USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 590 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 69 TYR OH : rot 147:sc= -0.949 USER MOD Set 1.2: A 77 GLN : amide:sc= -2.01! K(o=-3!,f=-2) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HD1:sc= -0.713 K(o=-0.71,f=-0.19) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 113:sc= -0.182! USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0.327 X(o=0.33,f=0) USER MOD Single : A 74 SER OG : rot 105:sc= -0.866! USER MOD Single : A 87 SER OG : rot 180:sc= -3.87! USER MOD Single : A 89 HIS : no HD1:sc= -3.44! K(o=-3.4!,f=-0.27) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.00563 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -2.9! C(o=-2.9!,f=-4!) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -2.57! K(o=-2.6!,f=-0.93) USER MOD Single : A 104 GLN : amide:sc=-0.00979 K(o=-0.0098,f=-1.2!) USER MOD Single : A 106 ASN : amide:sc= -2.05! C(o=-2!,f=-7.5!) USER MOD Single : A 107 SER OG : rot 70:sc= -0.891 USER MOD Single : A 109 SER OG : rot 37:sc= 0.596 USER MOD Single : A 112 CYS SG : rot 38:sc= 1.2 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.0149 USER MOD Single : A 119 LYS NZ :NH3+ -154:sc= -0.36 (180deg=-1.32!) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -7.73! C(o=-7.7!,f=-1.1!) USER MOD Single : A 130 ASN : amide:sc= -0.368 X(o=-0.37,f=-0.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 51 -19.201 9.031 44.688 1.00 0.00 N ATOM 2 CA MET A 51 -18.506 8.897 46.001 1.00 0.00 C ATOM 3 C MET A 51 -17.537 10.060 46.180 1.00 0.00 C ATOM 4 O MET A 51 -17.199 10.431 47.305 1.00 0.00 O ATOM 5 CB MET A 51 -17.745 7.571 46.039 1.00 0.00 C ATOM 6 CG MET A 51 -18.515 6.568 46.900 1.00 0.00 C ATOM 7 SD MET A 51 -20.081 6.157 46.092 1.00 0.00 S ATOM 8 CE MET A 51 -19.568 4.564 45.405 1.00 0.00 C ATOM 0 HA MET A 51 -19.237 8.913 46.809 1.00 0.00 H new ATOM 0 HB2 MET A 51 -17.622 7.181 45.029 1.00 0.00 H new ATOM 0 HB3 MET A 51 -16.745 7.724 46.446 1.00 0.00 H new ATOM 0 HG2 MET A 51 -17.921 5.666 47.046 1.00 0.00 H new ATOM 0 HG3 MET A 51 -18.703 6.989 47.888 1.00 0.00 H new ATOM 0 HE1 MET A 51 -20.397 4.122 44.853 1.00 0.00 H new ATOM 0 HE2 MET A 51 -18.723 4.713 44.733 1.00 0.00 H new ATOM 0 HE3 MET A 51 -19.274 3.896 46.215 1.00 0.00 H new ATOM 20 N HIS A 52 -17.093 10.635 45.067 1.00 0.00 N ATOM 21 CA HIS A 52 -16.167 11.759 45.119 1.00 0.00 C ATOM 22 C HIS A 52 -16.927 13.075 44.982 1.00 0.00 C ATOM 23 O HIS A 52 -17.574 13.323 43.966 1.00 0.00 O ATOM 24 CB HIS A 52 -15.136 11.644 43.992 1.00 0.00 C ATOM 25 CG HIS A 52 -14.706 10.210 43.847 1.00 0.00 C ATOM 26 ND1 HIS A 52 -14.308 9.679 42.630 1.00 0.00 N ATOM 27 CD2 HIS A 52 -14.608 9.183 44.754 1.00 0.00 C ATOM 28 CE1 HIS A 52 -13.990 8.386 42.836 1.00 0.00 C ATOM 29 NE2 HIS A 52 -14.157 8.034 44.113 1.00 0.00 N ATOM 0 H HIS A 52 -17.357 10.344 44.126 1.00 0.00 H new ATOM 0 HA HIS A 52 -15.653 11.741 46.080 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -15.564 12.002 43.056 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -14.273 12.273 44.209 1.00 0.00 H new ATOM 0 HD2 HIS A 52 -14.845 9.257 45.805 1.00 0.00 H new ATOM 0 HE1 HIS A 52 -13.643 7.716 42.063 1.00 0.00 H new ATOM 0 HE2 HIS A 52 -13.990 7.118 44.530 1.00 0.00 H new ATOM 38 N LEU A 53 -16.847 13.910 46.011 1.00 0.00 N ATOM 39 CA LEU A 53 -17.538 15.193 45.985 1.00 0.00 C ATOM 40 C LEU A 53 -16.598 16.304 45.532 1.00 0.00 C ATOM 41 O LEU A 53 -15.623 16.624 46.211 1.00 0.00 O ATOM 42 CB LEU A 53 -18.080 15.520 47.379 1.00 0.00 C ATOM 43 CG LEU A 53 -19.266 16.477 47.253 1.00 0.00 C ATOM 44 CD1 LEU A 53 -18.840 17.715 46.463 1.00 0.00 C ATOM 45 CD2 LEU A 53 -20.410 15.773 46.518 1.00 0.00 C ATOM 0 H LEU A 53 -16.318 13.726 46.863 1.00 0.00 H new ATOM 0 HA LEU A 53 -18.364 15.123 45.277 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -18.389 14.605 47.884 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -17.297 15.972 47.988 1.00 0.00 H new ATOM 0 HG LEU A 53 -19.600 16.777 48.246 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -19.685 18.398 46.373 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -18.023 18.215 46.983 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -18.508 17.416 45.469 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -21.257 16.453 46.427 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -20.075 15.475 45.524 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -20.713 14.889 47.079 1.00 0.00 H new ATOM 57 N THR A 54 -16.904 16.890 44.380 1.00 0.00 N ATOM 58 CA THR A 54 -16.086 17.970 43.842 1.00 0.00 C ATOM 59 C THR A 54 -16.950 19.182 43.516 1.00 0.00 C ATOM 60 O THR A 54 -17.977 19.059 42.846 1.00 0.00 O ATOM 61 CB THR A 54 -15.365 17.501 42.577 1.00 0.00 C ATOM 62 OG1 THR A 54 -15.190 18.604 41.697 1.00 0.00 O ATOM 63 CG2 THR A 54 -16.194 16.421 41.881 1.00 0.00 C ATOM 0 H THR A 54 -17.707 16.637 43.804 1.00 0.00 H new ATOM 0 HA THR A 54 -15.350 18.252 44.595 1.00 0.00 H new ATOM 0 HB THR A 54 -14.392 17.090 42.847 1.00 0.00 H new ATOM 0 HG1 THR A 54 -14.727 18.306 40.887 1.00 0.00 H new ATOM 0 HG21 THR A 54 -15.677 16.090 40.980 1.00 0.00 H new ATOM 0 HG22 THR A 54 -16.328 15.575 42.555 1.00 0.00 H new ATOM 0 HG23 THR A 54 -17.169 16.828 41.611 1.00 0.00 H new ATOM 71 N TYR A 55 -16.530 20.351 43.983 1.00 0.00 N ATOM 72 CA TYR A 55 -17.278 21.574 43.720 1.00 0.00 C ATOM 73 C TYR A 55 -16.411 22.570 42.959 1.00 0.00 C ATOM 74 O TYR A 55 -15.192 22.599 43.129 1.00 0.00 O ATOM 75 CB TYR A 55 -17.738 22.198 45.039 1.00 0.00 C ATOM 76 CG TYR A 55 -16.539 22.718 45.793 1.00 0.00 C ATOM 77 CD1 TYR A 55 -16.006 23.975 45.483 1.00 0.00 C ATOM 78 CD2 TYR A 55 -15.958 21.942 46.803 1.00 0.00 C ATOM 79 CE1 TYR A 55 -14.894 24.457 46.182 1.00 0.00 C ATOM 80 CE2 TYR A 55 -14.844 22.424 47.502 1.00 0.00 C ATOM 81 CZ TYR A 55 -14.312 23.681 47.192 1.00 0.00 C ATOM 82 OH TYR A 55 -13.216 24.155 47.882 1.00 0.00 O ATOM 0 H TYR A 55 -15.685 20.478 44.540 1.00 0.00 H new ATOM 0 HA TYR A 55 -18.150 21.326 43.114 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -18.439 23.010 44.845 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -18.266 21.457 45.640 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -16.454 24.573 44.703 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -16.368 20.972 47.043 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -14.485 25.427 45.943 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -14.395 21.825 48.281 1.00 0.00 H new ATOM 0 HH TYR A 55 -13.466 24.331 48.813 1.00 0.00 H new ATOM 92 N GLU A 56 -17.044 23.383 42.121 1.00 0.00 N ATOM 93 CA GLU A 56 -16.311 24.373 41.342 1.00 0.00 C ATOM 94 C GLU A 56 -17.220 25.527 40.936 1.00 0.00 C ATOM 95 O GLU A 56 -18.353 25.317 40.503 1.00 0.00 O ATOM 96 CB GLU A 56 -15.721 23.722 40.090 1.00 0.00 C ATOM 97 CG GLU A 56 -14.743 24.691 39.423 1.00 0.00 C ATOM 98 CD GLU A 56 -15.409 25.374 38.233 1.00 0.00 C ATOM 99 OE1 GLU A 56 -16.627 25.411 38.203 1.00 0.00 O ATOM 100 OE2 GLU A 56 -14.690 25.847 37.367 1.00 0.00 O ATOM 0 H GLU A 56 -18.052 23.377 41.965 1.00 0.00 H new ATOM 0 HA GLU A 56 -15.506 24.765 41.963 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.209 22.797 40.355 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.518 23.457 39.395 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -14.413 25.439 40.143 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.855 24.153 39.093 1.00 0.00 H new ATOM 107 N ILE A 57 -16.708 26.745 41.066 1.00 0.00 N ATOM 108 CA ILE A 57 -17.473 27.929 40.698 1.00 0.00 C ATOM 109 C ILE A 57 -17.052 28.404 39.311 1.00 0.00 C ATOM 110 O ILE A 57 -16.041 27.951 38.777 1.00 0.00 O ATOM 111 CB ILE A 57 -17.242 29.038 41.727 1.00 0.00 C ATOM 112 CG1 ILE A 57 -17.630 28.527 43.117 1.00 0.00 C ATOM 113 CG2 ILE A 57 -18.100 30.254 41.376 1.00 0.00 C ATOM 114 CD1 ILE A 57 -16.373 28.093 43.873 1.00 0.00 C ATOM 0 H ILE A 57 -15.772 26.938 41.421 1.00 0.00 H new ATOM 0 HA ILE A 57 -18.534 27.680 40.681 1.00 0.00 H new ATOM 0 HB ILE A 57 -16.190 29.325 41.720 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -18.148 29.309 43.672 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -18.321 27.689 43.028 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -17.933 31.042 42.111 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -17.827 30.618 40.385 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -19.152 29.970 41.381 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -16.651 27.729 44.862 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -15.873 27.297 43.321 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -15.698 28.943 43.975 1.00 0.00 H new ATOM 126 N PHE A 58 -17.830 29.306 38.725 1.00 0.00 N ATOM 127 CA PHE A 58 -17.513 29.813 37.394 1.00 0.00 C ATOM 128 C PHE A 58 -17.611 31.335 37.347 1.00 0.00 C ATOM 129 O PHE A 58 -18.202 31.958 38.230 1.00 0.00 O ATOM 130 CB PHE A 58 -18.473 29.208 36.367 1.00 0.00 C ATOM 131 CG PHE A 58 -19.729 28.741 37.062 1.00 0.00 C ATOM 132 CD1 PHE A 58 -20.786 29.634 37.271 1.00 0.00 C ATOM 133 CD2 PHE A 58 -19.837 27.414 37.495 1.00 0.00 C ATOM 134 CE1 PHE A 58 -21.952 29.200 37.915 1.00 0.00 C ATOM 135 CE2 PHE A 58 -21.003 26.980 38.138 1.00 0.00 C ATOM 136 CZ PHE A 58 -22.061 27.874 38.348 1.00 0.00 C ATOM 0 H PHE A 58 -18.674 29.698 39.143 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.489 29.526 37.157 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -18.720 29.948 35.605 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.996 28.372 35.856 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -20.703 30.657 36.936 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -19.021 26.725 37.333 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -22.767 29.889 38.077 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -21.087 25.956 38.472 1.00 0.00 H new ATOM 0 HZ PHE A 58 -22.960 27.540 38.844 1.00 0.00 H new ATOM 146 N GLY A 59 -17.028 31.922 36.307 1.00 0.00 N ATOM 147 CA GLY A 59 -17.051 33.371 36.143 1.00 0.00 C ATOM 148 C GLY A 59 -16.290 33.783 34.884 1.00 0.00 C ATOM 149 O GLY A 59 -15.263 33.190 34.552 1.00 0.00 O ATOM 0 H GLY A 59 -16.536 31.419 35.568 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.082 33.719 36.081 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -16.606 33.848 37.016 1.00 0.00 H new ATOM 153 N PRO A 60 -16.767 34.779 34.183 1.00 0.00 N ATOM 154 CA PRO A 60 -16.110 35.270 32.940 1.00 0.00 C ATOM 155 C PRO A 60 -14.592 35.334 33.077 1.00 0.00 C ATOM 156 O PRO A 60 -14.061 35.438 34.184 1.00 0.00 O ATOM 157 CB PRO A 60 -16.700 36.666 32.751 1.00 0.00 C ATOM 158 CG PRO A 60 -18.040 36.629 33.410 1.00 0.00 C ATOM 159 CD PRO A 60 -17.982 35.548 34.497 1.00 0.00 C ATOM 0 HA PRO A 60 -16.287 34.607 32.093 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -16.062 37.426 33.203 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -16.790 36.913 31.693 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.282 37.599 33.845 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.820 36.402 32.683 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.928 35.988 35.493 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -18.869 34.915 34.476 1.00 0.00 H new ATOM 167 N PRO A 61 -13.893 35.273 31.977 1.00 0.00 N ATOM 168 CA PRO A 61 -12.403 35.325 31.964 1.00 0.00 C ATOM 169 C PRO A 61 -11.871 36.707 32.336 1.00 0.00 C ATOM 170 O PRO A 61 -12.364 37.725 31.847 1.00 0.00 O ATOM 171 CB PRO A 61 -12.035 34.970 30.520 1.00 0.00 C ATOM 172 CG PRO A 61 -13.241 35.305 29.704 1.00 0.00 C ATOM 173 CD PRO A 61 -14.453 35.148 30.623 1.00 0.00 C ATOM 0 HA PRO A 61 -11.967 34.647 32.697 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -11.166 35.537 30.186 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.781 33.914 30.429 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -13.177 36.323 29.319 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -13.321 34.643 28.842 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -15.203 35.915 30.429 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -14.940 34.183 30.480 1.00 0.00 H new ATOM 181 N GLY A 62 -10.864 36.734 33.204 1.00 0.00 N ATOM 182 CA GLY A 62 -10.275 37.995 33.635 1.00 0.00 C ATOM 183 C GLY A 62 -10.920 38.487 34.926 1.00 0.00 C ATOM 184 O GLY A 62 -10.509 39.500 35.490 1.00 0.00 O ATOM 0 H GLY A 62 -10.442 35.903 33.619 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -9.203 37.867 33.786 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -10.400 38.745 32.853 1.00 0.00 H new ATOM 188 N THR A 63 -11.936 37.764 35.387 1.00 0.00 N ATOM 189 CA THR A 63 -12.633 38.138 36.611 1.00 0.00 C ATOM 190 C THR A 63 -11.932 37.550 37.833 1.00 0.00 C ATOM 191 O THR A 63 -11.623 36.360 37.871 1.00 0.00 O ATOM 192 CB THR A 63 -14.078 37.640 36.562 1.00 0.00 C ATOM 193 OG1 THR A 63 -14.817 38.426 35.638 1.00 0.00 O ATOM 194 CG2 THR A 63 -14.708 37.756 37.951 1.00 0.00 C ATOM 0 H THR A 63 -12.292 36.922 34.935 1.00 0.00 H new ATOM 0 HA THR A 63 -12.625 39.225 36.691 1.00 0.00 H new ATOM 0 HB THR A 63 -14.092 36.597 36.246 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.743 38.107 35.604 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.738 37.401 37.914 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.141 37.152 38.659 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.695 38.798 38.271 1.00 0.00 H new ATOM 202 N VAL A 64 -11.688 38.395 38.829 1.00 0.00 N ATOM 203 CA VAL A 64 -11.027 37.952 40.051 1.00 0.00 C ATOM 204 C VAL A 64 -12.034 37.842 41.191 1.00 0.00 C ATOM 205 O VAL A 64 -12.756 38.793 41.488 1.00 0.00 O ATOM 206 CB VAL A 64 -9.923 38.939 40.433 1.00 0.00 C ATOM 207 CG1 VAL A 64 -10.518 40.343 40.583 1.00 0.00 C ATOM 208 CG2 VAL A 64 -9.292 38.508 41.759 1.00 0.00 C ATOM 0 H VAL A 64 -11.936 39.384 38.815 1.00 0.00 H new ATOM 0 HA VAL A 64 -10.588 36.970 39.873 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.161 38.951 39.653 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.730 41.045 40.855 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.968 40.650 39.639 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -11.281 40.334 41.362 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.505 39.211 42.033 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.054 38.496 42.538 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -8.867 37.510 41.652 1.00 0.00 H new ATOM 218 N ALA A 65 -12.081 36.673 41.824 1.00 0.00 N ATOM 219 CA ALA A 65 -13.010 36.450 42.926 1.00 0.00 C ATOM 220 C ALA A 65 -12.321 35.713 44.070 1.00 0.00 C ATOM 221 O ALA A 65 -11.367 34.965 43.855 1.00 0.00 O ATOM 222 CB ALA A 65 -14.205 35.630 42.439 1.00 0.00 C ATOM 0 H ALA A 65 -11.492 35.872 41.595 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.353 37.419 43.288 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -14.896 35.467 43.266 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -14.716 36.170 41.641 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -13.857 34.668 42.062 1.00 0.00 H new ATOM 228 N ASP A 66 -12.815 35.927 45.286 1.00 0.00 N ATOM 229 CA ASP A 66 -12.244 35.273 46.457 1.00 0.00 C ATOM 230 C ASP A 66 -13.171 34.170 46.953 1.00 0.00 C ATOM 231 O ASP A 66 -14.301 34.434 47.366 1.00 0.00 O ATOM 232 CB ASP A 66 -12.020 36.295 47.573 1.00 0.00 C ATOM 233 CG ASP A 66 -10.806 37.161 47.253 1.00 0.00 C ATOM 234 OD1 ASP A 66 -10.470 37.266 46.085 1.00 0.00 O ATOM 235 OD2 ASP A 66 -10.231 37.708 48.180 1.00 0.00 O ATOM 0 H ASP A 66 -13.603 36.543 45.485 1.00 0.00 H new ATOM 0 HA ASP A 66 -11.288 34.833 46.175 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -12.904 36.922 47.686 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -11.870 35.781 48.523 1.00 0.00 H new ATOM 240 N ILE A 67 -12.691 32.932 46.904 1.00 0.00 N ATOM 241 CA ILE A 67 -13.489 31.795 47.346 1.00 0.00 C ATOM 242 C ILE A 67 -13.153 31.423 48.786 1.00 0.00 C ATOM 243 O ILE A 67 -11.983 31.285 49.146 1.00 0.00 O ATOM 244 CB ILE A 67 -13.234 30.596 46.433 1.00 0.00 C ATOM 245 CG1 ILE A 67 -13.451 31.010 44.975 1.00 0.00 C ATOM 246 CG2 ILE A 67 -14.202 29.467 46.791 1.00 0.00 C ATOM 247 CD1 ILE A 67 -12.097 31.249 44.303 1.00 0.00 C ATOM 0 H ILE A 67 -11.760 32.691 46.565 1.00 0.00 H new ATOM 0 HA ILE A 67 -14.541 32.075 47.297 1.00 0.00 H new ATOM 0 HB ILE A 67 -12.208 30.251 46.565 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -14.000 30.233 44.443 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -14.056 31.916 44.930 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -14.020 28.612 46.140 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -14.049 29.172 47.829 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -15.228 29.812 46.659 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -12.253 31.544 43.265 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.565 32.041 44.829 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.508 30.332 44.335 1.00 0.00 H new ATOM 259 N SER A 68 -14.183 31.249 49.598 1.00 0.00 N ATOM 260 CA SER A 68 -14.017 30.897 51.005 1.00 0.00 C ATOM 261 C SER A 68 -14.966 29.790 51.402 1.00 0.00 C ATOM 262 O SER A 68 -16.185 29.949 51.258 1.00 0.00 O ATOM 263 CB SER A 68 -14.189 32.144 51.909 1.00 0.00 C ATOM 264 OG SER A 68 -14.077 31.841 53.303 1.00 0.00 O ATOM 0 H SER A 68 -15.155 31.347 49.305 1.00 0.00 H new ATOM 0 HA SER A 68 -13.002 30.524 51.145 1.00 0.00 H new ATOM 0 HB2 SER A 68 -13.437 32.886 51.642 1.00 0.00 H new ATOM 0 HB3 SER A 68 -15.163 32.594 51.717 1.00 0.00 H new ATOM 0 HG SER A 68 -14.192 32.662 53.826 1.00 0.00 H new ATOM 270 N TYR A 69 -14.438 28.698 51.925 1.00 0.00 N ATOM 271 CA TYR A 69 -15.276 27.581 52.347 1.00 0.00 C ATOM 272 C TYR A 69 -14.613 26.812 53.486 1.00 0.00 C ATOM 273 O TYR A 69 -13.450 27.045 53.813 1.00 0.00 O ATOM 274 CB TYR A 69 -15.516 26.638 51.168 1.00 0.00 C ATOM 275 CG TYR A 69 -14.207 26.007 50.755 1.00 0.00 C ATOM 276 CD1 TYR A 69 -13.310 26.721 49.949 1.00 0.00 C ATOM 277 CD2 TYR A 69 -13.888 24.712 51.176 1.00 0.00 C ATOM 278 CE1 TYR A 69 -12.097 26.138 49.565 1.00 0.00 C ATOM 279 CE2 TYR A 69 -12.674 24.128 50.794 1.00 0.00 C ATOM 280 CZ TYR A 69 -11.779 24.842 49.988 1.00 0.00 C ATOM 281 OH TYR A 69 -10.581 24.266 49.612 1.00 0.00 O ATOM 0 H TYR A 69 -13.438 28.557 52.069 1.00 0.00 H new ATOM 0 HA TYR A 69 -16.228 27.978 52.698 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -16.233 25.865 51.446 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -15.948 27.187 50.331 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -13.555 27.721 49.624 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -14.579 24.161 51.797 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -11.407 26.688 48.943 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -12.428 23.128 51.121 1.00 0.00 H new ATOM 0 HH TYR A 69 -10.263 23.677 50.327 1.00 0.00 H new ATOM 291 N PHE A 70 -15.363 25.890 54.083 1.00 0.00 N ATOM 292 CA PHE A 70 -14.838 25.086 55.180 1.00 0.00 C ATOM 293 C PHE A 70 -14.162 23.830 54.639 1.00 0.00 C ATOM 294 O PHE A 70 -14.701 23.155 53.763 1.00 0.00 O ATOM 295 CB PHE A 70 -15.975 24.691 56.128 1.00 0.00 C ATOM 296 CG PHE A 70 -15.394 24.182 57.426 1.00 0.00 C ATOM 297 CD1 PHE A 70 -14.653 25.041 58.247 1.00 0.00 C ATOM 298 CD2 PHE A 70 -15.598 22.850 57.810 1.00 0.00 C ATOM 299 CE1 PHE A 70 -14.116 24.570 59.449 1.00 0.00 C ATOM 300 CE2 PHE A 70 -15.059 22.379 59.013 1.00 0.00 C ATOM 301 CZ PHE A 70 -14.319 23.239 59.834 1.00 0.00 C ATOM 0 H PHE A 70 -16.329 25.683 53.828 1.00 0.00 H new ATOM 0 HA PHE A 70 -14.102 25.677 55.725 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -16.620 25.549 56.317 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -16.595 23.922 55.668 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -14.496 26.068 57.952 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -16.171 22.187 57.178 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -13.544 25.233 60.081 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -15.214 21.352 59.308 1.00 0.00 H new ATOM 0 HZ PHE A 70 -13.905 22.876 60.763 1.00 0.00 H new ATOM 311 N ASP A 71 -12.979 23.524 55.162 1.00 0.00 N ATOM 312 CA ASP A 71 -12.243 22.347 54.715 1.00 0.00 C ATOM 313 C ASP A 71 -12.228 21.274 55.797 1.00 0.00 C ATOM 314 O ASP A 71 -12.107 21.577 56.985 1.00 0.00 O ATOM 315 CB ASP A 71 -10.807 22.735 54.359 1.00 0.00 C ATOM 316 CG ASP A 71 -10.368 22.002 53.095 1.00 0.00 C ATOM 317 OD1 ASP A 71 -10.140 20.807 53.178 1.00 0.00 O ATOM 318 OD2 ASP A 71 -10.267 22.647 52.065 1.00 0.00 O ATOM 0 H ASP A 71 -12.513 24.068 55.888 1.00 0.00 H new ATOM 0 HA ASP A 71 -12.743 21.946 53.833 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.739 23.812 54.207 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.139 22.487 55.184 1.00 0.00 H new ATOM 323 N VAL A 72 -12.347 20.018 55.378 1.00 0.00 N ATOM 324 CA VAL A 72 -12.341 18.905 56.320 1.00 0.00 C ATOM 325 C VAL A 72 -11.115 18.982 57.223 1.00 0.00 C ATOM 326 O VAL A 72 -11.019 18.269 58.221 1.00 0.00 O ATOM 327 CB VAL A 72 -12.339 17.579 55.560 1.00 0.00 C ATOM 328 CG1 VAL A 72 -11.890 16.455 56.497 1.00 0.00 C ATOM 329 CG2 VAL A 72 -13.750 17.284 55.048 1.00 0.00 C ATOM 0 H VAL A 72 -12.448 19.747 54.400 1.00 0.00 H new ATOM 0 HA VAL A 72 -13.238 18.965 56.937 1.00 0.00 H new ATOM 0 HB VAL A 72 -11.652 17.644 54.716 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -11.888 15.509 55.956 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -10.885 16.666 56.863 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -12.577 16.389 57.341 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -13.750 16.338 54.506 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -14.437 17.218 55.892 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -14.070 18.085 54.381 1.00 0.00 H new ATOM 339 N ASN A 73 -10.180 19.856 56.863 1.00 0.00 N ATOM 340 CA ASN A 73 -8.961 20.024 57.645 1.00 0.00 C ATOM 341 C ASN A 73 -9.201 20.981 58.807 1.00 0.00 C ATOM 342 O ASN A 73 -8.290 21.276 59.580 1.00 0.00 O ATOM 343 CB ASN A 73 -7.840 20.569 56.757 1.00 0.00 C ATOM 344 CG ASN A 73 -7.341 19.476 55.818 1.00 0.00 C ATOM 345 OD1 ASN A 73 -6.463 18.697 56.183 1.00 0.00 O ATOM 346 ND2 ASN A 73 -7.853 19.373 54.622 1.00 0.00 N ATOM 0 H ASN A 73 -10.243 20.455 56.040 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.669 19.052 58.042 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -8.203 21.419 56.179 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -7.019 20.932 57.375 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.525 18.645 53.988 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.581 20.021 54.322 1.00 0.00 H new ATOM 353 N SER A 74 -10.436 21.460 58.923 1.00 0.00 N ATOM 354 CA SER A 74 -10.794 22.382 59.995 1.00 0.00 C ATOM 355 C SER A 74 -10.630 23.829 59.541 1.00 0.00 C ATOM 356 O SER A 74 -11.614 24.520 59.273 1.00 0.00 O ATOM 357 CB SER A 74 -9.917 22.124 61.219 1.00 0.00 C ATOM 358 OG SER A 74 -9.592 20.741 61.279 1.00 0.00 O ATOM 0 H SER A 74 -11.202 21.226 58.291 1.00 0.00 H new ATOM 0 HA SER A 74 -11.839 22.216 60.256 1.00 0.00 H new ATOM 0 HB2 SER A 74 -9.007 22.721 61.162 1.00 0.00 H new ATOM 0 HB3 SER A 74 -10.440 22.426 62.126 1.00 0.00 H new ATOM 0 HG SER A 74 -8.662 20.611 60.998 1.00 0.00 H new ATOM 364 N GLU A 75 -9.385 24.285 59.459 1.00 0.00 N ATOM 365 CA GLU A 75 -9.111 25.653 59.038 1.00 0.00 C ATOM 366 C GLU A 75 -9.677 25.909 57.642 1.00 0.00 C ATOM 367 O GLU A 75 -9.519 25.083 56.743 1.00 0.00 O ATOM 368 CB GLU A 75 -7.602 25.905 59.031 1.00 0.00 C ATOM 369 CG GLU A 75 -6.913 24.862 58.147 1.00 0.00 C ATOM 370 CD GLU A 75 -5.523 24.554 58.692 1.00 0.00 C ATOM 371 OE1 GLU A 75 -4.609 25.302 58.388 1.00 0.00 O ATOM 372 OE2 GLU A 75 -5.393 23.574 59.407 1.00 0.00 O ATOM 0 H GLU A 75 -8.556 23.732 59.677 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.590 26.332 59.743 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -7.392 26.908 58.659 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.209 25.853 60.046 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.510 23.950 58.113 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.838 25.232 57.124 1.00 0.00 H new ATOM 379 N PRO A 76 -10.328 27.029 57.440 1.00 0.00 N ATOM 380 CA PRO A 76 -10.922 27.385 56.119 1.00 0.00 C ATOM 381 C PRO A 76 -9.862 27.824 55.111 1.00 0.00 C ATOM 382 O PRO A 76 -8.885 28.482 55.469 1.00 0.00 O ATOM 383 CB PRO A 76 -11.869 28.537 56.450 1.00 0.00 C ATOM 384 CG PRO A 76 -11.295 29.182 57.668 1.00 0.00 C ATOM 385 CD PRO A 76 -10.572 28.078 58.446 1.00 0.00 C ATOM 0 HA PRO A 76 -11.421 26.536 55.651 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -11.932 29.244 55.623 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.880 28.174 56.637 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.605 29.980 57.395 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -12.080 29.633 58.274 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.639 28.440 58.878 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -11.182 27.706 59.270 1.00 0.00 H new ATOM 393 N GLN A 77 -10.064 27.457 53.851 1.00 0.00 N ATOM 394 CA GLN A 77 -9.123 27.818 52.798 1.00 0.00 C ATOM 395 C GLN A 77 -9.684 28.957 51.951 1.00 0.00 C ATOM 396 O GLN A 77 -10.860 28.949 51.586 1.00 0.00 O ATOM 397 CB GLN A 77 -8.847 26.606 51.907 1.00 0.00 C ATOM 398 CG GLN A 77 -7.784 26.965 50.867 1.00 0.00 C ATOM 399 CD GLN A 77 -7.929 26.065 49.644 1.00 0.00 C ATOM 400 OE1 GLN A 77 -7.934 24.841 49.771 1.00 0.00 O ATOM 401 NE2 GLN A 77 -8.049 26.603 48.461 1.00 0.00 N ATOM 0 H GLN A 77 -10.867 26.913 53.535 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.193 28.146 53.262 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.508 25.766 52.513 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -9.765 26.291 51.410 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -7.887 28.010 50.575 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.789 26.851 51.297 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -8.044 27.618 48.359 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -8.147 26.009 47.638 1.00 0.00 H new ATOM 410 N ARG A 78 -8.838 29.936 51.647 1.00 0.00 N ATOM 411 CA ARG A 78 -9.267 31.077 50.844 1.00 0.00 C ATOM 412 C ARG A 78 -8.214 31.432 49.798 1.00 0.00 C ATOM 413 O ARG A 78 -7.049 31.652 50.127 1.00 0.00 O ATOM 414 CB ARG A 78 -9.517 32.286 51.748 1.00 0.00 C ATOM 415 CG ARG A 78 -10.578 31.935 52.791 1.00 0.00 C ATOM 416 CD ARG A 78 -10.813 33.139 53.704 1.00 0.00 C ATOM 417 NE ARG A 78 -9.738 34.112 53.543 1.00 0.00 N ATOM 418 CZ ARG A 78 -9.844 35.121 52.686 1.00 0.00 C ATOM 419 NH1 ARG A 78 -10.925 35.252 51.965 1.00 0.00 N ATOM 420 NH2 ARG A 78 -8.871 35.980 52.562 1.00 0.00 N ATOM 0 H ARG A 78 -7.862 29.964 51.940 1.00 0.00 H new ATOM 0 HA ARG A 78 -10.190 30.806 50.332 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -8.591 32.582 52.241 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -9.846 33.137 51.152 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.508 31.652 52.298 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.255 31.076 53.380 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -11.771 33.602 53.467 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.865 32.812 54.743 1.00 0.00 H new ATOM 0 HE ARG A 78 -8.889 34.015 54.099 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -11.686 34.580 52.061 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -11.008 36.026 51.306 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -8.026 35.878 53.124 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -8.955 36.754 51.903 1.00 0.00 H new ATOM 434 N VAL A 79 -8.636 31.491 48.540 1.00 0.00 N ATOM 435 CA VAL A 79 -7.725 31.828 47.452 1.00 0.00 C ATOM 436 C VAL A 79 -8.036 33.218 46.909 1.00 0.00 C ATOM 437 O VAL A 79 -9.178 33.516 46.561 1.00 0.00 O ATOM 438 CB VAL A 79 -7.846 30.800 46.326 1.00 0.00 C ATOM 439 CG1 VAL A 79 -7.529 29.406 46.868 1.00 0.00 C ATOM 440 CG2 VAL A 79 -9.274 30.818 45.771 1.00 0.00 C ATOM 0 H VAL A 79 -9.597 31.311 48.249 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.707 31.818 47.841 1.00 0.00 H new ATOM 0 HB VAL A 79 -7.142 31.048 45.532 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.616 28.675 46.064 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.513 29.392 47.264 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.232 29.156 47.663 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.362 30.086 44.968 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.977 30.570 46.567 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -9.501 31.811 45.383 1.00 0.00 H new ATOM 450 N ASP A 80 -7.016 34.068 46.847 1.00 0.00 N ATOM 451 CA ASP A 80 -7.200 35.427 46.350 1.00 0.00 C ATOM 452 C ASP A 80 -6.214 35.733 45.227 1.00 0.00 C ATOM 453 O ASP A 80 -5.109 35.193 45.192 1.00 0.00 O ATOM 454 CB ASP A 80 -7.004 36.426 47.491 1.00 0.00 C ATOM 455 CG ASP A 80 -7.277 37.843 46.996 1.00 0.00 C ATOM 456 OD1 ASP A 80 -6.751 38.195 45.952 1.00 0.00 O ATOM 457 OD2 ASP A 80 -8.005 38.553 47.667 1.00 0.00 O ATOM 0 H ASP A 80 -6.063 33.843 47.132 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.212 35.514 45.956 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -7.674 36.185 48.316 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -5.987 36.356 47.876 1.00 0.00 H new ATOM 462 N GLY A 81 -6.623 36.607 44.314 1.00 0.00 N ATOM 463 CA GLY A 81 -5.770 36.985 43.192 1.00 0.00 C ATOM 464 C GLY A 81 -5.910 35.994 42.042 1.00 0.00 C ATOM 465 O GLY A 81 -5.116 36.005 41.102 1.00 0.00 O ATOM 0 H GLY A 81 -7.534 37.065 44.328 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.035 37.985 42.849 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.731 37.025 43.518 1.00 0.00 H new ATOM 469 N ALA A 82 -6.920 35.137 42.124 1.00 0.00 N ATOM 470 CA ALA A 82 -7.152 34.143 41.083 1.00 0.00 C ATOM 471 C ALA A 82 -7.983 34.736 39.949 1.00 0.00 C ATOM 472 O ALA A 82 -8.916 35.503 40.187 1.00 0.00 O ATOM 473 CB ALA A 82 -7.877 32.931 41.669 1.00 0.00 C ATOM 0 H ALA A 82 -7.588 35.110 42.895 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.186 33.831 40.685 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -8.046 32.194 40.884 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.268 32.489 42.457 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.835 33.245 42.084 1.00 0.00 H new ATOM 479 N VAL A 83 -7.636 34.376 38.718 1.00 0.00 N ATOM 480 CA VAL A 83 -8.358 34.879 37.555 1.00 0.00 C ATOM 481 C VAL A 83 -9.631 34.071 37.327 1.00 0.00 C ATOM 482 O VAL A 83 -10.649 34.606 36.888 1.00 0.00 O ATOM 483 CB VAL A 83 -7.471 34.808 36.309 1.00 0.00 C ATOM 484 CG1 VAL A 83 -6.722 33.474 36.287 1.00 0.00 C ATOM 485 CG2 VAL A 83 -8.342 34.922 35.055 1.00 0.00 C ATOM 0 H VAL A 83 -6.866 33.743 38.501 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.628 35.918 37.742 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.752 35.627 36.330 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.091 33.425 35.399 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -6.101 33.391 37.179 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.440 32.654 36.267 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -7.711 34.872 34.168 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -9.061 34.103 35.036 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -8.875 35.873 35.067 1.00 0.00 H new ATOM 495 N LEU A 84 -9.569 32.780 37.639 1.00 0.00 N ATOM 496 CA LEU A 84 -10.725 31.909 37.472 1.00 0.00 C ATOM 497 C LEU A 84 -10.817 30.918 38.626 1.00 0.00 C ATOM 498 O LEU A 84 -9.811 30.557 39.234 1.00 0.00 O ATOM 499 CB LEU A 84 -10.632 31.146 36.147 1.00 0.00 C ATOM 500 CG LEU A 84 -9.167 31.010 35.732 1.00 0.00 C ATOM 501 CD1 LEU A 84 -8.428 30.135 36.746 1.00 0.00 C ATOM 502 CD2 LEU A 84 -9.090 30.362 34.347 1.00 0.00 C ATOM 0 H LEU A 84 -8.737 32.318 38.006 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.621 32.530 37.464 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -11.083 30.159 36.252 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -11.192 31.672 35.373 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.704 31.996 35.700 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.383 30.038 36.450 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.484 30.595 37.733 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -8.889 29.148 36.779 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.046 30.264 34.049 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.552 29.375 34.381 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.617 30.985 33.624 1.00 0.00 H new ATOM 514 N PRO A 85 -12.007 30.477 38.927 1.00 0.00 N ATOM 515 CA PRO A 85 -12.255 29.502 40.029 1.00 0.00 C ATOM 516 C PRO A 85 -11.561 28.165 39.779 1.00 0.00 C ATOM 517 O PRO A 85 -11.199 27.845 38.647 1.00 0.00 O ATOM 518 CB PRO A 85 -13.779 29.331 40.039 1.00 0.00 C ATOM 519 CG PRO A 85 -14.246 29.804 38.700 1.00 0.00 C ATOM 520 CD PRO A 85 -13.247 30.862 38.244 1.00 0.00 C ATOM 0 HA PRO A 85 -11.859 29.856 40.981 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -14.055 28.290 40.205 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -14.233 29.913 40.841 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -14.288 28.978 37.990 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -15.251 30.221 38.764 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.126 30.860 37.161 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -13.567 31.865 38.527 1.00 0.00 H new ATOM 528 N TRP A 86 -11.379 27.390 40.845 1.00 0.00 N ATOM 529 CA TRP A 86 -10.727 26.090 40.729 1.00 0.00 C ATOM 530 C TRP A 86 -11.633 24.991 41.272 1.00 0.00 C ATOM 531 O TRP A 86 -12.681 25.267 41.855 1.00 0.00 O ATOM 532 CB TRP A 86 -9.408 26.092 41.504 1.00 0.00 C ATOM 533 CG TRP A 86 -8.569 27.251 41.069 1.00 0.00 C ATOM 534 CD1 TRP A 86 -8.933 28.552 41.160 1.00 0.00 C ATOM 535 CD2 TRP A 86 -7.237 27.239 40.480 1.00 0.00 C ATOM 536 NE1 TRP A 86 -7.908 29.338 40.664 1.00 0.00 N ATOM 537 CE2 TRP A 86 -6.841 28.574 40.232 1.00 0.00 C ATOM 538 CE3 TRP A 86 -6.343 26.207 40.140 1.00 0.00 C ATOM 539 CZ2 TRP A 86 -5.601 28.876 39.667 1.00 0.00 C ATOM 540 CZ3 TRP A 86 -5.095 26.508 39.572 1.00 0.00 C ATOM 541 CH2 TRP A 86 -4.724 27.840 39.335 1.00 0.00 C ATOM 0 H TRP A 86 -11.671 27.637 41.791 1.00 0.00 H new ATOM 0 HA TRP A 86 -10.527 25.898 39.675 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.604 26.154 42.574 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -8.873 25.158 41.332 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.870 28.916 41.555 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -7.937 30.357 40.622 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -6.618 25.178 40.317 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -5.321 29.904 39.488 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -4.416 25.708 39.316 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -3.763 28.064 38.897 1.00 0.00 H new ATOM 552 N SER A 87 -11.221 23.750 41.087 1.00 0.00 N ATOM 553 CA SER A 87 -11.982 22.597 41.556 1.00 0.00 C ATOM 554 C SER A 87 -11.225 21.847 42.628 1.00 0.00 C ATOM 555 O SER A 87 -9.998 21.731 42.547 1.00 0.00 O ATOM 556 CB SER A 87 -12.364 21.670 40.376 1.00 0.00 C ATOM 557 OG SER A 87 -13.217 22.309 39.419 1.00 0.00 O ATOM 0 H SER A 87 -10.353 23.509 40.609 1.00 0.00 H new ATOM 0 HA SER A 87 -12.908 22.960 42.003 1.00 0.00 H new ATOM 0 HB2 SER A 87 -11.456 21.332 39.877 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.863 20.782 40.765 1.00 0.00 H new ATOM 0 HG SER A 87 -13.426 21.681 38.696 1.00 0.00 H new ATOM 563 N LEU A 88 -11.938 21.302 43.602 1.00 0.00 N ATOM 564 CA LEU A 88 -11.297 20.547 44.672 1.00 0.00 C ATOM 565 C LEU A 88 -12.000 19.209 44.887 1.00 0.00 C ATOM 566 O LEU A 88 -13.225 19.122 44.819 1.00 0.00 O ATOM 567 CB LEU A 88 -11.331 21.357 45.971 1.00 0.00 C ATOM 568 CG LEU A 88 -9.976 21.257 46.676 1.00 0.00 C ATOM 569 CD1 LEU A 88 -9.909 22.296 47.797 1.00 0.00 C ATOM 570 CD2 LEU A 88 -9.810 19.854 47.270 1.00 0.00 C ATOM 0 H LEU A 88 -12.953 21.366 43.675 1.00 0.00 H new ATOM 0 HA LEU A 88 -10.263 20.356 44.386 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.563 22.400 45.755 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.120 20.983 46.624 1.00 0.00 H new ATOM 0 HG LEU A 88 -9.178 21.443 45.958 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -8.945 22.226 48.300 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.027 23.294 47.375 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.707 22.109 48.515 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -8.845 19.783 47.772 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -10.608 19.667 47.989 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -9.859 19.113 46.472 1.00 0.00 H new ATOM 582 N HIS A 89 -11.210 18.172 45.147 1.00 0.00 N ATOM 583 CA HIS A 89 -11.760 16.841 45.374 1.00 0.00 C ATOM 584 C HIS A 89 -11.629 16.458 46.844 1.00 0.00 C ATOM 585 O HIS A 89 -10.530 16.461 47.398 1.00 0.00 O ATOM 586 CB HIS A 89 -11.022 15.820 44.507 1.00 0.00 C ATOM 587 CG HIS A 89 -10.275 16.539 43.418 1.00 0.00 C ATOM 588 ND1 HIS A 89 -10.559 16.345 42.074 1.00 0.00 N ATOM 589 CD2 HIS A 89 -9.256 17.457 43.457 1.00 0.00 C ATOM 590 CE1 HIS A 89 -9.725 17.129 41.368 1.00 0.00 C ATOM 591 NE2 HIS A 89 -8.911 17.828 42.162 1.00 0.00 N ATOM 0 H HIS A 89 -10.193 18.227 45.205 1.00 0.00 H new ATOM 0 HA HIS A 89 -12.816 16.848 45.104 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -10.329 15.241 45.117 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -11.731 15.115 44.073 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -8.792 17.834 44.357 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -9.715 17.186 40.290 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -8.190 18.492 41.879 1.00 0.00 H new ATOM 600 N ILE A 90 -12.755 16.135 47.470 1.00 0.00 N ATOM 601 CA ILE A 90 -12.749 15.759 48.879 1.00 0.00 C ATOM 602 C ILE A 90 -13.496 14.448 49.096 1.00 0.00 C ATOM 603 O ILE A 90 -14.663 14.317 48.727 1.00 0.00 O ATOM 604 CB ILE A 90 -13.396 16.864 49.715 1.00 0.00 C ATOM 605 CG1 ILE A 90 -12.362 17.957 50.000 1.00 0.00 C ATOM 606 CG2 ILE A 90 -13.898 16.282 51.035 1.00 0.00 C ATOM 607 CD1 ILE A 90 -13.016 19.332 49.851 1.00 0.00 C ATOM 0 H ILE A 90 -13.675 16.126 47.030 1.00 0.00 H new ATOM 0 HA ILE A 90 -11.714 15.623 49.192 1.00 0.00 H new ATOM 0 HB ILE A 90 -14.236 17.289 49.166 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -11.962 17.840 51.007 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -11.522 17.866 49.311 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -14.359 17.071 51.629 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -14.634 15.504 50.833 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -13.060 15.855 51.586 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -12.279 20.109 50.054 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -13.394 19.447 48.835 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -13.841 19.421 50.558 1.00 0.00 H new ATOM 619 N THR A 91 -12.813 13.480 49.699 1.00 0.00 N ATOM 620 CA THR A 91 -13.415 12.179 49.968 1.00 0.00 C ATOM 621 C THR A 91 -13.613 11.990 51.469 1.00 0.00 C ATOM 622 O THR A 91 -12.661 12.079 52.243 1.00 0.00 O ATOM 623 CB THR A 91 -12.516 11.067 49.425 1.00 0.00 C ATOM 624 OG1 THR A 91 -11.207 11.579 49.221 1.00 0.00 O ATOM 625 CG2 THR A 91 -13.077 10.552 48.099 1.00 0.00 C ATOM 0 H THR A 91 -11.846 13.571 50.010 1.00 0.00 H new ATOM 0 HA THR A 91 -14.385 12.133 49.473 1.00 0.00 H new ATOM 0 HB THR A 91 -12.480 10.247 50.142 1.00 0.00 H new ATOM 0 HG1 THR A 91 -10.628 10.868 48.875 1.00 0.00 H new ATOM 0 HG21 THR A 91 -12.434 9.760 47.715 1.00 0.00 H new ATOM 0 HG22 THR A 91 -14.082 10.159 48.257 1.00 0.00 H new ATOM 0 HG23 THR A 91 -13.116 11.369 47.379 1.00 0.00 H new ATOM 633 N THR A 92 -14.852 11.731 51.875 1.00 0.00 N ATOM 634 CA THR A 92 -15.153 11.539 53.288 1.00 0.00 C ATOM 635 C THR A 92 -15.881 10.217 53.517 1.00 0.00 C ATOM 636 O THR A 92 -16.828 9.886 52.803 1.00 0.00 O ATOM 637 CB THR A 92 -16.018 12.692 53.801 1.00 0.00 C ATOM 638 OG1 THR A 92 -15.383 13.928 53.503 1.00 0.00 O ATOM 639 CG2 THR A 92 -16.201 12.561 55.315 1.00 0.00 C ATOM 0 H THR A 92 -15.656 11.650 51.252 1.00 0.00 H new ATOM 0 HA THR A 92 -14.210 11.517 53.834 1.00 0.00 H new ATOM 0 HB THR A 92 -16.993 12.659 53.316 1.00 0.00 H new ATOM 0 HG1 THR A 92 -15.937 14.667 53.830 1.00 0.00 H new ATOM 0 HG21 THR A 92 -16.817 13.383 55.679 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.689 11.613 55.542 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.227 12.594 55.803 1.00 0.00 H new ATOM 647 N ASN A 93 -15.432 9.470 54.521 1.00 0.00 N ATOM 648 CA ASN A 93 -16.046 8.186 54.845 1.00 0.00 C ATOM 649 C ASN A 93 -16.415 7.422 53.578 1.00 0.00 C ATOM 650 O ASN A 93 -17.399 6.683 53.553 1.00 0.00 O ATOM 651 CB ASN A 93 -17.302 8.411 55.690 1.00 0.00 C ATOM 652 CG ASN A 93 -17.903 7.069 56.099 1.00 0.00 C ATOM 653 OD1 ASN A 93 -18.697 6.491 55.356 1.00 0.00 O ATOM 654 ND2 ASN A 93 -17.571 6.537 57.243 1.00 0.00 N ATOM 0 H ASN A 93 -14.649 9.729 55.122 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.324 7.595 55.408 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.054 8.993 56.577 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -18.033 8.989 55.124 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.969 5.641 57.523 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -16.913 7.017 57.857 1.00 0.00 H new ATOM 661 N ASP A 94 -15.621 7.605 52.529 1.00 0.00 N ATOM 662 CA ASP A 94 -15.876 6.923 51.263 1.00 0.00 C ATOM 663 C ASP A 94 -17.366 6.646 51.093 1.00 0.00 C ATOM 664 O ASP A 94 -17.783 5.496 50.965 1.00 0.00 O ATOM 665 CB ASP A 94 -15.101 5.606 51.214 1.00 0.00 C ATOM 666 CG ASP A 94 -13.844 5.707 52.072 1.00 0.00 C ATOM 667 OD1 ASP A 94 -13.980 5.920 53.265 1.00 0.00 O ATOM 668 OD2 ASP A 94 -12.763 5.570 51.523 1.00 0.00 O ATOM 0 H ASP A 94 -14.802 8.214 52.528 1.00 0.00 H new ATOM 0 HA ASP A 94 -15.544 7.570 50.451 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -15.730 4.791 51.571 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -14.830 5.372 50.184 1.00 0.00 H new ATOM 673 N ALA A 95 -18.164 7.709 51.093 1.00 0.00 N ATOM 674 CA ALA A 95 -19.607 7.570 50.937 1.00 0.00 C ATOM 675 C ALA A 95 -20.162 8.710 50.089 1.00 0.00 C ATOM 676 O ALA A 95 -19.493 9.202 49.181 1.00 0.00 O ATOM 677 CB ALA A 95 -20.284 7.574 52.309 1.00 0.00 C ATOM 0 H ALA A 95 -17.839 8.670 51.199 1.00 0.00 H new ATOM 0 HA ALA A 95 -19.812 6.624 50.436 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -21.362 7.470 52.183 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -19.906 6.742 52.904 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -20.067 8.513 52.819 1.00 0.00 H new ATOM 683 N ALA A 96 -21.387 9.123 50.392 1.00 0.00 N ATOM 684 CA ALA A 96 -22.019 10.207 49.650 1.00 0.00 C ATOM 685 C ALA A 96 -22.348 11.370 50.580 1.00 0.00 C ATOM 686 O ALA A 96 -23.058 11.202 51.573 1.00 0.00 O ATOM 687 CB ALA A 96 -23.299 9.704 48.983 1.00 0.00 C ATOM 0 H ALA A 96 -21.958 8.728 51.139 1.00 0.00 H new ATOM 0 HA ALA A 96 -21.325 10.555 48.885 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -23.766 10.519 48.430 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -23.057 8.892 48.297 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -23.988 9.341 49.745 1.00 0.00 H new ATOM 693 N VAL A 97 -21.830 12.548 50.253 1.00 0.00 N ATOM 694 CA VAL A 97 -22.076 13.732 51.067 1.00 0.00 C ATOM 695 C VAL A 97 -21.822 15.002 50.260 1.00 0.00 C ATOM 696 O VAL A 97 -20.867 15.078 49.486 1.00 0.00 O ATOM 697 CB VAL A 97 -21.171 13.717 52.299 1.00 0.00 C ATOM 698 CG1 VAL A 97 -19.739 14.058 51.885 1.00 0.00 C ATOM 699 CG2 VAL A 97 -21.671 14.753 53.308 1.00 0.00 C ATOM 0 H VAL A 97 -21.241 12.708 49.436 1.00 0.00 H new ATOM 0 HA VAL A 97 -23.119 13.721 51.383 1.00 0.00 H new ATOM 0 HB VAL A 97 -21.190 12.726 52.753 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -19.094 14.047 52.764 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -19.383 13.321 51.165 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -19.718 15.049 51.431 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -21.027 14.744 54.188 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -21.651 15.743 52.853 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -22.692 14.510 53.603 1.00 0.00 H new ATOM 709 N MET A 98 -22.683 15.995 50.448 1.00 0.00 N ATOM 710 CA MET A 98 -22.548 17.260 49.735 1.00 0.00 C ATOM 711 C MET A 98 -21.819 18.288 50.596 1.00 0.00 C ATOM 712 O MET A 98 -21.471 18.013 51.744 1.00 0.00 O ATOM 713 CB MET A 98 -23.931 17.795 49.358 1.00 0.00 C ATOM 714 CG MET A 98 -24.901 17.554 50.516 1.00 0.00 C ATOM 715 SD MET A 98 -25.806 16.013 50.229 1.00 0.00 S ATOM 716 CE MET A 98 -26.807 16.054 51.737 1.00 0.00 C ATOM 0 H MET A 98 -23.478 15.950 51.085 1.00 0.00 H new ATOM 0 HA MET A 98 -21.966 17.085 48.830 1.00 0.00 H new ATOM 0 HB2 MET A 98 -23.872 18.860 49.134 1.00 0.00 H new ATOM 0 HB3 MET A 98 -24.292 17.299 48.457 1.00 0.00 H new ATOM 0 HG2 MET A 98 -24.354 17.498 51.457 1.00 0.00 H new ATOM 0 HG3 MET A 98 -25.598 18.388 50.601 1.00 0.00 H new ATOM 0 HE1 MET A 98 -27.454 15.178 51.768 1.00 0.00 H new ATOM 0 HE2 MET A 98 -26.152 16.052 52.608 1.00 0.00 H new ATOM 0 HE3 MET A 98 -27.418 16.957 51.744 1.00 0.00 H new ATOM 726 N GLY A 99 -21.592 19.471 50.034 1.00 0.00 N ATOM 727 CA GLY A 99 -20.904 20.530 50.764 1.00 0.00 C ATOM 728 C GLY A 99 -21.570 21.881 50.523 1.00 0.00 C ATOM 729 O GLY A 99 -22.335 22.046 49.572 1.00 0.00 O ATOM 0 H GLY A 99 -21.871 19.719 49.085 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.908 20.304 51.830 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.861 20.574 50.451 1.00 0.00 H new ATOM 733 N ASN A 100 -21.271 22.844 51.389 1.00 0.00 N ATOM 734 CA ASN A 100 -21.846 24.179 51.262 1.00 0.00 C ATOM 735 C ASN A 100 -20.748 25.218 51.057 1.00 0.00 C ATOM 736 O ASN A 100 -19.904 25.422 51.931 1.00 0.00 O ATOM 737 CB ASN A 100 -22.648 24.521 52.518 1.00 0.00 C ATOM 738 CG ASN A 100 -23.388 23.285 53.018 1.00 0.00 C ATOM 739 OD1 ASN A 100 -24.618 23.261 53.030 1.00 0.00 O ATOM 740 ND2 ASN A 100 -22.707 22.254 53.435 1.00 0.00 N ATOM 0 H ASN A 100 -20.639 22.727 52.181 1.00 0.00 H new ATOM 0 HA ASN A 100 -22.506 24.190 50.395 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -21.981 24.894 53.295 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -23.360 25.317 52.299 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -23.194 21.424 53.773 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -21.687 22.278 53.423 1.00 0.00 H new ATOM 747 N ILE A 101 -20.764 25.871 49.900 1.00 0.00 N ATOM 748 CA ILE A 101 -19.765 26.886 49.592 1.00 0.00 C ATOM 749 C ILE A 101 -20.424 28.141 49.025 1.00 0.00 C ATOM 750 O ILE A 101 -21.386 28.058 48.263 1.00 0.00 O ATOM 751 CB ILE A 101 -18.746 26.336 48.589 1.00 0.00 C ATOM 752 CG1 ILE A 101 -19.191 26.669 47.161 1.00 0.00 C ATOM 753 CG2 ILE A 101 -18.644 24.818 48.747 1.00 0.00 C ATOM 754 CD1 ILE A 101 -18.277 25.958 46.161 1.00 0.00 C ATOM 0 H ILE A 101 -21.454 25.717 49.164 1.00 0.00 H new ATOM 0 HA ILE A 101 -19.252 27.151 50.516 1.00 0.00 H new ATOM 0 HB ILE A 101 -17.774 26.791 48.779 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -20.225 26.358 47.009 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -19.155 27.746 47.000 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -17.919 24.426 48.034 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -18.322 24.578 49.760 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -19.618 24.366 48.560 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -18.594 26.195 45.146 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -17.249 26.291 46.307 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -18.335 24.881 46.317 1.00 0.00 H new ATOM 766 N VAL A 102 -19.894 29.300 49.397 1.00 0.00 N ATOM 767 CA VAL A 102 -20.431 30.568 48.914 1.00 0.00 C ATOM 768 C VAL A 102 -19.345 31.359 48.191 1.00 0.00 C ATOM 769 O VAL A 102 -18.170 31.289 48.551 1.00 0.00 O ATOM 770 CB VAL A 102 -20.972 31.388 50.086 1.00 0.00 C ATOM 771 CG1 VAL A 102 -21.448 32.750 49.578 1.00 0.00 C ATOM 772 CG2 VAL A 102 -22.146 30.647 50.729 1.00 0.00 C ATOM 0 H VAL A 102 -19.097 29.389 50.028 1.00 0.00 H new ATOM 0 HA VAL A 102 -21.243 30.360 48.217 1.00 0.00 H new ATOM 0 HB VAL A 102 -20.183 31.530 50.824 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -21.834 33.335 50.413 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -20.613 33.279 49.119 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -22.237 32.607 48.840 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -22.532 31.231 51.564 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -22.935 30.505 49.991 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -21.809 29.676 51.091 1.00 0.00 H new ATOM 782 N ALA A 103 -19.742 32.111 47.169 1.00 0.00 N ATOM 783 CA ALA A 103 -18.784 32.905 46.409 1.00 0.00 C ATOM 784 C ALA A 103 -19.366 34.271 46.055 1.00 0.00 C ATOM 785 O ALA A 103 -20.535 34.382 45.683 1.00 0.00 O ATOM 786 CB ALA A 103 -18.397 32.167 45.124 1.00 0.00 C ATOM 0 H ALA A 103 -20.708 32.187 46.851 1.00 0.00 H new ATOM 0 HA ALA A 103 -17.899 33.053 47.028 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -17.681 32.766 44.562 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -17.947 31.207 45.377 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -19.287 32.001 44.517 1.00 0.00 H new ATOM 792 N GLN A 104 -18.538 35.305 46.167 1.00 0.00 N ATOM 793 CA GLN A 104 -18.975 36.662 45.851 1.00 0.00 C ATOM 794 C GLN A 104 -17.962 37.342 44.935 1.00 0.00 C ATOM 795 O GLN A 104 -16.907 37.788 45.385 1.00 0.00 O ATOM 796 CB GLN A 104 -19.129 37.476 47.140 1.00 0.00 C ATOM 797 CG GLN A 104 -20.570 37.367 47.643 1.00 0.00 C ATOM 798 CD GLN A 104 -20.796 38.347 48.790 1.00 0.00 C ATOM 799 OE1 GLN A 104 -20.202 39.425 48.815 1.00 0.00 O ATOM 800 NE2 GLN A 104 -21.626 38.034 49.748 1.00 0.00 N ATOM 0 H GLN A 104 -17.567 35.231 46.472 1.00 0.00 H new ATOM 0 HA GLN A 104 -19.937 36.609 45.341 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -18.439 37.109 47.899 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -18.875 38.520 46.956 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -21.265 37.579 46.830 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -20.771 36.349 47.978 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -22.117 37.140 49.725 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -21.783 38.683 50.519 1.00 0.00 H new ATOM 809 N GLY A 105 -18.286 37.413 43.647 1.00 0.00 N ATOM 810 CA GLY A 105 -17.390 38.035 42.681 1.00 0.00 C ATOM 811 C GLY A 105 -18.134 39.035 41.805 1.00 0.00 C ATOM 812 O GLY A 105 -19.363 39.028 41.743 1.00 0.00 O ATOM 0 H GLY A 105 -19.154 37.051 43.252 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -16.579 38.540 43.206 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -16.935 37.267 42.055 1.00 0.00 H new ATOM 816 N ASN A 106 -17.379 39.895 41.126 1.00 0.00 N ATOM 817 CA ASN A 106 -17.976 40.898 40.254 1.00 0.00 C ATOM 818 C ASN A 106 -18.384 40.268 38.925 1.00 0.00 C ATOM 819 O ASN A 106 -18.569 40.964 37.927 1.00 0.00 O ATOM 820 CB ASN A 106 -16.978 42.031 40.000 1.00 0.00 C ATOM 821 CG ASN A 106 -16.178 42.314 41.268 1.00 0.00 C ATOM 822 OD1 ASN A 106 -16.420 41.698 42.306 1.00 0.00 O ATOM 823 ND2 ASN A 106 -15.234 43.216 41.245 1.00 0.00 N ATOM 0 H ASN A 106 -16.360 39.916 41.163 1.00 0.00 H new ATOM 0 HA ASN A 106 -18.863 41.301 40.743 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.304 41.758 39.188 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -17.508 42.930 39.686 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -14.695 43.412 42.089 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -15.036 43.725 40.384 1.00 0.00 H new ATOM 830 N SER A 107 -18.523 38.946 38.924 1.00 0.00 N ATOM 831 CA SER A 107 -18.910 38.225 37.716 1.00 0.00 C ATOM 832 C SER A 107 -20.357 38.535 37.345 1.00 0.00 C ATOM 833 O SER A 107 -20.987 39.411 37.937 1.00 0.00 O ATOM 834 CB SER A 107 -18.752 36.721 37.932 1.00 0.00 C ATOM 835 OG SER A 107 -19.277 36.376 39.208 1.00 0.00 O ATOM 0 H SER A 107 -18.374 38.355 39.742 1.00 0.00 H new ATOM 0 HA SER A 107 -18.260 38.547 36.902 1.00 0.00 H new ATOM 0 HB2 SER A 107 -19.275 36.172 37.149 1.00 0.00 H new ATOM 0 HB3 SER A 107 -17.701 36.441 37.870 1.00 0.00 H new ATOM 0 HG SER A 107 -20.253 36.468 39.196 1.00 0.00 H new ATOM 841 N ASP A 108 -20.877 37.807 36.362 1.00 0.00 N ATOM 842 CA ASP A 108 -22.252 38.008 35.919 1.00 0.00 C ATOM 843 C ASP A 108 -23.079 36.748 36.143 1.00 0.00 C ATOM 844 O ASP A 108 -24.228 36.662 35.708 1.00 0.00 O ATOM 845 CB ASP A 108 -22.271 38.377 34.434 1.00 0.00 C ATOM 846 CG ASP A 108 -22.590 39.860 34.267 1.00 0.00 C ATOM 847 OD1 ASP A 108 -21.881 40.667 34.845 1.00 0.00 O ATOM 848 OD2 ASP A 108 -23.539 40.165 33.563 1.00 0.00 O ATOM 0 H ASP A 108 -20.371 37.077 35.860 1.00 0.00 H new ATOM 0 HA ASP A 108 -22.687 38.820 36.502 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -21.305 38.152 33.983 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -23.015 37.776 33.911 1.00 0.00 H new ATOM 853 N SER A 109 -22.489 35.772 36.837 1.00 0.00 N ATOM 854 CA SER A 109 -23.170 34.504 37.092 1.00 0.00 C ATOM 855 C SER A 109 -22.369 33.642 38.039 1.00 0.00 C ATOM 856 O SER A 109 -21.378 33.027 37.612 1.00 0.00 O ATOM 857 CB SER A 109 -23.475 33.766 35.765 1.00 0.00 C ATOM 858 OG SER A 109 -22.291 33.430 35.031 1.00 0.00 O ATOM 0 H SER A 109 -21.549 35.835 37.229 1.00 0.00 H new ATOM 0 HA SER A 109 -24.124 34.718 37.574 1.00 0.00 H new ATOM 0 HB2 SER A 109 -24.033 32.855 35.981 1.00 0.00 H new ATOM 0 HB3 SER A 109 -24.116 34.393 35.145 1.00 0.00 H new ATOM 0 HG SER A 109 -21.578 33.181 35.656 1.00 0.00 H new ATOM 864 N ILE A 110 -22.791 33.545 39.284 1.00 0.00 N ATOM 865 CA ILE A 110 -22.092 32.720 40.263 1.00 0.00 C ATOM 866 C ILE A 110 -23.061 31.742 40.921 1.00 0.00 C ATOM 867 O ILE A 110 -24.181 32.107 41.275 1.00 0.00 O ATOM 868 CB ILE A 110 -21.439 33.610 41.330 1.00 0.00 C ATOM 869 CG1 ILE A 110 -20.010 33.948 40.899 1.00 0.00 C ATOM 870 CG2 ILE A 110 -21.399 32.874 42.673 1.00 0.00 C ATOM 871 CD1 ILE A 110 -19.416 34.980 41.860 1.00 0.00 C ATOM 0 H ILE A 110 -23.614 34.025 39.647 1.00 0.00 H new ATOM 0 HA ILE A 110 -21.316 32.152 39.750 1.00 0.00 H new ATOM 0 HB ILE A 110 -22.022 34.525 41.439 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.398 33.046 40.894 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.009 34.340 39.882 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -20.934 33.513 43.424 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -22.415 32.628 42.984 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -20.820 31.957 42.568 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -18.398 35.220 41.552 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.023 35.885 41.843 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -19.403 34.571 42.870 1.00 0.00 H new ATOM 883 N GLY A 111 -22.620 30.498 41.079 1.00 0.00 N ATOM 884 CA GLY A 111 -23.459 29.476 41.693 1.00 0.00 C ATOM 885 C GLY A 111 -22.639 28.245 42.063 1.00 0.00 C ATOM 886 O GLY A 111 -21.446 28.171 41.769 1.00 0.00 O ATOM 0 H GLY A 111 -21.695 30.176 40.793 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -23.937 29.881 42.585 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -24.256 29.193 41.005 1.00 0.00 H new ATOM 890 N CYS A 112 -23.288 27.279 42.707 1.00 0.00 N ATOM 891 CA CYS A 112 -22.610 26.054 43.111 1.00 0.00 C ATOM 892 C CYS A 112 -23.355 24.831 42.588 1.00 0.00 C ATOM 893 O CYS A 112 -24.491 24.936 42.125 1.00 0.00 O ATOM 894 CB CYS A 112 -22.523 25.985 44.636 1.00 0.00 C ATOM 895 SG CYS A 112 -23.910 26.895 45.361 1.00 0.00 S ATOM 0 H CYS A 112 -24.276 27.321 42.958 1.00 0.00 H new ATOM 0 HA CYS A 112 -21.605 26.061 42.689 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -22.544 24.946 44.966 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -21.578 26.409 44.977 1.00 0.00 H new ATOM 0 HG CYS A 112 -24.979 26.698 44.647 1.00 0.00 H new ATOM 901 N ARG A 113 -22.709 23.672 42.666 1.00 0.00 N ATOM 902 CA ARG A 113 -23.322 22.434 42.199 1.00 0.00 C ATOM 903 C ARG A 113 -22.672 21.230 42.874 1.00 0.00 C ATOM 904 O ARG A 113 -21.456 21.196 43.067 1.00 0.00 O ATOM 905 CB ARG A 113 -23.168 22.314 40.682 1.00 0.00 C ATOM 906 CG ARG A 113 -21.700 22.059 40.337 1.00 0.00 C ATOM 907 CD ARG A 113 -21.389 22.646 38.959 1.00 0.00 C ATOM 908 NE ARG A 113 -22.091 21.897 37.923 1.00 0.00 N ATOM 909 CZ ARG A 113 -21.995 22.241 36.644 1.00 0.00 C ATOM 910 NH1 ARG A 113 -21.267 23.267 36.296 1.00 0.00 N ATOM 911 NH2 ARG A 113 -22.631 21.554 35.734 1.00 0.00 N ATOM 0 H ARG A 113 -21.768 23.564 43.045 1.00 0.00 H new ATOM 0 HA ARG A 113 -24.381 22.455 42.455 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -23.788 21.500 40.306 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -23.513 23.227 40.197 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -21.055 22.511 41.090 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -21.495 20.988 40.342 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -21.688 23.694 38.926 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -20.315 22.615 38.776 1.00 0.00 H new ATOM 0 HE ARG A 113 -22.665 21.096 38.185 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -20.771 23.805 37.007 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -21.194 23.531 35.313 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -23.201 20.753 36.006 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -22.557 21.818 34.752 1.00 0.00 H new ATOM 925 N ILE A 114 -23.489 20.246 43.231 1.00 0.00 N ATOM 926 CA ILE A 114 -22.982 19.046 43.884 1.00 0.00 C ATOM 927 C ILE A 114 -23.391 17.798 43.110 1.00 0.00 C ATOM 928 O ILE A 114 -24.575 17.476 43.012 1.00 0.00 O ATOM 929 CB ILE A 114 -23.521 18.962 45.313 1.00 0.00 C ATOM 930 CG1 ILE A 114 -22.850 20.035 46.174 1.00 0.00 C ATOM 931 CG2 ILE A 114 -23.218 17.581 45.892 1.00 0.00 C ATOM 932 CD1 ILE A 114 -23.640 21.342 46.072 1.00 0.00 C ATOM 0 H ILE A 114 -24.498 20.255 43.081 1.00 0.00 H new ATOM 0 HA ILE A 114 -21.894 19.102 43.908 1.00 0.00 H new ATOM 0 HB ILE A 114 -24.599 19.123 45.305 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -22.804 19.706 47.212 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -21.823 20.192 45.843 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -23.602 17.521 46.910 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -23.695 16.817 45.279 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -22.140 17.419 45.901 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -23.161 22.105 46.685 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -23.663 21.673 45.034 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -24.659 21.180 46.424 1.00 0.00 H new ATOM 944 N THR A 115 -22.404 17.094 42.565 1.00 0.00 N ATOM 945 CA THR A 115 -22.672 15.880 41.805 1.00 0.00 C ATOM 946 C THR A 115 -21.886 14.707 42.381 1.00 0.00 C ATOM 947 O THR A 115 -20.662 14.766 42.497 1.00 0.00 O ATOM 948 CB THR A 115 -22.287 16.084 40.338 1.00 0.00 C ATOM 949 OG1 THR A 115 -21.362 15.080 39.950 1.00 0.00 O ATOM 950 CG2 THR A 115 -21.652 17.464 40.162 1.00 0.00 C ATOM 0 H THR A 115 -21.417 17.342 42.635 1.00 0.00 H new ATOM 0 HA THR A 115 -23.737 15.659 41.871 1.00 0.00 H new ATOM 0 HB THR A 115 -23.179 16.017 39.715 1.00 0.00 H new ATOM 0 HG1 THR A 115 -21.115 15.208 39.010 1.00 0.00 H new ATOM 0 HG21 THR A 115 -21.378 17.608 39.117 1.00 0.00 H new ATOM 0 HG22 THR A 115 -22.365 18.233 40.460 1.00 0.00 H new ATOM 0 HG23 THR A 115 -20.760 17.536 40.784 1.00 0.00 H new ATOM 958 N VAL A 116 -22.596 13.643 42.743 1.00 0.00 N ATOM 959 CA VAL A 116 -21.949 12.464 43.309 1.00 0.00 C ATOM 960 C VAL A 116 -22.504 11.190 42.680 1.00 0.00 C ATOM 961 O VAL A 116 -23.658 11.148 42.254 1.00 0.00 O ATOM 962 CB VAL A 116 -22.166 12.424 44.823 1.00 0.00 C ATOM 963 CG1 VAL A 116 -23.648 12.186 45.118 1.00 0.00 C ATOM 964 CG2 VAL A 116 -21.337 11.289 45.426 1.00 0.00 C ATOM 0 H VAL A 116 -23.610 13.572 42.656 1.00 0.00 H new ATOM 0 HA VAL A 116 -20.882 12.524 43.096 1.00 0.00 H new ATOM 0 HB VAL A 116 -21.856 13.373 45.261 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -23.804 12.157 46.196 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -24.239 12.994 44.687 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -23.958 11.237 44.681 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -21.491 11.260 46.505 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -21.647 10.340 44.989 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -20.281 11.458 45.215 1.00 0.00 H new ATOM 974 N ASP A 117 -21.675 10.154 42.627 1.00 0.00 N ATOM 975 CA ASP A 117 -22.092 8.879 42.050 1.00 0.00 C ATOM 976 C ASP A 117 -22.656 9.084 40.648 1.00 0.00 C ATOM 977 O ASP A 117 -23.113 8.137 40.007 1.00 0.00 O ATOM 978 CB ASP A 117 -23.150 8.225 42.939 1.00 0.00 C ATOM 979 CG ASP A 117 -23.546 6.866 42.371 1.00 0.00 C ATOM 980 OD1 ASP A 117 -24.384 6.838 41.485 1.00 0.00 O ATOM 981 OD2 ASP A 117 -23.002 5.874 42.829 1.00 0.00 O ATOM 0 H ASP A 117 -20.716 10.170 42.974 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.220 8.228 41.986 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -22.763 8.106 43.951 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -24.027 8.869 43.007 1.00 0.00 H new ATOM 986 N GLY A 118 -22.620 10.326 40.175 1.00 0.00 N ATOM 987 CA GLY A 118 -23.127 10.645 38.846 1.00 0.00 C ATOM 988 C GLY A 118 -24.616 10.977 38.893 1.00 0.00 C ATOM 989 O GLY A 118 -25.263 11.105 37.854 1.00 0.00 O ATOM 0 H GLY A 118 -22.247 11.124 40.690 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -22.575 11.491 38.436 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -22.960 9.801 38.177 1.00 0.00 H new ATOM 993 N LYS A 119 -25.151 11.115 40.101 1.00 0.00 N ATOM 994 CA LYS A 119 -26.565 11.434 40.267 1.00 0.00 C ATOM 995 C LYS A 119 -26.736 12.701 41.099 1.00 0.00 C ATOM 996 O LYS A 119 -26.186 12.813 42.194 1.00 0.00 O ATOM 997 CB LYS A 119 -27.288 10.271 40.951 1.00 0.00 C ATOM 998 CG LYS A 119 -26.283 9.458 41.770 1.00 0.00 C ATOM 999 CD LYS A 119 -27.031 8.421 42.611 1.00 0.00 C ATOM 1000 CE LYS A 119 -27.447 9.047 43.943 1.00 0.00 C ATOM 1001 NZ LYS A 119 -26.229 9.444 44.706 1.00 0.00 N ATOM 0 H LYS A 119 -24.632 11.012 40.973 1.00 0.00 H new ATOM 0 HA LYS A 119 -26.997 11.600 39.280 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -28.079 10.650 41.598 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -27.764 9.635 40.205 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -25.574 8.962 41.107 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -25.706 10.119 42.417 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -27.911 8.067 42.073 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -26.395 7.554 42.788 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -28.079 9.918 43.767 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -28.037 8.337 44.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -26.443 9.448 45.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -25.464 8.766 44.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -25.929 10.395 44.411 1.00 0.00 H new ATOM 1015 N VAL A 120 -27.505 13.650 40.574 1.00 0.00 N ATOM 1016 CA VAL A 120 -27.744 14.904 41.278 1.00 0.00 C ATOM 1017 C VAL A 120 -28.815 14.718 42.348 1.00 0.00 C ATOM 1018 O VAL A 120 -29.836 14.075 42.110 1.00 0.00 O ATOM 1019 CB VAL A 120 -28.189 15.983 40.289 1.00 0.00 C ATOM 1020 CG1 VAL A 120 -29.607 15.680 39.804 1.00 0.00 C ATOM 1021 CG2 VAL A 120 -28.170 17.349 40.980 1.00 0.00 C ATOM 0 H VAL A 120 -27.970 13.575 39.669 1.00 0.00 H new ATOM 0 HA VAL A 120 -26.815 15.214 41.757 1.00 0.00 H new ATOM 0 HB VAL A 120 -27.508 15.995 39.438 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -29.923 16.449 39.100 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -29.623 14.708 39.311 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -30.288 15.666 40.655 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -28.487 18.118 40.275 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -28.850 17.335 41.832 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -27.160 17.568 41.325 1.00 0.00 H new ATOM 1031 N ARG A 121 -28.574 15.282 43.527 1.00 0.00 N ATOM 1032 CA ARG A 121 -29.527 15.165 44.624 1.00 0.00 C ATOM 1033 C ARG A 121 -30.026 16.540 45.060 1.00 0.00 C ATOM 1034 O ARG A 121 -31.231 16.779 45.129 1.00 0.00 O ATOM 1035 CB ARG A 121 -28.874 14.456 45.811 1.00 0.00 C ATOM 1036 CG ARG A 121 -29.930 14.177 46.882 1.00 0.00 C ATOM 1037 CD ARG A 121 -30.862 13.061 46.405 1.00 0.00 C ATOM 1038 NE ARG A 121 -30.904 11.986 47.388 1.00 0.00 N ATOM 1039 CZ ARG A 121 -31.783 12.000 48.384 1.00 0.00 C ATOM 1040 NH1 ARG A 121 -32.634 12.983 48.489 1.00 0.00 N ATOM 1041 NH2 ARG A 121 -31.797 11.028 49.256 1.00 0.00 N ATOM 0 H ARG A 121 -27.735 15.820 43.746 1.00 0.00 H new ATOM 0 HA ARG A 121 -30.378 14.581 44.275 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -28.417 13.522 45.484 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -28.077 15.074 46.224 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -29.448 13.888 47.816 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -30.503 15.081 47.086 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -31.865 13.458 46.246 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -30.517 12.674 45.446 1.00 0.00 H new ATOM 0 HE ARG A 121 -30.247 11.209 47.310 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -32.625 13.741 47.806 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -33.309 12.994 49.254 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -31.133 10.258 49.172 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -32.472 11.039 50.021 1.00 0.00 H new ATOM 1055 N ALA A 122 -29.091 17.438 45.353 1.00 0.00 N ATOM 1056 CA ALA A 122 -29.451 18.785 45.784 1.00 0.00 C ATOM 1057 C ALA A 122 -28.372 19.784 45.380 1.00 0.00 C ATOM 1058 O ALA A 122 -27.191 19.585 45.664 1.00 0.00 O ATOM 1059 CB ALA A 122 -29.633 18.815 47.302 1.00 0.00 C ATOM 0 H ALA A 122 -28.088 17.261 45.301 1.00 0.00 H new ATOM 0 HA ALA A 122 -30.387 19.063 45.299 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -29.902 19.824 47.616 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -30.425 18.123 47.587 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -28.702 18.520 47.786 1.00 0.00 H new ATOM 1065 N GLU A 123 -28.785 20.859 44.717 1.00 0.00 N ATOM 1066 CA GLU A 123 -27.843 21.883 44.280 1.00 0.00 C ATOM 1067 C GLU A 123 -28.524 23.246 44.197 1.00 0.00 C ATOM 1068 O GLU A 123 -29.558 23.396 43.545 1.00 0.00 O ATOM 1069 CB GLU A 123 -27.271 21.512 42.909 1.00 0.00 C ATOM 1070 CG GLU A 123 -28.417 21.185 41.948 1.00 0.00 C ATOM 1071 CD GLU A 123 -28.371 22.120 40.743 1.00 0.00 C ATOM 1072 OE1 GLU A 123 -27.382 22.086 40.028 1.00 0.00 O ATOM 1073 OE2 GLU A 123 -29.324 22.857 40.555 1.00 0.00 O ATOM 0 H GLU A 123 -29.758 21.043 44.472 1.00 0.00 H new ATOM 0 HA GLU A 123 -27.036 21.941 45.010 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -26.677 22.337 42.516 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -26.604 20.655 43.001 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -28.341 20.149 41.618 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -29.373 21.287 42.461 1.00 0.00 H new ATOM 1080 N ARG A 124 -27.936 24.236 44.861 1.00 0.00 N ATOM 1081 CA ARG A 124 -28.489 25.585 44.853 1.00 0.00 C ATOM 1082 C ARG A 124 -27.804 26.434 43.788 1.00 0.00 C ATOM 1083 O ARG A 124 -26.592 26.647 43.839 1.00 0.00 O ATOM 1084 CB ARG A 124 -28.297 26.235 46.226 1.00 0.00 C ATOM 1085 CG ARG A 124 -29.607 26.889 46.674 1.00 0.00 C ATOM 1086 CD ARG A 124 -29.348 27.755 47.908 1.00 0.00 C ATOM 1087 NE ARG A 124 -30.611 28.161 48.514 1.00 0.00 N ATOM 1088 CZ ARG A 124 -30.643 28.781 49.688 1.00 0.00 C ATOM 1089 NH1 ARG A 124 -29.531 29.025 50.329 1.00 0.00 N ATOM 1090 NH2 ARG A 124 -31.785 29.144 50.204 1.00 0.00 N ATOM 0 H ARG A 124 -27.082 24.130 45.408 1.00 0.00 H new ATOM 0 HA ARG A 124 -29.553 25.522 44.626 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -27.986 25.486 46.954 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -27.504 26.981 46.178 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -30.016 27.498 45.868 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -30.349 26.124 46.903 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -28.751 27.200 48.632 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -28.771 28.636 47.628 1.00 0.00 H new ATOM 0 HE ARG A 124 -31.486 27.965 48.027 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -28.638 28.739 49.928 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -29.556 29.501 51.231 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -32.654 28.952 49.706 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -31.809 29.620 51.106 1.00 0.00 H new ATOM 1104 N VAL A 125 -28.581 26.915 42.823 1.00 0.00 N ATOM 1105 CA VAL A 125 -28.027 27.735 41.752 1.00 0.00 C ATOM 1106 C VAL A 125 -28.691 29.107 41.719 1.00 0.00 C ATOM 1107 O VAL A 125 -29.893 29.221 41.474 1.00 0.00 O ATOM 1108 CB VAL A 125 -28.228 27.037 40.406 1.00 0.00 C ATOM 1109 CG1 VAL A 125 -27.451 27.785 39.322 1.00 0.00 C ATOM 1110 CG2 VAL A 125 -27.718 25.598 40.501 1.00 0.00 C ATOM 0 H VAL A 125 -29.586 26.753 42.760 1.00 0.00 H new ATOM 0 HA VAL A 125 -26.962 27.869 41.940 1.00 0.00 H new ATOM 0 HB VAL A 125 -29.288 27.032 40.152 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -27.594 27.288 38.363 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -27.814 28.811 39.257 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -26.390 27.791 39.573 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -27.860 25.098 39.543 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -26.658 25.604 40.754 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -28.272 25.066 41.274 1.00 0.00 H new ATOM 1120 N SER A 126 -27.899 30.147 41.961 1.00 0.00 N ATOM 1121 CA SER A 126 -28.417 31.511 41.952 1.00 0.00 C ATOM 1122 C SER A 126 -27.489 32.429 41.160 1.00 0.00 C ATOM 1123 O SER A 126 -26.338 32.638 41.540 1.00 0.00 O ATOM 1124 CB SER A 126 -28.554 32.029 43.383 1.00 0.00 C ATOM 1125 OG SER A 126 -29.746 32.798 43.491 1.00 0.00 O ATOM 0 H SER A 126 -26.902 30.073 42.165 1.00 0.00 H new ATOM 0 HA SER A 126 -29.398 31.505 41.476 1.00 0.00 H new ATOM 0 HB2 SER A 126 -28.581 31.194 44.083 1.00 0.00 H new ATOM 0 HB3 SER A 126 -27.689 32.638 43.646 1.00 0.00 H new ATOM 0 HG SER A 126 -29.839 33.131 44.408 1.00 0.00 H new ATOM 1131 N ASN A 127 -27.997 32.974 40.060 1.00 0.00 N ATOM 1132 CA ASN A 127 -27.201 33.868 39.227 1.00 0.00 C ATOM 1133 C ASN A 127 -27.552 35.324 39.516 1.00 0.00 C ATOM 1134 O ASN A 127 -28.726 35.690 39.573 1.00 0.00 O ATOM 1135 CB ASN A 127 -27.448 33.566 37.748 1.00 0.00 C ATOM 1136 CG ASN A 127 -27.149 32.098 37.457 1.00 0.00 C ATOM 1137 OD1 ASN A 127 -26.976 31.716 36.299 1.00 0.00 O ATOM 1138 ND2 ASN A 127 -27.077 31.248 38.443 1.00 0.00 N ATOM 0 H ASN A 127 -28.948 32.815 39.727 1.00 0.00 H new ATOM 0 HA ASN A 127 -26.148 33.706 39.459 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -28.482 33.793 37.490 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -26.818 34.204 37.128 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -26.877 30.265 38.256 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -27.220 31.566 39.402 1.00 0.00 H new ATOM 1145 N GLU A 128 -26.527 36.150 39.700 1.00 0.00 N ATOM 1146 CA GLU A 128 -26.739 37.565 39.984 1.00 0.00 C ATOM 1147 C GLU A 128 -25.780 38.424 39.165 1.00 0.00 C ATOM 1148 O GLU A 128 -24.605 38.092 39.020 1.00 0.00 O ATOM 1149 CB GLU A 128 -26.527 37.837 41.474 1.00 0.00 C ATOM 1150 CG GLU A 128 -27.701 37.266 42.274 1.00 0.00 C ATOM 1151 CD GLU A 128 -27.238 36.072 43.100 1.00 0.00 C ATOM 1152 OE1 GLU A 128 -27.028 35.020 42.520 1.00 0.00 O ATOM 1153 OE2 GLU A 128 -27.098 36.227 44.303 1.00 0.00 O ATOM 0 H GLU A 128 -25.548 35.867 39.658 1.00 0.00 H new ATOM 0 HA GLU A 128 -27.763 37.822 39.712 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -25.593 37.384 41.807 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -26.442 38.909 41.649 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -28.113 38.034 42.929 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -28.500 36.962 41.597 1.00 0.00 H new ATOM 1160 N VAL A 129 -26.292 39.530 38.635 1.00 0.00 N ATOM 1161 CA VAL A 129 -25.477 40.431 37.834 1.00 0.00 C ATOM 1162 C VAL A 129 -24.430 41.122 38.702 1.00 0.00 C ATOM 1163 O VAL A 129 -23.568 41.840 38.197 1.00 0.00 O ATOM 1164 CB VAL A 129 -26.371 41.478 37.172 1.00 0.00 C ATOM 1165 CG1 VAL A 129 -27.423 40.782 36.307 1.00 0.00 C ATOM 1166 CG2 VAL A 129 -27.068 42.310 38.252 1.00 0.00 C ATOM 0 H VAL A 129 -27.263 39.822 38.746 1.00 0.00 H new ATOM 0 HA VAL A 129 -24.964 39.851 37.067 1.00 0.00 H new ATOM 0 HB VAL A 129 -25.762 42.130 36.546 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -28.060 41.531 35.836 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -26.928 40.190 35.537 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -28.032 40.128 36.931 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -27.706 43.057 37.780 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -27.676 41.657 38.878 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -26.319 42.809 38.867 1.00 0.00 H new ATOM 1176 N ASN A 130 -24.513 40.900 40.011 1.00 0.00 N ATOM 1177 CA ASN A 130 -23.566 41.509 40.938 1.00 0.00 C ATOM 1178 C ASN A 130 -23.573 40.772 42.275 1.00 0.00 C ATOM 1179 O ASN A 130 -24.368 41.083 43.161 1.00 0.00 O ATOM 1180 CB ASN A 130 -23.925 42.979 41.163 1.00 0.00 C ATOM 1181 CG ASN A 130 -22.655 43.821 41.239 1.00 0.00 C ATOM 1182 OD1 ASN A 130 -22.477 44.591 42.183 1.00 0.00 O ATOM 1183 ND2 ASN A 130 -21.759 43.720 40.296 1.00 0.00 N ATOM 0 H ASN A 130 -25.219 40.309 40.450 1.00 0.00 H new ATOM 0 HA ASN A 130 -22.569 41.441 40.503 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -24.559 43.335 40.351 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -24.497 43.085 42.085 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -20.908 44.280 40.339 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -21.910 43.081 39.515 1.00 0.00 H new ATOM 1190 N ALA A 131 -22.681 39.795 42.412 1.00 0.00 N ATOM 1191 CA ALA A 131 -22.594 39.021 43.644 1.00 0.00 C ATOM 1192 C ALA A 131 -21.684 39.719 44.650 1.00 0.00 C ATOM 1193 O ALA A 131 -21.948 39.710 45.852 1.00 0.00 O ATOM 1194 CB ALA A 131 -22.049 37.624 43.345 1.00 0.00 C ATOM 0 H ALA A 131 -22.013 39.523 41.691 1.00 0.00 H new ATOM 0 HA ALA A 131 -23.593 38.937 44.071 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -21.987 37.052 44.271 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -22.715 37.115 42.648 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -21.056 37.708 42.903 1.00 0.00 H new