USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 832 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 39 LYS NZ :NH3+ -174:sc= -1.61! (180deg=0) USER MOD Set 1.2: A 41 ASN : amide:sc= -3.45! C(o=-5.1!,f=-28!) USER MOD Set 2.1: A 26 THR OG1 : rot -94:sc= 2.27 USER MOD Set 2.2: A 28 SER OG : rot 96:sc= 0.375 USER MOD Set 3.1: A 13 TYR OH : rot 65:sc= 0.47! USER MOD Set 3.2: A 19 LYS NZ :NH3+ -136:sc= 0.286! (180deg=-0.000887) USER MOD Single : A 5 ASN : amide:sc= 0.409 K(o=0.41,f=-6.7!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.213 USER MOD Single : A 15 GLN : amide:sc= -0.197 K(o=-0.2,f=-4.6!) USER MOD Single : A 16 THR OG1 : rot 108:sc= 1.08 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 23 ASN : amide:sc= -0.4 K(o=-0.4,f=-4.6!) USER MOD Single : A 24 TYR OH : rot 15:sc= 0.856 USER MOD Single : A 27 LYS NZ :NH3+ -149:sc= 0.24! (180deg=-1.33!) USER MOD Single : A 31 GLN : amide:sc= -1.09 K(o=-1.1,f=-1.7!) USER MOD Single : A 38 SER OG : rot 66:sc= 1.13 USER MOD Single : A 49 LYS NZ :NH3+ 155:sc= -0.563 (180deg=-2.1!) USER MOD Single : A 50 SER OG : rot -57:sc= -0.107! USER MOD Single : A 57 SER OG : rot 34:sc= -1.5! USER MOD Single : A 58 ASN : amide:sc= -1.97 K(o=-2,f=-7.6!) USER MOD Single : A 62 LYS NZ :NH3+ -173:sc= -4.22! (180deg=-5.62!) USER MOD Single : A 66 LYS NZ :NH3+ -155:sc= 0.489! (180deg=0.265!) USER MOD Single : A 67 SER OG : rot 72:sc= 1.17 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= 0.134 X(o=0.13,f=-0.25) USER MOD Single : A 78 TYR OH : rot 168:sc= 0.672 USER MOD Single : A 79 THR OG1 : rot -59:sc= -0.328! USER MOD Single : A 80 SER OG : rot 180:sc=-0.00633 USER MOD Single : A 84 ASN : amide:sc= 0.247 K(o=0.25,f=-16!) USER MOD Single : A 85 SER OG : rot 96:sc= 0.432! USER MOD Single : A 90 TYR OH : rot 58:sc= -1.11 USER MOD Single : A 91 SER OG : rot 129:sc= 1.19 USER MOD Single : A 92 SER OG : rot 110:sc= 0.979 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 165:sc= -1.98! (180deg=-3.64!) USER MOD Single : A 99 THR OG1 : rot 99:sc= -0.336 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot -22:sc= -1.26! USER MOD Single : A 104 GLN : amide:sc= 0.0454 K(o=0.045,f=-0.47) USER MOD Single : A 105 THR OG1 : rot -106:sc= 0.937 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ -153:sc= -1.04! (180deg=-2.51!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 3 13.615 16.625 37.871 1.00 0.00 N ATOM 2 CA VAL A 3 13.548 16.070 39.251 1.00 0.00 C ATOM 3 C VAL A 3 14.453 14.847 39.319 1.00 0.00 C ATOM 4 O VAL A 3 14.203 13.852 38.669 1.00 0.00 O ATOM 5 CB VAL A 3 12.103 15.677 39.599 1.00 0.00 C ATOM 6 CG1 VAL A 3 12.006 15.283 41.080 1.00 0.00 C ATOM 7 CG2 VAL A 3 11.174 16.869 39.336 1.00 0.00 C ATOM 0 HA VAL A 3 13.877 16.821 39.969 1.00 0.00 H new ATOM 0 HB VAL A 3 11.807 14.830 38.980 1.00 0.00 H new ATOM 0 HG11 VAL A 3 10.979 15.006 41.316 1.00 0.00 H new ATOM 0 HG12 VAL A 3 12.664 14.436 41.275 1.00 0.00 H new ATOM 0 HG13 VAL A 3 12.307 16.127 41.701 1.00 0.00 H new ATOM 0 HG21 VAL A 3 10.149 16.593 39.582 1.00 0.00 H new ATOM 0 HG22 VAL A 3 11.481 17.713 39.954 1.00 0.00 H new ATOM 0 HG23 VAL A 3 11.232 17.150 38.284 1.00 0.00 H new ATOM 17 N ILE A 4 15.523 14.933 40.073 1.00 0.00 N ATOM 18 CA ILE A 4 16.481 13.783 40.186 1.00 0.00 C ATOM 19 C ILE A 4 17.487 14.086 41.327 1.00 0.00 C ATOM 20 O ILE A 4 17.635 15.225 41.734 1.00 0.00 O ATOM 21 CB ILE A 4 17.226 13.618 38.848 1.00 0.00 C ATOM 22 CG1 ILE A 4 17.358 12.128 38.504 1.00 0.00 C ATOM 23 CG2 ILE A 4 18.619 14.246 38.954 1.00 0.00 C ATOM 24 CD1 ILE A 4 18.159 11.963 37.204 1.00 0.00 C ATOM 0 H ILE A 4 15.777 15.756 40.620 1.00 0.00 H new ATOM 0 HA ILE A 4 15.947 12.860 40.411 1.00 0.00 H new ATOM 0 HB ILE A 4 16.662 14.118 38.061 1.00 0.00 H new ATOM 0 HG12 ILE A 4 17.855 11.600 39.318 1.00 0.00 H new ATOM 0 HG13 ILE A 4 16.370 11.682 38.392 1.00 0.00 H new ATOM 0 HG21 ILE A 4 19.144 14.128 38.006 1.00 0.00 H new ATOM 0 HG22 ILE A 4 18.523 15.307 39.186 1.00 0.00 H new ATOM 0 HG23 ILE A 4 19.182 13.751 39.745 1.00 0.00 H new ATOM 0 HD11 ILE A 4 18.250 10.904 36.965 1.00 0.00 H new ATOM 0 HD12 ILE A 4 17.644 12.476 36.392 1.00 0.00 H new ATOM 0 HD13 ILE A 4 19.153 12.392 37.332 1.00 0.00 H new ATOM 36 N ASN A 5 18.160 13.093 41.873 1.00 0.00 N ATOM 37 CA ASN A 5 19.116 13.369 43.001 1.00 0.00 C ATOM 38 C ASN A 5 20.333 12.416 42.963 1.00 0.00 C ATOM 39 O ASN A 5 20.892 12.067 44.010 1.00 0.00 O ATOM 40 CB ASN A 5 18.365 13.151 44.313 1.00 0.00 C ATOM 41 CG ASN A 5 17.743 11.755 44.294 1.00 0.00 C ATOM 42 OD1 ASN A 5 17.929 10.997 43.355 1.00 0.00 O ATOM 43 ND2 ASN A 5 17.031 11.361 45.304 1.00 0.00 N ATOM 0 H ASN A 5 18.090 12.115 41.590 1.00 0.00 H new ATOM 0 HA ASN A 5 19.485 14.391 42.909 1.00 0.00 H new ATOM 0 HB2 ASN A 5 19.045 13.250 45.159 1.00 0.00 H new ATOM 0 HB3 ASN A 5 17.591 13.908 44.436 1.00 0.00 H new ATOM 0 HD21 ASN A 5 16.630 10.423 45.311 1.00 0.00 H new ATOM 0 HD22 ASN A 5 16.872 11.989 46.092 1.00 0.00 H new ATOM 50 N THR A 6 20.731 11.975 41.793 1.00 0.00 N ATOM 51 CA THR A 6 21.895 11.038 41.701 1.00 0.00 C ATOM 52 C THR A 6 23.136 11.805 41.199 1.00 0.00 C ATOM 53 O THR A 6 23.033 12.826 40.556 1.00 0.00 O ATOM 54 CB THR A 6 21.573 9.894 40.712 1.00 0.00 C ATOM 55 OG1 THR A 6 21.556 10.398 39.389 1.00 0.00 O ATOM 56 CG2 THR A 6 20.205 9.278 41.019 1.00 0.00 C ATOM 0 H THR A 6 20.302 12.222 40.901 1.00 0.00 H new ATOM 0 HA THR A 6 22.093 10.620 42.688 1.00 0.00 H new ATOM 0 HB THR A 6 22.342 9.129 40.816 1.00 0.00 H new ATOM 0 HG1 THR A 6 21.353 9.671 38.764 1.00 0.00 H new ATOM 0 HG21 THR A 6 20.000 8.475 40.310 1.00 0.00 H new ATOM 0 HG22 THR A 6 20.206 8.876 42.032 1.00 0.00 H new ATOM 0 HG23 THR A 6 19.434 10.043 40.933 1.00 0.00 H new ATOM 64 N PHE A 7 24.308 11.299 41.457 1.00 0.00 N ATOM 65 CA PHE A 7 25.552 11.995 40.990 1.00 0.00 C ATOM 66 C PHE A 7 25.568 12.120 39.445 1.00 0.00 C ATOM 67 O PHE A 7 25.586 13.218 38.921 1.00 0.00 O ATOM 68 CB PHE A 7 26.787 11.206 41.471 1.00 0.00 C ATOM 69 CG PHE A 7 26.514 9.715 41.426 1.00 0.00 C ATOM 70 CD1 PHE A 7 25.778 9.110 42.456 1.00 0.00 C ATOM 71 CD2 PHE A 7 26.998 8.938 40.366 1.00 0.00 C ATOM 72 CE1 PHE A 7 25.527 7.735 42.425 1.00 0.00 C ATOM 73 CE2 PHE A 7 26.743 7.557 40.337 1.00 0.00 C ATOM 74 CZ PHE A 7 26.009 6.958 41.367 1.00 0.00 C ATOM 0 H PHE A 7 24.465 10.432 41.972 1.00 0.00 H new ATOM 0 HA PHE A 7 25.573 13.001 41.410 1.00 0.00 H new ATOM 0 HB2 PHE A 7 27.645 11.444 40.843 1.00 0.00 H new ATOM 0 HB3 PHE A 7 27.044 11.504 42.487 1.00 0.00 H new ATOM 0 HD1 PHE A 7 25.405 9.708 43.274 1.00 0.00 H new ATOM 0 HD2 PHE A 7 27.566 9.400 39.572 1.00 0.00 H new ATOM 0 HE1 PHE A 7 24.960 7.272 43.219 1.00 0.00 H new ATOM 0 HE2 PHE A 7 27.114 6.957 39.519 1.00 0.00 H new ATOM 0 HZ PHE A 7 25.815 5.896 41.345 1.00 0.00 H new ATOM 84 N ASP A 8 25.566 11.018 38.720 1.00 0.00 N ATOM 85 CA ASP A 8 25.592 11.086 37.223 1.00 0.00 C ATOM 86 C ASP A 8 24.414 11.910 36.729 1.00 0.00 C ATOM 87 O ASP A 8 24.545 12.726 35.833 1.00 0.00 O ATOM 88 CB ASP A 8 25.521 9.663 36.659 1.00 0.00 C ATOM 89 CG ASP A 8 26.932 9.181 36.345 1.00 0.00 C ATOM 90 OD1 ASP A 8 27.790 9.339 37.192 1.00 0.00 O ATOM 91 OD2 ASP A 8 27.139 8.681 35.252 1.00 0.00 O ATOM 0 H ASP A 8 25.547 10.074 39.106 1.00 0.00 H new ATOM 0 HA ASP A 8 26.514 11.561 36.887 1.00 0.00 H new ATOM 0 HB2 ASP A 8 25.047 8.996 37.379 1.00 0.00 H new ATOM 0 HB3 ASP A 8 24.908 9.646 35.758 1.00 0.00 H new ATOM 96 N GLY A 9 23.269 11.716 37.321 1.00 0.00 N ATOM 97 CA GLY A 9 22.059 12.496 36.923 1.00 0.00 C ATOM 98 C GLY A 9 22.320 13.998 37.087 1.00 0.00 C ATOM 99 O GLY A 9 22.002 14.787 36.214 1.00 0.00 O ATOM 0 H GLY A 9 23.116 11.043 38.072 1.00 0.00 H new ATOM 0 HA2 GLY A 9 21.799 12.275 35.888 1.00 0.00 H new ATOM 0 HA3 GLY A 9 21.208 12.198 37.535 1.00 0.00 H new ATOM 103 N VAL A 10 22.902 14.405 38.188 1.00 0.00 N ATOM 104 CA VAL A 10 23.187 15.847 38.380 1.00 0.00 C ATOM 105 C VAL A 10 24.235 16.260 37.363 1.00 0.00 C ATOM 106 O VAL A 10 24.130 17.303 36.738 1.00 0.00 O ATOM 107 CB VAL A 10 23.717 16.069 39.786 1.00 0.00 C ATOM 108 CG1 VAL A 10 24.230 17.507 39.911 1.00 0.00 C ATOM 109 CG2 VAL A 10 22.589 15.836 40.804 1.00 0.00 C ATOM 0 H VAL A 10 23.189 13.798 38.956 1.00 0.00 H new ATOM 0 HA VAL A 10 22.282 16.439 38.245 1.00 0.00 H new ATOM 0 HB VAL A 10 24.531 15.371 39.984 1.00 0.00 H new ATOM 0 HG11 VAL A 10 24.611 17.671 40.919 1.00 0.00 H new ATOM 0 HG12 VAL A 10 25.030 17.672 39.189 1.00 0.00 H new ATOM 0 HG13 VAL A 10 23.414 18.203 39.714 1.00 0.00 H new ATOM 0 HG21 VAL A 10 22.970 15.996 41.813 1.00 0.00 H new ATOM 0 HG22 VAL A 10 21.774 16.533 40.610 1.00 0.00 H new ATOM 0 HG23 VAL A 10 22.222 14.814 40.712 1.00 0.00 H new ATOM 119 N ALA A 11 25.223 15.425 37.161 1.00 0.00 N ATOM 120 CA ALA A 11 26.279 15.745 36.162 1.00 0.00 C ATOM 121 C ALA A 11 25.639 15.867 34.783 1.00 0.00 C ATOM 122 O ALA A 11 25.699 16.908 34.161 1.00 0.00 O ATOM 123 CB ALA A 11 27.354 14.649 36.144 1.00 0.00 C ATOM 0 H ALA A 11 25.341 14.536 37.647 1.00 0.00 H new ATOM 0 HA ALA A 11 26.755 16.687 36.434 1.00 0.00 H new ATOM 0 HB1 ALA A 11 28.117 14.900 35.408 1.00 0.00 H new ATOM 0 HB2 ALA A 11 27.812 14.572 37.130 1.00 0.00 H new ATOM 0 HB3 ALA A 11 26.897 13.695 35.881 1.00 0.00 H new ATOM 129 N ASP A 12 25.002 14.831 34.304 1.00 0.00 N ATOM 130 CA ASP A 12 24.344 14.910 32.970 1.00 0.00 C ATOM 131 C ASP A 12 23.481 16.166 32.888 1.00 0.00 C ATOM 132 O ASP A 12 23.589 16.949 31.959 1.00 0.00 O ATOM 133 CB ASP A 12 23.442 13.687 32.771 1.00 0.00 C ATOM 134 CG ASP A 12 24.190 12.607 32.008 1.00 0.00 C ATOM 135 OD1 ASP A 12 25.282 12.263 32.440 1.00 0.00 O ATOM 136 OD2 ASP A 12 23.657 12.133 31.018 1.00 0.00 O ATOM 0 H ASP A 12 24.910 13.934 34.780 1.00 0.00 H new ATOM 0 HA ASP A 12 25.115 14.940 32.200 1.00 0.00 H new ATOM 0 HB2 ASP A 12 23.119 13.302 33.738 1.00 0.00 H new ATOM 0 HB3 ASP A 12 22.543 13.973 32.225 1.00 0.00 H new ATOM 141 N TYR A 13 22.611 16.364 33.847 1.00 0.00 N ATOM 142 CA TYR A 13 21.722 17.553 33.846 1.00 0.00 C ATOM 143 C TYR A 13 22.551 18.850 33.862 1.00 0.00 C ATOM 144 O TYR A 13 22.330 19.768 33.078 1.00 0.00 O ATOM 145 CB TYR A 13 20.862 17.458 35.102 1.00 0.00 C ATOM 146 CG TYR A 13 19.699 18.410 35.039 1.00 0.00 C ATOM 147 CD1 TYR A 13 18.484 18.013 34.463 1.00 0.00 C ATOM 148 CD2 TYR A 13 19.830 19.686 35.600 1.00 0.00 C ATOM 149 CE1 TYR A 13 17.400 18.896 34.446 1.00 0.00 C ATOM 150 CE2 TYR A 13 18.741 20.571 35.596 1.00 0.00 C ATOM 151 CZ TYR A 13 17.525 20.173 35.015 1.00 0.00 C ATOM 152 OH TYR A 13 16.447 21.033 35.024 1.00 0.00 O ATOM 0 H TYR A 13 22.482 15.738 34.642 1.00 0.00 H new ATOM 0 HA TYR A 13 21.105 17.575 32.948 1.00 0.00 H new ATOM 0 HB2 TYR A 13 20.495 16.438 35.218 1.00 0.00 H new ATOM 0 HB3 TYR A 13 21.470 17.680 35.979 1.00 0.00 H new ATOM 0 HD1 TYR A 13 18.386 17.027 34.033 1.00 0.00 H new ATOM 0 HD2 TYR A 13 20.770 19.990 36.036 1.00 0.00 H new ATOM 0 HE1 TYR A 13 16.466 18.595 33.995 1.00 0.00 H new ATOM 0 HE2 TYR A 13 18.837 21.552 36.037 1.00 0.00 H new ATOM 0 HH TYR A 13 15.734 20.658 35.583 1.00 0.00 H new ATOM 162 N LEU A 14 23.516 18.921 34.736 1.00 0.00 N ATOM 163 CA LEU A 14 24.384 20.132 34.832 1.00 0.00 C ATOM 164 C LEU A 14 25.352 20.207 33.640 1.00 0.00 C ATOM 165 O LEU A 14 25.523 21.255 33.046 1.00 0.00 O ATOM 166 CB LEU A 14 25.172 20.074 36.147 1.00 0.00 C ATOM 167 CG LEU A 14 26.086 21.298 36.253 1.00 0.00 C ATOM 168 CD1 LEU A 14 25.889 21.999 37.604 1.00 0.00 C ATOM 169 CD2 LEU A 14 27.544 20.858 36.133 1.00 0.00 C ATOM 0 H LEU A 14 23.745 18.180 35.399 1.00 0.00 H new ATOM 0 HA LEU A 14 23.758 21.024 34.812 1.00 0.00 H new ATOM 0 HB2 LEU A 14 24.485 20.046 36.993 1.00 0.00 H new ATOM 0 HB3 LEU A 14 25.765 19.160 36.187 1.00 0.00 H new ATOM 0 HG LEU A 14 25.835 21.990 35.449 1.00 0.00 H new ATOM 0 HD11 LEU A 14 26.546 22.867 37.663 1.00 0.00 H new ATOM 0 HD12 LEU A 14 24.852 22.322 37.699 1.00 0.00 H new ATOM 0 HD13 LEU A 14 26.129 21.307 38.411 1.00 0.00 H new ATOM 0 HD21 LEU A 14 28.194 21.729 36.208 1.00 0.00 H new ATOM 0 HD22 LEU A 14 27.780 20.158 36.935 1.00 0.00 H new ATOM 0 HD23 LEU A 14 27.699 20.372 35.170 1.00 0.00 H new ATOM 181 N GLN A 15 25.977 19.123 33.267 1.00 0.00 N ATOM 182 CA GLN A 15 26.917 19.162 32.109 1.00 0.00 C ATOM 183 C GLN A 15 26.163 19.537 30.818 1.00 0.00 C ATOM 184 O GLN A 15 26.755 19.995 29.868 1.00 0.00 O ATOM 185 CB GLN A 15 27.580 17.783 31.957 1.00 0.00 C ATOM 186 CG GLN A 15 28.689 17.613 33.017 1.00 0.00 C ATOM 187 CD GLN A 15 29.458 16.310 32.790 1.00 0.00 C ATOM 188 OE1 GLN A 15 28.975 15.239 33.100 1.00 0.00 O ATOM 189 NE2 GLN A 15 30.644 16.357 32.263 1.00 0.00 N ATOM 0 H GLN A 15 25.878 18.212 33.714 1.00 0.00 H new ATOM 0 HA GLN A 15 27.682 19.918 32.287 1.00 0.00 H new ATOM 0 HB2 GLN A 15 26.834 16.997 32.070 1.00 0.00 H new ATOM 0 HB3 GLN A 15 28.002 17.681 30.957 1.00 0.00 H new ATOM 0 HG2 GLN A 15 29.375 18.459 32.972 1.00 0.00 H new ATOM 0 HG3 GLN A 15 28.249 17.613 34.014 1.00 0.00 H new ATOM 0 HE21 GLN A 15 31.051 17.255 32.002 1.00 0.00 H new ATOM 0 HE22 GLN A 15 31.169 15.496 32.110 1.00 0.00 H new ATOM 198 N THR A 16 24.874 19.326 30.769 1.00 0.00 N ATOM 199 CA THR A 16 24.098 19.657 29.530 1.00 0.00 C ATOM 200 C THR A 16 23.474 21.061 29.627 1.00 0.00 C ATOM 201 O THR A 16 23.458 21.804 28.666 1.00 0.00 O ATOM 202 CB THR A 16 22.980 18.625 29.342 1.00 0.00 C ATOM 203 OG1 THR A 16 23.501 17.311 29.511 1.00 0.00 O ATOM 204 CG2 THR A 16 22.383 18.775 27.942 1.00 0.00 C ATOM 0 H THR A 16 24.321 18.938 31.533 1.00 0.00 H new ATOM 0 HA THR A 16 24.781 19.637 28.681 1.00 0.00 H new ATOM 0 HB THR A 16 22.202 18.793 30.086 1.00 0.00 H new ATOM 0 HG1 THR A 16 23.180 16.938 30.359 1.00 0.00 H new ATOM 0 HG21 THR A 16 21.588 18.042 27.805 1.00 0.00 H new ATOM 0 HG22 THR A 16 21.975 19.779 27.826 1.00 0.00 H new ATOM 0 HG23 THR A 16 23.160 18.610 27.196 1.00 0.00 H new ATOM 212 N TYR A 17 22.927 21.415 30.769 1.00 0.00 N ATOM 213 CA TYR A 17 22.268 22.749 30.911 1.00 0.00 C ATOM 214 C TYR A 17 23.079 23.710 31.819 1.00 0.00 C ATOM 215 O TYR A 17 22.558 24.707 32.279 1.00 0.00 O ATOM 216 CB TYR A 17 20.880 22.520 31.520 1.00 0.00 C ATOM 217 CG TYR A 17 20.037 21.681 30.580 1.00 0.00 C ATOM 218 CD1 TYR A 17 19.303 22.304 29.562 1.00 0.00 C ATOM 219 CD2 TYR A 17 19.973 20.284 30.735 1.00 0.00 C ATOM 220 CE1 TYR A 17 18.508 21.542 28.695 1.00 0.00 C ATOM 221 CE2 TYR A 17 19.176 19.521 29.865 1.00 0.00 C ATOM 222 CZ TYR A 17 18.449 20.150 28.847 1.00 0.00 C ATOM 223 OH TYR A 17 17.681 19.399 27.985 1.00 0.00 O ATOM 0 H TYR A 17 22.910 20.835 31.608 1.00 0.00 H new ATOM 0 HA TYR A 17 22.203 23.216 29.928 1.00 0.00 H new ATOM 0 HB2 TYR A 17 20.974 22.019 32.483 1.00 0.00 H new ATOM 0 HB3 TYR A 17 20.392 23.477 31.705 1.00 0.00 H new ATOM 0 HD1 TYR A 17 19.350 23.377 29.445 1.00 0.00 H new ATOM 0 HD2 TYR A 17 20.535 19.800 31.520 1.00 0.00 H new ATOM 0 HE1 TYR A 17 17.943 22.026 27.912 1.00 0.00 H new ATOM 0 HE2 TYR A 17 19.124 18.449 29.982 1.00 0.00 H new ATOM 0 HH TYR A 17 17.750 18.452 28.226 1.00 0.00 H new ATOM 233 N HIS A 18 24.342 23.426 32.073 1.00 0.00 N ATOM 234 CA HIS A 18 25.182 24.341 32.932 1.00 0.00 C ATOM 235 C HIS A 18 24.421 24.735 34.205 1.00 0.00 C ATOM 236 O HIS A 18 24.681 25.769 34.796 1.00 0.00 O ATOM 237 CB HIS A 18 25.541 25.612 32.138 1.00 0.00 C ATOM 238 CG HIS A 18 26.773 25.356 31.305 1.00 0.00 C ATOM 239 ND1 HIS A 18 26.747 24.522 30.206 1.00 0.00 N ATOM 240 CD2 HIS A 18 28.071 25.806 31.403 1.00 0.00 C ATOM 241 CE1 HIS A 18 27.992 24.481 29.694 1.00 0.00 C ATOM 242 NE2 HIS A 18 28.836 25.248 30.385 1.00 0.00 N ATOM 0 H HIS A 18 24.829 22.601 31.723 1.00 0.00 H new ATOM 0 HA HIS A 18 26.092 23.812 33.215 1.00 0.00 H new ATOM 0 HB2 HIS A 18 24.708 25.899 31.496 1.00 0.00 H new ATOM 0 HB3 HIS A 18 25.718 26.442 32.822 1.00 0.00 H new ATOM 0 HD2 HIS A 18 28.438 26.488 32.156 1.00 0.00 H new ATOM 0 HE1 HIS A 18 28.273 23.898 28.829 1.00 0.00 H new ATOM 0 HE2 HIS A 18 29.829 25.394 30.205 1.00 0.00 H new ATOM 250 N LYS A 19 23.479 23.931 34.622 1.00 0.00 N ATOM 251 CA LYS A 19 22.689 24.275 35.842 1.00 0.00 C ATOM 252 C LYS A 19 22.412 23.012 36.671 1.00 0.00 C ATOM 253 O LYS A 19 22.328 21.907 36.164 1.00 0.00 O ATOM 254 CB LYS A 19 21.359 24.933 35.432 1.00 0.00 C ATOM 255 CG LYS A 19 20.378 23.867 34.929 1.00 0.00 C ATOM 256 CD LYS A 19 19.108 24.505 34.342 1.00 0.00 C ATOM 257 CE LYS A 19 18.239 23.380 33.759 1.00 0.00 C ATOM 258 NZ LYS A 19 16.971 23.216 34.551 1.00 0.00 N ATOM 0 H LYS A 19 23.222 23.052 34.172 1.00 0.00 H new ATOM 0 HA LYS A 19 23.265 24.974 36.449 1.00 0.00 H new ATOM 0 HB2 LYS A 19 20.929 25.462 36.282 1.00 0.00 H new ATOM 0 HB3 LYS A 19 21.536 25.673 34.652 1.00 0.00 H new ATOM 0 HG2 LYS A 19 20.863 23.253 34.170 1.00 0.00 H new ATOM 0 HG3 LYS A 19 20.107 23.203 35.750 1.00 0.00 H new ATOM 0 HD2 LYS A 19 18.562 25.047 35.114 1.00 0.00 H new ATOM 0 HD3 LYS A 19 19.367 25.227 33.568 1.00 0.00 H new ATOM 0 HE2 LYS A 19 17.997 23.603 32.720 1.00 0.00 H new ATOM 0 HE3 LYS A 19 18.798 22.444 33.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 16.790 22.204 34.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 17.069 23.699 35.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 16.176 23.631 34.024 1.00 0.00 H new ATOM 272 N LEU A 20 22.270 23.174 37.956 1.00 0.00 N ATOM 273 CA LEU A 20 21.988 22.000 38.832 1.00 0.00 C ATOM 274 C LEU A 20 20.516 21.591 38.651 1.00 0.00 C ATOM 275 O LEU A 20 19.671 22.421 38.376 1.00 0.00 O ATOM 276 CB LEU A 20 22.245 22.390 40.297 1.00 0.00 C ATOM 277 CG LEU A 20 23.729 22.651 40.509 1.00 0.00 C ATOM 278 CD1 LEU A 20 24.017 24.124 40.250 1.00 0.00 C ATOM 279 CD2 LEU A 20 24.113 22.310 41.948 1.00 0.00 C ATOM 0 H LEU A 20 22.337 24.069 38.440 1.00 0.00 H new ATOM 0 HA LEU A 20 22.635 21.165 38.565 1.00 0.00 H new ATOM 0 HB2 LEU A 20 21.670 23.280 40.552 1.00 0.00 H new ATOM 0 HB3 LEU A 20 21.909 21.592 40.959 1.00 0.00 H new ATOM 0 HG LEU A 20 24.308 22.031 39.824 1.00 0.00 H new ATOM 0 HD11 LEU A 20 25.079 24.319 40.400 1.00 0.00 H new ATOM 0 HD12 LEU A 20 23.744 24.373 39.225 1.00 0.00 H new ATOM 0 HD13 LEU A 20 23.435 24.735 40.940 1.00 0.00 H new ATOM 0 HD21 LEU A 20 25.176 22.498 42.095 1.00 0.00 H new ATOM 0 HD22 LEU A 20 23.536 22.929 42.635 1.00 0.00 H new ATOM 0 HD23 LEU A 20 23.901 21.259 42.142 1.00 0.00 H new ATOM 291 N PRO A 21 20.210 20.321 38.821 1.00 0.00 N ATOM 292 CA PRO A 21 18.821 19.782 38.672 1.00 0.00 C ATOM 293 C PRO A 21 17.725 20.687 39.253 1.00 0.00 C ATOM 294 O PRO A 21 17.936 21.439 40.187 1.00 0.00 O ATOM 295 CB PRO A 21 18.840 18.476 39.445 1.00 0.00 C ATOM 296 CG PRO A 21 20.268 18.024 39.464 1.00 0.00 C ATOM 297 CD PRO A 21 21.152 19.259 39.188 1.00 0.00 C ATOM 0 HA PRO A 21 18.578 19.687 37.614 1.00 0.00 H new ATOM 0 HB2 PRO A 21 18.463 18.617 40.458 1.00 0.00 H new ATOM 0 HB3 PRO A 21 18.202 17.732 38.968 1.00 0.00 H new ATOM 0 HG2 PRO A 21 20.517 17.583 40.429 1.00 0.00 H new ATOM 0 HG3 PRO A 21 20.437 17.256 38.709 1.00 0.00 H new ATOM 0 HD2 PRO A 21 21.734 19.533 40.068 1.00 0.00 H new ATOM 0 HD3 PRO A 21 21.862 19.065 38.384 1.00 0.00 H new ATOM 305 N ASP A 22 16.556 20.593 38.692 1.00 0.00 N ATOM 306 CA ASP A 22 15.390 21.412 39.150 1.00 0.00 C ATOM 307 C ASP A 22 14.952 21.016 40.574 1.00 0.00 C ATOM 308 O ASP A 22 13.774 20.821 40.853 1.00 0.00 O ATOM 309 CB ASP A 22 14.241 21.141 38.189 1.00 0.00 C ATOM 310 CG ASP A 22 14.284 19.666 37.804 1.00 0.00 C ATOM 311 OD1 ASP A 22 13.848 18.855 38.596 1.00 0.00 O ATOM 312 OD2 ASP A 22 14.787 19.365 36.733 1.00 0.00 O ATOM 0 H ASP A 22 16.349 19.967 37.914 1.00 0.00 H new ATOM 0 HA ASP A 22 15.669 22.466 39.165 1.00 0.00 H new ATOM 0 HB2 ASP A 22 13.287 21.385 38.657 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.330 21.769 37.302 1.00 0.00 H new ATOM 317 N ASN A 23 15.888 20.908 41.472 1.00 0.00 N ATOM 318 CA ASN A 23 15.552 20.544 42.870 1.00 0.00 C ATOM 319 C ASN A 23 16.791 20.727 43.749 1.00 0.00 C ATOM 320 O ASN A 23 16.956 20.057 44.748 1.00 0.00 O ATOM 321 CB ASN A 23 15.049 19.102 42.932 1.00 0.00 C ATOM 322 CG ASN A 23 16.062 18.182 42.266 1.00 0.00 C ATOM 323 OD1 ASN A 23 15.819 17.672 41.186 1.00 0.00 O ATOM 324 ND2 ASN A 23 17.199 17.946 42.860 1.00 0.00 N ATOM 0 H ASN A 23 16.881 21.058 41.293 1.00 0.00 H new ATOM 0 HA ASN A 23 14.758 21.194 43.238 1.00 0.00 H new ATOM 0 HB2 ASN A 23 14.897 18.803 43.969 1.00 0.00 H new ATOM 0 HB3 ASN A 23 14.084 19.020 42.432 1.00 0.00 H new ATOM 0 HD21 ASN A 23 17.886 17.334 42.421 1.00 0.00 H new ATOM 0 HD22 ASN A 23 17.401 18.374 43.764 1.00 0.00 H new ATOM 331 N TYR A 24 17.682 21.617 43.385 1.00 0.00 N ATOM 332 CA TYR A 24 18.908 21.806 44.233 1.00 0.00 C ATOM 333 C TYR A 24 18.967 23.236 44.757 1.00 0.00 C ATOM 334 O TYR A 24 19.048 24.188 43.995 1.00 0.00 O ATOM 335 CB TYR A 24 20.162 21.508 43.430 1.00 0.00 C ATOM 336 CG TYR A 24 20.535 20.074 43.667 1.00 0.00 C ATOM 337 CD1 TYR A 24 21.310 19.735 44.776 1.00 0.00 C ATOM 338 CD2 TYR A 24 20.100 19.078 42.780 1.00 0.00 C ATOM 339 CE1 TYR A 24 21.653 18.402 45.002 1.00 0.00 C ATOM 340 CE2 TYR A 24 20.442 17.746 43.010 1.00 0.00 C ATOM 341 CZ TYR A 24 21.217 17.411 44.121 1.00 0.00 C ATOM 342 OH TYR A 24 21.559 16.104 44.347 1.00 0.00 O ATOM 0 H TYR A 24 17.620 22.210 42.557 1.00 0.00 H new ATOM 0 HA TYR A 24 18.853 21.115 45.074 1.00 0.00 H new ATOM 0 HB2 TYR A 24 19.986 21.686 42.369 1.00 0.00 H new ATOM 0 HB3 TYR A 24 20.975 22.168 43.733 1.00 0.00 H new ATOM 0 HD1 TYR A 24 21.644 20.503 45.458 1.00 0.00 H new ATOM 0 HD2 TYR A 24 19.501 19.342 41.921 1.00 0.00 H new ATOM 0 HE1 TYR A 24 22.256 18.137 45.858 1.00 0.00 H new ATOM 0 HE2 TYR A 24 20.108 16.976 42.330 1.00 0.00 H new ATOM 0 HH TYR A 24 21.891 16.007 45.264 1.00 0.00 H new ATOM 352 N ILE A 25 18.930 23.392 46.053 1.00 0.00 N ATOM 353 CA ILE A 25 18.988 24.770 46.633 1.00 0.00 C ATOM 354 C ILE A 25 20.224 24.888 47.541 1.00 0.00 C ATOM 355 O ILE A 25 20.578 23.972 48.261 1.00 0.00 O ATOM 356 CB ILE A 25 17.657 25.103 47.358 1.00 0.00 C ATOM 357 CG1 ILE A 25 17.466 24.249 48.627 1.00 0.00 C ATOM 358 CG2 ILE A 25 16.493 24.829 46.391 1.00 0.00 C ATOM 359 CD1 ILE A 25 16.238 24.758 49.393 1.00 0.00 C ATOM 0 H ILE A 25 18.863 22.634 46.732 1.00 0.00 H new ATOM 0 HA ILE A 25 19.098 25.513 45.843 1.00 0.00 H new ATOM 0 HB ILE A 25 17.683 26.150 47.660 1.00 0.00 H new ATOM 0 HG12 ILE A 25 17.334 23.201 48.359 1.00 0.00 H new ATOM 0 HG13 ILE A 25 18.353 24.308 49.257 1.00 0.00 H new ATOM 0 HG21 ILE A 25 15.548 25.058 46.884 1.00 0.00 H new ATOM 0 HG22 ILE A 25 16.601 25.455 45.505 1.00 0.00 H new ATOM 0 HG23 ILE A 25 16.504 23.779 46.097 1.00 0.00 H new ATOM 0 HD11 ILE A 25 16.096 24.159 50.292 1.00 0.00 H new ATOM 0 HD12 ILE A 25 16.390 25.801 49.672 1.00 0.00 H new ATOM 0 HD13 ILE A 25 15.355 24.677 48.760 1.00 0.00 H new ATOM 371 N THR A 26 20.918 26.003 47.475 1.00 0.00 N ATOM 372 CA THR A 26 22.164 26.167 48.300 1.00 0.00 C ATOM 373 C THR A 26 21.820 26.269 49.802 1.00 0.00 C ATOM 374 O THR A 26 20.671 26.451 50.192 1.00 0.00 O ATOM 375 CB THR A 26 22.897 27.451 47.861 1.00 0.00 C ATOM 376 OG1 THR A 26 22.221 28.579 48.401 1.00 0.00 O ATOM 377 CG2 THR A 26 22.916 27.556 46.324 1.00 0.00 C ATOM 0 H THR A 26 20.678 26.803 46.889 1.00 0.00 H new ATOM 0 HA THR A 26 22.800 25.295 48.146 1.00 0.00 H new ATOM 0 HB THR A 26 23.924 27.419 48.225 1.00 0.00 H new ATOM 0 HG1 THR A 26 21.577 28.919 47.745 1.00 0.00 H new ATOM 0 HG21 THR A 26 23.436 28.467 46.028 1.00 0.00 H new ATOM 0 HG22 THR A 26 23.432 26.691 45.907 1.00 0.00 H new ATOM 0 HG23 THR A 26 21.893 27.584 45.949 1.00 0.00 H new ATOM 385 N LYS A 27 22.825 26.149 50.648 1.00 0.00 N ATOM 386 CA LYS A 27 22.615 26.243 52.127 1.00 0.00 C ATOM 387 C LYS A 27 22.285 27.709 52.406 1.00 0.00 C ATOM 388 O LYS A 27 21.457 28.049 53.242 1.00 0.00 O ATOM 389 CB LYS A 27 23.914 25.818 52.852 1.00 0.00 C ATOM 390 CG LYS A 27 24.152 24.296 52.686 1.00 0.00 C ATOM 391 CD LYS A 27 25.632 23.942 52.981 1.00 0.00 C ATOM 392 CE LYS A 27 26.463 24.072 51.696 1.00 0.00 C ATOM 393 NZ LYS A 27 27.637 23.140 51.749 1.00 0.00 N ATOM 0 H LYS A 27 23.792 25.988 50.367 1.00 0.00 H new ATOM 0 HA LYS A 27 21.815 25.592 52.480 1.00 0.00 H new ATOM 0 HB2 LYS A 27 24.762 26.371 52.447 1.00 0.00 H new ATOM 0 HB3 LYS A 27 23.846 26.069 53.911 1.00 0.00 H new ATOM 0 HG2 LYS A 27 23.498 23.744 53.362 1.00 0.00 H new ATOM 0 HG3 LYS A 27 23.894 23.990 51.672 1.00 0.00 H new ATOM 0 HD2 LYS A 27 26.028 24.605 53.750 1.00 0.00 H new ATOM 0 HD3 LYS A 27 25.702 22.926 53.369 1.00 0.00 H new ATOM 0 HE2 LYS A 27 25.845 23.842 50.828 1.00 0.00 H new ATOM 0 HE3 LYS A 27 26.808 25.099 51.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 28.431 23.552 51.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 27.920 22.994 52.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 27.375 22.227 51.326 1.00 0.00 H new ATOM 407 N SER A 28 22.909 28.572 51.633 1.00 0.00 N ATOM 408 CA SER A 28 22.639 30.046 51.700 1.00 0.00 C ATOM 409 C SER A 28 21.127 30.239 51.746 1.00 0.00 C ATOM 410 O SER A 28 20.554 30.718 52.732 1.00 0.00 O ATOM 411 CB SER A 28 23.228 30.748 50.439 1.00 0.00 C ATOM 412 OG SER A 28 23.911 29.789 49.627 1.00 0.00 O ATOM 0 H SER A 28 23.611 28.307 50.942 1.00 0.00 H new ATOM 0 HA SER A 28 23.105 30.482 52.584 1.00 0.00 H new ATOM 0 HB2 SER A 28 22.429 31.219 49.867 1.00 0.00 H new ATOM 0 HB3 SER A 28 23.915 31.539 50.739 1.00 0.00 H new ATOM 0 HG SER A 28 23.308 29.466 48.925 1.00 0.00 H new ATOM 418 N GLU A 29 20.464 29.905 50.675 1.00 0.00 N ATOM 419 CA GLU A 29 18.994 30.055 50.682 1.00 0.00 C ATOM 420 C GLU A 29 18.428 29.177 51.796 1.00 0.00 C ATOM 421 O GLU A 29 17.743 29.667 52.665 1.00 0.00 O ATOM 422 CB GLU A 29 18.371 29.684 49.331 1.00 0.00 C ATOM 423 CG GLU A 29 19.157 30.406 48.225 1.00 0.00 C ATOM 424 CD GLU A 29 19.309 29.494 47.015 1.00 0.00 C ATOM 425 OE1 GLU A 29 20.175 28.638 47.063 1.00 0.00 O ATOM 426 OE2 GLU A 29 18.553 29.661 46.071 1.00 0.00 O ATOM 0 H GLU A 29 20.871 29.542 49.813 1.00 0.00 H new ATOM 0 HA GLU A 29 18.746 31.101 50.860 1.00 0.00 H new ATOM 0 HB2 GLU A 29 18.406 28.605 49.180 1.00 0.00 H new ATOM 0 HB3 GLU A 29 17.321 29.976 49.304 1.00 0.00 H new ATOM 0 HG2 GLU A 29 18.640 31.322 47.938 1.00 0.00 H new ATOM 0 HG3 GLU A 29 20.139 30.698 48.597 1.00 0.00 H new ATOM 433 N ALA A 30 18.673 27.884 51.774 1.00 0.00 N ATOM 434 CA ALA A 30 18.136 26.999 52.872 1.00 0.00 C ATOM 435 C ALA A 30 18.216 27.756 54.224 1.00 0.00 C ATOM 436 O ALA A 30 17.247 27.848 54.948 1.00 0.00 O ATOM 437 CB ALA A 30 18.972 25.705 52.972 1.00 0.00 C ATOM 0 H ALA A 30 19.214 27.405 51.054 1.00 0.00 H new ATOM 0 HA ALA A 30 17.102 26.742 52.645 1.00 0.00 H new ATOM 0 HB1 ALA A 30 18.574 25.075 53.768 1.00 0.00 H new ATOM 0 HB2 ALA A 30 18.924 25.167 52.025 1.00 0.00 H new ATOM 0 HB3 ALA A 30 20.009 25.958 53.194 1.00 0.00 H new ATOM 443 N GLN A 31 19.386 28.277 54.562 1.00 0.00 N ATOM 444 CA GLN A 31 19.575 29.017 55.853 1.00 0.00 C ATOM 445 C GLN A 31 18.622 30.222 55.928 1.00 0.00 C ATOM 446 O GLN A 31 17.871 30.355 56.871 1.00 0.00 O ATOM 447 CB GLN A 31 21.023 29.504 55.949 1.00 0.00 C ATOM 448 CG GLN A 31 21.944 28.312 56.256 1.00 0.00 C ATOM 449 CD GLN A 31 23.361 28.584 55.748 1.00 0.00 C ATOM 450 OE1 GLN A 31 23.697 29.693 55.401 1.00 0.00 O ATOM 451 NE2 GLN A 31 24.207 27.600 55.689 1.00 0.00 N ATOM 0 H GLN A 31 20.225 28.216 53.985 1.00 0.00 H new ATOM 0 HA GLN A 31 19.353 28.344 56.682 1.00 0.00 H new ATOM 0 HB2 GLN A 31 21.322 29.977 55.014 1.00 0.00 H new ATOM 0 HB3 GLN A 31 21.113 30.258 56.731 1.00 0.00 H new ATOM 0 HG2 GLN A 31 21.966 28.129 57.330 1.00 0.00 H new ATOM 0 HG3 GLN A 31 21.550 27.410 55.787 1.00 0.00 H new ATOM 0 HE21 GLN A 31 23.923 26.665 55.982 1.00 0.00 H new ATOM 0 HE22 GLN A 31 25.155 27.762 55.350 1.00 0.00 H new ATOM 460 N ALA A 32 18.656 31.124 54.960 1.00 0.00 N ATOM 461 CA ALA A 32 17.740 32.321 55.004 1.00 0.00 C ATOM 462 C ALA A 32 16.281 31.836 54.956 1.00 0.00 C ATOM 463 O ALA A 32 15.392 32.456 55.499 1.00 0.00 O ATOM 464 CB ALA A 32 18.010 33.214 53.791 1.00 0.00 C ATOM 0 H ALA A 32 19.274 31.082 54.149 1.00 0.00 H new ATOM 0 HA ALA A 32 17.917 32.885 55.920 1.00 0.00 H new ATOM 0 HB1 ALA A 32 17.348 34.080 53.822 1.00 0.00 H new ATOM 0 HB2 ALA A 32 19.047 33.549 53.810 1.00 0.00 H new ATOM 0 HB3 ALA A 32 17.827 32.650 52.876 1.00 0.00 H new ATOM 470 N LEU A 33 16.049 30.708 54.327 1.00 0.00 N ATOM 471 CA LEU A 33 14.674 30.135 54.241 1.00 0.00 C ATOM 472 C LEU A 33 14.167 29.809 55.651 1.00 0.00 C ATOM 473 O LEU A 33 12.980 29.820 55.911 1.00 0.00 O ATOM 474 CB LEU A 33 14.738 28.845 53.420 1.00 0.00 C ATOM 475 CG LEU A 33 13.332 28.306 53.163 1.00 0.00 C ATOM 476 CD1 LEU A 33 12.585 29.251 52.227 1.00 0.00 C ATOM 477 CD2 LEU A 33 13.454 26.944 52.496 1.00 0.00 C ATOM 0 H LEU A 33 16.769 30.154 53.863 1.00 0.00 H new ATOM 0 HA LEU A 33 13.999 30.851 53.771 1.00 0.00 H new ATOM 0 HB2 LEU A 33 15.240 29.035 52.471 1.00 0.00 H new ATOM 0 HB3 LEU A 33 15.329 28.098 53.950 1.00 0.00 H new ATOM 0 HG LEU A 33 12.788 28.224 54.104 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.582 28.865 52.045 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.516 30.238 52.685 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.122 29.326 51.282 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.459 26.542 52.304 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.991 27.047 51.553 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.999 26.265 53.152 1.00 0.00 H new ATOM 489 N GLY A 34 15.072 29.532 56.566 1.00 0.00 N ATOM 490 CA GLY A 34 14.673 29.202 57.969 1.00 0.00 C ATOM 491 C GLY A 34 15.205 27.817 58.341 1.00 0.00 C ATOM 492 O GLY A 34 14.470 26.958 58.790 1.00 0.00 O ATOM 0 H GLY A 34 16.077 29.522 56.395 1.00 0.00 H new ATOM 0 HA2 GLY A 34 15.068 29.951 58.656 1.00 0.00 H new ATOM 0 HA3 GLY A 34 13.587 29.223 58.064 1.00 0.00 H new ATOM 496 N TRP A 35 16.484 27.593 58.160 1.00 0.00 N ATOM 497 CA TRP A 35 17.064 26.254 58.508 1.00 0.00 C ATOM 498 C TRP A 35 17.376 26.200 60.010 1.00 0.00 C ATOM 499 O TRP A 35 17.727 27.200 60.611 1.00 0.00 O ATOM 500 CB TRP A 35 18.340 26.005 57.683 1.00 0.00 C ATOM 501 CG TRP A 35 18.376 24.593 57.196 1.00 0.00 C ATOM 502 CD1 TRP A 35 17.299 23.883 56.783 1.00 0.00 C ATOM 503 CD2 TRP A 35 19.527 23.711 57.031 1.00 0.00 C ATOM 504 NE1 TRP A 35 17.712 22.628 56.391 1.00 0.00 N ATOM 505 CE2 TRP A 35 19.069 22.471 56.515 1.00 0.00 C ATOM 506 CE3 TRP A 35 20.908 23.855 57.269 1.00 0.00 C ATOM 507 CZ2 TRP A 35 19.940 21.417 56.243 1.00 0.00 C ATOM 508 CZ3 TRP A 35 21.793 22.795 56.993 1.00 0.00 C ATOM 509 CH2 TRP A 35 21.311 21.578 56.480 1.00 0.00 C ATOM 0 H TRP A 35 17.148 28.272 57.789 1.00 0.00 H new ATOM 0 HA TRP A 35 16.340 25.474 58.272 1.00 0.00 H new ATOM 0 HB2 TRP A 35 18.373 26.690 56.836 1.00 0.00 H new ATOM 0 HB3 TRP A 35 19.221 26.209 58.292 1.00 0.00 H new ATOM 0 HD1 TRP A 35 16.281 24.242 56.764 1.00 0.00 H new ATOM 0 HE1 TRP A 35 17.083 21.902 56.049 1.00 0.00 H new ATOM 0 HE3 TRP A 35 21.290 24.784 57.666 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 19.561 20.484 55.853 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 22.850 22.918 57.177 1.00 0.00 H new ATOM 0 HH2 TRP A 35 21.996 20.770 56.269 1.00 0.00 H new ATOM 520 N VAL A 36 17.244 25.044 60.624 1.00 0.00 N ATOM 521 CA VAL A 36 17.518 24.930 62.096 1.00 0.00 C ATOM 522 C VAL A 36 18.348 23.662 62.359 1.00 0.00 C ATOM 523 O VAL A 36 17.965 22.558 61.979 1.00 0.00 O ATOM 524 CB VAL A 36 16.175 24.860 62.857 1.00 0.00 C ATOM 525 CG1 VAL A 36 16.381 24.312 64.273 1.00 0.00 C ATOM 526 CG2 VAL A 36 15.567 26.263 62.962 1.00 0.00 C ATOM 0 H VAL A 36 16.959 24.176 60.170 1.00 0.00 H new ATOM 0 HA VAL A 36 18.078 25.798 62.443 1.00 0.00 H new ATOM 0 HB VAL A 36 15.508 24.197 62.307 1.00 0.00 H new ATOM 0 HG11 VAL A 36 15.423 24.271 64.790 1.00 0.00 H new ATOM 0 HG12 VAL A 36 16.806 23.310 64.217 1.00 0.00 H new ATOM 0 HG13 VAL A 36 17.061 24.964 64.820 1.00 0.00 H new ATOM 0 HG21 VAL A 36 14.620 26.210 63.499 1.00 0.00 H new ATOM 0 HG22 VAL A 36 16.253 26.918 63.500 1.00 0.00 H new ATOM 0 HG23 VAL A 36 15.395 26.661 61.962 1.00 0.00 H new ATOM 536 N ALA A 37 19.479 23.817 63.010 1.00 0.00 N ATOM 537 CA ALA A 37 20.362 22.643 63.300 1.00 0.00 C ATOM 538 C ALA A 37 19.590 21.606 64.125 1.00 0.00 C ATOM 539 O ALA A 37 19.517 20.446 63.767 1.00 0.00 O ATOM 540 CB ALA A 37 21.598 23.105 64.090 1.00 0.00 C ATOM 0 H ALA A 37 19.828 24.711 63.354 1.00 0.00 H new ATOM 0 HA ALA A 37 20.680 22.195 62.358 1.00 0.00 H new ATOM 0 HB1 ALA A 37 22.238 22.248 64.299 1.00 0.00 H new ATOM 0 HB2 ALA A 37 22.153 23.837 63.503 1.00 0.00 H new ATOM 0 HB3 ALA A 37 21.281 23.558 65.029 1.00 0.00 H new ATOM 546 N SER A 38 19.000 22.011 65.216 1.00 0.00 N ATOM 547 CA SER A 38 18.233 21.034 66.048 1.00 0.00 C ATOM 548 C SER A 38 16.953 20.624 65.304 1.00 0.00 C ATOM 549 O SER A 38 15.868 20.665 65.854 1.00 0.00 O ATOM 550 CB SER A 38 17.867 21.675 67.388 1.00 0.00 C ATOM 551 OG SER A 38 16.775 22.571 67.205 1.00 0.00 O ATOM 0 H SER A 38 19.014 22.968 65.568 1.00 0.00 H new ATOM 0 HA SER A 38 18.846 20.151 66.229 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.601 20.904 68.111 1.00 0.00 H new ATOM 0 HB3 SER A 38 18.726 22.210 67.794 1.00 0.00 H new ATOM 0 HG SER A 38 15.976 22.065 66.948 1.00 0.00 H new ATOM 557 N LYS A 39 17.081 20.220 64.066 1.00 0.00 N ATOM 558 CA LYS A 39 15.891 19.795 63.270 1.00 0.00 C ATOM 559 C LYS A 39 16.359 19.376 61.882 1.00 0.00 C ATOM 560 O LYS A 39 16.012 18.313 61.393 1.00 0.00 O ATOM 561 CB LYS A 39 14.900 20.951 63.137 1.00 0.00 C ATOM 562 CG LYS A 39 13.655 20.456 62.394 1.00 0.00 C ATOM 563 CD LYS A 39 12.439 21.277 62.827 1.00 0.00 C ATOM 564 CE LYS A 39 11.897 22.082 61.644 1.00 0.00 C ATOM 565 NZ LYS A 39 12.732 23.306 61.465 1.00 0.00 N ATOM 0 H LYS A 39 17.969 20.166 63.568 1.00 0.00 H new ATOM 0 HA LYS A 39 15.397 18.965 63.774 1.00 0.00 H new ATOM 0 HB2 LYS A 39 14.626 21.327 64.123 1.00 0.00 H new ATOM 0 HB3 LYS A 39 15.358 21.779 62.596 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.802 20.545 61.318 1.00 0.00 H new ATOM 0 HG3 LYS A 39 13.488 19.400 62.607 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.663 20.616 63.212 1.00 0.00 H new ATOM 0 HD3 LYS A 39 12.716 21.950 63.638 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.916 21.478 60.737 1.00 0.00 H new ATOM 0 HE3 LYS A 39 10.858 22.358 61.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.311 23.909 60.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.774 23.831 62.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.693 23.032 61.179 1.00 0.00 H new ATOM 579 N GLY A 40 17.145 20.213 61.237 1.00 0.00 N ATOM 580 CA GLY A 40 17.649 19.869 59.873 1.00 0.00 C ATOM 581 C GLY A 40 16.470 19.712 58.936 1.00 0.00 C ATOM 582 O GLY A 40 16.268 18.681 58.326 1.00 0.00 O ATOM 0 H GLY A 40 17.455 21.115 61.599 1.00 0.00 H new ATOM 0 HA2 GLY A 40 18.316 20.651 59.510 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.228 18.946 59.907 1.00 0.00 H new ATOM 586 N ASN A 41 15.682 20.725 58.837 1.00 0.00 N ATOM 587 CA ASN A 41 14.486 20.658 57.968 1.00 0.00 C ATOM 588 C ASN A 41 14.887 20.691 56.485 1.00 0.00 C ATOM 589 O ASN A 41 16.004 21.055 56.126 1.00 0.00 O ATOM 590 CB ASN A 41 13.562 21.833 58.286 1.00 0.00 C ATOM 591 CG ASN A 41 14.268 22.869 59.159 1.00 0.00 C ATOM 592 OD1 ASN A 41 14.586 22.620 60.306 1.00 0.00 O ATOM 593 ND2 ASN A 41 14.514 24.038 58.666 1.00 0.00 N ATOM 0 H ASN A 41 15.812 21.611 59.325 1.00 0.00 H new ATOM 0 HA ASN A 41 13.965 19.720 58.159 1.00 0.00 H new ATOM 0 HB2 ASN A 41 13.231 22.300 57.359 1.00 0.00 H new ATOM 0 HB3 ASN A 41 12.670 21.470 58.797 1.00 0.00 H new ATOM 0 HD21 ASN A 41 14.973 24.747 59.238 1.00 0.00 H new ATOM 0 HD22 ASN A 41 14.249 24.252 57.704 1.00 0.00 H new ATOM 600 N LEU A 42 13.986 20.330 55.614 1.00 0.00 N ATOM 601 CA LEU A 42 14.305 20.350 54.156 1.00 0.00 C ATOM 602 C LEU A 42 13.074 19.916 53.342 1.00 0.00 C ATOM 603 O LEU A 42 12.504 20.696 52.614 1.00 0.00 O ATOM 604 CB LEU A 42 15.474 19.384 53.874 1.00 0.00 C ATOM 605 CG LEU A 42 15.794 19.374 52.381 1.00 0.00 C ATOM 606 CD1 LEU A 42 16.237 20.771 51.952 1.00 0.00 C ATOM 607 CD2 LEU A 42 16.903 18.354 52.095 1.00 0.00 C ATOM 0 H LEU A 42 13.042 20.022 55.847 1.00 0.00 H new ATOM 0 HA LEU A 42 14.586 21.362 53.865 1.00 0.00 H new ATOM 0 HB2 LEU A 42 16.354 19.689 54.441 1.00 0.00 H new ATOM 0 HB3 LEU A 42 15.214 18.379 54.205 1.00 0.00 H new ATOM 0 HG LEU A 42 14.905 19.091 51.817 1.00 0.00 H new ATOM 0 HD11 LEU A 42 16.467 20.769 50.886 1.00 0.00 H new ATOM 0 HD12 LEU A 42 15.436 21.483 52.149 1.00 0.00 H new ATOM 0 HD13 LEU A 42 17.125 21.060 52.514 1.00 0.00 H new ATOM 0 HD21 LEU A 42 17.128 18.350 51.028 1.00 0.00 H new ATOM 0 HD22 LEU A 42 17.799 18.624 52.654 1.00 0.00 H new ATOM 0 HD23 LEU A 42 16.571 17.361 52.399 1.00 0.00 H new ATOM 619 N ALA A 43 12.666 18.681 53.459 1.00 0.00 N ATOM 620 CA ALA A 43 11.490 18.184 52.663 1.00 0.00 C ATOM 621 C ALA A 43 10.254 19.001 53.009 1.00 0.00 C ATOM 622 O ALA A 43 9.318 19.066 52.246 1.00 0.00 O ATOM 623 CB ALA A 43 11.205 16.701 52.968 1.00 0.00 C ATOM 0 H ALA A 43 13.094 17.987 54.072 1.00 0.00 H new ATOM 0 HA ALA A 43 11.729 18.290 51.605 1.00 0.00 H new ATOM 0 HB1 ALA A 43 10.350 16.366 52.380 1.00 0.00 H new ATOM 0 HB2 ALA A 43 12.079 16.102 52.711 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.984 16.584 54.029 1.00 0.00 H new ATOM 629 N ASP A 44 10.269 19.599 54.174 1.00 0.00 N ATOM 630 CA ASP A 44 9.123 20.428 54.653 1.00 0.00 C ATOM 631 C ASP A 44 9.138 21.783 53.938 1.00 0.00 C ATOM 632 O ASP A 44 8.229 22.138 53.207 1.00 0.00 O ATOM 633 CB ASP A 44 9.269 20.621 56.190 1.00 0.00 C ATOM 634 CG ASP A 44 10.701 21.054 56.555 1.00 0.00 C ATOM 635 OD1 ASP A 44 11.626 20.331 56.224 1.00 0.00 O ATOM 636 OD2 ASP A 44 10.852 22.096 57.166 1.00 0.00 O ATOM 0 H ASP A 44 11.049 19.545 54.829 1.00 0.00 H new ATOM 0 HA ASP A 44 8.176 19.935 54.435 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.558 21.372 56.536 1.00 0.00 H new ATOM 0 HB3 ASP A 44 9.024 19.691 56.702 1.00 0.00 H new ATOM 641 N VAL A 45 10.159 22.551 54.168 1.00 0.00 N ATOM 642 CA VAL A 45 10.226 23.887 53.524 1.00 0.00 C ATOM 643 C VAL A 45 10.617 23.735 52.048 1.00 0.00 C ATOM 644 O VAL A 45 10.540 24.677 51.287 1.00 0.00 O ATOM 645 CB VAL A 45 11.277 24.744 54.254 1.00 0.00 C ATOM 646 CG1 VAL A 45 10.763 25.125 55.653 1.00 0.00 C ATOM 647 CG2 VAL A 45 12.586 23.957 54.387 1.00 0.00 C ATOM 0 H VAL A 45 10.947 22.314 54.771 1.00 0.00 H new ATOM 0 HA VAL A 45 9.251 24.371 53.583 1.00 0.00 H new ATOM 0 HB VAL A 45 11.457 25.652 53.678 1.00 0.00 H new ATOM 0 HG11 VAL A 45 11.512 25.731 56.163 1.00 0.00 H new ATOM 0 HG12 VAL A 45 9.838 25.694 55.558 1.00 0.00 H new ATOM 0 HG13 VAL A 45 10.574 24.220 56.230 1.00 0.00 H new ATOM 0 HG21 VAL A 45 13.327 24.567 54.904 1.00 0.00 H new ATOM 0 HG22 VAL A 45 12.406 23.045 54.956 1.00 0.00 H new ATOM 0 HG23 VAL A 45 12.957 23.698 53.395 1.00 0.00 H new ATOM 657 N ALA A 46 11.034 22.566 51.642 1.00 0.00 N ATOM 658 CA ALA A 46 11.435 22.362 50.209 1.00 0.00 C ATOM 659 C ALA A 46 11.103 20.917 49.784 1.00 0.00 C ATOM 660 O ALA A 46 11.993 20.102 49.601 1.00 0.00 O ATOM 661 CB ALA A 46 12.955 22.617 50.064 1.00 0.00 C ATOM 0 H ALA A 46 11.116 21.741 52.236 1.00 0.00 H new ATOM 0 HA ALA A 46 10.889 23.057 49.570 1.00 0.00 H new ATOM 0 HB1 ALA A 46 13.251 22.470 49.025 1.00 0.00 H new ATOM 0 HB2 ALA A 46 13.183 23.640 50.365 1.00 0.00 H new ATOM 0 HB3 ALA A 46 13.503 21.921 50.699 1.00 0.00 H new ATOM 667 N PRO A 47 9.824 20.596 49.653 1.00 0.00 N ATOM 668 CA PRO A 47 9.357 19.222 49.270 1.00 0.00 C ATOM 669 C PRO A 47 9.931 18.726 47.939 1.00 0.00 C ATOM 670 O PRO A 47 9.741 19.336 46.893 1.00 0.00 O ATOM 671 CB PRO A 47 7.820 19.368 49.162 1.00 0.00 C ATOM 672 CG PRO A 47 7.488 20.552 50.007 1.00 0.00 C ATOM 673 CD PRO A 47 8.680 21.507 49.868 1.00 0.00 C ATOM 0 HA PRO A 47 9.687 18.486 50.003 1.00 0.00 H new ATOM 0 HB2 PRO A 47 7.509 19.520 48.128 1.00 0.00 H new ATOM 0 HB3 PRO A 47 7.312 18.472 49.519 1.00 0.00 H new ATOM 0 HG2 PRO A 47 6.565 21.026 49.672 1.00 0.00 H new ATOM 0 HG3 PRO A 47 7.338 20.261 51.047 1.00 0.00 H new ATOM 0 HD2 PRO A 47 8.550 22.193 49.031 1.00 0.00 H new ATOM 0 HD3 PRO A 47 8.814 22.116 50.762 1.00 0.00 H new ATOM 681 N GLY A 48 10.587 17.591 47.953 1.00 0.00 N ATOM 682 CA GLY A 48 11.145 17.026 46.694 1.00 0.00 C ATOM 683 C GLY A 48 12.381 17.827 46.263 1.00 0.00 C ATOM 684 O GLY A 48 12.595 18.068 45.078 1.00 0.00 O ATOM 0 H GLY A 48 10.758 17.032 48.789 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.413 15.980 46.842 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.391 17.054 45.907 1.00 0.00 H new ATOM 688 N LYS A 49 13.172 18.274 47.221 1.00 0.00 N ATOM 689 CA LYS A 49 14.390 19.102 46.896 1.00 0.00 C ATOM 690 C LYS A 49 15.594 18.687 47.764 1.00 0.00 C ATOM 691 O LYS A 49 15.484 17.891 48.676 1.00 0.00 O ATOM 692 CB LYS A 49 14.040 20.574 47.160 1.00 0.00 C ATOM 693 CG LYS A 49 12.741 20.930 46.427 1.00 0.00 C ATOM 694 CD LYS A 49 13.014 21.002 44.923 1.00 0.00 C ATOM 695 CE LYS A 49 11.731 20.747 44.120 1.00 0.00 C ATOM 696 NZ LYS A 49 11.900 19.534 43.251 1.00 0.00 N ATOM 0 H LYS A 49 13.026 18.101 48.215 1.00 0.00 H new ATOM 0 HA LYS A 49 14.669 18.948 45.854 1.00 0.00 H new ATOM 0 HB2 LYS A 49 13.925 20.745 48.230 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.851 21.218 46.820 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.976 20.182 46.634 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.358 21.885 46.785 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.418 21.982 44.669 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.770 20.266 44.651 1.00 0.00 H new ATOM 0 HE2 LYS A 49 10.890 20.604 44.799 1.00 0.00 H new ATOM 0 HE3 LYS A 49 11.499 21.616 43.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 10.968 19.119 43.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.358 19.808 42.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 12.491 18.834 43.743 1.00 0.00 H new ATOM 710 N SER A 50 16.769 19.176 47.425 1.00 0.00 N ATOM 711 CA SER A 50 17.997 18.781 48.175 1.00 0.00 C ATOM 712 C SER A 50 18.963 19.975 48.327 1.00 0.00 C ATOM 713 O SER A 50 18.870 20.987 47.635 1.00 0.00 O ATOM 714 CB SER A 50 18.679 17.652 47.413 1.00 0.00 C ATOM 715 OG SER A 50 17.832 16.504 47.446 1.00 0.00 O ATOM 0 H SER A 50 16.924 19.832 46.659 1.00 0.00 H new ATOM 0 HA SER A 50 17.719 18.452 49.176 1.00 0.00 H new ATOM 0 HB2 SER A 50 18.870 17.952 46.383 1.00 0.00 H new ATOM 0 HB3 SER A 50 19.645 17.422 47.862 1.00 0.00 H new ATOM 0 HG SER A 50 17.640 16.266 48.377 1.00 0.00 H new ATOM 721 N ILE A 51 19.876 19.855 49.257 1.00 0.00 N ATOM 722 CA ILE A 51 20.856 20.942 49.534 1.00 0.00 C ATOM 723 C ILE A 51 22.051 20.840 48.575 1.00 0.00 C ATOM 724 O ILE A 51 22.708 19.810 48.459 1.00 0.00 O ATOM 725 CB ILE A 51 21.335 20.810 50.992 1.00 0.00 C ATOM 726 CG1 ILE A 51 20.125 20.818 51.968 1.00 0.00 C ATOM 727 CG2 ILE A 51 22.272 21.975 51.304 1.00 0.00 C ATOM 728 CD1 ILE A 51 19.712 22.260 52.282 1.00 0.00 C ATOM 0 H ILE A 51 19.983 19.030 49.847 1.00 0.00 H new ATOM 0 HA ILE A 51 20.382 21.912 49.384 1.00 0.00 H new ATOM 0 HB ILE A 51 21.862 19.864 51.119 1.00 0.00 H new ATOM 0 HG12 ILE A 51 19.287 20.280 51.525 1.00 0.00 H new ATOM 0 HG13 ILE A 51 20.387 20.298 52.889 1.00 0.00 H new ATOM 0 HG21 ILE A 51 22.620 21.896 52.334 1.00 0.00 H new ATOM 0 HG22 ILE A 51 23.127 21.945 50.628 1.00 0.00 H new ATOM 0 HG23 ILE A 51 21.738 22.916 51.173 1.00 0.00 H new ATOM 0 HD11 ILE A 51 18.864 22.255 52.966 1.00 0.00 H new ATOM 0 HD12 ILE A 51 20.548 22.785 52.744 1.00 0.00 H new ATOM 0 HD13 ILE A 51 19.430 22.767 51.359 1.00 0.00 H new ATOM 740 N GLY A 52 22.358 21.917 47.900 1.00 0.00 N ATOM 741 CA GLY A 52 23.517 21.909 46.949 1.00 0.00 C ATOM 742 C GLY A 52 23.533 23.202 46.137 1.00 0.00 C ATOM 743 O GLY A 52 22.511 23.839 45.946 1.00 0.00 O ATOM 0 H GLY A 52 21.858 22.804 47.964 1.00 0.00 H new ATOM 0 HA2 GLY A 52 24.451 21.805 47.501 1.00 0.00 H new ATOM 0 HA3 GLY A 52 23.444 21.051 46.281 1.00 0.00 H new ATOM 747 N GLY A 53 24.684 23.611 45.671 1.00 0.00 N ATOM 748 CA GLY A 53 24.744 24.874 44.873 1.00 0.00 C ATOM 749 C GLY A 53 25.714 25.876 45.512 1.00 0.00 C ATOM 750 O GLY A 53 26.190 26.773 44.842 1.00 0.00 O ATOM 0 H GLY A 53 25.575 23.133 45.805 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.063 24.651 43.855 1.00 0.00 H new ATOM 0 HA3 GLY A 53 23.750 25.315 44.807 1.00 0.00 H new ATOM 754 N ASP A 54 26.025 25.732 46.786 1.00 0.00 N ATOM 755 CA ASP A 54 26.979 26.688 47.437 1.00 0.00 C ATOM 756 C ASP A 54 28.375 26.475 46.851 1.00 0.00 C ATOM 757 O ASP A 54 28.532 26.011 45.733 1.00 0.00 O ATOM 758 CB ASP A 54 27.056 26.440 48.949 1.00 0.00 C ATOM 759 CG ASP A 54 25.715 26.032 49.502 1.00 0.00 C ATOM 760 OD1 ASP A 54 25.233 24.983 49.130 1.00 0.00 O ATOM 761 OD2 ASP A 54 25.208 26.765 50.316 1.00 0.00 O ATOM 0 H ASP A 54 25.661 24.999 47.395 1.00 0.00 H new ATOM 0 HA ASP A 54 26.625 27.703 47.255 1.00 0.00 H new ATOM 0 HB2 ASP A 54 27.790 25.661 49.156 1.00 0.00 H new ATOM 0 HB3 ASP A 54 27.400 27.344 49.452 1.00 0.00 H new ATOM 766 N ILE A 55 29.394 26.811 47.602 1.00 0.00 N ATOM 767 CA ILE A 55 30.785 26.650 47.084 1.00 0.00 C ATOM 768 C ILE A 55 31.664 25.871 48.080 1.00 0.00 C ATOM 769 O ILE A 55 31.611 26.075 49.284 1.00 0.00 O ATOM 770 CB ILE A 55 31.377 28.052 46.856 1.00 0.00 C ATOM 771 CG1 ILE A 55 30.540 28.822 45.820 1.00 0.00 C ATOM 772 CG2 ILE A 55 32.813 27.945 46.354 1.00 0.00 C ATOM 773 CD1 ILE A 55 29.720 29.896 46.534 1.00 0.00 C ATOM 0 H ILE A 55 29.323 27.188 48.547 1.00 0.00 H new ATOM 0 HA ILE A 55 30.759 26.085 46.152 1.00 0.00 H new ATOM 0 HB ILE A 55 31.363 28.586 47.806 1.00 0.00 H new ATOM 0 HG12 ILE A 55 31.192 29.280 45.076 1.00 0.00 H new ATOM 0 HG13 ILE A 55 29.880 28.138 45.287 1.00 0.00 H new ATOM 0 HG21 ILE A 55 33.219 28.944 46.197 1.00 0.00 H new ATOM 0 HG22 ILE A 55 33.418 27.419 47.092 1.00 0.00 H new ATOM 0 HG23 ILE A 55 32.829 27.395 45.413 1.00 0.00 H new ATOM 0 HD11 ILE A 55 29.125 30.445 45.804 1.00 0.00 H new ATOM 0 HD12 ILE A 55 29.058 29.425 47.261 1.00 0.00 H new ATOM 0 HD13 ILE A 55 30.391 30.585 47.047 1.00 0.00 H new ATOM 785 N PHE A 56 32.494 24.995 47.574 1.00 0.00 N ATOM 786 CA PHE A 56 33.404 24.207 48.459 1.00 0.00 C ATOM 787 C PHE A 56 34.828 24.775 48.358 1.00 0.00 C ATOM 788 O PHE A 56 35.602 24.396 47.499 1.00 0.00 O ATOM 789 CB PHE A 56 33.389 22.733 48.025 1.00 0.00 C ATOM 790 CG PHE A 56 33.822 21.859 49.174 1.00 0.00 C ATOM 791 CD1 PHE A 56 35.180 21.728 49.473 1.00 0.00 C ATOM 792 CD2 PHE A 56 32.869 21.180 49.939 1.00 0.00 C ATOM 793 CE1 PHE A 56 35.588 20.915 50.537 1.00 0.00 C ATOM 794 CE2 PHE A 56 33.277 20.365 51.002 1.00 0.00 C ATOM 795 CZ PHE A 56 34.636 20.233 51.299 1.00 0.00 C ATOM 0 H PHE A 56 32.581 24.790 46.578 1.00 0.00 H new ATOM 0 HA PHE A 56 33.065 24.275 49.493 1.00 0.00 H new ATOM 0 HB2 PHE A 56 32.388 22.451 47.698 1.00 0.00 H new ATOM 0 HB3 PHE A 56 34.055 22.588 47.174 1.00 0.00 H new ATOM 0 HD1 PHE A 56 35.916 22.254 48.883 1.00 0.00 H new ATOM 0 HD2 PHE A 56 31.819 21.284 49.710 1.00 0.00 H new ATOM 0 HE1 PHE A 56 36.638 20.815 50.769 1.00 0.00 H new ATOM 0 HE2 PHE A 56 32.542 19.839 51.592 1.00 0.00 H new ATOM 0 HZ PHE A 56 34.951 19.603 52.118 1.00 0.00 H new ATOM 805 N SER A 57 35.150 25.724 49.202 1.00 0.00 N ATOM 806 CA SER A 57 36.510 26.365 49.186 1.00 0.00 C ATOM 807 C SER A 57 37.616 25.314 49.412 1.00 0.00 C ATOM 808 O SER A 57 38.623 25.581 50.038 1.00 0.00 O ATOM 809 CB SER A 57 36.566 27.412 50.307 1.00 0.00 C ATOM 810 OG SER A 57 35.746 26.979 51.396 1.00 0.00 O ATOM 0 H SER A 57 34.519 26.090 49.915 1.00 0.00 H new ATOM 0 HA SER A 57 36.675 26.831 48.215 1.00 0.00 H new ATOM 0 HB2 SER A 57 37.594 27.549 50.642 1.00 0.00 H new ATOM 0 HB3 SER A 57 36.220 28.377 49.937 1.00 0.00 H new ATOM 0 HG SER A 57 35.780 26.002 51.463 1.00 0.00 H new ATOM 816 N ASN A 58 37.431 24.121 48.905 1.00 0.00 N ATOM 817 CA ASN A 58 38.450 23.030 49.071 1.00 0.00 C ATOM 818 C ASN A 58 39.062 23.097 50.477 1.00 0.00 C ATOM 819 O ASN A 58 40.238 22.856 50.669 1.00 0.00 O ATOM 820 CB ASN A 58 39.537 23.185 47.992 1.00 0.00 C ATOM 821 CG ASN A 58 40.520 22.005 48.060 1.00 0.00 C ATOM 822 OD1 ASN A 58 40.115 20.860 48.161 1.00 0.00 O ATOM 823 ND2 ASN A 58 41.801 22.230 47.987 1.00 0.00 N ATOM 0 H ASN A 58 36.604 23.849 48.374 1.00 0.00 H new ATOM 0 HA ASN A 58 37.973 22.057 48.954 1.00 0.00 H new ATOM 0 HB2 ASN A 58 39.077 23.229 47.005 1.00 0.00 H new ATOM 0 HB3 ASN A 58 40.072 24.123 48.136 1.00 0.00 H new ATOM 0 HD21 ASN A 58 42.458 21.450 48.014 1.00 0.00 H new ATOM 0 HD22 ASN A 58 42.147 23.186 47.902 1.00 0.00 H new ATOM 830 N ARG A 59 38.271 23.370 51.474 1.00 0.00 N ATOM 831 CA ARG A 59 38.826 23.415 52.855 1.00 0.00 C ATOM 832 C ARG A 59 39.196 22.002 53.320 1.00 0.00 C ATOM 833 O ARG A 59 38.926 21.617 54.440 1.00 0.00 O ATOM 834 CB ARG A 59 37.798 24.039 53.803 1.00 0.00 C ATOM 835 CG ARG A 59 37.801 25.559 53.608 1.00 0.00 C ATOM 836 CD ARG A 59 36.743 26.209 54.511 1.00 0.00 C ATOM 837 NE ARG A 59 35.674 26.829 53.655 1.00 0.00 N ATOM 838 CZ ARG A 59 34.542 27.229 54.169 1.00 0.00 C ATOM 839 NH1 ARG A 59 34.322 27.113 55.440 1.00 0.00 N ATOM 840 NH2 ARG A 59 33.633 27.746 53.400 1.00 0.00 N ATOM 0 H ARG A 59 37.272 23.563 51.395 1.00 0.00 H new ATOM 0 HA ARG A 59 39.728 24.027 52.861 1.00 0.00 H new ATOM 0 HB2 ARG A 59 36.806 23.635 53.602 1.00 0.00 H new ATOM 0 HB3 ARG A 59 38.039 23.791 54.837 1.00 0.00 H new ATOM 0 HG2 ARG A 59 38.787 25.961 53.842 1.00 0.00 H new ATOM 0 HG3 ARG A 59 37.598 25.800 52.565 1.00 0.00 H new ATOM 0 HD2 ARG A 59 36.306 25.463 55.175 1.00 0.00 H new ATOM 0 HD3 ARG A 59 37.204 26.967 55.144 1.00 0.00 H new ATOM 0 HE ARG A 59 35.836 26.939 52.654 1.00 0.00 H new ATOM 0 HH11 ARG A 59 35.035 26.707 56.046 1.00 0.00 H new ATOM 0 HH12 ARG A 59 33.436 27.427 55.835 1.00 0.00 H new ATOM 0 HH21 ARG A 59 33.804 27.838 52.399 1.00 0.00 H new ATOM 0 HH22 ARG A 59 32.747 28.060 53.797 1.00 0.00 H new ATOM 854 N GLU A 60 39.814 21.228 52.465 1.00 0.00 N ATOM 855 CA GLU A 60 40.206 19.839 52.863 1.00 0.00 C ATOM 856 C GLU A 60 41.484 19.419 52.114 1.00 0.00 C ATOM 857 O GLU A 60 42.231 18.569 52.556 1.00 0.00 O ATOM 858 CB GLU A 60 39.068 18.876 52.506 1.00 0.00 C ATOM 859 CG GLU A 60 37.936 18.988 53.537 1.00 0.00 C ATOM 860 CD GLU A 60 37.087 17.727 53.486 1.00 0.00 C ATOM 861 OE1 GLU A 60 36.360 17.563 52.524 1.00 0.00 O ATOM 862 OE2 GLU A 60 37.214 16.911 54.389 1.00 0.00 O ATOM 0 H GLU A 60 40.064 21.494 51.513 1.00 0.00 H new ATOM 0 HA GLU A 60 40.396 19.810 53.936 1.00 0.00 H new ATOM 0 HB2 GLU A 60 38.687 19.105 51.511 1.00 0.00 H new ATOM 0 HB3 GLU A 60 39.443 17.853 52.477 1.00 0.00 H new ATOM 0 HG2 GLU A 60 38.350 19.122 54.536 1.00 0.00 H new ATOM 0 HG3 GLU A 60 37.322 19.863 53.327 1.00 0.00 H new ATOM 869 N GLY A 61 41.718 20.010 50.973 1.00 0.00 N ATOM 870 CA GLY A 61 42.917 19.667 50.147 1.00 0.00 C ATOM 871 C GLY A 61 42.671 18.335 49.434 1.00 0.00 C ATOM 872 O GLY A 61 43.587 17.594 49.150 1.00 0.00 O ATOM 0 H GLY A 61 41.118 20.730 50.569 1.00 0.00 H new ATOM 0 HA2 GLY A 61 43.108 20.454 49.418 1.00 0.00 H new ATOM 0 HA3 GLY A 61 43.802 19.597 50.780 1.00 0.00 H new ATOM 876 N LYS A 62 41.430 18.028 49.152 1.00 0.00 N ATOM 877 CA LYS A 62 41.102 16.741 48.472 1.00 0.00 C ATOM 878 C LYS A 62 40.603 17.020 47.051 1.00 0.00 C ATOM 879 O LYS A 62 40.141 16.130 46.362 1.00 0.00 O ATOM 880 CB LYS A 62 40.001 16.019 49.265 1.00 0.00 C ATOM 881 CG LYS A 62 40.470 15.756 50.706 1.00 0.00 C ATOM 882 CD LYS A 62 39.700 14.560 51.289 1.00 0.00 C ATOM 883 CE LYS A 62 39.284 14.851 52.740 1.00 0.00 C ATOM 884 NZ LYS A 62 37.898 15.408 52.757 1.00 0.00 N ATOM 0 H LYS A 62 40.626 18.618 49.366 1.00 0.00 H new ATOM 0 HA LYS A 62 41.994 16.117 48.424 1.00 0.00 H new ATOM 0 HB2 LYS A 62 39.094 16.623 49.275 1.00 0.00 H new ATOM 0 HB3 LYS A 62 39.751 15.076 48.778 1.00 0.00 H new ATOM 0 HG2 LYS A 62 41.541 15.553 50.719 1.00 0.00 H new ATOM 0 HG3 LYS A 62 40.306 16.641 51.320 1.00 0.00 H new ATOM 0 HD2 LYS A 62 38.816 14.357 50.684 1.00 0.00 H new ATOM 0 HD3 LYS A 62 40.322 13.666 51.254 1.00 0.00 H new ATOM 0 HE2 LYS A 62 39.328 13.937 53.333 1.00 0.00 H new ATOM 0 HE3 LYS A 62 39.978 15.559 53.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 37.659 15.716 53.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 37.843 16.221 52.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 37.226 14.676 52.451 1.00 0.00 H new ATOM 898 N LEU A 63 40.692 18.248 46.614 1.00 0.00 N ATOM 899 CA LEU A 63 40.227 18.603 45.235 1.00 0.00 C ATOM 900 C LEU A 63 41.317 19.418 44.520 1.00 0.00 C ATOM 901 O LEU A 63 42.017 20.213 45.129 1.00 0.00 O ATOM 902 CB LEU A 63 38.946 19.439 45.333 1.00 0.00 C ATOM 903 CG LEU A 63 37.892 18.684 46.154 1.00 0.00 C ATOM 904 CD1 LEU A 63 37.227 19.644 47.139 1.00 0.00 C ATOM 905 CD2 LEU A 63 36.835 18.100 45.214 1.00 0.00 C ATOM 0 H LEU A 63 41.069 19.027 47.154 1.00 0.00 H new ATOM 0 HA LEU A 63 40.027 17.692 44.671 1.00 0.00 H new ATOM 0 HB2 LEU A 63 39.163 20.400 45.799 1.00 0.00 H new ATOM 0 HB3 LEU A 63 38.561 19.649 44.335 1.00 0.00 H new ATOM 0 HG LEU A 63 38.372 17.876 46.706 1.00 0.00 H new ATOM 0 HD11 LEU A 63 36.479 19.107 47.722 1.00 0.00 H new ATOM 0 HD12 LEU A 63 37.981 20.057 47.809 1.00 0.00 H new ATOM 0 HD13 LEU A 63 36.747 20.454 46.590 1.00 0.00 H new ATOM 0 HD21 LEU A 63 36.086 17.564 45.797 1.00 0.00 H new ATOM 0 HD22 LEU A 63 36.355 18.907 44.661 1.00 0.00 H new ATOM 0 HD23 LEU A 63 37.310 17.413 44.514 1.00 0.00 H new ATOM 917 N PRO A 64 41.466 19.213 43.228 1.00 0.00 N ATOM 918 CA PRO A 64 42.484 19.937 42.404 1.00 0.00 C ATOM 919 C PRO A 64 42.258 21.460 42.397 1.00 0.00 C ATOM 920 O PRO A 64 41.183 21.938 42.060 1.00 0.00 O ATOM 921 CB PRO A 64 42.324 19.340 40.994 1.00 0.00 C ATOM 922 CG PRO A 64 40.988 18.668 40.976 1.00 0.00 C ATOM 923 CD PRO A 64 40.681 18.266 42.418 1.00 0.00 C ATOM 0 HA PRO A 64 43.490 19.810 42.804 1.00 0.00 H new ATOM 0 HB2 PRO A 64 42.379 20.118 40.233 1.00 0.00 H new ATOM 0 HB3 PRO A 64 43.121 18.628 40.780 1.00 0.00 H new ATOM 0 HG2 PRO A 64 40.222 19.340 40.590 1.00 0.00 H new ATOM 0 HG3 PRO A 64 41.003 17.794 40.325 1.00 0.00 H new ATOM 0 HD2 PRO A 64 39.616 18.343 42.635 1.00 0.00 H new ATOM 0 HD3 PRO A 64 40.973 17.235 42.615 1.00 0.00 H new ATOM 931 N GLY A 65 43.265 22.220 42.767 1.00 0.00 N ATOM 932 CA GLY A 65 43.126 23.712 42.795 1.00 0.00 C ATOM 933 C GLY A 65 43.781 24.326 41.553 1.00 0.00 C ATOM 934 O GLY A 65 44.194 23.627 40.654 1.00 0.00 O ATOM 0 H GLY A 65 44.179 21.869 43.051 1.00 0.00 H new ATOM 0 HA2 GLY A 65 42.072 23.986 42.833 1.00 0.00 H new ATOM 0 HA3 GLY A 65 43.591 24.111 43.696 1.00 0.00 H new ATOM 938 N LYS A 66 43.864 25.627 41.495 1.00 0.00 N ATOM 939 CA LYS A 66 44.503 26.315 40.321 1.00 0.00 C ATOM 940 C LYS A 66 44.385 27.830 40.517 1.00 0.00 C ATOM 941 O LYS A 66 43.404 28.319 41.048 1.00 0.00 O ATOM 942 CB LYS A 66 43.804 25.892 39.018 1.00 0.00 C ATOM 943 CG LYS A 66 44.136 26.856 37.863 1.00 0.00 C ATOM 944 CD LYS A 66 43.201 26.543 36.681 1.00 0.00 C ATOM 945 CE LYS A 66 43.106 27.738 35.727 1.00 0.00 C ATOM 946 NZ LYS A 66 41.667 28.005 35.425 1.00 0.00 N ATOM 0 H LYS A 66 43.514 26.256 42.217 1.00 0.00 H new ATOM 0 HA LYS A 66 45.554 26.034 40.253 1.00 0.00 H new ATOM 0 HB2 LYS A 66 44.112 24.881 38.750 1.00 0.00 H new ATOM 0 HB3 LYS A 66 42.725 25.866 39.174 1.00 0.00 H new ATOM 0 HG2 LYS A 66 44.008 27.890 38.184 1.00 0.00 H new ATOM 0 HG3 LYS A 66 45.178 26.742 37.562 1.00 0.00 H new ATOM 0 HD2 LYS A 66 43.570 25.671 36.142 1.00 0.00 H new ATOM 0 HD3 LYS A 66 42.208 26.291 37.054 1.00 0.00 H new ATOM 0 HE2 LYS A 66 43.566 28.617 36.178 1.00 0.00 H new ATOM 0 HE3 LYS A 66 43.652 27.530 34.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 41.589 28.488 34.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 41.147 27.105 35.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 41.262 28.608 36.169 1.00 0.00 H new ATOM 960 N SER A 67 45.370 28.580 40.109 1.00 0.00 N ATOM 961 CA SER A 67 45.295 30.062 40.284 1.00 0.00 C ATOM 962 C SER A 67 44.198 30.623 39.368 1.00 0.00 C ATOM 963 O SER A 67 44.452 31.457 38.516 1.00 0.00 O ATOM 964 CB SER A 67 46.640 30.694 39.920 1.00 0.00 C ATOM 965 OG SER A 67 46.762 30.731 38.505 1.00 0.00 O ATOM 0 H SER A 67 46.221 28.236 39.664 1.00 0.00 H new ATOM 0 HA SER A 67 45.061 30.295 41.323 1.00 0.00 H new ATOM 0 HB2 SER A 67 46.707 31.701 40.331 1.00 0.00 H new ATOM 0 HB3 SER A 67 47.457 30.118 40.354 1.00 0.00 H new ATOM 0 HG SER A 67 46.155 31.410 38.142 1.00 0.00 H new ATOM 971 N GLY A 68 42.988 30.159 39.540 1.00 0.00 N ATOM 972 CA GLY A 68 41.851 30.639 38.688 1.00 0.00 C ATOM 973 C GLY A 68 40.846 29.495 38.493 1.00 0.00 C ATOM 974 O GLY A 68 40.780 28.884 37.430 1.00 0.00 O ATOM 0 H GLY A 68 42.733 29.462 40.240 1.00 0.00 H new ATOM 0 HA2 GLY A 68 41.362 31.491 39.160 1.00 0.00 H new ATOM 0 HA3 GLY A 68 42.224 30.980 37.722 1.00 0.00 H new ATOM 978 N ARG A 69 40.064 29.202 39.508 1.00 0.00 N ATOM 979 CA ARG A 69 39.056 28.095 39.404 1.00 0.00 C ATOM 980 C ARG A 69 38.168 28.099 40.652 1.00 0.00 C ATOM 981 O ARG A 69 38.470 28.752 41.640 1.00 0.00 O ATOM 982 CB ARG A 69 39.789 26.744 39.276 1.00 0.00 C ATOM 983 CG ARG A 69 39.392 25.765 40.401 1.00 0.00 C ATOM 984 CD ARG A 69 40.451 24.662 40.501 1.00 0.00 C ATOM 985 NE ARG A 69 40.083 23.519 39.612 1.00 0.00 N ATOM 986 CZ ARG A 69 40.980 22.642 39.254 1.00 0.00 C ATOM 987 NH1 ARG A 69 42.216 22.788 39.585 1.00 0.00 N ATOM 988 NH2 ARG A 69 40.631 21.644 38.518 1.00 0.00 N ATOM 0 H ARG A 69 40.081 29.684 40.407 1.00 0.00 H new ATOM 0 HA ARG A 69 38.432 28.244 38.523 1.00 0.00 H new ATOM 0 HB2 ARG A 69 39.560 26.297 38.308 1.00 0.00 H new ATOM 0 HB3 ARG A 69 40.866 26.911 39.303 1.00 0.00 H new ATOM 0 HG2 ARG A 69 39.310 26.295 41.350 1.00 0.00 H new ATOM 0 HG3 ARG A 69 38.414 25.330 40.194 1.00 0.00 H new ATOM 0 HD2 ARG A 69 41.426 25.056 40.216 1.00 0.00 H new ATOM 0 HD3 ARG A 69 40.535 24.319 41.532 1.00 0.00 H new ATOM 0 HE ARG A 69 39.122 23.424 39.282 1.00 0.00 H new ATOM 0 HH11 ARG A 69 42.505 23.598 40.134 1.00 0.00 H new ATOM 0 HH12 ARG A 69 42.906 22.094 39.298 1.00 0.00 H new ATOM 0 HH21 ARG A 69 39.660 21.545 38.220 1.00 0.00 H new ATOM 0 HH22 ARG A 69 41.325 20.953 38.233 1.00 0.00 H new ATOM 1002 N THR A 70 37.086 27.358 40.625 1.00 0.00 N ATOM 1003 CA THR A 70 36.189 27.304 41.818 1.00 0.00 C ATOM 1004 C THR A 70 35.620 25.887 41.985 1.00 0.00 C ATOM 1005 O THR A 70 35.531 25.126 41.036 1.00 0.00 O ATOM 1006 CB THR A 70 35.049 28.319 41.658 1.00 0.00 C ATOM 1007 OG1 THR A 70 35.607 29.618 41.514 1.00 0.00 O ATOM 1008 CG2 THR A 70 34.148 28.290 42.896 1.00 0.00 C ATOM 0 H THR A 70 36.788 26.791 39.831 1.00 0.00 H new ATOM 0 HA THR A 70 36.764 27.556 42.709 1.00 0.00 H new ATOM 0 HB THR A 70 34.456 28.066 40.779 1.00 0.00 H new ATOM 0 HG1 THR A 70 34.886 30.274 41.409 1.00 0.00 H new ATOM 0 HG21 THR A 70 33.341 29.013 42.776 1.00 0.00 H new ATOM 0 HG22 THR A 70 33.726 27.292 43.016 1.00 0.00 H new ATOM 0 HG23 THR A 70 34.734 28.545 43.779 1.00 0.00 H new ATOM 1016 N TRP A 71 35.250 25.533 43.188 1.00 0.00 N ATOM 1017 CA TRP A 71 34.689 24.173 43.471 1.00 0.00 C ATOM 1018 C TRP A 71 33.318 24.321 44.159 1.00 0.00 C ATOM 1019 O TRP A 71 33.155 25.144 45.041 1.00 0.00 O ATOM 1020 CB TRP A 71 35.652 23.448 44.418 1.00 0.00 C ATOM 1021 CG TRP A 71 36.560 22.565 43.634 1.00 0.00 C ATOM 1022 CD1 TRP A 71 37.867 22.813 43.378 1.00 0.00 C ATOM 1023 CD2 TRP A 71 36.249 21.294 43.002 1.00 0.00 C ATOM 1024 NE1 TRP A 71 38.381 21.768 42.631 1.00 0.00 N ATOM 1025 CE2 TRP A 71 37.418 20.808 42.370 1.00 0.00 C ATOM 1026 CE3 TRP A 71 35.074 20.522 42.917 1.00 0.00 C ATOM 1027 CZ2 TRP A 71 37.420 19.599 41.680 1.00 0.00 C ATOM 1028 CZ3 TRP A 71 35.075 19.304 42.221 1.00 0.00 C ATOM 1029 CH2 TRP A 71 36.248 18.847 41.603 1.00 0.00 C ATOM 0 H TRP A 71 35.314 26.141 44.005 1.00 0.00 H new ATOM 0 HA TRP A 71 34.569 23.611 42.545 1.00 0.00 H new ATOM 0 HB2 TRP A 71 36.235 24.174 44.984 1.00 0.00 H new ATOM 0 HB3 TRP A 71 35.090 22.857 45.141 1.00 0.00 H new ATOM 0 HD1 TRP A 71 38.417 23.683 43.704 1.00 0.00 H new ATOM 0 HE1 TRP A 71 39.348 21.712 42.312 1.00 0.00 H new ATOM 0 HE3 TRP A 71 34.168 20.870 43.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 38.324 19.245 41.207 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 34.170 18.717 42.161 1.00 0.00 H new ATOM 0 HH2 TRP A 71 36.244 17.910 41.066 1.00 0.00 H new ATOM 1040 N ARG A 72 32.335 23.521 43.793 1.00 0.00 N ATOM 1041 CA ARG A 72 30.982 23.631 44.451 1.00 0.00 C ATOM 1042 C ARG A 72 30.521 22.236 44.922 1.00 0.00 C ATOM 1043 O ARG A 72 30.959 21.233 44.394 1.00 0.00 O ATOM 1044 CB ARG A 72 29.963 24.196 43.446 1.00 0.00 C ATOM 1045 CG ARG A 72 30.453 25.531 42.863 1.00 0.00 C ATOM 1046 CD ARG A 72 29.792 25.761 41.493 1.00 0.00 C ATOM 1047 NE ARG A 72 29.444 27.217 41.306 1.00 0.00 N ATOM 1048 CZ ARG A 72 28.745 27.869 42.190 1.00 0.00 C ATOM 1049 NH1 ARG A 72 28.248 27.252 43.212 1.00 0.00 N ATOM 1050 NH2 ARG A 72 28.518 29.136 42.032 1.00 0.00 N ATOM 0 H ARG A 72 32.409 22.802 43.073 1.00 0.00 H new ATOM 0 HA ARG A 72 31.052 24.299 45.310 1.00 0.00 H new ATOM 0 HB2 ARG A 72 29.804 23.479 42.641 1.00 0.00 H new ATOM 0 HB3 ARG A 72 29.001 24.340 43.939 1.00 0.00 H new ATOM 0 HG2 ARG A 72 30.207 26.349 43.540 1.00 0.00 H new ATOM 0 HG3 ARG A 72 31.538 25.519 42.759 1.00 0.00 H new ATOM 0 HD2 ARG A 72 30.466 25.438 40.700 1.00 0.00 H new ATOM 0 HD3 ARG A 72 28.891 25.153 41.412 1.00 0.00 H new ATOM 0 HE ARG A 72 29.764 27.702 40.468 1.00 0.00 H new ATOM 0 HH11 ARG A 72 28.403 26.251 43.328 1.00 0.00 H new ATOM 0 HH12 ARG A 72 27.701 27.767 43.902 1.00 0.00 H new ATOM 0 HH21 ARG A 72 28.887 29.622 41.215 1.00 0.00 H new ATOM 0 HH22 ARG A 72 27.970 29.646 42.725 1.00 0.00 H new ATOM 1064 N GLU A 73 29.644 22.165 45.904 1.00 0.00 N ATOM 1065 CA GLU A 73 29.170 20.830 46.413 1.00 0.00 C ATOM 1066 C GLU A 73 27.646 20.666 46.271 1.00 0.00 C ATOM 1067 O GLU A 73 26.923 21.601 45.975 1.00 0.00 O ATOM 1068 CB GLU A 73 29.561 20.695 47.885 1.00 0.00 C ATOM 1069 CG GLU A 73 28.563 21.465 48.784 1.00 0.00 C ATOM 1070 CD GLU A 73 28.129 20.598 49.979 1.00 0.00 C ATOM 1071 OE1 GLU A 73 28.573 19.470 50.087 1.00 0.00 O ATOM 1072 OE2 GLU A 73 27.364 21.087 50.793 1.00 0.00 O ATOM 0 H GLU A 73 29.237 22.973 46.374 1.00 0.00 H new ATOM 0 HA GLU A 73 29.642 20.051 45.814 1.00 0.00 H new ATOM 0 HB2 GLU A 73 29.577 19.643 48.168 1.00 0.00 H new ATOM 0 HB3 GLU A 73 30.569 21.081 48.037 1.00 0.00 H new ATOM 0 HG2 GLU A 73 29.024 22.385 49.144 1.00 0.00 H new ATOM 0 HG3 GLU A 73 27.689 21.754 48.201 1.00 0.00 H new ATOM 1079 N ALA A 74 27.158 19.460 46.448 1.00 0.00 N ATOM 1080 CA ALA A 74 25.684 19.217 46.316 1.00 0.00 C ATOM 1081 C ALA A 74 25.307 17.836 46.882 1.00 0.00 C ATOM 1082 O ALA A 74 25.984 16.849 46.642 1.00 0.00 O ATOM 1083 CB ALA A 74 25.304 19.261 44.845 1.00 0.00 C ATOM 0 H ALA A 74 27.714 18.636 46.677 1.00 0.00 H new ATOM 0 HA ALA A 74 25.152 19.987 46.874 1.00 0.00 H new ATOM 0 HB1 ALA A 74 24.233 19.085 44.740 1.00 0.00 H new ATOM 0 HB2 ALA A 74 25.553 20.239 44.434 1.00 0.00 H new ATOM 0 HB3 ALA A 74 25.853 18.490 44.304 1.00 0.00 H new ATOM 1089 N ASP A 75 24.232 17.785 47.643 1.00 0.00 N ATOM 1090 CA ASP A 75 23.759 16.515 48.267 1.00 0.00 C ATOM 1091 C ASP A 75 23.465 15.446 47.217 1.00 0.00 C ATOM 1092 O ASP A 75 23.136 15.746 46.080 1.00 0.00 O ATOM 1093 CB ASP A 75 22.468 16.821 49.039 1.00 0.00 C ATOM 1094 CG ASP A 75 22.780 17.008 50.511 1.00 0.00 C ATOM 1095 OD1 ASP A 75 23.692 17.759 50.794 1.00 0.00 O ATOM 1096 OD2 ASP A 75 22.131 16.379 51.328 1.00 0.00 O ATOM 0 H ASP A 75 23.653 18.597 47.858 1.00 0.00 H new ATOM 0 HA ASP A 75 24.540 16.133 48.924 1.00 0.00 H new ATOM 0 HB2 ASP A 75 22.000 17.721 48.640 1.00 0.00 H new ATOM 0 HB3 ASP A 75 21.755 16.007 48.910 1.00 0.00 H new ATOM 1101 N ILE A 76 23.570 14.194 47.597 1.00 0.00 N ATOM 1102 CA ILE A 76 23.290 13.094 46.632 1.00 0.00 C ATOM 1103 C ILE A 76 22.440 12.007 47.295 1.00 0.00 C ATOM 1104 O ILE A 76 22.610 11.687 48.461 1.00 0.00 O ATOM 1105 CB ILE A 76 24.609 12.484 46.136 1.00 0.00 C ATOM 1106 CG1 ILE A 76 25.503 13.590 45.555 1.00 0.00 C ATOM 1107 CG2 ILE A 76 24.296 11.457 45.042 1.00 0.00 C ATOM 1108 CD1 ILE A 76 24.826 14.206 44.321 1.00 0.00 C ATOM 0 H ILE A 76 23.837 13.891 48.534 1.00 0.00 H new ATOM 0 HA ILE A 76 22.741 13.506 45.786 1.00 0.00 H new ATOM 0 HB ILE A 76 25.128 12.002 46.965 1.00 0.00 H new ATOM 0 HG12 ILE A 76 25.681 14.359 46.306 1.00 0.00 H new ATOM 0 HG13 ILE A 76 26.475 13.180 45.282 1.00 0.00 H new ATOM 0 HG21 ILE A 76 25.225 11.016 44.681 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.657 10.674 45.450 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.783 11.950 44.216 1.00 0.00 H new ATOM 0 HD11 ILE A 76 25.462 14.990 43.911 1.00 0.00 H new ATOM 0 HD12 ILE A 76 24.670 13.434 43.568 1.00 0.00 H new ATOM 0 HD13 ILE A 76 23.864 14.632 44.608 1.00 0.00 H new ATOM 1120 N ASN A 77 21.497 11.460 46.559 1.00 0.00 N ATOM 1121 CA ASN A 77 20.623 10.392 47.123 1.00 0.00 C ATOM 1122 C ASN A 77 19.843 10.923 48.336 1.00 0.00 C ATOM 1123 O ASN A 77 20.059 10.509 49.460 1.00 0.00 O ATOM 1124 CB ASN A 77 21.495 9.199 47.543 1.00 0.00 C ATOM 1125 CG ASN A 77 21.741 8.312 46.331 1.00 0.00 C ATOM 1126 OD1 ASN A 77 20.815 7.864 45.698 1.00 0.00 O ATOM 1127 ND2 ASN A 77 22.959 8.006 45.995 1.00 0.00 N ATOM 0 H ASN A 77 21.299 11.712 45.591 1.00 0.00 H new ATOM 0 HA ASN A 77 19.907 10.076 46.365 1.00 0.00 H new ATOM 0 HB2 ASN A 77 22.443 9.551 47.950 1.00 0.00 H new ATOM 0 HB3 ASN A 77 21.001 8.631 48.331 1.00 0.00 H new ATOM 0 HD21 ASN A 77 23.129 7.390 45.200 1.00 0.00 H new ATOM 0 HD22 ASN A 77 23.744 8.382 46.526 1.00 0.00 H new ATOM 1134 N TYR A 78 18.914 11.817 48.106 1.00 0.00 N ATOM 1135 CA TYR A 78 18.096 12.364 49.229 1.00 0.00 C ATOM 1136 C TYR A 78 16.599 12.191 48.911 1.00 0.00 C ATOM 1137 O TYR A 78 16.207 12.011 47.769 1.00 0.00 O ATOM 1138 CB TYR A 78 18.414 13.849 49.416 1.00 0.00 C ATOM 1139 CG TYR A 78 17.424 14.447 50.391 1.00 0.00 C ATOM 1140 CD1 TYR A 78 17.486 14.107 51.749 1.00 0.00 C ATOM 1141 CD2 TYR A 78 16.441 15.341 49.940 1.00 0.00 C ATOM 1142 CE1 TYR A 78 16.563 14.656 52.653 1.00 0.00 C ATOM 1143 CE2 TYR A 78 15.526 15.892 50.844 1.00 0.00 C ATOM 1144 CZ TYR A 78 15.583 15.550 52.197 1.00 0.00 C ATOM 1145 OH TYR A 78 14.675 16.095 53.072 1.00 0.00 O ATOM 0 H TYR A 78 18.687 12.192 47.185 1.00 0.00 H new ATOM 0 HA TYR A 78 18.333 11.825 50.146 1.00 0.00 H new ATOM 0 HB2 TYR A 78 19.431 13.972 49.789 1.00 0.00 H new ATOM 0 HB3 TYR A 78 18.361 14.369 48.459 1.00 0.00 H new ATOM 0 HD1 TYR A 78 18.244 13.423 52.100 1.00 0.00 H new ATOM 0 HD2 TYR A 78 16.391 15.604 48.894 1.00 0.00 H new ATOM 0 HE1 TYR A 78 16.607 14.390 53.699 1.00 0.00 H new ATOM 0 HE2 TYR A 78 14.774 16.584 50.495 1.00 0.00 H new ATOM 0 HH TYR A 78 14.198 16.830 52.633 1.00 0.00 H new ATOM 1155 N THR A 79 15.768 12.225 49.916 1.00 0.00 N ATOM 1156 CA THR A 79 14.297 12.060 49.687 1.00 0.00 C ATOM 1157 C THR A 79 13.549 13.035 50.594 1.00 0.00 C ATOM 1158 O THR A 79 13.087 14.083 50.172 1.00 0.00 O ATOM 1159 CB THR A 79 13.878 10.623 50.034 1.00 0.00 C ATOM 1160 OG1 THR A 79 13.972 10.435 51.447 1.00 0.00 O ATOM 1161 CG2 THR A 79 14.795 9.623 49.312 1.00 0.00 C ATOM 0 H THR A 79 16.041 12.360 50.889 1.00 0.00 H new ATOM 0 HA THR A 79 14.061 12.261 48.642 1.00 0.00 H new ATOM 0 HB THR A 79 12.850 10.455 49.711 1.00 0.00 H new ATOM 0 HG1 THR A 79 14.893 10.601 51.739 1.00 0.00 H new ATOM 0 HG21 THR A 79 14.493 8.606 49.562 1.00 0.00 H new ATOM 0 HG22 THR A 79 14.717 9.770 48.235 1.00 0.00 H new ATOM 0 HG23 THR A 79 15.826 9.783 49.626 1.00 0.00 H new ATOM 1169 N SER A 80 13.440 12.684 51.832 1.00 0.00 N ATOM 1170 CA SER A 80 12.739 13.555 52.814 1.00 0.00 C ATOM 1171 C SER A 80 13.355 13.319 54.199 1.00 0.00 C ATOM 1172 O SER A 80 13.154 12.275 54.796 1.00 0.00 O ATOM 1173 CB SER A 80 11.244 13.196 52.838 1.00 0.00 C ATOM 1174 OG SER A 80 10.769 13.285 54.170 1.00 0.00 O ATOM 0 H SER A 80 13.811 11.816 52.219 1.00 0.00 H new ATOM 0 HA SER A 80 12.846 14.603 52.535 1.00 0.00 H new ATOM 0 HB2 SER A 80 10.684 13.873 52.193 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.093 12.188 52.451 1.00 0.00 H new ATOM 0 HG SER A 80 9.816 13.059 54.193 1.00 0.00 H new ATOM 1180 N GLY A 81 14.113 14.255 54.700 1.00 0.00 N ATOM 1181 CA GLY A 81 14.748 14.065 56.040 1.00 0.00 C ATOM 1182 C GLY A 81 15.904 15.049 56.203 1.00 0.00 C ATOM 1183 O GLY A 81 15.698 16.237 56.350 1.00 0.00 O ATOM 0 H GLY A 81 14.321 15.142 54.243 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.011 14.220 56.828 1.00 0.00 H new ATOM 0 HA3 GLY A 81 15.111 13.042 56.140 1.00 0.00 H new ATOM 1187 N PHE A 82 17.116 14.563 56.149 1.00 0.00 N ATOM 1188 CA PHE A 82 18.308 15.458 56.277 1.00 0.00 C ATOM 1189 C PHE A 82 19.376 15.008 55.271 1.00 0.00 C ATOM 1190 O PHE A 82 19.096 14.239 54.365 1.00 0.00 O ATOM 1191 CB PHE A 82 18.849 15.359 57.716 1.00 0.00 C ATOM 1192 CG PHE A 82 19.899 16.423 57.952 1.00 0.00 C ATOM 1193 CD1 PHE A 82 19.525 17.770 58.019 1.00 0.00 C ATOM 1194 CD2 PHE A 82 21.246 16.064 58.101 1.00 0.00 C ATOM 1195 CE1 PHE A 82 20.494 18.759 58.237 1.00 0.00 C ATOM 1196 CE2 PHE A 82 22.216 17.053 58.317 1.00 0.00 C ATOM 1197 CZ PHE A 82 21.840 18.401 58.385 1.00 0.00 C ATOM 0 H PHE A 82 17.335 13.575 56.021 1.00 0.00 H new ATOM 0 HA PHE A 82 18.037 16.493 56.068 1.00 0.00 H new ATOM 0 HB2 PHE A 82 18.033 15.478 58.429 1.00 0.00 H new ATOM 0 HB3 PHE A 82 19.277 14.371 57.884 1.00 0.00 H new ATOM 0 HD1 PHE A 82 18.488 18.048 57.903 1.00 0.00 H new ATOM 0 HD2 PHE A 82 21.537 15.025 58.049 1.00 0.00 H new ATOM 0 HE1 PHE A 82 20.203 19.798 58.291 1.00 0.00 H new ATOM 0 HE2 PHE A 82 23.254 16.776 58.431 1.00 0.00 H new ATOM 0 HZ PHE A 82 22.587 19.163 58.551 1.00 0.00 H new ATOM 1207 N ARG A 83 20.585 15.488 55.397 1.00 0.00 N ATOM 1208 CA ARG A 83 21.638 15.071 54.434 1.00 0.00 C ATOM 1209 C ARG A 83 22.072 13.630 54.740 1.00 0.00 C ATOM 1210 O ARG A 83 21.350 12.860 55.342 1.00 0.00 O ATOM 1211 CB ARG A 83 22.853 16.009 54.525 1.00 0.00 C ATOM 1212 CG ARG A 83 22.407 17.480 54.506 1.00 0.00 C ATOM 1213 CD ARG A 83 23.498 18.336 53.842 1.00 0.00 C ATOM 1214 NE ARG A 83 24.844 17.741 54.131 1.00 0.00 N ATOM 1215 CZ ARG A 83 25.912 18.081 53.454 1.00 0.00 C ATOM 1216 NH1 ARG A 83 25.845 18.916 52.464 1.00 0.00 N ATOM 1217 NH2 ARG A 83 27.057 17.575 53.782 1.00 0.00 N ATOM 0 H ARG A 83 20.884 16.144 56.118 1.00 0.00 H new ATOM 0 HA ARG A 83 21.232 15.124 53.424 1.00 0.00 H new ATOM 0 HB2 ARG A 83 23.409 15.804 55.440 1.00 0.00 H new ATOM 0 HB3 ARG A 83 23.529 15.818 53.692 1.00 0.00 H new ATOM 0 HG2 ARG A 83 21.469 17.580 53.960 1.00 0.00 H new ATOM 0 HG3 ARG A 83 22.224 17.829 55.522 1.00 0.00 H new ATOM 0 HD2 ARG A 83 23.333 18.384 52.766 1.00 0.00 H new ATOM 0 HD3 ARG A 83 23.452 19.358 54.217 1.00 0.00 H new ATOM 0 HE ARG A 83 24.930 17.051 54.877 1.00 0.00 H new ATOM 0 HH11 ARG A 83 24.948 19.322 52.199 1.00 0.00 H new ATOM 0 HH12 ARG A 83 26.690 19.167 51.950 1.00 0.00 H new ATOM 0 HH21 ARG A 83 27.120 16.919 54.560 1.00 0.00 H new ATOM 0 HH22 ARG A 83 27.896 17.832 53.262 1.00 0.00 H new ATOM 1231 N ASN A 84 23.255 13.266 54.323 1.00 0.00 N ATOM 1232 CA ASN A 84 23.767 11.885 54.573 1.00 0.00 C ATOM 1233 C ASN A 84 25.282 11.871 54.272 1.00 0.00 C ATOM 1234 O ASN A 84 25.942 12.885 54.399 1.00 0.00 O ATOM 1235 CB ASN A 84 23.006 10.902 53.664 1.00 0.00 C ATOM 1236 CG ASN A 84 23.053 11.406 52.217 1.00 0.00 C ATOM 1237 OD1 ASN A 84 24.036 11.995 51.809 1.00 0.00 O ATOM 1238 ND2 ASN A 84 22.024 11.246 51.434 1.00 0.00 N ATOM 0 H ASN A 84 23.897 13.873 53.814 1.00 0.00 H new ATOM 0 HA ASN A 84 23.610 11.584 55.609 1.00 0.00 H new ATOM 0 HB2 ASN A 84 23.452 9.909 53.730 1.00 0.00 H new ATOM 0 HB3 ASN A 84 21.972 10.810 53.995 1.00 0.00 H new ATOM 0 HD21 ASN A 84 22.045 11.614 50.483 1.00 0.00 H new ATOM 0 HD22 ASN A 84 21.198 10.753 51.772 1.00 0.00 H new ATOM 1245 N SER A 85 25.852 10.748 53.900 1.00 0.00 N ATOM 1246 CA SER A 85 27.325 10.713 53.624 1.00 0.00 C ATOM 1247 C SER A 85 27.601 10.827 52.103 1.00 0.00 C ATOM 1248 O SER A 85 28.725 11.008 51.683 1.00 0.00 O ATOM 1249 CB SER A 85 27.898 9.399 54.170 1.00 0.00 C ATOM 1250 OG SER A 85 27.537 8.341 53.296 1.00 0.00 O ATOM 0 H SER A 85 25.365 9.860 53.776 1.00 0.00 H new ATOM 0 HA SER A 85 27.805 11.559 54.115 1.00 0.00 H new ATOM 0 HB2 SER A 85 28.983 9.466 54.252 1.00 0.00 H new ATOM 0 HB3 SER A 85 27.514 9.208 55.172 1.00 0.00 H new ATOM 0 HG SER A 85 28.267 8.176 52.663 1.00 0.00 H new ATOM 1256 N ASP A 86 26.577 10.739 51.284 1.00 0.00 N ATOM 1257 CA ASP A 86 26.764 10.830 49.795 1.00 0.00 C ATOM 1258 C ASP A 86 26.756 12.299 49.323 1.00 0.00 C ATOM 1259 O ASP A 86 25.770 13.006 49.449 1.00 0.00 O ATOM 1260 CB ASP A 86 25.622 10.062 49.116 1.00 0.00 C ATOM 1261 CG ASP A 86 26.218 9.067 48.120 1.00 0.00 C ATOM 1262 OD1 ASP A 86 27.120 8.345 48.505 1.00 0.00 O ATOM 1263 OD2 ASP A 86 25.774 9.042 46.975 1.00 0.00 O ATOM 0 H ASP A 86 25.611 10.607 51.585 1.00 0.00 H new ATOM 0 HA ASP A 86 27.729 10.398 49.528 1.00 0.00 H new ATOM 0 HB2 ASP A 86 25.025 9.537 49.862 1.00 0.00 H new ATOM 0 HB3 ASP A 86 24.954 10.755 48.603 1.00 0.00 H new ATOM 1268 N ARG A 87 27.848 12.747 48.762 1.00 0.00 N ATOM 1269 CA ARG A 87 27.927 14.149 48.263 1.00 0.00 C ATOM 1270 C ARG A 87 28.675 14.176 46.925 1.00 0.00 C ATOM 1271 O ARG A 87 29.577 13.387 46.679 1.00 0.00 O ATOM 1272 CB ARG A 87 28.685 15.018 49.286 1.00 0.00 C ATOM 1273 CG ARG A 87 27.813 15.197 50.525 1.00 0.00 C ATOM 1274 CD ARG A 87 26.752 16.277 50.228 1.00 0.00 C ATOM 1275 NE ARG A 87 25.404 16.016 50.865 1.00 0.00 N ATOM 1276 CZ ARG A 87 25.064 14.833 51.319 1.00 0.00 C ATOM 1277 NH1 ARG A 87 25.895 14.090 51.972 1.00 0.00 N ATOM 1278 NH2 ARG A 87 23.814 14.499 51.342 1.00 0.00 N ATOM 0 H ARG A 87 28.695 12.196 48.628 1.00 0.00 H new ATOM 0 HA ARG A 87 26.919 14.540 48.126 1.00 0.00 H new ATOM 0 HB2 ARG A 87 29.630 14.546 49.555 1.00 0.00 H new ATOM 0 HB3 ARG A 87 28.926 15.988 48.851 1.00 0.00 H new ATOM 0 HG2 ARG A 87 27.331 14.255 50.788 1.00 0.00 H new ATOM 0 HG3 ARG A 87 28.424 15.491 51.378 1.00 0.00 H new ATOM 0 HD2 ARG A 87 27.124 17.241 50.575 1.00 0.00 H new ATOM 0 HD3 ARG A 87 26.622 16.355 49.149 1.00 0.00 H new ATOM 0 HE ARG A 87 24.738 16.785 50.944 1.00 0.00 H new ATOM 0 HH11 ARG A 87 26.845 14.419 52.147 1.00 0.00 H new ATOM 0 HH12 ARG A 87 25.602 13.174 52.313 1.00 0.00 H new ATOM 0 HH21 ARG A 87 23.105 15.153 51.009 1.00 0.00 H new ATOM 0 HH22 ARG A 87 23.538 13.582 51.693 1.00 0.00 H new ATOM 1292 N ILE A 88 28.322 15.095 46.065 1.00 0.00 N ATOM 1293 CA ILE A 88 29.017 15.205 44.768 1.00 0.00 C ATOM 1294 C ILE A 88 29.729 16.552 44.716 1.00 0.00 C ATOM 1295 O ILE A 88 29.208 17.562 45.150 1.00 0.00 O ATOM 1296 CB ILE A 88 28.015 15.064 43.609 1.00 0.00 C ATOM 1297 CG1 ILE A 88 28.793 14.864 42.303 1.00 0.00 C ATOM 1298 CG2 ILE A 88 27.145 16.318 43.498 1.00 0.00 C ATOM 1299 CD1 ILE A 88 27.858 15.010 41.099 1.00 0.00 C ATOM 0 H ILE A 88 27.576 15.774 46.215 1.00 0.00 H new ATOM 0 HA ILE A 88 29.749 14.404 44.666 1.00 0.00 H new ATOM 0 HB ILE A 88 27.368 14.207 43.797 1.00 0.00 H new ATOM 0 HG12 ILE A 88 29.599 15.595 42.237 1.00 0.00 H new ATOM 0 HG13 ILE A 88 29.256 13.877 42.295 1.00 0.00 H new ATOM 0 HG21 ILE A 88 26.442 16.201 42.673 1.00 0.00 H new ATOM 0 HG22 ILE A 88 26.594 16.462 44.427 1.00 0.00 H new ATOM 0 HG23 ILE A 88 27.779 17.186 43.314 1.00 0.00 H new ATOM 0 HD11 ILE A 88 28.424 14.865 40.179 1.00 0.00 H new ATOM 0 HD12 ILE A 88 27.067 14.262 41.160 1.00 0.00 H new ATOM 0 HD13 ILE A 88 27.416 16.006 41.100 1.00 0.00 H new ATOM 1311 N LEU A 89 30.925 16.563 44.187 1.00 0.00 N ATOM 1312 CA LEU A 89 31.709 17.830 44.089 1.00 0.00 C ATOM 1313 C LEU A 89 31.919 18.151 42.604 1.00 0.00 C ATOM 1314 O LEU A 89 32.423 17.325 41.849 1.00 0.00 O ATOM 1315 CB LEU A 89 33.083 17.646 44.776 1.00 0.00 C ATOM 1316 CG LEU A 89 33.069 18.217 46.209 1.00 0.00 C ATOM 1317 CD1 LEU A 89 33.137 19.744 46.179 1.00 0.00 C ATOM 1318 CD2 LEU A 89 31.783 17.791 46.916 1.00 0.00 C ATOM 0 H LEU A 89 31.397 15.739 43.815 1.00 0.00 H new ATOM 0 HA LEU A 89 31.173 18.642 44.580 1.00 0.00 H new ATOM 0 HB2 LEU A 89 33.339 16.587 44.806 1.00 0.00 H new ATOM 0 HB3 LEU A 89 33.855 18.144 44.190 1.00 0.00 H new ATOM 0 HG LEU A 89 33.937 17.832 46.744 1.00 0.00 H new ATOM 0 HD11 LEU A 89 33.126 20.129 47.199 1.00 0.00 H new ATOM 0 HD12 LEU A 89 34.055 20.058 45.683 1.00 0.00 H new ATOM 0 HD13 LEU A 89 32.278 20.136 45.634 1.00 0.00 H new ATOM 0 HD21 LEU A 89 31.774 18.195 47.928 1.00 0.00 H new ATOM 0 HD22 LEU A 89 30.922 18.171 46.366 1.00 0.00 H new ATOM 0 HD23 LEU A 89 31.735 16.703 46.959 1.00 0.00 H new ATOM 1330 N TYR A 90 31.535 19.335 42.188 1.00 0.00 N ATOM 1331 CA TYR A 90 31.699 19.731 40.754 1.00 0.00 C ATOM 1332 C TYR A 90 32.646 20.930 40.664 1.00 0.00 C ATOM 1333 O TYR A 90 32.471 21.940 41.326 1.00 0.00 O ATOM 1334 CB TYR A 90 30.338 20.068 40.108 1.00 0.00 C ATOM 1335 CG TYR A 90 29.359 20.626 41.121 1.00 0.00 C ATOM 1336 CD1 TYR A 90 28.994 19.876 42.237 1.00 0.00 C ATOM 1337 CD2 TYR A 90 28.808 21.894 40.925 1.00 0.00 C ATOM 1338 CE1 TYR A 90 28.079 20.392 43.157 1.00 0.00 C ATOM 1339 CE2 TYR A 90 27.900 22.413 41.848 1.00 0.00 C ATOM 1340 CZ TYR A 90 27.534 21.667 42.963 1.00 0.00 C ATOM 1341 OH TYR A 90 26.613 22.185 43.848 1.00 0.00 O ATOM 0 H TYR A 90 31.113 20.047 42.784 1.00 0.00 H new ATOM 0 HA TYR A 90 32.124 18.890 40.206 1.00 0.00 H new ATOM 0 HB2 TYR A 90 30.485 20.792 39.307 1.00 0.00 H new ATOM 0 HB3 TYR A 90 29.919 19.170 39.653 1.00 0.00 H new ATOM 0 HD1 TYR A 90 29.419 18.895 42.391 1.00 0.00 H new ATOM 0 HD2 TYR A 90 29.085 22.474 40.057 1.00 0.00 H new ATOM 0 HE1 TYR A 90 27.792 19.807 44.018 1.00 0.00 H new ATOM 0 HE2 TYR A 90 27.480 23.396 41.696 1.00 0.00 H new ATOM 0 HH TYR A 90 27.004 22.217 44.746 1.00 0.00 H new ATOM 1351 N SER A 91 33.650 20.812 39.849 1.00 0.00 N ATOM 1352 CA SER A 91 34.658 21.903 39.701 1.00 0.00 C ATOM 1353 C SER A 91 34.327 22.832 38.533 1.00 0.00 C ATOM 1354 O SER A 91 33.650 22.467 37.585 1.00 0.00 O ATOM 1355 CB SER A 91 36.003 21.259 39.421 1.00 0.00 C ATOM 1356 OG SER A 91 36.097 21.010 38.026 1.00 0.00 O ATOM 0 H SER A 91 33.822 19.993 39.266 1.00 0.00 H new ATOM 0 HA SER A 91 34.664 22.494 40.617 1.00 0.00 H new ATOM 0 HB2 SER A 91 36.812 21.914 39.745 1.00 0.00 H new ATOM 0 HB3 SER A 91 36.102 20.329 39.980 1.00 0.00 H new ATOM 0 HG SER A 91 36.937 21.380 37.684 1.00 0.00 H new ATOM 1362 N SER A 92 34.848 24.035 38.580 1.00 0.00 N ATOM 1363 CA SER A 92 34.616 25.009 37.477 1.00 0.00 C ATOM 1364 C SER A 92 35.357 24.521 36.236 1.00 0.00 C ATOM 1365 O SER A 92 35.046 24.904 35.125 1.00 0.00 O ATOM 1366 CB SER A 92 35.150 26.389 37.896 1.00 0.00 C ATOM 1367 OG SER A 92 36.463 26.253 38.445 1.00 0.00 O ATOM 0 H SER A 92 35.428 24.383 39.344 1.00 0.00 H new ATOM 0 HA SER A 92 33.551 25.091 37.262 1.00 0.00 H new ATOM 0 HB2 SER A 92 35.173 27.057 37.035 1.00 0.00 H new ATOM 0 HB3 SER A 92 34.483 26.839 38.631 1.00 0.00 H new ATOM 0 HG SER A 92 37.118 26.640 37.827 1.00 0.00 H new ATOM 1373 N ASP A 93 36.330 23.664 36.412 1.00 0.00 N ATOM 1374 CA ASP A 93 37.087 23.146 35.228 1.00 0.00 C ATOM 1375 C ASP A 93 36.312 21.993 34.571 1.00 0.00 C ATOM 1376 O ASP A 93 36.822 21.320 33.696 1.00 0.00 O ATOM 1377 CB ASP A 93 38.475 22.659 35.667 1.00 0.00 C ATOM 1378 CG ASP A 93 38.740 23.106 37.094 1.00 0.00 C ATOM 1379 OD1 ASP A 93 39.235 24.204 37.277 1.00 0.00 O ATOM 1380 OD2 ASP A 93 38.430 22.335 37.993 1.00 0.00 O ATOM 0 H ASP A 93 36.633 23.302 37.316 1.00 0.00 H new ATOM 0 HA ASP A 93 37.205 23.952 34.503 1.00 0.00 H new ATOM 0 HB2 ASP A 93 38.529 21.572 35.599 1.00 0.00 H new ATOM 0 HB3 ASP A 93 39.240 23.059 35.001 1.00 0.00 H new ATOM 1385 N TRP A 94 35.080 21.774 34.984 1.00 0.00 N ATOM 1386 CA TRP A 94 34.239 20.679 34.395 1.00 0.00 C ATOM 1387 C TRP A 94 34.645 19.316 34.980 1.00 0.00 C ATOM 1388 O TRP A 94 34.515 18.298 34.327 1.00 0.00 O ATOM 1389 CB TRP A 94 34.397 20.666 32.859 1.00 0.00 C ATOM 1390 CG TRP A 94 33.056 20.620 32.191 1.00 0.00 C ATOM 1391 CD1 TRP A 94 32.119 21.597 32.250 1.00 0.00 C ATOM 1392 CD2 TRP A 94 32.496 19.571 31.342 1.00 0.00 C ATOM 1393 NE1 TRP A 94 31.023 21.212 31.500 1.00 0.00 N ATOM 1394 CE2 TRP A 94 31.206 19.976 30.922 1.00 0.00 C ATOM 1395 CE3 TRP A 94 32.974 18.322 30.904 1.00 0.00 C ATOM 1396 CZ2 TRP A 94 30.420 19.172 30.100 1.00 0.00 C ATOM 1397 CZ3 TRP A 94 32.183 17.508 30.072 1.00 0.00 C ATOM 1398 CH2 TRP A 94 30.907 17.935 29.672 1.00 0.00 C ATOM 0 H TRP A 94 34.618 22.316 35.714 1.00 0.00 H new ATOM 0 HA TRP A 94 33.195 20.865 34.645 1.00 0.00 H new ATOM 0 HB2 TRP A 94 34.940 21.555 32.536 1.00 0.00 H new ATOM 0 HB3 TRP A 94 34.990 19.803 32.556 1.00 0.00 H new ATOM 0 HD1 TRP A 94 32.213 22.525 32.794 1.00 0.00 H new ATOM 0 HE1 TRP A 94 30.180 21.776 31.388 1.00 0.00 H new ATOM 0 HE3 TRP A 94 33.954 17.986 31.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 29.438 19.504 29.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 32.559 16.552 29.740 1.00 0.00 H new ATOM 0 HH2 TRP A 94 30.302 17.308 29.034 1.00 0.00 H new ATOM 1409 N LEU A 95 35.134 19.290 36.204 1.00 0.00 N ATOM 1410 CA LEU A 95 35.549 17.990 36.831 1.00 0.00 C ATOM 1411 C LEU A 95 34.469 17.513 37.815 1.00 0.00 C ATOM 1412 O LEU A 95 33.935 18.284 38.595 1.00 0.00 O ATOM 1413 CB LEU A 95 36.884 18.179 37.577 1.00 0.00 C ATOM 1414 CG LEU A 95 37.958 18.670 36.601 1.00 0.00 C ATOM 1415 CD1 LEU A 95 39.140 19.246 37.381 1.00 0.00 C ATOM 1416 CD2 LEU A 95 38.438 17.494 35.744 1.00 0.00 C ATOM 0 H LEU A 95 35.263 20.113 36.793 1.00 0.00 H new ATOM 0 HA LEU A 95 35.674 17.240 36.049 1.00 0.00 H new ATOM 0 HB2 LEU A 95 36.760 18.897 38.387 1.00 0.00 H new ATOM 0 HB3 LEU A 95 37.194 17.238 38.030 1.00 0.00 H new ATOM 0 HG LEU A 95 37.538 19.445 35.960 1.00 0.00 H new ATOM 0 HD11 LEU A 95 39.902 19.594 36.683 1.00 0.00 H new ATOM 0 HD12 LEU A 95 38.800 20.081 37.993 1.00 0.00 H new ATOM 0 HD13 LEU A 95 39.563 18.474 38.024 1.00 0.00 H new ATOM 0 HD21 LEU A 95 39.202 17.839 35.048 1.00 0.00 H new ATOM 0 HD22 LEU A 95 38.857 16.721 36.389 1.00 0.00 H new ATOM 0 HD23 LEU A 95 37.597 17.084 35.185 1.00 0.00 H new ATOM 1428 N ILE A 96 34.145 16.246 37.776 1.00 0.00 N ATOM 1429 CA ILE A 96 33.091 15.704 38.686 1.00 0.00 C ATOM 1430 C ILE A 96 33.726 14.789 39.744 1.00 0.00 C ATOM 1431 O ILE A 96 34.354 13.789 39.430 1.00 0.00 O ATOM 1432 CB ILE A 96 32.079 14.910 37.853 1.00 0.00 C ATOM 1433 CG1 ILE A 96 31.623 15.761 36.655 1.00 0.00 C ATOM 1434 CG2 ILE A 96 30.868 14.525 38.715 1.00 0.00 C ATOM 1435 CD1 ILE A 96 30.907 17.028 37.145 1.00 0.00 C ATOM 0 H ILE A 96 34.567 15.560 37.150 1.00 0.00 H new ATOM 0 HA ILE A 96 32.589 16.527 39.194 1.00 0.00 H new ATOM 0 HB ILE A 96 32.551 13.997 37.490 1.00 0.00 H new ATOM 0 HG12 ILE A 96 32.484 16.034 36.045 1.00 0.00 H new ATOM 0 HG13 ILE A 96 30.955 15.179 36.020 1.00 0.00 H new ATOM 0 HG21 ILE A 96 30.156 13.961 38.112 1.00 0.00 H new ATOM 0 HG22 ILE A 96 31.198 13.912 39.554 1.00 0.00 H new ATOM 0 HG23 ILE A 96 30.388 15.428 39.093 1.00 0.00 H new ATOM 0 HD11 ILE A 96 30.590 17.621 36.287 1.00 0.00 H new ATOM 0 HD12 ILE A 96 30.035 16.748 37.735 1.00 0.00 H new ATOM 0 HD13 ILE A 96 31.588 17.616 37.761 1.00 0.00 H new ATOM 1447 N TYR A 97 33.567 15.140 41.000 1.00 0.00 N ATOM 1448 CA TYR A 97 34.148 14.313 42.111 1.00 0.00 C ATOM 1449 C TYR A 97 33.004 13.805 43.016 1.00 0.00 C ATOM 1450 O TYR A 97 32.029 14.506 43.246 1.00 0.00 O ATOM 1451 CB TYR A 97 35.119 15.172 42.932 1.00 0.00 C ATOM 1452 CG TYR A 97 36.479 15.188 42.259 1.00 0.00 C ATOM 1453 CD1 TYR A 97 36.586 15.630 40.933 1.00 0.00 C ATOM 1454 CD2 TYR A 97 37.631 14.770 42.949 1.00 0.00 C ATOM 1455 CE1 TYR A 97 37.831 15.657 40.296 1.00 0.00 C ATOM 1456 CE2 TYR A 97 38.882 14.796 42.306 1.00 0.00 C ATOM 1457 CZ TYR A 97 38.979 15.240 40.979 1.00 0.00 C ATOM 1458 OH TYR A 97 40.201 15.270 40.345 1.00 0.00 O ATOM 0 H TYR A 97 33.057 15.969 41.306 1.00 0.00 H new ATOM 0 HA TYR A 97 34.687 13.461 41.696 1.00 0.00 H new ATOM 0 HB2 TYR A 97 34.735 16.188 43.022 1.00 0.00 H new ATOM 0 HB3 TYR A 97 35.207 14.774 43.943 1.00 0.00 H new ATOM 0 HD1 TYR A 97 35.703 15.951 40.401 1.00 0.00 H new ATOM 0 HD2 TYR A 97 37.555 14.430 43.971 1.00 0.00 H new ATOM 0 HE1 TYR A 97 37.906 16.000 39.275 1.00 0.00 H new ATOM 0 HE2 TYR A 97 39.767 14.474 42.834 1.00 0.00 H new ATOM 0 HH TYR A 97 40.895 14.950 40.958 1.00 0.00 H new ATOM 1468 N LYS A 98 33.100 12.600 43.524 1.00 0.00 N ATOM 1469 CA LYS A 98 32.003 12.070 44.396 1.00 0.00 C ATOM 1470 C LYS A 98 32.584 11.447 45.674 1.00 0.00 C ATOM 1471 O LYS A 98 33.668 10.873 45.684 1.00 0.00 O ATOM 1472 CB LYS A 98 31.190 11.023 43.605 1.00 0.00 C ATOM 1473 CG LYS A 98 30.379 10.098 44.539 1.00 0.00 C ATOM 1474 CD LYS A 98 29.204 10.869 45.161 1.00 0.00 C ATOM 1475 CE LYS A 98 27.908 10.058 45.033 1.00 0.00 C ATOM 1476 NZ LYS A 98 27.946 8.895 45.964 1.00 0.00 N ATOM 0 H LYS A 98 33.884 11.964 43.375 1.00 0.00 H new ATOM 0 HA LYS A 98 31.348 12.890 44.691 1.00 0.00 H new ATOM 0 HB2 LYS A 98 30.512 11.532 42.920 1.00 0.00 H new ATOM 0 HB3 LYS A 98 31.866 10.422 42.997 1.00 0.00 H new ATOM 0 HG2 LYS A 98 30.005 9.241 43.979 1.00 0.00 H new ATOM 0 HG3 LYS A 98 31.024 9.708 45.326 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.410 11.074 46.211 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.089 11.832 44.664 1.00 0.00 H new ATOM 0 HE2 LYS A 98 27.049 10.690 45.260 1.00 0.00 H new ATOM 0 HE3 LYS A 98 27.786 9.710 44.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 26.989 8.500 46.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 28.583 8.166 45.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 28.292 9.206 46.894 1.00 0.00 H new ATOM 1490 N THR A 99 31.845 11.551 46.748 1.00 0.00 N ATOM 1491 CA THR A 99 32.279 10.972 48.056 1.00 0.00 C ATOM 1492 C THR A 99 31.130 10.125 48.611 1.00 0.00 C ATOM 1493 O THR A 99 30.036 10.157 48.087 1.00 0.00 O ATOM 1494 CB THR A 99 32.598 12.098 49.039 1.00 0.00 C ATOM 1495 OG1 THR A 99 32.730 11.551 50.338 1.00 0.00 O ATOM 1496 CG2 THR A 99 31.477 13.135 49.034 1.00 0.00 C ATOM 0 H THR A 99 30.941 12.022 46.774 1.00 0.00 H new ATOM 0 HA THR A 99 33.170 10.360 47.916 1.00 0.00 H new ATOM 0 HB THR A 99 33.528 12.584 48.742 1.00 0.00 H new ATOM 0 HG1 THR A 99 33.680 11.425 50.545 1.00 0.00 H new ATOM 0 HG21 THR A 99 31.716 13.932 49.738 1.00 0.00 H new ATOM 0 HG22 THR A 99 31.373 13.554 48.033 1.00 0.00 H new ATOM 0 HG23 THR A 99 30.541 12.660 49.327 1.00 0.00 H new ATOM 1504 N THR A 100 31.362 9.381 49.665 1.00 0.00 N ATOM 1505 CA THR A 100 30.253 8.548 50.258 1.00 0.00 C ATOM 1506 C THR A 100 30.396 8.483 51.782 1.00 0.00 C ATOM 1507 O THR A 100 29.578 7.889 52.452 1.00 0.00 O ATOM 1508 CB THR A 100 30.301 7.118 49.704 1.00 0.00 C ATOM 1509 OG1 THR A 100 31.559 6.545 50.016 1.00 0.00 O ATOM 1510 CG2 THR A 100 30.110 7.129 48.189 1.00 0.00 C ATOM 0 H THR A 100 32.261 9.310 50.141 1.00 0.00 H new ATOM 0 HA THR A 100 29.304 9.014 49.993 1.00 0.00 H new ATOM 0 HB THR A 100 29.500 6.532 50.154 1.00 0.00 H new ATOM 0 HG1 THR A 100 31.597 5.630 49.667 1.00 0.00 H new ATOM 0 HG21 THR A 100 30.146 6.108 47.810 1.00 0.00 H new ATOM 0 HG22 THR A 100 29.144 7.571 47.947 1.00 0.00 H new ATOM 0 HG23 THR A 100 30.904 7.716 47.726 1.00 0.00 H new ATOM 1518 N ASP A 101 31.432 9.052 52.341 1.00 0.00 N ATOM 1519 CA ASP A 101 31.608 8.980 53.818 1.00 0.00 C ATOM 1520 C ASP A 101 31.489 10.384 54.399 1.00 0.00 C ATOM 1521 O ASP A 101 31.914 10.660 55.510 1.00 0.00 O ATOM 1522 CB ASP A 101 32.981 8.389 54.112 1.00 0.00 C ATOM 1523 CG ASP A 101 33.983 8.880 53.067 1.00 0.00 C ATOM 1524 OD1 ASP A 101 33.814 9.987 52.569 1.00 0.00 O ATOM 1525 OD2 ASP A 101 34.891 8.133 52.756 1.00 0.00 O ATOM 0 H ASP A 101 32.160 9.561 51.839 1.00 0.00 H new ATOM 0 HA ASP A 101 30.843 8.349 54.271 1.00 0.00 H new ATOM 0 HB2 ASP A 101 33.308 8.681 55.110 1.00 0.00 H new ATOM 0 HB3 ASP A 101 32.930 7.300 54.099 1.00 0.00 H new ATOM 1530 N ALA A 102 30.893 11.259 53.640 1.00 0.00 N ATOM 1531 CA ALA A 102 30.687 12.669 54.088 1.00 0.00 C ATOM 1532 C ALA A 102 31.992 13.461 53.948 1.00 0.00 C ATOM 1533 O ALA A 102 32.552 13.926 54.924 1.00 0.00 O ATOM 1534 CB ALA A 102 30.212 12.694 55.547 1.00 0.00 C ATOM 0 H ALA A 102 30.532 11.054 52.708 1.00 0.00 H new ATOM 0 HA ALA A 102 29.924 13.130 53.460 1.00 0.00 H new ATOM 0 HB1 ALA A 102 30.065 13.726 55.864 1.00 0.00 H new ATOM 0 HB2 ALA A 102 29.271 12.150 55.633 1.00 0.00 H new ATOM 0 HB3 ALA A 102 30.962 12.223 56.182 1.00 0.00 H new ATOM 1540 N TYR A 103 32.469 13.618 52.738 1.00 0.00 N ATOM 1541 CA TYR A 103 33.731 14.398 52.487 1.00 0.00 C ATOM 1542 C TYR A 103 34.976 13.663 53.021 1.00 0.00 C ATOM 1543 O TYR A 103 36.091 14.005 52.661 1.00 0.00 O ATOM 1544 CB TYR A 103 33.652 15.779 53.166 1.00 0.00 C ATOM 1545 CG TYR A 103 32.304 16.420 52.916 1.00 0.00 C ATOM 1546 CD1 TYR A 103 32.068 17.114 51.724 1.00 0.00 C ATOM 1547 CD2 TYR A 103 31.289 16.320 53.874 1.00 0.00 C ATOM 1548 CE1 TYR A 103 30.819 17.705 51.492 1.00 0.00 C ATOM 1549 CE2 TYR A 103 30.041 16.913 53.640 1.00 0.00 C ATOM 1550 CZ TYR A 103 29.809 17.606 52.447 1.00 0.00 C ATOM 1551 OH TYR A 103 28.579 18.196 52.214 1.00 0.00 O ATOM 0 H TYR A 103 32.034 13.235 51.899 1.00 0.00 H new ATOM 0 HA TYR A 103 33.824 14.510 51.407 1.00 0.00 H new ATOM 0 HB2 TYR A 103 33.817 15.673 54.238 1.00 0.00 H new ATOM 0 HB3 TYR A 103 34.444 16.424 52.784 1.00 0.00 H new ATOM 0 HD1 TYR A 103 32.849 17.194 50.982 1.00 0.00 H new ATOM 0 HD2 TYR A 103 31.468 15.785 54.795 1.00 0.00 H new ATOM 0 HE1 TYR A 103 30.639 18.239 50.571 1.00 0.00 H new ATOM 0 HE2 TYR A 103 29.259 16.835 54.380 1.00 0.00 H new ATOM 0 HH TYR A 103 28.679 18.908 51.548 1.00 0.00 H new ATOM 1561 N GLN A 104 34.822 12.656 53.850 1.00 0.00 N ATOM 1562 CA GLN A 104 36.021 11.925 54.374 1.00 0.00 C ATOM 1563 C GLN A 104 36.937 11.539 53.197 1.00 0.00 C ATOM 1564 O GLN A 104 37.966 12.154 52.984 1.00 0.00 O ATOM 1565 CB GLN A 104 35.565 10.678 55.155 1.00 0.00 C ATOM 1566 CG GLN A 104 35.648 10.980 56.669 1.00 0.00 C ATOM 1567 CD GLN A 104 34.930 9.902 57.488 1.00 0.00 C ATOM 1568 OE1 GLN A 104 35.516 9.297 58.359 1.00 0.00 O ATOM 1569 NE2 GLN A 104 33.677 9.639 57.254 1.00 0.00 N ATOM 0 H GLN A 104 33.923 12.310 54.185 1.00 0.00 H new ATOM 0 HA GLN A 104 36.583 12.566 55.053 1.00 0.00 H new ATOM 0 HB2 GLN A 104 34.545 10.412 54.879 1.00 0.00 H new ATOM 0 HB3 GLN A 104 36.196 9.825 54.905 1.00 0.00 H new ATOM 0 HG2 GLN A 104 36.693 11.037 56.975 1.00 0.00 H new ATOM 0 HG3 GLN A 104 35.202 11.953 56.874 1.00 0.00 H new ATOM 0 HE21 GLN A 104 33.178 10.145 56.522 1.00 0.00 H new ATOM 0 HE22 GLN A 104 33.194 8.927 57.802 1.00 0.00 H new ATOM 1578 N THR A 105 36.571 10.558 52.417 1.00 0.00 N ATOM 1579 CA THR A 105 37.407 10.172 51.250 1.00 0.00 C ATOM 1580 C THR A 105 36.804 10.809 49.994 1.00 0.00 C ATOM 1581 O THR A 105 35.835 11.541 50.069 1.00 0.00 O ATOM 1582 CB THR A 105 37.400 8.652 51.099 1.00 0.00 C ATOM 1583 OG1 THR A 105 36.097 8.240 50.711 1.00 0.00 O ATOM 1584 CG2 THR A 105 37.772 7.995 52.431 1.00 0.00 C ATOM 0 H THR A 105 35.723 10.005 52.541 1.00 0.00 H new ATOM 0 HA THR A 105 38.432 10.513 51.393 1.00 0.00 H new ATOM 0 HB THR A 105 38.127 8.352 50.344 1.00 0.00 H new ATOM 0 HG1 THR A 105 35.646 7.821 51.474 1.00 0.00 H new ATOM 0 HG21 THR A 105 37.765 6.911 52.316 1.00 0.00 H new ATOM 0 HG22 THR A 105 38.767 8.322 52.732 1.00 0.00 H new ATOM 0 HG23 THR A 105 37.049 8.284 53.194 1.00 0.00 H new ATOM 1592 N PHE A 106 37.361 10.545 48.847 1.00 0.00 N ATOM 1593 CA PHE A 106 36.810 11.150 47.601 1.00 0.00 C ATOM 1594 C PHE A 106 37.271 10.353 46.376 1.00 0.00 C ATOM 1595 O PHE A 106 38.432 10.017 46.240 1.00 0.00 O ATOM 1596 CB PHE A 106 37.312 12.593 47.488 1.00 0.00 C ATOM 1597 CG PHE A 106 36.145 13.549 47.530 1.00 0.00 C ATOM 1598 CD1 PHE A 106 35.165 13.491 46.530 1.00 0.00 C ATOM 1599 CD2 PHE A 106 36.049 14.507 48.553 1.00 0.00 C ATOM 1600 CE1 PHE A 106 34.083 14.384 46.550 1.00 0.00 C ATOM 1601 CE2 PHE A 106 34.966 15.402 48.578 1.00 0.00 C ATOM 1602 CZ PHE A 106 33.981 15.338 47.575 1.00 0.00 C ATOM 0 H PHE A 106 38.171 9.939 48.717 1.00 0.00 H new ATOM 0 HA PHE A 106 35.721 11.133 47.642 1.00 0.00 H new ATOM 0 HB2 PHE A 106 38.002 12.812 48.303 1.00 0.00 H new ATOM 0 HB3 PHE A 106 37.866 12.723 46.558 1.00 0.00 H new ATOM 0 HD1 PHE A 106 35.243 12.757 45.742 1.00 0.00 H new ATOM 0 HD2 PHE A 106 36.808 14.556 49.320 1.00 0.00 H new ATOM 0 HE1 PHE A 106 33.329 14.338 45.778 1.00 0.00 H new ATOM 0 HE2 PHE A 106 34.890 16.137 49.365 1.00 0.00 H new ATOM 0 HZ PHE A 106 33.146 16.023 47.594 1.00 0.00 H new ATOM 1612 N THR A 107 36.363 10.068 45.480 1.00 0.00 N ATOM 1613 CA THR A 107 36.719 9.316 44.236 1.00 0.00 C ATOM 1614 C THR A 107 36.215 10.112 43.018 1.00 0.00 C ATOM 1615 O THR A 107 35.133 10.686 43.046 1.00 0.00 O ATOM 1616 CB THR A 107 36.041 7.946 44.264 1.00 0.00 C ATOM 1617 OG1 THR A 107 36.566 7.175 45.340 1.00 0.00 O ATOM 1618 CG2 THR A 107 36.298 7.223 42.944 1.00 0.00 C ATOM 0 H THR A 107 35.379 10.326 45.556 1.00 0.00 H new ATOM 0 HA THR A 107 37.799 9.184 44.173 1.00 0.00 H new ATOM 0 HB THR A 107 34.968 8.076 44.403 1.00 0.00 H new ATOM 0 HG1 THR A 107 36.129 6.298 45.358 1.00 0.00 H new ATOM 0 HG21 THR A 107 35.815 6.246 42.964 1.00 0.00 H new ATOM 0 HG22 THR A 107 35.892 7.812 42.122 1.00 0.00 H new ATOM 0 HG23 THR A 107 37.371 7.094 42.803 1.00 0.00 H new ATOM 1626 N LYS A 108 36.981 10.171 41.951 1.00 0.00 N ATOM 1627 CA LYS A 108 36.524 10.938 40.757 1.00 0.00 C ATOM 1628 C LYS A 108 35.654 10.054 39.856 1.00 0.00 C ATOM 1629 O LYS A 108 35.933 8.889 39.653 1.00 0.00 O ATOM 1630 CB LYS A 108 37.754 11.438 39.986 1.00 0.00 C ATOM 1631 CG LYS A 108 37.315 12.123 38.688 1.00 0.00 C ATOM 1632 CD LYS A 108 38.558 12.499 37.866 1.00 0.00 C ATOM 1633 CE LYS A 108 38.243 12.424 36.368 1.00 0.00 C ATOM 1634 NZ LYS A 108 37.849 13.780 35.885 1.00 0.00 N ATOM 0 H LYS A 108 37.893 9.724 41.860 1.00 0.00 H new ATOM 0 HA LYS A 108 35.923 11.789 41.078 1.00 0.00 H new ATOM 0 HB2 LYS A 108 38.321 12.136 40.602 1.00 0.00 H new ATOM 0 HB3 LYS A 108 38.416 10.602 39.760 1.00 0.00 H new ATOM 0 HG2 LYS A 108 36.672 11.458 38.112 1.00 0.00 H new ATOM 0 HG3 LYS A 108 36.731 13.015 38.914 1.00 0.00 H new ATOM 0 HD2 LYS A 108 38.885 13.506 38.127 1.00 0.00 H new ATOM 0 HD3 LYS A 108 39.380 11.825 38.107 1.00 0.00 H new ATOM 0 HE2 LYS A 108 39.114 12.067 35.818 1.00 0.00 H new ATOM 0 HE3 LYS A 108 37.438 11.712 36.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 37.221 13.686 35.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 37.351 14.288 36.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 38.700 14.312 35.613 1.00 0.00 H new ATOM 1648 N ILE A 109 34.601 10.611 39.307 1.00 0.00 N ATOM 1649 CA ILE A 109 33.709 9.813 38.412 1.00 0.00 C ATOM 1650 C ILE A 109 33.788 10.350 36.973 1.00 0.00 C ATOM 1651 O ILE A 109 33.688 9.599 36.020 1.00 0.00 O ATOM 1652 CB ILE A 109 32.257 9.863 38.934 1.00 0.00 C ATOM 1653 CG1 ILE A 109 31.857 11.295 39.314 1.00 0.00 C ATOM 1654 CG2 ILE A 109 32.138 8.984 40.184 1.00 0.00 C ATOM 1655 CD1 ILE A 109 30.355 11.339 39.625 1.00 0.00 C ATOM 0 H ILE A 109 34.322 11.583 39.441 1.00 0.00 H new ATOM 0 HA ILE A 109 34.041 8.775 38.410 1.00 0.00 H new ATOM 0 HB ILE A 109 31.599 9.505 38.142 1.00 0.00 H new ATOM 0 HG12 ILE A 109 32.429 11.626 40.181 1.00 0.00 H new ATOM 0 HG13 ILE A 109 32.091 11.978 38.498 1.00 0.00 H new ATOM 0 HG21 ILE A 109 31.114 9.017 40.556 1.00 0.00 H new ATOM 0 HG22 ILE A 109 32.400 7.956 39.932 1.00 0.00 H new ATOM 0 HG23 ILE A 109 32.815 9.353 40.954 1.00 0.00 H new ATOM 0 HD11 ILE A 109 30.069 12.356 39.895 1.00 0.00 H new ATOM 0 HD12 ILE A 109 29.792 11.025 38.746 1.00 0.00 H new ATOM 0 HD13 ILE A 109 30.136 10.668 40.455 1.00 0.00 H new ATOM 1667 N ARG A 110 34.004 11.627 36.805 1.00 0.00 N ATOM 1668 CA ARG A 110 34.113 12.188 35.434 1.00 0.00 C ATOM 1669 C ARG A 110 35.130 13.343 35.454 1.00 0.00 C ATOM 1670 O ARG A 110 35.950 13.411 34.550 1.00 0.00 O ATOM 1671 CB ARG A 110 32.742 12.700 34.955 1.00 0.00 C ATOM 1672 CG ARG A 110 31.720 11.549 34.889 1.00 0.00 C ATOM 1673 CD ARG A 110 30.550 11.979 34.000 1.00 0.00 C ATOM 1674 NE ARG A 110 29.371 11.085 34.236 1.00 0.00 N ATOM 1675 CZ ARG A 110 28.189 11.437 33.807 1.00 0.00 C ATOM 1676 NH1 ARG A 110 28.026 12.558 33.172 1.00 0.00 N ATOM 1677 NH2 ARG A 110 27.166 10.671 33.999 1.00 0.00 N ATOM 1678 OXT ARG A 110 35.093 14.134 36.389 1.00 0.00 O ATOM 0 H ARG A 110 34.109 12.304 37.561 1.00 0.00 H new ATOM 0 HA ARG A 110 34.447 11.411 34.746 1.00 0.00 H new ATOM 0 HB2 ARG A 110 32.381 13.474 35.632 1.00 0.00 H new ATOM 0 HB3 ARG A 110 32.844 13.159 33.972 1.00 0.00 H new ATOM 0 HG2 ARG A 110 32.189 10.651 34.488 1.00 0.00 H new ATOM 0 HG3 ARG A 110 31.364 11.303 35.889 1.00 0.00 H new ATOM 0 HD2 ARG A 110 30.281 13.013 34.214 1.00 0.00 H new ATOM 0 HD3 ARG A 110 30.845 11.937 32.951 1.00 0.00 H new ATOM 0 HE ARG A 110 29.492 10.202 34.732 1.00 0.00 H new ATOM 0 HH11 ARG A 110 28.824 13.170 33.005 1.00 0.00 H new ATOM 0 HH12 ARG A 110 27.100 12.826 32.840 1.00 0.00 H new ATOM 0 HH21 ARG A 110 27.278 9.784 34.489 1.00 0.00 H new ATOM 0 HH22 ARG A 110 26.246 10.954 33.660 1.00 0.00 H new TER 1692 ARG A 110