USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 847 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 78 THR OG1 : rot 180:sc= -0.0148 USER MOD Set 1.2: A 79 LYS NZ :NH3+ -124:sc= 1.06 (180deg=-0.253) USER MOD Set 2.1: A 55 LYS NZ :NH3+ 147:sc= 0.0457 (180deg=-1.81!) USER MOD Set 2.2: A 67 TYR OH : rot 180:sc= 0.364 USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.764 (180deg=-4.24!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ -169:sc= -1.19 (180deg=-1.55!) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.446) USER MOD Single : A 14 CYS SG : rot 128:sc= 0.358 USER MOD Single : A 16 GLN : amide:sc= -0.2 K(o=-0.2,f=-1.2!) USER MOD Single : A 17 CYS SG : rot 180:sc= -1.58 USER MOD Single : A 18 HIS : no HE2:sc= -0.357 K(o=-0.36,f=-4.5!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 0.493 K(o=0.49,f=-3.3!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.667 K(o=0.67,f=-2.6!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0455) USER MOD Single : A 40 THR OG1 : rot 76:sc= 0.0945 USER MOD Single : A 42 GLN : amide:sc= -0.0598 X(o=-0.06,f=-0.18) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.0264 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc=-0.00474 USER MOD Single : A 52 ASN : amide:sc= 1.07 K(o=1.1,f=-7.1!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= 0.656 K(o=0.66,f=-2.3!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 MET CE :methyl -158:sc= -0.0316 (180deg=-0.428) USER MOD Single : A 86 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.235) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0673 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.596) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -76:sc= 1.31 USER MOD Single : A 103 ASN : amide:sc= -0.315 K(o=-0.32,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.360 -4.358 -15.145 1.00 10.00 N ATOM 2 CA GLY A 1 -3.925 -4.318 -15.204 1.00 10.00 C ATOM 3 C GLY A 1 -3.498 -5.766 -15.358 1.00 10.00 C ATOM 4 O GLY A 1 -4.325 -6.663 -15.196 1.00 10.00 O ATOM 0 H1 GLY A 1 -5.754 -3.659 -15.806 1.00 10.00 H new ATOM 0 H2 GLY A 1 -5.692 -5.308 -15.407 1.00 10.00 H new ATOM 0 H3 GLY A 1 -5.674 -4.136 -14.179 1.00 10.00 H new ATOM 0 HA2 GLY A 1 -3.581 -3.714 -16.043 1.00 10.00 H new ATOM 0 HA3 GLY A 1 -3.505 -3.877 -14.300 1.00 10.00 H new ATOM 10 N ASP A 2 -2.257 -5.943 -15.723 1.00 10.00 N ATOM 11 CA ASP A 2 -1.551 -7.204 -15.871 1.00 10.00 C ATOM 12 C ASP A 2 -0.947 -7.651 -14.536 1.00 10.00 C ATOM 13 O ASP A 2 -0.174 -6.917 -13.921 1.00 10.00 O ATOM 14 CB ASP A 2 -0.432 -7.059 -16.900 1.00 10.00 C ATOM 15 CG ASP A 2 -0.026 -8.425 -17.418 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.202 -9.297 -16.552 1.00 10.00 O ATOM 17 OD2 ASP A 2 0.038 -8.581 -18.653 1.00 10.00 O ATOM 0 H ASP A 2 -1.657 -5.148 -15.945 1.00 10.00 H new ATOM 0 HA ASP A 2 -2.267 -7.954 -16.206 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -0.765 -6.432 -17.727 1.00 10.00 H new ATOM 0 HB3 ASP A 2 0.427 -6.562 -16.449 1.00 10.00 H new ATOM 22 N VAL A 3 -1.266 -8.868 -14.092 1.00 10.00 N ATOM 23 CA VAL A 3 -0.676 -9.459 -12.898 1.00 10.00 C ATOM 24 C VAL A 3 0.841 -9.624 -13.067 1.00 10.00 C ATOM 25 O VAL A 3 1.593 -9.387 -12.123 1.00 10.00 O ATOM 26 CB VAL A 3 -1.372 -10.799 -12.583 1.00 10.00 C ATOM 27 CG1 VAL A 3 -0.841 -11.473 -11.305 1.00 10.00 C ATOM 28 CG2 VAL A 3 -2.888 -10.597 -12.445 1.00 10.00 C ATOM 0 H VAL A 3 -1.945 -9.471 -14.556 1.00 10.00 H new ATOM 0 HA VAL A 3 -0.830 -8.792 -12.050 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.148 -11.458 -13.422 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -1.372 -12.411 -11.141 1.00 10.00 H new ATOM 0 HG12 VAL A 3 0.225 -11.674 -11.416 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -0.999 -10.812 -10.453 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.364 -11.552 -12.223 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -3.089 -9.895 -11.636 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.289 -10.201 -13.378 1.00 10.00 H new ATOM 38 N GLU A 4 1.313 -10.037 -14.247 1.00 10.00 N ATOM 39 CA GLU A 4 2.732 -10.279 -14.460 1.00 10.00 C ATOM 40 C GLU A 4 3.504 -8.977 -14.290 1.00 10.00 C ATOM 41 O GLU A 4 4.423 -8.894 -13.474 1.00 10.00 O ATOM 42 CB GLU A 4 2.990 -10.871 -15.854 1.00 10.00 C ATOM 43 CG GLU A 4 3.253 -12.381 -15.819 1.00 10.00 C ATOM 44 CD GLU A 4 4.699 -12.620 -15.429 1.00 10.00 C ATOM 45 OE1 GLU A 4 5.570 -12.590 -16.325 1.00 10.00 O ATOM 46 OE2 GLU A 4 5.010 -12.541 -14.220 1.00 10.00 O ATOM 0 H GLU A 4 0.729 -10.209 -15.065 1.00 10.00 H new ATOM 0 HA GLU A 4 3.074 -11.003 -13.720 1.00 10.00 H new ATOM 0 HB2 GLU A 4 2.130 -10.671 -16.493 1.00 10.00 H new ATOM 0 HB3 GLU A 4 3.846 -10.368 -16.305 1.00 10.00 H new ATOM 0 HG2 GLU A 4 2.586 -12.863 -15.105 1.00 10.00 H new ATOM 0 HG3 GLU A 4 3.048 -12.822 -16.795 1.00 10.00 H new ATOM 53 N LYS A 5 3.150 -7.952 -15.069 1.00 10.00 N ATOM 54 CA LYS A 5 3.781 -6.655 -14.892 1.00 10.00 C ATOM 55 C LYS A 5 3.582 -6.192 -13.453 1.00 10.00 C ATOM 56 O LYS A 5 4.546 -5.786 -12.818 1.00 10.00 O ATOM 57 CB LYS A 5 3.297 -5.631 -15.912 1.00 10.00 C ATOM 58 CG LYS A 5 4.083 -5.734 -17.222 1.00 10.00 C ATOM 59 CD LYS A 5 4.890 -4.452 -17.487 1.00 10.00 C ATOM 60 CE LYS A 5 5.186 -4.325 -18.987 1.00 10.00 C ATOM 61 NZ LYS A 5 6.460 -3.629 -19.261 1.00 10.00 N ATOM 0 H LYS A 5 2.448 -7.997 -15.808 1.00 10.00 H new ATOM 0 HA LYS A 5 4.850 -6.756 -15.077 1.00 10.00 H new ATOM 0 HB2 LYS A 5 2.236 -5.785 -16.109 1.00 10.00 H new ATOM 0 HB3 LYS A 5 3.402 -4.627 -15.500 1.00 10.00 H new ATOM 0 HG2 LYS A 5 4.757 -6.589 -17.179 1.00 10.00 H new ATOM 0 HG3 LYS A 5 3.396 -5.912 -18.049 1.00 10.00 H new ATOM 0 HD2 LYS A 5 4.331 -3.582 -17.142 1.00 10.00 H new ATOM 0 HD3 LYS A 5 5.823 -4.476 -16.924 1.00 10.00 H new ATOM 0 HE2 LYS A 5 5.217 -5.319 -19.432 1.00 10.00 H new ATOM 0 HE3 LYS A 5 4.371 -3.785 -19.469 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 6.610 -3.571 -20.289 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 6.424 -2.669 -18.862 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 7.244 -4.156 -18.826 1.00 10.00 H new ATOM 75 N GLY A 6 2.368 -6.308 -12.915 1.00 10.00 N ATOM 76 CA GLY A 6 2.063 -5.946 -11.544 1.00 10.00 C ATOM 77 C GLY A 6 3.026 -6.542 -10.522 1.00 10.00 C ATOM 78 O GLY A 6 3.460 -5.849 -9.603 1.00 10.00 O ATOM 0 H GLY A 6 1.563 -6.661 -13.432 1.00 10.00 H new ATOM 0 HA2 GLY A 6 2.077 -4.860 -11.453 1.00 10.00 H new ATOM 0 HA3 GLY A 6 1.050 -6.272 -11.308 1.00 10.00 H new ATOM 82 N LYS A 7 3.357 -7.826 -10.677 1.00 10.00 N ATOM 83 CA LYS A 7 4.256 -8.541 -9.798 1.00 10.00 C ATOM 84 C LYS A 7 5.597 -7.832 -9.860 1.00 10.00 C ATOM 85 O LYS A 7 6.133 -7.383 -8.846 1.00 10.00 O ATOM 86 CB LYS A 7 4.339 -10.009 -10.254 1.00 10.00 C ATOM 87 CG LYS A 7 5.364 -10.807 -9.435 1.00 10.00 C ATOM 88 CD LYS A 7 5.534 -12.228 -9.999 1.00 10.00 C ATOM 89 CE LYS A 7 4.914 -13.277 -9.066 1.00 10.00 C ATOM 90 NZ LYS A 7 5.029 -14.643 -9.619 1.00 10.00 N ATOM 0 H LYS A 7 2.994 -8.401 -11.437 1.00 10.00 H new ATOM 0 HA LYS A 7 3.911 -8.549 -8.764 1.00 10.00 H new ATOM 0 HB2 LYS A 7 3.358 -10.474 -10.160 1.00 10.00 H new ATOM 0 HB3 LYS A 7 4.609 -10.046 -11.309 1.00 10.00 H new ATOM 0 HG2 LYS A 7 6.324 -10.291 -9.445 1.00 10.00 H new ATOM 0 HG3 LYS A 7 5.042 -10.861 -8.395 1.00 10.00 H new ATOM 0 HD2 LYS A 7 5.066 -12.290 -10.981 1.00 10.00 H new ATOM 0 HD3 LYS A 7 6.594 -12.442 -10.137 1.00 10.00 H new ATOM 0 HE2 LYS A 7 5.407 -13.236 -8.095 1.00 10.00 H new ATOM 0 HE3 LYS A 7 3.863 -13.040 -8.900 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 4.599 -15.322 -8.959 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 4.537 -14.690 -10.534 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 6.033 -14.880 -9.753 1.00 10.00 H new ATOM 104 N LYS A 8 6.132 -7.732 -11.077 1.00 10.00 N ATOM 105 CA LYS A 8 7.441 -7.152 -11.275 1.00 10.00 C ATOM 106 C LYS A 8 7.460 -5.702 -10.791 1.00 10.00 C ATOM 107 O LYS A 8 8.448 -5.265 -10.220 1.00 10.00 O ATOM 108 CB LYS A 8 7.897 -7.276 -12.735 1.00 10.00 C ATOM 109 CG LYS A 8 8.543 -8.629 -13.073 1.00 10.00 C ATOM 110 CD LYS A 8 7.639 -9.838 -12.800 1.00 10.00 C ATOM 111 CE LYS A 8 7.936 -11.002 -13.760 1.00 10.00 C ATOM 112 NZ LYS A 8 7.010 -10.967 -14.906 1.00 10.00 N ATOM 0 H LYS A 8 5.673 -8.047 -11.932 1.00 10.00 H new ATOM 0 HA LYS A 8 8.158 -7.713 -10.676 1.00 10.00 H new ATOM 0 HB2 LYS A 8 7.038 -7.121 -13.388 1.00 10.00 H new ATOM 0 HB3 LYS A 8 8.609 -6.480 -12.952 1.00 10.00 H new ATOM 0 HG2 LYS A 8 8.827 -8.631 -14.125 1.00 10.00 H new ATOM 0 HG3 LYS A 8 9.461 -8.736 -12.495 1.00 10.00 H new ATOM 0 HD2 LYS A 8 7.778 -10.171 -11.771 1.00 10.00 H new ATOM 0 HD3 LYS A 8 6.595 -9.541 -12.901 1.00 10.00 H new ATOM 0 HE2 LYS A 8 8.965 -10.938 -14.113 1.00 10.00 H new ATOM 0 HE3 LYS A 8 7.838 -11.951 -13.233 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 7.093 -11.852 -15.446 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 6.035 -10.862 -14.561 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 7.248 -10.163 -15.521 1.00 10.00 H new ATOM 126 N ILE A 9 6.380 -4.950 -10.995 1.00 10.00 N ATOM 127 CA ILE A 9 6.258 -3.585 -10.533 1.00 10.00 C ATOM 128 C ILE A 9 6.333 -3.578 -9.012 1.00 10.00 C ATOM 129 O ILE A 9 7.273 -3.020 -8.459 1.00 10.00 O ATOM 130 CB ILE A 9 4.960 -2.965 -11.085 1.00 10.00 C ATOM 131 CG1 ILE A 9 5.103 -2.693 -12.593 1.00 10.00 C ATOM 132 CG2 ILE A 9 4.580 -1.662 -10.376 1.00 10.00 C ATOM 133 CD1 ILE A 9 3.746 -2.422 -13.245 1.00 10.00 C ATOM 0 H ILE A 9 5.557 -5.285 -11.495 1.00 10.00 H new ATOM 0 HA ILE A 9 7.075 -2.966 -10.903 1.00 10.00 H new ATOM 0 HB ILE A 9 4.165 -3.688 -10.902 1.00 10.00 H new ATOM 0 HG12 ILE A 9 5.760 -1.837 -12.749 1.00 10.00 H new ATOM 0 HG13 ILE A 9 5.575 -3.549 -13.075 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.658 -1.270 -10.805 1.00 10.00 H new ATOM 0 HG22 ILE A 9 4.432 -1.856 -9.314 1.00 10.00 H new ATOM 0 HG23 ILE A 9 5.379 -0.932 -10.504 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.885 -2.234 -14.310 1.00 10.00 H new ATOM 0 HD12 ILE A 9 3.098 -3.288 -13.111 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.286 -1.550 -12.780 1.00 10.00 H new ATOM 145 N PHE A 10 5.358 -4.185 -8.339 1.00 10.00 N ATOM 146 CA PHE A 10 5.315 -4.251 -6.887 1.00 10.00 C ATOM 147 C PHE A 10 6.697 -4.585 -6.310 1.00 10.00 C ATOM 148 O PHE A 10 7.183 -3.946 -5.377 1.00 10.00 O ATOM 149 CB PHE A 10 4.276 -5.298 -6.489 1.00 10.00 C ATOM 150 CG PHE A 10 4.321 -5.626 -5.020 1.00 10.00 C ATOM 151 CD1 PHE A 10 3.782 -4.728 -4.082 1.00 10.00 C ATOM 152 CD2 PHE A 10 5.086 -6.723 -4.586 1.00 10.00 C ATOM 153 CE1 PHE A 10 3.916 -4.989 -2.712 1.00 10.00 C ATOM 154 CE2 PHE A 10 5.214 -6.989 -3.218 1.00 10.00 C ATOM 155 CZ PHE A 10 4.588 -6.147 -2.289 1.00 10.00 C ATOM 0 H PHE A 10 4.571 -4.648 -8.794 1.00 10.00 H new ATOM 0 HA PHE A 10 5.032 -3.281 -6.478 1.00 10.00 H new ATOM 0 HB2 PHE A 10 3.281 -4.934 -6.746 1.00 10.00 H new ATOM 0 HB3 PHE A 10 4.442 -6.208 -7.066 1.00 10.00 H new ATOM 0 HD1 PHE A 10 3.266 -3.840 -4.416 1.00 10.00 H new ATOM 0 HD2 PHE A 10 5.575 -7.360 -5.308 1.00 10.00 H new ATOM 0 HE1 PHE A 10 3.505 -4.304 -1.986 1.00 10.00 H new ATOM 0 HE2 PHE A 10 5.791 -7.837 -2.881 1.00 10.00 H new ATOM 0 HZ PHE A 10 4.623 -6.391 -1.238 1.00 10.00 H new ATOM 165 N VAL A 11 7.363 -5.572 -6.905 1.00 10.00 N ATOM 166 CA VAL A 11 8.708 -5.936 -6.517 1.00 10.00 C ATOM 167 C VAL A 11 9.679 -4.766 -6.748 1.00 10.00 C ATOM 168 O VAL A 11 10.306 -4.260 -5.825 1.00 10.00 O ATOM 169 CB VAL A 11 9.098 -7.219 -7.269 1.00 10.00 C ATOM 170 CG1 VAL A 11 10.583 -7.576 -7.133 1.00 10.00 C ATOM 171 CG2 VAL A 11 8.245 -8.383 -6.754 1.00 10.00 C ATOM 0 H VAL A 11 6.981 -6.135 -7.665 1.00 10.00 H new ATOM 0 HA VAL A 11 8.761 -6.145 -5.449 1.00 10.00 H new ATOM 0 HB VAL A 11 8.915 -7.036 -8.328 1.00 10.00 H new ATOM 0 HG11 VAL A 11 10.789 -8.491 -7.688 1.00 10.00 H new ATOM 0 HG12 VAL A 11 11.190 -6.764 -7.533 1.00 10.00 H new ATOM 0 HG13 VAL A 11 10.826 -7.726 -6.081 1.00 10.00 H new ATOM 0 HG21 VAL A 11 8.517 -9.296 -7.284 1.00 10.00 H new ATOM 0 HG22 VAL A 11 8.419 -8.517 -5.686 1.00 10.00 H new ATOM 0 HG23 VAL A 11 7.191 -8.165 -6.925 1.00 10.00 H new ATOM 181 N GLN A 12 9.812 -4.316 -7.991 1.00 10.00 N ATOM 182 CA GLN A 12 10.793 -3.319 -8.396 1.00 10.00 C ATOM 183 C GLN A 12 10.565 -1.967 -7.709 1.00 10.00 C ATOM 184 O GLN A 12 11.483 -1.153 -7.655 1.00 10.00 O ATOM 185 CB GLN A 12 10.751 -3.178 -9.920 1.00 10.00 C ATOM 186 CG GLN A 12 11.209 -4.476 -10.610 1.00 10.00 C ATOM 187 CD GLN A 12 12.721 -4.535 -10.791 1.00 10.00 C ATOM 188 OE1 GLN A 12 13.263 -3.899 -11.687 1.00 10.00 O ATOM 189 NE2 GLN A 12 13.414 -5.306 -9.958 1.00 10.00 N ATOM 0 H GLN A 12 9.228 -4.642 -8.761 1.00 10.00 H new ATOM 0 HA GLN A 12 11.781 -3.655 -8.083 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.738 -2.932 -10.238 1.00 10.00 H new ATOM 0 HB3 GLN A 12 11.392 -2.352 -10.230 1.00 10.00 H new ATOM 0 HG2 GLN A 12 10.883 -5.333 -10.020 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.726 -4.557 -11.584 1.00 10.00 H new ATOM 0 HE21 GLN A 12 12.933 -5.823 -9.222 1.00 10.00 H new ATOM 0 HE22 GLN A 12 14.427 -5.380 -10.055 1.00 10.00 H new ATOM 198 N LYS A 13 9.342 -1.699 -7.244 1.00 10.00 N ATOM 199 CA LYS A 13 8.983 -0.454 -6.582 1.00 10.00 C ATOM 200 C LYS A 13 9.066 -0.587 -5.062 1.00 10.00 C ATOM 201 O LYS A 13 9.583 0.313 -4.402 1.00 10.00 O ATOM 202 CB LYS A 13 7.569 -0.018 -6.981 1.00 10.00 C ATOM 203 CG LYS A 13 7.505 0.751 -8.308 1.00 10.00 C ATOM 204 CD LYS A 13 8.035 -0.056 -9.493 1.00 10.00 C ATOM 205 CE LYS A 13 7.806 0.621 -10.844 1.00 10.00 C ATOM 206 NZ LYS A 13 8.334 -0.231 -11.929 1.00 10.00 N ATOM 0 H LYS A 13 8.565 -2.355 -7.321 1.00 10.00 H new ATOM 0 HA LYS A 13 9.698 0.303 -6.903 1.00 10.00 H new ATOM 0 HB2 LYS A 13 6.934 -0.901 -7.053 1.00 10.00 H new ATOM 0 HB3 LYS A 13 7.156 0.608 -6.190 1.00 10.00 H new ATOM 0 HG2 LYS A 13 6.472 1.039 -8.505 1.00 10.00 H new ATOM 0 HG3 LYS A 13 8.081 1.672 -8.216 1.00 10.00 H new ATOM 0 HD2 LYS A 13 9.103 -0.226 -9.358 1.00 10.00 H new ATOM 0 HD3 LYS A 13 7.555 -1.034 -9.500 1.00 10.00 H new ATOM 0 HE2 LYS A 13 6.741 0.800 -10.995 1.00 10.00 H new ATOM 0 HE3 LYS A 13 8.298 1.594 -10.861 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 7.778 -0.076 -12.794 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 9.329 0.013 -12.109 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 8.268 -1.230 -11.649 1.00 10.00 H new ATOM 220 N CYS A 14 8.484 -1.654 -4.506 1.00 10.00 N ATOM 221 CA CYS A 14 8.252 -1.788 -3.077 1.00 10.00 C ATOM 222 C CYS A 14 9.166 -2.898 -2.533 1.00 10.00 C ATOM 223 O CYS A 14 10.125 -2.598 -1.825 1.00 10.00 O ATOM 224 CB CYS A 14 6.769 -1.987 -2.772 1.00 10.00 C ATOM 225 SG CYS A 14 5.606 -1.575 -4.141 1.00 10.00 S ATOM 0 H CYS A 14 8.159 -2.455 -5.048 1.00 10.00 H new ATOM 0 HA CYS A 14 8.515 -0.867 -2.557 1.00 10.00 H new ATOM 0 HB2 CYS A 14 6.612 -3.028 -2.488 1.00 10.00 H new ATOM 0 HB3 CYS A 14 6.511 -1.378 -1.906 1.00 10.00 H new ATOM 0 HG CYS A 14 4.802 -2.576 -4.344 1.00 10.00 H new ATOM 230 N ALA A 15 8.886 -4.163 -2.882 1.00 10.00 N ATOM 231 CA ALA A 15 9.579 -5.384 -2.446 1.00 10.00 C ATOM 232 C ALA A 15 10.085 -5.404 -1.003 1.00 10.00 C ATOM 233 O ALA A 15 9.510 -6.065 -0.144 1.00 10.00 O ATOM 234 CB ALA A 15 10.742 -5.733 -3.379 1.00 10.00 C ATOM 0 H ALA A 15 8.118 -4.374 -3.519 1.00 10.00 H new ATOM 0 HA ALA A 15 8.791 -6.135 -2.494 1.00 10.00 H new ATOM 0 HB1 ALA A 15 11.231 -6.641 -3.026 1.00 10.00 H new ATOM 0 HB2 ALA A 15 10.363 -5.894 -4.388 1.00 10.00 H new ATOM 0 HB3 ALA A 15 11.460 -4.913 -3.387 1.00 10.00 H new ATOM 240 N GLN A 16 11.208 -4.747 -0.716 1.00 10.00 N ATOM 241 CA GLN A 16 11.886 -4.820 0.564 1.00 10.00 C ATOM 242 C GLN A 16 11.183 -3.951 1.618 1.00 10.00 C ATOM 243 O GLN A 16 11.833 -3.258 2.396 1.00 10.00 O ATOM 244 CB GLN A 16 13.353 -4.442 0.346 1.00 10.00 C ATOM 245 CG GLN A 16 13.536 -2.999 -0.160 1.00 10.00 C ATOM 246 CD GLN A 16 14.593 -2.220 0.624 1.00 10.00 C ATOM 247 OE1 GLN A 16 14.824 -2.459 1.807 1.00 10.00 O ATOM 248 NE2 GLN A 16 15.263 -1.276 -0.031 1.00 10.00 N ATOM 0 H GLN A 16 11.677 -4.138 -1.386 1.00 10.00 H new ATOM 0 HA GLN A 16 11.847 -5.834 0.962 1.00 10.00 H new ATOM 0 HB2 GLN A 16 13.897 -4.564 1.283 1.00 10.00 H new ATOM 0 HB3 GLN A 16 13.797 -5.132 -0.372 1.00 10.00 H new ATOM 0 HG2 GLN A 16 13.816 -3.022 -1.213 1.00 10.00 H new ATOM 0 HG3 GLN A 16 12.583 -2.474 -0.095 1.00 10.00 H new ATOM 0 HE21 GLN A 16 15.057 -1.092 -1.013 1.00 10.00 H new ATOM 0 HE22 GLN A 16 15.983 -0.736 0.449 1.00 10.00 H new ATOM 257 N CYS A 17 9.853 -4.007 1.638 1.00 10.00 N ATOM 258 CA CYS A 17 8.973 -3.163 2.430 1.00 10.00 C ATOM 259 C CYS A 17 7.598 -3.805 2.564 1.00 10.00 C ATOM 260 O CYS A 17 7.012 -3.738 3.641 1.00 10.00 O ATOM 261 CB CYS A 17 8.864 -1.764 1.855 1.00 10.00 C ATOM 262 SG CYS A 17 9.621 -0.623 3.049 1.00 10.00 S ATOM 0 H CYS A 17 9.337 -4.679 1.071 1.00 10.00 H new ATOM 0 HA CYS A 17 9.412 -3.069 3.423 1.00 10.00 H new ATOM 0 HB2 CYS A 17 9.372 -1.704 0.892 1.00 10.00 H new ATOM 0 HB3 CYS A 17 7.821 -1.501 1.682 1.00 10.00 H new ATOM 0 HG CYS A 17 9.551 0.592 2.593 1.00 10.00 H new ATOM 267 N HIS A 18 7.080 -4.420 1.493 1.00 10.00 N ATOM 268 CA HIS A 18 5.840 -5.159 1.530 1.00 10.00 C ATOM 269 C HIS A 18 6.061 -6.478 0.823 1.00 10.00 C ATOM 270 O HIS A 18 6.810 -6.540 -0.145 1.00 10.00 O ATOM 271 CB HIS A 18 4.781 -4.390 0.763 1.00 10.00 C ATOM 272 CG HIS A 18 4.288 -3.168 1.474 1.00 10.00 C ATOM 273 ND1 HIS A 18 3.386 -3.144 2.510 1.00 10.00 N ATOM 274 CD2 HIS A 18 4.408 -1.898 0.993 1.00 10.00 C ATOM 275 CE1 HIS A 18 2.949 -1.880 2.625 1.00 10.00 C ATOM 276 NE2 HIS A 18 3.563 -1.075 1.733 1.00 10.00 N ATOM 0 H HIS A 18 7.524 -4.410 0.575 1.00 10.00 H new ATOM 0 HA HIS A 18 5.523 -5.311 2.562 1.00 10.00 H new ATOM 0 HB2 HIS A 18 5.188 -4.097 -0.205 1.00 10.00 H new ATOM 0 HB3 HIS A 18 3.936 -5.050 0.567 1.00 10.00 H new ATOM 0 HD1 HIS A 18 3.102 -3.938 3.084 1.00 10.00 H new ATOM 0 HD2 HIS A 18 5.047 -1.585 0.180 1.00 10.00 H new ATOM 0 HE1 HIS A 18 2.206 -1.551 3.336 1.00 10.00 H new ATOM 284 N THR A 19 5.355 -7.509 1.275 1.00 10.00 N ATOM 285 CA THR A 19 5.470 -8.851 0.732 1.00 10.00 C ATOM 286 C THR A 19 4.181 -9.314 0.041 1.00 10.00 C ATOM 287 O THR A 19 4.246 -10.160 -0.842 1.00 10.00 O ATOM 288 CB THR A 19 5.895 -9.760 1.880 1.00 10.00 C ATOM 289 OG1 THR A 19 7.155 -9.363 2.382 1.00 10.00 O ATOM 290 CG2 THR A 19 5.986 -11.203 1.417 1.00 10.00 C ATOM 0 H THR A 19 4.681 -7.432 2.037 1.00 10.00 H new ATOM 0 HA THR A 19 6.219 -8.882 -0.059 1.00 10.00 H new ATOM 0 HB THR A 19 5.143 -9.678 2.665 1.00 10.00 H new ATOM 0 HG1 THR A 19 7.414 -9.954 3.119 1.00 10.00 H new ATOM 0 HG21 THR A 19 6.291 -11.834 2.252 1.00 10.00 H new ATOM 0 HG22 THR A 19 5.013 -11.530 1.051 1.00 10.00 H new ATOM 0 HG23 THR A 19 6.720 -11.282 0.615 1.00 10.00 H new ATOM 298 N VAL A 20 3.025 -8.777 0.448 1.00 10.00 N ATOM 299 CA VAL A 20 1.698 -9.088 -0.080 1.00 10.00 C ATOM 300 C VAL A 20 1.410 -10.584 -0.017 1.00 10.00 C ATOM 301 O VAL A 20 0.713 -11.103 -0.879 1.00 10.00 O ATOM 302 CB VAL A 20 1.452 -8.507 -1.491 1.00 10.00 C ATOM 303 CG1 VAL A 20 1.542 -6.981 -1.518 1.00 10.00 C ATOM 304 CG2 VAL A 20 2.320 -9.067 -2.617 1.00 10.00 C ATOM 0 H VAL A 20 2.992 -8.080 1.192 1.00 10.00 H new ATOM 0 HA VAL A 20 0.983 -8.587 0.572 1.00 10.00 H new ATOM 0 HB VAL A 20 0.434 -8.838 -1.696 1.00 10.00 H new ATOM 0 HG11 VAL A 20 1.362 -6.624 -2.532 1.00 10.00 H new ATOM 0 HG12 VAL A 20 0.794 -6.560 -0.846 1.00 10.00 H new ATOM 0 HG13 VAL A 20 2.535 -6.669 -1.195 1.00 10.00 H new ATOM 0 HG21 VAL A 20 2.054 -8.582 -3.557 1.00 10.00 H new ATOM 0 HG22 VAL A 20 3.370 -8.878 -2.395 1.00 10.00 H new ATOM 0 HG23 VAL A 20 2.155 -10.141 -2.704 1.00 10.00 H new ATOM 314 N GLU A 21 1.945 -11.269 0.999 1.00 10.00 N ATOM 315 CA GLU A 21 1.862 -12.705 1.111 1.00 10.00 C ATOM 316 C GLU A 21 1.600 -13.110 2.559 1.00 10.00 C ATOM 317 O GLU A 21 1.900 -12.363 3.498 1.00 10.00 O ATOM 318 CB GLU A 21 3.164 -13.327 0.585 1.00 10.00 C ATOM 319 CG GLU A 21 2.895 -14.581 -0.238 1.00 10.00 C ATOM 320 CD GLU A 21 4.206 -15.265 -0.600 1.00 10.00 C ATOM 321 OE1 GLU A 21 4.725 -15.962 0.299 1.00 10.00 O ATOM 322 OE2 GLU A 21 4.677 -15.051 -1.738 1.00 10.00 O ATOM 0 H GLU A 21 2.450 -10.826 1.767 1.00 10.00 H new ATOM 0 HA GLU A 21 1.030 -13.074 0.511 1.00 10.00 H new ATOM 0 HB2 GLU A 21 3.695 -12.597 -0.026 1.00 10.00 H new ATOM 0 HB3 GLU A 21 3.814 -13.574 1.424 1.00 10.00 H new ATOM 0 HG2 GLU A 21 2.263 -15.266 0.327 1.00 10.00 H new ATOM 0 HG3 GLU A 21 2.351 -14.319 -1.145 1.00 10.00 H new ATOM 329 N LYS A 22 1.081 -14.328 2.726 1.00 10.00 N ATOM 330 CA LYS A 22 0.763 -14.915 4.020 1.00 10.00 C ATOM 331 C LYS A 22 2.001 -15.156 4.891 1.00 10.00 C ATOM 332 O LYS A 22 1.880 -15.327 6.100 1.00 10.00 O ATOM 333 CB LYS A 22 -0.076 -16.186 3.814 1.00 10.00 C ATOM 334 CG LYS A 22 0.695 -17.310 3.093 1.00 10.00 C ATOM 335 CD LYS A 22 0.914 -18.565 3.961 1.00 10.00 C ATOM 336 CE LYS A 22 0.086 -19.746 3.428 1.00 10.00 C ATOM 337 NZ LYS A 22 0.431 -21.019 4.093 1.00 10.00 N ATOM 0 H LYS A 22 0.867 -14.945 1.943 1.00 10.00 H new ATOM 0 HA LYS A 22 0.168 -14.195 4.583 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -0.416 -16.551 4.783 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -0.967 -15.937 3.237 1.00 10.00 H new ATOM 0 HG2 LYS A 22 0.150 -17.592 2.192 1.00 10.00 H new ATOM 0 HG3 LYS A 22 1.664 -16.927 2.773 1.00 10.00 H new ATOM 0 HD2 LYS A 22 1.971 -18.829 3.967 1.00 10.00 H new ATOM 0 HD3 LYS A 22 0.633 -18.353 4.993 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -0.974 -19.538 3.574 1.00 10.00 H new ATOM 0 HE3 LYS A 22 0.247 -19.844 2.354 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -0.153 -21.785 3.701 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 1.436 -21.233 3.933 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 0.253 -20.937 5.114 1.00 10.00 H new ATOM 351 N GLY A 23 3.186 -15.166 4.276 1.00 10.00 N ATOM 352 CA GLY A 23 4.474 -15.285 4.955 1.00 10.00 C ATOM 353 C GLY A 23 5.236 -13.963 4.958 1.00 10.00 C ATOM 354 O GLY A 23 6.459 -13.952 5.095 1.00 10.00 O ATOM 0 H GLY A 23 3.276 -15.089 3.263 1.00 10.00 H new ATOM 0 HA2 GLY A 23 4.315 -15.615 5.981 1.00 10.00 H new ATOM 0 HA3 GLY A 23 5.075 -16.050 4.463 1.00 10.00 H new ATOM 358 N GLY A 24 4.532 -12.841 4.796 1.00 10.00 N ATOM 359 CA GLY A 24 5.167 -11.543 4.731 1.00 10.00 C ATOM 360 C GLY A 24 5.805 -11.137 6.055 1.00 10.00 C ATOM 361 O GLY A 24 5.110 -10.906 7.041 1.00 10.00 O ATOM 0 H GLY A 24 3.516 -12.816 4.708 1.00 10.00 H new ATOM 0 HA2 GLY A 24 5.930 -11.554 3.952 1.00 10.00 H new ATOM 0 HA3 GLY A 24 4.428 -10.795 4.443 1.00 10.00 H new ATOM 365 N LYS A 25 7.136 -11.041 6.065 1.00 10.00 N ATOM 366 CA LYS A 25 7.891 -10.643 7.239 1.00 10.00 C ATOM 367 C LYS A 25 7.772 -9.135 7.460 1.00 10.00 C ATOM 368 O LYS A 25 7.671 -8.363 6.508 1.00 10.00 O ATOM 369 CB LYS A 25 9.361 -11.048 7.081 1.00 10.00 C ATOM 370 CG LYS A 25 9.511 -12.552 6.811 1.00 10.00 C ATOM 371 CD LYS A 25 10.984 -12.954 6.963 1.00 10.00 C ATOM 372 CE LYS A 25 11.206 -14.385 6.454 1.00 10.00 C ATOM 373 NZ LYS A 25 12.569 -14.877 6.749 1.00 10.00 N ATOM 0 H LYS A 25 7.717 -11.240 5.251 1.00 10.00 H new ATOM 0 HA LYS A 25 7.481 -11.152 8.111 1.00 10.00 H new ATOM 0 HB2 LYS A 25 9.807 -10.485 6.261 1.00 10.00 H new ATOM 0 HB3 LYS A 25 9.910 -10.784 7.985 1.00 10.00 H new ATOM 0 HG2 LYS A 25 8.894 -13.121 7.507 1.00 10.00 H new ATOM 0 HG3 LYS A 25 9.160 -12.789 5.807 1.00 10.00 H new ATOM 0 HD2 LYS A 25 11.615 -12.262 6.406 1.00 10.00 H new ATOM 0 HD3 LYS A 25 11.280 -12.884 8.010 1.00 10.00 H new ATOM 0 HE2 LYS A 25 10.474 -15.050 6.913 1.00 10.00 H new ATOM 0 HE3 LYS A 25 11.035 -14.417 5.378 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 12.674 -15.847 6.388 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 13.268 -14.259 6.290 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 12.725 -14.872 7.777 1.00 10.00 H new ATOM 387 N HIS A 26 7.828 -8.720 8.725 1.00 10.00 N ATOM 388 CA HIS A 26 7.860 -7.318 9.108 1.00 10.00 C ATOM 389 C HIS A 26 9.260 -6.753 8.842 1.00 10.00 C ATOM 390 O HIS A 26 10.251 -7.355 9.262 1.00 10.00 O ATOM 391 CB HIS A 26 7.430 -7.182 10.580 1.00 10.00 C ATOM 392 CG HIS A 26 8.071 -8.163 11.540 1.00 10.00 C ATOM 393 ND1 HIS A 26 9.380 -8.588 11.521 1.00 10.00 N ATOM 394 CD2 HIS A 26 7.432 -8.852 12.538 1.00 10.00 C ATOM 395 CE1 HIS A 26 9.526 -9.511 12.486 1.00 10.00 C ATOM 396 NE2 HIS A 26 8.365 -9.709 13.130 1.00 10.00 N ATOM 0 H HIS A 26 7.853 -9.360 9.519 1.00 10.00 H new ATOM 0 HA HIS A 26 7.158 -6.735 8.512 1.00 10.00 H new ATOM 0 HB2 HIS A 26 7.659 -6.170 10.915 1.00 10.00 H new ATOM 0 HB3 HIS A 26 6.348 -7.300 10.637 1.00 10.00 H new ATOM 0 HD1 HIS A 26 10.109 -8.261 10.887 1.00 10.00 H new ATOM 0 HD2 HIS A 26 6.394 -8.751 12.817 1.00 10.00 H new ATOM 0 HE1 HIS A 26 10.450 -10.023 12.712 1.00 10.00 H new ATOM 404 N LYS A 27 9.353 -5.615 8.145 1.00 10.00 N ATOM 405 CA LYS A 27 10.597 -4.862 7.999 1.00 10.00 C ATOM 406 C LYS A 27 10.341 -3.394 8.341 1.00 10.00 C ATOM 407 O LYS A 27 10.801 -2.910 9.371 1.00 10.00 O ATOM 408 CB LYS A 27 11.221 -5.053 6.604 1.00 10.00 C ATOM 409 CG LYS A 27 11.871 -6.442 6.521 1.00 10.00 C ATOM 410 CD LYS A 27 12.547 -6.741 5.169 1.00 10.00 C ATOM 411 CE LYS A 27 14.087 -6.648 5.194 1.00 10.00 C ATOM 412 NZ LYS A 27 14.600 -5.338 4.737 1.00 10.00 N ATOM 0 H LYS A 27 8.560 -5.190 7.664 1.00 10.00 H new ATOM 0 HA LYS A 27 11.336 -5.249 8.701 1.00 10.00 H new ATOM 0 HB2 LYS A 27 10.456 -4.951 5.834 1.00 10.00 H new ATOM 0 HB3 LYS A 27 11.966 -4.279 6.418 1.00 10.00 H new ATOM 0 HG2 LYS A 27 12.614 -6.532 7.314 1.00 10.00 H new ATOM 0 HG3 LYS A 27 11.110 -7.199 6.710 1.00 10.00 H new ATOM 0 HD2 LYS A 27 12.260 -7.742 4.846 1.00 10.00 H new ATOM 0 HD3 LYS A 27 12.165 -6.044 4.423 1.00 10.00 H new ATOM 0 HE2 LYS A 27 14.439 -6.835 6.208 1.00 10.00 H new ATOM 0 HE3 LYS A 27 14.502 -7.434 4.563 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 15.639 -5.339 4.777 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 14.291 -5.166 3.759 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 14.231 -4.586 5.353 1.00 10.00 H new ATOM 426 N THR A 28 9.585 -2.709 7.483 1.00 10.00 N ATOM 427 CA THR A 28 9.207 -1.310 7.654 1.00 10.00 C ATOM 428 C THR A 28 7.688 -1.193 7.666 1.00 10.00 C ATOM 429 O THR A 28 7.129 -0.564 8.562 1.00 10.00 O ATOM 430 CB THR A 28 9.850 -0.470 6.550 1.00 10.00 C ATOM 431 OG1 THR A 28 11.254 -0.501 6.700 1.00 10.00 O ATOM 432 CG2 THR A 28 9.370 0.986 6.561 1.00 10.00 C ATOM 0 H THR A 28 9.210 -3.124 6.630 1.00 10.00 H new ATOM 0 HA THR A 28 9.571 -0.928 8.608 1.00 10.00 H new ATOM 0 HB THR A 28 9.552 -0.903 5.595 1.00 10.00 H new ATOM 0 HG1 THR A 28 11.670 0.035 5.993 1.00 10.00 H new ATOM 0 HG21 THR A 28 9.858 1.536 5.757 1.00 10.00 H new ATOM 0 HG22 THR A 28 8.290 1.014 6.416 1.00 10.00 H new ATOM 0 HG23 THR A 28 9.620 1.444 7.518 1.00 10.00 H new ATOM 440 N GLY A 29 7.018 -1.776 6.666 1.00 10.00 N ATOM 441 CA GLY A 29 5.568 -1.817 6.599 1.00 10.00 C ATOM 442 C GLY A 29 5.078 -3.237 6.781 1.00 10.00 C ATOM 443 O GLY A 29 5.862 -4.181 6.656 1.00 10.00 O ATOM 0 H GLY A 29 7.478 -2.234 5.879 1.00 10.00 H new ATOM 0 HA2 GLY A 29 5.142 -1.176 7.371 1.00 10.00 H new ATOM 0 HA3 GLY A 29 5.230 -1.428 5.639 1.00 10.00 H new ATOM 447 N PRO A 30 3.790 -3.394 7.106 1.00 10.00 N ATOM 448 CA PRO A 30 3.206 -4.703 7.200 1.00 10.00 C ATOM 449 C PRO A 30 3.041 -5.334 5.833 1.00 10.00 C ATOM 450 O PRO A 30 3.017 -4.677 4.790 1.00 10.00 O ATOM 451 CB PRO A 30 1.872 -4.519 7.933 1.00 10.00 C ATOM 452 CG PRO A 30 1.513 -3.040 7.751 1.00 10.00 C ATOM 453 CD PRO A 30 2.841 -2.344 7.452 1.00 10.00 C ATOM 0 HA PRO A 30 3.848 -5.392 7.749 1.00 10.00 H new ATOM 0 HB2 PRO A 30 1.101 -5.166 7.515 1.00 10.00 H new ATOM 0 HB3 PRO A 30 1.964 -4.775 8.989 1.00 10.00 H new ATOM 0 HG2 PRO A 30 0.804 -2.904 6.935 1.00 10.00 H new ATOM 0 HG3 PRO A 30 1.048 -2.633 8.649 1.00 10.00 H new ATOM 0 HD2 PRO A 30 2.731 -1.635 6.632 1.00 10.00 H new ATOM 0 HD3 PRO A 30 3.186 -1.779 8.318 1.00 10.00 H new ATOM 461 N ASN A 31 2.937 -6.658 5.866 1.00 10.00 N ATOM 462 CA ASN A 31 2.579 -7.412 4.699 1.00 10.00 C ATOM 463 C ASN A 31 1.175 -6.984 4.309 1.00 10.00 C ATOM 464 O ASN A 31 0.246 -7.063 5.108 1.00 10.00 O ATOM 465 CB ASN A 31 2.718 -8.911 4.966 1.00 10.00 C ATOM 466 CG ASN A 31 1.748 -9.481 5.998 1.00 10.00 C ATOM 467 OD1 ASN A 31 1.517 -8.878 7.042 1.00 10.00 O ATOM 468 ND2 ASN A 31 1.212 -10.671 5.736 1.00 10.00 N ATOM 0 H ASN A 31 3.099 -7.222 6.700 1.00 10.00 H new ATOM 0 HA ASN A 31 3.248 -7.214 3.862 1.00 10.00 H new ATOM 0 HB2 ASN A 31 2.579 -9.445 4.026 1.00 10.00 H new ATOM 0 HB3 ASN A 31 3.736 -9.111 5.299 1.00 10.00 H new ATOM 0 HD21 ASN A 31 0.588 -11.109 6.413 1.00 10.00 H new ATOM 0 HD22 ASN A 31 1.425 -11.144 4.858 1.00 10.00 H new ATOM 475 N LEU A 32 1.052 -6.491 3.081 1.00 10.00 N ATOM 476 CA LEU A 32 -0.185 -6.043 2.466 1.00 10.00 C ATOM 477 C LEU A 32 -1.085 -7.267 2.216 1.00 10.00 C ATOM 478 O LEU A 32 -1.476 -7.539 1.094 1.00 10.00 O ATOM 479 CB LEU A 32 0.219 -5.315 1.164 1.00 10.00 C ATOM 480 CG LEU A 32 0.234 -3.789 1.221 1.00 10.00 C ATOM 481 CD1 LEU A 32 1.137 -3.240 0.108 1.00 10.00 C ATOM 482 CD2 LEU A 32 -1.168 -3.300 0.962 1.00 10.00 C ATOM 0 H LEU A 32 1.855 -6.390 2.460 1.00 10.00 H new ATOM 0 HA LEU A 32 -0.756 -5.360 3.094 1.00 10.00 H new ATOM 0 HB2 LEU A 32 1.213 -5.657 0.875 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -0.466 -5.622 0.374 1.00 10.00 H new ATOM 0 HG LEU A 32 0.600 -3.459 2.193 1.00 10.00 H new ATOM 0 HD11 LEU A 32 1.146 -2.151 0.151 1.00 10.00 H new ATOM 0 HD12 LEU A 32 2.151 -3.617 0.243 1.00 10.00 H new ATOM 0 HD13 LEU A 32 0.756 -3.562 -0.861 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -1.186 -2.211 0.997 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -1.495 -3.637 -0.022 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -1.839 -3.698 1.723 1.00 10.00 H new ATOM 494 N HIS A 33 -1.396 -8.060 3.237 1.00 10.00 N ATOM 495 CA HIS A 33 -2.131 -9.306 3.111 1.00 10.00 C ATOM 496 C HIS A 33 -3.510 -9.076 3.724 1.00 10.00 C ATOM 497 O HIS A 33 -3.614 -8.591 4.848 1.00 10.00 O ATOM 498 CB HIS A 33 -1.333 -10.409 3.804 1.00 10.00 C ATOM 499 CG HIS A 33 -1.960 -11.773 3.711 1.00 10.00 C ATOM 500 ND1 HIS A 33 -2.229 -12.492 2.564 1.00 10.00 N ATOM 501 CD2 HIS A 33 -2.328 -12.538 4.780 1.00 10.00 C ATOM 502 CE1 HIS A 33 -2.783 -13.657 2.948 1.00 10.00 C ATOM 503 NE2 HIS A 33 -2.853 -13.735 4.289 1.00 10.00 N ATOM 0 H HIS A 33 -1.135 -7.844 4.199 1.00 10.00 H new ATOM 0 HA HIS A 33 -2.268 -9.621 2.077 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -0.335 -10.449 3.367 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -1.211 -10.148 4.855 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -2.230 -12.266 5.821 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -3.125 -14.426 2.271 1.00 10.00 H new ATOM 0 HE2 HIS A 33 -3.217 -14.514 4.838 1.00 10.00 H new ATOM 511 N GLY A 34 -4.568 -9.350 2.961 1.00 10.00 N ATOM 512 CA GLY A 34 -5.928 -8.999 3.338 1.00 10.00 C ATOM 513 C GLY A 34 -6.180 -7.492 3.250 1.00 10.00 C ATOM 514 O GLY A 34 -7.091 -6.986 3.901 1.00 10.00 O ATOM 0 H GLY A 34 -4.500 -9.824 2.060 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.630 -9.522 2.688 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.121 -9.339 4.355 1.00 10.00 H new ATOM 518 N LEU A 35 -5.397 -6.779 2.429 1.00 10.00 N ATOM 519 CA LEU A 35 -5.584 -5.356 2.183 1.00 10.00 C ATOM 520 C LEU A 35 -7.002 -5.119 1.668 1.00 10.00 C ATOM 521 O LEU A 35 -7.815 -4.429 2.283 1.00 10.00 O ATOM 522 CB LEU A 35 -4.540 -4.887 1.149 1.00 10.00 C ATOM 523 CG LEU A 35 -4.716 -3.456 0.588 1.00 10.00 C ATOM 524 CD1 LEU A 35 -4.451 -2.362 1.623 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.877 -3.254 -0.671 1.00 10.00 C ATOM 0 H LEU A 35 -4.613 -7.183 1.917 1.00 10.00 H new ATOM 0 HA LEU A 35 -5.449 -4.788 3.103 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -3.553 -4.955 1.607 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -4.552 -5.585 0.312 1.00 10.00 H new ATOM 0 HG LEU A 35 -5.768 -3.359 0.318 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.592 -1.384 1.163 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.144 -2.474 2.457 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -3.427 -2.447 1.988 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.019 -2.240 -1.044 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -2.824 -3.409 -0.435 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -4.187 -3.968 -1.434 1.00 10.00 H new ATOM 537 N PHE A 36 -7.286 -5.705 0.505 1.00 10.00 N ATOM 538 CA PHE A 36 -8.576 -5.592 -0.135 1.00 10.00 C ATOM 539 C PHE A 36 -9.611 -6.379 0.656 1.00 10.00 C ATOM 540 O PHE A 36 -9.589 -7.607 0.659 1.00 10.00 O ATOM 541 CB PHE A 36 -8.471 -6.072 -1.583 1.00 10.00 C ATOM 542 CG PHE A 36 -7.451 -5.316 -2.414 1.00 10.00 C ATOM 543 CD1 PHE A 36 -7.391 -3.911 -2.373 1.00 10.00 C ATOM 544 CD2 PHE A 36 -6.588 -6.016 -3.270 1.00 10.00 C ATOM 545 CE1 PHE A 36 -6.501 -3.213 -3.202 1.00 10.00 C ATOM 546 CE2 PHE A 36 -5.712 -5.310 -4.109 1.00 10.00 C ATOM 547 CZ PHE A 36 -5.661 -3.911 -4.078 1.00 10.00 C ATOM 0 H PHE A 36 -6.617 -6.273 -0.015 1.00 10.00 H new ATOM 0 HA PHE A 36 -8.899 -4.551 -0.153 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -8.213 -7.131 -1.586 1.00 10.00 H new ATOM 0 HB3 PHE A 36 -9.449 -5.981 -2.056 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -8.035 -3.366 -1.698 1.00 10.00 H new ATOM 0 HD2 PHE A 36 -6.598 -7.096 -3.283 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -6.463 -2.134 -3.165 1.00 10.00 H new ATOM 0 HE2 PHE A 36 -5.069 -5.852 -4.787 1.00 10.00 H new ATOM 0 HZ PHE A 36 -4.980 -3.376 -4.723 1.00 10.00 H new ATOM 557 N GLY A 37 -10.528 -5.655 1.301 1.00 10.00 N ATOM 558 CA GLY A 37 -11.587 -6.225 2.121 1.00 10.00 C ATOM 559 C GLY A 37 -11.375 -5.943 3.607 1.00 10.00 C ATOM 560 O GLY A 37 -11.845 -6.708 4.446 1.00 10.00 O ATOM 0 H GLY A 37 -10.551 -4.636 1.264 1.00 10.00 H new ATOM 0 HA2 GLY A 37 -12.548 -5.816 1.808 1.00 10.00 H new ATOM 0 HA3 GLY A 37 -11.631 -7.302 1.959 1.00 10.00 H new ATOM 564 N ARG A 38 -10.710 -4.834 3.948 1.00 10.00 N ATOM 565 CA ARG A 38 -10.539 -4.398 5.323 1.00 10.00 C ATOM 566 C ARG A 38 -10.340 -2.881 5.321 1.00 10.00 C ATOM 567 O ARG A 38 -9.792 -2.325 4.370 1.00 10.00 O ATOM 568 CB ARG A 38 -9.365 -5.167 5.948 1.00 10.00 C ATOM 569 CG ARG A 38 -9.143 -4.831 7.428 1.00 10.00 C ATOM 570 CD ARG A 38 -8.151 -5.817 8.063 1.00 10.00 C ATOM 571 NE ARG A 38 -8.821 -7.041 8.539 1.00 10.00 N ATOM 572 CZ ARG A 38 -9.454 -7.166 9.718 1.00 10.00 C ATOM 573 NH1 ARG A 38 -9.545 -6.113 10.537 1.00 10.00 N ATOM 574 NH2 ARG A 38 -10.000 -8.335 10.075 1.00 10.00 N ATOM 0 H ARG A 38 -10.274 -4.214 3.265 1.00 10.00 H new ATOM 0 HA ARG A 38 -11.416 -4.613 5.934 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -9.546 -6.237 5.848 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -8.455 -4.944 5.391 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -8.764 -3.813 7.523 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -10.093 -4.868 7.961 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -7.386 -6.082 7.334 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -7.642 -5.334 8.897 1.00 10.00 H new ATOM 0 HE ARG A 38 -8.803 -7.856 7.926 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -9.135 -5.219 10.266 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -10.025 -6.203 11.433 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -9.937 -9.139 9.451 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -10.479 -8.422 10.972 1.00 10.00 H new ATOM 588 N LYS A 39 -10.837 -2.208 6.365 1.00 10.00 N ATOM 589 CA LYS A 39 -10.628 -0.784 6.557 1.00 10.00 C ATOM 590 C LYS A 39 -9.212 -0.491 7.054 1.00 10.00 C ATOM 591 O LYS A 39 -8.480 -1.386 7.468 1.00 10.00 O ATOM 592 CB LYS A 39 -11.682 -0.224 7.521 1.00 10.00 C ATOM 593 CG LYS A 39 -12.988 0.075 6.773 1.00 10.00 C ATOM 594 CD LYS A 39 -13.980 0.852 7.649 1.00 10.00 C ATOM 595 CE LYS A 39 -15.033 -0.024 8.341 1.00 10.00 C ATOM 596 NZ LYS A 39 -14.437 -1.016 9.255 1.00 10.00 N ATOM 0 H LYS A 39 -11.396 -2.645 7.098 1.00 10.00 H new ATOM 0 HA LYS A 39 -10.740 -0.286 5.594 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -11.870 -0.941 8.321 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -11.308 0.686 7.990 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -12.769 0.651 5.874 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -13.444 -0.861 6.449 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -13.423 1.400 8.410 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -14.489 1.592 7.032 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -15.719 0.613 8.900 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -15.623 -0.541 7.585 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -15.193 -1.523 9.758 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -13.870 -1.695 8.708 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -13.827 -0.531 9.944 1.00 10.00 H new ATOM 610 N THR A 40 -8.845 0.788 7.016 1.00 10.00 N ATOM 611 CA THR A 40 -7.567 1.283 7.477 1.00 10.00 C ATOM 612 C THR A 40 -7.471 1.208 9.004 1.00 10.00 C ATOM 613 O THR A 40 -8.417 0.827 9.692 1.00 10.00 O ATOM 614 CB THR A 40 -7.396 2.722 6.968 1.00 10.00 C ATOM 615 OG1 THR A 40 -8.366 3.576 7.547 1.00 10.00 O ATOM 616 CG2 THR A 40 -7.565 2.804 5.451 1.00 10.00 C ATOM 0 H THR A 40 -9.452 1.523 6.652 1.00 10.00 H new ATOM 0 HA THR A 40 -6.761 0.664 7.083 1.00 10.00 H new ATOM 0 HB THR A 40 -6.389 3.033 7.248 1.00 10.00 H new ATOM 0 HG1 THR A 40 -8.117 3.773 8.474 1.00 10.00 H new ATOM 0 HG21 THR A 40 -7.437 3.837 5.126 1.00 10.00 H new ATOM 0 HG22 THR A 40 -6.817 2.176 4.967 1.00 10.00 H new ATOM 0 HG23 THR A 40 -8.561 2.458 5.177 1.00 10.00 H new ATOM 624 N GLY A 41 -6.312 1.613 9.513 1.00 10.00 N ATOM 625 CA GLY A 41 -5.923 1.592 10.911 1.00 10.00 C ATOM 626 C GLY A 41 -6.186 0.255 11.592 1.00 10.00 C ATOM 627 O GLY A 41 -6.603 0.237 12.747 1.00 10.00 O ATOM 0 H GLY A 41 -5.574 1.988 8.917 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -4.862 1.828 10.989 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.464 2.375 11.443 1.00 10.00 H new ATOM 631 N GLN A 42 -5.952 -0.848 10.876 1.00 10.00 N ATOM 632 CA GLN A 42 -6.241 -2.203 11.326 1.00 10.00 C ATOM 633 C GLN A 42 -5.125 -3.126 10.839 1.00 10.00 C ATOM 634 O GLN A 42 -5.361 -4.047 10.057 1.00 10.00 O ATOM 635 CB GLN A 42 -7.620 -2.635 10.796 1.00 10.00 C ATOM 636 CG GLN A 42 -8.789 -1.973 11.538 1.00 10.00 C ATOM 637 CD GLN A 42 -8.967 -2.567 12.933 1.00 10.00 C ATOM 638 OE1 GLN A 42 -8.338 -2.144 13.893 1.00 10.00 O ATOM 639 NE2 GLN A 42 -9.829 -3.573 13.063 1.00 10.00 N ATOM 0 H GLN A 42 -5.545 -0.817 9.941 1.00 10.00 H new ATOM 0 HA GLN A 42 -6.278 -2.254 12.414 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -7.687 -2.391 9.736 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.711 -3.718 10.881 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.612 -0.900 11.617 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -9.707 -2.103 10.965 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -10.344 -3.912 12.250 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -9.974 -4.005 13.975 1.00 10.00 H new ATOM 648 N ALA A 43 -3.902 -2.862 11.302 1.00 10.00 N ATOM 649 CA ALA A 43 -2.745 -3.683 10.978 1.00 10.00 C ATOM 650 C ALA A 43 -2.867 -5.055 11.656 1.00 10.00 C ATOM 651 O ALA A 43 -3.441 -5.139 12.740 1.00 10.00 O ATOM 652 CB ALA A 43 -1.458 -2.967 11.403 1.00 10.00 C ATOM 0 H ALA A 43 -3.691 -2.072 11.912 1.00 10.00 H new ATOM 0 HA ALA A 43 -2.705 -3.841 9.900 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -0.597 -3.589 11.157 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -1.380 -2.015 10.877 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -1.480 -2.787 12.478 1.00 10.00 H new ATOM 658 N PRO A 44 -2.336 -6.131 11.049 1.00 10.00 N ATOM 659 CA PRO A 44 -2.439 -7.468 11.610 1.00 10.00 C ATOM 660 C PRO A 44 -1.494 -7.655 12.796 1.00 10.00 C ATOM 661 O PRO A 44 -1.932 -7.991 13.893 1.00 10.00 O ATOM 662 CB PRO A 44 -2.140 -8.426 10.452 1.00 10.00 C ATOM 663 CG PRO A 44 -1.298 -7.603 9.472 1.00 10.00 C ATOM 664 CD PRO A 44 -1.729 -6.155 9.727 1.00 10.00 C ATOM 0 HA PRO A 44 -3.430 -7.661 12.020 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -1.598 -9.307 10.797 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -3.059 -8.780 9.984 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -0.232 -7.738 9.653 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -1.487 -7.898 8.440 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -0.873 -5.482 9.681 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -2.438 -5.822 8.969 1.00 10.00 H new ATOM 672 N GLY A 45 -0.194 -7.453 12.573 1.00 10.00 N ATOM 673 CA GLY A 45 0.829 -7.568 13.600 1.00 10.00 C ATOM 674 C GLY A 45 1.885 -6.505 13.349 1.00 10.00 C ATOM 675 O GLY A 45 3.050 -6.804 13.102 1.00 10.00 O ATOM 0 H GLY A 45 0.178 -7.201 11.657 1.00 10.00 H new ATOM 0 HA2 GLY A 45 0.389 -7.439 14.589 1.00 10.00 H new ATOM 0 HA3 GLY A 45 1.278 -8.561 13.578 1.00 10.00 H new ATOM 679 N PHE A 46 1.443 -5.251 13.390 1.00 10.00 N ATOM 680 CA PHE A 46 2.283 -4.069 13.307 1.00 10.00 C ATOM 681 C PHE A 46 1.641 -3.045 14.247 1.00 10.00 C ATOM 682 O PHE A 46 0.434 -3.119 14.482 1.00 10.00 O ATOM 683 CB PHE A 46 2.352 -3.602 11.842 1.00 10.00 C ATOM 684 CG PHE A 46 2.812 -2.175 11.596 1.00 10.00 C ATOM 685 CD1 PHE A 46 4.179 -1.839 11.639 1.00 10.00 C ATOM 686 CD2 PHE A 46 1.870 -1.183 11.263 1.00 10.00 C ATOM 687 CE1 PHE A 46 4.586 -0.512 11.406 1.00 10.00 C ATOM 688 CE2 PHE A 46 2.272 0.148 11.071 1.00 10.00 C ATOM 689 CZ PHE A 46 3.630 0.488 11.155 1.00 10.00 C ATOM 0 H PHE A 46 0.453 -5.026 13.486 1.00 10.00 H new ATOM 0 HA PHE A 46 3.316 -4.241 13.611 1.00 10.00 H new ATOM 0 HB2 PHE A 46 3.022 -4.272 11.304 1.00 10.00 H new ATOM 0 HB3 PHE A 46 1.362 -3.720 11.401 1.00 10.00 H new ATOM 0 HD1 PHE A 46 4.915 -2.600 11.851 1.00 10.00 H new ATOM 0 HD2 PHE A 46 0.829 -1.449 11.154 1.00 10.00 H new ATOM 0 HE1 PHE A 46 5.636 -0.261 11.420 1.00 10.00 H new ATOM 0 HE2 PHE A 46 1.536 0.910 10.859 1.00 10.00 H new ATOM 0 HZ PHE A 46 3.940 1.515 11.027 1.00 10.00 H new ATOM 699 N THR A 47 2.440 -2.148 14.832 1.00 10.00 N ATOM 700 CA THR A 47 1.930 -1.123 15.737 1.00 10.00 C ATOM 701 C THR A 47 1.002 -0.159 14.989 1.00 10.00 C ATOM 702 O THR A 47 0.864 -0.227 13.773 1.00 10.00 O ATOM 703 CB THR A 47 3.095 -0.409 16.441 1.00 10.00 C ATOM 704 OG1 THR A 47 2.597 0.398 17.491 1.00 10.00 O ATOM 705 CG2 THR A 47 3.926 0.453 15.483 1.00 10.00 C ATOM 0 H THR A 47 3.450 -2.114 14.691 1.00 10.00 H new ATOM 0 HA THR A 47 1.328 -1.592 16.516 1.00 10.00 H new ATOM 0 HB THR A 47 3.753 -1.183 16.836 1.00 10.00 H new ATOM 0 HG1 THR A 47 3.343 0.850 17.938 1.00 10.00 H new ATOM 0 HG21 THR A 47 4.734 0.933 16.034 1.00 10.00 H new ATOM 0 HG22 THR A 47 4.346 -0.176 14.698 1.00 10.00 H new ATOM 0 HG23 THR A 47 3.289 1.216 15.035 1.00 10.00 H new ATOM 713 N TYR A 48 0.353 0.747 15.713 1.00 10.00 N ATOM 714 CA TYR A 48 -0.538 1.725 15.105 1.00 10.00 C ATOM 715 C TYR A 48 0.266 2.981 14.763 1.00 10.00 C ATOM 716 O TYR A 48 1.402 3.154 15.204 1.00 10.00 O ATOM 717 CB TYR A 48 -1.729 1.996 16.040 1.00 10.00 C ATOM 718 CG TYR A 48 -2.725 0.847 16.154 1.00 10.00 C ATOM 719 CD1 TYR A 48 -2.363 -0.356 16.793 1.00 10.00 C ATOM 720 CD2 TYR A 48 -4.035 0.994 15.653 1.00 10.00 C ATOM 721 CE1 TYR A 48 -3.298 -1.397 16.933 1.00 10.00 C ATOM 722 CE2 TYR A 48 -4.978 -0.036 15.822 1.00 10.00 C ATOM 723 CZ TYR A 48 -4.612 -1.229 16.465 1.00 10.00 C ATOM 724 OH TYR A 48 -5.543 -2.202 16.673 1.00 10.00 O ATOM 0 H TYR A 48 0.429 0.823 16.727 1.00 10.00 H new ATOM 0 HA TYR A 48 -0.960 1.347 14.174 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -1.347 2.228 17.034 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -2.256 2.882 15.687 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -1.361 -0.479 17.178 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -4.315 1.901 15.138 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -3.006 -2.326 17.400 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -5.986 0.091 15.456 1.00 10.00 H new ATOM 0 HH TYR A 48 -6.399 -1.924 16.286 1.00 10.00 H new ATOM 734 N THR A 49 -0.295 3.851 13.925 1.00 10.00 N ATOM 735 CA THR A 49 0.357 5.077 13.495 1.00 10.00 C ATOM 736 C THR A 49 -0.721 6.131 13.261 1.00 10.00 C ATOM 737 O THR A 49 -1.729 5.840 12.607 1.00 10.00 O ATOM 738 CB THR A 49 1.183 4.797 12.230 1.00 10.00 C ATOM 739 OG1 THR A 49 2.198 3.856 12.524 1.00 10.00 O ATOM 740 CG2 THR A 49 1.851 6.057 11.670 1.00 10.00 C ATOM 0 H THR A 49 -1.224 3.719 13.524 1.00 10.00 H new ATOM 0 HA THR A 49 1.045 5.450 14.254 1.00 10.00 H new ATOM 0 HB THR A 49 0.490 4.415 11.481 1.00 10.00 H new ATOM 0 HG1 THR A 49 2.723 3.677 11.716 1.00 10.00 H new ATOM 0 HG21 THR A 49 2.421 5.800 10.777 1.00 10.00 H new ATOM 0 HG22 THR A 49 1.087 6.791 11.414 1.00 10.00 H new ATOM 0 HG23 THR A 49 2.521 6.477 12.420 1.00 10.00 H new ATOM 748 N ASP A 50 -0.490 7.338 13.792 1.00 10.00 N ATOM 749 CA ASP A 50 -1.354 8.515 13.743 1.00 10.00 C ATOM 750 C ASP A 50 -1.463 9.057 12.320 1.00 10.00 C ATOM 751 O ASP A 50 -1.053 10.174 12.015 1.00 10.00 O ATOM 752 CB ASP A 50 -0.806 9.582 14.700 1.00 10.00 C ATOM 753 CG ASP A 50 -1.108 9.230 16.145 1.00 10.00 C ATOM 754 OD1 ASP A 50 -0.434 8.302 16.642 1.00 10.00 O ATOM 755 OD2 ASP A 50 -2.023 9.870 16.705 1.00 10.00 O ATOM 0 H ASP A 50 0.371 7.527 14.305 1.00 10.00 H new ATOM 0 HA ASP A 50 -2.359 8.235 14.058 1.00 10.00 H new ATOM 0 HB2 ASP A 50 0.271 9.678 14.564 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -1.245 10.550 14.459 1.00 10.00 H new ATOM 760 N ALA A 51 -2.030 8.237 11.440 1.00 10.00 N ATOM 761 CA ALA A 51 -2.160 8.499 10.024 1.00 10.00 C ATOM 762 C ALA A 51 -3.020 7.402 9.412 1.00 10.00 C ATOM 763 O ALA A 51 -3.965 7.668 8.671 1.00 10.00 O ATOM 764 CB ALA A 51 -0.776 8.554 9.361 1.00 10.00 C ATOM 0 H ALA A 51 -2.425 7.337 11.713 1.00 10.00 H new ATOM 0 HA ALA A 51 -2.636 9.466 9.861 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -0.891 8.752 8.295 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -0.186 9.349 9.816 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -0.268 7.600 9.500 1.00 10.00 H new ATOM 770 N ASN A 52 -2.707 6.143 9.727 1.00 10.00 N ATOM 771 CA ASN A 52 -3.424 5.037 9.121 1.00 10.00 C ATOM 772 C ASN A 52 -4.877 5.039 9.590 1.00 10.00 C ATOM 773 O ASN A 52 -5.796 5.065 8.775 1.00 10.00 O ATOM 774 CB ASN A 52 -2.713 3.707 9.374 1.00 10.00 C ATOM 775 CG ASN A 52 -3.027 2.772 8.214 1.00 10.00 C ATOM 776 OD1 ASN A 52 -3.964 1.988 8.254 1.00 10.00 O ATOM 777 ND2 ASN A 52 -2.321 2.929 7.103 1.00 10.00 N ATOM 0 H ASN A 52 -1.976 5.875 10.386 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.433 5.166 8.039 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -1.637 3.861 9.458 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -3.047 3.270 10.315 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -2.557 2.392 6.268 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -1.541 3.587 7.083 1.00 10.00 H new ATOM 784 N LYS A 53 -5.060 5.093 10.911 1.00 10.00 N ATOM 785 CA LYS A 53 -6.372 5.225 11.554 1.00 10.00 C ATOM 786 C LYS A 53 -7.030 6.541 11.155 1.00 10.00 C ATOM 787 O LYS A 53 -8.237 6.591 10.931 1.00 10.00 O ATOM 788 CB LYS A 53 -6.252 5.135 13.090 1.00 10.00 C ATOM 789 CG LYS A 53 -7.280 4.183 13.731 1.00 10.00 C ATOM 790 CD LYS A 53 -8.747 4.641 13.663 1.00 10.00 C ATOM 791 CE LYS A 53 -9.082 5.714 14.716 1.00 10.00 C ATOM 792 NZ LYS A 53 -10.287 5.363 15.501 1.00 10.00 N ATOM 0 H LYS A 53 -4.288 5.046 11.576 1.00 10.00 H new ATOM 0 HA LYS A 53 -6.996 4.399 11.213 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -5.248 4.800 13.349 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.376 6.131 13.515 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.199 3.211 13.245 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.012 4.040 14.778 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -8.955 5.036 12.669 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -9.400 3.780 13.807 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -8.234 5.838 15.389 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -9.239 6.672 14.220 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -10.477 6.111 16.198 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -11.102 5.269 14.862 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -10.129 4.462 15.995 1.00 10.00 H new ATOM 806 N ASN A 54 -6.227 7.605 11.074 1.00 10.00 N ATOM 807 CA ASN A 54 -6.703 8.936 10.728 1.00 10.00 C ATOM 808 C ASN A 54 -7.457 8.937 9.397 1.00 10.00 C ATOM 809 O ASN A 54 -8.313 9.785 9.172 1.00 10.00 O ATOM 810 CB ASN A 54 -5.524 9.916 10.683 1.00 10.00 C ATOM 811 CG ASN A 54 -5.980 11.330 11.013 1.00 10.00 C ATOM 812 OD1 ASN A 54 -6.060 12.192 10.146 1.00 10.00 O ATOM 813 ND2 ASN A 54 -6.266 11.574 12.290 1.00 10.00 N ATOM 0 H ASN A 54 -5.223 7.561 11.249 1.00 10.00 H new ATOM 0 HA ASN A 54 -7.405 9.256 11.498 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.758 9.602 11.392 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -5.069 9.898 9.693 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -6.564 12.506 12.577 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -6.187 10.829 12.982 1.00 10.00 H new ATOM 820 N LYS A 55 -7.134 7.982 8.517 1.00 10.00 N ATOM 821 CA LYS A 55 -7.759 7.859 7.215 1.00 10.00 C ATOM 822 C LYS A 55 -9.214 7.405 7.352 1.00 10.00 C ATOM 823 O LYS A 55 -10.123 8.072 6.870 1.00 10.00 O ATOM 824 CB LYS A 55 -6.918 6.894 6.379 1.00 10.00 C ATOM 825 CG LYS A 55 -6.910 7.329 4.915 1.00 10.00 C ATOM 826 CD LYS A 55 -6.094 6.355 4.062 1.00 10.00 C ATOM 827 CE LYS A 55 -4.574 6.469 4.244 1.00 10.00 C ATOM 828 NZ LYS A 55 -4.025 5.728 5.402 1.00 10.00 N ATOM 0 H LYS A 55 -6.425 7.272 8.700 1.00 10.00 H new ATOM 0 HA LYS A 55 -7.794 8.824 6.710 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -5.898 6.864 6.762 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -7.320 5.884 6.463 1.00 10.00 H new ATOM 0 HG2 LYS A 55 -7.932 7.379 4.540 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -6.491 8.332 4.831 1.00 10.00 H new ATOM 0 HD2 LYS A 55 -6.401 5.337 4.302 1.00 10.00 H new ATOM 0 HD3 LYS A 55 -6.335 6.521 3.012 1.00 10.00 H new ATOM 0 HE2 LYS A 55 -4.087 6.109 3.338 1.00 10.00 H new ATOM 0 HE3 LYS A 55 -4.314 7.522 4.349 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 -3.071 5.383 5.173 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 -3.976 6.360 6.227 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 -4.642 4.920 5.621 1.00 10.00 H new ATOM 842 N GLY A 56 -9.431 6.254 7.994 1.00 10.00 N ATOM 843 CA GLY A 56 -10.762 5.730 8.256 1.00 10.00 C ATOM 844 C GLY A 56 -11.518 5.375 6.973 1.00 10.00 C ATOM 845 O GLY A 56 -12.723 5.595 6.886 1.00 10.00 O ATOM 0 H GLY A 56 -8.680 5.661 8.346 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -10.682 4.842 8.884 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -11.335 6.467 8.818 1.00 10.00 H new ATOM 849 N ILE A 57 -10.817 4.796 5.993 1.00 10.00 N ATOM 850 CA ILE A 57 -11.379 4.388 4.705 1.00 10.00 C ATOM 851 C ILE A 57 -11.120 2.904 4.454 1.00 10.00 C ATOM 852 O ILE A 57 -10.619 2.208 5.340 1.00 10.00 O ATOM 853 CB ILE A 57 -10.869 5.317 3.580 1.00 10.00 C ATOM 854 CG1 ILE A 57 -9.343 5.388 3.448 1.00 10.00 C ATOM 855 CG2 ILE A 57 -11.448 6.720 3.790 1.00 10.00 C ATOM 856 CD1 ILE A 57 -8.737 4.252 2.615 1.00 10.00 C ATOM 0 H ILE A 57 -9.821 4.594 6.077 1.00 10.00 H new ATOM 0 HA ILE A 57 -12.463 4.501 4.720 1.00 10.00 H new ATOM 0 HB ILE A 57 -11.215 4.882 2.642 1.00 10.00 H new ATOM 0 HG12 ILE A 57 -9.071 6.342 2.995 1.00 10.00 H new ATOM 0 HG13 ILE A 57 -8.901 5.370 4.444 1.00 10.00 H new ATOM 0 HG21 ILE A 57 -11.093 7.382 3.000 1.00 10.00 H new ATOM 0 HG22 ILE A 57 -12.537 6.672 3.762 1.00 10.00 H new ATOM 0 HG23 ILE A 57 -11.127 7.105 4.758 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -7.655 4.372 2.568 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -8.976 3.294 3.077 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -9.149 4.281 1.606 1.00 10.00 H new ATOM 868 N THR A 58 -11.483 2.422 3.260 1.00 10.00 N ATOM 869 CA THR A 58 -11.265 1.055 2.813 1.00 10.00 C ATOM 870 C THR A 58 -10.266 1.033 1.665 1.00 10.00 C ATOM 871 O THR A 58 -10.081 2.031 0.969 1.00 10.00 O ATOM 872 CB THR A 58 -12.592 0.394 2.420 1.00 10.00 C ATOM 873 OG1 THR A 58 -12.413 -1.005 2.324 1.00 10.00 O ATOM 874 CG2 THR A 58 -13.116 0.926 1.085 1.00 10.00 C ATOM 0 H THR A 58 -11.952 2.997 2.560 1.00 10.00 H new ATOM 0 HA THR A 58 -10.845 0.477 3.636 1.00 10.00 H new ATOM 0 HB THR A 58 -13.324 0.632 3.192 1.00 10.00 H new ATOM 0 HG1 THR A 58 -13.262 -1.427 2.075 1.00 10.00 H new ATOM 0 HG21 THR A 58 -14.057 0.433 0.841 1.00 10.00 H new ATOM 0 HG22 THR A 58 -13.278 2.001 1.160 1.00 10.00 H new ATOM 0 HG23 THR A 58 -12.387 0.723 0.301 1.00 10.00 H new ATOM 882 N TRP A 59 -9.657 -0.128 1.455 1.00 10.00 N ATOM 883 CA TRP A 59 -8.705 -0.357 0.392 1.00 10.00 C ATOM 884 C TRP A 59 -9.366 -1.211 -0.680 1.00 10.00 C ATOM 885 O TRP A 59 -9.884 -2.287 -0.378 1.00 10.00 O ATOM 886 CB TRP A 59 -7.494 -1.047 0.995 1.00 10.00 C ATOM 887 CG TRP A 59 -6.838 -0.271 2.091 1.00 10.00 C ATOM 888 CD1 TRP A 59 -6.844 -0.587 3.405 1.00 10.00 C ATOM 889 CD2 TRP A 59 -6.068 0.959 1.973 1.00 10.00 C ATOM 890 NE1 TRP A 59 -6.009 0.283 4.080 1.00 10.00 N ATOM 891 CE2 TRP A 59 -5.531 1.279 3.251 1.00 10.00 C ATOM 892 CE3 TRP A 59 -5.772 1.836 0.908 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -4.714 2.402 3.457 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -4.961 2.966 1.102 1.00 10.00 C ATOM 895 CH2 TRP A 59 -4.427 3.242 2.370 1.00 10.00 C ATOM 0 H TRP A 59 -9.820 -0.950 2.036 1.00 10.00 H new ATOM 0 HA TRP A 59 -8.384 0.575 -0.073 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -7.798 -2.019 1.383 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -6.764 -1.232 0.207 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -7.410 -1.390 3.855 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -5.774 0.200 5.069 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -6.176 1.635 -0.073 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -4.313 2.616 4.437 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 -4.748 3.624 0.273 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -3.792 4.105 2.510 1.00 10.00 H new ATOM 906 N LYS A 60 -9.381 -0.720 -1.923 1.00 10.00 N ATOM 907 CA LYS A 60 -9.980 -1.415 -3.056 1.00 10.00 C ATOM 908 C LYS A 60 -9.159 -1.149 -4.310 1.00 10.00 C ATOM 909 O LYS A 60 -8.538 -2.054 -4.856 1.00 10.00 O ATOM 910 CB LYS A 60 -11.428 -0.941 -3.248 1.00 10.00 C ATOM 911 CG LYS A 60 -12.383 -1.436 -2.158 1.00 10.00 C ATOM 912 CD LYS A 60 -12.643 -2.945 -2.283 1.00 10.00 C ATOM 913 CE LYS A 60 -13.594 -3.423 -1.179 1.00 10.00 C ATOM 914 NZ LYS A 60 -14.258 -4.692 -1.543 1.00 10.00 N ATOM 0 H LYS A 60 -8.972 0.181 -2.169 1.00 10.00 H new ATOM 0 HA LYS A 60 -9.988 -2.488 -2.864 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -11.446 0.149 -3.268 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -11.788 -1.283 -4.218 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -11.962 -1.218 -1.177 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -13.327 -0.896 -2.227 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -13.072 -3.166 -3.260 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -11.700 -3.488 -2.219 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -13.037 -3.556 -0.251 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -14.348 -2.658 -0.991 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -14.893 -4.985 -0.773 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -14.809 -4.558 -2.415 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -13.540 -5.428 -1.698 1.00 10.00 H new ATOM 928 N GLU A 61 -9.147 0.110 -4.736 1.00 10.00 N ATOM 929 CA GLU A 61 -8.344 0.589 -5.844 1.00 10.00 C ATOM 930 C GLU A 61 -8.447 2.105 -5.892 1.00 10.00 C ATOM 931 O GLU A 61 -7.430 2.759 -6.016 1.00 10.00 O ATOM 932 CB GLU A 61 -8.719 -0.072 -7.180 1.00 10.00 C ATOM 933 CG GLU A 61 -10.178 0.153 -7.599 1.00 10.00 C ATOM 934 CD GLU A 61 -10.562 -0.820 -8.706 1.00 10.00 C ATOM 935 OE1 GLU A 61 -10.779 -2.003 -8.366 1.00 10.00 O ATOM 936 OE2 GLU A 61 -10.596 -0.371 -9.870 1.00 10.00 O ATOM 0 H GLU A 61 -9.713 0.841 -4.305 1.00 10.00 H new ATOM 0 HA GLU A 61 -7.305 0.305 -5.680 1.00 10.00 H new ATOM 0 HB2 GLU A 61 -8.064 0.314 -7.961 1.00 10.00 H new ATOM 0 HB3 GLU A 61 -8.533 -1.144 -7.108 1.00 10.00 H new ATOM 0 HG2 GLU A 61 -10.836 0.017 -6.741 1.00 10.00 H new ATOM 0 HG3 GLU A 61 -10.311 1.179 -7.943 1.00 10.00 H new ATOM 943 N GLU A 62 -9.648 2.665 -5.744 1.00 10.00 N ATOM 944 CA GLU A 62 -9.910 4.091 -5.932 1.00 10.00 C ATOM 945 C GLU A 62 -9.075 4.964 -4.979 1.00 10.00 C ATOM 946 O GLU A 62 -8.210 5.712 -5.427 1.00 10.00 O ATOM 947 CB GLU A 62 -11.432 4.300 -5.797 1.00 10.00 C ATOM 948 CG GLU A 62 -11.987 5.414 -6.690 1.00 10.00 C ATOM 949 CD GLU A 62 -11.588 6.803 -6.217 1.00 10.00 C ATOM 950 OE1 GLU A 62 -11.624 7.005 -4.984 1.00 10.00 O ATOM 951 OE2 GLU A 62 -11.270 7.628 -7.098 1.00 10.00 O ATOM 0 H GLU A 62 -10.478 2.132 -5.486 1.00 10.00 H new ATOM 0 HA GLU A 62 -9.595 4.415 -6.924 1.00 10.00 H new ATOM 0 HB2 GLU A 62 -11.940 3.367 -6.039 1.00 10.00 H new ATOM 0 HB3 GLU A 62 -11.667 4.530 -4.758 1.00 10.00 H new ATOM 0 HG2 GLU A 62 -11.632 5.267 -7.710 1.00 10.00 H new ATOM 0 HG3 GLU A 62 -13.074 5.343 -6.718 1.00 10.00 H new ATOM 958 N THR A 63 -9.251 4.835 -3.659 1.00 10.00 N ATOM 959 CA THR A 63 -8.419 5.596 -2.730 1.00 10.00 C ATOM 960 C THR A 63 -6.949 5.230 -2.938 1.00 10.00 C ATOM 961 O THR A 63 -6.073 6.094 -2.977 1.00 10.00 O ATOM 962 CB THR A 63 -8.874 5.356 -1.281 1.00 10.00 C ATOM 963 OG1 THR A 63 -10.091 6.041 -1.074 1.00 10.00 O ATOM 964 CG2 THR A 63 -7.829 5.855 -0.277 1.00 10.00 C ATOM 0 H THR A 63 -9.944 4.227 -3.222 1.00 10.00 H new ATOM 0 HA THR A 63 -8.531 6.662 -2.928 1.00 10.00 H new ATOM 0 HB THR A 63 -9.002 4.285 -1.125 1.00 10.00 H new ATOM 0 HG1 THR A 63 -10.396 5.896 -0.154 1.00 10.00 H new ATOM 0 HG21 THR A 63 -8.182 5.670 0.738 1.00 10.00 H new ATOM 0 HG22 THR A 63 -6.889 5.326 -0.436 1.00 10.00 H new ATOM 0 HG23 THR A 63 -7.671 6.924 -0.417 1.00 10.00 H new ATOM 972 N LEU A 64 -6.682 3.930 -3.060 1.00 10.00 N ATOM 973 CA LEU A 64 -5.343 3.391 -3.184 1.00 10.00 C ATOM 974 C LEU A 64 -4.591 4.034 -4.355 1.00 10.00 C ATOM 975 O LEU A 64 -3.433 4.412 -4.210 1.00 10.00 O ATOM 976 CB LEU A 64 -5.444 1.862 -3.281 1.00 10.00 C ATOM 977 CG LEU A 64 -4.373 1.164 -2.457 1.00 10.00 C ATOM 978 CD1 LEU A 64 -4.729 -0.311 -2.300 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.995 1.331 -3.091 1.00 10.00 C ATOM 0 H LEU A 64 -7.409 3.215 -3.075 1.00 10.00 H new ATOM 0 HA LEU A 64 -4.749 3.634 -2.303 1.00 10.00 H new ATOM 0 HB2 LEU A 64 -6.429 1.542 -2.940 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -5.353 1.559 -4.324 1.00 10.00 H new ATOM 0 HG LEU A 64 -4.333 1.625 -1.470 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.961 -0.810 -1.709 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -5.691 -0.401 -1.795 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -4.790 -0.777 -3.283 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.249 0.822 -2.480 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -3.000 0.900 -4.092 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.750 2.391 -3.154 1.00 10.00 H new ATOM 991 N MET A 65 -5.259 4.200 -5.497 1.00 10.00 N ATOM 992 CA MET A 65 -4.729 4.809 -6.698 1.00 10.00 C ATOM 993 C MET A 65 -4.083 6.151 -6.355 1.00 10.00 C ATOM 994 O MET A 65 -2.940 6.409 -6.737 1.00 10.00 O ATOM 995 CB MET A 65 -5.847 4.982 -7.750 1.00 10.00 C ATOM 996 CG MET A 65 -6.101 3.794 -8.690 1.00 10.00 C ATOM 997 SD MET A 65 -6.551 4.301 -10.374 1.00 10.00 S ATOM 998 CE MET A 65 -7.333 2.804 -11.010 1.00 10.00 C ATOM 0 H MET A 65 -6.227 3.897 -5.606 1.00 10.00 H new ATOM 0 HA MET A 65 -3.966 4.158 -7.125 1.00 10.00 H new ATOM 0 HB2 MET A 65 -6.776 5.205 -7.225 1.00 10.00 H new ATOM 0 HB3 MET A 65 -5.608 5.853 -8.360 1.00 10.00 H new ATOM 0 HG2 MET A 65 -5.206 3.173 -8.731 1.00 10.00 H new ATOM 0 HG3 MET A 65 -6.899 3.176 -8.278 1.00 10.00 H new ATOM 0 HE1 MET A 65 -7.659 2.972 -12.037 1.00 10.00 H new ATOM 0 HE2 MET A 65 -6.618 1.982 -10.986 1.00 10.00 H new ATOM 0 HE3 MET A 65 -8.195 2.553 -10.392 1.00 10.00 H new ATOM 1008 N GLU A 66 -4.798 6.992 -5.606 1.00 10.00 N ATOM 1009 CA GLU A 66 -4.251 8.273 -5.211 1.00 10.00 C ATOM 1010 C GLU A 66 -3.187 8.041 -4.151 1.00 10.00 C ATOM 1011 O GLU A 66 -2.095 8.579 -4.255 1.00 10.00 O ATOM 1012 CB GLU A 66 -5.350 9.212 -4.710 1.00 10.00 C ATOM 1013 CG GLU A 66 -5.929 10.096 -5.829 1.00 10.00 C ATOM 1014 CD GLU A 66 -5.812 11.574 -5.471 1.00 10.00 C ATOM 1015 OE1 GLU A 66 -4.655 12.013 -5.280 1.00 10.00 O ATOM 1016 OE2 GLU A 66 -6.864 12.238 -5.372 1.00 10.00 O ATOM 0 H GLU A 66 -5.743 6.806 -5.269 1.00 10.00 H new ATOM 0 HA GLU A 66 -3.796 8.759 -6.074 1.00 10.00 H new ATOM 0 HB2 GLU A 66 -6.152 8.622 -4.266 1.00 10.00 H new ATOM 0 HB3 GLU A 66 -4.948 9.848 -3.921 1.00 10.00 H new ATOM 0 HG2 GLU A 66 -5.401 9.901 -6.762 1.00 10.00 H new ATOM 0 HG3 GLU A 66 -6.975 9.840 -5.996 1.00 10.00 H new ATOM 1023 N TYR A 67 -3.474 7.224 -3.141 1.00 10.00 N ATOM 1024 CA TYR A 67 -2.533 6.956 -2.066 1.00 10.00 C ATOM 1025 C TYR A 67 -1.126 6.652 -2.593 1.00 10.00 C ATOM 1026 O TYR A 67 -0.144 7.209 -2.103 1.00 10.00 O ATOM 1027 CB TYR A 67 -3.066 5.809 -1.207 1.00 10.00 C ATOM 1028 CG TYR A 67 -2.388 5.697 0.145 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.424 6.787 1.032 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -1.709 4.520 0.519 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -1.866 6.668 2.313 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -1.212 4.382 1.829 1.00 10.00 C ATOM 1033 CZ TYR A 67 -1.377 5.428 2.753 1.00 10.00 C ATOM 1034 OH TYR A 67 -1.331 5.167 4.095 1.00 10.00 O ATOM 0 H TYR A 67 -4.363 6.733 -3.048 1.00 10.00 H new ATOM 0 HA TYR A 67 -2.441 7.853 -1.454 1.00 10.00 H new ATOM 0 HB2 TYR A 67 -4.137 5.946 -1.057 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -2.937 4.871 -1.747 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -2.882 7.716 0.727 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -1.570 3.725 -0.198 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -1.812 7.530 2.961 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -0.705 3.475 2.123 1.00 10.00 H new ATOM 0 HH TYR A 67 -0.970 4.268 4.241 1.00 10.00 H new ATOM 1044 N LEU A 68 -1.029 5.790 -3.609 1.00 10.00 N ATOM 1045 CA LEU A 68 0.246 5.492 -4.247 1.00 10.00 C ATOM 1046 C LEU A 68 0.773 6.693 -5.029 1.00 10.00 C ATOM 1047 O LEU A 68 1.953 7.012 -4.907 1.00 10.00 O ATOM 1048 CB LEU A 68 0.155 4.265 -5.160 1.00 10.00 C ATOM 1049 CG LEU A 68 -0.394 3.014 -4.470 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -0.256 1.803 -5.394 1.00 10.00 C ATOM 1051 CD2 LEU A 68 0.247 2.743 -3.104 1.00 10.00 C ATOM 0 H LEU A 68 -1.824 5.287 -4.005 1.00 10.00 H new ATOM 0 HA LEU A 68 0.950 5.265 -3.447 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.480 4.506 -6.012 1.00 10.00 H new ATOM 0 HB3 LEU A 68 1.147 4.044 -5.554 1.00 10.00 H new ATOM 0 HG LEU A 68 -1.450 3.198 -4.270 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -0.649 0.918 -4.895 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -0.816 1.980 -6.312 1.00 10.00 H new ATOM 0 HD13 LEU A 68 0.796 1.647 -5.635 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -0.188 1.842 -2.670 1.00 10.00 H new ATOM 0 HD22 LEU A 68 1.321 2.604 -3.227 1.00 10.00 H new ATOM 0 HD23 LEU A 68 0.064 3.589 -2.442 1.00 10.00 H new ATOM 1063 N GLU A 69 -0.068 7.351 -5.839 1.00 10.00 N ATOM 1064 CA GLU A 69 0.360 8.499 -6.639 1.00 10.00 C ATOM 1065 C GLU A 69 0.295 9.837 -5.883 1.00 10.00 C ATOM 1066 O GLU A 69 0.292 10.897 -6.503 1.00 10.00 O ATOM 1067 CB GLU A 69 -0.356 8.525 -8.009 1.00 10.00 C ATOM 1068 CG GLU A 69 0.647 8.397 -9.176 1.00 10.00 C ATOM 1069 CD GLU A 69 0.182 9.108 -10.435 1.00 10.00 C ATOM 1070 OE1 GLU A 69 0.039 10.345 -10.390 1.00 10.00 O ATOM 1071 OE2 GLU A 69 -0.059 8.376 -11.421 1.00 10.00 O ATOM 0 H GLU A 69 -1.051 7.104 -5.955 1.00 10.00 H new ATOM 0 HA GLU A 69 1.422 8.363 -6.841 1.00 10.00 H new ATOM 0 HB2 GLU A 69 -1.079 7.710 -8.058 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.916 9.455 -8.110 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.609 8.806 -8.868 1.00 10.00 H new ATOM 0 HG3 GLU A 69 0.806 7.342 -9.398 1.00 10.00 H new ATOM 1078 N ASN A 70 0.263 9.815 -4.548 1.00 10.00 N ATOM 1079 CA ASN A 70 0.043 11.005 -3.733 1.00 10.00 C ATOM 1080 C ASN A 70 0.141 10.644 -2.242 1.00 10.00 C ATOM 1081 O ASN A 70 -0.786 10.889 -1.468 1.00 10.00 O ATOM 1082 CB ASN A 70 -1.325 11.630 -4.111 1.00 10.00 C ATOM 1083 CG ASN A 70 -1.235 12.922 -4.916 1.00 10.00 C ATOM 1084 OD1 ASN A 70 -0.244 13.649 -4.869 1.00 10.00 O ATOM 1085 ND2 ASN A 70 -2.308 13.261 -5.622 1.00 10.00 N ATOM 0 H ASN A 70 0.390 8.963 -4.002 1.00 10.00 H new ATOM 0 HA ASN A 70 0.813 11.752 -3.926 1.00 10.00 H new ATOM 0 HB2 ASN A 70 -1.897 10.900 -4.684 1.00 10.00 H new ATOM 0 HB3 ASN A 70 -1.885 11.826 -3.196 1.00 10.00 H new ATOM 0 HD21 ASN A 70 -2.321 14.140 -6.140 1.00 10.00 H new ATOM 0 HD22 ASN A 70 -3.119 12.642 -5.647 1.00 10.00 H new ATOM 1092 N PRO A 71 1.275 10.085 -1.783 1.00 10.00 N ATOM 1093 CA PRO A 71 1.386 9.653 -0.401 1.00 10.00 C ATOM 1094 C PRO A 71 1.399 10.844 0.559 1.00 10.00 C ATOM 1095 O PRO A 71 0.829 10.769 1.646 1.00 10.00 O ATOM 1096 CB PRO A 71 2.654 8.793 -0.335 1.00 10.00 C ATOM 1097 CG PRO A 71 3.512 9.296 -1.498 1.00 10.00 C ATOM 1098 CD PRO A 71 2.483 9.762 -2.532 1.00 10.00 C ATOM 0 HA PRO A 71 0.524 9.068 -0.082 1.00 10.00 H new ATOM 0 HB2 PRO A 71 3.167 8.913 0.619 1.00 10.00 H new ATOM 0 HB3 PRO A 71 2.422 7.733 -0.441 1.00 10.00 H new ATOM 0 HG2 PRO A 71 4.167 10.111 -1.189 1.00 10.00 H new ATOM 0 HG3 PRO A 71 4.150 8.507 -1.896 1.00 10.00 H new ATOM 0 HD2 PRO A 71 2.847 10.632 -3.079 1.00 10.00 H new ATOM 0 HD3 PRO A 71 2.289 8.981 -3.267 1.00 10.00 H new ATOM 1106 N LYS A 72 2.014 11.959 0.152 1.00 10.00 N ATOM 1107 CA LYS A 72 2.039 13.192 0.926 1.00 10.00 C ATOM 1108 C LYS A 72 0.908 14.127 0.499 1.00 10.00 C ATOM 1109 O LYS A 72 1.145 15.285 0.162 1.00 10.00 O ATOM 1110 CB LYS A 72 3.422 13.850 0.841 1.00 10.00 C ATOM 1111 CG LYS A 72 3.940 14.218 -0.565 1.00 10.00 C ATOM 1112 CD LYS A 72 4.557 13.028 -1.324 1.00 10.00 C ATOM 1113 CE LYS A 72 5.871 13.395 -2.034 1.00 10.00 C ATOM 1114 NZ LYS A 72 5.646 14.188 -3.258 1.00 10.00 N ATOM 0 H LYS A 72 2.513 12.026 -0.735 1.00 10.00 H new ATOM 0 HA LYS A 72 1.864 12.957 1.976 1.00 10.00 H new ATOM 0 HB2 LYS A 72 3.402 14.759 1.443 1.00 10.00 H new ATOM 0 HB3 LYS A 72 4.145 13.178 1.303 1.00 10.00 H new ATOM 0 HG2 LYS A 72 3.117 14.625 -1.152 1.00 10.00 H new ATOM 0 HG3 LYS A 72 4.687 15.007 -0.473 1.00 10.00 H new ATOM 0 HD2 LYS A 72 4.742 12.213 -0.625 1.00 10.00 H new ATOM 0 HD3 LYS A 72 3.841 12.661 -2.060 1.00 10.00 H new ATOM 0 HE2 LYS A 72 6.505 13.959 -1.350 1.00 10.00 H new ATOM 0 HE3 LYS A 72 6.410 12.483 -2.289 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 6.560 14.411 -3.700 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 5.063 13.641 -3.924 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 5.155 15.072 -3.014 1.00 10.00 H new ATOM 1128 N LYS A 73 -0.323 13.616 0.510 1.00 10.00 N ATOM 1129 CA LYS A 73 -1.502 14.399 0.167 1.00 10.00 C ATOM 1130 C LYS A 73 -2.642 14.038 1.115 1.00 10.00 C ATOM 1131 O LYS A 73 -3.192 14.908 1.782 1.00 10.00 O ATOM 1132 CB LYS A 73 -1.864 14.169 -1.309 1.00 10.00 C ATOM 1133 CG LYS A 73 -2.814 15.251 -1.851 1.00 10.00 C ATOM 1134 CD LYS A 73 -2.169 15.969 -3.045 1.00 10.00 C ATOM 1135 CE LYS A 73 -3.015 17.154 -3.533 1.00 10.00 C ATOM 1136 NZ LYS A 73 -2.167 18.272 -3.997 1.00 10.00 N ATOM 0 H LYS A 73 -0.527 12.648 0.757 1.00 10.00 H new ATOM 0 HA LYS A 73 -1.303 15.464 0.286 1.00 10.00 H new ATOM 0 HB2 LYS A 73 -0.953 14.156 -1.907 1.00 10.00 H new ATOM 0 HB3 LYS A 73 -2.331 13.190 -1.418 1.00 10.00 H new ATOM 0 HG2 LYS A 73 -3.758 14.798 -2.155 1.00 10.00 H new ATOM 0 HG3 LYS A 73 -3.045 15.970 -1.065 1.00 10.00 H new ATOM 0 HD2 LYS A 73 -1.178 16.324 -2.762 1.00 10.00 H new ATOM 0 HD3 LYS A 73 -2.032 15.261 -3.862 1.00 10.00 H new ATOM 0 HE2 LYS A 73 -3.665 16.828 -4.345 1.00 10.00 H new ATOM 0 HE3 LYS A 73 -3.662 17.498 -2.725 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 -2.771 19.055 -4.319 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 -1.565 18.599 -3.215 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 -1.568 17.950 -4.784 1.00 10.00 H new ATOM 1150 N TYR A 74 -2.975 12.747 1.185 1.00 10.00 N ATOM 1151 CA TYR A 74 -4.056 12.254 2.029 1.00 10.00 C ATOM 1152 C TYR A 74 -3.748 12.526 3.503 1.00 10.00 C ATOM 1153 O TYR A 74 -4.567 13.093 4.220 1.00 10.00 O ATOM 1154 CB TYR A 74 -4.272 10.753 1.775 1.00 10.00 C ATOM 1155 CG TYR A 74 -5.171 10.428 0.594 1.00 10.00 C ATOM 1156 CD1 TYR A 74 -4.963 11.035 -0.661 1.00 10.00 C ATOM 1157 CD2 TYR A 74 -6.297 9.601 0.782 1.00 10.00 C ATOM 1158 CE1 TYR A 74 -5.912 10.881 -1.684 1.00 10.00 C ATOM 1159 CE2 TYR A 74 -7.222 9.416 -0.259 1.00 10.00 C ATOM 1160 CZ TYR A 74 -7.024 10.046 -1.498 1.00 10.00 C ATOM 1161 OH TYR A 74 -7.909 9.859 -2.515 1.00 10.00 O ATOM 0 H TYR A 74 -2.499 12.016 0.656 1.00 10.00 H new ATOM 0 HA TYR A 74 -4.976 12.782 1.778 1.00 10.00 H new ATOM 0 HB2 TYR A 74 -3.302 10.283 1.615 1.00 10.00 H new ATOM 0 HB3 TYR A 74 -4.699 10.305 2.672 1.00 10.00 H new ATOM 0 HD1 TYR A 74 -4.072 11.620 -0.836 1.00 10.00 H new ATOM 0 HD2 TYR A 74 -6.449 9.107 1.730 1.00 10.00 H new ATOM 0 HE1 TYR A 74 -5.785 11.408 -2.618 1.00 10.00 H new ATOM 0 HE2 TYR A 74 -8.087 8.788 -0.106 1.00 10.00 H new ATOM 0 HH TYR A 74 -8.620 9.252 -2.222 1.00 10.00 H new ATOM 1171 N ILE A 75 -2.572 12.085 3.955 1.00 10.00 N ATOM 1172 CA ILE A 75 -2.144 12.157 5.347 1.00 10.00 C ATOM 1173 C ILE A 75 -0.683 12.621 5.387 1.00 10.00 C ATOM 1174 O ILE A 75 0.223 11.788 5.307 1.00 10.00 O ATOM 1175 CB ILE A 75 -2.358 10.800 6.053 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -2.180 9.608 5.092 1.00 10.00 C ATOM 1177 CG2 ILE A 75 -3.756 10.789 6.695 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -1.976 8.285 5.832 1.00 10.00 C ATOM 0 H ILE A 75 -1.876 11.658 3.344 1.00 10.00 H new ATOM 0 HA ILE A 75 -2.747 12.882 5.893 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.596 10.686 6.824 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -3.057 9.530 4.449 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.324 9.793 4.443 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.918 9.835 7.197 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -3.829 11.598 7.422 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -4.512 10.926 5.922 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.856 7.478 5.109 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -1.084 8.350 6.455 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -2.843 8.082 6.461 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.429 13.938 5.486 1.00 10.00 N ATOM 1191 CA PRO A 76 0.917 14.493 5.469 1.00 10.00 C ATOM 1192 C PRO A 76 1.634 14.232 6.802 1.00 10.00 C ATOM 1193 O PRO A 76 1.883 15.147 7.581 1.00 10.00 O ATOM 1194 CB PRO A 76 0.738 15.981 5.140 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.659 16.312 5.665 1.00 10.00 C ATOM 1196 CD PRO A 76 -1.429 14.998 5.532 1.00 10.00 C ATOM 0 HA PRO A 76 1.560 14.024 4.724 1.00 10.00 H new ATOM 0 HB2 PRO A 76 1.501 16.591 5.624 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.815 16.165 4.068 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.626 16.651 6.700 1.00 10.00 H new ATOM 0 HG3 PRO A 76 -1.125 17.108 5.084 1.00 10.00 H new ATOM 0 HD2 PRO A 76 -2.106 14.857 6.375 1.00 10.00 H new ATOM 0 HD3 PRO A 76 -2.040 14.995 4.629 1.00 10.00 H new ATOM 1204 N GLY A 77 1.986 12.968 7.045 1.00 10.00 N ATOM 1205 CA GLY A 77 2.731 12.529 8.217 1.00 10.00 C ATOM 1206 C GLY A 77 2.695 11.007 8.302 1.00 10.00 C ATOM 1207 O GLY A 77 2.300 10.444 9.317 1.00 10.00 O ATOM 0 H GLY A 77 1.752 12.203 6.412 1.00 10.00 H new ATOM 0 HA2 GLY A 77 3.762 12.876 8.156 1.00 10.00 H new ATOM 0 HA3 GLY A 77 2.301 12.964 9.119 1.00 10.00 H new ATOM 1211 N THR A 78 3.086 10.340 7.210 1.00 10.00 N ATOM 1212 CA THR A 78 3.068 8.884 7.112 1.00 10.00 C ATOM 1213 C THR A 78 4.448 8.335 6.782 1.00 10.00 C ATOM 1214 O THR A 78 4.889 7.373 7.410 1.00 10.00 O ATOM 1215 CB THR A 78 1.963 8.432 6.143 1.00 10.00 C ATOM 1216 OG1 THR A 78 1.789 7.030 6.224 1.00 10.00 O ATOM 1217 CG2 THR A 78 2.184 8.828 4.678 1.00 10.00 C ATOM 0 H THR A 78 3.425 10.802 6.366 1.00 10.00 H new ATOM 0 HA THR A 78 2.818 8.457 8.083 1.00 10.00 H new ATOM 0 HB THR A 78 1.068 8.963 6.467 1.00 10.00 H new ATOM 0 HG1 THR A 78 1.082 6.752 5.605 1.00 10.00 H new ATOM 0 HG21 THR A 78 1.353 8.465 4.074 1.00 10.00 H new ATOM 0 HG22 THR A 78 2.243 9.914 4.599 1.00 10.00 H new ATOM 0 HG23 THR A 78 3.114 8.387 4.318 1.00 10.00 H new ATOM 1225 N LYS A 79 5.119 8.923 5.793 1.00 10.00 N ATOM 1226 CA LYS A 79 6.483 8.597 5.408 1.00 10.00 C ATOM 1227 C LYS A 79 6.934 9.491 4.255 1.00 10.00 C ATOM 1228 O LYS A 79 8.086 9.905 4.234 1.00 10.00 O ATOM 1229 CB LYS A 79 6.683 7.110 5.071 1.00 10.00 C ATOM 1230 CG LYS A 79 5.782 6.512 3.976 1.00 10.00 C ATOM 1231 CD LYS A 79 4.592 5.687 4.480 1.00 10.00 C ATOM 1232 CE LYS A 79 5.044 4.516 5.355 1.00 10.00 C ATOM 1233 NZ LYS A 79 4.855 4.767 6.802 1.00 10.00 N ATOM 0 H LYS A 79 4.711 9.663 5.222 1.00 10.00 H new ATOM 0 HA LYS A 79 7.111 8.790 6.278 1.00 10.00 H new ATOM 0 HB2 LYS A 79 7.721 6.968 4.770 1.00 10.00 H new ATOM 0 HB3 LYS A 79 6.534 6.533 5.984 1.00 10.00 H new ATOM 0 HG2 LYS A 79 5.402 7.325 3.358 1.00 10.00 H new ATOM 0 HG3 LYS A 79 6.393 5.880 3.332 1.00 10.00 H new ATOM 0 HD2 LYS A 79 3.920 6.329 5.050 1.00 10.00 H new ATOM 0 HD3 LYS A 79 4.026 5.308 3.629 1.00 10.00 H new ATOM 0 HE2 LYS A 79 4.488 3.622 5.071 1.00 10.00 H new ATOM 0 HE3 LYS A 79 6.097 4.311 5.162 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 5.763 4.650 7.296 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 4.506 5.737 6.944 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 4.163 4.091 7.184 1.00 10.00 H new ATOM 1247 N MET A 80 6.019 9.778 3.315 1.00 10.00 N ATOM 1248 CA MET A 80 6.275 10.589 2.131 1.00 10.00 C ATOM 1249 C MET A 80 7.432 10.004 1.316 1.00 10.00 C ATOM 1250 O MET A 80 8.568 10.449 1.442 1.00 10.00 O ATOM 1251 CB MET A 80 6.507 12.052 2.542 1.00 10.00 C ATOM 1252 CG MET A 80 6.878 12.951 1.351 1.00 10.00 C ATOM 1253 SD MET A 80 8.542 13.662 1.311 1.00 10.00 S ATOM 1254 CE MET A 80 8.533 14.568 2.872 1.00 10.00 C ATOM 0 H MET A 80 5.058 9.440 3.366 1.00 10.00 H new ATOM 0 HA MET A 80 5.403 10.573 1.478 1.00 10.00 H new ATOM 0 HB2 MET A 80 5.606 12.439 3.017 1.00 10.00 H new ATOM 0 HB3 MET A 80 7.303 12.094 3.286 1.00 10.00 H new ATOM 0 HG2 MET A 80 6.741 12.371 0.439 1.00 10.00 H new ATOM 0 HG3 MET A 80 6.163 13.773 1.317 1.00 10.00 H new ATOM 0 HE1 MET A 80 9.284 15.357 2.839 1.00 10.00 H new ATOM 0 HE2 MET A 80 7.549 15.010 3.031 1.00 10.00 H new ATOM 0 HE3 MET A 80 8.760 13.885 3.690 1.00 10.00 H new ATOM 1264 N ILE A 81 7.141 9.017 0.461 1.00 10.00 N ATOM 1265 CA ILE A 81 8.173 8.434 -0.388 1.00 10.00 C ATOM 1266 C ILE A 81 8.301 9.176 -1.724 1.00 10.00 C ATOM 1267 O ILE A 81 7.988 10.366 -1.806 1.00 10.00 O ATOM 1268 CB ILE A 81 8.034 6.898 -0.483 1.00 10.00 C ATOM 1269 CG1 ILE A 81 6.815 6.426 -1.296 1.00 10.00 C ATOM 1270 CG2 ILE A 81 7.993 6.290 0.924 1.00 10.00 C ATOM 1271 CD1 ILE A 81 6.808 4.900 -1.431 1.00 10.00 C ATOM 0 H ILE A 81 6.212 8.613 0.343 1.00 10.00 H new ATOM 0 HA ILE A 81 9.142 8.584 0.087 1.00 10.00 H new ATOM 0 HB ILE A 81 8.912 6.548 -1.026 1.00 10.00 H new ATOM 0 HG12 ILE A 81 5.898 6.757 -0.809 1.00 10.00 H new ATOM 0 HG13 ILE A 81 6.833 6.883 -2.285 1.00 10.00 H new ATOM 0 HG21 ILE A 81 7.895 5.207 0.850 1.00 10.00 H new ATOM 0 HG22 ILE A 81 8.914 6.535 1.453 1.00 10.00 H new ATOM 0 HG23 ILE A 81 7.141 6.695 1.471 1.00 10.00 H new ATOM 0 HD11 ILE A 81 5.938 4.590 -2.009 1.00 10.00 H new ATOM 0 HD12 ILE A 81 7.716 4.576 -1.940 1.00 10.00 H new ATOM 0 HD13 ILE A 81 6.766 4.447 -0.440 1.00 10.00 H new ATOM 1283 N PHE A 82 8.786 8.475 -2.756 1.00 10.00 N ATOM 1284 CA PHE A 82 8.908 8.962 -4.121 1.00 10.00 C ATOM 1285 C PHE A 82 7.606 9.613 -4.609 1.00 10.00 C ATOM 1286 O PHE A 82 6.542 9.412 -4.026 1.00 10.00 O ATOM 1287 CB PHE A 82 9.351 7.797 -5.028 1.00 10.00 C ATOM 1288 CG PHE A 82 8.486 6.542 -4.968 1.00 10.00 C ATOM 1289 CD1 PHE A 82 7.169 6.570 -5.460 1.00 10.00 C ATOM 1290 CD2 PHE A 82 9.010 5.328 -4.479 1.00 10.00 C ATOM 1291 CE1 PHE A 82 6.353 5.429 -5.392 1.00 10.00 C ATOM 1292 CE2 PHE A 82 8.218 4.163 -4.482 1.00 10.00 C ATOM 1293 CZ PHE A 82 6.880 4.220 -4.912 1.00 10.00 C ATOM 0 H PHE A 82 9.115 7.515 -2.651 1.00 10.00 H new ATOM 0 HA PHE A 82 9.665 9.745 -4.159 1.00 10.00 H new ATOM 0 HB2 PHE A 82 9.372 8.152 -6.058 1.00 10.00 H new ATOM 0 HB3 PHE A 82 10.373 7.524 -4.764 1.00 10.00 H new ATOM 0 HD1 PHE A 82 6.781 7.479 -5.895 1.00 10.00 H new ATOM 0 HD2 PHE A 82 10.021 5.291 -4.101 1.00 10.00 H new ATOM 0 HE1 PHE A 82 5.322 5.482 -5.709 1.00 10.00 H new ATOM 0 HE2 PHE A 82 8.639 3.224 -4.153 1.00 10.00 H new ATOM 0 HZ PHE A 82 6.260 3.336 -4.873 1.00 10.00 H new ATOM 1303 N ALA A 83 7.701 10.388 -5.697 1.00 10.00 N ATOM 1304 CA ALA A 83 6.594 11.167 -6.243 1.00 10.00 C ATOM 1305 C ALA A 83 5.304 10.347 -6.328 1.00 10.00 C ATOM 1306 O ALA A 83 4.302 10.707 -5.714 1.00 10.00 O ATOM 1307 CB ALA A 83 6.985 11.732 -7.614 1.00 10.00 C ATOM 0 H ALA A 83 8.566 10.490 -6.228 1.00 10.00 H new ATOM 0 HA ALA A 83 6.392 11.995 -5.563 1.00 10.00 H new ATOM 0 HB1 ALA A 83 6.156 12.313 -8.018 1.00 10.00 H new ATOM 0 HB2 ALA A 83 7.860 12.374 -7.507 1.00 10.00 H new ATOM 0 HB3 ALA A 83 7.218 10.911 -8.293 1.00 10.00 H new ATOM 1313 N GLY A 84 5.357 9.242 -7.075 1.00 10.00 N ATOM 1314 CA GLY A 84 4.273 8.292 -7.210 1.00 10.00 C ATOM 1315 C GLY A 84 4.727 7.154 -8.119 1.00 10.00 C ATOM 1316 O GLY A 84 5.900 7.102 -8.492 1.00 10.00 O ATOM 0 H GLY A 84 6.183 8.985 -7.615 1.00 10.00 H new ATOM 0 HA2 GLY A 84 3.988 7.903 -6.232 1.00 10.00 H new ATOM 0 HA3 GLY A 84 3.393 8.781 -7.628 1.00 10.00 H new ATOM 1320 N ILE A 85 3.813 6.245 -8.471 1.00 10.00 N ATOM 1321 CA ILE A 85 4.057 5.226 -9.485 1.00 10.00 C ATOM 1322 C ILE A 85 4.298 5.898 -10.843 1.00 10.00 C ATOM 1323 O ILE A 85 4.006 7.077 -11.020 1.00 10.00 O ATOM 1324 CB ILE A 85 2.883 4.219 -9.478 1.00 10.00 C ATOM 1325 CG1 ILE A 85 3.277 2.933 -8.742 1.00 10.00 C ATOM 1326 CG2 ILE A 85 2.264 3.898 -10.847 1.00 10.00 C ATOM 1327 CD1 ILE A 85 4.041 1.946 -9.628 1.00 10.00 C ATOM 0 H ILE A 85 2.882 6.199 -8.057 1.00 10.00 H new ATOM 0 HA ILE A 85 4.960 4.656 -9.268 1.00 10.00 H new ATOM 0 HB ILE A 85 2.088 4.734 -8.939 1.00 10.00 H new ATOM 0 HG12 ILE A 85 3.892 3.189 -7.879 1.00 10.00 H new ATOM 0 HG13 ILE A 85 2.378 2.449 -8.361 1.00 10.00 H new ATOM 0 HG21 ILE A 85 1.452 3.182 -10.720 1.00 10.00 H new ATOM 0 HG22 ILE A 85 1.875 4.813 -11.294 1.00 10.00 H new ATOM 0 HG23 ILE A 85 3.025 3.471 -11.499 1.00 10.00 H new ATOM 0 HD11 ILE A 85 4.292 1.057 -9.050 1.00 10.00 H new ATOM 0 HD12 ILE A 85 3.419 1.663 -10.478 1.00 10.00 H new ATOM 0 HD13 ILE A 85 4.957 2.414 -9.988 1.00 10.00 H new ATOM 1339 N LYS A 86 4.843 5.137 -11.799 1.00 10.00 N ATOM 1340 CA LYS A 86 5.179 5.630 -13.128 1.00 10.00 C ATOM 1341 C LYS A 86 4.014 6.401 -13.758 1.00 10.00 C ATOM 1342 O LYS A 86 4.219 7.509 -14.245 1.00 10.00 O ATOM 1343 CB LYS A 86 5.633 4.487 -14.050 1.00 10.00 C ATOM 1344 CG LYS A 86 6.665 3.565 -13.388 1.00 10.00 C ATOM 1345 CD LYS A 86 7.444 2.705 -14.404 1.00 10.00 C ATOM 1346 CE LYS A 86 8.729 3.374 -14.922 1.00 10.00 C ATOM 1347 NZ LYS A 86 8.500 4.188 -16.132 1.00 10.00 N ATOM 0 H LYS A 86 5.063 4.150 -11.664 1.00 10.00 H new ATOM 0 HA LYS A 86 6.012 6.323 -13.010 1.00 10.00 H new ATOM 0 HB2 LYS A 86 4.765 3.899 -14.347 1.00 10.00 H new ATOM 0 HB3 LYS A 86 6.060 4.908 -14.960 1.00 10.00 H new ATOM 0 HG2 LYS A 86 7.369 4.169 -12.816 1.00 10.00 H new ATOM 0 HG3 LYS A 86 6.158 2.910 -12.680 1.00 10.00 H new ATOM 0 HD2 LYS A 86 7.702 1.753 -13.939 1.00 10.00 H new ATOM 0 HD3 LYS A 86 6.795 2.481 -15.250 1.00 10.00 H new ATOM 0 HE2 LYS A 86 9.146 4.006 -14.138 1.00 10.00 H new ATOM 0 HE3 LYS A 86 9.471 2.606 -15.141 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 9.413 4.419 -16.573 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 7.916 3.652 -16.805 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 8.010 5.067 -15.871 1.00 10.00 H new ATOM 1361 N LYS A 87 2.818 5.797 -13.771 1.00 10.00 N ATOM 1362 CA LYS A 87 1.580 6.370 -14.268 1.00 10.00 C ATOM 1363 C LYS A 87 0.423 5.400 -13.994 1.00 10.00 C ATOM 1364 O LYS A 87 0.617 4.344 -13.387 1.00 10.00 O ATOM 1365 CB LYS A 87 1.703 6.687 -15.761 1.00 10.00 C ATOM 1366 CG LYS A 87 1.941 5.437 -16.614 1.00 10.00 C ATOM 1367 CD LYS A 87 2.240 5.787 -18.077 1.00 10.00 C ATOM 1368 CE LYS A 87 1.137 6.659 -18.699 1.00 10.00 C ATOM 1369 NZ LYS A 87 1.377 6.930 -20.131 1.00 10.00 N ATOM 0 H LYS A 87 2.692 4.849 -13.416 1.00 10.00 H new ATOM 0 HA LYS A 87 1.375 7.307 -13.749 1.00 10.00 H new ATOM 0 HB2 LYS A 87 0.794 7.184 -16.099 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.524 7.387 -15.913 1.00 10.00 H new ATOM 0 HG2 LYS A 87 2.774 4.869 -16.200 1.00 10.00 H new ATOM 0 HG3 LYS A 87 1.062 4.794 -16.568 1.00 10.00 H new ATOM 0 HD2 LYS A 87 3.193 6.312 -18.136 1.00 10.00 H new ATOM 0 HD3 LYS A 87 2.345 4.869 -18.655 1.00 10.00 H new ATOM 0 HE2 LYS A 87 0.174 6.161 -18.582 1.00 10.00 H new ATOM 0 HE3 LYS A 87 1.075 7.603 -18.158 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 0.608 7.521 -20.506 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 2.283 7.429 -20.243 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 1.410 6.031 -20.654 1.00 10.00 H new ATOM 1383 N LYS A 88 -0.771 5.733 -14.500 1.00 10.00 N ATOM 1384 CA LYS A 88 -1.992 4.967 -14.302 1.00 10.00 C ATOM 1385 C LYS A 88 -1.793 3.519 -14.728 1.00 10.00 C ATOM 1386 O LYS A 88 -2.140 2.620 -13.972 1.00 10.00 O ATOM 1387 CB LYS A 88 -3.159 5.641 -15.044 1.00 10.00 C ATOM 1388 CG LYS A 88 -4.507 4.937 -14.792 1.00 10.00 C ATOM 1389 CD LYS A 88 -5.681 5.738 -15.385 1.00 10.00 C ATOM 1390 CE LYS A 88 -5.886 5.479 -16.887 1.00 10.00 C ATOM 1391 NZ LYS A 88 -6.638 4.231 -17.149 1.00 10.00 N ATOM 0 H LYS A 88 -0.910 6.566 -15.072 1.00 10.00 H new ATOM 0 HA LYS A 88 -2.242 4.951 -13.241 1.00 10.00 H new ATOM 0 HB2 LYS A 88 -3.232 6.682 -14.729 1.00 10.00 H new ATOM 0 HB3 LYS A 88 -2.950 5.646 -16.114 1.00 10.00 H new ATOM 0 HG2 LYS A 88 -4.486 3.940 -15.232 1.00 10.00 H new ATOM 0 HG3 LYS A 88 -4.657 4.809 -13.720 1.00 10.00 H new ATOM 0 HD2 LYS A 88 -6.595 5.482 -14.850 1.00 10.00 H new ATOM 0 HD3 LYS A 88 -5.505 6.802 -15.226 1.00 10.00 H new ATOM 0 HE2 LYS A 88 -6.420 6.321 -17.328 1.00 10.00 H new ATOM 0 HE3 LYS A 88 -4.915 5.424 -17.379 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 -6.750 4.102 -18.175 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 -6.118 3.422 -16.753 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 -7.576 4.291 -16.704 1.00 10.00 H new ATOM 1405 N THR A 89 -1.243 3.313 -15.927 1.00 10.00 N ATOM 1406 CA THR A 89 -0.958 2.018 -16.517 1.00 10.00 C ATOM 1407 C THR A 89 -0.303 1.090 -15.486 1.00 10.00 C ATOM 1408 O THR A 89 -0.938 0.160 -14.985 1.00 10.00 O ATOM 1409 CB THR A 89 -0.084 2.275 -17.755 1.00 10.00 C ATOM 1410 OG1 THR A 89 -0.656 3.329 -18.513 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.060 1.022 -18.611 1.00 10.00 C ATOM 0 H THR A 89 -0.974 4.086 -16.536 1.00 10.00 H new ATOM 0 HA THR A 89 -1.866 1.501 -16.827 1.00 10.00 H new ATOM 0 HB THR A 89 0.916 2.556 -17.424 1.00 10.00 H new ATOM 0 HG1 THR A 89 -0.103 3.500 -19.304 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.684 1.243 -19.477 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.523 0.230 -18.022 1.00 10.00 H new ATOM 0 HG23 THR A 89 -0.924 0.696 -18.947 1.00 10.00 H new ATOM 1419 N GLU A 90 0.944 1.394 -15.123 1.00 10.00 N ATOM 1420 CA GLU A 90 1.670 0.744 -14.057 1.00 10.00 C ATOM 1421 C GLU A 90 0.830 0.547 -12.809 1.00 10.00 C ATOM 1422 O GLU A 90 0.809 -0.550 -12.267 1.00 10.00 O ATOM 1423 CB GLU A 90 2.909 1.570 -13.735 1.00 10.00 C ATOM 1424 CG GLU A 90 4.091 1.141 -14.614 1.00 10.00 C ATOM 1425 CD GLU A 90 3.962 1.551 -16.076 1.00 10.00 C ATOM 1426 OE1 GLU A 90 3.091 2.405 -16.365 1.00 10.00 O ATOM 1427 OE2 GLU A 90 4.779 1.032 -16.865 1.00 10.00 O ATOM 0 H GLU A 90 1.485 2.125 -15.585 1.00 10.00 H new ATOM 0 HA GLU A 90 1.951 -0.252 -14.399 1.00 10.00 H new ATOM 0 HB2 GLU A 90 2.698 2.628 -13.892 1.00 10.00 H new ATOM 0 HB3 GLU A 90 3.169 1.450 -12.683 1.00 10.00 H new ATOM 0 HG2 GLU A 90 5.007 1.570 -14.207 1.00 10.00 H new ATOM 0 HG3 GLU A 90 4.195 0.057 -14.560 1.00 10.00 H new ATOM 1434 N ARG A 91 0.179 1.600 -12.318 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.600 1.491 -11.092 1.00 10.00 C ATOM 1436 C ARG A 91 -1.662 0.394 -11.220 1.00 10.00 C ATOM 1437 O ARG A 91 -1.883 -0.388 -10.296 1.00 10.00 O ATOM 1438 CB ARG A 91 -1.249 2.841 -10.769 1.00 10.00 C ATOM 1439 CG ARG A 91 -1.100 3.156 -9.280 1.00 10.00 C ATOM 1440 CD ARG A 91 -1.957 4.360 -8.903 1.00 10.00 C ATOM 1441 NE ARG A 91 -1.739 5.532 -9.773 1.00 10.00 N ATOM 1442 CZ ARG A 91 -2.597 5.983 -10.705 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -3.717 5.318 -10.996 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -2.342 7.098 -11.385 1.00 10.00 N ATOM 0 H ARG A 91 0.176 2.526 -12.746 1.00 10.00 H new ATOM 0 HA ARG A 91 0.066 1.216 -10.274 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.784 3.628 -11.363 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -2.305 2.819 -11.040 1.00 10.00 H new ATOM 0 HG2 ARG A 91 -1.397 2.291 -8.687 1.00 10.00 H new ATOM 0 HG3 ARG A 91 -0.055 3.359 -9.047 1.00 10.00 H new ATOM 0 HD2 ARG A 91 -3.008 4.076 -8.946 1.00 10.00 H new ATOM 0 HD3 ARG A 91 -1.744 4.639 -7.871 1.00 10.00 H new ATOM 0 HE ARG A 91 -0.864 6.043 -9.658 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -3.936 4.450 -10.508 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -4.354 5.678 -11.707 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -1.487 7.622 -11.202 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -3.002 7.428 -12.089 1.00 10.00 H new ATOM 1458 N GLU A 92 -2.315 0.355 -12.380 1.00 10.00 N ATOM 1459 CA GLU A 92 -3.369 -0.597 -12.686 1.00 10.00 C ATOM 1460 C GLU A 92 -2.773 -2.005 -12.646 1.00 10.00 C ATOM 1461 O GLU A 92 -3.256 -2.872 -11.917 1.00 10.00 O ATOM 1462 CB GLU A 92 -4.011 -0.237 -14.042 1.00 10.00 C ATOM 1463 CG GLU A 92 -5.546 -0.313 -14.031 1.00 10.00 C ATOM 1464 CD GLU A 92 -6.039 -1.725 -14.297 1.00 10.00 C ATOM 1465 OE1 GLU A 92 -6.014 -2.576 -13.377 1.00 10.00 O ATOM 1466 OE2 GLU A 92 -6.330 -2.019 -15.478 1.00 10.00 O ATOM 0 H GLU A 92 -2.119 0.999 -13.146 1.00 10.00 H new ATOM 0 HA GLU A 92 -4.171 -0.560 -11.949 1.00 10.00 H new ATOM 0 HB2 GLU A 92 -3.707 0.771 -14.323 1.00 10.00 H new ATOM 0 HB3 GLU A 92 -3.627 -0.911 -14.808 1.00 10.00 H new ATOM 0 HG2 GLU A 92 -5.921 0.028 -13.066 1.00 10.00 H new ATOM 0 HG3 GLU A 92 -5.949 0.362 -14.786 1.00 10.00 H new ATOM 1473 N ASP A 93 -1.689 -2.224 -13.399 1.00 10.00 N ATOM 1474 CA ASP A 93 -0.946 -3.486 -13.386 1.00 10.00 C ATOM 1475 C ASP A 93 -0.626 -3.890 -11.947 1.00 10.00 C ATOM 1476 O ASP A 93 -0.912 -5.004 -11.514 1.00 10.00 O ATOM 1477 CB ASP A 93 0.326 -3.363 -14.240 1.00 10.00 C ATOM 1478 CG ASP A 93 0.070 -3.389 -15.742 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.112 -3.536 -16.129 1.00 10.00 O ATOM 1480 OD2 ASP A 93 1.074 -3.277 -16.478 1.00 10.00 O ATOM 0 H ASP A 93 -1.302 -1.528 -14.036 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.561 -4.272 -13.824 1.00 10.00 H new ATOM 0 HB2 ASP A 93 0.834 -2.433 -13.985 1.00 10.00 H new ATOM 0 HB3 ASP A 93 1.004 -4.177 -13.983 1.00 10.00 H new ATOM 1485 N LEU A 94 -0.078 -2.956 -11.176 1.00 10.00 N ATOM 1486 CA LEU A 94 0.211 -3.137 -9.764 1.00 10.00 C ATOM 1487 C LEU A 94 -1.002 -3.708 -9.031 1.00 10.00 C ATOM 1488 O LEU A 94 -0.922 -4.804 -8.472 1.00 10.00 O ATOM 1489 CB LEU A 94 0.670 -1.804 -9.163 1.00 10.00 C ATOM 1490 CG LEU A 94 1.894 -1.983 -8.272 1.00 10.00 C ATOM 1491 CD1 LEU A 94 2.444 -0.604 -7.922 1.00 10.00 C ATOM 1492 CD2 LEU A 94 1.558 -2.735 -6.996 1.00 10.00 C ATOM 0 H LEU A 94 0.182 -2.034 -11.526 1.00 10.00 H new ATOM 0 HA LEU A 94 1.018 -3.860 -9.647 1.00 10.00 H new ATOM 0 HB2 LEU A 94 0.902 -1.103 -9.965 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -0.143 -1.367 -8.583 1.00 10.00 H new ATOM 0 HG LEU A 94 2.635 -2.571 -8.814 1.00 10.00 H new ATOM 0 HD11 LEU A 94 3.321 -0.713 -7.284 1.00 10.00 H new ATOM 0 HD12 LEU A 94 2.723 -0.081 -8.837 1.00 10.00 H new ATOM 0 HD13 LEU A 94 1.681 -0.031 -7.395 1.00 10.00 H new ATOM 0 HD21 LEU A 94 2.457 -2.842 -6.389 1.00 10.00 H new ATOM 0 HD22 LEU A 94 0.805 -2.182 -6.435 1.00 10.00 H new ATOM 0 HD23 LEU A 94 1.171 -3.722 -7.247 1.00 10.00 H new ATOM 1504 N ILE A 95 -2.128 -2.985 -9.065 1.00 10.00 N ATOM 1505 CA ILE A 95 -3.388 -3.435 -8.493 1.00 10.00 C ATOM 1506 C ILE A 95 -3.752 -4.831 -8.995 1.00 10.00 C ATOM 1507 O ILE A 95 -4.284 -5.634 -8.236 1.00 10.00 O ATOM 1508 CB ILE A 95 -4.508 -2.404 -8.772 1.00 10.00 C ATOM 1509 CG1 ILE A 95 -4.620 -1.410 -7.615 1.00 10.00 C ATOM 1510 CG2 ILE A 95 -5.888 -3.051 -8.965 1.00 10.00 C ATOM 1511 CD1 ILE A 95 -3.569 -0.306 -7.635 1.00 10.00 C ATOM 0 H ILE A 95 -2.183 -2.062 -9.497 1.00 10.00 H new ATOM 0 HA ILE A 95 -3.273 -3.509 -7.412 1.00 10.00 H new ATOM 0 HB ILE A 95 -4.225 -1.904 -9.698 1.00 10.00 H new ATOM 0 HG12 ILE A 95 -5.610 -0.954 -7.637 1.00 10.00 H new ATOM 0 HG13 ILE A 95 -4.541 -1.955 -6.674 1.00 10.00 H new ATOM 0 HG21 ILE A 95 -6.630 -2.276 -9.157 1.00 10.00 H new ATOM 0 HG22 ILE A 95 -5.853 -3.737 -9.811 1.00 10.00 H new ATOM 0 HG23 ILE A 95 -6.162 -3.600 -8.064 1.00 10.00 H new ATOM 0 HD11 ILE A 95 -3.719 0.355 -6.781 1.00 10.00 H new ATOM 0 HD12 ILE A 95 -2.575 -0.749 -7.580 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -3.660 0.267 -8.558 1.00 10.00 H new ATOM 1523 N ALA A 96 -3.520 -5.119 -10.273 1.00 10.00 N ATOM 1524 CA ALA A 96 -3.788 -6.431 -10.841 1.00 10.00 C ATOM 1525 C ALA A 96 -3.054 -7.532 -10.073 1.00 10.00 C ATOM 1526 O ALA A 96 -3.682 -8.504 -9.657 1.00 10.00 O ATOM 1527 CB ALA A 96 -3.444 -6.465 -12.326 1.00 10.00 C ATOM 0 H ALA A 96 -3.141 -4.448 -10.941 1.00 10.00 H new ATOM 0 HA ALA A 96 -4.856 -6.623 -10.743 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.654 -7.457 -12.725 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.045 -5.726 -12.856 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.387 -6.236 -12.460 1.00 10.00 H new ATOM 1533 N TYR A 97 -1.741 -7.388 -9.867 1.00 10.00 N ATOM 1534 CA TYR A 97 -1.010 -8.348 -9.044 1.00 10.00 C ATOM 1535 C TYR A 97 -1.591 -8.361 -7.642 1.00 10.00 C ATOM 1536 O TYR A 97 -2.050 -9.398 -7.160 1.00 10.00 O ATOM 1537 CB TYR A 97 0.479 -8.014 -8.977 1.00 10.00 C ATOM 1538 CG TYR A 97 1.266 -8.836 -7.970 1.00 10.00 C ATOM 1539 CD1 TYR A 97 1.335 -10.238 -8.090 1.00 10.00 C ATOM 1540 CD2 TYR A 97 1.950 -8.197 -6.920 1.00 10.00 C ATOM 1541 CE1 TYR A 97 2.153 -10.986 -7.224 1.00 10.00 C ATOM 1542 CE2 TYR A 97 2.800 -8.942 -6.088 1.00 10.00 C ATOM 1543 CZ TYR A 97 2.914 -10.330 -6.243 1.00 10.00 C ATOM 1544 OH TYR A 97 3.818 -11.017 -5.491 1.00 10.00 O ATOM 0 H TYR A 97 -1.175 -6.631 -10.251 1.00 10.00 H new ATOM 0 HA TYR A 97 -1.114 -9.332 -9.502 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.915 -8.159 -9.965 1.00 10.00 H new ATOM 0 HB3 TYR A 97 0.591 -6.958 -8.731 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.757 -10.741 -8.851 1.00 10.00 H new ATOM 0 HD2 TYR A 97 1.822 -7.137 -6.755 1.00 10.00 H new ATOM 0 HE1 TYR A 97 2.196 -12.061 -7.313 1.00 10.00 H new ATOM 0 HE2 TYR A 97 3.372 -8.441 -5.321 1.00 10.00 H new ATOM 0 HH TYR A 97 4.255 -10.404 -4.863 1.00 10.00 H new ATOM 1554 N LEU A 98 -1.546 -7.190 -7.004 1.00 10.00 N ATOM 1555 CA LEU A 98 -2.010 -6.978 -5.646 1.00 10.00 C ATOM 1556 C LEU A 98 -3.340 -7.696 -5.398 1.00 10.00 C ATOM 1557 O LEU A 98 -3.475 -8.374 -4.385 1.00 10.00 O ATOM 1558 CB LEU A 98 -2.039 -5.465 -5.337 1.00 10.00 C ATOM 1559 CG LEU A 98 -1.133 -5.075 -4.155 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -0.071 -4.063 -4.567 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -1.953 -4.482 -3.011 1.00 10.00 C ATOM 0 H LEU A 98 -1.174 -6.344 -7.436 1.00 10.00 H new ATOM 0 HA LEU A 98 -1.312 -7.427 -4.939 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -1.728 -4.913 -6.224 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -3.063 -5.164 -5.117 1.00 10.00 H new ATOM 0 HG LEU A 98 -0.642 -5.990 -3.824 1.00 10.00 H new ATOM 0 HD11 LEU A 98 0.548 -3.814 -3.705 1.00 10.00 H new ATOM 0 HD12 LEU A 98 0.554 -4.490 -5.351 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -0.554 -3.160 -4.940 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -1.290 -4.215 -2.188 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -2.474 -3.591 -3.361 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -2.681 -5.216 -2.666 1.00 10.00 H new ATOM 1573 N LYS A 99 -4.304 -7.599 -6.320 1.00 10.00 N ATOM 1574 CA LYS A 99 -5.602 -8.255 -6.215 1.00 10.00 C ATOM 1575 C LYS A 99 -5.470 -9.719 -5.814 1.00 10.00 C ATOM 1576 O LYS A 99 -6.090 -10.143 -4.841 1.00 10.00 O ATOM 1577 CB LYS A 99 -6.398 -8.131 -7.523 1.00 10.00 C ATOM 1578 CG LYS A 99 -7.418 -6.985 -7.476 1.00 10.00 C ATOM 1579 CD LYS A 99 -8.520 -7.187 -8.531 1.00 10.00 C ATOM 1580 CE LYS A 99 -8.028 -7.003 -9.974 1.00 10.00 C ATOM 1581 NZ LYS A 99 -7.838 -5.577 -10.311 1.00 10.00 N ATOM 0 H LYS A 99 -4.197 -7.051 -7.174 1.00 10.00 H new ATOM 0 HA LYS A 99 -6.150 -7.741 -5.426 1.00 10.00 H new ATOM 0 HB2 LYS A 99 -5.709 -7.968 -8.351 1.00 10.00 H new ATOM 0 HB3 LYS A 99 -6.917 -9.069 -7.721 1.00 10.00 H new ATOM 0 HG2 LYS A 99 -7.865 -6.931 -6.483 1.00 10.00 H new ATOM 0 HG3 LYS A 99 -6.912 -6.035 -7.650 1.00 10.00 H new ATOM 0 HD2 LYS A 99 -8.937 -8.188 -8.423 1.00 10.00 H new ATOM 0 HD3 LYS A 99 -9.329 -6.483 -8.339 1.00 10.00 H new ATOM 0 HE2 LYS A 99 -7.087 -7.537 -10.108 1.00 10.00 H new ATOM 0 HE3 LYS A 99 -8.747 -7.447 -10.663 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 -7.046 -5.481 -10.978 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 -8.706 -5.205 -10.747 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 -7.628 -5.041 -9.445 1.00 10.00 H new ATOM 1595 N LYS A 100 -4.685 -10.494 -6.562 1.00 10.00 N ATOM 1596 CA LYS A 100 -4.445 -11.864 -6.200 1.00 10.00 C ATOM 1597 C LYS A 100 -3.584 -11.866 -4.939 1.00 10.00 C ATOM 1598 O LYS A 100 -3.940 -12.499 -3.957 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.776 -12.568 -7.385 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.482 -14.030 -7.041 1.00 10.00 C ATOM 1601 CD LYS A 100 -4.401 -15.019 -7.771 1.00 10.00 C ATOM 1602 CE LYS A 100 -3.872 -15.316 -9.182 1.00 10.00 C ATOM 1603 NZ LYS A 100 -4.826 -16.117 -9.977 1.00 10.00 N ATOM 0 H LYS A 100 -4.214 -10.187 -7.413 1.00 10.00 H new ATOM 0 HA LYS A 100 -5.364 -12.407 -5.980 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -4.424 -12.517 -8.260 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -2.850 -12.056 -7.645 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -2.445 -14.254 -7.292 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.588 -14.172 -5.965 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -4.471 -15.946 -7.201 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -5.408 -14.607 -7.835 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -3.670 -14.377 -9.698 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -2.925 -15.850 -9.108 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -4.428 -16.294 -10.922 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -5.000 -17.024 -9.499 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -5.722 -15.597 -10.070 1.00 10.00 H new ATOM 1617 N ALA A 101 -2.459 -11.155 -4.968 1.00 10.00 N ATOM 1618 CA ALA A 101 -1.381 -11.358 -4.016 1.00 10.00 C ATOM 1619 C ALA A 101 -1.888 -11.170 -2.586 1.00 10.00 C ATOM 1620 O ALA A 101 -1.785 -12.041 -1.730 1.00 10.00 O ATOM 1621 CB ALA A 101 -0.243 -10.394 -4.357 1.00 10.00 C ATOM 0 H ALA A 101 -2.274 -10.423 -5.654 1.00 10.00 H new ATOM 0 HA ALA A 101 -1.004 -12.379 -4.081 1.00 10.00 H new ATOM 0 HB1 ALA A 101 0.576 -10.533 -3.651 1.00 10.00 H new ATOM 0 HB2 ALA A 101 0.112 -10.593 -5.368 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -0.605 -9.368 -4.295 1.00 10.00 H new ATOM 1627 N THR A 102 -2.500 -10.015 -2.346 1.00 10.00 N ATOM 1628 CA THR A 102 -3.015 -9.669 -1.038 1.00 10.00 C ATOM 1629 C THR A 102 -4.126 -10.614 -0.596 1.00 10.00 C ATOM 1630 O THR A 102 -4.273 -10.852 0.602 1.00 10.00 O ATOM 1631 CB THR A 102 -3.479 -8.217 -1.052 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.567 -8.046 -1.936 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.306 -7.345 -1.498 1.00 10.00 C ATOM 0 H THR A 102 -2.650 -9.298 -3.055 1.00 10.00 H new ATOM 0 HA THR A 102 -2.217 -9.779 -0.304 1.00 10.00 H new ATOM 0 HB THR A 102 -3.810 -7.931 -0.054 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.242 -8.053 -2.860 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.615 -6.300 -1.515 1.00 10.00 H new ATOM 0 HG22 THR A 102 -1.477 -7.466 -0.801 1.00 10.00 H new ATOM 0 HG23 THR A 102 -1.988 -7.646 -2.496 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.905 -11.134 -1.551 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.900 -12.158 -1.286 1.00 10.00 C ATOM 1643 C ASN A 103 -5.185 -13.407 -0.763 1.00 10.00 C ATOM 1644 O ASN A 103 -5.435 -13.805 0.372 1.00 10.00 O ATOM 1645 CB ASN A 103 -6.758 -12.379 -2.543 1.00 10.00 C ATOM 1646 CG ASN A 103 -7.892 -13.380 -2.365 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -7.759 -14.396 -1.698 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -9.031 -13.113 -3.001 1.00 10.00 N ATOM 0 H ASN A 103 -4.857 -10.850 -2.530 1.00 10.00 H new ATOM 0 HA ASN A 103 -6.602 -11.858 -0.508 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -7.180 -11.423 -2.853 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -6.113 -12.720 -3.353 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -9.815 -13.762 -2.937 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -9.119 -12.259 -3.552 1.00 10.00 H new ATOM 1655 N GLU A 104 -4.257 -13.959 -1.550 1.00 10.00 N ATOM 1656 CA GLU A 104 -3.391 -15.070 -1.185 1.00 10.00 C ATOM 1657 C GLU A 104 -2.225 -15.141 -2.180 1.00 10.00 C ATOM 1658 O GLU A 104 -1.107 -15.472 -1.726 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.179 -16.393 -1.178 1.00 10.00 C ATOM 1660 CG GLU A 104 -4.415 -16.922 0.245 1.00 10.00 C ATOM 1661 CD GLU A 104 -5.133 -18.266 0.249 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -4.737 -19.131 -0.562 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -6.052 -18.420 1.083 1.00 10.00 O ATOM 1664 OXT GLU A 104 -2.480 -14.898 -3.384 1.00 10.00 O ATOM 0 H GLU A 104 -4.086 -13.625 -2.499 1.00 10.00 H new ATOM 0 HA GLU A 104 -3.001 -14.911 -0.180 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -5.139 -16.244 -1.672 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -3.635 -17.140 -1.756 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -3.458 -17.022 0.757 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -5.003 -16.197 0.807 1.00 10.00 H new