USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 872 hydrogens (29 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 46 LYS NZ :NH3+ -150:sc= 0.156 (180deg=0) USER MOD Set 1.2: A 49 SER OG : rot 35:sc= 1.24 USER MOD Set 2.1: A 9 THR OG1 : rot 180:sc= -0.652 USER MOD Set 2.2: A 15 LYS NZ :NH3+ -164:sc= -0.0437 (180deg=-0.262) USER MOD Single : A 1 GLY N :NH3+ -136:sc= -0.0374 (180deg=-0.868) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0209 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot -74:sc= 0.89 USER MOD Single : A 12 SER OG : rot 172:sc= -1.17 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -25:sc= 0.446 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.43 K(o=-0.43,f=-6.9!) USER MOD Single : A 32 THR OG1 : rot -140:sc= -2.93! USER MOD Single : A 34 SER OG : rot -99:sc= -3.61! USER MOD Single : A 36 HIS :FLIP no HD1:sc= -1.73 F(o=-5.5!,f=-1.7) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 162:sc= -0.246 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 SER OG : rot -152:sc= 0.81 USER MOD Single : A 51 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0347) USER MOD Single : A 54 ASN :FLIP amide:sc=-0.00194 F(o=-0.72,f=-0.0019) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= -0.267 X(o=-0.27,f=0) USER MOD Single : A 77 MET CE :methyl -144:sc= -7.07! (180deg=-13.5!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 172:sc= -0.515 USER MOD Single : A 90 GLN : amide:sc= -0.218 K(o=-0.22,f=-1.2!) USER MOD Single : A 93 TYR OH : rot -36:sc= -1.66 USER MOD Single : A 105 ASN : amide:sc= -0.494 X(o=-0.49,f=-0.46) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 JZF OH : rot -150:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.356 -0.809 23.482 1.00 0.00 N ATOM 2 CA GLY A 1 9.018 -1.188 23.066 1.00 0.00 C ATOM 3 C GLY A 1 8.917 -1.410 21.570 1.00 0.00 C ATOM 4 O GLY A 1 8.340 -0.604 20.839 1.00 0.00 O ATOM 0 H1 GLY A 1 10.617 -1.339 24.338 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.031 -1.026 22.721 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.380 0.211 23.686 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.724 -2.100 23.586 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.315 -0.410 23.363 1.00 0.00 H new ATOM 8 N PRO A 2 9.489 -2.525 21.093 1.00 0.00 N ATOM 9 CA PRO A 2 9.475 -2.876 19.669 1.00 0.00 C ATOM 10 C PRO A 2 8.084 -3.264 19.182 1.00 0.00 C ATOM 11 O PRO A 2 7.127 -3.282 19.955 1.00 0.00 O ATOM 12 CB PRO A 2 10.424 -4.075 19.590 1.00 0.00 C ATOM 13 CG PRO A 2 10.389 -4.676 20.952 1.00 0.00 C ATOM 14 CD PRO A 2 10.194 -3.530 21.906 1.00 0.00 C ATOM 0 HA PRO A 2 9.773 -2.038 19.039 1.00 0.00 H new ATOM 0 HB2 PRO A 2 10.098 -4.789 18.834 1.00 0.00 H new ATOM 0 HB3 PRO A 2 11.433 -3.764 19.320 1.00 0.00 H new ATOM 0 HG2 PRO A 2 9.577 -5.398 21.039 1.00 0.00 H new ATOM 0 HG3 PRO A 2 11.315 -5.209 21.167 1.00 0.00 H new ATOM 0 HD2 PRO A 2 9.608 -3.827 22.776 1.00 0.00 H new ATOM 0 HD3 PRO A 2 11.146 -3.150 22.278 1.00 0.00 H new ATOM 22 N GLY A 3 7.978 -3.574 17.893 1.00 0.00 N ATOM 23 CA GLY A 3 6.700 -3.959 17.325 1.00 0.00 C ATOM 24 C GLY A 3 6.849 -4.721 16.023 1.00 0.00 C ATOM 25 O GLY A 3 7.923 -4.731 15.421 1.00 0.00 O ATOM 0 H GLY A 3 8.755 -3.565 17.232 1.00 0.00 H new ATOM 0 HA2 GLY A 3 6.158 -4.575 18.043 1.00 0.00 H new ATOM 0 HA3 GLY A 3 6.099 -3.066 17.153 1.00 0.00 H new ATOM 29 N SER A 4 5.770 -5.363 15.588 1.00 0.00 N ATOM 30 CA SER A 4 5.787 -6.137 14.352 1.00 0.00 C ATOM 31 C SER A 4 4.407 -6.152 13.701 1.00 0.00 C ATOM 32 O SER A 4 3.387 -6.206 14.387 1.00 0.00 O ATOM 33 CB SER A 4 6.249 -7.569 14.628 1.00 0.00 C ATOM 34 OG SER A 4 7.545 -7.585 15.202 1.00 0.00 O ATOM 0 H SER A 4 4.873 -5.363 16.073 1.00 0.00 H new ATOM 0 HA SER A 4 6.488 -5.663 13.665 1.00 0.00 H new ATOM 0 HB2 SER A 4 5.544 -8.059 15.300 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.252 -8.139 13.699 1.00 0.00 H new ATOM 0 HG SER A 4 7.817 -8.511 15.370 1.00 0.00 H new ATOM 40 N MET A 5 4.386 -6.105 12.373 1.00 0.00 N ATOM 41 CA MET A 5 3.131 -6.115 11.629 1.00 0.00 C ATOM 42 C MET A 5 3.162 -7.168 10.525 1.00 0.00 C ATOM 43 O MET A 5 3.519 -6.875 9.384 1.00 0.00 O ATOM 44 CB MET A 5 2.861 -4.735 11.027 1.00 0.00 C ATOM 45 CG MET A 5 2.194 -3.770 11.993 1.00 0.00 C ATOM 46 SD MET A 5 1.595 -2.276 11.181 1.00 0.00 S ATOM 47 CE MET A 5 2.540 -1.021 12.042 1.00 0.00 C ATOM 0 H MET A 5 5.222 -6.060 11.790 1.00 0.00 H new ATOM 0 HA MET A 5 2.328 -6.365 12.322 1.00 0.00 H new ATOM 0 HB2 MET A 5 3.804 -4.304 10.689 1.00 0.00 H new ATOM 0 HB3 MET A 5 2.229 -4.849 10.146 1.00 0.00 H new ATOM 0 HG2 MET A 5 1.360 -4.272 12.483 1.00 0.00 H new ATOM 0 HG3 MET A 5 2.904 -3.495 12.773 1.00 0.00 H new ATOM 0 HE1 MET A 5 2.280 -0.037 11.651 1.00 0.00 H new ATOM 0 HE2 MET A 5 2.311 -1.060 13.107 1.00 0.00 H new ATOM 0 HE3 MET A 5 3.605 -1.201 11.893 1.00 0.00 H new ATOM 57 N THR A 6 2.787 -8.395 10.873 1.00 0.00 N ATOM 58 CA THR A 6 2.773 -9.491 9.912 1.00 0.00 C ATOM 59 C THR A 6 1.353 -9.989 9.667 1.00 0.00 C ATOM 60 O THR A 6 0.569 -10.144 10.603 1.00 0.00 O ATOM 61 CB THR A 6 3.642 -10.668 10.391 1.00 0.00 C ATOM 62 OG1 THR A 6 3.531 -11.763 9.476 1.00 0.00 O ATOM 63 CG2 THR A 6 3.224 -11.119 11.783 1.00 0.00 C ATOM 0 H THR A 6 2.489 -8.655 11.813 1.00 0.00 H new ATOM 0 HA THR A 6 3.184 -9.101 8.981 1.00 0.00 H new ATOM 0 HB THR A 6 4.678 -10.332 10.431 1.00 0.00 H new ATOM 0 HG1 THR A 6 4.088 -12.507 9.787 1.00 0.00 H new ATOM 0 HG21 THR A 6 3.852 -11.951 12.100 1.00 0.00 H new ATOM 0 HG22 THR A 6 3.338 -10.291 12.483 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.182 -11.438 11.765 1.00 0.00 H new ATOM 71 N VAL A 7 1.029 -10.239 8.402 1.00 0.00 N ATOM 72 CA VAL A 7 -0.296 -10.722 8.034 1.00 0.00 C ATOM 73 C VAL A 7 -0.329 -12.245 7.974 1.00 0.00 C ATOM 74 O VAL A 7 0.477 -12.867 7.282 1.00 0.00 O ATOM 75 CB VAL A 7 -0.742 -10.155 6.673 1.00 0.00 C ATOM 76 CG1 VAL A 7 0.260 -10.522 5.588 1.00 0.00 C ATOM 77 CG2 VAL A 7 -2.133 -10.657 6.317 1.00 0.00 C ATOM 0 H VAL A 7 1.666 -10.115 7.615 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.984 -10.377 8.806 1.00 0.00 H new ATOM 0 HB VAL A 7 -0.781 -9.068 6.746 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -0.071 -10.113 4.633 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.237 -10.109 5.840 1.00 0.00 H new ATOM 0 HG13 VAL A 7 0.333 -11.607 5.512 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -2.432 -10.247 5.353 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -2.124 -11.746 6.261 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.841 -10.339 7.082 1.00 0.00 H new ATOM 87 N VAL A 8 -1.268 -12.840 8.703 1.00 0.00 N ATOM 88 CA VAL A 8 -1.407 -14.291 8.731 1.00 0.00 C ATOM 89 C VAL A 8 -2.607 -14.744 7.907 1.00 0.00 C ATOM 90 O VAL A 8 -3.647 -14.085 7.888 1.00 0.00 O ATOM 91 CB VAL A 8 -1.563 -14.812 10.173 1.00 0.00 C ATOM 92 CG1 VAL A 8 -1.744 -16.322 10.178 1.00 0.00 C ATOM 93 CG2 VAL A 8 -0.365 -14.407 11.017 1.00 0.00 C ATOM 0 H VAL A 8 -1.943 -12.340 9.281 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.496 -14.705 8.299 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.455 -14.362 10.610 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -1.853 -16.672 11.205 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -2.636 -16.583 9.609 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.873 -16.794 9.724 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.491 -14.783 12.032 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.543 -14.827 10.585 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.287 -13.320 11.040 1.00 0.00 H new ATOM 103 N THR A 9 -2.456 -15.875 7.224 1.00 0.00 N ATOM 104 CA THR A 9 -3.526 -16.417 6.396 1.00 0.00 C ATOM 105 C THR A 9 -4.106 -17.686 7.009 1.00 0.00 C ATOM 106 O THR A 9 -3.417 -18.414 7.725 1.00 0.00 O ATOM 107 CB THR A 9 -3.031 -16.728 4.971 1.00 0.00 C ATOM 108 OG1 THR A 9 -2.316 -15.605 4.445 1.00 0.00 O ATOM 109 CG2 THR A 9 -4.198 -17.068 4.056 1.00 0.00 C ATOM 0 H THR A 9 -1.602 -16.433 7.228 1.00 0.00 H new ATOM 0 HA THR A 9 -4.303 -15.654 6.344 1.00 0.00 H new ATOM 0 HB THR A 9 -2.366 -17.590 5.020 1.00 0.00 H new ATOM 0 HG1 THR A 9 -2.003 -15.811 3.539 1.00 0.00 H new ATOM 0 HG21 THR A 9 -3.825 -17.284 3.055 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.722 -17.941 4.444 1.00 0.00 H new ATOM 0 HG23 THR A 9 -4.885 -16.223 4.012 1.00 0.00 H new ATOM 117 N THR A 10 -5.378 -17.948 6.725 1.00 0.00 N ATOM 118 CA THR A 10 -6.052 -19.129 7.248 1.00 0.00 C ATOM 119 C THR A 10 -5.985 -20.285 6.257 1.00 0.00 C ATOM 120 O THR A 10 -5.339 -20.183 5.214 1.00 0.00 O ATOM 121 CB THR A 10 -7.527 -18.835 7.578 1.00 0.00 C ATOM 122 OG1 THR A 10 -8.246 -18.529 6.378 1.00 0.00 O ATOM 123 CG2 THR A 10 -7.643 -17.674 8.554 1.00 0.00 C ATOM 0 H THR A 10 -5.963 -17.357 6.134 1.00 0.00 H new ATOM 0 HA THR A 10 -5.532 -19.409 8.164 1.00 0.00 H new ATOM 0 HB THR A 10 -7.956 -19.723 8.042 1.00 0.00 H new ATOM 0 HG1 THR A 10 -8.009 -17.627 6.076 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.694 -17.485 8.772 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.120 -17.921 9.478 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.198 -16.782 8.113 1.00 0.00 H new ATOM 131 N GLU A 11 -6.657 -21.383 6.589 1.00 0.00 N ATOM 132 CA GLU A 11 -6.673 -22.558 5.725 1.00 0.00 C ATOM 133 C GLU A 11 -7.586 -22.338 4.523 1.00 0.00 C ATOM 134 O GLU A 11 -7.395 -22.940 3.466 1.00 0.00 O ATOM 135 CB GLU A 11 -7.133 -23.789 6.510 1.00 0.00 C ATOM 136 CG GLU A 11 -6.276 -24.090 7.727 1.00 0.00 C ATOM 137 CD GLU A 11 -4.955 -24.740 7.364 1.00 0.00 C ATOM 138 OE1 GLU A 11 -4.976 -25.846 6.784 1.00 0.00 O ATOM 139 OE2 GLU A 11 -3.899 -24.142 7.659 1.00 0.00 O ATOM 0 H GLU A 11 -7.197 -21.483 7.449 1.00 0.00 H new ATOM 0 HA GLU A 11 -5.659 -22.724 5.363 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -8.164 -23.641 6.830 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -7.126 -24.655 5.848 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.084 -23.164 8.270 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.826 -24.746 8.401 1.00 0.00 H new ATOM 146 N SER A 12 -8.578 -21.470 4.692 1.00 0.00 N ATOM 147 CA SER A 12 -9.524 -21.172 3.622 1.00 0.00 C ATOM 148 C SER A 12 -8.913 -20.209 2.609 1.00 0.00 C ATOM 149 O SER A 12 -9.107 -20.353 1.403 1.00 0.00 O ATOM 150 CB SER A 12 -10.808 -20.576 4.200 1.00 0.00 C ATOM 151 OG SER A 12 -11.936 -20.948 3.427 1.00 0.00 O ATOM 0 H SER A 12 -8.748 -20.961 5.559 1.00 0.00 H new ATOM 0 HA SER A 12 -9.763 -22.105 3.111 1.00 0.00 H new ATOM 0 HB2 SER A 12 -10.940 -20.915 5.228 1.00 0.00 H new ATOM 0 HB3 SER A 12 -10.727 -19.489 4.231 1.00 0.00 H new ATOM 0 HG SER A 12 -12.755 -20.665 3.886 1.00 0.00 H new ATOM 157 N GLY A 13 -8.172 -19.224 3.110 1.00 0.00 N ATOM 158 CA GLY A 13 -7.544 -18.251 2.237 1.00 0.00 C ATOM 159 C GLY A 13 -7.547 -16.855 2.828 1.00 0.00 C ATOM 160 O GLY A 13 -6.583 -16.104 2.671 1.00 0.00 O ATOM 0 H GLY A 13 -7.996 -19.084 4.105 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.517 -18.556 2.038 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.064 -18.238 1.279 1.00 0.00 H new ATOM 164 N LEU A 14 -8.633 -16.504 3.508 1.00 0.00 N ATOM 165 CA LEU A 14 -8.758 -15.187 4.123 1.00 0.00 C ATOM 166 C LEU A 14 -7.671 -14.970 5.170 1.00 0.00 C ATOM 167 O LEU A 14 -7.275 -15.901 5.873 1.00 0.00 O ATOM 168 CB LEU A 14 -10.138 -15.032 4.765 1.00 0.00 C ATOM 169 CG LEU A 14 -10.290 -13.881 5.759 1.00 0.00 C ATOM 170 CD1 LEU A 14 -11.664 -13.241 5.629 1.00 0.00 C ATOM 171 CD2 LEU A 14 -10.060 -14.370 7.181 1.00 0.00 C ATOM 0 H LEU A 14 -9.439 -17.113 3.647 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.640 -14.436 3.342 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -10.873 -14.899 3.971 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.385 -15.962 5.276 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.537 -13.127 5.529 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.754 -12.424 6.345 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -11.791 -12.854 4.618 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -12.433 -13.986 5.831 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -10.172 -13.537 7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -10.789 -15.144 7.422 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.054 -14.780 7.266 1.00 0.00 H new ATOM 183 N LYS A 15 -7.192 -13.735 5.271 1.00 0.00 N ATOM 184 CA LYS A 15 -6.152 -13.393 6.235 1.00 0.00 C ATOM 185 C LYS A 15 -6.710 -12.511 7.347 1.00 0.00 C ATOM 186 O LYS A 15 -7.825 -11.998 7.245 1.00 0.00 O ATOM 187 CB LYS A 15 -4.994 -12.678 5.535 1.00 0.00 C ATOM 188 CG LYS A 15 -4.325 -13.514 4.458 1.00 0.00 C ATOM 189 CD LYS A 15 -4.887 -13.203 3.081 1.00 0.00 C ATOM 190 CE LYS A 15 -4.134 -13.950 1.990 1.00 0.00 C ATOM 191 NZ LYS A 15 -2.717 -13.503 1.889 1.00 0.00 N ATOM 0 H LYS A 15 -7.507 -12.953 4.697 1.00 0.00 H new ATOM 0 HA LYS A 15 -5.784 -14.318 6.679 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -5.364 -11.755 5.089 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.249 -12.396 6.279 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -3.251 -13.326 4.465 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.465 -14.572 4.678 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.942 -13.474 3.048 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.828 -12.130 2.896 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -4.164 -15.020 2.196 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.633 -13.795 1.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -2.316 -13.822 0.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -2.676 -12.465 1.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.168 -13.910 2.673 1.00 0.00 H new ATOM 205 N TYR A 16 -5.929 -12.337 8.407 1.00 0.00 N ATOM 206 CA TYR A 16 -6.345 -11.518 9.538 1.00 0.00 C ATOM 207 C TYR A 16 -5.145 -10.840 10.191 1.00 0.00 C ATOM 208 O TYR A 16 -4.064 -11.421 10.281 1.00 0.00 O ATOM 209 CB TYR A 16 -7.086 -12.372 10.568 1.00 0.00 C ATOM 210 CG TYR A 16 -6.186 -13.322 11.327 1.00 0.00 C ATOM 211 CD1 TYR A 16 -5.580 -14.397 10.687 1.00 0.00 C ATOM 212 CD2 TYR A 16 -5.940 -13.143 12.682 1.00 0.00 C ATOM 213 CE1 TYR A 16 -4.758 -15.267 11.376 1.00 0.00 C ATOM 214 CE2 TYR A 16 -5.118 -14.008 13.379 1.00 0.00 C ATOM 215 CZ TYR A 16 -4.530 -15.068 12.722 1.00 0.00 C ATOM 216 OH TYR A 16 -3.710 -15.932 13.411 1.00 0.00 O ATOM 0 H TYR A 16 -5.003 -12.753 8.506 1.00 0.00 H new ATOM 0 HA TYR A 16 -7.017 -10.745 9.166 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -7.588 -11.715 11.278 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -7.861 -12.946 10.061 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -5.755 -14.555 9.633 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -6.399 -12.314 13.200 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -4.296 -16.098 10.864 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -4.937 -13.855 14.433 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.653 -15.652 14.348 1.00 0.00 H new ATOM 226 N GLU A 17 -5.345 -9.607 10.646 1.00 0.00 N ATOM 227 CA GLU A 17 -4.279 -8.849 11.291 1.00 0.00 C ATOM 228 C GLU A 17 -4.829 -8.004 12.437 1.00 0.00 C ATOM 229 O GLU A 17 -5.672 -7.132 12.230 1.00 0.00 O ATOM 230 CB GLU A 17 -3.575 -7.949 10.273 1.00 0.00 C ATOM 231 CG GLU A 17 -2.061 -8.077 10.292 1.00 0.00 C ATOM 232 CD GLU A 17 -1.397 -7.019 11.153 1.00 0.00 C ATOM 233 OE1 GLU A 17 -1.508 -5.823 10.813 1.00 0.00 O ATOM 234 OE2 GLU A 17 -0.768 -7.389 12.166 1.00 0.00 O ATOM 0 H GLU A 17 -6.234 -9.112 10.580 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.559 -9.559 11.698 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.939 -8.190 9.274 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.846 -6.912 10.469 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.788 -9.065 10.662 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.681 -8.002 9.273 1.00 0.00 H new ATOM 241 N ASP A 18 -4.345 -8.271 13.645 1.00 0.00 N ATOM 242 CA ASP A 18 -4.786 -7.537 14.825 1.00 0.00 C ATOM 243 C ASP A 18 -4.472 -6.050 14.689 1.00 0.00 C ATOM 244 O ASP A 18 -3.379 -5.672 14.267 1.00 0.00 O ATOM 245 CB ASP A 18 -4.119 -8.099 16.081 1.00 0.00 C ATOM 246 CG ASP A 18 -4.750 -9.399 16.540 1.00 0.00 C ATOM 247 OD1 ASP A 18 -5.960 -9.590 16.297 1.00 0.00 O ATOM 248 OD2 ASP A 18 -4.033 -10.226 17.140 1.00 0.00 O ATOM 0 H ASP A 18 -3.647 -8.991 13.833 1.00 0.00 H new ATOM 0 HA ASP A 18 -5.866 -7.655 14.913 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -3.060 -8.263 15.884 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -4.184 -7.364 16.883 1.00 0.00 H new ATOM 253 N LEU A 19 -5.438 -5.212 15.047 1.00 0.00 N ATOM 254 CA LEU A 19 -5.266 -3.765 14.964 1.00 0.00 C ATOM 255 C LEU A 19 -5.434 -3.117 16.334 1.00 0.00 C ATOM 256 O LEU A 19 -4.718 -2.177 16.681 1.00 0.00 O ATOM 257 CB LEU A 19 -6.271 -3.168 13.978 1.00 0.00 C ATOM 258 CG LEU A 19 -5.810 -3.075 12.523 1.00 0.00 C ATOM 259 CD1 LEU A 19 -6.923 -2.526 11.644 1.00 0.00 C ATOM 260 CD2 LEU A 19 -4.563 -2.209 12.412 1.00 0.00 C ATOM 0 H LEU A 19 -6.349 -5.509 15.398 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.255 -3.564 14.609 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.182 -3.766 14.012 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.534 -2.167 14.320 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.563 -4.078 12.176 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.576 -2.467 10.612 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.789 -3.186 11.699 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -7.203 -1.531 11.990 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.250 -2.154 11.369 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.783 -1.206 12.778 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.762 -2.646 13.009 1.00 0.00 H new ATOM 272 N THR A 20 -6.383 -3.627 17.112 1.00 0.00 N ATOM 273 CA THR A 20 -6.645 -3.100 18.445 1.00 0.00 C ATOM 274 C THR A 20 -7.409 -4.108 19.296 1.00 0.00 C ATOM 275 O THR A 20 -8.503 -4.538 18.931 1.00 0.00 O ATOM 276 CB THR A 20 -7.447 -1.786 18.382 1.00 0.00 C ATOM 277 OG1 THR A 20 -6.811 -0.866 17.488 1.00 0.00 O ATOM 278 CG2 THR A 20 -7.568 -1.159 19.762 1.00 0.00 C ATOM 0 H THR A 20 -6.984 -4.406 16.841 1.00 0.00 H new ATOM 0 HA THR A 20 -5.675 -2.904 18.903 1.00 0.00 H new ATOM 0 HB THR A 20 -8.448 -2.014 18.016 1.00 0.00 H new ATOM 0 HG1 THR A 20 -5.856 -1.078 17.425 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.138 -0.233 19.692 1.00 0.00 H new ATOM 0 HG22 THR A 20 -8.079 -1.850 20.432 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.573 -0.944 20.153 1.00 0.00 H new ATOM 286 N GLU A 21 -6.826 -4.480 20.431 1.00 0.00 N ATOM 287 CA GLU A 21 -7.453 -5.439 21.333 1.00 0.00 C ATOM 288 C GLU A 21 -8.812 -4.931 21.807 1.00 0.00 C ATOM 289 O GLU A 21 -9.165 -3.773 21.589 1.00 0.00 O ATOM 290 CB GLU A 21 -6.549 -5.708 22.537 1.00 0.00 C ATOM 291 CG GLU A 21 -6.530 -4.574 23.549 1.00 0.00 C ATOM 292 CD GLU A 21 -5.960 -3.291 22.977 1.00 0.00 C ATOM 293 OE1 GLU A 21 -4.722 -3.125 23.013 1.00 0.00 O ATOM 294 OE2 GLU A 21 -6.750 -2.453 22.494 1.00 0.00 O ATOM 0 H GLU A 21 -5.921 -4.132 20.748 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.602 -6.370 20.786 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.880 -6.621 23.033 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.533 -5.887 22.185 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.545 -4.390 23.902 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -5.940 -4.875 24.415 1.00 0.00 H new ATOM 301 N GLY A 22 -9.572 -5.809 22.456 1.00 0.00 N ATOM 302 CA GLY A 22 -10.884 -5.432 22.949 1.00 0.00 C ATOM 303 C GLY A 22 -11.208 -6.075 24.283 1.00 0.00 C ATOM 304 O GLY A 22 -11.798 -5.441 25.158 1.00 0.00 O ATOM 0 H GLY A 22 -9.302 -6.774 22.649 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.933 -4.348 23.050 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -11.640 -5.719 22.218 1.00 0.00 H new ATOM 308 N SER A 23 -10.822 -7.337 24.439 1.00 0.00 N ATOM 309 CA SER A 23 -11.080 -8.068 25.674 1.00 0.00 C ATOM 310 C SER A 23 -12.579 -8.176 25.939 1.00 0.00 C ATOM 311 O SER A 23 -13.084 -7.658 26.934 1.00 0.00 O ATOM 312 CB SER A 23 -10.391 -7.379 26.853 1.00 0.00 C ATOM 313 OG SER A 23 -10.068 -8.311 27.871 1.00 0.00 O ATOM 0 H SER A 23 -10.329 -7.875 23.726 1.00 0.00 H new ATOM 0 HA SER A 23 -10.675 -9.074 25.563 1.00 0.00 H new ATOM 0 HB2 SER A 23 -9.484 -6.883 26.509 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.043 -6.605 27.258 1.00 0.00 H new ATOM 0 HG SER A 23 -9.627 -7.846 28.612 1.00 0.00 H new ATOM 319 N GLY A 24 -13.286 -8.853 25.039 1.00 0.00 N ATOM 320 CA GLY A 24 -14.719 -9.017 25.192 1.00 0.00 C ATOM 321 C GLY A 24 -15.184 -10.417 24.840 1.00 0.00 C ATOM 322 O GLY A 24 -14.451 -11.387 25.030 1.00 0.00 O ATOM 0 H GLY A 24 -12.891 -9.291 24.207 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.999 -8.793 26.221 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -15.234 -8.296 24.557 1.00 0.00 H new ATOM 326 N ALA A 25 -16.406 -10.522 24.328 1.00 0.00 N ATOM 327 CA ALA A 25 -16.967 -11.812 23.949 1.00 0.00 C ATOM 328 C ALA A 25 -16.941 -11.999 22.436 1.00 0.00 C ATOM 329 O ALA A 25 -17.180 -11.057 21.682 1.00 0.00 O ATOM 330 CB ALA A 25 -18.388 -11.945 24.475 1.00 0.00 C ATOM 0 H ALA A 25 -17.026 -9.729 24.166 1.00 0.00 H new ATOM 0 HA ALA A 25 -16.352 -12.593 24.396 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -18.794 -12.914 24.184 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -18.383 -11.865 25.562 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -19.007 -11.151 24.056 1.00 0.00 H new ATOM 336 N GLU A 26 -16.649 -13.220 21.999 1.00 0.00 N ATOM 337 CA GLU A 26 -16.591 -13.528 20.575 1.00 0.00 C ATOM 338 C GLU A 26 -17.991 -13.738 20.006 1.00 0.00 C ATOM 339 O GLU A 26 -18.855 -14.325 20.657 1.00 0.00 O ATOM 340 CB GLU A 26 -15.739 -14.776 20.335 1.00 0.00 C ATOM 341 CG GLU A 26 -15.244 -14.909 18.905 1.00 0.00 C ATOM 342 CD GLU A 26 -15.474 -16.296 18.335 1.00 0.00 C ATOM 343 OE1 GLU A 26 -14.592 -17.162 18.510 1.00 0.00 O ATOM 344 OE2 GLU A 26 -16.535 -16.514 17.713 1.00 0.00 O ATOM 0 H GLU A 26 -16.449 -14.012 22.610 1.00 0.00 H new ATOM 0 HA GLU A 26 -16.134 -12.680 20.065 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -14.881 -14.755 21.007 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -16.323 -15.660 20.592 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -15.751 -14.174 18.279 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.179 -14.678 18.870 1.00 0.00 H new ATOM 351 N ALA A 27 -18.208 -13.253 18.788 1.00 0.00 N ATOM 352 CA ALA A 27 -19.501 -13.388 18.131 1.00 0.00 C ATOM 353 C ALA A 27 -19.880 -14.855 17.961 1.00 0.00 C ATOM 354 O ALA A 27 -19.013 -15.719 17.829 1.00 0.00 O ATOM 355 CB ALA A 27 -19.483 -12.685 16.781 1.00 0.00 C ATOM 0 H ALA A 27 -17.504 -12.763 18.236 1.00 0.00 H new ATOM 0 HA ALA A 27 -20.253 -12.917 18.764 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -20.456 -12.794 16.301 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -19.266 -11.627 16.925 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -18.715 -13.130 16.149 1.00 0.00 H new ATOM 361 N ARG A 28 -21.180 -15.130 17.965 1.00 0.00 N ATOM 362 CA ARG A 28 -21.674 -16.493 17.813 1.00 0.00 C ATOM 363 C ARG A 28 -22.815 -16.549 16.803 1.00 0.00 C ATOM 364 O ARG A 28 -23.684 -15.678 16.783 1.00 0.00 O ATOM 365 CB ARG A 28 -22.145 -17.041 19.162 1.00 0.00 C ATOM 366 CG ARG A 28 -21.027 -17.199 20.179 1.00 0.00 C ATOM 367 CD ARG A 28 -21.573 -17.524 21.561 1.00 0.00 C ATOM 368 NE ARG A 28 -21.869 -18.946 21.712 1.00 0.00 N ATOM 369 CZ ARG A 28 -20.937 -19.876 21.887 1.00 0.00 C ATOM 370 NH1 ARG A 28 -19.656 -19.536 21.934 1.00 0.00 N ATOM 371 NH2 ARG A 28 -21.285 -21.150 22.017 1.00 0.00 N ATOM 0 H ARG A 28 -21.911 -14.426 18.072 1.00 0.00 H new ATOM 0 HA ARG A 28 -20.855 -17.110 17.444 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -22.904 -16.374 19.570 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -22.621 -18.009 19.005 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -20.351 -17.992 19.858 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -20.442 -16.280 20.224 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -20.848 -17.222 22.317 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -22.479 -16.944 21.738 1.00 0.00 H new ATOM 0 HE ARG A 28 -22.845 -19.241 21.681 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -19.384 -18.558 21.836 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -18.943 -20.253 22.069 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -22.269 -21.416 21.983 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -20.568 -21.863 22.151 1.00 0.00 H new ATOM 385 N ALA A 29 -22.806 -17.580 15.964 1.00 0.00 N ATOM 386 CA ALA A 29 -23.841 -17.751 14.952 1.00 0.00 C ATOM 387 C ALA A 29 -25.219 -17.879 15.592 1.00 0.00 C ATOM 388 O ALA A 29 -25.469 -18.796 16.372 1.00 0.00 O ATOM 389 CB ALA A 29 -23.542 -18.969 14.091 1.00 0.00 C ATOM 0 H ALA A 29 -22.093 -18.309 15.965 1.00 0.00 H new ATOM 0 HA ALA A 29 -23.844 -16.864 14.318 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -24.323 -19.084 13.340 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -22.580 -18.838 13.596 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -23.509 -19.859 14.719 1.00 0.00 H new ATOM 395 N GLY A 30 -26.111 -16.951 15.256 1.00 0.00 N ATOM 396 CA GLY A 30 -27.453 -16.978 15.808 1.00 0.00 C ATOM 397 C GLY A 30 -27.752 -15.763 16.664 1.00 0.00 C ATOM 398 O GLY A 30 -28.914 -15.451 16.924 1.00 0.00 O ATOM 0 H GLY A 30 -25.928 -16.182 14.612 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -28.176 -17.032 14.994 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -27.578 -17.880 16.407 1.00 0.00 H new ATOM 402 N GLN A 31 -26.702 -15.076 17.102 1.00 0.00 N ATOM 403 CA GLN A 31 -26.859 -13.890 17.935 1.00 0.00 C ATOM 404 C GLN A 31 -26.607 -12.621 17.128 1.00 0.00 C ATOM 405 O GLN A 31 -25.829 -12.623 16.173 1.00 0.00 O ATOM 406 CB GLN A 31 -25.903 -13.948 19.128 1.00 0.00 C ATOM 407 CG GLN A 31 -24.556 -13.297 18.861 1.00 0.00 C ATOM 408 CD GLN A 31 -23.622 -13.378 20.052 1.00 0.00 C ATOM 409 OE1 GLN A 31 -22.448 -13.721 19.913 1.00 0.00 O ATOM 410 NE2 GLN A 31 -24.140 -13.062 21.233 1.00 0.00 N ATOM 0 H GLN A 31 -25.734 -15.320 16.894 1.00 0.00 H new ATOM 0 HA GLN A 31 -27.885 -13.868 18.302 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -26.371 -13.458 19.982 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -25.745 -14.990 19.406 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -24.087 -13.779 18.003 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -24.709 -12.251 18.594 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -25.119 -12.783 21.302 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -23.559 -13.098 22.071 1.00 0.00 H new ATOM 419 N THR A 32 -27.270 -11.536 17.517 1.00 0.00 N ATOM 420 CA THR A 32 -27.119 -10.260 16.829 1.00 0.00 C ATOM 421 C THR A 32 -26.059 -9.395 17.502 1.00 0.00 C ATOM 422 O THR A 32 -25.947 -9.374 18.728 1.00 0.00 O ATOM 423 CB THR A 32 -28.448 -9.484 16.788 1.00 0.00 C ATOM 424 OG1 THR A 32 -29.533 -10.382 16.528 1.00 0.00 O ATOM 425 CG2 THR A 32 -28.411 -8.403 15.717 1.00 0.00 C ATOM 0 H THR A 32 -27.917 -11.516 18.305 1.00 0.00 H new ATOM 0 HA THR A 32 -26.807 -10.485 15.809 1.00 0.00 H new ATOM 0 HB THR A 32 -28.595 -9.009 17.758 1.00 0.00 H new ATOM 0 HG1 THR A 32 -30.168 -9.959 15.913 1.00 0.00 H new ATOM 0 HG21 THR A 32 -29.361 -7.868 15.707 1.00 0.00 H new ATOM 0 HG22 THR A 32 -27.603 -7.704 15.933 1.00 0.00 H new ATOM 0 HG23 THR A 32 -28.243 -8.862 14.743 1.00 0.00 H new ATOM 433 N VAL A 33 -25.284 -8.681 16.693 1.00 0.00 N ATOM 434 CA VAL A 33 -24.234 -7.811 17.210 1.00 0.00 C ATOM 435 C VAL A 33 -23.996 -6.625 16.283 1.00 0.00 C ATOM 436 O VAL A 33 -24.397 -6.643 15.119 1.00 0.00 O ATOM 437 CB VAL A 33 -22.910 -8.578 17.394 1.00 0.00 C ATOM 438 CG1 VAL A 33 -23.102 -9.756 18.337 1.00 0.00 C ATOM 439 CG2 VAL A 33 -22.373 -9.043 16.049 1.00 0.00 C ATOM 0 H VAL A 33 -25.363 -8.688 15.676 1.00 0.00 H new ATOM 0 HA VAL A 33 -24.574 -7.448 18.180 1.00 0.00 H new ATOM 0 HB VAL A 33 -22.178 -7.904 17.838 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -22.157 -10.286 18.455 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -23.438 -9.393 19.308 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -23.849 -10.434 17.925 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -21.438 -9.583 16.198 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -23.101 -9.702 15.575 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -22.195 -8.178 15.410 1.00 0.00 H new ATOM 449 N SER A 34 -23.341 -5.594 16.807 1.00 0.00 N ATOM 450 CA SER A 34 -23.052 -4.396 16.027 1.00 0.00 C ATOM 451 C SER A 34 -21.552 -4.253 15.785 1.00 0.00 C ATOM 452 O SER A 34 -20.767 -4.143 16.727 1.00 0.00 O ATOM 453 CB SER A 34 -23.584 -3.154 16.745 1.00 0.00 C ATOM 454 OG SER A 34 -24.823 -2.739 16.195 1.00 0.00 O ATOM 0 H SER A 34 -23.000 -5.564 17.768 1.00 0.00 H new ATOM 0 HA SER A 34 -23.551 -4.492 15.062 1.00 0.00 H new ATOM 0 HB2 SER A 34 -23.707 -3.368 17.807 1.00 0.00 H new ATOM 0 HB3 SER A 34 -22.858 -2.345 16.665 1.00 0.00 H new ATOM 0 HG SER A 34 -24.672 -2.000 15.570 1.00 0.00 H new ATOM 460 N VAL A 35 -21.161 -4.257 14.515 1.00 0.00 N ATOM 461 CA VAL A 35 -19.756 -4.127 14.147 1.00 0.00 C ATOM 462 C VAL A 35 -19.576 -3.127 13.011 1.00 0.00 C ATOM 463 O VAL A 35 -20.527 -2.799 12.301 1.00 0.00 O ATOM 464 CB VAL A 35 -19.160 -5.483 13.722 1.00 0.00 C ATOM 465 CG1 VAL A 35 -19.473 -6.552 14.758 1.00 0.00 C ATOM 466 CG2 VAL A 35 -19.680 -5.887 12.352 1.00 0.00 C ATOM 0 H VAL A 35 -21.797 -4.349 13.723 1.00 0.00 H new ATOM 0 HA VAL A 35 -19.229 -3.767 15.031 1.00 0.00 H new ATOM 0 HB VAL A 35 -18.077 -5.380 13.658 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -19.044 -7.503 14.441 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -19.046 -6.264 15.719 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -20.553 -6.657 14.858 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -19.249 -6.847 12.068 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -20.766 -5.973 12.386 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -19.398 -5.131 11.619 1.00 0.00 H new ATOM 476 N HIS A 36 -18.348 -2.645 12.843 1.00 0.00 N ATOM 477 CA HIS A 36 -18.042 -1.682 11.792 1.00 0.00 C ATOM 478 C HIS A 36 -17.106 -2.291 10.753 1.00 0.00 C ATOM 479 O HIS A 36 -16.096 -2.906 11.097 1.00 0.00 O ATOM 480 CB HIS A 36 -17.409 -0.425 12.390 1.00 0.00 C ATOM 481 CG HIS A 36 -18.288 0.785 12.310 1.00 0.00 C ATOM 482 ND1 HIS A 36 -18.864 1.527 13.284 1.00 0.00 N flip ATOM 483 CD2 HIS A 36 -18.669 1.361 11.116 1.00 0.00 C flip ATOM 484 CE1 HIS A 36 -19.573 2.529 12.668 1.00 0.00 C flip ATOM 485 NE2 HIS A 36 -19.438 2.406 11.360 1.00 0.00 N flip ATOM 0 H HIS A 36 -17.549 -2.906 13.421 1.00 0.00 H new ATOM 0 HA HIS A 36 -18.976 -1.410 11.300 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -17.161 -0.615 13.434 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -16.472 -0.218 11.872 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -18.383 1.012 10.135 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -20.147 3.293 13.171 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -19.857 3.015 10.657 1.00 0.00 H new ATOM 493 N TYR A 37 -17.449 -2.118 9.481 1.00 0.00 N ATOM 494 CA TYR A 37 -16.641 -2.654 8.392 1.00 0.00 C ATOM 495 C TYR A 37 -16.001 -1.529 7.584 1.00 0.00 C ATOM 496 O TYR A 37 -16.678 -0.593 7.156 1.00 0.00 O ATOM 497 CB TYR A 37 -17.498 -3.531 7.477 1.00 0.00 C ATOM 498 CG TYR A 37 -18.583 -2.769 6.750 1.00 0.00 C ATOM 499 CD1 TYR A 37 -19.824 -2.558 7.338 1.00 0.00 C ATOM 500 CD2 TYR A 37 -18.367 -2.261 5.475 1.00 0.00 C ATOM 501 CE1 TYR A 37 -20.819 -1.863 6.678 1.00 0.00 C ATOM 502 CE2 TYR A 37 -19.355 -1.563 4.808 1.00 0.00 C ATOM 503 CZ TYR A 37 -20.579 -1.367 5.413 1.00 0.00 C ATOM 504 OH TYR A 37 -21.567 -0.674 4.751 1.00 0.00 O ATOM 0 H TYR A 37 -18.281 -1.611 9.179 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.847 -3.261 8.827 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -16.853 -4.016 6.744 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -17.957 -4.322 8.071 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -20.014 -2.944 8.329 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -17.411 -2.414 4.997 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -21.779 -1.709 7.149 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -19.170 -1.173 3.818 1.00 0.00 H new ATOM 0 HH TYR A 37 -21.236 -0.392 3.873 1.00 0.00 H new ATOM 514 N THR A 38 -14.692 -1.628 7.377 1.00 0.00 N ATOM 515 CA THR A 38 -13.959 -0.620 6.621 1.00 0.00 C ATOM 516 C THR A 38 -13.319 -1.225 5.377 1.00 0.00 C ATOM 517 O THR A 38 -12.358 -1.987 5.469 1.00 0.00 O ATOM 518 CB THR A 38 -12.863 0.039 7.480 1.00 0.00 C ATOM 519 OG1 THR A 38 -13.133 -0.177 8.869 1.00 0.00 O ATOM 520 CG2 THR A 38 -12.781 1.532 7.199 1.00 0.00 C ATOM 0 H THR A 38 -14.117 -2.397 7.722 1.00 0.00 H new ATOM 0 HA THR A 38 -14.681 0.139 6.322 1.00 0.00 H new ATOM 0 HB THR A 38 -11.907 -0.416 7.222 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.318 -0.016 9.390 1.00 0.00 H new ATOM 0 HG21 THR A 38 -12.001 1.976 7.817 1.00 0.00 H new ATOM 0 HG22 THR A 38 -12.546 1.692 6.147 1.00 0.00 H new ATOM 0 HG23 THR A 38 -13.738 1.999 7.432 1.00 0.00 H new ATOM 528 N GLY A 39 -13.858 -0.878 4.211 1.00 0.00 N ATOM 529 CA GLY A 39 -13.325 -1.395 2.965 1.00 0.00 C ATOM 530 C GLY A 39 -11.911 -0.920 2.697 1.00 0.00 C ATOM 531 O GLY A 39 -11.696 0.237 2.335 1.00 0.00 O ATOM 0 H GLY A 39 -14.654 -0.248 4.108 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.340 -2.485 2.992 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.970 -1.087 2.142 1.00 0.00 H new ATOM 535 N TRP A 40 -10.945 -1.813 2.876 1.00 0.00 N ATOM 536 CA TRP A 40 -9.543 -1.478 2.653 1.00 0.00 C ATOM 537 C TRP A 40 -8.968 -2.285 1.494 1.00 0.00 C ATOM 538 O TRP A 40 -9.398 -3.410 1.235 1.00 0.00 O ATOM 539 CB TRP A 40 -8.728 -1.732 3.922 1.00 0.00 C ATOM 540 CG TRP A 40 -9.063 -0.792 5.041 1.00 0.00 C ATOM 541 CD1 TRP A 40 -9.842 0.327 4.966 1.00 0.00 C ATOM 542 CD2 TRP A 40 -8.627 -0.890 6.401 1.00 0.00 C ATOM 543 NE1 TRP A 40 -9.916 0.931 6.198 1.00 0.00 N ATOM 544 CE2 TRP A 40 -9.181 0.204 7.095 1.00 0.00 C ATOM 545 CE3 TRP A 40 -7.826 -1.796 7.101 1.00 0.00 C ATOM 546 CZ2 TRP A 40 -8.956 0.414 8.453 1.00 0.00 C ATOM 547 CZ3 TRP A 40 -7.603 -1.585 8.448 1.00 0.00 C ATOM 548 CH2 TRP A 40 -8.167 -0.488 9.113 1.00 0.00 C ATOM 0 H TRP A 40 -11.106 -2.775 3.175 1.00 0.00 H new ATOM 0 HA TRP A 40 -9.484 -0.420 2.398 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -8.897 -2.756 4.255 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -7.667 -1.643 3.688 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -10.328 0.685 4.070 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -10.435 1.783 6.410 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -7.389 -2.646 6.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -9.389 1.259 8.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -6.983 -2.278 8.998 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -7.975 -0.352 10.167 1.00 0.00 H new ATOM 559 N LEU A 41 -7.994 -1.706 0.801 1.00 0.00 N ATOM 560 CA LEU A 41 -7.360 -2.373 -0.331 1.00 0.00 C ATOM 561 C LEU A 41 -6.102 -3.115 0.110 1.00 0.00 C ATOM 562 O LEU A 41 -5.499 -2.786 1.132 1.00 0.00 O ATOM 563 CB LEU A 41 -7.011 -1.355 -1.418 1.00 0.00 C ATOM 564 CG LEU A 41 -8.061 -1.153 -2.511 1.00 0.00 C ATOM 565 CD1 LEU A 41 -9.017 -0.032 -2.133 1.00 0.00 C ATOM 566 CD2 LEU A 41 -7.392 -0.859 -3.846 1.00 0.00 C ATOM 0 H LEU A 41 -7.626 -0.776 1.003 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.065 -3.099 -0.735 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.823 -0.393 -0.940 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.078 -1.663 -1.891 1.00 0.00 H new ATOM 0 HG LEU A 41 -8.635 -2.074 -2.610 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.757 0.097 -2.923 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.522 -0.283 -1.200 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.458 0.895 -2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.155 -0.718 -4.612 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.792 0.047 -3.761 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.750 -1.695 -4.123 1.00 0.00 H new ATOM 578 N THR A 42 -5.709 -4.117 -0.670 1.00 0.00 N ATOM 579 CA THR A 42 -4.522 -4.905 -0.361 1.00 0.00 C ATOM 580 C THR A 42 -3.275 -4.030 -0.324 1.00 0.00 C ATOM 581 O THR A 42 -2.250 -4.416 0.238 1.00 0.00 O ATOM 582 CB THR A 42 -4.314 -6.033 -1.390 1.00 0.00 C ATOM 583 OG1 THR A 42 -3.816 -5.490 -2.618 1.00 0.00 O ATOM 584 CG2 THR A 42 -5.615 -6.777 -1.649 1.00 0.00 C ATOM 0 H THR A 42 -6.195 -4.402 -1.520 1.00 0.00 H new ATOM 0 HA THR A 42 -4.682 -5.345 0.623 1.00 0.00 H new ATOM 0 HB THR A 42 -3.587 -6.736 -0.983 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.685 -6.213 -3.266 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.443 -7.568 -2.379 1.00 0.00 H new ATOM 0 HG22 THR A 42 -5.976 -7.214 -0.718 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.360 -6.082 -2.036 1.00 0.00 H new ATOM 592 N ASP A 43 -3.369 -2.849 -0.925 1.00 0.00 N ATOM 593 CA ASP A 43 -2.248 -1.917 -0.959 1.00 0.00 C ATOM 594 C ASP A 43 -2.136 -1.153 0.357 1.00 0.00 C ATOM 595 O ASP A 43 -1.083 -0.604 0.680 1.00 0.00 O ATOM 596 CB ASP A 43 -2.408 -0.935 -2.121 1.00 0.00 C ATOM 597 CG ASP A 43 -2.239 -1.603 -3.471 1.00 0.00 C ATOM 598 OD1 ASP A 43 -1.146 -2.148 -3.731 1.00 0.00 O ATOM 599 OD2 ASP A 43 -3.200 -1.581 -4.268 1.00 0.00 O ATOM 0 H ASP A 43 -4.210 -2.514 -1.395 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.334 -2.493 -1.103 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -3.394 -0.472 -2.069 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -1.675 -0.135 -2.020 1.00 0.00 H new ATOM 604 N GLY A 44 -3.230 -1.122 1.112 1.00 0.00 N ATOM 605 CA GLY A 44 -3.233 -0.422 2.384 1.00 0.00 C ATOM 606 C GLY A 44 -4.034 0.863 2.336 1.00 0.00 C ATOM 607 O GLY A 44 -4.055 1.625 3.302 1.00 0.00 O ATOM 0 H GLY A 44 -4.113 -1.569 0.866 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.645 -1.075 3.154 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -2.207 -0.196 2.673 1.00 0.00 H new ATOM 611 N GLN A 45 -4.694 1.106 1.207 1.00 0.00 N ATOM 612 CA GLN A 45 -5.497 2.311 1.037 1.00 0.00 C ATOM 613 C GLN A 45 -6.979 2.010 1.240 1.00 0.00 C ATOM 614 O GLN A 45 -7.488 0.994 0.766 1.00 0.00 O ATOM 615 CB GLN A 45 -5.272 2.907 -0.354 1.00 0.00 C ATOM 616 CG GLN A 45 -5.693 1.986 -1.487 1.00 0.00 C ATOM 617 CD GLN A 45 -5.025 2.335 -2.802 1.00 0.00 C ATOM 618 OE1 GLN A 45 -3.825 2.122 -2.978 1.00 0.00 O ATOM 619 NE2 GLN A 45 -5.801 2.874 -3.735 1.00 0.00 N ATOM 0 H GLN A 45 -4.688 0.485 0.398 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.185 3.035 1.790 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -5.826 3.843 -0.433 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.216 3.151 -0.469 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -5.450 0.957 -1.223 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.775 2.037 -1.609 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.791 3.033 -3.546 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -5.407 3.129 -4.641 1.00 0.00 H new ATOM 628 N LYS A 46 -7.666 2.899 1.948 1.00 0.00 N ATOM 629 CA LYS A 46 -9.090 2.731 2.214 1.00 0.00 C ATOM 630 C LYS A 46 -9.928 3.323 1.085 1.00 0.00 C ATOM 631 O LYS A 46 -9.521 4.287 0.437 1.00 0.00 O ATOM 632 CB LYS A 46 -9.464 3.393 3.542 1.00 0.00 C ATOM 633 CG LYS A 46 -10.924 3.216 3.920 1.00 0.00 C ATOM 634 CD LYS A 46 -11.711 4.500 3.721 1.00 0.00 C ATOM 635 CE LYS A 46 -11.400 5.518 4.807 1.00 0.00 C ATOM 636 NZ LYS A 46 -12.037 6.836 4.531 1.00 0.00 N ATOM 0 H LYS A 46 -7.260 3.744 2.349 1.00 0.00 H new ATOM 0 HA LYS A 46 -9.299 1.663 2.276 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -8.840 2.978 4.333 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.239 4.458 3.483 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.363 2.422 3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -10.996 2.902 4.961 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -11.476 4.924 2.745 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.778 4.278 3.724 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.748 5.141 5.769 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -10.320 5.646 4.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -11.453 7.595 4.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -12.119 6.973 3.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -12.984 6.861 4.960 1.00 0.00 H new ATOM 650 N PHE A 47 -11.101 2.741 0.857 1.00 0.00 N ATOM 651 CA PHE A 47 -11.996 3.211 -0.194 1.00 0.00 C ATOM 652 C PHE A 47 -13.449 3.165 0.270 1.00 0.00 C ATOM 653 O PHE A 47 -14.373 3.306 -0.532 1.00 0.00 O ATOM 654 CB PHE A 47 -11.825 2.365 -1.457 1.00 0.00 C ATOM 655 CG PHE A 47 -12.424 0.992 -1.344 1.00 0.00 C ATOM 656 CD1 PHE A 47 -11.821 0.021 -0.561 1.00 0.00 C ATOM 657 CD2 PHE A 47 -13.589 0.673 -2.022 1.00 0.00 C ATOM 658 CE1 PHE A 47 -12.370 -1.243 -0.456 1.00 0.00 C ATOM 659 CE2 PHE A 47 -14.143 -0.590 -1.921 1.00 0.00 C ATOM 660 CZ PHE A 47 -13.533 -1.548 -1.136 1.00 0.00 C ATOM 0 H PHE A 47 -11.454 1.943 1.386 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.737 4.245 -0.421 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -12.284 2.885 -2.298 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -10.762 2.272 -1.681 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.912 0.254 -0.027 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -14.070 1.419 -2.637 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -11.890 -1.992 0.157 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -15.051 -0.827 -2.455 1.00 0.00 H new ATOM 0 HZ PHE A 47 -13.965 -2.535 -1.054 1.00 0.00 H new ATOM 670 N ASP A 48 -13.644 2.966 1.569 1.00 0.00 N ATOM 671 CA ASP A 48 -14.984 2.902 2.141 1.00 0.00 C ATOM 672 C ASP A 48 -14.921 2.722 3.654 1.00 0.00 C ATOM 673 O ASP A 48 -14.273 1.802 4.153 1.00 0.00 O ATOM 674 CB ASP A 48 -15.775 1.755 1.511 1.00 0.00 C ATOM 675 CG ASP A 48 -17.228 2.116 1.273 1.00 0.00 C ATOM 676 OD1 ASP A 48 -18.034 1.989 2.218 1.00 0.00 O ATOM 677 OD2 ASP A 48 -17.560 2.526 0.140 1.00 0.00 O ATOM 0 H ASP A 48 -12.891 2.846 2.246 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.490 3.843 1.926 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -15.313 1.476 0.564 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -15.722 0.881 2.161 1.00 0.00 H new ATOM 682 N SER A 49 -15.597 3.607 4.379 1.00 0.00 N ATOM 683 CA SER A 49 -15.614 3.549 5.836 1.00 0.00 C ATOM 684 C SER A 49 -16.867 4.217 6.392 1.00 0.00 C ATOM 685 O SER A 49 -16.983 5.443 6.392 1.00 0.00 O ATOM 686 CB SER A 49 -14.366 4.224 6.409 1.00 0.00 C ATOM 687 OG SER A 49 -14.352 5.609 6.110 1.00 0.00 O ATOM 0 H SER A 49 -16.140 4.373 3.981 1.00 0.00 H new ATOM 0 HA SER A 49 -15.620 2.500 6.133 1.00 0.00 H new ATOM 0 HB2 SER A 49 -14.335 4.082 7.489 1.00 0.00 H new ATOM 0 HB3 SER A 49 -13.473 3.751 6.000 1.00 0.00 H new ATOM 0 HG SER A 49 -15.269 5.955 6.120 1.00 0.00 H new ATOM 693 N SER A 50 -17.804 3.402 6.866 1.00 0.00 N ATOM 694 CA SER A 50 -19.052 3.913 7.421 1.00 0.00 C ATOM 695 C SER A 50 -18.803 4.638 8.741 1.00 0.00 C ATOM 696 O SER A 50 -19.571 5.515 9.136 1.00 0.00 O ATOM 697 CB SER A 50 -20.046 2.769 7.634 1.00 0.00 C ATOM 698 OG SER A 50 -21.282 3.043 6.997 1.00 0.00 O ATOM 0 H SER A 50 -17.723 2.385 6.877 1.00 0.00 H new ATOM 0 HA SER A 50 -19.473 4.624 6.710 1.00 0.00 H new ATOM 0 HB2 SER A 50 -19.628 1.842 7.241 1.00 0.00 H new ATOM 0 HB3 SER A 50 -20.209 2.618 8.701 1.00 0.00 H new ATOM 0 HG SER A 50 -22.004 2.582 7.473 1.00 0.00 H new ATOM 704 N LYS A 51 -17.722 4.264 9.418 1.00 0.00 N ATOM 705 CA LYS A 51 -17.368 4.877 10.693 1.00 0.00 C ATOM 706 C LYS A 51 -17.214 6.388 10.546 1.00 0.00 C ATOM 707 O LYS A 51 -17.388 7.136 11.508 1.00 0.00 O ATOM 708 CB LYS A 51 -16.070 4.271 11.231 1.00 0.00 C ATOM 709 CG LYS A 51 -14.828 4.741 10.494 1.00 0.00 C ATOM 710 CD LYS A 51 -13.643 3.828 10.759 1.00 0.00 C ATOM 711 CE LYS A 51 -13.070 4.048 12.151 1.00 0.00 C ATOM 712 NZ LYS A 51 -12.277 5.305 12.232 1.00 0.00 N ATOM 0 H LYS A 51 -17.076 3.539 9.105 1.00 0.00 H new ATOM 0 HA LYS A 51 -18.174 4.679 11.399 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -15.972 4.522 12.287 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -16.132 3.185 11.166 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -15.030 4.775 9.423 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -14.582 5.757 10.804 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -13.952 2.788 10.652 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -12.869 4.009 10.013 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -13.883 4.084 12.877 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -12.438 3.202 12.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -11.807 5.360 13.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -11.560 5.312 11.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -12.909 6.122 12.116 1.00 0.00 H new ATOM 726 N ASP A 52 -16.888 6.829 9.336 1.00 0.00 N ATOM 727 CA ASP A 52 -16.712 8.251 9.063 1.00 0.00 C ATOM 728 C ASP A 52 -17.993 9.024 9.362 1.00 0.00 C ATOM 729 O ASP A 52 -17.963 10.236 9.573 1.00 0.00 O ATOM 730 CB ASP A 52 -16.302 8.465 7.605 1.00 0.00 C ATOM 731 CG ASP A 52 -16.456 9.908 7.166 1.00 0.00 C ATOM 732 OD1 ASP A 52 -17.586 10.303 6.812 1.00 0.00 O ATOM 733 OD2 ASP A 52 -15.445 10.642 7.177 1.00 0.00 O ATOM 0 H ASP A 52 -16.740 6.223 8.529 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.922 8.626 9.714 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.265 8.157 7.473 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.908 7.826 6.963 1.00 0.00 H new ATOM 738 N ARG A 53 -19.116 8.314 9.378 1.00 0.00 N ATOM 739 CA ARG A 53 -20.408 8.933 9.649 1.00 0.00 C ATOM 740 C ARG A 53 -21.111 8.239 10.812 1.00 0.00 C ATOM 741 O ARG A 53 -22.320 8.380 10.993 1.00 0.00 O ATOM 742 CB ARG A 53 -21.293 8.885 8.402 1.00 0.00 C ATOM 743 CG ARG A 53 -22.505 9.799 8.480 1.00 0.00 C ATOM 744 CD ARG A 53 -22.952 10.249 7.098 1.00 0.00 C ATOM 745 NE ARG A 53 -22.255 11.457 6.663 1.00 0.00 N ATOM 746 CZ ARG A 53 -22.464 12.657 7.193 1.00 0.00 C ATOM 747 NH1 ARG A 53 -23.344 12.808 8.173 1.00 0.00 N ATOM 748 NH2 ARG A 53 -21.790 13.708 6.744 1.00 0.00 N ATOM 0 H ARG A 53 -19.157 7.309 9.206 1.00 0.00 H new ATOM 0 HA ARG A 53 -20.233 9.974 9.922 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -20.696 9.160 7.532 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -21.631 7.860 8.246 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -23.324 9.278 8.977 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -22.266 10.671 9.088 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -22.772 9.449 6.380 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -24.026 10.434 7.107 1.00 0.00 H new ATOM 0 HE ARG A 53 -21.571 11.374 5.911 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -23.862 12.002 8.522 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -23.503 13.730 8.578 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -21.111 13.595 5.991 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -21.951 14.629 7.151 1.00 0.00 H new ATOM 762 N ASN A 54 -20.345 7.488 11.597 1.00 0.00 N ATOM 763 CA ASN A 54 -20.894 6.770 12.741 1.00 0.00 C ATOM 764 C ASN A 54 -22.057 5.878 12.317 1.00 0.00 C ATOM 765 O ASN A 54 -23.115 5.879 12.945 1.00 0.00 O ATOM 766 CB ASN A 54 -21.360 7.758 13.813 1.00 0.00 C ATOM 767 CG ASN A 54 -20.201 8.401 14.550 1.00 0.00 C ATOM 768 OD1 ASN A 54 -19.375 9.142 13.821 1.00 0.00 O flip ATOM 769 ND2 ASN A 54 -20.050 8.232 15.760 1.00 0.00 N flip ATOM 0 H ASN A 54 -19.342 7.361 11.461 1.00 0.00 H new ATOM 0 HA ASN A 54 -20.107 6.139 13.154 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -21.967 8.535 13.348 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -21.999 7.240 14.528 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -20.710 7.654 16.280 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -19.265 8.670 16.242 1.00 0.00 H new ATOM 776 N ASP A 55 -21.851 5.118 11.247 1.00 0.00 N ATOM 777 CA ASP A 55 -22.881 4.219 10.738 1.00 0.00 C ATOM 778 C ASP A 55 -22.478 2.762 10.940 1.00 0.00 C ATOM 779 O ASP A 55 -22.010 2.088 10.022 1.00 0.00 O ATOM 780 CB ASP A 55 -23.137 4.489 9.255 1.00 0.00 C ATOM 781 CG ASP A 55 -24.156 3.537 8.661 1.00 0.00 C ATOM 782 OD1 ASP A 55 -25.362 3.709 8.937 1.00 0.00 O ATOM 783 OD2 ASP A 55 -23.748 2.620 7.918 1.00 0.00 O ATOM 0 H ASP A 55 -20.981 5.106 10.715 1.00 0.00 H new ATOM 0 HA ASP A 55 -23.799 4.405 11.296 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -23.486 5.514 9.130 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -22.200 4.402 8.706 1.00 0.00 H new ATOM 788 N PRO A 56 -22.662 2.261 12.171 1.00 0.00 N ATOM 789 CA PRO A 56 -22.324 0.879 12.523 1.00 0.00 C ATOM 790 C PRO A 56 -23.258 -0.131 11.866 1.00 0.00 C ATOM 791 O PRO A 56 -24.461 0.103 11.752 1.00 0.00 O ATOM 792 CB PRO A 56 -22.489 0.850 14.044 1.00 0.00 C ATOM 793 CG PRO A 56 -23.464 1.936 14.341 1.00 0.00 C ATOM 794 CD PRO A 56 -23.215 3.007 13.314 1.00 0.00 C ATOM 0 HA PRO A 56 -21.325 0.604 12.184 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -22.859 -0.118 14.384 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -21.538 1.023 14.549 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -24.488 1.568 14.281 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -23.323 2.322 15.350 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -24.134 3.529 13.047 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -22.516 3.759 13.679 1.00 0.00 H new ATOM 802 N PHE A 57 -22.697 -1.256 11.436 1.00 0.00 N ATOM 803 CA PHE A 57 -23.480 -2.303 10.790 1.00 0.00 C ATOM 804 C PHE A 57 -23.820 -3.416 11.777 1.00 0.00 C ATOM 805 O PHE A 57 -22.937 -4.129 12.253 1.00 0.00 O ATOM 806 CB PHE A 57 -22.714 -2.880 9.597 1.00 0.00 C ATOM 807 CG PHE A 57 -23.593 -3.589 8.607 1.00 0.00 C ATOM 808 CD1 PHE A 57 -24.509 -2.884 7.844 1.00 0.00 C ATOM 809 CD2 PHE A 57 -23.503 -4.962 8.440 1.00 0.00 C ATOM 810 CE1 PHE A 57 -25.319 -3.533 6.931 1.00 0.00 C ATOM 811 CE2 PHE A 57 -24.310 -5.617 7.529 1.00 0.00 C ATOM 812 CZ PHE A 57 -25.220 -4.902 6.774 1.00 0.00 C ATOM 0 H PHE A 57 -21.703 -1.466 11.523 1.00 0.00 H new ATOM 0 HA PHE A 57 -24.410 -1.859 10.435 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -22.186 -2.073 9.089 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -21.958 -3.575 9.962 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -24.591 -1.814 7.964 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -22.794 -5.526 9.028 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -26.028 -2.971 6.341 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -24.229 -6.687 7.407 1.00 0.00 H new ATOM 0 HZ PHE A 57 -25.853 -5.412 6.063 1.00 0.00 H new ATOM 822 N ALA A 58 -25.106 -3.558 12.080 1.00 0.00 N ATOM 823 CA ALA A 58 -25.564 -4.583 13.008 1.00 0.00 C ATOM 824 C ALA A 58 -26.363 -5.662 12.285 1.00 0.00 C ATOM 825 O ALA A 58 -27.108 -5.373 11.349 1.00 0.00 O ATOM 826 CB ALA A 58 -26.399 -3.958 14.116 1.00 0.00 C ATOM 0 H ALA A 58 -25.849 -2.975 11.695 1.00 0.00 H new ATOM 0 HA ALA A 58 -24.687 -5.054 13.451 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -26.734 -4.736 14.802 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -25.796 -3.230 14.659 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -27.265 -3.459 13.681 1.00 0.00 H new ATOM 832 N PHE A 59 -26.203 -6.906 12.724 1.00 0.00 N ATOM 833 CA PHE A 59 -26.908 -8.028 12.117 1.00 0.00 C ATOM 834 C PHE A 59 -26.714 -9.300 12.937 1.00 0.00 C ATOM 835 O PHE A 59 -26.079 -9.282 13.991 1.00 0.00 O ATOM 836 CB PHE A 59 -26.419 -8.251 10.685 1.00 0.00 C ATOM 837 CG PHE A 59 -25.051 -8.868 10.608 1.00 0.00 C ATOM 838 CD1 PHE A 59 -23.942 -8.187 11.083 1.00 0.00 C ATOM 839 CD2 PHE A 59 -24.876 -10.129 10.061 1.00 0.00 C ATOM 840 CE1 PHE A 59 -22.683 -8.752 11.013 1.00 0.00 C ATOM 841 CE2 PHE A 59 -23.619 -10.699 9.988 1.00 0.00 C ATOM 842 CZ PHE A 59 -22.521 -10.010 10.466 1.00 0.00 C ATOM 0 H PHE A 59 -25.591 -7.162 13.499 1.00 0.00 H new ATOM 0 HA PHE A 59 -27.971 -7.788 12.097 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -27.128 -8.893 10.163 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -26.408 -7.296 10.160 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -24.063 -7.204 11.513 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -25.731 -10.672 9.688 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -21.826 -8.210 11.386 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -23.495 -11.682 9.558 1.00 0.00 H new ATOM 0 HZ PHE A 59 -21.538 -10.454 10.412 1.00 0.00 H new ATOM 852 N VAL A 60 -27.267 -10.405 12.445 1.00 0.00 N ATOM 853 CA VAL A 60 -27.155 -11.687 13.130 1.00 0.00 C ATOM 854 C VAL A 60 -26.105 -12.573 12.469 1.00 0.00 C ATOM 855 O VAL A 60 -26.119 -12.770 11.253 1.00 0.00 O ATOM 856 CB VAL A 60 -28.502 -12.432 13.149 1.00 0.00 C ATOM 857 CG1 VAL A 60 -28.355 -13.783 13.833 1.00 0.00 C ATOM 858 CG2 VAL A 60 -29.567 -11.591 13.836 1.00 0.00 C ATOM 0 H VAL A 60 -27.797 -10.437 11.574 1.00 0.00 H new ATOM 0 HA VAL A 60 -26.852 -11.473 14.155 1.00 0.00 H new ATOM 0 HB VAL A 60 -28.816 -12.604 12.120 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -29.317 -14.295 13.837 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -27.625 -14.386 13.294 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -28.018 -13.637 14.859 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -30.512 -12.134 13.840 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -29.262 -11.385 14.862 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -29.691 -10.651 13.299 1.00 0.00 H new ATOM 868 N LEU A 61 -25.196 -13.106 13.277 1.00 0.00 N ATOM 869 CA LEU A 61 -24.137 -13.974 12.772 1.00 0.00 C ATOM 870 C LEU A 61 -24.710 -15.297 12.273 1.00 0.00 C ATOM 871 O LEU A 61 -25.694 -15.802 12.811 1.00 0.00 O ATOM 872 CB LEU A 61 -23.099 -14.234 13.864 1.00 0.00 C ATOM 873 CG LEU A 61 -21.928 -15.138 13.475 1.00 0.00 C ATOM 874 CD1 LEU A 61 -21.269 -14.638 12.199 1.00 0.00 C ATOM 875 CD2 LEU A 61 -20.914 -15.213 14.607 1.00 0.00 C ATOM 0 H LEU A 61 -25.170 -12.953 14.285 1.00 0.00 H new ATOM 0 HA LEU A 61 -23.655 -13.469 11.935 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -22.698 -13.275 14.192 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -23.606 -14.678 14.721 1.00 0.00 H new ATOM 0 HG LEU A 61 -22.313 -16.141 13.292 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -20.438 -15.293 11.938 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -21.999 -14.636 11.389 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -20.897 -13.625 12.354 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -20.088 -15.860 14.313 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -20.534 -14.214 14.822 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -21.393 -15.618 15.498 1.00 0.00 H new ATOM 887 N GLY A 62 -24.085 -15.854 11.240 1.00 0.00 N ATOM 888 CA GLY A 62 -24.544 -17.115 10.687 1.00 0.00 C ATOM 889 C GLY A 62 -25.848 -16.973 9.926 1.00 0.00 C ATOM 890 O GLY A 62 -26.612 -17.930 9.807 1.00 0.00 O ATOM 0 H GLY A 62 -23.269 -15.454 10.776 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -23.780 -17.516 10.021 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -24.674 -17.836 11.494 1.00 0.00 H new ATOM 894 N GLY A 63 -26.103 -15.774 9.411 1.00 0.00 N ATOM 895 CA GLY A 63 -27.325 -15.532 8.666 1.00 0.00 C ATOM 896 C GLY A 63 -27.274 -16.109 7.265 1.00 0.00 C ATOM 897 O GLY A 63 -27.935 -17.104 6.971 1.00 0.00 O ATOM 0 H GLY A 63 -25.486 -14.966 9.496 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -28.167 -15.967 9.204 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -27.504 -14.458 8.607 1.00 0.00 H new ATOM 901 N GLY A 64 -26.487 -15.480 6.397 1.00 0.00 N ATOM 902 CA GLY A 64 -26.368 -15.950 5.029 1.00 0.00 C ATOM 903 C GLY A 64 -26.600 -14.848 4.015 1.00 0.00 C ATOM 904 O GLY A 64 -27.153 -15.089 2.942 1.00 0.00 O ATOM 0 H GLY A 64 -25.930 -14.654 6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -25.375 -16.374 4.879 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -27.086 -16.752 4.860 1.00 0.00 H new ATOM 908 N MET A 65 -26.179 -13.634 4.355 1.00 0.00 N ATOM 909 CA MET A 65 -26.345 -12.491 3.466 1.00 0.00 C ATOM 910 C MET A 65 -24.991 -11.940 3.030 1.00 0.00 C ATOM 911 O MET A 65 -24.874 -11.317 1.974 1.00 0.00 O ATOM 912 CB MET A 65 -27.157 -11.393 4.157 1.00 0.00 C ATOM 913 CG MET A 65 -27.383 -10.166 3.289 1.00 0.00 C ATOM 914 SD MET A 65 -28.710 -9.114 3.906 1.00 0.00 S ATOM 915 CE MET A 65 -28.650 -7.767 2.728 1.00 0.00 C ATOM 0 H MET A 65 -25.720 -13.417 5.240 1.00 0.00 H new ATOM 0 HA MET A 65 -26.883 -12.827 2.580 1.00 0.00 H new ATOM 0 HB2 MET A 65 -28.123 -11.800 4.455 1.00 0.00 H new ATOM 0 HB3 MET A 65 -26.643 -11.092 5.070 1.00 0.00 H new ATOM 0 HG2 MET A 65 -26.461 -9.588 3.237 1.00 0.00 H new ATOM 0 HG3 MET A 65 -27.618 -10.483 2.273 1.00 0.00 H new ATOM 0 HE1 MET A 65 -29.415 -7.031 2.977 1.00 0.00 H new ATOM 0 HE2 MET A 65 -27.668 -7.296 2.764 1.00 0.00 H new ATOM 0 HE3 MET A 65 -28.831 -8.153 1.725 1.00 0.00 H new ATOM 925 N VAL A 66 -23.971 -12.173 3.849 1.00 0.00 N ATOM 926 CA VAL A 66 -22.625 -11.700 3.547 1.00 0.00 C ATOM 927 C VAL A 66 -21.820 -12.767 2.813 1.00 0.00 C ATOM 928 O VAL A 66 -22.318 -13.860 2.545 1.00 0.00 O ATOM 929 CB VAL A 66 -21.872 -11.295 4.828 1.00 0.00 C ATOM 930 CG1 VAL A 66 -22.690 -10.301 5.637 1.00 0.00 C ATOM 931 CG2 VAL A 66 -21.537 -12.524 5.660 1.00 0.00 C ATOM 0 H VAL A 66 -24.051 -12.686 4.727 1.00 0.00 H new ATOM 0 HA VAL A 66 -22.733 -10.825 2.906 1.00 0.00 H new ATOM 0 HB VAL A 66 -20.938 -10.812 4.542 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -22.142 -10.027 6.538 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -22.874 -9.409 5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -23.642 -10.754 5.915 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -21.005 -12.219 6.561 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -22.458 -13.037 5.938 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -20.908 -13.197 5.078 1.00 0.00 H new ATOM 941 N ILE A 67 -20.573 -12.441 2.490 1.00 0.00 N ATOM 942 CA ILE A 67 -19.698 -13.372 1.788 1.00 0.00 C ATOM 943 C ILE A 67 -18.957 -14.275 2.768 1.00 0.00 C ATOM 944 O ILE A 67 -18.875 -13.981 3.961 1.00 0.00 O ATOM 945 CB ILE A 67 -18.670 -12.629 0.915 1.00 0.00 C ATOM 946 CG1 ILE A 67 -17.633 -11.927 1.795 1.00 0.00 C ATOM 947 CG2 ILE A 67 -19.370 -11.626 0.010 1.00 0.00 C ATOM 948 CD1 ILE A 67 -16.690 -11.032 1.021 1.00 0.00 C ATOM 0 H ILE A 67 -20.146 -11.540 2.703 1.00 0.00 H new ATOM 0 HA ILE A 67 -20.335 -13.981 1.146 1.00 0.00 H new ATOM 0 HB ILE A 67 -18.154 -13.357 0.288 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -18.150 -11.332 2.548 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -17.052 -12.679 2.328 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -18.630 -11.109 -0.601 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -20.073 -12.149 -0.638 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -19.909 -10.900 0.619 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -15.983 -10.568 1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -16.146 -11.626 0.287 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -17.261 -10.257 0.510 1.00 0.00 H new ATOM 960 N LYS A 68 -18.417 -15.376 2.257 1.00 0.00 N ATOM 961 CA LYS A 68 -17.679 -16.323 3.085 1.00 0.00 C ATOM 962 C LYS A 68 -16.685 -15.598 3.987 1.00 0.00 C ATOM 963 O LYS A 68 -16.669 -15.801 5.200 1.00 0.00 O ATOM 964 CB LYS A 68 -16.942 -17.335 2.205 1.00 0.00 C ATOM 965 CG LYS A 68 -17.760 -18.575 1.888 1.00 0.00 C ATOM 966 CD LYS A 68 -16.872 -19.741 1.487 1.00 0.00 C ATOM 967 CE LYS A 68 -17.485 -21.073 1.891 1.00 0.00 C ATOM 968 NZ LYS A 68 -16.950 -22.199 1.076 1.00 0.00 N ATOM 0 H LYS A 68 -18.477 -15.635 1.272 1.00 0.00 H new ATOM 0 HA LYS A 68 -18.395 -16.852 3.714 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -16.655 -16.851 1.272 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -16.021 -17.635 2.705 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -18.355 -18.852 2.758 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -18.459 -18.355 1.081 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -16.713 -19.725 0.409 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -15.894 -19.633 1.955 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -17.284 -21.260 2.946 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -18.568 -21.024 1.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.392 -23.089 1.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -17.164 -22.033 0.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.920 -22.262 1.205 1.00 0.00 H new ATOM 982 N GLY A 69 -15.857 -14.749 3.385 1.00 0.00 N ATOM 983 CA GLY A 69 -14.873 -14.006 4.149 1.00 0.00 C ATOM 984 C GLY A 69 -15.489 -13.249 5.308 1.00 0.00 C ATOM 985 O GLY A 69 -14.900 -13.163 6.385 1.00 0.00 O ATOM 0 H GLY A 69 -15.851 -14.563 2.382 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -14.118 -14.694 4.529 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -14.362 -13.303 3.491 1.00 0.00 H new ATOM 989 N TRP A 70 -16.677 -12.698 5.088 1.00 0.00 N ATOM 990 CA TRP A 70 -17.373 -11.943 6.123 1.00 0.00 C ATOM 991 C TRP A 70 -17.786 -12.851 7.276 1.00 0.00 C ATOM 992 O TRP A 70 -17.441 -12.600 8.431 1.00 0.00 O ATOM 993 CB TRP A 70 -18.605 -11.250 5.537 1.00 0.00 C ATOM 994 CG TRP A 70 -18.339 -9.845 5.087 1.00 0.00 C ATOM 995 CD1 TRP A 70 -17.414 -9.441 4.167 1.00 0.00 C ATOM 996 CD2 TRP A 70 -19.003 -8.660 5.539 1.00 0.00 C ATOM 997 NE1 TRP A 70 -17.464 -8.076 4.020 1.00 0.00 N ATOM 998 CE2 TRP A 70 -18.431 -7.573 4.849 1.00 0.00 C ATOM 999 CE3 TRP A 70 -20.027 -8.412 6.456 1.00 0.00 C ATOM 1000 CZ2 TRP A 70 -18.849 -6.261 5.051 1.00 0.00 C ATOM 1001 CZ3 TRP A 70 -20.441 -7.108 6.656 1.00 0.00 C ATOM 1002 CH2 TRP A 70 -19.853 -6.046 5.956 1.00 0.00 C ATOM 0 H TRP A 70 -17.178 -12.760 4.202 1.00 0.00 H new ATOM 0 HA TRP A 70 -16.688 -11.187 6.508 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -18.972 -11.831 4.691 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -19.398 -11.240 6.285 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -16.742 -10.098 3.634 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -16.876 -7.526 3.394 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -20.487 -9.224 6.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 -18.397 -5.441 4.512 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 -21.231 -6.905 7.364 1.00 0.00 H new ATOM 0 HH2 TRP A 70 -20.199 -5.038 6.134 1.00 0.00 H new ATOM 1013 N ASP A 71 -18.525 -13.908 6.955 1.00 0.00 N ATOM 1014 CA ASP A 71 -18.984 -14.855 7.964 1.00 0.00 C ATOM 1015 C ASP A 71 -17.814 -15.372 8.796 1.00 0.00 C ATOM 1016 O ASP A 71 -17.921 -15.514 10.013 1.00 0.00 O ATOM 1017 CB ASP A 71 -19.711 -16.026 7.302 1.00 0.00 C ATOM 1018 CG ASP A 71 -19.815 -17.233 8.214 1.00 0.00 C ATOM 1019 OD1 ASP A 71 -20.628 -17.192 9.162 1.00 0.00 O ATOM 1020 OD2 ASP A 71 -19.086 -18.219 7.979 1.00 0.00 O ATOM 0 H ASP A 71 -18.819 -14.130 6.004 1.00 0.00 H new ATOM 0 HA ASP A 71 -19.676 -14.335 8.626 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -20.712 -15.709 7.008 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -19.185 -16.308 6.390 1.00 0.00 H new ATOM 1025 N GLU A 72 -16.698 -15.651 8.129 1.00 0.00 N ATOM 1026 CA GLU A 72 -15.509 -16.154 8.808 1.00 0.00 C ATOM 1027 C GLU A 72 -14.954 -15.112 9.775 1.00 0.00 C ATOM 1028 O GLU A 72 -14.543 -15.439 10.888 1.00 0.00 O ATOM 1029 CB GLU A 72 -14.437 -16.540 7.787 1.00 0.00 C ATOM 1030 CG GLU A 72 -13.201 -17.166 8.409 1.00 0.00 C ATOM 1031 CD GLU A 72 -13.540 -18.233 9.433 1.00 0.00 C ATOM 1032 OE1 GLU A 72 -13.892 -19.358 9.021 1.00 0.00 O ATOM 1033 OE2 GLU A 72 -13.453 -17.943 10.644 1.00 0.00 O ATOM 0 H GLU A 72 -16.592 -15.537 7.121 1.00 0.00 H new ATOM 0 HA GLU A 72 -15.793 -17.039 9.378 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -14.866 -17.239 7.069 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -14.142 -15.651 7.229 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -12.586 -17.604 7.623 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.604 -16.388 8.885 1.00 0.00 H new ATOM 1040 N GLY A 73 -14.944 -13.855 9.342 1.00 0.00 N ATOM 1041 CA GLY A 73 -14.437 -12.785 10.180 1.00 0.00 C ATOM 1042 C GLY A 73 -15.401 -12.411 11.289 1.00 0.00 C ATOM 1043 O GLY A 73 -14.984 -12.000 12.372 1.00 0.00 O ATOM 0 H GLY A 73 -15.278 -13.559 8.425 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.486 -13.089 10.617 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -14.239 -11.908 9.564 1.00 0.00 H new ATOM 1047 N VAL A 74 -16.695 -12.551 11.018 1.00 0.00 N ATOM 1048 CA VAL A 74 -17.721 -12.225 12.001 1.00 0.00 C ATOM 1049 C VAL A 74 -17.822 -13.306 13.071 1.00 0.00 C ATOM 1050 O VAL A 74 -18.200 -13.032 14.209 1.00 0.00 O ATOM 1051 CB VAL A 74 -19.099 -12.046 11.336 1.00 0.00 C ATOM 1052 CG1 VAL A 74 -20.144 -11.651 12.368 1.00 0.00 C ATOM 1053 CG2 VAL A 74 -19.022 -11.014 10.221 1.00 0.00 C ATOM 0 H VAL A 74 -17.057 -12.888 10.126 1.00 0.00 H new ATOM 0 HA VAL A 74 -17.425 -11.285 12.466 1.00 0.00 H new ATOM 0 HB VAL A 74 -19.398 -12.999 10.899 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -21.110 -11.529 11.879 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -20.217 -12.429 13.128 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -19.854 -10.711 12.838 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -20.004 -10.900 9.762 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -18.701 -10.057 10.632 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -18.306 -11.344 9.468 1.00 0.00 H new ATOM 1063 N GLN A 75 -17.480 -14.535 12.697 1.00 0.00 N ATOM 1064 CA GLN A 75 -17.532 -15.658 13.625 1.00 0.00 C ATOM 1065 C GLN A 75 -16.247 -15.751 14.440 1.00 0.00 C ATOM 1066 O GLN A 75 -16.018 -16.730 15.148 1.00 0.00 O ATOM 1067 CB GLN A 75 -17.764 -16.965 12.865 1.00 0.00 C ATOM 1068 CG GLN A 75 -16.563 -17.416 12.049 1.00 0.00 C ATOM 1069 CD GLN A 75 -16.745 -18.800 11.459 1.00 0.00 C ATOM 1070 OE1 GLN A 75 -15.836 -19.630 11.500 1.00 0.00 O ATOM 1071 NE2 GLN A 75 -17.924 -19.058 10.906 1.00 0.00 N ATOM 0 H GLN A 75 -17.164 -14.778 11.758 1.00 0.00 H new ATOM 0 HA GLN A 75 -18.363 -15.492 14.310 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -18.024 -17.748 13.577 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -18.619 -16.842 12.200 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -16.387 -16.702 11.244 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -15.675 -17.409 12.682 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -18.649 -18.341 10.894 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -18.104 -19.973 10.493 1.00 0.00 H new ATOM 1080 N GLY A 76 -15.408 -14.724 14.333 1.00 0.00 N ATOM 1081 CA GLY A 76 -14.155 -14.711 15.065 1.00 0.00 C ATOM 1082 C GLY A 76 -13.976 -13.449 15.885 1.00 0.00 C ATOM 1083 O GLY A 76 -13.522 -13.502 17.027 1.00 0.00 O ATOM 0 H GLY A 76 -15.574 -13.902 13.753 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.114 -15.578 15.724 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -13.327 -14.805 14.363 1.00 0.00 H new ATOM 1087 N MET A 77 -14.333 -12.310 15.301 1.00 0.00 N ATOM 1088 CA MET A 77 -14.209 -11.028 15.986 1.00 0.00 C ATOM 1089 C MET A 77 -14.855 -11.085 17.366 1.00 0.00 C ATOM 1090 O MET A 77 -15.718 -11.924 17.625 1.00 0.00 O ATOM 1091 CB MET A 77 -14.852 -9.917 15.154 1.00 0.00 C ATOM 1092 CG MET A 77 -16.246 -10.260 14.655 1.00 0.00 C ATOM 1093 SD MET A 77 -17.515 -10.004 15.911 1.00 0.00 S ATOM 1094 CE MET A 77 -18.948 -9.689 14.884 1.00 0.00 C ATOM 0 H MET A 77 -14.710 -12.248 14.355 1.00 0.00 H new ATOM 0 HA MET A 77 -13.148 -10.811 16.110 1.00 0.00 H new ATOM 0 HB2 MET A 77 -14.903 -9.008 15.754 1.00 0.00 H new ATOM 0 HB3 MET A 77 -14.213 -9.698 14.299 1.00 0.00 H new ATOM 0 HG2 MET A 77 -16.476 -9.649 13.782 1.00 0.00 H new ATOM 0 HG3 MET A 77 -16.266 -11.300 14.330 1.00 0.00 H new ATOM 0 HE1 MET A 77 -19.581 -8.942 15.363 1.00 0.00 H new ATOM 0 HE2 MET A 77 -18.624 -9.320 13.911 1.00 0.00 H new ATOM 0 HE3 MET A 77 -19.512 -10.613 14.753 1.00 0.00 H new ATOM 1104 N LYS A 78 -14.433 -10.187 18.250 1.00 0.00 N ATOM 1105 CA LYS A 78 -14.971 -10.133 19.604 1.00 0.00 C ATOM 1106 C LYS A 78 -15.365 -8.708 19.977 1.00 0.00 C ATOM 1107 O LYS A 78 -14.958 -7.749 19.321 1.00 0.00 O ATOM 1108 CB LYS A 78 -13.944 -10.668 20.604 1.00 0.00 C ATOM 1109 CG LYS A 78 -13.288 -11.967 20.167 1.00 0.00 C ATOM 1110 CD LYS A 78 -12.175 -12.377 21.117 1.00 0.00 C ATOM 1111 CE LYS A 78 -10.842 -11.769 20.710 1.00 0.00 C ATOM 1112 NZ LYS A 78 -9.958 -11.533 21.884 1.00 0.00 N ATOM 0 H LYS A 78 -13.719 -9.486 18.052 1.00 0.00 H new ATOM 0 HA LYS A 78 -15.863 -10.758 19.639 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.172 -9.914 20.757 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.433 -10.823 21.566 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.038 -12.757 20.121 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.885 -11.852 19.161 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -12.426 -12.062 22.130 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.091 -13.464 21.133 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.340 -12.432 20.005 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -11.016 -10.826 20.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -9.060 -11.118 21.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -10.425 -10.880 22.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -9.770 -12.436 22.364 1.00 0.00 H new ATOM 1126 N VAL A 79 -16.158 -8.575 21.035 1.00 0.00 N ATOM 1127 CA VAL A 79 -16.605 -7.266 21.497 1.00 0.00 C ATOM 1128 C VAL A 79 -15.420 -6.349 21.777 1.00 0.00 C ATOM 1129 O VAL A 79 -14.572 -6.652 22.615 1.00 0.00 O ATOM 1130 CB VAL A 79 -17.462 -7.383 22.771 1.00 0.00 C ATOM 1131 CG1 VAL A 79 -17.853 -6.004 23.280 1.00 0.00 C ATOM 1132 CG2 VAL A 79 -18.697 -8.232 22.506 1.00 0.00 C ATOM 0 H VAL A 79 -16.505 -9.358 21.589 1.00 0.00 H new ATOM 0 HA VAL A 79 -17.211 -6.838 20.699 1.00 0.00 H new ATOM 0 HB VAL A 79 -16.870 -7.875 23.543 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -18.458 -6.107 24.181 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -16.954 -5.433 23.510 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -18.428 -5.483 22.514 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -19.291 -8.304 23.417 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -19.294 -7.771 21.719 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -18.392 -9.230 22.192 1.00 0.00 H new ATOM 1142 N GLY A 80 -15.369 -5.224 21.070 1.00 0.00 N ATOM 1143 CA GLY A 80 -14.284 -4.279 21.257 1.00 0.00 C ATOM 1144 C GLY A 80 -13.044 -4.656 20.472 1.00 0.00 C ATOM 1145 O GLY A 80 -12.033 -3.956 20.520 1.00 0.00 O ATOM 0 H GLY A 80 -16.060 -4.950 20.371 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -14.615 -3.286 20.952 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -14.036 -4.221 22.317 1.00 0.00 H new ATOM 1149 N GLY A 81 -13.120 -5.767 19.746 1.00 0.00 N ATOM 1150 CA GLY A 81 -11.988 -6.218 18.958 1.00 0.00 C ATOM 1151 C GLY A 81 -11.933 -5.562 17.593 1.00 0.00 C ATOM 1152 O GLY A 81 -12.955 -5.424 16.921 1.00 0.00 O ATOM 0 H GLY A 81 -13.946 -6.363 19.689 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -11.065 -6.004 19.498 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -12.042 -7.300 18.836 1.00 0.00 H new ATOM 1156 N VAL A 82 -10.737 -5.154 17.181 1.00 0.00 N ATOM 1157 CA VAL A 82 -10.553 -4.508 15.887 1.00 0.00 C ATOM 1158 C VAL A 82 -9.349 -5.086 15.150 1.00 0.00 C ATOM 1159 O VAL A 82 -8.216 -4.994 15.624 1.00 0.00 O ATOM 1160 CB VAL A 82 -10.365 -2.987 16.041 1.00 0.00 C ATOM 1161 CG1 VAL A 82 -10.438 -2.300 14.686 1.00 0.00 C ATOM 1162 CG2 VAL A 82 -11.403 -2.416 16.995 1.00 0.00 C ATOM 0 H VAL A 82 -9.881 -5.259 17.725 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.456 -4.698 15.307 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.377 -2.801 16.462 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.303 -1.226 14.815 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.653 -2.689 14.038 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.411 -2.492 14.233 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.255 -1.340 17.092 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.402 -2.611 16.605 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.297 -2.886 17.972 1.00 0.00 H new ATOM 1172 N ARG A 83 -9.603 -5.680 13.989 1.00 0.00 N ATOM 1173 CA ARG A 83 -8.540 -6.274 13.187 1.00 0.00 C ATOM 1174 C ARG A 83 -8.908 -6.266 11.706 1.00 0.00 C ATOM 1175 O ARG A 83 -10.083 -6.354 11.347 1.00 0.00 O ATOM 1176 CB ARG A 83 -8.264 -7.706 13.646 1.00 0.00 C ATOM 1177 CG ARG A 83 -9.509 -8.578 13.705 1.00 0.00 C ATOM 1178 CD ARG A 83 -9.211 -9.933 14.327 1.00 0.00 C ATOM 1179 NE ARG A 83 -10.096 -10.226 15.451 1.00 0.00 N ATOM 1180 CZ ARG A 83 -10.147 -11.406 16.058 1.00 0.00 C ATOM 1181 NH1 ARG A 83 -9.367 -12.399 15.652 1.00 0.00 N ATOM 1182 NH2 ARG A 83 -10.979 -11.596 17.074 1.00 0.00 N ATOM 0 H ARG A 83 -10.535 -5.763 13.583 1.00 0.00 H new ATOM 0 HA ARG A 83 -7.639 -5.676 13.324 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.543 -8.163 12.969 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.802 -7.680 14.633 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.281 -8.072 14.284 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -9.905 -8.717 12.699 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -9.317 -10.710 13.570 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -8.175 -9.957 14.666 1.00 0.00 H new ATOM 0 HE ARG A 83 -10.709 -9.484 15.788 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -8.726 -12.257 14.872 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -9.408 -13.304 16.120 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -11.581 -10.835 17.390 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -11.017 -12.503 17.539 1.00 0.00 H new ATOM 1196 N ARG A 84 -7.897 -6.158 10.851 1.00 0.00 N ATOM 1197 CA ARG A 84 -8.114 -6.136 9.409 1.00 0.00 C ATOM 1198 C ARG A 84 -8.052 -7.546 8.829 1.00 0.00 C ATOM 1199 O ARG A 84 -7.042 -8.239 8.960 1.00 0.00 O ATOM 1200 CB ARG A 84 -7.072 -5.246 8.728 1.00 0.00 C ATOM 1201 CG ARG A 84 -5.641 -5.714 8.938 1.00 0.00 C ATOM 1202 CD ARG A 84 -4.640 -4.686 8.434 1.00 0.00 C ATOM 1203 NE ARG A 84 -3.344 -5.287 8.130 1.00 0.00 N ATOM 1204 CZ ARG A 84 -2.371 -4.651 7.489 1.00 0.00 C ATOM 1205 NH1 ARG A 84 -2.545 -3.399 7.087 1.00 0.00 N ATOM 1206 NH2 ARG A 84 -1.220 -5.265 7.249 1.00 0.00 N ATOM 0 H ARG A 84 -6.919 -6.084 11.131 1.00 0.00 H new ATOM 0 HA ARG A 84 -9.107 -5.728 9.222 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -7.280 -5.210 7.659 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -7.172 -4.229 9.107 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -5.470 -5.901 9.998 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.486 -6.660 8.418 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.035 -4.204 7.540 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.511 -3.907 9.185 1.00 0.00 H new ATOM 0 HE ARG A 84 -3.177 -6.249 8.427 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -3.428 -2.923 7.270 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -1.796 -2.913 6.595 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -1.081 -6.227 7.557 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -0.473 -4.775 6.756 1.00 0.00 H new ATOM 1220 N LEU A 85 -9.137 -7.964 8.187 1.00 0.00 N ATOM 1221 CA LEU A 85 -9.206 -9.292 7.586 1.00 0.00 C ATOM 1222 C LEU A 85 -9.217 -9.201 6.064 1.00 0.00 C ATOM 1223 O LEU A 85 -10.037 -8.492 5.479 1.00 0.00 O ATOM 1224 CB LEU A 85 -10.455 -10.029 8.074 1.00 0.00 C ATOM 1225 CG LEU A 85 -10.783 -9.884 9.560 1.00 0.00 C ATOM 1226 CD1 LEU A 85 -12.194 -10.374 9.846 1.00 0.00 C ATOM 1227 CD2 LEU A 85 -9.771 -10.644 10.406 1.00 0.00 C ATOM 0 H LEU A 85 -9.981 -7.403 8.069 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.320 -9.849 7.891 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.310 -9.675 7.498 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.337 -11.089 7.850 1.00 0.00 H new ATOM 0 HG LEU A 85 -10.727 -8.828 9.823 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.409 -10.263 10.909 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -12.907 -9.787 9.268 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.278 -11.424 9.567 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.020 -10.530 11.461 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.795 -11.701 10.140 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -8.773 -10.246 10.224 1.00 0.00 H new ATOM 1239 N THR A 86 -8.303 -9.926 5.426 1.00 0.00 N ATOM 1240 CA THR A 86 -8.208 -9.928 3.972 1.00 0.00 C ATOM 1241 C THR A 86 -9.166 -10.944 3.360 1.00 0.00 C ATOM 1242 O THR A 86 -8.991 -12.152 3.523 1.00 0.00 O ATOM 1243 CB THR A 86 -6.775 -10.243 3.503 1.00 0.00 C ATOM 1244 OG1 THR A 86 -5.826 -9.602 4.363 1.00 0.00 O ATOM 1245 CG2 THR A 86 -6.560 -9.781 2.070 1.00 0.00 C ATOM 0 H THR A 86 -7.618 -10.519 5.894 1.00 0.00 H new ATOM 0 HA THR A 86 -8.480 -8.928 3.636 1.00 0.00 H new ATOM 0 HB THR A 86 -6.632 -11.323 3.545 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.923 -9.909 4.140 1.00 0.00 H new ATOM 0 HG21 THR A 86 -5.541 -10.014 1.762 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.264 -10.292 1.413 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.721 -8.705 2.007 1.00 0.00 H new ATOM 1253 N ILE A 87 -10.176 -10.447 2.654 1.00 0.00 N ATOM 1254 CA ILE A 87 -11.160 -11.313 2.016 1.00 0.00 C ATOM 1255 C ILE A 87 -10.873 -11.466 0.526 1.00 0.00 C ATOM 1256 O ILE A 87 -11.155 -10.579 -0.280 1.00 0.00 O ATOM 1257 CB ILE A 87 -12.589 -10.770 2.199 1.00 0.00 C ATOM 1258 CG1 ILE A 87 -12.935 -10.672 3.686 1.00 0.00 C ATOM 1259 CG2 ILE A 87 -13.590 -11.659 1.475 1.00 0.00 C ATOM 1260 CD1 ILE A 87 -14.121 -9.779 3.974 1.00 0.00 C ATOM 0 H ILE A 87 -10.334 -9.450 2.509 1.00 0.00 H new ATOM 0 HA ILE A 87 -11.085 -12.287 2.500 1.00 0.00 H new ATOM 0 HB ILE A 87 -12.640 -9.771 1.767 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -13.142 -11.671 4.069 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -12.067 -10.296 4.228 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -14.596 -11.262 1.614 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -13.353 -11.683 0.411 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -13.539 -12.669 1.881 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -14.308 -9.757 5.048 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -13.910 -8.769 3.622 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -15.001 -10.166 3.460 1.00 0.00 H new ATOM 1272 N PRO A 88 -10.300 -12.619 0.149 1.00 0.00 N ATOM 1273 CA PRO A 88 -9.964 -12.917 -1.246 1.00 0.00 C ATOM 1274 C PRO A 88 -11.204 -13.139 -2.106 1.00 0.00 C ATOM 1275 O PRO A 88 -12.326 -13.236 -1.607 1.00 0.00 O ATOM 1276 CB PRO A 88 -9.145 -14.206 -1.146 1.00 0.00 C ATOM 1277 CG PRO A 88 -9.600 -14.847 0.120 1.00 0.00 C ATOM 1278 CD PRO A 88 -9.936 -13.720 1.057 1.00 0.00 C ATOM 0 HA PRO A 88 -9.432 -12.093 -1.722 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -9.322 -14.855 -2.004 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -8.076 -13.995 -1.121 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -10.469 -15.482 -0.054 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -8.819 -15.483 0.538 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -10.759 -13.982 1.722 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -9.088 -13.456 1.689 1.00 0.00 H new ATOM 1286 N PRO A 89 -11.001 -13.222 -3.429 1.00 0.00 N ATOM 1287 CA PRO A 89 -12.091 -13.435 -4.386 1.00 0.00 C ATOM 1288 C PRO A 89 -12.681 -14.838 -4.289 1.00 0.00 C ATOM 1289 O PRO A 89 -13.883 -15.028 -4.475 1.00 0.00 O ATOM 1290 CB PRO A 89 -11.415 -13.231 -5.744 1.00 0.00 C ATOM 1291 CG PRO A 89 -9.979 -13.547 -5.504 1.00 0.00 C ATOM 1292 CD PRO A 89 -9.691 -13.116 -4.093 1.00 0.00 C ATOM 0 HA PRO A 89 -12.929 -12.762 -4.207 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -11.843 -13.887 -6.502 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -11.541 -12.208 -6.099 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -9.787 -14.612 -5.634 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -9.340 -13.019 -6.212 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -8.948 -13.758 -3.620 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -9.303 -12.098 -4.055 1.00 0.00 H new ATOM 1300 N GLN A 90 -11.829 -15.815 -3.997 1.00 0.00 N ATOM 1301 CA GLN A 90 -12.268 -17.200 -3.876 1.00 0.00 C ATOM 1302 C GLN A 90 -13.197 -17.374 -2.680 1.00 0.00 C ATOM 1303 O GLN A 90 -13.844 -18.412 -2.528 1.00 0.00 O ATOM 1304 CB GLN A 90 -11.061 -18.129 -3.739 1.00 0.00 C ATOM 1305 CG GLN A 90 -10.121 -17.743 -2.609 1.00 0.00 C ATOM 1306 CD GLN A 90 -8.673 -17.669 -3.054 1.00 0.00 C ATOM 1307 OE1 GLN A 90 -8.381 -17.328 -4.200 1.00 0.00 O ATOM 1308 NE2 GLN A 90 -7.758 -17.988 -2.146 1.00 0.00 N ATOM 0 H GLN A 90 -10.831 -15.673 -3.840 1.00 0.00 H new ATOM 0 HA GLN A 90 -12.818 -17.461 -4.780 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -11.414 -19.147 -3.575 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -10.506 -18.131 -4.677 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -10.423 -16.777 -2.205 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -10.212 -18.469 -1.801 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -8.046 -18.265 -1.208 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -6.767 -17.956 -2.387 1.00 0.00 H new ATOM 1317 N LEU A 91 -13.259 -16.353 -1.832 1.00 0.00 N ATOM 1318 CA LEU A 91 -14.110 -16.394 -0.647 1.00 0.00 C ATOM 1319 C LEU A 91 -15.037 -15.183 -0.601 1.00 0.00 C ATOM 1320 O LEU A 91 -15.731 -14.957 0.389 1.00 0.00 O ATOM 1321 CB LEU A 91 -13.253 -16.441 0.619 1.00 0.00 C ATOM 1322 CG LEU A 91 -12.815 -17.832 1.081 1.00 0.00 C ATOM 1323 CD1 LEU A 91 -11.508 -18.229 0.412 1.00 0.00 C ATOM 1324 CD2 LEU A 91 -12.674 -17.871 2.596 1.00 0.00 C ATOM 0 H LEU A 91 -12.731 -15.487 -1.942 1.00 0.00 H new ATOM 0 HA LEU A 91 -14.721 -17.295 -0.699 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.361 -15.838 0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.810 -15.970 1.429 1.00 0.00 H new ATOM 0 HG LEU A 91 -13.582 -18.549 0.789 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.212 -19.221 0.752 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -11.642 -18.242 -0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -10.732 -17.509 0.673 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -12.362 -18.868 2.907 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -11.927 -17.142 2.911 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -13.632 -17.631 3.057 1.00 0.00 H new ATOM 1336 N GLY A 92 -15.046 -14.409 -1.683 1.00 0.00 N ATOM 1337 CA GLY A 92 -15.893 -13.233 -1.746 1.00 0.00 C ATOM 1338 C GLY A 92 -16.364 -12.933 -3.155 1.00 0.00 C ATOM 1339 O GLY A 92 -17.239 -13.620 -3.684 1.00 0.00 O ATOM 0 H GLY A 92 -14.482 -14.576 -2.516 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -16.759 -13.378 -1.100 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -15.346 -12.374 -1.358 1.00 0.00 H new ATOM 1343 N TYR A 93 -15.785 -11.905 -3.765 1.00 0.00 N ATOM 1344 CA TYR A 93 -16.154 -11.513 -5.120 1.00 0.00 C ATOM 1345 C TYR A 93 -15.962 -12.672 -6.093 1.00 0.00 C ATOM 1346 O TYR A 93 -16.928 -13.216 -6.627 1.00 0.00 O ATOM 1347 CB TYR A 93 -15.322 -10.311 -5.570 1.00 0.00 C ATOM 1348 CG TYR A 93 -15.917 -8.979 -5.174 1.00 0.00 C ATOM 1349 CD1 TYR A 93 -16.638 -8.842 -3.993 1.00 0.00 C ATOM 1350 CD2 TYR A 93 -15.761 -7.858 -5.979 1.00 0.00 C ATOM 1351 CE1 TYR A 93 -17.185 -7.628 -3.627 1.00 0.00 C ATOM 1352 CE2 TYR A 93 -16.303 -6.639 -5.620 1.00 0.00 C ATOM 1353 CZ TYR A 93 -17.014 -6.529 -4.444 1.00 0.00 C ATOM 1354 OH TYR A 93 -17.557 -5.317 -4.083 1.00 0.00 O ATOM 0 H TYR A 93 -15.058 -11.328 -3.342 1.00 0.00 H new ATOM 0 HA TYR A 93 -17.208 -11.236 -5.117 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -14.322 -10.393 -5.145 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -15.211 -10.342 -6.654 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -16.773 -9.700 -3.351 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -15.206 -7.941 -6.902 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -17.743 -7.539 -2.707 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -16.170 -5.777 -6.257 1.00 0.00 H new ATOM 0 HH TYR A 93 -18.419 -5.464 -3.641 1.00 0.00 H new ATOM 1364 N GLY A 94 -14.706 -13.045 -6.319 1.00 0.00 N ATOM 1365 CA GLY A 94 -14.409 -14.137 -7.227 1.00 0.00 C ATOM 1366 C GLY A 94 -13.772 -13.661 -8.517 1.00 0.00 C ATOM 1367 O GLY A 94 -13.298 -12.529 -8.603 1.00 0.00 O ATOM 0 H GLY A 94 -13.889 -12.610 -5.890 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.741 -14.843 -6.735 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.329 -14.675 -7.456 1.00 0.00 H new ATOM 1371 N ALA A 95 -13.758 -14.529 -9.524 1.00 0.00 N ATOM 1372 CA ALA A 95 -13.175 -14.191 -10.816 1.00 0.00 C ATOM 1373 C ALA A 95 -14.179 -13.455 -11.696 1.00 0.00 C ATOM 1374 O ALA A 95 -13.897 -13.152 -12.856 1.00 0.00 O ATOM 1375 CB ALA A 95 -12.678 -15.447 -11.516 1.00 0.00 C ATOM 0 H ALA A 95 -14.144 -15.472 -9.469 1.00 0.00 H new ATOM 0 HA ALA A 95 -12.329 -13.527 -10.642 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.245 -15.179 -12.480 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -11.920 -15.931 -10.900 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.512 -16.132 -11.671 1.00 0.00 H new ATOM 1381 N ARG A 96 -15.351 -13.170 -11.138 1.00 0.00 N ATOM 1382 CA ARG A 96 -16.398 -12.471 -11.874 1.00 0.00 C ATOM 1383 C ARG A 96 -16.008 -11.018 -12.125 1.00 0.00 C ATOM 1384 O ARG A 96 -16.483 -10.391 -13.072 1.00 0.00 O ATOM 1385 CB ARG A 96 -17.718 -12.530 -11.103 1.00 0.00 C ATOM 1386 CG ARG A 96 -18.947 -12.465 -11.995 1.00 0.00 C ATOM 1387 CD ARG A 96 -19.248 -11.038 -12.426 1.00 0.00 C ATOM 1388 NE ARG A 96 -20.678 -10.814 -12.620 1.00 0.00 N ATOM 1389 CZ ARG A 96 -21.229 -9.608 -12.705 1.00 0.00 C ATOM 1390 NH1 ARG A 96 -20.473 -8.523 -12.615 1.00 0.00 N ATOM 1391 NH2 ARG A 96 -22.538 -9.487 -12.882 1.00 0.00 N ATOM 0 H ARG A 96 -15.599 -13.412 -10.179 1.00 0.00 H new ATOM 0 HA ARG A 96 -16.524 -12.967 -12.837 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -17.749 -13.452 -10.522 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -17.751 -11.704 -10.392 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -18.792 -13.087 -12.876 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -19.806 -12.874 -11.463 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -18.872 -10.345 -11.673 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -18.718 -10.820 -13.353 1.00 0.00 H new ATOM 0 HE ARG A 96 -21.288 -11.628 -12.694 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -19.466 -8.613 -12.480 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -20.898 -7.598 -12.681 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -23.122 -10.320 -12.953 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -22.960 -8.561 -12.947 1.00 0.00 H new ATOM 1405 N GLY A 97 -15.139 -10.487 -11.270 1.00 0.00 N ATOM 1406 CA GLY A 97 -14.700 -9.111 -11.416 1.00 0.00 C ATOM 1407 C GLY A 97 -15.785 -8.116 -11.057 1.00 0.00 C ATOM 1408 O GLY A 97 -16.967 -8.457 -11.034 1.00 0.00 O ATOM 0 H GLY A 97 -14.731 -10.985 -10.479 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -13.831 -8.941 -10.781 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -14.382 -8.942 -12.445 1.00 0.00 H new ATOM 1412 N ALA A 98 -15.382 -6.881 -10.774 1.00 0.00 N ATOM 1413 CA ALA A 98 -16.329 -5.833 -10.415 1.00 0.00 C ATOM 1414 C ALA A 98 -16.160 -4.610 -11.310 1.00 0.00 C ATOM 1415 O ALA A 98 -17.136 -3.951 -11.668 1.00 0.00 O ATOM 1416 CB ALA A 98 -16.158 -5.446 -8.953 1.00 0.00 C ATOM 0 H ALA A 98 -14.407 -6.582 -10.787 1.00 0.00 H new ATOM 0 HA ALA A 98 -17.336 -6.222 -10.562 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.871 -4.662 -8.698 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.336 -6.317 -8.323 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -15.144 -5.081 -8.790 1.00 0.00 H new ATOM 1422 N GLY A 99 -14.915 -4.311 -11.668 1.00 0.00 N ATOM 1423 CA GLY A 99 -14.641 -3.167 -12.518 1.00 0.00 C ATOM 1424 C GLY A 99 -13.427 -3.378 -13.401 1.00 0.00 C ATOM 1425 O GLY A 99 -13.120 -4.505 -13.788 1.00 0.00 O ATOM 0 H GLY A 99 -14.091 -4.841 -11.384 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -15.511 -2.966 -13.143 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -14.485 -2.285 -11.896 1.00 0.00 H new ATOM 1429 N GLY A 100 -12.734 -2.289 -13.721 1.00 0.00 N ATOM 1430 CA GLY A 100 -11.556 -2.381 -14.563 1.00 0.00 C ATOM 1431 C GLY A 100 -10.294 -2.651 -13.767 1.00 0.00 C ATOM 1432 O GLY A 100 -9.510 -3.534 -14.113 1.00 0.00 O ATOM 0 H GLY A 100 -12.968 -1.345 -13.412 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.697 -3.176 -15.295 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -11.438 -1.452 -15.121 1.00 0.00 H new ATOM 1436 N VAL A 101 -10.096 -1.886 -12.698 1.00 0.00 N ATOM 1437 CA VAL A 101 -8.921 -2.047 -11.851 1.00 0.00 C ATOM 1438 C VAL A 101 -9.084 -3.229 -10.902 1.00 0.00 C ATOM 1439 O VAL A 101 -8.179 -3.548 -10.131 1.00 0.00 O ATOM 1440 CB VAL A 101 -8.645 -0.775 -11.026 1.00 0.00 C ATOM 1441 CG1 VAL A 101 -8.426 0.419 -11.943 1.00 0.00 C ATOM 1442 CG2 VAL A 101 -9.788 -0.511 -10.058 1.00 0.00 C ATOM 0 H VAL A 101 -10.734 -1.149 -12.398 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.076 -2.232 -12.515 1.00 0.00 H new ATOM 0 HB VAL A 101 -7.735 -0.929 -10.446 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -8.233 1.308 -11.343 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -7.572 0.227 -12.593 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -9.316 0.579 -12.551 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -9.577 0.391 -9.483 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.714 -0.377 -10.617 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.893 -1.358 -9.379 1.00 0.00 H new ATOM 1452 N ILE A 102 -10.244 -3.875 -10.964 1.00 0.00 N ATOM 1453 CA ILE A 102 -10.525 -5.023 -10.112 1.00 0.00 C ATOM 1454 C ILE A 102 -10.528 -6.318 -10.917 1.00 0.00 C ATOM 1455 O ILE A 102 -11.556 -6.752 -11.437 1.00 0.00 O ATOM 1456 CB ILE A 102 -11.880 -4.873 -9.396 1.00 0.00 C ATOM 1457 CG1 ILE A 102 -11.892 -3.607 -8.537 1.00 0.00 C ATOM 1458 CG2 ILE A 102 -12.167 -6.100 -8.543 1.00 0.00 C ATOM 1459 CD1 ILE A 102 -13.199 -3.381 -7.811 1.00 0.00 C ATOM 0 H ILE A 102 -11.004 -3.622 -11.596 1.00 0.00 H new ATOM 0 HA ILE A 102 -9.731 -5.065 -9.366 1.00 0.00 H new ATOM 0 HB ILE A 102 -12.663 -4.786 -10.149 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -11.085 -3.666 -7.806 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -11.685 -2.745 -9.172 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -13.128 -5.979 -8.043 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -12.197 -6.986 -9.178 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -11.382 -6.216 -7.796 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -13.135 -2.466 -7.222 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -14.007 -3.289 -8.537 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -13.399 -4.224 -7.150 1.00 0.00 H new ATOM 1471 N PRO A 103 -9.351 -6.952 -11.022 1.00 0.00 N ATOM 1472 CA PRO A 103 -9.191 -8.208 -11.760 1.00 0.00 C ATOM 1473 C PRO A 103 -9.872 -9.381 -11.061 1.00 0.00 C ATOM 1474 O PRO A 103 -10.278 -9.294 -9.903 1.00 0.00 O ATOM 1475 CB PRO A 103 -7.674 -8.412 -11.790 1.00 0.00 C ATOM 1476 CG PRO A 103 -7.169 -7.671 -10.601 1.00 0.00 C ATOM 1477 CD PRO A 103 -8.084 -6.491 -10.427 1.00 0.00 C ATOM 0 HA PRO A 103 -9.648 -8.161 -12.749 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -7.416 -9.470 -11.737 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -7.240 -8.024 -12.712 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -7.177 -8.305 -9.714 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -6.139 -7.347 -10.752 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -8.206 -6.228 -9.376 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -7.700 -5.606 -10.935 1.00 0.00 H new ATOM 1485 N PRO A 104 -9.999 -10.506 -11.781 1.00 0.00 N ATOM 1486 CA PRO A 104 -10.630 -11.718 -11.250 1.00 0.00 C ATOM 1487 C PRO A 104 -9.783 -12.387 -10.172 1.00 0.00 C ATOM 1488 O PRO A 104 -10.237 -13.311 -9.498 1.00 0.00 O ATOM 1489 CB PRO A 104 -10.746 -12.624 -12.478 1.00 0.00 C ATOM 1490 CG PRO A 104 -9.666 -12.162 -13.394 1.00 0.00 C ATOM 1491 CD PRO A 104 -9.538 -10.681 -13.168 1.00 0.00 C ATOM 0 HA PRO A 104 -11.585 -11.504 -10.770 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -10.616 -13.672 -12.210 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -11.727 -12.534 -12.945 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -8.727 -12.672 -13.179 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -9.916 -12.378 -14.433 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -8.510 -10.343 -13.295 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -10.150 -10.113 -13.869 1.00 0.00 H new ATOM 1499 N ASN A 105 -8.551 -11.914 -10.016 1.00 0.00 N ATOM 1500 CA ASN A 105 -7.641 -12.467 -9.019 1.00 0.00 C ATOM 1501 C ASN A 105 -7.315 -11.433 -7.947 1.00 0.00 C ATOM 1502 O ASN A 105 -6.396 -11.619 -7.149 1.00 0.00 O ATOM 1503 CB ASN A 105 -6.352 -12.949 -9.688 1.00 0.00 C ATOM 1504 CG ASN A 105 -5.460 -13.721 -8.735 1.00 0.00 C ATOM 1505 OD1 ASN A 105 -4.302 -13.360 -8.520 1.00 0.00 O ATOM 1506 ND2 ASN A 105 -5.996 -14.790 -8.158 1.00 0.00 N ATOM 0 H ASN A 105 -8.160 -11.150 -10.567 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.134 -13.314 -8.542 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -6.602 -13.581 -10.540 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -5.805 -12.090 -10.078 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -5.444 -15.349 -7.507 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -6.960 -15.052 -8.365 1.00 0.00 H new ATOM 1513 N ALA A 106 -8.074 -10.342 -7.934 1.00 0.00 N ATOM 1514 CA ALA A 106 -7.868 -9.279 -6.958 1.00 0.00 C ATOM 1515 C ALA A 106 -8.494 -9.639 -5.614 1.00 0.00 C ATOM 1516 O ALA A 106 -9.498 -10.350 -5.555 1.00 0.00 O ATOM 1517 CB ALA A 106 -8.442 -7.969 -7.476 1.00 0.00 C ATOM 0 H ALA A 106 -8.837 -10.171 -8.589 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.795 -9.159 -6.809 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -8.281 -7.184 -6.737 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.946 -7.698 -8.408 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -9.511 -8.086 -7.655 1.00 0.00 H new ATOM 1523 N THR A 107 -7.894 -9.143 -4.536 1.00 0.00 N ATOM 1524 CA THR A 107 -8.392 -9.414 -3.193 1.00 0.00 C ATOM 1525 C THR A 107 -8.914 -8.143 -2.533 1.00 0.00 C ATOM 1526 O THR A 107 -8.373 -7.056 -2.741 1.00 0.00 O ATOM 1527 CB THR A 107 -7.296 -10.029 -2.301 1.00 0.00 C ATOM 1528 OG1 THR A 107 -6.873 -11.286 -2.841 1.00 0.00 O ATOM 1529 CG2 THR A 107 -7.802 -10.225 -0.880 1.00 0.00 C ATOM 0 H THR A 107 -7.063 -8.552 -4.567 1.00 0.00 H new ATOM 0 HA THR A 107 -9.209 -10.128 -3.297 1.00 0.00 H new ATOM 0 HB THR A 107 -6.450 -9.342 -2.276 1.00 0.00 H new ATOM 0 HG1 THR A 107 -6.175 -11.669 -2.269 1.00 0.00 H new ATOM 0 HG21 THR A 107 -7.011 -10.660 -0.269 1.00 0.00 H new ATOM 0 HG22 THR A 107 -8.095 -9.262 -0.462 1.00 0.00 H new ATOM 0 HG23 THR A 107 -8.663 -10.894 -0.889 1.00 0.00 H new ATOM 1537 N LEU A 108 -9.967 -8.285 -1.737 1.00 0.00 N ATOM 1538 CA LEU A 108 -10.563 -7.147 -1.046 1.00 0.00 C ATOM 1539 C LEU A 108 -10.383 -7.272 0.464 1.00 0.00 C ATOM 1540 O LEU A 108 -10.730 -8.292 1.059 1.00 0.00 O ATOM 1541 CB LEU A 108 -12.051 -7.040 -1.386 1.00 0.00 C ATOM 1542 CG LEU A 108 -12.390 -6.872 -2.867 1.00 0.00 C ATOM 1543 CD1 LEU A 108 -13.828 -7.286 -3.136 1.00 0.00 C ATOM 1544 CD2 LEU A 108 -12.156 -5.434 -3.308 1.00 0.00 C ATOM 0 H LEU A 108 -10.426 -9.177 -1.554 1.00 0.00 H new ATOM 0 HA LEU A 108 -10.054 -6.243 -1.381 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -12.553 -7.935 -1.018 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -12.468 -6.194 -0.840 1.00 0.00 H new ATOM 0 HG LEU A 108 -11.733 -7.520 -3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -14.051 -7.159 -4.195 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -13.964 -8.331 -2.859 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -14.502 -6.664 -2.547 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -12.402 -5.333 -4.365 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -12.788 -4.766 -2.723 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -11.110 -5.172 -3.153 1.00 0.00 H new ATOM 1556 N VAL A 109 -9.839 -6.226 1.078 1.00 0.00 N ATOM 1557 CA VAL A 109 -9.616 -6.217 2.519 1.00 0.00 C ATOM 1558 C VAL A 109 -10.705 -5.429 3.239 1.00 0.00 C ATOM 1559 O VAL A 109 -11.252 -4.468 2.698 1.00 0.00 O ATOM 1560 CB VAL A 109 -8.244 -5.613 2.871 1.00 0.00 C ATOM 1561 CG1 VAL A 109 -7.767 -6.121 4.223 1.00 0.00 C ATOM 1562 CG2 VAL A 109 -7.228 -5.931 1.784 1.00 0.00 C ATOM 0 H VAL A 109 -9.545 -5.374 0.600 1.00 0.00 H new ATOM 0 HA VAL A 109 -9.644 -7.255 2.850 1.00 0.00 H new ATOM 0 HB VAL A 109 -8.349 -4.530 2.934 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -6.796 -5.683 4.454 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -8.485 -5.838 4.992 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -7.677 -7.207 4.193 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -6.264 -5.497 2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -7.125 -7.012 1.687 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -7.566 -5.513 0.836 1.00 0.00 H new ATOM 1572 N PHE A 110 -11.016 -5.843 4.463 1.00 0.00 N ATOM 1573 CA PHE A 110 -12.041 -5.177 5.258 1.00 0.00 C ATOM 1574 C PHE A 110 -11.687 -5.213 6.742 1.00 0.00 C ATOM 1575 O PHE A 110 -11.318 -6.258 7.277 1.00 0.00 O ATOM 1576 CB PHE A 110 -13.402 -5.837 5.031 1.00 0.00 C ATOM 1577 CG PHE A 110 -14.195 -5.209 3.921 1.00 0.00 C ATOM 1578 CD1 PHE A 110 -14.990 -4.100 4.161 1.00 0.00 C ATOM 1579 CD2 PHE A 110 -14.146 -5.729 2.637 1.00 0.00 C ATOM 1580 CE1 PHE A 110 -15.721 -3.519 3.141 1.00 0.00 C ATOM 1581 CE2 PHE A 110 -14.874 -5.152 1.613 1.00 0.00 C ATOM 1582 CZ PHE A 110 -15.663 -4.047 1.866 1.00 0.00 C ATOM 0 H PHE A 110 -10.573 -6.637 4.926 1.00 0.00 H new ATOM 0 HA PHE A 110 -12.092 -4.136 4.940 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -13.252 -6.893 4.807 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -13.980 -5.786 5.954 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -15.039 -3.684 5.157 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -13.532 -6.594 2.434 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -16.336 -2.654 3.341 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -14.826 -5.565 0.616 1.00 0.00 H new ATOM 0 HZ PHE A 110 -16.234 -3.596 1.068 1.00 0.00 H new ATOM 1592 N GLU A 111 -11.801 -4.063 7.400 1.00 0.00 N ATOM 1593 CA GLU A 111 -11.491 -3.963 8.821 1.00 0.00 C ATOM 1594 C GLU A 111 -12.738 -4.202 9.668 1.00 0.00 C ATOM 1595 O GLU A 111 -13.729 -3.480 9.552 1.00 0.00 O ATOM 1596 CB GLU A 111 -10.900 -2.589 9.141 1.00 0.00 C ATOM 1597 CG GLU A 111 -10.619 -2.377 10.619 1.00 0.00 C ATOM 1598 CD GLU A 111 -11.735 -1.631 11.324 1.00 0.00 C ATOM 1599 OE1 GLU A 111 -11.749 -0.384 11.258 1.00 0.00 O ATOM 1600 OE2 GLU A 111 -12.595 -2.294 11.942 1.00 0.00 O ATOM 0 H GLU A 111 -12.105 -3.189 6.972 1.00 0.00 H new ATOM 0 HA GLU A 111 -10.756 -4.732 9.061 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -9.973 -2.462 8.582 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.588 -1.817 8.796 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.473 -3.344 11.100 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.688 -1.822 10.732 1.00 0.00 H new ATOM 1607 N VAL A 112 -12.682 -5.221 10.519 1.00 0.00 N ATOM 1608 CA VAL A 112 -13.805 -5.556 11.386 1.00 0.00 C ATOM 1609 C VAL A 112 -13.591 -5.018 12.797 1.00 0.00 C ATOM 1610 O VAL A 112 -12.588 -5.322 13.441 1.00 0.00 O ATOM 1611 CB VAL A 112 -14.025 -7.079 11.458 1.00 0.00 C ATOM 1612 CG1 VAL A 112 -15.367 -7.395 12.101 1.00 0.00 C ATOM 1613 CG2 VAL A 112 -13.931 -7.696 10.070 1.00 0.00 C ATOM 0 H VAL A 112 -11.870 -5.829 10.627 1.00 0.00 H new ATOM 0 HA VAL A 112 -14.689 -5.089 10.952 1.00 0.00 H new ATOM 0 HB VAL A 112 -13.241 -7.513 12.078 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.505 -8.475 12.143 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -15.392 -6.986 13.111 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -16.167 -6.950 11.510 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -14.089 -8.772 10.139 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.693 -7.258 9.425 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -12.944 -7.500 9.651 1.00 0.00 H new ATOM 1623 N GLU A 113 -14.540 -4.216 13.269 1.00 0.00 N ATOM 1624 CA GLU A 113 -14.454 -3.636 14.604 1.00 0.00 C ATOM 1625 C GLU A 113 -15.786 -3.761 15.339 1.00 0.00 C ATOM 1626 O GLU A 113 -16.753 -3.069 15.017 1.00 0.00 O ATOM 1627 CB GLU A 113 -14.043 -2.165 14.519 1.00 0.00 C ATOM 1628 CG GLU A 113 -14.286 -1.389 15.803 1.00 0.00 C ATOM 1629 CD GLU A 113 -13.574 -0.050 15.819 1.00 0.00 C ATOM 1630 OE1 GLU A 113 -13.174 0.423 14.735 1.00 0.00 O ATOM 1631 OE2 GLU A 113 -13.417 0.524 16.917 1.00 0.00 O ATOM 0 H GLU A 113 -15.376 -3.953 12.747 1.00 0.00 H new ATOM 0 HA GLU A 113 -13.697 -4.186 15.163 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -12.985 -2.106 14.264 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -14.593 -1.689 13.707 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -15.357 -1.228 15.929 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -13.951 -1.985 16.652 1.00 0.00 H new ATOM 1638 N LEU A 114 -15.829 -4.648 16.327 1.00 0.00 N ATOM 1639 CA LEU A 114 -17.042 -4.865 17.108 1.00 0.00 C ATOM 1640 C LEU A 114 -17.217 -3.771 18.156 1.00 0.00 C ATOM 1641 O LEU A 114 -16.341 -3.552 18.994 1.00 0.00 O ATOM 1642 CB LEU A 114 -16.996 -6.235 17.787 1.00 0.00 C ATOM 1643 CG LEU A 114 -18.348 -6.854 18.141 1.00 0.00 C ATOM 1644 CD1 LEU A 114 -18.166 -8.267 18.672 1.00 0.00 C ATOM 1645 CD2 LEU A 114 -19.080 -5.991 19.158 1.00 0.00 C ATOM 0 H LEU A 114 -15.038 -5.229 16.606 1.00 0.00 H new ATOM 0 HA LEU A 114 -17.894 -4.831 16.429 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -16.463 -6.925 17.133 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -16.409 -6.146 18.701 1.00 0.00 H new ATOM 0 HG LEU A 114 -18.951 -6.903 17.234 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -19.139 -8.691 18.919 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -17.684 -8.882 17.912 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -17.544 -8.242 19.567 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -20.040 -6.447 19.398 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -18.480 -5.909 20.065 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -19.244 -4.997 18.741 1.00 0.00 H new ATOM 1657 N LEU A 115 -18.356 -3.088 18.106 1.00 0.00 N ATOM 1658 CA LEU A 115 -18.648 -2.018 19.052 1.00 0.00 C ATOM 1659 C LEU A 115 -19.351 -2.564 20.291 1.00 0.00 C ATOM 1660 O LEU A 115 -18.983 -2.237 21.420 1.00 0.00 O ATOM 1661 CB LEU A 115 -19.517 -0.947 18.390 1.00 0.00 C ATOM 1662 CG LEU A 115 -19.018 -0.415 17.046 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -19.484 -1.313 15.910 1.00 0.00 C ATOM 1664 CD2 LEU A 115 -19.494 1.014 16.828 1.00 0.00 C ATOM 0 H LEU A 115 -19.092 -3.257 17.420 1.00 0.00 H new ATOM 0 HA LEU A 115 -17.703 -1.571 19.360 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -20.517 -1.356 18.248 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -19.611 -0.107 19.078 1.00 0.00 H new ATOM 0 HG LEU A 115 -17.928 -0.416 17.059 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -19.119 -0.919 14.961 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -19.094 -2.320 16.058 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -20.573 -1.345 15.895 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -19.130 1.376 15.867 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -20.584 1.040 16.836 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -19.110 1.651 17.625 1.00 0.00 H new ATOM 1676 N ASP A 116 -20.361 -3.397 20.073 1.00 0.00 N ATOM 1677 CA ASP A 116 -21.114 -3.992 21.172 1.00 0.00 C ATOM 1678 C ASP A 116 -22.100 -5.035 20.654 1.00 0.00 C ATOM 1679 O ASP A 116 -22.702 -4.863 19.594 1.00 0.00 O ATOM 1680 CB ASP A 116 -21.861 -2.908 21.951 1.00 0.00 C ATOM 1681 CG ASP A 116 -22.998 -3.472 22.780 1.00 0.00 C ATOM 1682 OD1 ASP A 116 -24.118 -3.599 22.242 1.00 0.00 O ATOM 1683 OD2 ASP A 116 -22.769 -3.785 23.967 1.00 0.00 O ATOM 0 H ASP A 116 -20.678 -3.677 19.145 1.00 0.00 H new ATOM 0 HA ASP A 116 -20.407 -4.487 21.839 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -21.162 -2.387 22.605 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -22.255 -2.169 21.253 1.00 0.00 H new ATOM 1688 N VAL A 117 -22.259 -6.117 21.409 1.00 0.00 N ATOM 1689 CA VAL A 117 -23.172 -7.188 21.027 1.00 0.00 C ATOM 1690 C VAL A 117 -24.618 -6.811 21.328 1.00 0.00 C ATOM 1691 O VAL A 117 -25.453 -7.701 21.478 1.00 0.00 O ATOM 1692 CB VAL A 117 -22.832 -8.502 21.755 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -21.509 -9.062 21.257 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -22.794 -8.281 23.260 1.00 0.00 C ATOM 0 H VAL A 117 -21.768 -6.275 22.289 1.00 0.00 H new ATOM 0 HA VAL A 117 -23.055 -7.336 19.953 1.00 0.00 H new ATOM 0 HB VAL A 117 -23.612 -9.231 21.536 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -21.286 -9.990 21.783 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -21.577 -9.258 20.187 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -20.715 -8.339 21.444 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -22.552 -9.219 23.760 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -22.035 -7.536 23.499 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -23.768 -7.929 23.601 1.00 0.00 H new TER 1704 VAL A 117 HETATM 1705 N1 JZF A 130 -20.935 -6.342 0.794 1.00 0.00 N HETATM 1706 O1 JZF A 130 -20.151 -3.517 -4.517 1.00 0.00 O HETATM 1707 C2 JZF A 130 -21.428 -5.695 -0.309 1.00 0.00 C HETATM 1708 O2 JZF A 130 -22.614 -5.707 -0.572 1.00 0.00 O HETATM 1709 C3 JZF A 130 -20.484 -4.954 -1.238 1.00 0.00 C HETATM 1710 O3 JZF A 130 -19.209 -6.888 2.144 1.00 0.00 O HETATM 1711 C4 JZF A 130 -19.263 -4.407 -0.486 1.00 0.00 C HETATM 1712 O4 JZF A 130 -23.567 -8.723 1.091 1.00 0.00 O HETATM 1713 C5 JZF A 130 -18.611 -5.555 0.302 1.00 0.00 C HETATM 1714 O5 JZF A 130 -21.457 -9.011 0.305 1.00 0.00 O HETATM 1715 C6 JZF A 130 -19.614 -6.304 1.157 1.00 0.00 C HETATM 1716 C7 JZF A 130 -18.294 -3.575 -1.383 1.00 0.00 C HETATM 1717 C8 JZF A 130 -18.814 -2.421 -2.298 1.00 0.00 C HETATM 1718 C9 JZF A 130 -18.202 -2.314 -3.741 1.00 0.00 C HETATM 1719 OH JZF A 130 -18.794 -1.167 -1.607 1.00 0.00 O HETATM 1720 C10 JZF A 130 -19.051 -3.064 -4.771 1.00 0.00 C HETATM 1721 C11 JZF A 130 -18.491 -3.062 -6.189 1.00 0.00 C HETATM 1722 C12 JZF A 130 -18.269 -1.607 -6.670 1.00 0.00 C HETATM 1723 C13 JZF A 130 -17.419 -0.777 -5.677 1.00 0.00 C HETATM 1724 C14 JZF A 130 -18.028 -0.853 -4.256 1.00 0.00 C HETATM 1725 C15 JZF A 130 -21.884 -7.095 1.656 1.00 0.00 C HETATM 1726 C16 JZF A 130 -21.260 -8.711 -1.095 1.00 0.00 C HETATM 1727 C17 JZF A 130 -21.379 -10.024 -1.885 1.00 0.00 C HETATM 1728 C18 JZF A 130 -19.410 -3.807 -7.185 1.00 0.00 C HETATM 1729 C19 JZF A 130 -15.928 -1.189 -5.703 1.00 0.00 C HETATM 1730 C21 JZF A 130 -22.412 -8.352 0.997 1.00 0.00 C HETATM 0 H319 JZF A 130 -15.836 -2.241 -5.432 1.00 0.00 H new HETATM 0 H318 JZF A 130 -19.524 -4.844 -6.869 1.00 0.00 H new HETATM 0 H317 JZF A 130 -20.619 -10.726 -1.541 1.00 0.00 H new HETATM 0 H219 JZF A 130 -15.526 -1.036 -6.704 1.00 0.00 H new HETATM 0 H218 JZF A 130 -20.388 -3.325 -7.208 1.00 0.00 H new HETATM 0 H217 JZF A 130 -22.368 -10.454 -1.729 1.00 0.00 H new HETATM 0 H216 JZF A 130 -22.003 -7.991 -1.438 1.00 0.00 H new HETATM 0 H215 JZF A 130 -21.386 -7.362 2.588 1.00 0.00 H new HETATM 0 H214 JZF A 130 -18.998 -0.357 -4.256 1.00 0.00 H new HETATM 0 H212 JZF A 130 -17.776 -1.620 -7.642 1.00 0.00 H new HETATM 0 H1OH JZF A 130 -19.509 -0.592 -1.952 1.00 0.00 H new HETATM 0 H13A JZF A 130 -17.445 0.265 -5.995 1.00 0.00 H new HETATM 0 H119 JZF A 130 -15.370 -0.581 -4.991 1.00 0.00 H new HETATM 0 H118 JZF A 130 -18.967 -3.777 -8.181 1.00 0.00 H new HETATM 0 H117 JZF A 130 -21.234 -9.824 -2.947 1.00 0.00 H new HETATM 0 H116 JZF A 130 -20.281 -8.259 -1.253 1.00 0.00 H new HETATM 0 H115 JZF A 130 -22.722 -6.448 1.916 1.00 0.00 H new HETATM 0 H114 JZF A 130 -17.389 -0.304 -3.564 1.00 0.00 H new HETATM 0 H112 JZF A 130 -19.235 -1.122 -6.809 1.00 0.00 H new HETATM 0 H9 JZF A 130 -17.214 -2.764 -3.641 1.00 0.00 H new HETATM 0 H8 JZF A 130 -19.844 -2.708 -2.508 1.00 0.00 H new HETATM 0 H4 JZF A 130 -19.590 -3.660 0.238 1.00 0.00 H new HETATM 0 H27 JZF A 130 -17.545 -3.141 -0.721 1.00 0.00 H new HETATM 0 H25 JZF A 130 -18.139 -6.249 -0.394 1.00 0.00 H new HETATM 0 H23 JZF A 130 -20.153 -5.624 -2.031 1.00 0.00 H new HETATM 0 H17 JZF A 130 -17.776 -4.283 -2.030 1.00 0.00 H new HETATM 0 H15 JZF A 130 -17.821 -5.155 0.938 1.00 0.00 H new HETATM 0 H13 JZF A 130 -21.015 -4.132 -1.717 1.00 0.00 H new HETATM 0 H11 JZF A 130 -17.540 -3.593 -6.160 1.00 0.00 H new