USER MOD reduce.3.24.130724 H: found=0, std=0, add=1167, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1166 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 55 ASN : amide:sc= -2.27 K(o=-0.56,f=-5.9!) USER MOD Set 1.2: A 59 TYR OH : rot 180:sc= 0.908 USER MOD Set 1.3: A 76 LYS NZ :NH3+ -165:sc= 0.796 (180deg=0) USER MOD Single : A 1 MET CE :methyl -159:sc= -0.116 (180deg=-1.19) USER MOD Single : A 1 MET N :NH3+ -166:sc= 0 (180deg=-0.267) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 54:sc= 1.18 USER MOD Single : A 20 TYR OH : rot 180:sc= -0.467 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 94:sc= 0.666 USER MOD Single : A 28 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.0634) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -3.06 X(o=-3.1,f=-3.4) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -114:sc= 0 (180deg=-0.123) USER MOD Single : A 62 THR OG1 : rot -84:sc= -0.514 USER MOD Single : A 68 ASN :FLIP amide:sc= -0.618 F(o=-2.1,f=-0.62) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.135) USER MOD Single : A 86 ASN : amide:sc= 0.48 K(o=0.48,f=-5!) 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 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -0.366 X(o=-0.37,f=-0.36) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -171:sc= -1.77 (180deg=-2.01) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= -0.053 X(o=-0.053,f=-0.47) USER MOD Single : A 119 ASN : amide:sc= -0.0506 X(o=-0.051,f=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 109.960 22.964 16.139 1.00 0.00 N ATOM 2 CA MET A 1 111.332 22.685 15.623 1.00 0.00 C ATOM 3 C MET A 1 111.575 21.174 15.559 1.00 0.00 C ATOM 4 O MET A 1 111.277 20.459 16.499 1.00 0.00 O ATOM 5 CB MET A 1 112.282 23.339 16.629 1.00 0.00 C ATOM 6 CG MET A 1 112.193 24.861 16.507 1.00 0.00 C ATOM 7 SD MET A 1 113.519 25.624 17.475 1.00 0.00 S ATOM 8 CE MET A 1 112.992 25.024 19.099 1.00 0.00 C ATOM 0 H1 MET A 1 109.717 23.959 15.959 1.00 0.00 H new ATOM 0 H2 MET A 1 109.276 22.348 15.656 1.00 0.00 H new ATOM 0 H3 MET A 1 109.930 22.780 17.162 1.00 0.00 H new ATOM 0 HA MET A 1 111.479 23.075 14.616 1.00 0.00 H new ATOM 0 HB2 MET A 1 112.024 23.030 17.642 1.00 0.00 H new ATOM 0 HB3 MET A 1 113.305 23.009 16.446 1.00 0.00 H new ATOM 0 HG2 MET A 1 112.275 25.158 15.461 1.00 0.00 H new ATOM 0 HG3 MET A 1 111.223 25.209 16.862 1.00 0.00 H new ATOM 0 HE1 MET A 1 113.424 25.653 19.877 1.00 0.00 H new ATOM 0 HE2 MET A 1 111.905 25.060 19.165 1.00 0.00 H new ATOM 0 HE3 MET A 1 113.330 23.997 19.234 1.00 0.00 H new ATOM 20 N VAL A 2 112.112 20.700 14.458 1.00 0.00 N ATOM 21 CA VAL A 2 112.387 19.237 14.294 1.00 0.00 C ATOM 22 C VAL A 2 113.807 19.026 13.747 1.00 0.00 C ATOM 23 O VAL A 2 114.290 19.818 12.957 1.00 0.00 O ATOM 24 CB VAL A 2 111.298 18.730 13.329 1.00 0.00 C ATOM 25 CG1 VAL A 2 111.397 19.413 11.958 1.00 0.00 C ATOM 26 CG2 VAL A 2 111.427 17.213 13.148 1.00 0.00 C ATOM 0 H VAL A 2 112.374 21.273 13.656 1.00 0.00 H new ATOM 0 HA VAL A 2 112.350 18.687 15.234 1.00 0.00 H new ATOM 0 HB VAL A 2 110.329 18.974 13.765 1.00 0.00 H new ATOM 0 HG11 VAL A 2 110.614 19.031 11.304 1.00 0.00 H new ATOM 0 HG12 VAL A 2 111.276 20.490 12.078 1.00 0.00 H new ATOM 0 HG13 VAL A 2 112.372 19.204 11.517 1.00 0.00 H new ATOM 0 HG21 VAL A 2 110.654 16.861 12.465 1.00 0.00 H new ATOM 0 HG22 VAL A 2 112.409 16.978 12.737 1.00 0.00 H new ATOM 0 HG23 VAL A 2 111.310 16.720 14.113 1.00 0.00 H new ATOM 36 N LYS A 3 114.461 17.967 14.169 1.00 0.00 N ATOM 37 CA LYS A 3 115.848 17.672 13.692 1.00 0.00 C ATOM 38 C LYS A 3 115.802 16.710 12.501 1.00 0.00 C ATOM 39 O LYS A 3 115.243 15.631 12.599 1.00 0.00 O ATOM 40 CB LYS A 3 116.556 17.020 14.881 1.00 0.00 C ATOM 41 CG LYS A 3 118.053 16.905 14.585 1.00 0.00 C ATOM 42 CD LYS A 3 118.752 16.203 15.750 1.00 0.00 C ATOM 43 CE LYS A 3 120.267 16.237 15.534 1.00 0.00 C ATOM 44 NZ LYS A 3 120.852 16.164 16.901 1.00 0.00 N ATOM 0 H LYS A 3 114.086 17.288 14.831 1.00 0.00 H new ATOM 0 HA LYS A 3 116.366 18.571 13.358 1.00 0.00 H new ATOM 0 HB2 LYS A 3 116.397 17.613 15.782 1.00 0.00 H new ATOM 0 HB3 LYS A 3 116.135 16.033 15.071 1.00 0.00 H new ATOM 0 HG2 LYS A 3 118.210 16.346 13.663 1.00 0.00 H new ATOM 0 HG3 LYS A 3 118.482 17.896 14.434 1.00 0.00 H new ATOM 0 HD2 LYS A 3 118.497 16.694 16.689 1.00 0.00 H new ATOM 0 HD3 LYS A 3 118.408 15.171 15.826 1.00 0.00 H new ATOM 0 HE2 LYS A 3 120.597 15.400 14.918 1.00 0.00 H new ATOM 0 HE3 LYS A 3 120.572 17.150 15.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 121.890 16.182 16.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 120.526 16.977 17.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 120.550 15.282 17.361 1.00 0.00 H new ATOM 58 N LEU A 4 116.384 17.102 11.390 1.00 0.00 N ATOM 59 CA LEU A 4 116.372 16.248 10.163 1.00 0.00 C ATOM 60 C LEU A 4 117.778 15.718 9.869 1.00 0.00 C ATOM 61 O LEU A 4 118.762 16.338 10.234 1.00 0.00 O ATOM 62 CB LEU A 4 115.904 17.172 9.037 1.00 0.00 C ATOM 63 CG LEU A 4 114.447 17.579 9.268 1.00 0.00 C ATOM 64 CD1 LEU A 4 114.080 18.722 8.320 1.00 0.00 C ATOM 65 CD2 LEU A 4 113.534 16.381 8.995 1.00 0.00 C ATOM 0 H LEU A 4 116.873 17.991 11.283 1.00 0.00 H new ATOM 0 HA LEU A 4 115.722 15.380 10.275 1.00 0.00 H new ATOM 0 HB2 LEU A 4 116.536 18.059 8.996 1.00 0.00 H new ATOM 0 HB3 LEU A 4 116.001 16.667 8.076 1.00 0.00 H new ATOM 0 HG LEU A 4 114.321 17.907 10.300 1.00 0.00 H new ATOM 0 HD11 LEU A 4 113.042 19.012 8.484 1.00 0.00 H new ATOM 0 HD12 LEU A 4 114.730 19.576 8.511 1.00 0.00 H new ATOM 0 HD13 LEU A 4 114.206 18.394 7.288 1.00 0.00 H new ATOM 0 HD21 LEU A 4 112.496 16.670 9.159 1.00 0.00 H new ATOM 0 HD22 LEU A 4 113.661 16.055 7.963 1.00 0.00 H new ATOM 0 HD23 LEU A 4 113.794 15.564 9.668 1.00 0.00 H new ATOM 77 N MET A 5 117.867 14.581 9.216 1.00 0.00 N ATOM 78 CA MET A 5 119.192 14.000 8.841 1.00 0.00 C ATOM 79 C MET A 5 119.230 13.721 7.336 1.00 0.00 C ATOM 80 O MET A 5 118.223 13.363 6.749 1.00 0.00 O ATOM 81 CB MET A 5 119.298 12.697 9.634 1.00 0.00 C ATOM 82 CG MET A 5 120.731 12.169 9.561 1.00 0.00 C ATOM 83 SD MET A 5 121.772 13.088 10.723 1.00 0.00 S ATOM 84 CE MET A 5 123.344 12.848 9.858 1.00 0.00 C ATOM 0 H MET A 5 117.063 14.025 8.924 1.00 0.00 H new ATOM 0 HA MET A 5 120.019 14.674 9.064 1.00 0.00 H new ATOM 0 HB2 MET A 5 119.015 12.867 10.673 1.00 0.00 H new ATOM 0 HB3 MET A 5 118.606 11.957 9.232 1.00 0.00 H new ATOM 0 HG2 MET A 5 120.751 11.106 9.801 1.00 0.00 H new ATOM 0 HG3 MET A 5 121.118 12.275 8.547 1.00 0.00 H new ATOM 0 HE1 MET A 5 124.143 13.343 10.411 1.00 0.00 H new ATOM 0 HE2 MET A 5 123.560 11.782 9.784 1.00 0.00 H new ATOM 0 HE3 MET A 5 123.277 13.275 8.857 1.00 0.00 H new ATOM 94 N ILE A 6 120.381 13.882 6.724 1.00 0.00 N ATOM 95 CA ILE A 6 120.496 13.732 5.237 1.00 0.00 C ATOM 96 C ILE A 6 121.635 12.759 4.914 1.00 0.00 C ATOM 97 O ILE A 6 122.703 12.844 5.496 1.00 0.00 O ATOM 98 CB ILE A 6 120.818 15.137 4.684 1.00 0.00 C ATOM 99 CG1 ILE A 6 119.798 16.199 5.153 1.00 0.00 C ATOM 100 CG2 ILE A 6 120.842 15.107 3.150 1.00 0.00 C ATOM 101 CD1 ILE A 6 118.363 15.830 4.754 1.00 0.00 C ATOM 0 H ILE A 6 121.255 14.113 7.197 1.00 0.00 H new ATOM 0 HA ILE A 6 119.580 13.339 4.794 1.00 0.00 H new ATOM 0 HB ILE A 6 121.798 15.415 5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 6 119.857 16.306 6.236 1.00 0.00 H new ATOM 0 HG13 ILE A 6 120.057 17.166 4.722 1.00 0.00 H new ATOM 0 HG21 ILE A 6 121.070 16.103 2.770 1.00 0.00 H new ATOM 0 HG22 ILE A 6 121.605 14.406 2.812 1.00 0.00 H new ATOM 0 HG23 ILE A 6 119.868 14.791 2.777 1.00 0.00 H new ATOM 0 HD11 ILE A 6 117.678 16.603 5.103 1.00 0.00 H new ATOM 0 HD12 ILE A 6 118.296 15.749 3.669 1.00 0.00 H new ATOM 0 HD13 ILE A 6 118.094 14.876 5.206 1.00 0.00 H new ATOM 113 N ILE A 7 121.408 11.845 3.998 1.00 0.00 N ATOM 114 CA ILE A 7 122.517 10.973 3.487 1.00 0.00 C ATOM 115 C ILE A 7 122.497 10.981 1.952 1.00 0.00 C ATOM 116 O ILE A 7 121.445 11.093 1.349 1.00 0.00 O ATOM 117 CB ILE A 7 122.259 9.560 4.049 1.00 0.00 C ATOM 118 CG1 ILE A 7 122.234 9.595 5.584 1.00 0.00 C ATOM 119 CG2 ILE A 7 123.378 8.605 3.607 1.00 0.00 C ATOM 120 CD1 ILE A 7 121.688 8.272 6.130 1.00 0.00 C ATOM 0 H ILE A 7 120.495 11.664 3.580 1.00 0.00 H new ATOM 0 HA ILE A 7 123.499 11.325 3.802 1.00 0.00 H new ATOM 0 HB ILE A 7 121.298 9.213 3.669 1.00 0.00 H new ATOM 0 HG12 ILE A 7 123.239 9.769 5.968 1.00 0.00 H new ATOM 0 HG13 ILE A 7 121.614 10.423 5.927 1.00 0.00 H new ATOM 0 HG21 ILE A 7 123.187 7.610 4.009 1.00 0.00 H new ATOM 0 HG22 ILE A 7 123.407 8.557 2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 7 124.335 8.969 3.980 1.00 0.00 H new ATOM 0 HD11 ILE A 7 121.674 8.306 7.219 1.00 0.00 H new ATOM 0 HD12 ILE A 7 120.675 8.116 5.759 1.00 0.00 H new ATOM 0 HD13 ILE A 7 122.326 7.452 5.801 1.00 0.00 H new ATOM 132 N GLU A 8 123.652 10.868 1.335 1.00 0.00 N ATOM 133 CA GLU A 8 123.736 10.842 -0.159 1.00 0.00 C ATOM 134 C GLU A 8 124.137 9.447 -0.647 1.00 0.00 C ATOM 135 O GLU A 8 124.928 8.774 -0.009 1.00 0.00 O ATOM 136 CB GLU A 8 124.820 11.863 -0.514 1.00 0.00 C ATOM 137 CG GLU A 8 124.336 13.272 -0.165 1.00 0.00 C ATOM 138 CD GLU A 8 125.389 14.295 -0.594 1.00 0.00 C ATOM 139 OE1 GLU A 8 125.314 14.756 -1.721 1.00 0.00 O ATOM 140 OE2 GLU A 8 126.253 14.600 0.212 1.00 0.00 O ATOM 0 H GLU A 8 124.550 10.792 1.812 1.00 0.00 H new ATOM 0 HA GLU A 8 122.781 11.079 -0.627 1.00 0.00 H new ATOM 0 HB2 GLU A 8 125.737 11.638 0.030 1.00 0.00 H new ATOM 0 HB3 GLU A 8 125.057 11.802 -1.576 1.00 0.00 H new ATOM 0 HG2 GLU A 8 123.390 13.477 -0.665 1.00 0.00 H new ATOM 0 HG3 GLU A 8 124.153 13.350 0.907 1.00 0.00 H new ATOM 147 N GLY A 9 123.594 9.021 -1.766 1.00 0.00 N ATOM 148 CA GLY A 9 123.942 7.684 -2.339 1.00 0.00 C ATOM 149 C GLY A 9 124.117 7.805 -3.856 1.00 0.00 C ATOM 150 O GLY A 9 123.523 8.667 -4.479 1.00 0.00 O ATOM 0 H GLY A 9 122.916 9.553 -2.311 1.00 0.00 H new ATOM 0 HA2 GLY A 9 124.860 7.311 -1.885 1.00 0.00 H new ATOM 0 HA3 GLY A 9 123.157 6.963 -2.110 1.00 0.00 H new ATOM 154 N GLU A 10 124.925 6.947 -4.439 1.00 0.00 N ATOM 155 CA GLU A 10 125.164 6.990 -5.915 1.00 0.00 C ATOM 156 C GLU A 10 124.432 5.836 -6.607 1.00 0.00 C ATOM 157 O GLU A 10 124.389 4.733 -6.092 1.00 0.00 O ATOM 158 CB GLU A 10 126.677 6.841 -6.089 1.00 0.00 C ATOM 159 CG GLU A 10 127.055 7.139 -7.542 1.00 0.00 C ATOM 160 CD GLU A 10 128.544 6.857 -7.755 1.00 0.00 C ATOM 161 OE1 GLU A 10 129.005 5.826 -7.293 1.00 0.00 O ATOM 162 OE2 GLU A 10 129.199 7.680 -8.375 1.00 0.00 O ATOM 0 H GLU A 10 125.433 6.212 -3.947 1.00 0.00 H new ATOM 0 HA GLU A 10 124.795 7.915 -6.358 1.00 0.00 H new ATOM 0 HB2 GLU A 10 127.200 7.523 -5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 10 126.987 5.831 -5.821 1.00 0.00 H new ATOM 0 HG2 GLU A 10 126.458 6.525 -8.217 1.00 0.00 H new ATOM 0 HG3 GLU A 10 126.834 8.180 -7.779 1.00 0.00 H new ATOM 169 N VAL A 11 123.862 6.095 -7.764 1.00 0.00 N ATOM 170 CA VAL A 11 123.115 5.036 -8.530 1.00 0.00 C ATOM 171 C VAL A 11 124.077 3.911 -8.942 1.00 0.00 C ATOM 172 O VAL A 11 125.059 4.160 -9.616 1.00 0.00 O ATOM 173 CB VAL A 11 122.531 5.718 -9.787 1.00 0.00 C ATOM 174 CG1 VAL A 11 121.654 4.731 -10.568 1.00 0.00 C ATOM 175 CG2 VAL A 11 121.670 6.930 -9.402 1.00 0.00 C ATOM 0 H VAL A 11 123.882 7.008 -8.218 1.00 0.00 H new ATOM 0 HA VAL A 11 122.324 4.597 -7.921 1.00 0.00 H new ATOM 0 HB VAL A 11 123.368 6.046 -10.403 1.00 0.00 H new ATOM 0 HG11 VAL A 11 121.249 5.225 -11.451 1.00 0.00 H new ATOM 0 HG12 VAL A 11 122.254 3.874 -10.874 1.00 0.00 H new ATOM 0 HG13 VAL A 11 120.835 4.392 -9.934 1.00 0.00 H new ATOM 0 HG21 VAL A 11 121.270 7.393 -10.304 1.00 0.00 H new ATOM 0 HG22 VAL A 11 120.847 6.604 -8.766 1.00 0.00 H new ATOM 0 HG23 VAL A 11 122.281 7.654 -8.863 1.00 0.00 H new ATOM 185 N VAL A 12 123.789 2.696 -8.541 1.00 0.00 N ATOM 186 CA VAL A 12 124.582 1.513 -9.010 1.00 0.00 C ATOM 187 C VAL A 12 123.636 0.422 -9.529 1.00 0.00 C ATOM 188 O VAL A 12 122.616 0.151 -8.920 1.00 0.00 O ATOM 189 CB VAL A 12 125.389 1.016 -7.798 1.00 0.00 C ATOM 190 CG1 VAL A 12 126.383 2.097 -7.366 1.00 0.00 C ATOM 191 CG2 VAL A 12 124.475 0.675 -6.612 1.00 0.00 C ATOM 0 H VAL A 12 123.028 2.470 -7.900 1.00 0.00 H new ATOM 0 HA VAL A 12 125.250 1.777 -9.830 1.00 0.00 H new ATOM 0 HB VAL A 12 125.917 0.110 -8.097 1.00 0.00 H new ATOM 0 HG11 VAL A 12 126.954 1.744 -6.507 1.00 0.00 H new ATOM 0 HG12 VAL A 12 127.063 2.316 -8.189 1.00 0.00 H new ATOM 0 HG13 VAL A 12 125.840 3.002 -7.093 1.00 0.00 H new ATOM 0 HG21 VAL A 12 125.080 0.328 -5.775 1.00 0.00 H new ATOM 0 HG22 VAL A 12 123.919 1.564 -6.314 1.00 0.00 H new ATOM 0 HG23 VAL A 12 123.776 -0.109 -6.905 1.00 0.00 H new ATOM 201 N SER A 13 123.975 -0.192 -10.640 1.00 0.00 N ATOM 202 CA SER A 13 123.101 -1.254 -11.233 1.00 0.00 C ATOM 203 C SER A 13 123.434 -2.617 -10.622 1.00 0.00 C ATOM 204 O SER A 13 124.416 -3.237 -10.991 1.00 0.00 O ATOM 205 CB SER A 13 123.405 -1.253 -12.733 1.00 0.00 C ATOM 206 OG SER A 13 124.764 -1.618 -12.936 1.00 0.00 O ATOM 0 H SER A 13 124.828 0.000 -11.165 1.00 0.00 H new ATOM 0 HA SER A 13 122.046 -1.063 -11.038 1.00 0.00 H new ATOM 0 HB2 SER A 13 122.747 -1.952 -13.250 1.00 0.00 H new ATOM 0 HB3 SER A 13 123.215 -0.266 -13.154 1.00 0.00 H new ATOM 0 HG SER A 13 124.944 -2.472 -12.490 1.00 0.00 H new ATOM 212 N GLY A 14 122.622 -3.075 -9.695 1.00 0.00 N ATOM 213 CA GLY A 14 122.832 -4.418 -9.074 1.00 0.00 C ATOM 214 C GLY A 14 121.615 -4.785 -8.221 1.00 0.00 C ATOM 215 O GLY A 14 120.726 -3.976 -8.030 1.00 0.00 O ATOM 0 H GLY A 14 121.813 -2.565 -9.340 1.00 0.00 H new ATOM 0 HA2 GLY A 14 122.985 -5.169 -9.849 1.00 0.00 H new ATOM 0 HA3 GLY A 14 123.731 -4.408 -8.458 1.00 0.00 H new ATOM 219 N LEU A 15 121.581 -5.999 -7.716 1.00 0.00 N ATOM 220 CA LEU A 15 120.502 -6.418 -6.771 1.00 0.00 C ATOM 221 C LEU A 15 121.119 -6.875 -5.447 1.00 0.00 C ATOM 222 O LEU A 15 122.272 -7.266 -5.404 1.00 0.00 O ATOM 223 CB LEU A 15 119.781 -7.575 -7.467 1.00 0.00 C ATOM 224 CG LEU A 15 119.050 -7.056 -8.707 1.00 0.00 C ATOM 225 CD1 LEU A 15 118.580 -8.239 -9.556 1.00 0.00 C ATOM 226 CD2 LEU A 15 117.834 -6.227 -8.278 1.00 0.00 C ATOM 0 H LEU A 15 122.267 -6.724 -7.924 1.00 0.00 H new ATOM 0 HA LEU A 15 119.815 -5.605 -6.538 1.00 0.00 H new ATOM 0 HB2 LEU A 15 120.498 -8.345 -7.752 1.00 0.00 H new ATOM 0 HB3 LEU A 15 119.071 -8.039 -6.782 1.00 0.00 H new ATOM 0 HG LEU A 15 119.728 -6.433 -9.290 1.00 0.00 H new ATOM 0 HD11 LEU A 15 118.059 -7.869 -10.439 1.00 0.00 H new ATOM 0 HD12 LEU A 15 119.442 -8.831 -9.864 1.00 0.00 H new ATOM 0 HD13 LEU A 15 117.903 -8.861 -8.970 1.00 0.00 H new ATOM 0 HD21 LEU A 15 117.315 -5.858 -9.163 1.00 0.00 H new ATOM 0 HD22 LEU A 15 117.157 -6.850 -7.693 1.00 0.00 H new ATOM 0 HD23 LEU A 15 118.164 -5.383 -7.673 1.00 0.00 H new ATOM 238 N GLY A 16 120.355 -6.829 -4.378 1.00 0.00 N ATOM 239 CA GLY A 16 120.909 -7.090 -3.013 1.00 0.00 C ATOM 240 C GLY A 16 121.359 -8.549 -2.890 1.00 0.00 C ATOM 241 O GLY A 16 122.388 -8.828 -2.299 1.00 0.00 O ATOM 0 H GLY A 16 119.357 -6.618 -4.397 1.00 0.00 H new ATOM 0 HA2 GLY A 16 121.752 -6.425 -2.822 1.00 0.00 H new ATOM 0 HA3 GLY A 16 120.153 -6.871 -2.259 1.00 0.00 H new ATOM 245 N GLU A 17 120.597 -9.466 -3.443 1.00 0.00 N ATOM 246 CA GLU A 17 120.945 -10.919 -3.359 1.00 0.00 C ATOM 247 C GLU A 17 120.154 -11.718 -4.399 1.00 0.00 C ATOM 248 O GLU A 17 118.991 -12.019 -4.193 1.00 0.00 O ATOM 249 CB GLU A 17 120.549 -11.349 -1.944 1.00 0.00 C ATOM 250 CG GLU A 17 121.088 -12.753 -1.662 1.00 0.00 C ATOM 251 CD GLU A 17 120.599 -13.224 -0.291 1.00 0.00 C ATOM 252 OE1 GLU A 17 120.669 -12.443 0.643 1.00 0.00 O ATOM 253 OE2 GLU A 17 120.163 -14.360 -0.198 1.00 0.00 O ATOM 0 H GLU A 17 119.738 -9.264 -3.955 1.00 0.00 H new ATOM 0 HA GLU A 17 122.002 -11.096 -3.557 1.00 0.00 H new ATOM 0 HB2 GLU A 17 120.946 -10.643 -1.214 1.00 0.00 H new ATOM 0 HB3 GLU A 17 119.464 -11.338 -1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 17 120.754 -13.444 -2.436 1.00 0.00 H new ATOM 0 HG3 GLU A 17 122.178 -12.747 -1.689 1.00 0.00 H new ATOM 260 N GLY A 18 120.781 -12.053 -5.504 1.00 0.00 N ATOM 261 CA GLY A 18 120.119 -12.892 -6.552 1.00 0.00 C ATOM 262 C GLY A 18 118.982 -12.102 -7.207 1.00 0.00 C ATOM 263 O GLY A 18 119.117 -10.918 -7.460 1.00 0.00 O ATOM 0 H GLY A 18 121.737 -11.775 -5.725 1.00 0.00 H new ATOM 0 HA2 GLY A 18 120.848 -13.191 -7.306 1.00 0.00 H new ATOM 0 HA3 GLY A 18 119.729 -13.807 -6.106 1.00 0.00 H new ATOM 267 N ARG A 19 117.875 -12.757 -7.475 1.00 0.00 N ATOM 268 CA ARG A 19 116.702 -12.074 -8.105 1.00 0.00 C ATOM 269 C ARG A 19 115.391 -12.582 -7.492 1.00 0.00 C ATOM 270 O ARG A 19 115.283 -13.742 -7.134 1.00 0.00 O ATOM 271 CB ARG A 19 116.786 -12.395 -9.608 1.00 0.00 C ATOM 272 CG ARG A 19 116.740 -13.909 -9.867 1.00 0.00 C ATOM 273 CD ARG A 19 117.102 -14.189 -11.329 1.00 0.00 C ATOM 274 NE ARG A 19 116.921 -15.667 -11.521 1.00 0.00 N ATOM 275 CZ ARG A 19 117.560 -16.347 -12.454 1.00 0.00 C ATOM 276 NH1 ARG A 19 118.384 -15.791 -13.311 1.00 0.00 N ATOM 277 NH2 ARG A 19 117.353 -17.633 -12.535 1.00 0.00 N ATOM 0 H ARG A 19 117.735 -13.748 -7.281 1.00 0.00 H new ATOM 0 HA ARG A 19 116.720 -10.997 -7.937 1.00 0.00 H new ATOM 0 HB2 ARG A 19 115.961 -11.911 -10.131 1.00 0.00 H new ATOM 0 HB3 ARG A 19 117.708 -11.983 -10.018 1.00 0.00 H new ATOM 0 HG2 ARG A 19 117.436 -14.423 -9.204 1.00 0.00 H new ATOM 0 HG3 ARG A 19 115.745 -14.296 -9.647 1.00 0.00 H new ATOM 0 HD2 ARG A 19 116.459 -13.626 -12.005 1.00 0.00 H new ATOM 0 HD3 ARG A 19 118.128 -13.890 -11.542 1.00 0.00 H new ATOM 0 HE ARG A 19 116.278 -16.166 -10.906 1.00 0.00 H new ATOM 0 HH11 ARG A 19 118.556 -14.786 -13.275 1.00 0.00 H new ATOM 0 HH12 ARG A 19 118.853 -16.364 -14.013 1.00 0.00 H new ATOM 0 HH21 ARG A 19 116.710 -18.088 -11.887 1.00 0.00 H new ATOM 0 HH22 ARG A 19 117.834 -18.183 -13.247 1.00 0.00 H new ATOM 291 N TYR A 20 114.410 -11.717 -7.376 1.00 0.00 N ATOM 292 CA TYR A 20 113.079 -12.117 -6.820 1.00 0.00 C ATOM 293 C TYR A 20 111.957 -11.355 -7.531 1.00 0.00 C ATOM 294 O TYR A 20 112.200 -10.335 -8.151 1.00 0.00 O ATOM 295 CB TYR A 20 113.125 -11.758 -5.330 1.00 0.00 C ATOM 296 CG TYR A 20 113.429 -10.304 -5.045 1.00 0.00 C ATOM 297 CD1 TYR A 20 112.446 -9.298 -5.300 1.00 0.00 C ATOM 298 CD2 TYR A 20 114.704 -9.938 -4.514 1.00 0.00 C ATOM 299 CE1 TYR A 20 112.739 -7.926 -5.024 1.00 0.00 C ATOM 300 CE2 TYR A 20 114.998 -8.566 -4.239 1.00 0.00 C ATOM 301 CZ TYR A 20 114.015 -7.561 -4.494 1.00 0.00 C ATOM 302 OH TYR A 20 114.299 -6.238 -4.226 1.00 0.00 O ATOM 0 H TYR A 20 114.478 -10.736 -7.648 1.00 0.00 H new ATOM 0 HA TYR A 20 112.881 -13.179 -6.965 1.00 0.00 H new ATOM 0 HB2 TYR A 20 112.166 -12.011 -4.878 1.00 0.00 H new ATOM 0 HB3 TYR A 20 113.879 -12.376 -4.843 1.00 0.00 H new ATOM 0 HD1 TYR A 20 111.482 -9.574 -5.701 1.00 0.00 H new ATOM 0 HD2 TYR A 20 115.446 -10.698 -4.320 1.00 0.00 H new ATOM 0 HE1 TYR A 20 111.996 -7.166 -5.216 1.00 0.00 H new ATOM 0 HE2 TYR A 20 115.962 -8.290 -3.839 1.00 0.00 H new ATOM 0 HH TYR A 20 115.209 -6.164 -3.869 1.00 0.00 H new ATOM 312 N PHE A 21 110.744 -11.849 -7.436 1.00 0.00 N ATOM 313 CA PHE A 21 109.600 -11.241 -8.182 1.00 0.00 C ATOM 314 C PHE A 21 108.682 -10.471 -7.228 1.00 0.00 C ATOM 315 O PHE A 21 108.284 -10.988 -6.198 1.00 0.00 O ATOM 316 CB PHE A 21 108.857 -12.427 -8.800 1.00 0.00 C ATOM 317 CG PHE A 21 109.682 -13.200 -9.799 1.00 0.00 C ATOM 318 CD1 PHE A 21 110.487 -14.299 -9.365 1.00 0.00 C ATOM 319 CD2 PHE A 21 109.660 -12.833 -11.181 1.00 0.00 C ATOM 320 CE1 PHE A 21 111.269 -15.031 -10.312 1.00 0.00 C ATOM 321 CE2 PHE A 21 110.441 -13.565 -12.128 1.00 0.00 C ATOM 322 CZ PHE A 21 111.246 -14.664 -11.693 1.00 0.00 C ATOM 0 H PHE A 21 110.498 -12.658 -6.865 1.00 0.00 H new ATOM 0 HA PHE A 21 109.936 -10.528 -8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 21 108.539 -13.101 -8.004 1.00 0.00 H new ATOM 0 HB3 PHE A 21 107.954 -12.064 -9.290 1.00 0.00 H new ATOM 0 HD1 PHE A 21 110.504 -14.576 -8.321 1.00 0.00 H new ATOM 0 HD2 PHE A 21 109.053 -12.002 -11.509 1.00 0.00 H new ATOM 0 HE1 PHE A 21 111.877 -15.861 -9.984 1.00 0.00 H new ATOM 0 HE2 PHE A 21 110.423 -13.288 -13.172 1.00 0.00 H new ATOM 0 HZ PHE A 21 111.837 -15.217 -12.408 1.00 0.00 H new ATOM 332 N LEU A 22 108.353 -9.248 -7.573 1.00 0.00 N ATOM 333 CA LEU A 22 107.400 -8.434 -6.754 1.00 0.00 C ATOM 334 C LEU A 22 105.970 -8.541 -7.303 1.00 0.00 C ATOM 335 O LEU A 22 105.016 -8.404 -6.557 1.00 0.00 O ATOM 336 CB LEU A 22 107.909 -6.994 -6.859 1.00 0.00 C ATOM 337 CG LEU A 22 109.167 -6.832 -6.004 1.00 0.00 C ATOM 338 CD1 LEU A 22 109.854 -5.510 -6.352 1.00 0.00 C ATOM 339 CD2 LEU A 22 108.780 -6.830 -4.524 1.00 0.00 C ATOM 0 H LEU A 22 108.711 -8.773 -8.401 1.00 0.00 H new ATOM 0 HA LEU A 22 107.360 -8.781 -5.722 1.00 0.00 H new ATOM 0 HB2 LEU A 22 108.129 -6.750 -7.898 1.00 0.00 H new ATOM 0 HB3 LEU A 22 107.138 -6.300 -6.525 1.00 0.00 H new ATOM 0 HG LEU A 22 109.849 -7.659 -6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 22 110.750 -5.394 -5.743 1.00 0.00 H new ATOM 0 HD12 LEU A 22 110.129 -5.510 -7.407 1.00 0.00 H new ATOM 0 HD13 LEU A 22 109.172 -4.683 -6.155 1.00 0.00 H new ATOM 0 HD21 LEU A 22 109.676 -6.715 -3.914 1.00 0.00 H new ATOM 0 HD22 LEU A 22 108.098 -6.003 -4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 22 108.290 -7.771 -4.275 1.00 0.00 H new ATOM 351 N SER A 23 105.822 -8.784 -8.588 1.00 0.00 N ATOM 352 CA SER A 23 104.457 -8.847 -9.219 1.00 0.00 C ATOM 353 C SER A 23 103.584 -9.947 -8.596 1.00 0.00 C ATOM 354 O SER A 23 102.371 -9.880 -8.679 1.00 0.00 O ATOM 355 CB SER A 23 104.684 -9.147 -10.705 1.00 0.00 C ATOM 356 OG SER A 23 105.197 -10.464 -10.844 1.00 0.00 O ATOM 0 H SER A 23 106.596 -8.943 -9.233 1.00 0.00 H new ATOM 0 HA SER A 23 103.930 -7.906 -9.062 1.00 0.00 H new ATOM 0 HB2 SER A 23 103.748 -9.049 -11.255 1.00 0.00 H new ATOM 0 HB3 SER A 23 105.381 -8.426 -11.131 1.00 0.00 H new ATOM 0 HG SER A 23 105.342 -10.660 -11.793 1.00 0.00 H new ATOM 362 N LEU A 24 104.185 -10.946 -7.979 1.00 0.00 N ATOM 363 CA LEU A 24 103.392 -12.070 -7.369 1.00 0.00 C ATOM 364 C LEU A 24 102.466 -11.544 -6.256 1.00 0.00 C ATOM 365 O LEU A 24 102.760 -10.513 -5.681 1.00 0.00 O ATOM 366 CB LEU A 24 104.414 -13.051 -6.783 1.00 0.00 C ATOM 367 CG LEU A 24 104.969 -13.939 -7.898 1.00 0.00 C ATOM 368 CD1 LEU A 24 106.242 -14.634 -7.414 1.00 0.00 C ATOM 369 CD2 LEU A 24 103.926 -14.993 -8.275 1.00 0.00 C ATOM 0 H LEU A 24 105.196 -11.030 -7.872 1.00 0.00 H new ATOM 0 HA LEU A 24 102.759 -12.549 -8.116 1.00 0.00 H new ATOM 0 HB2 LEU A 24 105.225 -12.504 -6.302 1.00 0.00 H new ATOM 0 HB3 LEU A 24 103.945 -13.665 -6.014 1.00 0.00 H new ATOM 0 HG LEU A 24 105.200 -13.326 -8.769 1.00 0.00 H new ATOM 0 HD11 LEU A 24 106.636 -15.266 -8.210 1.00 0.00 H new ATOM 0 HD12 LEU A 24 106.986 -13.884 -7.144 1.00 0.00 H new ATOM 0 HD13 LEU A 24 106.013 -15.248 -6.543 1.00 0.00 H new ATOM 0 HD21 LEU A 24 104.320 -15.627 -9.070 1.00 0.00 H new ATOM 0 HD22 LEU A 24 103.696 -15.605 -7.403 1.00 0.00 H new ATOM 0 HD23 LEU A 24 103.018 -14.499 -8.621 1.00 0.00 H new ATOM 381 N PRO A 25 101.381 -12.250 -5.974 1.00 0.00 N ATOM 382 CA PRO A 25 100.343 -11.729 -5.027 1.00 0.00 C ATOM 383 C PRO A 25 100.909 -11.370 -3.638 1.00 0.00 C ATOM 384 O PRO A 25 100.712 -10.247 -3.210 1.00 0.00 O ATOM 385 CB PRO A 25 99.338 -12.877 -4.930 1.00 0.00 C ATOM 386 CG PRO A 25 99.507 -13.595 -6.223 1.00 0.00 C ATOM 387 CD PRO A 25 100.984 -13.584 -6.477 1.00 0.00 C ATOM 0 HA PRO A 25 99.909 -10.795 -5.385 1.00 0.00 H new ATOM 0 HB2 PRO A 25 99.550 -13.525 -4.080 1.00 0.00 H new ATOM 0 HB3 PRO A 25 98.319 -12.510 -4.805 1.00 0.00 H new ATOM 0 HG2 PRO A 25 99.124 -14.614 -6.163 1.00 0.00 H new ATOM 0 HG3 PRO A 25 98.964 -13.097 -7.026 1.00 0.00 H new ATOM 0 HD2 PRO A 25 101.494 -14.387 -5.945 1.00 0.00 H new ATOM 0 HD3 PRO A 25 101.216 -13.705 -7.535 1.00 0.00 H new ATOM 395 N PRO A 26 101.591 -12.287 -2.961 1.00 0.00 N ATOM 396 CA PRO A 26 101.891 -12.082 -1.509 1.00 0.00 C ATOM 397 C PRO A 26 102.768 -10.839 -1.293 1.00 0.00 C ATOM 398 O PRO A 26 102.544 -10.081 -0.365 1.00 0.00 O ATOM 399 CB PRO A 26 102.627 -13.358 -1.089 1.00 0.00 C ATOM 400 CG PRO A 26 103.115 -13.968 -2.358 1.00 0.00 C ATOM 401 CD PRO A 26 102.153 -13.566 -3.438 1.00 0.00 C ATOM 0 HA PRO A 26 100.989 -11.911 -0.921 1.00 0.00 H new ATOM 0 HB2 PRO A 26 103.455 -13.131 -0.418 1.00 0.00 H new ATOM 0 HB3 PRO A 26 101.962 -14.038 -0.556 1.00 0.00 H new ATOM 0 HG2 PRO A 26 104.122 -13.621 -2.590 1.00 0.00 H new ATOM 0 HG3 PRO A 26 103.164 -15.053 -2.270 1.00 0.00 H new ATOM 0 HD2 PRO A 26 102.657 -13.447 -4.397 1.00 0.00 H new ATOM 0 HD3 PRO A 26 101.375 -14.316 -3.578 1.00 0.00 H new ATOM 409 N TYR A 27 103.748 -10.634 -2.146 1.00 0.00 N ATOM 410 CA TYR A 27 104.666 -9.454 -1.999 1.00 0.00 C ATOM 411 C TYR A 27 103.898 -8.146 -2.215 1.00 0.00 C ATOM 412 O TYR A 27 104.058 -7.204 -1.462 1.00 0.00 O ATOM 413 CB TYR A 27 105.751 -9.610 -3.070 1.00 0.00 C ATOM 414 CG TYR A 27 106.643 -10.809 -2.855 1.00 0.00 C ATOM 415 CD1 TYR A 27 107.297 -10.997 -1.598 1.00 0.00 C ATOM 416 CD2 TYR A 27 106.836 -11.753 -3.910 1.00 0.00 C ATOM 417 CE1 TYR A 27 108.144 -12.131 -1.397 1.00 0.00 C ATOM 418 CE2 TYR A 27 107.683 -12.887 -3.709 1.00 0.00 C ATOM 419 CZ TYR A 27 108.337 -13.076 -2.452 1.00 0.00 C ATOM 420 OH TYR A 27 109.154 -14.171 -2.257 1.00 0.00 O ATOM 0 H TYR A 27 103.952 -11.237 -2.943 1.00 0.00 H new ATOM 0 HA TYR A 27 105.097 -9.418 -0.999 1.00 0.00 H new ATOM 0 HB2 TYR A 27 105.276 -9.691 -4.048 1.00 0.00 H new ATOM 0 HB3 TYR A 27 106.365 -8.709 -3.088 1.00 0.00 H new ATOM 0 HD1 TYR A 27 107.151 -10.283 -0.801 1.00 0.00 H new ATOM 0 HD2 TYR A 27 106.342 -11.610 -4.860 1.00 0.00 H new ATOM 0 HE1 TYR A 27 108.638 -12.274 -0.447 1.00 0.00 H new ATOM 0 HE2 TYR A 27 107.829 -13.601 -4.506 1.00 0.00 H new ATOM 0 HH TYR A 27 108.614 -14.933 -1.960 1.00 0.00 H new ATOM 430 N LYS A 28 103.066 -8.095 -3.232 1.00 0.00 N ATOM 431 CA LYS A 28 102.323 -6.831 -3.559 1.00 0.00 C ATOM 432 C LYS A 28 101.332 -6.489 -2.441 1.00 0.00 C ATOM 433 O LYS A 28 101.205 -5.340 -2.059 1.00 0.00 O ATOM 434 CB LYS A 28 101.576 -7.098 -4.870 1.00 0.00 C ATOM 435 CG LYS A 28 101.021 -5.784 -5.424 1.00 0.00 C ATOM 436 CD LYS A 28 100.251 -6.063 -6.716 1.00 0.00 C ATOM 437 CE LYS A 28 99.973 -4.744 -7.442 1.00 0.00 C ATOM 438 NZ LYS A 28 101.214 -4.464 -8.217 1.00 0.00 N ATOM 0 H LYS A 28 102.869 -8.879 -3.853 1.00 0.00 H new ATOM 0 HA LYS A 28 103.005 -5.986 -3.657 1.00 0.00 H new ATOM 0 HB2 LYS A 28 102.248 -7.555 -5.596 1.00 0.00 H new ATOM 0 HB3 LYS A 28 100.763 -7.804 -4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 28 100.365 -5.315 -4.690 1.00 0.00 H new ATOM 0 HG3 LYS A 28 101.835 -5.085 -5.616 1.00 0.00 H new ATOM 0 HD2 LYS A 28 100.827 -6.729 -7.358 1.00 0.00 H new ATOM 0 HD3 LYS A 28 99.313 -6.570 -6.490 1.00 0.00 H new ATOM 0 HE2 LYS A 28 99.108 -4.830 -8.099 1.00 0.00 H new ATOM 0 HE3 LYS A 28 99.759 -3.942 -6.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 101.392 -3.439 -8.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 102.018 -4.951 -7.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 101.099 -4.806 -9.192 1.00 0.00 H new ATOM 452 N GLU A 29 100.645 -7.481 -1.921 1.00 0.00 N ATOM 453 CA GLU A 29 99.590 -7.228 -0.883 1.00 0.00 C ATOM 454 C GLU A 29 100.229 -6.713 0.412 1.00 0.00 C ATOM 455 O GLU A 29 99.800 -5.706 0.952 1.00 0.00 O ATOM 456 CB GLU A 29 98.898 -8.573 -0.635 1.00 0.00 C ATOM 457 CG GLU A 29 97.643 -8.357 0.215 1.00 0.00 C ATOM 458 CD GLU A 29 97.037 -9.712 0.591 1.00 0.00 C ATOM 459 OE1 GLU A 29 97.790 -10.589 0.981 1.00 0.00 O ATOM 460 OE2 GLU A 29 95.829 -9.848 0.482 1.00 0.00 O ATOM 0 H GLU A 29 100.770 -8.462 -2.172 1.00 0.00 H new ATOM 0 HA GLU A 29 98.879 -6.473 -1.218 1.00 0.00 H new ATOM 0 HB2 GLU A 29 98.631 -9.036 -1.585 1.00 0.00 H new ATOM 0 HB3 GLU A 29 99.580 -9.256 -0.128 1.00 0.00 H new ATOM 0 HG2 GLU A 29 97.894 -7.797 1.116 1.00 0.00 H new ATOM 0 HG3 GLU A 29 96.915 -7.763 -0.338 1.00 0.00 H new ATOM 467 N ILE A 30 101.244 -7.391 0.897 1.00 0.00 N ATOM 468 CA ILE A 30 101.861 -7.007 2.210 1.00 0.00 C ATOM 469 C ILE A 30 102.596 -5.664 2.073 1.00 0.00 C ATOM 470 O ILE A 30 102.621 -4.874 2.999 1.00 0.00 O ATOM 471 CB ILE A 30 102.794 -8.166 2.608 1.00 0.00 C ATOM 472 CG1 ILE A 30 103.360 -7.914 4.009 1.00 0.00 C ATOM 473 CG2 ILE A 30 103.948 -8.336 1.610 1.00 0.00 C ATOM 474 CD1 ILE A 30 103.952 -9.214 4.557 1.00 0.00 C ATOM 0 H ILE A 30 101.673 -8.195 0.440 1.00 0.00 H new ATOM 0 HA ILE A 30 101.116 -6.858 2.991 1.00 0.00 H new ATOM 0 HB ILE A 30 102.207 -9.084 2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 30 104.126 -7.140 3.970 1.00 0.00 H new ATOM 0 HG13 ILE A 30 102.574 -7.551 4.671 1.00 0.00 H new ATOM 0 HG21 ILE A 30 104.583 -9.163 1.926 1.00 0.00 H new ATOM 0 HG22 ILE A 30 103.544 -8.546 0.619 1.00 0.00 H new ATOM 0 HG23 ILE A 30 104.537 -7.419 1.575 1.00 0.00 H new ATOM 0 HD11 ILE A 30 104.356 -9.038 5.554 1.00 0.00 H new ATOM 0 HD12 ILE A 30 103.173 -9.975 4.610 1.00 0.00 H new ATOM 0 HD13 ILE A 30 104.750 -9.557 3.898 1.00 0.00 H new ATOM 486 N PHE A 31 103.182 -5.410 0.923 1.00 0.00 N ATOM 487 CA PHE A 31 103.855 -4.089 0.670 1.00 0.00 C ATOM 488 C PHE A 31 102.822 -2.956 0.673 1.00 0.00 C ATOM 489 O PHE A 31 103.072 -1.900 1.225 1.00 0.00 O ATOM 490 CB PHE A 31 104.531 -4.208 -0.703 1.00 0.00 C ATOM 491 CG PHE A 31 105.949 -4.726 -0.633 1.00 0.00 C ATOM 492 CD1 PHE A 31 106.214 -6.013 -0.072 1.00 0.00 C ATOM 493 CD2 PHE A 31 107.026 -3.928 -1.129 1.00 0.00 C ATOM 494 CE1 PHE A 31 107.555 -6.503 -0.007 1.00 0.00 C ATOM 495 CE2 PHE A 31 108.368 -4.418 -1.064 1.00 0.00 C ATOM 496 CZ PHE A 31 108.632 -5.706 -0.504 1.00 0.00 C ATOM 0 H PHE A 31 103.224 -6.066 0.143 1.00 0.00 H new ATOM 0 HA PHE A 31 104.584 -3.857 1.446 1.00 0.00 H new ATOM 0 HB2 PHE A 31 103.940 -4.872 -1.334 1.00 0.00 H new ATOM 0 HB3 PHE A 31 104.533 -3.230 -1.184 1.00 0.00 H new ATOM 0 HD1 PHE A 31 105.400 -6.616 0.303 1.00 0.00 H new ATOM 0 HD2 PHE A 31 106.826 -2.955 -1.553 1.00 0.00 H new ATOM 0 HE1 PHE A 31 107.754 -7.476 0.418 1.00 0.00 H new ATOM 0 HE2 PHE A 31 109.182 -3.815 -1.438 1.00 0.00 H new ATOM 0 HZ PHE A 31 109.645 -6.077 -0.456 1.00 0.00 H new ATOM 506 N LYS A 32 101.677 -3.175 0.066 1.00 0.00 N ATOM 507 CA LYS A 32 100.597 -2.131 0.049 1.00 0.00 C ATOM 508 C LYS A 32 100.063 -1.880 1.463 1.00 0.00 C ATOM 509 O LYS A 32 99.670 -0.772 1.784 1.00 0.00 O ATOM 510 CB LYS A 32 99.484 -2.674 -0.854 1.00 0.00 C ATOM 511 CG LYS A 32 98.473 -1.562 -1.146 1.00 0.00 C ATOM 512 CD LYS A 32 97.362 -2.104 -2.047 1.00 0.00 C ATOM 513 CE LYS A 32 96.394 -0.974 -2.402 1.00 0.00 C ATOM 514 NZ LYS A 32 95.416 -1.587 -3.343 1.00 0.00 N ATOM 0 H LYS A 32 101.442 -4.039 -0.422 1.00 0.00 H new ATOM 0 HA LYS A 32 100.979 -1.180 -0.322 1.00 0.00 H new ATOM 0 HB2 LYS A 32 99.908 -3.048 -1.786 1.00 0.00 H new ATOM 0 HB3 LYS A 32 98.986 -3.514 -0.370 1.00 0.00 H new ATOM 0 HG2 LYS A 32 98.049 -1.188 -0.214 1.00 0.00 H new ATOM 0 HG3 LYS A 32 98.971 -0.722 -1.630 1.00 0.00 H new ATOM 0 HD2 LYS A 32 97.790 -2.528 -2.955 1.00 0.00 H new ATOM 0 HD3 LYS A 32 96.828 -2.908 -1.540 1.00 0.00 H new ATOM 0 HE2 LYS A 32 95.897 -0.586 -1.513 1.00 0.00 H new ATOM 0 HE3 LYS A 32 96.917 -0.137 -2.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 94.718 -0.872 -3.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 95.917 -1.941 -4.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 94.929 -2.376 -2.872 1.00 0.00 H new ATOM 528 N LYS A 33 100.041 -2.898 2.294 1.00 0.00 N ATOM 529 CA LYS A 33 99.580 -2.723 3.712 1.00 0.00 C ATOM 530 C LYS A 33 100.572 -1.861 4.501 1.00 0.00 C ATOM 531 O LYS A 33 100.167 -1.051 5.316 1.00 0.00 O ATOM 532 CB LYS A 33 99.494 -4.127 4.319 1.00 0.00 C ATOM 533 CG LYS A 33 98.285 -4.862 3.736 1.00 0.00 C ATOM 534 CD LYS A 33 98.111 -6.204 4.453 1.00 0.00 C ATOM 535 CE LYS A 33 96.907 -6.945 3.868 1.00 0.00 C ATOM 536 NZ LYS A 33 96.434 -7.834 4.965 1.00 0.00 N ATOM 0 H LYS A 33 100.324 -3.847 2.050 1.00 0.00 H new ATOM 0 HA LYS A 33 98.615 -2.217 3.748 1.00 0.00 H new ATOM 0 HB2 LYS A 33 100.408 -4.683 4.108 1.00 0.00 H new ATOM 0 HB3 LYS A 33 99.405 -4.061 5.403 1.00 0.00 H new ATOM 0 HG2 LYS A 33 97.386 -4.256 3.852 1.00 0.00 H new ATOM 0 HG3 LYS A 33 98.425 -5.024 2.667 1.00 0.00 H new ATOM 0 HD2 LYS A 33 99.012 -6.807 4.341 1.00 0.00 H new ATOM 0 HD3 LYS A 33 97.967 -6.041 5.521 1.00 0.00 H new ATOM 0 HE2 LYS A 33 96.127 -6.249 3.559 1.00 0.00 H new ATOM 0 HE3 LYS A 33 97.188 -7.521 2.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 95.608 -8.377 4.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 97.195 -8.490 5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 96.167 -7.257 5.788 1.00 0.00 H new ATOM 550 N ILE A 34 101.853 -2.032 4.261 1.00 0.00 N ATOM 551 CA ILE A 34 102.892 -1.281 5.042 1.00 0.00 C ATOM 552 C ILE A 34 103.040 0.135 4.469 1.00 0.00 C ATOM 553 O ILE A 34 103.200 1.085 5.215 1.00 0.00 O ATOM 554 CB ILE A 34 104.211 -2.071 4.910 1.00 0.00 C ATOM 555 CG1 ILE A 34 104.036 -3.513 5.406 1.00 0.00 C ATOM 556 CG2 ILE A 34 105.311 -1.411 5.750 1.00 0.00 C ATOM 557 CD1 ILE A 34 105.201 -4.364 4.896 1.00 0.00 C ATOM 0 H ILE A 34 102.226 -2.664 3.553 1.00 0.00 H new ATOM 0 HA ILE A 34 102.614 -1.185 6.092 1.00 0.00 H new ATOM 0 HB ILE A 34 104.488 -2.074 3.856 1.00 0.00 H new ATOM 0 HG12 ILE A 34 104.004 -3.534 6.495 1.00 0.00 H new ATOM 0 HG13 ILE A 34 103.089 -3.920 5.051 1.00 0.00 H new ATOM 0 HG21 ILE A 34 106.236 -1.978 5.648 1.00 0.00 H new ATOM 0 HG22 ILE A 34 105.471 -0.390 5.403 1.00 0.00 H new ATOM 0 HG23 ILE A 34 105.009 -1.395 6.797 1.00 0.00 H new ATOM 0 HD11 ILE A 34 105.082 -5.390 5.245 1.00 0.00 H new ATOM 0 HD12 ILE A 34 105.212 -4.351 3.806 1.00 0.00 H new ATOM 0 HD13 ILE A 34 106.140 -3.959 5.273 1.00 0.00 H new ATOM 569 N LEU A 35 102.985 0.270 3.164 1.00 0.00 N ATOM 570 CA LEU A 35 103.252 1.592 2.511 1.00 0.00 C ATOM 571 C LEU A 35 101.949 2.312 2.144 1.00 0.00 C ATOM 572 O LEU A 35 101.925 3.528 2.065 1.00 0.00 O ATOM 573 CB LEU A 35 104.028 1.267 1.232 1.00 0.00 C ATOM 574 CG LEU A 35 105.372 0.608 1.560 1.00 0.00 C ATOM 575 CD1 LEU A 35 106.005 0.093 0.266 1.00 0.00 C ATOM 576 CD2 LEU A 35 106.308 1.631 2.210 1.00 0.00 C ATOM 0 H LEU A 35 102.764 -0.487 2.518 1.00 0.00 H new ATOM 0 HA LEU A 35 103.801 2.250 3.184 1.00 0.00 H new ATOM 0 HB2 LEU A 35 103.437 0.602 0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 35 104.196 2.181 0.662 1.00 0.00 H new ATOM 0 HG LEU A 35 105.211 -0.220 2.251 1.00 0.00 H new ATOM 0 HD11 LEU A 35 106.962 -0.377 0.491 1.00 0.00 H new ATOM 0 HD12 LEU A 35 105.342 -0.637 -0.198 1.00 0.00 H new ATOM 0 HD13 LEU A 35 106.163 0.926 -0.419 1.00 0.00 H new ATOM 0 HD21 LEU A 35 107.262 1.156 2.441 1.00 0.00 H new ATOM 0 HD22 LEU A 35 106.473 2.461 1.523 1.00 0.00 H new ATOM 0 HD23 LEU A 35 105.857 2.004 3.129 1.00 0.00 H new ATOM 588 N GLY A 36 100.883 1.577 1.926 1.00 0.00 N ATOM 589 CA GLY A 36 99.608 2.188 1.438 1.00 0.00 C ATOM 590 C GLY A 36 99.624 2.378 -0.089 1.00 0.00 C ATOM 591 O GLY A 36 98.787 3.094 -0.611 1.00 0.00 O ATOM 0 H GLY A 36 100.844 0.568 2.068 1.00 0.00 H new ATOM 0 HA2 GLY A 36 98.768 1.553 1.718 1.00 0.00 H new ATOM 0 HA3 GLY A 36 99.455 3.151 1.924 1.00 0.00 H new ATOM 595 N PHE A 37 100.549 1.762 -0.803 1.00 0.00 N ATOM 596 CA PHE A 37 100.493 1.766 -2.299 1.00 0.00 C ATOM 597 C PHE A 37 101.168 0.514 -2.870 1.00 0.00 C ATOM 598 O PHE A 37 101.912 -0.159 -2.179 1.00 0.00 O ATOM 599 CB PHE A 37 101.223 3.043 -2.739 1.00 0.00 C ATOM 600 CG PHE A 37 102.691 3.110 -2.370 1.00 0.00 C ATOM 601 CD1 PHE A 37 103.645 2.301 -3.067 1.00 0.00 C ATOM 602 CD2 PHE A 37 103.130 3.998 -1.340 1.00 0.00 C ATOM 603 CE1 PHE A 37 105.031 2.380 -2.732 1.00 0.00 C ATOM 604 CE2 PHE A 37 104.517 4.074 -1.003 1.00 0.00 C ATOM 605 CZ PHE A 37 105.467 3.265 -1.700 1.00 0.00 C ATOM 0 H PHE A 37 101.341 1.256 -0.406 1.00 0.00 H new ATOM 0 HA PHE A 37 99.466 1.753 -2.665 1.00 0.00 H new ATOM 0 HB2 PHE A 37 101.133 3.139 -3.821 1.00 0.00 H new ATOM 0 HB3 PHE A 37 100.715 3.902 -2.299 1.00 0.00 H new ATOM 0 HD1 PHE A 37 103.316 1.630 -3.847 1.00 0.00 H new ATOM 0 HD2 PHE A 37 102.413 4.612 -0.816 1.00 0.00 H new ATOM 0 HE1 PHE A 37 105.750 1.770 -3.259 1.00 0.00 H new ATOM 0 HE2 PHE A 37 104.847 4.743 -0.222 1.00 0.00 H new ATOM 0 HZ PHE A 37 106.515 3.323 -1.446 1.00 0.00 H new ATOM 615 N GLU A 38 100.907 0.213 -4.122 1.00 0.00 N ATOM 616 CA GLU A 38 101.588 -0.933 -4.801 1.00 0.00 C ATOM 617 C GLU A 38 102.811 -0.421 -5.585 1.00 0.00 C ATOM 618 O GLU A 38 102.624 0.243 -6.587 1.00 0.00 O ATOM 619 CB GLU A 38 100.545 -1.509 -5.763 1.00 0.00 C ATOM 620 CG GLU A 38 99.406 -2.143 -4.961 1.00 0.00 C ATOM 621 CD GLU A 38 98.146 -2.211 -5.828 1.00 0.00 C ATOM 622 OE1 GLU A 38 97.695 -1.165 -6.263 1.00 0.00 O ATOM 623 OE2 GLU A 38 97.657 -3.308 -6.041 1.00 0.00 O ATOM 0 H GLU A 38 100.243 0.720 -4.707 1.00 0.00 H new ATOM 0 HA GLU A 38 101.943 -1.682 -4.093 1.00 0.00 H new ATOM 0 HB2 GLU A 38 100.155 -0.721 -6.408 1.00 0.00 H new ATOM 0 HB3 GLU A 38 101.005 -2.254 -6.412 1.00 0.00 H new ATOM 0 HG2 GLU A 38 99.690 -3.143 -4.635 1.00 0.00 H new ATOM 0 HG3 GLU A 38 99.211 -1.558 -4.062 1.00 0.00 H new ATOM 630 N PRO A 39 104.019 -0.730 -5.131 1.00 0.00 N ATOM 631 CA PRO A 39 105.242 -0.180 -5.796 1.00 0.00 C ATOM 632 C PRO A 39 105.401 -0.767 -7.203 1.00 0.00 C ATOM 633 O PRO A 39 104.789 -1.770 -7.526 1.00 0.00 O ATOM 634 CB PRO A 39 106.376 -0.639 -4.879 1.00 0.00 C ATOM 635 CG PRO A 39 105.843 -1.886 -4.268 1.00 0.00 C ATOM 636 CD PRO A 39 104.397 -1.597 -3.995 1.00 0.00 C ATOM 0 HA PRO A 39 105.213 0.902 -5.926 1.00 0.00 H new ATOM 0 HB2 PRO A 39 107.293 -0.826 -5.437 1.00 0.00 H new ATOM 0 HB3 PRO A 39 106.610 0.111 -4.123 1.00 0.00 H new ATOM 0 HG2 PRO A 39 105.955 -2.735 -4.942 1.00 0.00 H new ATOM 0 HG3 PRO A 39 106.376 -2.135 -3.350 1.00 0.00 H new ATOM 0 HD2 PRO A 39 103.800 -2.509 -3.965 1.00 0.00 H new ATOM 0 HD3 PRO A 39 104.258 -1.094 -3.038 1.00 0.00 H new ATOM 644 N TYR A 40 106.216 -0.145 -8.025 1.00 0.00 N ATOM 645 CA TYR A 40 106.451 -0.656 -9.416 1.00 0.00 C ATOM 646 C TYR A 40 107.341 -1.900 -9.370 1.00 0.00 C ATOM 647 O TYR A 40 107.996 -2.156 -8.373 1.00 0.00 O ATOM 648 CB TYR A 40 107.166 0.468 -10.171 1.00 0.00 C ATOM 649 CG TYR A 40 107.361 0.178 -11.640 1.00 0.00 C ATOM 650 CD1 TYR A 40 108.546 -0.487 -12.085 1.00 0.00 C ATOM 651 CD2 TYR A 40 106.362 0.567 -12.585 1.00 0.00 C ATOM 652 CE1 TYR A 40 108.731 -0.763 -13.475 1.00 0.00 C ATOM 653 CE2 TYR A 40 106.548 0.290 -13.975 1.00 0.00 C ATOM 654 CZ TYR A 40 107.732 -0.374 -14.420 1.00 0.00 C ATOM 655 OH TYR A 40 107.911 -0.640 -15.762 1.00 0.00 O ATOM 0 H TYR A 40 106.733 0.702 -7.789 1.00 0.00 H new ATOM 0 HA TYR A 40 105.515 -0.931 -9.903 1.00 0.00 H new ATOM 0 HB2 TYR A 40 106.593 1.389 -10.064 1.00 0.00 H new ATOM 0 HB3 TYR A 40 108.139 0.642 -9.711 1.00 0.00 H new ATOM 0 HD1 TYR A 40 109.301 -0.781 -11.371 1.00 0.00 H new ATOM 0 HD2 TYR A 40 105.467 1.070 -12.249 1.00 0.00 H new ATOM 0 HE1 TYR A 40 109.626 -1.266 -13.811 1.00 0.00 H new ATOM 0 HE2 TYR A 40 105.793 0.583 -14.689 1.00 0.00 H new ATOM 0 HH TYR A 40 107.138 -0.311 -16.267 1.00 0.00 H new ATOM 665 N GLU A 41 107.368 -2.663 -10.442 1.00 0.00 N ATOM 666 CA GLU A 41 108.216 -3.899 -10.475 1.00 0.00 C ATOM 667 C GLU A 41 109.675 -3.523 -10.775 1.00 0.00 C ATOM 668 O GLU A 41 110.146 -3.641 -11.895 1.00 0.00 O ATOM 669 CB GLU A 41 107.629 -4.769 -11.596 1.00 0.00 C ATOM 670 CG GLU A 41 106.229 -5.246 -11.201 1.00 0.00 C ATOM 671 CD GLU A 41 106.332 -6.285 -10.081 1.00 0.00 C ATOM 672 OE1 GLU A 41 107.187 -7.150 -10.177 1.00 0.00 O ATOM 673 OE2 GLU A 41 105.553 -6.198 -9.146 1.00 0.00 O ATOM 0 H GLU A 41 106.839 -2.481 -11.295 1.00 0.00 H new ATOM 0 HA GLU A 41 108.214 -4.429 -9.523 1.00 0.00 H new ATOM 0 HB2 GLU A 41 107.581 -4.199 -12.524 1.00 0.00 H new ATOM 0 HB3 GLU A 41 108.277 -5.626 -11.781 1.00 0.00 H new ATOM 0 HG2 GLU A 41 105.626 -4.400 -10.870 1.00 0.00 H new ATOM 0 HG3 GLU A 41 105.725 -5.678 -12.065 1.00 0.00 H new ATOM 680 N GLY A 42 110.382 -3.065 -9.765 1.00 0.00 N ATOM 681 CA GLY A 42 111.842 -2.779 -9.905 1.00 0.00 C ATOM 682 C GLY A 42 112.388 -2.249 -8.576 1.00 0.00 C ATOM 683 O GLY A 42 111.631 -2.000 -7.655 1.00 0.00 O ATOM 0 H GLY A 42 110.000 -2.876 -8.838 1.00 0.00 H new ATOM 0 HA2 GLY A 42 112.375 -3.685 -10.194 1.00 0.00 H new ATOM 0 HA3 GLY A 42 112.006 -2.047 -10.696 1.00 0.00 H new ATOM 687 N THR A 43 113.687 -2.084 -8.482 1.00 0.00 N ATOM 688 CA THR A 43 114.300 -1.444 -7.275 1.00 0.00 C ATOM 689 C THR A 43 115.383 -0.445 -7.688 1.00 0.00 C ATOM 690 O THR A 43 115.951 -0.547 -8.761 1.00 0.00 O ATOM 691 CB THR A 43 114.916 -2.578 -6.443 1.00 0.00 C ATOM 692 OG1 THR A 43 115.486 -3.568 -7.292 1.00 0.00 O ATOM 693 CG2 THR A 43 113.842 -3.212 -5.558 1.00 0.00 C ATOM 0 H THR A 43 114.355 -2.369 -9.198 1.00 0.00 H new ATOM 0 HA THR A 43 113.552 -0.895 -6.704 1.00 0.00 H new ATOM 0 HB THR A 43 115.704 -2.161 -5.816 1.00 0.00 H new ATOM 0 HG1 THR A 43 115.876 -4.282 -6.746 1.00 0.00 H new ATOM 0 HG21 THR A 43 114.284 -4.016 -4.969 1.00 0.00 H new ATOM 0 HG22 THR A 43 113.430 -2.457 -4.889 1.00 0.00 H new ATOM 0 HG23 THR A 43 113.046 -3.615 -6.184 1.00 0.00 H new ATOM 701 N LEU A 44 115.659 0.513 -6.834 1.00 0.00 N ATOM 702 CA LEU A 44 116.807 1.442 -7.048 1.00 0.00 C ATOM 703 C LEU A 44 117.899 1.116 -6.026 1.00 0.00 C ATOM 704 O LEU A 44 117.686 1.254 -4.836 1.00 0.00 O ATOM 705 CB LEU A 44 116.229 2.842 -6.809 1.00 0.00 C ATOM 706 CG LEU A 44 117.288 3.911 -7.101 1.00 0.00 C ATOM 707 CD1 LEU A 44 117.547 3.982 -8.607 1.00 0.00 C ATOM 708 CD2 LEU A 44 116.787 5.270 -6.608 1.00 0.00 C ATOM 0 H LEU A 44 115.125 0.690 -5.983 1.00 0.00 H new ATOM 0 HA LEU A 44 117.251 1.362 -8.040 1.00 0.00 H new ATOM 0 HB2 LEU A 44 115.359 2.998 -7.447 1.00 0.00 H new ATOM 0 HB3 LEU A 44 115.887 2.931 -5.778 1.00 0.00 H new ATOM 0 HG LEU A 44 118.214 3.652 -6.587 1.00 0.00 H new ATOM 0 HD11 LEU A 44 118.300 4.743 -8.811 1.00 0.00 H new ATOM 0 HD12 LEU A 44 117.903 3.015 -8.961 1.00 0.00 H new ATOM 0 HD13 LEU A 44 116.622 4.239 -9.123 1.00 0.00 H new ATOM 0 HD21 LEU A 44 117.539 6.032 -6.815 1.00 0.00 H new ATOM 0 HD22 LEU A 44 115.861 5.525 -7.123 1.00 0.00 H new ATOM 0 HD23 LEU A 44 116.604 5.223 -5.535 1.00 0.00 H new ATOM 720 N ASN A 45 119.049 0.687 -6.490 1.00 0.00 N ATOM 721 CA ASN A 45 120.154 0.294 -5.564 1.00 0.00 C ATOM 722 C ASN A 45 121.149 1.447 -5.424 1.00 0.00 C ATOM 723 O ASN A 45 121.699 1.910 -6.407 1.00 0.00 O ATOM 724 CB ASN A 45 120.821 -0.914 -6.224 1.00 0.00 C ATOM 725 CG ASN A 45 119.943 -2.152 -6.035 1.00 0.00 C ATOM 726 OD1 ASN A 45 118.792 -2.160 -6.422 1.00 0.00 O ATOM 727 ND2 ASN A 45 120.444 -3.207 -5.452 1.00 0.00 N ATOM 0 H ASN A 45 119.269 0.592 -7.481 1.00 0.00 H new ATOM 0 HA ASN A 45 119.792 0.057 -4.564 1.00 0.00 H new ATOM 0 HB2 ASN A 45 120.973 -0.723 -7.286 1.00 0.00 H new ATOM 0 HB3 ASN A 45 121.805 -1.083 -5.786 1.00 0.00 H new ATOM 0 HD21 ASN A 45 119.869 -4.039 -5.321 1.00 0.00 H new ATOM 0 HD22 ASN A 45 121.411 -3.199 -5.127 1.00 0.00 H new ATOM 734 N LEU A 46 121.377 1.900 -4.211 1.00 0.00 N ATOM 735 CA LEU A 46 122.324 3.035 -3.977 1.00 0.00 C ATOM 736 C LEU A 46 123.471 2.598 -3.063 1.00 0.00 C ATOM 737 O LEU A 46 123.254 1.932 -2.066 1.00 0.00 O ATOM 738 CB LEU A 46 121.490 4.129 -3.307 1.00 0.00 C ATOM 739 CG LEU A 46 120.588 4.798 -4.346 1.00 0.00 C ATOM 740 CD1 LEU A 46 119.559 5.680 -3.636 1.00 0.00 C ATOM 741 CD2 LEU A 46 121.436 5.665 -5.280 1.00 0.00 C ATOM 0 H LEU A 46 120.942 1.527 -3.367 1.00 0.00 H new ATOM 0 HA LEU A 46 122.777 3.383 -4.906 1.00 0.00 H new ATOM 0 HB2 LEU A 46 120.885 3.701 -2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 46 122.145 4.870 -2.849 1.00 0.00 H new ATOM 0 HG LEU A 46 120.076 4.030 -4.926 1.00 0.00 H new ATOM 0 HD11 LEU A 46 118.916 6.157 -4.376 1.00 0.00 H new ATOM 0 HD12 LEU A 46 118.952 5.067 -2.970 1.00 0.00 H new ATOM 0 HD13 LEU A 46 120.074 6.446 -3.056 1.00 0.00 H new ATOM 0 HD21 LEU A 46 120.792 6.141 -6.019 1.00 0.00 H new ATOM 0 HD22 LEU A 46 121.949 6.431 -4.699 1.00 0.00 H new ATOM 0 HD23 LEU A 46 122.172 5.041 -5.787 1.00 0.00 H new ATOM 753 N LYS A 47 124.680 2.974 -3.413 1.00 0.00 N ATOM 754 CA LYS A 47 125.857 2.727 -2.526 1.00 0.00 C ATOM 755 C LYS A 47 126.124 3.977 -1.684 1.00 0.00 C ATOM 756 O LYS A 47 126.155 5.076 -2.211 1.00 0.00 O ATOM 757 CB LYS A 47 127.027 2.452 -3.476 1.00 0.00 C ATOM 758 CG LYS A 47 128.256 2.012 -2.676 1.00 0.00 C ATOM 759 CD LYS A 47 129.460 1.905 -3.613 1.00 0.00 C ATOM 760 CE LYS A 47 130.657 1.340 -2.845 1.00 0.00 C ATOM 761 NZ LYS A 47 131.799 1.423 -3.799 1.00 0.00 N ATOM 0 H LYS A 47 124.901 3.448 -4.289 1.00 0.00 H new ATOM 0 HA LYS A 47 125.701 1.896 -1.839 1.00 0.00 H new ATOM 0 HB2 LYS A 47 126.751 1.677 -4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 47 127.258 3.349 -4.051 1.00 0.00 H new ATOM 0 HG2 LYS A 47 128.462 2.729 -1.881 1.00 0.00 H new ATOM 0 HG3 LYS A 47 128.067 1.051 -2.197 1.00 0.00 H new ATOM 0 HD2 LYS A 47 129.220 1.260 -4.458 1.00 0.00 H new ATOM 0 HD3 LYS A 47 129.706 2.886 -4.020 1.00 0.00 H new ATOM 0 HE2 LYS A 47 130.854 1.917 -1.941 1.00 0.00 H new ATOM 0 HE3 LYS A 47 130.477 0.311 -2.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 132.658 1.053 -3.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 131.585 0.859 -4.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 131.951 2.415 -4.073 1.00 0.00 H new ATOM 775 N LEU A 48 126.311 3.808 -0.397 1.00 0.00 N ATOM 776 CA LEU A 48 126.490 4.973 0.522 1.00 0.00 C ATOM 777 C LEU A 48 127.919 5.007 1.068 1.00 0.00 C ATOM 778 O LEU A 48 128.616 4.009 1.047 1.00 0.00 O ATOM 779 CB LEU A 48 125.502 4.753 1.670 1.00 0.00 C ATOM 780 CG LEU A 48 124.063 4.815 1.152 1.00 0.00 C ATOM 781 CD1 LEU A 48 123.110 4.333 2.248 1.00 0.00 C ATOM 782 CD2 LEU A 48 123.714 6.257 0.776 1.00 0.00 C ATOM 0 H LEU A 48 126.347 2.897 0.061 1.00 0.00 H new ATOM 0 HA LEU A 48 126.313 5.917 0.006 1.00 0.00 H new ATOM 0 HB2 LEU A 48 125.686 3.785 2.137 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.652 5.511 2.438 1.00 0.00 H new ATOM 0 HG LEU A 48 123.966 4.178 0.273 1.00 0.00 H new ATOM 0 HD11 LEU A 48 122.084 4.376 1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 48 123.356 3.306 2.519 1.00 0.00 H new ATOM 0 HD13 LEU A 48 123.210 4.973 3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.689 6.299 0.407 1.00 0.00 H new ATOM 0 HD22 LEU A 48 123.810 6.895 1.654 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.394 6.605 -0.002 1.00 0.00 H new ATOM 794 N ASP A 49 128.344 6.153 1.551 1.00 0.00 N ATOM 795 CA ASP A 49 129.662 6.253 2.256 1.00 0.00 C ATOM 796 C ASP A 49 129.526 5.989 3.768 1.00 0.00 C ATOM 797 O ASP A 49 130.448 6.267 4.515 1.00 0.00 O ATOM 798 CB ASP A 49 130.179 7.677 1.982 1.00 0.00 C ATOM 799 CG ASP A 49 129.223 8.744 2.534 1.00 0.00 C ATOM 800 OD1 ASP A 49 128.064 8.727 2.155 1.00 0.00 O ATOM 801 OD2 ASP A 49 129.669 9.557 3.327 1.00 0.00 O ATOM 0 H ASP A 49 127.828 7.030 1.485 1.00 0.00 H new ATOM 0 HA ASP A 49 130.357 5.498 1.890 1.00 0.00 H new ATOM 0 HB2 ASP A 49 131.163 7.800 2.435 1.00 0.00 H new ATOM 0 HB3 ASP A 49 130.302 7.819 0.908 1.00 0.00 H new ATOM 806 N ARG A 50 128.403 5.465 4.218 1.00 0.00 N ATOM 807 CA ARG A 50 128.185 5.222 5.677 1.00 0.00 C ATOM 808 C ARG A 50 127.353 3.951 5.864 1.00 0.00 C ATOM 809 O ARG A 50 126.427 3.707 5.111 1.00 0.00 O ATOM 810 CB ARG A 50 127.407 6.441 6.183 1.00 0.00 C ATOM 811 CG ARG A 50 128.279 7.696 6.098 1.00 0.00 C ATOM 812 CD ARG A 50 127.533 8.875 6.733 1.00 0.00 C ATOM 813 NE ARG A 50 128.381 10.085 6.474 1.00 0.00 N ATOM 814 CZ ARG A 50 128.333 11.163 7.233 1.00 0.00 C ATOM 815 NH1 ARG A 50 127.525 11.284 8.261 1.00 0.00 N ATOM 816 NH2 ARG A 50 129.119 12.164 6.941 1.00 0.00 N ATOM 0 H ARG A 50 127.621 5.194 3.622 1.00 0.00 H new ATOM 0 HA ARG A 50 129.122 5.090 6.218 1.00 0.00 H new ATOM 0 HB2 ARG A 50 126.503 6.577 5.590 1.00 0.00 H new ATOM 0 HB3 ARG A 50 127.091 6.278 7.213 1.00 0.00 H new ATOM 0 HG2 ARG A 50 129.226 7.530 6.612 1.00 0.00 H new ATOM 0 HG3 ARG A 50 128.516 7.918 5.058 1.00 0.00 H new ATOM 0 HD2 ARG A 50 126.542 8.992 6.295 1.00 0.00 H new ATOM 0 HD3 ARG A 50 127.392 8.718 7.802 1.00 0.00 H new ATOM 0 HE ARG A 50 129.020 10.074 5.679 1.00 0.00 H new ATOM 0 HH11 ARG A 50 126.893 10.521 8.506 1.00 0.00 H new ATOM 0 HH12 ARG A 50 127.529 12.141 8.815 1.00 0.00 H new ATOM 0 HH21 ARG A 50 129.750 12.101 6.142 1.00 0.00 H new ATOM 0 HH22 ARG A 50 129.102 13.009 7.512 1.00 0.00 H new ATOM 830 N GLU A 51 127.681 3.151 6.856 1.00 0.00 N ATOM 831 CA GLU A 51 126.894 1.901 7.136 1.00 0.00 C ATOM 832 C GLU A 51 125.449 2.246 7.528 1.00 0.00 C ATOM 833 O GLU A 51 125.206 3.267 8.147 1.00 0.00 O ATOM 834 CB GLU A 51 127.615 1.167 8.281 1.00 0.00 C ATOM 835 CG GLU A 51 127.726 2.048 9.533 1.00 0.00 C ATOM 836 CD GLU A 51 128.131 1.187 10.731 1.00 0.00 C ATOM 837 OE1 GLU A 51 129.161 0.538 10.647 1.00 0.00 O ATOM 838 OE2 GLU A 51 127.404 1.190 11.711 1.00 0.00 O ATOM 0 H GLU A 51 128.465 3.311 7.488 1.00 0.00 H new ATOM 0 HA GLU A 51 126.838 1.269 6.250 1.00 0.00 H new ATOM 0 HB2 GLU A 51 127.075 0.252 8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 51 128.612 0.871 7.954 1.00 0.00 H new ATOM 0 HG2 GLU A 51 128.463 2.835 9.372 1.00 0.00 H new ATOM 0 HG3 GLU A 51 126.773 2.539 9.730 1.00 0.00 H new ATOM 845 N PHE A 52 124.510 1.400 7.169 1.00 0.00 N ATOM 846 CA PHE A 52 123.072 1.662 7.490 1.00 0.00 C ATOM 847 C PHE A 52 122.421 0.417 8.101 1.00 0.00 C ATOM 848 O PHE A 52 122.631 -0.688 7.633 1.00 0.00 O ATOM 849 CB PHE A 52 122.419 2.008 6.151 1.00 0.00 C ATOM 850 CG PHE A 52 120.968 2.411 6.277 1.00 0.00 C ATOM 851 CD1 PHE A 52 120.626 3.765 6.584 1.00 0.00 C ATOM 852 CD2 PHE A 52 119.939 1.438 6.094 1.00 0.00 C ATOM 853 CE1 PHE A 52 119.253 4.144 6.709 1.00 0.00 C ATOM 854 CE2 PHE A 52 118.566 1.817 6.218 1.00 0.00 C ATOM 855 CZ PHE A 52 118.224 3.170 6.526 1.00 0.00 C ATOM 0 H PHE A 52 124.682 0.532 6.663 1.00 0.00 H new ATOM 0 HA PHE A 52 122.957 2.465 8.219 1.00 0.00 H new ATOM 0 HB2 PHE A 52 122.975 2.821 5.683 1.00 0.00 H new ATOM 0 HB3 PHE A 52 122.493 1.147 5.486 1.00 0.00 H new ATOM 0 HD1 PHE A 52 121.404 4.501 6.721 1.00 0.00 H new ATOM 0 HD2 PHE A 52 120.198 0.416 5.862 1.00 0.00 H new ATOM 0 HE1 PHE A 52 118.994 5.166 6.942 1.00 0.00 H new ATOM 0 HE2 PHE A 52 117.788 1.081 6.079 1.00 0.00 H new ATOM 0 HZ PHE A 52 117.187 3.456 6.620 1.00 0.00 H new ATOM 865 N ASP A 53 121.638 0.604 9.139 1.00 0.00 N ATOM 866 CA ASP A 53 120.870 -0.523 9.750 1.00 0.00 C ATOM 867 C ASP A 53 119.452 -0.057 10.097 1.00 0.00 C ATOM 868 O ASP A 53 119.281 0.930 10.791 1.00 0.00 O ATOM 869 CB ASP A 53 121.644 -0.890 11.017 1.00 0.00 C ATOM 870 CG ASP A 53 121.084 -2.187 11.607 1.00 0.00 C ATOM 871 OD1 ASP A 53 120.848 -3.110 10.844 1.00 0.00 O ATOM 872 OD2 ASP A 53 120.902 -2.235 12.812 1.00 0.00 O ATOM 0 H ASP A 53 121.499 1.506 9.594 1.00 0.00 H new ATOM 0 HA ASP A 53 120.771 -1.375 9.077 1.00 0.00 H new ATOM 0 HB2 ASP A 53 122.702 -1.012 10.786 1.00 0.00 H new ATOM 0 HB3 ASP A 53 121.568 -0.084 11.747 1.00 0.00 H new ATOM 877 N ILE A 54 118.450 -0.762 9.618 1.00 0.00 N ATOM 878 CA ILE A 54 117.027 -0.343 9.857 1.00 0.00 C ATOM 879 C ILE A 54 116.676 -0.379 11.358 1.00 0.00 C ATOM 880 O ILE A 54 115.768 0.311 11.786 1.00 0.00 O ATOM 881 CB ILE A 54 116.151 -1.305 9.027 1.00 0.00 C ATOM 882 CG1 ILE A 54 114.681 -0.875 9.116 1.00 0.00 C ATOM 883 CG2 ILE A 54 116.301 -2.752 9.517 1.00 0.00 C ATOM 884 CD1 ILE A 54 113.854 -1.611 8.061 1.00 0.00 C ATOM 0 H ILE A 54 118.558 -1.615 9.069 1.00 0.00 H new ATOM 0 HA ILE A 54 116.858 0.689 9.549 1.00 0.00 H new ATOM 0 HB ILE A 54 116.483 -1.261 7.990 1.00 0.00 H new ATOM 0 HG12 ILE A 54 114.291 -1.090 10.111 1.00 0.00 H new ATOM 0 HG13 ILE A 54 114.599 0.202 8.967 1.00 0.00 H new ATOM 0 HG21 ILE A 54 115.672 -3.407 8.914 1.00 0.00 H new ATOM 0 HG22 ILE A 54 117.342 -3.061 9.424 1.00 0.00 H new ATOM 0 HG23 ILE A 54 115.995 -2.816 10.561 1.00 0.00 H new ATOM 0 HD11 ILE A 54 112.812 -1.299 8.133 1.00 0.00 H new ATOM 0 HD12 ILE A 54 114.237 -1.374 7.068 1.00 0.00 H new ATOM 0 HD13 ILE A 54 113.923 -2.686 8.229 1.00 0.00 H new ATOM 896 N ASN A 55 117.381 -1.169 12.141 1.00 0.00 N ATOM 897 CA ASN A 55 117.076 -1.269 13.609 1.00 0.00 C ATOM 898 C ASN A 55 117.541 -0.027 14.386 1.00 0.00 C ATOM 899 O ASN A 55 117.344 0.039 15.588 1.00 0.00 O ATOM 900 CB ASN A 55 117.815 -2.512 14.116 1.00 0.00 C ATOM 901 CG ASN A 55 117.206 -3.768 13.488 1.00 0.00 C ATOM 902 OD1 ASN A 55 116.828 -3.763 12.333 1.00 0.00 O ATOM 903 ND2 ASN A 55 117.094 -4.852 14.205 1.00 0.00 N ATOM 0 H ASN A 55 118.157 -1.750 11.824 1.00 0.00 H new ATOM 0 HA ASN A 55 115.999 -1.338 13.762 1.00 0.00 H new ATOM 0 HB2 ASN A 55 118.874 -2.445 13.865 1.00 0.00 H new ATOM 0 HB3 ASN A 55 117.748 -2.568 15.202 1.00 0.00 H new ATOM 0 HD21 ASN A 55 116.689 -5.694 13.796 1.00 0.00 H new ATOM 0 HD22 ASN A 55 117.411 -4.857 15.174 1.00 0.00 H new ATOM 910 N LYS A 56 118.146 0.944 13.732 1.00 0.00 N ATOM 911 CA LYS A 56 118.418 2.263 14.388 1.00 0.00 C ATOM 912 C LYS A 56 117.257 3.249 14.172 1.00 0.00 C ATOM 913 O LYS A 56 117.194 4.264 14.843 1.00 0.00 O ATOM 914 CB LYS A 56 119.701 2.793 13.740 1.00 0.00 C ATOM 915 CG LYS A 56 120.878 1.894 14.126 1.00 0.00 C ATOM 916 CD LYS A 56 122.175 2.487 13.573 1.00 0.00 C ATOM 917 CE LYS A 56 123.336 1.527 13.852 1.00 0.00 C ATOM 918 NZ LYS A 56 124.524 2.167 13.222 1.00 0.00 N ATOM 0 H LYS A 56 118.464 0.875 12.765 1.00 0.00 H new ATOM 0 HA LYS A 56 118.524 2.148 15.467 1.00 0.00 H new ATOM 0 HB2 LYS A 56 119.590 2.819 12.656 1.00 0.00 H new ATOM 0 HB3 LYS A 56 119.889 3.816 14.065 1.00 0.00 H new ATOM 0 HG2 LYS A 56 120.940 1.804 15.210 1.00 0.00 H new ATOM 0 HG3 LYS A 56 120.727 0.889 13.731 1.00 0.00 H new ATOM 0 HD2 LYS A 56 122.081 2.658 12.501 1.00 0.00 H new ATOM 0 HD3 LYS A 56 122.371 3.455 14.035 1.00 0.00 H new ATOM 0 HE2 LYS A 56 123.484 1.387 14.923 1.00 0.00 H new ATOM 0 HE3 LYS A 56 123.145 0.542 13.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 125.361 1.568 13.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 124.357 2.281 12.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 124.685 3.100 13.653 1.00 0.00 H new ATOM 932 N PHE A 57 116.351 2.967 13.256 1.00 0.00 N ATOM 933 CA PHE A 57 115.133 3.817 13.079 1.00 0.00 C ATOM 934 C PHE A 57 113.885 2.995 13.411 1.00 0.00 C ATOM 935 O PHE A 57 113.982 1.808 13.671 1.00 0.00 O ATOM 936 CB PHE A 57 115.121 4.232 11.603 1.00 0.00 C ATOM 937 CG PHE A 57 116.372 4.952 11.151 1.00 0.00 C ATOM 938 CD1 PHE A 57 116.458 6.375 11.253 1.00 0.00 C ATOM 939 CD2 PHE A 57 117.471 4.204 10.626 1.00 0.00 C ATOM 940 CE1 PHE A 57 117.643 7.050 10.829 1.00 0.00 C ATOM 941 CE2 PHE A 57 118.657 4.880 10.202 1.00 0.00 C ATOM 942 CZ PHE A 57 118.743 6.304 10.303 1.00 0.00 C ATOM 0 H PHE A 57 116.410 2.173 12.619 1.00 0.00 H new ATOM 0 HA PHE A 57 115.142 4.688 13.734 1.00 0.00 H new ATOM 0 HB2 PHE A 57 114.985 3.342 10.988 1.00 0.00 H new ATOM 0 HB3 PHE A 57 114.260 4.877 11.425 1.00 0.00 H new ATOM 0 HD1 PHE A 57 115.627 6.939 11.650 1.00 0.00 H new ATOM 0 HD2 PHE A 57 117.405 3.129 10.550 1.00 0.00 H new ATOM 0 HE1 PHE A 57 117.708 8.125 10.906 1.00 0.00 H new ATOM 0 HE2 PHE A 57 119.488 4.316 9.805 1.00 0.00 H new ATOM 0 HZ PHE A 57 119.638 6.815 9.982 1.00 0.00 H new ATOM 952 N LYS A 58 112.729 3.620 13.403 1.00 0.00 N ATOM 953 CA LYS A 58 111.463 2.905 13.756 1.00 0.00 C ATOM 954 C LYS A 58 110.803 2.349 12.489 1.00 0.00 C ATOM 955 O LYS A 58 110.195 3.085 11.733 1.00 0.00 O ATOM 956 CB LYS A 58 110.565 3.957 14.412 1.00 0.00 C ATOM 957 CG LYS A 58 111.173 4.383 15.752 1.00 0.00 C ATOM 958 CD LYS A 58 110.151 5.207 16.538 1.00 0.00 C ATOM 959 CE LYS A 58 110.004 6.590 15.900 1.00 0.00 C ATOM 960 NZ LYS A 58 111.144 7.385 16.436 1.00 0.00 N ATOM 0 H LYS A 58 112.610 4.605 13.164 1.00 0.00 H new ATOM 0 HA LYS A 58 111.643 2.061 14.422 1.00 0.00 H new ATOM 0 HB2 LYS A 58 110.461 4.822 13.756 1.00 0.00 H new ATOM 0 HB3 LYS A 58 109.565 3.552 14.567 1.00 0.00 H new ATOM 0 HG2 LYS A 58 111.466 3.504 16.326 1.00 0.00 H new ATOM 0 HG3 LYS A 58 112.076 4.969 15.583 1.00 0.00 H new ATOM 0 HD2 LYS A 58 109.188 4.696 16.548 1.00 0.00 H new ATOM 0 HD3 LYS A 58 110.470 5.306 17.575 1.00 0.00 H new ATOM 0 HE2 LYS A 58 110.042 6.529 14.812 1.00 0.00 H new ATOM 0 HE3 LYS A 58 109.048 7.045 16.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 110.780 8.150 17.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 111.765 6.767 16.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 111.684 7.794 15.647 1.00 0.00 H new ATOM 974 N TYR A 59 110.926 1.059 12.269 1.00 0.00 N ATOM 975 CA TYR A 59 110.352 0.420 11.045 1.00 0.00 C ATOM 976 C TYR A 59 109.154 -0.467 11.413 1.00 0.00 C ATOM 977 O TYR A 59 108.838 -0.627 12.578 1.00 0.00 O ATOM 978 CB TYR A 59 111.512 -0.396 10.451 1.00 0.00 C ATOM 979 CG TYR A 59 111.974 -1.560 11.302 1.00 0.00 C ATOM 980 CD1 TYR A 59 111.377 -2.847 11.130 1.00 0.00 C ATOM 981 CD2 TYR A 59 113.000 -1.377 12.280 1.00 0.00 C ATOM 982 CE1 TYR A 59 111.805 -3.949 11.934 1.00 0.00 C ATOM 983 CE2 TYR A 59 113.429 -2.478 13.084 1.00 0.00 C ATOM 984 CZ TYR A 59 112.832 -3.764 12.910 1.00 0.00 C ATOM 985 OH TYR A 59 113.245 -4.827 13.687 1.00 0.00 O ATOM 0 H TYR A 59 111.407 0.415 12.897 1.00 0.00 H new ATOM 0 HA TYR A 59 109.970 1.147 10.328 1.00 0.00 H new ATOM 0 HB2 TYR A 59 111.208 -0.776 9.476 1.00 0.00 H new ATOM 0 HB3 TYR A 59 112.358 0.271 10.283 1.00 0.00 H new ATOM 0 HD1 TYR A 59 110.601 -2.987 10.392 1.00 0.00 H new ATOM 0 HD2 TYR A 59 113.452 -0.405 12.412 1.00 0.00 H new ATOM 0 HE1 TYR A 59 111.352 -4.921 11.804 1.00 0.00 H new ATOM 0 HE2 TYR A 59 114.204 -2.338 13.823 1.00 0.00 H new ATOM 0 HH TYR A 59 113.951 -4.530 14.299 1.00 0.00 H new ATOM 995 N ILE A 60 108.501 -1.033 10.424 1.00 0.00 N ATOM 996 CA ILE A 60 107.380 -1.991 10.680 1.00 0.00 C ATOM 997 C ILE A 60 107.844 -3.395 10.273 1.00 0.00 C ATOM 998 O ILE A 60 108.354 -3.584 9.184 1.00 0.00 O ATOM 999 CB ILE A 60 106.202 -1.510 9.810 1.00 0.00 C ATOM 1000 CG1 ILE A 60 105.797 -0.082 10.199 1.00 0.00 C ATOM 1001 CG2 ILE A 60 104.986 -2.424 10.011 1.00 0.00 C ATOM 1002 CD1 ILE A 60 104.895 0.510 9.115 1.00 0.00 C ATOM 0 H ILE A 60 108.701 -0.868 9.438 1.00 0.00 H new ATOM 0 HA ILE A 60 107.079 -2.029 11.727 1.00 0.00 H new ATOM 0 HB ILE A 60 106.523 -1.535 8.769 1.00 0.00 H new ATOM 0 HG12 ILE A 60 105.275 -0.089 11.156 1.00 0.00 H new ATOM 0 HG13 ILE A 60 106.685 0.537 10.325 1.00 0.00 H new ATOM 0 HG21 ILE A 60 104.161 -2.073 9.391 1.00 0.00 H new ATOM 0 HG22 ILE A 60 105.246 -3.444 9.726 1.00 0.00 H new ATOM 0 HG23 ILE A 60 104.686 -2.405 11.059 1.00 0.00 H new ATOM 0 HD11 ILE A 60 104.609 1.524 9.394 1.00 0.00 H new ATOM 0 HD12 ILE A 60 105.432 0.532 8.167 1.00 0.00 H new ATOM 0 HD13 ILE A 60 104.000 -0.104 9.011 1.00 0.00 H new ATOM 1014 N GLU A 61 107.671 -4.361 11.147 1.00 0.00 N ATOM 1015 CA GLU A 61 108.135 -5.754 10.863 1.00 0.00 C ATOM 1016 C GLU A 61 106.940 -6.658 10.547 1.00 0.00 C ATOM 1017 O GLU A 61 105.862 -6.463 11.081 1.00 0.00 O ATOM 1018 CB GLU A 61 108.813 -6.208 12.156 1.00 0.00 C ATOM 1019 CG GLU A 61 109.560 -7.520 11.910 1.00 0.00 C ATOM 1020 CD GLU A 61 110.145 -8.030 13.228 1.00 0.00 C ATOM 1021 OE1 GLU A 61 109.426 -8.025 14.214 1.00 0.00 O ATOM 1022 OE2 GLU A 61 111.302 -8.413 13.230 1.00 0.00 O ATOM 0 H GLU A 61 107.222 -4.239 12.055 1.00 0.00 H new ATOM 0 HA GLU A 61 108.805 -5.800 10.004 1.00 0.00 H new ATOM 0 HB2 GLU A 61 109.507 -5.442 12.503 1.00 0.00 H new ATOM 0 HB3 GLU A 61 108.069 -6.343 12.941 1.00 0.00 H new ATOM 0 HG2 GLU A 61 108.882 -8.263 11.489 1.00 0.00 H new ATOM 0 HG3 GLU A 61 110.356 -7.366 11.182 1.00 0.00 H new ATOM 1029 N THR A 62 107.132 -7.634 9.688 1.00 0.00 N ATOM 1030 CA THR A 62 106.052 -8.628 9.393 1.00 0.00 C ATOM 1031 C THR A 62 106.554 -10.059 9.618 1.00 0.00 C ATOM 1032 O THR A 62 107.640 -10.413 9.193 1.00 0.00 O ATOM 1033 CB THR A 62 105.686 -8.401 7.925 1.00 0.00 C ATOM 1034 OG1 THR A 62 106.868 -8.341 7.142 1.00 0.00 O ATOM 1035 CG2 THR A 62 104.914 -7.087 7.798 1.00 0.00 C ATOM 0 H THR A 62 108.001 -7.784 9.175 1.00 0.00 H new ATOM 0 HA THR A 62 105.191 -8.499 10.048 1.00 0.00 H new ATOM 0 HB THR A 62 105.066 -9.224 7.570 1.00 0.00 H new ATOM 0 HG1 THR A 62 107.233 -7.432 7.170 1.00 0.00 H new ATOM 0 HG21 THR A 62 104.650 -6.919 6.754 1.00 0.00 H new ATOM 0 HG22 THR A 62 104.005 -7.139 8.398 1.00 0.00 H new ATOM 0 HG23 THR A 62 105.535 -6.264 8.152 1.00 0.00 H new ATOM 1043 N GLU A 63 105.753 -10.867 10.275 1.00 0.00 N ATOM 1044 CA GLU A 63 106.204 -12.223 10.735 1.00 0.00 C ATOM 1045 C GLU A 63 106.278 -13.223 9.570 1.00 0.00 C ATOM 1046 O GLU A 63 105.866 -12.922 8.463 1.00 0.00 O ATOM 1047 CB GLU A 63 105.192 -12.677 11.804 1.00 0.00 C ATOM 1048 CG GLU A 63 103.774 -12.820 11.220 1.00 0.00 C ATOM 1049 CD GLU A 63 102.726 -12.394 12.254 1.00 0.00 C ATOM 1050 OE1 GLU A 63 102.935 -11.379 12.896 1.00 0.00 O ATOM 1051 OE2 GLU A 63 101.733 -13.092 12.382 1.00 0.00 O ATOM 0 H GLU A 63 104.788 -10.640 10.516 1.00 0.00 H new ATOM 0 HA GLU A 63 107.213 -12.176 11.146 1.00 0.00 H new ATOM 0 HB2 GLU A 63 105.510 -13.631 12.225 1.00 0.00 H new ATOM 0 HB3 GLU A 63 105.178 -11.956 12.622 1.00 0.00 H new ATOM 0 HG2 GLU A 63 103.679 -12.208 10.323 1.00 0.00 H new ATOM 0 HG3 GLU A 63 103.600 -13.853 10.920 1.00 0.00 H new ATOM 1058 N ASP A 64 106.802 -14.401 9.830 1.00 0.00 N ATOM 1059 CA ASP A 64 106.968 -15.441 8.757 1.00 0.00 C ATOM 1060 C ASP A 64 105.587 -15.918 8.290 1.00 0.00 C ATOM 1061 O ASP A 64 104.694 -16.100 9.099 1.00 0.00 O ATOM 1062 CB ASP A 64 107.741 -16.610 9.390 1.00 0.00 C ATOM 1063 CG ASP A 64 109.115 -16.144 9.882 1.00 0.00 C ATOM 1064 OD1 ASP A 64 109.908 -15.727 9.055 1.00 0.00 O ATOM 1065 OD2 ASP A 64 109.348 -16.212 11.077 1.00 0.00 O ATOM 0 H ASP A 64 107.126 -14.690 10.753 1.00 0.00 H new ATOM 0 HA ASP A 64 107.502 -15.042 7.894 1.00 0.00 H new ATOM 0 HB2 ASP A 64 107.171 -17.022 10.223 1.00 0.00 H new ATOM 0 HB3 ASP A 64 107.862 -17.411 8.660 1.00 0.00 H new ATOM 1070 N PHE A 65 105.417 -16.118 7.001 1.00 0.00 N ATOM 1071 CA PHE A 65 104.071 -16.456 6.443 1.00 0.00 C ATOM 1072 C PHE A 65 104.194 -17.509 5.337 1.00 0.00 C ATOM 1073 O PHE A 65 105.281 -17.778 4.859 1.00 0.00 O ATOM 1074 CB PHE A 65 103.520 -15.137 5.886 1.00 0.00 C ATOM 1075 CG PHE A 65 104.382 -14.503 4.815 1.00 0.00 C ATOM 1076 CD1 PHE A 65 104.169 -14.830 3.440 1.00 0.00 C ATOM 1077 CD2 PHE A 65 105.409 -13.578 5.179 1.00 0.00 C ATOM 1078 CE1 PHE A 65 104.982 -14.231 2.429 1.00 0.00 C ATOM 1079 CE2 PHE A 65 106.223 -12.980 4.168 1.00 0.00 C ATOM 1080 CZ PHE A 65 106.009 -13.306 2.793 1.00 0.00 C ATOM 0 H PHE A 65 106.163 -16.060 6.308 1.00 0.00 H new ATOM 0 HA PHE A 65 103.411 -16.880 7.200 1.00 0.00 H new ATOM 0 HB2 PHE A 65 102.526 -15.316 5.476 1.00 0.00 H new ATOM 0 HB3 PHE A 65 103.403 -14.430 6.707 1.00 0.00 H new ATOM 0 HD1 PHE A 65 103.394 -15.530 3.165 1.00 0.00 H new ATOM 0 HD2 PHE A 65 105.570 -13.331 6.218 1.00 0.00 H new ATOM 0 HE1 PHE A 65 104.820 -14.477 1.390 1.00 0.00 H new ATOM 0 HE2 PHE A 65 107.000 -12.282 4.443 1.00 0.00 H new ATOM 0 HZ PHE A 65 106.623 -12.853 2.029 1.00 0.00 H new ATOM 1090 N GLU A 66 103.087 -18.097 4.940 1.00 0.00 N ATOM 1091 CA GLU A 66 103.100 -19.127 3.854 1.00 0.00 C ATOM 1092 C GLU A 66 102.139 -18.733 2.727 1.00 0.00 C ATOM 1093 O GLU A 66 101.130 -18.091 2.963 1.00 0.00 O ATOM 1094 CB GLU A 66 102.639 -20.424 4.525 1.00 0.00 C ATOM 1095 CG GLU A 66 103.847 -21.173 5.098 1.00 0.00 C ATOM 1096 CD GLU A 66 103.387 -22.406 5.884 1.00 0.00 C ATOM 1097 OE1 GLU A 66 102.369 -22.323 6.553 1.00 0.00 O ATOM 1098 OE2 GLU A 66 104.070 -23.415 5.808 1.00 0.00 O ATOM 0 H GLU A 66 102.164 -17.903 5.329 1.00 0.00 H new ATOM 0 HA GLU A 66 104.087 -19.230 3.403 1.00 0.00 H new ATOM 0 HB2 GLU A 66 101.929 -20.199 5.321 1.00 0.00 H new ATOM 0 HB3 GLU A 66 102.120 -21.053 3.802 1.00 0.00 H new ATOM 0 HG2 GLU A 66 104.512 -21.476 4.289 1.00 0.00 H new ATOM 0 HG3 GLU A 66 104.418 -20.511 5.749 1.00 0.00 H new ATOM 1105 N PHE A 67 102.460 -19.120 1.515 1.00 0.00 N ATOM 1106 CA PHE A 67 101.555 -18.884 0.350 1.00 0.00 C ATOM 1107 C PHE A 67 101.743 -20.012 -0.671 1.00 0.00 C ATOM 1108 O PHE A 67 102.857 -20.397 -0.971 1.00 0.00 O ATOM 1109 CB PHE A 67 101.991 -17.527 -0.217 1.00 0.00 C ATOM 1110 CG PHE A 67 101.272 -17.118 -1.483 1.00 0.00 C ATOM 1111 CD1 PHE A 67 100.052 -16.376 -1.412 1.00 0.00 C ATOM 1112 CD2 PHE A 67 101.808 -17.488 -2.756 1.00 0.00 C ATOM 1113 CE1 PHE A 67 99.372 -16.000 -2.612 1.00 0.00 C ATOM 1114 CE2 PHE A 67 101.129 -17.113 -3.956 1.00 0.00 C ATOM 1115 CZ PHE A 67 99.912 -16.370 -3.885 1.00 0.00 C ATOM 0 H PHE A 67 103.330 -19.599 1.282 1.00 0.00 H new ATOM 0 HA PHE A 67 100.498 -18.874 0.617 1.00 0.00 H new ATOM 0 HB2 PHE A 67 101.829 -16.761 0.542 1.00 0.00 H new ATOM 0 HB3 PHE A 67 103.062 -17.557 -0.416 1.00 0.00 H new ATOM 0 HD1 PHE A 67 99.644 -16.099 -0.451 1.00 0.00 H new ATOM 0 HD2 PHE A 67 102.728 -18.052 -2.811 1.00 0.00 H new ATOM 0 HE1 PHE A 67 98.452 -15.437 -2.558 1.00 0.00 H new ATOM 0 HE2 PHE A 67 101.536 -17.392 -4.917 1.00 0.00 H new ATOM 0 HZ PHE A 67 99.399 -16.087 -4.792 1.00 0.00 H new ATOM 1125 N ASN A 68 100.660 -20.547 -1.198 1.00 0.00 N ATOM 1126 CA ASN A 68 100.714 -21.645 -2.229 1.00 0.00 C ATOM 1127 C ASN A 68 101.592 -22.822 -1.768 1.00 0.00 C ATOM 1128 O ASN A 68 102.247 -23.463 -2.571 1.00 0.00 O ATOM 1129 CB ASN A 68 101.286 -21.003 -3.502 1.00 0.00 C ATOM 1130 CG ASN A 68 100.160 -20.366 -4.319 1.00 0.00 C ATOM 1131 OD1 ASN A 68 99.401 -19.457 -3.770 1.00 0.00 O flip ATOM 1132 ND2 ASN A 68 99.969 -20.699 -5.473 1.00 0.00 N flip ATOM 0 H ASN A 68 99.713 -20.260 -0.949 1.00 0.00 H new ATOM 0 HA ASN A 68 99.722 -22.063 -2.399 1.00 0.00 H new ATOM 0 HB2 ASN A 68 102.026 -20.248 -3.237 1.00 0.00 H new ATOM 0 HB3 ASN A 68 101.799 -21.756 -4.100 1.00 0.00 H new ATOM 0 HD21 ASN A 68 100.561 -21.409 -5.904 1.00 0.00 H new ATOM 0 HD22 ASN A 68 99.217 -20.268 -6.010 1.00 0.00 H new ATOM 1139 N GLY A 69 101.596 -23.098 -0.483 1.00 0.00 N ATOM 1140 CA GLY A 69 102.348 -24.274 0.058 1.00 0.00 C ATOM 1141 C GLY A 69 103.856 -23.994 0.155 1.00 0.00 C ATOM 1142 O GLY A 69 104.633 -24.923 0.294 1.00 0.00 O ATOM 0 H GLY A 69 101.103 -22.550 0.221 1.00 0.00 H new ATOM 0 HA2 GLY A 69 101.962 -24.529 1.045 1.00 0.00 H new ATOM 0 HA3 GLY A 69 102.180 -25.139 -0.584 1.00 0.00 H new ATOM 1146 N LYS A 70 104.275 -22.747 0.086 1.00 0.00 N ATOM 1147 CA LYS A 70 105.728 -22.408 0.182 1.00 0.00 C ATOM 1148 C LYS A 70 105.961 -21.464 1.364 1.00 0.00 C ATOM 1149 O LYS A 70 105.160 -20.580 1.609 1.00 0.00 O ATOM 1150 CB LYS A 70 106.064 -21.709 -1.137 1.00 0.00 C ATOM 1151 CG LYS A 70 105.968 -22.712 -2.289 1.00 0.00 C ATOM 1152 CD LYS A 70 106.407 -22.039 -3.590 1.00 0.00 C ATOM 1153 CE LYS A 70 106.200 -23.004 -4.760 1.00 0.00 C ATOM 1154 NZ LYS A 70 106.372 -22.170 -5.981 1.00 0.00 N ATOM 0 H LYS A 70 103.659 -21.943 -0.034 1.00 0.00 H new ATOM 0 HA LYS A 70 106.351 -23.288 0.342 1.00 0.00 H new ATOM 0 HB2 LYS A 70 105.377 -20.879 -1.306 1.00 0.00 H new ATOM 0 HB3 LYS A 70 107.068 -21.287 -1.091 1.00 0.00 H new ATOM 0 HG2 LYS A 70 106.598 -23.578 -2.085 1.00 0.00 H new ATOM 0 HG3 LYS A 70 104.945 -23.077 -2.383 1.00 0.00 H new ATOM 0 HD2 LYS A 70 105.833 -21.127 -3.751 1.00 0.00 H new ATOM 0 HD3 LYS A 70 107.456 -21.749 -3.526 1.00 0.00 H new ATOM 0 HE2 LYS A 70 106.924 -23.818 -4.733 1.00 0.00 H new ATOM 0 HE3 LYS A 70 105.209 -23.457 -4.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 106.245 -22.762 -6.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 105.665 -21.407 -5.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 107.327 -21.757 -5.988 1.00 0.00 H new ATOM 1168 N ARG A 71 107.044 -21.652 2.081 1.00 0.00 N ATOM 1169 CA ARG A 71 107.328 -20.810 3.286 1.00 0.00 C ATOM 1170 C ARG A 71 108.197 -19.609 2.904 1.00 0.00 C ATOM 1171 O ARG A 71 109.207 -19.761 2.240 1.00 0.00 O ATOM 1172 CB ARG A 71 108.074 -21.728 4.257 1.00 0.00 C ATOM 1173 CG ARG A 71 107.126 -22.821 4.754 1.00 0.00 C ATOM 1174 CD ARG A 71 107.856 -23.724 5.753 1.00 0.00 C ATOM 1175 NE ARG A 71 106.875 -24.796 6.128 1.00 0.00 N ATOM 1176 CZ ARG A 71 107.248 -25.986 6.556 1.00 0.00 C ATOM 1177 NH1 ARG A 71 108.505 -26.330 6.720 1.00 0.00 N ATOM 1178 NH2 ARG A 71 106.323 -26.862 6.843 1.00 0.00 N ATOM 0 H ARG A 71 107.750 -22.360 1.880 1.00 0.00 H new ATOM 0 HA ARG A 71 106.415 -20.412 3.729 1.00 0.00 H new ATOM 0 HB2 ARG A 71 108.935 -22.176 3.762 1.00 0.00 H new ATOM 0 HB3 ARG A 71 108.455 -21.151 5.100 1.00 0.00 H new ATOM 0 HG2 ARG A 71 106.253 -22.371 5.227 1.00 0.00 H new ATOM 0 HG3 ARG A 71 106.764 -23.412 3.913 1.00 0.00 H new ATOM 0 HD2 ARG A 71 108.754 -24.154 5.308 1.00 0.00 H new ATOM 0 HD3 ARG A 71 108.173 -23.160 6.630 1.00 0.00 H new ATOM 0 HE ARG A 71 105.878 -24.596 6.048 1.00 0.00 H new ATOM 0 HH11 ARG A 71 109.248 -25.662 6.513 1.00 0.00 H new ATOM 0 HH12 ARG A 71 108.738 -27.265 7.054 1.00 0.00 H new ATOM 0 HH21 ARG A 71 105.339 -26.618 6.734 1.00 0.00 H new ATOM 0 HH22 ARG A 71 106.585 -27.790 7.176 1.00 0.00 H new ATOM 1192 N PHE A 72 107.801 -18.428 3.321 1.00 0.00 N ATOM 1193 CA PHE A 72 108.589 -17.193 3.027 1.00 0.00 C ATOM 1194 C PHE A 72 109.013 -16.529 4.339 1.00 0.00 C ATOM 1195 O PHE A 72 108.264 -16.528 5.302 1.00 0.00 O ATOM 1196 CB PHE A 72 107.633 -16.290 2.247 1.00 0.00 C ATOM 1197 CG PHE A 72 107.198 -16.875 0.924 1.00 0.00 C ATOM 1198 CD1 PHE A 72 106.141 -17.836 0.881 1.00 0.00 C ATOM 1199 CD2 PHE A 72 107.844 -16.468 -0.285 1.00 0.00 C ATOM 1200 CE1 PHE A 72 105.730 -18.392 -0.371 1.00 0.00 C ATOM 1201 CE2 PHE A 72 107.433 -17.023 -1.537 1.00 0.00 C ATOM 1202 CZ PHE A 72 106.376 -17.985 -1.579 1.00 0.00 C ATOM 0 H PHE A 72 106.951 -18.269 3.861 1.00 0.00 H new ATOM 0 HA PHE A 72 109.498 -17.399 2.462 1.00 0.00 H new ATOM 0 HB2 PHE A 72 106.751 -16.095 2.857 1.00 0.00 H new ATOM 0 HB3 PHE A 72 108.116 -15.329 2.069 1.00 0.00 H new ATOM 0 HD1 PHE A 72 105.652 -18.142 1.794 1.00 0.00 H new ATOM 0 HD2 PHE A 72 108.642 -15.741 -0.252 1.00 0.00 H new ATOM 0 HE1 PHE A 72 104.932 -19.119 -0.403 1.00 0.00 H new ATOM 0 HE2 PHE A 72 107.921 -16.716 -2.450 1.00 0.00 H new ATOM 0 HZ PHE A 72 106.066 -18.404 -2.525 1.00 0.00 H new ATOM 1212 N PHE A 73 110.197 -15.964 4.369 1.00 0.00 N ATOM 1213 CA PHE A 73 110.795 -15.499 5.660 1.00 0.00 C ATOM 1214 C PHE A 73 110.317 -14.082 5.987 1.00 0.00 C ATOM 1215 O PHE A 73 109.934 -13.335 5.104 1.00 0.00 O ATOM 1216 CB PHE A 73 112.312 -15.521 5.452 1.00 0.00 C ATOM 1217 CG PHE A 73 112.869 -16.907 5.231 1.00 0.00 C ATOM 1218 CD1 PHE A 73 113.192 -17.734 6.351 1.00 0.00 C ATOM 1219 CD2 PHE A 73 113.072 -17.392 3.901 1.00 0.00 C ATOM 1220 CE1 PHE A 73 113.719 -19.046 6.141 1.00 0.00 C ATOM 1221 CE2 PHE A 73 113.599 -18.704 3.692 1.00 0.00 C ATOM 1222 CZ PHE A 73 113.923 -19.531 4.813 1.00 0.00 C ATOM 0 H PHE A 73 110.779 -15.804 3.547 1.00 0.00 H new ATOM 0 HA PHE A 73 110.499 -16.137 6.493 1.00 0.00 H new ATOM 0 HB2 PHE A 73 112.562 -14.896 4.595 1.00 0.00 H new ATOM 0 HB3 PHE A 73 112.797 -15.078 6.322 1.00 0.00 H new ATOM 0 HD1 PHE A 73 113.038 -17.368 7.355 1.00 0.00 H new ATOM 0 HD2 PHE A 73 112.827 -16.767 3.055 1.00 0.00 H new ATOM 0 HE1 PHE A 73 113.963 -19.671 6.987 1.00 0.00 H new ATOM 0 HE2 PHE A 73 113.753 -19.071 2.688 1.00 0.00 H new ATOM 0 HZ PHE A 73 114.322 -20.522 4.655 1.00 0.00 H new ATOM 1232 N GLY A 74 110.342 -13.721 7.251 1.00 0.00 N ATOM 1233 CA GLY A 74 109.819 -12.395 7.698 1.00 0.00 C ATOM 1234 C GLY A 74 110.694 -11.270 7.136 1.00 0.00 C ATOM 1235 O GLY A 74 111.847 -11.485 6.805 1.00 0.00 O ATOM 0 H GLY A 74 110.711 -14.304 8.003 1.00 0.00 H new ATOM 0 HA2 GLY A 74 108.790 -12.269 7.362 1.00 0.00 H new ATOM 0 HA3 GLY A 74 109.807 -12.348 8.787 1.00 0.00 H new ATOM 1239 N VAL A 75 110.143 -10.083 7.038 1.00 0.00 N ATOM 1240 CA VAL A 75 110.871 -8.945 6.390 1.00 0.00 C ATOM 1241 C VAL A 75 110.654 -7.652 7.180 1.00 0.00 C ATOM 1242 O VAL A 75 109.692 -7.532 7.919 1.00 0.00 O ATOM 1243 CB VAL A 75 110.314 -8.823 4.960 1.00 0.00 C ATOM 1244 CG1 VAL A 75 110.637 -10.096 4.173 1.00 0.00 C ATOM 1245 CG2 VAL A 75 108.794 -8.612 4.965 1.00 0.00 C ATOM 0 H VAL A 75 109.211 -9.852 7.383 1.00 0.00 H new ATOM 0 HA VAL A 75 111.946 -9.124 6.369 1.00 0.00 H new ATOM 0 HB VAL A 75 110.782 -7.957 4.492 1.00 0.00 H new ATOM 0 HG11 VAL A 75 110.242 -10.008 3.161 1.00 0.00 H new ATOM 0 HG12 VAL A 75 111.718 -10.233 4.130 1.00 0.00 H new ATOM 0 HG13 VAL A 75 110.182 -10.954 4.667 1.00 0.00 H new ATOM 0 HG21 VAL A 75 108.435 -8.530 3.939 1.00 0.00 H new ATOM 0 HG22 VAL A 75 108.311 -9.459 5.452 1.00 0.00 H new ATOM 0 HG23 VAL A 75 108.555 -7.697 5.507 1.00 0.00 H new ATOM 1255 N LYS A 76 111.543 -6.699 7.023 1.00 0.00 N ATOM 1256 CA LYS A 76 111.401 -5.380 7.714 1.00 0.00 C ATOM 1257 C LYS A 76 111.334 -4.259 6.673 1.00 0.00 C ATOM 1258 O LYS A 76 112.075 -4.273 5.706 1.00 0.00 O ATOM 1259 CB LYS A 76 112.662 -5.239 8.572 1.00 0.00 C ATOM 1260 CG LYS A 76 112.669 -6.307 9.669 1.00 0.00 C ATOM 1261 CD LYS A 76 113.909 -6.131 10.547 1.00 0.00 C ATOM 1262 CE LYS A 76 113.951 -7.241 11.600 1.00 0.00 C ATOM 1263 NZ LYS A 76 114.950 -6.780 12.604 1.00 0.00 N ATOM 0 H LYS A 76 112.373 -6.782 6.436 1.00 0.00 H new ATOM 0 HA LYS A 76 110.495 -5.320 8.317 1.00 0.00 H new ATOM 0 HB2 LYS A 76 113.550 -5.341 7.948 1.00 0.00 H new ATOM 0 HB3 LYS A 76 112.699 -4.246 9.019 1.00 0.00 H new ATOM 0 HG2 LYS A 76 111.767 -6.226 10.275 1.00 0.00 H new ATOM 0 HG3 LYS A 76 112.665 -7.301 9.223 1.00 0.00 H new ATOM 0 HD2 LYS A 76 114.809 -6.163 9.934 1.00 0.00 H new ATOM 0 HD3 LYS A 76 113.888 -5.155 11.032 1.00 0.00 H new ATOM 0 HE2 LYS A 76 112.972 -7.390 12.056 1.00 0.00 H new ATOM 0 HE3 LYS A 76 114.245 -8.193 11.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 115.225 -7.578 13.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 115.791 -6.413 12.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 114.533 -6.027 13.188 1.00 0.00 H new ATOM 1277 N VAL A 77 110.455 -3.302 6.872 1.00 0.00 N ATOM 1278 CA VAL A 77 110.262 -2.208 5.865 1.00 0.00 C ATOM 1279 C VAL A 77 110.219 -0.855 6.589 1.00 0.00 C ATOM 1280 O VAL A 77 109.663 -0.750 7.667 1.00 0.00 O ATOM 1281 CB VAL A 77 108.923 -2.512 5.164 1.00 0.00 C ATOM 1282 CG1 VAL A 77 108.634 -1.463 4.083 1.00 0.00 C ATOM 1283 CG2 VAL A 77 108.973 -3.889 4.489 1.00 0.00 C ATOM 0 H VAL A 77 109.858 -3.233 7.696 1.00 0.00 H new ATOM 0 HA VAL A 77 111.073 -2.160 5.138 1.00 0.00 H new ATOM 0 HB VAL A 77 108.140 -2.494 5.922 1.00 0.00 H new ATOM 0 HG11 VAL A 77 107.685 -1.692 3.598 1.00 0.00 H new ATOM 0 HG12 VAL A 77 108.578 -0.475 4.540 1.00 0.00 H new ATOM 0 HG13 VAL A 77 109.433 -1.475 3.342 1.00 0.00 H new ATOM 0 HG21 VAL A 77 108.020 -4.089 3.999 1.00 0.00 H new ATOM 0 HG22 VAL A 77 109.772 -3.902 3.748 1.00 0.00 H new ATOM 0 HG23 VAL A 77 109.162 -4.656 5.240 1.00 0.00 H new ATOM 1293 N LEU A 78 110.803 0.164 5.996 1.00 0.00 N ATOM 1294 CA LEU A 78 110.785 1.529 6.610 1.00 0.00 C ATOM 1295 C LEU A 78 110.507 2.595 5.529 1.00 0.00 C ATOM 1296 O LEU A 78 111.221 2.624 4.544 1.00 0.00 O ATOM 1297 CB LEU A 78 112.191 1.691 7.197 1.00 0.00 C ATOM 1298 CG LEU A 78 112.320 3.016 7.957 1.00 0.00 C ATOM 1299 CD1 LEU A 78 111.447 2.997 9.214 1.00 0.00 C ATOM 1300 CD2 LEU A 78 113.779 3.207 8.370 1.00 0.00 C ATOM 0 H LEU A 78 111.295 0.104 5.105 1.00 0.00 H new ATOM 0 HA LEU A 78 110.008 1.649 7.365 1.00 0.00 H new ATOM 0 HB2 LEU A 78 112.406 0.860 7.869 1.00 0.00 H new ATOM 0 HB3 LEU A 78 112.930 1.654 6.396 1.00 0.00 H new ATOM 0 HG LEU A 78 111.995 3.831 7.311 1.00 0.00 H new ATOM 0 HD11 LEU A 78 111.550 3.945 9.743 1.00 0.00 H new ATOM 0 HD12 LEU A 78 110.405 2.850 8.931 1.00 0.00 H new ATOM 0 HD13 LEU A 78 111.764 2.182 9.865 1.00 0.00 H new ATOM 0 HD21 LEU A 78 113.884 4.147 8.912 1.00 0.00 H new ATOM 0 HD22 LEU A 78 114.086 2.382 9.012 1.00 0.00 H new ATOM 0 HD23 LEU A 78 114.409 3.229 7.481 1.00 0.00 H new ATOM 1312 N PRO A 79 109.498 3.436 5.719 1.00 0.00 N ATOM 1313 CA PRO A 79 109.207 4.528 4.732 1.00 0.00 C ATOM 1314 C PRO A 79 110.368 5.528 4.641 1.00 0.00 C ATOM 1315 O PRO A 79 111.079 5.746 5.606 1.00 0.00 O ATOM 1316 CB PRO A 79 107.961 5.208 5.312 1.00 0.00 C ATOM 1317 CG PRO A 79 107.349 4.154 6.164 1.00 0.00 C ATOM 1318 CD PRO A 79 108.513 3.479 6.820 1.00 0.00 C ATOM 0 HA PRO A 79 109.064 4.148 3.720 1.00 0.00 H new ATOM 0 HB2 PRO A 79 108.222 6.092 5.894 1.00 0.00 H new ATOM 0 HB3 PRO A 79 107.280 5.533 4.526 1.00 0.00 H new ATOM 0 HG2 PRO A 79 106.672 4.584 6.902 1.00 0.00 H new ATOM 0 HG3 PRO A 79 106.767 3.451 5.569 1.00 0.00 H new ATOM 0 HD2 PRO A 79 108.882 4.042 7.677 1.00 0.00 H new ATOM 0 HD3 PRO A 79 108.258 2.482 7.180 1.00 0.00 H new ATOM 1326 N ILE A 80 110.553 6.123 3.484 1.00 0.00 N ATOM 1327 CA ILE A 80 111.531 7.249 3.331 1.00 0.00 C ATOM 1328 C ILE A 80 110.971 8.313 2.379 1.00 0.00 C ATOM 1329 O ILE A 80 109.964 8.095 1.729 1.00 0.00 O ATOM 1330 CB ILE A 80 112.827 6.636 2.765 1.00 0.00 C ATOM 1331 CG1 ILE A 80 112.568 5.935 1.419 1.00 0.00 C ATOM 1332 CG2 ILE A 80 113.398 5.628 3.770 1.00 0.00 C ATOM 1333 CD1 ILE A 80 113.897 5.559 0.756 1.00 0.00 C ATOM 0 H ILE A 80 110.060 5.872 2.627 1.00 0.00 H new ATOM 0 HA ILE A 80 111.721 7.739 4.286 1.00 0.00 H new ATOM 0 HB ILE A 80 113.543 7.440 2.598 1.00 0.00 H new ATOM 0 HG12 ILE A 80 111.965 5.040 1.576 1.00 0.00 H new ATOM 0 HG13 ILE A 80 111.998 6.592 0.762 1.00 0.00 H new ATOM 0 HG21 ILE A 80 114.314 5.194 3.370 1.00 0.00 H new ATOM 0 HG22 ILE A 80 113.617 6.135 4.710 1.00 0.00 H new ATOM 0 HG23 ILE A 80 112.669 4.837 3.946 1.00 0.00 H new ATOM 0 HD11 ILE A 80 113.702 5.064 -0.195 1.00 0.00 H new ATOM 0 HD12 ILE A 80 114.485 6.460 0.582 1.00 0.00 H new ATOM 0 HD13 ILE A 80 114.451 4.885 1.409 1.00 0.00 H new ATOM 1345 N LYS A 81 111.623 9.448 2.301 1.00 0.00 N ATOM 1346 CA LYS A 81 111.320 10.442 1.227 1.00 0.00 C ATOM 1347 C LYS A 81 112.554 10.608 0.336 1.00 0.00 C ATOM 1348 O LYS A 81 113.645 10.821 0.832 1.00 0.00 O ATOM 1349 CB LYS A 81 110.996 11.747 1.957 1.00 0.00 C ATOM 1350 CG LYS A 81 109.701 11.588 2.759 1.00 0.00 C ATOM 1351 CD LYS A 81 108.507 11.534 1.803 1.00 0.00 C ATOM 1352 CE LYS A 81 107.207 11.635 2.603 1.00 0.00 C ATOM 1353 NZ LYS A 81 107.020 13.092 2.850 1.00 0.00 N ATOM 0 H LYS A 81 112.362 9.730 2.945 1.00 0.00 H new ATOM 0 HA LYS A 81 110.492 10.134 0.589 1.00 0.00 H new ATOM 0 HB2 LYS A 81 111.816 12.014 2.623 1.00 0.00 H new ATOM 0 HB3 LYS A 81 110.891 12.560 1.238 1.00 0.00 H new ATOM 0 HG2 LYS A 81 109.742 10.678 3.358 1.00 0.00 H new ATOM 0 HG3 LYS A 81 109.587 12.421 3.453 1.00 0.00 H new ATOM 0 HD2 LYS A 81 108.567 12.350 1.083 1.00 0.00 H new ATOM 0 HD3 LYS A 81 108.525 10.604 1.234 1.00 0.00 H new ATOM 0 HE2 LYS A 81 106.368 11.218 2.047 1.00 0.00 H new ATOM 0 HE3 LYS A 81 107.276 11.081 3.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 106.684 13.239 3.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 107.926 13.585 2.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 106.319 13.470 2.181 1.00 0.00 H new ATOM 1367 N ILE A 82 112.380 10.510 -0.961 1.00 0.00 N ATOM 1368 CA ILE A 82 113.546 10.523 -1.901 1.00 0.00 C ATOM 1369 C ILE A 82 113.597 11.883 -2.605 1.00 0.00 C ATOM 1370 O ILE A 82 112.624 12.303 -3.206 1.00 0.00 O ATOM 1371 CB ILE A 82 113.298 9.376 -2.902 1.00 0.00 C ATOM 1372 CG1 ILE A 82 113.203 8.033 -2.166 1.00 0.00 C ATOM 1373 CG2 ILE A 82 114.452 9.289 -3.909 1.00 0.00 C ATOM 1374 CD1 ILE A 82 112.603 6.977 -3.097 1.00 0.00 C ATOM 0 H ILE A 82 111.470 10.421 -1.413 1.00 0.00 H new ATOM 0 HA ILE A 82 114.501 10.380 -1.394 1.00 0.00 H new ATOM 0 HB ILE A 82 112.362 9.583 -3.421 1.00 0.00 H new ATOM 0 HG12 ILE A 82 114.192 7.719 -1.833 1.00 0.00 H new ATOM 0 HG13 ILE A 82 112.585 8.139 -1.274 1.00 0.00 H new ATOM 0 HG21 ILE A 82 114.263 8.475 -4.609 1.00 0.00 H new ATOM 0 HG22 ILE A 82 114.529 10.228 -4.457 1.00 0.00 H new ATOM 0 HG23 ILE A 82 115.385 9.102 -3.378 1.00 0.00 H new ATOM 0 HD11 ILE A 82 112.537 6.024 -2.572 1.00 0.00 H new ATOM 0 HD12 ILE A 82 111.606 7.290 -3.408 1.00 0.00 H new ATOM 0 HD13 ILE A 82 113.238 6.863 -3.976 1.00 0.00 H new ATOM 1386 N LEU A 83 114.723 12.556 -2.528 1.00 0.00 N ATOM 1387 CA LEU A 83 114.865 13.905 -3.156 1.00 0.00 C ATOM 1388 C LEU A 83 115.761 13.819 -4.395 1.00 0.00 C ATOM 1389 O LEU A 83 116.931 13.490 -4.291 1.00 0.00 O ATOM 1390 CB LEU A 83 115.520 14.784 -2.086 1.00 0.00 C ATOM 1391 CG LEU A 83 114.583 14.945 -0.883 1.00 0.00 C ATOM 1392 CD1 LEU A 83 115.342 15.609 0.266 1.00 0.00 C ATOM 1393 CD2 LEU A 83 113.390 15.822 -1.273 1.00 0.00 C ATOM 0 H LEU A 83 115.559 12.220 -2.049 1.00 0.00 H new ATOM 0 HA LEU A 83 113.905 14.307 -3.480 1.00 0.00 H new ATOM 0 HB2 LEU A 83 116.461 14.338 -1.765 1.00 0.00 H new ATOM 0 HB3 LEU A 83 115.757 15.762 -2.504 1.00 0.00 H new ATOM 0 HG LEU A 83 114.226 13.964 -0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 83 114.678 15.724 1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 83 116.192 14.988 0.548 1.00 0.00 H new ATOM 0 HD13 LEU A 83 115.698 16.589 -0.052 1.00 0.00 H new ATOM 0 HD21 LEU A 83 112.726 15.935 -0.416 1.00 0.00 H new ATOM 0 HD22 LEU A 83 113.747 16.803 -1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 83 112.847 15.354 -2.094 1.00 0.00 H new ATOM 1405 N ILE A 84 115.213 14.111 -5.552 1.00 0.00 N ATOM 1406 CA ILE A 84 116.018 14.123 -6.814 1.00 0.00 C ATOM 1407 C ILE A 84 115.750 15.447 -7.540 1.00 0.00 C ATOM 1408 O ILE A 84 114.615 15.757 -7.859 1.00 0.00 O ATOM 1409 CB ILE A 84 115.538 12.914 -7.639 1.00 0.00 C ATOM 1410 CG1 ILE A 84 115.773 11.611 -6.860 1.00 0.00 C ATOM 1411 CG2 ILE A 84 116.316 12.829 -8.959 1.00 0.00 C ATOM 1412 CD1 ILE A 84 114.994 10.467 -7.517 1.00 0.00 C ATOM 0 H ILE A 84 114.228 14.345 -5.675 1.00 0.00 H new ATOM 0 HA ILE A 84 117.091 14.049 -6.640 1.00 0.00 H new ATOM 0 HB ILE A 84 114.474 13.044 -7.839 1.00 0.00 H new ATOM 0 HG12 ILE A 84 116.837 11.375 -6.841 1.00 0.00 H new ATOM 0 HG13 ILE A 84 115.455 11.733 -5.825 1.00 0.00 H new ATOM 0 HG21 ILE A 84 115.967 11.970 -9.532 1.00 0.00 H new ATOM 0 HG22 ILE A 84 116.155 13.740 -9.536 1.00 0.00 H new ATOM 0 HG23 ILE A 84 117.379 12.716 -8.748 1.00 0.00 H new ATOM 0 HD11 ILE A 84 115.164 9.545 -6.961 1.00 0.00 H new ATOM 0 HD12 ILE A 84 113.930 10.702 -7.513 1.00 0.00 H new ATOM 0 HD13 ILE A 84 115.334 10.339 -8.545 1.00 0.00 H new ATOM 1424 N GLY A 85 116.784 16.219 -7.795 1.00 0.00 N ATOM 1425 CA GLY A 85 116.617 17.552 -8.453 1.00 0.00 C ATOM 1426 C GLY A 85 115.826 18.491 -7.534 1.00 0.00 C ATOM 1427 O GLY A 85 116.245 18.766 -6.423 1.00 0.00 O ATOM 0 H GLY A 85 117.749 15.975 -7.571 1.00 0.00 H new ATOM 0 HA2 GLY A 85 117.593 17.983 -8.675 1.00 0.00 H new ATOM 0 HA3 GLY A 85 116.097 17.436 -9.404 1.00 0.00 H new ATOM 1431 N ASN A 86 114.697 18.976 -7.998 1.00 0.00 N ATOM 1432 CA ASN A 86 113.805 19.826 -7.147 1.00 0.00 C ATOM 1433 C ASN A 86 112.491 19.107 -6.792 1.00 0.00 C ATOM 1434 O ASN A 86 111.543 19.751 -6.380 1.00 0.00 O ATOM 1435 CB ASN A 86 113.539 21.099 -7.969 1.00 0.00 C ATOM 1436 CG ASN A 86 112.852 20.777 -9.304 1.00 0.00 C ATOM 1437 OD1 ASN A 86 113.314 19.940 -10.053 1.00 0.00 O ATOM 1438 ND2 ASN A 86 111.760 21.412 -9.631 1.00 0.00 N ATOM 0 H ASN A 86 114.352 18.816 -8.944 1.00 0.00 H new ATOM 0 HA ASN A 86 114.277 20.053 -6.191 1.00 0.00 H new ATOM 0 HB2 ASN A 86 112.914 21.781 -7.393 1.00 0.00 H new ATOM 0 HB3 ASN A 86 114.481 21.614 -8.159 1.00 0.00 H new ATOM 0 HD21 ASN A 86 111.295 21.205 -10.515 1.00 0.00 H new ATOM 0 HD22 ASN A 86 111.371 22.115 -9.003 1.00 0.00 H new ATOM 1445 N LYS A 87 112.430 17.800 -6.944 1.00 0.00 N ATOM 1446 CA LYS A 87 111.151 17.054 -6.723 1.00 0.00 C ATOM 1447 C LYS A 87 111.319 16.020 -5.606 1.00 0.00 C ATOM 1448 O LYS A 87 112.381 15.443 -5.451 1.00 0.00 O ATOM 1449 CB LYS A 87 110.863 16.355 -8.053 1.00 0.00 C ATOM 1450 CG LYS A 87 110.536 17.398 -9.124 1.00 0.00 C ATOM 1451 CD LYS A 87 110.136 16.691 -10.420 1.00 0.00 C ATOM 1452 CE LYS A 87 109.922 17.729 -11.524 1.00 0.00 C ATOM 1453 NZ LYS A 87 109.059 17.048 -12.529 1.00 0.00 N ATOM 0 H LYS A 87 113.222 17.216 -7.214 1.00 0.00 H new ATOM 0 HA LYS A 87 110.340 17.717 -6.422 1.00 0.00 H new ATOM 0 HB2 LYS A 87 111.726 15.764 -8.359 1.00 0.00 H new ATOM 0 HB3 LYS A 87 110.028 15.664 -7.938 1.00 0.00 H new ATOM 0 HG2 LYS A 87 109.725 18.042 -8.784 1.00 0.00 H new ATOM 0 HG3 LYS A 87 111.400 18.039 -9.299 1.00 0.00 H new ATOM 0 HD2 LYS A 87 110.912 15.985 -10.716 1.00 0.00 H new ATOM 0 HD3 LYS A 87 109.223 16.115 -10.266 1.00 0.00 H new ATOM 0 HE2 LYS A 87 109.442 18.627 -11.134 1.00 0.00 H new ATOM 0 HE3 LYS A 87 110.870 18.040 -11.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 108.867 17.697 -13.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 109.545 16.201 -12.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 108.161 16.770 -12.084 1.00 0.00 H new ATOM 1467 N LYS A 88 110.278 15.793 -4.837 1.00 0.00 N ATOM 1468 CA LYS A 88 110.320 14.762 -3.751 1.00 0.00 C ATOM 1469 C LYS A 88 109.201 13.731 -3.955 1.00 0.00 C ATOM 1470 O LYS A 88 108.056 14.091 -4.162 1.00 0.00 O ATOM 1471 CB LYS A 88 110.157 15.527 -2.426 1.00 0.00 C ATOM 1472 CG LYS A 88 108.838 16.312 -2.378 1.00 0.00 C ATOM 1473 CD LYS A 88 108.739 17.058 -1.046 1.00 0.00 C ATOM 1474 CE LYS A 88 109.707 18.243 -1.050 1.00 0.00 C ATOM 1475 NZ LYS A 88 109.524 18.894 0.277 1.00 0.00 N ATOM 0 H LYS A 88 109.389 16.286 -4.918 1.00 0.00 H new ATOM 0 HA LYS A 88 111.257 14.204 -3.755 1.00 0.00 H new ATOM 0 HB2 LYS A 88 110.192 14.824 -1.594 1.00 0.00 H new ATOM 0 HB3 LYS A 88 110.993 16.214 -2.298 1.00 0.00 H new ATOM 0 HG2 LYS A 88 108.792 17.018 -3.207 1.00 0.00 H new ATOM 0 HG3 LYS A 88 107.993 15.632 -2.491 1.00 0.00 H new ATOM 0 HD2 LYS A 88 107.719 17.409 -0.889 1.00 0.00 H new ATOM 0 HD3 LYS A 88 108.975 16.385 -0.222 1.00 0.00 H new ATOM 0 HE2 LYS A 88 110.736 17.912 -1.189 1.00 0.00 H new ATOM 0 HE3 LYS A 88 109.482 18.934 -1.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 110.156 19.717 0.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 108.537 19.205 0.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 109.752 18.215 1.031 1.00 0.00 H new ATOM 1489 N ILE A 89 109.540 12.464 -3.897 1.00 0.00 N ATOM 1490 CA ILE A 89 108.526 11.378 -4.084 1.00 0.00 C ATOM 1491 C ILE A 89 108.596 10.420 -2.886 1.00 0.00 C ATOM 1492 O ILE A 89 109.661 10.194 -2.341 1.00 0.00 O ATOM 1493 CB ILE A 89 108.905 10.666 -5.398 1.00 0.00 C ATOM 1494 CG1 ILE A 89 108.867 11.655 -6.572 1.00 0.00 C ATOM 1495 CG2 ILE A 89 107.916 9.532 -5.697 1.00 0.00 C ATOM 1496 CD1 ILE A 89 109.586 11.048 -7.779 1.00 0.00 C ATOM 0 H ILE A 89 110.489 12.133 -3.726 1.00 0.00 H new ATOM 0 HA ILE A 89 107.506 11.758 -4.140 1.00 0.00 H new ATOM 0 HB ILE A 89 109.911 10.263 -5.280 1.00 0.00 H new ATOM 0 HG12 ILE A 89 107.834 11.888 -6.831 1.00 0.00 H new ATOM 0 HG13 ILE A 89 109.343 12.593 -6.286 1.00 0.00 H new ATOM 0 HG21 ILE A 89 108.198 9.040 -6.628 1.00 0.00 H new ATOM 0 HG22 ILE A 89 107.936 8.808 -4.883 1.00 0.00 H new ATOM 0 HG23 ILE A 89 106.911 9.942 -5.793 1.00 0.00 H new ATOM 0 HD11 ILE A 89 109.558 11.752 -8.611 1.00 0.00 H new ATOM 0 HD12 ILE A 89 110.623 10.837 -7.517 1.00 0.00 H new ATOM 0 HD13 ILE A 89 109.090 10.122 -8.070 1.00 0.00 H new ATOM 1508 N ASP A 90 107.471 9.873 -2.486 1.00 0.00 N ATOM 1509 CA ASP A 90 107.452 8.887 -1.355 1.00 0.00 C ATOM 1510 C ASP A 90 108.033 7.549 -1.818 1.00 0.00 C ATOM 1511 O ASP A 90 107.729 7.087 -2.903 1.00 0.00 O ATOM 1512 CB ASP A 90 105.982 8.716 -0.957 1.00 0.00 C ATOM 1513 CG ASP A 90 105.449 10.029 -0.380 1.00 0.00 C ATOM 1514 OD1 ASP A 90 105.554 11.038 -1.057 1.00 0.00 O ATOM 1515 OD2 ASP A 90 104.942 10.002 0.730 1.00 0.00 O ATOM 0 H ASP A 90 106.558 10.069 -2.897 1.00 0.00 H new ATOM 0 HA ASP A 90 108.051 9.234 -0.513 1.00 0.00 H new ATOM 0 HB2 ASP A 90 105.392 8.423 -1.825 1.00 0.00 H new ATOM 0 HB3 ASP A 90 105.885 7.918 -0.221 1.00 0.00 H new ATOM 1520 N GLY A 91 108.861 6.936 -1.001 1.00 0.00 N ATOM 1521 CA GLY A 91 109.440 5.601 -1.341 1.00 0.00 C ATOM 1522 C GLY A 91 109.634 4.797 -0.055 1.00 0.00 C ATOM 1523 O GLY A 91 109.129 5.172 0.988 1.00 0.00 O ATOM 0 H GLY A 91 109.162 7.312 -0.102 1.00 0.00 H new ATOM 0 HA2 GLY A 91 108.778 5.067 -2.022 1.00 0.00 H new ATOM 0 HA3 GLY A 91 110.393 5.725 -1.855 1.00 0.00 H new ATOM 1527 N ALA A 92 110.363 3.707 -0.129 1.00 0.00 N ATOM 1528 CA ALA A 92 110.608 2.858 1.077 1.00 0.00 C ATOM 1529 C ALA A 92 111.843 1.978 0.867 1.00 0.00 C ATOM 1530 O ALA A 92 112.203 1.678 -0.256 1.00 0.00 O ATOM 1531 CB ALA A 92 109.352 1.998 1.221 1.00 0.00 C ATOM 0 H ALA A 92 110.803 3.368 -0.985 1.00 0.00 H new ATOM 0 HA ALA A 92 110.796 3.456 1.969 1.00 0.00 H new ATOM 0 HB1 ALA A 92 109.456 1.345 2.088 1.00 0.00 H new ATOM 0 HB2 ALA A 92 108.483 2.642 1.354 1.00 0.00 H new ATOM 0 HB3 ALA A 92 109.221 1.393 0.324 1.00 0.00 H new ATOM 1537 N ILE A 93 112.478 1.572 1.943 1.00 0.00 N ATOM 1538 CA ILE A 93 113.665 0.665 1.849 1.00 0.00 C ATOM 1539 C ILE A 93 113.258 -0.723 2.361 1.00 0.00 C ATOM 1540 O ILE A 93 112.498 -0.831 3.307 1.00 0.00 O ATOM 1541 CB ILE A 93 114.755 1.285 2.746 1.00 0.00 C ATOM 1542 CG1 ILE A 93 115.100 2.705 2.278 1.00 0.00 C ATOM 1543 CG2 ILE A 93 116.034 0.439 2.687 1.00 0.00 C ATOM 1544 CD1 ILE A 93 115.892 3.426 3.371 1.00 0.00 C ATOM 0 H ILE A 93 112.219 1.835 2.894 1.00 0.00 H new ATOM 0 HA ILE A 93 114.032 0.557 0.828 1.00 0.00 H new ATOM 0 HB ILE A 93 114.368 1.316 3.765 1.00 0.00 H new ATOM 0 HG12 ILE A 93 115.684 2.664 1.358 1.00 0.00 H new ATOM 0 HG13 ILE A 93 114.187 3.256 2.052 1.00 0.00 H new ATOM 0 HG21 ILE A 93 116.796 0.887 3.324 1.00 0.00 H new ATOM 0 HG22 ILE A 93 115.818 -0.571 3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 93 116.397 0.400 1.660 1.00 0.00 H new ATOM 0 HD11 ILE A 93 116.137 4.435 3.038 1.00 0.00 H new ATOM 0 HD12 ILE A 93 115.292 3.480 4.280 1.00 0.00 H new ATOM 0 HD13 ILE A 93 116.812 2.878 3.575 1.00 0.00 H new ATOM 1556 N VAL A 94 113.764 -1.763 1.739 1.00 0.00 N ATOM 1557 CA VAL A 94 113.365 -3.159 2.111 1.00 0.00 C ATOM 1558 C VAL A 94 114.615 -3.948 2.527 1.00 0.00 C ATOM 1559 O VAL A 94 115.617 -3.933 1.834 1.00 0.00 O ATOM 1560 CB VAL A 94 112.713 -3.762 0.850 1.00 0.00 C ATOM 1561 CG1 VAL A 94 112.239 -5.195 1.125 1.00 0.00 C ATOM 1562 CG2 VAL A 94 111.495 -2.932 0.428 1.00 0.00 C ATOM 0 H VAL A 94 114.444 -1.703 0.981 1.00 0.00 H new ATOM 0 HA VAL A 94 112.670 -3.187 2.951 1.00 0.00 H new ATOM 0 HB VAL A 94 113.461 -3.760 0.057 1.00 0.00 H new ATOM 0 HG11 VAL A 94 111.781 -5.606 0.225 1.00 0.00 H new ATOM 0 HG12 VAL A 94 113.091 -5.811 1.413 1.00 0.00 H new ATOM 0 HG13 VAL A 94 111.507 -5.188 1.933 1.00 0.00 H new ATOM 0 HG21 VAL A 94 111.047 -3.371 -0.463 1.00 0.00 H new ATOM 0 HG22 VAL A 94 110.763 -2.923 1.236 1.00 0.00 H new ATOM 0 HG23 VAL A 94 111.808 -1.911 0.211 1.00 0.00 H new ATOM 1572 N VAL A 95 114.547 -4.626 3.650 1.00 0.00 N ATOM 1573 CA VAL A 95 115.678 -5.496 4.105 1.00 0.00 C ATOM 1574 C VAL A 95 115.093 -6.761 4.764 1.00 0.00 C ATOM 1575 O VAL A 95 114.152 -6.642 5.526 1.00 0.00 O ATOM 1576 CB VAL A 95 116.473 -4.650 5.119 1.00 0.00 C ATOM 1577 CG1 VAL A 95 117.671 -5.443 5.656 1.00 0.00 C ATOM 1578 CG2 VAL A 95 117.006 -3.377 4.450 1.00 0.00 C ATOM 0 H VAL A 95 113.744 -4.612 4.278 1.00 0.00 H new ATOM 0 HA VAL A 95 116.324 -5.819 3.289 1.00 0.00 H new ATOM 0 HB VAL A 95 115.800 -4.391 5.936 1.00 0.00 H new ATOM 0 HG11 VAL A 95 118.222 -4.831 6.371 1.00 0.00 H new ATOM 0 HG12 VAL A 95 117.317 -6.348 6.150 1.00 0.00 H new ATOM 0 HG13 VAL A 95 118.328 -5.715 4.829 1.00 0.00 H new ATOM 0 HG21 VAL A 95 117.565 -2.790 5.179 1.00 0.00 H new ATOM 0 HG22 VAL A 95 117.661 -3.648 3.622 1.00 0.00 H new ATOM 0 HG23 VAL A 95 116.171 -2.787 4.073 1.00 0.00 H new ATOM 1588 N PRO A 96 115.641 -7.933 4.472 1.00 0.00 N ATOM 1589 CA PRO A 96 115.166 -9.197 5.131 1.00 0.00 C ATOM 1590 C PRO A 96 115.286 -9.123 6.661 1.00 0.00 C ATOM 1591 O PRO A 96 116.097 -8.378 7.182 1.00 0.00 O ATOM 1592 CB PRO A 96 116.114 -10.261 4.572 1.00 0.00 C ATOM 1593 CG PRO A 96 116.538 -9.699 3.263 1.00 0.00 C ATOM 1594 CD PRO A 96 116.727 -8.235 3.514 1.00 0.00 C ATOM 0 HA PRO A 96 114.114 -9.399 4.932 1.00 0.00 H new ATOM 0 HB2 PRO A 96 116.966 -10.426 5.232 1.00 0.00 H new ATOM 0 HB3 PRO A 96 115.613 -11.221 4.452 1.00 0.00 H new ATOM 0 HG2 PRO A 96 117.461 -10.162 2.915 1.00 0.00 H new ATOM 0 HG3 PRO A 96 115.784 -9.874 2.495 1.00 0.00 H new ATOM 0 HD2 PRO A 96 117.710 -8.018 3.933 1.00 0.00 H new ATOM 0 HD3 PRO A 96 116.635 -7.651 2.598 1.00 0.00 H new ATOM 1602 N LYS A 97 114.481 -9.889 7.365 1.00 0.00 N ATOM 1603 CA LYS A 97 114.516 -9.881 8.866 1.00 0.00 C ATOM 1604 C LYS A 97 115.856 -10.427 9.373 1.00 0.00 C ATOM 1605 O LYS A 97 116.389 -9.941 10.355 1.00 0.00 O ATOM 1606 CB LYS A 97 113.365 -10.784 9.328 1.00 0.00 C ATOM 1607 CG LYS A 97 113.174 -10.652 10.842 1.00 0.00 C ATOM 1608 CD LYS A 97 112.109 -11.646 11.309 1.00 0.00 C ATOM 1609 CE LYS A 97 111.971 -11.571 12.832 1.00 0.00 C ATOM 1610 NZ LYS A 97 110.570 -11.995 13.111 1.00 0.00 N ATOM 0 H LYS A 97 113.795 -10.525 6.959 1.00 0.00 H new ATOM 0 HA LYS A 97 114.409 -8.869 9.258 1.00 0.00 H new ATOM 0 HB2 LYS A 97 112.446 -10.509 8.811 1.00 0.00 H new ATOM 0 HB3 LYS A 97 113.578 -11.821 9.069 1.00 0.00 H new ATOM 0 HG2 LYS A 97 114.116 -10.843 11.356 1.00 0.00 H new ATOM 0 HG3 LYS A 97 112.874 -9.635 11.094 1.00 0.00 H new ATOM 0 HD2 LYS A 97 111.154 -11.420 10.835 1.00 0.00 H new ATOM 0 HD3 LYS A 97 112.383 -12.657 11.008 1.00 0.00 H new ATOM 0 HE2 LYS A 97 112.688 -12.226 13.326 1.00 0.00 H new ATOM 0 HE3 LYS A 97 112.158 -10.561 13.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 110.397 -11.970 14.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 109.910 -11.349 12.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 110.423 -12.963 12.759 1.00 0.00 H new ATOM 1624 N LYS A 98 116.389 -11.425 8.706 1.00 0.00 N ATOM 1625 CA LYS A 98 117.663 -12.067 9.161 1.00 0.00 C ATOM 1626 C LYS A 98 118.860 -11.439 8.442 1.00 0.00 C ATOM 1627 O LYS A 98 118.941 -11.473 7.227 1.00 0.00 O ATOM 1628 CB LYS A 98 117.528 -13.544 8.787 1.00 0.00 C ATOM 1629 CG LYS A 98 118.663 -14.342 9.433 1.00 0.00 C ATOM 1630 CD LYS A 98 118.565 -15.808 9.008 1.00 0.00 C ATOM 1631 CE LYS A 98 119.599 -16.633 9.776 1.00 0.00 C ATOM 1632 NZ LYS A 98 119.671 -17.933 9.049 1.00 0.00 N ATOM 0 H LYS A 98 115.990 -11.825 7.857 1.00 0.00 H new ATOM 0 HA LYS A 98 117.828 -11.934 10.230 1.00 0.00 H new ATOM 0 HB2 LYS A 98 116.564 -13.928 9.121 1.00 0.00 H new ATOM 0 HB3 LYS A 98 117.559 -13.660 7.704 1.00 0.00 H new ATOM 0 HG2 LYS A 98 119.627 -13.930 9.134 1.00 0.00 H new ATOM 0 HG3 LYS A 98 118.605 -14.263 10.519 1.00 0.00 H new ATOM 0 HD2 LYS A 98 117.562 -16.188 9.204 1.00 0.00 H new ATOM 0 HD3 LYS A 98 118.736 -15.899 7.935 1.00 0.00 H new ATOM 0 HE2 LYS A 98 120.569 -16.135 9.792 1.00 0.00 H new ATOM 0 HE3 LYS A 98 119.298 -16.777 10.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 120.361 -18.555 9.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 118.735 -18.387 9.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 119.967 -17.765 8.066 1.00 0.00 H new ATOM 1646 N THR A 99 119.778 -10.872 9.192 1.00 0.00 N ATOM 1647 CA THR A 99 121.008 -10.268 8.593 1.00 0.00 C ATOM 1648 C THR A 99 122.254 -10.779 9.324 1.00 0.00 C ATOM 1649 O THR A 99 122.178 -11.172 10.474 1.00 0.00 O ATOM 1650 CB THR A 99 120.850 -8.760 8.792 1.00 0.00 C ATOM 1651 OG1 THR A 99 120.578 -8.490 10.160 1.00 0.00 O ATOM 1652 CG2 THR A 99 119.698 -8.244 7.927 1.00 0.00 C ATOM 0 H THR A 99 119.724 -10.803 10.208 1.00 0.00 H new ATOM 0 HA THR A 99 121.126 -10.528 7.541 1.00 0.00 H new ATOM 0 HB THR A 99 121.772 -8.257 8.499 1.00 0.00 H new ATOM 0 HG1 THR A 99 120.478 -7.524 10.289 1.00 0.00 H new ATOM 0 HG21 THR A 99 119.588 -7.169 8.071 1.00 0.00 H new ATOM 0 HG22 THR A 99 119.910 -8.450 6.878 1.00 0.00 H new ATOM 0 HG23 THR A 99 118.774 -8.745 8.215 1.00 0.00 H new ATOM 1660 N TYR A 100 123.386 -10.771 8.658 1.00 0.00 N ATOM 1661 CA TYR A 100 124.659 -11.242 9.286 1.00 0.00 C ATOM 1662 C TYR A 100 125.471 -10.049 9.798 1.00 0.00 C ATOM 1663 O TYR A 100 125.788 -9.973 10.971 1.00 0.00 O ATOM 1664 CB TYR A 100 125.412 -11.965 8.169 1.00 0.00 C ATOM 1665 CG TYR A 100 126.686 -12.632 8.634 1.00 0.00 C ATOM 1666 CD1 TYR A 100 126.640 -13.943 9.199 1.00 0.00 C ATOM 1667 CD2 TYR A 100 127.936 -11.950 8.508 1.00 0.00 C ATOM 1668 CE1 TYR A 100 127.844 -14.574 9.639 1.00 0.00 C ATOM 1669 CE2 TYR A 100 129.140 -12.582 8.948 1.00 0.00 C ATOM 1670 CZ TYR A 100 129.094 -13.894 9.514 1.00 0.00 C ATOM 1671 OH TYR A 100 130.258 -14.503 9.939 1.00 0.00 O ATOM 0 H TYR A 100 123.481 -10.453 7.693 1.00 0.00 H new ATOM 0 HA TYR A 100 124.479 -11.893 10.141 1.00 0.00 H new ATOM 0 HB2 TYR A 100 124.758 -12.717 7.728 1.00 0.00 H new ATOM 0 HB3 TYR A 100 125.652 -11.250 7.382 1.00 0.00 H new ATOM 0 HD1 TYR A 100 125.695 -14.457 9.294 1.00 0.00 H new ATOM 0 HD2 TYR A 100 127.971 -10.959 8.081 1.00 0.00 H new ATOM 0 HE1 TYR A 100 127.809 -15.565 10.066 1.00 0.00 H new ATOM 0 HE2 TYR A 100 130.085 -12.068 8.853 1.00 0.00 H new ATOM 0 HH TYR A 100 131.017 -13.904 9.781 1.00 0.00 H new ATOM 1681 N HIS A 101 125.802 -9.129 8.918 1.00 0.00 N ATOM 1682 CA HIS A 101 126.606 -7.932 9.312 1.00 0.00 C ATOM 1683 C HIS A 101 126.022 -6.671 8.667 1.00 0.00 C ATOM 1684 O HIS A 101 125.148 -6.759 7.824 1.00 0.00 O ATOM 1685 CB HIS A 101 128.012 -8.209 8.779 1.00 0.00 C ATOM 1686 CG HIS A 101 129.034 -7.198 9.222 1.00 0.00 C ATOM 1687 ND1 HIS A 101 129.417 -7.067 10.547 1.00 0.00 N ATOM 1688 CD2 HIS A 101 129.760 -6.262 8.527 1.00 0.00 C ATOM 1689 CE1 HIS A 101 130.336 -6.087 10.609 1.00 0.00 C ATOM 1690 NE2 HIS A 101 130.582 -5.561 9.406 1.00 0.00 N ATOM 0 H HIS A 101 125.544 -9.161 7.932 1.00 0.00 H new ATOM 0 HA HIS A 101 126.605 -7.766 10.389 1.00 0.00 H new ATOM 0 HB2 HIS A 101 128.327 -9.200 9.107 1.00 0.00 H new ATOM 0 HB3 HIS A 101 127.981 -8.229 7.690 1.00 0.00 H new ATOM 0 HD2 HIS A 101 129.702 -6.095 7.462 1.00 0.00 H new ATOM 0 HE1 HIS A 101 130.817 -5.764 11.521 1.00 0.00 H new ATOM 0 HE2 HIS A 101 131.232 -4.808 9.180 1.00 0.00 H new ATOM 1698 N SER A 102 126.504 -5.514 9.062 1.00 0.00 N ATOM 1699 CA SER A 102 126.011 -4.229 8.469 1.00 0.00 C ATOM 1700 C SER A 102 126.787 -3.914 7.186 1.00 0.00 C ATOM 1701 O SER A 102 127.951 -4.253 7.069 1.00 0.00 O ATOM 1702 CB SER A 102 126.264 -3.154 9.528 1.00 0.00 C ATOM 1703 OG SER A 102 127.665 -2.969 9.685 1.00 0.00 O ATOM 0 H SER A 102 127.224 -5.405 9.776 1.00 0.00 H new ATOM 0 HA SER A 102 124.955 -4.283 8.205 1.00 0.00 H new ATOM 0 HB2 SER A 102 125.793 -2.217 9.231 1.00 0.00 H new ATOM 0 HB3 SER A 102 125.816 -3.449 10.477 1.00 0.00 H new ATOM 0 HG SER A 102 127.830 -2.280 10.362 1.00 0.00 H new ATOM 1709 N SER A 103 126.143 -3.270 6.239 1.00 0.00 N ATOM 1710 CA SER A 103 126.790 -2.973 4.925 1.00 0.00 C ATOM 1711 C SER A 103 126.515 -1.525 4.507 1.00 0.00 C ATOM 1712 O SER A 103 125.776 -0.819 5.169 1.00 0.00 O ATOM 1713 CB SER A 103 126.148 -3.947 3.938 1.00 0.00 C ATOM 1714 OG SER A 103 126.440 -5.279 4.336 1.00 0.00 O ATOM 0 H SER A 103 125.184 -2.934 6.325 1.00 0.00 H new ATOM 0 HA SER A 103 127.873 -3.087 4.966 1.00 0.00 H new ATOM 0 HB2 SER A 103 125.069 -3.793 3.907 1.00 0.00 H new ATOM 0 HB3 SER A 103 126.526 -3.765 2.932 1.00 0.00 H new ATOM 0 HG SER A 103 126.028 -5.906 3.706 1.00 0.00 H new ATOM 1720 N GLU A 104 127.110 -1.095 3.416 1.00 0.00 N ATOM 1721 CA GLU A 104 126.862 0.280 2.885 1.00 0.00 C ATOM 1722 C GLU A 104 126.005 0.228 1.613 1.00 0.00 C ATOM 1723 O GLU A 104 126.107 1.103 0.774 1.00 0.00 O ATOM 1724 CB GLU A 104 128.255 0.837 2.567 1.00 0.00 C ATOM 1725 CG GLU A 104 128.826 1.552 3.794 1.00 0.00 C ATOM 1726 CD GLU A 104 130.277 1.960 3.524 1.00 0.00 C ATOM 1727 OE1 GLU A 104 130.537 2.475 2.449 1.00 0.00 O ATOM 1728 OE2 GLU A 104 131.102 1.749 4.398 1.00 0.00 O ATOM 0 H GLU A 104 127.766 -1.650 2.866 1.00 0.00 H new ATOM 0 HA GLU A 104 126.321 0.900 3.600 1.00 0.00 H new ATOM 0 HB2 GLU A 104 128.919 0.027 2.266 1.00 0.00 H new ATOM 0 HB3 GLU A 104 128.196 1.529 1.727 1.00 0.00 H new ATOM 0 HG2 GLU A 104 128.227 2.433 4.025 1.00 0.00 H new ATOM 0 HG3 GLU A 104 128.778 0.897 4.664 1.00 0.00 H new ATOM 1735 N ILE A 105 125.174 -0.781 1.471 1.00 0.00 N ATOM 1736 CA ILE A 105 124.301 -0.902 0.259 1.00 0.00 C ATOM 1737 C ILE A 105 122.836 -0.985 0.706 1.00 0.00 C ATOM 1738 O ILE A 105 122.486 -1.814 1.528 1.00 0.00 O ATOM 1739 CB ILE A 105 124.738 -2.198 -0.457 1.00 0.00 C ATOM 1740 CG1 ILE A 105 126.244 -2.180 -0.798 1.00 0.00 C ATOM 1741 CG2 ILE A 105 123.928 -2.397 -1.747 1.00 0.00 C ATOM 1742 CD1 ILE A 105 126.616 -0.990 -1.695 1.00 0.00 C ATOM 0 H ILE A 105 125.064 -1.533 2.151 1.00 0.00 H new ATOM 0 HA ILE A 105 124.395 -0.047 -0.410 1.00 0.00 H new ATOM 0 HB ILE A 105 124.549 -3.025 0.227 1.00 0.00 H new ATOM 0 HG12 ILE A 105 126.824 -2.135 0.124 1.00 0.00 H new ATOM 0 HG13 ILE A 105 126.514 -3.110 -1.299 1.00 0.00 H new ATOM 0 HG21 ILE A 105 124.248 -3.315 -2.240 1.00 0.00 H new ATOM 0 HG22 ILE A 105 122.868 -2.467 -1.504 1.00 0.00 H new ATOM 0 HG23 ILE A 105 124.092 -1.551 -2.414 1.00 0.00 H new ATOM 0 HD11 ILE A 105 127.684 -1.016 -1.910 1.00 0.00 H new ATOM 0 HD12 ILE A 105 126.056 -1.049 -2.629 1.00 0.00 H new ATOM 0 HD13 ILE A 105 126.372 -0.059 -1.184 1.00 0.00 H new ATOM 1754 N ILE A 106 121.994 -0.131 0.169 1.00 0.00 N ATOM 1755 CA ILE A 106 120.532 -0.164 0.503 1.00 0.00 C ATOM 1756 C ILE A 106 119.700 -0.267 -0.780 1.00 0.00 C ATOM 1757 O ILE A 106 120.073 0.281 -1.802 1.00 0.00 O ATOM 1758 CB ILE A 106 120.227 1.142 1.260 1.00 0.00 C ATOM 1759 CG1 ILE A 106 120.606 2.377 0.428 1.00 0.00 C ATOM 1760 CG2 ILE A 106 121.009 1.167 2.576 1.00 0.00 C ATOM 1761 CD1 ILE A 106 119.977 3.626 1.048 1.00 0.00 C ATOM 0 H ILE A 106 122.261 0.596 -0.495 1.00 0.00 H new ATOM 0 HA ILE A 106 120.280 -1.030 1.116 1.00 0.00 H new ATOM 0 HB ILE A 106 119.155 1.173 1.455 1.00 0.00 H new ATOM 0 HG12 ILE A 106 121.690 2.484 0.390 1.00 0.00 H new ATOM 0 HG13 ILE A 106 120.262 2.256 -0.599 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.792 2.092 3.111 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.715 0.316 3.190 1.00 0.00 H new ATOM 0 HG23 ILE A 106 122.077 1.111 2.366 1.00 0.00 H new ATOM 0 HD11 ILE A 106 120.247 4.501 0.457 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.892 3.518 1.063 1.00 0.00 H new ATOM 0 HD13 ILE A 106 120.343 3.750 2.067 1.00 0.00 H new ATOM 1773 N GLU A 107 118.586 -0.962 -0.721 1.00 0.00 N ATOM 1774 CA GLU A 107 117.697 -1.102 -1.915 1.00 0.00 C ATOM 1775 C GLU A 107 116.354 -0.413 -1.658 1.00 0.00 C ATOM 1776 O GLU A 107 115.735 -0.622 -0.628 1.00 0.00 O ATOM 1777 CB GLU A 107 117.493 -2.605 -2.098 1.00 0.00 C ATOM 1778 CG GLU A 107 118.660 -3.188 -2.897 1.00 0.00 C ATOM 1779 CD GLU A 107 118.448 -4.691 -3.087 1.00 0.00 C ATOM 1780 OE1 GLU A 107 118.409 -5.394 -2.091 1.00 0.00 O ATOM 1781 OE2 GLU A 107 118.327 -5.113 -4.225 1.00 0.00 O ATOM 0 H GLU A 107 118.254 -1.443 0.115 1.00 0.00 H new ATOM 0 HA GLU A 107 118.133 -0.641 -2.802 1.00 0.00 H new ATOM 0 HB2 GLU A 107 117.424 -3.094 -1.126 1.00 0.00 H new ATOM 0 HB3 GLU A 107 116.553 -2.794 -2.617 1.00 0.00 H new ATOM 0 HG2 GLU A 107 118.733 -2.695 -3.866 1.00 0.00 H new ATOM 0 HG3 GLU A 107 119.599 -3.006 -2.375 1.00 0.00 H new ATOM 1788 N ILE A 108 115.911 0.393 -2.594 1.00 0.00 N ATOM 1789 CA ILE A 108 114.665 1.199 -2.403 1.00 0.00 C ATOM 1790 C ILE A 108 113.620 0.777 -3.446 1.00 0.00 C ATOM 1791 O ILE A 108 113.962 0.374 -4.541 1.00 0.00 O ATOM 1792 CB ILE A 108 115.103 2.666 -2.598 1.00 0.00 C ATOM 1793 CG1 ILE A 108 116.114 3.057 -1.514 1.00 0.00 C ATOM 1794 CG2 ILE A 108 113.901 3.616 -2.502 1.00 0.00 C ATOM 1795 CD1 ILE A 108 116.824 4.351 -1.917 1.00 0.00 C ATOM 0 H ILE A 108 116.368 0.528 -3.496 1.00 0.00 H new ATOM 0 HA ILE A 108 114.208 1.055 -1.424 1.00 0.00 H new ATOM 0 HB ILE A 108 115.553 2.751 -3.587 1.00 0.00 H new ATOM 0 HG12 ILE A 108 115.605 3.192 -0.560 1.00 0.00 H new ATOM 0 HG13 ILE A 108 116.843 2.258 -1.377 1.00 0.00 H new ATOM 0 HG21 ILE A 108 114.237 4.643 -2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 108 113.174 3.363 -3.274 1.00 0.00 H new ATOM 0 HG23 ILE A 108 113.437 3.517 -1.521 1.00 0.00 H new ATOM 0 HD11 ILE A 108 117.542 4.627 -1.145 1.00 0.00 H new ATOM 0 HD12 ILE A 108 117.346 4.200 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 108 116.090 5.148 -2.032 1.00 0.00 H new ATOM 1807 N ILE A 109 112.360 0.873 -3.095 1.00 0.00 N ATOM 1808 CA ILE A 109 111.258 0.746 -4.103 1.00 0.00 C ATOM 1809 C ILE A 109 110.445 2.045 -4.138 1.00 0.00 C ATOM 1810 O ILE A 109 110.420 2.779 -3.165 1.00 0.00 O ATOM 1811 CB ILE A 109 110.391 -0.448 -3.667 1.00 0.00 C ATOM 1812 CG1 ILE A 109 109.850 -0.261 -2.241 1.00 0.00 C ATOM 1813 CG2 ILE A 109 111.222 -1.731 -3.720 1.00 0.00 C ATOM 1814 CD1 ILE A 109 108.605 -1.129 -2.051 1.00 0.00 C ATOM 0 H ILE A 109 112.043 1.036 -2.139 1.00 0.00 H new ATOM 0 HA ILE A 109 111.644 0.578 -5.108 1.00 0.00 H new ATOM 0 HB ILE A 109 109.545 -0.514 -4.351 1.00 0.00 H new ATOM 0 HG12 ILE A 109 110.613 -0.535 -1.512 1.00 0.00 H new ATOM 0 HG13 ILE A 109 109.606 0.787 -2.068 1.00 0.00 H new ATOM 0 HG21 ILE A 109 110.607 -2.576 -3.411 1.00 0.00 H new ATOM 0 HG22 ILE A 109 111.576 -1.893 -4.738 1.00 0.00 H new ATOM 0 HG23 ILE A 109 112.076 -1.639 -3.049 1.00 0.00 H new ATOM 0 HD11 ILE A 109 108.220 -0.997 -1.040 1.00 0.00 H new ATOM 0 HD12 ILE A 109 107.842 -0.833 -2.771 1.00 0.00 H new ATOM 0 HD13 ILE A 109 108.864 -2.176 -2.207 1.00 0.00 H new ATOM 1826 N ALA A 110 109.792 2.320 -5.244 1.00 0.00 N ATOM 1827 CA ALA A 110 109.039 3.603 -5.401 1.00 0.00 C ATOM 1828 C ALA A 110 107.749 3.368 -6.204 1.00 0.00 C ATOM 1829 O ALA A 110 107.613 2.324 -6.813 1.00 0.00 O ATOM 1830 CB ALA A 110 109.986 4.539 -6.151 1.00 0.00 C ATOM 0 H ALA A 110 109.750 1.701 -6.053 1.00 0.00 H new ATOM 0 HA ALA A 110 108.739 4.024 -4.441 1.00 0.00 H new ATOM 0 HB1 ALA A 110 109.500 5.503 -6.303 1.00 0.00 H new ATOM 0 HB2 ALA A 110 110.896 4.679 -5.568 1.00 0.00 H new ATOM 0 HB3 ALA A 110 110.238 4.103 -7.118 1.00 0.00 H new ATOM 1836 N PRO A 111 106.832 4.326 -6.193 1.00 0.00 N ATOM 1837 CA PRO A 111 105.564 4.196 -6.985 1.00 0.00 C ATOM 1838 C PRO A 111 105.846 4.023 -8.485 1.00 0.00 C ATOM 1839 O PRO A 111 105.080 3.382 -9.186 1.00 0.00 O ATOM 1840 CB PRO A 111 104.848 5.523 -6.723 1.00 0.00 C ATOM 1841 CG PRO A 111 105.391 5.963 -5.409 1.00 0.00 C ATOM 1842 CD PRO A 111 106.846 5.611 -5.461 1.00 0.00 C ATOM 0 HA PRO A 111 104.981 3.321 -6.696 1.00 0.00 H new ATOM 0 HB2 PRO A 111 105.056 6.252 -7.507 1.00 0.00 H new ATOM 0 HB3 PRO A 111 103.766 5.394 -6.686 1.00 0.00 H new ATOM 0 HG2 PRO A 111 105.248 7.033 -5.260 1.00 0.00 H new ATOM 0 HG3 PRO A 111 104.890 5.456 -4.584 1.00 0.00 H new ATOM 0 HD2 PRO A 111 107.430 6.370 -5.982 1.00 0.00 H new ATOM 0 HD3 PRO A 111 107.275 5.507 -4.465 1.00 0.00 H new ATOM 1850 N MET A 112 106.930 4.588 -8.966 1.00 0.00 N ATOM 1851 CA MET A 112 107.276 4.493 -10.419 1.00 0.00 C ATOM 1852 C MET A 112 108.796 4.386 -10.610 1.00 0.00 C ATOM 1853 O MET A 112 109.552 4.622 -9.683 1.00 0.00 O ATOM 1854 CB MET A 112 106.655 5.732 -11.107 1.00 0.00 C ATOM 1855 CG MET A 112 107.449 7.041 -10.919 1.00 0.00 C ATOM 1856 SD MET A 112 107.343 7.642 -9.214 1.00 0.00 S ATOM 1857 CE MET A 112 105.592 8.094 -9.241 1.00 0.00 C ATOM 0 H MET A 112 107.597 5.117 -8.405 1.00 0.00 H new ATOM 0 HA MET A 112 106.870 3.590 -10.876 1.00 0.00 H new ATOM 0 HB2 MET A 112 106.562 5.530 -12.174 1.00 0.00 H new ATOM 0 HB3 MET A 112 105.646 5.877 -10.721 1.00 0.00 H new ATOM 0 HG2 MET A 112 108.493 6.875 -11.183 1.00 0.00 H new ATOM 0 HG3 MET A 112 107.065 7.802 -11.599 1.00 0.00 H new ATOM 0 HE1 MET A 112 105.343 8.640 -8.331 1.00 0.00 H new ATOM 0 HE2 MET A 112 105.392 8.723 -10.108 1.00 0.00 H new ATOM 0 HE3 MET A 112 104.984 7.191 -9.300 1.00 0.00 H new ATOM 1867 N LYS A 113 109.230 4.036 -11.800 1.00 0.00 N ATOM 1868 CA LYS A 113 110.697 3.860 -12.064 1.00 0.00 C ATOM 1869 C LYS A 113 111.396 5.223 -12.066 1.00 0.00 C ATOM 1870 O LYS A 113 111.264 5.992 -13.003 1.00 0.00 O ATOM 1871 CB LYS A 113 110.812 3.196 -13.441 1.00 0.00 C ATOM 1872 CG LYS A 113 112.240 2.682 -13.640 1.00 0.00 C ATOM 1873 CD LYS A 113 112.290 1.769 -14.867 1.00 0.00 C ATOM 1874 CE LYS A 113 112.165 2.610 -16.138 1.00 0.00 C ATOM 1875 NZ LYS A 113 112.254 1.630 -17.257 1.00 0.00 N ATOM 0 H LYS A 113 108.627 3.864 -12.605 1.00 0.00 H new ATOM 0 HA LYS A 113 111.171 3.250 -11.295 1.00 0.00 H new ATOM 0 HB2 LYS A 113 110.103 2.372 -13.520 1.00 0.00 H new ATOM 0 HB3 LYS A 113 110.559 3.911 -14.224 1.00 0.00 H new ATOM 0 HG2 LYS A 113 112.924 3.520 -13.770 1.00 0.00 H new ATOM 0 HG3 LYS A 113 112.568 2.137 -12.755 1.00 0.00 H new ATOM 0 HD2 LYS A 113 113.226 1.210 -14.879 1.00 0.00 H new ATOM 0 HD3 LYS A 113 111.483 1.038 -14.822 1.00 0.00 H new ATOM 0 HE2 LYS A 113 111.219 3.152 -16.162 1.00 0.00 H new ATOM 0 HE3 LYS A 113 112.960 3.353 -16.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 112.176 2.132 -18.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 113.167 1.134 -17.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 111.481 0.939 -17.176 1.00 0.00 H new ATOM 1889 N LEU A 114 112.139 5.517 -11.020 1.00 0.00 N ATOM 1890 CA LEU A 114 112.822 6.851 -10.894 1.00 0.00 C ATOM 1891 C LEU A 114 113.789 7.097 -12.059 1.00 0.00 C ATOM 1892 O LEU A 114 113.957 8.224 -12.491 1.00 0.00 O ATOM 1893 CB LEU A 114 113.603 6.813 -9.575 1.00 0.00 C ATOM 1894 CG LEU A 114 112.627 6.711 -8.400 1.00 0.00 C ATOM 1895 CD1 LEU A 114 113.400 6.378 -7.123 1.00 0.00 C ATOM 1896 CD2 LEU A 114 111.904 8.047 -8.220 1.00 0.00 C ATOM 0 H LEU A 114 112.303 4.882 -10.239 1.00 0.00 H new ATOM 0 HA LEU A 114 112.087 7.656 -10.912 1.00 0.00 H new ATOM 0 HB2 LEU A 114 114.284 5.962 -9.569 1.00 0.00 H new ATOM 0 HB3 LEU A 114 114.213 7.711 -9.477 1.00 0.00 H new ATOM 0 HG LEU A 114 111.898 5.926 -8.601 1.00 0.00 H new ATOM 0 HD11 LEU A 114 112.706 6.305 -6.286 1.00 0.00 H new ATOM 0 HD12 LEU A 114 113.918 5.427 -7.249 1.00 0.00 H new ATOM 0 HD13 LEU A 114 114.128 7.164 -6.923 1.00 0.00 H new ATOM 0 HD21 LEU A 114 111.209 7.975 -7.383 1.00 0.00 H new ATOM 0 HD22 LEU A 114 112.634 8.831 -8.019 1.00 0.00 H new ATOM 0 HD23 LEU A 114 111.353 8.288 -9.129 1.00 0.00 H new ATOM 1908 N ARG A 115 114.412 6.053 -12.563 1.00 0.00 N ATOM 1909 CA ARG A 115 115.457 6.218 -13.631 1.00 0.00 C ATOM 1910 C ARG A 115 114.852 6.825 -14.900 1.00 0.00 C ATOM 1911 O ARG A 115 115.503 7.599 -15.577 1.00 0.00 O ATOM 1912 CB ARG A 115 116.001 4.820 -13.936 1.00 0.00 C ATOM 1913 CG ARG A 115 116.717 4.264 -12.704 1.00 0.00 C ATOM 1914 CD ARG A 115 117.373 2.925 -13.056 1.00 0.00 C ATOM 1915 NE ARG A 115 117.864 2.353 -11.758 1.00 0.00 N ATOM 1916 CZ ARG A 115 118.855 1.484 -11.692 1.00 0.00 C ATOM 1917 NH1 ARG A 115 119.481 1.027 -12.753 1.00 0.00 N ATOM 1918 NH2 ARG A 115 119.224 1.050 -10.518 1.00 0.00 N ATOM 0 H ARG A 115 114.240 5.089 -12.279 1.00 0.00 H new ATOM 0 HA ARG A 115 116.245 6.890 -13.291 1.00 0.00 H new ATOM 0 HB2 ARG A 115 115.185 4.157 -14.224 1.00 0.00 H new ATOM 0 HB3 ARG A 115 116.690 4.864 -14.780 1.00 0.00 H new ATOM 0 HG2 ARG A 115 117.471 4.971 -12.358 1.00 0.00 H new ATOM 0 HG3 ARG A 115 116.008 4.130 -11.887 1.00 0.00 H new ATOM 0 HD2 ARG A 115 116.659 2.254 -13.533 1.00 0.00 H new ATOM 0 HD3 ARG A 115 118.196 3.066 -13.757 1.00 0.00 H new ATOM 0 HE ARG A 115 117.413 2.648 -10.892 1.00 0.00 H new ATOM 0 HH11 ARG A 115 119.207 1.344 -13.683 1.00 0.00 H new ATOM 0 HH12 ARG A 115 120.241 0.356 -12.647 1.00 0.00 H new ATOM 0 HH21 ARG A 115 118.749 1.383 -9.679 1.00 0.00 H new ATOM 0 HH22 ARG A 115 119.987 0.378 -10.439 1.00 0.00 H new ATOM 1932 N GLU A 116 113.624 6.477 -15.207 1.00 0.00 N ATOM 1933 CA GLU A 116 112.949 7.040 -16.419 1.00 0.00 C ATOM 1934 C GLU A 116 112.467 8.459 -16.113 1.00 0.00 C ATOM 1935 O GLU A 116 112.712 9.374 -16.879 1.00 0.00 O ATOM 1936 CB GLU A 116 111.769 6.114 -16.730 1.00 0.00 C ATOM 1937 CG GLU A 116 111.157 6.496 -18.080 1.00 0.00 C ATOM 1938 CD GLU A 116 112.101 6.085 -19.215 1.00 0.00 C ATOM 1939 OE1 GLU A 116 112.642 4.994 -19.148 1.00 0.00 O ATOM 1940 OE2 GLU A 116 112.265 6.871 -20.134 1.00 0.00 O ATOM 0 H GLU A 116 113.058 5.823 -14.666 1.00 0.00 H new ATOM 0 HA GLU A 116 113.622 7.096 -17.275 1.00 0.00 H new ATOM 0 HB2 GLU A 116 112.104 5.077 -16.752 1.00 0.00 H new ATOM 0 HB3 GLU A 116 111.017 6.190 -15.944 1.00 0.00 H new ATOM 0 HG2 GLU A 116 110.191 6.006 -18.203 1.00 0.00 H new ATOM 0 HG3 GLU A 116 110.976 7.570 -18.116 1.00 0.00 H new ATOM 1947 N GLN A 117 111.803 8.642 -14.992 1.00 0.00 N ATOM 1948 CA GLN A 117 111.154 9.962 -14.685 1.00 0.00 C ATOM 1949 C GLN A 117 112.200 11.079 -14.578 1.00 0.00 C ATOM 1950 O GLN A 117 111.928 12.211 -14.940 1.00 0.00 O ATOM 1951 CB GLN A 117 110.430 9.789 -13.344 1.00 0.00 C ATOM 1952 CG GLN A 117 109.300 8.766 -13.496 1.00 0.00 C ATOM 1953 CD GLN A 117 108.163 9.375 -14.317 1.00 0.00 C ATOM 1954 OE1 GLN A 117 107.735 10.483 -14.058 1.00 0.00 O ATOM 1955 NE2 GLN A 117 107.649 8.694 -15.305 1.00 0.00 N ATOM 0 H GLN A 117 111.682 7.929 -14.272 1.00 0.00 H new ATOM 0 HA GLN A 117 110.464 10.245 -15.480 1.00 0.00 H new ATOM 0 HB2 GLN A 117 111.133 9.458 -12.580 1.00 0.00 H new ATOM 0 HB3 GLN A 117 110.026 10.745 -13.012 1.00 0.00 H new ATOM 0 HG2 GLN A 117 109.674 7.866 -13.985 1.00 0.00 H new ATOM 0 HG3 GLN A 117 108.933 8.466 -12.514 1.00 0.00 H new ATOM 0 HE21 GLN A 117 108.007 7.764 -15.524 1.00 0.00 H new ATOM 0 HE22 GLN A 117 106.890 9.092 -15.858 1.00 0.00 H new ATOM 1964 N PHE A 118 113.378 10.762 -14.090 1.00 0.00 N ATOM 1965 CA PHE A 118 114.443 11.799 -13.910 1.00 0.00 C ATOM 1966 C PHE A 118 115.585 11.657 -14.927 1.00 0.00 C ATOM 1967 O PHE A 118 116.589 12.337 -14.806 1.00 0.00 O ATOM 1968 CB PHE A 118 114.966 11.568 -12.492 1.00 0.00 C ATOM 1969 CG PHE A 118 113.981 11.957 -11.416 1.00 0.00 C ATOM 1970 CD1 PHE A 118 113.927 13.309 -10.951 1.00 0.00 C ATOM 1971 CD2 PHE A 118 113.103 10.976 -10.860 1.00 0.00 C ATOM 1972 CE1 PHE A 118 112.996 13.678 -9.932 1.00 0.00 C ATOM 1973 CE2 PHE A 118 112.171 11.345 -9.841 1.00 0.00 C ATOM 1974 CZ PHE A 118 112.117 12.696 -9.377 1.00 0.00 C ATOM 0 H PHE A 118 113.648 9.820 -13.807 1.00 0.00 H new ATOM 0 HA PHE A 118 114.042 12.801 -14.065 1.00 0.00 H new ATOM 0 HB2 PHE A 118 115.223 10.515 -12.375 1.00 0.00 H new ATOM 0 HB3 PHE A 118 115.885 12.137 -12.355 1.00 0.00 H new ATOM 0 HD1 PHE A 118 114.590 14.051 -11.370 1.00 0.00 H new ATOM 0 HD2 PHE A 118 113.144 9.955 -11.210 1.00 0.00 H new ATOM 0 HE1 PHE A 118 112.956 14.699 -9.581 1.00 0.00 H new ATOM 0 HE2 PHE A 118 111.508 10.603 -9.422 1.00 0.00 H new ATOM 0 HZ PHE A 118 111.412 12.975 -8.607 1.00 0.00 H new ATOM 1984 N ASN A 119 115.462 10.795 -15.924 1.00 0.00 N ATOM 1985 CA ASN A 119 116.553 10.580 -16.944 1.00 0.00 C ATOM 1986 C ASN A 119 117.912 10.292 -16.277 1.00 0.00 C ATOM 1987 O ASN A 119 118.930 10.849 -16.655 1.00 0.00 O ATOM 1988 CB ASN A 119 116.601 11.868 -17.779 1.00 0.00 C ATOM 1989 CG ASN A 119 115.297 12.020 -18.566 1.00 0.00 C ATOM 1990 OD1 ASN A 119 114.645 13.042 -18.493 1.00 0.00 O ATOM 1991 ND2 ASN A 119 114.889 11.038 -19.323 1.00 0.00 N ATOM 0 H ASN A 119 114.633 10.221 -16.074 1.00 0.00 H new ATOM 0 HA ASN A 119 116.344 9.708 -17.564 1.00 0.00 H new ATOM 0 HB2 ASN A 119 116.747 12.730 -17.128 1.00 0.00 H new ATOM 0 HB3 ASN A 119 117.449 11.838 -18.463 1.00 0.00 H new ATOM 0 HD21 ASN A 119 114.022 11.129 -19.853 1.00 0.00 H new ATOM 0 HD22 ASN A 119 115.437 10.180 -19.384 1.00 0.00 H new ATOM 1998 N LEU A 120 117.922 9.419 -15.294 1.00 0.00 N ATOM 1999 CA LEU A 120 119.144 9.214 -14.453 1.00 0.00 C ATOM 2000 C LEU A 120 120.019 8.093 -15.022 1.00 0.00 C ATOM 2001 O LEU A 120 119.515 7.069 -15.447 1.00 0.00 O ATOM 2002 CB LEU A 120 118.630 8.832 -13.062 1.00 0.00 C ATOM 2003 CG LEU A 120 118.001 10.053 -12.389 1.00 0.00 C ATOM 2004 CD1 LEU A 120 117.243 9.608 -11.136 1.00 0.00 C ATOM 2005 CD2 LEU A 120 119.100 11.042 -11.991 1.00 0.00 C ATOM 0 H LEU A 120 117.126 8.835 -15.038 1.00 0.00 H new ATOM 0 HA LEU A 120 119.761 10.112 -14.427 1.00 0.00 H new ATOM 0 HB2 LEU A 120 117.895 8.031 -13.143 1.00 0.00 H new ATOM 0 HB3 LEU A 120 119.450 8.452 -12.453 1.00 0.00 H new ATOM 0 HG LEU A 120 117.312 10.535 -13.083 1.00 0.00 H new ATOM 0 HD11 LEU A 120 116.794 10.477 -10.655 1.00 0.00 H new ATOM 0 HD12 LEU A 120 116.460 8.903 -11.416 1.00 0.00 H new ATOM 0 HD13 LEU A 120 117.934 9.127 -10.444 1.00 0.00 H new ATOM 0 HD21 LEU A 120 118.651 11.912 -11.512 1.00 0.00 H new ATOM 0 HD22 LEU A 120 119.789 10.560 -11.297 1.00 0.00 H new ATOM 0 HD23 LEU A 120 119.644 11.359 -12.881 1.00 0.00 H new ATOM 2017 N LYS A 121 121.316 8.296 -15.027 1.00 0.00 N ATOM 2018 CA LYS A 121 122.268 7.245 -15.500 1.00 0.00 C ATOM 2019 C LYS A 121 123.144 6.776 -14.335 1.00 0.00 C ATOM 2020 O LYS A 121 123.314 7.488 -13.362 1.00 0.00 O ATOM 2021 CB LYS A 121 123.121 7.933 -16.565 1.00 0.00 C ATOM 2022 CG LYS A 121 123.919 6.881 -17.340 1.00 0.00 C ATOM 2023 CD LYS A 121 124.826 7.575 -18.357 1.00 0.00 C ATOM 2024 CE LYS A 121 125.509 6.523 -19.234 1.00 0.00 C ATOM 2025 NZ LYS A 121 125.820 7.228 -20.509 1.00 0.00 N ATOM 0 H LYS A 121 121.760 9.161 -14.718 1.00 0.00 H new ATOM 0 HA LYS A 121 121.756 6.367 -15.894 1.00 0.00 H new ATOM 0 HB2 LYS A 121 122.485 8.497 -17.247 1.00 0.00 H new ATOM 0 HB3 LYS A 121 123.799 8.647 -16.097 1.00 0.00 H new ATOM 0 HG2 LYS A 121 124.517 6.283 -16.652 1.00 0.00 H new ATOM 0 HG3 LYS A 121 123.240 6.197 -17.849 1.00 0.00 H new ATOM 0 HD2 LYS A 121 124.242 8.256 -18.976 1.00 0.00 H new ATOM 0 HD3 LYS A 121 125.575 8.176 -17.841 1.00 0.00 H new ATOM 0 HE2 LYS A 121 126.415 6.143 -18.762 1.00 0.00 H new ATOM 0 HE3 LYS A 121 124.856 5.667 -19.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 126.291 6.571 -21.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 124.938 7.573 -20.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 126.449 8.034 -20.316 1.00 0.00 H new ATOM 2039 N ASP A 122 123.700 5.586 -14.432 1.00 0.00 N ATOM 2040 CA ASP A 122 124.552 5.023 -13.323 1.00 0.00 C ATOM 2041 C ASP A 122 125.708 5.969 -12.966 1.00 0.00 C ATOM 2042 O ASP A 122 126.342 6.530 -13.842 1.00 0.00 O ATOM 2043 CB ASP A 122 125.114 3.697 -13.848 1.00 0.00 C ATOM 2044 CG ASP A 122 123.971 2.703 -14.068 1.00 0.00 C ATOM 2045 OD1 ASP A 122 123.116 2.610 -13.202 1.00 0.00 O ATOM 2046 OD2 ASP A 122 123.970 2.050 -15.098 1.00 0.00 O ATOM 0 H ASP A 122 123.599 4.973 -15.241 1.00 0.00 H new ATOM 0 HA ASP A 122 123.959 4.890 -12.418 1.00 0.00 H new ATOM 0 HB2 ASP A 122 125.650 3.863 -14.783 1.00 0.00 H new ATOM 0 HB3 ASP A 122 125.832 3.288 -13.137 1.00 0.00 H new ATOM 2051 N GLY A 123 125.972 6.137 -11.690 1.00 0.00 N ATOM 2052 CA GLY A 123 127.049 7.070 -11.236 1.00 0.00 C ATOM 2053 C GLY A 123 126.461 8.403 -10.755 1.00 0.00 C ATOM 2054 O GLY A 123 127.099 9.100 -9.984 1.00 0.00 O ATOM 0 H GLY A 123 125.479 5.659 -10.936 1.00 0.00 H new ATOM 0 HA2 GLY A 123 127.618 6.608 -10.429 1.00 0.00 H new ATOM 0 HA3 GLY A 123 127.746 7.251 -12.054 1.00 0.00 H new ATOM 2058 N ASP A 124 125.269 8.763 -11.192 1.00 0.00 N ATOM 2059 CA ASP A 124 124.641 10.056 -10.747 1.00 0.00 C ATOM 2060 C ASP A 124 124.346 10.004 -9.245 1.00 0.00 C ATOM 2061 O ASP A 124 124.225 8.932 -8.680 1.00 0.00 O ATOM 2062 CB ASP A 124 123.342 10.217 -11.547 1.00 0.00 C ATOM 2063 CG ASP A 124 123.628 10.918 -12.878 1.00 0.00 C ATOM 2064 OD1 ASP A 124 124.411 11.855 -12.882 1.00 0.00 O ATOM 2065 OD2 ASP A 124 123.052 10.507 -13.871 1.00 0.00 O ATOM 0 H ASP A 124 124.704 8.214 -11.840 1.00 0.00 H new ATOM 0 HA ASP A 124 125.307 10.901 -10.922 1.00 0.00 H new ATOM 0 HB2 ASP A 124 122.895 9.240 -11.730 1.00 0.00 H new ATOM 0 HB3 ASP A 124 122.620 10.795 -10.970 1.00 0.00 H new ATOM 2070 N VAL A 125 124.233 11.147 -8.611 1.00 0.00 N ATOM 2071 CA VAL A 125 124.058 11.192 -7.123 1.00 0.00 C ATOM 2072 C VAL A 125 122.651 11.708 -6.791 1.00 0.00 C ATOM 2073 O VAL A 125 122.202 12.694 -7.347 1.00 0.00 O ATOM 2074 CB VAL A 125 125.147 12.147 -6.594 1.00 0.00 C ATOM 2075 CG1 VAL A 125 125.080 12.242 -5.065 1.00 0.00 C ATOM 2076 CG2 VAL A 125 126.541 11.633 -6.977 1.00 0.00 C ATOM 0 H VAL A 125 124.255 12.060 -9.065 1.00 0.00 H new ATOM 0 HA VAL A 125 124.157 10.209 -6.663 1.00 0.00 H new ATOM 0 HB VAL A 125 124.973 13.127 -7.038 1.00 0.00 H new ATOM 0 HG11 VAL A 125 125.855 12.920 -4.708 1.00 0.00 H new ATOM 0 HG12 VAL A 125 124.102 12.620 -4.766 1.00 0.00 H new ATOM 0 HG13 VAL A 125 125.235 11.254 -4.632 1.00 0.00 H new ATOM 0 HG21 VAL A 125 127.299 12.318 -6.596 1.00 0.00 H new ATOM 0 HG22 VAL A 125 126.696 10.644 -6.545 1.00 0.00 H new ATOM 0 HG23 VAL A 125 126.620 11.571 -8.062 1.00 0.00 H new ATOM 2086 N ILE A 126 121.970 11.037 -5.891 1.00 0.00 N ATOM 2087 CA ILE A 126 120.640 11.518 -5.397 1.00 0.00 C ATOM 2088 C ILE A 126 120.644 11.546 -3.865 1.00 0.00 C ATOM 2089 O ILE A 126 121.463 10.894 -3.240 1.00 0.00 O ATOM 2090 CB ILE A 126 119.586 10.536 -5.938 1.00 0.00 C ATOM 2091 CG1 ILE A 126 119.879 9.094 -5.497 1.00 0.00 C ATOM 2092 CG2 ILE A 126 119.567 10.595 -7.468 1.00 0.00 C ATOM 2093 CD1 ILE A 126 118.646 8.222 -5.744 1.00 0.00 C ATOM 0 H ILE A 126 122.286 10.162 -5.472 1.00 0.00 H new ATOM 0 HA ILE A 126 120.419 12.529 -5.739 1.00 0.00 H new ATOM 0 HB ILE A 126 118.617 10.830 -5.534 1.00 0.00 H new ATOM 0 HG12 ILE A 126 120.732 8.700 -6.049 1.00 0.00 H new ATOM 0 HG13 ILE A 126 120.146 9.073 -4.440 1.00 0.00 H new ATOM 0 HG21 ILE A 126 118.820 9.899 -7.850 1.00 0.00 H new ATOM 0 HG22 ILE A 126 119.319 11.606 -7.790 1.00 0.00 H new ATOM 0 HG23 ILE A 126 120.549 10.322 -7.855 1.00 0.00 H new ATOM 0 HD11 ILE A 126 118.855 7.199 -5.431 1.00 0.00 H new ATOM 0 HD12 ILE A 126 117.804 8.612 -5.172 1.00 0.00 H new ATOM 0 HD13 ILE A 126 118.399 8.233 -6.806 1.00 0.00 H new ATOM 2105 N LYS A 127 119.738 12.290 -3.272 1.00 0.00 N ATOM 2106 CA LYS A 127 119.735 12.462 -1.786 1.00 0.00 C ATOM 2107 C LYS A 127 118.550 11.718 -1.168 1.00 0.00 C ATOM 2108 O LYS A 127 117.460 11.732 -1.711 1.00 0.00 O ATOM 2109 CB LYS A 127 119.595 13.969 -1.561 1.00 0.00 C ATOM 2110 CG LYS A 127 120.863 14.681 -2.038 1.00 0.00 C ATOM 2111 CD LYS A 127 120.764 16.173 -1.713 1.00 0.00 C ATOM 2112 CE LYS A 127 121.978 16.903 -2.292 1.00 0.00 C ATOM 2113 NZ LYS A 127 121.714 18.347 -2.038 1.00 0.00 N ATOM 0 H LYS A 127 118.995 12.789 -3.761 1.00 0.00 H new ATOM 0 HA LYS A 127 120.637 12.062 -1.324 1.00 0.00 H new ATOM 0 HB2 LYS A 127 118.728 14.348 -2.102 1.00 0.00 H new ATOM 0 HB3 LYS A 127 119.426 14.175 -0.504 1.00 0.00 H new ATOM 0 HG2 LYS A 127 121.739 14.250 -1.553 1.00 0.00 H new ATOM 0 HG3 LYS A 127 120.990 14.539 -3.111 1.00 0.00 H new ATOM 0 HD2 LYS A 127 119.845 16.586 -2.129 1.00 0.00 H new ATOM 0 HD3 LYS A 127 120.719 16.319 -0.634 1.00 0.00 H new ATOM 0 HE2 LYS A 127 122.901 16.579 -1.810 1.00 0.00 H new ATOM 0 HE3 LYS A 127 122.088 16.703 -3.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 122.504 18.914 -2.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 120.833 18.628 -2.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 121.621 18.508 -1.015 1.00 0.00 H new ATOM 2127 N ILE A 128 118.764 11.075 -0.043 1.00 0.00 N ATOM 2128 CA ILE A 128 117.642 10.427 0.708 1.00 0.00 C ATOM 2129 C ILE A 128 117.374 11.201 2.003 1.00 0.00 C ATOM 2130 O ILE A 128 118.297 11.616 2.684 1.00 0.00 O ATOM 2131 CB ILE A 128 118.071 8.976 0.988 1.00 0.00 C ATOM 2132 CG1 ILE A 128 119.399 8.917 1.759 1.00 0.00 C ATOM 2133 CG2 ILE A 128 118.231 8.230 -0.339 1.00 0.00 C ATOM 2134 CD1 ILE A 128 119.613 7.501 2.301 1.00 0.00 C ATOM 0 H ILE A 128 119.681 10.971 0.391 1.00 0.00 H new ATOM 0 HA ILE A 128 116.714 10.433 0.136 1.00 0.00 H new ATOM 0 HB ILE A 128 117.299 8.509 1.600 1.00 0.00 H new ATOM 0 HG12 ILE A 128 120.225 9.196 1.104 1.00 0.00 H new ATOM 0 HG13 ILE A 128 119.387 9.634 2.580 1.00 0.00 H new ATOM 0 HG21 ILE A 128 118.535 7.202 -0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 128 117.282 8.232 -0.875 1.00 0.00 H new ATOM 0 HG23 ILE A 128 118.991 8.724 -0.945 1.00 0.00 H new ATOM 0 HD11 ILE A 128 120.555 7.459 2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 128 118.793 7.240 2.970 1.00 0.00 H new ATOM 0 HD13 ILE A 128 119.643 6.795 1.471 1.00 0.00 H new ATOM 2146 N LEU A 129 116.118 11.390 2.332 1.00 0.00 N ATOM 2147 CA LEU A 129 115.738 12.263 3.484 1.00 0.00 C ATOM 2148 C LEU A 129 115.232 11.403 4.646 1.00 0.00 C ATOM 2149 O LEU A 129 114.456 10.486 4.443 1.00 0.00 O ATOM 2150 CB LEU A 129 114.613 13.148 2.931 1.00 0.00 C ATOM 2151 CG LEU A 129 114.180 14.191 3.974 1.00 0.00 C ATOM 2152 CD1 LEU A 129 115.027 15.457 3.830 1.00 0.00 C ATOM 2153 CD2 LEU A 129 112.705 14.550 3.767 1.00 0.00 C ATOM 0 H LEU A 129 115.329 10.969 1.842 1.00 0.00 H new ATOM 0 HA LEU A 129 116.573 12.850 3.868 1.00 0.00 H new ATOM 0 HB2 LEU A 129 114.951 13.651 2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.760 12.529 2.652 1.00 0.00 H new ATOM 0 HG LEU A 129 114.320 13.770 4.970 1.00 0.00 H new ATOM 0 HD11 LEU A 129 114.714 16.191 4.573 1.00 0.00 H new ATOM 0 HD12 LEU A 129 116.078 15.211 3.984 1.00 0.00 H new ATOM 0 HD13 LEU A 129 114.894 15.872 2.831 1.00 0.00 H new ATOM 0 HD21 LEU A 129 112.403 15.289 4.509 1.00 0.00 H new ATOM 0 HD22 LEU A 129 112.568 14.962 2.767 1.00 0.00 H new ATOM 0 HD23 LEU A 129 112.094 13.654 3.878 1.00 0.00 H new ATOM 2165 N ILE A 130 115.670 11.700 5.849 1.00 0.00 N ATOM 2166 CA ILE A 130 115.160 10.977 7.057 1.00 0.00 C ATOM 2167 C ILE A 130 114.629 12.003 8.068 1.00 0.00 C ATOM 2168 O ILE A 130 115.353 12.890 8.483 1.00 0.00 O ATOM 2169 CB ILE A 130 116.365 10.198 7.622 1.00 0.00 C ATOM 2170 CG1 ILE A 130 116.895 9.202 6.582 1.00 0.00 C ATOM 2171 CG2 ILE A 130 115.958 9.411 8.873 1.00 0.00 C ATOM 2172 CD1 ILE A 130 118.337 8.828 6.929 1.00 0.00 C ATOM 0 H ILE A 130 116.366 12.420 6.045 1.00 0.00 H new ATOM 0 HA ILE A 130 114.341 10.295 6.827 1.00 0.00 H new ATOM 0 HB ILE A 130 117.139 10.923 7.874 1.00 0.00 H new ATOM 0 HG12 ILE A 130 116.270 8.309 6.565 1.00 0.00 H new ATOM 0 HG13 ILE A 130 116.851 9.641 5.585 1.00 0.00 H new ATOM 0 HG21 ILE A 130 116.821 8.868 9.258 1.00 0.00 H new ATOM 0 HG22 ILE A 130 115.595 10.101 9.635 1.00 0.00 H new ATOM 0 HG23 ILE A 130 115.169 8.704 8.617 1.00 0.00 H new ATOM 0 HD11 ILE A 130 118.717 8.120 6.192 1.00 0.00 H new ATOM 0 HD12 ILE A 130 118.957 9.725 6.924 1.00 0.00 H new ATOM 0 HD13 ILE A 130 118.367 8.372 7.919 1.00 0.00 H new ATOM 2184 N LYS A 131 113.379 11.877 8.451 1.00 0.00 N ATOM 2185 CA LYS A 131 112.792 12.782 9.489 1.00 0.00 C ATOM 2186 C LYS A 131 112.908 12.136 10.872 1.00 0.00 C ATOM 2187 O LYS A 131 112.853 10.926 10.995 1.00 0.00 O ATOM 2188 CB LYS A 131 111.321 12.948 9.098 1.00 0.00 C ATOM 2189 CG LYS A 131 111.225 13.732 7.787 1.00 0.00 C ATOM 2190 CD LYS A 131 109.753 13.909 7.405 1.00 0.00 C ATOM 2191 CE LYS A 131 109.104 14.936 8.334 1.00 0.00 C ATOM 2192 NZ LYS A 131 107.909 15.425 7.590 1.00 0.00 N ATOM 0 H LYS A 131 112.734 11.177 8.083 1.00 0.00 H new ATOM 0 HA LYS A 131 113.307 13.741 9.536 1.00 0.00 H new ATOM 0 HB2 LYS A 131 110.852 11.971 8.985 1.00 0.00 H new ATOM 0 HB3 LYS A 131 110.781 13.471 9.887 1.00 0.00 H new ATOM 0 HG2 LYS A 131 111.703 14.705 7.897 1.00 0.00 H new ATOM 0 HG3 LYS A 131 111.756 13.204 6.995 1.00 0.00 H new ATOM 0 HD2 LYS A 131 109.672 14.238 6.369 1.00 0.00 H new ATOM 0 HD3 LYS A 131 109.230 12.955 7.478 1.00 0.00 H new ATOM 0 HE2 LYS A 131 108.820 14.485 9.285 1.00 0.00 H new ATOM 0 HE3 LYS A 131 109.790 15.752 8.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 107.409 16.135 8.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 108.211 15.855 6.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 107.271 14.627 7.394 1.00 0.00 H new ATOM 2206 N GLY A 132 113.068 12.940 11.900 1.00 0.00 N ATOM 2207 CA GLY A 132 113.198 12.404 13.289 1.00 0.00 C ATOM 2208 C GLY A 132 112.805 13.487 14.297 1.00 0.00 C ATOM 2209 O GLY A 132 112.586 14.627 13.927 1.00 0.00 O ATOM 0 H GLY A 132 113.114 13.957 11.831 1.00 0.00 H new ATOM 0 HA2 GLY A 132 112.560 11.529 13.413 1.00 0.00 H new ATOM 0 HA3 GLY A 132 114.223 12.079 13.470 1.00 0.00 H new ATOM 2213 N ASP A 133 112.718 13.128 15.558 1.00 0.00 N ATOM 2214 CA ASP A 133 112.352 14.113 16.624 1.00 0.00 C ATOM 2215 C ASP A 133 112.901 13.658 17.982 1.00 0.00 C ATOM 2216 O ASP A 133 113.427 12.565 18.100 1.00 0.00 O ATOM 2217 CB ASP A 133 110.813 14.178 16.631 1.00 0.00 C ATOM 2218 CG ASP A 133 110.191 12.803 16.908 1.00 0.00 C ATOM 2219 OD1 ASP A 133 109.999 12.059 15.959 1.00 0.00 O ATOM 2220 OD2 ASP A 133 109.916 12.519 18.063 1.00 0.00 O ATOM 0 H ASP A 133 112.888 12.181 15.896 1.00 0.00 H new ATOM 0 HA ASP A 133 112.780 15.097 16.432 1.00 0.00 H new ATOM 0 HB2 ASP A 133 110.482 14.887 17.389 1.00 0.00 H new ATOM 0 HB3 ASP A 133 110.460 14.551 15.670 1.00 0.00 H new ATOM 2225 N LYS A 134 112.778 14.492 18.992 1.00 0.00 N ATOM 2226 CA LYS A 134 113.280 14.129 20.361 1.00 0.00 C ATOM 2227 C LYS A 134 112.490 12.942 20.931 1.00 0.00 C ATOM 2228 O LYS A 134 111.283 12.873 20.780 1.00 0.00 O ATOM 2229 CB LYS A 134 113.124 15.385 21.239 1.00 0.00 C ATOM 2230 CG LYS A 134 111.656 15.821 21.352 1.00 0.00 C ATOM 2231 CD LYS A 134 111.558 17.046 22.262 1.00 0.00 C ATOM 2232 CE LYS A 134 110.092 17.308 22.612 1.00 0.00 C ATOM 2233 NZ LYS A 134 110.133 18.138 23.848 1.00 0.00 N ATOM 0 H LYS A 134 112.348 15.415 18.926 1.00 0.00 H new ATOM 0 HA LYS A 134 114.324 13.817 20.328 1.00 0.00 H new ATOM 0 HB2 LYS A 134 113.522 15.185 22.234 1.00 0.00 H new ATOM 0 HB3 LYS A 134 113.714 16.199 20.818 1.00 0.00 H new ATOM 0 HG2 LYS A 134 111.258 16.055 20.365 1.00 0.00 H new ATOM 0 HG3 LYS A 134 111.053 15.007 21.754 1.00 0.00 H new ATOM 0 HD2 LYS A 134 112.136 16.883 23.172 1.00 0.00 H new ATOM 0 HD3 LYS A 134 111.985 17.917 21.764 1.00 0.00 H new ATOM 0 HE2 LYS A 134 109.580 17.830 21.803 1.00 0.00 H new ATOM 0 HE3 LYS A 134 109.554 16.375 22.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 109.163 18.359 24.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 110.620 17.613 24.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 110.645 19.022 23.655 1.00 0.00 H new ATOM 2247 N ASP A 135 113.172 12.023 21.577 1.00 0.00 N ATOM 2248 CA ASP A 135 112.495 10.822 22.161 1.00 0.00 C ATOM 2249 C ASP A 135 112.150 11.075 23.632 1.00 0.00 C ATOM 2250 O ASP A 135 113.027 11.281 24.450 1.00 0.00 O ATOM 2251 CB ASP A 135 113.510 9.684 22.033 1.00 0.00 C ATOM 2252 CG ASP A 135 112.837 8.354 22.383 1.00 0.00 C ATOM 2253 OD1 ASP A 135 112.211 7.781 21.508 1.00 0.00 O ATOM 2254 OD2 ASP A 135 112.960 7.933 23.521 1.00 0.00 O ATOM 0 H ASP A 135 114.181 12.056 21.725 1.00 0.00 H new ATOM 0 HA ASP A 135 111.561 10.587 21.651 1.00 0.00 H new ATOM 0 HB2 ASP A 135 113.904 9.647 21.018 1.00 0.00 H new ATOM 0 HB3 ASP A 135 114.356 9.861 22.697 1.00 0.00 H new ATOM 2259 N GLU A 136 110.874 11.059 23.968 1.00 0.00 N ATOM 2260 CA GLU A 136 110.401 11.301 25.376 1.00 0.00 C ATOM 2261 C GLU A 136 110.947 12.623 25.940 1.00 0.00 C ATOM 2262 O GLU A 136 110.219 13.600 25.910 1.00 0.00 O ATOM 2263 CB GLU A 136 110.887 10.106 26.207 1.00 0.00 C ATOM 2264 CG GLU A 136 110.225 10.134 27.587 1.00 0.00 C ATOM 2265 CD GLU A 136 110.806 9.019 28.460 1.00 0.00 C ATOM 2266 OE1 GLU A 136 112.016 8.864 28.462 1.00 0.00 O ATOM 2267 OE2 GLU A 136 110.031 8.340 29.111 1.00 0.00 O ATOM 2268 OXT GLU A 136 112.083 12.635 26.391 1.00 0.00 O ATOM 0 H GLU A 136 110.121 10.883 23.303 1.00 0.00 H new ATOM 0 HA GLU A 136 109.315 11.389 25.406 1.00 0.00 H new ATOM 0 HB2 GLU A 136 110.646 9.174 25.696 1.00 0.00 H new ATOM 0 HB3 GLU A 136 111.971 10.141 26.312 1.00 0.00 H new ATOM 0 HG2 GLU A 136 110.389 11.102 28.060 1.00 0.00 H new ATOM 0 HG3 GLU A 136 109.147 10.006 27.487 1.00 0.00 H new TER 2275 GLU A 136