.00 C ATOM 1986 CD1 PHE A 144 13.964 3.400 3.894 1.00 0.00 C ATOM 1987 CD2 PHE A 144 15.165 2.734 5.904 1.00 0.00 C ATOM 1988 CE1 PHE A 144 15.169 3.428 3.174 1.00 0.00 C ATOM 1989 CE2 PHE A 144 16.374 2.771 5.186 1.00 0.00 C ATOM 1990 CZ PHE A 144 16.374 3.108 3.821 1.00 0.00 C ATOM 0 H PHE A 144 10.517 3.601 4.938 1.00 0.00 H new ATOM 0 HA PHE A 144 12.280 1.417 4.464 1.00 0.00 H new ATOM 0 HB2 PHE A 144 12.135 3.855 6.063 1.00 0.00 H new ATOM 0 HB3 PHE A 144 12.804 2.533 6.999 1.00 0.00 H new ATOM 0 HD1 PHE A 144 13.038 3.653 3.399 1.00 0.00 H new ATOM 0 HD2 PHE A 144 15.167 2.468 6.951 1.00 0.00 H new ATOM 0 HE1 PHE A 144 15.169 3.694 2.127 1.00 0.00 H new ATOM 0 HE2 PHE A 144 17.304 2.540 5.684 1.00 0.00 H new ATOM 0 HZ PHE A 144 17.302 3.121 3.269 1.00 0.00 H new