USER MOD reduce.3.24.130724 H: found=0, std=0, add=1189, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 966 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 60 ASN : amide:sc= -1.59 K(o=-1.6,f=-3.6!) USER MOD Set 1.2: A 62 THR OG1 : rot -38:sc= 0.0195 USER MOD Set 2.1: A 36 MET CE :methyl 150:sc= -0.859 (180deg=-1.65) USER MOD Set 2.2: A 51 MET CE :methyl 159:sc= -0.032 (180deg=-0.542) USER MOD Set 3.1: A 28 THR OG1 : rot 180:sc= -0.262 USER MOD Set 3.2: A 29 THR OG1 : rot 180:sc= 0.00179 USER MOD Single : A 8 GLN : amide:sc= -0.31 K(o=-0.31,f=-2.5!) USER MOD Single : A 13 LYS NZ :NH3+ -157:sc= -0.0667 (180deg=-0.337) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 164:sc= 0.307 (180deg=0.0607) USER MOD Single : A 26 THR OG1 : rot 63:sc= 0.917 USER MOD Single : A 30 LYS NZ :NH3+ 157:sc= -0.0909 (180deg=-0.446) USER MOD Single : A 34 THR OG1 : rot 81:sc= 0.637 USER MOD Single : A 38 SER OG : rot 83:sc= 0.183 USER MOD Single : A 41 GLN : amide:sc= -0.0138 X(o=-0.014,f=-0.29) USER MOD Single : A 42 ASN : amide:sc= -0.517 K(o=-0.52,f=-1.3) USER MOD Single : A 44 THR OG1 : rot 25:sc= 0.0715 USER MOD Single : A 49 GLN : amide:sc= -0.0343 K(o=-0.034,f=-1.6!) USER MOD Single : A 53 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 70 THR OG1 : rot -70:sc= 1.02 USER MOD Single : A 71 MET CE :methyl -127:sc= -1.14 (180deg=-2.76) USER MOD Single : A 72 MET CE :methyl -149:sc= -0.259 (180deg=-1.52!) USER MOD Single : A 75 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0535) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0.0714 USER MOD Single : A 94 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0427) USER MOD Single : A 97 ASN :FLIP amide:sc= 0.969 F(o=-1.2,f=0.97) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -1.21 X(o=-1.2,f=-0.79) USER MOD Single : A 109 MET CE :methyl 145:sc= -0.554 (180deg=-1.74) USER MOD Single : A 110 THR OG1 : rot 94:sc= 1.31 USER MOD Single : A 111 ASN : amide:sc= -0.794 X(o=-0.79,f=-0.83) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00182 USER MOD Single : A 124 MET CE :methyl -143:sc= -5.14! (180deg=-7.17!) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 137 ASN : amide:sc= -2.42 K(o=-2.4,f=-3.8) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0376 K(o=-0.038,f=-1.5) USER MOD Single : A 144 MET CE :methyl -154:sc= -3.21 (180deg=-5.56!) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot -16:sc= 0.321 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 158 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0155) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 GLN : amide:sc= -0.297 K(o=-0.3,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 8 0.034 -4.494 16.344 1.00 0.00 N ATOM 2 CA GLN A 8 1.024 -5.003 15.401 1.00 0.00 C ATOM 3 C GLN A 8 0.382 -5.955 14.398 1.00 0.00 C ATOM 4 O GLN A 8 0.876 -6.122 13.282 1.00 0.00 O ATOM 5 CB GLN A 8 2.152 -5.716 16.149 1.00 0.00 C ATOM 6 CG GLN A 8 1.662 -6.774 17.126 1.00 0.00 C ATOM 7 CD GLN A 8 1.459 -6.226 18.525 1.00 0.00 C ATOM 8 OE1 GLN A 8 1.962 -5.156 18.864 1.00 0.00 O ATOM 9 NE2 GLN A 8 0.718 -6.961 19.345 1.00 0.00 N ATOM 0 HA GLN A 8 1.438 -4.155 14.855 1.00 0.00 H new ATOM 0 HB2 GLN A 8 2.818 -6.184 15.424 1.00 0.00 H new ATOM 0 HB3 GLN A 8 2.740 -4.977 16.692 1.00 0.00 H new ATOM 0 HG2 GLN A 8 0.723 -7.191 16.763 1.00 0.00 H new ATOM 0 HG3 GLN A 8 2.381 -7.592 17.161 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.320 -7.843 19.021 1.00 0.00 H new ATOM 0 HE22 GLN A 8 0.546 -6.644 20.299 1.00 0.00 H new ATOM 16 N ILE A 9 -0.720 -6.579 14.804 1.00 0.00 N ATOM 17 CA ILE A 9 -1.430 -7.514 13.940 1.00 0.00 C ATOM 18 C ILE A 9 -2.487 -6.798 13.106 1.00 0.00 C ATOM 19 O ILE A 9 -2.912 -7.297 12.065 1.00 0.00 O ATOM 20 CB ILE A 9 -2.105 -8.632 14.755 1.00 0.00 C ATOM 21 CG1 ILE A 9 -1.066 -9.383 15.591 1.00 0.00 C ATOM 22 CG2 ILE A 9 -2.843 -9.589 13.831 1.00 0.00 C ATOM 23 CD1 ILE A 9 -1.672 -10.231 16.687 1.00 0.00 C ATOM 0 H ILE A 9 -1.140 -6.454 15.725 1.00 0.00 H new ATOM 0 HA ILE A 9 -0.687 -7.957 13.277 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.830 -8.181 15.432 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.475 -10.021 14.934 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -0.381 -8.662 16.037 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -3.315 -10.374 14.422 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -3.607 -9.043 13.277 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -2.137 -10.036 13.131 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -0.878 -10.734 17.239 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.240 -9.596 17.367 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.336 -10.975 16.246 1.00 0.00 H new ATOM 34 N ALA A 10 -2.904 -5.625 13.570 1.00 0.00 N ATOM 35 CA ALA A 10 -3.909 -4.839 12.865 1.00 0.00 C ATOM 36 C ALA A 10 -3.440 -4.484 11.458 1.00 0.00 C ATOM 37 O ALA A 10 -4.185 -4.636 10.490 1.00 0.00 O ATOM 38 CB ALA A 10 -4.235 -3.576 13.648 1.00 0.00 C ATOM 0 H ALA A 10 -2.562 -5.198 14.431 1.00 0.00 H new ATOM 0 HA ALA A 10 -4.812 -5.443 12.778 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -4.987 -2.998 13.110 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -4.620 -3.847 14.631 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -3.332 -2.977 13.764 1.00 0.00 H new ATOM 44 N GLU A 11 -2.203 -4.011 11.352 1.00 0.00 N ATOM 45 CA GLU A 11 -1.637 -3.634 10.062 1.00 0.00 C ATOM 46 C GLU A 11 -1.787 -4.766 9.050 1.00 0.00 C ATOM 47 O GLU A 11 -2.153 -4.540 7.897 1.00 0.00 O ATOM 48 CB GLU A 11 -0.159 -3.266 10.217 1.00 0.00 C ATOM 49 CG GLU A 11 0.642 -4.285 11.008 1.00 0.00 C ATOM 50 CD GLU A 11 1.462 -3.651 12.115 1.00 0.00 C ATOM 51 OE1 GLU A 11 0.872 -2.936 12.954 1.00 0.00 O ATOM 52 OE2 GLU A 11 2.692 -3.866 12.143 1.00 0.00 O ATOM 0 H GLU A 11 -1.573 -3.880 12.144 1.00 0.00 H new ATOM 0 HA GLU A 11 -2.184 -2.766 9.694 1.00 0.00 H new ATOM 0 HB2 GLU A 11 0.285 -3.156 9.228 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.084 -2.296 10.709 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -0.038 -5.020 11.440 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.306 -4.824 10.332 1.00 0.00 H new ATOM 57 N PHE A 12 -1.501 -5.988 9.490 1.00 0.00 N ATOM 58 CA PHE A 12 -1.602 -7.156 8.624 1.00 0.00 C ATOM 59 C PHE A 12 -3.057 -7.441 8.263 1.00 0.00 C ATOM 60 O PHE A 12 -3.394 -7.634 7.095 1.00 0.00 O ATOM 61 CB PHE A 12 -0.986 -8.379 9.307 1.00 0.00 C ATOM 62 CG PHE A 12 0.346 -8.102 9.944 1.00 0.00 C ATOM 63 CD1 PHE A 12 1.283 -7.306 9.305 1.00 0.00 C ATOM 64 CD2 PHE A 12 0.659 -8.635 11.184 1.00 0.00 C ATOM 65 CE1 PHE A 12 2.509 -7.050 9.890 1.00 0.00 C ATOM 66 CE2 PHE A 12 1.883 -8.382 11.774 1.00 0.00 C ATOM 67 CZ PHE A 12 2.808 -7.587 11.126 1.00 0.00 C ATOM 0 H PHE A 12 -1.197 -6.194 10.442 1.00 0.00 H new ATOM 0 HA PHE A 12 -1.052 -6.945 7.707 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -1.675 -8.745 10.068 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -0.870 -9.176 8.572 1.00 0.00 H new ATOM 0 HD1 PHE A 12 1.053 -6.881 8.339 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -0.062 -9.255 11.696 1.00 0.00 H new ATOM 0 HE1 PHE A 12 3.232 -6.430 9.381 1.00 0.00 H new ATOM 0 HE2 PHE A 12 2.116 -8.805 12.740 1.00 0.00 H new ATOM 0 HZ PHE A 12 3.764 -7.386 11.586 1.00 0.00 H new ATOM 76 N LYS A 13 -3.918 -7.466 9.276 1.00 0.00 N ATOM 77 CA LYS A 13 -5.337 -7.727 9.068 1.00 0.00 C ATOM 78 C LYS A 13 -5.905 -6.814 7.987 1.00 0.00 C ATOM 79 O LYS A 13 -6.680 -7.252 7.137 1.00 0.00 O ATOM 80 CB LYS A 13 -6.109 -7.529 10.375 1.00 0.00 C ATOM 81 CG LYS A 13 -7.444 -8.253 10.408 1.00 0.00 C ATOM 82 CD LYS A 13 -7.264 -9.741 10.662 1.00 0.00 C ATOM 83 CE LYS A 13 -8.471 -10.334 11.373 1.00 0.00 C ATOM 84 NZ LYS A 13 -8.586 -9.843 12.775 1.00 0.00 N ATOM 0 H LYS A 13 -3.657 -7.308 10.249 1.00 0.00 H new ATOM 0 HA LYS A 13 -5.447 -8.761 8.740 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -5.496 -7.877 11.206 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.279 -6.463 10.529 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -8.073 -7.823 11.187 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -7.963 -8.105 9.461 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -7.109 -10.257 9.715 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -6.370 -9.903 11.264 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -9.377 -10.079 10.824 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -8.394 -11.421 11.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -9.141 -10.520 13.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -7.636 -9.748 13.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -9.061 -8.918 12.781 1.00 0.00 H new ATOM 94 N GLU A 14 -5.512 -5.544 8.024 1.00 0.00 N ATOM 95 CA GLU A 14 -5.984 -4.571 7.045 1.00 0.00 C ATOM 96 C GLU A 14 -5.295 -4.776 5.699 1.00 0.00 C ATOM 97 O GLU A 14 -5.923 -4.667 4.646 1.00 0.00 O ATOM 98 CB GLU A 14 -5.732 -3.148 7.546 1.00 0.00 C ATOM 99 CG GLU A 14 -6.494 -2.806 8.816 1.00 0.00 C ATOM 100 CD GLU A 14 -6.092 -1.464 9.395 1.00 0.00 C ATOM 101 OE1 GLU A 14 -5.184 -0.821 8.828 1.00 0.00 O ATOM 102 OE2 GLU A 14 -6.686 -1.056 10.415 1.00 0.00 O ATOM 0 H GLU A 14 -4.869 -5.166 8.720 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.056 -4.718 6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -4.665 -3.019 7.727 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -6.010 -2.442 6.764 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -7.563 -2.800 8.603 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.321 -3.584 9.559 1.00 0.00 H new ATOM 107 N ALA A 15 -4.001 -5.075 5.742 1.00 0.00 N ATOM 108 CA ALA A 15 -3.227 -5.297 4.527 1.00 0.00 C ATOM 109 C ALA A 15 -3.836 -6.412 3.684 1.00 0.00 C ATOM 110 O ALA A 15 -3.836 -6.346 2.455 1.00 0.00 O ATOM 111 CB ALA A 15 -1.782 -5.623 4.874 1.00 0.00 C ATOM 0 H ALA A 15 -3.466 -5.169 6.606 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.249 -4.380 3.939 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.216 -5.786 3.957 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.344 -4.792 5.428 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -1.749 -6.524 5.486 1.00 0.00 H new ATOM 117 N PHE A 16 -4.354 -7.437 4.353 1.00 0.00 N ATOM 118 CA PHE A 16 -4.966 -8.568 3.665 1.00 0.00 C ATOM 119 C PHE A 16 -6.448 -8.314 3.411 1.00 0.00 C ATOM 120 O PHE A 16 -6.961 -8.598 2.329 1.00 0.00 O ATOM 121 CB PHE A 16 -4.789 -9.847 4.486 1.00 0.00 C ATOM 122 CG PHE A 16 -5.807 -10.906 4.173 1.00 0.00 C ATOM 123 CD1 PHE A 16 -5.576 -11.832 3.169 1.00 0.00 C ATOM 124 CD2 PHE A 16 -6.995 -10.975 4.882 1.00 0.00 C ATOM 125 CE1 PHE A 16 -6.510 -12.808 2.877 1.00 0.00 C ATOM 126 CE2 PHE A 16 -7.934 -11.949 4.595 1.00 0.00 C ATOM 127 CZ PHE A 16 -7.692 -12.865 3.591 1.00 0.00 C ATOM 0 H PHE A 16 -4.362 -7.508 5.371 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.467 -8.689 2.703 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -3.792 -10.249 4.307 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.848 -9.600 5.546 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.654 -11.791 2.607 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -7.190 -10.260 5.668 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.317 -13.525 2.093 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -8.856 -11.993 5.156 1.00 0.00 H new ATOM 0 HZ PHE A 16 -8.425 -13.625 3.364 1.00 0.00 H new ATOM 136 N SER A 17 -7.131 -7.777 4.417 1.00 0.00 N ATOM 137 CA SER A 17 -8.557 -7.488 4.306 1.00 0.00 C ATOM 138 C SER A 17 -8.850 -6.681 3.045 1.00 0.00 C ATOM 139 O SER A 17 -9.761 -7.007 2.283 1.00 0.00 O ATOM 140 CB SER A 17 -9.041 -6.724 5.538 1.00 0.00 C ATOM 141 OG SER A 17 -10.315 -6.145 5.312 1.00 0.00 O ATOM 0 H SER A 17 -6.720 -7.533 5.318 1.00 0.00 H new ATOM 0 HA SER A 17 -9.091 -8.436 4.243 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.092 -7.400 6.392 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.323 -5.944 5.791 1.00 0.00 H new ATOM 0 HG SER A 17 -10.603 -5.663 6.116 1.00 0.00 H new ATOM 146 N LEU A 18 -8.071 -5.625 2.832 1.00 0.00 N ATOM 147 CA LEU A 18 -8.246 -4.769 1.664 1.00 0.00 C ATOM 148 C LEU A 18 -7.818 -5.492 0.390 1.00 0.00 C ATOM 149 O LEU A 18 -8.261 -5.152 -0.708 1.00 0.00 O ATOM 150 CB LEU A 18 -7.440 -3.480 1.827 1.00 0.00 C ATOM 151 CG LEU A 18 -5.920 -3.639 1.876 1.00 0.00 C ATOM 152 CD1 LEU A 18 -5.336 -3.626 0.472 1.00 0.00 C ATOM 153 CD2 LEU A 18 -5.295 -2.542 2.726 1.00 0.00 C ATOM 0 H LEU A 18 -7.313 -5.342 3.453 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.304 -4.521 1.581 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -7.689 -2.813 1.002 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -7.763 -2.987 2.744 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.690 -4.601 2.334 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.253 -3.740 0.527 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.759 -4.448 -0.106 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.577 -2.680 -0.013 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.213 -2.672 2.749 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.535 -1.569 2.298 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -5.689 -2.599 3.741 1.00 0.00 H new ATOM 164 N PHE A 19 -6.956 -6.490 0.545 1.00 0.00 N ATOM 165 CA PHE A 19 -6.469 -7.263 -0.593 1.00 0.00 C ATOM 166 C PHE A 19 -7.602 -8.056 -1.237 1.00 0.00 C ATOM 167 O PHE A 19 -7.934 -7.848 -2.404 1.00 0.00 O ATOM 168 CB PHE A 19 -5.353 -8.212 -0.152 1.00 0.00 C ATOM 169 CG PHE A 19 -4.227 -8.314 -1.141 1.00 0.00 C ATOM 170 CD1 PHE A 19 -4.443 -8.836 -2.406 1.00 0.00 C ATOM 171 CD2 PHE A 19 -2.952 -7.889 -0.805 1.00 0.00 C ATOM 172 CE1 PHE A 19 -3.410 -8.931 -3.318 1.00 0.00 C ATOM 173 CE2 PHE A 19 -1.915 -7.982 -1.713 1.00 0.00 C ATOM 174 CZ PHE A 19 -2.143 -8.505 -2.972 1.00 0.00 C ATOM 0 H PHE A 19 -6.580 -6.783 1.446 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.073 -6.566 -1.331 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.956 -7.873 0.805 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -5.774 -9.204 0.011 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -5.431 -9.173 -2.682 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.767 -7.481 0.177 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -3.593 -9.338 -4.301 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -0.926 -7.646 -1.439 1.00 0.00 H new ATOM 0 HZ PHE A 19 -1.333 -8.580 -3.682 1.00 0.00 H new ATOM 183 N ASP A 20 -8.190 -8.967 -0.468 1.00 0.00 N ATOM 184 CA ASP A 20 -9.286 -9.792 -0.962 1.00 0.00 C ATOM 185 C ASP A 20 -10.615 -9.049 -0.858 1.00 0.00 C ATOM 186 O ASP A 20 -11.112 -8.796 0.239 1.00 0.00 O ATOM 187 CB ASP A 20 -9.358 -11.104 -0.179 1.00 0.00 C ATOM 188 CG ASP A 20 -10.297 -12.108 -0.818 1.00 0.00 C ATOM 189 OD1 ASP A 20 -10.389 -12.127 -2.063 1.00 0.00 O ATOM 190 OD2 ASP A 20 -10.940 -12.876 -0.071 1.00 0.00 O ATOM 0 H ASP A 20 -7.926 -9.152 0.500 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.096 -10.015 -2.012 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.360 -11.537 -0.109 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.688 -10.899 0.839 1.00 0.00 H new ATOM 194 N LYS A 21 -11.185 -8.702 -2.007 1.00 0.00 N ATOM 195 CA LYS A 21 -12.455 -7.989 -2.047 1.00 0.00 C ATOM 196 C LYS A 21 -13.626 -8.966 -2.060 1.00 0.00 C ATOM 197 O LYS A 21 -14.723 -8.641 -1.604 1.00 0.00 O ATOM 198 CB LYS A 21 -12.518 -7.085 -3.280 1.00 0.00 C ATOM 199 CG LYS A 21 -12.600 -7.848 -4.591 1.00 0.00 C ATOM 200 CD LYS A 21 -12.195 -6.977 -5.769 1.00 0.00 C ATOM 201 CE LYS A 21 -12.173 -7.771 -7.066 1.00 0.00 C ATOM 202 NZ LYS A 21 -13.498 -8.378 -7.367 1.00 0.00 N ATOM 0 H LYS A 21 -10.786 -8.904 -2.924 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.526 -7.374 -1.150 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -13.385 -6.430 -3.196 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.636 -6.445 -3.296 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.952 -8.723 -4.545 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.617 -8.211 -4.739 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -12.891 -6.143 -5.863 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.209 -6.550 -5.585 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.878 -7.117 -7.887 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.421 -8.557 -6.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.526 -8.673 -8.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -13.647 -9.206 -6.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.248 -7.679 -7.192 1.00 0.00 H new ATOM 212 N ASP A 22 -13.388 -10.162 -2.584 1.00 0.00 N ATOM 213 CA ASP A 22 -14.423 -11.187 -2.655 1.00 0.00 C ATOM 214 C ASP A 22 -14.712 -11.763 -1.272 1.00 0.00 C ATOM 215 O ASP A 22 -15.767 -12.351 -1.041 1.00 0.00 O ATOM 216 CB ASP A 22 -14.000 -12.306 -3.608 1.00 0.00 C ATOM 217 CG ASP A 22 -13.190 -11.790 -4.782 1.00 0.00 C ATOM 218 OD1 ASP A 22 -13.636 -10.821 -5.431 1.00 0.00 O ATOM 219 OD2 ASP A 22 -12.110 -12.356 -5.051 1.00 0.00 O ATOM 0 H ASP A 22 -12.486 -10.447 -2.967 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.333 -10.723 -3.034 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -13.412 -13.043 -3.061 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -14.888 -12.818 -3.980 1.00 0.00 H new ATOM 223 N GLY A 23 -13.765 -11.590 -0.354 1.00 0.00 N ATOM 224 CA GLY A 23 -13.936 -12.099 0.993 1.00 0.00 C ATOM 225 C GLY A 23 -14.132 -13.602 1.026 1.00 0.00 C ATOM 226 O GLY A 23 -15.034 -14.103 1.697 1.00 0.00 O ATOM 0 H GLY A 23 -12.883 -11.106 -0.520 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.063 -11.837 1.590 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.796 -11.614 1.455 1.00 0.00 H new ATOM 229 N ASP A 24 -13.286 -14.322 0.297 1.00 0.00 N ATOM 230 CA ASP A 24 -13.371 -15.777 0.243 1.00 0.00 C ATOM 231 C ASP A 24 -12.343 -16.416 1.171 1.00 0.00 C ATOM 232 O ASP A 24 -12.473 -17.578 1.553 1.00 0.00 O ATOM 233 CB ASP A 24 -13.160 -16.270 -1.189 1.00 0.00 C ATOM 234 CG ASP A 24 -12.017 -15.557 -1.883 1.00 0.00 C ATOM 235 OD1 ASP A 24 -10.990 -15.296 -1.221 1.00 0.00 O ATOM 236 OD2 ASP A 24 -12.149 -15.257 -3.089 1.00 0.00 O ATOM 0 H ASP A 24 -12.534 -13.922 -0.264 1.00 0.00 H new ATOM 0 HA ASP A 24 -14.367 -16.070 0.576 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.962 -17.342 -1.176 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.077 -16.123 -1.760 1.00 0.00 H new ATOM 240 N GLY A 25 -11.318 -15.648 1.529 1.00 0.00 N ATOM 241 CA GLY A 25 -10.281 -16.157 2.408 1.00 0.00 C ATOM 242 C GLY A 25 -9.048 -16.609 1.649 1.00 0.00 C ATOM 243 O GLY A 25 -8.344 -17.522 2.081 1.00 0.00 O ATOM 0 H GLY A 25 -11.187 -14.683 1.226 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.001 -15.382 3.121 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.676 -16.993 2.985 1.00 0.00 H new ATOM 246 N THR A 26 -8.786 -15.968 0.514 1.00 0.00 N ATOM 247 CA THR A 26 -7.633 -16.312 -0.308 1.00 0.00 C ATOM 248 C THR A 26 -7.374 -15.244 -1.366 1.00 0.00 C ATOM 249 O THR A 26 -8.239 -14.415 -1.649 1.00 0.00 O ATOM 250 CB THR A 26 -7.822 -17.672 -1.004 1.00 0.00 C ATOM 251 OG1 THR A 26 -6.690 -17.962 -1.831 1.00 0.00 O ATOM 252 CG2 THR A 26 -9.088 -17.677 -1.848 1.00 0.00 C ATOM 0 H THR A 26 -9.357 -15.208 0.144 1.00 0.00 H new ATOM 0 HA THR A 26 -6.775 -16.373 0.362 1.00 0.00 H new ATOM 0 HB THR A 26 -7.914 -18.438 -0.235 1.00 0.00 H new ATOM 0 HG1 THR A 26 -5.888 -18.037 -1.273 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.200 -18.648 -2.330 1.00 0.00 H new ATOM 0 HG22 THR A 26 -9.951 -17.486 -1.210 1.00 0.00 H new ATOM 0 HG23 THR A 26 -9.021 -16.900 -2.609 1.00 0.00 H new ATOM 259 N ILE A 27 -6.180 -15.271 -1.947 1.00 0.00 N ATOM 260 CA ILE A 27 -5.809 -14.307 -2.975 1.00 0.00 C ATOM 261 C ILE A 27 -5.181 -15.001 -4.179 1.00 0.00 C ATOM 262 O ILE A 27 -4.176 -15.702 -4.052 1.00 0.00 O ATOM 263 CB ILE A 27 -4.825 -13.254 -2.432 1.00 0.00 C ATOM 264 CG1 ILE A 27 -5.471 -12.459 -1.294 1.00 0.00 C ATOM 265 CG2 ILE A 27 -4.375 -12.322 -3.547 1.00 0.00 C ATOM 266 CD1 ILE A 27 -4.511 -12.113 -0.178 1.00 0.00 C ATOM 0 H ILE A 27 -5.453 -15.950 -1.723 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.727 -13.808 -3.285 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.948 -13.768 -2.039 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -5.892 -11.539 -1.698 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.300 -13.036 -0.884 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -3.680 -11.584 -3.146 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -3.880 -12.900 -4.327 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -5.242 -11.813 -3.968 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -5.037 -11.550 0.593 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -4.108 -13.030 0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -3.695 -11.509 -0.574 1.00 0.00 H new ATOM 277 N THR A 28 -5.777 -14.798 -5.349 1.00 0.00 N ATOM 278 CA THR A 28 -5.277 -15.404 -6.577 1.00 0.00 C ATOM 279 C THR A 28 -4.433 -14.414 -7.374 1.00 0.00 C ATOM 280 O THR A 28 -4.425 -13.216 -7.086 1.00 0.00 O ATOM 281 CB THR A 28 -6.429 -15.909 -7.465 1.00 0.00 C ATOM 282 OG1 THR A 28 -5.903 -16.574 -8.619 1.00 0.00 O ATOM 283 CG2 THR A 28 -7.322 -14.757 -7.900 1.00 0.00 C ATOM 0 H THR A 28 -6.607 -14.218 -5.473 1.00 0.00 H new ATOM 0 HA THR A 28 -4.658 -16.251 -6.282 1.00 0.00 H new ATOM 0 HB THR A 28 -7.026 -16.611 -6.883 1.00 0.00 H new ATOM 0 HG1 THR A 28 -6.642 -16.894 -9.178 1.00 0.00 H new ATOM 0 HG21 THR A 28 -8.129 -15.138 -8.526 1.00 0.00 H new ATOM 0 HG22 THR A 28 -7.744 -14.272 -7.020 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.734 -14.034 -8.466 1.00 0.00 H new ATOM 290 N THR A 29 -3.725 -14.921 -8.377 1.00 0.00 N ATOM 291 CA THR A 29 -2.878 -14.082 -9.216 1.00 0.00 C ATOM 292 C THR A 29 -3.646 -12.874 -9.739 1.00 0.00 C ATOM 293 O THR A 29 -3.077 -11.800 -9.935 1.00 0.00 O ATOM 294 CB THR A 29 -2.311 -14.871 -10.410 1.00 0.00 C ATOM 295 OG1 THR A 29 -3.307 -15.760 -10.928 1.00 0.00 O ATOM 296 CG2 THR A 29 -1.081 -15.666 -9.999 1.00 0.00 C ATOM 0 H THR A 29 -3.721 -15.909 -8.629 1.00 0.00 H new ATOM 0 HA THR A 29 -2.053 -13.742 -8.590 1.00 0.00 H new ATOM 0 HB THR A 29 -2.023 -14.158 -11.183 1.00 0.00 H new ATOM 0 HG1 THR A 29 -2.939 -16.257 -11.688 1.00 0.00 H new ATOM 0 HG21 THR A 29 -0.698 -16.215 -10.859 1.00 0.00 H new ATOM 0 HG22 THR A 29 -0.313 -14.985 -9.633 1.00 0.00 H new ATOM 0 HG23 THR A 29 -1.349 -16.369 -9.210 1.00 0.00 H new ATOM 303 N LYS A 30 -4.943 -13.055 -9.963 1.00 0.00 N ATOM 304 CA LYS A 30 -5.791 -11.980 -10.462 1.00 0.00 C ATOM 305 C LYS A 30 -5.812 -10.806 -9.487 1.00 0.00 C ATOM 306 O LYS A 30 -5.676 -9.651 -9.891 1.00 0.00 O ATOM 307 CB LYS A 30 -7.216 -12.490 -10.692 1.00 0.00 C ATOM 308 CG LYS A 30 -8.080 -11.539 -11.499 1.00 0.00 C ATOM 309 CD LYS A 30 -9.560 -11.799 -11.271 1.00 0.00 C ATOM 310 CE LYS A 30 -10.070 -11.074 -10.035 1.00 0.00 C ATOM 311 NZ LYS A 30 -10.054 -9.596 -10.213 1.00 0.00 N ATOM 0 H LYS A 30 -5.430 -13.937 -9.806 1.00 0.00 H new ATOM 0 HA LYS A 30 -5.377 -11.636 -11.410 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -7.171 -13.450 -11.205 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.690 -12.667 -9.726 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -7.844 -10.511 -11.225 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.850 -11.648 -12.559 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.126 -11.474 -12.144 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -9.730 -12.870 -11.162 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.086 -11.402 -9.815 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -9.455 -11.343 -9.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -10.737 -9.160 -9.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -9.101 -9.232 -10.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -10.313 -9.361 -11.193 1.00 0.00 H new ATOM 321 N GLU A 31 -5.980 -11.111 -8.204 1.00 0.00 N ATOM 322 CA GLU A 31 -6.018 -10.080 -7.174 1.00 0.00 C ATOM 323 C GLU A 31 -4.688 -9.335 -7.101 1.00 0.00 C ATOM 324 O GLU A 31 -4.608 -8.151 -7.430 1.00 0.00 O ATOM 325 CB GLU A 31 -6.342 -10.700 -5.813 1.00 0.00 C ATOM 326 CG GLU A 31 -7.474 -9.999 -5.079 1.00 0.00 C ATOM 327 CD GLU A 31 -8.366 -10.965 -4.324 1.00 0.00 C ATOM 328 OE1 GLU A 31 -7.843 -11.710 -3.469 1.00 0.00 O ATOM 329 OE2 GLU A 31 -9.586 -10.978 -4.590 1.00 0.00 O ATOM 0 H GLU A 31 -6.092 -12.062 -7.854 1.00 0.00 H new ATOM 0 HA GLU A 31 -6.800 -9.368 -7.437 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -6.606 -11.748 -5.954 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -5.448 -10.677 -5.191 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -7.055 -9.275 -4.380 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -8.075 -9.440 -5.796 1.00 0.00 H new ATOM 334 N LEU A 32 -3.646 -10.037 -6.670 1.00 0.00 N ATOM 335 CA LEU A 32 -2.319 -9.443 -6.553 1.00 0.00 C ATOM 336 C LEU A 32 -1.926 -8.731 -7.844 1.00 0.00 C ATOM 337 O LEU A 32 -1.395 -7.622 -7.816 1.00 0.00 O ATOM 338 CB LEU A 32 -1.285 -10.519 -6.217 1.00 0.00 C ATOM 339 CG LEU A 32 -1.382 -11.819 -7.016 1.00 0.00 C ATOM 340 CD1 LEU A 32 -0.096 -12.069 -7.786 1.00 0.00 C ATOM 341 CD2 LEU A 32 -1.693 -12.989 -6.095 1.00 0.00 C ATOM 0 H LEU A 32 -3.694 -11.018 -6.396 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.346 -8.709 -5.748 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.291 -10.098 -6.367 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.373 -10.760 -5.158 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.197 -11.723 -7.734 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.184 -12.998 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.082 -11.243 -8.475 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.737 -12.145 -7.088 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.758 -13.906 -6.681 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.901 -13.088 -5.353 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.643 -12.812 -5.590 1.00 0.00 H new ATOM 352 N GLY A 33 -2.193 -9.376 -8.975 1.00 0.00 N ATOM 353 CA GLY A 33 -1.863 -8.789 -10.260 1.00 0.00 C ATOM 354 C GLY A 33 -2.510 -7.433 -10.461 1.00 0.00 C ATOM 355 O GLY A 33 -1.820 -6.423 -10.613 1.00 0.00 O ATOM 0 H GLY A 33 -2.632 -10.295 -9.024 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.781 -8.688 -10.343 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.182 -9.462 -11.056 1.00 0.00 H new ATOM 358 N THR A 34 -3.839 -7.408 -10.466 1.00 0.00 N ATOM 359 CA THR A 34 -4.579 -6.167 -10.653 1.00 0.00 C ATOM 360 C THR A 34 -4.181 -5.127 -9.612 1.00 0.00 C ATOM 361 O THR A 34 -4.236 -3.924 -9.869 1.00 0.00 O ATOM 362 CB THR A 34 -6.099 -6.402 -10.572 1.00 0.00 C ATOM 363 OG1 THR A 34 -6.492 -7.404 -11.517 1.00 0.00 O ATOM 364 CG2 THR A 34 -6.861 -5.114 -10.844 1.00 0.00 C ATOM 0 H THR A 34 -4.425 -8.234 -10.343 1.00 0.00 H new ATOM 0 HA THR A 34 -4.328 -5.796 -11.647 1.00 0.00 H new ATOM 0 HB THR A 34 -6.338 -6.741 -9.564 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.309 -8.293 -11.147 1.00 0.00 H new ATOM 0 HG21 THR A 34 -7.932 -5.305 -10.781 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.582 -4.363 -10.105 1.00 0.00 H new ATOM 0 HG23 THR A 34 -6.615 -4.750 -11.841 1.00 0.00 H new ATOM 371 N VAL A 35 -3.779 -5.598 -8.435 1.00 0.00 N ATOM 372 CA VAL A 35 -3.370 -4.707 -7.355 1.00 0.00 C ATOM 373 C VAL A 35 -2.107 -3.938 -7.727 1.00 0.00 C ATOM 374 O VAL A 35 -2.114 -2.709 -7.792 1.00 0.00 O ATOM 375 CB VAL A 35 -3.118 -5.487 -6.051 1.00 0.00 C ATOM 376 CG1 VAL A 35 -2.412 -4.607 -5.031 1.00 0.00 C ATOM 377 CG2 VAL A 35 -4.426 -6.023 -5.490 1.00 0.00 C ATOM 0 H VAL A 35 -3.728 -6.591 -8.205 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.187 -4.003 -7.197 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.470 -6.335 -6.274 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.242 -5.175 -4.116 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.455 -4.276 -5.436 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.032 -3.738 -4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.229 -6.571 -4.569 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.100 -5.192 -5.281 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.888 -6.690 -6.218 1.00 0.00 H new ATOM 387 N MET A 36 -1.025 -4.669 -7.970 1.00 0.00 N ATOM 388 CA MET A 36 0.246 -4.054 -8.337 1.00 0.00 C ATOM 389 C MET A 36 0.098 -3.215 -9.602 1.00 0.00 C ATOM 390 O MET A 36 0.731 -2.168 -9.740 1.00 0.00 O ATOM 391 CB MET A 36 1.315 -5.129 -8.544 1.00 0.00 C ATOM 392 CG MET A 36 2.733 -4.626 -8.323 1.00 0.00 C ATOM 393 SD MET A 36 3.786 -5.851 -7.522 1.00 0.00 S ATOM 394 CE MET A 36 3.274 -7.343 -8.371 1.00 0.00 C ATOM 0 H MET A 36 -1.002 -5.687 -7.920 1.00 0.00 H new ATOM 0 HA MET A 36 0.554 -3.398 -7.522 1.00 0.00 H new ATOM 0 HB2 MET A 36 1.122 -5.958 -7.863 1.00 0.00 H new ATOM 0 HB3 MET A 36 1.231 -5.523 -9.557 1.00 0.00 H new ATOM 0 HG2 MET A 36 3.170 -4.348 -9.282 1.00 0.00 H new ATOM 0 HG3 MET A 36 2.703 -3.723 -7.713 1.00 0.00 H new ATOM 0 HE1 MET A 36 4.110 -8.041 -8.416 1.00 0.00 H new ATOM 0 HE2 MET A 36 2.446 -7.803 -7.831 1.00 0.00 H new ATOM 0 HE3 MET A 36 2.954 -7.094 -9.383 1.00 0.00 H new ATOM 402 N ARG A 37 -0.739 -3.682 -10.522 1.00 0.00 N ATOM 403 CA ARG A 37 -0.968 -2.975 -11.776 1.00 0.00 C ATOM 404 C ARG A 37 -1.804 -1.719 -11.547 1.00 0.00 C ATOM 405 O ARG A 37 -1.658 -0.725 -12.259 1.00 0.00 O ATOM 406 CB ARG A 37 -1.668 -3.889 -12.783 1.00 0.00 C ATOM 407 CG ARG A 37 -1.668 -3.346 -14.202 1.00 0.00 C ATOM 408 CD ARG A 37 -2.390 -4.284 -15.158 1.00 0.00 C ATOM 409 NE ARG A 37 -3.842 -4.169 -15.045 1.00 0.00 N ATOM 410 CZ ARG A 37 -4.530 -3.113 -15.464 1.00 0.00 C ATOM 411 NH1 ARG A 37 -3.902 -2.087 -16.021 1.00 0.00 N ATOM 412 NH2 ARG A 37 -5.850 -3.083 -15.328 1.00 0.00 N ATOM 0 H ARG A 37 -1.270 -4.547 -10.423 1.00 0.00 H new ATOM 0 HA ARG A 37 0.001 -2.679 -12.178 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.180 -4.864 -12.776 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -2.698 -4.046 -12.463 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.148 -2.368 -14.218 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -0.641 -3.202 -14.538 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -2.087 -4.062 -16.181 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -2.091 -5.312 -14.953 1.00 0.00 H new ATOM 0 HE ARG A 37 -4.355 -4.942 -14.621 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -2.888 -2.107 -16.129 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.433 -1.277 -16.342 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -6.337 -3.871 -14.901 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -6.378 -2.272 -15.650 1.00 0.00 H new ATOM 423 N SER A 38 -2.680 -1.771 -10.550 1.00 0.00 N ATOM 424 CA SER A 38 -3.544 -0.640 -10.230 1.00 0.00 C ATOM 425 C SER A 38 -2.764 0.448 -9.495 1.00 0.00 C ATOM 426 O SER A 38 -3.287 1.530 -9.227 1.00 0.00 O ATOM 427 CB SER A 38 -4.726 -1.099 -9.376 1.00 0.00 C ATOM 428 OG SER A 38 -5.811 -1.514 -10.188 1.00 0.00 O ATOM 0 H SER A 38 -2.811 -2.585 -9.949 1.00 0.00 H new ATOM 0 HA SER A 38 -3.920 -0.226 -11.166 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.415 -1.921 -8.731 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.046 -0.286 -8.724 1.00 0.00 H new ATOM 0 HG SER A 38 -5.674 -2.444 -10.466 1.00 0.00 H new ATOM 433 N LEU A 39 -1.510 0.151 -9.172 1.00 0.00 N ATOM 434 CA LEU A 39 -0.656 1.103 -8.469 1.00 0.00 C ATOM 435 C LEU A 39 0.158 1.935 -9.454 1.00 0.00 C ATOM 436 O LEU A 39 1.149 2.562 -9.081 1.00 0.00 O ATOM 437 CB LEU A 39 0.281 0.365 -7.511 1.00 0.00 C ATOM 438 CG LEU A 39 -0.184 0.270 -6.057 1.00 0.00 C ATOM 439 CD1 LEU A 39 -1.657 -0.108 -5.992 1.00 0.00 C ATOM 440 CD2 LEU A 39 0.660 -0.738 -5.292 1.00 0.00 C ATOM 0 H LEU A 39 -1.062 -0.740 -9.385 1.00 0.00 H new ATOM 0 HA LEU A 39 -1.296 1.775 -7.897 1.00 0.00 H new ATOM 0 HB2 LEU A 39 0.433 -0.646 -7.890 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.251 0.861 -7.529 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.059 1.247 -5.591 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -1.971 -0.171 -4.950 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -2.250 0.650 -6.504 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.806 -1.074 -6.475 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.315 -0.792 -4.259 1.00 0.00 H new ATOM 0 HD22 LEU A 39 0.567 -1.719 -5.758 1.00 0.00 H new ATOM 0 HD23 LEU A 39 1.704 -0.426 -5.310 1.00 0.00 H new ATOM 451 N GLY A 40 -0.269 1.938 -10.713 1.00 0.00 N ATOM 452 CA GLY A 40 0.431 2.700 -11.731 1.00 0.00 C ATOM 453 C GLY A 40 1.642 1.967 -12.273 1.00 0.00 C ATOM 454 O GLY A 40 2.489 2.563 -12.937 1.00 0.00 O ATOM 0 H GLY A 40 -1.086 1.427 -11.046 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.253 2.920 -12.550 1.00 0.00 H new ATOM 0 HA3 GLY A 40 0.746 3.656 -11.313 1.00 0.00 H new ATOM 457 N GLN A 41 1.724 0.671 -11.988 1.00 0.00 N ATOM 458 CA GLN A 41 2.844 -0.142 -12.449 1.00 0.00 C ATOM 459 C GLN A 41 2.408 -1.082 -13.569 1.00 0.00 C ATOM 460 O GLN A 41 1.257 -1.055 -14.002 1.00 0.00 O ATOM 461 CB GLN A 41 3.428 -0.948 -11.288 1.00 0.00 C ATOM 462 CG GLN A 41 3.992 -0.086 -10.171 1.00 0.00 C ATOM 463 CD GLN A 41 5.405 0.385 -10.453 1.00 0.00 C ATOM 464 OE1 GLN A 41 6.270 -0.405 -10.833 1.00 0.00 O ATOM 465 NE2 GLN A 41 5.648 1.677 -10.269 1.00 0.00 N ATOM 0 H GLN A 41 1.030 0.162 -11.441 1.00 0.00 H new ATOM 0 HA GLN A 41 3.611 0.527 -12.839 1.00 0.00 H new ATOM 0 HB2 GLN A 41 2.652 -1.595 -10.879 1.00 0.00 H new ATOM 0 HB3 GLN A 41 4.217 -1.597 -11.668 1.00 0.00 H new ATOM 0 HG2 GLN A 41 3.347 0.780 -10.025 1.00 0.00 H new ATOM 0 HG3 GLN A 41 3.981 -0.652 -9.240 1.00 0.00 H new ATOM 0 HE21 GLN A 41 4.902 2.296 -9.953 1.00 0.00 H new ATOM 0 HE22 GLN A 41 6.581 2.050 -10.444 1.00 0.00 H new ATOM 472 N ASN A 42 3.335 -1.914 -14.031 1.00 0.00 N ATOM 473 CA ASN A 42 3.047 -2.862 -15.101 1.00 0.00 C ATOM 474 C ASN A 42 3.610 -4.240 -14.772 1.00 0.00 C ATOM 475 O ASN A 42 4.620 -4.676 -15.328 1.00 0.00 O ATOM 476 CB ASN A 42 3.631 -2.363 -16.424 1.00 0.00 C ATOM 477 CG ASN A 42 3.144 -0.972 -16.783 1.00 0.00 C ATOM 478 OD1 ASN A 42 2.010 -0.601 -16.478 1.00 0.00 O ATOM 479 ND2 ASN A 42 4.001 -0.195 -17.435 1.00 0.00 N ATOM 0 H ASN A 42 4.292 -1.951 -13.681 1.00 0.00 H new ATOM 0 HA ASN A 42 1.964 -2.945 -15.198 1.00 0.00 H new ATOM 0 HB2 ASN A 42 4.719 -2.359 -16.359 1.00 0.00 H new ATOM 0 HB3 ASN A 42 3.362 -3.056 -17.221 1.00 0.00 H new ATOM 0 HD21 ASN A 42 3.729 0.751 -17.704 1.00 0.00 H new ATOM 0 HD22 ASN A 42 4.931 -0.544 -17.667 1.00 0.00 H new ATOM 485 N PRO A 43 2.945 -4.947 -13.846 1.00 0.00 N ATOM 486 CA PRO A 43 3.360 -6.287 -13.423 1.00 0.00 C ATOM 487 C PRO A 43 3.146 -7.331 -14.513 1.00 0.00 C ATOM 488 O PRO A 43 2.185 -7.258 -15.279 1.00 0.00 O ATOM 489 CB PRO A 43 2.455 -6.576 -12.222 1.00 0.00 C ATOM 490 CG PRO A 43 1.248 -5.731 -12.445 1.00 0.00 C ATOM 491 CD PRO A 43 1.735 -4.490 -13.142 1.00 0.00 C ATOM 0 HA PRO A 43 4.425 -6.330 -13.193 1.00 0.00 H new ATOM 0 HB2 PRO A 43 2.194 -7.633 -12.168 1.00 0.00 H new ATOM 0 HB3 PRO A 43 2.949 -6.322 -11.284 1.00 0.00 H new ATOM 0 HG2 PRO A 43 0.511 -6.256 -13.052 1.00 0.00 H new ATOM 0 HG3 PRO A 43 0.765 -5.484 -11.500 1.00 0.00 H new ATOM 0 HD2 PRO A 43 0.990 -4.100 -13.835 1.00 0.00 H new ATOM 0 HD3 PRO A 43 1.959 -3.693 -12.433 1.00 0.00 H new ATOM 496 N THR A 44 4.049 -8.305 -14.578 1.00 0.00 N ATOM 497 CA THR A 44 3.960 -9.364 -15.575 1.00 0.00 C ATOM 498 C THR A 44 3.611 -10.700 -14.929 1.00 0.00 C ATOM 499 O THR A 44 3.681 -10.846 -13.709 1.00 0.00 O ATOM 500 CB THR A 44 5.281 -9.513 -16.356 1.00 0.00 C ATOM 501 OG1 THR A 44 6.388 -9.512 -15.449 1.00 0.00 O ATOM 502 CG2 THR A 44 5.442 -8.386 -17.365 1.00 0.00 C ATOM 0 H THR A 44 4.850 -8.382 -13.952 1.00 0.00 H new ATOM 0 HA THR A 44 3.167 -9.081 -16.267 1.00 0.00 H new ATOM 0 HB THR A 44 5.255 -10.460 -16.895 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.089 -9.817 -14.567 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.381 -8.512 -17.904 1.00 0.00 H new ATOM 0 HG22 THR A 44 4.612 -8.409 -18.071 1.00 0.00 H new ATOM 0 HG23 THR A 44 5.449 -7.429 -16.843 1.00 0.00 H new ATOM 509 N GLU A 45 3.238 -11.672 -15.754 1.00 0.00 N ATOM 510 CA GLU A 45 2.879 -12.996 -15.262 1.00 0.00 C ATOM 511 C GLU A 45 4.004 -13.587 -14.416 1.00 0.00 C ATOM 512 O GLU A 45 3.766 -14.409 -13.533 1.00 0.00 O ATOM 513 CB GLU A 45 2.560 -13.931 -16.431 1.00 0.00 C ATOM 514 CG GLU A 45 1.378 -13.477 -17.269 1.00 0.00 C ATOM 515 CD GLU A 45 1.281 -14.215 -18.591 1.00 0.00 C ATOM 516 OE1 GLU A 45 2.051 -13.880 -19.514 1.00 0.00 O ATOM 517 OE2 GLU A 45 0.435 -15.127 -18.699 1.00 0.00 O ATOM 0 H GLU A 45 3.176 -11.567 -16.767 1.00 0.00 H new ATOM 0 HA GLU A 45 1.993 -12.894 -14.636 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.439 -14.011 -17.071 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.357 -14.929 -16.042 1.00 0.00 H new ATOM 0 HG2 GLU A 45 0.458 -13.628 -16.705 1.00 0.00 H new ATOM 0 HG3 GLU A 45 1.463 -12.407 -17.460 1.00 0.00 H new ATOM 522 N ALA A 46 5.232 -13.158 -14.694 1.00 0.00 N ATOM 523 CA ALA A 46 6.393 -13.642 -13.960 1.00 0.00 C ATOM 524 C ALA A 46 6.309 -13.260 -12.486 1.00 0.00 C ATOM 525 O ALA A 46 6.425 -14.114 -11.607 1.00 0.00 O ATOM 526 CB ALA A 46 7.673 -13.095 -14.576 1.00 0.00 C ATOM 0 H ALA A 46 5.447 -12.477 -15.422 1.00 0.00 H new ATOM 0 HA ALA A 46 6.406 -14.730 -14.027 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.533 -13.465 -14.017 1.00 0.00 H new ATOM 0 HB2 ALA A 46 7.746 -13.422 -15.613 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.658 -12.006 -14.539 1.00 0.00 H new ATOM 532 N GLU A 47 6.107 -11.973 -12.223 1.00 0.00 N ATOM 533 CA GLU A 47 6.010 -11.478 -10.855 1.00 0.00 C ATOM 534 C GLU A 47 4.932 -12.232 -10.081 1.00 0.00 C ATOM 535 O GLU A 47 5.158 -12.679 -8.955 1.00 0.00 O ATOM 536 CB GLU A 47 5.702 -9.980 -10.851 1.00 0.00 C ATOM 537 CG GLU A 47 6.943 -9.104 -10.879 1.00 0.00 C ATOM 538 CD GLU A 47 7.977 -9.589 -11.877 1.00 0.00 C ATOM 539 OE1 GLU A 47 7.670 -9.606 -13.087 1.00 0.00 O ATOM 540 OE2 GLU A 47 9.092 -9.952 -11.447 1.00 0.00 O ATOM 0 H GLU A 47 6.007 -11.254 -12.940 1.00 0.00 H new ATOM 0 HA GLU A 47 6.970 -11.645 -10.366 1.00 0.00 H new ATOM 0 HB2 GLU A 47 5.081 -9.743 -11.715 1.00 0.00 H new ATOM 0 HB3 GLU A 47 5.118 -9.740 -9.963 1.00 0.00 H new ATOM 0 HG2 GLU A 47 6.656 -8.082 -11.126 1.00 0.00 H new ATOM 0 HG3 GLU A 47 7.388 -9.078 -9.884 1.00 0.00 H new ATOM 545 N LEU A 48 3.760 -12.369 -10.691 1.00 0.00 N ATOM 546 CA LEU A 48 2.645 -13.067 -10.060 1.00 0.00 C ATOM 547 C LEU A 48 3.023 -14.507 -9.728 1.00 0.00 C ATOM 548 O LEU A 48 3.028 -14.904 -8.562 1.00 0.00 O ATOM 549 CB LEU A 48 1.421 -13.047 -10.976 1.00 0.00 C ATOM 550 CG LEU A 48 1.131 -11.721 -11.680 1.00 0.00 C ATOM 551 CD1 LEU A 48 -0.180 -11.800 -12.447 1.00 0.00 C ATOM 552 CD2 LEU A 48 1.095 -10.579 -10.675 1.00 0.00 C ATOM 0 H LEU A 48 3.557 -12.006 -11.622 1.00 0.00 H new ATOM 0 HA LEU A 48 2.404 -12.550 -9.131 1.00 0.00 H new ATOM 0 HB2 LEU A 48 1.548 -13.818 -11.736 1.00 0.00 H new ATOM 0 HB3 LEU A 48 0.546 -13.321 -10.386 1.00 0.00 H new ATOM 0 HG LEU A 48 1.934 -11.526 -12.391 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -0.370 -10.847 -12.942 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -0.117 -12.591 -13.194 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -0.994 -12.018 -11.755 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.887 -9.644 -11.195 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.313 -10.767 -9.939 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.059 -10.508 -10.171 1.00 0.00 H new ATOM 563 N GLN A 49 3.342 -15.283 -10.759 1.00 0.00 N ATOM 564 CA GLN A 49 3.722 -16.678 -10.576 1.00 0.00 C ATOM 565 C GLN A 49 4.836 -16.808 -9.542 1.00 0.00 C ATOM 566 O GLN A 49 4.820 -17.713 -8.708 1.00 0.00 O ATOM 567 CB GLN A 49 4.173 -17.284 -11.907 1.00 0.00 C ATOM 568 CG GLN A 49 3.021 -17.673 -12.819 1.00 0.00 C ATOM 569 CD GLN A 49 3.453 -18.594 -13.943 1.00 0.00 C ATOM 570 OE1 GLN A 49 4.571 -19.109 -13.945 1.00 0.00 O ATOM 571 NE2 GLN A 49 2.565 -18.806 -14.909 1.00 0.00 N ATOM 0 H GLN A 49 3.345 -14.969 -11.729 1.00 0.00 H new ATOM 0 HA GLN A 49 2.849 -17.222 -10.214 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.810 -16.568 -12.426 1.00 0.00 H new ATOM 0 HB3 GLN A 49 4.782 -18.166 -11.708 1.00 0.00 H new ATOM 0 HG2 GLN A 49 2.246 -18.163 -12.230 1.00 0.00 H new ATOM 0 HG3 GLN A 49 2.578 -16.772 -13.243 1.00 0.00 H new ATOM 0 HE21 GLN A 49 1.649 -18.358 -14.867 1.00 0.00 H new ATOM 0 HE22 GLN A 49 2.799 -19.416 -15.692 1.00 0.00 H new ATOM 578 N ASP A 50 5.800 -15.897 -9.602 1.00 0.00 N ATOM 579 CA ASP A 50 6.921 -15.909 -8.670 1.00 0.00 C ATOM 580 C ASP A 50 6.430 -15.836 -7.227 1.00 0.00 C ATOM 581 O ASP A 50 6.645 -16.757 -6.441 1.00 0.00 O ATOM 582 CB ASP A 50 7.866 -14.740 -8.959 1.00 0.00 C ATOM 583 CG ASP A 50 9.011 -14.662 -7.969 1.00 0.00 C ATOM 584 OD1 ASP A 50 9.538 -15.727 -7.587 1.00 0.00 O ATOM 585 OD2 ASP A 50 9.379 -13.535 -7.575 1.00 0.00 O ATOM 0 H ASP A 50 5.828 -15.141 -10.286 1.00 0.00 H new ATOM 0 HA ASP A 50 7.462 -16.846 -8.804 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.268 -14.842 -9.967 1.00 0.00 H new ATOM 0 HB3 ASP A 50 7.303 -13.807 -8.933 1.00 0.00 H new ATOM 589 N MET A 51 5.769 -14.734 -6.888 1.00 0.00 N ATOM 590 CA MET A 51 5.247 -14.541 -5.540 1.00 0.00 C ATOM 591 C MET A 51 4.431 -15.750 -5.095 1.00 0.00 C ATOM 592 O MET A 51 4.726 -16.368 -4.072 1.00 0.00 O ATOM 593 CB MET A 51 4.385 -13.278 -5.479 1.00 0.00 C ATOM 594 CG MET A 51 5.164 -12.030 -5.096 1.00 0.00 C ATOM 595 SD MET A 51 6.427 -11.600 -6.309 1.00 0.00 S ATOM 596 CE MET A 51 5.944 -9.925 -6.721 1.00 0.00 C ATOM 0 H MET A 51 5.582 -13.962 -7.528 1.00 0.00 H new ATOM 0 HA MET A 51 6.093 -14.427 -4.863 1.00 0.00 H new ATOM 0 HB2 MET A 51 3.916 -13.120 -6.450 1.00 0.00 H new ATOM 0 HB3 MET A 51 3.581 -13.431 -4.758 1.00 0.00 H new ATOM 0 HG2 MET A 51 4.473 -11.195 -4.985 1.00 0.00 H new ATOM 0 HG3 MET A 51 5.635 -12.184 -4.125 1.00 0.00 H new ATOM 0 HE1 MET A 51 6.795 -9.396 -7.150 1.00 0.00 H new ATOM 0 HE2 MET A 51 5.129 -9.949 -7.445 1.00 0.00 H new ATOM 0 HE3 MET A 51 5.613 -9.410 -5.819 1.00 0.00 H new ATOM 604 N ILE A 52 3.403 -16.081 -5.870 1.00 0.00 N ATOM 605 CA ILE A 52 2.544 -17.216 -5.555 1.00 0.00 C ATOM 606 C ILE A 52 3.368 -18.474 -5.296 1.00 0.00 C ATOM 607 O ILE A 52 3.304 -19.059 -4.217 1.00 0.00 O ATOM 608 CB ILE A 52 1.543 -17.497 -6.692 1.00 0.00 C ATOM 609 CG1 ILE A 52 0.664 -16.270 -6.941 1.00 0.00 C ATOM 610 CG2 ILE A 52 0.687 -18.709 -6.356 1.00 0.00 C ATOM 611 CD1 ILE A 52 -0.262 -15.945 -5.789 1.00 0.00 C ATOM 0 H ILE A 52 3.145 -15.580 -6.720 1.00 0.00 H new ATOM 0 HA ILE A 52 1.992 -16.953 -4.652 1.00 0.00 H new ATOM 0 HB ILE A 52 2.101 -17.712 -7.603 1.00 0.00 H new ATOM 0 HG12 ILE A 52 1.303 -15.409 -7.137 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.069 -16.436 -7.839 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -0.015 -18.895 -7.169 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.327 -19.581 -6.223 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.135 -18.520 -5.435 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.854 -15.064 -6.036 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -0.926 -16.790 -5.607 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.327 -15.747 -4.893 1.00 0.00 H new ATOM 622 N ASN A 53 4.145 -18.882 -6.296 1.00 0.00 N ATOM 623 CA ASN A 53 4.983 -20.069 -6.176 1.00 0.00 C ATOM 624 C ASN A 53 5.937 -19.944 -4.992 1.00 0.00 C ATOM 625 O ASN A 53 6.411 -20.946 -4.457 1.00 0.00 O ATOM 626 CB ASN A 53 5.778 -20.289 -7.465 1.00 0.00 C ATOM 627 CG ASN A 53 6.891 -21.304 -7.292 1.00 0.00 C ATOM 628 OD1 ASN A 53 6.645 -22.460 -6.949 1.00 0.00 O ATOM 629 ND2 ASN A 53 8.125 -20.873 -7.528 1.00 0.00 N ATOM 0 H ASN A 53 4.211 -18.408 -7.197 1.00 0.00 H new ATOM 0 HA ASN A 53 4.333 -20.927 -6.007 1.00 0.00 H new ATOM 0 HB2 ASN A 53 5.103 -20.625 -8.252 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.203 -19.340 -7.793 1.00 0.00 H new ATOM 0 HD21 ASN A 53 8.916 -21.509 -7.427 1.00 0.00 H new ATOM 0 HD22 ASN A 53 8.282 -19.906 -7.810 1.00 0.00 H new ATOM 635 N GLU A 54 6.214 -18.708 -4.590 1.00 0.00 N ATOM 636 CA GLU A 54 7.112 -18.452 -3.470 1.00 0.00 C ATOM 637 C GLU A 54 6.364 -18.541 -2.143 1.00 0.00 C ATOM 638 O GLU A 54 6.960 -18.809 -1.098 1.00 0.00 O ATOM 639 CB GLU A 54 7.761 -17.074 -3.611 1.00 0.00 C ATOM 640 CG GLU A 54 8.849 -16.805 -2.584 1.00 0.00 C ATOM 641 CD GLU A 54 9.935 -15.887 -3.113 1.00 0.00 C ATOM 642 OE1 GLU A 54 9.731 -14.655 -3.093 1.00 0.00 O ATOM 643 OE2 GLU A 54 10.987 -16.402 -3.544 1.00 0.00 O ATOM 0 H GLU A 54 5.830 -17.868 -5.023 1.00 0.00 H new ATOM 0 HA GLU A 54 7.891 -19.214 -3.481 1.00 0.00 H new ATOM 0 HB2 GLU A 54 8.186 -16.983 -4.611 1.00 0.00 H new ATOM 0 HB3 GLU A 54 6.991 -16.308 -3.521 1.00 0.00 H new ATOM 0 HG2 GLU A 54 8.403 -16.359 -1.695 1.00 0.00 H new ATOM 0 HG3 GLU A 54 9.295 -17.751 -2.277 1.00 0.00 H new ATOM 648 N VAL A 55 5.055 -18.314 -2.191 1.00 0.00 N ATOM 649 CA VAL A 55 4.225 -18.368 -0.993 1.00 0.00 C ATOM 650 C VAL A 55 3.173 -19.466 -1.104 1.00 0.00 C ATOM 651 O VAL A 55 2.118 -19.395 -0.472 1.00 0.00 O ATOM 652 CB VAL A 55 3.522 -17.022 -0.735 1.00 0.00 C ATOM 653 CG1 VAL A 55 4.519 -15.875 -0.815 1.00 0.00 C ATOM 654 CG2 VAL A 55 2.383 -16.819 -1.724 1.00 0.00 C ATOM 0 H VAL A 55 4.546 -18.091 -3.047 1.00 0.00 H new ATOM 0 HA VAL A 55 4.889 -18.587 -0.157 1.00 0.00 H new ATOM 0 HB VAL A 55 3.102 -17.037 0.271 1.00 0.00 H new ATOM 0 HG11 VAL A 55 4.004 -14.932 -0.630 1.00 0.00 H new ATOM 0 HG12 VAL A 55 5.297 -16.017 -0.065 1.00 0.00 H new ATOM 0 HG13 VAL A 55 4.970 -15.854 -1.807 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.897 -15.863 -1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 55 2.778 -16.823 -2.740 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.657 -17.625 -1.613 1.00 0.00 H new ATOM 664 N ASP A 56 3.467 -20.480 -1.909 1.00 0.00 N ATOM 665 CA ASP A 56 2.546 -21.595 -2.101 1.00 0.00 C ATOM 666 C ASP A 56 3.294 -22.924 -2.095 1.00 0.00 C ATOM 667 O ASP A 56 3.962 -23.276 -3.068 1.00 0.00 O ATOM 668 CB ASP A 56 1.782 -21.432 -3.416 1.00 0.00 C ATOM 669 CG ASP A 56 0.473 -22.197 -3.423 1.00 0.00 C ATOM 670 OD1 ASP A 56 -0.008 -22.561 -2.329 1.00 0.00 O ATOM 671 OD2 ASP A 56 -0.071 -22.430 -4.522 1.00 0.00 O ATOM 0 H ASP A 56 4.335 -20.554 -2.439 1.00 0.00 H new ATOM 0 HA ASP A 56 1.836 -21.594 -1.274 1.00 0.00 H new ATOM 0 HB2 ASP A 56 1.582 -20.374 -3.588 1.00 0.00 H new ATOM 0 HB3 ASP A 56 2.406 -21.777 -4.241 1.00 0.00 H new ATOM 675 N ALA A 57 3.179 -23.658 -0.993 1.00 0.00 N ATOM 676 CA ALA A 57 3.843 -24.948 -0.861 1.00 0.00 C ATOM 677 C ALA A 57 2.944 -26.081 -1.344 1.00 0.00 C ATOM 678 O ALA A 57 3.407 -27.198 -1.579 1.00 0.00 O ATOM 679 CB ALA A 57 4.259 -25.183 0.584 1.00 0.00 C ATOM 0 H ALA A 57 2.632 -23.380 -0.178 1.00 0.00 H new ATOM 0 HA ALA A 57 4.735 -24.934 -1.487 1.00 0.00 H new ATOM 0 HB1 ALA A 57 4.754 -26.151 0.667 1.00 0.00 H new ATOM 0 HB2 ALA A 57 4.945 -24.396 0.898 1.00 0.00 H new ATOM 0 HB3 ALA A 57 3.376 -25.171 1.223 1.00 0.00 H new ATOM 685 N ASP A 58 1.657 -25.786 -1.491 1.00 0.00 N ATOM 686 CA ASP A 58 0.692 -26.780 -1.947 1.00 0.00 C ATOM 687 C ASP A 58 0.669 -26.857 -3.470 1.00 0.00 C ATOM 688 O ASP A 58 0.589 -27.942 -4.046 1.00 0.00 O ATOM 689 CB ASP A 58 -0.705 -26.446 -1.421 1.00 0.00 C ATOM 690 CG ASP A 58 -0.662 -25.571 -0.184 1.00 0.00 C ATOM 691 OD1 ASP A 58 -0.306 -26.086 0.896 1.00 0.00 O ATOM 692 OD2 ASP A 58 -0.985 -24.369 -0.295 1.00 0.00 O ATOM 0 H ASP A 58 1.258 -24.867 -1.301 1.00 0.00 H new ATOM 0 HA ASP A 58 0.997 -27.751 -1.556 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.273 -25.940 -2.202 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.234 -27.371 -1.191 1.00 0.00 H new ATOM 696 N GLY A 59 0.741 -25.698 -4.118 1.00 0.00 N ATOM 697 CA GLY A 59 0.726 -25.657 -5.569 1.00 0.00 C ATOM 698 C GLY A 59 -0.670 -25.470 -6.129 1.00 0.00 C ATOM 699 O GLY A 59 -1.050 -26.130 -7.095 1.00 0.00 O ATOM 0 H GLY A 59 0.809 -24.787 -3.664 1.00 0.00 H new ATOM 0 HA2 GLY A 59 1.364 -24.843 -5.913 1.00 0.00 H new ATOM 0 HA3 GLY A 59 1.150 -26.582 -5.960 1.00 0.00 H new ATOM 702 N ASN A 60 -1.435 -24.570 -5.521 1.00 0.00 N ATOM 703 CA ASN A 60 -2.799 -24.301 -5.964 1.00 0.00 C ATOM 704 C ASN A 60 -2.893 -22.935 -6.635 1.00 0.00 C ATOM 705 O ASN A 60 -3.975 -22.491 -7.014 1.00 0.00 O ATOM 706 CB ASN A 60 -3.765 -24.368 -4.779 1.00 0.00 C ATOM 707 CG ASN A 60 -3.092 -24.023 -3.464 1.00 0.00 C ATOM 708 OD1 ASN A 60 -2.306 -23.079 -3.386 1.00 0.00 O ATOM 709 ND2 ASN A 60 -3.398 -24.790 -2.425 1.00 0.00 N ATOM 0 H ASN A 60 -1.134 -24.014 -4.720 1.00 0.00 H new ATOM 0 HA ASN A 60 -3.075 -25.063 -6.692 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.594 -23.682 -4.951 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.189 -25.370 -4.715 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -2.976 -24.608 -1.515 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -4.055 -25.562 -2.537 1.00 0.00 H new ATOM 715 N GLY A 61 -1.749 -22.272 -6.780 1.00 0.00 N ATOM 716 CA GLY A 61 -1.723 -20.963 -7.407 1.00 0.00 C ATOM 717 C GLY A 61 -2.574 -19.950 -6.666 1.00 0.00 C ATOM 718 O GLY A 61 -3.120 -19.026 -7.271 1.00 0.00 O ATOM 0 H GLY A 61 -0.840 -22.618 -6.474 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -0.694 -20.605 -7.453 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.077 -21.048 -8.435 1.00 0.00 H new ATOM 721 N THR A 62 -2.691 -20.123 -5.353 1.00 0.00 N ATOM 722 CA THR A 62 -3.483 -19.219 -4.530 1.00 0.00 C ATOM 723 C THR A 62 -2.765 -18.891 -3.226 1.00 0.00 C ATOM 724 O THR A 62 -1.866 -19.619 -2.802 1.00 0.00 O ATOM 725 CB THR A 62 -4.864 -19.818 -4.207 1.00 0.00 C ATOM 726 OG1 THR A 62 -4.725 -20.896 -3.275 1.00 0.00 O ATOM 727 CG2 THR A 62 -5.546 -20.319 -5.471 1.00 0.00 C ATOM 0 H THR A 62 -2.246 -20.882 -4.837 1.00 0.00 H new ATOM 0 HA THR A 62 -3.619 -18.304 -5.106 1.00 0.00 H new ATOM 0 HB THR A 62 -5.481 -19.035 -3.766 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.913 -21.404 -3.482 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.520 -20.738 -5.217 1.00 0.00 H new ATOM 0 HG22 THR A 62 -5.677 -19.490 -6.167 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.930 -21.089 -5.936 1.00 0.00 H new ATOM 734 N ILE A 63 -3.168 -17.795 -2.593 1.00 0.00 N ATOM 735 CA ILE A 63 -2.565 -17.373 -1.335 1.00 0.00 C ATOM 736 C ILE A 63 -3.549 -17.511 -0.180 1.00 0.00 C ATOM 737 O ILE A 63 -4.733 -17.204 -0.319 1.00 0.00 O ATOM 738 CB ILE A 63 -2.075 -15.915 -1.407 1.00 0.00 C ATOM 739 CG1 ILE A 63 -0.675 -15.853 -2.021 1.00 0.00 C ATOM 740 CG2 ILE A 63 -2.079 -15.287 -0.021 1.00 0.00 C ATOM 741 CD1 ILE A 63 -0.450 -14.637 -2.892 1.00 0.00 C ATOM 0 H ILE A 63 -3.910 -17.182 -2.931 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.710 -18.026 -1.160 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.755 -15.350 -2.044 1.00 0.00 H new ATOM 0 HG12 ILE A 63 0.065 -15.858 -1.220 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -0.508 -16.751 -2.615 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.730 -14.256 -0.087 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.091 -15.302 0.382 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.418 -15.852 0.636 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.563 -14.659 -3.293 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -1.166 -14.641 -3.714 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.585 -13.734 -2.297 1.00 0.00 H new ATOM 752 N ASP A 64 -3.052 -17.973 0.962 1.00 0.00 N ATOM 753 CA ASP A 64 -3.886 -18.149 2.145 1.00 0.00 C ATOM 754 C ASP A 64 -3.788 -16.936 3.065 1.00 0.00 C ATOM 755 O ASP A 64 -3.092 -15.967 2.760 1.00 0.00 O ATOM 756 CB ASP A 64 -3.477 -19.413 2.902 1.00 0.00 C ATOM 757 CG ASP A 64 -3.820 -20.680 2.144 1.00 0.00 C ATOM 758 OD1 ASP A 64 -4.770 -20.646 1.332 1.00 0.00 O ATOM 759 OD2 ASP A 64 -3.140 -21.704 2.359 1.00 0.00 O ATOM 0 H ASP A 64 -2.074 -18.233 1.094 1.00 0.00 H new ATOM 0 HA ASP A 64 -4.920 -18.251 1.817 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -2.404 -19.387 3.093 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -3.973 -19.428 3.872 1.00 0.00 H new ATOM 763 N PHE A 65 -4.491 -16.996 4.191 1.00 0.00 N ATOM 764 CA PHE A 65 -4.486 -15.902 5.155 1.00 0.00 C ATOM 765 C PHE A 65 -3.110 -15.751 5.798 1.00 0.00 C ATOM 766 O PHE A 65 -2.488 -14.689 5.751 1.00 0.00 O ATOM 767 CB PHE A 65 -5.543 -16.139 6.234 1.00 0.00 C ATOM 768 CG PHE A 65 -5.211 -15.497 7.551 1.00 0.00 C ATOM 769 CD1 PHE A 65 -4.975 -14.134 7.632 1.00 0.00 C ATOM 770 CD2 PHE A 65 -5.135 -16.256 8.707 1.00 0.00 C ATOM 771 CE1 PHE A 65 -4.667 -13.541 8.842 1.00 0.00 C ATOM 772 CE2 PHE A 65 -4.829 -15.669 9.921 1.00 0.00 C ATOM 773 CZ PHE A 65 -4.596 -14.310 9.988 1.00 0.00 C ATOM 0 H PHE A 65 -5.072 -17.791 4.458 1.00 0.00 H new ATOM 0 HA PHE A 65 -4.722 -14.981 4.623 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -6.501 -15.755 5.883 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.665 -17.212 6.383 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.032 -13.528 6.740 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -5.317 -17.320 8.660 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -4.482 -12.478 8.892 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.772 -16.272 10.815 1.00 0.00 H new ATOM 0 HZ PHE A 65 -4.358 -13.848 10.935 1.00 0.00 H new ATOM 782 N PRO A 66 -2.625 -16.838 6.415 1.00 0.00 N ATOM 783 CA PRO A 66 -1.318 -16.853 7.082 1.00 0.00 C ATOM 784 C PRO A 66 -0.163 -16.779 6.090 1.00 0.00 C ATOM 785 O PRO A 66 0.864 -16.158 6.367 1.00 0.00 O ATOM 786 CB PRO A 66 -1.309 -18.198 7.813 1.00 0.00 C ATOM 787 CG PRO A 66 -2.248 -19.057 7.039 1.00 0.00 C ATOM 788 CD PRO A 66 -3.312 -18.136 6.511 1.00 0.00 C ATOM 0 HA PRO A 66 -1.185 -15.994 7.740 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -0.308 -18.628 7.838 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -1.634 -18.088 8.848 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -1.731 -19.564 6.224 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.681 -19.831 7.673 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -3.684 -18.466 5.541 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -4.170 -18.088 7.181 1.00 0.00 H new ATOM 793 N GLU A 67 -0.336 -17.414 4.936 1.00 0.00 N ATOM 794 CA GLU A 67 0.695 -17.419 3.904 1.00 0.00 C ATOM 795 C GLU A 67 1.200 -16.005 3.634 1.00 0.00 C ATOM 796 O GLU A 67 2.356 -15.684 3.908 1.00 0.00 O ATOM 797 CB GLU A 67 0.152 -18.034 2.612 1.00 0.00 C ATOM 798 CG GLU A 67 0.429 -19.523 2.484 1.00 0.00 C ATOM 799 CD GLU A 67 -0.089 -20.102 1.182 1.00 0.00 C ATOM 800 OE1 GLU A 67 -0.756 -19.364 0.429 1.00 0.00 O ATOM 801 OE2 GLU A 67 0.173 -21.294 0.917 1.00 0.00 O ATOM 0 H GLU A 67 -1.180 -17.932 4.691 1.00 0.00 H new ATOM 0 HA GLU A 67 1.529 -18.022 4.262 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.924 -17.868 2.565 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.592 -17.516 1.760 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.503 -19.696 2.553 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.033 -20.048 3.320 1.00 0.00 H new ATOM 806 N PHE A 68 0.325 -15.164 3.093 1.00 0.00 N ATOM 807 CA PHE A 68 0.683 -13.784 2.782 1.00 0.00 C ATOM 808 C PHE A 68 1.322 -13.104 3.989 1.00 0.00 C ATOM 809 O PHE A 68 2.303 -12.370 3.856 1.00 0.00 O ATOM 810 CB PHE A 68 -0.555 -13.002 2.339 1.00 0.00 C ATOM 811 CG PHE A 68 -0.239 -11.825 1.462 1.00 0.00 C ATOM 812 CD1 PHE A 68 -0.034 -11.994 0.102 1.00 0.00 C ATOM 813 CD2 PHE A 68 -0.145 -10.550 1.997 1.00 0.00 C ATOM 814 CE1 PHE A 68 0.259 -10.912 -0.708 1.00 0.00 C ATOM 815 CE2 PHE A 68 0.148 -9.465 1.192 1.00 0.00 C ATOM 816 CZ PHE A 68 0.348 -9.646 -0.163 1.00 0.00 C ATOM 0 H PHE A 68 -0.636 -15.413 2.861 1.00 0.00 H new ATOM 0 HA PHE A 68 1.407 -13.797 1.968 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.227 -13.673 1.804 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.090 -12.653 3.222 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.104 -12.981 -0.330 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -0.302 -10.402 3.055 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.418 -11.057 -1.766 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.220 -8.477 1.622 1.00 0.00 H new ATOM 0 HZ PHE A 68 0.573 -8.799 -0.795 1.00 0.00 H new ATOM 825 N LEU A 69 0.761 -13.352 5.167 1.00 0.00 N ATOM 826 CA LEU A 69 1.276 -12.764 6.399 1.00 0.00 C ATOM 827 C LEU A 69 2.752 -13.102 6.589 1.00 0.00 C ATOM 828 O LEU A 69 3.561 -12.235 6.920 1.00 0.00 O ATOM 829 CB LEU A 69 0.469 -13.260 7.601 1.00 0.00 C ATOM 830 CG LEU A 69 0.169 -12.221 8.682 1.00 0.00 C ATOM 831 CD1 LEU A 69 -1.267 -11.733 8.570 1.00 0.00 C ATOM 832 CD2 LEU A 69 0.431 -12.801 10.065 1.00 0.00 C ATOM 0 H LEU A 69 -0.051 -13.956 5.295 1.00 0.00 H new ATOM 0 HA LEU A 69 1.177 -11.681 6.324 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.477 -13.661 7.238 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.010 -14.087 8.060 1.00 0.00 H new ATOM 0 HG LEU A 69 0.833 -11.369 8.535 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.462 -10.994 9.347 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.422 -11.279 7.591 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -1.948 -12.575 8.691 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.212 -12.048 10.823 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.208 -13.670 10.222 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.476 -13.100 10.142 1.00 0.00 H new ATOM 843 N THR A 70 3.096 -14.369 6.375 1.00 0.00 N ATOM 844 CA THR A 70 4.473 -14.821 6.521 1.00 0.00 C ATOM 845 C THR A 70 5.377 -14.181 5.474 1.00 0.00 C ATOM 846 O THR A 70 6.457 -13.686 5.792 1.00 0.00 O ATOM 847 CB THR A 70 4.576 -16.353 6.405 1.00 0.00 C ATOM 848 OG1 THR A 70 4.473 -16.748 5.032 1.00 0.00 O ATOM 849 CG2 THR A 70 3.484 -17.033 7.216 1.00 0.00 C ATOM 0 H THR A 70 2.439 -15.099 6.100 1.00 0.00 H new ATOM 0 HA THR A 70 4.802 -14.516 7.515 1.00 0.00 H new ATOM 0 HB THR A 70 5.544 -16.660 6.800 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.555 -16.607 4.719 1.00 0.00 H new ATOM 0 HG21 THR A 70 3.578 -18.115 7.118 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.583 -16.754 8.265 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.508 -16.719 6.847 1.00 0.00 H new ATOM 856 N MET A 71 4.926 -14.193 4.224 1.00 0.00 N ATOM 857 CA MET A 71 5.695 -13.611 3.129 1.00 0.00 C ATOM 858 C MET A 71 6.092 -12.174 3.449 1.00 0.00 C ATOM 859 O MET A 71 7.259 -11.802 3.324 1.00 0.00 O ATOM 860 CB MET A 71 4.885 -13.653 1.831 1.00 0.00 C ATOM 861 CG MET A 71 5.569 -12.955 0.666 1.00 0.00 C ATOM 862 SD MET A 71 5.046 -11.240 0.480 1.00 0.00 S ATOM 863 CE MET A 71 3.311 -11.455 0.089 1.00 0.00 C ATOM 0 H MET A 71 4.033 -14.599 3.944 1.00 0.00 H new ATOM 0 HA MET A 71 6.603 -14.200 3.001 1.00 0.00 H new ATOM 0 HB2 MET A 71 4.698 -14.693 1.562 1.00 0.00 H new ATOM 0 HB3 MET A 71 3.914 -13.189 2.003 1.00 0.00 H new ATOM 0 HG2 MET A 71 6.649 -12.988 0.811 1.00 0.00 H new ATOM 0 HG3 MET A 71 5.355 -13.498 -0.254 1.00 0.00 H new ATOM 0 HE1 MET A 71 3.075 -10.916 -0.829 1.00 0.00 H new ATOM 0 HE2 MET A 71 3.098 -12.515 -0.048 1.00 0.00 H new ATOM 0 HE3 MET A 71 2.703 -11.065 0.905 1.00 0.00 H new ATOM 871 N MET A 72 5.116 -11.371 3.859 1.00 0.00 N ATOM 872 CA MET A 72 5.366 -9.975 4.196 1.00 0.00 C ATOM 873 C MET A 72 6.153 -9.863 5.498 1.00 0.00 C ATOM 874 O MET A 72 7.183 -9.191 5.555 1.00 0.00 O ATOM 875 CB MET A 72 4.045 -9.213 4.319 1.00 0.00 C ATOM 876 CG MET A 72 4.163 -7.734 3.989 1.00 0.00 C ATOM 877 SD MET A 72 3.508 -6.677 5.294 1.00 0.00 S ATOM 878 CE MET A 72 1.907 -7.431 5.568 1.00 0.00 C ATOM 0 H MET A 72 4.145 -11.663 3.966 1.00 0.00 H new ATOM 0 HA MET A 72 5.958 -9.534 3.394 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.310 -9.667 3.655 1.00 0.00 H new ATOM 0 HB3 MET A 72 3.666 -9.321 5.335 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.211 -7.486 3.818 1.00 0.00 H new ATOM 0 HG3 MET A 72 3.631 -7.529 3.060 1.00 0.00 H new ATOM 0 HE1 MET A 72 1.195 -6.668 5.882 1.00 0.00 H new ATOM 0 HE2 MET A 72 1.560 -7.894 4.644 1.00 0.00 H new ATOM 0 HE3 MET A 72 1.991 -8.191 6.345 1.00 0.00 H new ATOM 886 N ALA A 73 5.661 -10.525 6.540 1.00 0.00 N ATOM 887 CA ALA A 73 6.320 -10.501 7.840 1.00 0.00 C ATOM 888 C ALA A 73 7.795 -10.870 7.716 1.00 0.00 C ATOM 889 O ALA A 73 8.622 -10.442 8.521 1.00 0.00 O ATOM 890 CB ALA A 73 5.618 -11.444 8.806 1.00 0.00 C ATOM 0 H ALA A 73 4.809 -11.084 6.509 1.00 0.00 H new ATOM 0 HA ALA A 73 6.258 -9.485 8.231 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.121 -11.416 9.773 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.580 -11.134 8.928 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.649 -12.459 8.411 1.00 0.00 H new ATOM 896 N ARG A 74 8.117 -11.666 6.702 1.00 0.00 N ATOM 897 CA ARG A 74 9.491 -12.094 6.474 1.00 0.00 C ATOM 898 C ARG A 74 10.423 -10.891 6.352 1.00 0.00 C ATOM 899 O ARG A 74 11.619 -10.988 6.625 1.00 0.00 O ATOM 900 CB ARG A 74 9.579 -12.950 5.208 1.00 0.00 C ATOM 901 CG ARG A 74 10.957 -13.543 4.968 1.00 0.00 C ATOM 902 CD ARG A 74 11.106 -14.047 3.541 1.00 0.00 C ATOM 903 NE ARG A 74 10.266 -15.212 3.281 1.00 0.00 N ATOM 904 CZ ARG A 74 10.590 -16.448 3.645 1.00 0.00 C ATOM 905 NH1 ARG A 74 11.729 -16.677 4.283 1.00 0.00 N ATOM 906 NH2 ARG A 74 9.772 -17.456 3.373 1.00 0.00 N ATOM 0 H ARG A 74 7.445 -12.027 6.025 1.00 0.00 H new ATOM 0 HA ARG A 74 9.805 -12.690 7.331 1.00 0.00 H new ATOM 0 HB2 ARG A 74 8.852 -13.759 5.275 1.00 0.00 H new ATOM 0 HB3 ARG A 74 9.300 -12.341 4.348 1.00 0.00 H new ATOM 0 HG2 ARG A 74 11.719 -12.790 5.170 1.00 0.00 H new ATOM 0 HG3 ARG A 74 11.127 -14.364 5.665 1.00 0.00 H new ATOM 0 HD2 ARG A 74 10.844 -13.249 2.846 1.00 0.00 H new ATOM 0 HD3 ARG A 74 12.149 -14.303 3.354 1.00 0.00 H new ATOM 0 HE ARG A 74 9.382 -15.069 2.793 1.00 0.00 H new ATOM 0 HH11 ARG A 74 12.359 -15.903 4.496 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.976 -17.627 4.561 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.894 -17.282 2.884 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.021 -18.405 3.653 1.00 0.00 H new ATOM 917 N LYS A 75 9.865 -9.757 5.941 1.00 0.00 N ATOM 918 CA LYS A 75 10.644 -8.535 5.784 1.00 0.00 C ATOM 919 C LYS A 75 11.168 -8.046 7.131 1.00 0.00 C ATOM 920 O LYS A 75 12.105 -7.250 7.190 1.00 0.00 O ATOM 921 CB LYS A 75 9.791 -7.443 5.132 1.00 0.00 C ATOM 922 CG LYS A 75 8.772 -6.825 6.072 1.00 0.00 C ATOM 923 CD LYS A 75 7.622 -6.190 5.308 1.00 0.00 C ATOM 924 CE LYS A 75 6.849 -5.209 6.177 1.00 0.00 C ATOM 925 NZ LYS A 75 6.288 -5.865 7.390 1.00 0.00 N ATOM 0 H LYS A 75 8.876 -9.659 5.711 1.00 0.00 H new ATOM 0 HA LYS A 75 11.496 -8.757 5.141 1.00 0.00 H new ATOM 0 HB2 LYS A 75 10.447 -6.659 4.754 1.00 0.00 H new ATOM 0 HB3 LYS A 75 9.271 -7.865 4.272 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.385 -7.590 6.744 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.258 -6.072 6.692 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.009 -5.673 4.430 1.00 0.00 H new ATOM 0 HD3 LYS A 75 6.949 -6.968 4.949 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.507 -4.393 6.477 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.039 -4.768 5.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.712 -5.180 7.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.694 -6.670 7.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.065 -6.204 7.992 1.00 0.00 H new ATOM 935 N MET A 76 10.559 -8.531 8.209 1.00 0.00 N ATOM 936 CA MET A 76 10.969 -8.146 9.554 1.00 0.00 C ATOM 937 C MET A 76 12.472 -8.327 9.739 1.00 0.00 C ATOM 938 O MET A 76 13.107 -7.600 10.503 1.00 0.00 O ATOM 939 CB MET A 76 10.212 -8.972 10.597 1.00 0.00 C ATOM 940 CG MET A 76 10.314 -8.412 12.006 1.00 0.00 C ATOM 941 SD MET A 76 9.561 -9.492 13.238 1.00 0.00 S ATOM 942 CE MET A 76 10.917 -10.609 13.584 1.00 0.00 C ATOM 0 H MET A 76 9.781 -9.190 8.177 1.00 0.00 H new ATOM 0 HA MET A 76 10.729 -7.092 9.691 1.00 0.00 H new ATOM 0 HB2 MET A 76 9.161 -9.027 10.312 1.00 0.00 H new ATOM 0 HB3 MET A 76 10.598 -9.991 10.591 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.364 -8.258 12.256 1.00 0.00 H new ATOM 0 HG3 MET A 76 9.831 -7.435 12.041 1.00 0.00 H new ATOM 0 HE1 MET A 76 10.605 -11.339 14.331 1.00 0.00 H new ATOM 0 HE2 MET A 76 11.205 -11.126 12.669 1.00 0.00 H new ATOM 0 HE3 MET A 76 11.767 -10.042 13.963 1.00 0.00 H new ATOM 950 N LYS A 77 13.037 -9.301 9.033 1.00 0.00 N ATOM 951 CA LYS A 77 14.466 -9.578 9.117 1.00 0.00 C ATOM 952 C LYS A 77 15.280 -8.307 8.893 1.00 0.00 C ATOM 953 O LYS A 77 16.378 -8.160 9.430 1.00 0.00 O ATOM 954 CB LYS A 77 14.862 -10.639 8.089 1.00 0.00 C ATOM 955 CG LYS A 77 14.118 -11.953 8.252 1.00 0.00 C ATOM 956 CD LYS A 77 14.310 -12.856 7.046 1.00 0.00 C ATOM 957 CE LYS A 77 14.170 -14.324 7.421 1.00 0.00 C ATOM 958 NZ LYS A 77 14.838 -15.215 6.433 1.00 0.00 N ATOM 0 H LYS A 77 12.526 -9.912 8.396 1.00 0.00 H new ATOM 0 HA LYS A 77 14.680 -9.954 10.117 1.00 0.00 H new ATOM 0 HB2 LYS A 77 14.678 -10.249 7.088 1.00 0.00 H new ATOM 0 HB3 LYS A 77 15.933 -10.826 8.167 1.00 0.00 H new ATOM 0 HG2 LYS A 77 14.470 -12.463 9.149 1.00 0.00 H new ATOM 0 HG3 LYS A 77 13.056 -11.755 8.394 1.00 0.00 H new ATOM 0 HD2 LYS A 77 13.576 -12.603 6.280 1.00 0.00 H new ATOM 0 HD3 LYS A 77 15.295 -12.682 6.613 1.00 0.00 H new ATOM 0 HE2 LYS A 77 14.601 -14.489 8.408 1.00 0.00 H new ATOM 0 HE3 LYS A 77 13.113 -14.583 7.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 14.720 -16.206 6.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 14.410 -15.076 5.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 15.851 -14.986 6.388 1.00 0.00 H new ATOM 968 N ASP A 78 14.736 -7.394 8.098 1.00 0.00 N ATOM 969 CA ASP A 78 15.410 -6.135 7.805 1.00 0.00 C ATOM 970 C ASP A 78 14.636 -4.955 8.385 1.00 0.00 C ATOM 971 O ASP A 78 13.419 -4.859 8.227 1.00 0.00 O ATOM 972 CB ASP A 78 15.575 -5.960 6.295 1.00 0.00 C ATOM 973 CG ASP A 78 14.263 -6.099 5.549 1.00 0.00 C ATOM 974 OD1 ASP A 78 13.439 -5.163 5.616 1.00 0.00 O ATOM 975 OD2 ASP A 78 14.059 -7.146 4.898 1.00 0.00 O ATOM 0 H ASP A 78 13.829 -7.502 7.644 1.00 0.00 H new ATOM 0 HA ASP A 78 16.396 -6.163 8.270 1.00 0.00 H new ATOM 0 HB2 ASP A 78 16.003 -4.979 6.091 1.00 0.00 H new ATOM 0 HB3 ASP A 78 16.282 -6.701 5.922 1.00 0.00 H new ATOM 979 N THR A 79 15.351 -4.059 9.059 1.00 0.00 N ATOM 980 CA THR A 79 14.731 -2.887 9.664 1.00 0.00 C ATOM 981 C THR A 79 14.703 -1.715 8.691 1.00 0.00 C ATOM 982 O THR A 79 14.391 -0.587 9.072 1.00 0.00 O ATOM 983 CB THR A 79 15.472 -2.458 10.946 1.00 0.00 C ATOM 984 OG1 THR A 79 16.794 -2.012 10.620 1.00 0.00 O ATOM 985 CG2 THR A 79 15.551 -3.610 11.937 1.00 0.00 C ATOM 0 H THR A 79 16.359 -4.123 9.199 1.00 0.00 H new ATOM 0 HA THR A 79 13.709 -3.167 9.920 1.00 0.00 H new ATOM 0 HB THR A 79 14.915 -1.642 11.406 1.00 0.00 H new ATOM 0 HG1 THR A 79 17.258 -1.739 11.439 1.00 0.00 H new ATOM 0 HG21 THR A 79 16.078 -3.283 12.833 1.00 0.00 H new ATOM 0 HG22 THR A 79 14.544 -3.930 12.204 1.00 0.00 H new ATOM 0 HG23 THR A 79 16.088 -4.443 11.484 1.00 0.00 H new ATOM 992 N ASP A 80 15.029 -1.989 7.433 1.00 0.00 N ATOM 993 CA ASP A 80 15.039 -0.957 6.404 1.00 0.00 C ATOM 994 C ASP A 80 13.617 -0.560 6.018 1.00 0.00 C ATOM 995 O ASP A 80 12.967 -1.238 5.223 1.00 0.00 O ATOM 996 CB ASP A 80 15.798 -1.445 5.169 1.00 0.00 C ATOM 997 CG ASP A 80 17.296 -1.497 5.392 1.00 0.00 C ATOM 998 OD1 ASP A 80 17.721 -1.473 6.567 1.00 0.00 O ATOM 999 OD2 ASP A 80 18.044 -1.561 4.395 1.00 0.00 O ATOM 0 H ASP A 80 15.290 -2.918 7.101 1.00 0.00 H new ATOM 0 HA ASP A 80 15.545 -0.080 6.809 1.00 0.00 H new ATOM 0 HB2 ASP A 80 15.440 -2.437 4.895 1.00 0.00 H new ATOM 0 HB3 ASP A 80 15.582 -0.785 4.329 1.00 0.00 H new ATOM 1003 N SER A 81 13.141 0.543 6.587 1.00 0.00 N ATOM 1004 CA SER A 81 11.794 1.028 6.307 1.00 0.00 C ATOM 1005 C SER A 81 11.801 2.001 5.132 1.00 0.00 C ATOM 1006 O SER A 81 10.781 2.202 4.475 1.00 0.00 O ATOM 1007 CB SER A 81 11.207 1.708 7.545 1.00 0.00 C ATOM 1008 OG SER A 81 12.214 2.375 8.286 1.00 0.00 O ATOM 0 H SER A 81 13.668 1.118 7.245 1.00 0.00 H new ATOM 0 HA SER A 81 11.173 0.172 6.043 1.00 0.00 H new ATOM 0 HB2 SER A 81 10.441 2.422 7.243 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.719 0.964 8.175 1.00 0.00 H new ATOM 0 HG SER A 81 11.813 2.803 9.071 1.00 0.00 H new ATOM 1013 N GLU A 82 12.959 2.602 4.876 1.00 0.00 N ATOM 1014 CA GLU A 82 13.098 3.555 3.781 1.00 0.00 C ATOM 1015 C GLU A 82 12.738 2.908 2.447 1.00 0.00 C ATOM 1016 O GLU A 82 12.199 3.560 1.554 1.00 0.00 O ATOM 1017 CB GLU A 82 14.527 4.098 3.728 1.00 0.00 C ATOM 1018 CG GLU A 82 14.791 5.217 4.722 1.00 0.00 C ATOM 1019 CD GLU A 82 16.271 5.473 4.933 1.00 0.00 C ATOM 1020 OE1 GLU A 82 17.021 4.493 5.120 1.00 0.00 O ATOM 1021 OE2 GLU A 82 16.678 6.653 4.910 1.00 0.00 O ATOM 0 H GLU A 82 13.813 2.446 5.411 1.00 0.00 H new ATOM 0 HA GLU A 82 12.409 4.380 3.962 1.00 0.00 H new ATOM 0 HB2 GLU A 82 15.224 3.282 3.919 1.00 0.00 H new ATOM 0 HB3 GLU A 82 14.731 4.462 2.721 1.00 0.00 H new ATOM 0 HG2 GLU A 82 14.315 6.132 4.369 1.00 0.00 H new ATOM 0 HG3 GLU A 82 14.330 4.966 5.677 1.00 0.00 H new ATOM 1026 N GLU A 83 13.041 1.620 2.320 1.00 0.00 N ATOM 1027 CA GLU A 83 12.751 0.884 1.094 1.00 0.00 C ATOM 1028 C GLU A 83 11.258 0.915 0.783 1.00 0.00 C ATOM 1029 O GLU A 83 10.842 1.425 -0.257 1.00 0.00 O ATOM 1030 CB GLU A 83 13.228 -0.564 1.218 1.00 0.00 C ATOM 1031 CG GLU A 83 13.553 -1.214 -0.117 1.00 0.00 C ATOM 1032 CD GLU A 83 14.573 -0.426 -0.916 1.00 0.00 C ATOM 1033 OE1 GLU A 83 15.636 -0.090 -0.353 1.00 0.00 O ATOM 1034 OE2 GLU A 83 14.306 -0.143 -2.103 1.00 0.00 O ATOM 0 H GLU A 83 13.487 1.065 3.050 1.00 0.00 H new ATOM 0 HA GLU A 83 13.285 1.366 0.275 1.00 0.00 H new ATOM 0 HB2 GLU A 83 14.114 -0.593 1.852 1.00 0.00 H new ATOM 0 HB3 GLU A 83 12.458 -1.150 1.720 1.00 0.00 H new ATOM 0 HG2 GLU A 83 13.932 -2.221 0.056 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.638 -1.314 -0.701 1.00 0.00 H new ATOM 1039 N GLU A 84 10.457 0.365 1.690 1.00 0.00 N ATOM 1040 CA GLU A 84 9.011 0.328 1.511 1.00 0.00 C ATOM 1041 C GLU A 84 8.446 1.738 1.361 1.00 0.00 C ATOM 1042 O GLU A 84 7.652 2.007 0.458 1.00 0.00 O ATOM 1043 CB GLU A 84 8.346 -0.376 2.695 1.00 0.00 C ATOM 1044 CG GLU A 84 8.769 0.174 4.046 1.00 0.00 C ATOM 1045 CD GLU A 84 8.204 -0.625 5.205 1.00 0.00 C ATOM 1046 OE1 GLU A 84 8.434 -1.852 5.246 1.00 0.00 O ATOM 1047 OE2 GLU A 84 7.532 -0.025 6.069 1.00 0.00 O ATOM 0 H GLU A 84 10.786 -0.061 2.556 1.00 0.00 H new ATOM 0 HA GLU A 84 8.797 -0.230 0.599 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.264 -0.287 2.599 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.583 -1.439 2.655 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.857 0.177 4.108 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.442 1.210 4.131 1.00 0.00 H new ATOM 1052 N ILE A 85 8.860 2.633 2.251 1.00 0.00 N ATOM 1053 CA ILE A 85 8.396 4.015 2.218 1.00 0.00 C ATOM 1054 C ILE A 85 8.612 4.634 0.841 1.00 0.00 C ATOM 1055 O ILE A 85 7.658 4.868 0.098 1.00 0.00 O ATOM 1056 CB ILE A 85 9.114 4.876 3.273 1.00 0.00 C ATOM 1057 CG1 ILE A 85 8.683 4.460 4.681 1.00 0.00 C ATOM 1058 CG2 ILE A 85 8.825 6.352 3.039 1.00 0.00 C ATOM 1059 CD1 ILE A 85 7.218 4.710 4.963 1.00 0.00 C ATOM 0 H ILE A 85 9.516 2.426 3.004 1.00 0.00 H new ATOM 0 HA ILE A 85 7.330 3.995 2.442 1.00 0.00 H new ATOM 0 HB ILE A 85 10.188 4.717 3.180 1.00 0.00 H new ATOM 0 HG12 ILE A 85 8.895 3.400 4.819 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.283 5.003 5.411 1.00 0.00 H new ATOM 0 HG21 ILE A 85 9.340 6.948 3.793 1.00 0.00 H new ATOM 0 HG22 ILE A 85 9.176 6.639 2.048 1.00 0.00 H new ATOM 0 HG23 ILE A 85 7.752 6.528 3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 85 6.983 4.391 5.979 1.00 0.00 H new ATOM 0 HD12 ILE A 85 7.004 5.773 4.858 1.00 0.00 H new ATOM 0 HD13 ILE A 85 6.610 4.145 4.256 1.00 0.00 H new ATOM 1070 N ARG A 86 9.872 4.895 0.506 1.00 0.00 N ATOM 1071 CA ARG A 86 10.212 5.486 -0.782 1.00 0.00 C ATOM 1072 C ARG A 86 9.478 4.778 -1.918 1.00 0.00 C ATOM 1073 O ARG A 86 8.892 5.422 -2.787 1.00 0.00 O ATOM 1074 CB ARG A 86 11.723 5.416 -1.015 1.00 0.00 C ATOM 1075 CG ARG A 86 12.475 6.633 -0.503 1.00 0.00 C ATOM 1076 CD ARG A 86 13.920 6.293 -0.165 1.00 0.00 C ATOM 1077 NE ARG A 86 14.864 7.055 -0.977 1.00 0.00 N ATOM 1078 CZ ARG A 86 15.166 6.751 -2.234 1.00 0.00 C ATOM 1079 NH1 ARG A 86 14.600 5.705 -2.820 1.00 0.00 N ATOM 1080 NH2 ARG A 86 16.037 7.492 -2.908 1.00 0.00 N ATOM 0 H ARG A 86 10.673 4.706 1.109 1.00 0.00 H new ATOM 0 HA ARG A 86 9.900 6.530 -0.768 1.00 0.00 H new ATOM 0 HB2 ARG A 86 12.116 4.524 -0.527 1.00 0.00 H new ATOM 0 HB3 ARG A 86 11.913 5.305 -2.083 1.00 0.00 H new ATOM 0 HG2 ARG A 86 12.452 7.420 -1.257 1.00 0.00 H new ATOM 0 HG3 ARG A 86 11.975 7.025 0.383 1.00 0.00 H new ATOM 0 HD2 ARG A 86 14.103 6.496 0.890 1.00 0.00 H new ATOM 0 HD3 ARG A 86 14.087 5.227 -0.319 1.00 0.00 H new ATOM 0 HE ARG A 86 15.317 7.866 -0.555 1.00 0.00 H new ATOM 0 HH11 ARG A 86 13.931 5.132 -2.305 1.00 0.00 H new ATOM 0 HH12 ARG A 86 14.833 5.473 -3.786 1.00 0.00 H new ATOM 0 HH21 ARG A 86 16.476 8.297 -2.461 1.00 0.00 H new ATOM 0 HH22 ARG A 86 16.267 7.257 -3.873 1.00 0.00 H new ATOM 1091 N GLU A 87 9.516 3.448 -1.901 1.00 0.00 N ATOM 1092 CA GLU A 87 8.855 2.655 -2.930 1.00 0.00 C ATOM 1093 C GLU A 87 7.386 3.047 -3.061 1.00 0.00 C ATOM 1094 O GLU A 87 6.844 3.104 -4.164 1.00 0.00 O ATOM 1095 CB GLU A 87 8.970 1.163 -2.606 1.00 0.00 C ATOM 1096 CG GLU A 87 8.574 0.258 -3.760 1.00 0.00 C ATOM 1097 CD GLU A 87 9.344 0.563 -5.031 1.00 0.00 C ATOM 1098 OE1 GLU A 87 10.587 0.439 -5.015 1.00 0.00 O ATOM 1099 OE2 GLU A 87 8.705 0.924 -6.040 1.00 0.00 O ATOM 0 H GLU A 87 9.996 2.900 -1.188 1.00 0.00 H new ATOM 0 HA GLU A 87 9.351 2.853 -3.880 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.997 0.941 -2.317 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.340 0.937 -1.745 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.744 -0.781 -3.477 1.00 0.00 H new ATOM 0 HG3 GLU A 87 7.506 0.366 -3.952 1.00 0.00 H new ATOM 1104 N ALA A 88 6.748 3.315 -1.927 1.00 0.00 N ATOM 1105 CA ALA A 88 5.344 3.703 -1.914 1.00 0.00 C ATOM 1106 C ALA A 88 5.142 5.059 -2.582 1.00 0.00 C ATOM 1107 O ALA A 88 4.429 5.171 -3.579 1.00 0.00 O ATOM 1108 CB ALA A 88 4.817 3.733 -0.486 1.00 0.00 C ATOM 0 H ALA A 88 7.182 3.270 -1.005 1.00 0.00 H new ATOM 0 HA ALA A 88 4.783 2.960 -2.482 1.00 0.00 H new ATOM 0 HB1 ALA A 88 3.767 4.025 -0.492 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.916 2.743 -0.041 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.390 4.453 0.098 1.00 0.00 H new ATOM 1114 N PHE A 89 5.776 6.086 -2.027 1.00 0.00 N ATOM 1115 CA PHE A 89 5.664 7.436 -2.568 1.00 0.00 C ATOM 1116 C PHE A 89 6.148 7.482 -4.015 1.00 0.00 C ATOM 1117 O PHE A 89 5.816 8.403 -4.761 1.00 0.00 O ATOM 1118 CB PHE A 89 6.471 8.418 -1.716 1.00 0.00 C ATOM 1119 CG PHE A 89 6.636 9.769 -2.353 1.00 0.00 C ATOM 1120 CD1 PHE A 89 5.705 10.771 -2.135 1.00 0.00 C ATOM 1121 CD2 PHE A 89 7.723 10.035 -3.171 1.00 0.00 C ATOM 1122 CE1 PHE A 89 5.855 12.014 -2.719 1.00 0.00 C ATOM 1123 CE2 PHE A 89 7.878 11.277 -3.758 1.00 0.00 C ATOM 1124 CZ PHE A 89 6.941 12.267 -3.532 1.00 0.00 C ATOM 0 H PHE A 89 6.373 6.010 -1.203 1.00 0.00 H new ATOM 0 HA PHE A 89 4.613 7.725 -2.545 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.980 8.538 -0.750 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.456 7.994 -1.522 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.852 10.578 -1.501 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.457 9.264 -3.352 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.123 12.787 -2.539 1.00 0.00 H new ATOM 0 HE2 PHE A 89 8.730 11.473 -4.392 1.00 0.00 H new ATOM 0 HZ PHE A 89 7.058 13.238 -3.991 1.00 0.00 H new ATOM 1133 N ARG A 90 6.937 6.485 -4.401 1.00 0.00 N ATOM 1134 CA ARG A 90 7.469 6.412 -5.757 1.00 0.00 C ATOM 1135 C ARG A 90 6.439 5.821 -6.714 1.00 0.00 C ATOM 1136 O ARG A 90 6.276 6.295 -7.838 1.00 0.00 O ATOM 1137 CB ARG A 90 8.747 5.572 -5.781 1.00 0.00 C ATOM 1138 CG ARG A 90 9.998 6.357 -5.426 1.00 0.00 C ATOM 1139 CD ARG A 90 11.214 5.449 -5.319 1.00 0.00 C ATOM 1140 NE ARG A 90 11.513 4.783 -6.583 1.00 0.00 N ATOM 1141 CZ ARG A 90 12.625 4.088 -6.803 1.00 0.00 C ATOM 1142 NH1 ARG A 90 13.535 3.970 -5.847 1.00 0.00 N ATOM 1143 NH2 ARG A 90 12.826 3.511 -7.981 1.00 0.00 N ATOM 0 H ARG A 90 7.222 5.716 -3.794 1.00 0.00 H new ATOM 0 HA ARG A 90 7.703 7.425 -6.084 1.00 0.00 H new ATOM 0 HB2 ARG A 90 8.639 4.742 -5.083 1.00 0.00 H new ATOM 0 HB3 ARG A 90 8.869 5.140 -6.774 1.00 0.00 H new ATOM 0 HG2 ARG A 90 10.178 7.120 -6.184 1.00 0.00 H new ATOM 0 HG3 ARG A 90 9.846 6.877 -4.480 1.00 0.00 H new ATOM 0 HD2 ARG A 90 12.078 6.035 -5.005 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.040 4.700 -4.547 1.00 0.00 H new ATOM 0 HE ARG A 90 10.832 4.855 -7.339 1.00 0.00 H new ATOM 0 HH11 ARG A 90 13.383 4.413 -4.941 1.00 0.00 H new ATOM 0 HH12 ARG A 90 14.387 3.436 -6.017 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.127 3.600 -8.719 1.00 0.00 H new ATOM 0 HH22 ARG A 90 13.679 2.978 -8.149 1.00 0.00 H new ATOM 1154 N VAL A 91 5.746 4.781 -6.261 1.00 0.00 N ATOM 1155 CA VAL A 91 4.732 4.124 -7.076 1.00 0.00 C ATOM 1156 C VAL A 91 3.460 4.962 -7.151 1.00 0.00 C ATOM 1157 O VAL A 91 2.687 4.853 -8.104 1.00 0.00 O ATOM 1158 CB VAL A 91 4.383 2.730 -6.522 1.00 0.00 C ATOM 1159 CG1 VAL A 91 5.613 1.836 -6.510 1.00 0.00 C ATOM 1160 CG2 VAL A 91 3.783 2.845 -5.129 1.00 0.00 C ATOM 0 H VAL A 91 5.869 4.375 -5.333 1.00 0.00 H new ATOM 0 HA VAL A 91 5.152 4.015 -8.076 1.00 0.00 H new ATOM 0 HB VAL A 91 3.640 2.274 -7.176 1.00 0.00 H new ATOM 0 HG11 VAL A 91 5.346 0.856 -6.115 1.00 0.00 H new ATOM 0 HG12 VAL A 91 5.994 1.727 -7.526 1.00 0.00 H new ATOM 0 HG13 VAL A 91 6.382 2.284 -5.880 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.542 1.851 -4.753 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.501 3.321 -4.462 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.875 3.446 -5.173 1.00 0.00 H new ATOM 1170 N PHE A 92 3.248 5.799 -6.141 1.00 0.00 N ATOM 1171 CA PHE A 92 2.070 6.656 -6.093 1.00 0.00 C ATOM 1172 C PHE A 92 2.146 7.746 -7.157 1.00 0.00 C ATOM 1173 O PHE A 92 1.163 8.029 -7.843 1.00 0.00 O ATOM 1174 CB PHE A 92 1.930 7.289 -4.706 1.00 0.00 C ATOM 1175 CG PHE A 92 1.821 6.282 -3.597 1.00 0.00 C ATOM 1176 CD1 PHE A 92 1.282 5.028 -3.832 1.00 0.00 C ATOM 1177 CD2 PHE A 92 2.257 6.591 -2.319 1.00 0.00 C ATOM 1178 CE1 PHE A 92 1.179 4.100 -2.812 1.00 0.00 C ATOM 1179 CE2 PHE A 92 2.158 5.668 -1.295 1.00 0.00 C ATOM 1180 CZ PHE A 92 1.619 4.420 -1.542 1.00 0.00 C ATOM 0 H PHE A 92 3.877 5.902 -5.345 1.00 0.00 H new ATOM 0 HA PHE A 92 1.194 6.039 -6.293 1.00 0.00 H new ATOM 0 HB2 PHE A 92 2.791 7.931 -4.520 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.047 7.928 -4.694 1.00 0.00 H new ATOM 0 HD1 PHE A 92 0.938 4.772 -4.823 1.00 0.00 H new ATOM 0 HD2 PHE A 92 2.679 7.565 -2.120 1.00 0.00 H new ATOM 0 HE1 PHE A 92 0.755 3.126 -3.008 1.00 0.00 H new ATOM 0 HE2 PHE A 92 2.502 5.922 -0.303 1.00 0.00 H new ATOM 0 HZ PHE A 92 1.542 3.696 -0.744 1.00 0.00 H new ATOM 1189 N ASP A 93 3.319 8.355 -7.288 1.00 0.00 N ATOM 1190 CA ASP A 93 3.526 9.415 -8.269 1.00 0.00 C ATOM 1191 C ASP A 93 3.856 8.831 -9.638 1.00 0.00 C ATOM 1192 O ASP A 93 5.021 8.593 -9.960 1.00 0.00 O ATOM 1193 CB ASP A 93 4.649 10.348 -7.814 1.00 0.00 C ATOM 1194 CG ASP A 93 4.503 11.748 -8.378 1.00 0.00 C ATOM 1195 OD1 ASP A 93 3.463 12.026 -9.013 1.00 0.00 O ATOM 1196 OD2 ASP A 93 5.428 12.564 -8.186 1.00 0.00 O ATOM 0 H ASP A 93 4.142 8.133 -6.727 1.00 0.00 H new ATOM 0 HA ASP A 93 2.601 9.986 -8.351 1.00 0.00 H new ATOM 0 HB2 ASP A 93 4.658 10.397 -6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 93 5.609 9.934 -8.122 1.00 0.00 H new ATOM 1200 N LYS A 94 2.823 8.600 -10.442 1.00 0.00 N ATOM 1201 CA LYS A 94 3.003 8.043 -11.778 1.00 0.00 C ATOM 1202 C LYS A 94 4.067 8.815 -12.551 1.00 0.00 C ATOM 1203 O LYS A 94 4.955 8.222 -13.163 1.00 0.00 O ATOM 1204 CB LYS A 94 1.679 8.072 -12.546 1.00 0.00 C ATOM 1205 CG LYS A 94 0.721 6.963 -12.148 1.00 0.00 C ATOM 1206 CD LYS A 94 -0.279 6.667 -13.254 1.00 0.00 C ATOM 1207 CE LYS A 94 -1.465 7.617 -13.203 1.00 0.00 C ATOM 1208 NZ LYS A 94 -2.403 7.274 -12.098 1.00 0.00 N ATOM 0 H LYS A 94 1.853 8.790 -10.192 1.00 0.00 H new ATOM 0 HA LYS A 94 3.334 7.010 -11.673 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.195 9.035 -12.383 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.886 7.996 -13.613 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.285 6.060 -11.915 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.188 7.249 -11.241 1.00 0.00 H new ATOM 0 HD2 LYS A 94 0.214 6.750 -14.223 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.631 5.639 -13.162 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -1.107 8.638 -13.072 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.997 7.585 -14.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.276 7.831 -12.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.632 6.260 -12.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.957 7.491 -11.184 1.00 0.00 H new ATOM 1218 N ASP A 95 3.974 10.140 -12.516 1.00 0.00 N ATOM 1219 CA ASP A 95 4.931 10.993 -13.211 1.00 0.00 C ATOM 1220 C ASP A 95 6.241 11.084 -12.434 1.00 0.00 C ATOM 1221 O ASP A 95 7.282 11.430 -12.992 1.00 0.00 O ATOM 1222 CB ASP A 95 4.347 12.391 -13.414 1.00 0.00 C ATOM 1223 CG ASP A 95 3.863 13.011 -12.117 1.00 0.00 C ATOM 1224 OD1 ASP A 95 4.614 12.964 -11.120 1.00 0.00 O ATOM 1225 OD2 ASP A 95 2.733 13.543 -12.100 1.00 0.00 O ATOM 0 H ASP A 95 3.245 10.647 -12.013 1.00 0.00 H new ATOM 0 HA ASP A 95 5.136 10.549 -14.185 1.00 0.00 H new ATOM 0 HB2 ASP A 95 5.103 13.036 -13.861 1.00 0.00 H new ATOM 0 HB3 ASP A 95 3.517 12.336 -14.119 1.00 0.00 H new ATOM 1229 N GLY A 96 6.182 10.769 -11.145 1.00 0.00 N ATOM 1230 CA GLY A 96 7.370 10.823 -10.312 1.00 0.00 C ATOM 1231 C GLY A 96 8.045 12.179 -10.352 1.00 0.00 C ATOM 1232 O GLY A 96 9.271 12.271 -10.303 1.00 0.00 O ATOM 0 H GLY A 96 5.333 10.477 -10.661 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.100 10.585 -9.283 1.00 0.00 H new ATOM 0 HA3 GLY A 96 8.075 10.060 -10.641 1.00 0.00 H new ATOM 1235 N ASN A 97 7.244 13.235 -10.445 1.00 0.00 N ATOM 1236 CA ASN A 97 7.772 14.593 -10.494 1.00 0.00 C ATOM 1237 C ASN A 97 8.354 15.001 -9.144 1.00 0.00 C ATOM 1238 O ASN A 97 9.029 16.023 -9.029 1.00 0.00 O ATOM 1239 CB ASN A 97 6.673 15.575 -10.906 1.00 0.00 C ATOM 1240 CG ASN A 97 5.671 15.822 -9.794 1.00 0.00 C ATOM 1241 OD1 ASN A 97 5.816 16.948 -9.106 1.00 0.00 O flip ATOM 1242 ND2 ASN A 97 4.778 15.009 -9.558 1.00 0.00 N flip ATOM 0 H ASN A 97 6.227 13.176 -10.488 1.00 0.00 H new ATOM 0 HA ASN A 97 8.570 14.619 -11.236 1.00 0.00 H new ATOM 0 HB2 ASN A 97 7.127 16.522 -11.199 1.00 0.00 H new ATOM 0 HB3 ASN A 97 6.152 15.187 -11.781 1.00 0.00 H new ATOM 0 HD21 ASN A 97 4.705 14.156 -10.113 1.00 0.00 H new ATOM 0 HD22 ASN A 97 4.111 15.188 -8.807 1.00 0.00 H new ATOM 1248 N GLY A 98 8.087 14.192 -8.123 1.00 0.00 N ATOM 1249 CA GLY A 98 8.591 14.484 -6.793 1.00 0.00 C ATOM 1250 C GLY A 98 7.490 14.880 -5.829 1.00 0.00 C ATOM 1251 O GLY A 98 7.761 15.289 -4.701 1.00 0.00 O ATOM 0 H GLY A 98 7.531 13.340 -8.193 1.00 0.00 H new ATOM 0 HA2 GLY A 98 9.112 13.609 -6.405 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.323 15.289 -6.854 1.00 0.00 H new ATOM 1254 N TYR A 99 6.244 14.758 -6.275 1.00 0.00 N ATOM 1255 CA TYR A 99 5.098 15.110 -5.445 1.00 0.00 C ATOM 1256 C TYR A 99 3.863 14.318 -5.859 1.00 0.00 C ATOM 1257 O TYR A 99 3.630 14.083 -7.045 1.00 0.00 O ATOM 1258 CB TYR A 99 4.813 16.610 -5.543 1.00 0.00 C ATOM 1259 CG TYR A 99 5.959 17.477 -5.073 1.00 0.00 C ATOM 1260 CD1 TYR A 99 6.072 17.851 -3.740 1.00 0.00 C ATOM 1261 CD2 TYR A 99 6.929 17.921 -5.963 1.00 0.00 C ATOM 1262 CE1 TYR A 99 7.117 18.644 -3.307 1.00 0.00 C ATOM 1263 CE2 TYR A 99 7.979 18.712 -5.538 1.00 0.00 C ATOM 1264 CZ TYR A 99 8.068 19.072 -4.209 1.00 0.00 C ATOM 1265 OH TYR A 99 9.111 19.860 -3.782 1.00 0.00 O ATOM 0 H TYR A 99 6.002 14.418 -7.206 1.00 0.00 H new ATOM 0 HA TYR A 99 5.338 14.859 -4.412 1.00 0.00 H new ATOM 0 HB2 TYR A 99 4.580 16.860 -6.578 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.927 16.842 -4.952 1.00 0.00 H new ATOM 0 HD1 TYR A 99 5.330 17.516 -3.030 1.00 0.00 H new ATOM 0 HD2 TYR A 99 6.861 17.643 -7.004 1.00 0.00 H new ATOM 0 HE1 TYR A 99 7.189 18.927 -2.267 1.00 0.00 H new ATOM 0 HE2 TYR A 99 8.726 19.047 -6.242 1.00 0.00 H new ATOM 0 HH TYR A 99 9.692 20.073 -4.542 1.00 0.00 H new ATOM 1274 N ILE A 100 3.073 13.909 -4.872 1.00 0.00 N ATOM 1275 CA ILE A 100 1.860 13.144 -5.132 1.00 0.00 C ATOM 1276 C ILE A 100 0.634 14.050 -5.162 1.00 0.00 C ATOM 1277 O ILE A 100 0.419 14.851 -4.252 1.00 0.00 O ATOM 1278 CB ILE A 100 1.647 12.046 -4.071 1.00 0.00 C ATOM 1279 CG1 ILE A 100 2.768 11.008 -4.149 1.00 0.00 C ATOM 1280 CG2 ILE A 100 0.290 11.385 -4.259 1.00 0.00 C ATOM 1281 CD1 ILE A 100 2.733 9.998 -3.024 1.00 0.00 C ATOM 0 H ILE A 100 3.251 14.095 -3.885 1.00 0.00 H new ATOM 0 HA ILE A 100 1.987 12.675 -6.108 1.00 0.00 H new ATOM 0 HB ILE A 100 1.671 12.505 -3.083 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.700 10.482 -5.101 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.729 11.521 -4.136 1.00 0.00 H new ATOM 0 HG21 ILE A 100 0.154 10.612 -3.503 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -0.496 12.133 -4.159 1.00 0.00 H new ATOM 0 HG23 ILE A 100 0.239 10.935 -5.251 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.556 9.293 -3.142 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.832 10.514 -2.069 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.786 9.458 -3.049 1.00 0.00 H new ATOM 1292 N SER A 101 -0.168 13.917 -6.214 1.00 0.00 N ATOM 1293 CA SER A 101 -1.372 14.726 -6.364 1.00 0.00 C ATOM 1294 C SER A 101 -2.611 13.938 -5.950 1.00 0.00 C ATOM 1295 O SER A 101 -2.563 12.717 -5.805 1.00 0.00 O ATOM 1296 CB SER A 101 -1.516 15.201 -7.811 1.00 0.00 C ATOM 1297 OG SER A 101 -0.630 16.273 -8.086 1.00 0.00 O ATOM 0 H SER A 101 -0.006 13.257 -6.975 1.00 0.00 H new ATOM 0 HA SER A 101 -1.280 15.594 -5.712 1.00 0.00 H new ATOM 0 HB2 SER A 101 -1.313 14.373 -8.491 1.00 0.00 H new ATOM 0 HB3 SER A 101 -2.543 15.518 -7.993 1.00 0.00 H new ATOM 0 HG SER A 101 -0.740 16.558 -9.017 1.00 0.00 H new ATOM 1302 N ALA A 102 -3.720 14.647 -5.761 1.00 0.00 N ATOM 1303 CA ALA A 102 -4.973 14.014 -5.366 1.00 0.00 C ATOM 1304 C ALA A 102 -5.378 12.930 -6.360 1.00 0.00 C ATOM 1305 O ALA A 102 -5.946 11.908 -5.979 1.00 0.00 O ATOM 1306 CB ALA A 102 -6.073 15.057 -5.241 1.00 0.00 C ATOM 0 H ALA A 102 -3.776 15.659 -5.875 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.823 13.541 -4.395 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -7.003 14.571 -4.946 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -5.793 15.793 -4.487 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -6.213 15.555 -6.200 1.00 0.00 H new ATOM 1312 N ALA A 103 -5.082 13.163 -7.634 1.00 0.00 N ATOM 1313 CA ALA A 103 -5.415 12.205 -8.682 1.00 0.00 C ATOM 1314 C ALA A 103 -4.681 10.886 -8.473 1.00 0.00 C ATOM 1315 O ALA A 103 -5.293 9.819 -8.467 1.00 0.00 O ATOM 1316 CB ALA A 103 -5.085 12.784 -10.050 1.00 0.00 C ATOM 0 H ALA A 103 -4.613 14.006 -7.966 1.00 0.00 H new ATOM 0 HA ALA A 103 -6.486 12.007 -8.632 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.338 12.058 -10.823 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -5.659 13.697 -10.207 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -4.020 13.012 -10.101 1.00 0.00 H new ATOM 1322 N GLU A 104 -3.365 10.966 -8.304 1.00 0.00 N ATOM 1323 CA GLU A 104 -2.547 9.776 -8.096 1.00 0.00 C ATOM 1324 C GLU A 104 -3.018 9.000 -6.870 1.00 0.00 C ATOM 1325 O GLU A 104 -3.162 7.778 -6.912 1.00 0.00 O ATOM 1326 CB GLU A 104 -1.075 10.163 -7.935 1.00 0.00 C ATOM 1327 CG GLU A 104 -0.326 10.267 -9.253 1.00 0.00 C ATOM 1328 CD GLU A 104 0.727 11.358 -9.239 1.00 0.00 C ATOM 1329 OE1 GLU A 104 1.034 11.873 -8.143 1.00 0.00 O ATOM 1330 OE2 GLU A 104 1.245 11.698 -10.324 1.00 0.00 O ATOM 0 H GLU A 104 -2.842 11.842 -8.307 1.00 0.00 H new ATOM 0 HA GLU A 104 -2.653 9.136 -8.972 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.014 11.119 -7.416 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -0.581 9.425 -7.303 1.00 0.00 H new ATOM 0 HG2 GLU A 104 0.149 9.311 -9.473 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.036 10.463 -10.056 1.00 0.00 H new ATOM 1335 N LEU A 105 -3.256 9.718 -5.778 1.00 0.00 N ATOM 1336 CA LEU A 105 -3.711 9.098 -4.538 1.00 0.00 C ATOM 1337 C LEU A 105 -5.101 8.494 -4.708 1.00 0.00 C ATOM 1338 O LEU A 105 -5.284 7.284 -4.572 1.00 0.00 O ATOM 1339 CB LEU A 105 -3.724 10.127 -3.406 1.00 0.00 C ATOM 1340 CG LEU A 105 -3.300 9.615 -2.029 1.00 0.00 C ATOM 1341 CD1 LEU A 105 -1.832 9.219 -2.034 1.00 0.00 C ATOM 1342 CD2 LEU A 105 -3.567 10.667 -0.962 1.00 0.00 C ATOM 0 H LEU A 105 -3.142 10.730 -5.726 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.016 8.297 -4.285 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.067 10.951 -3.683 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -4.731 10.536 -3.325 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.892 8.731 -1.795 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.549 8.857 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -1.670 8.430 -2.769 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.222 10.085 -2.291 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.259 10.285 0.011 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -3.002 11.570 -1.192 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.631 10.901 -0.940 1.00 0.00 H new ATOM 1353 N ARG A 106 -6.077 9.345 -5.010 1.00 0.00 N ATOM 1354 CA ARG A 106 -7.450 8.894 -5.200 1.00 0.00 C ATOM 1355 C ARG A 106 -7.507 7.719 -6.171 1.00 0.00 C ATOM 1356 O ARG A 106 -8.367 6.845 -6.055 1.00 0.00 O ATOM 1357 CB ARG A 106 -8.318 10.042 -5.720 1.00 0.00 C ATOM 1358 CG ARG A 106 -8.155 10.303 -7.208 1.00 0.00 C ATOM 1359 CD ARG A 106 -9.066 11.425 -7.680 1.00 0.00 C ATOM 1360 NE ARG A 106 -10.469 11.017 -7.706 1.00 0.00 N ATOM 1361 CZ ARG A 106 -10.992 10.243 -8.650 1.00 0.00 C ATOM 1362 NH1 ARG A 106 -10.234 9.797 -9.642 1.00 0.00 N ATOM 1363 NH2 ARG A 106 -12.278 9.916 -8.605 1.00 0.00 N ATOM 0 H ARG A 106 -5.942 10.349 -5.128 1.00 0.00 H new ATOM 0 HA ARG A 106 -7.835 8.564 -4.235 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.364 9.818 -5.511 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -8.071 10.951 -5.171 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -7.118 10.561 -7.422 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -8.378 9.393 -7.765 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -8.951 12.286 -7.022 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -8.762 11.743 -8.677 1.00 0.00 H new ATOM 0 HE ARG A 106 -11.080 11.345 -6.958 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -9.246 10.048 -9.682 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -10.639 9.203 -10.366 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -12.865 10.259 -7.845 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -12.679 9.322 -9.331 1.00 0.00 H new ATOM 1374 N HIS A 107 -6.586 7.704 -7.129 1.00 0.00 N ATOM 1375 CA HIS A 107 -6.531 6.636 -8.121 1.00 0.00 C ATOM 1376 C HIS A 107 -6.000 5.347 -7.502 1.00 0.00 C ATOM 1377 O HIS A 107 -6.545 4.266 -7.729 1.00 0.00 O ATOM 1378 CB HIS A 107 -5.650 7.050 -9.300 1.00 0.00 C ATOM 1379 CG HIS A 107 -6.366 7.878 -10.322 1.00 0.00 C ATOM 1380 ND1 HIS A 107 -7.707 7.726 -10.608 1.00 0.00 N ATOM 1381 CD2 HIS A 107 -5.922 8.873 -11.126 1.00 0.00 C ATOM 1382 CE1 HIS A 107 -8.055 8.589 -11.546 1.00 0.00 C ATOM 1383 NE2 HIS A 107 -6.990 9.297 -11.877 1.00 0.00 N ATOM 0 H HIS A 107 -5.867 8.419 -7.240 1.00 0.00 H new ATOM 0 HA HIS A 107 -7.544 6.456 -8.481 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -4.795 7.612 -8.924 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -5.257 6.154 -9.781 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -4.915 9.261 -11.168 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -9.042 8.697 -11.970 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -6.965 10.038 -12.577 1.00 0.00 H new ATOM 1386 N VAL A 108 -4.933 5.467 -6.719 1.00 0.00 N ATOM 1387 CA VAL A 108 -4.328 4.312 -6.067 1.00 0.00 C ATOM 1388 C VAL A 108 -5.280 3.696 -5.048 1.00 0.00 C ATOM 1389 O VAL A 108 -5.231 2.494 -4.786 1.00 0.00 O ATOM 1390 CB VAL A 108 -3.012 4.691 -5.362 1.00 0.00 C ATOM 1391 CG1 VAL A 108 -2.467 3.507 -4.577 1.00 0.00 C ATOM 1392 CG2 VAL A 108 -1.990 5.188 -6.373 1.00 0.00 C ATOM 0 H VAL A 108 -4.469 6.354 -6.521 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.115 3.582 -6.848 1.00 0.00 H new ATOM 0 HB VAL A 108 -3.216 5.499 -4.659 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.537 3.793 -4.086 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -3.196 3.202 -3.826 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -2.277 2.676 -5.257 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.066 5.451 -5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.788 4.403 -7.102 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -2.383 6.066 -6.885 1.00 0.00 H new ATOM 1402 N MET A 109 -6.144 4.527 -4.476 1.00 0.00 N ATOM 1403 CA MET A 109 -7.109 4.063 -3.486 1.00 0.00 C ATOM 1404 C MET A 109 -8.380 3.558 -4.161 1.00 0.00 C ATOM 1405 O MET A 109 -8.931 2.525 -3.779 1.00 0.00 O ATOM 1406 CB MET A 109 -7.449 5.189 -2.508 1.00 0.00 C ATOM 1407 CG MET A 109 -8.142 4.707 -1.243 1.00 0.00 C ATOM 1408 SD MET A 109 -6.979 4.187 0.032 1.00 0.00 S ATOM 1409 CE MET A 109 -6.123 5.726 0.357 1.00 0.00 C ATOM 0 H MET A 109 -6.196 5.525 -4.681 1.00 0.00 H new ATOM 0 HA MET A 109 -6.659 3.237 -2.935 1.00 0.00 H new ATOM 0 HB2 MET A 109 -6.532 5.710 -2.234 1.00 0.00 H new ATOM 0 HB3 MET A 109 -8.090 5.914 -3.010 1.00 0.00 H new ATOM 0 HG2 MET A 109 -8.771 5.506 -0.851 1.00 0.00 H new ATOM 0 HG3 MET A 109 -8.801 3.874 -1.489 1.00 0.00 H new ATOM 0 HE1 MET A 109 -5.870 5.785 1.416 1.00 0.00 H new ATOM 0 HE2 MET A 109 -5.210 5.767 -0.237 1.00 0.00 H new ATOM 0 HE3 MET A 109 -6.767 6.564 0.091 1.00 0.00 H new ATOM 1417 N THR A 110 -8.844 4.294 -5.166 1.00 0.00 N ATOM 1418 CA THR A 110 -10.051 3.923 -5.893 1.00 0.00 C ATOM 1419 C THR A 110 -9.836 2.648 -6.701 1.00 0.00 C ATOM 1420 O THR A 110 -10.668 1.743 -6.684 1.00 0.00 O ATOM 1421 CB THR A 110 -10.505 5.048 -6.842 1.00 0.00 C ATOM 1422 OG1 THR A 110 -10.876 6.206 -6.086 1.00 0.00 O ATOM 1423 CG2 THR A 110 -11.680 4.595 -7.696 1.00 0.00 C ATOM 0 H THR A 110 -8.401 5.152 -5.495 1.00 0.00 H new ATOM 0 HA THR A 110 -10.828 3.752 -5.148 1.00 0.00 H new ATOM 0 HB THR A 110 -9.673 5.296 -7.501 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.108 6.810 -6.015 1.00 0.00 H new ATOM 0 HG21 THR A 110 -11.983 5.406 -8.358 1.00 0.00 H new ATOM 0 HG22 THR A 110 -11.385 3.731 -8.292 1.00 0.00 H new ATOM 0 HG23 THR A 110 -12.515 4.322 -7.051 1.00 0.00 H new ATOM 1430 N ASN A 111 -8.712 2.584 -7.408 1.00 0.00 N ATOM 1431 CA ASN A 111 -8.387 1.419 -8.224 1.00 0.00 C ATOM 1432 C ASN A 111 -8.313 0.160 -7.367 1.00 0.00 C ATOM 1433 O ASN A 111 -8.698 -0.926 -7.804 1.00 0.00 O ATOM 1434 CB ASN A 111 -7.058 1.634 -8.951 1.00 0.00 C ATOM 1435 CG ASN A 111 -7.186 2.596 -10.117 1.00 0.00 C ATOM 1436 OD1 ASN A 111 -6.424 3.557 -10.230 1.00 0.00 O ATOM 1437 ND2 ASN A 111 -8.152 2.340 -10.991 1.00 0.00 N ATOM 0 H ASN A 111 -8.011 3.325 -7.432 1.00 0.00 H new ATOM 0 HA ASN A 111 -9.179 1.290 -8.961 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -6.320 2.017 -8.247 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -6.686 0.676 -9.313 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -8.286 2.951 -11.796 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -8.760 1.532 -10.857 1.00 0.00 H new ATOM 1443 N LEU A 112 -7.816 0.311 -6.144 1.00 0.00 N ATOM 1444 CA LEU A 112 -7.692 -0.814 -5.225 1.00 0.00 C ATOM 1445 C LEU A 112 -9.064 -1.347 -4.825 1.00 0.00 C ATOM 1446 O LEU A 112 -9.207 -2.509 -4.448 1.00 0.00 O ATOM 1447 CB LEU A 112 -6.913 -0.396 -3.976 1.00 0.00 C ATOM 1448 CG LEU A 112 -5.564 -1.084 -3.763 1.00 0.00 C ATOM 1449 CD1 LEU A 112 -5.731 -2.596 -3.765 1.00 0.00 C ATOM 1450 CD2 LEU A 112 -4.571 -0.655 -4.833 1.00 0.00 C ATOM 0 H LEU A 112 -7.493 1.202 -5.766 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.149 -1.608 -5.737 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.746 0.680 -4.020 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.537 -0.586 -3.103 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.173 -0.782 -2.791 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.761 -3.069 -3.612 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.408 -2.888 -2.962 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.144 -2.915 -4.722 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.617 -1.155 -4.665 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.955 -0.927 -5.816 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -4.429 0.425 -4.785 1.00 0.00 H new ATOM 1461 N GLY A 113 -10.076 -0.487 -4.914 1.00 0.00 N ATOM 1462 CA GLY A 113 -11.425 -0.889 -4.561 1.00 0.00 C ATOM 1463 C GLY A 113 -11.902 -0.249 -3.273 1.00 0.00 C ATOM 1464 O GLY A 113 -13.101 -0.221 -2.994 1.00 0.00 O ATOM 0 H GLY A 113 -9.985 0.480 -5.224 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -12.104 -0.620 -5.370 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -11.463 -1.974 -4.460 1.00 0.00 H new ATOM 1467 N GLU A 114 -10.964 0.267 -2.486 1.00 0.00 N ATOM 1468 CA GLU A 114 -11.297 0.908 -1.219 1.00 0.00 C ATOM 1469 C GLU A 114 -12.165 2.141 -1.445 1.00 0.00 C ATOM 1470 O GLU A 114 -11.687 3.174 -1.916 1.00 0.00 O ATOM 1471 CB GLU A 114 -10.021 1.299 -0.470 1.00 0.00 C ATOM 1472 CG GLU A 114 -9.118 0.120 -0.148 1.00 0.00 C ATOM 1473 CD GLU A 114 -7.991 0.488 0.798 1.00 0.00 C ATOM 1474 OE1 GLU A 114 -8.268 1.145 1.824 1.00 0.00 O ATOM 1475 OE2 GLU A 114 -6.833 0.121 0.511 1.00 0.00 O ATOM 0 H GLU A 114 -9.967 0.254 -2.703 1.00 0.00 H new ATOM 0 HA GLU A 114 -11.860 0.195 -0.617 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -9.464 2.019 -1.070 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -10.294 1.801 0.458 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -9.713 -0.678 0.296 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -8.697 -0.273 -1.073 1.00 0.00 H new ATOM 1480 N LYS A 115 -13.445 2.026 -1.107 1.00 0.00 N ATOM 1481 CA LYS A 115 -14.382 3.131 -1.272 1.00 0.00 C ATOM 1482 C LYS A 115 -13.983 4.318 -0.400 1.00 0.00 C ATOM 1483 O LYS A 115 -13.555 4.145 0.742 1.00 0.00 O ATOM 1484 CB LYS A 115 -15.801 2.680 -0.919 1.00 0.00 C ATOM 1485 CG LYS A 115 -16.845 3.769 -1.088 1.00 0.00 C ATOM 1486 CD LYS A 115 -18.231 3.279 -0.700 1.00 0.00 C ATOM 1487 CE LYS A 115 -19.104 4.417 -0.194 1.00 0.00 C ATOM 1488 NZ LYS A 115 -19.635 5.247 -1.311 1.00 0.00 N ATOM 0 H LYS A 115 -13.857 1.178 -0.717 1.00 0.00 H new ATOM 0 HA LYS A 115 -14.355 3.444 -2.316 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -16.070 1.830 -1.547 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -15.816 2.331 0.114 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -16.577 4.629 -0.474 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -16.855 4.107 -2.124 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -18.706 2.810 -1.561 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -18.145 2.514 0.072 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -19.935 4.009 0.382 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -18.525 5.046 0.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -20.225 6.012 -0.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -18.843 5.657 -1.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -20.209 4.653 -1.943 1.00 0.00 H new ATOM 1498 N LEU A 116 -14.129 5.520 -0.944 1.00 0.00 N ATOM 1499 CA LEU A 116 -13.785 6.737 -0.215 1.00 0.00 C ATOM 1500 C LEU A 116 -14.550 7.936 -0.767 1.00 0.00 C ATOM 1501 O LEU A 116 -15.006 7.924 -1.910 1.00 0.00 O ATOM 1502 CB LEU A 116 -12.280 6.995 -0.295 1.00 0.00 C ATOM 1503 CG LEU A 116 -11.749 7.451 -1.654 1.00 0.00 C ATOM 1504 CD1 LEU A 116 -12.319 6.585 -2.768 1.00 0.00 C ATOM 1505 CD2 LEU A 116 -12.083 8.916 -1.892 1.00 0.00 C ATOM 0 H LEU A 116 -14.483 5.679 -1.887 1.00 0.00 H new ATOM 0 HA LEU A 116 -14.067 6.599 0.829 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -12.021 7.751 0.446 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -11.759 6.080 -0.012 1.00 0.00 H new ATOM 0 HG LEU A 116 -10.665 7.341 -1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -11.930 6.924 -3.728 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -12.030 5.547 -2.606 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -13.406 6.663 -2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -11.698 9.224 -2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -13.164 9.051 -1.871 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -11.627 9.525 -1.111 1.00 0.00 H new ATOM 1516 N THR A 117 -14.684 8.974 0.054 1.00 0.00 N ATOM 1517 CA THR A 117 -15.391 10.182 -0.351 1.00 0.00 C ATOM 1518 C THR A 117 -14.430 11.356 -0.503 1.00 0.00 C ATOM 1519 O THR A 117 -13.258 11.263 -0.138 1.00 0.00 O ATOM 1520 CB THR A 117 -16.487 10.558 0.663 1.00 0.00 C ATOM 1521 OG1 THR A 117 -16.065 10.220 1.989 1.00 0.00 O ATOM 1522 CG2 THR A 117 -17.790 9.843 0.342 1.00 0.00 C ATOM 0 H THR A 117 -14.312 9.001 1.003 1.00 0.00 H new ATOM 0 HA THR A 117 -15.855 9.969 -1.314 1.00 0.00 H new ATOM 0 HB THR A 117 -16.656 11.633 0.599 1.00 0.00 H new ATOM 0 HG1 THR A 117 -16.767 10.464 2.628 1.00 0.00 H new ATOM 0 HG21 THR A 117 -18.549 10.125 1.072 1.00 0.00 H new ATOM 0 HG22 THR A 117 -18.124 10.126 -0.656 1.00 0.00 H new ATOM 0 HG23 THR A 117 -17.632 8.765 0.380 1.00 0.00 H new ATOM 1529 N ASP A 118 -14.934 12.460 -1.043 1.00 0.00 N ATOM 1530 CA ASP A 118 -14.121 13.655 -1.241 1.00 0.00 C ATOM 1531 C ASP A 118 -13.389 14.032 0.043 1.00 0.00 C ATOM 1532 O ASP A 118 -12.227 14.438 0.009 1.00 0.00 O ATOM 1533 CB ASP A 118 -14.994 14.820 -1.707 1.00 0.00 C ATOM 1534 CG ASP A 118 -15.402 14.693 -3.162 1.00 0.00 C ATOM 1535 OD1 ASP A 118 -14.531 14.370 -3.997 1.00 0.00 O ATOM 1536 OD2 ASP A 118 -16.592 14.917 -3.465 1.00 0.00 O ATOM 0 H ASP A 118 -15.902 12.553 -1.352 1.00 0.00 H new ATOM 0 HA ASP A 118 -13.380 13.438 -2.010 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -15.888 14.872 -1.085 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -14.453 15.755 -1.565 1.00 0.00 H new ATOM 1540 N GLU A 119 -14.076 13.897 1.172 1.00 0.00 N ATOM 1541 CA GLU A 119 -13.491 14.227 2.467 1.00 0.00 C ATOM 1542 C GLU A 119 -12.293 13.329 2.766 1.00 0.00 C ATOM 1543 O GLU A 119 -11.271 13.789 3.275 1.00 0.00 O ATOM 1544 CB GLU A 119 -14.537 14.087 3.574 1.00 0.00 C ATOM 1545 CG GLU A 119 -14.092 14.669 4.906 1.00 0.00 C ATOM 1546 CD GLU A 119 -15.163 14.561 5.976 1.00 0.00 C ATOM 1547 OE1 GLU A 119 -16.043 15.446 6.023 1.00 0.00 O ATOM 1548 OE2 GLU A 119 -15.120 13.595 6.764 1.00 0.00 O ATOM 0 H GLU A 119 -15.038 13.562 1.217 1.00 0.00 H new ATOM 0 HA GLU A 119 -13.148 15.261 2.431 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.456 14.582 3.259 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.773 13.031 3.708 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -13.194 14.152 5.243 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -13.824 15.717 4.769 1.00 0.00 H new ATOM 1553 N GLU A 120 -12.429 12.046 2.448 1.00 0.00 N ATOM 1554 CA GLU A 120 -11.359 11.084 2.684 1.00 0.00 C ATOM 1555 C GLU A 120 -10.050 11.561 2.062 1.00 0.00 C ATOM 1556 O GLU A 120 -9.110 11.927 2.768 1.00 0.00 O ATOM 1557 CB GLU A 120 -11.738 9.715 2.114 1.00 0.00 C ATOM 1558 CG GLU A 120 -10.904 8.573 2.668 1.00 0.00 C ATOM 1559 CD GLU A 120 -10.940 8.504 4.183 1.00 0.00 C ATOM 1560 OE1 GLU A 120 -10.143 9.219 4.827 1.00 0.00 O ATOM 1561 OE2 GLU A 120 -11.763 7.736 4.723 1.00 0.00 O ATOM 0 H GLU A 120 -13.269 11.649 2.027 1.00 0.00 H new ATOM 0 HA GLU A 120 -11.218 10.995 3.761 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -12.790 9.521 2.325 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -11.630 9.740 1.030 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -11.266 7.631 2.257 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -9.872 8.689 2.338 1.00 0.00 H new ATOM 1566 N VAL A 121 -9.997 11.554 0.733 1.00 0.00 N ATOM 1567 CA VAL A 121 -8.804 11.987 0.014 1.00 0.00 C ATOM 1568 C VAL A 121 -8.389 13.393 0.434 1.00 0.00 C ATOM 1569 O VAL A 121 -7.220 13.644 0.725 1.00 0.00 O ATOM 1570 CB VAL A 121 -9.028 11.962 -1.509 1.00 0.00 C ATOM 1571 CG1 VAL A 121 -7.927 12.732 -2.223 1.00 0.00 C ATOM 1572 CG2 VAL A 121 -9.102 10.529 -2.014 1.00 0.00 C ATOM 0 H VAL A 121 -10.765 11.254 0.133 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.009 11.286 0.268 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.979 12.448 -1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -8.102 12.704 -3.299 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -7.928 13.767 -1.883 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -6.962 12.277 -2.000 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -9.261 10.531 -3.092 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -8.169 10.014 -1.785 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -9.930 10.014 -1.527 1.00 0.00 H new ATOM 1582 N ASP A 122 -9.355 14.305 0.463 1.00 0.00 N ATOM 1583 CA ASP A 122 -9.090 15.685 0.849 1.00 0.00 C ATOM 1584 C ASP A 122 -8.336 15.745 2.174 1.00 0.00 C ATOM 1585 O ASP A 122 -7.351 16.470 2.306 1.00 0.00 O ATOM 1586 CB ASP A 122 -10.400 16.467 0.957 1.00 0.00 C ATOM 1587 CG ASP A 122 -10.189 17.886 1.446 1.00 0.00 C ATOM 1588 OD1 ASP A 122 -9.806 18.746 0.626 1.00 0.00 O ATOM 1589 OD2 ASP A 122 -10.406 18.138 2.651 1.00 0.00 O ATOM 0 H ASP A 122 -10.328 14.113 0.224 1.00 0.00 H new ATOM 0 HA ASP A 122 -8.467 16.138 0.078 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -10.887 16.491 -0.018 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -11.075 15.948 1.638 1.00 0.00 H new ATOM 1593 N GLU A 123 -8.807 14.977 3.152 1.00 0.00 N ATOM 1594 CA GLU A 123 -8.179 14.945 4.467 1.00 0.00 C ATOM 1595 C GLU A 123 -6.793 14.312 4.392 1.00 0.00 C ATOM 1596 O GLU A 123 -5.866 14.736 5.081 1.00 0.00 O ATOM 1597 CB GLU A 123 -9.052 14.171 5.456 1.00 0.00 C ATOM 1598 CG GLU A 123 -8.726 14.457 6.911 1.00 0.00 C ATOM 1599 CD GLU A 123 -9.615 13.692 7.872 1.00 0.00 C ATOM 1600 OE1 GLU A 123 -10.784 13.432 7.516 1.00 0.00 O ATOM 1601 OE2 GLU A 123 -9.144 13.354 8.977 1.00 0.00 O ATOM 0 H GLU A 123 -9.621 14.369 3.058 1.00 0.00 H new ATOM 0 HA GLU A 123 -8.073 15.972 4.815 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -10.098 14.416 5.272 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -8.937 13.103 5.270 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -7.684 14.199 7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -8.830 15.526 7.099 1.00 0.00 H new ATOM 1606 N MET A 124 -6.659 13.293 3.548 1.00 0.00 N ATOM 1607 CA MET A 124 -5.386 12.601 3.382 1.00 0.00 C ATOM 1608 C MET A 124 -4.305 13.561 2.892 1.00 0.00 C ATOM 1609 O MET A 124 -3.167 13.516 3.358 1.00 0.00 O ATOM 1610 CB MET A 124 -5.537 11.439 2.397 1.00 0.00 C ATOM 1611 CG MET A 124 -5.701 10.088 3.074 1.00 0.00 C ATOM 1612 SD MET A 124 -5.766 8.725 1.894 1.00 0.00 S ATOM 1613 CE MET A 124 -4.023 8.475 1.568 1.00 0.00 C ATOM 0 H MET A 124 -7.416 12.929 2.969 1.00 0.00 H new ATOM 0 HA MET A 124 -5.085 12.208 4.353 1.00 0.00 H new ATOM 0 HB2 MET A 124 -6.401 11.624 1.759 1.00 0.00 H new ATOM 0 HB3 MET A 124 -4.662 11.407 1.748 1.00 0.00 H new ATOM 0 HG2 MET A 124 -4.872 9.928 3.763 1.00 0.00 H new ATOM 0 HG3 MET A 124 -6.614 10.092 3.669 1.00 0.00 H new ATOM 0 HE1 MET A 124 -3.882 8.220 0.518 1.00 0.00 H new ATOM 0 HE2 MET A 124 -3.475 9.389 1.796 1.00 0.00 H new ATOM 0 HE3 MET A 124 -3.649 7.663 2.192 1.00 0.00 H new ATOM 1621 N ILE A 125 -4.670 14.425 1.951 1.00 0.00 N ATOM 1622 CA ILE A 125 -3.732 15.394 1.401 1.00 0.00 C ATOM 1623 C ILE A 125 -3.536 16.571 2.350 1.00 0.00 C ATOM 1624 O ILE A 125 -2.410 17.012 2.585 1.00 0.00 O ATOM 1625 CB ILE A 125 -4.207 15.925 0.035 1.00 0.00 C ATOM 1626 CG1 ILE A 125 -4.190 14.804 -1.006 1.00 0.00 C ATOM 1627 CG2 ILE A 125 -3.335 17.087 -0.415 1.00 0.00 C ATOM 1628 CD1 ILE A 125 -2.815 14.220 -1.242 1.00 0.00 C ATOM 0 H ILE A 125 -5.608 14.473 1.554 1.00 0.00 H new ATOM 0 HA ILE A 125 -2.783 14.874 1.270 1.00 0.00 H new ATOM 0 HB ILE A 125 -5.231 16.284 0.138 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -4.863 14.009 -0.684 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -4.579 15.189 -1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -3.684 17.451 -1.382 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -3.394 17.891 0.318 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -2.301 16.753 -0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -2.878 13.431 -1.991 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.143 15.002 -1.595 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.431 13.805 -0.310 1.00 0.00 H new ATOM 1639 N ARG A 126 -4.639 17.074 2.896 1.00 0.00 N ATOM 1640 CA ARG A 126 -4.588 18.199 3.821 1.00 0.00 C ATOM 1641 C ARG A 126 -3.789 17.840 5.071 1.00 0.00 C ATOM 1642 O ARG A 126 -3.206 18.710 5.716 1.00 0.00 O ATOM 1643 CB ARG A 126 -6.003 18.628 4.214 1.00 0.00 C ATOM 1644 CG ARG A 126 -6.502 17.981 5.496 1.00 0.00 C ATOM 1645 CD ARG A 126 -7.948 18.355 5.782 1.00 0.00 C ATOM 1646 NE ARG A 126 -8.114 19.794 5.970 1.00 0.00 N ATOM 1647 CZ ARG A 126 -9.234 20.351 6.418 1.00 0.00 C ATOM 1648 NH1 ARG A 126 -10.279 19.596 6.723 1.00 0.00 N ATOM 1649 NH2 ARG A 126 -9.309 21.668 6.562 1.00 0.00 N ATOM 0 H ARG A 126 -5.578 16.720 2.713 1.00 0.00 H new ATOM 0 HA ARG A 126 -4.090 19.028 3.318 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -6.026 19.711 4.331 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -6.687 18.381 3.402 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -6.414 16.897 5.416 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -5.873 18.291 6.330 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -8.578 18.022 4.958 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -8.288 17.831 6.675 1.00 0.00 H new ATOM 0 HE ARG A 126 -7.328 20.404 5.745 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -10.226 18.583 6.614 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -11.137 20.027 7.067 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -8.507 22.253 6.329 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -10.169 22.095 6.906 1.00 0.00 H new ATOM 1660 N GLU A 127 -3.768 16.554 5.405 1.00 0.00 N ATOM 1661 CA GLU A 127 -3.041 16.081 6.578 1.00 0.00 C ATOM 1662 C GLU A 127 -1.607 15.709 6.214 1.00 0.00 C ATOM 1663 O GLU A 127 -0.672 15.999 6.961 1.00 0.00 O ATOM 1664 CB GLU A 127 -3.753 14.874 7.193 1.00 0.00 C ATOM 1665 CG GLU A 127 -5.091 15.215 7.829 1.00 0.00 C ATOM 1666 CD GLU A 127 -4.940 16.005 9.116 1.00 0.00 C ATOM 1667 OE1 GLU A 127 -3.799 16.116 9.612 1.00 0.00 O ATOM 1668 OE2 GLU A 127 -5.961 16.510 9.625 1.00 0.00 O ATOM 0 H GLU A 127 -4.246 15.821 4.881 1.00 0.00 H new ATOM 0 HA GLU A 127 -3.014 16.889 7.309 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -3.909 14.122 6.420 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -3.106 14.426 7.947 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -5.689 15.790 7.122 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -5.637 14.294 8.034 1.00 0.00 H new ATOM 1673 N ALA A 128 -1.441 15.066 5.064 1.00 0.00 N ATOM 1674 CA ALA A 128 -0.121 14.655 4.602 1.00 0.00 C ATOM 1675 C ALA A 128 0.712 15.860 4.178 1.00 0.00 C ATOM 1676 O ALA A 128 1.941 15.824 4.226 1.00 0.00 O ATOM 1677 CB ALA A 128 -0.249 13.668 3.450 1.00 0.00 C ATOM 0 H ALA A 128 -2.204 14.818 4.434 1.00 0.00 H new ATOM 0 HA ALA A 128 0.391 14.166 5.431 1.00 0.00 H new ATOM 0 HB1 ALA A 128 0.744 13.369 3.115 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.799 12.788 3.784 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.784 14.139 2.625 1.00 0.00 H new ATOM 1683 N ASP A 129 0.034 16.925 3.764 1.00 0.00 N ATOM 1684 CA ASP A 129 0.712 18.142 3.332 1.00 0.00 C ATOM 1685 C ASP A 129 0.611 19.227 4.399 1.00 0.00 C ATOM 1686 O ASP A 129 -0.452 19.813 4.604 1.00 0.00 O ATOM 1687 CB ASP A 129 0.114 18.645 2.017 1.00 0.00 C ATOM 1688 CG ASP A 129 1.007 19.656 1.325 1.00 0.00 C ATOM 1689 OD1 ASP A 129 2.167 19.820 1.759 1.00 0.00 O ATOM 1690 OD2 ASP A 129 0.547 20.282 0.347 1.00 0.00 O ATOM 0 H ASP A 129 -0.984 16.970 3.718 1.00 0.00 H new ATOM 0 HA ASP A 129 1.765 17.907 3.177 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -0.056 17.799 1.351 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -0.858 19.097 2.213 1.00 0.00 H new ATOM 1694 N ILE A 130 1.725 19.489 5.076 1.00 0.00 N ATOM 1695 CA ILE A 130 1.762 20.504 6.122 1.00 0.00 C ATOM 1696 C ILE A 130 1.697 21.907 5.528 1.00 0.00 C ATOM 1697 O ILE A 130 1.465 22.883 6.242 1.00 0.00 O ATOM 1698 CB ILE A 130 3.034 20.380 6.981 1.00 0.00 C ATOM 1699 CG1 ILE A 130 4.221 21.033 6.271 1.00 0.00 C ATOM 1700 CG2 ILE A 130 3.328 18.919 7.283 1.00 0.00 C ATOM 1701 CD1 ILE A 130 4.599 20.352 4.974 1.00 0.00 C ATOM 0 H ILE A 130 2.613 19.013 4.919 1.00 0.00 H new ATOM 0 HA ILE A 130 0.889 20.339 6.754 1.00 0.00 H new ATOM 0 HB ILE A 130 2.870 20.900 7.925 1.00 0.00 H new ATOM 0 HG12 ILE A 130 3.983 22.077 6.068 1.00 0.00 H new ATOM 0 HG13 ILE A 130 5.082 21.027 6.939 1.00 0.00 H new ATOM 0 HG21 ILE A 130 4.230 18.847 7.891 1.00 0.00 H new ATOM 0 HG22 ILE A 130 2.489 18.484 7.826 1.00 0.00 H new ATOM 0 HG23 ILE A 130 3.476 18.377 6.349 1.00 0.00 H new ATOM 0 HD11 ILE A 130 5.448 20.868 4.526 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.869 19.315 5.173 1.00 0.00 H new ATOM 0 HD13 ILE A 130 3.753 20.381 4.288 1.00 0.00 H new ATOM 1712 N ASP A 131 1.901 22.000 4.219 1.00 0.00 N ATOM 1713 CA ASP A 131 1.863 23.284 3.529 1.00 0.00 C ATOM 1714 C ASP A 131 0.490 23.528 2.911 1.00 0.00 C ATOM 1715 O ASP A 131 0.118 24.666 2.629 1.00 0.00 O ATOM 1716 CB ASP A 131 2.940 23.336 2.443 1.00 0.00 C ATOM 1717 CG ASP A 131 4.184 22.557 2.825 1.00 0.00 C ATOM 1718 OD1 ASP A 131 4.875 22.971 3.780 1.00 0.00 O ATOM 1719 OD2 ASP A 131 4.467 21.532 2.169 1.00 0.00 O ATOM 0 H ASP A 131 2.094 21.202 3.614 1.00 0.00 H new ATOM 0 HA ASP A 131 2.057 24.068 4.261 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.535 22.935 1.514 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.209 24.375 2.252 1.00 0.00 H new ATOM 1723 N GLY A 132 -0.261 22.451 2.704 1.00 0.00 N ATOM 1724 CA GLY A 132 -1.584 22.569 2.119 1.00 0.00 C ATOM 1725 C GLY A 132 -1.554 23.189 0.737 1.00 0.00 C ATOM 1726 O GLY A 132 -2.357 24.070 0.427 1.00 0.00 O ATOM 0 H GLY A 132 0.023 21.498 2.931 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -2.041 21.581 2.061 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -2.214 23.174 2.771 1.00 0.00 H new ATOM 1729 N ASP A 133 -0.626 22.730 -0.095 1.00 0.00 N ATOM 1730 CA ASP A 133 -0.495 23.245 -1.453 1.00 0.00 C ATOM 1731 C ASP A 133 -1.282 22.388 -2.439 1.00 0.00 C ATOM 1732 O ASP A 133 -1.558 22.809 -3.561 1.00 0.00 O ATOM 1733 CB ASP A 133 0.979 23.293 -1.863 1.00 0.00 C ATOM 1734 CG ASP A 133 1.720 22.021 -1.503 1.00 0.00 C ATOM 1735 OD1 ASP A 133 1.452 20.978 -2.134 1.00 0.00 O ATOM 1736 OD2 ASP A 133 2.570 22.068 -0.588 1.00 0.00 O ATOM 0 H ASP A 133 0.047 22.002 0.147 1.00 0.00 H new ATOM 0 HA ASP A 133 -0.903 24.255 -1.472 1.00 0.00 H new ATOM 0 HB2 ASP A 133 1.049 23.459 -2.938 1.00 0.00 H new ATOM 0 HB3 ASP A 133 1.461 24.141 -1.377 1.00 0.00 H new ATOM 1740 N GLY A 134 -1.641 21.181 -2.011 1.00 0.00 N ATOM 1741 CA GLY A 134 -2.392 20.283 -2.868 1.00 0.00 C ATOM 1742 C GLY A 134 -1.547 19.140 -3.394 1.00 0.00 C ATOM 1743 O GLY A 134 -2.000 18.356 -4.228 1.00 0.00 O ATOM 0 H GLY A 134 -1.425 20.810 -1.086 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -3.238 19.879 -2.313 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.801 20.845 -3.708 1.00 0.00 H new ATOM 1746 N GLN A 135 -0.313 19.046 -2.907 1.00 0.00 N ATOM 1747 CA GLN A 135 0.598 17.992 -3.336 1.00 0.00 C ATOM 1748 C GLN A 135 1.407 17.458 -2.157 1.00 0.00 C ATOM 1749 O GLN A 135 1.966 18.228 -1.375 1.00 0.00 O ATOM 1750 CB GLN A 135 1.541 18.514 -4.421 1.00 0.00 C ATOM 1751 CG GLN A 135 1.083 18.190 -5.833 1.00 0.00 C ATOM 1752 CD GLN A 135 1.739 19.072 -6.878 1.00 0.00 C ATOM 1753 OE1 GLN A 135 2.898 19.463 -6.737 1.00 0.00 O ATOM 1754 NE2 GLN A 135 1.000 19.389 -7.934 1.00 0.00 N ATOM 0 H GLN A 135 0.078 19.686 -2.216 1.00 0.00 H new ATOM 0 HA GLN A 135 0.002 17.176 -3.744 1.00 0.00 H new ATOM 0 HB2 GLN A 135 1.637 19.595 -4.318 1.00 0.00 H new ATOM 0 HB3 GLN A 135 2.533 18.090 -4.263 1.00 0.00 H new ATOM 0 HG2 GLN A 135 1.307 17.146 -6.052 1.00 0.00 H new ATOM 0 HG3 GLN A 135 0.001 18.304 -5.895 1.00 0.00 H new ATOM 0 HE21 GLN A 135 0.044 19.043 -8.010 1.00 0.00 H new ATOM 0 HE22 GLN A 135 1.388 19.979 -8.670 1.00 0.00 H new ATOM 1761 N VAL A 136 1.464 16.137 -2.036 1.00 0.00 N ATOM 1762 CA VAL A 136 2.205 15.500 -0.953 1.00 0.00 C ATOM 1763 C VAL A 136 3.663 15.277 -1.341 1.00 0.00 C ATOM 1764 O VAL A 136 3.957 14.739 -2.407 1.00 0.00 O ATOM 1765 CB VAL A 136 1.578 14.148 -0.564 1.00 0.00 C ATOM 1766 CG1 VAL A 136 2.546 13.332 0.279 1.00 0.00 C ATOM 1767 CG2 VAL A 136 0.266 14.363 0.175 1.00 0.00 C ATOM 0 H VAL A 136 1.006 15.486 -2.674 1.00 0.00 H new ATOM 0 HA VAL A 136 2.158 16.175 -0.098 1.00 0.00 H new ATOM 0 HB VAL A 136 1.368 13.589 -1.476 1.00 0.00 H new ATOM 0 HG11 VAL A 136 2.085 12.380 0.544 1.00 0.00 H new ATOM 0 HG12 VAL A 136 3.458 13.148 -0.290 1.00 0.00 H new ATOM 0 HG13 VAL A 136 2.790 13.882 1.188 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.163 13.398 0.442 1.00 0.00 H new ATOM 0 HG22 VAL A 136 0.449 14.942 1.080 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -0.429 14.904 -0.467 1.00 0.00 H new ATOM 1777 N ASN A 137 4.572 15.696 -0.466 1.00 0.00 N ATOM 1778 CA ASN A 137 6.001 15.543 -0.716 1.00 0.00 C ATOM 1779 C ASN A 137 6.607 14.498 0.214 1.00 0.00 C ATOM 1780 O ASN A 137 5.997 14.109 1.210 1.00 0.00 O ATOM 1781 CB ASN A 137 6.717 16.882 -0.533 1.00 0.00 C ATOM 1782 CG ASN A 137 8.154 16.839 -1.018 1.00 0.00 C ATOM 1783 OD1 ASN A 137 8.451 16.269 -2.067 1.00 0.00 O ATOM 1784 ND2 ASN A 137 9.054 17.446 -0.253 1.00 0.00 N ATOM 0 H ASN A 137 4.345 16.144 0.422 1.00 0.00 H new ATOM 0 HA ASN A 137 6.131 15.206 -1.745 1.00 0.00 H new ATOM 0 HB2 ASN A 137 6.176 17.658 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN A 137 6.700 17.159 0.521 1.00 0.00 H new ATOM 0 HD21 ASN A 137 10.036 17.452 -0.528 1.00 0.00 H new ATOM 0 HD22 ASN A 137 8.763 17.907 0.609 1.00 0.00 H new ATOM 1790 N TYR A 138 7.811 14.046 -0.118 1.00 0.00 N ATOM 1791 CA TYR A 138 8.501 13.045 0.687 1.00 0.00 C ATOM 1792 C TYR A 138 8.852 13.600 2.064 1.00 0.00 C ATOM 1793 O TYR A 138 8.691 12.922 3.078 1.00 0.00 O ATOM 1794 CB TYR A 138 9.769 12.572 -0.025 1.00 0.00 C ATOM 1795 CG TYR A 138 10.588 11.591 0.783 1.00 0.00 C ATOM 1796 CD1 TYR A 138 10.214 10.256 0.879 1.00 0.00 C ATOM 1797 CD2 TYR A 138 11.736 11.999 1.451 1.00 0.00 C ATOM 1798 CE1 TYR A 138 10.958 9.357 1.617 1.00 0.00 C ATOM 1799 CE2 TYR A 138 12.487 11.106 2.190 1.00 0.00 C ATOM 1800 CZ TYR A 138 12.095 9.786 2.270 1.00 0.00 C ATOM 1801 OH TYR A 138 12.840 8.893 3.006 1.00 0.00 O ATOM 0 H TYR A 138 8.330 14.357 -0.939 1.00 0.00 H new ATOM 0 HA TYR A 138 7.830 12.196 0.819 1.00 0.00 H new ATOM 0 HB2 TYR A 138 9.492 12.108 -0.972 1.00 0.00 H new ATOM 0 HB3 TYR A 138 10.386 13.438 -0.263 1.00 0.00 H new ATOM 0 HD1 TYR A 138 9.326 9.916 0.367 1.00 0.00 H new ATOM 0 HD2 TYR A 138 12.046 13.032 1.391 1.00 0.00 H new ATOM 0 HE1 TYR A 138 10.651 8.323 1.683 1.00 0.00 H new ATOM 0 HE2 TYR A 138 13.377 11.440 2.703 1.00 0.00 H new ATOM 0 HH TYR A 138 13.609 9.355 3.401 1.00 0.00 H new ATOM 1810 N GLU A 139 9.335 14.838 2.089 1.00 0.00 N ATOM 1811 CA GLU A 139 9.711 15.486 3.341 1.00 0.00 C ATOM 1812 C GLU A 139 8.596 15.358 4.375 1.00 0.00 C ATOM 1813 O GLU A 139 8.837 14.970 5.517 1.00 0.00 O ATOM 1814 CB GLU A 139 10.033 16.962 3.101 1.00 0.00 C ATOM 1815 CG GLU A 139 10.769 17.620 4.256 1.00 0.00 C ATOM 1816 CD GLU A 139 10.504 19.110 4.344 1.00 0.00 C ATOM 1817 OE1 GLU A 139 9.482 19.496 4.951 1.00 0.00 O ATOM 1818 OE2 GLU A 139 11.316 19.890 3.806 1.00 0.00 O ATOM 0 H GLU A 139 9.475 15.412 1.258 1.00 0.00 H new ATOM 0 HA GLU A 139 10.600 14.987 3.727 1.00 0.00 H new ATOM 0 HB2 GLU A 139 10.637 17.051 2.198 1.00 0.00 H new ATOM 0 HB3 GLU A 139 9.104 17.503 2.918 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.469 17.146 5.190 1.00 0.00 H new ATOM 0 HG3 GLU A 139 11.840 17.451 4.143 1.00 0.00 H new ATOM 1823 N GLU A 140 7.375 15.690 3.965 1.00 0.00 N ATOM 1824 CA GLU A 140 6.224 15.615 4.856 1.00 0.00 C ATOM 1825 C GLU A 140 5.673 14.193 4.914 1.00 0.00 C ATOM 1826 O GLU A 140 5.136 13.765 5.936 1.00 0.00 O ATOM 1827 CB GLU A 140 5.129 16.579 4.394 1.00 0.00 C ATOM 1828 CG GLU A 140 4.652 16.323 2.976 1.00 0.00 C ATOM 1829 CD GLU A 140 4.118 17.574 2.304 1.00 0.00 C ATOM 1830 OE1 GLU A 140 4.612 18.676 2.624 1.00 0.00 O ATOM 1831 OE2 GLU A 140 3.207 17.450 1.459 1.00 0.00 O ATOM 0 H GLU A 140 7.158 16.013 3.022 1.00 0.00 H new ATOM 0 HA GLU A 140 6.552 15.901 5.856 1.00 0.00 H new ATOM 0 HB2 GLU A 140 4.280 16.503 5.073 1.00 0.00 H new ATOM 0 HB3 GLU A 140 5.503 17.600 4.464 1.00 0.00 H new ATOM 0 HG2 GLU A 140 5.476 15.922 2.386 1.00 0.00 H new ATOM 0 HG3 GLU A 140 3.872 15.562 2.991 1.00 0.00 H new ATOM 1836 N PHE A 141 5.810 13.466 3.810 1.00 0.00 N ATOM 1837 CA PHE A 141 5.325 12.093 3.733 1.00 0.00 C ATOM 1838 C PHE A 141 5.859 11.262 4.896 1.00 0.00 C ATOM 1839 O PHE A 141 5.107 10.550 5.562 1.00 0.00 O ATOM 1840 CB PHE A 141 5.739 11.457 2.405 1.00 0.00 C ATOM 1841 CG PHE A 141 5.276 10.036 2.250 1.00 0.00 C ATOM 1842 CD1 PHE A 141 5.992 8.996 2.822 1.00 0.00 C ATOM 1843 CD2 PHE A 141 4.127 9.741 1.535 1.00 0.00 C ATOM 1844 CE1 PHE A 141 5.568 7.688 2.681 1.00 0.00 C ATOM 1845 CE2 PHE A 141 3.699 8.435 1.391 1.00 0.00 C ATOM 1846 CZ PHE A 141 4.420 7.407 1.965 1.00 0.00 C ATOM 0 H PHE A 141 6.253 13.805 2.956 1.00 0.00 H new ATOM 0 HA PHE A 141 4.237 12.114 3.794 1.00 0.00 H new ATOM 0 HB2 PHE A 141 5.338 12.053 1.585 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.825 11.488 2.320 1.00 0.00 H new ATOM 0 HD1 PHE A 141 6.890 9.210 3.383 1.00 0.00 H new ATOM 0 HD2 PHE A 141 3.559 10.541 1.085 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.134 6.886 3.130 1.00 0.00 H new ATOM 0 HE2 PHE A 141 2.802 8.219 0.830 1.00 0.00 H new ATOM 0 HZ PHE A 141 4.087 6.385 1.855 1.00 0.00 H new ATOM 1855 N VAL A 142 7.163 11.357 5.134 1.00 0.00 N ATOM 1856 CA VAL A 142 7.799 10.615 6.216 1.00 0.00 C ATOM 1857 C VAL A 142 7.302 11.092 7.576 1.00 0.00 C ATOM 1858 O VAL A 142 7.317 10.341 8.551 1.00 0.00 O ATOM 1859 CB VAL A 142 9.333 10.753 6.165 1.00 0.00 C ATOM 1860 CG1 VAL A 142 9.833 10.637 4.734 1.00 0.00 C ATOM 1861 CG2 VAL A 142 9.770 12.072 6.786 1.00 0.00 C ATOM 0 H VAL A 142 7.800 11.941 4.592 1.00 0.00 H new ATOM 0 HA VAL A 142 7.531 9.567 6.082 1.00 0.00 H new ATOM 0 HB VAL A 142 9.773 9.941 6.744 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.918 10.737 4.719 1.00 0.00 H new ATOM 0 HG12 VAL A 142 9.552 9.665 4.328 1.00 0.00 H new ATOM 0 HG13 VAL A 142 9.387 11.426 4.128 1.00 0.00 H new ATOM 0 HG21 VAL A 142 10.856 12.153 6.742 1.00 0.00 H new ATOM 0 HG22 VAL A 142 9.322 12.899 6.236 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.446 12.110 7.826 1.00 0.00 H new ATOM 1871 N GLN A 143 6.861 12.344 7.633 1.00 0.00 N ATOM 1872 CA GLN A 143 6.359 12.922 8.874 1.00 0.00 C ATOM 1873 C GLN A 143 4.886 12.583 9.075 1.00 0.00 C ATOM 1874 O GLN A 143 4.372 12.642 10.191 1.00 0.00 O ATOM 1875 CB GLN A 143 6.550 14.440 8.869 1.00 0.00 C ATOM 1876 CG GLN A 143 6.326 15.085 10.228 1.00 0.00 C ATOM 1877 CD GLN A 143 6.056 16.573 10.129 1.00 0.00 C ATOM 1878 OE1 GLN A 143 5.292 17.022 9.274 1.00 0.00 O ATOM 1879 NE2 GLN A 143 6.682 17.348 11.008 1.00 0.00 N ATOM 0 H GLN A 143 6.841 12.978 6.834 1.00 0.00 H new ATOM 0 HA GLN A 143 6.927 12.495 9.700 1.00 0.00 H new ATOM 0 HB2 GLN A 143 7.560 14.670 8.529 1.00 0.00 H new ATOM 0 HB3 GLN A 143 5.862 14.882 8.148 1.00 0.00 H new ATOM 0 HG2 GLN A 143 5.485 14.599 10.723 1.00 0.00 H new ATOM 0 HG3 GLN A 143 7.203 14.919 10.854 1.00 0.00 H new ATOM 0 HE21 GLN A 143 7.307 16.933 11.700 1.00 0.00 H new ATOM 0 HE22 GLN A 143 6.538 18.358 10.991 1.00 0.00 H new ATOM 1886 N MET A 144 4.212 12.227 7.986 1.00 0.00 N ATOM 1887 CA MET A 144 2.796 11.878 8.043 1.00 0.00 C ATOM 1888 C MET A 144 2.579 10.632 8.895 1.00 0.00 C ATOM 1889 O MET A 144 1.475 10.388 9.382 1.00 0.00 O ATOM 1890 CB MET A 144 2.248 11.649 6.633 1.00 0.00 C ATOM 1891 CG MET A 144 0.868 11.012 6.614 1.00 0.00 C ATOM 1892 SD MET A 144 0.932 9.224 6.390 1.00 0.00 S ATOM 1893 CE MET A 144 1.532 9.116 4.706 1.00 0.00 C ATOM 0 H MET A 144 4.623 12.172 7.054 1.00 0.00 H new ATOM 0 HA MET A 144 2.260 12.709 8.502 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.206 12.604 6.109 1.00 0.00 H new ATOM 0 HB3 MET A 144 2.941 11.013 6.082 1.00 0.00 H new ATOM 0 HG2 MET A 144 0.354 11.239 7.548 1.00 0.00 H new ATOM 0 HG3 MET A 144 0.279 11.454 5.811 1.00 0.00 H new ATOM 0 HE1 MET A 144 1.204 8.176 4.262 1.00 0.00 H new ATOM 0 HE2 MET A 144 1.137 9.949 4.125 1.00 0.00 H new ATOM 0 HE3 MET A 144 2.621 9.157 4.705 1.00 0.00 H new ATOM 1901 N MET A 145 3.637 9.847 9.069 1.00 0.00 N ATOM 1902 CA MET A 145 3.559 8.626 9.862 1.00 0.00 C ATOM 1903 C MET A 145 4.327 8.780 11.172 1.00 0.00 C ATOM 1904 O MET A 145 4.530 7.809 11.902 1.00 0.00 O ATOM 1905 CB MET A 145 4.114 7.441 9.070 1.00 0.00 C ATOM 1906 CG MET A 145 5.576 7.598 8.684 1.00 0.00 C ATOM 1907 SD MET A 145 6.695 6.859 9.890 1.00 0.00 S ATOM 1908 CE MET A 145 7.671 5.791 8.834 1.00 0.00 C ATOM 0 H MET A 145 4.558 10.034 8.672 1.00 0.00 H new ATOM 0 HA MET A 145 2.510 8.439 10.094 1.00 0.00 H new ATOM 0 HB2 MET A 145 3.999 6.533 9.662 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.520 7.309 8.165 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.742 7.138 7.710 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.809 8.658 8.580 1.00 0.00 H new ATOM 0 HE1 MET A 145 8.411 5.263 9.435 1.00 0.00 H new ATOM 0 HE2 MET A 145 7.018 5.068 8.345 1.00 0.00 H new ATOM 0 HE3 MET A 145 8.178 6.391 8.079 1.00 0.00 H new ATOM 1916 N THR A 146 4.751 10.006 11.464 1.00 0.00 N ATOM 1917 CA THR A 146 5.495 10.286 12.685 1.00 0.00 C ATOM 1918 C THR A 146 4.618 10.985 13.717 1.00 0.00 C ATOM 1919 O THR A 146 5.025 11.975 14.322 1.00 0.00 O ATOM 1920 CB THR A 146 6.731 11.161 12.401 1.00 0.00 C ATOM 1921 OG1 THR A 146 6.322 12.437 11.895 1.00 0.00 O ATOM 1922 CG2 THR A 146 7.654 10.485 11.398 1.00 0.00 C ATOM 0 H THR A 146 4.591 10.820 10.871 1.00 0.00 H new ATOM 0 HA THR A 146 5.822 9.325 13.083 1.00 0.00 H new ATOM 0 HB THR A 146 7.274 11.298 13.336 1.00 0.00 H new ATOM 0 HG1 THR A 146 5.390 12.387 11.595 1.00 0.00 H new ATOM 0 HG21 THR A 146 8.519 11.122 11.213 1.00 0.00 H new ATOM 0 HG22 THR A 146 7.987 9.527 11.798 1.00 0.00 H new ATOM 0 HG23 THR A 146 7.118 10.321 10.463 1.00 0.00 H new ATOM 1929 N GLY A 147 3.411 10.462 13.913 1.00 0.00 N ATOM 1930 CA GLY A 147 2.496 11.049 14.873 1.00 0.00 C ATOM 1931 C GLY A 147 1.182 11.465 14.242 1.00 0.00 C ATOM 1932 O GLY A 147 0.730 12.596 14.421 1.00 0.00 O ATOM 0 H GLY A 147 3.051 9.642 13.424 1.00 0.00 H new ATOM 0 HA2 GLY A 147 2.302 10.332 15.670 1.00 0.00 H new ATOM 0 HA3 GLY A 147 2.966 11.918 15.333 1.00 0.00 H new ATOM 1935 N ALA A 148 0.568 10.549 13.501 1.00 0.00 N ATOM 1936 CA ALA A 148 -0.702 10.827 12.841 1.00 0.00 C ATOM 1937 C ALA A 148 -1.852 10.105 13.537 1.00 0.00 C ATOM 1938 O ALA A 148 -2.897 9.859 12.936 1.00 0.00 O ATOM 1939 CB ALA A 148 -0.635 10.424 11.375 1.00 0.00 C ATOM 0 H ALA A 148 0.929 9.608 13.342 1.00 0.00 H new ATOM 0 HA ALA A 148 -0.888 11.899 12.904 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -1.590 10.637 10.895 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.155 10.988 10.878 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -0.421 9.358 11.300 1.00 0.00 H new ATOM 1945 N SER A 149 -1.651 9.769 14.807 1.00 0.00 N ATOM 1946 CA SER A 149 -2.670 9.072 15.584 1.00 0.00 C ATOM 1947 C SER A 149 -4.048 9.679 15.341 1.00 0.00 C ATOM 1948 O SER A 149 -5.046 8.965 15.249 1.00 0.00 O ATOM 1949 CB SER A 149 -2.330 9.127 17.075 1.00 0.00 C ATOM 1950 OG SER A 149 -3.200 8.298 17.826 1.00 0.00 O ATOM 0 H SER A 149 -0.792 9.968 15.320 1.00 0.00 H new ATOM 0 HA SER A 149 -2.690 8.031 15.262 1.00 0.00 H new ATOM 0 HB2 SER A 149 -1.298 8.810 17.228 1.00 0.00 H new ATOM 0 HB3 SER A 149 -2.404 10.155 17.431 1.00 0.00 H new ATOM 0 HG SER A 149 -2.962 8.349 18.775 1.00 0.00 H new ATOM 1955 N THR A 150 -4.095 11.003 15.238 1.00 0.00 N ATOM 1956 CA THR A 150 -5.349 11.709 15.007 1.00 0.00 C ATOM 1957 C THR A 150 -5.533 12.033 13.529 1.00 0.00 C ATOM 1958 O THR A 150 -6.658 12.184 13.052 1.00 0.00 O ATOM 1959 CB THR A 150 -5.417 13.015 15.820 1.00 0.00 C ATOM 1960 OG1 THR A 150 -4.778 12.836 17.089 1.00 0.00 O ATOM 1961 CG2 THR A 150 -6.860 13.447 16.030 1.00 0.00 C ATOM 0 H THR A 150 -3.278 11.609 15.311 1.00 0.00 H new ATOM 0 HA THR A 150 -6.150 11.045 15.333 1.00 0.00 H new ATOM 0 HB THR A 150 -4.899 13.793 15.259 1.00 0.00 H new ATOM 0 HG1 THR A 150 -4.824 13.671 17.599 1.00 0.00 H new ATOM 0 HG21 THR A 150 -6.883 14.372 16.607 1.00 0.00 H new ATOM 0 HG22 THR A 150 -7.335 13.611 15.063 1.00 0.00 H new ATOM 0 HG23 THR A 150 -7.398 12.669 16.571 1.00 0.00 H new ATOM 1968 N ALA A 151 -4.422 12.138 12.807 1.00 0.00 N ATOM 1969 CA ALA A 151 -4.463 12.442 11.382 1.00 0.00 C ATOM 1970 C ALA A 151 -5.201 11.354 10.610 1.00 0.00 C ATOM 1971 O ALA A 151 -5.734 10.414 11.198 1.00 0.00 O ATOM 1972 CB ALA A 151 -3.052 12.612 10.840 1.00 0.00 C ATOM 0 H ALA A 151 -3.483 12.017 13.186 1.00 0.00 H new ATOM 0 HA ALA A 151 -5.007 13.377 11.249 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -3.096 12.839 9.775 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -2.557 13.429 11.365 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -2.490 11.690 10.992 1.00 0.00 H new ATOM 1978 N ALA A 152 -5.229 11.489 9.288 1.00 0.00 N ATOM 1979 CA ALA A 152 -5.901 10.517 8.435 1.00 0.00 C ATOM 1980 C ALA A 152 -4.978 9.351 8.098 1.00 0.00 C ATOM 1981 O ALA A 152 -5.049 8.786 7.008 1.00 0.00 O ATOM 1982 CB ALA A 152 -6.397 11.186 7.161 1.00 0.00 C ATOM 0 H ALA A 152 -4.794 12.262 8.785 1.00 0.00 H new ATOM 0 HA ALA A 152 -6.757 10.122 8.982 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -6.897 10.448 6.533 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -7.099 11.980 7.416 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -5.551 11.610 6.619 1.00 0.00 H new ATOM 1988 N GLY A 153 -4.111 8.997 9.041 1.00 0.00 N ATOM 1989 CA GLY A 153 -3.186 7.899 8.825 1.00 0.00 C ATOM 1990 C GLY A 153 -3.874 6.657 8.296 1.00 0.00 C ATOM 1991 O GLY A 153 -3.249 5.826 7.637 1.00 0.00 O ATOM 0 H GLY A 153 -4.032 9.451 9.951 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.415 8.211 8.121 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -2.684 7.661 9.763 1.00 0.00 H new ATOM 1994 N SER A 154 -5.164 6.528 8.586 1.00 0.00 N ATOM 1995 CA SER A 154 -5.936 5.374 8.140 1.00 0.00 C ATOM 1996 C SER A 154 -5.732 5.127 6.648 1.00 0.00 C ATOM 1997 O SER A 154 -5.196 4.094 6.246 1.00 0.00 O ATOM 1998 CB SER A 154 -7.423 5.583 8.434 1.00 0.00 C ATOM 1999 OG SER A 154 -7.658 5.685 9.828 1.00 0.00 O ATOM 0 H SER A 154 -5.697 7.208 9.128 1.00 0.00 H new ATOM 0 HA SER A 154 -5.584 4.500 8.687 1.00 0.00 H new ATOM 0 HB2 SER A 154 -7.772 6.488 7.936 1.00 0.00 H new ATOM 0 HB3 SER A 154 -7.998 4.752 8.025 1.00 0.00 H new ATOM 0 HG SER A 154 -8.615 5.820 9.989 1.00 0.00 H new ATOM 2004 N GLY A 155 -6.162 6.084 5.831 1.00 0.00 N ATOM 2005 CA GLY A 155 -6.016 5.952 4.393 1.00 0.00 C ATOM 2006 C GLY A 155 -4.598 5.615 3.982 1.00 0.00 C ATOM 2007 O GLY A 155 -4.358 4.604 3.324 1.00 0.00 O ATOM 0 H GLY A 155 -6.609 6.948 6.139 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -6.690 5.175 4.033 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -6.318 6.883 3.913 1.00 0.00 H new ATOM 2010 N TRP A 156 -3.653 6.466 4.370 1.00 0.00 N ATOM 2011 CA TRP A 156 -2.250 6.254 4.035 1.00 0.00 C ATOM 2012 C TRP A 156 -1.797 4.856 4.446 1.00 0.00 C ATOM 2013 O TRP A 156 -0.978 4.235 3.769 1.00 0.00 O ATOM 2014 CB TRP A 156 -1.376 7.307 4.717 1.00 0.00 C ATOM 2015 CG TRP A 156 -1.546 8.682 4.144 1.00 0.00 C ATOM 2016 CD1 TRP A 156 -2.159 9.747 4.737 1.00 0.00 C ATOM 2017 CD2 TRP A 156 -1.098 9.136 2.862 1.00 0.00 C ATOM 2018 NE1 TRP A 156 -2.120 10.837 3.902 1.00 0.00 N ATOM 2019 CE2 TRP A 156 -1.473 10.489 2.746 1.00 0.00 C ATOM 2020 CE3 TRP A 156 -0.414 8.534 1.803 1.00 0.00 C ATOM 2021 CZ2 TRP A 156 -1.188 11.246 1.613 1.00 0.00 C ATOM 2022 CZ3 TRP A 156 -0.131 9.286 0.679 1.00 0.00 C ATOM 2023 CH2 TRP A 156 -0.517 10.629 0.590 1.00 0.00 C ATOM 0 H TRP A 156 -3.834 7.308 4.916 1.00 0.00 H new ATOM 0 HA TRP A 156 -2.143 6.348 2.954 1.00 0.00 H new ATOM 0 HB2 TRP A 156 -1.613 7.332 5.781 1.00 0.00 H new ATOM 0 HB3 TRP A 156 -0.330 7.012 4.631 1.00 0.00 H new ATOM 0 HD1 TRP A 156 -2.609 9.735 5.719 1.00 0.00 H new ATOM 0 HE1 TRP A 156 -2.510 11.757 4.109 1.00 0.00 H new ATOM 0 HE3 TRP A 156 -0.112 7.499 1.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 -1.485 12.282 1.543 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 0.397 8.830 -0.145 1.00 0.00 H new ATOM 0 HH2 TRP A 156 -0.281 11.190 -0.303 1.00 0.00 H new ATOM 2033 N ARG A 157 -2.336 4.369 5.558 1.00 0.00 N ATOM 2034 CA ARG A 157 -1.986 3.045 6.060 1.00 0.00 C ATOM 2035 C ARG A 157 -2.467 1.957 5.104 1.00 0.00 C ATOM 2036 O ARG A 157 -1.712 1.056 4.740 1.00 0.00 O ATOM 2037 CB ARG A 157 -2.593 2.824 7.447 1.00 0.00 C ATOM 2038 CG ARG A 157 -1.628 3.111 8.586 1.00 0.00 C ATOM 2039 CD ARG A 157 -0.800 1.884 8.936 1.00 0.00 C ATOM 2040 NE ARG A 157 -0.295 1.937 10.305 1.00 0.00 N ATOM 2041 CZ ARG A 157 0.653 2.776 10.707 1.00 0.00 C ATOM 2042 NH1 ARG A 157 1.197 3.629 9.850 1.00 0.00 N ATOM 2043 NH2 ARG A 157 1.060 2.764 11.971 1.00 0.00 N ATOM 0 H ARG A 157 -3.016 4.871 6.129 1.00 0.00 H new ATOM 0 HA ARG A 157 -0.900 2.988 6.133 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -3.471 3.461 7.556 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -2.936 1.792 7.524 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -0.966 3.930 8.306 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -2.186 3.438 9.464 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -1.408 0.988 8.808 1.00 0.00 H new ATOM 0 HD3 ARG A 157 0.038 1.802 8.243 1.00 0.00 H new ATOM 0 HE ARG A 157 -0.692 1.294 10.990 1.00 0.00 H new ATOM 0 HH11 ARG A 157 0.888 3.643 8.878 1.00 0.00 H new ATOM 0 HH12 ARG A 157 1.925 4.272 10.163 1.00 0.00 H new ATOM 0 HH21 ARG A 157 0.645 2.110 12.634 1.00 0.00 H new ATOM 0 HH22 ARG A 157 1.788 3.409 12.278 1.00 0.00 H new ATOM 2054 N LYS A 158 -3.730 2.047 4.700 1.00 0.00 N ATOM 2055 CA LYS A 158 -4.314 1.072 3.787 1.00 0.00 C ATOM 2056 C LYS A 158 -3.536 1.022 2.476 1.00 0.00 C ATOM 2057 O LYS A 158 -3.070 -0.039 2.060 1.00 0.00 O ATOM 2058 CB LYS A 158 -5.779 1.415 3.510 1.00 0.00 C ATOM 2059 CG LYS A 158 -6.755 0.699 4.428 1.00 0.00 C ATOM 2060 CD LYS A 158 -6.525 1.068 5.884 1.00 0.00 C ATOM 2061 CE LYS A 158 -7.430 0.271 6.811 1.00 0.00 C ATOM 2062 NZ LYS A 158 -8.858 0.665 6.665 1.00 0.00 N ATOM 0 H LYS A 158 -4.369 2.787 4.991 1.00 0.00 H new ATOM 0 HA LYS A 158 -4.261 0.091 4.259 1.00 0.00 H new ATOM 0 HB2 LYS A 158 -5.918 2.491 3.614 1.00 0.00 H new ATOM 0 HB3 LYS A 158 -6.013 1.162 2.476 1.00 0.00 H new ATOM 0 HG2 LYS A 158 -7.776 0.954 4.144 1.00 0.00 H new ATOM 0 HG3 LYS A 158 -6.649 -0.379 4.304 1.00 0.00 H new ATOM 0 HD2 LYS A 158 -5.483 0.886 6.146 1.00 0.00 H new ATOM 0 HD3 LYS A 158 -6.707 2.134 6.024 1.00 0.00 H new ATOM 0 HE2 LYS A 158 -7.323 -0.792 6.597 1.00 0.00 H new ATOM 0 HE3 LYS A 158 -7.115 0.422 7.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 -9.431 0.161 7.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 -8.952 1.690 6.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 -9.190 0.419 5.711 1.00 0.00 H new ATOM 2072 N ILE A 159 -3.398 2.176 1.830 1.00 0.00 N ATOM 2073 CA ILE A 159 -2.675 2.263 0.568 1.00 0.00 C ATOM 2074 C ILE A 159 -1.251 1.736 0.713 1.00 0.00 C ATOM 2075 O ILE A 159 -0.770 0.975 -0.126 1.00 0.00 O ATOM 2076 CB ILE A 159 -2.624 3.711 0.047 1.00 0.00 C ATOM 2077 CG1 ILE A 159 -1.809 3.783 -1.246 1.00 0.00 C ATOM 2078 CG2 ILE A 159 -2.034 4.634 1.104 1.00 0.00 C ATOM 2079 CD1 ILE A 159 -1.643 5.189 -1.779 1.00 0.00 C ATOM 0 H ILE A 159 -3.778 3.063 2.161 1.00 0.00 H new ATOM 0 HA ILE A 159 -3.217 1.647 -0.149 1.00 0.00 H new ATOM 0 HB ILE A 159 -3.641 4.040 -0.168 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -0.824 3.352 -1.069 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -2.294 3.170 -2.006 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -2.005 5.654 0.721 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -2.652 4.601 2.001 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -1.023 4.309 1.348 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -1.055 5.163 -2.697 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -2.623 5.617 -1.988 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -1.131 5.801 -1.037 1.00 0.00 H new ATOM 2090 N LYS A 160 -0.580 2.145 1.785 1.00 0.00 N ATOM 2091 CA LYS A 160 0.788 1.713 2.044 1.00 0.00 C ATOM 2092 C LYS A 160 0.859 0.198 2.200 1.00 0.00 C ATOM 2093 O LYS A 160 1.776 -0.447 1.690 1.00 0.00 O ATOM 2094 CB LYS A 160 1.329 2.393 3.303 1.00 0.00 C ATOM 2095 CG LYS A 160 2.792 2.089 3.577 1.00 0.00 C ATOM 2096 CD LYS A 160 3.383 3.059 4.586 1.00 0.00 C ATOM 2097 CE LYS A 160 2.846 2.805 5.986 1.00 0.00 C ATOM 2098 NZ LYS A 160 3.389 3.777 6.974 1.00 0.00 N ATOM 0 H LYS A 160 -0.963 2.776 2.489 1.00 0.00 H new ATOM 0 HA LYS A 160 1.402 2.001 1.191 1.00 0.00 H new ATOM 0 HB2 LYS A 160 1.202 3.471 3.206 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.734 2.078 4.160 1.00 0.00 H new ATOM 0 HG2 LYS A 160 2.889 1.070 3.951 1.00 0.00 H new ATOM 0 HG3 LYS A 160 3.356 2.142 2.646 1.00 0.00 H new ATOM 0 HD2 LYS A 160 4.469 2.965 4.589 1.00 0.00 H new ATOM 0 HD3 LYS A 160 3.153 4.082 4.287 1.00 0.00 H new ATOM 0 HE2 LYS A 160 1.758 2.869 5.974 1.00 0.00 H new ATOM 0 HE3 LYS A 160 3.103 1.792 6.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 2.999 3.570 7.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 4.426 3.699 7.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 3.123 4.742 6.694 1.00 0.00 H new ATOM 2108 N LEU A 161 -0.114 -0.365 2.908 1.00 0.00 N ATOM 2109 CA LEU A 161 -0.162 -1.806 3.131 1.00 0.00 C ATOM 2110 C LEU A 161 -0.386 -2.552 1.820 1.00 0.00 C ATOM 2111 O LEU A 161 0.155 -3.638 1.612 1.00 0.00 O ATOM 2112 CB LEU A 161 -1.273 -2.152 4.125 1.00 0.00 C ATOM 2113 CG LEU A 161 -0.934 -1.960 5.604 1.00 0.00 C ATOM 2114 CD1 LEU A 161 -2.196 -2.002 6.450 1.00 0.00 C ATOM 2115 CD2 LEU A 161 0.056 -3.020 6.066 1.00 0.00 C ATOM 0 H LEU A 161 -0.880 0.154 3.337 1.00 0.00 H new ATOM 0 HA LEU A 161 0.797 -2.117 3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -2.146 -1.542 3.891 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -1.560 -3.192 3.971 1.00 0.00 H new ATOM 0 HG LEU A 161 -0.471 -0.981 5.727 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -1.935 -1.864 7.499 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -2.871 -1.206 6.136 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -2.688 -2.966 6.322 1.00 0.00 H new ATOM 0 HD21 LEU A 161 0.286 -2.868 7.121 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -0.380 -4.010 5.928 1.00 0.00 H new ATOM 0 HD23 LEU A 161 0.972 -2.942 5.480 1.00 0.00 H new ATOM 2126 N ALA A 162 -1.188 -1.963 0.939 1.00 0.00 N ATOM 2127 CA ALA A 162 -1.480 -2.570 -0.353 1.00 0.00 C ATOM 2128 C ALA A 162 -0.232 -2.629 -1.227 1.00 0.00 C ATOM 2129 O ALA A 162 0.094 -3.674 -1.791 1.00 0.00 O ATOM 2130 CB ALA A 162 -2.586 -1.799 -1.060 1.00 0.00 C ATOM 0 H ALA A 162 -1.647 -1.066 1.097 1.00 0.00 H new ATOM 0 HA ALA A 162 -1.818 -3.592 -0.179 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -2.794 -2.263 -2.024 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -3.488 -1.813 -0.448 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -2.269 -0.768 -1.215 1.00 0.00 H new ATOM 2136 N VAL A 163 0.463 -1.501 -1.335 1.00 0.00 N ATOM 2137 CA VAL A 163 1.677 -1.426 -2.141 1.00 0.00 C ATOM 2138 C VAL A 163 2.782 -2.293 -1.551 1.00 0.00 C ATOM 2139 O VAL A 163 3.566 -2.900 -2.282 1.00 0.00 O ATOM 2140 CB VAL A 163 2.183 0.025 -2.257 1.00 0.00 C ATOM 2141 CG1 VAL A 163 2.381 0.634 -0.877 1.00 0.00 C ATOM 2142 CG2 VAL A 163 3.473 0.075 -3.061 1.00 0.00 C ATOM 0 H VAL A 163 0.207 -0.627 -0.875 1.00 0.00 H new ATOM 0 HA VAL A 163 1.422 -1.795 -3.134 1.00 0.00 H new ATOM 0 HB VAL A 163 1.431 0.613 -2.782 1.00 0.00 H new ATOM 0 HG11 VAL A 163 2.739 1.659 -0.979 1.00 0.00 H new ATOM 0 HG12 VAL A 163 1.433 0.633 -0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 163 3.114 0.048 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL A 163 3.817 1.107 -3.133 1.00 0.00 H new ATOM 0 HG22 VAL A 163 4.234 -0.527 -2.565 1.00 0.00 H new ATOM 0 HG23 VAL A 163 3.294 -0.319 -4.061 1.00 0.00 H new ATOM 2152 N ARG A 164 2.840 -2.347 -0.225 1.00 0.00 N ATOM 2153 CA ARG A 164 3.852 -3.140 0.465 1.00 0.00 C ATOM 2154 C ARG A 164 3.661 -4.628 0.184 1.00 0.00 C ATOM 2155 O ARG A 164 4.576 -5.304 -0.286 1.00 0.00 O ATOM 2156 CB ARG A 164 3.793 -2.883 1.971 1.00 0.00 C ATOM 2157 CG ARG A 164 4.926 -2.011 2.485 1.00 0.00 C ATOM 2158 CD ARG A 164 6.224 -2.795 2.600 1.00 0.00 C ATOM 2159 NE ARG A 164 6.989 -2.772 1.356 1.00 0.00 N ATOM 2160 CZ ARG A 164 8.063 -3.524 1.140 1.00 0.00 C ATOM 2161 NH1 ARG A 164 8.497 -4.352 2.080 1.00 0.00 N ATOM 2162 NH2 ARG A 164 8.706 -3.448 -0.018 1.00 0.00 N ATOM 0 H ARG A 164 2.198 -1.851 0.394 1.00 0.00 H new ATOM 0 HA ARG A 164 4.831 -2.839 0.091 1.00 0.00 H new ATOM 0 HB2 ARG A 164 2.842 -2.408 2.213 1.00 0.00 H new ATOM 0 HB3 ARG A 164 3.815 -3.838 2.495 1.00 0.00 H new ATOM 0 HG2 ARG A 164 5.069 -1.165 1.813 1.00 0.00 H new ATOM 0 HG3 ARG A 164 4.659 -1.602 3.460 1.00 0.00 H new ATOM 0 HD2 ARG A 164 6.829 -2.379 3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 164 6.001 -3.827 2.870 1.00 0.00 H new ATOM 0 HE ARG A 164 6.682 -2.145 0.613 1.00 0.00 H new ATOM 0 HH11 ARG A 164 8.006 -4.413 2.972 1.00 0.00 H new ATOM 0 HH12 ARG A 164 9.322 -4.928 1.911 1.00 0.00 H new ATOM 0 HH21 ARG A 164 8.376 -2.812 -0.744 1.00 0.00 H new ATOM 0 HH22 ARG A 164 9.530 -4.026 -0.183 1.00 0.00 H new ATOM 2173 N GLY A 165 2.465 -5.131 0.474 1.00 0.00 N ATOM 2174 CA GLY A 165 2.175 -6.535 0.246 1.00 0.00 C ATOM 2175 C GLY A 165 2.267 -6.916 -1.218 1.00 0.00 C ATOM 2176 O GLY A 165 2.844 -7.946 -1.564 1.00 0.00 O ATOM 0 H GLY A 165 1.692 -4.591 0.863 1.00 0.00 H new ATOM 0 HA2 GLY A 165 2.872 -7.145 0.821 1.00 0.00 H new ATOM 0 HA3 GLY A 165 1.174 -6.761 0.615 1.00 0.00 H new ATOM 2179 N ALA A 166 1.693 -6.083 -2.081 1.00 0.00 N ATOM 2180 CA ALA A 166 1.712 -6.337 -3.516 1.00 0.00 C ATOM 2181 C ALA A 166 3.134 -6.577 -4.012 1.00 0.00 C ATOM 2182 O ALA A 166 3.366 -7.423 -4.875 1.00 0.00 O ATOM 2183 CB ALA A 166 1.078 -5.177 -4.267 1.00 0.00 C ATOM 0 H ALA A 166 1.209 -5.227 -1.811 1.00 0.00 H new ATOM 0 HA ALA A 166 1.131 -7.239 -3.707 1.00 0.00 H new ATOM 0 HB1 ALA A 166 1.100 -5.381 -5.337 1.00 0.00 H new ATOM 0 HB2 ALA A 166 0.045 -5.054 -3.942 1.00 0.00 H new ATOM 0 HB3 ALA A 166 1.634 -4.263 -4.061 1.00 0.00 H new ATOM 2189 N GLN A 167 4.082 -5.825 -3.462 1.00 0.00 N ATOM 2190 CA GLN A 167 5.482 -5.956 -3.851 1.00 0.00 C ATOM 2191 C GLN A 167 6.232 -6.867 -2.885 1.00 0.00 C ATOM 2192 O GLN A 167 6.363 -6.560 -1.701 1.00 0.00 O ATOM 2193 CB GLN A 167 6.151 -4.580 -3.896 1.00 0.00 C ATOM 2194 CG GLN A 167 5.463 -3.601 -4.835 1.00 0.00 C ATOM 2195 CD GLN A 167 6.447 -2.715 -5.576 1.00 0.00 C ATOM 2196 OE1 GLN A 167 7.369 -2.159 -4.979 1.00 0.00 O ATOM 2197 NE2 GLN A 167 6.255 -2.581 -6.882 1.00 0.00 N ATOM 0 H GLN A 167 3.907 -5.119 -2.747 1.00 0.00 H new ATOM 0 HA GLN A 167 5.517 -6.403 -4.845 1.00 0.00 H new ATOM 0 HB2 GLN A 167 6.165 -4.158 -2.891 1.00 0.00 H new ATOM 0 HB3 GLN A 167 7.189 -4.700 -4.206 1.00 0.00 H new ATOM 0 HG2 GLN A 167 4.864 -4.156 -5.557 1.00 0.00 H new ATOM 0 HG3 GLN A 167 4.776 -2.977 -4.264 1.00 0.00 H new ATOM 0 HE21 GLN A 167 5.477 -3.061 -7.335 1.00 0.00 H new ATOM 0 HE22 GLN A 167 6.885 -1.998 -7.433 1.00 0.00 H new ATOM 2204 N ALA A 168 6.723 -7.991 -3.401 1.00 0.00 N ATOM 2205 CA ALA A 168 7.461 -8.946 -2.585 1.00 0.00 C ATOM 2206 C ALA A 168 8.773 -8.346 -2.089 1.00 0.00 C ATOM 2207 O ALA A 168 9.112 -8.456 -0.910 1.00 0.00 O ATOM 2208 CB ALA A 168 7.725 -10.220 -3.373 1.00 0.00 C ATOM 0 H ALA A 168 6.622 -8.261 -4.379 1.00 0.00 H new ATOM 0 HA ALA A 168 6.852 -9.190 -1.715 1.00 0.00 H new ATOM 0 HB1 ALA A 168 8.277 -10.925 -2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 168 6.776 -10.666 -3.672 1.00 0.00 H new ATOM 0 HB3 ALA A 168 8.311 -9.984 -4.261 1.00 0.00 H new