USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1099 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 54 HIS : no HD1:sc= -0.327 K(o=-0.86,f=-5.2!) USER MOD Set 1.2: A 129 GLN : amide:sc= -0.535 X(o=-0.86,f=-0.46) USER MOD Set 2.1: A 47 CYS SG : rot -103:sc= 0.0488 USER MOD Set 2.2: A 49 THR OG1 : rot 180:sc= 0.0901 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.0564 K(o=-0.056,f=-0.62) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 76:sc= 0.822 USER MOD Single : A 23 GLN : amide:sc= -7.04! C(o=-7!,f=-9.3!) USER MOD Single : A 28 TYR OH : rot 159:sc= -1.1 USER MOD Single : A 31 LYS NZ :NH3+ 154:sc= -0.0431 (180deg=-0.331) USER MOD Single : A 45 HIS : no HD1:sc= -0.131 K(o=-0.13,f=-0.85) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -1.03 K(o=-1,f=-3.3!) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0867 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -170:sc= -1.96 USER MOD Single : A 102 TYR OH : rot -174:sc= -0.489 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0101 USER MOD Single : A 127 GLN : amide:sc= -4.75! K(o=-4.7!,f=-5.4) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot -42:sc= 0.0339 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.904 -5.703 7.129 1.00 0.00 N ATOM 2 CA MET A 1 11.782 -4.833 7.440 1.00 0.00 C ATOM 3 C MET A 1 11.315 -4.076 6.195 1.00 0.00 C ATOM 4 O MET A 1 12.077 -3.311 5.606 1.00 0.00 O ATOM 5 CB MET A 1 12.196 -3.833 8.521 1.00 0.00 C ATOM 6 CG MET A 1 10.975 -3.307 9.278 1.00 0.00 C ATOM 7 SD MET A 1 11.489 -2.535 10.803 1.00 0.00 S ATOM 8 CE MET A 1 11.483 -3.954 11.886 1.00 0.00 C ATOM 0 H1 MET A 1 13.203 -6.205 7.989 1.00 0.00 H new ATOM 0 H2 MET A 1 12.618 -6.394 6.406 1.00 0.00 H new ATOM 0 H3 MET A 1 13.696 -5.133 6.769 1.00 0.00 H new ATOM 0 HA MET A 1 10.957 -5.448 7.799 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.883 -4.311 9.219 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.732 -3.001 8.065 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.436 -2.589 8.661 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.287 -4.126 9.489 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.783 -3.648 12.888 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.480 -4.380 11.921 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.182 -4.701 11.510 1.00 0.00 H new ATOM 18 N VAL A 2 10.063 -4.315 5.832 1.00 0.00 N ATOM 19 CA VAL A 2 9.485 -3.664 4.668 1.00 0.00 C ATOM 20 C VAL A 2 10.102 -4.256 3.399 1.00 0.00 C ATOM 21 O VAL A 2 11.299 -4.539 3.360 1.00 0.00 O ATOM 22 CB VAL A 2 9.667 -2.149 4.771 1.00 0.00 C ATOM 23 CG1 VAL A 2 8.769 -1.419 3.770 1.00 0.00 C ATOM 24 CG2 VAL A 2 9.408 -1.661 6.197 1.00 0.00 C ATOM 0 H VAL A 2 9.433 -4.950 6.323 1.00 0.00 H new ATOM 0 HA VAL A 2 8.411 -3.846 4.623 1.00 0.00 H new ATOM 0 HB VAL A 2 10.703 -1.919 4.521 1.00 0.00 H new ATOM 0 HG11 VAL A 2 8.918 -0.343 3.864 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.022 -1.733 2.757 1.00 0.00 H new ATOM 0 HG13 VAL A 2 7.726 -1.660 3.974 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.544 -0.580 6.242 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.387 -1.910 6.487 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.108 -2.144 6.879 1.00 0.00 H new ATOM 34 N PRO A 3 9.235 -4.431 2.366 1.00 0.00 N ATOM 35 CA PRO A 3 9.683 -4.984 1.099 1.00 0.00 C ATOM 36 C PRO A 3 10.481 -3.950 0.301 1.00 0.00 C ATOM 37 O PRO A 3 10.591 -2.795 0.709 1.00 0.00 O ATOM 38 CB PRO A 3 8.412 -5.428 0.393 1.00 0.00 C ATOM 39 CG PRO A 3 7.274 -4.690 1.079 1.00 0.00 C ATOM 40 CD PRO A 3 7.812 -4.107 2.376 1.00 0.00 C ATOM 0 HA PRO A 3 10.367 -5.823 1.224 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.450 -5.186 -0.669 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.280 -6.507 0.469 1.00 0.00 H new ATOM 0 HG2 PRO A 3 6.889 -3.899 0.435 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.445 -5.369 1.280 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.652 -3.030 2.423 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.313 -4.541 3.242 1.00 0.00 H new ATOM 48 N PRO A 4 11.030 -4.415 -0.853 1.00 0.00 N ATOM 49 CA PRO A 4 11.814 -3.544 -1.712 1.00 0.00 C ATOM 50 C PRO A 4 10.912 -2.582 -2.489 1.00 0.00 C ATOM 51 O PRO A 4 11.156 -1.377 -2.510 1.00 0.00 O ATOM 52 CB PRO A 4 12.598 -4.483 -2.615 1.00 0.00 C ATOM 53 CG PRO A 4 11.880 -5.822 -2.546 1.00 0.00 C ATOM 54 CD PRO A 4 10.920 -5.776 -1.369 1.00 0.00 C ATOM 0 HA PRO A 4 12.488 -2.897 -1.151 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.627 -4.108 -3.638 1.00 0.00 H new ATOM 0 HB3 PRO A 4 13.631 -4.576 -2.280 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.339 -6.013 -3.473 1.00 0.00 H new ATOM 0 HG3 PRO A 4 12.597 -6.634 -2.422 1.00 0.00 H new ATOM 0 HD2 PRO A 4 9.900 -6.000 -1.681 1.00 0.00 H new ATOM 0 HD3 PRO A 4 11.189 -6.510 -0.610 1.00 0.00 H new ATOM 62 N LYS A 5 9.889 -3.152 -3.108 1.00 0.00 N ATOM 63 CA LYS A 5 8.949 -2.360 -3.883 1.00 0.00 C ATOM 64 C LYS A 5 8.575 -1.103 -3.095 1.00 0.00 C ATOM 65 O LYS A 5 8.635 0.006 -3.624 1.00 0.00 O ATOM 66 CB LYS A 5 7.744 -3.210 -4.294 1.00 0.00 C ATOM 67 CG LYS A 5 7.717 -3.427 -5.808 1.00 0.00 C ATOM 68 CD LYS A 5 7.434 -2.116 -6.545 1.00 0.00 C ATOM 69 CE LYS A 5 5.980 -2.056 -7.018 1.00 0.00 C ATOM 70 NZ LYS A 5 5.731 -0.807 -7.771 1.00 0.00 N ATOM 0 H LYS A 5 9.690 -4.152 -3.089 1.00 0.00 H new ATOM 0 HA LYS A 5 9.408 -2.027 -4.814 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.784 -4.173 -3.786 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.824 -2.720 -3.977 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.673 -3.835 -6.138 1.00 0.00 H new ATOM 0 HG3 LYS A 5 6.953 -4.162 -6.060 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.641 -1.272 -5.887 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.103 -2.024 -7.401 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.761 -2.918 -7.649 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.310 -2.110 -6.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 4.740 -0.782 -8.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 5.921 0.012 -7.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 6.357 -0.771 -8.600 1.00 0.00 H new ATOM 84 N LEU A 6 8.198 -1.319 -1.844 1.00 0.00 N ATOM 85 CA LEU A 6 7.815 -0.217 -0.977 1.00 0.00 C ATOM 86 C LEU A 6 9.045 0.642 -0.677 1.00 0.00 C ATOM 87 O LEU A 6 9.127 1.789 -1.112 1.00 0.00 O ATOM 88 CB LEU A 6 7.109 -0.740 0.275 1.00 0.00 C ATOM 89 CG LEU A 6 6.162 0.239 0.970 1.00 0.00 C ATOM 90 CD1 LEU A 6 6.708 0.654 2.338 1.00 0.00 C ATOM 91 CD2 LEU A 6 5.872 1.448 0.078 1.00 0.00 C ATOM 0 H LEU A 6 8.149 -2.241 -1.409 1.00 0.00 H new ATOM 0 HA LEU A 6 7.091 0.427 -1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.543 -1.631 0.003 1.00 0.00 H new ATOM 0 HB3 LEU A 6 7.868 -1.051 0.993 1.00 0.00 H new ATOM 0 HG LEU A 6 5.213 -0.269 1.143 1.00 0.00 H new ATOM 0 HD11 LEU A 6 6.015 1.350 2.810 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.821 -0.229 2.968 1.00 0.00 H new ATOM 0 HD13 LEU A 6 7.677 1.136 2.212 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.196 2.129 0.596 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.804 1.965 -0.148 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.408 1.113 -0.850 1.00 0.00 H new ATOM 103 N LYS A 7 9.971 0.053 0.065 1.00 0.00 N ATOM 104 CA LYS A 7 11.193 0.749 0.429 1.00 0.00 C ATOM 105 C LYS A 7 11.694 1.553 -0.773 1.00 0.00 C ATOM 106 O LYS A 7 12.309 2.605 -0.608 1.00 0.00 O ATOM 107 CB LYS A 7 12.225 -0.234 0.984 1.00 0.00 C ATOM 108 CG LYS A 7 13.327 0.502 1.751 1.00 0.00 C ATOM 109 CD LYS A 7 13.288 0.150 3.239 1.00 0.00 C ATOM 110 CE LYS A 7 14.701 0.060 3.818 1.00 0.00 C ATOM 111 NZ LYS A 7 14.659 -0.432 5.213 1.00 0.00 N ATOM 0 H LYS A 7 9.899 -0.899 0.424 1.00 0.00 H new ATOM 0 HA LYS A 7 11.001 1.461 1.232 1.00 0.00 H new ATOM 0 HB2 LYS A 7 11.733 -0.949 1.644 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.665 -0.805 0.166 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.301 0.240 1.337 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.206 1.578 1.625 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.717 0.904 3.780 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.773 -0.800 3.378 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.308 -0.609 3.208 1.00 0.00 H new ATOM 0 HE3 LYS A 7 15.177 1.040 3.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 15.626 -0.487 5.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.097 0.221 5.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 14.224 -1.377 5.235 1.00 0.00 H new ATOM 125 N GLN A 8 11.412 1.026 -1.956 1.00 0.00 N ATOM 126 CA GLN A 8 11.826 1.682 -3.184 1.00 0.00 C ATOM 127 C GLN A 8 11.064 2.996 -3.368 1.00 0.00 C ATOM 128 O GLN A 8 11.671 4.063 -3.450 1.00 0.00 O ATOM 129 CB GLN A 8 11.628 0.761 -4.390 1.00 0.00 C ATOM 130 CG GLN A 8 12.944 0.089 -4.788 1.00 0.00 C ATOM 131 CD GLN A 8 13.096 0.039 -6.310 1.00 0.00 C ATOM 132 OE1 GLN A 8 12.130 0.027 -7.056 1.00 0.00 O ATOM 133 NE2 GLN A 8 14.358 0.010 -6.728 1.00 0.00 N ATOM 0 H GLN A 8 10.902 0.153 -2.090 1.00 0.00 H new ATOM 0 HA GLN A 8 12.890 1.909 -3.111 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.884 0.000 -4.153 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.240 1.335 -5.231 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.781 0.635 -4.353 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.977 -0.922 -4.382 1.00 0.00 H new ATOM 0 HE21 GLN A 8 15.120 0.022 -6.050 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.564 -0.025 -7.726 1.00 0.00 H new ATOM 142 N ALA A 9 9.746 2.876 -3.426 1.00 0.00 N ATOM 143 CA ALA A 9 8.895 4.041 -3.598 1.00 0.00 C ATOM 144 C ALA A 9 9.326 5.132 -2.616 1.00 0.00 C ATOM 145 O ALA A 9 9.522 6.282 -3.006 1.00 0.00 O ATOM 146 CB ALA A 9 7.431 3.636 -3.415 1.00 0.00 C ATOM 0 H ALA A 9 9.246 1.989 -3.357 1.00 0.00 H new ATOM 0 HA ALA A 9 8.997 4.445 -4.605 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.793 4.510 -3.544 1.00 0.00 H new ATOM 0 HB2 ALA A 9 7.167 2.881 -4.156 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.289 3.228 -2.414 1.00 0.00 H new ATOM 152 N LEU A 10 9.462 4.732 -1.360 1.00 0.00 N ATOM 153 CA LEU A 10 9.866 5.661 -0.318 1.00 0.00 C ATOM 154 C LEU A 10 11.272 6.181 -0.622 1.00 0.00 C ATOM 155 O LEU A 10 11.444 7.347 -0.974 1.00 0.00 O ATOM 156 CB LEU A 10 9.736 5.010 1.060 1.00 0.00 C ATOM 157 CG LEU A 10 8.310 4.715 1.531 1.00 0.00 C ATOM 158 CD1 LEU A 10 8.317 3.900 2.826 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.500 6.005 1.670 1.00 0.00 C ATOM 0 H LEU A 10 9.300 3.777 -1.040 1.00 0.00 H new ATOM 0 HA LEU A 10 9.203 6.526 -0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.296 4.075 1.052 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.212 5.660 1.794 1.00 0.00 H new ATOM 0 HG LEU A 10 7.819 4.107 0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 10 7.291 3.704 3.138 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.832 2.954 2.658 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.833 4.460 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.491 5.767 2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.980 6.659 2.398 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.451 6.510 0.705 1.00 0.00 H new ATOM 171 N GLU A 11 12.242 5.290 -0.476 1.00 0.00 N ATOM 172 CA GLU A 11 13.628 5.645 -0.730 1.00 0.00 C ATOM 173 C GLU A 11 13.731 6.520 -1.981 1.00 0.00 C ATOM 174 O GLU A 11 14.460 7.511 -1.991 1.00 0.00 O ATOM 175 CB GLU A 11 14.498 4.393 -0.864 1.00 0.00 C ATOM 176 CG GLU A 11 14.795 3.782 0.507 1.00 0.00 C ATOM 177 CD GLU A 11 15.964 2.799 0.428 1.00 0.00 C ATOM 178 OE1 GLU A 11 15.931 1.951 -0.490 1.00 0.00 O ATOM 179 OE2 GLU A 11 16.864 2.916 1.287 1.00 0.00 O ATOM 0 H GLU A 11 12.096 4.323 -0.185 1.00 0.00 H new ATOM 0 HA GLU A 11 13.999 6.217 0.121 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.991 3.659 -1.491 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.433 4.647 -1.363 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.029 4.574 1.219 1.00 0.00 H new ATOM 0 HG3 GLU A 11 13.909 3.269 0.880 1.00 0.00 H new ATOM 186 N LEU A 12 12.990 6.123 -3.005 1.00 0.00 N ATOM 187 CA LEU A 12 12.989 6.860 -4.258 1.00 0.00 C ATOM 188 C LEU A 12 12.381 8.245 -4.029 1.00 0.00 C ATOM 189 O LEU A 12 12.919 9.248 -4.496 1.00 0.00 O ATOM 190 CB LEU A 12 12.288 6.053 -5.352 1.00 0.00 C ATOM 191 CG LEU A 12 12.128 6.753 -6.703 1.00 0.00 C ATOM 192 CD1 LEU A 12 13.456 7.350 -7.172 1.00 0.00 C ATOM 193 CD2 LEU A 12 11.526 5.807 -7.744 1.00 0.00 C ATOM 0 H LEU A 12 12.386 5.301 -2.993 1.00 0.00 H new ATOM 0 HA LEU A 12 14.009 7.014 -4.611 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.845 5.129 -5.508 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.299 5.772 -4.991 1.00 0.00 H new ATOM 0 HG LEU A 12 11.429 7.580 -6.578 1.00 0.00 H new ATOM 0 HD11 LEU A 12 13.314 7.842 -8.134 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.806 8.078 -6.441 1.00 0.00 H new ATOM 0 HD13 LEU A 12 14.195 6.556 -7.276 1.00 0.00 H new ATOM 0 HD21 LEU A 12 11.423 6.330 -8.695 1.00 0.00 H new ATOM 0 HD22 LEU A 12 12.180 4.945 -7.873 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.545 5.471 -7.407 1.00 0.00 H new ATOM 205 N PHE A 13 11.267 8.256 -3.311 1.00 0.00 N ATOM 206 CA PHE A 13 10.581 9.502 -3.015 1.00 0.00 C ATOM 207 C PHE A 13 11.544 10.532 -2.423 1.00 0.00 C ATOM 208 O PHE A 13 11.704 11.623 -2.967 1.00 0.00 O ATOM 209 CB PHE A 13 9.497 9.181 -1.983 1.00 0.00 C ATOM 210 CG PHE A 13 8.469 10.298 -1.794 1.00 0.00 C ATOM 211 CD1 PHE A 13 7.541 10.539 -2.758 1.00 0.00 C ATOM 212 CD2 PHE A 13 8.482 11.050 -0.660 1.00 0.00 C ATOM 213 CE1 PHE A 13 6.586 11.575 -2.582 1.00 0.00 C ATOM 214 CE2 PHE A 13 7.527 12.086 -0.484 1.00 0.00 C ATOM 215 CZ PHE A 13 6.599 12.327 -1.449 1.00 0.00 C ATOM 0 H PHE A 13 10.823 7.422 -2.926 1.00 0.00 H new ATOM 0 HA PHE A 13 10.161 9.922 -3.929 1.00 0.00 H new ATOM 0 HB2 PHE A 13 8.979 8.271 -2.286 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.972 8.972 -1.025 1.00 0.00 H new ATOM 0 HD1 PHE A 13 7.530 9.942 -3.658 1.00 0.00 H new ATOM 0 HD2 PHE A 13 9.219 10.859 0.106 1.00 0.00 H new ATOM 0 HE1 PHE A 13 5.849 11.766 -3.348 1.00 0.00 H new ATOM 0 HE2 PHE A 13 7.537 12.683 0.416 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.873 13.115 -1.315 1.00 0.00 H new ATOM 225 N LYS A 14 12.162 10.149 -1.315 1.00 0.00 N ATOM 226 CA LYS A 14 13.105 11.025 -0.642 1.00 0.00 C ATOM 227 C LYS A 14 14.250 11.364 -1.599 1.00 0.00 C ATOM 228 O LYS A 14 15.014 12.297 -1.353 1.00 0.00 O ATOM 229 CB LYS A 14 13.569 10.403 0.676 1.00 0.00 C ATOM 230 CG LYS A 14 14.286 11.436 1.548 1.00 0.00 C ATOM 231 CD LYS A 14 15.133 10.753 2.623 1.00 0.00 C ATOM 232 CE LYS A 14 15.306 11.659 3.843 1.00 0.00 C ATOM 233 NZ LYS A 14 16.417 11.178 4.694 1.00 0.00 N ATOM 0 H LYS A 14 12.028 9.243 -0.867 1.00 0.00 H new ATOM 0 HA LYS A 14 12.625 11.965 -0.371 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.711 10.001 1.214 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.238 9.567 0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 14 14.921 12.065 0.925 1.00 0.00 H new ATOM 0 HG3 LYS A 14 13.553 12.091 2.019 1.00 0.00 H new ATOM 0 HD2 LYS A 14 14.660 9.818 2.924 1.00 0.00 H new ATOM 0 HD3 LYS A 14 16.110 10.498 2.213 1.00 0.00 H new ATOM 0 HE2 LYS A 14 15.505 12.681 3.519 1.00 0.00 H new ATOM 0 HE3 LYS A 14 14.382 11.682 4.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 16.520 11.805 5.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 16.212 10.211 5.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 17.300 11.179 4.145 1.00 0.00 H new ATOM 247 N SER A 15 14.334 10.588 -2.669 1.00 0.00 N ATOM 248 CA SER A 15 15.374 10.794 -3.663 1.00 0.00 C ATOM 249 C SER A 15 14.791 11.494 -4.893 1.00 0.00 C ATOM 250 O SER A 15 15.529 11.903 -5.787 1.00 0.00 O ATOM 251 CB SER A 15 16.022 9.468 -4.065 1.00 0.00 C ATOM 252 OG SER A 15 17.394 9.630 -4.417 1.00 0.00 O ATOM 0 H SER A 15 13.699 9.815 -2.870 1.00 0.00 H new ATOM 0 HA SER A 15 16.146 11.426 -3.224 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.940 8.760 -3.241 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.479 9.040 -4.908 1.00 0.00 H new ATOM 0 HG SER A 15 17.773 8.761 -4.666 1.00 0.00 H new ATOM 258 N LEU A 16 13.471 11.610 -4.897 1.00 0.00 N ATOM 259 CA LEU A 16 12.780 12.254 -6.002 1.00 0.00 C ATOM 260 C LEU A 16 12.794 13.769 -5.793 1.00 0.00 C ATOM 261 O LEU A 16 13.005 14.244 -4.678 1.00 0.00 O ATOM 262 CB LEU A 16 11.376 11.669 -6.169 1.00 0.00 C ATOM 263 CG LEU A 16 11.290 10.334 -6.913 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.858 9.796 -6.909 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.850 10.460 -8.332 1.00 0.00 C ATOM 0 H LEU A 16 12.862 11.269 -4.153 1.00 0.00 H new ATOM 0 HA LEU A 16 13.297 12.057 -6.941 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.938 11.540 -5.179 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.761 12.397 -6.698 1.00 0.00 H new ATOM 0 HG LEU A 16 11.909 9.608 -6.385 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.824 8.847 -7.444 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.529 9.645 -5.881 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.199 10.512 -7.399 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.777 9.498 -8.839 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.277 11.205 -8.884 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.895 10.767 -8.285 1.00 0.00 H new ATOM 277 N PRO A 17 12.560 14.506 -6.912 1.00 0.00 N ATOM 278 CA PRO A 17 12.544 15.958 -6.863 1.00 0.00 C ATOM 279 C PRO A 17 11.256 16.470 -6.216 1.00 0.00 C ATOM 280 O PRO A 17 10.175 15.942 -6.473 1.00 0.00 O ATOM 281 CB PRO A 17 12.700 16.402 -8.308 1.00 0.00 C ATOM 282 CG PRO A 17 12.331 15.197 -9.157 1.00 0.00 C ATOM 283 CD PRO A 17 12.307 13.978 -8.250 1.00 0.00 C ATOM 0 HA PRO A 17 13.344 16.367 -6.246 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.050 17.249 -8.529 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.722 16.723 -8.510 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.358 15.344 -9.625 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.054 15.061 -9.961 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.345 13.467 -8.299 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.068 13.254 -8.540 1.00 0.00 H new ATOM 291 N LYS A 18 11.413 17.492 -5.387 1.00 0.00 N ATOM 292 CA LYS A 18 10.276 18.081 -4.701 1.00 0.00 C ATOM 293 C LYS A 18 9.073 18.108 -5.646 1.00 0.00 C ATOM 294 O LYS A 18 8.110 17.369 -5.452 1.00 0.00 O ATOM 295 CB LYS A 18 10.645 19.454 -4.135 1.00 0.00 C ATOM 296 CG LYS A 18 11.444 20.270 -5.153 1.00 0.00 C ATOM 297 CD LYS A 18 12.706 20.856 -4.516 1.00 0.00 C ATOM 298 CE LYS A 18 12.725 22.381 -4.641 1.00 0.00 C ATOM 299 NZ LYS A 18 12.536 23.012 -3.316 1.00 0.00 N ATOM 0 H LYS A 18 12.311 17.927 -5.175 1.00 0.00 H new ATOM 0 HA LYS A 18 9.993 17.473 -3.842 1.00 0.00 H new ATOM 0 HB2 LYS A 18 9.739 19.994 -3.862 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.230 19.330 -3.223 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.718 19.637 -5.997 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.824 21.075 -5.547 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.752 20.573 -3.464 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.589 20.437 -4.998 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.672 22.705 -5.073 1.00 0.00 H new ATOM 0 HE3 LYS A 18 11.937 22.706 -5.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 12.551 24.047 -3.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 11.621 22.717 -2.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 13.302 22.716 -2.678 1.00 0.00 H new ATOM 313 N GLU A 19 9.169 18.968 -6.649 1.00 0.00 N ATOM 314 CA GLU A 19 8.101 19.101 -7.625 1.00 0.00 C ATOM 315 C GLU A 19 7.429 17.748 -7.865 1.00 0.00 C ATOM 316 O GLU A 19 6.217 17.678 -8.061 1.00 0.00 O ATOM 317 CB GLU A 19 8.625 19.692 -8.935 1.00 0.00 C ATOM 318 CG GLU A 19 9.754 18.834 -9.511 1.00 0.00 C ATOM 319 CD GLU A 19 9.973 19.140 -10.994 1.00 0.00 C ATOM 320 OE1 GLU A 19 9.059 18.813 -11.782 1.00 0.00 O ATOM 321 OE2 GLU A 19 11.049 19.695 -11.306 1.00 0.00 O ATOM 0 H GLU A 19 9.970 19.580 -6.807 1.00 0.00 H new ATOM 0 HA GLU A 19 7.356 19.789 -7.226 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.812 19.762 -9.657 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.986 20.706 -8.762 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.675 19.019 -8.958 1.00 0.00 H new ATOM 0 HG3 GLU A 19 9.514 17.778 -9.385 1.00 0.00 H new ATOM 328 N LEU A 20 8.246 16.705 -7.842 1.00 0.00 N ATOM 329 CA LEU A 20 7.746 15.357 -8.054 1.00 0.00 C ATOM 330 C LEU A 20 7.237 14.792 -6.727 1.00 0.00 C ATOM 331 O LEU A 20 6.079 14.388 -6.624 1.00 0.00 O ATOM 332 CB LEU A 20 8.814 14.489 -8.723 1.00 0.00 C ATOM 333 CG LEU A 20 8.853 14.533 -10.252 1.00 0.00 C ATOM 334 CD1 LEU A 20 8.959 15.974 -10.756 1.00 0.00 C ATOM 335 CD2 LEU A 20 9.978 13.651 -10.797 1.00 0.00 C ATOM 0 H LEU A 20 9.251 16.766 -7.680 1.00 0.00 H new ATOM 0 HA LEU A 20 6.900 15.368 -8.741 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.790 14.793 -8.346 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.661 13.455 -8.413 1.00 0.00 H new ATOM 0 HG LEU A 20 7.914 14.128 -10.630 1.00 0.00 H new ATOM 0 HD11 LEU A 20 8.985 15.977 -11.846 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.096 16.544 -10.412 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.872 16.428 -10.370 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.984 13.700 -11.886 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.935 14.003 -10.413 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.818 12.620 -10.481 1.00 0.00 H new ATOM 347 N ARG A 21 8.126 14.781 -5.745 1.00 0.00 N ATOM 348 CA ARG A 21 7.780 14.272 -4.428 1.00 0.00 C ATOM 349 C ARG A 21 6.345 14.660 -4.069 1.00 0.00 C ATOM 350 O ARG A 21 5.668 13.939 -3.338 1.00 0.00 O ATOM 351 CB ARG A 21 8.731 14.817 -3.360 1.00 0.00 C ATOM 352 CG ARG A 21 8.175 16.096 -2.732 1.00 0.00 C ATOM 353 CD ARG A 21 8.929 16.450 -1.449 1.00 0.00 C ATOM 354 NE ARG A 21 10.386 16.467 -1.706 1.00 0.00 N ATOM 355 CZ ARG A 21 11.270 17.163 -0.978 1.00 0.00 C ATOM 356 NH1 ARG A 21 10.850 17.903 0.057 1.00 0.00 N ATOM 357 NH2 ARG A 21 12.573 17.120 -1.285 1.00 0.00 N ATOM 0 H ARG A 21 9.085 15.116 -5.834 1.00 0.00 H new ATOM 0 HA ARG A 21 7.869 13.186 -4.458 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.884 14.065 -2.586 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.705 15.020 -3.805 1.00 0.00 H new ATOM 0 HG2 ARG A 21 8.254 16.918 -3.443 1.00 0.00 H new ATOM 0 HG3 ARG A 21 7.116 15.966 -2.511 1.00 0.00 H new ATOM 0 HD2 ARG A 21 8.605 17.424 -1.084 1.00 0.00 H new ATOM 0 HD3 ARG A 21 8.697 15.724 -0.669 1.00 0.00 H new ATOM 0 HE ARG A 21 10.740 15.914 -2.487 1.00 0.00 H new ATOM 0 HH11 ARG A 21 9.858 17.936 0.291 1.00 0.00 H new ATOM 0 HH12 ARG A 21 11.523 18.433 0.611 1.00 0.00 H new ATOM 0 HH21 ARG A 21 12.893 16.557 -2.073 1.00 0.00 H new ATOM 0 HH22 ARG A 21 13.245 17.650 -0.731 1.00 0.00 H new ATOM 371 N SER A 22 5.923 15.799 -4.600 1.00 0.00 N ATOM 372 CA SER A 22 4.580 16.291 -4.344 1.00 0.00 C ATOM 373 C SER A 22 3.612 15.741 -5.394 1.00 0.00 C ATOM 374 O SER A 22 2.517 15.292 -5.060 1.00 0.00 O ATOM 375 CB SER A 22 4.545 17.820 -4.340 1.00 0.00 C ATOM 376 OG SER A 22 3.715 18.333 -3.301 1.00 0.00 O ATOM 0 H SER A 22 6.487 16.395 -5.206 1.00 0.00 H new ATOM 0 HA SER A 22 4.271 15.945 -3.358 1.00 0.00 H new ATOM 0 HB2 SER A 22 5.557 18.205 -4.219 1.00 0.00 H new ATOM 0 HB3 SER A 22 4.181 18.177 -5.304 1.00 0.00 H new ATOM 0 HG SER A 22 4.180 18.255 -2.442 1.00 0.00 H new ATOM 382 N GLN A 23 4.052 15.795 -6.643 1.00 0.00 N ATOM 383 CA GLN A 23 3.238 15.309 -7.745 1.00 0.00 C ATOM 384 C GLN A 23 3.039 13.796 -7.629 1.00 0.00 C ATOM 385 O GLN A 23 1.953 13.286 -7.902 1.00 0.00 O ATOM 386 CB GLN A 23 3.861 15.679 -9.092 1.00 0.00 C ATOM 387 CG GLN A 23 4.781 14.564 -9.595 1.00 0.00 C ATOM 388 CD GLN A 23 5.669 15.061 -10.738 1.00 0.00 C ATOM 389 OE1 GLN A 23 6.115 16.196 -10.764 1.00 0.00 O ATOM 390 NE2 GLN A 23 5.899 14.149 -11.679 1.00 0.00 N ATOM 0 H GLN A 23 4.961 16.168 -6.916 1.00 0.00 H new ATOM 0 HA GLN A 23 2.261 15.790 -7.690 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.073 15.863 -9.823 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.427 16.605 -8.993 1.00 0.00 H new ATOM 0 HG2 GLN A 23 5.404 14.204 -8.776 1.00 0.00 H new ATOM 0 HG3 GLN A 23 4.182 13.719 -9.936 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.494 13.216 -11.595 1.00 0.00 H new ATOM 0 HE22 GLN A 23 6.480 14.382 -12.484 1.00 0.00 H new ATOM 399 N VAL A 24 4.105 13.120 -7.226 1.00 0.00 N ATOM 400 CA VAL A 24 4.061 11.676 -7.071 1.00 0.00 C ATOM 401 C VAL A 24 2.910 11.302 -6.135 1.00 0.00 C ATOM 402 O VAL A 24 2.018 10.545 -6.515 1.00 0.00 O ATOM 403 CB VAL A 24 5.418 11.160 -6.586 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.323 9.698 -6.147 1.00 0.00 C ATOM 405 CG2 VAL A 24 6.490 11.341 -7.662 1.00 0.00 C ATOM 0 H VAL A 24 5.004 13.546 -7.002 1.00 0.00 H new ATOM 0 HA VAL A 24 3.869 11.195 -8.030 1.00 0.00 H new ATOM 0 HB VAL A 24 5.711 11.752 -5.719 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.301 9.356 -5.807 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.604 9.609 -5.333 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.997 9.086 -6.988 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.444 10.966 -7.292 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.205 10.787 -8.556 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.586 12.399 -7.906 1.00 0.00 H new ATOM 415 N LEU A 25 2.968 11.850 -4.930 1.00 0.00 N ATOM 416 CA LEU A 25 1.941 11.584 -3.937 1.00 0.00 C ATOM 417 C LEU A 25 0.566 11.619 -4.609 1.00 0.00 C ATOM 418 O LEU A 25 -0.320 10.841 -4.258 1.00 0.00 O ATOM 419 CB LEU A 25 2.073 12.549 -2.757 1.00 0.00 C ATOM 420 CG LEU A 25 3.259 12.305 -1.821 1.00 0.00 C ATOM 421 CD1 LEU A 25 3.377 13.423 -0.783 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.168 10.924 -1.169 1.00 0.00 C ATOM 0 H LEU A 25 3.710 12.477 -4.619 1.00 0.00 H new ATOM 0 HA LEU A 25 2.067 10.586 -3.518 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.148 13.563 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.156 12.501 -2.170 1.00 0.00 H new ATOM 0 HG LEU A 25 4.172 12.320 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.227 13.225 -0.130 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.523 14.377 -1.290 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.465 13.464 -0.188 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.023 10.776 -0.509 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.247 10.855 -0.591 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.170 10.156 -1.942 1.00 0.00 H new ATOM 434 N LEU A 26 0.432 12.528 -5.563 1.00 0.00 N ATOM 435 CA LEU A 26 -0.819 12.675 -6.287 1.00 0.00 C ATOM 436 C LEU A 26 -1.037 11.447 -7.174 1.00 0.00 C ATOM 437 O LEU A 26 -2.074 10.791 -7.088 1.00 0.00 O ATOM 438 CB LEU A 26 -0.843 13.999 -7.053 1.00 0.00 C ATOM 439 CG LEU A 26 -1.676 15.120 -6.428 1.00 0.00 C ATOM 440 CD1 LEU A 26 -3.127 14.677 -6.226 1.00 0.00 C ATOM 441 CD2 LEU A 26 -1.041 15.616 -5.127 1.00 0.00 C ATOM 0 H LEU A 26 1.170 13.171 -5.852 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.658 12.720 -5.593 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.183 14.352 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.222 13.808 -8.057 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.690 15.962 -7.120 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.698 15.492 -5.780 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -3.564 14.412 -7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.154 13.811 -5.565 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.653 16.412 -4.704 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.976 14.792 -4.417 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.041 15.998 -5.333 1.00 0.00 H new ATOM 453 N GLU A 27 -0.042 11.174 -8.005 1.00 0.00 N ATOM 454 CA GLU A 27 -0.112 10.037 -8.907 1.00 0.00 C ATOM 455 C GLU A 27 -0.534 8.780 -8.145 1.00 0.00 C ATOM 456 O GLU A 27 -1.471 8.091 -8.547 1.00 0.00 O ATOM 457 CB GLU A 27 1.224 9.822 -9.623 1.00 0.00 C ATOM 458 CG GLU A 27 1.744 11.131 -10.218 1.00 0.00 C ATOM 459 CD GLU A 27 1.975 10.995 -11.724 1.00 0.00 C ATOM 460 OE1 GLU A 27 3.038 10.446 -12.088 1.00 0.00 O ATOM 461 OE2 GLU A 27 1.084 11.443 -12.478 1.00 0.00 O ATOM 0 H GLU A 27 0.817 11.720 -8.073 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.865 10.247 -9.667 1.00 0.00 H new ATOM 0 HB2 GLU A 27 1.956 9.421 -8.922 1.00 0.00 H new ATOM 0 HB3 GLU A 27 1.102 9.082 -10.414 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.029 11.931 -10.027 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.676 11.413 -9.728 1.00 0.00 H new ATOM 468 N TYR A 28 0.177 8.519 -7.058 1.00 0.00 N ATOM 469 CA TYR A 28 -0.112 7.356 -6.235 1.00 0.00 C ATOM 470 C TYR A 28 -1.621 7.146 -6.095 1.00 0.00 C ATOM 471 O TYR A 28 -2.134 6.073 -6.410 1.00 0.00 O ATOM 472 CB TYR A 28 0.479 7.657 -4.857 1.00 0.00 C ATOM 473 CG TYR A 28 1.965 7.317 -4.729 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.782 7.364 -5.841 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.489 6.962 -3.503 1.00 0.00 C ATOM 476 CE1 TYR A 28 4.180 7.043 -5.721 1.00 0.00 C ATOM 477 CE2 TYR A 28 3.888 6.641 -3.383 1.00 0.00 C ATOM 478 CZ TYR A 28 4.664 6.698 -4.498 1.00 0.00 C ATOM 479 OH TYR A 28 5.985 6.395 -4.385 1.00 0.00 O ATOM 0 H TYR A 28 0.953 9.093 -6.728 1.00 0.00 H new ATOM 0 HA TYR A 28 0.308 6.455 -6.682 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.339 8.715 -4.636 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.077 7.098 -4.105 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.372 7.642 -6.801 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.850 6.925 -2.633 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.830 7.075 -6.583 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.311 6.361 -2.429 1.00 0.00 H new ATOM 0 HH TYR A 28 6.265 6.496 -3.451 1.00 0.00 H new ATOM 489 N ALA A 29 -2.290 8.187 -5.622 1.00 0.00 N ATOM 490 CA ALA A 29 -3.730 8.130 -5.436 1.00 0.00 C ATOM 491 C ALA A 29 -4.400 7.803 -6.771 1.00 0.00 C ATOM 492 O ALA A 29 -5.392 7.076 -6.811 1.00 0.00 O ATOM 493 CB ALA A 29 -4.222 9.454 -4.846 1.00 0.00 C ATOM 0 H ALA A 29 -1.861 9.075 -5.362 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.995 7.341 -4.732 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.302 9.411 -4.707 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.738 9.626 -3.884 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -3.976 10.269 -5.526 1.00 0.00 H new ATOM 499 N ALA A 30 -3.831 8.355 -7.833 1.00 0.00 N ATOM 500 CA ALA A 30 -4.361 8.130 -9.168 1.00 0.00 C ATOM 501 C ALA A 30 -4.198 6.654 -9.535 1.00 0.00 C ATOM 502 O ALA A 30 -4.949 6.128 -10.355 1.00 0.00 O ATOM 503 CB ALA A 30 -3.658 9.059 -10.159 1.00 0.00 C ATOM 0 H ALA A 30 -3.009 8.957 -7.796 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.425 8.362 -9.203 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.055 8.891 -11.160 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.830 10.096 -9.870 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -2.588 8.853 -10.154 1.00 0.00 H new ATOM 509 N LYS A 31 -3.213 6.027 -8.909 1.00 0.00 N ATOM 510 CA LYS A 31 -2.942 4.622 -9.160 1.00 0.00 C ATOM 511 C LYS A 31 -3.632 3.775 -8.089 1.00 0.00 C ATOM 512 O LYS A 31 -3.129 2.719 -7.708 1.00 0.00 O ATOM 513 CB LYS A 31 -1.435 4.376 -9.261 1.00 0.00 C ATOM 514 CG LYS A 31 -0.857 5.023 -10.521 1.00 0.00 C ATOM 515 CD LYS A 31 -0.059 6.282 -10.175 1.00 0.00 C ATOM 516 CE LYS A 31 1.402 6.141 -10.608 1.00 0.00 C ATOM 517 NZ LYS A 31 1.494 5.981 -12.077 1.00 0.00 N ATOM 0 H LYS A 31 -2.593 6.466 -8.229 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.356 4.321 -10.122 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -0.937 4.780 -8.379 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.238 3.304 -9.275 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.213 4.311 -11.037 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.665 5.277 -11.207 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.506 7.147 -10.666 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.108 6.464 -9.101 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.966 7.020 -10.296 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.853 5.280 -10.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.421 6.319 -12.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.384 4.977 -12.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.742 6.535 -12.534 1.00 0.00 H new ATOM 531 N VAL A 32 -4.774 4.269 -7.634 1.00 0.00 N ATOM 532 CA VAL A 32 -5.539 3.571 -6.615 1.00 0.00 C ATOM 533 C VAL A 32 -6.970 3.362 -7.112 1.00 0.00 C ATOM 534 O VAL A 32 -7.801 4.264 -7.021 1.00 0.00 O ATOM 535 CB VAL A 32 -5.471 4.338 -5.293 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.426 3.736 -4.260 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.039 4.380 -4.756 1.00 0.00 C ATOM 0 H VAL A 32 -5.188 5.145 -7.953 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.114 2.585 -6.426 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.787 5.363 -5.484 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.358 4.300 -3.330 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.447 3.782 -4.638 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.154 2.697 -4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.019 4.931 -3.816 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.683 3.363 -4.588 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.393 4.876 -5.481 1.00 0.00 H new ATOM 547 N PRO A 33 -7.222 2.134 -7.640 1.00 0.00 N ATOM 548 CA PRO A 33 -8.539 1.794 -8.151 1.00 0.00 C ATOM 549 C PRO A 33 -9.523 1.542 -7.007 1.00 0.00 C ATOM 550 O PRO A 33 -9.113 1.279 -5.877 1.00 0.00 O ATOM 551 CB PRO A 33 -8.318 0.570 -9.025 1.00 0.00 C ATOM 552 CG PRO A 33 -6.976 -0.006 -8.604 1.00 0.00 C ATOM 553 CD PRO A 33 -6.262 1.040 -7.763 1.00 0.00 C ATOM 0 HA PRO A 33 -8.988 2.603 -8.727 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.117 -0.159 -8.886 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.313 0.840 -10.081 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.117 -0.924 -8.033 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -6.380 -0.264 -9.479 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.987 0.643 -6.786 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -5.341 1.373 -8.242 1.00 0.00 H new ATOM 561 N PRO A 34 -10.836 1.633 -7.347 1.00 0.00 N ATOM 562 CA PRO A 34 -11.882 1.418 -6.362 1.00 0.00 C ATOM 563 C PRO A 34 -12.034 -0.070 -6.040 1.00 0.00 C ATOM 564 O PRO A 34 -11.685 -0.924 -6.853 1.00 0.00 O ATOM 565 CB PRO A 34 -13.133 2.023 -6.977 1.00 0.00 C ATOM 566 CG PRO A 34 -12.851 2.138 -8.467 1.00 0.00 C ATOM 567 CD PRO A 34 -11.359 1.943 -8.675 1.00 0.00 C ATOM 0 HA PRO A 34 -11.659 1.887 -5.403 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -14.003 1.393 -6.792 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -13.348 3.000 -6.544 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -13.415 1.388 -9.021 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -13.164 3.113 -8.841 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -11.160 1.134 -9.378 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -10.896 2.841 -9.083 1.00 0.00 H new ATOM 575 N PRO A 35 -12.568 -0.342 -4.819 1.00 0.00 N ATOM 576 CA PRO A 35 -12.770 -1.712 -4.379 1.00 0.00 C ATOM 577 C PRO A 35 -13.973 -2.342 -5.084 1.00 0.00 C ATOM 578 O PRO A 35 -14.897 -1.640 -5.491 1.00 0.00 O ATOM 579 CB PRO A 35 -12.947 -1.619 -2.872 1.00 0.00 C ATOM 580 CG PRO A 35 -13.301 -0.169 -2.583 1.00 0.00 C ATOM 581 CD PRO A 35 -12.993 0.644 -3.829 1.00 0.00 C ATOM 0 HA PRO A 35 -11.932 -2.362 -4.629 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.735 -2.289 -2.529 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -12.034 -1.909 -2.353 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.355 -0.079 -2.319 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -12.727 0.202 -1.734 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -13.870 1.194 -4.170 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.210 1.378 -3.639 1.00 0.00 H new ATOM 589 N PRO A 36 -13.920 -3.695 -5.211 1.00 0.00 N ATOM 590 CA PRO A 36 -14.993 -4.429 -5.861 1.00 0.00 C ATOM 591 C PRO A 36 -16.219 -4.527 -4.950 1.00 0.00 C ATOM 592 O PRO A 36 -16.113 -4.345 -3.738 1.00 0.00 O ATOM 593 CB PRO A 36 -14.395 -5.784 -6.200 1.00 0.00 C ATOM 594 CG PRO A 36 -13.164 -5.928 -5.320 1.00 0.00 C ATOM 595 CD PRO A 36 -12.841 -4.560 -4.742 1.00 0.00 C ATOM 0 HA PRO A 36 -15.356 -3.934 -6.761 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -15.109 -6.585 -6.007 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -14.129 -5.841 -7.256 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -13.348 -6.646 -4.521 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -12.322 -6.306 -5.900 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -12.802 -4.589 -3.653 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.870 -4.204 -5.086 1.00 0.00 H new ATOM 603 N PRO A 37 -17.385 -4.823 -5.585 1.00 0.00 N ATOM 604 CA PRO A 37 -18.629 -4.948 -4.846 1.00 0.00 C ATOM 605 C PRO A 37 -18.676 -6.267 -4.071 1.00 0.00 C ATOM 606 O PRO A 37 -18.447 -7.333 -4.640 1.00 0.00 O ATOM 607 CB PRO A 37 -19.723 -4.836 -5.895 1.00 0.00 C ATOM 608 CG PRO A 37 -19.052 -5.118 -7.229 1.00 0.00 C ATOM 609 CD PRO A 37 -17.548 -5.045 -7.019 1.00 0.00 C ATOM 0 HA PRO A 37 -18.745 -4.177 -4.085 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -20.524 -5.550 -5.702 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -20.172 -3.843 -5.886 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -19.338 -6.102 -7.600 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -19.369 -4.391 -7.977 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -17.059 -5.966 -7.335 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.106 -4.234 -7.598 1.00 0.00 H new ATOM 617 N GLY A 38 -18.975 -6.151 -2.786 1.00 0.00 N ATOM 618 CA GLY A 38 -19.056 -7.321 -1.928 1.00 0.00 C ATOM 619 C GLY A 38 -17.958 -7.296 -0.863 1.00 0.00 C ATOM 620 O GLY A 38 -18.204 -7.627 0.296 1.00 0.00 O ATOM 0 H GLY A 38 -19.164 -5.265 -2.318 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -20.033 -7.357 -1.447 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -18.963 -8.225 -2.530 1.00 0.00 H new ATOM 624 N VAL A 39 -16.769 -6.900 -1.293 1.00 0.00 N ATOM 625 CA VAL A 39 -15.632 -6.827 -0.391 1.00 0.00 C ATOM 626 C VAL A 39 -15.987 -5.933 0.798 1.00 0.00 C ATOM 627 O VAL A 39 -16.362 -4.775 0.619 1.00 0.00 O ATOM 628 CB VAL A 39 -14.392 -6.350 -1.149 1.00 0.00 C ATOM 629 CG1 VAL A 39 -13.256 -6.010 -0.183 1.00 0.00 C ATOM 630 CG2 VAL A 39 -13.944 -7.390 -2.178 1.00 0.00 C ATOM 0 H VAL A 39 -16.568 -6.626 -2.255 1.00 0.00 H new ATOM 0 HA VAL A 39 -15.394 -7.814 0.004 1.00 0.00 H new ATOM 0 HB VAL A 39 -14.658 -5.440 -1.687 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.387 -5.674 -0.748 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -13.578 -5.218 0.493 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -12.993 -6.896 0.395 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -13.061 -7.026 -2.703 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -13.705 -8.324 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -14.747 -7.562 -2.895 1.00 0.00 H new ATOM 640 N GLU A 40 -15.856 -6.503 1.987 1.00 0.00 N ATOM 641 CA GLU A 40 -16.158 -5.772 3.206 1.00 0.00 C ATOM 642 C GLU A 40 -14.910 -5.044 3.711 1.00 0.00 C ATOM 643 O GLU A 40 -13.849 -5.649 3.852 1.00 0.00 O ATOM 644 CB GLU A 40 -16.720 -6.705 4.280 1.00 0.00 C ATOM 645 CG GLU A 40 -16.755 -6.013 5.644 1.00 0.00 C ATOM 646 CD GLU A 40 -18.123 -6.180 6.309 1.00 0.00 C ATOM 647 OE1 GLU A 40 -19.060 -5.482 5.863 1.00 0.00 O ATOM 648 OE2 GLU A 40 -18.201 -7.002 7.247 1.00 0.00 O ATOM 0 H GLU A 40 -15.545 -7.463 2.132 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.923 -5.029 2.981 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -17.726 -7.021 4.002 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -16.109 -7.605 4.341 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -15.981 -6.430 6.287 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -16.532 -4.953 5.524 1.00 0.00 H new ATOM 655 N LEU A 41 -15.080 -3.756 3.969 1.00 0.00 N ATOM 656 CA LEU A 41 -13.981 -2.939 4.455 1.00 0.00 C ATOM 657 C LEU A 41 -14.309 -2.437 5.862 1.00 0.00 C ATOM 658 O LEU A 41 -15.474 -2.227 6.195 1.00 0.00 O ATOM 659 CB LEU A 41 -13.665 -1.819 3.461 1.00 0.00 C ATOM 660 CG LEU A 41 -13.215 -2.266 2.068 1.00 0.00 C ATOM 661 CD1 LEU A 41 -14.301 -1.991 1.026 1.00 0.00 C ATOM 662 CD2 LEU A 41 -11.880 -1.620 1.690 1.00 0.00 C ATOM 0 H LEU A 41 -15.962 -3.258 3.851 1.00 0.00 H new ATOM 0 HA LEU A 41 -13.070 -3.532 4.531 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.553 -1.196 3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.884 -1.190 3.889 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.056 -3.344 2.090 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.955 -2.318 0.045 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -15.207 -2.536 1.292 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.516 -0.923 0.997 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.583 -1.954 0.696 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.987 -0.535 1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.118 -1.910 2.413 1.00 0.00 H new ATOM 674 N GLU A 42 -13.259 -2.259 6.652 1.00 0.00 N ATOM 675 CA GLU A 42 -13.421 -1.785 8.016 1.00 0.00 C ATOM 676 C GLU A 42 -13.163 -0.279 8.089 1.00 0.00 C ATOM 677 O GLU A 42 -12.234 0.227 7.461 1.00 0.00 O ATOM 678 CB GLU A 42 -12.500 -2.546 8.973 1.00 0.00 C ATOM 679 CG GLU A 42 -13.142 -2.688 10.354 1.00 0.00 C ATOM 680 CD GLU A 42 -13.028 -4.125 10.867 1.00 0.00 C ATOM 681 OE1 GLU A 42 -13.460 -5.030 10.120 1.00 0.00 O ATOM 682 OE2 GLU A 42 -12.511 -4.287 11.993 1.00 0.00 O ATOM 0 H GLU A 42 -12.294 -2.435 6.373 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.449 -1.973 8.326 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.282 -3.533 8.566 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -11.549 -2.021 9.062 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -12.658 -2.008 11.055 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -14.192 -2.399 10.302 1.00 0.00 H new ATOM 689 N ARG A 43 -14.002 0.396 8.861 1.00 0.00 N ATOM 690 CA ARG A 43 -13.877 1.834 9.024 1.00 0.00 C ATOM 691 C ARG A 43 -12.692 2.164 9.934 1.00 0.00 C ATOM 692 O ARG A 43 -12.514 1.540 10.979 1.00 0.00 O ATOM 693 CB ARG A 43 -15.152 2.434 9.621 1.00 0.00 C ATOM 694 CG ARG A 43 -14.893 3.839 10.167 1.00 0.00 C ATOM 695 CD ARG A 43 -16.032 4.791 9.794 1.00 0.00 C ATOM 696 NE ARG A 43 -17.212 4.525 10.647 1.00 0.00 N ATOM 697 CZ ARG A 43 -18.336 5.255 10.622 1.00 0.00 C ATOM 698 NH1 ARG A 43 -18.439 6.299 9.788 1.00 0.00 N ATOM 699 NH2 ARG A 43 -19.357 4.940 11.431 1.00 0.00 N ATOM 0 H ARG A 43 -14.771 -0.027 9.381 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.713 2.266 8.037 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.931 2.474 8.859 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.521 1.791 10.421 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -14.789 3.798 11.251 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.952 4.219 9.770 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.709 5.825 9.918 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -16.295 4.663 8.744 1.00 0.00 H new ATOM 0 HE ARG A 43 -17.167 3.738 11.294 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -17.662 6.538 9.172 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -19.294 6.854 9.769 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -19.279 4.145 12.065 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -20.212 5.495 11.412 1.00 0.00 H new ATOM 713 N VAL A 44 -11.911 3.144 9.503 1.00 0.00 N ATOM 714 CA VAL A 44 -10.748 3.564 10.265 1.00 0.00 C ATOM 715 C VAL A 44 -11.127 4.751 11.153 1.00 0.00 C ATOM 716 O VAL A 44 -11.038 5.902 10.729 1.00 0.00 O ATOM 717 CB VAL A 44 -9.585 3.873 9.319 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.360 4.358 10.096 1.00 0.00 C ATOM 719 CG2 VAL A 44 -9.242 2.656 8.458 1.00 0.00 C ATOM 0 H VAL A 44 -12.061 3.659 8.636 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.411 2.761 10.921 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.899 4.677 8.653 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.548 4.570 9.400 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.613 5.265 10.646 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.044 3.585 10.797 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.413 2.902 7.795 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.958 1.824 9.102 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -10.111 2.374 7.863 1.00 0.00 H new ATOM 729 N HIS A 45 -11.542 4.430 12.370 1.00 0.00 N ATOM 730 CA HIS A 45 -11.935 5.455 13.322 1.00 0.00 C ATOM 731 C HIS A 45 -10.788 6.450 13.507 1.00 0.00 C ATOM 732 O HIS A 45 -10.993 7.661 13.430 1.00 0.00 O ATOM 733 CB HIS A 45 -12.393 4.827 14.639 1.00 0.00 C ATOM 734 CG HIS A 45 -13.753 4.174 14.568 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.773 4.652 13.765 1.00 0.00 N ATOM 736 CD2 HIS A 45 -14.248 3.075 15.207 1.00 0.00 C ATOM 737 CE1 HIS A 45 -15.831 3.870 13.922 1.00 0.00 C ATOM 738 NE2 HIS A 45 -15.504 2.893 14.816 1.00 0.00 N ATOM 0 H HIS A 45 -11.615 3.474 12.719 1.00 0.00 H new ATOM 0 HA HIS A 45 -12.791 6.008 12.934 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -11.660 4.083 14.949 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -12.411 5.597 15.410 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -13.710 2.458 15.911 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -16.785 3.986 13.429 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -16.122 2.146 15.132 1.00 0.00 H new ATOM 746 N GLU A 46 -9.605 5.903 13.747 1.00 0.00 N ATOM 747 CA GLU A 46 -8.425 6.728 13.943 1.00 0.00 C ATOM 748 C GLU A 46 -8.429 7.903 12.964 1.00 0.00 C ATOM 749 O GLU A 46 -7.994 9.002 13.305 1.00 0.00 O ATOM 750 CB GLU A 46 -7.147 5.899 13.799 1.00 0.00 C ATOM 751 CG GLU A 46 -6.201 6.142 14.977 1.00 0.00 C ATOM 752 CD GLU A 46 -5.538 4.837 15.426 1.00 0.00 C ATOM 753 OE1 GLU A 46 -6.218 4.075 16.147 1.00 0.00 O ATOM 754 OE2 GLU A 46 -4.368 4.632 15.038 1.00 0.00 O ATOM 0 H GLU A 46 -9.439 4.899 13.810 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.449 7.126 14.957 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.400 4.840 13.744 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.645 6.156 12.866 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.436 6.863 14.691 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.754 6.578 15.809 1.00 0.00 H new ATOM 761 N CYS A 47 -8.926 7.632 11.766 1.00 0.00 N ATOM 762 CA CYS A 47 -8.993 8.653 10.735 1.00 0.00 C ATOM 763 C CYS A 47 -10.339 9.372 10.857 1.00 0.00 C ATOM 764 O CYS A 47 -11.350 8.752 11.182 1.00 0.00 O ATOM 765 CB CYS A 47 -8.787 8.062 9.339 1.00 0.00 C ATOM 766 SG CYS A 47 -8.560 9.406 8.117 1.00 0.00 S ATOM 0 H CYS A 47 -9.286 6.720 11.487 1.00 0.00 H new ATOM 0 HA CYS A 47 -8.185 9.370 10.877 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -7.916 7.407 9.337 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.646 7.450 9.064 1.00 0.00 H new ATOM 0 HG CYS A 47 -9.657 9.565 7.438 1.00 0.00 H new ATOM 772 N GLN A 48 -10.307 10.669 10.589 1.00 0.00 N ATOM 773 CA GLN A 48 -11.511 11.479 10.665 1.00 0.00 C ATOM 774 C GLN A 48 -12.515 11.038 9.599 1.00 0.00 C ATOM 775 O GLN A 48 -13.636 10.646 9.921 1.00 0.00 O ATOM 776 CB GLN A 48 -11.181 12.966 10.526 1.00 0.00 C ATOM 777 CG GLN A 48 -10.152 13.400 11.572 1.00 0.00 C ATOM 778 CD GLN A 48 -10.743 14.443 12.523 1.00 0.00 C ATOM 779 OE1 GLN A 48 -11.467 14.132 13.454 1.00 0.00 O ATOM 780 NE2 GLN A 48 -10.394 15.694 12.237 1.00 0.00 N ATOM 0 H GLN A 48 -9.466 11.179 10.319 1.00 0.00 H new ATOM 0 HA GLN A 48 -11.964 11.331 11.646 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -10.794 13.164 9.526 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -12.091 13.556 10.639 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.818 12.532 12.141 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.274 13.812 11.075 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -9.784 15.884 11.442 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -10.736 16.463 12.813 1.00 0.00 H new ATOM 789 N THR A 49 -12.077 11.116 8.351 1.00 0.00 N ATOM 790 CA THR A 49 -12.924 10.730 7.235 1.00 0.00 C ATOM 791 C THR A 49 -13.216 9.229 7.281 1.00 0.00 C ATOM 792 O THR A 49 -12.500 8.474 7.937 1.00 0.00 O ATOM 793 CB THR A 49 -12.236 11.176 5.943 1.00 0.00 C ATOM 794 OG1 THR A 49 -11.049 10.389 5.893 1.00 0.00 O ATOM 795 CG2 THR A 49 -11.726 12.616 6.018 1.00 0.00 C ATOM 0 H THR A 49 -11.147 11.441 8.088 1.00 0.00 H new ATOM 0 HA THR A 49 -13.896 11.220 7.289 1.00 0.00 H new ATOM 0 HB THR A 49 -12.932 11.081 5.110 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.542 10.613 5.085 1.00 0.00 H new ATOM 0 HG21 THR A 49 -11.247 12.882 5.076 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.563 13.289 6.202 1.00 0.00 H new ATOM 0 HG23 THR A 49 -11.004 12.705 6.830 1.00 0.00 H new ATOM 803 N PRO A 50 -14.297 8.831 6.559 1.00 0.00 N ATOM 804 CA PRO A 50 -14.692 7.433 6.511 1.00 0.00 C ATOM 805 C PRO A 50 -13.751 6.628 5.613 1.00 0.00 C ATOM 806 O PRO A 50 -14.113 6.267 4.494 1.00 0.00 O ATOM 807 CB PRO A 50 -16.126 7.447 6.008 1.00 0.00 C ATOM 808 CG PRO A 50 -16.326 8.804 5.354 1.00 0.00 C ATOM 809 CD PRO A 50 -15.168 9.697 5.770 1.00 0.00 C ATOM 0 HA PRO A 50 -14.630 6.944 7.483 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -16.297 6.641 5.295 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -16.829 7.302 6.828 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -16.360 8.704 4.269 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -17.275 9.241 5.664 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -14.646 10.099 4.902 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -15.515 10.549 6.355 1.00 0.00 H new ATOM 817 N PHE A 51 -12.562 6.369 6.137 1.00 0.00 N ATOM 818 CA PHE A 51 -11.567 5.612 5.396 1.00 0.00 C ATOM 819 C PHE A 51 -11.713 4.112 5.656 1.00 0.00 C ATOM 820 O PHE A 51 -11.370 3.628 6.734 1.00 0.00 O ATOM 821 CB PHE A 51 -10.195 6.072 5.893 1.00 0.00 C ATOM 822 CG PHE A 51 -9.019 5.474 5.118 1.00 0.00 C ATOM 823 CD1 PHE A 51 -9.165 5.150 3.805 1.00 0.00 C ATOM 824 CD2 PHE A 51 -7.829 5.266 5.741 1.00 0.00 C ATOM 825 CE1 PHE A 51 -8.074 4.595 3.085 1.00 0.00 C ATOM 826 CE2 PHE A 51 -6.738 4.711 5.021 1.00 0.00 C ATOM 827 CZ PHE A 51 -6.884 4.387 3.708 1.00 0.00 C ATOM 0 H PHE A 51 -12.265 6.670 7.065 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.691 5.782 4.326 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -10.143 7.159 5.830 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.094 5.808 6.946 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -10.111 5.315 3.310 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.713 5.523 6.784 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.190 4.338 2.042 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.792 4.546 5.516 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.054 3.965 3.161 1.00 0.00 H new ATOM 837 N PHE A 52 -12.224 3.417 4.650 1.00 0.00 N ATOM 838 CA PHE A 52 -12.420 1.981 4.756 1.00 0.00 C ATOM 839 C PHE A 52 -11.346 1.221 3.975 1.00 0.00 C ATOM 840 O PHE A 52 -11.040 1.569 2.836 1.00 0.00 O ATOM 841 CB PHE A 52 -13.790 1.671 4.150 1.00 0.00 C ATOM 842 CG PHE A 52 -14.900 2.623 4.600 1.00 0.00 C ATOM 843 CD1 PHE A 52 -15.399 2.537 5.863 1.00 0.00 C ATOM 844 CD2 PHE A 52 -15.388 3.555 3.738 1.00 0.00 C ATOM 845 CE1 PHE A 52 -16.429 3.421 6.281 1.00 0.00 C ATOM 846 CE2 PHE A 52 -16.418 4.439 4.156 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.916 4.353 5.419 1.00 0.00 C ATOM 0 H PHE A 52 -12.508 3.822 3.758 1.00 0.00 H new ATOM 0 HA PHE A 52 -12.357 1.673 5.800 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -13.712 1.708 3.063 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -14.071 0.652 4.415 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -15.012 1.797 6.547 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -14.992 3.623 2.735 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -16.825 3.353 7.283 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -16.806 5.179 3.472 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.699 5.026 5.737 1.00 0.00 H new ATOM 857 N VAL A 53 -10.803 0.199 4.619 1.00 0.00 N ATOM 858 CA VAL A 53 -9.770 -0.613 3.999 1.00 0.00 C ATOM 859 C VAL A 53 -10.011 -2.085 4.340 1.00 0.00 C ATOM 860 O VAL A 53 -10.742 -2.397 5.278 1.00 0.00 O ATOM 861 CB VAL A 53 -8.388 -0.118 4.429 1.00 0.00 C ATOM 862 CG1 VAL A 53 -8.221 1.373 4.129 1.00 0.00 C ATOM 863 CG2 VAL A 53 -8.136 -0.411 5.909 1.00 0.00 C ATOM 0 H VAL A 53 -11.059 -0.086 5.564 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.811 -0.520 2.914 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.643 -0.662 3.849 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.230 1.699 4.445 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.335 1.544 3.059 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.979 1.940 4.670 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.147 -0.049 6.188 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.891 0.093 6.513 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.191 -1.486 6.082 1.00 0.00 H new ATOM 873 N HIS A 54 -9.381 -2.951 3.559 1.00 0.00 N ATOM 874 CA HIS A 54 -9.518 -4.382 3.766 1.00 0.00 C ATOM 875 C HIS A 54 -8.227 -5.087 3.344 1.00 0.00 C ATOM 876 O HIS A 54 -7.727 -4.868 2.242 1.00 0.00 O ATOM 877 CB HIS A 54 -10.752 -4.921 3.040 1.00 0.00 C ATOM 878 CG HIS A 54 -10.883 -6.425 3.084 1.00 0.00 C ATOM 879 ND1 HIS A 54 -11.372 -7.102 4.188 1.00 0.00 N ATOM 880 CD2 HIS A 54 -10.585 -7.374 2.151 1.00 0.00 C ATOM 881 CE1 HIS A 54 -11.363 -8.400 3.919 1.00 0.00 C ATOM 882 NE2 HIS A 54 -10.875 -8.566 2.657 1.00 0.00 N ATOM 0 H HIS A 54 -8.775 -2.689 2.782 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.674 -4.586 4.825 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.644 -4.476 3.481 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -10.717 -4.600 1.999 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -10.181 -7.187 1.167 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -11.686 -9.188 4.583 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -10.753 -9.459 2.180 1.00 0.00 H new ATOM 890 N ALA A 55 -7.725 -5.920 4.244 1.00 0.00 N ATOM 891 CA ALA A 55 -6.502 -6.659 3.979 1.00 0.00 C ATOM 892 C ALA A 55 -6.802 -8.159 4.001 1.00 0.00 C ATOM 893 O ALA A 55 -7.563 -8.631 4.844 1.00 0.00 O ATOM 894 CB ALA A 55 -5.434 -6.263 5.001 1.00 0.00 C ATOM 0 H ALA A 55 -8.143 -6.099 5.157 1.00 0.00 H new ATOM 0 HA ALA A 55 -6.113 -6.415 2.990 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.517 -6.817 4.802 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.236 -5.194 4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.788 -6.495 6.005 1.00 0.00 H new ATOM 900 N ASP A 56 -6.188 -8.867 3.064 1.00 0.00 N ATOM 901 CA ASP A 56 -6.381 -10.304 2.965 1.00 0.00 C ATOM 902 C ASP A 56 -5.299 -10.898 2.061 1.00 0.00 C ATOM 903 O ASP A 56 -4.597 -10.166 1.364 1.00 0.00 O ATOM 904 CB ASP A 56 -7.743 -10.636 2.353 1.00 0.00 C ATOM 905 CG ASP A 56 -8.874 -10.838 3.364 1.00 0.00 C ATOM 906 OD1 ASP A 56 -8.560 -10.842 4.574 1.00 0.00 O ATOM 907 OD2 ASP A 56 -10.027 -10.985 2.904 1.00 0.00 O ATOM 0 H ASP A 56 -5.557 -8.472 2.367 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.326 -10.722 3.970 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.024 -9.833 1.672 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.645 -11.542 1.755 1.00 0.00 H new ATOM 912 N VAL A 57 -5.198 -12.218 2.102 1.00 0.00 N ATOM 913 CA VAL A 57 -4.213 -12.919 1.295 1.00 0.00 C ATOM 914 C VAL A 57 -4.867 -14.140 0.646 1.00 0.00 C ATOM 915 O VAL A 57 -5.509 -14.940 1.326 1.00 0.00 O ATOM 916 CB VAL A 57 -2.995 -13.276 2.150 1.00 0.00 C ATOM 917 CG1 VAL A 57 -3.419 -13.704 3.556 1.00 0.00 C ATOM 918 CG2 VAL A 57 -2.153 -14.362 1.476 1.00 0.00 C ATOM 0 H VAL A 57 -5.782 -12.821 2.681 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.852 -12.278 0.490 1.00 0.00 H new ATOM 0 HB VAL A 57 -2.377 -12.383 2.244 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.535 -13.952 4.143 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.957 -12.888 4.038 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -4.068 -14.577 3.490 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.294 -14.598 2.103 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.758 -15.258 1.338 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -1.807 -14.005 0.506 1.00 0.00 H new ATOM 928 N GLU A 58 -4.683 -14.245 -0.662 1.00 0.00 N ATOM 929 CA GLU A 58 -5.248 -15.355 -1.410 1.00 0.00 C ATOM 930 C GLU A 58 -4.151 -16.079 -2.195 1.00 0.00 C ATOM 931 O GLU A 58 -3.728 -15.612 -3.251 1.00 0.00 O ATOM 932 CB GLU A 58 -6.364 -14.878 -2.341 1.00 0.00 C ATOM 933 CG GLU A 58 -7.720 -15.430 -1.898 1.00 0.00 C ATOM 934 CD GLU A 58 -7.834 -16.923 -2.214 1.00 0.00 C ATOM 935 OE1 GLU A 58 -7.767 -17.256 -3.417 1.00 0.00 O ATOM 936 OE2 GLU A 58 -7.985 -17.698 -1.244 1.00 0.00 O ATOM 0 H GLU A 58 -4.151 -13.580 -1.223 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.687 -16.059 -0.702 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.396 -13.788 -2.348 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.153 -15.198 -3.361 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.850 -15.270 -0.828 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.520 -14.886 -2.401 1.00 0.00 H new ATOM 943 N GLY A 59 -3.722 -17.207 -1.648 1.00 0.00 N ATOM 944 CA GLY A 59 -2.683 -17.999 -2.283 1.00 0.00 C ATOM 945 C GLY A 59 -1.320 -17.728 -1.645 1.00 0.00 C ATOM 946 O GLY A 59 -0.865 -18.494 -0.796 1.00 0.00 O ATOM 0 H GLY A 59 -4.075 -17.591 -0.772 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -2.925 -19.058 -2.197 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.643 -17.767 -3.347 1.00 0.00 H new ATOM 950 N GLY A 60 -0.705 -16.637 -2.077 1.00 0.00 N ATOM 951 CA GLY A 60 0.597 -16.256 -1.559 1.00 0.00 C ATOM 952 C GLY A 60 0.827 -14.751 -1.707 1.00 0.00 C ATOM 953 O GLY A 60 1.968 -14.290 -1.705 1.00 0.00 O ATOM 0 H GLY A 60 -1.085 -16.004 -2.781 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.671 -16.537 -0.508 1.00 0.00 H new ATOM 0 HA3 GLY A 60 1.377 -16.801 -2.090 1.00 0.00 H new ATOM 957 N LYS A 61 -0.274 -14.025 -1.833 1.00 0.00 N ATOM 958 CA LYS A 61 -0.207 -12.582 -1.982 1.00 0.00 C ATOM 959 C LYS A 61 -1.320 -11.935 -1.155 1.00 0.00 C ATOM 960 O LYS A 61 -2.372 -12.537 -0.945 1.00 0.00 O ATOM 961 CB LYS A 61 -0.236 -12.194 -3.462 1.00 0.00 C ATOM 962 CG LYS A 61 1.111 -12.478 -4.130 1.00 0.00 C ATOM 963 CD LYS A 61 1.137 -11.940 -5.562 1.00 0.00 C ATOM 964 CE LYS A 61 2.027 -12.805 -6.456 1.00 0.00 C ATOM 965 NZ LYS A 61 3.215 -12.042 -6.898 1.00 0.00 N ATOM 0 H LYS A 61 -1.219 -14.410 -1.835 1.00 0.00 H new ATOM 0 HA LYS A 61 0.739 -12.203 -1.595 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.023 -12.750 -3.972 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.478 -11.136 -3.559 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.912 -12.019 -3.551 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.298 -13.552 -4.138 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.124 -11.917 -5.964 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.503 -10.913 -5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.341 -13.696 -5.913 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.461 -13.144 -7.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.808 -12.644 -7.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.910 -11.205 -7.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.763 -11.740 -6.067 1.00 0.00 H new ATOM 979 N VAL A 62 -1.050 -10.717 -0.708 1.00 0.00 N ATOM 980 CA VAL A 62 -2.016 -9.983 0.091 1.00 0.00 C ATOM 981 C VAL A 62 -2.770 -8.999 -0.805 1.00 0.00 C ATOM 982 O VAL A 62 -2.156 -8.212 -1.524 1.00 0.00 O ATOM 983 CB VAL A 62 -1.312 -9.302 1.267 1.00 0.00 C ATOM 984 CG1 VAL A 62 -0.145 -10.152 1.774 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.841 -7.897 0.885 1.00 0.00 C ATOM 0 H VAL A 62 -0.177 -10.221 -0.884 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.753 -10.663 0.519 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.033 -9.205 2.078 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.338 -9.645 2.610 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.518 -11.122 2.104 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.577 -10.295 0.970 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.344 -7.435 1.738 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.143 -7.962 0.050 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.700 -7.292 0.594 1.00 0.00 H new ATOM 995 N ARG A 63 -4.091 -9.075 -0.733 1.00 0.00 N ATOM 996 CA ARG A 63 -4.936 -8.200 -1.529 1.00 0.00 C ATOM 997 C ARG A 63 -5.273 -6.931 -0.745 1.00 0.00 C ATOM 998 O ARG A 63 -5.770 -7.004 0.378 1.00 0.00 O ATOM 999 CB ARG A 63 -6.233 -8.904 -1.930 1.00 0.00 C ATOM 1000 CG ARG A 63 -5.959 -10.035 -2.924 1.00 0.00 C ATOM 1001 CD ARG A 63 -5.467 -9.481 -4.262 1.00 0.00 C ATOM 1002 NE ARG A 63 -6.528 -9.612 -5.286 1.00 0.00 N ATOM 1003 CZ ARG A 63 -6.438 -9.120 -6.529 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -5.335 -8.461 -6.910 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -7.450 -9.286 -7.390 1.00 0.00 N ATOM 0 H ARG A 63 -4.597 -9.729 -0.136 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.385 -7.937 -2.432 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.722 -9.306 -1.043 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.920 -8.183 -2.374 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.213 -10.714 -2.511 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.868 -10.616 -3.079 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.186 -8.434 -4.150 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.574 -10.018 -4.581 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.381 -10.108 -5.029 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.564 -8.334 -6.254 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.266 -8.086 -7.856 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.290 -9.787 -7.100 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.381 -8.911 -8.336 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.991 -5.796 -1.368 1.00 0.00 N ATOM 1020 CA LEU A 64 -5.258 -4.512 -0.742 1.00 0.00 C ATOM 1021 C LEU A 64 -6.570 -3.946 -1.290 1.00 0.00 C ATOM 1022 O LEU A 64 -6.927 -4.198 -2.440 1.00 0.00 O ATOM 1023 CB LEU A 64 -4.063 -3.572 -0.916 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.723 -4.086 -0.385 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -2.323 -5.390 -1.077 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -1.638 -3.014 -0.509 1.00 0.00 C ATOM 0 H LEU A 64 -4.580 -5.739 -2.300 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.386 -4.632 0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.950 -3.352 -1.978 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -4.291 -2.630 -0.418 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.837 -4.308 0.676 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -1.367 -5.734 -0.681 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.085 -6.148 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.231 -5.219 -2.150 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.695 -3.404 -0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.517 -2.739 -1.557 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.928 -2.135 0.066 1.00 0.00 H new ATOM 1038 N TYR A 65 -7.253 -3.193 -0.441 1.00 0.00 N ATOM 1039 CA TYR A 65 -8.517 -2.589 -0.825 1.00 0.00 C ATOM 1040 C TYR A 65 -8.774 -1.304 -0.035 1.00 0.00 C ATOM 1041 O TYR A 65 -8.761 -1.314 1.195 1.00 0.00 O ATOM 1042 CB TYR A 65 -9.598 -3.614 -0.474 1.00 0.00 C ATOM 1043 CG TYR A 65 -9.518 -4.906 -1.290 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -9.991 -4.934 -2.586 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -8.973 -6.044 -0.730 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -9.917 -6.149 -3.354 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -8.899 -7.259 -1.498 1.00 0.00 C ATOM 1048 CZ TYR A 65 -9.374 -7.252 -2.773 1.00 0.00 C ATOM 1049 OH TYR A 65 -9.304 -8.400 -3.498 1.00 0.00 O ATOM 0 H TYR A 65 -6.955 -2.987 0.512 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.513 -2.331 -1.884 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.521 -3.860 0.585 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.577 -3.160 -0.626 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -10.417 -4.044 -3.024 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.602 -6.023 0.284 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -10.284 -6.184 -4.369 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.476 -8.156 -1.072 1.00 0.00 H new ATOM 0 HH TYR A 65 -8.892 -9.105 -2.956 1.00 0.00 H new ATOM 1059 N PHE A 66 -9.003 -0.229 -0.774 1.00 0.00 N ATOM 1060 CA PHE A 66 -9.263 1.061 -0.158 1.00 0.00 C ATOM 1061 C PHE A 66 -10.516 1.709 -0.750 1.00 0.00 C ATOM 1062 O PHE A 66 -10.861 1.461 -1.905 1.00 0.00 O ATOM 1063 CB PHE A 66 -8.054 1.951 -0.456 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.751 1.463 0.179 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -6.456 1.792 1.466 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -5.887 0.699 -0.542 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -5.247 1.339 2.055 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -4.677 0.246 0.048 1.00 0.00 C ATOM 1069 CZ PHE A 66 -4.383 0.575 1.334 1.00 0.00 C ATOM 0 H PHE A 66 -9.014 -0.225 -1.794 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.423 0.936 0.913 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.919 2.013 -1.536 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -8.263 2.961 -0.102 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -7.142 2.398 2.039 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -6.121 0.437 -1.563 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -5.013 1.601 3.076 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -3.991 -0.360 -0.525 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.463 0.230 1.783 1.00 0.00 H new ATOM 1079 N HIS A 67 -11.164 2.526 0.067 1.00 0.00 N ATOM 1080 CA HIS A 67 -12.371 3.212 -0.361 1.00 0.00 C ATOM 1081 C HIS A 67 -12.369 4.643 0.180 1.00 0.00 C ATOM 1082 O HIS A 67 -12.420 4.852 1.391 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.617 2.424 0.049 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.916 3.147 -0.219 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -15.255 4.336 0.402 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -15.953 2.836 -1.049 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -16.445 4.714 -0.040 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.877 3.783 -0.939 1.00 0.00 N ATOM 0 H HIS A 67 -10.876 2.728 1.024 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.392 3.273 -1.449 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.625 1.473 -0.484 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.554 2.192 1.112 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -16.012 1.967 -1.687 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.980 5.603 0.259 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -17.763 3.810 -1.443 1.00 0.00 H new ATOM 1096 N VAL A 68 -12.308 5.590 -0.744 1.00 0.00 N ATOM 1097 CA VAL A 68 -12.298 6.996 -0.374 1.00 0.00 C ATOM 1098 C VAL A 68 -13.477 7.703 -1.046 1.00 0.00 C ATOM 1099 O VAL A 68 -13.479 7.897 -2.260 1.00 0.00 O ATOM 1100 CB VAL A 68 -10.946 7.620 -0.727 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -10.730 8.927 0.038 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -9.804 6.636 -0.467 1.00 0.00 C ATOM 0 H VAL A 68 -12.265 5.412 -1.747 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.422 7.109 0.703 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.951 7.852 -1.792 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.762 9.350 -0.231 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -11.519 9.634 -0.219 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.755 8.730 1.110 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.854 7.104 -0.726 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.796 6.358 0.587 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.947 5.744 -1.076 1.00 0.00 H new ATOM 1112 N PRO A 69 -14.476 8.079 -0.204 1.00 0.00 N ATOM 1113 CA PRO A 69 -15.658 8.761 -0.703 1.00 0.00 C ATOM 1114 C PRO A 69 -15.347 10.221 -1.041 1.00 0.00 C ATOM 1115 O PRO A 69 -15.333 10.601 -2.211 1.00 0.00 O ATOM 1116 CB PRO A 69 -16.693 8.615 0.401 1.00 0.00 C ATOM 1117 CG PRO A 69 -15.914 8.266 1.659 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.508 7.866 1.240 1.00 0.00 C ATOM 0 HA PRO A 69 -16.027 8.334 -1.636 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -17.256 9.539 0.534 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -17.415 7.835 0.159 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -15.882 9.119 2.337 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -16.399 7.450 2.195 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -13.757 8.472 1.746 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -14.301 6.826 1.491 1.00 0.00 H new ATOM 1126 N ASP A 70 -15.106 10.999 0.004 1.00 0.00 N ATOM 1127 CA ASP A 70 -14.797 12.408 -0.168 1.00 0.00 C ATOM 1128 C ASP A 70 -13.810 12.571 -1.326 1.00 0.00 C ATOM 1129 O ASP A 70 -13.822 13.588 -2.018 1.00 0.00 O ATOM 1130 CB ASP A 70 -14.149 12.987 1.091 1.00 0.00 C ATOM 1131 CG ASP A 70 -15.119 13.648 2.072 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -15.449 14.830 1.835 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -15.510 12.956 3.037 1.00 0.00 O ATOM 0 H ASP A 70 -15.119 10.680 0.973 1.00 0.00 H new ATOM 0 HA ASP A 70 -15.729 12.936 -0.369 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -13.620 12.187 1.610 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.402 13.722 0.792 1.00 0.00 H new ATOM 1138 N GLU A 71 -12.978 11.555 -1.500 1.00 0.00 N ATOM 1139 CA GLU A 71 -11.986 11.573 -2.562 1.00 0.00 C ATOM 1140 C GLU A 71 -10.911 12.620 -2.265 1.00 0.00 C ATOM 1141 O GLU A 71 -10.671 13.515 -3.074 1.00 0.00 O ATOM 1142 CB GLU A 71 -12.642 11.829 -3.920 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.760 10.534 -4.725 1.00 0.00 C ATOM 1144 CD GLU A 71 -12.737 10.818 -6.228 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -13.712 11.441 -6.703 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -11.746 10.406 -6.869 1.00 0.00 O ATOM 0 H GLU A 71 -12.970 10.714 -0.923 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.509 10.594 -2.605 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.632 12.262 -3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.055 12.557 -4.480 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.940 9.864 -4.465 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.685 10.022 -4.462 1.00 0.00 H new ATOM 1153 N ALA A 72 -10.291 12.473 -1.103 1.00 0.00 N ATOM 1154 CA ALA A 72 -9.247 13.395 -0.690 1.00 0.00 C ATOM 1155 C ALA A 72 -7.918 12.966 -1.316 1.00 0.00 C ATOM 1156 O ALA A 72 -7.530 11.803 -1.222 1.00 0.00 O ATOM 1157 CB ALA A 72 -9.183 13.443 0.838 1.00 0.00 C ATOM 0 H ALA A 72 -10.492 11.729 -0.435 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.466 14.404 -1.039 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.400 14.135 1.148 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.142 13.780 1.232 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.962 12.448 1.224 1.00 0.00 H new ATOM 1163 N PRO A 73 -7.239 13.955 -1.956 1.00 0.00 N ATOM 1164 CA PRO A 73 -5.961 13.693 -2.597 1.00 0.00 C ATOM 1165 C PRO A 73 -4.846 13.552 -1.559 1.00 0.00 C ATOM 1166 O PRO A 73 -3.721 13.186 -1.897 1.00 0.00 O ATOM 1167 CB PRO A 73 -5.748 14.863 -3.544 1.00 0.00 C ATOM 1168 CG PRO A 73 -6.678 15.964 -3.062 1.00 0.00 C ATOM 1169 CD PRO A 73 -7.667 15.345 -2.087 1.00 0.00 C ATOM 0 HA PRO A 73 -5.950 12.750 -3.143 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.710 15.194 -3.528 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.977 14.580 -4.572 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -6.110 16.758 -2.577 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.203 16.416 -3.904 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.648 15.857 -1.125 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -8.688 15.411 -2.463 1.00 0.00 H new ATOM 1177 N THR A 74 -5.197 13.850 -0.317 1.00 0.00 N ATOM 1178 CA THR A 74 -4.239 13.761 0.773 1.00 0.00 C ATOM 1179 C THR A 74 -4.383 12.423 1.502 1.00 0.00 C ATOM 1180 O THR A 74 -3.430 11.937 2.108 1.00 0.00 O ATOM 1181 CB THR A 74 -4.444 14.974 1.682 1.00 0.00 C ATOM 1182 OG1 THR A 74 -5.853 15.190 1.661 1.00 0.00 O ATOM 1183 CG2 THR A 74 -3.861 16.257 1.088 1.00 0.00 C ATOM 0 H THR A 74 -6.131 14.153 -0.041 1.00 0.00 H new ATOM 0 HA THR A 74 -3.214 13.784 0.402 1.00 0.00 H new ATOM 0 HB THR A 74 -3.984 14.782 2.651 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.075 15.959 2.227 1.00 0.00 H new ATOM 0 HG21 THR A 74 -4.034 17.087 1.773 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.789 16.132 0.933 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.344 16.468 0.134 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.583 11.867 1.418 1.00 0.00 N ATOM 1192 CA VAL A 75 -5.864 10.595 2.062 1.00 0.00 C ATOM 1193 C VAL A 75 -5.623 9.459 1.066 1.00 0.00 C ATOM 1194 O VAL A 75 -5.117 8.401 1.436 1.00 0.00 O ATOM 1195 CB VAL A 75 -7.284 10.599 2.632 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.759 9.176 2.930 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -7.371 11.479 3.880 1.00 0.00 C ATOM 0 H VAL A 75 -6.371 12.274 0.914 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.190 10.437 2.904 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.947 11.022 1.877 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.771 9.207 3.334 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.753 8.591 2.011 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.092 8.715 3.658 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.391 11.464 4.265 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.690 11.099 4.641 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.094 12.502 3.624 1.00 0.00 H new ATOM 1207 N LYS A 76 -5.996 9.718 -0.179 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.827 8.730 -1.232 1.00 0.00 C ATOM 1209 C LYS A 76 -4.335 8.531 -1.503 1.00 0.00 C ATOM 1210 O LYS A 76 -3.888 7.410 -1.742 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.630 9.127 -2.472 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.264 7.900 -3.131 1.00 0.00 C ATOM 1213 CD LYS A 76 -7.950 8.276 -4.445 1.00 0.00 C ATOM 1214 CE LYS A 76 -8.211 7.036 -5.302 1.00 0.00 C ATOM 1215 NZ LYS A 76 -9.564 7.093 -5.899 1.00 0.00 N ATOM 0 H LYS A 76 -6.414 10.597 -0.482 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.226 7.765 -0.918 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.408 9.837 -2.193 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.978 9.631 -3.185 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.498 7.147 -3.319 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.990 7.453 -2.452 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -8.892 8.782 -4.235 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.326 8.979 -4.997 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.462 6.968 -6.091 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.114 6.138 -4.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.724 6.244 -6.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.276 7.136 -5.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.644 7.940 -6.498 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.605 9.635 -1.456 1.00 0.00 N ATOM 1230 CA ALA A 77 -2.172 9.596 -1.694 1.00 0.00 C ATOM 1231 C ALA A 77 -1.560 8.435 -0.906 1.00 0.00 C ATOM 1232 O ALA A 77 -0.931 7.551 -1.485 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.554 10.944 -1.319 1.00 0.00 C ATOM 0 H ALA A 77 -3.979 10.563 -1.257 1.00 0.00 H new ATOM 0 HA ALA A 77 -1.964 9.425 -2.750 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.479 10.914 -1.498 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.001 11.731 -1.927 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.741 11.149 -0.265 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.767 8.476 0.402 1.00 0.00 N ATOM 1240 CA PHE A 78 -1.244 7.439 1.275 1.00 0.00 C ATOM 1241 C PHE A 78 -1.709 6.054 0.821 1.00 0.00 C ATOM 1242 O PHE A 78 -0.901 5.135 0.690 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.793 7.714 2.676 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.812 7.390 3.804 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.387 8.029 3.867 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -1.139 6.463 4.744 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.298 7.728 4.914 1.00 0.00 C ATOM 1248 CE2 PHE A 78 -0.228 6.162 5.791 1.00 0.00 C ATOM 1249 CZ PHE A 78 0.971 6.801 5.854 1.00 0.00 C ATOM 0 H PHE A 78 -2.290 9.211 0.878 1.00 0.00 H new ATOM 0 HA PHE A 78 -0.154 7.452 1.256 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -2.075 8.765 2.745 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.702 7.130 2.820 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.646 8.765 3.121 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.091 5.956 4.694 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.250 8.235 4.964 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.487 5.426 6.537 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.664 6.572 6.651 1.00 0.00 H new ATOM 1259 N ALA A 79 -3.010 5.947 0.593 1.00 0.00 N ATOM 1260 CA ALA A 79 -3.593 4.689 0.156 1.00 0.00 C ATOM 1261 C ALA A 79 -2.709 4.073 -0.930 1.00 0.00 C ATOM 1262 O ALA A 79 -2.417 2.879 -0.894 1.00 0.00 O ATOM 1263 CB ALA A 79 -5.025 4.930 -0.324 1.00 0.00 C ATOM 0 H ALA A 79 -3.677 6.711 0.703 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.642 3.980 0.983 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.462 3.987 -0.652 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.618 5.341 0.493 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.016 5.634 -1.156 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.308 4.916 -1.871 1.00 0.00 N ATOM 1270 CA GLY A 80 -1.464 4.469 -2.966 1.00 0.00 C ATOM 1271 C GLY A 80 -0.068 4.093 -2.464 1.00 0.00 C ATOM 1272 O GLY A 80 0.597 3.240 -3.049 1.00 0.00 O ATOM 0 H GLY A 80 -2.552 5.906 -1.897 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.922 3.610 -3.456 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.385 5.258 -3.714 1.00 0.00 H new ATOM 1276 N LEU A 81 0.334 4.748 -1.384 1.00 0.00 N ATOM 1277 CA LEU A 81 1.638 4.493 -0.797 1.00 0.00 C ATOM 1278 C LEU A 81 1.656 3.086 -0.196 1.00 0.00 C ATOM 1279 O LEU A 81 2.681 2.406 -0.229 1.00 0.00 O ATOM 1280 CB LEU A 81 2.000 5.594 0.203 1.00 0.00 C ATOM 1281 CG LEU A 81 3.099 5.250 1.210 1.00 0.00 C ATOM 1282 CD1 LEU A 81 4.389 4.841 0.495 1.00 0.00 C ATOM 1283 CD2 LEU A 81 3.327 6.404 2.188 1.00 0.00 C ATOM 0 H LEU A 81 -0.221 5.455 -0.901 1.00 0.00 H new ATOM 0 HA LEU A 81 2.413 4.523 -1.563 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.310 6.477 -0.356 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.101 5.866 0.755 1.00 0.00 H new ATOM 0 HG LEU A 81 2.769 4.392 1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.154 4.602 1.234 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.199 3.966 -0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.734 5.663 -0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.113 6.134 2.893 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.626 7.295 1.636 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.405 6.607 2.733 1.00 0.00 H new ATOM 1295 N LEU A 82 0.510 2.691 0.339 1.00 0.00 N ATOM 1296 CA LEU A 82 0.381 1.377 0.946 1.00 0.00 C ATOM 1297 C LEU A 82 0.464 0.306 -0.144 1.00 0.00 C ATOM 1298 O LEU A 82 1.261 -0.625 -0.045 1.00 0.00 O ATOM 1299 CB LEU A 82 -0.893 1.300 1.790 1.00 0.00 C ATOM 1300 CG LEU A 82 -0.888 2.110 3.087 1.00 0.00 C ATOM 1301 CD1 LEU A 82 0.261 1.678 4.000 1.00 0.00 C ATOM 1302 CD2 LEU A 82 -0.855 3.612 2.796 1.00 0.00 C ATOM 0 H LEU A 82 -0.338 3.258 0.365 1.00 0.00 H new ATOM 0 HA LEU A 82 1.204 1.193 1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.731 1.635 1.179 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -1.078 0.255 2.038 1.00 0.00 H new ATOM 0 HG LEU A 82 -1.817 1.906 3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 82 0.241 2.270 4.915 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.151 0.622 4.248 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.211 1.833 3.488 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.852 4.165 3.736 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.045 3.853 2.230 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.734 3.889 2.215 1.00 0.00 H new ATOM 1314 N ARG A 83 -0.372 0.475 -1.158 1.00 0.00 N ATOM 1315 CA ARG A 83 -0.403 -0.466 -2.265 1.00 0.00 C ATOM 1316 C ARG A 83 0.838 -0.294 -3.143 1.00 0.00 C ATOM 1317 O ARG A 83 1.166 -1.173 -3.940 1.00 0.00 O ATOM 1318 CB ARG A 83 -1.656 -0.268 -3.121 1.00 0.00 C ATOM 1319 CG ARG A 83 -1.395 0.728 -4.253 1.00 0.00 C ATOM 1320 CD ARG A 83 -2.709 1.205 -4.876 1.00 0.00 C ATOM 1321 NE ARG A 83 -3.034 0.382 -6.062 1.00 0.00 N ATOM 1322 CZ ARG A 83 -3.680 -0.791 -6.008 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -4.072 -1.286 -4.827 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -3.932 -1.469 -7.136 1.00 0.00 N ATOM 0 H ARG A 83 -1.032 1.249 -1.236 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.419 -1.472 -1.845 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.970 -1.224 -3.539 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.474 0.092 -2.497 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -0.839 1.583 -3.869 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.774 0.261 -5.017 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.514 1.137 -4.144 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.626 2.253 -5.162 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.749 0.729 -6.978 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.879 -0.770 -3.968 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.564 -2.179 -4.786 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.632 -1.092 -8.035 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.424 -2.362 -7.095 1.00 0.00 H new ATOM 1338 N GLU A 84 1.494 0.843 -2.969 1.00 0.00 N ATOM 1339 CA GLU A 84 2.692 1.141 -3.735 1.00 0.00 C ATOM 1340 C GLU A 84 3.667 -0.036 -3.676 1.00 0.00 C ATOM 1341 O GLU A 84 4.101 -0.541 -4.710 1.00 0.00 O ATOM 1342 CB GLU A 84 3.355 2.427 -3.239 1.00 0.00 C ATOM 1343 CG GLU A 84 3.253 3.537 -4.288 1.00 0.00 C ATOM 1344 CD GLU A 84 3.698 3.035 -5.662 1.00 0.00 C ATOM 1345 OE1 GLU A 84 4.692 2.278 -5.695 1.00 0.00 O ATOM 1346 OE2 GLU A 84 3.035 3.419 -6.649 1.00 0.00 O ATOM 0 H GLU A 84 1.219 1.570 -2.308 1.00 0.00 H new ATOM 0 HA GLU A 84 2.404 1.297 -4.775 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.880 2.752 -2.313 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.403 2.235 -3.009 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.225 3.896 -4.343 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.871 4.383 -3.988 1.00 0.00 H new ATOM 1353 N GLY A 85 3.984 -0.440 -2.454 1.00 0.00 N ATOM 1354 CA GLY A 85 4.900 -1.549 -2.246 1.00 0.00 C ATOM 1355 C GLY A 85 4.281 -2.607 -1.330 1.00 0.00 C ATOM 1356 O GLY A 85 4.892 -3.014 -0.344 1.00 0.00 O ATOM 0 H GLY A 85 3.623 -0.019 -1.598 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.156 -1.998 -3.205 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.828 -1.182 -1.808 1.00 0.00 H new ATOM 1360 N LEU A 86 3.075 -3.022 -1.689 1.00 0.00 N ATOM 1361 CA LEU A 86 2.366 -4.024 -0.912 1.00 0.00 C ATOM 1362 C LEU A 86 1.426 -4.806 -1.832 1.00 0.00 C ATOM 1363 O LEU A 86 1.330 -6.028 -1.735 1.00 0.00 O ATOM 1364 CB LEU A 86 1.661 -3.377 0.282 1.00 0.00 C ATOM 1365 CG LEU A 86 2.540 -2.520 1.195 1.00 0.00 C ATOM 1366 CD1 LEU A 86 1.691 -1.762 2.218 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.625 -3.366 1.865 1.00 0.00 C ATOM 0 H LEU A 86 2.571 -2.682 -2.508 1.00 0.00 H new ATOM 0 HA LEU A 86 3.067 -4.742 -0.487 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.848 -2.756 -0.094 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.208 -4.166 0.883 1.00 0.00 H new ATOM 0 HG LEU A 86 3.047 -1.776 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.340 -1.160 2.855 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.989 -1.111 1.697 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.139 -2.474 2.832 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.235 -2.732 2.508 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.158 -4.148 2.464 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.255 -3.821 1.101 1.00 0.00 H new ATOM 1379 N GLU A 87 0.755 -4.068 -2.704 1.00 0.00 N ATOM 1380 CA GLU A 87 -0.175 -4.676 -3.641 1.00 0.00 C ATOM 1381 C GLU A 87 0.459 -5.906 -4.294 1.00 0.00 C ATOM 1382 O GLU A 87 1.391 -5.782 -5.086 1.00 0.00 O ATOM 1383 CB GLU A 87 -0.628 -3.667 -4.697 1.00 0.00 C ATOM 1384 CG GLU A 87 -1.458 -4.349 -5.786 1.00 0.00 C ATOM 1385 CD GLU A 87 -2.827 -4.770 -5.249 1.00 0.00 C ATOM 1386 OE1 GLU A 87 -3.477 -3.912 -4.614 1.00 0.00 O ATOM 1387 OE2 GLU A 87 -3.193 -5.942 -5.485 1.00 0.00 O ATOM 0 H GLU A 87 0.837 -3.054 -2.782 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.059 -4.996 -3.090 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.217 -2.881 -4.225 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.243 -3.188 -5.145 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.587 -3.670 -6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.926 -5.223 -6.160 1.00 0.00 H new ATOM 1394 N GLY A 88 -0.073 -7.066 -3.937 1.00 0.00 N ATOM 1395 CA GLY A 88 0.428 -8.318 -4.478 1.00 0.00 C ATOM 1396 C GLY A 88 1.724 -8.737 -3.780 1.00 0.00 C ATOM 1397 O GLY A 88 2.611 -9.315 -4.406 1.00 0.00 O ATOM 0 H GLY A 88 -0.846 -7.165 -3.279 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.324 -9.098 -4.356 1.00 0.00 H new ATOM 0 HA3 GLY A 88 0.605 -8.211 -5.548 1.00 0.00 H new ATOM 1401 N GLU A 89 1.791 -8.429 -2.493 1.00 0.00 N ATOM 1402 CA GLU A 89 2.963 -8.767 -1.703 1.00 0.00 C ATOM 1403 C GLU A 89 2.641 -9.908 -0.737 1.00 0.00 C ATOM 1404 O GLU A 89 1.509 -10.386 -0.690 1.00 0.00 O ATOM 1405 CB GLU A 89 3.488 -7.543 -0.951 1.00 0.00 C ATOM 1406 CG GLU A 89 4.123 -6.537 -1.914 1.00 0.00 C ATOM 1407 CD GLU A 89 5.194 -7.206 -2.778 1.00 0.00 C ATOM 1408 OE1 GLU A 89 6.056 -7.890 -2.185 1.00 0.00 O ATOM 1409 OE2 GLU A 89 5.127 -7.018 -4.012 1.00 0.00 O ATOM 0 H GLU A 89 1.053 -7.949 -1.978 1.00 0.00 H new ATOM 0 HA GLU A 89 3.749 -9.102 -2.380 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.671 -7.067 -0.409 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.223 -7.855 -0.209 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.353 -6.104 -2.553 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.566 -5.717 -1.349 1.00 0.00 H new ATOM 1416 N SER A 90 3.658 -10.313 0.010 1.00 0.00 N ATOM 1417 CA SER A 90 3.497 -11.389 0.973 1.00 0.00 C ATOM 1418 C SER A 90 2.783 -10.872 2.223 1.00 0.00 C ATOM 1419 O SER A 90 2.804 -9.674 2.503 1.00 0.00 O ATOM 1420 CB SER A 90 4.850 -11.999 1.348 1.00 0.00 C ATOM 1421 OG SER A 90 5.885 -11.020 1.384 1.00 0.00 O ATOM 0 H SER A 90 4.596 -9.915 -0.032 1.00 0.00 H new ATOM 0 HA SER A 90 2.891 -12.170 0.514 1.00 0.00 H new ATOM 0 HB2 SER A 90 4.773 -12.481 2.323 1.00 0.00 H new ATOM 0 HB3 SER A 90 5.110 -12.775 0.628 1.00 0.00 H new ATOM 0 HG SER A 90 6.754 -11.465 1.470 1.00 0.00 H new ATOM 1427 N PRO A 91 2.152 -11.824 2.960 1.00 0.00 N ATOM 1428 CA PRO A 91 1.432 -11.476 4.174 1.00 0.00 C ATOM 1429 C PRO A 91 2.402 -11.182 5.320 1.00 0.00 C ATOM 1430 O PRO A 91 2.009 -10.618 6.340 1.00 0.00 O ATOM 1431 CB PRO A 91 0.529 -12.667 4.450 1.00 0.00 C ATOM 1432 CG PRO A 91 1.109 -13.824 3.653 1.00 0.00 C ATOM 1433 CD PRO A 91 2.106 -13.252 2.659 1.00 0.00 C ATOM 0 HA PRO A 91 0.844 -10.564 4.069 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.504 -12.900 5.515 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.497 -12.458 4.145 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.598 -14.537 4.316 1.00 0.00 H new ATOM 0 HG3 PRO A 91 0.318 -14.363 3.132 1.00 0.00 H new ATOM 0 HD2 PRO A 91 3.087 -13.712 2.773 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.788 -13.430 1.632 1.00 0.00 H new ATOM 1441 N GLU A 92 3.649 -11.577 5.114 1.00 0.00 N ATOM 1442 CA GLU A 92 4.678 -11.363 6.118 1.00 0.00 C ATOM 1443 C GLU A 92 5.436 -10.065 5.832 1.00 0.00 C ATOM 1444 O GLU A 92 5.794 -9.335 6.755 1.00 0.00 O ATOM 1445 CB GLU A 92 5.636 -12.554 6.185 1.00 0.00 C ATOM 1446 CG GLU A 92 4.865 -13.874 6.253 1.00 0.00 C ATOM 1447 CD GLU A 92 5.157 -14.613 7.560 1.00 0.00 C ATOM 1448 OE1 GLU A 92 4.527 -14.243 8.574 1.00 0.00 O ATOM 1449 OE2 GLU A 92 6.005 -15.531 7.516 1.00 0.00 O ATOM 0 H GLU A 92 3.971 -12.044 4.266 1.00 0.00 H new ATOM 0 HA GLU A 92 4.195 -11.273 7.091 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.285 -12.553 5.310 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.280 -12.459 7.060 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.796 -13.679 6.172 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.139 -14.503 5.406 1.00 0.00 H new ATOM 1456 N ALA A 93 5.659 -9.817 4.550 1.00 0.00 N ATOM 1457 CA ALA A 93 6.368 -8.620 4.131 1.00 0.00 C ATOM 1458 C ALA A 93 5.501 -7.393 4.418 1.00 0.00 C ATOM 1459 O ALA A 93 6.018 -6.292 4.604 1.00 0.00 O ATOM 1460 CB ALA A 93 6.741 -8.739 2.652 1.00 0.00 C ATOM 0 H ALA A 93 5.361 -10.425 3.787 1.00 0.00 H new ATOM 0 HA ALA A 93 7.295 -8.506 4.692 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.273 -7.841 2.338 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.381 -9.609 2.507 1.00 0.00 H new ATOM 0 HB3 ALA A 93 5.835 -8.851 2.056 1.00 0.00 H new ATOM 1466 N VAL A 94 4.196 -7.622 4.443 1.00 0.00 N ATOM 1467 CA VAL A 94 3.252 -6.549 4.704 1.00 0.00 C ATOM 1468 C VAL A 94 3.225 -6.253 6.204 1.00 0.00 C ATOM 1469 O VAL A 94 3.200 -5.092 6.612 1.00 0.00 O ATOM 1470 CB VAL A 94 1.877 -6.913 4.141 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.766 -6.171 4.886 1.00 0.00 C ATOM 1472 CG2 VAL A 94 1.809 -6.636 2.637 1.00 0.00 C ATOM 0 H VAL A 94 3.770 -8.536 4.287 1.00 0.00 H new ATOM 0 HA VAL A 94 3.563 -5.635 4.198 1.00 0.00 H new ATOM 0 HB VAL A 94 1.725 -7.982 4.292 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -0.201 -6.448 4.466 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.794 -6.440 5.942 1.00 0.00 H new ATOM 0 HG13 VAL A 94 0.913 -5.096 4.781 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.821 -6.903 2.262 1.00 0.00 H new ATOM 0 HG22 VAL A 94 1.992 -5.577 2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.565 -7.230 2.123 1.00 0.00 H new ATOM 1482 N LEU A 95 3.230 -7.322 6.986 1.00 0.00 N ATOM 1483 CA LEU A 95 3.206 -7.192 8.433 1.00 0.00 C ATOM 1484 C LEU A 95 4.497 -6.518 8.902 1.00 0.00 C ATOM 1485 O LEU A 95 4.488 -5.751 9.864 1.00 0.00 O ATOM 1486 CB LEU A 95 2.947 -8.549 9.090 1.00 0.00 C ATOM 1487 CG LEU A 95 1.479 -8.914 9.320 1.00 0.00 C ATOM 1488 CD1 LEU A 95 0.903 -8.145 10.511 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.655 -8.702 8.048 1.00 0.00 C ATOM 0 H LEU A 95 3.250 -8.283 6.645 1.00 0.00 H new ATOM 0 HA LEU A 95 2.380 -6.552 8.743 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.400 -9.323 8.470 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.461 -8.569 10.051 1.00 0.00 H new ATOM 0 HG LEU A 95 1.425 -9.975 9.565 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.141 -8.423 10.653 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.469 -8.390 11.410 1.00 0.00 H new ATOM 0 HD13 LEU A 95 0.971 -7.074 10.320 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.384 -8.969 8.239 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.712 -7.656 7.748 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.050 -9.330 7.250 1.00 0.00 H new ATOM 1501 N GLU A 96 5.577 -6.829 8.201 1.00 0.00 N ATOM 1502 CA GLU A 96 6.874 -6.263 8.533 1.00 0.00 C ATOM 1503 C GLU A 96 6.815 -4.735 8.482 1.00 0.00 C ATOM 1504 O GLU A 96 7.577 -4.058 9.171 1.00 0.00 O ATOM 1505 CB GLU A 96 7.962 -6.801 7.601 1.00 0.00 C ATOM 1506 CG GLU A 96 8.325 -8.244 7.957 1.00 0.00 C ATOM 1507 CD GLU A 96 9.359 -8.287 9.084 1.00 0.00 C ATOM 1508 OE1 GLU A 96 8.941 -8.098 10.246 1.00 0.00 O ATOM 1509 OE2 GLU A 96 10.545 -8.508 8.757 1.00 0.00 O ATOM 0 H GLU A 96 5.581 -7.466 7.404 1.00 0.00 H new ATOM 0 HA GLU A 96 7.131 -6.564 9.549 1.00 0.00 H new ATOM 0 HB2 GLU A 96 7.617 -6.753 6.568 1.00 0.00 H new ATOM 0 HB3 GLU A 96 8.849 -6.171 7.670 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.428 -8.784 8.261 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.720 -8.751 7.077 1.00 0.00 H new ATOM 1516 N VAL A 97 5.903 -4.237 7.660 1.00 0.00 N ATOM 1517 CA VAL A 97 5.735 -2.801 7.511 1.00 0.00 C ATOM 1518 C VAL A 97 5.260 -2.207 8.839 1.00 0.00 C ATOM 1519 O VAL A 97 4.138 -2.464 9.272 1.00 0.00 O ATOM 1520 CB VAL A 97 4.785 -2.504 6.349 1.00 0.00 C ATOM 1521 CG1 VAL A 97 4.686 -0.998 6.093 1.00 0.00 C ATOM 1522 CG2 VAL A 97 5.216 -3.248 5.084 1.00 0.00 C ATOM 0 H VAL A 97 5.273 -4.802 7.090 1.00 0.00 H new ATOM 0 HA VAL A 97 6.686 -2.328 7.265 1.00 0.00 H new ATOM 0 HB VAL A 97 3.794 -2.863 6.627 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.005 -0.814 5.262 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.310 -0.501 6.987 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.673 -0.605 5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.524 -3.019 4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.221 -2.934 4.802 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.211 -4.321 5.274 1.00 0.00 H new ATOM 1532 N PRO A 98 6.162 -1.404 9.464 1.00 0.00 N ATOM 1533 CA PRO A 98 5.846 -0.771 10.733 1.00 0.00 C ATOM 1534 C PRO A 98 4.885 0.403 10.537 1.00 0.00 C ATOM 1535 O PRO A 98 4.621 0.812 9.407 1.00 0.00 O ATOM 1536 CB PRO A 98 7.189 -0.349 11.307 1.00 0.00 C ATOM 1537 CG PRO A 98 8.158 -0.341 10.136 1.00 0.00 C ATOM 1538 CD PRO A 98 7.500 -1.077 8.981 1.00 0.00 C ATOM 0 HA PRO A 98 5.327 -1.441 11.419 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.125 0.637 11.768 1.00 0.00 H new ATOM 0 HB3 PRO A 98 7.518 -1.042 12.082 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.400 0.682 9.848 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.095 -0.825 10.413 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.457 -0.454 8.088 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.056 -1.976 8.716 1.00 0.00 H new ATOM 1546 N PRO A 99 4.373 0.925 11.684 1.00 0.00 N ATOM 1547 CA PRO A 99 3.447 2.044 11.649 1.00 0.00 C ATOM 1548 C PRO A 99 4.177 3.352 11.338 1.00 0.00 C ATOM 1549 O PRO A 99 3.552 4.406 11.232 1.00 0.00 O ATOM 1550 CB PRO A 99 2.781 2.046 13.016 1.00 0.00 C ATOM 1551 CG PRO A 99 3.686 1.226 13.921 1.00 0.00 C ATOM 1552 CD PRO A 99 4.663 0.467 13.040 1.00 0.00 C ATOM 0 HA PRO A 99 2.703 1.949 10.858 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.668 3.062 13.394 1.00 0.00 H new ATOM 0 HB3 PRO A 99 1.783 1.612 12.965 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.222 1.875 14.614 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.098 0.533 14.523 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.695 0.681 13.318 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.525 -0.610 13.132 1.00 0.00 H new ATOM 1560 N GLY A 100 5.490 3.240 11.200 1.00 0.00 N ATOM 1561 CA GLY A 100 6.313 4.401 10.904 1.00 0.00 C ATOM 1562 C GLY A 100 7.288 4.105 9.763 1.00 0.00 C ATOM 1563 O GLY A 100 8.461 4.468 9.834 1.00 0.00 O ATOM 0 H GLY A 100 6.004 2.364 11.288 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.676 5.243 10.634 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.868 4.694 11.795 1.00 0.00 H new ATOM 1567 N PHE A 101 6.767 3.448 8.737 1.00 0.00 N ATOM 1568 CA PHE A 101 7.576 3.099 7.582 1.00 0.00 C ATOM 1569 C PHE A 101 7.734 4.295 6.641 1.00 0.00 C ATOM 1570 O PHE A 101 8.447 4.213 5.642 1.00 0.00 O ATOM 1571 CB PHE A 101 6.843 1.977 6.844 1.00 0.00 C ATOM 1572 CG PHE A 101 5.615 2.447 6.061 1.00 0.00 C ATOM 1573 CD1 PHE A 101 5.750 2.869 4.775 1.00 0.00 C ATOM 1574 CD2 PHE A 101 4.390 2.443 6.650 1.00 0.00 C ATOM 1575 CE1 PHE A 101 4.610 3.305 4.048 1.00 0.00 C ATOM 1576 CE2 PHE A 101 3.251 2.880 5.923 1.00 0.00 C ATOM 1577 CZ PHE A 101 3.385 3.301 4.637 1.00 0.00 C ATOM 0 H PHE A 101 5.794 3.148 8.682 1.00 0.00 H new ATOM 0 HA PHE A 101 8.571 2.791 7.904 1.00 0.00 H new ATOM 0 HB2 PHE A 101 7.537 1.494 6.156 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.534 1.222 7.567 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.723 2.873 4.307 1.00 0.00 H new ATOM 0 HD2 PHE A 101 4.283 2.107 7.671 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.717 3.640 3.027 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.278 2.878 6.392 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.518 3.632 4.084 1.00 0.00 H new ATOM 1587 N TYR A 102 7.058 5.378 6.994 1.00 0.00 N ATOM 1588 CA TYR A 102 7.114 6.589 6.194 1.00 0.00 C ATOM 1589 C TYR A 102 7.924 7.677 6.902 1.00 0.00 C ATOM 1590 O TYR A 102 8.651 8.433 6.258 1.00 0.00 O ATOM 1591 CB TYR A 102 5.667 7.063 6.044 1.00 0.00 C ATOM 1592 CG TYR A 102 5.050 7.597 7.338 1.00 0.00 C ATOM 1593 CD1 TYR A 102 4.540 6.720 8.273 1.00 0.00 C ATOM 1594 CD2 TYR A 102 5.004 8.957 7.571 1.00 0.00 C ATOM 1595 CE1 TYR A 102 3.959 7.222 9.491 1.00 0.00 C ATOM 1596 CE2 TYR A 102 4.424 9.459 8.789 1.00 0.00 C ATOM 1597 CZ TYR A 102 3.930 8.567 9.689 1.00 0.00 C ATOM 1598 OH TYR A 102 3.382 9.042 10.840 1.00 0.00 O ATOM 0 H TYR A 102 6.468 5.442 7.824 1.00 0.00 H new ATOM 0 HA TYR A 102 7.591 6.393 5.234 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.628 7.845 5.285 1.00 0.00 H new ATOM 0 HB3 TYR A 102 5.060 6.234 5.679 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.577 5.656 8.091 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.403 9.644 6.840 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.556 6.546 10.230 1.00 0.00 H new ATOM 0 HE2 TYR A 102 4.382 10.520 8.984 1.00 0.00 H new ATOM 0 HH TYR A 102 3.343 10.021 10.804 1.00 0.00 H new ATOM 1608 N ARG A 103 7.772 7.722 8.217 1.00 0.00 N ATOM 1609 CA ARG A 103 8.480 8.705 9.019 1.00 0.00 C ATOM 1610 C ARG A 103 9.969 8.701 8.670 1.00 0.00 C ATOM 1611 O ARG A 103 10.609 7.651 8.674 1.00 0.00 O ATOM 1612 CB ARG A 103 8.313 8.420 10.513 1.00 0.00 C ATOM 1613 CG ARG A 103 7.034 9.064 11.054 1.00 0.00 C ATOM 1614 CD ARG A 103 7.121 9.267 12.568 1.00 0.00 C ATOM 1615 NE ARG A 103 5.813 9.717 13.094 1.00 0.00 N ATOM 1616 CZ ARG A 103 5.650 10.338 14.271 1.00 0.00 C ATOM 1617 NH1 ARG A 103 6.711 10.586 15.050 1.00 0.00 N ATOM 1618 NH2 ARG A 103 4.425 10.710 14.668 1.00 0.00 N ATOM 0 H ARG A 103 7.169 7.093 8.747 1.00 0.00 H new ATOM 0 HA ARG A 103 8.054 9.683 8.797 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.281 7.343 10.680 1.00 0.00 H new ATOM 0 HB3 ARG A 103 9.176 8.802 11.059 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.870 10.024 10.564 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.177 8.434 10.817 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.416 8.336 13.052 1.00 0.00 H new ATOM 0 HD3 ARG A 103 7.889 10.004 12.801 1.00 0.00 H new ATOM 0 HE ARG A 103 4.984 9.544 12.526 1.00 0.00 H new ATOM 0 HH11 ARG A 103 7.643 10.302 14.748 1.00 0.00 H new ATOM 0 HH12 ARG A 103 6.587 11.058 15.945 1.00 0.00 H new ATOM 0 HH21 ARG A 103 3.617 10.521 14.075 1.00 0.00 H new ATOM 0 HH22 ARG A 103 4.301 11.182 15.563 1.00 0.00 H new ATOM 1632 N GLY A 104 10.478 9.889 8.376 1.00 0.00 N ATOM 1633 CA GLY A 104 11.881 10.036 8.025 1.00 0.00 C ATOM 1634 C GLY A 104 12.036 10.577 6.603 1.00 0.00 C ATOM 1635 O GLY A 104 12.417 11.731 6.412 1.00 0.00 O ATOM 0 H GLY A 104 9.944 10.758 8.374 1.00 0.00 H new ATOM 0 HA2 GLY A 104 12.367 10.711 8.730 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.383 9.072 8.108 1.00 0.00 H new ATOM 1639 N TYR A 105 11.733 9.718 5.640 1.00 0.00 N ATOM 1640 CA TYR A 105 11.835 10.096 4.241 1.00 0.00 C ATOM 1641 C TYR A 105 11.449 11.563 4.040 1.00 0.00 C ATOM 1642 O TYR A 105 12.313 12.439 4.025 1.00 0.00 O ATOM 1643 CB TYR A 105 10.836 9.211 3.492 1.00 0.00 C ATOM 1644 CG TYR A 105 11.239 7.737 3.426 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.316 7.349 2.655 1.00 0.00 C ATOM 1646 CD2 TYR A 105 10.525 6.794 4.138 1.00 0.00 C ATOM 1647 CE1 TYR A 105 12.694 5.962 2.593 1.00 0.00 C ATOM 1648 CE2 TYR A 105 10.904 5.406 4.075 1.00 0.00 C ATOM 1649 CZ TYR A 105 11.970 5.058 3.306 1.00 0.00 C ATOM 1650 OH TYR A 105 12.328 3.748 3.247 1.00 0.00 O ATOM 0 H TYR A 105 11.417 8.762 5.802 1.00 0.00 H new ATOM 0 HA TYR A 105 12.857 9.970 3.882 1.00 0.00 H new ATOM 0 HB2 TYR A 105 9.862 9.290 3.976 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.719 9.591 2.477 1.00 0.00 H new ATOM 0 HD1 TYR A 105 12.875 8.086 2.098 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.683 7.097 4.742 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.535 5.646 1.993 1.00 0.00 H new ATOM 0 HE2 TYR A 105 10.354 4.658 4.626 1.00 0.00 H new ATOM 0 HH TYR A 105 11.723 3.218 3.807 1.00 0.00 H new ATOM 1660 N GLY A 106 10.152 11.785 3.889 1.00 0.00 N ATOM 1661 CA GLY A 106 9.641 13.131 3.689 1.00 0.00 C ATOM 1662 C GLY A 106 8.158 13.105 3.313 1.00 0.00 C ATOM 1663 O GLY A 106 7.754 13.716 2.325 1.00 0.00 O ATOM 0 H GLY A 106 9.439 11.056 3.901 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.779 13.715 4.599 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.210 13.627 2.903 1.00 0.00 H new ATOM 1667 N LEU A 107 7.389 12.391 4.121 1.00 0.00 N ATOM 1668 CA LEU A 107 5.959 12.277 3.886 1.00 0.00 C ATOM 1669 C LEU A 107 5.214 13.216 4.836 1.00 0.00 C ATOM 1670 O LEU A 107 4.309 13.937 4.419 1.00 0.00 O ATOM 1671 CB LEU A 107 5.514 10.817 3.989 1.00 0.00 C ATOM 1672 CG LEU A 107 5.563 10.007 2.692 1.00 0.00 C ATOM 1673 CD1 LEU A 107 5.785 8.521 2.981 1.00 0.00 C ATOM 1674 CD2 LEU A 107 4.308 10.246 1.849 1.00 0.00 C ATOM 0 H LEU A 107 7.729 11.885 4.939 1.00 0.00 H new ATOM 0 HA LEU A 107 5.713 12.590 2.871 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.140 10.319 4.729 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.493 10.795 4.369 1.00 0.00 H new ATOM 0 HG LEU A 107 6.415 10.351 2.106 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.816 7.968 2.042 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.729 8.390 3.510 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.969 8.144 3.597 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.368 9.659 0.933 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.427 9.946 2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 107 4.235 11.304 1.598 1.00 0.00 H new ATOM 1686 N GLU A 108 5.621 13.177 6.096 1.00 0.00 N ATOM 1687 CA GLU A 108 5.004 14.015 7.109 1.00 0.00 C ATOM 1688 C GLU A 108 5.057 15.485 6.686 1.00 0.00 C ATOM 1689 O GLU A 108 4.115 16.238 6.927 1.00 0.00 O ATOM 1690 CB GLU A 108 5.671 13.812 8.471 1.00 0.00 C ATOM 1691 CG GLU A 108 4.626 13.728 9.586 1.00 0.00 C ATOM 1692 CD GLU A 108 5.292 13.752 10.963 1.00 0.00 C ATOM 1693 OE1 GLU A 108 5.809 14.831 11.326 1.00 0.00 O ATOM 1694 OE2 GLU A 108 5.270 12.690 11.623 1.00 0.00 O ATOM 0 H GLU A 108 6.372 12.577 6.439 1.00 0.00 H new ATOM 0 HA GLU A 108 3.959 13.722 7.207 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.266 12.899 8.456 1.00 0.00 H new ATOM 0 HB3 GLU A 108 6.356 14.636 8.671 1.00 0.00 H new ATOM 0 HG2 GLU A 108 3.929 14.562 9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 108 4.043 12.813 9.475 1.00 0.00 H new ATOM 1701 N GLU A 109 6.168 15.848 6.063 1.00 0.00 N ATOM 1702 CA GLU A 109 6.356 17.214 5.605 1.00 0.00 C ATOM 1703 C GLU A 109 5.112 17.700 4.859 1.00 0.00 C ATOM 1704 O GLU A 109 4.794 18.888 4.882 1.00 0.00 O ATOM 1705 CB GLU A 109 7.603 17.330 4.725 1.00 0.00 C ATOM 1706 CG GLU A 109 8.877 17.260 5.569 1.00 0.00 C ATOM 1707 CD GLU A 109 9.791 18.454 5.282 1.00 0.00 C ATOM 1708 OE1 GLU A 109 9.358 19.586 5.587 1.00 0.00 O ATOM 1709 OE2 GLU A 109 10.902 18.207 4.765 1.00 0.00 O ATOM 0 H GLU A 109 6.947 15.220 5.865 1.00 0.00 H new ATOM 0 HA GLU A 109 6.505 17.851 6.476 1.00 0.00 H new ATOM 0 HB2 GLU A 109 7.607 16.528 3.986 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.578 18.271 4.175 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.616 17.243 6.627 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.408 16.332 5.357 1.00 0.00 H new ATOM 1716 N PHE A 110 4.441 16.756 4.214 1.00 0.00 N ATOM 1717 CA PHE A 110 3.239 17.073 3.463 1.00 0.00 C ATOM 1718 C PHE A 110 1.984 16.806 4.297 1.00 0.00 C ATOM 1719 O PHE A 110 1.053 17.609 4.299 1.00 0.00 O ATOM 1720 CB PHE A 110 3.224 16.160 2.235 1.00 0.00 C ATOM 1721 CG PHE A 110 4.217 16.568 1.145 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.197 17.833 0.646 1.00 0.00 C ATOM 1723 CD2 PHE A 110 5.119 15.666 0.674 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.118 18.212 -0.366 1.00 0.00 C ATOM 1725 CE2 PHE A 110 6.040 16.044 -0.339 1.00 0.00 C ATOM 1726 CZ PHE A 110 6.020 17.310 -0.837 1.00 0.00 C ATOM 0 H PHE A 110 4.708 15.772 4.197 1.00 0.00 H new ATOM 0 HA PHE A 110 3.241 18.127 3.186 1.00 0.00 H new ATOM 0 HB2 PHE A 110 3.445 15.140 2.550 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.219 16.153 1.813 1.00 0.00 H new ATOM 0 HD1 PHE A 110 3.480 18.549 1.020 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.135 14.662 1.070 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.102 19.217 -0.762 1.00 0.00 H new ATOM 0 HE2 PHE A 110 6.756 15.327 -0.714 1.00 0.00 H new ATOM 0 HZ PHE A 110 6.721 17.599 -1.607 1.00 0.00 H new ATOM 1736 N PHE A 111 2.001 15.675 4.986 1.00 0.00 N ATOM 1737 CA PHE A 111 0.876 15.291 5.823 1.00 0.00 C ATOM 1738 C PHE A 111 1.192 15.518 7.303 1.00 0.00 C ATOM 1739 O PHE A 111 2.171 14.984 7.822 1.00 0.00 O ATOM 1740 CB PHE A 111 0.632 13.799 5.588 1.00 0.00 C ATOM 1741 CG PHE A 111 0.481 13.418 4.115 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.595 13.853 3.406 1.00 0.00 C ATOM 1743 CD2 PHE A 111 1.423 12.643 3.513 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.735 13.498 2.039 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.283 12.289 2.145 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.207 12.724 1.437 1.00 0.00 C ATOM 0 H PHE A 111 2.776 15.012 4.982 1.00 0.00 H new ATOM 0 HA PHE A 111 0.002 15.890 5.570 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.460 13.234 6.016 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -0.269 13.500 6.124 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -1.343 14.469 3.883 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.277 12.297 4.076 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.590 13.843 1.477 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.031 11.674 1.667 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.100 12.455 0.397 1.00 0.00 H new ATOM 1756 N THR A 112 0.344 16.311 7.941 1.00 0.00 N ATOM 1757 CA THR A 112 0.519 16.615 9.351 1.00 0.00 C ATOM 1758 C THR A 112 0.805 15.336 10.141 1.00 0.00 C ATOM 1759 O THR A 112 0.503 14.237 9.679 1.00 0.00 O ATOM 1760 CB THR A 112 -0.726 17.361 9.833 1.00 0.00 C ATOM 1761 OG1 THR A 112 -1.796 16.749 9.118 1.00 0.00 O ATOM 1762 CG2 THR A 112 -0.753 18.818 9.366 1.00 0.00 C ATOM 0 H THR A 112 -0.467 16.753 7.507 1.00 0.00 H new ATOM 0 HA THR A 112 1.383 17.259 9.512 1.00 0.00 H new ATOM 0 HB THR A 112 -0.770 17.327 10.922 1.00 0.00 H new ATOM 0 HG1 THR A 112 -2.643 17.172 9.372 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.657 19.302 9.735 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.122 19.340 9.753 1.00 0.00 H new ATOM 0 HG23 THR A 112 -0.743 18.851 8.277 1.00 0.00 H new ATOM 1770 N PRO A 113 1.399 15.527 11.349 1.00 0.00 N ATOM 1771 CA PRO A 113 1.728 14.402 12.207 1.00 0.00 C ATOM 1772 C PRO A 113 0.473 13.836 12.875 1.00 0.00 C ATOM 1773 O PRO A 113 0.468 12.691 13.325 1.00 0.00 O ATOM 1774 CB PRO A 113 2.735 14.950 13.205 1.00 0.00 C ATOM 1775 CG PRO A 113 2.583 16.462 13.163 1.00 0.00 C ATOM 1776 CD PRO A 113 1.771 16.815 11.928 1.00 0.00 C ATOM 0 HA PRO A 113 2.150 13.562 11.655 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.541 14.566 14.206 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.749 14.652 12.940 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.084 16.821 14.063 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.560 16.943 13.127 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.890 17.402 12.188 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.355 17.411 11.227 1.00 0.00 H new ATOM 1784 N LEU A 114 -0.560 14.664 12.918 1.00 0.00 N ATOM 1785 CA LEU A 114 -1.818 14.259 13.523 1.00 0.00 C ATOM 1786 C LEU A 114 -2.566 13.332 12.562 1.00 0.00 C ATOM 1787 O LEU A 114 -2.907 12.206 12.921 1.00 0.00 O ATOM 1788 CB LEU A 114 -2.627 15.487 13.948 1.00 0.00 C ATOM 1789 CG LEU A 114 -2.430 15.952 15.392 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -2.934 14.899 16.381 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -0.971 16.330 15.652 1.00 0.00 C ATOM 0 H LEU A 114 -0.552 15.613 12.544 1.00 0.00 H new ATOM 0 HA LEU A 114 -1.637 13.693 14.437 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.373 16.313 13.283 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.685 15.271 13.798 1.00 0.00 H new ATOM 0 HG LEU A 114 -3.028 16.850 15.546 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -2.782 15.255 17.400 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -3.996 14.721 16.213 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -2.383 13.970 16.235 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.859 16.657 16.686 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -0.333 15.464 15.474 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -0.680 17.139 14.982 1.00 0.00 H new ATOM 1803 N ARG A 115 -2.799 13.841 11.361 1.00 0.00 N ATOM 1804 CA ARG A 115 -3.501 13.072 10.347 1.00 0.00 C ATOM 1805 C ARG A 115 -2.860 11.692 10.189 1.00 0.00 C ATOM 1806 O ARG A 115 -3.560 10.689 10.059 1.00 0.00 O ATOM 1807 CB ARG A 115 -3.481 13.794 8.998 1.00 0.00 C ATOM 1808 CG ARG A 115 -4.709 13.427 8.162 1.00 0.00 C ATOM 1809 CD ARG A 115 -4.360 13.364 6.673 1.00 0.00 C ATOM 1810 NE ARG A 115 -5.527 13.775 5.862 1.00 0.00 N ATOM 1811 CZ ARG A 115 -5.832 15.047 5.575 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -5.058 16.041 6.033 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -6.912 15.327 4.832 1.00 0.00 N ATOM 0 H ARG A 115 -2.515 14.775 11.067 1.00 0.00 H new ATOM 0 HA ARG A 115 -4.536 12.960 10.672 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -3.455 14.872 9.159 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -2.574 13.531 8.454 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.101 12.464 8.488 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -5.497 14.163 8.324 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -3.512 14.016 6.462 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -4.058 12.352 6.404 1.00 0.00 H new ATOM 0 HE ARG A 115 -6.138 13.043 5.499 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -4.237 15.828 6.600 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -5.290 17.010 5.815 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -7.502 14.571 4.485 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -7.144 16.296 4.614 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.535 11.685 10.204 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.791 10.444 10.064 1.00 0.00 C ATOM 1829 C LEU A 116 -1.225 9.469 11.160 1.00 0.00 C ATOM 1830 O LEU A 116 -1.555 8.318 10.877 1.00 0.00 O ATOM 1831 CB LEU A 116 0.713 10.720 10.047 1.00 0.00 C ATOM 1832 CG LEU A 116 1.334 10.967 8.670 1.00 0.00 C ATOM 1833 CD1 LEU A 116 1.345 9.685 7.836 1.00 0.00 C ATOM 1834 CD2 LEU A 116 0.625 12.115 7.947 1.00 0.00 C ATOM 0 H LEU A 116 -0.957 12.519 10.311 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.015 9.971 9.108 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.910 11.590 10.674 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.223 9.874 10.507 1.00 0.00 H new ATOM 0 HG LEU A 116 2.372 11.268 8.812 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.791 9.888 6.862 1.00 0.00 H new ATOM 0 HD12 LEU A 116 1.928 8.921 8.350 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.323 9.331 7.700 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.085 12.270 6.971 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.428 11.867 7.816 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.712 13.027 8.538 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.209 9.964 12.389 1.00 0.00 N ATOM 1847 CA ARG A 117 -1.596 9.150 13.529 1.00 0.00 C ATOM 1848 C ARG A 117 -2.844 8.330 13.196 1.00 0.00 C ATOM 1849 O ARG A 117 -3.050 7.253 13.754 1.00 0.00 O ATOM 1850 CB ARG A 117 -1.878 10.020 14.756 1.00 0.00 C ATOM 1851 CG ARG A 117 -0.629 10.799 15.174 1.00 0.00 C ATOM 1852 CD ARG A 117 -0.320 10.584 16.658 1.00 0.00 C ATOM 1853 NE ARG A 117 -1.540 10.803 17.466 1.00 0.00 N ATOM 1854 CZ ARG A 117 -1.648 10.491 18.764 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -0.609 9.942 19.409 1.00 0.00 N ATOM 1856 NH2 ARG A 117 -2.794 10.726 19.418 1.00 0.00 N ATOM 0 H ARG A 117 -0.934 10.919 12.620 1.00 0.00 H new ATOM 0 HA ARG A 117 -0.767 8.480 13.755 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -2.688 10.715 14.535 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -2.213 9.393 15.582 1.00 0.00 H new ATOM 0 HG2 ARG A 117 0.222 10.480 14.572 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -0.777 11.861 14.980 1.00 0.00 H new ATOM 0 HD2 ARG A 117 0.055 9.573 16.817 1.00 0.00 H new ATOM 0 HD3 ARG A 117 0.465 11.269 16.977 1.00 0.00 H new ATOM 0 HE ARG A 117 -2.350 11.218 17.005 1.00 0.00 H new ATOM 0 HH11 ARG A 117 0.263 9.762 18.911 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -0.690 9.704 20.398 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -3.585 11.143 18.927 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -2.875 10.488 20.407 1.00 0.00 H new ATOM 1870 N GLY A 118 -3.644 8.871 12.289 1.00 0.00 N ATOM 1871 CA GLY A 118 -4.866 8.203 11.876 1.00 0.00 C ATOM 1872 C GLY A 118 -4.614 7.294 10.671 1.00 0.00 C ATOM 1873 O GLY A 118 -5.130 6.179 10.611 1.00 0.00 O ATOM 0 H GLY A 118 -3.470 9.764 11.829 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -5.260 7.614 12.704 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.623 8.945 11.624 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.820 7.805 9.741 1.00 0.00 N ATOM 1878 CA LEU A 119 -3.493 7.053 8.541 1.00 0.00 C ATOM 1879 C LEU A 119 -2.815 5.740 8.936 1.00 0.00 C ATOM 1880 O LEU A 119 -3.189 4.674 8.450 1.00 0.00 O ATOM 1881 CB LEU A 119 -2.662 7.909 7.583 1.00 0.00 C ATOM 1882 CG LEU A 119 -3.451 8.838 6.658 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -2.513 9.627 5.743 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -4.504 8.060 5.866 1.00 0.00 C ATOM 0 H LEU A 119 -3.394 8.730 9.794 1.00 0.00 H new ATOM 0 HA LEU A 119 -4.400 6.793 7.996 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.974 8.515 8.172 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.055 7.245 6.967 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.983 9.562 7.275 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.100 10.279 5.096 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.836 10.230 6.348 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -1.934 8.935 5.132 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.050 8.744 5.217 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.014 7.298 5.260 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.199 7.582 6.556 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.831 5.859 9.816 1.00 0.00 N ATOM 1897 CA GLU A 120 -1.098 4.694 10.282 1.00 0.00 C ATOM 1898 C GLU A 120 -2.070 3.591 10.705 1.00 0.00 C ATOM 1899 O GLU A 120 -1.807 2.409 10.484 1.00 0.00 O ATOM 1900 CB GLU A 120 -0.155 5.063 11.428 1.00 0.00 C ATOM 1901 CG GLU A 120 0.799 6.185 11.014 1.00 0.00 C ATOM 1902 CD GLU A 120 1.337 5.954 9.600 1.00 0.00 C ATOM 1903 OE1 GLU A 120 1.929 4.874 9.387 1.00 0.00 O ATOM 1904 OE2 GLU A 120 1.143 6.862 8.763 1.00 0.00 O ATOM 0 H GLU A 120 -1.524 6.745 10.218 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.488 4.319 9.460 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.736 5.377 12.295 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.418 4.186 11.729 1.00 0.00 H new ATOM 0 HG2 GLU A 120 0.280 7.143 11.058 1.00 0.00 H new ATOM 0 HG3 GLU A 120 1.629 6.240 11.718 1.00 0.00 H new ATOM 1911 N ALA A 121 -3.173 4.015 11.304 1.00 0.00 N ATOM 1912 CA ALA A 121 -4.184 3.077 11.760 1.00 0.00 C ATOM 1913 C ALA A 121 -4.492 2.081 10.640 1.00 0.00 C ATOM 1914 O ALA A 121 -4.711 0.899 10.898 1.00 0.00 O ATOM 1915 CB ALA A 121 -5.427 3.846 12.214 1.00 0.00 C ATOM 0 H ALA A 121 -3.389 4.996 11.484 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.821 2.509 12.616 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -6.186 3.142 12.556 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.161 4.518 13.030 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.821 4.426 11.380 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.499 2.596 9.419 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.776 1.767 8.258 1.00 0.00 C ATOM 1923 C ALA A 122 -3.869 0.536 8.288 1.00 0.00 C ATOM 1924 O ALA A 122 -4.347 -0.588 8.435 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.594 2.595 6.984 1.00 0.00 C ATOM 0 H ALA A 122 -4.317 3.577 9.209 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.808 1.416 8.274 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.802 1.973 6.113 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -5.282 3.441 6.998 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.569 2.962 6.932 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.576 0.789 8.147 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.598 -0.285 8.156 1.00 0.00 C ATOM 1933 C LEU A 123 -1.860 -1.198 9.355 1.00 0.00 C ATOM 1934 O LEU A 123 -2.045 -2.403 9.194 1.00 0.00 O ATOM 1935 CB LEU A 123 -0.178 0.283 8.114 1.00 0.00 C ATOM 1936 CG LEU A 123 0.957 -0.741 8.186 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.211 -1.374 6.817 1.00 0.00 C ATOM 1938 CD2 LEU A 123 2.224 -0.114 8.772 1.00 0.00 C ATOM 0 H LEU A 123 -2.183 1.722 8.026 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.698 -0.898 7.260 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -0.065 0.857 7.194 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -0.063 0.982 8.942 1.00 0.00 H new ATOM 0 HG LEU A 123 0.653 -1.542 8.860 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.022 -2.098 6.896 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.307 -1.878 6.476 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.485 -0.598 6.103 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.015 -0.863 8.812 1.00 0.00 H new ATOM 0 HD22 LEU A 123 2.543 0.717 8.143 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.018 0.250 9.778 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.867 -0.589 10.532 1.00 0.00 N ATOM 1951 CA LEU A 124 -2.103 -1.332 11.758 1.00 0.00 C ATOM 1952 C LEU A 124 -3.352 -2.199 11.591 1.00 0.00 C ATOM 1953 O LEU A 124 -3.332 -3.389 11.903 1.00 0.00 O ATOM 1954 CB LEU A 124 -2.170 -0.382 12.956 1.00 0.00 C ATOM 1955 CG LEU A 124 -0.870 0.342 13.311 1.00 0.00 C ATOM 1956 CD1 LEU A 124 -1.153 1.619 14.105 1.00 0.00 C ATOM 1957 CD2 LEU A 124 0.093 -0.590 14.049 1.00 0.00 C ATOM 0 H LEU A 124 -1.713 0.411 10.662 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.271 -2.006 11.961 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.937 0.367 12.758 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.496 -0.950 13.827 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.381 0.641 12.384 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.212 2.114 14.345 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.774 2.288 13.509 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -1.675 1.366 15.028 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.009 -0.050 14.290 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.374 -0.941 14.969 1.00 0.00 H new ATOM 0 HD23 LEU A 124 0.331 -1.444 13.415 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.409 -1.570 11.098 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.665 -2.270 10.886 1.00 0.00 C ATOM 1971 C ARG A 125 -5.462 -3.444 9.926 1.00 0.00 C ATOM 1972 O ARG A 125 -5.655 -4.599 10.303 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.729 -1.331 10.315 1.00 0.00 C ATOM 1974 CG ARG A 125 -7.516 -0.649 11.435 1.00 0.00 C ATOM 1975 CD ARG A 125 -7.974 0.748 11.011 1.00 0.00 C ATOM 1976 NE ARG A 125 -8.337 1.546 12.204 1.00 0.00 N ATOM 1977 CZ ARG A 125 -9.457 1.364 12.917 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -10.330 0.412 12.561 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -9.704 2.135 13.985 1.00 0.00 N ATOM 0 H ARG A 125 -4.422 -0.583 10.839 1.00 0.00 H new ATOM 0 HA ARG A 125 -6.006 -2.641 11.853 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.254 -0.577 9.688 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.411 -1.893 9.677 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -8.383 -1.256 11.697 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.896 -0.577 12.328 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -7.179 1.248 10.457 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -8.830 0.671 10.341 1.00 0.00 H new ATOM 0 HE ARG A 125 -7.695 2.280 12.502 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -10.142 -0.174 11.748 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -11.183 0.273 13.103 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -9.040 2.860 14.255 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -10.556 1.997 14.528 1.00 0.00 H new ATOM 1993 N LEU A 126 -5.075 -3.108 8.704 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.844 -4.120 7.688 1.00 0.00 C ATOM 1995 C LEU A 126 -3.991 -5.245 8.278 1.00 0.00 C ATOM 1996 O LEU A 126 -4.323 -6.421 8.136 1.00 0.00 O ATOM 1997 CB LEU A 126 -4.245 -3.489 6.429 1.00 0.00 C ATOM 1998 CG LEU A 126 -5.102 -2.427 5.738 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -4.277 -1.180 5.416 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -5.785 -2.998 4.494 1.00 0.00 C ATOM 0 H LEU A 126 -4.916 -2.149 8.395 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.788 -4.567 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -3.287 -3.040 6.692 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -4.038 -4.283 5.712 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.889 -2.123 6.428 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.911 -0.441 4.925 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.878 -0.760 6.339 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.454 -1.449 4.754 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.388 -2.222 4.022 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.028 -3.347 3.792 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.426 -3.831 4.781 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.908 -4.844 8.928 1.00 0.00 N ATOM 2013 CA GLN A 127 -2.005 -5.803 9.540 1.00 0.00 C ATOM 2014 C GLN A 127 -2.788 -6.789 10.410 1.00 0.00 C ATOM 2015 O GLN A 127 -2.358 -7.925 10.607 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.922 -5.093 10.356 1.00 0.00 C ATOM 2017 CG GLN A 127 0.144 -4.487 9.441 1.00 0.00 C ATOM 2018 CD GLN A 127 1.526 -4.546 10.095 1.00 0.00 C ATOM 2019 OE1 GLN A 127 1.668 -4.767 11.286 1.00 0.00 O ATOM 2020 NE2 GLN A 127 2.533 -4.337 9.252 1.00 0.00 N ATOM 0 H GLN A 127 -2.636 -3.868 9.044 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.509 -6.362 8.747 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -1.374 -4.309 10.963 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -0.457 -5.800 11.043 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.163 -5.025 8.493 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -0.111 -3.452 9.215 1.00 0.00 H new ATOM 0 HE21 GLN A 127 2.344 -4.157 8.266 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.495 -4.356 9.591 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.923 -6.319 10.906 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.769 -7.146 11.750 1.00 0.00 C ATOM 2031 C ALA A 128 -5.628 -8.055 10.869 1.00 0.00 C ATOM 2032 O ALA A 128 -5.960 -9.172 11.261 1.00 0.00 O ATOM 2033 CB ALA A 128 -5.612 -6.251 12.661 1.00 0.00 C ATOM 0 H ALA A 128 -4.276 -5.377 10.740 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.163 -7.786 12.392 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.247 -6.871 13.294 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.955 -5.647 13.287 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.236 -5.597 12.052 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.963 -7.541 9.694 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.777 -8.293 8.754 1.00 0.00 C ATOM 2041 C GLN A 129 -5.935 -9.369 8.066 1.00 0.00 C ATOM 2042 O GLN A 129 -6.454 -10.418 7.684 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.426 -7.364 7.726 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.417 -6.411 8.397 1.00 0.00 C ATOM 2045 CD GLN A 129 -9.692 -6.268 7.563 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -10.353 -7.235 7.223 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.999 -5.012 7.255 1.00 0.00 N ATOM 0 H GLN A 129 -5.686 -6.614 9.372 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.577 -8.784 9.308 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.655 -6.790 7.212 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.941 -7.956 6.969 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.668 -6.782 9.391 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.954 -5.433 8.530 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -9.402 -4.249 7.572 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.832 -4.812 6.702 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.651 -9.073 7.928 1.00 0.00 N ATOM 2057 CA VAL A 130 -3.733 -10.003 7.292 1.00 0.00 C ATOM 2058 C VAL A 130 -3.400 -11.132 8.269 1.00 0.00 C ATOM 2059 O VAL A 130 -3.675 -12.299 7.991 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.493 -9.256 6.796 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -1.498 -10.219 6.145 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -2.879 -8.131 5.834 1.00 0.00 C ATOM 0 H VAL A 130 -4.225 -8.203 8.246 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.195 -10.457 6.416 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.005 -8.804 7.660 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.626 -9.663 5.801 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.187 -10.968 6.873 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.972 -10.713 5.296 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.979 -7.616 5.497 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.401 -8.551 4.974 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.532 -7.423 6.345 1.00 0.00 H new ATOM 2072 N ARG A 131 -2.813 -10.746 9.392 1.00 0.00 N ATOM 2073 CA ARG A 131 -2.440 -11.712 10.412 1.00 0.00 C ATOM 2074 C ARG A 131 -3.540 -12.763 10.576 1.00 0.00 C ATOM 2075 O ARG A 131 -3.258 -13.920 10.882 1.00 0.00 O ATOM 2076 CB ARG A 131 -2.194 -11.026 11.757 1.00 0.00 C ATOM 2077 CG ARG A 131 -0.823 -10.349 11.785 1.00 0.00 C ATOM 2078 CD ARG A 131 -0.794 -9.211 12.807 1.00 0.00 C ATOM 2079 NE ARG A 131 0.454 -9.275 13.601 1.00 0.00 N ATOM 2080 CZ ARG A 131 0.824 -8.349 14.495 1.00 0.00 C ATOM 2081 NH1 ARG A 131 0.045 -7.281 14.715 1.00 0.00 N ATOM 2082 NH2 ARG A 131 1.974 -8.489 15.169 1.00 0.00 N ATOM 0 H ARG A 131 -2.586 -9.778 9.618 1.00 0.00 H new ATOM 0 HA ARG A 131 -1.517 -12.195 10.090 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -2.973 -10.286 11.939 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.258 -11.760 12.560 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -0.056 -11.083 12.031 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -0.585 -9.960 10.795 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -0.861 -8.251 12.296 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -1.659 -9.282 13.467 1.00 0.00 H new ATOM 0 HE ARG A 131 1.071 -10.075 13.458 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -0.830 -7.173 14.202 1.00 0.00 H new ATOM 0 HH12 ARG A 131 0.327 -6.576 15.396 1.00 0.00 H new ATOM 0 HH21 ARG A 131 2.568 -9.301 15.001 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.255 -7.783 15.850 1.00 0.00 H new ATOM 2096 N LYS A 132 -4.772 -12.322 10.365 1.00 0.00 N ATOM 2097 CA LYS A 132 -5.915 -13.209 10.486 1.00 0.00 C ATOM 2098 C LYS A 132 -5.850 -14.271 9.387 1.00 0.00 C ATOM 2099 O LYS A 132 -6.030 -15.458 9.654 1.00 0.00 O ATOM 2100 CB LYS A 132 -7.218 -12.407 10.489 1.00 0.00 C ATOM 2101 CG LYS A 132 -8.317 -13.143 9.720 1.00 0.00 C ATOM 2102 CD LYS A 132 -8.346 -12.707 8.254 1.00 0.00 C ATOM 2103 CE LYS A 132 -8.862 -13.835 7.357 1.00 0.00 C ATOM 2104 NZ LYS A 132 -10.342 -13.830 7.317 1.00 0.00 N ATOM 0 H LYS A 132 -5.003 -11.361 10.111 1.00 0.00 H new ATOM 0 HA LYS A 132 -5.889 -13.735 11.440 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -7.541 -12.235 11.516 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -7.048 -11.428 10.040 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -8.150 -14.218 9.780 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -9.284 -12.944 10.181 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -8.983 -11.830 8.144 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -7.345 -12.415 7.938 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -8.465 -13.717 6.349 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -8.506 -14.795 7.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -10.675 -14.601 6.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -10.716 -13.965 8.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -10.676 -12.920 6.941 1.00 0.00 H new ATOM 2118 N ALA A 133 -5.591 -13.806 8.173 1.00 0.00 N ATOM 2119 CA ALA A 133 -5.500 -14.701 7.032 1.00 0.00 C ATOM 2120 C ALA A 133 -4.527 -15.836 7.357 1.00 0.00 C ATOM 2121 O ALA A 133 -4.793 -16.995 7.042 1.00 0.00 O ATOM 2122 CB ALA A 133 -5.078 -13.908 5.794 1.00 0.00 C ATOM 0 H ALA A 133 -5.441 -12.821 7.955 1.00 0.00 H new ATOM 0 HA ALA A 133 -6.470 -15.149 6.817 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -5.010 -14.579 4.938 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -5.816 -13.133 5.589 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -4.107 -13.446 5.971 1.00 0.00 H new ATOM 2128 N LEU A 134 -3.421 -15.464 7.984 1.00 0.00 N ATOM 2129 CA LEU A 134 -2.407 -16.437 8.355 1.00 0.00 C ATOM 2130 C LEU A 134 -3.063 -17.577 9.137 1.00 0.00 C ATOM 2131 O LEU A 134 -2.725 -18.743 8.941 1.00 0.00 O ATOM 2132 CB LEU A 134 -1.260 -15.756 9.105 1.00 0.00 C ATOM 2133 CG LEU A 134 -0.347 -14.861 8.265 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -1.128 -13.689 7.666 1.00 0.00 C ATOM 2135 CD2 LEU A 134 0.859 -14.390 9.080 1.00 0.00 C ATOM 0 H LEU A 134 -3.204 -14.502 8.245 1.00 0.00 H new ATOM 0 HA LEU A 134 -1.957 -16.878 7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.684 -15.155 9.909 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -0.649 -16.528 9.572 1.00 0.00 H new ATOM 0 HG LEU A 134 0.037 -15.450 7.432 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.456 -13.068 7.074 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.925 -14.071 7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -1.560 -13.092 8.469 1.00 0.00 H new ATOM 0 HD21 LEU A 134 1.492 -13.755 8.460 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.515 -13.824 9.945 1.00 0.00 H new ATOM 0 HD23 LEU A 134 1.431 -15.255 9.416 1.00 0.00 H new ATOM 2147 N THR A 135 -3.989 -17.200 10.006 1.00 0.00 N ATOM 2148 CA THR A 135 -4.695 -18.176 10.818 1.00 0.00 C ATOM 2149 C THR A 135 -5.973 -18.633 10.112 1.00 0.00 C ATOM 2150 O THR A 135 -6.560 -19.649 10.480 1.00 0.00 O ATOM 2151 CB THR A 135 -4.949 -17.553 12.192 1.00 0.00 C ATOM 2152 OG1 THR A 135 -5.418 -18.640 12.985 1.00 0.00 O ATOM 2153 CG2 THR A 135 -6.119 -16.568 12.181 1.00 0.00 C ATOM 0 H THR A 135 -4.267 -16.232 10.166 1.00 0.00 H new ATOM 0 HA THR A 135 -4.099 -19.078 10.959 1.00 0.00 H new ATOM 0 HB THR A 135 -4.048 -17.042 12.531 1.00 0.00 H new ATOM 0 HG1 THR A 135 -5.606 -18.325 13.894 1.00 0.00 H new ATOM 0 HG21 THR A 135 -6.256 -16.155 13.180 1.00 0.00 H new ATOM 0 HG22 THR A 135 -5.908 -15.760 11.480 1.00 0.00 H new ATOM 0 HG23 THR A 135 -7.028 -17.086 11.874 1.00 0.00 H new ATOM 2161 N SER A 136 -6.366 -17.859 9.111 1.00 0.00 N ATOM 2162 CA SER A 136 -7.564 -18.172 8.350 1.00 0.00 C ATOM 2163 C SER A 136 -7.610 -17.327 7.075 1.00 0.00 C ATOM 2164 O SER A 136 -8.522 -17.472 6.263 1.00 0.00 O ATOM 2165 CB SER A 136 -8.824 -17.939 9.186 1.00 0.00 C ATOM 2166 OG SER A 136 -9.949 -18.642 8.665 1.00 0.00 O ATOM 0 H SER A 136 -5.877 -17.016 8.809 1.00 0.00 H new ATOM 0 HA SER A 136 -7.530 -19.227 8.078 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.642 -18.257 10.213 1.00 0.00 H new ATOM 0 HB3 SER A 136 -9.046 -16.872 9.217 1.00 0.00 H new ATOM 0 HG SER A 136 -9.962 -18.560 7.689 1.00 0.00 H new TER 2172 SER A 136