USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 910 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 17 THR OG1 : rot 69:sc= 0.969 USER MOD Set 1.2: A 18 GLN : amide:sc= -2.06! C(o=-1.1!,f=-6.8!) USER MOD Single : A 1 SER N :NH3+ -119:sc= -0.105 (180deg=-0.925!) USER MOD Single : A 1 SER OG : rot 140:sc= -7.11! USER MOD Single : A 3 GLN : amide:sc= -2.37 K(o=-2.4,f=-7!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.476 K(o=-0.48,f=-2.7!) USER MOD Single : A 13 THR OG1 : rot -79:sc= 0.978 USER MOD Single : A 27 ASN : amide:sc= -2.81! C(o=-2.8!,f=-1.2!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.0203 USER MOD Single : A 32 SER OG : rot -11:sc= -1.93! USER MOD Single : A 38 THR OG1 : rot 47:sc= -0.686! USER MOD Single : A 41 GLN : amide:sc= -1.02 K(o=-1,f=-0.21) USER MOD Single : A 43 GLN : amide:sc= -0.0267 K(o=-0.027,f=-1.3!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -77:sc= 0.735 USER MOD Single : A 50 ASN : amide:sc= -0.382 X(o=-0.38,f=-0.017) USER MOD Single : A 51 ASN : amide:sc= -0.29 X(o=-0.29,f=-0.26) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0226 USER MOD Single : A 66 HIS : no HD1:sc= -1.58! K(o=-1.6!,f=-0.44) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.278 USER MOD Single : A 76 SER OG : rot 180:sc= -0.16 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 171:sc= -0.292 (180deg=-0.473) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 133:sc= -0.393 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 71:sc= 0.183 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 146:sc= -1.14! USER MOD Single : A 100 TYR OH : rot 20:sc= -1.64! USER MOD Single : A 101 ASN : amide:sc= -0.392 X(o=-0.39,f=-0.74) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.35) USER MOD Single : A 108 THR OG1 : rot 5:sc= 0.194 USER MOD Single : A 111 ASN : amide:sc= -0.294 K(o=-0.29,f=-3.3!) USER MOD Single : A 115 LYS NZ :NH3+ 144:sc= -0.531 (180deg=-2.35!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.0134 X(o=-0.013,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 5.694 1.940 -1.233 1.00 0.00 N ATOM 2 CA SER A 1 6.271 1.757 -2.597 1.00 0.00 C ATOM 3 C SER A 1 7.619 2.482 -2.684 1.00 0.00 C ATOM 4 O SER A 1 8.597 1.932 -3.149 1.00 0.00 O ATOM 5 CB SER A 1 5.304 2.325 -3.638 1.00 0.00 C ATOM 6 OG SER A 1 6.038 2.758 -4.775 1.00 0.00 O ATOM 0 H1 SER A 1 5.581 1.012 -0.776 1.00 0.00 H new ATOM 0 H2 SER A 1 6.332 2.531 -0.663 1.00 0.00 H new ATOM 0 H3 SER A 1 4.766 2.404 -1.308 1.00 0.00 H new ATOM 0 HA SER A 1 6.424 0.695 -2.791 1.00 0.00 H new ATOM 0 HB2 SER A 1 4.577 1.566 -3.928 1.00 0.00 H new ATOM 0 HB3 SER A 1 4.744 3.158 -3.214 1.00 0.00 H new ATOM 0 HG SER A 1 5.549 2.520 -5.590 1.00 0.00 H new ATOM 14 N TRP A 2 7.685 3.706 -2.222 1.00 0.00 N ATOM 15 CA TRP A 2 8.978 4.467 -2.258 1.00 0.00 C ATOM 16 C TRP A 2 9.493 4.559 -3.702 1.00 0.00 C ATOM 17 O TRP A 2 9.300 3.667 -4.501 1.00 0.00 O ATOM 18 CB TRP A 2 10.027 3.778 -1.374 1.00 0.00 C ATOM 19 CG TRP A 2 9.387 2.694 -0.560 1.00 0.00 C ATOM 20 CD1 TRP A 2 9.649 1.370 -0.668 1.00 0.00 C ATOM 21 CD2 TRP A 2 8.369 2.827 0.470 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.865 0.685 0.243 1.00 0.00 N ATOM 23 CE2 TRP A 2 8.058 1.540 0.967 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.697 3.931 1.017 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.112 1.354 1.977 1.00 0.00 C ATOM 26 CZ3 TRP A 2 6.744 3.750 2.033 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.452 2.464 2.511 1.00 0.00 C ATOM 0 H TRP A 2 6.898 4.215 -1.820 1.00 0.00 H new ATOM 0 HA TRP A 2 8.802 5.473 -1.876 1.00 0.00 H new ATOM 0 HB2 TRP A 2 10.817 3.357 -1.996 1.00 0.00 H new ATOM 0 HB3 TRP A 2 10.495 4.509 -0.715 1.00 0.00 H new ATOM 0 HD1 TRP A 2 10.354 0.922 -1.353 1.00 0.00 H new ATOM 0 HE1 TRP A 2 8.881 -0.328 0.365 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.914 4.925 0.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 6.892 0.362 2.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 6.233 4.606 2.449 1.00 0.00 H new ATOM 0 HH2 TRP A 2 5.717 2.332 3.291 1.00 0.00 H new ATOM 38 N GLN A 3 10.135 5.648 -4.046 1.00 0.00 N ATOM 39 CA GLN A 3 10.647 5.811 -5.446 1.00 0.00 C ATOM 40 C GLN A 3 12.007 5.119 -5.607 1.00 0.00 C ATOM 41 O GLN A 3 12.095 4.057 -6.191 1.00 0.00 O ATOM 42 CB GLN A 3 10.786 7.302 -5.799 1.00 0.00 C ATOM 43 CG GLN A 3 11.143 8.121 -4.554 1.00 0.00 C ATOM 44 CD GLN A 3 9.866 8.664 -3.914 1.00 0.00 C ATOM 45 OE1 GLN A 3 8.798 8.576 -4.487 1.00 0.00 O ATOM 46 NE2 GLN A 3 9.932 9.226 -2.737 1.00 0.00 N ATOM 0 H GLN A 3 10.327 6.431 -3.421 1.00 0.00 H new ATOM 0 HA GLN A 3 9.929 5.348 -6.123 1.00 0.00 H new ATOM 0 HB2 GLN A 3 11.557 7.431 -6.559 1.00 0.00 H new ATOM 0 HB3 GLN A 3 9.853 7.668 -6.226 1.00 0.00 H new ATOM 0 HG2 GLN A 3 11.684 7.499 -3.840 1.00 0.00 H new ATOM 0 HG3 GLN A 3 11.804 8.944 -4.825 1.00 0.00 H new ATOM 0 HE21 GLN A 3 10.829 9.300 -2.257 1.00 0.00 H new ATOM 0 HE22 GLN A 3 9.087 9.591 -2.298 1.00 0.00 H new ATOM 55 N THR A 4 13.066 5.712 -5.113 1.00 0.00 N ATOM 56 CA THR A 4 14.416 5.087 -5.254 1.00 0.00 C ATOM 57 C THR A 4 14.308 3.572 -5.055 1.00 0.00 C ATOM 58 O THR A 4 15.075 2.806 -5.605 1.00 0.00 O ATOM 59 CB THR A 4 15.367 5.677 -4.208 1.00 0.00 C ATOM 60 OG1 THR A 4 16.575 4.929 -4.190 1.00 0.00 O ATOM 61 CG2 THR A 4 14.714 5.624 -2.826 1.00 0.00 C ATOM 0 H THR A 4 13.053 6.603 -4.617 1.00 0.00 H new ATOM 0 HA THR A 4 14.804 5.291 -6.252 1.00 0.00 H new ATOM 0 HB THR A 4 15.584 6.714 -4.464 1.00 0.00 H new ATOM 0 HG1 THR A 4 17.184 5.307 -3.522 1.00 0.00 H new ATOM 0 HG21 THR A 4 15.394 6.045 -2.086 1.00 0.00 H new ATOM 0 HG22 THR A 4 13.789 6.201 -2.838 1.00 0.00 H new ATOM 0 HG23 THR A 4 14.492 4.588 -2.568 1.00 0.00 H new ATOM 69 N TYR A 5 13.355 3.136 -4.282 1.00 0.00 N ATOM 70 CA TYR A 5 13.184 1.674 -4.056 1.00 0.00 C ATOM 71 C TYR A 5 12.309 1.098 -5.173 1.00 0.00 C ATOM 72 O TYR A 5 12.586 0.049 -5.722 1.00 0.00 O ATOM 73 CB TYR A 5 12.501 1.457 -2.704 1.00 0.00 C ATOM 74 CG TYR A 5 13.375 1.993 -1.586 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.713 2.331 -1.838 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.846 2.154 -0.296 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.518 2.826 -0.805 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.655 2.650 0.734 1.00 0.00 C ATOM 79 CZ TYR A 5 14.989 2.986 0.480 1.00 0.00 C ATOM 80 OH TYR A 5 15.784 3.476 1.495 1.00 0.00 O ATOM 0 H TYR A 5 12.684 3.731 -3.795 1.00 0.00 H new ATOM 0 HA TYR A 5 14.154 1.176 -4.059 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.533 1.959 -2.692 1.00 0.00 H new ATOM 0 HB3 TYR A 5 12.311 0.395 -2.550 1.00 0.00 H new ATOM 0 HD1 TYR A 5 15.123 2.209 -2.830 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.816 1.896 -0.098 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.548 3.085 -1.000 1.00 0.00 H new ATOM 0 HE2 TYR A 5 13.248 2.773 1.727 1.00 0.00 H new ATOM 0 HH TYR A 5 15.263 3.526 2.323 1.00 0.00 H new ATOM 90 N VAL A 6 11.257 1.790 -5.509 1.00 0.00 N ATOM 91 CA VAL A 6 10.341 1.322 -6.590 1.00 0.00 C ATOM 92 C VAL A 6 11.158 0.883 -7.811 1.00 0.00 C ATOM 93 O VAL A 6 10.721 0.082 -8.611 1.00 0.00 O ATOM 94 CB VAL A 6 9.414 2.499 -6.963 1.00 0.00 C ATOM 95 CG1 VAL A 6 9.255 2.636 -8.485 1.00 0.00 C ATOM 96 CG2 VAL A 6 8.034 2.284 -6.338 1.00 0.00 C ATOM 0 H VAL A 6 10.988 2.673 -5.075 1.00 0.00 H new ATOM 0 HA VAL A 6 9.751 0.470 -6.252 1.00 0.00 H new ATOM 0 HB VAL A 6 9.869 3.413 -6.581 1.00 0.00 H new ATOM 0 HG11 VAL A 6 8.596 3.475 -8.708 1.00 0.00 H new ATOM 0 HG12 VAL A 6 10.231 2.811 -8.938 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.826 1.720 -8.890 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.381 3.116 -6.602 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.606 1.354 -6.712 1.00 0.00 H new ATOM 0 HG23 VAL A 6 8.130 2.229 -5.254 1.00 0.00 H new ATOM 106 N ASP A 7 12.311 1.448 -7.989 1.00 0.00 N ATOM 107 CA ASP A 7 13.129 1.108 -9.189 1.00 0.00 C ATOM 108 C ASP A 7 13.305 -0.408 -9.350 1.00 0.00 C ATOM 109 O ASP A 7 12.585 -1.040 -10.097 1.00 0.00 O ATOM 110 CB ASP A 7 14.499 1.786 -9.092 1.00 0.00 C ATOM 111 CG ASP A 7 14.737 2.633 -10.344 1.00 0.00 C ATOM 112 OD1 ASP A 7 13.763 2.998 -10.982 1.00 0.00 O ATOM 113 OD2 ASP A 7 15.889 2.900 -10.645 1.00 0.00 O ATOM 0 H ASP A 7 12.728 2.132 -7.358 1.00 0.00 H new ATOM 0 HA ASP A 7 12.598 1.474 -10.068 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.545 2.413 -8.201 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.283 1.035 -8.993 1.00 0.00 H new ATOM 118 N THR A 8 14.268 -0.999 -8.694 1.00 0.00 N ATOM 119 CA THR A 8 14.477 -2.467 -8.872 1.00 0.00 C ATOM 120 C THR A 8 14.642 -3.160 -7.519 1.00 0.00 C ATOM 121 O THR A 8 14.872 -4.352 -7.454 1.00 0.00 O ATOM 122 CB THR A 8 15.738 -2.695 -9.710 1.00 0.00 C ATOM 123 OG1 THR A 8 16.673 -1.658 -9.449 1.00 0.00 O ATOM 124 CG2 THR A 8 15.377 -2.695 -11.196 1.00 0.00 C ATOM 0 H THR A 8 14.911 -0.537 -8.051 1.00 0.00 H new ATOM 0 HA THR A 8 13.606 -2.886 -9.375 1.00 0.00 H new ATOM 0 HB THR A 8 16.177 -3.657 -9.447 1.00 0.00 H new ATOM 0 HG1 THR A 8 17.481 -1.804 -9.984 1.00 0.00 H new ATOM 0 HG21 THR A 8 16.277 -2.858 -11.789 1.00 0.00 H new ATOM 0 HG22 THR A 8 14.661 -3.492 -11.397 1.00 0.00 H new ATOM 0 HG23 THR A 8 14.935 -1.735 -11.463 1.00 0.00 H new ATOM 132 N ASN A 9 14.533 -2.440 -6.442 1.00 0.00 N ATOM 133 CA ASN A 9 14.692 -3.091 -5.113 1.00 0.00 C ATOM 134 C ASN A 9 13.328 -3.520 -4.587 1.00 0.00 C ATOM 135 O ASN A 9 12.882 -4.611 -4.850 1.00 0.00 O ATOM 136 CB ASN A 9 15.346 -2.116 -4.132 1.00 0.00 C ATOM 137 CG ASN A 9 16.832 -2.456 -4.000 1.00 0.00 C ATOM 138 OD1 ASN A 9 17.230 -3.583 -4.215 1.00 0.00 O ATOM 139 ND2 ASN A 9 17.676 -1.523 -3.654 1.00 0.00 N ATOM 0 H ASN A 9 14.343 -1.438 -6.421 1.00 0.00 H new ATOM 0 HA ASN A 9 15.329 -3.970 -5.217 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.225 -1.091 -4.484 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.859 -2.179 -3.159 1.00 0.00 H new ATOM 0 HD21 ASN A 9 18.668 -1.741 -3.564 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.343 -0.576 -3.473 1.00 0.00 H new ATOM 146 N LEU A 10 12.663 -2.681 -3.844 1.00 0.00 N ATOM 147 CA LEU A 10 11.327 -3.068 -3.303 1.00 0.00 C ATOM 148 C LEU A 10 10.421 -3.543 -4.435 1.00 0.00 C ATOM 149 O LEU A 10 9.549 -4.365 -4.236 1.00 0.00 O ATOM 150 CB LEU A 10 10.674 -1.865 -2.627 1.00 0.00 C ATOM 151 CG LEU A 10 10.516 -2.147 -1.136 1.00 0.00 C ATOM 152 CD1 LEU A 10 9.573 -3.336 -0.941 1.00 0.00 C ATOM 153 CD2 LEU A 10 11.884 -2.477 -0.538 1.00 0.00 C ATOM 0 H LEU A 10 12.983 -1.747 -3.588 1.00 0.00 H new ATOM 0 HA LEU A 10 11.465 -3.872 -2.580 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.284 -0.974 -2.777 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.701 -1.665 -3.076 1.00 0.00 H new ATOM 0 HG LEU A 10 10.102 -1.270 -0.638 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.459 -3.539 0.124 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.600 -3.103 -1.372 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.988 -4.214 -1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 10 11.776 -2.679 0.528 1.00 0.00 H new ATOM 0 HD22 LEU A 10 12.296 -3.356 -1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 10 12.557 -1.631 -0.680 1.00 0.00 H new ATOM 165 N VAL A 11 10.603 -3.029 -5.619 1.00 0.00 N ATOM 166 CA VAL A 11 9.727 -3.457 -6.741 1.00 0.00 C ATOM 167 C VAL A 11 10.331 -4.681 -7.422 1.00 0.00 C ATOM 168 O VAL A 11 9.712 -5.724 -7.481 1.00 0.00 O ATOM 169 CB VAL A 11 9.581 -2.311 -7.756 1.00 0.00 C ATOM 170 CG1 VAL A 11 9.054 -2.857 -9.086 1.00 0.00 C ATOM 171 CG2 VAL A 11 8.595 -1.275 -7.210 1.00 0.00 C ATOM 0 H VAL A 11 11.314 -2.337 -5.856 1.00 0.00 H new ATOM 0 HA VAL A 11 8.741 -3.712 -6.352 1.00 0.00 H new ATOM 0 HB VAL A 11 10.554 -1.848 -7.917 1.00 0.00 H new ATOM 0 HG11 VAL A 11 8.953 -2.040 -9.800 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.752 -3.597 -9.478 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.081 -3.323 -8.928 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.489 -0.461 -7.927 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.625 -1.745 -7.049 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.968 -0.880 -6.265 1.00 0.00 H new ATOM 181 N GLY A 12 11.531 -4.569 -7.930 1.00 0.00 N ATOM 182 CA GLY A 12 12.162 -5.747 -8.593 1.00 0.00 C ATOM 183 C GLY A 12 11.875 -6.977 -7.738 1.00 0.00 C ATOM 184 O GLY A 12 11.727 -8.073 -8.236 1.00 0.00 O ATOM 0 H GLY A 12 12.097 -3.720 -7.915 1.00 0.00 H new ATOM 0 HA2 GLY A 12 11.761 -5.879 -9.598 1.00 0.00 H new ATOM 0 HA3 GLY A 12 13.237 -5.596 -8.696 1.00 0.00 H new ATOM 188 N THR A 13 11.762 -6.764 -6.447 1.00 0.00 N ATOM 189 CA THR A 13 11.448 -7.866 -5.493 1.00 0.00 C ATOM 190 C THR A 13 12.123 -7.600 -4.154 1.00 0.00 C ATOM 191 O THR A 13 12.783 -8.458 -3.602 1.00 0.00 O ATOM 192 CB THR A 13 11.965 -9.196 -6.011 1.00 0.00 C ATOM 193 OG1 THR A 13 11.967 -10.150 -4.957 1.00 0.00 O ATOM 194 CG2 THR A 13 13.389 -9.008 -6.544 1.00 0.00 C ATOM 0 H THR A 13 11.878 -5.850 -6.010 1.00 0.00 H new ATOM 0 HA THR A 13 10.364 -7.907 -5.382 1.00 0.00 H new ATOM 0 HB THR A 13 11.320 -9.554 -6.814 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.749 -10.003 -4.384 1.00 0.00 H new ATOM 0 HG21 THR A 13 13.766 -9.960 -6.918 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.381 -8.278 -7.353 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.034 -8.652 -5.741 1.00 0.00 H new ATOM 202 N GLY A 14 11.941 -6.443 -3.603 1.00 0.00 N ATOM 203 CA GLY A 14 12.547 -6.172 -2.275 1.00 0.00 C ATOM 204 C GLY A 14 11.526 -6.589 -1.224 1.00 0.00 C ATOM 205 O GLY A 14 11.578 -6.167 -0.087 1.00 0.00 O ATOM 0 H GLY A 14 11.404 -5.676 -4.008 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.475 -6.731 -2.154 1.00 0.00 H new ATOM 0 HA3 GLY A 14 12.795 -5.116 -2.173 1.00 0.00 H new ATOM 209 N ALA A 15 10.583 -7.414 -1.632 1.00 0.00 N ATOM 210 CA ALA A 15 9.502 -7.886 -0.725 1.00 0.00 C ATOM 211 C ALA A 15 8.248 -8.014 -1.580 1.00 0.00 C ATOM 212 O ALA A 15 7.352 -8.782 -1.289 1.00 0.00 O ATOM 213 CB ALA A 15 9.249 -6.880 0.401 1.00 0.00 C ATOM 0 H ALA A 15 10.525 -7.783 -2.581 1.00 0.00 H new ATOM 0 HA ALA A 15 9.781 -8.833 -0.262 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.454 -7.251 1.048 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.161 -6.750 0.984 1.00 0.00 H new ATOM 0 HB3 ALA A 15 8.952 -5.922 -0.027 1.00 0.00 H new ATOM 219 N VAL A 16 8.194 -7.266 -2.653 1.00 0.00 N ATOM 220 CA VAL A 16 7.025 -7.333 -3.557 1.00 0.00 C ATOM 221 C VAL A 16 7.536 -7.284 -4.994 1.00 0.00 C ATOM 222 O VAL A 16 8.553 -6.682 -5.277 1.00 0.00 O ATOM 223 CB VAL A 16 6.111 -6.135 -3.294 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.604 -6.186 -1.852 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.900 -4.840 -3.510 1.00 0.00 C ATOM 0 H VAL A 16 8.920 -6.609 -2.937 1.00 0.00 H new ATOM 0 HA VAL A 16 6.462 -8.251 -3.388 1.00 0.00 H new ATOM 0 HB VAL A 16 5.263 -6.166 -3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.953 -5.332 -1.665 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.046 -7.109 -1.695 1.00 0.00 H new ATOM 0 HG13 VAL A 16 6.451 -6.153 -1.167 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.252 -3.984 -3.324 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.746 -4.811 -2.824 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.264 -4.803 -4.537 1.00 0.00 H new ATOM 235 N THR A 17 6.844 -7.896 -5.909 1.00 0.00 N ATOM 236 CA THR A 17 7.300 -7.859 -7.325 1.00 0.00 C ATOM 237 C THR A 17 6.730 -6.609 -7.989 1.00 0.00 C ATOM 238 O THR A 17 6.630 -6.527 -9.194 1.00 0.00 O ATOM 239 CB THR A 17 6.796 -9.103 -8.062 1.00 0.00 C ATOM 240 OG1 THR A 17 5.452 -9.363 -7.681 1.00 0.00 O ATOM 241 CG2 THR A 17 7.674 -10.304 -7.707 1.00 0.00 C ATOM 0 H THR A 17 5.985 -8.419 -5.740 1.00 0.00 H new ATOM 0 HA THR A 17 8.389 -7.839 -7.363 1.00 0.00 H new ATOM 0 HB THR A 17 6.843 -8.932 -9.138 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.869 -8.661 -8.038 1.00 0.00 H new ATOM 0 HG21 THR A 17 7.312 -11.187 -8.233 1.00 0.00 H new ATOM 0 HG22 THR A 17 8.704 -10.102 -8.002 1.00 0.00 H new ATOM 0 HG23 THR A 17 7.633 -10.480 -6.632 1.00 0.00 H new ATOM 249 N GLN A 18 6.352 -5.634 -7.202 1.00 0.00 N ATOM 250 CA GLN A 18 5.774 -4.378 -7.771 1.00 0.00 C ATOM 251 C GLN A 18 5.628 -3.337 -6.654 1.00 0.00 C ATOM 252 O GLN A 18 5.822 -3.633 -5.494 1.00 0.00 O ATOM 253 CB GLN A 18 4.386 -4.669 -8.353 1.00 0.00 C ATOM 254 CG GLN A 18 4.509 -5.200 -9.783 1.00 0.00 C ATOM 255 CD GLN A 18 4.149 -6.689 -9.802 1.00 0.00 C ATOM 256 OE1 GLN A 18 3.848 -7.265 -8.775 1.00 0.00 O ATOM 257 NE2 GLN A 18 4.167 -7.339 -10.933 1.00 0.00 N ATOM 0 H GLN A 18 6.419 -5.654 -6.184 1.00 0.00 H new ATOM 0 HA GLN A 18 6.433 -4.001 -8.553 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.869 -5.399 -7.730 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.784 -3.761 -8.346 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.847 -4.645 -10.448 1.00 0.00 H new ATOM 0 HG3 GLN A 18 5.525 -5.055 -10.151 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.420 -6.856 -11.795 1.00 0.00 H new ATOM 0 HE22 GLN A 18 3.928 -8.330 -10.955 1.00 0.00 H new ATOM 266 N ALA A 19 5.276 -2.124 -6.991 1.00 0.00 N ATOM 267 CA ALA A 19 5.106 -1.075 -5.940 1.00 0.00 C ATOM 268 C ALA A 19 4.591 0.217 -6.582 1.00 0.00 C ATOM 269 O ALA A 19 5.067 0.639 -7.618 1.00 0.00 O ATOM 270 CB ALA A 19 6.450 -0.807 -5.258 1.00 0.00 C ATOM 0 H ALA A 19 5.099 -1.814 -7.946 1.00 0.00 H new ATOM 0 HA ALA A 19 4.387 -1.422 -5.198 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.323 -0.042 -4.492 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.813 -1.725 -4.797 1.00 0.00 H new ATOM 0 HB3 ALA A 19 7.172 -0.463 -5.999 1.00 0.00 H new ATOM 276 N ALA A 20 3.615 0.849 -5.980 1.00 0.00 N ATOM 277 CA ALA A 20 3.072 2.107 -6.564 1.00 0.00 C ATOM 278 C ALA A 20 2.942 3.177 -5.478 1.00 0.00 C ATOM 279 O ALA A 20 2.242 3.002 -4.502 1.00 0.00 O ATOM 280 CB ALA A 20 1.690 1.828 -7.159 1.00 0.00 C ATOM 0 H ALA A 20 3.173 0.547 -5.112 1.00 0.00 H new ATOM 0 HA ALA A 20 3.750 2.463 -7.339 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.287 2.745 -7.588 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.775 1.070 -7.938 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.022 1.470 -6.376 1.00 0.00 H new ATOM 286 N ILE A 21 3.599 4.294 -5.644 1.00 0.00 N ATOM 287 CA ILE A 21 3.490 5.377 -4.625 1.00 0.00 C ATOM 288 C ILE A 21 2.266 6.234 -4.952 1.00 0.00 C ATOM 289 O ILE A 21 2.320 7.124 -5.777 1.00 0.00 O ATOM 290 CB ILE A 21 4.752 6.241 -4.650 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.977 5.347 -4.429 1.00 0.00 C ATOM 292 CG2 ILE A 21 4.675 7.292 -3.536 1.00 0.00 C ATOM 293 CD1 ILE A 21 7.194 6.205 -4.074 1.00 0.00 C ATOM 0 H ILE A 21 4.204 4.502 -6.438 1.00 0.00 H new ATOM 0 HA ILE A 21 3.383 4.943 -3.631 1.00 0.00 H new ATOM 0 HB ILE A 21 4.834 6.744 -5.614 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.778 4.635 -3.628 1.00 0.00 H new ATOM 0 HG13 ILE A 21 6.181 4.766 -5.329 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.574 7.908 -3.554 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.800 7.923 -3.691 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.596 6.793 -2.570 1.00 0.00 H new ATOM 0 HD11 ILE A 21 8.060 5.562 -3.919 1.00 0.00 H new ATOM 0 HD12 ILE A 21 7.400 6.900 -4.888 1.00 0.00 H new ATOM 0 HD13 ILE A 21 6.990 6.766 -3.162 1.00 0.00 H new ATOM 305 N LEU A 22 1.160 5.964 -4.316 1.00 0.00 N ATOM 306 CA LEU A 22 -0.072 6.751 -4.593 1.00 0.00 C ATOM 307 C LEU A 22 0.008 8.089 -3.851 1.00 0.00 C ATOM 308 O LEU A 22 0.974 8.371 -3.172 1.00 0.00 O ATOM 309 CB LEU A 22 -1.295 5.962 -4.113 1.00 0.00 C ATOM 310 CG LEU A 22 -1.457 4.687 -4.952 1.00 0.00 C ATOM 311 CD1 LEU A 22 -1.450 5.041 -6.439 1.00 0.00 C ATOM 312 CD2 LEU A 22 -0.303 3.725 -4.662 1.00 0.00 C ATOM 0 H LEU A 22 1.057 5.230 -3.615 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.161 6.936 -5.663 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.181 5.703 -3.060 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.191 6.578 -4.195 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.403 4.212 -4.693 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.565 4.132 -7.030 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.274 5.721 -6.655 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -0.506 5.522 -6.694 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.423 2.822 -5.260 1.00 0.00 H new ATOM 0 HD22 LEU A 22 0.643 4.205 -4.915 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.305 3.462 -3.604 1.00 0.00 H new ATOM 324 N GLY A 23 -0.995 8.915 -3.978 1.00 0.00 N ATOM 325 CA GLY A 23 -0.966 10.233 -3.279 1.00 0.00 C ATOM 326 C GLY A 23 -2.304 10.478 -2.579 1.00 0.00 C ATOM 327 O GLY A 23 -3.301 10.767 -3.210 1.00 0.00 O ATOM 0 H GLY A 23 -1.831 8.736 -4.534 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -0.155 10.251 -2.550 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.768 11.031 -3.995 1.00 0.00 H new ATOM 331 N LEU A 24 -2.335 10.368 -1.278 1.00 0.00 N ATOM 332 CA LEU A 24 -3.611 10.597 -0.541 1.00 0.00 C ATOM 333 C LEU A 24 -4.208 11.941 -0.961 1.00 0.00 C ATOM 334 O LEU A 24 -5.406 12.084 -1.097 1.00 0.00 O ATOM 335 CB LEU A 24 -3.347 10.612 0.968 1.00 0.00 C ATOM 336 CG LEU A 24 -1.968 11.214 1.252 1.00 0.00 C ATOM 337 CD1 LEU A 24 -2.099 12.329 2.292 1.00 0.00 C ATOM 338 CD2 LEU A 24 -1.040 10.127 1.795 1.00 0.00 C ATOM 0 H LEU A 24 -1.533 10.130 -0.694 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.308 9.793 -0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.118 11.193 1.475 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.399 9.598 1.365 1.00 0.00 H new ATOM 0 HG LEU A 24 -1.556 11.622 0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.117 12.756 2.493 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.762 13.106 1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.512 11.920 3.214 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.058 10.555 1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.456 9.721 2.717 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.944 9.330 1.058 1.00 0.00 H new ATOM 350 N ASP A 25 -3.381 12.929 -1.166 1.00 0.00 N ATOM 351 CA ASP A 25 -3.903 14.263 -1.574 1.00 0.00 C ATOM 352 C ASP A 25 -2.994 14.859 -2.653 1.00 0.00 C ATOM 353 O ASP A 25 -2.774 16.052 -2.701 1.00 0.00 O ATOM 354 CB ASP A 25 -3.928 15.192 -0.358 1.00 0.00 C ATOM 355 CG ASP A 25 -2.497 15.596 0.004 1.00 0.00 C ATOM 356 OD1 ASP A 25 -1.707 14.710 0.289 1.00 0.00 O ATOM 357 OD2 ASP A 25 -2.215 16.782 -0.013 1.00 0.00 O ATOM 0 H ASP A 25 -2.367 12.870 -1.069 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.913 14.154 -1.970 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.523 16.078 -0.576 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.401 14.691 0.487 1.00 0.00 H new ATOM 362 N GLY A 26 -2.462 14.039 -3.518 1.00 0.00 N ATOM 363 CA GLY A 26 -1.567 14.566 -4.586 1.00 0.00 C ATOM 364 C GLY A 26 -2.037 14.057 -5.949 1.00 0.00 C ATOM 365 O GLY A 26 -2.990 14.557 -6.516 1.00 0.00 O ATOM 0 H GLY A 26 -2.608 13.030 -3.531 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.571 15.656 -4.573 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -0.540 14.249 -4.403 1.00 0.00 H new ATOM 369 N ASN A 27 -1.371 13.071 -6.484 1.00 0.00 N ATOM 370 CA ASN A 27 -1.773 12.534 -7.815 1.00 0.00 C ATOM 371 C ASN A 27 -0.754 11.484 -8.269 1.00 0.00 C ATOM 372 O ASN A 27 -0.223 11.555 -9.360 1.00 0.00 O ATOM 373 CB ASN A 27 -1.810 13.676 -8.833 1.00 0.00 C ATOM 374 CG ASN A 27 -0.742 14.714 -8.479 1.00 0.00 C ATOM 375 OD1 ASN A 27 -0.993 15.902 -8.526 1.00 0.00 O ATOM 376 ND2 ASN A 27 0.449 14.313 -8.125 1.00 0.00 N ATOM 0 H ASN A 27 -0.565 12.614 -6.057 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.760 12.078 -7.741 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.636 13.288 -9.837 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.796 14.141 -8.838 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.168 14.997 -7.888 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.661 13.316 -8.085 1.00 0.00 H new ATOM 383 N THR A 28 -0.473 10.506 -7.445 1.00 0.00 N ATOM 384 CA THR A 28 0.508 9.464 -7.842 1.00 0.00 C ATOM 385 C THR A 28 1.857 10.130 -8.137 1.00 0.00 C ATOM 386 O THR A 28 2.074 10.668 -9.204 1.00 0.00 O ATOM 387 CB THR A 28 -0.019 8.744 -9.087 1.00 0.00 C ATOM 388 OG1 THR A 28 -0.936 7.734 -8.689 1.00 0.00 O ATOM 389 CG2 THR A 28 1.135 8.106 -9.868 1.00 0.00 C ATOM 0 H THR A 28 -0.882 10.389 -6.518 1.00 0.00 H new ATOM 0 HA THR A 28 0.644 8.739 -7.039 1.00 0.00 H new ATOM 0 HB THR A 28 -0.517 9.469 -9.731 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.278 7.271 -9.482 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.742 7.599 -10.749 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.837 8.880 -10.178 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.649 7.384 -9.233 1.00 0.00 H new ATOM 397 N TRP A 29 2.762 10.100 -7.196 1.00 0.00 N ATOM 398 CA TRP A 29 4.093 10.735 -7.416 1.00 0.00 C ATOM 399 C TRP A 29 5.013 9.759 -8.152 1.00 0.00 C ATOM 400 O TRP A 29 5.897 10.157 -8.884 1.00 0.00 O ATOM 401 CB TRP A 29 4.713 11.096 -6.064 1.00 0.00 C ATOM 402 CG TRP A 29 3.861 12.113 -5.377 1.00 0.00 C ATOM 403 CD1 TRP A 29 2.662 12.552 -5.824 1.00 0.00 C ATOM 404 CD2 TRP A 29 4.120 12.822 -4.132 1.00 0.00 C ATOM 405 NE1 TRP A 29 2.169 13.488 -4.931 1.00 0.00 N ATOM 406 CE2 TRP A 29 3.033 13.689 -3.872 1.00 0.00 C ATOM 407 CE3 TRP A 29 5.184 12.799 -3.213 1.00 0.00 C ATOM 408 CZ2 TRP A 29 3.000 14.502 -2.739 1.00 0.00 C ATOM 409 CZ3 TRP A 29 5.155 13.616 -2.071 1.00 0.00 C ATOM 410 CH2 TRP A 29 4.065 14.467 -1.835 1.00 0.00 C ATOM 0 H TRP A 29 2.637 9.662 -6.283 1.00 0.00 H new ATOM 0 HA TRP A 29 3.969 11.637 -8.015 1.00 0.00 H new ATOM 0 HB2 TRP A 29 4.803 10.204 -5.444 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.720 11.488 -6.207 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.170 12.226 -6.729 1.00 0.00 H new ATOM 0 HE1 TRP A 29 1.277 13.970 -5.041 1.00 0.00 H new ATOM 0 HE3 TRP A 29 6.029 12.149 -3.386 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.157 15.154 -2.562 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 5.977 13.589 -1.370 1.00 0.00 H new ATOM 0 HH2 TRP A 29 4.049 15.094 -0.956 1.00 0.00 H new ATOM 421 N ALA A 30 4.816 8.484 -7.962 1.00 0.00 N ATOM 422 CA ALA A 30 5.683 7.486 -8.650 1.00 0.00 C ATOM 423 C ALA A 30 4.957 6.143 -8.716 1.00 0.00 C ATOM 424 O ALA A 30 4.057 5.878 -7.945 1.00 0.00 O ATOM 425 CB ALA A 30 6.990 7.323 -7.871 1.00 0.00 C ATOM 0 H ALA A 30 4.093 8.090 -7.361 1.00 0.00 H new ATOM 0 HA ALA A 30 5.904 7.830 -9.660 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.625 6.593 -8.374 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.507 8.281 -7.823 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.771 6.978 -6.861 1.00 0.00 H new ATOM 431 N THR A 31 5.337 5.295 -9.631 1.00 0.00 N ATOM 432 CA THR A 31 4.666 3.970 -9.741 1.00 0.00 C ATOM 433 C THR A 31 5.568 3.001 -10.505 1.00 0.00 C ATOM 434 O THR A 31 6.367 3.398 -11.329 1.00 0.00 O ATOM 435 CB THR A 31 3.341 4.131 -10.492 1.00 0.00 C ATOM 436 OG1 THR A 31 2.923 2.866 -10.986 1.00 0.00 O ATOM 437 CG2 THR A 31 3.529 5.101 -11.660 1.00 0.00 C ATOM 0 H THR A 31 6.083 5.462 -10.307 1.00 0.00 H new ATOM 0 HA THR A 31 4.475 3.577 -8.743 1.00 0.00 H new ATOM 0 HB THR A 31 2.584 4.525 -9.814 1.00 0.00 H new ATOM 0 HG1 THR A 31 2.074 2.966 -11.466 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.586 5.215 -12.194 1.00 0.00 H new ATOM 0 HG22 THR A 31 3.850 6.071 -11.280 1.00 0.00 H new ATOM 0 HG23 THR A 31 4.286 4.709 -12.340 1.00 0.00 H new ATOM 445 N SER A 32 5.445 1.730 -10.236 1.00 0.00 N ATOM 446 CA SER A 32 6.295 0.731 -10.943 1.00 0.00 C ATOM 447 C SER A 32 5.783 -0.676 -10.640 1.00 0.00 C ATOM 448 O SER A 32 6.496 -1.503 -10.108 1.00 0.00 O ATOM 449 CB SER A 32 7.734 0.854 -10.452 1.00 0.00 C ATOM 450 OG SER A 32 8.261 2.113 -10.846 1.00 0.00 O ATOM 0 H SER A 32 4.792 1.340 -9.556 1.00 0.00 H new ATOM 0 HA SER A 32 6.254 0.914 -12.017 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.769 0.756 -9.367 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.341 0.048 -10.865 1.00 0.00 H new ATOM 0 HG SER A 32 7.655 2.534 -11.491 1.00 0.00 H new ATOM 456 N ALA A 33 4.552 -0.954 -10.963 1.00 0.00 N ATOM 457 CA ALA A 33 4.001 -2.308 -10.682 1.00 0.00 C ATOM 458 C ALA A 33 3.554 -2.966 -11.988 1.00 0.00 C ATOM 459 O ALA A 33 4.110 -3.959 -12.417 1.00 0.00 O ATOM 460 CB ALA A 33 2.802 -2.180 -9.741 1.00 0.00 C ATOM 0 H ALA A 33 3.904 -0.304 -11.409 1.00 0.00 H new ATOM 0 HA ALA A 33 4.771 -2.922 -10.216 1.00 0.00 H new ATOM 0 HB1 ALA A 33 2.396 -3.170 -9.533 1.00 0.00 H new ATOM 0 HB2 ALA A 33 3.120 -1.715 -8.808 1.00 0.00 H new ATOM 0 HB3 ALA A 33 2.035 -1.564 -10.211 1.00 0.00 H new ATOM 466 N GLY A 34 2.546 -2.431 -12.617 1.00 0.00 N ATOM 467 CA GLY A 34 2.053 -3.032 -13.887 1.00 0.00 C ATOM 468 C GLY A 34 0.528 -3.106 -13.837 1.00 0.00 C ATOM 469 O GLY A 34 -0.149 -2.882 -14.821 1.00 0.00 O ATOM 0 H GLY A 34 2.041 -1.601 -12.306 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.374 -2.432 -14.738 1.00 0.00 H new ATOM 0 HA3 GLY A 34 2.475 -4.028 -14.022 1.00 0.00 H new ATOM 473 N PHE A 35 -0.018 -3.410 -12.691 1.00 0.00 N ATOM 474 CA PHE A 35 -1.499 -3.489 -12.566 1.00 0.00 C ATOM 475 C PHE A 35 -2.114 -2.139 -12.942 1.00 0.00 C ATOM 476 O PHE A 35 -1.417 -1.193 -13.250 1.00 0.00 O ATOM 477 CB PHE A 35 -1.881 -3.866 -11.130 1.00 0.00 C ATOM 478 CG PHE A 35 -1.692 -2.694 -10.189 1.00 0.00 C ATOM 479 CD1 PHE A 35 -0.638 -1.783 -10.373 1.00 0.00 C ATOM 480 CD2 PHE A 35 -2.574 -2.525 -9.114 1.00 0.00 C ATOM 481 CE1 PHE A 35 -0.472 -0.714 -9.483 1.00 0.00 C ATOM 482 CE2 PHE A 35 -2.407 -1.455 -8.228 1.00 0.00 C ATOM 483 CZ PHE A 35 -1.357 -0.550 -8.411 1.00 0.00 C ATOM 0 H PHE A 35 0.500 -3.607 -11.835 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.881 -4.255 -13.241 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.920 -4.195 -11.101 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.271 -4.706 -10.797 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.044 -1.907 -11.201 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -3.385 -3.223 -8.969 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.340 -0.016 -9.624 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.090 -1.328 -7.401 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.229 0.275 -7.726 1.00 0.00 H new ATOM 493 N ALA A 36 -3.416 -2.046 -12.936 1.00 0.00 N ATOM 494 CA ALA A 36 -4.070 -0.761 -13.315 1.00 0.00 C ATOM 495 C ALA A 36 -4.324 0.096 -12.073 1.00 0.00 C ATOM 496 O ALA A 36 -4.710 -0.394 -11.030 1.00 0.00 O ATOM 497 CB ALA A 36 -5.401 -1.057 -14.006 1.00 0.00 C ATOM 0 H ALA A 36 -4.054 -2.802 -12.686 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.412 -0.215 -13.991 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.883 -0.120 -14.285 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.222 -1.653 -14.901 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.049 -1.610 -13.326 1.00 0.00 H new ATOM 503 N VAL A 37 -4.121 1.381 -12.190 1.00 0.00 N ATOM 504 CA VAL A 37 -4.357 2.293 -11.037 1.00 0.00 C ATOM 505 C VAL A 37 -4.796 3.658 -11.581 1.00 0.00 C ATOM 506 O VAL A 37 -4.234 4.170 -12.529 1.00 0.00 O ATOM 507 CB VAL A 37 -3.061 2.409 -10.205 1.00 0.00 C ATOM 508 CG1 VAL A 37 -2.723 3.873 -9.890 1.00 0.00 C ATOM 509 CG2 VAL A 37 -3.251 1.649 -8.891 1.00 0.00 C ATOM 0 H VAL A 37 -3.799 1.840 -13.042 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.141 1.905 -10.387 1.00 0.00 H new ATOM 0 HB VAL A 37 -2.240 1.987 -10.785 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.805 3.916 -9.303 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -2.585 4.423 -10.821 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -3.538 4.320 -9.322 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -2.342 1.723 -8.293 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.085 2.081 -8.338 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.461 0.601 -9.104 1.00 0.00 H new ATOM 519 N THR A 38 -5.801 4.247 -10.993 1.00 0.00 N ATOM 520 CA THR A 38 -6.276 5.571 -11.481 1.00 0.00 C ATOM 521 C THR A 38 -6.458 6.524 -10.291 1.00 0.00 C ATOM 522 O THR A 38 -7.276 6.274 -9.428 1.00 0.00 O ATOM 523 CB THR A 38 -7.616 5.390 -12.198 1.00 0.00 C ATOM 524 OG1 THR A 38 -8.609 5.003 -11.258 1.00 0.00 O ATOM 525 CG2 THR A 38 -7.480 4.309 -13.272 1.00 0.00 C ATOM 0 H THR A 38 -6.313 3.868 -10.196 1.00 0.00 H new ATOM 0 HA THR A 38 -5.543 5.991 -12.170 1.00 0.00 H new ATOM 0 HB THR A 38 -7.906 6.331 -12.666 1.00 0.00 H new ATOM 0 HG1 THR A 38 -8.559 5.585 -10.471 1.00 0.00 H new ATOM 0 HG21 THR A 38 -8.435 4.181 -13.782 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.720 4.607 -13.994 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.188 3.368 -12.806 1.00 0.00 H new ATOM 533 N PRO A 39 -5.692 7.590 -10.276 1.00 0.00 N ATOM 534 CA PRO A 39 -5.764 8.587 -9.193 1.00 0.00 C ATOM 535 C PRO A 39 -7.181 9.158 -9.087 1.00 0.00 C ATOM 536 O PRO A 39 -7.682 9.783 -10.002 1.00 0.00 O ATOM 537 CB PRO A 39 -4.764 9.679 -9.596 1.00 0.00 C ATOM 538 CG PRO A 39 -4.075 9.226 -10.909 1.00 0.00 C ATOM 539 CD PRO A 39 -4.702 7.887 -11.326 1.00 0.00 C ATOM 0 HA PRO A 39 -5.528 8.159 -8.219 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -5.275 10.631 -9.741 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.025 9.830 -8.809 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -4.213 9.973 -11.691 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -3.001 9.116 -10.759 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -5.175 7.960 -12.306 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.949 7.102 -11.393 1.00 0.00 H new ATOM 547 N ALA A 40 -7.830 8.944 -7.976 1.00 0.00 N ATOM 548 CA ALA A 40 -9.215 9.467 -7.801 1.00 0.00 C ATOM 549 C ALA A 40 -9.880 8.735 -6.635 1.00 0.00 C ATOM 550 O ALA A 40 -10.209 9.324 -5.625 1.00 0.00 O ATOM 551 CB ALA A 40 -10.017 9.227 -9.082 1.00 0.00 C ATOM 0 H ALA A 40 -7.459 8.427 -7.178 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.182 10.536 -7.593 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -11.030 9.609 -8.954 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.537 9.742 -9.914 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.057 8.158 -9.292 1.00 0.00 H new ATOM 557 N GLN A 41 -10.075 7.450 -6.762 1.00 0.00 N ATOM 558 CA GLN A 41 -10.709 6.680 -5.655 1.00 0.00 C ATOM 559 C GLN A 41 -9.752 6.637 -4.461 1.00 0.00 C ATOM 560 O GLN A 41 -10.124 6.261 -3.367 1.00 0.00 O ATOM 561 CB GLN A 41 -11.004 5.254 -6.126 1.00 0.00 C ATOM 562 CG GLN A 41 -12.031 5.289 -7.260 1.00 0.00 C ATOM 563 CD GLN A 41 -13.430 5.491 -6.675 1.00 0.00 C ATOM 564 OE1 GLN A 41 -14.184 4.548 -6.535 1.00 0.00 O ATOM 565 NE2 GLN A 41 -13.811 6.689 -6.324 1.00 0.00 N ATOM 0 H GLN A 41 -9.823 6.901 -7.584 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.642 7.162 -5.361 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.086 4.776 -6.468 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -11.384 4.658 -5.296 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -11.795 6.096 -7.954 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.993 4.359 -7.828 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -13.178 7.480 -6.441 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -14.742 6.834 -5.932 1.00 0.00 H new ATOM 574 N GLY A 42 -8.520 7.020 -4.667 1.00 0.00 N ATOM 575 CA GLY A 42 -7.535 7.005 -3.548 1.00 0.00 C ATOM 576 C GLY A 42 -8.071 7.841 -2.386 1.00 0.00 C ATOM 577 O GLY A 42 -7.704 7.639 -1.245 1.00 0.00 O ATOM 0 H GLY A 42 -8.154 7.343 -5.563 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.356 5.981 -3.221 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.578 7.404 -3.886 1.00 0.00 H new ATOM 581 N GLN A 43 -8.938 8.777 -2.664 1.00 0.00 N ATOM 582 CA GLN A 43 -9.496 9.620 -1.571 1.00 0.00 C ATOM 583 C GLN A 43 -10.400 8.764 -0.683 1.00 0.00 C ATOM 584 O GLN A 43 -10.247 8.725 0.521 1.00 0.00 O ATOM 585 CB GLN A 43 -10.311 10.768 -2.173 1.00 0.00 C ATOM 586 CG GLN A 43 -10.475 11.876 -1.131 1.00 0.00 C ATOM 587 CD GLN A 43 -11.688 12.739 -1.487 1.00 0.00 C ATOM 588 OE1 GLN A 43 -12.208 12.653 -2.582 1.00 0.00 O ATOM 589 NE2 GLN A 43 -12.162 13.574 -0.602 1.00 0.00 N ATOM 0 H GLN A 43 -9.283 8.993 -3.599 1.00 0.00 H new ATOM 0 HA GLN A 43 -8.680 10.030 -0.975 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -9.810 11.158 -3.059 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.288 10.406 -2.492 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -10.604 11.441 -0.140 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -9.576 12.491 -1.095 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -11.725 13.646 0.317 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -12.969 14.155 -0.830 1.00 0.00 H new ATOM 598 N THR A 44 -11.340 8.075 -1.271 1.00 0.00 N ATOM 599 CA THR A 44 -12.252 7.219 -0.461 1.00 0.00 C ATOM 600 C THR A 44 -11.423 6.202 0.325 1.00 0.00 C ATOM 601 O THR A 44 -11.831 5.723 1.364 1.00 0.00 O ATOM 602 CB THR A 44 -13.219 6.483 -1.390 1.00 0.00 C ATOM 603 OG1 THR A 44 -13.841 7.418 -2.260 1.00 0.00 O ATOM 604 CG2 THR A 44 -14.285 5.769 -0.558 1.00 0.00 C ATOM 0 H THR A 44 -11.515 8.068 -2.276 1.00 0.00 H new ATOM 0 HA THR A 44 -12.819 7.841 0.232 1.00 0.00 H new ATOM 0 HB THR A 44 -12.670 5.748 -1.979 1.00 0.00 H new ATOM 0 HG1 THR A 44 -14.460 6.948 -2.857 1.00 0.00 H new ATOM 0 HG21 THR A 44 -14.973 5.245 -1.221 1.00 0.00 H new ATOM 0 HG22 THR A 44 -13.806 5.052 0.108 1.00 0.00 H new ATOM 0 HG23 THR A 44 -14.836 6.501 0.032 1.00 0.00 H new ATOM 612 N LEU A 45 -10.260 5.870 -0.163 1.00 0.00 N ATOM 613 CA LEU A 45 -9.403 4.885 0.553 1.00 0.00 C ATOM 614 C LEU A 45 -8.972 5.468 1.902 1.00 0.00 C ATOM 615 O LEU A 45 -8.995 4.798 2.915 1.00 0.00 O ATOM 616 CB LEU A 45 -8.164 4.582 -0.297 1.00 0.00 C ATOM 617 CG LEU A 45 -7.206 3.685 0.487 1.00 0.00 C ATOM 618 CD1 LEU A 45 -7.032 2.357 -0.253 1.00 0.00 C ATOM 619 CD2 LEU A 45 -5.847 4.377 0.611 1.00 0.00 C ATOM 0 H LEU A 45 -9.866 6.239 -1.028 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.963 3.965 0.721 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -8.459 4.092 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -7.664 5.511 -0.572 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.613 3.499 1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.349 1.716 0.305 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.999 1.863 -0.346 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.624 2.545 -1.246 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -5.163 3.738 1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.440 4.561 -0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.968 5.325 1.135 1.00 0.00 H new ATOM 631 N ALA A 46 -8.579 6.711 1.922 1.00 0.00 N ATOM 632 CA ALA A 46 -8.144 7.338 3.203 1.00 0.00 C ATOM 633 C ALA A 46 -9.299 7.322 4.210 1.00 0.00 C ATOM 634 O ALA A 46 -9.090 7.249 5.405 1.00 0.00 O ATOM 635 CB ALA A 46 -7.722 8.784 2.942 1.00 0.00 C ATOM 0 H ALA A 46 -8.540 7.321 1.106 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.304 6.776 3.610 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -7.404 9.245 3.877 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -6.896 8.799 2.230 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -8.565 9.341 2.532 1.00 0.00 H new ATOM 641 N SER A 47 -10.513 7.397 3.738 1.00 0.00 N ATOM 642 CA SER A 47 -11.677 7.397 4.672 1.00 0.00 C ATOM 643 C SER A 47 -11.778 6.047 5.386 1.00 0.00 C ATOM 644 O SER A 47 -12.231 5.964 6.510 1.00 0.00 O ATOM 645 CB SER A 47 -12.961 7.650 3.881 1.00 0.00 C ATOM 646 OG SER A 47 -13.562 6.405 3.552 1.00 0.00 O ATOM 0 H SER A 47 -10.750 7.458 2.748 1.00 0.00 H new ATOM 0 HA SER A 47 -11.539 8.183 5.414 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.651 8.256 4.469 1.00 0.00 H new ATOM 0 HB3 SER A 47 -12.738 8.211 2.973 1.00 0.00 H new ATOM 0 HG SER A 47 -13.079 5.996 2.804 1.00 0.00 H new ATOM 652 N ALA A 48 -11.367 4.987 4.744 1.00 0.00 N ATOM 653 CA ALA A 48 -11.449 3.647 5.395 1.00 0.00 C ATOM 654 C ALA A 48 -10.249 3.444 6.322 1.00 0.00 C ATOM 655 O ALA A 48 -10.205 2.512 7.098 1.00 0.00 O ATOM 656 CB ALA A 48 -11.450 2.555 4.323 1.00 0.00 C ATOM 0 H ALA A 48 -10.979 4.990 3.801 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.369 3.590 5.977 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -11.510 1.577 4.800 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -12.309 2.691 3.666 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -10.532 2.618 3.739 1.00 0.00 H new ATOM 662 N PHE A 49 -9.273 4.305 6.244 1.00 0.00 N ATOM 663 CA PHE A 49 -8.077 4.148 7.120 1.00 0.00 C ATOM 664 C PHE A 49 -8.295 4.912 8.427 1.00 0.00 C ATOM 665 O PHE A 49 -7.364 5.189 9.156 1.00 0.00 O ATOM 666 CB PHE A 49 -6.844 4.693 6.399 1.00 0.00 C ATOM 667 CG PHE A 49 -6.403 3.699 5.350 1.00 0.00 C ATOM 668 CD1 PHE A 49 -7.327 3.211 4.418 1.00 0.00 C ATOM 669 CD2 PHE A 49 -5.073 3.265 5.307 1.00 0.00 C ATOM 670 CE1 PHE A 49 -6.924 2.291 3.446 1.00 0.00 C ATOM 671 CE2 PHE A 49 -4.669 2.345 4.332 1.00 0.00 C ATOM 672 CZ PHE A 49 -5.596 1.859 3.402 1.00 0.00 C ATOM 0 H PHE A 49 -9.251 5.107 5.615 1.00 0.00 H new ATOM 0 HA PHE A 49 -7.925 3.092 7.345 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.074 5.652 5.935 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.039 4.869 7.112 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -8.353 3.546 4.450 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.359 3.640 6.025 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -7.639 1.914 2.729 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.643 2.010 4.297 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.284 1.149 2.650 1.00 0.00 H new ATOM 682 N ASN A 50 -9.518 5.246 8.732 1.00 0.00 N ATOM 683 CA ASN A 50 -9.795 5.984 9.996 1.00 0.00 C ATOM 684 C ASN A 50 -10.271 4.997 11.066 1.00 0.00 C ATOM 685 O ASN A 50 -10.653 5.380 12.154 1.00 0.00 O ATOM 686 CB ASN A 50 -10.880 7.033 9.749 1.00 0.00 C ATOM 687 CG ASN A 50 -10.258 8.262 9.086 1.00 0.00 C ATOM 688 OD1 ASN A 50 -9.513 8.992 9.710 1.00 0.00 O ATOM 689 ND2 ASN A 50 -10.531 8.524 7.837 1.00 0.00 N ATOM 0 H ASN A 50 -10.338 5.040 8.161 1.00 0.00 H new ATOM 0 HA ASN A 50 -8.885 6.479 10.336 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.662 6.620 9.112 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -11.351 7.314 10.691 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -10.119 9.341 7.385 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -11.156 7.912 7.312 1.00 0.00 H new ATOM 696 N ASN A 51 -10.251 3.726 10.764 1.00 0.00 N ATOM 697 CA ASN A 51 -10.698 2.711 11.759 1.00 0.00 C ATOM 698 C ASN A 51 -10.489 1.309 11.181 1.00 0.00 C ATOM 699 O ASN A 51 -10.322 1.137 9.990 1.00 0.00 O ATOM 700 CB ASN A 51 -12.180 2.920 12.072 1.00 0.00 C ATOM 701 CG ASN A 51 -12.377 2.967 13.589 1.00 0.00 C ATOM 702 OD1 ASN A 51 -13.297 2.371 14.114 1.00 0.00 O ATOM 703 ND2 ASN A 51 -11.543 3.654 14.320 1.00 0.00 N ATOM 0 H ASN A 51 -9.943 3.347 9.868 1.00 0.00 H new ATOM 0 HA ASN A 51 -10.117 2.818 12.675 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -12.531 3.847 11.620 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -12.771 2.112 11.642 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.663 3.691 15.332 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -10.771 4.154 13.879 1.00 0.00 H new ATOM 710 N ALA A 52 -10.493 0.305 12.015 1.00 0.00 N ATOM 711 CA ALA A 52 -10.291 -1.084 11.511 1.00 0.00 C ATOM 712 C ALA A 52 -11.639 -1.804 11.424 1.00 0.00 C ATOM 713 O ALA A 52 -11.718 -2.942 11.005 1.00 0.00 O ATOM 714 CB ALA A 52 -9.370 -1.843 12.469 1.00 0.00 C ATOM 0 H ALA A 52 -10.627 0.386 13.023 1.00 0.00 H new ATOM 0 HA ALA A 52 -9.838 -1.046 10.520 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -9.221 -2.859 12.102 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -8.408 -1.334 12.529 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -9.824 -1.878 13.459 1.00 0.00 H new ATOM 720 N ASP A 53 -12.699 -1.154 11.819 1.00 0.00 N ATOM 721 CA ASP A 53 -14.038 -1.806 11.762 1.00 0.00 C ATOM 722 C ASP A 53 -14.546 -1.843 10.315 1.00 0.00 C ATOM 723 O ASP A 53 -14.888 -2.895 9.812 1.00 0.00 O ATOM 724 CB ASP A 53 -15.024 -1.022 12.631 1.00 0.00 C ATOM 725 CG ASP A 53 -15.269 -1.784 13.933 1.00 0.00 C ATOM 726 OD1 ASP A 53 -14.440 -2.611 14.278 1.00 0.00 O ATOM 727 OD2 ASP A 53 -16.280 -1.528 14.566 1.00 0.00 O ATOM 0 H ASP A 53 -12.696 -0.200 12.179 1.00 0.00 H new ATOM 0 HA ASP A 53 -13.953 -2.827 12.134 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -14.627 -0.030 12.846 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -15.964 -0.880 12.097 1.00 0.00 H new ATOM 732 N PRO A 54 -14.590 -0.693 9.687 1.00 0.00 N ATOM 733 CA PRO A 54 -15.065 -0.580 8.296 1.00 0.00 C ATOM 734 C PRO A 54 -14.174 -1.394 7.352 1.00 0.00 C ATOM 735 O PRO A 54 -14.507 -1.605 6.203 1.00 0.00 O ATOM 736 CB PRO A 54 -14.973 0.917 7.969 1.00 0.00 C ATOM 737 CG PRO A 54 -14.441 1.643 9.230 1.00 0.00 C ATOM 738 CD PRO A 54 -14.177 0.580 10.307 1.00 0.00 C ATOM 0 HA PRO A 54 -16.077 -0.966 8.176 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.307 1.083 7.122 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -15.951 1.308 7.687 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.526 2.189 8.999 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -15.167 2.374 9.585 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -13.125 0.558 10.592 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -14.749 0.783 11.212 1.00 0.00 H new ATOM 746 N ILE A 55 -13.048 -1.857 7.824 1.00 0.00 N ATOM 747 CA ILE A 55 -12.149 -2.659 6.943 1.00 0.00 C ATOM 748 C ILE A 55 -11.979 -4.065 7.524 1.00 0.00 C ATOM 749 O ILE A 55 -11.464 -4.954 6.876 1.00 0.00 O ATOM 750 CB ILE A 55 -10.779 -1.981 6.832 1.00 0.00 C ATOM 751 CG1 ILE A 55 -10.516 -1.135 8.080 1.00 0.00 C ATOM 752 CG2 ILE A 55 -10.757 -1.083 5.595 1.00 0.00 C ATOM 753 CD1 ILE A 55 -9.164 -0.430 7.945 1.00 0.00 C ATOM 0 H ILE A 55 -12.712 -1.716 8.777 1.00 0.00 H new ATOM 0 HA ILE A 55 -12.594 -2.727 5.950 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.005 -2.744 6.746 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.310 -0.399 8.207 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -10.521 -1.767 8.968 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.784 -0.599 5.514 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.938 -1.685 4.705 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.533 -0.323 5.683 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -8.977 0.172 8.834 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -8.375 -1.174 7.839 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -9.176 0.215 7.066 1.00 0.00 H new ATOM 765 N ARG A 56 -12.416 -4.278 8.735 1.00 0.00 N ATOM 766 CA ARG A 56 -12.284 -5.632 9.342 1.00 0.00 C ATOM 767 C ARG A 56 -13.606 -6.385 9.188 1.00 0.00 C ATOM 768 O ARG A 56 -14.089 -7.013 10.110 1.00 0.00 O ATOM 769 CB ARG A 56 -11.944 -5.508 10.829 1.00 0.00 C ATOM 770 CG ARG A 56 -11.817 -6.908 11.431 1.00 0.00 C ATOM 771 CD ARG A 56 -12.658 -7.000 12.704 1.00 0.00 C ATOM 772 NE ARG A 56 -11.883 -7.730 13.756 1.00 0.00 N ATOM 773 CZ ARG A 56 -11.310 -8.878 13.500 1.00 0.00 C ATOM 774 NH1 ARG A 56 -11.572 -9.522 12.392 1.00 0.00 N ATOM 775 NH2 ARG A 56 -10.513 -9.414 14.383 1.00 0.00 N ATOM 0 H ARG A 56 -12.857 -3.575 9.328 1.00 0.00 H new ATOM 0 HA ARG A 56 -11.486 -6.175 8.836 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -11.012 -4.958 10.957 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -12.721 -4.945 11.347 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -12.148 -7.656 10.710 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.773 -7.124 11.657 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.918 -6.001 13.055 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -13.594 -7.520 12.499 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.800 -7.325 14.689 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -12.229 -9.130 11.717 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.119 -10.416 12.203 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.339 -8.938 15.268 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -10.064 -10.309 14.188 1.00 0.00 H new ATOM 789 N ALA A 57 -14.198 -6.323 8.028 1.00 0.00 N ATOM 790 CA ALA A 57 -15.490 -7.032 7.809 1.00 0.00 C ATOM 791 C ALA A 57 -15.829 -7.007 6.317 1.00 0.00 C ATOM 792 O ALA A 57 -15.985 -8.036 5.689 1.00 0.00 O ATOM 793 CB ALA A 57 -16.598 -6.329 8.596 1.00 0.00 C ATOM 0 H ALA A 57 -13.842 -5.811 7.221 1.00 0.00 H new ATOM 0 HA ALA A 57 -15.405 -8.064 8.149 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.543 -6.848 8.436 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.353 -6.340 9.658 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -16.688 -5.297 8.255 1.00 0.00 H new ATOM 799 N SER A 58 -15.939 -5.840 5.745 1.00 0.00 N ATOM 800 CA SER A 58 -16.262 -5.750 4.294 1.00 0.00 C ATOM 801 C SER A 58 -14.964 -5.622 3.494 1.00 0.00 C ATOM 802 O SER A 58 -14.896 -5.988 2.337 1.00 0.00 O ATOM 803 CB SER A 58 -17.138 -4.523 4.041 1.00 0.00 C ATOM 804 OG SER A 58 -16.602 -3.410 4.744 1.00 0.00 O ATOM 0 H SER A 58 -15.819 -4.945 6.220 1.00 0.00 H new ATOM 0 HA SER A 58 -16.797 -6.647 3.983 1.00 0.00 H new ATOM 0 HB2 SER A 58 -17.181 -4.307 2.974 1.00 0.00 H new ATOM 0 HB3 SER A 58 -18.159 -4.717 4.369 1.00 0.00 H new ATOM 0 HG SER A 58 -17.161 -2.621 4.582 1.00 0.00 H new ATOM 810 N GLY A 59 -13.931 -5.105 4.105 1.00 0.00 N ATOM 811 CA GLY A 59 -12.636 -4.954 3.382 1.00 0.00 C ATOM 812 C GLY A 59 -12.538 -3.546 2.791 1.00 0.00 C ATOM 813 O GLY A 59 -13.121 -2.608 3.298 1.00 0.00 O ATOM 0 H GLY A 59 -13.929 -4.781 5.072 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -11.805 -5.131 4.064 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.562 -5.698 2.589 1.00 0.00 H new ATOM 817 N PHE A 60 -11.805 -3.393 1.722 1.00 0.00 N ATOM 818 CA PHE A 60 -11.670 -2.047 1.096 1.00 0.00 C ATOM 819 C PHE A 60 -11.638 -2.197 -0.426 1.00 0.00 C ATOM 820 O PHE A 60 -11.818 -3.275 -0.957 1.00 0.00 O ATOM 821 CB PHE A 60 -10.376 -1.386 1.575 1.00 0.00 C ATOM 822 CG PHE A 60 -9.189 -2.077 0.947 1.00 0.00 C ATOM 823 CD1 PHE A 60 -8.730 -3.291 1.469 1.00 0.00 C ATOM 824 CD2 PHE A 60 -8.546 -1.501 -0.155 1.00 0.00 C ATOM 825 CE1 PHE A 60 -7.628 -3.931 0.888 1.00 0.00 C ATOM 826 CE2 PHE A 60 -7.445 -2.140 -0.736 1.00 0.00 C ATOM 827 CZ PHE A 60 -6.985 -3.355 -0.215 1.00 0.00 C ATOM 0 H PHE A 60 -11.294 -4.142 1.255 1.00 0.00 H new ATOM 0 HA PHE A 60 -12.518 -1.425 1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -10.376 -0.329 1.309 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.308 -1.441 2.661 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -9.225 -3.735 2.320 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -8.900 -0.563 -0.557 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -7.274 -4.869 1.290 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -6.950 -1.696 -1.587 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.135 -3.848 -0.663 1.00 0.00 H new ATOM 837 N ASP A 61 -11.416 -1.124 -1.135 1.00 0.00 N ATOM 838 CA ASP A 61 -11.379 -1.213 -2.621 1.00 0.00 C ATOM 839 C ASP A 61 -10.460 -0.126 -3.183 1.00 0.00 C ATOM 840 O ASP A 61 -10.498 1.014 -2.762 1.00 0.00 O ATOM 841 CB ASP A 61 -12.791 -1.019 -3.179 1.00 0.00 C ATOM 842 CG ASP A 61 -13.511 0.074 -2.388 1.00 0.00 C ATOM 843 OD1 ASP A 61 -13.376 1.230 -2.755 1.00 0.00 O ATOM 844 OD2 ASP A 61 -14.185 -0.262 -1.428 1.00 0.00 O ATOM 0 H ASP A 61 -11.259 -0.192 -0.750 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.000 -2.193 -2.912 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.742 -0.746 -4.233 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -13.349 -1.954 -3.117 1.00 0.00 H new ATOM 849 N LEU A 62 -9.639 -0.471 -4.136 1.00 0.00 N ATOM 850 CA LEU A 62 -8.721 0.538 -4.735 1.00 0.00 C ATOM 851 C LEU A 62 -9.487 1.341 -5.796 1.00 0.00 C ATOM 852 O LEU A 62 -10.627 1.710 -5.596 1.00 0.00 O ATOM 853 CB LEU A 62 -7.517 -0.182 -5.355 1.00 0.00 C ATOM 854 CG LEU A 62 -6.628 -0.735 -4.239 1.00 0.00 C ATOM 855 CD1 LEU A 62 -6.844 -2.243 -4.106 1.00 0.00 C ATOM 856 CD2 LEU A 62 -5.163 -0.459 -4.577 1.00 0.00 C ATOM 0 H LEU A 62 -9.564 -1.410 -4.527 1.00 0.00 H new ATOM 0 HA LEU A 62 -8.357 1.225 -3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.856 -0.992 -6.000 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.949 0.507 -5.980 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.886 -0.250 -3.297 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.209 -2.633 -3.310 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.889 -2.441 -3.867 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.588 -2.732 -5.046 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -4.526 -0.852 -3.784 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.909 -0.944 -5.520 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.007 0.616 -4.669 1.00 0.00 H new ATOM 868 N ALA A 63 -8.876 1.627 -6.911 1.00 0.00 N ATOM 869 CA ALA A 63 -9.575 2.417 -7.964 1.00 0.00 C ATOM 870 C ALA A 63 -10.429 1.497 -8.840 1.00 0.00 C ATOM 871 O ALA A 63 -10.476 1.641 -10.045 1.00 0.00 O ATOM 872 CB ALA A 63 -8.535 3.112 -8.835 1.00 0.00 C ATOM 0 H ALA A 63 -7.922 1.348 -7.140 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.222 3.153 -7.487 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -9.038 3.693 -9.609 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.929 3.776 -8.219 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.893 2.365 -9.302 1.00 0.00 H new ATOM 878 N GLY A 64 -11.109 0.559 -8.247 1.00 0.00 N ATOM 879 CA GLY A 64 -11.966 -0.361 -9.049 1.00 0.00 C ATOM 880 C GLY A 64 -11.667 -1.815 -8.676 1.00 0.00 C ATOM 881 O GLY A 64 -12.244 -2.735 -9.221 1.00 0.00 O ATOM 0 H GLY A 64 -11.110 0.388 -7.242 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.018 -0.140 -8.869 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -11.785 -0.205 -10.112 1.00 0.00 H new ATOM 885 N VAL A 65 -10.768 -2.032 -7.756 1.00 0.00 N ATOM 886 CA VAL A 65 -10.435 -3.431 -7.358 1.00 0.00 C ATOM 887 C VAL A 65 -11.129 -3.772 -6.037 1.00 0.00 C ATOM 888 O VAL A 65 -11.211 -2.960 -5.138 1.00 0.00 O ATOM 889 CB VAL A 65 -8.921 -3.565 -7.189 1.00 0.00 C ATOM 890 CG1 VAL A 65 -8.531 -5.042 -7.247 1.00 0.00 C ATOM 891 CG2 VAL A 65 -8.218 -2.804 -8.316 1.00 0.00 C ATOM 0 H VAL A 65 -10.250 -1.304 -7.263 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.778 -4.118 -8.132 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.621 -3.150 -6.227 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.452 -5.138 -7.127 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.035 -5.583 -6.446 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.827 -5.459 -8.209 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.138 -2.897 -8.199 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.516 -3.221 -9.278 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.498 -1.751 -8.274 1.00 0.00 H new ATOM 901 N HIS A 66 -11.629 -4.973 -5.915 1.00 0.00 N ATOM 902 CA HIS A 66 -12.318 -5.370 -4.654 1.00 0.00 C ATOM 903 C HIS A 66 -11.421 -6.319 -3.857 1.00 0.00 C ATOM 904 O HIS A 66 -11.223 -7.460 -4.226 1.00 0.00 O ATOM 905 CB HIS A 66 -13.631 -6.078 -4.992 1.00 0.00 C ATOM 906 CG HIS A 66 -14.317 -5.353 -6.115 1.00 0.00 C ATOM 907 ND1 HIS A 66 -15.242 -5.976 -6.939 1.00 0.00 N ATOM 908 CD2 HIS A 66 -14.224 -4.060 -6.566 1.00 0.00 C ATOM 909 CE1 HIS A 66 -15.664 -5.065 -7.834 1.00 0.00 C ATOM 910 NE2 HIS A 66 -15.075 -3.880 -7.652 1.00 0.00 N ATOM 0 H HIS A 66 -11.590 -5.695 -6.634 1.00 0.00 H new ATOM 0 HA HIS A 66 -12.525 -4.480 -4.059 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -13.436 -7.112 -5.278 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -14.277 -6.106 -4.115 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -13.587 -3.298 -6.142 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -16.391 -5.267 -8.606 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -15.218 -3.027 -8.193 1.00 0.00 H new ATOM 918 N TYR A 67 -10.881 -5.860 -2.761 1.00 0.00 N ATOM 919 CA TYR A 67 -10.004 -6.737 -1.937 1.00 0.00 C ATOM 920 C TYR A 67 -10.653 -6.957 -0.568 1.00 0.00 C ATOM 921 O TYR A 67 -11.580 -6.265 -0.194 1.00 0.00 O ATOM 922 CB TYR A 67 -8.641 -6.066 -1.744 1.00 0.00 C ATOM 923 CG TYR A 67 -7.752 -6.338 -2.936 1.00 0.00 C ATOM 924 CD1 TYR A 67 -7.697 -7.619 -3.500 1.00 0.00 C ATOM 925 CD2 TYR A 67 -6.974 -5.305 -3.473 1.00 0.00 C ATOM 926 CE1 TYR A 67 -6.864 -7.866 -4.599 1.00 0.00 C ATOM 927 CE2 TYR A 67 -6.141 -5.551 -4.570 1.00 0.00 C ATOM 928 CZ TYR A 67 -6.087 -6.831 -5.133 1.00 0.00 C ATOM 929 OH TYR A 67 -5.262 -7.074 -6.213 1.00 0.00 O ATOM 0 H TYR A 67 -11.010 -4.914 -2.401 1.00 0.00 H new ATOM 0 HA TYR A 67 -9.871 -7.693 -2.442 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.771 -4.991 -1.616 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -8.169 -6.440 -0.836 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -8.297 -8.417 -3.087 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -7.017 -4.317 -3.040 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -6.821 -8.854 -5.034 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -5.540 -4.754 -4.982 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.794 -6.249 -6.459 1.00 0.00 H new ATOM 939 N VAL A 68 -10.171 -7.908 0.185 1.00 0.00 N ATOM 940 CA VAL A 68 -10.759 -8.162 1.531 1.00 0.00 C ATOM 941 C VAL A 68 -9.685 -7.939 2.600 1.00 0.00 C ATOM 942 O VAL A 68 -8.520 -7.780 2.298 1.00 0.00 O ATOM 943 CB VAL A 68 -11.266 -9.605 1.611 1.00 0.00 C ATOM 944 CG1 VAL A 68 -10.082 -10.568 1.532 1.00 0.00 C ATOM 945 CG2 VAL A 68 -12.003 -9.812 2.938 1.00 0.00 C ATOM 0 H VAL A 68 -9.396 -8.519 -0.073 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.592 -7.480 1.698 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.946 -9.798 0.781 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.444 -11.595 1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -9.555 -10.421 0.589 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.401 -10.377 2.362 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -12.365 -10.839 2.997 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.322 -9.619 3.767 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.848 -9.126 2.996 1.00 0.00 H new ATOM 955 N THR A 69 -10.068 -7.923 3.847 1.00 0.00 N ATOM 956 CA THR A 69 -9.065 -7.708 4.926 1.00 0.00 C ATOM 957 C THR A 69 -9.453 -8.535 6.154 1.00 0.00 C ATOM 958 O THR A 69 -10.605 -8.860 6.356 1.00 0.00 O ATOM 959 CB THR A 69 -9.031 -6.224 5.300 1.00 0.00 C ATOM 960 OG1 THR A 69 -9.395 -5.447 4.167 1.00 0.00 O ATOM 961 CG2 THR A 69 -7.622 -5.842 5.752 1.00 0.00 C ATOM 0 H THR A 69 -11.029 -8.049 4.164 1.00 0.00 H new ATOM 0 HA THR A 69 -8.080 -8.018 4.576 1.00 0.00 H new ATOM 0 HB THR A 69 -9.732 -6.036 6.113 1.00 0.00 H new ATOM 0 HG1 THR A 69 -9.376 -4.496 4.403 1.00 0.00 H new ATOM 0 HG21 THR A 69 -7.599 -4.785 6.018 1.00 0.00 H new ATOM 0 HG22 THR A 69 -7.343 -6.441 6.619 1.00 0.00 H new ATOM 0 HG23 THR A 69 -6.917 -6.027 4.942 1.00 0.00 H new ATOM 969 N LEU A 70 -8.498 -8.879 6.974 1.00 0.00 N ATOM 970 CA LEU A 70 -8.813 -9.684 8.187 1.00 0.00 C ATOM 971 C LEU A 70 -8.305 -8.951 9.431 1.00 0.00 C ATOM 972 O LEU A 70 -9.076 -8.500 10.254 1.00 0.00 O ATOM 973 CB LEU A 70 -8.130 -11.049 8.086 1.00 0.00 C ATOM 974 CG LEU A 70 -9.051 -12.126 8.661 1.00 0.00 C ATOM 975 CD1 LEU A 70 -10.187 -12.408 7.675 1.00 0.00 C ATOM 976 CD2 LEU A 70 -8.248 -13.408 8.892 1.00 0.00 C ATOM 0 H LEU A 70 -7.514 -8.637 6.856 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.892 -9.822 8.261 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.896 -11.274 7.045 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.185 -11.036 8.630 1.00 0.00 H new ATOM 0 HG LEU A 70 -9.469 -11.780 9.606 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.843 -13.176 8.086 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.758 -11.495 7.507 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.770 -12.755 6.729 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.902 -14.178 9.302 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.831 -13.752 7.945 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.438 -13.209 9.594 1.00 0.00 H new ATOM 988 N ARG A 71 -7.013 -8.827 9.574 1.00 0.00 N ATOM 989 CA ARG A 71 -6.461 -8.121 10.765 1.00 0.00 C ATOM 990 C ARG A 71 -5.916 -6.756 10.344 1.00 0.00 C ATOM 991 O ARG A 71 -4.790 -6.408 10.642 1.00 0.00 O ATOM 992 CB ARG A 71 -5.330 -8.952 11.375 1.00 0.00 C ATOM 993 CG ARG A 71 -4.318 -9.321 10.288 1.00 0.00 C ATOM 994 CD ARG A 71 -2.916 -8.890 10.724 1.00 0.00 C ATOM 995 NE ARG A 71 -2.669 -9.353 12.118 1.00 0.00 N ATOM 996 CZ ARG A 71 -1.454 -9.374 12.597 1.00 0.00 C ATOM 997 NH1 ARG A 71 -0.452 -8.976 11.861 1.00 0.00 N ATOM 998 NH2 ARG A 71 -1.243 -9.790 13.817 1.00 0.00 N ATOM 0 H ARG A 71 -6.317 -9.183 8.919 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.252 -7.986 11.502 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.838 -8.388 12.167 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.735 -9.856 11.831 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -4.339 -10.396 10.107 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.584 -8.834 9.349 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.168 -9.310 10.051 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.822 -7.806 10.667 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.451 -9.654 12.700 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -0.617 -8.648 10.909 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.496 -8.993 12.237 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -2.026 -10.098 14.394 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -0.295 -9.807 14.193 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.704 -5.979 9.655 1.00 0.00 N ATOM 1013 CA ALA A 72 -6.229 -4.636 9.217 1.00 0.00 C ATOM 1014 C ALA A 72 -5.737 -3.848 10.433 1.00 0.00 C ATOM 1015 O ALA A 72 -5.643 -4.369 11.527 1.00 0.00 O ATOM 1016 CB ALA A 72 -7.380 -3.880 8.553 1.00 0.00 C ATOM 0 H ALA A 72 -7.656 -6.215 9.376 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.412 -4.754 8.505 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.033 -2.898 8.232 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.732 -4.441 7.687 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.197 -3.762 9.265 1.00 0.00 H new ATOM 1022 N ASP A 73 -5.423 -2.594 10.250 1.00 0.00 N ATOM 1023 CA ASP A 73 -4.937 -1.772 11.393 1.00 0.00 C ATOM 1024 C ASP A 73 -5.436 -0.334 11.238 1.00 0.00 C ATOM 1025 O ASP A 73 -6.477 -0.086 10.665 1.00 0.00 O ATOM 1026 CB ASP A 73 -3.407 -1.783 11.414 1.00 0.00 C ATOM 1027 CG ASP A 73 -2.916 -1.848 12.861 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -3.751 -1.959 13.744 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -1.714 -1.785 13.061 1.00 0.00 O ATOM 0 H ASP A 73 -5.482 -2.104 9.357 1.00 0.00 H new ATOM 0 HA ASP A 73 -5.316 -2.188 12.326 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -3.031 -2.639 10.853 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -3.020 -0.888 10.927 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.700 0.619 11.745 1.00 0.00 N ATOM 1035 CA ASP A 74 -5.135 2.039 11.626 1.00 0.00 C ATOM 1036 C ASP A 74 -4.186 2.788 10.686 1.00 0.00 C ATOM 1037 O ASP A 74 -4.611 3.434 9.748 1.00 0.00 O ATOM 1038 CB ASP A 74 -5.108 2.700 13.007 1.00 0.00 C ATOM 1039 CG ASP A 74 -5.676 4.115 12.905 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -6.889 4.247 12.905 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -4.889 5.045 12.830 1.00 0.00 O ATOM 0 H ASP A 74 -3.818 0.475 12.236 1.00 0.00 H new ATOM 0 HA ASP A 74 -6.148 2.074 11.225 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.692 2.112 13.715 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.087 2.733 13.386 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.907 2.713 10.930 1.00 0.00 N ATOM 1047 CA ARG A 75 -1.940 3.428 10.047 1.00 0.00 C ATOM 1048 C ARG A 75 -1.383 2.461 8.998 1.00 0.00 C ATOM 1049 O ARG A 75 -0.535 2.817 8.205 1.00 0.00 O ATOM 1050 CB ARG A 75 -0.798 4.013 10.896 1.00 0.00 C ATOM 1051 CG ARG A 75 0.289 2.960 11.159 1.00 0.00 C ATOM 1052 CD ARG A 75 -0.229 1.919 12.153 1.00 0.00 C ATOM 1053 NE ARG A 75 -0.898 2.612 13.302 1.00 0.00 N ATOM 1054 CZ ARG A 75 -0.275 3.530 13.994 1.00 0.00 C ATOM 1055 NH1 ARG A 75 1.015 3.692 13.866 1.00 0.00 N ATOM 1056 NH2 ARG A 75 -0.931 4.238 14.872 1.00 0.00 N ATOM 0 H ARG A 75 -2.489 2.190 11.700 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.451 4.243 9.535 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.362 4.871 10.384 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.194 4.376 11.844 1.00 0.00 H new ATOM 0 HG2 ARG A 75 0.572 2.475 10.225 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.185 3.439 11.554 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.933 1.249 11.660 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.596 1.305 12.515 1.00 0.00 H new ATOM 0 HE ARG A 75 -1.856 2.363 13.548 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.542 3.101 13.223 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.495 4.410 14.409 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -1.927 4.075 15.017 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -0.447 4.955 15.413 1.00 0.00 H new ATOM 1070 N SER A 76 -1.846 1.241 8.989 1.00 0.00 N ATOM 1071 CA SER A 76 -1.333 0.261 7.990 1.00 0.00 C ATOM 1072 C SER A 76 -2.475 -0.633 7.505 1.00 0.00 C ATOM 1073 O SER A 76 -3.324 -1.043 8.272 1.00 0.00 O ATOM 1074 CB SER A 76 -0.254 -0.604 8.641 1.00 0.00 C ATOM 1075 OG SER A 76 0.231 0.048 9.806 1.00 0.00 O ATOM 0 H SER A 76 -2.555 0.881 9.628 1.00 0.00 H new ATOM 0 HA SER A 76 -0.913 0.799 7.140 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.662 -1.581 8.900 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.563 -0.776 7.940 1.00 0.00 H new ATOM 0 HG SER A 76 0.922 -0.505 10.227 1.00 0.00 H new ATOM 1081 N ILE A 77 -2.498 -0.944 6.238 1.00 0.00 N ATOM 1082 CA ILE A 77 -3.579 -1.817 5.700 1.00 0.00 C ATOM 1083 C ILE A 77 -3.107 -2.456 4.389 1.00 0.00 C ATOM 1084 O ILE A 77 -3.067 -1.816 3.356 1.00 0.00 O ATOM 1085 CB ILE A 77 -4.838 -0.979 5.445 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -5.530 -0.676 6.778 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -5.802 -1.758 4.544 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -5.109 0.710 7.275 1.00 0.00 C ATOM 0 H ILE A 77 -1.813 -0.630 5.551 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.811 -2.599 6.422 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.555 -0.046 4.957 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -6.612 -0.715 6.654 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -5.266 -1.433 7.516 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.696 -1.160 4.365 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.315 -1.977 3.594 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -6.082 -2.692 5.032 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.603 0.922 8.223 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.028 0.733 7.416 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -5.396 1.462 6.540 1.00 0.00 H new ATOM 1100 N TYR A 78 -2.758 -3.715 4.421 1.00 0.00 N ATOM 1101 CA TYR A 78 -2.298 -4.400 3.175 1.00 0.00 C ATOM 1102 C TYR A 78 -3.388 -5.375 2.721 1.00 0.00 C ATOM 1103 O TYR A 78 -3.766 -6.273 3.446 1.00 0.00 O ATOM 1104 CB TYR A 78 -0.997 -5.181 3.432 1.00 0.00 C ATOM 1105 CG TYR A 78 -0.369 -4.757 4.742 1.00 0.00 C ATOM 1106 CD1 TYR A 78 -0.860 -5.272 5.949 1.00 0.00 C ATOM 1107 CD2 TYR A 78 0.703 -3.852 4.752 1.00 0.00 C ATOM 1108 CE1 TYR A 78 -0.282 -4.885 7.163 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.280 -3.466 5.968 1.00 0.00 C ATOM 1110 CZ TYR A 78 0.787 -3.982 7.173 1.00 0.00 C ATOM 1111 OH TYR A 78 1.354 -3.601 8.370 1.00 0.00 O ATOM 0 H TYR A 78 -2.771 -4.300 5.256 1.00 0.00 H new ATOM 0 HA TYR A 78 -2.108 -3.651 2.406 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -1.207 -6.250 3.453 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -0.296 -5.010 2.615 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.685 -5.968 5.942 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.083 -3.454 3.823 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.661 -5.283 8.093 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.106 -2.770 5.977 1.00 0.00 H new ATOM 0 HH TYR A 78 2.085 -2.971 8.200 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.904 -5.203 1.532 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.979 -6.119 1.048 1.00 0.00 C ATOM 1123 C GLY A 79 -4.378 -7.466 0.637 1.00 0.00 C ATOM 1124 O GLY A 79 -3.205 -7.572 0.340 1.00 0.00 O ATOM 0 H GLY A 79 -3.629 -4.471 0.877 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.721 -6.267 1.832 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.496 -5.669 0.201 1.00 0.00 H new ATOM 1128 N LYS A 80 -5.179 -8.497 0.620 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.666 -9.840 0.228 1.00 0.00 C ATOM 1130 C LYS A 80 -5.800 -10.657 -0.397 1.00 0.00 C ATOM 1131 O LYS A 80 -6.798 -10.936 0.238 1.00 0.00 O ATOM 1132 CB LYS A 80 -4.140 -10.565 1.468 1.00 0.00 C ATOM 1133 CG LYS A 80 -2.614 -10.655 1.396 1.00 0.00 C ATOM 1134 CD LYS A 80 -2.213 -11.906 0.613 1.00 0.00 C ATOM 1135 CE LYS A 80 -1.814 -13.015 1.590 1.00 0.00 C ATOM 1136 NZ LYS A 80 -2.960 -13.321 2.490 1.00 0.00 N ATOM 0 H LYS A 80 -6.170 -8.466 0.862 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.860 -9.724 -0.496 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -4.442 -10.032 2.370 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.572 -11.564 1.529 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.209 -9.766 0.913 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.193 -10.692 2.401 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -3.042 -12.238 -0.012 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.382 -11.679 -0.055 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.520 -13.910 1.041 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.950 -12.703 2.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -2.745 -14.172 3.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.122 -12.518 3.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -3.814 -13.488 1.920 1.00 0.00 H new ATOM 1150 N LYS A 81 -5.658 -11.045 -1.634 1.00 0.00 N ATOM 1151 CA LYS A 81 -6.731 -11.845 -2.289 1.00 0.00 C ATOM 1152 C LYS A 81 -6.136 -12.636 -3.455 1.00 0.00 C ATOM 1153 O LYS A 81 -5.278 -12.155 -4.168 1.00 0.00 O ATOM 1154 CB LYS A 81 -7.824 -10.909 -2.809 1.00 0.00 C ATOM 1155 CG LYS A 81 -9.176 -11.623 -2.755 1.00 0.00 C ATOM 1156 CD LYS A 81 -9.927 -11.391 -4.067 1.00 0.00 C ATOM 1157 CE LYS A 81 -9.448 -12.400 -5.112 1.00 0.00 C ATOM 1158 NZ LYS A 81 -9.360 -11.732 -6.440 1.00 0.00 N ATOM 0 H LYS A 81 -4.847 -10.843 -2.219 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.163 -12.535 -1.564 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.856 -10.001 -2.207 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.602 -10.606 -3.832 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.029 -12.691 -2.591 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.763 -11.250 -1.916 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.000 -11.497 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -9.756 -10.375 -4.422 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -8.474 -12.800 -4.828 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.137 -13.243 -5.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.034 -12.417 -7.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.297 -11.371 -6.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -8.687 -10.941 -6.387 1.00 0.00 H new ATOM 1172 N GLY A 82 -6.582 -13.847 -3.654 1.00 0.00 N ATOM 1173 CA GLY A 82 -6.036 -14.666 -4.775 1.00 0.00 C ATOM 1174 C GLY A 82 -4.515 -14.750 -4.648 1.00 0.00 C ATOM 1175 O GLY A 82 -3.988 -15.131 -3.621 1.00 0.00 O ATOM 0 H GLY A 82 -7.299 -14.304 -3.091 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -6.470 -15.666 -4.754 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.308 -14.220 -5.732 1.00 0.00 H new ATOM 1179 N SER A 83 -3.801 -14.398 -5.683 1.00 0.00 N ATOM 1180 CA SER A 83 -2.313 -14.459 -5.617 1.00 0.00 C ATOM 1181 C SER A 83 -1.735 -13.045 -5.711 1.00 0.00 C ATOM 1182 O SER A 83 -0.570 -12.859 -6.002 1.00 0.00 O ATOM 1183 CB SER A 83 -1.786 -15.303 -6.780 1.00 0.00 C ATOM 1184 OG SER A 83 -2.855 -16.061 -7.332 1.00 0.00 O ATOM 0 H SER A 83 -4.183 -14.071 -6.570 1.00 0.00 H new ATOM 0 HA SER A 83 -2.011 -14.910 -4.672 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.349 -14.659 -7.543 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.995 -15.968 -6.433 1.00 0.00 H new ATOM 0 HG SER A 83 -2.521 -16.602 -8.078 1.00 0.00 H new ATOM 1190 N ALA A 84 -2.539 -12.046 -5.466 1.00 0.00 N ATOM 1191 CA ALA A 84 -2.033 -10.647 -5.544 1.00 0.00 C ATOM 1192 C ALA A 84 -2.529 -9.849 -4.334 1.00 0.00 C ATOM 1193 O ALA A 84 -3.705 -9.829 -4.031 1.00 0.00 O ATOM 1194 CB ALA A 84 -2.544 -9.994 -6.830 1.00 0.00 C ATOM 0 H ALA A 84 -3.523 -12.139 -5.215 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.943 -10.656 -5.546 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.175 -8.970 -6.890 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.187 -10.559 -7.691 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.634 -9.987 -6.826 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.639 -9.185 -3.645 1.00 0.00 N ATOM 1201 CA GLY A 85 -2.053 -8.381 -2.459 1.00 0.00 C ATOM 1202 C GLY A 85 -1.407 -6.997 -2.542 1.00 0.00 C ATOM 1203 O GLY A 85 -0.488 -6.778 -3.304 1.00 0.00 O ATOM 0 H GLY A 85 -0.641 -9.165 -3.853 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.139 -8.288 -2.428 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.750 -8.883 -1.540 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.883 -6.054 -1.772 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.292 -4.688 -1.826 1.00 0.00 C ATOM 1209 C VAL A 86 -0.910 -4.222 -0.418 1.00 0.00 C ATOM 1210 O VAL A 86 -1.536 -4.581 0.559 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.318 -3.723 -2.436 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.047 -4.419 -3.584 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -3.342 -3.307 -1.373 1.00 0.00 C ATOM 0 H VAL A 86 -2.652 -6.171 -1.112 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.393 -4.705 -2.441 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.799 -2.838 -2.805 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.776 -3.736 -4.019 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -2.326 -4.714 -4.347 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.559 -5.304 -3.206 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -4.066 -2.622 -1.814 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -3.859 -4.191 -1.000 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -2.830 -2.811 -0.548 1.00 0.00 H new ATOM 1223 N ILE A 87 0.106 -3.410 -0.312 1.00 0.00 N ATOM 1224 CA ILE A 87 0.526 -2.899 1.022 1.00 0.00 C ATOM 1225 C ILE A 87 0.341 -1.383 1.033 1.00 0.00 C ATOM 1226 O ILE A 87 1.264 -0.632 0.785 1.00 0.00 O ATOM 1227 CB ILE A 87 1.998 -3.252 1.269 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.103 -4.724 1.678 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.567 -2.375 2.387 1.00 0.00 C ATOM 1230 CD1 ILE A 87 3.394 -5.322 1.116 1.00 0.00 C ATOM 0 H ILE A 87 0.666 -3.077 -1.097 1.00 0.00 H new ATOM 0 HA ILE A 87 -0.076 -3.353 1.809 1.00 0.00 H new ATOM 0 HB ILE A 87 2.566 -3.079 0.355 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.093 -4.812 2.764 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.241 -5.278 1.305 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.613 -2.633 2.555 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.494 -1.326 2.100 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.000 -2.541 3.303 1.00 0.00 H new ATOM 0 HD11 ILE A 87 3.467 -6.370 1.408 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.386 -5.248 0.029 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.250 -4.775 1.510 1.00 0.00 H new ATOM 1242 N THR A 88 -0.851 -0.925 1.299 1.00 0.00 N ATOM 1243 CA THR A 88 -1.097 0.542 1.300 1.00 0.00 C ATOM 1244 C THR A 88 -0.835 1.123 2.690 1.00 0.00 C ATOM 1245 O THR A 88 -1.147 0.521 3.699 1.00 0.00 O ATOM 1246 CB THR A 88 -2.549 0.827 0.909 1.00 0.00 C ATOM 1247 OG1 THR A 88 -3.332 0.933 2.086 1.00 0.00 O ATOM 1248 CG2 THR A 88 -3.093 -0.305 0.034 1.00 0.00 C ATOM 0 H THR A 88 -1.663 -1.503 1.515 1.00 0.00 H new ATOM 0 HA THR A 88 -0.422 1.005 0.580 1.00 0.00 H new ATOM 0 HB THR A 88 -2.594 1.759 0.346 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.900 1.730 2.031 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.127 -0.090 -0.237 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.490 -0.388 -0.870 1.00 0.00 H new ATOM 0 HG23 THR A 88 -3.050 -1.244 0.586 1.00 0.00 H new ATOM 1256 N VAL A 89 -0.273 2.299 2.743 1.00 0.00 N ATOM 1257 CA VAL A 89 0.006 2.948 4.054 1.00 0.00 C ATOM 1258 C VAL A 89 -0.063 4.467 3.875 1.00 0.00 C ATOM 1259 O VAL A 89 0.142 4.980 2.794 1.00 0.00 O ATOM 1260 CB VAL A 89 1.402 2.548 4.540 1.00 0.00 C ATOM 1261 CG1 VAL A 89 1.713 3.267 5.856 1.00 0.00 C ATOM 1262 CG2 VAL A 89 1.449 1.035 4.765 1.00 0.00 C ATOM 0 H VAL A 89 0.007 2.842 1.927 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.730 2.628 4.791 1.00 0.00 H new ATOM 0 HB VAL A 89 2.141 2.829 3.789 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.707 2.981 6.201 1.00 0.00 H new ATOM 0 HG12 VAL A 89 1.680 4.345 5.698 1.00 0.00 H new ATOM 0 HG13 VAL A 89 0.974 2.987 6.607 1.00 0.00 H new ATOM 0 HG21 VAL A 89 2.442 0.749 5.111 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.709 0.756 5.515 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.229 0.521 3.829 1.00 0.00 H new ATOM 1272 N LYS A 90 -0.358 5.192 4.917 1.00 0.00 N ATOM 1273 CA LYS A 90 -0.443 6.675 4.784 1.00 0.00 C ATOM 1274 C LYS A 90 0.740 7.328 5.500 1.00 0.00 C ATOM 1275 O LYS A 90 0.939 7.145 6.684 1.00 0.00 O ATOM 1276 CB LYS A 90 -1.750 7.169 5.406 1.00 0.00 C ATOM 1277 CG LYS A 90 -2.926 6.419 4.778 1.00 0.00 C ATOM 1278 CD LYS A 90 -4.235 6.884 5.420 1.00 0.00 C ATOM 1279 CE LYS A 90 -4.716 8.161 4.731 1.00 0.00 C ATOM 1280 NZ LYS A 90 -4.974 9.209 5.759 1.00 0.00 N ATOM 0 H LYS A 90 -0.543 4.826 5.851 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.417 6.943 3.728 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.736 7.009 6.484 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.860 8.241 5.245 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.953 6.599 3.703 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.802 5.345 4.918 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.992 6.104 5.333 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.086 7.067 6.484 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.966 8.509 4.021 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.625 7.961 4.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.301 10.079 5.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.704 8.875 6.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.097 9.406 6.282 1.00 0.00 H new ATOM 1294 N THR A 91 1.525 8.092 4.791 1.00 0.00 N ATOM 1295 CA THR A 91 2.690 8.759 5.434 1.00 0.00 C ATOM 1296 C THR A 91 2.280 10.148 5.918 1.00 0.00 C ATOM 1297 O THR A 91 2.436 10.483 7.075 1.00 0.00 O ATOM 1298 CB THR A 91 3.830 8.887 4.426 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.347 8.591 3.124 1.00 0.00 O ATOM 1300 CG2 THR A 91 4.950 7.915 4.797 1.00 0.00 C ATOM 0 H THR A 91 1.410 8.282 3.796 1.00 0.00 H new ATOM 0 HA THR A 91 3.024 8.162 6.283 1.00 0.00 H new ATOM 0 HB THR A 91 4.218 9.905 4.442 1.00 0.00 H new ATOM 0 HG1 THR A 91 2.755 9.312 2.823 1.00 0.00 H new ATOM 0 HG21 THR A 91 5.764 8.006 4.078 1.00 0.00 H new ATOM 0 HG22 THR A 91 5.320 8.150 5.795 1.00 0.00 H new ATOM 0 HG23 THR A 91 4.566 6.895 4.783 1.00 0.00 H new ATOM 1308 N SER A 92 1.757 10.966 5.044 1.00 0.00 N ATOM 1309 CA SER A 92 1.343 12.333 5.468 1.00 0.00 C ATOM 1310 C SER A 92 0.961 13.167 4.242 1.00 0.00 C ATOM 1311 O SER A 92 0.109 14.030 4.312 1.00 0.00 O ATOM 1312 CB SER A 92 2.506 13.006 6.197 1.00 0.00 C ATOM 1313 OG SER A 92 2.269 14.406 6.268 1.00 0.00 O ATOM 0 H SER A 92 1.600 10.748 4.060 1.00 0.00 H new ATOM 0 HA SER A 92 0.482 12.259 6.132 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.610 12.592 7.200 1.00 0.00 H new ATOM 0 HB3 SER A 92 3.441 12.810 5.673 1.00 0.00 H new ATOM 0 HG SER A 92 3.012 14.840 6.736 1.00 0.00 H new ATOM 1319 N LYS A 93 1.584 12.923 3.122 1.00 0.00 N ATOM 1320 CA LYS A 93 1.252 13.714 1.902 1.00 0.00 C ATOM 1321 C LYS A 93 0.959 12.772 0.730 1.00 0.00 C ATOM 1322 O LYS A 93 0.207 13.103 -0.165 1.00 0.00 O ATOM 1323 CB LYS A 93 2.433 14.619 1.545 1.00 0.00 C ATOM 1324 CG LYS A 93 2.881 15.390 2.788 1.00 0.00 C ATOM 1325 CD LYS A 93 4.203 16.101 2.494 1.00 0.00 C ATOM 1326 CE LYS A 93 4.897 16.458 3.810 1.00 0.00 C ATOM 1327 NZ LYS A 93 4.977 17.941 3.940 1.00 0.00 N ATOM 0 H LYS A 93 2.306 12.213 2.998 1.00 0.00 H new ATOM 0 HA LYS A 93 0.370 14.322 2.100 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.258 14.021 1.158 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.146 15.315 0.757 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.120 16.116 3.073 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.001 14.708 3.629 1.00 0.00 H new ATOM 0 HD2 LYS A 93 4.847 15.459 1.894 1.00 0.00 H new ATOM 0 HD3 LYS A 93 4.020 17.004 1.911 1.00 0.00 H new ATOM 0 HE2 LYS A 93 4.345 16.037 4.651 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.897 16.025 3.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 5.448 18.186 4.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 5.521 18.330 3.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 4.018 18.342 3.933 1.00 0.00 H new ATOM 1341 N SER A 94 1.544 11.604 0.721 1.00 0.00 N ATOM 1342 CA SER A 94 1.290 10.656 -0.402 1.00 0.00 C ATOM 1343 C SER A 94 1.050 9.249 0.150 1.00 0.00 C ATOM 1344 O SER A 94 1.537 8.894 1.206 1.00 0.00 O ATOM 1345 CB SER A 94 2.499 10.633 -1.338 1.00 0.00 C ATOM 1346 OG SER A 94 2.556 11.856 -2.060 1.00 0.00 O ATOM 0 H SER A 94 2.184 11.266 1.440 1.00 0.00 H new ATOM 0 HA SER A 94 0.408 10.984 -0.952 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.415 10.493 -0.764 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.423 9.793 -2.028 1.00 0.00 H new ATOM 0 HG SER A 94 3.492 12.104 -2.211 1.00 0.00 H new ATOM 1352 N ILE A 95 0.303 8.446 -0.557 1.00 0.00 N ATOM 1353 CA ILE A 95 0.031 7.064 -0.076 1.00 0.00 C ATOM 1354 C ILE A 95 1.049 6.104 -0.693 1.00 0.00 C ATOM 1355 O ILE A 95 1.429 6.237 -1.838 1.00 0.00 O ATOM 1356 CB ILE A 95 -1.382 6.651 -0.497 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -2.406 7.488 0.271 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.603 5.168 -0.185 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -3.805 6.908 0.052 1.00 0.00 C ATOM 0 H ILE A 95 -0.131 8.689 -1.448 1.00 0.00 H new ATOM 0 HA ILE A 95 0.112 7.030 1.010 1.00 0.00 H new ATOM 0 HB ILE A 95 -1.501 6.816 -1.568 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.165 7.492 1.334 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.373 8.524 -0.068 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.610 4.879 -0.486 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.875 4.569 -0.731 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.482 4.999 0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.536 7.504 0.599 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.044 6.927 -1.011 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.833 5.880 0.412 1.00 0.00 H new ATOM 1371 N LEU A 96 1.489 5.134 0.059 1.00 0.00 N ATOM 1372 CA LEU A 96 2.480 4.160 -0.477 1.00 0.00 C ATOM 1373 C LEU A 96 1.764 2.831 -0.718 1.00 0.00 C ATOM 1374 O LEU A 96 0.834 2.495 -0.018 1.00 0.00 O ATOM 1375 CB LEU A 96 3.621 3.937 0.532 1.00 0.00 C ATOM 1376 CG LEU A 96 3.734 5.115 1.514 1.00 0.00 C ATOM 1377 CD1 LEU A 96 3.953 4.573 2.928 1.00 0.00 C ATOM 1378 CD2 LEU A 96 4.920 5.998 1.116 1.00 0.00 C ATOM 0 H LEU A 96 1.204 4.973 1.025 1.00 0.00 H new ATOM 0 HA LEU A 96 2.904 4.549 -1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.445 3.015 1.085 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.563 3.814 -0.002 1.00 0.00 H new ATOM 0 HG LEU A 96 2.818 5.705 1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.034 5.405 3.628 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.110 3.942 3.210 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.871 3.986 2.955 1.00 0.00 H new ATOM 0 HD21 LEU A 96 5.001 6.833 1.811 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.837 5.410 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.767 6.380 0.107 1.00 0.00 H new ATOM 1390 N VAL A 97 2.179 2.071 -1.695 1.00 0.00 N ATOM 1391 CA VAL A 97 1.496 0.770 -1.952 1.00 0.00 C ATOM 1392 C VAL A 97 2.524 -0.305 -2.311 1.00 0.00 C ATOM 1393 O VAL A 97 3.375 -0.114 -3.156 1.00 0.00 O ATOM 1394 CB VAL A 97 0.502 0.925 -3.111 1.00 0.00 C ATOM 1395 CG1 VAL A 97 0.056 -0.455 -3.599 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.723 1.707 -2.631 1.00 0.00 C ATOM 0 H VAL A 97 2.954 2.291 -2.321 1.00 0.00 H new ATOM 0 HA VAL A 97 0.964 0.471 -1.049 1.00 0.00 H new ATOM 0 HB VAL A 97 0.986 1.461 -3.928 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.650 -0.339 -4.422 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.924 -1.018 -3.942 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.425 -0.992 -2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.429 1.817 -3.454 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.201 1.169 -1.812 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.413 2.693 -2.285 1.00 0.00 H new ATOM 1406 N GLY A 98 2.428 -1.446 -1.689 1.00 0.00 N ATOM 1407 CA GLY A 98 3.369 -2.555 -2.005 1.00 0.00 C ATOM 1408 C GLY A 98 2.606 -3.578 -2.841 1.00 0.00 C ATOM 1409 O GLY A 98 1.803 -4.334 -2.330 1.00 0.00 O ATOM 0 H GLY A 98 1.735 -1.659 -0.972 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.234 -2.180 -2.553 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.745 -3.012 -1.089 1.00 0.00 H new ATOM 1413 N VAL A 99 2.829 -3.596 -4.123 1.00 0.00 N ATOM 1414 CA VAL A 99 2.088 -4.556 -4.985 1.00 0.00 C ATOM 1415 C VAL A 99 2.953 -5.794 -5.219 1.00 0.00 C ATOM 1416 O VAL A 99 4.070 -5.705 -5.687 1.00 0.00 O ATOM 1417 CB VAL A 99 1.731 -3.891 -6.327 1.00 0.00 C ATOM 1418 CG1 VAL A 99 0.234 -4.062 -6.598 1.00 0.00 C ATOM 1419 CG2 VAL A 99 2.052 -2.389 -6.282 1.00 0.00 C ATOM 0 H VAL A 99 3.489 -2.990 -4.610 1.00 0.00 H new ATOM 0 HA VAL A 99 1.163 -4.853 -4.490 1.00 0.00 H new ATOM 0 HB VAL A 99 2.316 -4.364 -7.116 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.020 -3.592 -7.548 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.009 -5.124 -6.643 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.337 -3.593 -5.797 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.794 -1.933 -7.238 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.474 -1.917 -5.487 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.116 -2.250 -6.089 1.00 0.00 H new ATOM 1429 N TYR A 100 2.450 -6.949 -4.881 1.00 0.00 N ATOM 1430 CA TYR A 100 3.245 -8.193 -5.071 1.00 0.00 C ATOM 1431 C TYR A 100 2.377 -9.255 -5.749 1.00 0.00 C ATOM 1432 O TYR A 100 1.168 -9.143 -5.798 1.00 0.00 O ATOM 1433 CB TYR A 100 3.713 -8.708 -3.708 1.00 0.00 C ATOM 1434 CG TYR A 100 2.584 -8.602 -2.709 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.266 -7.364 -2.135 1.00 0.00 C ATOM 1436 CD2 TYR A 100 1.857 -9.745 -2.353 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.221 -7.270 -1.207 1.00 0.00 C ATOM 1438 CE2 TYR A 100 0.814 -9.650 -1.425 1.00 0.00 C ATOM 1439 CZ TYR A 100 0.496 -8.413 -0.852 1.00 0.00 C ATOM 1440 OH TYR A 100 -0.532 -8.320 0.064 1.00 0.00 O ATOM 0 H TYR A 100 1.522 -7.084 -4.481 1.00 0.00 H new ATOM 0 HA TYR A 100 4.111 -7.981 -5.697 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.040 -9.744 -3.793 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.571 -8.130 -3.365 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.827 -6.482 -2.408 1.00 0.00 H new ATOM 0 HD2 TYR A 100 2.101 -10.700 -2.795 1.00 0.00 H new ATOM 0 HE1 TYR A 100 0.975 -6.316 -0.766 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.254 -10.532 -1.151 1.00 0.00 H new ATOM 0 HH TYR A 100 -0.832 -7.389 0.125 1.00 0.00 H new ATOM 1450 N ASN A 101 2.982 -10.284 -6.275 1.00 0.00 N ATOM 1451 CA ASN A 101 2.189 -11.349 -6.951 1.00 0.00 C ATOM 1452 C ASN A 101 2.901 -12.692 -6.795 1.00 0.00 C ATOM 1453 O ASN A 101 3.854 -12.817 -6.052 1.00 0.00 O ATOM 1454 CB ASN A 101 2.048 -11.013 -8.437 1.00 0.00 C ATOM 1455 CG ASN A 101 0.649 -10.450 -8.701 1.00 0.00 C ATOM 1456 OD1 ASN A 101 -0.236 -11.167 -9.123 1.00 0.00 O ATOM 1457 ND2 ASN A 101 0.412 -9.188 -8.466 1.00 0.00 N ATOM 0 H ASN A 101 3.991 -10.433 -6.266 1.00 0.00 H new ATOM 0 HA ASN A 101 1.200 -11.410 -6.497 1.00 0.00 H new ATOM 0 HB2 ASN A 101 2.806 -10.286 -8.730 1.00 0.00 H new ATOM 0 HB3 ASN A 101 2.212 -11.906 -9.040 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -0.517 -8.803 -8.637 1.00 0.00 H new ATOM 0 HD22 ASN A 101 1.156 -8.587 -8.112 1.00 0.00 H new ATOM 1464 N GLU A 102 2.447 -13.701 -7.487 1.00 0.00 N ATOM 1465 CA GLU A 102 3.100 -15.033 -7.372 1.00 0.00 C ATOM 1466 C GLU A 102 3.006 -15.521 -5.925 1.00 0.00 C ATOM 1467 O GLU A 102 3.774 -16.355 -5.489 1.00 0.00 O ATOM 1468 CB GLU A 102 4.570 -14.915 -7.782 1.00 0.00 C ATOM 1469 CG GLU A 102 4.677 -14.066 -9.051 1.00 0.00 C ATOM 1470 CD GLU A 102 5.534 -14.798 -10.086 1.00 0.00 C ATOM 1471 OE1 GLU A 102 6.431 -15.519 -9.681 1.00 0.00 O ATOM 1472 OE2 GLU A 102 5.276 -14.625 -11.266 1.00 0.00 O ATOM 0 H GLU A 102 1.653 -13.659 -8.126 1.00 0.00 H new ATOM 0 HA GLU A 102 2.598 -15.745 -8.027 1.00 0.00 H new ATOM 0 HB2 GLU A 102 5.148 -14.461 -6.977 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.991 -15.905 -7.957 1.00 0.00 H new ATOM 0 HG2 GLU A 102 3.684 -13.873 -9.457 1.00 0.00 H new ATOM 0 HG3 GLU A 102 5.119 -13.098 -8.817 1.00 0.00 H new ATOM 1479 N LYS A 103 2.065 -15.008 -5.178 1.00 0.00 N ATOM 1480 CA LYS A 103 1.915 -15.442 -3.761 1.00 0.00 C ATOM 1481 C LYS A 103 3.225 -15.193 -3.006 1.00 0.00 C ATOM 1482 O LYS A 103 4.034 -16.084 -2.834 1.00 0.00 O ATOM 1483 CB LYS A 103 1.576 -16.933 -3.724 1.00 0.00 C ATOM 1484 CG LYS A 103 0.076 -17.125 -3.966 1.00 0.00 C ATOM 1485 CD LYS A 103 -0.676 -17.043 -2.636 1.00 0.00 C ATOM 1486 CE LYS A 103 -0.604 -18.396 -1.924 1.00 0.00 C ATOM 1487 NZ LYS A 103 -1.884 -19.132 -2.126 1.00 0.00 N ATOM 0 H LYS A 103 1.393 -14.306 -5.490 1.00 0.00 H new ATOM 0 HA LYS A 103 1.115 -14.874 -3.287 1.00 0.00 H new ATOM 0 HB2 LYS A 103 2.148 -17.465 -4.484 1.00 0.00 H new ATOM 0 HB3 LYS A 103 1.856 -17.356 -2.759 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -0.292 -16.361 -4.651 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -0.105 -18.090 -4.438 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.241 -16.266 -2.008 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -1.716 -16.767 -2.811 1.00 0.00 H new ATOM 0 HE2 LYS A 103 0.229 -18.980 -2.314 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -0.420 -18.250 -0.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -1.836 -20.051 -1.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.670 -18.575 -1.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -2.041 -19.283 -3.143 1.00 0.00 H new ATOM 1501 N ILE A 104 3.441 -13.988 -2.553 1.00 0.00 N ATOM 1502 CA ILE A 104 4.696 -13.678 -1.811 1.00 0.00 C ATOM 1503 C ILE A 104 4.423 -13.748 -0.301 1.00 0.00 C ATOM 1504 O ILE A 104 3.339 -13.447 0.158 1.00 0.00 O ATOM 1505 CB ILE A 104 5.179 -12.273 -2.211 1.00 0.00 C ATOM 1506 CG1 ILE A 104 6.068 -12.379 -3.453 1.00 0.00 C ATOM 1507 CG2 ILE A 104 5.985 -11.632 -1.074 1.00 0.00 C ATOM 1508 CD1 ILE A 104 6.550 -10.985 -3.858 1.00 0.00 C ATOM 0 H ILE A 104 2.800 -13.202 -2.665 1.00 0.00 H new ATOM 0 HA ILE A 104 5.472 -14.403 -2.059 1.00 0.00 H new ATOM 0 HB ILE A 104 4.308 -11.652 -2.420 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.922 -13.025 -3.248 1.00 0.00 H new ATOM 0 HG13 ILE A 104 5.513 -12.835 -4.272 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.317 -10.639 -1.378 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.359 -11.549 -0.186 1.00 0.00 H new ATOM 0 HG23 ILE A 104 6.853 -12.252 -0.849 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.183 -11.061 -4.742 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.690 -10.353 -4.081 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.121 -10.546 -3.040 1.00 0.00 H new ATOM 1520 N GLN A 105 5.400 -14.146 0.470 1.00 0.00 N ATOM 1521 CA GLN A 105 5.200 -14.238 1.946 1.00 0.00 C ATOM 1522 C GLN A 105 4.615 -12.919 2.468 1.00 0.00 C ATOM 1523 O GLN A 105 5.301 -11.917 2.499 1.00 0.00 O ATOM 1524 CB GLN A 105 6.548 -14.492 2.626 1.00 0.00 C ATOM 1525 CG GLN A 105 6.961 -15.949 2.417 1.00 0.00 C ATOM 1526 CD GLN A 105 7.850 -16.056 1.176 1.00 0.00 C ATOM 1527 OE1 GLN A 105 9.042 -15.830 1.246 1.00 0.00 O ATOM 1528 NE2 GLN A 105 7.317 -16.394 0.032 1.00 0.00 N ATOM 0 H GLN A 105 6.328 -14.412 0.141 1.00 0.00 H new ATOM 0 HA GLN A 105 4.514 -15.056 2.168 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.306 -13.826 2.214 1.00 0.00 H new ATOM 0 HB3 GLN A 105 6.476 -14.273 3.691 1.00 0.00 H new ATOM 0 HG2 GLN A 105 7.496 -16.315 3.293 1.00 0.00 H new ATOM 0 HG3 GLN A 105 6.077 -16.575 2.299 1.00 0.00 H new ATOM 0 HE21 GLN A 105 6.317 -16.584 -0.028 1.00 0.00 H new ATOM 0 HE22 GLN A 105 7.901 -16.468 -0.801 1.00 0.00 H new ATOM 1537 N PRO A 106 3.366 -12.953 2.865 1.00 0.00 N ATOM 1538 CA PRO A 106 2.682 -11.757 3.390 1.00 0.00 C ATOM 1539 C PRO A 106 3.379 -11.266 4.663 1.00 0.00 C ATOM 1540 O PRO A 106 3.461 -10.082 4.921 1.00 0.00 O ATOM 1541 CB PRO A 106 1.254 -12.224 3.703 1.00 0.00 C ATOM 1542 CG PRO A 106 1.163 -13.731 3.353 1.00 0.00 C ATOM 1543 CD PRO A 106 2.538 -14.172 2.824 1.00 0.00 C ATOM 0 HA PRO A 106 2.694 -10.928 2.682 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.020 -12.061 4.755 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.529 -11.652 3.123 1.00 0.00 H new ATOM 0 HG2 PRO A 106 0.888 -14.312 4.233 1.00 0.00 H new ATOM 0 HG3 PRO A 106 0.391 -13.903 2.603 1.00 0.00 H new ATOM 0 HD2 PRO A 106 2.965 -14.961 3.443 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.464 -14.566 1.810 1.00 0.00 H new ATOM 1551 N GLY A 107 3.879 -12.169 5.461 1.00 0.00 N ATOM 1552 CA GLY A 107 4.567 -11.758 6.717 1.00 0.00 C ATOM 1553 C GLY A 107 6.037 -11.458 6.419 1.00 0.00 C ATOM 1554 O GLY A 107 6.926 -11.904 7.118 1.00 0.00 O ATOM 0 H GLY A 107 3.841 -13.175 5.297 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.083 -10.877 7.138 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.490 -12.550 7.462 1.00 0.00 H new ATOM 1558 N THR A 108 6.301 -10.705 5.387 1.00 0.00 N ATOM 1559 CA THR A 108 7.714 -10.378 5.046 1.00 0.00 C ATOM 1560 C THR A 108 7.775 -8.987 4.409 1.00 0.00 C ATOM 1561 O THR A 108 8.681 -8.219 4.662 1.00 0.00 O ATOM 1562 CB THR A 108 8.252 -11.415 4.058 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.450 -12.650 4.733 1.00 0.00 O ATOM 1564 CG2 THR A 108 9.579 -10.925 3.474 1.00 0.00 C ATOM 0 H THR A 108 5.600 -10.302 4.765 1.00 0.00 H new ATOM 0 HA THR A 108 8.320 -10.390 5.952 1.00 0.00 H new ATOM 0 HB THR A 108 7.535 -11.556 3.249 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.128 -12.574 5.656 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.962 -11.664 2.770 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.421 -9.979 2.956 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.300 -10.783 4.279 1.00 0.00 H new ATOM 1572 N ALA A 109 6.820 -8.659 3.583 1.00 0.00 N ATOM 1573 CA ALA A 109 6.825 -7.319 2.930 1.00 0.00 C ATOM 1574 C ALA A 109 6.104 -6.311 3.823 1.00 0.00 C ATOM 1575 O ALA A 109 6.265 -5.116 3.682 1.00 0.00 O ATOM 1576 CB ALA A 109 6.106 -7.408 1.583 1.00 0.00 C ATOM 0 H ALA A 109 6.036 -9.261 3.332 1.00 0.00 H new ATOM 0 HA ALA A 109 7.854 -6.995 2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.109 -6.429 1.104 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.619 -8.126 0.944 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.077 -7.732 1.740 1.00 0.00 H new ATOM 1582 N ALA A 110 5.307 -6.782 4.742 1.00 0.00 N ATOM 1583 CA ALA A 110 4.573 -5.848 5.641 1.00 0.00 C ATOM 1584 C ALA A 110 5.530 -5.301 6.701 1.00 0.00 C ATOM 1585 O ALA A 110 5.571 -4.115 6.960 1.00 0.00 O ATOM 1586 CB ALA A 110 3.427 -6.595 6.327 1.00 0.00 C ATOM 0 H ALA A 110 5.132 -7.773 4.909 1.00 0.00 H new ATOM 0 HA ALA A 110 4.170 -5.022 5.055 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.890 -5.912 6.985 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.744 -6.985 5.573 1.00 0.00 H new ATOM 0 HB3 ALA A 110 3.830 -7.421 6.913 1.00 0.00 H new ATOM 1592 N ASN A 111 6.300 -6.156 7.319 1.00 0.00 N ATOM 1593 CA ASN A 111 7.250 -5.682 8.365 1.00 0.00 C ATOM 1594 C ASN A 111 8.285 -4.754 7.729 1.00 0.00 C ATOM 1595 O ASN A 111 8.636 -3.730 8.280 1.00 0.00 O ATOM 1596 CB ASN A 111 7.961 -6.882 8.995 1.00 0.00 C ATOM 1597 CG ASN A 111 8.223 -6.597 10.475 1.00 0.00 C ATOM 1598 OD1 ASN A 111 7.751 -5.612 11.008 1.00 0.00 O ATOM 1599 ND2 ASN A 111 8.960 -7.421 11.168 1.00 0.00 N ATOM 0 H ASN A 111 6.312 -7.161 7.145 1.00 0.00 H new ATOM 0 HA ASN A 111 6.700 -5.142 9.136 1.00 0.00 H new ATOM 0 HB2 ASN A 111 7.350 -7.778 8.888 1.00 0.00 H new ATOM 0 HB3 ASN A 111 8.901 -7.074 8.478 1.00 0.00 H new ATOM 0 HD21 ASN A 111 9.139 -7.238 12.155 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.357 -8.248 10.722 1.00 0.00 H new ATOM 1606 N VAL A 112 8.776 -5.102 6.572 1.00 0.00 N ATOM 1607 CA VAL A 112 9.785 -4.235 5.905 1.00 0.00 C ATOM 1608 C VAL A 112 9.163 -2.875 5.590 1.00 0.00 C ATOM 1609 O VAL A 112 9.845 -1.874 5.499 1.00 0.00 O ATOM 1610 CB VAL A 112 10.252 -4.892 4.618 1.00 0.00 C ATOM 1611 CG1 VAL A 112 11.267 -3.987 3.919 1.00 0.00 C ATOM 1612 CG2 VAL A 112 10.902 -6.241 4.936 1.00 0.00 C ATOM 0 H VAL A 112 8.522 -5.948 6.061 1.00 0.00 H new ATOM 0 HA VAL A 112 10.638 -4.097 6.569 1.00 0.00 H new ATOM 0 HB VAL A 112 9.396 -5.049 3.962 1.00 0.00 H new ATOM 0 HG11 VAL A 112 11.601 -4.460 2.996 1.00 0.00 H new ATOM 0 HG12 VAL A 112 10.802 -3.029 3.688 1.00 0.00 H new ATOM 0 HG13 VAL A 112 12.123 -3.826 4.574 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.236 -6.711 4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.757 -6.087 5.594 1.00 0.00 H new ATOM 0 HG23 VAL A 112 10.176 -6.887 5.429 1.00 0.00 H new ATOM 1622 N VAL A 113 7.867 -2.830 5.424 1.00 0.00 N ATOM 1623 CA VAL A 113 7.202 -1.533 5.117 1.00 0.00 C ATOM 1624 C VAL A 113 6.858 -0.817 6.425 1.00 0.00 C ATOM 1625 O VAL A 113 6.698 0.386 6.461 1.00 0.00 O ATOM 1626 CB VAL A 113 5.917 -1.789 4.326 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.091 -0.503 4.266 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.272 -2.233 2.905 1.00 0.00 C ATOM 0 H VAL A 113 7.243 -3.634 5.488 1.00 0.00 H new ATOM 0 HA VAL A 113 7.875 -0.912 4.525 1.00 0.00 H new ATOM 0 HB VAL A 113 5.338 -2.571 4.817 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.176 -0.684 3.703 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.838 -0.186 5.278 1.00 0.00 H new ATOM 0 HG13 VAL A 113 5.670 0.279 3.775 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.357 -2.415 2.342 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.851 -1.451 2.414 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.861 -3.149 2.947 1.00 0.00 H new ATOM 1638 N GLU A 114 6.742 -1.548 7.501 1.00 0.00 N ATOM 1639 CA GLU A 114 6.410 -0.915 8.800 1.00 0.00 C ATOM 1640 C GLU A 114 7.542 0.030 9.206 1.00 0.00 C ATOM 1641 O GLU A 114 7.312 1.128 9.672 1.00 0.00 O ATOM 1642 CB GLU A 114 6.249 -2.006 9.856 1.00 0.00 C ATOM 1643 CG GLU A 114 5.863 -1.364 11.183 1.00 0.00 C ATOM 1644 CD GLU A 114 5.066 -2.362 12.025 1.00 0.00 C ATOM 1645 OE1 GLU A 114 4.086 -2.884 11.518 1.00 0.00 O ATOM 1646 OE2 GLU A 114 5.446 -2.585 13.162 1.00 0.00 O ATOM 0 H GLU A 114 6.864 -2.560 7.531 1.00 0.00 H new ATOM 0 HA GLU A 114 5.482 -0.349 8.713 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.484 -2.718 9.547 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.179 -2.564 9.965 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.758 -1.052 11.721 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.269 -0.467 11.005 1.00 0.00 H new ATOM 1653 N LYS A 115 8.765 -0.389 9.026 1.00 0.00 N ATOM 1654 CA LYS A 115 9.913 0.484 9.396 1.00 0.00 C ATOM 1655 C LYS A 115 10.113 1.539 8.310 1.00 0.00 C ATOM 1656 O LYS A 115 10.190 2.720 8.584 1.00 0.00 O ATOM 1657 CB LYS A 115 11.179 -0.364 9.523 1.00 0.00 C ATOM 1658 CG LYS A 115 11.815 -0.128 10.894 1.00 0.00 C ATOM 1659 CD LYS A 115 13.032 -1.040 11.059 1.00 0.00 C ATOM 1660 CE LYS A 115 13.271 -1.302 12.546 1.00 0.00 C ATOM 1661 NZ LYS A 115 11.986 -1.697 13.190 1.00 0.00 N ATOM 0 H LYS A 115 9.018 -1.298 8.639 1.00 0.00 H new ATOM 0 HA LYS A 115 9.709 0.973 10.348 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.937 -1.419 9.399 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.884 -0.104 8.733 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.114 0.916 10.993 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.089 -0.327 11.682 1.00 0.00 H new ATOM 0 HD2 LYS A 115 12.869 -1.981 10.534 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.912 -0.575 10.614 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.012 -2.091 12.673 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.671 -0.408 13.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.170 -2.413 13.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.545 -0.862 13.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.345 -2.092 12.473 1.00 0.00 H new ATOM 1675 N LEU A 116 10.196 1.126 7.076 1.00 0.00 N ATOM 1676 CA LEU A 116 10.388 2.110 5.976 1.00 0.00 C ATOM 1677 C LEU A 116 9.362 3.232 6.124 1.00 0.00 C ATOM 1678 O LEU A 116 9.628 4.373 5.808 1.00 0.00 O ATOM 1679 CB LEU A 116 10.200 1.416 4.626 1.00 0.00 C ATOM 1680 CG LEU A 116 11.318 1.841 3.671 1.00 0.00 C ATOM 1681 CD1 LEU A 116 12.676 1.613 4.336 1.00 0.00 C ATOM 1682 CD2 LEU A 116 11.232 1.007 2.390 1.00 0.00 C ATOM 0 H LEU A 116 10.139 0.151 6.782 1.00 0.00 H new ATOM 0 HA LEU A 116 11.395 2.525 6.027 1.00 0.00 H new ATOM 0 HB2 LEU A 116 10.212 0.334 4.757 1.00 0.00 H new ATOM 0 HB3 LEU A 116 9.229 1.676 4.204 1.00 0.00 H new ATOM 0 HG LEU A 116 11.208 2.898 3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.471 1.916 3.654 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.737 2.204 5.250 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.790 0.556 4.578 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.027 1.307 1.707 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.343 -0.049 2.635 1.00 0.00 H new ATOM 0 HD23 LEU A 116 10.265 1.169 1.915 1.00 0.00 H new ATOM 1694 N ALA A 117 8.193 2.920 6.613 1.00 0.00 N ATOM 1695 CA ALA A 117 7.158 3.973 6.793 1.00 0.00 C ATOM 1696 C ALA A 117 7.681 5.004 7.791 1.00 0.00 C ATOM 1697 O ALA A 117 7.625 6.196 7.561 1.00 0.00 O ATOM 1698 CB ALA A 117 5.876 3.342 7.338 1.00 0.00 C ATOM 0 H ALA A 117 7.911 1.981 6.895 1.00 0.00 H new ATOM 0 HA ALA A 117 6.943 4.452 5.838 1.00 0.00 H new ATOM 0 HB1 ALA A 117 5.118 4.114 7.470 1.00 0.00 H new ATOM 0 HB2 ALA A 117 5.512 2.592 6.635 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.083 2.869 8.298 1.00 0.00 H new ATOM 1704 N ASP A 118 8.199 4.547 8.898 1.00 0.00 N ATOM 1705 CA ASP A 118 8.737 5.488 9.917 1.00 0.00 C ATOM 1706 C ASP A 118 9.897 6.276 9.307 1.00 0.00 C ATOM 1707 O ASP A 118 10.315 7.291 9.828 1.00 0.00 O ATOM 1708 CB ASP A 118 9.239 4.698 11.127 1.00 0.00 C ATOM 1709 CG ASP A 118 8.516 5.175 12.387 1.00 0.00 C ATOM 1710 OD1 ASP A 118 7.505 5.844 12.250 1.00 0.00 O ATOM 1711 OD2 ASP A 118 8.984 4.861 13.469 1.00 0.00 O ATOM 0 H ASP A 118 8.272 3.559 9.140 1.00 0.00 H new ATOM 0 HA ASP A 118 7.952 6.174 10.234 1.00 0.00 H new ATOM 0 HB2 ASP A 118 9.064 3.633 10.976 1.00 0.00 H new ATOM 0 HB3 ASP A 118 10.315 4.832 11.240 1.00 0.00 H new ATOM 1716 N TYR A 119 10.417 5.814 8.205 1.00 0.00 N ATOM 1717 CA TYR A 119 11.550 6.530 7.554 1.00 0.00 C ATOM 1718 C TYR A 119 10.990 7.663 6.682 1.00 0.00 C ATOM 1719 O TYR A 119 11.452 8.785 6.731 1.00 0.00 O ATOM 1720 CB TYR A 119 12.360 5.517 6.714 1.00 0.00 C ATOM 1721 CG TYR A 119 12.671 6.058 5.334 1.00 0.00 C ATOM 1722 CD1 TYR A 119 13.440 7.219 5.195 1.00 0.00 C ATOM 1723 CD2 TYR A 119 12.189 5.397 4.197 1.00 0.00 C ATOM 1724 CE1 TYR A 119 13.728 7.720 3.920 1.00 0.00 C ATOM 1725 CE2 TYR A 119 12.477 5.898 2.922 1.00 0.00 C ATOM 1726 CZ TYR A 119 13.247 7.059 2.784 1.00 0.00 C ATOM 1727 OH TYR A 119 13.531 7.553 1.526 1.00 0.00 O ATOM 0 H TYR A 119 10.106 4.969 7.725 1.00 0.00 H new ATOM 0 HA TYR A 119 12.213 6.970 8.299 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.290 5.278 7.229 1.00 0.00 H new ATOM 0 HB3 TYR A 119 11.798 4.588 6.623 1.00 0.00 H new ATOM 0 HD1 TYR A 119 13.811 7.729 6.072 1.00 0.00 H new ATOM 0 HD2 TYR A 119 11.595 4.501 4.304 1.00 0.00 H new ATOM 0 HE1 TYR A 119 14.321 8.616 3.813 1.00 0.00 H new ATOM 0 HE2 TYR A 119 12.105 5.389 2.045 1.00 0.00 H new ATOM 0 HH TYR A 119 13.123 6.975 0.848 1.00 0.00 H new ATOM 1737 N LEU A 120 10.001 7.371 5.885 1.00 0.00 N ATOM 1738 CA LEU A 120 9.412 8.420 5.009 1.00 0.00 C ATOM 1739 C LEU A 120 8.429 9.271 5.817 1.00 0.00 C ATOM 1740 O LEU A 120 7.928 10.273 5.346 1.00 0.00 O ATOM 1741 CB LEU A 120 8.671 7.746 3.857 1.00 0.00 C ATOM 1742 CG LEU A 120 9.592 7.655 2.641 1.00 0.00 C ATOM 1743 CD1 LEU A 120 9.365 6.319 1.931 1.00 0.00 C ATOM 1744 CD2 LEU A 120 9.277 8.803 1.682 1.00 0.00 C ATOM 0 H LEU A 120 9.574 6.448 5.803 1.00 0.00 H new ATOM 0 HA LEU A 120 10.204 9.059 4.618 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.345 6.749 4.154 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.775 8.313 3.606 1.00 0.00 H new ATOM 0 HG LEU A 120 10.631 7.723 2.962 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.021 6.252 1.063 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.585 5.501 2.616 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.327 6.251 1.607 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.932 8.741 0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.238 8.733 1.359 1.00 0.00 H new ATOM 0 HD23 LEU A 120 9.436 9.755 2.189 1.00 0.00 H new ATOM 1756 N ILE A 121 8.148 8.878 7.028 1.00 0.00 N ATOM 1757 CA ILE A 121 7.196 9.661 7.866 1.00 0.00 C ATOM 1758 C ILE A 121 7.969 10.712 8.663 1.00 0.00 C ATOM 1759 O ILE A 121 7.415 11.695 9.114 1.00 0.00 O ATOM 1760 CB ILE A 121 6.469 8.717 8.825 1.00 0.00 C ATOM 1761 CG1 ILE A 121 5.567 7.776 8.023 1.00 0.00 C ATOM 1762 CG2 ILE A 121 5.616 9.530 9.800 1.00 0.00 C ATOM 1763 CD1 ILE A 121 5.389 6.462 8.787 1.00 0.00 C ATOM 0 H ILE A 121 8.537 8.047 7.475 1.00 0.00 H new ATOM 0 HA ILE A 121 6.466 10.157 7.227 1.00 0.00 H new ATOM 0 HB ILE A 121 7.201 8.135 9.385 1.00 0.00 H new ATOM 0 HG12 ILE A 121 4.597 8.243 7.852 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.005 7.583 7.044 1.00 0.00 H new ATOM 0 HG21 ILE A 121 5.099 8.855 10.482 1.00 0.00 H new ATOM 0 HG22 ILE A 121 6.257 10.202 10.371 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.883 10.114 9.243 1.00 0.00 H new ATOM 0 HD11 ILE A 121 4.746 5.793 8.215 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.362 5.993 8.935 1.00 0.00 H new ATOM 0 HD13 ILE A 121 4.932 6.663 9.756 1.00 0.00 H new ATOM 1775 N GLY A 122 9.247 10.515 8.840 1.00 0.00 N ATOM 1776 CA GLY A 122 10.055 11.504 9.607 1.00 0.00 C ATOM 1777 C GLY A 122 11.050 12.192 8.669 1.00 0.00 C ATOM 1778 O GLY A 122 11.813 13.045 9.078 1.00 0.00 O ATOM 0 H GLY A 122 9.766 9.711 8.486 1.00 0.00 H new ATOM 0 HA2 GLY A 122 9.401 12.245 10.066 1.00 0.00 H new ATOM 0 HA3 GLY A 122 10.588 11.004 10.416 1.00 0.00 H new ATOM 1782 N GLN A 123 11.049 11.829 7.414 1.00 0.00 N ATOM 1783 CA GLN A 123 11.994 12.464 6.452 1.00 0.00 C ATOM 1784 C GLN A 123 11.285 12.691 5.115 1.00 0.00 C ATOM 1785 O GLN A 123 11.360 13.757 4.537 1.00 0.00 O ATOM 1786 CB GLN A 123 13.201 11.550 6.238 1.00 0.00 C ATOM 1787 CG GLN A 123 13.859 11.240 7.583 1.00 0.00 C ATOM 1788 CD GLN A 123 15.379 11.317 7.434 1.00 0.00 C ATOM 1789 OE1 GLN A 123 16.061 10.313 7.509 1.00 0.00 O ATOM 1790 NE2 GLN A 123 15.943 12.474 7.222 1.00 0.00 N ATOM 0 H GLN A 123 10.434 11.120 7.014 1.00 0.00 H new ATOM 0 HA GLN A 123 12.330 13.420 6.854 1.00 0.00 H new ATOM 0 HB2 GLN A 123 12.887 10.625 5.754 1.00 0.00 H new ATOM 0 HB3 GLN A 123 13.919 12.030 5.573 1.00 0.00 H new ATOM 0 HG2 GLN A 123 13.520 11.949 8.338 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.566 10.247 7.924 1.00 0.00 H new ATOM 0 HE21 GLN A 123 15.371 13.316 7.159 1.00 0.00 H new ATOM 0 HE22 GLN A 123 16.956 12.536 7.119 1.00 0.00 H new ATOM 1799 N GLY A 124 10.598 11.699 4.619 1.00 0.00 N ATOM 1800 CA GLY A 124 9.888 11.860 3.317 1.00 0.00 C ATOM 1801 C GLY A 124 8.637 12.717 3.519 1.00 0.00 C ATOM 1802 O GLY A 124 8.713 13.926 3.625 1.00 0.00 O ATOM 0 H GLY A 124 10.497 10.784 5.058 1.00 0.00 H new ATOM 0 HA2 GLY A 124 10.548 12.328 2.587 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.612 10.884 2.918 1.00 0.00 H new ATOM 1806 N PHE A 125 7.486 12.105 3.573 1.00 0.00 N ATOM 1807 CA PHE A 125 6.232 12.890 3.769 1.00 0.00 C ATOM 1808 C PHE A 125 5.712 12.664 5.190 1.00 0.00 C ATOM 1809 O PHE A 125 5.621 11.515 5.590 1.00 0.00 O ATOM 1810 CB PHE A 125 5.159 12.448 2.761 1.00 0.00 C ATOM 1811 CG PHE A 125 5.799 11.708 1.607 1.00 0.00 C ATOM 1812 CD1 PHE A 125 6.859 12.291 0.902 1.00 0.00 C ATOM 1813 CD2 PHE A 125 5.331 10.440 1.244 1.00 0.00 C ATOM 1814 CE1 PHE A 125 7.451 11.605 -0.165 1.00 0.00 C ATOM 1815 CE2 PHE A 125 5.923 9.754 0.177 1.00 0.00 C ATOM 1816 CZ PHE A 125 6.983 10.336 -0.528 1.00 0.00 C ATOM 1817 OXT PHE A 125 5.413 13.643 5.854 1.00 0.00 O ATOM 0 H PHE A 125 7.358 11.096 3.490 1.00 0.00 H new ATOM 0 HA PHE A 125 6.449 13.947 3.613 1.00 0.00 H new ATOM 0 HB2 PHE A 125 4.429 11.806 3.254 1.00 0.00 H new ATOM 0 HB3 PHE A 125 4.618 13.318 2.389 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.220 13.270 1.181 1.00 0.00 H new ATOM 0 HD2 PHE A 125 4.513 9.991 1.787 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.269 12.055 -0.708 1.00 0.00 H new ATOM 0 HE2 PHE A 125 5.562 8.775 -0.102 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.440 9.807 -1.351 1.00 0.00 H new TER 1827 PHE A 125