USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 903 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 122 HIS : no HE2:sc= 1.13 K(o=2.1,f=-6.1!) USER MOD Set 1.2: A 124 HIS : no HE2:sc= 0.927 K(o=2.1,f=-4.6!) USER MOD Set 2.1: A 13 GLN : amide:sc= 1.68 K(o=3,f=1.2) USER MOD Set 2.2: A 40 SER OG : rot 144:sc= 1.31 USER MOD Set 3.1: A 32 SER OG : rot 50:sc= -0.166 USER MOD Set 3.2: A 35 SER OG : rot 132:sc= 1.11 USER MOD Set 4.1: A 14 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Set 4.2: A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.0556 (180deg=-0.323) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 CYS SG : rot -101:sc= 0.00591 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 148:sc= -0.0449 (180deg=-0.388) USER MOD Single : A 27 SER OG : rot -10:sc= 0.291 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc=-0.00852 K(o=-0.0085,f=-3!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 34:sc= 1.2 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 41 SER OG : rot 180:sc=-0.00162 USER MOD Single : A 47 THR OG1 : rot 164:sc= 0.667 USER MOD Single : A 49 THR OG1 : rot -120:sc= 0.0431 USER MOD Single : A 51 HIS : no HE2:sc= 0.609 K(o=0.61,f=-2.1!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc=-0.00168 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 CYS SG : rot 4:sc= -0.834 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.716! C(o=-0.72!,f=-2.9!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 ASN : amide:sc= 0.948 K(o=0.95,f=-0.87) USER MOD Single : A 80 HIS : no HD1:sc=-0.00179 X(o=-0.0018,f=0) USER MOD Single : A 84 ASN : amide:sc= 0.409 K(o=0.41,f=-0.2) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.0765 K(o=-0.076,f=-0.98) USER MOD Single : A 92 SER OG : rot -119:sc= -0.02 USER MOD Single : A 95 CYS SG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot -45:sc= 0.01 USER MOD Single : A 100 SER OG : rot -48:sc= 1.4 USER MOD Single : A 102 LYS NZ :NH3+ 169:sc= 1.22 (180deg=1.14) USER MOD Single : A 106 LYS NZ :NH3+ 137:sc= 2.1 (180deg=0.499) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 26:sc= 0.0941 USER MOD Single : A 114 GLN : amide:sc=-0.00938 X(o=-0.0094,f=-0.097) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 HIS : no HE2:sc= 0.45 K(o=0.45,f=-1.6) USER MOD Single : A 120 HIS : no HD1:sc= -0.197 X(o=-0.2,f=0) USER MOD Single : A 121 HIS : no HE2:sc= 0.298 K(o=0.3,f=-1.4) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.829 31.047 26.339 1.00 0.00 N ATOM 2 CA MET A 1 27.653 32.504 26.153 1.00 0.00 C ATOM 3 C MET A 1 28.257 33.266 27.336 1.00 0.00 C ATOM 4 O MET A 1 28.453 32.686 28.405 1.00 0.00 O ATOM 5 CB MET A 1 26.171 32.869 25.978 1.00 0.00 C ATOM 6 CG MET A 1 25.550 32.290 24.700 1.00 0.00 C ATOM 7 SD MET A 1 23.744 32.425 24.644 1.00 0.00 S ATOM 8 CE MET A 1 23.439 31.684 23.017 1.00 0.00 C ATOM 0 H1 MET A 1 28.373 30.659 25.543 1.00 0.00 H new ATOM 0 H2 MET A 1 28.340 30.870 27.227 1.00 0.00 H new ATOM 0 H3 MET A 1 26.897 30.587 26.378 1.00 0.00 H new ATOM 0 HA MET A 1 28.177 32.794 25.242 1.00 0.00 H new ATOM 0 HB2 MET A 1 25.611 32.509 26.841 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.071 33.954 25.963 1.00 0.00 H new ATOM 0 HG2 MET A 1 25.971 32.805 23.836 1.00 0.00 H new ATOM 0 HG3 MET A 1 25.830 31.240 24.614 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.368 31.683 22.813 1.00 0.00 H new ATOM 0 HE2 MET A 1 23.954 32.263 22.251 1.00 0.00 H new ATOM 0 HE3 MET A 1 23.811 30.659 23.008 1.00 0.00 H new ATOM 20 N SER A 2 28.504 34.571 27.166 1.00 0.00 N ATOM 21 CA SER A 2 29.211 35.458 28.113 1.00 0.00 C ATOM 22 C SER A 2 30.694 35.142 28.361 1.00 0.00 C ATOM 23 O SER A 2 31.222 34.112 27.935 1.00 0.00 O ATOM 24 CB SER A 2 28.450 35.595 29.442 1.00 0.00 C ATOM 25 OG SER A 2 28.394 36.959 29.812 1.00 0.00 O ATOM 0 H SER A 2 28.204 35.066 26.326 1.00 0.00 H new ATOM 0 HA SER A 2 29.222 36.418 27.597 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.442 35.193 29.340 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.947 35.016 30.220 1.00 0.00 H new ATOM 0 HG SER A 2 27.908 37.049 30.658 1.00 0.00 H new ATOM 31 N PHE A 3 31.375 36.077 29.020 1.00 0.00 N ATOM 32 CA PHE A 3 32.802 36.054 29.357 1.00 0.00 C ATOM 33 C PHE A 3 33.093 37.061 30.486 1.00 0.00 C ATOM 34 O PHE A 3 32.350 38.029 30.656 1.00 0.00 O ATOM 35 CB PHE A 3 33.636 36.384 28.099 1.00 0.00 C ATOM 36 CG PHE A 3 33.097 37.521 27.238 1.00 0.00 C ATOM 37 CD1 PHE A 3 33.269 38.863 27.629 1.00 0.00 C ATOM 38 CD2 PHE A 3 32.385 37.232 26.055 1.00 0.00 C ATOM 39 CE1 PHE A 3 32.714 39.903 26.862 1.00 0.00 C ATOM 40 CE2 PHE A 3 31.829 38.273 25.288 1.00 0.00 C ATOM 41 CZ PHE A 3 31.984 39.608 25.697 1.00 0.00 C ATOM 0 H PHE A 3 30.919 36.925 29.355 1.00 0.00 H new ATOM 0 HA PHE A 3 33.077 35.059 29.708 1.00 0.00 H new ATOM 0 HB2 PHE A 3 34.649 36.636 28.411 1.00 0.00 H new ATOM 0 HB3 PHE A 3 33.706 35.487 27.484 1.00 0.00 H new ATOM 0 HD1 PHE A 3 33.830 39.095 28.522 1.00 0.00 H new ATOM 0 HD2 PHE A 3 32.266 36.207 25.736 1.00 0.00 H new ATOM 0 HE1 PHE A 3 32.849 40.930 27.168 1.00 0.00 H new ATOM 0 HE2 PHE A 3 31.283 38.045 24.384 1.00 0.00 H new ATOM 0 HZ PHE A 3 31.543 40.406 25.118 1.00 0.00 H new ATOM 51 N CYS A 4 34.187 36.871 31.229 1.00 0.00 N ATOM 52 CA CYS A 4 34.720 37.853 32.177 1.00 0.00 C ATOM 53 C CYS A 4 36.252 37.957 32.053 1.00 0.00 C ATOM 54 O CYS A 4 36.949 36.935 32.005 1.00 0.00 O ATOM 55 CB CYS A 4 34.261 37.485 33.594 1.00 0.00 C ATOM 56 SG CYS A 4 34.735 38.812 34.739 1.00 0.00 S ATOM 0 H CYS A 4 34.738 36.013 31.187 1.00 0.00 H new ATOM 0 HA CYS A 4 34.330 38.844 31.946 1.00 0.00 H new ATOM 0 HB2 CYS A 4 33.181 37.341 33.613 1.00 0.00 H new ATOM 0 HB3 CYS A 4 34.714 36.543 33.903 1.00 0.00 H new ATOM 0 HG CYS A 4 35.809 38.465 35.384 1.00 0.00 H new ATOM 62 N SER A 5 36.766 39.191 31.997 1.00 0.00 N ATOM 63 CA SER A 5 38.166 39.519 31.702 1.00 0.00 C ATOM 64 C SER A 5 38.643 40.699 32.548 1.00 0.00 C ATOM 65 O SER A 5 38.212 41.833 32.343 1.00 0.00 O ATOM 66 CB SER A 5 38.344 39.880 30.215 1.00 0.00 C ATOM 67 OG SER A 5 37.981 38.805 29.365 1.00 0.00 O ATOM 0 H SER A 5 36.196 40.021 32.162 1.00 0.00 H new ATOM 0 HA SER A 5 38.759 38.636 31.940 1.00 0.00 H new ATOM 0 HB2 SER A 5 37.735 40.753 29.977 1.00 0.00 H new ATOM 0 HB3 SER A 5 39.382 40.155 30.030 1.00 0.00 H new ATOM 0 HG SER A 5 38.105 39.071 28.430 1.00 0.00 H new ATOM 73 N PHE A 6 39.575 40.443 33.465 1.00 0.00 N ATOM 74 CA PHE A 6 40.297 41.486 34.200 1.00 0.00 C ATOM 75 C PHE A 6 41.649 41.775 33.530 1.00 0.00 C ATOM 76 O PHE A 6 42.418 40.849 33.264 1.00 0.00 O ATOM 77 CB PHE A 6 40.519 41.065 35.660 1.00 0.00 C ATOM 78 CG PHE A 6 39.273 40.846 36.499 1.00 0.00 C ATOM 79 CD1 PHE A 6 38.616 39.600 36.483 1.00 0.00 C ATOM 80 CD2 PHE A 6 38.806 41.866 37.351 1.00 0.00 C ATOM 81 CE1 PHE A 6 37.493 39.381 37.303 1.00 0.00 C ATOM 82 CE2 PHE A 6 37.691 41.642 38.179 1.00 0.00 C ATOM 83 CZ PHE A 6 37.032 40.401 38.153 1.00 0.00 C ATOM 0 H PHE A 6 39.854 39.496 33.723 1.00 0.00 H new ATOM 0 HA PHE A 6 39.692 42.393 34.185 1.00 0.00 H new ATOM 0 HB2 PHE A 6 41.100 40.143 35.664 1.00 0.00 H new ATOM 0 HB3 PHE A 6 41.128 41.827 36.146 1.00 0.00 H new ATOM 0 HD1 PHE A 6 38.975 38.810 35.840 1.00 0.00 H new ATOM 0 HD2 PHE A 6 39.306 42.823 37.369 1.00 0.00 H new ATOM 0 HE1 PHE A 6 36.985 38.428 37.279 1.00 0.00 H new ATOM 0 HE2 PHE A 6 37.341 42.425 38.836 1.00 0.00 H new ATOM 0 HZ PHE A 6 36.173 40.231 38.785 1.00 0.00 H new ATOM 93 N PHE A 7 41.975 43.054 33.323 1.00 0.00 N ATOM 94 CA PHE A 7 43.350 43.480 33.047 1.00 0.00 C ATOM 95 C PHE A 7 44.110 43.583 34.377 1.00 0.00 C ATOM 96 O PHE A 7 43.601 44.170 35.332 1.00 0.00 O ATOM 97 CB PHE A 7 43.344 44.804 32.269 1.00 0.00 C ATOM 98 CG PHE A 7 44.691 45.183 31.677 1.00 0.00 C ATOM 99 CD1 PHE A 7 45.699 45.732 32.493 1.00 0.00 C ATOM 100 CD2 PHE A 7 44.934 45.001 30.301 1.00 0.00 C ATOM 101 CE1 PHE A 7 46.947 46.077 31.943 1.00 0.00 C ATOM 102 CE2 PHE A 7 46.174 45.367 29.747 1.00 0.00 C ATOM 103 CZ PHE A 7 47.184 45.895 30.569 1.00 0.00 C ATOM 0 H PHE A 7 41.299 43.818 33.342 1.00 0.00 H new ATOM 0 HA PHE A 7 43.861 42.749 32.420 1.00 0.00 H new ATOM 0 HB2 PHE A 7 42.612 44.737 31.464 1.00 0.00 H new ATOM 0 HB3 PHE A 7 43.014 45.602 32.934 1.00 0.00 H new ATOM 0 HD1 PHE A 7 45.513 45.889 33.545 1.00 0.00 H new ATOM 0 HD2 PHE A 7 44.166 44.579 29.670 1.00 0.00 H new ATOM 0 HE1 PHE A 7 47.723 46.482 32.576 1.00 0.00 H new ATOM 0 HE2 PHE A 7 46.350 45.242 28.689 1.00 0.00 H new ATOM 0 HZ PHE A 7 48.141 46.161 30.146 1.00 0.00 H new ATOM 113 N GLY A 8 45.307 43.002 34.460 1.00 0.00 N ATOM 114 CA GLY A 8 45.992 42.790 35.738 1.00 0.00 C ATOM 115 C GLY A 8 47.479 42.422 35.670 1.00 0.00 C ATOM 116 O GLY A 8 48.038 42.042 36.695 1.00 0.00 O ATOM 0 H GLY A 8 45.828 42.666 33.650 1.00 0.00 H new ATOM 0 HA2 GLY A 8 45.893 43.699 36.332 1.00 0.00 H new ATOM 0 HA3 GLY A 8 45.470 41.999 36.277 1.00 0.00 H new ATOM 120 N GLY A 9 48.129 42.538 34.506 1.00 0.00 N ATOM 121 CA GLY A 9 49.506 42.084 34.219 1.00 0.00 C ATOM 122 C GLY A 9 50.673 42.731 34.992 1.00 0.00 C ATOM 123 O GLY A 9 51.817 42.582 34.575 1.00 0.00 O ATOM 0 H GLY A 9 47.691 42.972 33.694 1.00 0.00 H new ATOM 0 HA2 GLY A 9 49.545 41.010 34.400 1.00 0.00 H new ATOM 0 HA3 GLY A 9 49.689 42.235 33.155 1.00 0.00 H new ATOM 127 N GLU A 10 50.412 43.463 36.075 1.00 0.00 N ATOM 128 CA GLU A 10 51.338 44.367 36.760 1.00 0.00 C ATOM 129 C GLU A 10 51.627 43.961 38.215 1.00 0.00 C ATOM 130 O GLU A 10 50.889 43.196 38.842 1.00 0.00 O ATOM 131 CB GLU A 10 50.756 45.792 36.678 1.00 0.00 C ATOM 132 CG GLU A 10 51.442 46.689 35.655 1.00 0.00 C ATOM 133 CD GLU A 10 52.909 47.017 35.972 1.00 0.00 C ATOM 134 OE1 GLU A 10 53.423 46.543 37.012 1.00 0.00 O ATOM 135 OE2 GLU A 10 53.519 47.735 35.149 1.00 0.00 O ATOM 0 H GLU A 10 49.496 43.440 36.524 1.00 0.00 H new ATOM 0 HA GLU A 10 52.305 44.316 36.260 1.00 0.00 H new ATOM 0 HB2 GLU A 10 49.696 45.726 36.434 1.00 0.00 H new ATOM 0 HB3 GLU A 10 50.828 46.259 37.660 1.00 0.00 H new ATOM 0 HG2 GLU A 10 51.394 46.207 34.679 1.00 0.00 H new ATOM 0 HG3 GLU A 10 50.884 47.622 35.577 1.00 0.00 H new ATOM 142 N VAL A 11 52.686 44.532 38.795 1.00 0.00 N ATOM 143 CA VAL A 11 53.156 44.278 40.174 1.00 0.00 C ATOM 144 C VAL A 11 52.113 44.639 41.250 1.00 0.00 C ATOM 145 O VAL A 11 52.147 44.120 42.371 1.00 0.00 O ATOM 146 CB VAL A 11 54.507 44.993 40.385 1.00 0.00 C ATOM 147 CG1 VAL A 11 54.370 46.509 40.568 1.00 0.00 C ATOM 148 CG2 VAL A 11 55.285 44.401 41.563 1.00 0.00 C ATOM 0 H VAL A 11 53.267 45.211 38.304 1.00 0.00 H new ATOM 0 HA VAL A 11 53.303 43.205 40.295 1.00 0.00 H new ATOM 0 HB VAL A 11 55.066 44.823 39.465 1.00 0.00 H new ATOM 0 HG11 VAL A 11 55.357 46.949 40.712 1.00 0.00 H new ATOM 0 HG12 VAL A 11 53.905 46.942 39.682 1.00 0.00 H new ATOM 0 HG13 VAL A 11 53.750 46.716 41.441 1.00 0.00 H new ATOM 0 HG21 VAL A 11 56.230 44.932 41.678 1.00 0.00 H new ATOM 0 HG22 VAL A 11 54.697 44.504 42.475 1.00 0.00 H new ATOM 0 HG23 VAL A 11 55.482 43.346 41.375 1.00 0.00 H new ATOM 158 N PHE A 12 51.089 45.412 40.870 1.00 0.00 N ATOM 159 CA PHE A 12 49.906 45.702 41.691 1.00 0.00 C ATOM 160 C PHE A 12 48.968 44.491 41.915 1.00 0.00 C ATOM 161 O PHE A 12 47.903 44.633 42.518 1.00 0.00 O ATOM 162 CB PHE A 12 49.182 46.959 41.170 1.00 0.00 C ATOM 163 CG PHE A 12 48.225 46.827 39.989 1.00 0.00 C ATOM 164 CD1 PHE A 12 48.304 45.763 39.067 1.00 0.00 C ATOM 165 CD2 PHE A 12 47.227 47.807 39.817 1.00 0.00 C ATOM 166 CE1 PHE A 12 47.400 45.685 37.993 1.00 0.00 C ATOM 167 CE2 PHE A 12 46.324 47.730 38.740 1.00 0.00 C ATOM 168 CZ PHE A 12 46.409 46.666 37.828 1.00 0.00 C ATOM 0 H PHE A 12 51.059 45.866 39.957 1.00 0.00 H new ATOM 0 HA PHE A 12 50.267 45.921 42.696 1.00 0.00 H new ATOM 0 HB2 PHE A 12 48.621 47.384 42.002 1.00 0.00 H new ATOM 0 HB3 PHE A 12 49.945 47.688 40.895 1.00 0.00 H new ATOM 0 HD1 PHE A 12 49.063 45.004 39.186 1.00 0.00 H new ATOM 0 HD2 PHE A 12 47.154 48.625 40.518 1.00 0.00 H new ATOM 0 HE1 PHE A 12 47.468 44.867 37.292 1.00 0.00 H new ATOM 0 HE2 PHE A 12 45.566 48.489 38.615 1.00 0.00 H new ATOM 0 HZ PHE A 12 45.715 46.602 37.003 1.00 0.00 H new ATOM 178 N GLN A 13 49.384 43.277 41.515 1.00 0.00 N ATOM 179 CA GLN A 13 48.844 42.020 42.060 1.00 0.00 C ATOM 180 C GLN A 13 48.862 41.985 43.599 1.00 0.00 C ATOM 181 O GLN A 13 48.010 41.349 44.217 1.00 0.00 O ATOM 182 CB GLN A 13 49.583 40.795 41.513 1.00 0.00 C ATOM 183 CG GLN A 13 51.078 40.702 41.856 1.00 0.00 C ATOM 184 CD GLN A 13 51.837 40.039 40.722 1.00 0.00 C ATOM 185 OE1 GLN A 13 52.267 38.895 40.782 1.00 0.00 O ATOM 186 NE2 GLN A 13 51.994 40.735 39.625 1.00 0.00 N ATOM 0 H GLN A 13 50.104 43.140 40.805 1.00 0.00 H new ATOM 0 HA GLN A 13 47.805 41.983 41.731 1.00 0.00 H new ATOM 0 HB2 GLN A 13 49.088 39.899 41.888 1.00 0.00 H new ATOM 0 HB3 GLN A 13 49.478 40.787 40.428 1.00 0.00 H new ATOM 0 HG2 GLN A 13 51.479 41.699 42.038 1.00 0.00 H new ATOM 0 HG3 GLN A 13 51.213 40.132 42.775 1.00 0.00 H new ATOM 0 HE21 GLN A 13 51.637 41.689 39.571 1.00 0.00 H new ATOM 0 HE22 GLN A 13 52.473 40.324 38.824 1.00 0.00 H new ATOM 195 N ASN A 14 49.842 42.660 44.215 1.00 0.00 N ATOM 196 CA ASN A 14 50.008 42.700 45.668 1.00 0.00 C ATOM 197 C ASN A 14 50.659 43.977 46.201 1.00 0.00 C ATOM 198 O ASN A 14 50.236 44.539 47.210 1.00 0.00 O ATOM 199 CB ASN A 14 50.852 41.479 46.054 1.00 0.00 C ATOM 200 CG ASN A 14 50.879 41.275 47.550 1.00 0.00 C ATOM 201 OD1 ASN A 14 51.820 41.641 48.236 1.00 0.00 O ATOM 202 ND2 ASN A 14 49.871 40.645 48.095 1.00 0.00 N ATOM 0 H ASN A 14 50.547 43.198 43.711 1.00 0.00 H new ATOM 0 HA ASN A 14 49.016 42.687 46.120 1.00 0.00 H new ATOM 0 HB2 ASN A 14 50.448 40.589 45.572 1.00 0.00 H new ATOM 0 HB3 ASN A 14 51.870 41.607 45.685 1.00 0.00 H new ATOM 0 HD21 ASN A 14 49.869 40.457 49.098 1.00 0.00 H new ATOM 0 HD22 ASN A 14 49.087 40.341 47.518 1.00 0.00 H new ATOM 209 N HIS A 15 51.707 44.414 45.520 1.00 0.00 N ATOM 210 CA HIS A 15 52.661 45.384 46.037 1.00 0.00 C ATOM 211 C HIS A 15 52.352 46.797 45.528 1.00 0.00 C ATOM 212 O HIS A 15 52.372 47.049 44.325 1.00 0.00 O ATOM 213 CB HIS A 15 54.078 44.930 45.659 1.00 0.00 C ATOM 214 CG HIS A 15 54.431 43.525 46.100 1.00 0.00 C ATOM 215 ND1 HIS A 15 54.478 43.061 47.395 1.00 0.00 N ATOM 216 CD2 HIS A 15 54.769 42.472 45.290 1.00 0.00 C ATOM 217 CE1 HIS A 15 54.838 41.767 47.365 1.00 0.00 C ATOM 218 NE2 HIS A 15 55.021 41.356 46.099 1.00 0.00 N ATOM 0 H HIS A 15 51.923 44.099 44.574 1.00 0.00 H new ATOM 0 HA HIS A 15 52.584 45.431 47.123 1.00 0.00 H new ATOM 0 HB2 HIS A 15 54.189 44.995 44.577 1.00 0.00 H new ATOM 0 HB3 HIS A 15 54.796 45.624 46.096 1.00 0.00 H new ATOM 0 HD2 HIS A 15 54.831 42.498 44.212 1.00 0.00 H new ATOM 0 HE1 HIS A 15 54.963 41.143 48.238 1.00 0.00 H new ATOM 0 HE2 HIS A 15 55.289 40.422 45.790 1.00 0.00 H new ATOM 226 N PHE A 16 52.105 47.721 46.461 1.00 0.00 N ATOM 227 CA PHE A 16 51.976 49.161 46.192 1.00 0.00 C ATOM 228 C PHE A 16 53.091 49.998 46.860 1.00 0.00 C ATOM 229 O PHE A 16 53.079 51.223 46.789 1.00 0.00 O ATOM 230 CB PHE A 16 50.554 49.618 46.570 1.00 0.00 C ATOM 231 CG PHE A 16 50.072 50.829 45.791 1.00 0.00 C ATOM 232 CD1 PHE A 16 49.559 50.664 44.490 1.00 0.00 C ATOM 233 CD2 PHE A 16 50.172 52.121 46.340 1.00 0.00 C ATOM 234 CE1 PHE A 16 49.169 51.786 43.734 1.00 0.00 C ATOM 235 CE2 PHE A 16 49.792 53.243 45.581 1.00 0.00 C ATOM 236 CZ PHE A 16 49.300 53.076 44.276 1.00 0.00 C ATOM 0 H PHE A 16 51.986 47.486 47.447 1.00 0.00 H new ATOM 0 HA PHE A 16 52.117 49.336 45.125 1.00 0.00 H new ATOM 0 HB2 PHE A 16 49.861 48.793 46.405 1.00 0.00 H new ATOM 0 HB3 PHE A 16 50.528 49.849 47.635 1.00 0.00 H new ATOM 0 HD1 PHE A 16 49.464 49.673 44.071 1.00 0.00 H new ATOM 0 HD2 PHE A 16 50.541 52.251 47.346 1.00 0.00 H new ATOM 0 HE1 PHE A 16 48.770 51.655 42.739 1.00 0.00 H new ATOM 0 HE2 PHE A 16 49.879 54.234 46.002 1.00 0.00 H new ATOM 0 HZ PHE A 16 49.022 53.939 43.689 1.00 0.00 H new ATOM 246 N GLU A 17 54.067 49.352 47.511 1.00 0.00 N ATOM 247 CA GLU A 17 55.168 50.000 48.234 1.00 0.00 C ATOM 248 C GLU A 17 56.556 49.701 47.625 1.00 0.00 C ATOM 249 O GLU A 17 56.779 48.599 47.117 1.00 0.00 O ATOM 250 CB GLU A 17 55.086 49.637 49.724 1.00 0.00 C ATOM 251 CG GLU A 17 55.476 48.194 50.069 1.00 0.00 C ATOM 252 CD GLU A 17 55.165 47.822 51.530 1.00 0.00 C ATOM 253 OE1 GLU A 17 54.637 48.679 52.282 1.00 0.00 O ATOM 254 OE2 GLU A 17 55.440 46.666 51.950 1.00 0.00 O ATOM 0 H GLU A 17 54.113 48.334 47.550 1.00 0.00 H new ATOM 0 HA GLU A 17 55.050 51.079 48.131 1.00 0.00 H new ATOM 0 HB2 GLU A 17 55.733 50.314 50.282 1.00 0.00 H new ATOM 0 HB3 GLU A 17 54.067 49.813 50.068 1.00 0.00 H new ATOM 0 HG2 GLU A 17 54.946 47.511 49.405 1.00 0.00 H new ATOM 0 HG3 GLU A 17 56.541 48.057 49.883 1.00 0.00 H new ATOM 261 N PRO A 18 57.507 50.656 47.675 1.00 0.00 N ATOM 262 CA PRO A 18 58.867 50.479 47.163 1.00 0.00 C ATOM 263 C PRO A 18 59.771 49.731 48.159 1.00 0.00 C ATOM 264 O PRO A 18 59.450 49.584 49.337 1.00 0.00 O ATOM 265 CB PRO A 18 59.354 51.902 46.866 1.00 0.00 C ATOM 266 CG PRO A 18 58.635 52.753 47.913 1.00 0.00 C ATOM 267 CD PRO A 18 57.312 52.023 48.134 1.00 0.00 C ATOM 0 HA PRO A 18 58.894 49.853 46.271 1.00 0.00 H new ATOM 0 HB2 PRO A 18 60.437 51.983 46.959 1.00 0.00 H new ATOM 0 HB3 PRO A 18 59.097 52.211 45.853 1.00 0.00 H new ATOM 0 HG2 PRO A 18 59.212 52.823 48.835 1.00 0.00 H new ATOM 0 HG3 PRO A 18 58.475 53.771 47.559 1.00 0.00 H new ATOM 0 HD2 PRO A 18 57.031 52.041 49.187 1.00 0.00 H new ATOM 0 HD3 PRO A 18 56.506 52.506 47.581 1.00 0.00 H new ATOM 275 N GLY A 19 60.948 49.282 47.715 1.00 0.00 N ATOM 276 CA GLY A 19 61.876 48.538 48.571 1.00 0.00 C ATOM 277 C GLY A 19 63.198 48.156 47.902 1.00 0.00 C ATOM 278 O GLY A 19 63.505 48.631 46.804 1.00 0.00 O ATOM 0 H GLY A 19 61.282 49.422 46.762 1.00 0.00 H new ATOM 0 HA2 GLY A 19 62.092 49.137 49.456 1.00 0.00 H new ATOM 0 HA3 GLY A 19 61.382 47.629 48.914 1.00 0.00 H new ATOM 282 N VAL A 20 63.989 47.324 48.588 1.00 0.00 N ATOM 283 CA VAL A 20 65.345 46.906 48.174 1.00 0.00 C ATOM 284 C VAL A 20 65.587 45.418 48.491 1.00 0.00 C ATOM 285 O VAL A 20 64.901 44.837 49.330 1.00 0.00 O ATOM 286 CB VAL A 20 66.426 47.756 48.870 1.00 0.00 C ATOM 287 CG1 VAL A 20 67.757 47.782 48.098 1.00 0.00 C ATOM 288 CG2 VAL A 20 66.043 49.224 49.123 1.00 0.00 C ATOM 0 H VAL A 20 63.701 46.907 49.473 1.00 0.00 H new ATOM 0 HA VAL A 20 65.413 47.057 47.097 1.00 0.00 H new ATOM 0 HB VAL A 20 66.530 47.246 49.828 1.00 0.00 H new ATOM 0 HG11 VAL A 20 68.478 48.396 48.637 1.00 0.00 H new ATOM 0 HG12 VAL A 20 68.143 46.767 48.004 1.00 0.00 H new ATOM 0 HG13 VAL A 20 67.594 48.201 47.105 1.00 0.00 H new ATOM 0 HG21 VAL A 20 66.869 49.736 49.616 1.00 0.00 H new ATOM 0 HG22 VAL A 20 65.829 49.713 48.173 1.00 0.00 H new ATOM 0 HG23 VAL A 20 65.159 49.265 49.760 1.00 0.00 H new ATOM 298 N TYR A 21 66.593 44.808 47.866 1.00 0.00 N ATOM 299 CA TYR A 21 67.057 43.443 48.159 1.00 0.00 C ATOM 300 C TYR A 21 68.348 43.466 48.987 1.00 0.00 C ATOM 301 O TYR A 21 69.135 44.405 48.864 1.00 0.00 O ATOM 302 CB TYR A 21 67.245 42.655 46.857 1.00 0.00 C ATOM 303 CG TYR A 21 65.944 42.253 46.190 1.00 0.00 C ATOM 304 CD1 TYR A 21 65.318 41.050 46.562 1.00 0.00 C ATOM 305 CD2 TYR A 21 65.353 43.079 45.212 1.00 0.00 C ATOM 306 CE1 TYR A 21 64.111 40.660 45.951 1.00 0.00 C ATOM 307 CE2 TYR A 21 64.144 42.696 44.600 1.00 0.00 C ATOM 308 CZ TYR A 21 63.522 41.482 44.969 1.00 0.00 C ATOM 309 OH TYR A 21 62.358 41.102 44.382 1.00 0.00 O ATOM 0 H TYR A 21 67.125 45.257 47.121 1.00 0.00 H new ATOM 0 HA TYR A 21 66.296 42.940 48.755 1.00 0.00 H new ATOM 0 HB2 TYR A 21 67.828 43.257 46.160 1.00 0.00 H new ATOM 0 HB3 TYR A 21 67.827 41.758 47.067 1.00 0.00 H new ATOM 0 HD1 TYR A 21 65.765 40.423 47.319 1.00 0.00 H new ATOM 0 HD2 TYR A 21 65.829 44.007 44.932 1.00 0.00 H new ATOM 0 HE1 TYR A 21 63.637 39.732 46.234 1.00 0.00 H new ATOM 0 HE2 TYR A 21 63.693 43.329 43.850 1.00 0.00 H new ATOM 0 HH TYR A 21 62.085 41.779 43.728 1.00 0.00 H new ATOM 319 N VAL A 22 68.567 42.448 49.828 1.00 0.00 N ATOM 320 CA VAL A 22 69.765 42.328 50.682 1.00 0.00 C ATOM 321 C VAL A 22 70.256 40.879 50.767 1.00 0.00 C ATOM 322 O VAL A 22 69.482 39.947 50.530 1.00 0.00 O ATOM 323 CB VAL A 22 69.573 42.928 52.100 1.00 0.00 C ATOM 324 CG1 VAL A 22 68.696 44.187 52.133 1.00 0.00 C ATOM 325 CG2 VAL A 22 68.930 41.973 53.120 1.00 0.00 C ATOM 0 H VAL A 22 67.913 41.673 49.939 1.00 0.00 H new ATOM 0 HA VAL A 22 70.534 42.926 50.193 1.00 0.00 H new ATOM 0 HB VAL A 22 70.604 43.151 52.373 1.00 0.00 H new ATOM 0 HG11 VAL A 22 68.611 44.544 53.159 1.00 0.00 H new ATOM 0 HG12 VAL A 22 69.149 44.962 51.515 1.00 0.00 H new ATOM 0 HG13 VAL A 22 67.704 43.950 51.748 1.00 0.00 H new ATOM 0 HG21 VAL A 22 68.835 42.478 54.082 1.00 0.00 H new ATOM 0 HG22 VAL A 22 67.942 41.676 52.768 1.00 0.00 H new ATOM 0 HG23 VAL A 22 69.556 41.088 53.235 1.00 0.00 H new ATOM 335 N CYS A 23 71.519 40.673 51.148 1.00 0.00 N ATOM 336 CA CYS A 23 72.101 39.330 51.191 1.00 0.00 C ATOM 337 C CYS A 23 71.366 38.383 52.170 1.00 0.00 C ATOM 338 O CYS A 23 70.859 38.791 53.220 1.00 0.00 O ATOM 339 CB CYS A 23 73.608 39.430 51.479 1.00 0.00 C ATOM 340 SG CYS A 23 74.387 37.792 51.370 1.00 0.00 S ATOM 0 H CYS A 23 72.157 41.417 51.430 1.00 0.00 H new ATOM 0 HA CYS A 23 71.967 38.871 50.211 1.00 0.00 H new ATOM 0 HB2 CYS A 23 74.076 40.110 50.767 1.00 0.00 H new ATOM 0 HB3 CYS A 23 73.767 39.850 52.472 1.00 0.00 H new ATOM 345 N ALA A 24 71.399 37.091 51.842 1.00 0.00 N ATOM 346 CA ALA A 24 70.981 36.012 52.731 1.00 0.00 C ATOM 347 C ALA A 24 71.772 36.005 54.060 1.00 0.00 C ATOM 348 O ALA A 24 71.201 35.719 55.113 1.00 0.00 O ATOM 349 CB ALA A 24 71.151 34.684 51.982 1.00 0.00 C ATOM 0 H ALA A 24 71.724 36.761 50.933 1.00 0.00 H new ATOM 0 HA ALA A 24 69.937 36.162 53.005 1.00 0.00 H new ATOM 0 HB1 ALA A 24 70.844 33.861 52.627 1.00 0.00 H new ATOM 0 HB2 ALA A 24 70.533 34.691 51.084 1.00 0.00 H new ATOM 0 HB3 ALA A 24 72.197 34.556 51.702 1.00 0.00 H new ATOM 355 N LYS A 25 73.069 36.346 54.003 1.00 0.00 N ATOM 356 CA LYS A 25 74.054 36.226 55.093 1.00 0.00 C ATOM 357 C LYS A 25 74.704 37.539 55.515 1.00 0.00 C ATOM 358 O LYS A 25 74.909 37.770 56.707 1.00 0.00 O ATOM 359 CB LYS A 25 75.134 35.230 54.647 1.00 0.00 C ATOM 360 CG LYS A 25 74.864 33.834 55.214 1.00 0.00 C ATOM 361 CD LYS A 25 75.265 33.689 56.690 1.00 0.00 C ATOM 362 CE LYS A 25 76.666 33.088 56.895 1.00 0.00 C ATOM 363 NZ LYS A 25 77.762 33.978 56.434 1.00 0.00 N ATOM 0 H LYS A 25 73.481 36.732 53.154 1.00 0.00 H new ATOM 0 HA LYS A 25 73.514 35.882 55.975 1.00 0.00 H new ATOM 0 HB2 LYS A 25 75.164 35.184 53.558 1.00 0.00 H new ATOM 0 HB3 LYS A 25 76.113 35.577 54.978 1.00 0.00 H new ATOM 0 HG2 LYS A 25 73.803 33.606 55.109 1.00 0.00 H new ATOM 0 HG3 LYS A 25 75.409 33.098 54.623 1.00 0.00 H new ATOM 0 HD2 LYS A 25 75.227 34.669 57.165 1.00 0.00 H new ATOM 0 HD3 LYS A 25 74.532 33.060 57.196 1.00 0.00 H new ATOM 0 HE2 LYS A 25 76.808 32.868 57.953 1.00 0.00 H new ATOM 0 HE3 LYS A 25 76.728 32.140 56.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 78.601 33.833 57.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 77.997 33.756 55.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 77.456 34.970 56.503 1.00 0.00 H new ATOM 377 N CYS A 26 75.035 38.367 54.536 1.00 0.00 N ATOM 378 CA CYS A 26 75.836 39.566 54.685 1.00 0.00 C ATOM 379 C CYS A 26 74.982 40.795 55.074 1.00 0.00 C ATOM 380 O CYS A 26 75.535 41.800 55.520 1.00 0.00 O ATOM 381 CB CYS A 26 76.581 39.735 53.354 1.00 0.00 C ATOM 382 SG CYS A 26 77.295 38.180 52.734 1.00 0.00 S ATOM 0 H CYS A 26 74.737 38.212 53.573 1.00 0.00 H new ATOM 0 HA CYS A 26 76.545 39.477 55.508 1.00 0.00 H new ATOM 0 HB2 CYS A 26 75.894 40.135 52.608 1.00 0.00 H new ATOM 0 HB3 CYS A 26 77.377 40.469 53.481 1.00 0.00 H new ATOM 387 N SER A 27 73.671 40.699 54.805 1.00 0.00 N ATOM 388 CA SER A 27 72.614 41.708 54.994 1.00 0.00 C ATOM 389 C SER A 27 72.836 43.053 54.290 1.00 0.00 C ATOM 390 O SER A 27 72.024 43.960 54.452 1.00 0.00 O ATOM 391 CB SER A 27 72.228 41.872 56.470 1.00 0.00 C ATOM 392 OG SER A 27 73.284 42.408 57.234 1.00 0.00 O ATOM 0 H SER A 27 73.288 39.838 54.415 1.00 0.00 H new ATOM 0 HA SER A 27 71.757 41.288 54.468 1.00 0.00 H new ATOM 0 HB2 SER A 27 71.357 42.523 56.547 1.00 0.00 H new ATOM 0 HB3 SER A 27 71.939 40.904 56.879 1.00 0.00 H new ATOM 0 HG SER A 27 74.105 42.414 56.699 1.00 0.00 H new ATOM 398 N TYR A 28 73.879 43.153 53.464 1.00 0.00 N ATOM 399 CA TYR A 28 74.197 44.332 52.665 1.00 0.00 C ATOM 400 C TYR A 28 73.206 44.512 51.506 1.00 0.00 C ATOM 401 O TYR A 28 72.836 43.537 50.846 1.00 0.00 O ATOM 402 CB TYR A 28 75.642 44.247 52.189 1.00 0.00 C ATOM 403 CG TYR A 28 76.188 45.524 51.580 1.00 0.00 C ATOM 404 CD1 TYR A 28 76.052 45.769 50.199 1.00 0.00 C ATOM 405 CD2 TYR A 28 76.837 46.465 52.400 1.00 0.00 C ATOM 406 CE1 TYR A 28 76.578 46.948 49.635 1.00 0.00 C ATOM 407 CE2 TYR A 28 77.379 47.638 51.839 1.00 0.00 C ATOM 408 CZ TYR A 28 77.253 47.877 50.454 1.00 0.00 C ATOM 409 OH TYR A 28 77.795 49.001 49.911 1.00 0.00 O ATOM 0 H TYR A 28 74.544 42.391 53.330 1.00 0.00 H new ATOM 0 HA TYR A 28 74.096 45.223 53.285 1.00 0.00 H new ATOM 0 HB2 TYR A 28 76.272 43.966 53.033 1.00 0.00 H new ATOM 0 HB3 TYR A 28 75.721 43.447 51.452 1.00 0.00 H new ATOM 0 HD1 TYR A 28 75.544 45.052 49.572 1.00 0.00 H new ATOM 0 HD2 TYR A 28 76.920 46.288 53.462 1.00 0.00 H new ATOM 0 HE1 TYR A 28 76.465 47.140 48.578 1.00 0.00 H new ATOM 0 HE2 TYR A 28 77.890 48.353 52.467 1.00 0.00 H new ATOM 0 HH TYR A 28 78.222 49.532 50.616 1.00 0.00 H new ATOM 419 N GLU A 29 72.776 45.747 51.262 1.00 0.00 N ATOM 420 CA GLU A 29 71.618 46.067 50.422 1.00 0.00 C ATOM 421 C GLU A 29 72.019 46.466 48.996 1.00 0.00 C ATOM 422 O GLU A 29 72.755 47.435 48.796 1.00 0.00 O ATOM 423 CB GLU A 29 70.751 47.164 51.077 1.00 0.00 C ATOM 424 CG GLU A 29 70.605 47.058 52.607 1.00 0.00 C ATOM 425 CD GLU A 29 71.646 47.947 53.314 1.00 0.00 C ATOM 426 OE1 GLU A 29 72.831 47.545 53.386 1.00 0.00 O ATOM 427 OE2 GLU A 29 71.295 49.082 53.724 1.00 0.00 O ATOM 0 H GLU A 29 73.231 46.574 51.650 1.00 0.00 H new ATOM 0 HA GLU A 29 71.025 45.156 50.340 1.00 0.00 H new ATOM 0 HB2 GLU A 29 71.180 48.136 50.835 1.00 0.00 H new ATOM 0 HB3 GLU A 29 69.757 47.134 50.630 1.00 0.00 H new ATOM 0 HG2 GLU A 29 69.600 47.359 52.904 1.00 0.00 H new ATOM 0 HG3 GLU A 29 70.732 46.021 52.919 1.00 0.00 H new ATOM 434 N LEU A 30 71.534 45.737 47.984 1.00 0.00 N ATOM 435 CA LEU A 30 71.780 45.997 46.573 1.00 0.00 C ATOM 436 C LEU A 30 70.763 45.296 45.654 1.00 0.00 C ATOM 437 O LEU A 30 70.365 44.150 45.843 1.00 0.00 O ATOM 438 CB LEU A 30 73.246 45.679 46.194 1.00 0.00 C ATOM 439 CG LEU A 30 73.886 44.421 46.815 1.00 0.00 C ATOM 440 CD1 LEU A 30 73.160 43.144 46.414 1.00 0.00 C ATOM 441 CD2 LEU A 30 75.337 44.313 46.341 1.00 0.00 C ATOM 0 H LEU A 30 70.939 44.923 48.138 1.00 0.00 H new ATOM 0 HA LEU A 30 71.630 47.064 46.411 1.00 0.00 H new ATOM 0 HB2 LEU A 30 73.300 45.583 45.110 1.00 0.00 H new ATOM 0 HB3 LEU A 30 73.858 46.538 46.469 1.00 0.00 H new ATOM 0 HG LEU A 30 73.823 44.525 47.898 1.00 0.00 H new ATOM 0 HD11 LEU A 30 73.649 42.287 46.877 1.00 0.00 H new ATOM 0 HD12 LEU A 30 72.124 43.194 46.748 1.00 0.00 H new ATOM 0 HD13 LEU A 30 73.187 43.035 45.330 1.00 0.00 H new ATOM 0 HD21 LEU A 30 75.797 43.426 46.776 1.00 0.00 H new ATOM 0 HD22 LEU A 30 75.360 44.238 45.254 1.00 0.00 H new ATOM 0 HD23 LEU A 30 75.889 45.199 46.655 1.00 0.00 H new ATOM 453 N PHE A 31 70.376 46.013 44.607 1.00 0.00 N ATOM 454 CA PHE A 31 69.759 45.467 43.390 1.00 0.00 C ATOM 455 C PHE A 31 69.934 46.383 42.165 1.00 0.00 C ATOM 456 O PHE A 31 69.777 47.602 42.254 1.00 0.00 O ATOM 457 CB PHE A 31 68.270 45.144 43.608 1.00 0.00 C ATOM 458 CG PHE A 31 67.819 43.919 42.827 1.00 0.00 C ATOM 459 CD1 PHE A 31 68.321 42.650 43.175 1.00 0.00 C ATOM 460 CD2 PHE A 31 66.916 44.036 41.752 1.00 0.00 C ATOM 461 CE1 PHE A 31 67.946 41.511 42.440 1.00 0.00 C ATOM 462 CE2 PHE A 31 66.540 42.896 41.017 1.00 0.00 C ATOM 463 CZ PHE A 31 67.061 41.635 41.354 1.00 0.00 C ATOM 0 H PHE A 31 70.484 47.027 44.574 1.00 0.00 H new ATOM 0 HA PHE A 31 70.291 44.540 43.177 1.00 0.00 H new ATOM 0 HB2 PHE A 31 68.089 44.981 44.670 1.00 0.00 H new ATOM 0 HB3 PHE A 31 67.668 46.003 43.310 1.00 0.00 H new ATOM 0 HD1 PHE A 31 68.998 42.551 44.011 1.00 0.00 H new ATOM 0 HD2 PHE A 31 66.511 45.003 41.491 1.00 0.00 H new ATOM 0 HE1 PHE A 31 68.338 40.541 42.710 1.00 0.00 H new ATOM 0 HE2 PHE A 31 65.849 42.991 40.192 1.00 0.00 H new ATOM 0 HZ PHE A 31 66.782 40.763 40.780 1.00 0.00 H new ATOM 473 N SER A 32 70.204 45.790 40.998 1.00 0.00 N ATOM 474 CA SER A 32 70.100 46.402 39.672 1.00 0.00 C ATOM 475 C SER A 32 68.681 46.887 39.325 1.00 0.00 C ATOM 476 O SER A 32 67.715 46.589 40.024 1.00 0.00 O ATOM 477 CB SER A 32 70.606 45.400 38.625 1.00 0.00 C ATOM 478 OG SER A 32 70.620 44.055 39.059 1.00 0.00 O ATOM 0 H SER A 32 70.517 44.820 40.952 1.00 0.00 H new ATOM 0 HA SER A 32 70.719 47.299 39.674 1.00 0.00 H new ATOM 0 HB2 SER A 32 69.979 45.475 37.736 1.00 0.00 H new ATOM 0 HB3 SER A 32 71.616 45.683 38.328 1.00 0.00 H new ATOM 0 HG SER A 32 69.750 43.828 39.450 1.00 0.00 H new ATOM 484 N SER A 33 68.553 47.649 38.232 1.00 0.00 N ATOM 485 CA SER A 33 67.272 48.183 37.745 1.00 0.00 C ATOM 486 C SER A 33 66.856 47.627 36.375 1.00 0.00 C ATOM 487 O SER A 33 65.668 47.459 36.096 1.00 0.00 O ATOM 488 CB SER A 33 67.341 49.709 37.736 1.00 0.00 C ATOM 489 OG SER A 33 66.051 50.283 37.715 1.00 0.00 O ATOM 0 H SER A 33 69.348 47.917 37.651 1.00 0.00 H new ATOM 0 HA SER A 33 66.492 47.852 38.430 1.00 0.00 H new ATOM 0 HB2 SER A 33 67.881 50.056 38.617 1.00 0.00 H new ATOM 0 HB3 SER A 33 67.904 50.044 36.865 1.00 0.00 H new ATOM 0 HG SER A 33 66.128 51.260 37.711 1.00 0.00 H new ATOM 495 N HIS A 34 67.833 47.259 35.539 1.00 0.00 N ATOM 496 CA HIS A 34 67.634 46.566 34.257 1.00 0.00 C ATOM 497 C HIS A 34 67.237 45.087 34.424 1.00 0.00 C ATOM 498 O HIS A 34 66.802 44.442 33.475 1.00 0.00 O ATOM 499 CB HIS A 34 68.953 46.682 33.486 1.00 0.00 C ATOM 500 CG HIS A 34 68.901 46.288 32.035 1.00 0.00 C ATOM 501 ND1 HIS A 34 69.654 45.305 31.439 1.00 0.00 N ATOM 502 CD2 HIS A 34 68.220 46.933 31.039 1.00 0.00 C ATOM 503 CE1 HIS A 34 69.458 45.373 30.113 1.00 0.00 C ATOM 504 NE2 HIS A 34 68.605 46.370 29.815 1.00 0.00 N ATOM 0 H HIS A 34 68.816 47.440 35.741 1.00 0.00 H new ATOM 0 HA HIS A 34 66.805 47.030 33.722 1.00 0.00 H new ATOM 0 HB2 HIS A 34 69.300 47.713 33.551 1.00 0.00 H new ATOM 0 HB3 HIS A 34 69.699 46.063 33.984 1.00 0.00 H new ATOM 0 HD2 HIS A 34 67.510 47.736 31.173 1.00 0.00 H new ATOM 0 HE1 HIS A 34 69.920 44.720 29.388 1.00 0.00 H new ATOM 0 HE2 HIS A 34 68.300 46.658 28.885 1.00 0.00 H new ATOM 512 N SER A 35 67.376 44.560 35.644 1.00 0.00 N ATOM 513 CA SER A 35 67.155 43.193 36.085 1.00 0.00 C ATOM 514 C SER A 35 65.682 42.795 36.206 1.00 0.00 C ATOM 515 O SER A 35 65.342 41.614 36.203 1.00 0.00 O ATOM 516 CB SER A 35 67.803 43.057 37.463 1.00 0.00 C ATOM 517 OG SER A 35 67.508 44.191 38.261 1.00 0.00 O ATOM 0 H SER A 35 67.677 45.147 36.422 1.00 0.00 H new ATOM 0 HA SER A 35 67.585 42.534 35.331 1.00 0.00 H new ATOM 0 HB2 SER A 35 67.441 42.154 37.955 1.00 0.00 H new ATOM 0 HB3 SER A 35 68.882 42.951 37.356 1.00 0.00 H new ATOM 0 HG SER A 35 67.196 43.898 39.143 1.00 0.00 H new ATOM 523 N LYS A 36 64.804 43.783 36.365 1.00 0.00 N ATOM 524 CA LYS A 36 63.410 43.599 36.807 1.00 0.00 C ATOM 525 C LYS A 36 62.378 44.028 35.752 1.00 0.00 C ATOM 526 O LYS A 36 62.540 45.058 35.098 1.00 0.00 O ATOM 527 CB LYS A 36 63.207 44.345 38.151 1.00 0.00 C ATOM 528 CG LYS A 36 63.699 45.808 38.092 1.00 0.00 C ATOM 529 CD LYS A 36 63.227 46.721 39.229 1.00 0.00 C ATOM 530 CE LYS A 36 63.552 48.173 38.838 1.00 0.00 C ATOM 531 NZ LYS A 36 62.996 49.151 39.800 1.00 0.00 N ATOM 0 H LYS A 36 65.041 44.759 36.188 1.00 0.00 H new ATOM 0 HA LYS A 36 63.237 42.532 36.951 1.00 0.00 H new ATOM 0 HB2 LYS A 36 62.150 44.330 38.416 1.00 0.00 H new ATOM 0 HB3 LYS A 36 63.741 43.817 38.941 1.00 0.00 H new ATOM 0 HG2 LYS A 36 64.789 45.804 38.084 1.00 0.00 H new ATOM 0 HG3 LYS A 36 63.375 46.242 37.146 1.00 0.00 H new ATOM 0 HD2 LYS A 36 62.156 46.601 39.394 1.00 0.00 H new ATOM 0 HD3 LYS A 36 63.725 46.457 40.162 1.00 0.00 H new ATOM 0 HE2 LYS A 36 64.633 48.298 38.780 1.00 0.00 H new ATOM 0 HE3 LYS A 36 63.154 48.377 37.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 63.240 50.115 39.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 61.961 49.051 39.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 63.395 48.975 40.744 1.00 0.00 H new ATOM 545 N TYR A 37 61.291 43.265 35.645 1.00 0.00 N ATOM 546 CA TYR A 37 60.071 43.604 34.892 1.00 0.00 C ATOM 547 C TYR A 37 58.827 42.991 35.556 1.00 0.00 C ATOM 548 O TYR A 37 58.943 42.200 36.492 1.00 0.00 O ATOM 549 CB TYR A 37 60.177 43.177 33.418 1.00 0.00 C ATOM 550 CG TYR A 37 60.367 41.689 33.174 1.00 0.00 C ATOM 551 CD1 TYR A 37 61.602 41.076 33.465 1.00 0.00 C ATOM 552 CD2 TYR A 37 59.301 40.914 32.673 1.00 0.00 C ATOM 553 CE1 TYR A 37 61.743 39.684 33.337 1.00 0.00 C ATOM 554 CE2 TYR A 37 59.454 39.523 32.504 1.00 0.00 C ATOM 555 CZ TYR A 37 60.665 38.903 32.871 1.00 0.00 C ATOM 556 OH TYR A 37 60.794 37.552 32.830 1.00 0.00 O ATOM 0 H TYR A 37 61.228 42.353 36.098 1.00 0.00 H new ATOM 0 HA TYR A 37 59.966 44.689 34.910 1.00 0.00 H new ATOM 0 HB2 TYR A 37 59.274 43.499 32.900 1.00 0.00 H new ATOM 0 HB3 TYR A 37 61.012 43.710 32.964 1.00 0.00 H new ATOM 0 HD1 TYR A 37 62.440 41.676 33.786 1.00 0.00 H new ATOM 0 HD2 TYR A 37 58.364 41.388 32.418 1.00 0.00 H new ATOM 0 HE1 TYR A 37 62.679 39.211 33.596 1.00 0.00 H new ATOM 0 HE2 TYR A 37 58.646 38.935 32.095 1.00 0.00 H new ATOM 0 HH TYR A 37 61.354 37.254 33.577 1.00 0.00 H new ATOM 566 N ALA A 38 57.644 43.386 35.084 1.00 0.00 N ATOM 567 CA ALA A 38 56.354 43.070 35.714 1.00 0.00 C ATOM 568 C ALA A 38 55.486 42.085 34.903 1.00 0.00 C ATOM 569 O ALA A 38 55.365 42.208 33.683 1.00 0.00 O ATOM 570 CB ALA A 38 55.611 44.378 35.998 1.00 0.00 C ATOM 0 H ALA A 38 57.550 43.946 34.237 1.00 0.00 H new ATOM 0 HA ALA A 38 56.561 42.546 36.647 1.00 0.00 H new ATOM 0 HB1 ALA A 38 54.652 44.157 36.466 1.00 0.00 H new ATOM 0 HB2 ALA A 38 56.207 44.997 36.668 1.00 0.00 H new ATOM 0 HB3 ALA A 38 55.444 44.912 35.063 1.00 0.00 H new ATOM 576 N HIS A 39 54.881 41.109 35.588 1.00 0.00 N ATOM 577 CA HIS A 39 53.981 40.081 35.099 1.00 0.00 C ATOM 578 C HIS A 39 53.092 39.586 36.257 1.00 0.00 C ATOM 579 O HIS A 39 53.531 39.606 37.408 1.00 0.00 O ATOM 580 CB HIS A 39 54.854 38.941 34.558 1.00 0.00 C ATOM 581 CG HIS A 39 54.809 38.901 33.064 1.00 0.00 C ATOM 582 ND1 HIS A 39 55.521 39.673 32.179 1.00 0.00 N ATOM 583 CD2 HIS A 39 53.840 38.263 32.364 1.00 0.00 C ATOM 584 CE1 HIS A 39 55.007 39.477 30.956 1.00 0.00 C ATOM 585 NE2 HIS A 39 53.958 38.633 31.015 1.00 0.00 N ATOM 0 H HIS A 39 55.029 41.018 36.593 1.00 0.00 H new ATOM 0 HA HIS A 39 53.327 40.461 34.314 1.00 0.00 H new ATOM 0 HB2 HIS A 39 55.883 39.075 34.892 1.00 0.00 H new ATOM 0 HB3 HIS A 39 54.509 37.989 34.962 1.00 0.00 H new ATOM 0 HD2 HIS A 39 53.104 37.587 32.773 1.00 0.00 H new ATOM 0 HE1 HIS A 39 55.381 39.932 30.051 1.00 0.00 H new ATOM 0 HE2 HIS A 39 53.371 38.326 30.239 1.00 0.00 H new ATOM 593 N SER A 40 51.875 39.096 35.989 1.00 0.00 N ATOM 594 CA SER A 40 50.988 38.519 36.998 1.00 0.00 C ATOM 595 C SER A 40 51.040 36.986 36.969 1.00 0.00 C ATOM 596 O SER A 40 50.178 36.327 36.369 1.00 0.00 O ATOM 597 CB SER A 40 49.585 39.106 36.835 1.00 0.00 C ATOM 598 OG SER A 40 49.292 39.974 37.906 1.00 0.00 O ATOM 0 H SER A 40 51.476 39.091 35.050 1.00 0.00 H new ATOM 0 HA SER A 40 51.327 38.790 37.998 1.00 0.00 H new ATOM 0 HB2 SER A 40 49.517 39.646 35.891 1.00 0.00 H new ATOM 0 HB3 SER A 40 48.849 38.303 36.797 1.00 0.00 H new ATOM 0 HG SER A 40 48.761 40.730 37.579 1.00 0.00 H new ATOM 604 N SER A 41 52.076 36.414 37.593 1.00 0.00 N ATOM 605 CA SER A 41 52.387 34.973 37.550 1.00 0.00 C ATOM 606 C SER A 41 53.120 34.484 38.814 1.00 0.00 C ATOM 607 O SER A 41 53.896 35.254 39.390 1.00 0.00 O ATOM 608 CB SER A 41 53.288 34.649 36.342 1.00 0.00 C ATOM 609 OG SER A 41 52.792 35.213 35.139 1.00 0.00 O ATOM 0 H SER A 41 52.738 36.948 38.155 1.00 0.00 H new ATOM 0 HA SER A 41 51.426 34.464 37.476 1.00 0.00 H new ATOM 0 HB2 SER A 41 54.294 35.024 36.530 1.00 0.00 H new ATOM 0 HB3 SER A 41 53.367 33.568 36.229 1.00 0.00 H new ATOM 0 HG SER A 41 53.393 34.985 34.399 1.00 0.00 H new ATOM 615 N PRO A 42 52.949 33.210 39.225 1.00 0.00 N ATOM 616 CA PRO A 42 53.837 32.535 40.175 1.00 0.00 C ATOM 617 C PRO A 42 55.180 32.163 39.515 1.00 0.00 C ATOM 618 O PRO A 42 55.266 32.051 38.288 1.00 0.00 O ATOM 619 CB PRO A 42 53.061 31.296 40.632 1.00 0.00 C ATOM 620 CG PRO A 42 52.256 30.926 39.386 1.00 0.00 C ATOM 621 CD PRO A 42 51.917 32.284 38.771 1.00 0.00 C ATOM 0 HA PRO A 42 54.099 33.174 41.018 1.00 0.00 H new ATOM 0 HB2 PRO A 42 53.728 30.490 40.937 1.00 0.00 H new ATOM 0 HB3 PRO A 42 52.414 31.514 41.482 1.00 0.00 H new ATOM 0 HG2 PRO A 42 52.836 30.308 38.701 1.00 0.00 H new ATOM 0 HG3 PRO A 42 51.357 30.364 39.640 1.00 0.00 H new ATOM 0 HD2 PRO A 42 51.900 32.224 37.683 1.00 0.00 H new ATOM 0 HD3 PRO A 42 50.929 32.618 39.087 1.00 0.00 H new ATOM 629 N TRP A 43 56.227 31.974 40.325 1.00 0.00 N ATOM 630 CA TRP A 43 57.624 31.747 39.919 1.00 0.00 C ATOM 631 C TRP A 43 58.110 32.612 38.730 1.00 0.00 C ATOM 632 O TRP A 43 58.532 32.070 37.701 1.00 0.00 O ATOM 633 CB TRP A 43 57.902 30.242 39.745 1.00 0.00 C ATOM 634 CG TRP A 43 57.620 29.339 40.916 1.00 0.00 C ATOM 635 CD1 TRP A 43 57.042 28.121 40.816 1.00 0.00 C ATOM 636 CD2 TRP A 43 57.954 29.493 42.336 1.00 0.00 C ATOM 637 NE1 TRP A 43 56.962 27.527 42.058 1.00 0.00 N ATOM 638 CE2 TRP A 43 57.511 28.327 43.034 1.00 0.00 C ATOM 639 CE3 TRP A 43 58.596 30.484 43.116 1.00 0.00 C ATOM 640 CZ2 TRP A 43 57.682 28.156 44.415 1.00 0.00 C ATOM 641 CZ3 TRP A 43 58.762 30.330 44.507 1.00 0.00 C ATOM 642 CH2 TRP A 43 58.307 29.170 45.158 1.00 0.00 C ATOM 0 H TRP A 43 56.120 31.975 41.339 1.00 0.00 H new ATOM 0 HA TRP A 43 58.242 32.106 40.742 1.00 0.00 H new ATOM 0 HB2 TRP A 43 57.313 29.888 38.899 1.00 0.00 H new ATOM 0 HB3 TRP A 43 58.951 30.124 39.475 1.00 0.00 H new ATOM 0 HD1 TRP A 43 56.693 27.677 39.895 1.00 0.00 H new ATOM 0 HE1 TRP A 43 56.548 26.611 42.231 1.00 0.00 H new ATOM 0 HE3 TRP A 43 58.967 31.377 42.635 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 57.337 27.255 44.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 59.243 31.110 45.078 1.00 0.00 H new ATOM 0 HH2 TRP A 43 58.438 29.059 46.224 1.00 0.00 H new ATOM 653 N PRO A 44 58.055 33.957 38.826 1.00 0.00 N ATOM 654 CA PRO A 44 58.634 34.847 37.820 1.00 0.00 C ATOM 655 C PRO A 44 60.173 34.789 37.823 1.00 0.00 C ATOM 656 O PRO A 44 60.794 34.470 38.836 1.00 0.00 O ATOM 657 CB PRO A 44 58.114 36.243 38.178 1.00 0.00 C ATOM 658 CG PRO A 44 57.992 36.178 39.701 1.00 0.00 C ATOM 659 CD PRO A 44 57.540 34.739 39.945 1.00 0.00 C ATOM 0 HA PRO A 44 58.345 34.557 36.810 1.00 0.00 H new ATOM 0 HB2 PRO A 44 58.803 37.025 37.860 1.00 0.00 H new ATOM 0 HB3 PRO A 44 57.155 36.451 37.704 1.00 0.00 H new ATOM 0 HG2 PRO A 44 58.941 36.392 40.192 1.00 0.00 H new ATOM 0 HG3 PRO A 44 57.267 36.899 40.080 1.00 0.00 H new ATOM 0 HD2 PRO A 44 57.927 34.365 40.893 1.00 0.00 H new ATOM 0 HD3 PRO A 44 56.453 34.676 39.997 1.00 0.00 H new ATOM 667 N ALA A 45 60.788 35.146 36.693 1.00 0.00 N ATOM 668 CA ALA A 45 62.241 35.200 36.517 1.00 0.00 C ATOM 669 C ALA A 45 62.688 36.605 36.077 1.00 0.00 C ATOM 670 O ALA A 45 62.051 37.222 35.223 1.00 0.00 O ATOM 671 CB ALA A 45 62.655 34.114 35.515 1.00 0.00 C ATOM 0 H ALA A 45 60.275 35.413 35.853 1.00 0.00 H new ATOM 0 HA ALA A 45 62.741 35.005 37.466 1.00 0.00 H new ATOM 0 HB1 ALA A 45 63.735 34.142 35.374 1.00 0.00 H new ATOM 0 HB2 ALA A 45 62.364 33.136 35.898 1.00 0.00 H new ATOM 0 HB3 ALA A 45 62.160 34.292 34.561 1.00 0.00 H new ATOM 677 N PHE A 46 63.803 37.084 36.625 1.00 0.00 N ATOM 678 CA PHE A 46 64.438 38.363 36.293 1.00 0.00 C ATOM 679 C PHE A 46 65.068 38.283 34.889 1.00 0.00 C ATOM 680 O PHE A 46 65.267 37.201 34.329 1.00 0.00 O ATOM 681 CB PHE A 46 65.530 38.611 37.351 1.00 0.00 C ATOM 682 CG PHE A 46 65.026 38.899 38.755 1.00 0.00 C ATOM 683 CD1 PHE A 46 64.271 40.061 39.010 1.00 0.00 C ATOM 684 CD2 PHE A 46 65.335 38.026 39.816 1.00 0.00 C ATOM 685 CE1 PHE A 46 63.820 40.345 40.312 1.00 0.00 C ATOM 686 CE2 PHE A 46 64.887 38.313 41.118 1.00 0.00 C ATOM 687 CZ PHE A 46 64.129 39.470 41.368 1.00 0.00 C ATOM 0 H PHE A 46 64.313 36.571 37.344 1.00 0.00 H new ATOM 0 HA PHE A 46 63.710 39.174 36.291 1.00 0.00 H new ATOM 0 HB2 PHE A 46 66.180 37.737 37.389 1.00 0.00 H new ATOM 0 HB3 PHE A 46 66.144 39.451 37.025 1.00 0.00 H new ATOM 0 HD1 PHE A 46 64.037 40.738 38.201 1.00 0.00 H new ATOM 0 HD2 PHE A 46 65.917 37.135 39.630 1.00 0.00 H new ATOM 0 HE1 PHE A 46 63.237 41.234 40.500 1.00 0.00 H new ATOM 0 HE2 PHE A 46 65.126 37.641 41.929 1.00 0.00 H new ATOM 0 HZ PHE A 46 63.785 39.686 42.369 1.00 0.00 H new ATOM 697 N THR A 47 65.439 39.423 34.314 1.00 0.00 N ATOM 698 CA THR A 47 66.414 39.454 33.214 1.00 0.00 C ATOM 699 C THR A 47 67.812 39.156 33.754 1.00 0.00 C ATOM 700 O THR A 47 68.498 38.277 33.246 1.00 0.00 O ATOM 701 CB THR A 47 66.407 40.802 32.479 1.00 0.00 C ATOM 702 OG1 THR A 47 66.331 41.820 33.435 1.00 0.00 O ATOM 703 CG2 THR A 47 65.204 40.959 31.553 1.00 0.00 C ATOM 0 H THR A 47 65.083 40.339 34.587 1.00 0.00 H new ATOM 0 HA THR A 47 66.128 38.688 32.493 1.00 0.00 H new ATOM 0 HB THR A 47 67.315 40.853 31.877 1.00 0.00 H new ATOM 0 HG1 THR A 47 66.585 42.673 33.025 1.00 0.00 H new ATOM 0 HG21 THR A 47 65.249 41.930 31.059 1.00 0.00 H new ATOM 0 HG22 THR A 47 65.217 40.169 30.802 1.00 0.00 H new ATOM 0 HG23 THR A 47 64.285 40.891 32.135 1.00 0.00 H new ATOM 711 N GLU A 48 68.240 39.865 34.797 1.00 0.00 N ATOM 712 CA GLU A 48 69.604 39.893 35.295 1.00 0.00 C ATOM 713 C GLU A 48 69.651 39.970 36.830 1.00 0.00 C ATOM 714 O GLU A 48 68.636 40.017 37.519 1.00 0.00 O ATOM 715 CB GLU A 48 70.272 41.146 34.707 1.00 0.00 C ATOM 716 CG GLU A 48 70.335 41.195 33.205 1.00 0.00 C ATOM 717 CD GLU A 48 70.879 42.479 32.585 1.00 0.00 C ATOM 718 OE1 GLU A 48 71.052 43.514 33.272 1.00 0.00 O ATOM 719 OE2 GLU A 48 71.095 42.466 31.352 1.00 0.00 O ATOM 0 H GLU A 48 67.613 40.460 35.339 1.00 0.00 H new ATOM 0 HA GLU A 48 70.117 38.978 35.000 1.00 0.00 H new ATOM 0 HB2 GLU A 48 69.733 42.025 35.061 1.00 0.00 H new ATOM 0 HB3 GLU A 48 71.287 41.215 35.099 1.00 0.00 H new ATOM 0 HG2 GLU A 48 70.951 40.364 32.863 1.00 0.00 H new ATOM 0 HG3 GLU A 48 69.330 41.028 32.816 1.00 0.00 H new ATOM 726 N THR A 49 70.864 40.077 37.359 1.00 0.00 N ATOM 727 CA THR A 49 71.155 40.516 38.735 1.00 0.00 C ATOM 728 C THR A 49 72.221 41.615 38.705 1.00 0.00 C ATOM 729 O THR A 49 72.434 42.247 37.668 1.00 0.00 O ATOM 730 CB THR A 49 71.558 39.351 39.655 1.00 0.00 C ATOM 731 OG1 THR A 49 72.711 38.704 39.175 1.00 0.00 O ATOM 732 CG2 THR A 49 70.435 38.344 39.852 1.00 0.00 C ATOM 0 H THR A 49 71.707 39.855 36.830 1.00 0.00 H new ATOM 0 HA THR A 49 70.239 40.923 39.163 1.00 0.00 H new ATOM 0 HB THR A 49 71.775 39.789 40.629 1.00 0.00 H new ATOM 0 HG1 THR A 49 72.505 37.765 38.987 1.00 0.00 H new ATOM 0 HG21 THR A 49 70.775 37.544 40.510 1.00 0.00 H new ATOM 0 HG22 THR A 49 69.575 38.841 40.300 1.00 0.00 H new ATOM 0 HG23 THR A 49 70.149 37.924 38.887 1.00 0.00 H new ATOM 740 N ILE A 50 72.829 41.940 39.849 1.00 0.00 N ATOM 741 CA ILE A 50 73.808 43.020 39.985 1.00 0.00 C ATOM 742 C ILE A 50 75.225 42.571 39.577 1.00 0.00 C ATOM 743 O ILE A 50 76.034 43.384 39.138 1.00 0.00 O ATOM 744 CB ILE A 50 73.782 43.584 41.426 1.00 0.00 C ATOM 745 CG1 ILE A 50 72.462 43.462 42.222 1.00 0.00 C ATOM 746 CG2 ILE A 50 74.222 45.057 41.405 1.00 0.00 C ATOM 747 CD1 ILE A 50 72.255 42.118 42.941 1.00 0.00 C ATOM 0 H ILE A 50 72.650 41.449 40.725 1.00 0.00 H new ATOM 0 HA ILE A 50 73.527 43.817 39.297 1.00 0.00 H new ATOM 0 HB ILE A 50 74.474 42.937 41.966 1.00 0.00 H new ATOM 0 HG12 ILE A 50 72.427 44.261 42.962 1.00 0.00 H new ATOM 0 HG13 ILE A 50 71.628 43.623 41.539 1.00 0.00 H new ATOM 0 HG21 ILE A 50 74.204 45.456 42.419 1.00 0.00 H new ATOM 0 HG22 ILE A 50 75.233 45.129 41.004 1.00 0.00 H new ATOM 0 HG23 ILE A 50 73.541 45.631 40.777 1.00 0.00 H new ATOM 0 HD11 ILE A 50 71.302 42.131 43.470 1.00 0.00 H new ATOM 0 HD12 ILE A 50 72.252 41.310 42.209 1.00 0.00 H new ATOM 0 HD13 ILE A 50 73.064 41.959 43.654 1.00 0.00 H new ATOM 759 N HIS A 51 75.499 41.268 39.712 1.00 0.00 N ATOM 760 CA HIS A 51 76.724 40.538 39.352 1.00 0.00 C ATOM 761 C HIS A 51 78.075 41.272 39.650 1.00 0.00 C ATOM 762 O HIS A 51 78.887 41.458 38.739 1.00 0.00 O ATOM 763 CB HIS A 51 76.522 40.014 37.913 1.00 0.00 C ATOM 764 CG HIS A 51 77.162 38.676 37.602 1.00 0.00 C ATOM 765 ND1 HIS A 51 76.510 37.552 37.128 1.00 0.00 N ATOM 766 CD2 HIS A 51 78.486 38.337 37.723 1.00 0.00 C ATOM 767 CE1 HIS A 51 77.408 36.572 36.991 1.00 0.00 C ATOM 768 NE2 HIS A 51 78.637 37.001 37.323 1.00 0.00 N ATOM 0 H HIS A 51 74.805 40.638 40.113 1.00 0.00 H new ATOM 0 HA HIS A 51 76.861 39.691 40.024 1.00 0.00 H new ATOM 0 HB2 HIS A 51 75.452 39.937 37.722 1.00 0.00 H new ATOM 0 HB3 HIS A 51 76.917 40.755 37.218 1.00 0.00 H new ATOM 0 HD1 HIS A 51 75.514 37.483 36.919 1.00 0.00 H new ATOM 0 HD2 HIS A 51 79.277 38.987 38.067 1.00 0.00 H new ATOM 0 HE1 HIS A 51 77.177 35.571 36.658 1.00 0.00 H new ATOM 776 N PRO A 52 78.332 41.724 40.903 1.00 0.00 N ATOM 777 CA PRO A 52 79.537 42.481 41.282 1.00 0.00 C ATOM 778 C PRO A 52 80.763 41.596 41.600 1.00 0.00 C ATOM 779 O PRO A 52 80.704 40.371 41.604 1.00 0.00 O ATOM 780 CB PRO A 52 79.096 43.289 42.510 1.00 0.00 C ATOM 781 CG PRO A 52 78.179 42.300 43.222 1.00 0.00 C ATOM 782 CD PRO A 52 77.433 41.663 42.053 1.00 0.00 C ATOM 0 HA PRO A 52 79.882 43.101 40.454 1.00 0.00 H new ATOM 0 HB2 PRO A 52 79.942 43.582 43.132 1.00 0.00 H new ATOM 0 HB3 PRO A 52 78.573 44.204 42.231 1.00 0.00 H new ATOM 0 HG2 PRO A 52 78.741 41.564 43.798 1.00 0.00 H new ATOM 0 HG3 PRO A 52 77.502 42.798 43.916 1.00 0.00 H new ATOM 0 HD2 PRO A 52 77.164 40.632 42.281 1.00 0.00 H new ATOM 0 HD3 PRO A 52 76.505 42.197 41.848 1.00 0.00 H new ATOM 790 N ASP A 53 81.875 42.228 41.979 1.00 0.00 N ATOM 791 CA ASP A 53 83.159 41.628 42.373 1.00 0.00 C ATOM 792 C ASP A 53 83.113 40.817 43.679 1.00 0.00 C ATOM 793 O ASP A 53 84.044 40.080 44.003 1.00 0.00 O ATOM 794 CB ASP A 53 84.208 42.752 42.485 1.00 0.00 C ATOM 795 CG ASP A 53 83.849 43.771 43.574 1.00 0.00 C ATOM 796 OD1 ASP A 53 82.852 44.511 43.378 1.00 0.00 O ATOM 797 OD2 ASP A 53 84.496 43.787 44.649 1.00 0.00 O ATOM 0 H ASP A 53 81.908 43.246 42.023 1.00 0.00 H new ATOM 0 HA ASP A 53 83.422 40.907 41.599 1.00 0.00 H new ATOM 0 HB2 ASP A 53 85.183 42.317 42.704 1.00 0.00 H new ATOM 0 HB3 ASP A 53 84.295 43.263 41.526 1.00 0.00 H new ATOM 802 N SER A 54 82.011 40.949 44.414 1.00 0.00 N ATOM 803 CA SER A 54 81.711 40.242 45.667 1.00 0.00 C ATOM 804 C SER A 54 81.204 38.813 45.504 1.00 0.00 C ATOM 805 O SER A 54 81.190 38.026 46.445 1.00 0.00 O ATOM 806 CB SER A 54 80.637 41.018 46.417 1.00 0.00 C ATOM 807 OG SER A 54 81.194 42.175 47.011 1.00 0.00 O ATOM 0 H SER A 54 81.261 41.584 44.141 1.00 0.00 H new ATOM 0 HA SER A 54 82.661 40.181 46.199 1.00 0.00 H new ATOM 0 HB2 SER A 54 79.838 41.301 45.732 1.00 0.00 H new ATOM 0 HB3 SER A 54 80.190 40.386 47.184 1.00 0.00 H new ATOM 0 HG SER A 54 80.494 42.667 47.489 1.00 0.00 H new ATOM 813 N VAL A 55 80.723 38.514 44.309 1.00 0.00 N ATOM 814 CA VAL A 55 80.033 37.262 43.959 1.00 0.00 C ATOM 815 C VAL A 55 80.774 36.490 42.869 1.00 0.00 C ATOM 816 O VAL A 55 81.717 36.980 42.245 1.00 0.00 O ATOM 817 CB VAL A 55 78.538 37.488 43.632 1.00 0.00 C ATOM 818 CG1 VAL A 55 77.865 38.418 44.657 1.00 0.00 C ATOM 819 CG2 VAL A 55 78.265 38.034 42.227 1.00 0.00 C ATOM 0 H VAL A 55 80.800 39.154 43.519 1.00 0.00 H new ATOM 0 HA VAL A 55 80.049 36.628 44.846 1.00 0.00 H new ATOM 0 HB VAL A 55 78.107 36.488 43.681 1.00 0.00 H new ATOM 0 HG11 VAL A 55 76.816 38.552 44.393 1.00 0.00 H new ATOM 0 HG12 VAL A 55 77.935 37.976 45.651 1.00 0.00 H new ATOM 0 HG13 VAL A 55 78.366 39.386 44.654 1.00 0.00 H new ATOM 0 HG21 VAL A 55 77.191 38.160 42.088 1.00 0.00 H new ATOM 0 HG22 VAL A 55 78.762 38.997 42.108 1.00 0.00 H new ATOM 0 HG23 VAL A 55 78.647 37.334 41.484 1.00 0.00 H new ATOM 829 N THR A 56 80.362 35.246 42.664 1.00 0.00 N ATOM 830 CA THR A 56 80.962 34.289 41.723 1.00 0.00 C ATOM 831 C THR A 56 79.893 33.447 41.039 1.00 0.00 C ATOM 832 O THR A 56 78.765 33.339 41.505 1.00 0.00 O ATOM 833 CB THR A 56 81.979 33.392 42.443 1.00 0.00 C ATOM 834 OG1 THR A 56 82.665 32.545 41.554 1.00 0.00 O ATOM 835 CG2 THR A 56 81.364 32.497 43.519 1.00 0.00 C ATOM 0 H THR A 56 79.567 34.852 43.167 1.00 0.00 H new ATOM 0 HA THR A 56 81.484 34.856 40.953 1.00 0.00 H new ATOM 0 HB THR A 56 82.659 34.103 42.911 1.00 0.00 H new ATOM 0 HG1 THR A 56 83.303 31.994 42.054 1.00 0.00 H new ATOM 0 HG21 THR A 56 82.146 31.894 43.981 1.00 0.00 H new ATOM 0 HG22 THR A 56 80.887 33.116 44.278 1.00 0.00 H new ATOM 0 HG23 THR A 56 80.621 31.841 43.066 1.00 0.00 H new ATOM 843 N LYS A 57 80.233 32.812 39.924 1.00 0.00 N ATOM 844 CA LYS A 57 79.434 31.780 39.306 1.00 0.00 C ATOM 845 C LYS A 57 80.243 30.591 38.818 1.00 0.00 C ATOM 846 O LYS A 57 81.475 30.603 38.767 1.00 0.00 O ATOM 847 CB LYS A 57 78.580 32.387 38.206 1.00 0.00 C ATOM 848 CG LYS A 57 79.172 33.358 37.211 1.00 0.00 C ATOM 849 CD LYS A 57 80.167 32.733 36.228 1.00 0.00 C ATOM 850 CE LYS A 57 80.378 33.673 35.035 1.00 0.00 C ATOM 851 NZ LYS A 57 81.032 32.958 33.917 1.00 0.00 N ATOM 0 H LYS A 57 81.096 33.011 39.417 1.00 0.00 H new ATOM 0 HA LYS A 57 78.781 31.367 40.075 1.00 0.00 H new ATOM 0 HB2 LYS A 57 78.160 31.560 37.634 1.00 0.00 H new ATOM 0 HB3 LYS A 57 77.747 32.895 38.692 1.00 0.00 H new ATOM 0 HG2 LYS A 57 78.362 33.818 36.645 1.00 0.00 H new ATOM 0 HG3 LYS A 57 79.673 34.157 37.757 1.00 0.00 H new ATOM 0 HD2 LYS A 57 81.117 32.546 36.728 1.00 0.00 H new ATOM 0 HD3 LYS A 57 79.794 31.769 35.882 1.00 0.00 H new ATOM 0 HE2 LYS A 57 79.419 34.073 34.706 1.00 0.00 H new ATOM 0 HE3 LYS A 57 80.990 34.522 35.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 81.166 33.611 33.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 81.956 32.598 34.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 80.434 32.162 33.616 1.00 0.00 H new ATOM 865 N CYS A 58 79.482 29.591 38.420 1.00 0.00 N ATOM 866 CA CYS A 58 79.908 28.348 37.792 1.00 0.00 C ATOM 867 C CYS A 58 78.900 27.846 36.734 1.00 0.00 C ATOM 868 O CYS A 58 77.738 28.248 36.724 1.00 0.00 O ATOM 869 CB CYS A 58 80.173 27.333 38.910 1.00 0.00 C ATOM 870 SG CYS A 58 78.917 27.365 40.227 1.00 0.00 S ATOM 0 H CYS A 58 78.469 29.626 38.535 1.00 0.00 H new ATOM 0 HA CYS A 58 80.826 28.507 37.226 1.00 0.00 H new ATOM 0 HB2 CYS A 58 80.213 26.332 38.480 1.00 0.00 H new ATOM 0 HB3 CYS A 58 81.152 27.532 39.347 1.00 0.00 H new ATOM 0 HG CYS A 58 77.973 28.200 39.907 1.00 0.00 H new ATOM 876 N PRO A 59 79.310 26.976 35.801 1.00 0.00 N ATOM 877 CA PRO A 59 78.371 26.290 34.919 1.00 0.00 C ATOM 878 C PRO A 59 77.612 25.178 35.647 1.00 0.00 C ATOM 879 O PRO A 59 78.102 24.602 36.620 1.00 0.00 O ATOM 880 CB PRO A 59 79.218 25.731 33.784 1.00 0.00 C ATOM 881 CG PRO A 59 80.590 25.510 34.431 1.00 0.00 C ATOM 882 CD PRO A 59 80.682 26.590 35.511 1.00 0.00 C ATOM 0 HA PRO A 59 77.602 26.971 34.554 1.00 0.00 H new ATOM 0 HB2 PRO A 59 78.804 24.801 33.396 1.00 0.00 H new ATOM 0 HB3 PRO A 59 79.277 26.427 32.948 1.00 0.00 H new ATOM 0 HG2 PRO A 59 80.670 24.511 34.860 1.00 0.00 H new ATOM 0 HG3 PRO A 59 81.394 25.609 33.701 1.00 0.00 H new ATOM 0 HD2 PRO A 59 81.178 26.209 36.404 1.00 0.00 H new ATOM 0 HD3 PRO A 59 81.263 27.444 35.162 1.00 0.00 H new ATOM 890 N GLU A 60 76.441 24.814 35.129 1.00 0.00 N ATOM 891 CA GLU A 60 75.864 23.506 35.404 1.00 0.00 C ATOM 892 C GLU A 60 76.665 22.404 34.695 1.00 0.00 C ATOM 893 O GLU A 60 77.332 22.624 33.678 1.00 0.00 O ATOM 894 CB GLU A 60 74.415 23.403 34.944 1.00 0.00 C ATOM 895 CG GLU A 60 73.396 24.336 35.593 1.00 0.00 C ATOM 896 CD GLU A 60 72.915 23.761 36.928 1.00 0.00 C ATOM 897 OE1 GLU A 60 73.694 23.777 37.907 1.00 0.00 O ATOM 898 OE2 GLU A 60 71.766 23.260 37.010 1.00 0.00 O ATOM 0 H GLU A 60 75.877 25.406 34.519 1.00 0.00 H new ATOM 0 HA GLU A 60 75.902 23.377 36.486 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.392 23.577 33.868 1.00 0.00 H new ATOM 0 HB3 GLU A 60 74.083 22.378 35.108 1.00 0.00 H new ATOM 0 HG2 GLU A 60 73.843 25.317 35.753 1.00 0.00 H new ATOM 0 HG3 GLU A 60 72.547 24.478 34.925 1.00 0.00 H new ATOM 905 N LYS A 61 76.561 21.184 35.217 1.00 0.00 N ATOM 906 CA LYS A 61 77.335 20.019 34.795 1.00 0.00 C ATOM 907 C LYS A 61 76.521 19.055 33.948 1.00 0.00 C ATOM 908 O LYS A 61 76.914 18.587 32.887 1.00 0.00 O ATOM 909 CB LYS A 61 77.970 19.453 36.067 1.00 0.00 C ATOM 910 CG LYS A 61 77.190 18.475 36.926 1.00 0.00 C ATOM 911 CD LYS A 61 77.304 17.038 36.420 1.00 0.00 C ATOM 912 CE LYS A 61 76.583 16.020 37.310 1.00 0.00 C ATOM 913 NZ LYS A 61 77.362 15.704 38.527 1.00 0.00 N ATOM 0 H LYS A 61 75.911 20.972 35.974 1.00 0.00 H new ATOM 0 HA LYS A 61 78.136 20.274 34.102 1.00 0.00 H new ATOM 0 HB2 LYS A 61 78.899 18.962 35.777 1.00 0.00 H new ATOM 0 HB3 LYS A 61 78.240 20.298 36.700 1.00 0.00 H new ATOM 0 HG2 LYS A 61 77.554 18.526 37.952 1.00 0.00 H new ATOM 0 HG3 LYS A 61 76.140 18.769 36.945 1.00 0.00 H new ATOM 0 HD2 LYS A 61 76.894 16.982 35.412 1.00 0.00 H new ATOM 0 HD3 LYS A 61 78.358 16.767 36.351 1.00 0.00 H new ATOM 0 HE2 LYS A 61 75.607 16.413 37.595 1.00 0.00 H new ATOM 0 HE3 LYS A 61 76.405 15.105 36.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 76.841 15.012 39.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 78.283 15.305 38.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 77.510 16.573 39.080 1.00 0.00 H new ATOM 927 N ASN A 62 75.330 18.872 34.473 1.00 0.00 N ATOM 928 CA ASN A 62 74.159 18.122 34.047 1.00 0.00 C ATOM 929 C ASN A 62 73.280 18.900 33.069 1.00 0.00 C ATOM 930 O ASN A 62 72.338 18.343 32.512 1.00 0.00 O ATOM 931 CB ASN A 62 73.405 17.724 35.345 1.00 0.00 C ATOM 932 CG ASN A 62 73.563 18.659 36.486 1.00 0.00 C ATOM 933 OD1 ASN A 62 73.669 19.872 36.387 1.00 0.00 O ATOM 934 ND2 ASN A 62 73.573 18.049 37.618 1.00 0.00 N ATOM 0 H ASN A 62 75.126 19.325 35.364 1.00 0.00 H new ATOM 0 HA ASN A 62 74.454 17.236 33.484 1.00 0.00 H new ATOM 0 HB2 ASN A 62 72.343 17.635 35.115 1.00 0.00 H new ATOM 0 HB3 ASN A 62 73.748 16.737 35.656 1.00 0.00 H new ATOM 0 HD21 ASN A 62 73.673 18.580 38.483 1.00 0.00 H new ATOM 0 HD22 ASN A 62 73.481 17.034 37.651 1.00 0.00 H new ATOM 941 N ARG A 63 73.587 20.188 32.878 1.00 0.00 N ATOM 942 CA ARG A 63 72.850 21.128 32.043 1.00 0.00 C ATOM 943 C ARG A 63 73.783 22.094 31.287 1.00 0.00 C ATOM 944 O ARG A 63 73.811 23.275 31.618 1.00 0.00 O ATOM 945 CB ARG A 63 71.782 21.866 32.880 1.00 0.00 C ATOM 946 CG ARG A 63 71.047 21.009 33.916 1.00 0.00 C ATOM 947 CD ARG A 63 69.832 21.735 34.486 1.00 0.00 C ATOM 948 NE ARG A 63 69.105 20.886 35.452 1.00 0.00 N ATOM 949 CZ ARG A 63 68.727 21.239 36.665 1.00 0.00 C ATOM 950 NH1 ARG A 63 69.162 22.315 37.249 1.00 0.00 N ATOM 951 NH2 ARG A 63 67.885 20.523 37.351 1.00 0.00 N ATOM 0 H ARG A 63 74.396 20.619 33.326 1.00 0.00 H new ATOM 0 HA ARG A 63 72.331 20.560 31.271 1.00 0.00 H new ATOM 0 HB2 ARG A 63 72.261 22.698 33.396 1.00 0.00 H new ATOM 0 HB3 ARG A 63 71.045 22.295 32.200 1.00 0.00 H new ATOM 0 HG2 ARG A 63 70.729 20.073 33.456 1.00 0.00 H new ATOM 0 HG3 ARG A 63 71.730 20.750 34.725 1.00 0.00 H new ATOM 0 HD2 ARG A 63 70.152 22.655 34.975 1.00 0.00 H new ATOM 0 HD3 ARG A 63 69.163 22.022 33.675 1.00 0.00 H new ATOM 0 HE ARG A 63 68.874 19.939 35.153 1.00 0.00 H new ATOM 0 HH11 ARG A 63 69.823 22.925 36.768 1.00 0.00 H new ATOM 0 HH12 ARG A 63 68.843 22.550 38.189 1.00 0.00 H new ATOM 0 HH21 ARG A 63 67.501 19.666 36.952 1.00 0.00 H new ATOM 0 HH22 ARG A 63 67.609 20.818 38.287 1.00 0.00 H new ATOM 965 N PRO A 64 74.578 21.636 30.301 1.00 0.00 N ATOM 966 CA PRO A 64 75.697 22.395 29.714 1.00 0.00 C ATOM 967 C PRO A 64 75.272 23.535 28.752 1.00 0.00 C ATOM 968 O PRO A 64 75.904 23.787 27.725 1.00 0.00 O ATOM 969 CB PRO A 64 76.593 21.323 29.075 1.00 0.00 C ATOM 970 CG PRO A 64 75.580 20.275 28.615 1.00 0.00 C ATOM 971 CD PRO A 64 74.544 20.291 29.740 1.00 0.00 C ATOM 0 HA PRO A 64 76.233 22.964 30.474 1.00 0.00 H new ATOM 0 HB2 PRO A 64 77.171 21.722 28.241 1.00 0.00 H new ATOM 0 HB3 PRO A 64 77.306 20.912 29.789 1.00 0.00 H new ATOM 0 HG2 PRO A 64 75.137 20.535 27.653 1.00 0.00 H new ATOM 0 HG3 PRO A 64 76.038 19.292 28.500 1.00 0.00 H new ATOM 0 HD2 PRO A 64 73.551 20.053 29.359 1.00 0.00 H new ATOM 0 HD3 PRO A 64 74.781 19.546 30.499 1.00 0.00 H new ATOM 979 N GLU A 65 74.187 24.227 29.100 1.00 0.00 N ATOM 980 CA GLU A 65 73.489 25.257 28.342 1.00 0.00 C ATOM 981 C GLU A 65 73.310 26.581 29.100 1.00 0.00 C ATOM 982 O GLU A 65 72.993 27.611 28.512 1.00 0.00 O ATOM 983 CB GLU A 65 72.121 24.723 27.845 1.00 0.00 C ATOM 984 CG GLU A 65 72.075 23.243 27.491 1.00 0.00 C ATOM 985 CD GLU A 65 70.787 22.767 26.796 1.00 0.00 C ATOM 986 OE1 GLU A 65 69.708 23.385 26.951 1.00 0.00 O ATOM 987 OE2 GLU A 65 70.839 21.712 26.119 1.00 0.00 O ATOM 0 H GLU A 65 73.737 24.064 30.001 1.00 0.00 H new ATOM 0 HA GLU A 65 74.128 25.490 27.490 1.00 0.00 H new ATOM 0 HB2 GLU A 65 71.375 24.916 28.616 1.00 0.00 H new ATOM 0 HB3 GLU A 65 71.826 25.297 26.966 1.00 0.00 H new ATOM 0 HG2 GLU A 65 72.922 23.016 26.843 1.00 0.00 H new ATOM 0 HG3 GLU A 65 72.209 22.664 28.405 1.00 0.00 H new ATOM 994 N ALA A 66 73.567 26.564 30.403 1.00 0.00 N ATOM 995 CA ALA A 66 73.245 27.588 31.387 1.00 0.00 C ATOM 996 C ALA A 66 74.219 27.535 32.581 1.00 0.00 C ATOM 997 O ALA A 66 75.032 26.615 32.725 1.00 0.00 O ATOM 998 CB ALA A 66 71.802 27.349 31.854 1.00 0.00 C ATOM 0 H ALA A 66 74.044 25.770 30.831 1.00 0.00 H new ATOM 0 HA ALA A 66 73.341 28.578 30.941 1.00 0.00 H new ATOM 0 HB1 ALA A 66 71.530 28.102 32.594 1.00 0.00 H new ATOM 0 HB2 ALA A 66 71.127 27.418 31.001 1.00 0.00 H new ATOM 0 HB3 ALA A 66 71.723 26.357 32.300 1.00 0.00 H new ATOM 1004 N LEU A 67 74.121 28.541 33.445 1.00 0.00 N ATOM 1005 CA LEU A 67 74.985 28.720 34.623 1.00 0.00 C ATOM 1006 C LEU A 67 74.215 28.768 35.954 1.00 0.00 C ATOM 1007 O LEU A 67 73.057 29.178 36.019 1.00 0.00 O ATOM 1008 CB LEU A 67 75.887 29.964 34.461 1.00 0.00 C ATOM 1009 CG LEU A 67 76.908 29.868 33.308 1.00 0.00 C ATOM 1010 CD1 LEU A 67 76.389 30.515 32.023 1.00 0.00 C ATOM 1011 CD2 LEU A 67 78.209 30.587 33.679 1.00 0.00 C ATOM 0 H LEU A 67 73.422 29.278 33.349 1.00 0.00 H new ATOM 0 HA LEU A 67 75.612 27.830 34.673 1.00 0.00 H new ATOM 0 HB2 LEU A 67 75.255 30.837 34.298 1.00 0.00 H new ATOM 0 HB3 LEU A 67 76.426 30.130 35.394 1.00 0.00 H new ATOM 0 HG LEU A 67 77.077 28.804 33.142 1.00 0.00 H new ATOM 0 HD11 LEU A 67 77.141 30.423 31.240 1.00 0.00 H new ATOM 0 HD12 LEU A 67 75.474 30.014 31.707 1.00 0.00 H new ATOM 0 HD13 LEU A 67 76.181 31.570 32.205 1.00 0.00 H new ATOM 0 HD21 LEU A 67 78.916 30.508 32.853 1.00 0.00 H new ATOM 0 HD22 LEU A 67 78.000 31.638 33.879 1.00 0.00 H new ATOM 0 HD23 LEU A 67 78.638 30.127 34.569 1.00 0.00 H new ATOM 1023 N LYS A 68 74.911 28.396 37.032 1.00 0.00 N ATOM 1024 CA LYS A 68 74.572 28.610 38.442 1.00 0.00 C ATOM 1025 C LYS A 68 75.462 29.710 39.040 1.00 0.00 C ATOM 1026 O LYS A 68 76.682 29.678 38.913 1.00 0.00 O ATOM 1027 CB LYS A 68 74.709 27.289 39.223 1.00 0.00 C ATOM 1028 CG LYS A 68 75.828 26.355 38.749 1.00 0.00 C ATOM 1029 CD LYS A 68 76.018 25.271 39.790 1.00 0.00 C ATOM 1030 CE LYS A 68 77.192 24.369 39.411 1.00 0.00 C ATOM 1031 NZ LYS A 68 77.577 23.472 40.522 1.00 0.00 N ATOM 0 H LYS A 68 75.796 27.898 36.934 1.00 0.00 H new ATOM 0 HA LYS A 68 73.536 28.941 38.518 1.00 0.00 H new ATOM 0 HB2 LYS A 68 74.877 27.524 40.274 1.00 0.00 H new ATOM 0 HB3 LYS A 68 73.762 26.752 39.164 1.00 0.00 H new ATOM 0 HG2 LYS A 68 75.572 25.915 37.785 1.00 0.00 H new ATOM 0 HG3 LYS A 68 76.754 26.913 38.609 1.00 0.00 H new ATOM 0 HD2 LYS A 68 76.198 25.722 40.766 1.00 0.00 H new ATOM 0 HD3 LYS A 68 75.108 24.677 39.876 1.00 0.00 H new ATOM 0 HE2 LYS A 68 76.925 23.773 38.538 1.00 0.00 H new ATOM 0 HE3 LYS A 68 78.046 24.984 39.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 78.376 22.876 40.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 77.856 24.041 41.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 76.770 22.867 40.776 1.00 0.00 H new ATOM 1045 N VAL A 69 74.872 30.693 39.709 1.00 0.00 N ATOM 1046 CA VAL A 69 75.589 31.834 40.308 1.00 0.00 C ATOM 1047 C VAL A 69 75.451 31.796 41.837 1.00 0.00 C ATOM 1048 O VAL A 69 74.353 31.579 42.358 1.00 0.00 O ATOM 1049 CB VAL A 69 75.057 33.160 39.736 1.00 0.00 C ATOM 1050 CG1 VAL A 69 75.898 34.342 40.215 1.00 0.00 C ATOM 1051 CG2 VAL A 69 74.965 33.155 38.202 1.00 0.00 C ATOM 0 H VAL A 69 73.864 30.729 39.858 1.00 0.00 H new ATOM 0 HA VAL A 69 76.647 31.761 40.058 1.00 0.00 H new ATOM 0 HB VAL A 69 74.041 33.271 40.116 1.00 0.00 H new ATOM 0 HG11 VAL A 69 75.500 35.266 39.796 1.00 0.00 H new ATOM 0 HG12 VAL A 69 75.866 34.394 41.303 1.00 0.00 H new ATOM 0 HG13 VAL A 69 76.930 34.211 39.888 1.00 0.00 H new ATOM 0 HG21 VAL A 69 74.584 34.116 37.857 1.00 0.00 H new ATOM 0 HG22 VAL A 69 75.955 32.984 37.779 1.00 0.00 H new ATOM 0 HG23 VAL A 69 74.291 32.361 37.881 1.00 0.00 H new ATOM 1061 N SER A 70 76.536 32.014 42.579 1.00 0.00 N ATOM 1062 CA SER A 70 76.546 31.996 44.053 1.00 0.00 C ATOM 1063 C SER A 70 77.186 33.228 44.700 1.00 0.00 C ATOM 1064 O SER A 70 78.042 33.919 44.145 1.00 0.00 O ATOM 1065 CB SER A 70 77.181 30.712 44.594 1.00 0.00 C ATOM 1066 OG SER A 70 78.457 30.467 44.038 1.00 0.00 O ATOM 0 H SER A 70 77.450 32.212 42.173 1.00 0.00 H new ATOM 0 HA SER A 70 75.494 32.024 44.338 1.00 0.00 H new ATOM 0 HB2 SER A 70 77.267 30.781 45.678 1.00 0.00 H new ATOM 0 HB3 SER A 70 76.526 29.868 44.380 1.00 0.00 H new ATOM 0 HG SER A 70 78.824 29.639 44.413 1.00 0.00 H new ATOM 1072 N CYS A 71 76.777 33.481 45.943 1.00 0.00 N ATOM 1073 CA CYS A 71 77.447 34.441 46.798 1.00 0.00 C ATOM 1074 C CYS A 71 78.634 33.707 47.430 1.00 0.00 C ATOM 1075 O CYS A 71 78.535 33.152 48.522 1.00 0.00 O ATOM 1076 CB CYS A 71 76.456 35.012 47.816 1.00 0.00 C ATOM 1077 SG CYS A 71 77.342 36.287 48.740 1.00 0.00 S ATOM 0 H CYS A 71 75.975 33.025 46.377 1.00 0.00 H new ATOM 0 HA CYS A 71 77.823 35.305 46.250 1.00 0.00 H new ATOM 0 HB2 CYS A 71 75.584 35.432 47.314 1.00 0.00 H new ATOM 0 HB3 CYS A 71 76.093 34.231 48.484 1.00 0.00 H new ATOM 1082 N GLY A 72 79.733 33.596 46.693 1.00 0.00 N ATOM 1083 CA GLY A 72 80.903 32.855 47.178 1.00 0.00 C ATOM 1084 C GLY A 72 81.580 33.510 48.391 1.00 0.00 C ATOM 1085 O GLY A 72 82.363 32.857 49.077 1.00 0.00 O ATOM 0 H GLY A 72 79.844 34.004 45.765 1.00 0.00 H new ATOM 0 HA2 GLY A 72 80.598 31.843 47.444 1.00 0.00 H new ATOM 0 HA3 GLY A 72 81.629 32.767 46.370 1.00 0.00 H new ATOM 1089 N LYS A 73 81.211 34.760 48.701 1.00 0.00 N ATOM 1090 CA LYS A 73 81.616 35.523 49.886 1.00 0.00 C ATOM 1091 C LYS A 73 81.176 34.888 51.206 1.00 0.00 C ATOM 1092 O LYS A 73 82.003 34.670 52.091 1.00 0.00 O ATOM 1093 CB LYS A 73 81.051 36.943 49.768 1.00 0.00 C ATOM 1094 CG LYS A 73 82.123 38.004 49.507 1.00 0.00 C ATOM 1095 CD LYS A 73 83.009 38.193 50.742 1.00 0.00 C ATOM 1096 CE LYS A 73 84.156 39.147 50.421 1.00 0.00 C ATOM 1097 NZ LYS A 73 85.333 38.837 51.258 1.00 0.00 N ATOM 0 H LYS A 73 80.587 35.295 48.097 1.00 0.00 H new ATOM 0 HA LYS A 73 82.706 35.534 49.912 1.00 0.00 H new ATOM 0 HB2 LYS A 73 80.320 36.969 48.960 1.00 0.00 H new ATOM 0 HB3 LYS A 73 80.520 37.192 50.687 1.00 0.00 H new ATOM 0 HG2 LYS A 73 82.736 37.707 48.656 1.00 0.00 H new ATOM 0 HG3 LYS A 73 81.649 38.950 49.245 1.00 0.00 H new ATOM 0 HD2 LYS A 73 82.417 38.588 51.567 1.00 0.00 H new ATOM 0 HD3 LYS A 73 83.405 37.231 51.066 1.00 0.00 H new ATOM 0 HE2 LYS A 73 84.420 39.066 49.367 1.00 0.00 H new ATOM 0 HE3 LYS A 73 83.840 40.176 50.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 86.105 39.495 51.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 85.081 38.936 52.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 85.643 37.861 51.074 1.00 0.00 H new ATOM 1111 N CYS A 74 79.881 34.617 51.333 1.00 0.00 N ATOM 1112 CA CYS A 74 79.252 33.994 52.480 1.00 0.00 C ATOM 1113 C CYS A 74 79.063 32.476 52.270 1.00 0.00 C ATOM 1114 O CYS A 74 79.029 31.718 53.244 1.00 0.00 O ATOM 1115 CB CYS A 74 77.972 34.782 52.756 1.00 0.00 C ATOM 1116 SG CYS A 74 76.958 35.101 51.280 1.00 0.00 S ATOM 0 H CYS A 74 79.211 34.840 50.597 1.00 0.00 H new ATOM 0 HA CYS A 74 79.879 34.039 53.371 1.00 0.00 H new ATOM 0 HB2 CYS A 74 77.372 34.235 53.484 1.00 0.00 H new ATOM 0 HB3 CYS A 74 78.237 35.735 53.213 1.00 0.00 H new ATOM 1121 N GLY A 75 79.026 32.051 51.006 1.00 0.00 N ATOM 1122 CA GLY A 75 78.905 30.663 50.562 1.00 0.00 C ATOM 1123 C GLY A 75 77.486 30.259 50.139 1.00 0.00 C ATOM 1124 O GLY A 75 77.041 29.151 50.445 1.00 0.00 O ATOM 0 H GLY A 75 79.083 32.702 50.223 1.00 0.00 H new ATOM 0 HA2 GLY A 75 79.582 30.501 49.723 1.00 0.00 H new ATOM 0 HA3 GLY A 75 79.233 30.006 51.367 1.00 0.00 H new ATOM 1128 N ASN A 76 76.751 31.161 49.479 1.00 0.00 N ATOM 1129 CA ASN A 76 75.346 30.987 49.108 1.00 0.00 C ATOM 1130 C ASN A 76 75.132 30.482 47.672 1.00 0.00 C ATOM 1131 O ASN A 76 75.777 29.542 47.215 1.00 0.00 O ATOM 1132 CB ASN A 76 74.514 32.194 49.584 1.00 0.00 C ATOM 1133 CG ASN A 76 73.075 31.808 49.906 1.00 0.00 C ATOM 1134 OD1 ASN A 76 72.805 30.768 50.482 1.00 0.00 O ATOM 1135 ND2 ASN A 76 72.098 32.579 49.504 1.00 0.00 N ATOM 0 H ASN A 76 77.131 32.059 49.180 1.00 0.00 H new ATOM 0 HA ASN A 76 74.932 30.141 49.656 1.00 0.00 H new ATOM 0 HB2 ASN A 76 74.979 32.628 50.469 1.00 0.00 H new ATOM 0 HB3 ASN A 76 74.518 32.964 48.812 1.00 0.00 H new ATOM 0 HD21 ASN A 76 71.130 32.306 49.674 1.00 0.00 H new ATOM 0 HD22 ASN A 76 72.304 33.453 49.020 1.00 0.00 H new ATOM 1142 N GLY A 77 74.176 31.080 46.975 1.00 0.00 N ATOM 1143 CA GLY A 77 73.600 30.617 45.729 1.00 0.00 C ATOM 1144 C GLY A 77 72.469 31.532 45.263 1.00 0.00 C ATOM 1145 O GLY A 77 71.286 31.222 45.361 1.00 0.00 O ATOM 0 H GLY A 77 73.759 31.956 47.288 1.00 0.00 H new ATOM 0 HA2 GLY A 77 74.374 30.574 44.963 1.00 0.00 H new ATOM 0 HA3 GLY A 77 73.221 29.603 45.856 1.00 0.00 H new ATOM 1149 N LEU A 78 72.889 32.707 44.804 1.00 0.00 N ATOM 1150 CA LEU A 78 72.097 33.843 44.297 1.00 0.00 C ATOM 1151 C LEU A 78 71.095 33.472 43.206 1.00 0.00 C ATOM 1152 O LEU A 78 70.115 34.178 43.013 1.00 0.00 O ATOM 1153 CB LEU A 78 73.054 34.889 43.703 1.00 0.00 C ATOM 1154 CG LEU A 78 74.027 35.429 44.747 1.00 0.00 C ATOM 1155 CD1 LEU A 78 75.139 36.227 44.086 1.00 0.00 C ATOM 1156 CD2 LEU A 78 73.332 36.315 45.785 1.00 0.00 C ATOM 0 H LEU A 78 73.887 32.916 44.771 1.00 0.00 H new ATOM 0 HA LEU A 78 71.530 34.218 45.149 1.00 0.00 H new ATOM 0 HB2 LEU A 78 73.614 34.443 42.881 1.00 0.00 H new ATOM 0 HB3 LEU A 78 72.476 35.713 43.285 1.00 0.00 H new ATOM 0 HG LEU A 78 74.444 34.561 45.258 1.00 0.00 H new ATOM 0 HD11 LEU A 78 75.821 36.602 44.849 1.00 0.00 H new ATOM 0 HD12 LEU A 78 75.686 35.586 43.395 1.00 0.00 H new ATOM 0 HD13 LEU A 78 74.709 37.066 43.539 1.00 0.00 H new ATOM 0 HD21 LEU A 78 74.066 36.675 46.506 1.00 0.00 H new ATOM 0 HD22 LEU A 78 72.867 37.165 45.285 1.00 0.00 H new ATOM 0 HD23 LEU A 78 72.567 35.737 46.304 1.00 0.00 H new ATOM 1168 N GLY A 79 71.367 32.386 42.494 1.00 0.00 N ATOM 1169 CA GLY A 79 70.416 31.752 41.574 1.00 0.00 C ATOM 1170 C GLY A 79 71.084 31.045 40.396 1.00 0.00 C ATOM 1171 O GLY A 79 72.169 30.478 40.509 1.00 0.00 O ATOM 0 H GLY A 79 72.268 31.909 42.536 1.00 0.00 H new ATOM 0 HA2 GLY A 79 69.815 31.030 42.127 1.00 0.00 H new ATOM 0 HA3 GLY A 79 69.732 32.510 41.192 1.00 0.00 H new ATOM 1175 N HIS A 80 70.423 31.081 39.250 1.00 0.00 N ATOM 1176 CA HIS A 80 70.865 30.588 37.962 1.00 0.00 C ATOM 1177 C HIS A 80 70.738 31.678 36.893 1.00 0.00 C ATOM 1178 O HIS A 80 69.860 32.533 36.950 1.00 0.00 O ATOM 1179 CB HIS A 80 70.014 29.393 37.582 1.00 0.00 C ATOM 1180 CG HIS A 80 70.155 28.185 38.475 1.00 0.00 C ATOM 1181 ND1 HIS A 80 69.488 27.968 39.659 1.00 0.00 N ATOM 1182 CD2 HIS A 80 70.952 27.094 38.253 1.00 0.00 C ATOM 1183 CE1 HIS A 80 69.885 26.784 40.149 1.00 0.00 C ATOM 1184 NE2 HIS A 80 70.770 26.203 39.321 1.00 0.00 N ATOM 0 H HIS A 80 69.490 31.489 39.196 1.00 0.00 H new ATOM 0 HA HIS A 80 71.913 30.297 38.027 1.00 0.00 H new ATOM 0 HB2 HIS A 80 68.968 29.700 37.578 1.00 0.00 H new ATOM 0 HB3 HIS A 80 70.264 29.100 36.562 1.00 0.00 H new ATOM 0 HD2 HIS A 80 71.605 26.946 37.406 1.00 0.00 H new ATOM 0 HE1 HIS A 80 69.541 26.357 41.080 1.00 0.00 H new ATOM 0 HE2 HIS A 80 71.219 25.296 39.445 1.00 0.00 H new ATOM 1192 N GLU A 81 71.585 31.609 35.877 1.00 0.00 N ATOM 1193 CA GLU A 81 71.784 32.643 34.868 1.00 0.00 C ATOM 1194 C GLU A 81 71.921 31.959 33.501 1.00 0.00 C ATOM 1195 O GLU A 81 72.899 31.260 33.217 1.00 0.00 O ATOM 1196 CB GLU A 81 73.026 33.447 35.280 1.00 0.00 C ATOM 1197 CG GLU A 81 73.308 34.709 34.459 1.00 0.00 C ATOM 1198 CD GLU A 81 74.469 35.495 35.092 1.00 0.00 C ATOM 1199 OE1 GLU A 81 74.221 36.348 35.979 1.00 0.00 O ATOM 1200 OE2 GLU A 81 75.636 35.231 34.717 1.00 0.00 O ATOM 0 H GLU A 81 72.180 30.795 35.725 1.00 0.00 H new ATOM 0 HA GLU A 81 70.947 33.337 34.792 1.00 0.00 H new ATOM 0 HB2 GLU A 81 72.919 33.734 36.326 1.00 0.00 H new ATOM 0 HB3 GLU A 81 73.896 32.793 35.216 1.00 0.00 H new ATOM 0 HG2 GLU A 81 73.557 34.438 33.433 1.00 0.00 H new ATOM 0 HG3 GLU A 81 72.415 35.333 34.416 1.00 0.00 H new ATOM 1207 N PHE A 82 70.893 32.087 32.666 1.00 0.00 N ATOM 1208 CA PHE A 82 70.796 31.350 31.402 1.00 0.00 C ATOM 1209 C PHE A 82 71.434 32.165 30.262 1.00 0.00 C ATOM 1210 O PHE A 82 70.761 32.744 29.409 1.00 0.00 O ATOM 1211 CB PHE A 82 69.338 30.906 31.153 1.00 0.00 C ATOM 1212 CG PHE A 82 69.190 29.613 30.359 1.00 0.00 C ATOM 1213 CD1 PHE A 82 69.764 29.480 29.078 1.00 0.00 C ATOM 1214 CD2 PHE A 82 68.502 28.515 30.917 1.00 0.00 C ATOM 1215 CE1 PHE A 82 69.679 28.262 28.380 1.00 0.00 C ATOM 1216 CE2 PHE A 82 68.413 27.296 30.217 1.00 0.00 C ATOM 1217 CZ PHE A 82 69.013 27.166 28.951 1.00 0.00 C ATOM 0 H PHE A 82 70.101 32.705 32.844 1.00 0.00 H new ATOM 0 HA PHE A 82 71.372 30.426 31.451 1.00 0.00 H new ATOM 0 HB2 PHE A 82 68.841 30.784 32.115 1.00 0.00 H new ATOM 0 HB3 PHE A 82 68.816 31.703 30.623 1.00 0.00 H new ATOM 0 HD1 PHE A 82 70.273 30.320 28.629 1.00 0.00 H new ATOM 0 HD2 PHE A 82 68.040 28.610 31.889 1.00 0.00 H new ATOM 0 HE1 PHE A 82 70.127 28.170 27.402 1.00 0.00 H new ATOM 0 HE2 PHE A 82 67.884 26.461 30.652 1.00 0.00 H new ATOM 0 HZ PHE A 82 68.961 26.227 28.421 1.00 0.00 H new ATOM 1227 N LEU A 83 72.767 32.217 30.272 1.00 0.00 N ATOM 1228 CA LEU A 83 73.591 32.684 29.160 1.00 0.00 C ATOM 1229 C LEU A 83 73.600 31.615 28.045 1.00 0.00 C ATOM 1230 O LEU A 83 72.879 30.626 28.090 1.00 0.00 O ATOM 1231 CB LEU A 83 74.991 32.995 29.745 1.00 0.00 C ATOM 1232 CG LEU A 83 75.899 33.960 28.955 1.00 0.00 C ATOM 1233 CD1 LEU A 83 75.307 35.366 28.841 1.00 0.00 C ATOM 1234 CD2 LEU A 83 77.256 34.066 29.651 1.00 0.00 C ATOM 0 H LEU A 83 73.318 31.926 31.080 1.00 0.00 H new ATOM 0 HA LEU A 83 73.205 33.590 28.694 1.00 0.00 H new ATOM 0 HB2 LEU A 83 74.853 33.407 30.745 1.00 0.00 H new ATOM 0 HB3 LEU A 83 75.524 32.051 29.860 1.00 0.00 H new ATOM 0 HG LEU A 83 75.998 33.551 27.949 1.00 0.00 H new ATOM 0 HD11 LEU A 83 75.988 36.003 28.276 1.00 0.00 H new ATOM 0 HD12 LEU A 83 74.347 35.316 28.328 1.00 0.00 H new ATOM 0 HD13 LEU A 83 75.164 35.783 29.838 1.00 0.00 H new ATOM 0 HD21 LEU A 83 77.899 34.748 29.094 1.00 0.00 H new ATOM 0 HD22 LEU A 83 77.117 34.445 30.664 1.00 0.00 H new ATOM 0 HD23 LEU A 83 77.721 33.081 29.693 1.00 0.00 H new ATOM 1246 N ASN A 84 74.441 31.808 27.033 1.00 0.00 N ATOM 1247 CA ASN A 84 74.788 30.858 25.955 1.00 0.00 C ATOM 1248 C ASN A 84 73.666 30.566 24.945 1.00 0.00 C ATOM 1249 O ASN A 84 73.891 29.933 23.913 1.00 0.00 O ATOM 1250 CB ASN A 84 75.387 29.557 26.514 1.00 0.00 C ATOM 1251 CG ASN A 84 76.112 29.654 27.817 1.00 0.00 C ATOM 1252 OD1 ASN A 84 77.223 30.138 27.936 1.00 0.00 O ATOM 1253 ND2 ASN A 84 75.478 29.126 28.825 1.00 0.00 N ATOM 0 H ASN A 84 74.939 32.692 26.928 1.00 0.00 H new ATOM 0 HA ASN A 84 75.550 31.380 25.377 1.00 0.00 H new ATOM 0 HB2 ASN A 84 74.580 28.833 26.627 1.00 0.00 H new ATOM 0 HB3 ASN A 84 76.075 29.154 25.771 1.00 0.00 H new ATOM 0 HD21 ASN A 84 75.911 29.110 29.748 1.00 0.00 H new ATOM 0 HD22 ASN A 84 74.548 28.729 28.691 1.00 0.00 H new ATOM 1260 N ASP A 85 72.475 31.087 25.212 1.00 0.00 N ATOM 1261 CA ASP A 85 71.268 30.811 24.430 1.00 0.00 C ATOM 1262 C ASP A 85 71.182 31.680 23.172 1.00 0.00 C ATOM 1263 O ASP A 85 70.697 31.251 22.128 1.00 0.00 O ATOM 1264 CB ASP A 85 70.043 31.012 25.327 1.00 0.00 C ATOM 1265 CG ASP A 85 68.772 30.590 24.597 1.00 0.00 C ATOM 1266 OD1 ASP A 85 68.626 29.379 24.320 1.00 0.00 O ATOM 1267 OD2 ASP A 85 67.937 31.460 24.262 1.00 0.00 O ATOM 0 H ASP A 85 72.314 31.725 25.991 1.00 0.00 H new ATOM 0 HA ASP A 85 71.305 29.778 24.083 1.00 0.00 H new ATOM 0 HB2 ASP A 85 70.155 30.429 26.241 1.00 0.00 H new ATOM 0 HB3 ASP A 85 69.969 32.058 25.623 1.00 0.00 H new ATOM 1272 N GLY A 86 71.693 32.902 23.288 1.00 0.00 N ATOM 1273 CA GLY A 86 71.667 33.928 22.275 1.00 0.00 C ATOM 1274 C GLY A 86 72.695 35.048 22.470 1.00 0.00 C ATOM 1275 O GLY A 86 72.305 36.214 22.444 1.00 0.00 O ATOM 0 H GLY A 86 72.159 33.210 24.141 1.00 0.00 H new ATOM 0 HA2 GLY A 86 71.836 33.464 21.303 1.00 0.00 H new ATOM 0 HA3 GLY A 86 70.670 34.369 22.249 1.00 0.00 H new ATOM 1279 N PRO A 87 74.003 34.762 22.650 1.00 0.00 N ATOM 1280 CA PRO A 87 75.016 35.776 22.994 1.00 0.00 C ATOM 1281 C PRO A 87 75.145 36.926 21.978 1.00 0.00 C ATOM 1282 O PRO A 87 75.637 38.001 22.320 1.00 0.00 O ATOM 1283 CB PRO A 87 76.330 34.996 23.118 1.00 0.00 C ATOM 1284 CG PRO A 87 76.114 33.753 22.255 1.00 0.00 C ATOM 1285 CD PRO A 87 74.632 33.459 22.474 1.00 0.00 C ATOM 0 HA PRO A 87 74.729 36.285 23.914 1.00 0.00 H new ATOM 0 HB2 PRO A 87 77.177 35.584 22.764 1.00 0.00 H new ATOM 0 HB3 PRO A 87 76.538 34.730 24.154 1.00 0.00 H new ATOM 0 HG2 PRO A 87 76.340 33.942 21.206 1.00 0.00 H new ATOM 0 HG3 PRO A 87 76.745 32.923 22.573 1.00 0.00 H new ATOM 0 HD2 PRO A 87 74.206 32.929 21.622 1.00 0.00 H new ATOM 0 HD3 PRO A 87 74.481 32.828 23.350 1.00 0.00 H new ATOM 1293 N LYS A 88 74.668 36.713 20.746 1.00 0.00 N ATOM 1294 CA LYS A 88 74.571 37.701 19.662 1.00 0.00 C ATOM 1295 C LYS A 88 73.491 38.784 19.872 1.00 0.00 C ATOM 1296 O LYS A 88 73.377 39.666 19.026 1.00 0.00 O ATOM 1297 CB LYS A 88 74.361 36.961 18.323 1.00 0.00 C ATOM 1298 CG LYS A 88 75.515 36.021 17.953 1.00 0.00 C ATOM 1299 CD LYS A 88 75.267 35.229 16.659 1.00 0.00 C ATOM 1300 CE LYS A 88 75.117 36.135 15.431 1.00 0.00 C ATOM 1301 NZ LYS A 88 75.011 35.344 14.183 1.00 0.00 N ATOM 0 H LYS A 88 74.320 35.797 20.462 1.00 0.00 H new ATOM 0 HA LYS A 88 75.512 38.251 19.654 1.00 0.00 H new ATOM 0 HB2 LYS A 88 73.437 36.385 18.377 1.00 0.00 H new ATOM 0 HB3 LYS A 88 74.233 37.695 17.528 1.00 0.00 H new ATOM 0 HG2 LYS A 88 76.429 36.605 17.843 1.00 0.00 H new ATOM 0 HG3 LYS A 88 75.681 35.321 18.772 1.00 0.00 H new ATOM 0 HD2 LYS A 88 76.094 34.538 16.497 1.00 0.00 H new ATOM 0 HD3 LYS A 88 74.366 34.627 16.773 1.00 0.00 H new ATOM 0 HE2 LYS A 88 74.230 36.759 15.544 1.00 0.00 H new ATOM 0 HE3 LYS A 88 75.973 36.806 15.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 74.911 35.987 13.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 75.868 34.767 14.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 74.180 34.722 14.236 1.00 0.00 H new ATOM 1315 N ARG A 89 72.637 38.689 20.902 1.00 0.00 N ATOM 1316 CA ARG A 89 71.530 39.586 21.220 1.00 0.00 C ATOM 1317 C ARG A 89 71.859 40.576 22.353 1.00 0.00 C ATOM 1318 O ARG A 89 72.977 40.598 22.868 1.00 0.00 O ATOM 1319 CB ARG A 89 70.280 38.750 21.517 1.00 0.00 C ATOM 1320 CG ARG A 89 69.714 38.117 20.268 1.00 0.00 C ATOM 1321 CD ARG A 89 70.430 36.880 19.733 1.00 0.00 C ATOM 1322 NE ARG A 89 69.819 36.387 18.489 1.00 0.00 N ATOM 1323 CZ ARG A 89 70.068 36.789 17.257 1.00 0.00 C ATOM 1324 NH1 ARG A 89 70.864 37.792 17.006 1.00 0.00 N ATOM 1325 NH2 ARG A 89 69.513 36.153 16.272 1.00 0.00 N ATOM 0 H ARG A 89 72.712 37.929 21.578 1.00 0.00 H new ATOM 0 HA ARG A 89 71.339 40.217 20.352 1.00 0.00 H new ATOM 0 HB2 ARG A 89 70.528 37.971 22.238 1.00 0.00 H new ATOM 0 HB3 ARG A 89 69.522 39.383 21.979 1.00 0.00 H new ATOM 0 HG2 ARG A 89 68.676 37.849 20.465 1.00 0.00 H new ATOM 0 HG3 ARG A 89 69.705 38.870 19.480 1.00 0.00 H new ATOM 0 HD2 ARG A 89 71.479 37.117 19.553 1.00 0.00 H new ATOM 0 HD3 ARG A 89 70.406 36.092 20.486 1.00 0.00 H new ATOM 0 HE ARG A 89 69.122 35.649 18.590 1.00 0.00 H new ATOM 0 HH11 ARG A 89 71.315 38.290 17.774 1.00 0.00 H new ATOM 0 HH12 ARG A 89 71.036 38.078 16.042 1.00 0.00 H new ATOM 0 HH21 ARG A 89 68.899 35.360 16.458 1.00 0.00 H new ATOM 0 HH22 ARG A 89 69.691 36.446 15.311 1.00 0.00 H new ATOM 1339 N GLY A 90 70.854 41.350 22.774 1.00 0.00 N ATOM 1340 CA GLY A 90 70.728 42.022 24.061 1.00 0.00 C ATOM 1341 C GLY A 90 69.944 41.249 25.135 1.00 0.00 C ATOM 1342 O GLY A 90 69.425 41.841 26.080 1.00 0.00 O ATOM 0 H GLY A 90 70.049 41.534 22.175 1.00 0.00 H new ATOM 0 HA2 GLY A 90 71.728 42.229 24.443 1.00 0.00 H new ATOM 0 HA3 GLY A 90 70.242 42.985 23.903 1.00 0.00 H new ATOM 1346 N GLN A 91 69.765 39.947 24.930 1.00 0.00 N ATOM 1347 CA GLN A 91 69.043 39.029 25.804 1.00 0.00 C ATOM 1348 C GLN A 91 69.748 38.773 27.150 1.00 0.00 C ATOM 1349 O GLN A 91 70.975 38.756 27.233 1.00 0.00 O ATOM 1350 CB GLN A 91 68.845 37.693 25.079 1.00 0.00 C ATOM 1351 CG GLN A 91 67.756 37.697 24.002 1.00 0.00 C ATOM 1352 CD GLN A 91 67.741 36.388 23.212 1.00 0.00 C ATOM 1353 OE1 GLN A 91 68.767 35.856 22.815 1.00 0.00 O ATOM 1354 NE2 GLN A 91 66.598 35.793 22.963 1.00 0.00 N ATOM 0 H GLN A 91 70.140 39.479 24.105 1.00 0.00 H new ATOM 0 HA GLN A 91 68.089 39.502 26.034 1.00 0.00 H new ATOM 0 HB2 GLN A 91 69.789 37.403 24.619 1.00 0.00 H new ATOM 0 HB3 GLN A 91 68.602 36.929 25.817 1.00 0.00 H new ATOM 0 HG2 GLN A 91 66.783 37.852 24.468 1.00 0.00 H new ATOM 0 HG3 GLN A 91 67.920 38.532 23.321 1.00 0.00 H new ATOM 0 HE21 GLN A 91 65.725 36.213 23.282 1.00 0.00 H new ATOM 0 HE22 GLN A 91 66.583 34.911 22.451 1.00 0.00 H new ATOM 1363 N SER A 92 68.923 38.482 28.162 1.00 0.00 N ATOM 1364 CA SER A 92 69.253 38.231 29.563 1.00 0.00 C ATOM 1365 C SER A 92 68.036 37.550 30.223 1.00 0.00 C ATOM 1366 O SER A 92 66.908 38.059 30.129 1.00 0.00 O ATOM 1367 CB SER A 92 69.533 39.546 30.300 1.00 0.00 C ATOM 1368 OG SER A 92 70.740 40.167 29.897 1.00 0.00 O ATOM 0 H SER A 92 67.918 38.411 28.003 1.00 0.00 H new ATOM 0 HA SER A 92 70.142 37.603 29.617 1.00 0.00 H new ATOM 0 HB2 SER A 92 68.704 40.233 30.130 1.00 0.00 H new ATOM 0 HB3 SER A 92 69.572 39.353 31.372 1.00 0.00 H new ATOM 0 HG SER A 92 71.343 40.240 30.666 1.00 0.00 H new ATOM 1374 N ARG A 93 68.244 36.399 30.871 1.00 0.00 N ATOM 1375 CA ARG A 93 67.332 35.802 31.879 1.00 0.00 C ATOM 1376 C ARG A 93 68.070 35.185 33.075 1.00 0.00 C ATOM 1377 O ARG A 93 69.054 34.464 32.906 1.00 0.00 O ATOM 1378 CB ARG A 93 66.363 34.769 31.263 1.00 0.00 C ATOM 1379 CG ARG A 93 65.144 35.360 30.531 1.00 0.00 C ATOM 1380 CD ARG A 93 64.288 36.271 31.434 1.00 0.00 C ATOM 1381 NE ARG A 93 63.045 36.720 30.782 1.00 0.00 N ATOM 1382 CZ ARG A 93 62.943 37.597 29.802 1.00 0.00 C ATOM 1383 NH1 ARG A 93 63.966 38.201 29.266 1.00 0.00 N ATOM 1384 NH2 ARG A 93 61.783 37.899 29.308 1.00 0.00 N ATOM 0 H ARG A 93 69.076 35.831 30.710 1.00 0.00 H new ATOM 0 HA ARG A 93 66.745 36.641 32.253 1.00 0.00 H new ATOM 0 HB2 ARG A 93 66.920 34.147 30.562 1.00 0.00 H new ATOM 0 HB3 ARG A 93 66.006 34.113 32.057 1.00 0.00 H new ATOM 0 HG2 ARG A 93 65.486 35.930 29.667 1.00 0.00 H new ATOM 0 HG3 ARG A 93 64.525 34.547 30.151 1.00 0.00 H new ATOM 0 HD2 ARG A 93 64.039 35.735 32.350 1.00 0.00 H new ATOM 0 HD3 ARG A 93 64.875 37.142 31.724 1.00 0.00 H new ATOM 0 HE ARG A 93 62.175 36.311 31.123 1.00 0.00 H new ATOM 0 HH11 ARG A 93 64.908 38.004 29.603 1.00 0.00 H new ATOM 0 HH12 ARG A 93 63.824 38.871 28.510 1.00 0.00 H new ATOM 0 HH21 ARG A 93 60.941 37.457 29.677 1.00 0.00 H new ATOM 0 HH22 ARG A 93 61.713 38.578 28.550 1.00 0.00 H new ATOM 1398 N PHE A 94 67.532 35.410 34.278 1.00 0.00 N ATOM 1399 CA PHE A 94 68.058 34.924 35.554 1.00 0.00 C ATOM 1400 C PHE A 94 66.918 34.355 36.418 1.00 0.00 C ATOM 1401 O PHE A 94 65.886 35.003 36.600 1.00 0.00 O ATOM 1402 CB PHE A 94 68.804 36.077 36.244 1.00 0.00 C ATOM 1403 CG PHE A 94 69.606 35.674 37.467 1.00 0.00 C ATOM 1404 CD1 PHE A 94 68.958 35.350 38.675 1.00 0.00 C ATOM 1405 CD2 PHE A 94 71.013 35.647 37.407 1.00 0.00 C ATOM 1406 CE1 PHE A 94 69.708 34.962 39.797 1.00 0.00 C ATOM 1407 CE2 PHE A 94 71.764 35.270 38.533 1.00 0.00 C ATOM 1408 CZ PHE A 94 71.112 34.913 39.726 1.00 0.00 C ATOM 0 H PHE A 94 66.681 35.960 34.392 1.00 0.00 H new ATOM 0 HA PHE A 94 68.762 34.107 35.396 1.00 0.00 H new ATOM 0 HB2 PHE A 94 69.477 36.539 35.522 1.00 0.00 H new ATOM 0 HB3 PHE A 94 68.079 36.837 36.536 1.00 0.00 H new ATOM 0 HD1 PHE A 94 67.881 35.400 38.738 1.00 0.00 H new ATOM 0 HD2 PHE A 94 71.517 35.917 36.491 1.00 0.00 H new ATOM 0 HE1 PHE A 94 69.206 34.701 40.717 1.00 0.00 H new ATOM 0 HE2 PHE A 94 72.843 35.254 38.482 1.00 0.00 H new ATOM 0 HZ PHE A 94 71.687 34.602 40.586 1.00 0.00 H new ATOM 1418 N CYS A 95 67.097 33.151 36.966 1.00 0.00 N ATOM 1419 CA CYS A 95 66.088 32.436 37.757 1.00 0.00 C ATOM 1420 C CYS A 95 66.617 32.030 39.146 1.00 0.00 C ATOM 1421 O CYS A 95 67.753 31.594 39.274 1.00 0.00 O ATOM 1422 CB CYS A 95 65.568 31.241 36.951 1.00 0.00 C ATOM 1423 SG CYS A 95 64.063 30.613 37.746 1.00 0.00 S ATOM 0 H CYS A 95 67.970 32.631 36.871 1.00 0.00 H new ATOM 0 HA CYS A 95 65.253 33.108 37.954 1.00 0.00 H new ATOM 0 HB2 CYS A 95 65.356 31.541 35.925 1.00 0.00 H new ATOM 0 HB3 CYS A 95 66.325 30.458 36.904 1.00 0.00 H new ATOM 0 HG CYS A 95 63.607 29.599 37.072 1.00 0.00 H new ATOM 1429 N ILE A 96 65.817 32.189 40.200 1.00 0.00 N ATOM 1430 CA ILE A 96 66.298 32.344 41.582 1.00 0.00 C ATOM 1431 C ILE A 96 65.613 31.392 42.581 1.00 0.00 C ATOM 1432 O ILE A 96 64.572 30.801 42.287 1.00 0.00 O ATOM 1433 CB ILE A 96 66.097 33.835 41.946 1.00 0.00 C ATOM 1434 CG1 ILE A 96 66.835 34.236 43.234 1.00 0.00 C ATOM 1435 CG2 ILE A 96 64.612 34.240 42.026 1.00 0.00 C ATOM 1436 CD1 ILE A 96 67.199 35.722 43.293 1.00 0.00 C ATOM 0 H ILE A 96 64.800 32.215 40.122 1.00 0.00 H new ATOM 0 HA ILE A 96 67.349 32.064 41.647 1.00 0.00 H new ATOM 0 HB ILE A 96 66.543 34.390 41.121 1.00 0.00 H new ATOM 0 HG12 ILE A 96 66.211 33.989 44.093 1.00 0.00 H new ATOM 0 HG13 ILE A 96 67.746 33.643 43.321 1.00 0.00 H new ATOM 0 HG21 ILE A 96 64.536 35.296 42.285 1.00 0.00 H new ATOM 0 HG22 ILE A 96 64.135 34.068 41.061 1.00 0.00 H new ATOM 0 HG23 ILE A 96 64.113 33.643 42.789 1.00 0.00 H new ATOM 0 HD11 ILE A 96 67.717 35.933 44.229 1.00 0.00 H new ATOM 0 HD12 ILE A 96 67.849 35.971 42.454 1.00 0.00 H new ATOM 0 HD13 ILE A 96 66.290 36.322 43.238 1.00 0.00 H new ATOM 1448 N PHE A 97 66.187 31.260 43.781 1.00 0.00 N ATOM 1449 CA PHE A 97 65.605 30.552 44.919 1.00 0.00 C ATOM 1450 C PHE A 97 65.161 31.492 46.050 1.00 0.00 C ATOM 1451 O PHE A 97 65.733 32.556 46.275 1.00 0.00 O ATOM 1452 CB PHE A 97 66.623 29.541 45.448 1.00 0.00 C ATOM 1453 CG PHE A 97 66.838 28.295 44.599 1.00 0.00 C ATOM 1454 CD1 PHE A 97 65.751 27.574 44.060 1.00 0.00 C ATOM 1455 CD2 PHE A 97 68.151 27.855 44.337 1.00 0.00 C ATOM 1456 CE1 PHE A 97 65.977 26.454 43.240 1.00 0.00 C ATOM 1457 CE2 PHE A 97 68.374 26.725 43.531 1.00 0.00 C ATOM 1458 CZ PHE A 97 67.289 26.030 42.970 1.00 0.00 C ATOM 0 H PHE A 97 67.102 31.658 43.991 1.00 0.00 H new ATOM 0 HA PHE A 97 64.706 30.047 44.567 1.00 0.00 H new ATOM 0 HB2 PHE A 97 67.581 30.048 45.562 1.00 0.00 H new ATOM 0 HB3 PHE A 97 66.308 29.227 46.443 1.00 0.00 H new ATOM 0 HD1 PHE A 97 64.740 27.884 44.279 1.00 0.00 H new ATOM 0 HD2 PHE A 97 68.990 28.389 44.758 1.00 0.00 H new ATOM 0 HE1 PHE A 97 65.140 25.919 42.817 1.00 0.00 H new ATOM 0 HE2 PHE A 97 69.383 26.390 43.342 1.00 0.00 H new ATOM 0 HZ PHE A 97 67.463 25.174 42.334 1.00 0.00 H new ATOM 1468 N SER A 98 64.196 31.036 46.850 1.00 0.00 N ATOM 1469 CA SER A 98 63.747 31.698 48.086 1.00 0.00 C ATOM 1470 C SER A 98 64.848 31.896 49.138 1.00 0.00 C ATOM 1471 O SER A 98 64.743 32.798 49.966 1.00 0.00 O ATOM 1472 CB SER A 98 62.644 30.855 48.707 1.00 0.00 C ATOM 1473 OG SER A 98 63.136 29.544 48.911 1.00 0.00 O ATOM 0 H SER A 98 63.688 30.173 46.655 1.00 0.00 H new ATOM 0 HA SER A 98 63.410 32.693 47.797 1.00 0.00 H new ATOM 0 HB2 SER A 98 62.323 31.290 49.654 1.00 0.00 H new ATOM 0 HB3 SER A 98 61.771 30.834 48.054 1.00 0.00 H new ATOM 0 HG SER A 98 62.434 28.990 49.313 1.00 0.00 H new ATOM 1479 N SER A 99 65.892 31.061 49.122 1.00 0.00 N ATOM 1480 CA SER A 99 67.063 31.154 50.009 1.00 0.00 C ATOM 1481 C SER A 99 68.280 31.842 49.356 1.00 0.00 C ATOM 1482 O SER A 99 69.364 31.901 49.933 1.00 0.00 O ATOM 1483 CB SER A 99 67.373 29.788 50.617 1.00 0.00 C ATOM 1484 OG SER A 99 68.032 29.929 51.861 1.00 0.00 O ATOM 0 H SER A 99 65.950 30.277 48.473 1.00 0.00 H new ATOM 0 HA SER A 99 66.806 31.824 50.830 1.00 0.00 H new ATOM 0 HB2 SER A 99 66.448 29.227 50.752 1.00 0.00 H new ATOM 0 HB3 SER A 99 67.998 29.214 49.933 1.00 0.00 H new ATOM 0 HG SER A 99 68.734 30.609 51.784 1.00 0.00 H new ATOM 1490 N SER A 100 68.134 32.379 48.136 1.00 0.00 N ATOM 1491 CA SER A 100 69.219 33.084 47.439 1.00 0.00 C ATOM 1492 C SER A 100 69.574 34.412 48.108 1.00 0.00 C ATOM 1493 O SER A 100 70.749 34.778 48.164 1.00 0.00 O ATOM 1494 CB SER A 100 68.829 33.356 45.991 1.00 0.00 C ATOM 1495 OG SER A 100 68.784 32.159 45.239 1.00 0.00 O ATOM 0 H SER A 100 67.263 32.337 47.606 1.00 0.00 H new ATOM 0 HA SER A 100 70.092 32.433 47.483 1.00 0.00 H new ATOM 0 HB2 SER A 100 67.855 33.845 45.960 1.00 0.00 H new ATOM 0 HB3 SER A 100 69.545 34.044 45.542 1.00 0.00 H new ATOM 0 HG SER A 100 69.601 31.642 45.398 1.00 0.00 H new ATOM 1501 N LEU A 101 68.553 35.125 48.590 1.00 0.00 N ATOM 1502 CA LEU A 101 68.639 36.453 49.214 1.00 0.00 C ATOM 1503 C LEU A 101 67.334 36.856 49.935 1.00 0.00 C ATOM 1504 O LEU A 101 66.324 36.162 49.827 1.00 0.00 O ATOM 1505 CB LEU A 101 69.047 37.495 48.154 1.00 0.00 C ATOM 1506 CG LEU A 101 68.397 37.424 46.755 1.00 0.00 C ATOM 1507 CD1 LEU A 101 66.870 37.476 46.789 1.00 0.00 C ATOM 1508 CD2 LEU A 101 68.894 38.596 45.907 1.00 0.00 C ATOM 0 H LEU A 101 67.595 34.777 48.555 1.00 0.00 H new ATOM 0 HA LEU A 101 69.405 36.413 49.988 1.00 0.00 H new ATOM 0 HB2 LEU A 101 68.840 38.483 48.565 1.00 0.00 H new ATOM 0 HB3 LEU A 101 70.127 37.425 48.021 1.00 0.00 H new ATOM 0 HG LEU A 101 68.685 36.462 46.330 1.00 0.00 H new ATOM 0 HD11 LEU A 101 66.481 37.422 45.772 1.00 0.00 H new ATOM 0 HD12 LEU A 101 66.490 36.634 47.368 1.00 0.00 H new ATOM 0 HD13 LEU A 101 66.548 38.409 47.251 1.00 0.00 H new ATOM 0 HD21 LEU A 101 68.437 38.549 44.918 1.00 0.00 H new ATOM 0 HD22 LEU A 101 68.621 39.535 46.389 1.00 0.00 H new ATOM 0 HD23 LEU A 101 69.978 38.540 45.809 1.00 0.00 H new ATOM 1520 N LYS A 102 67.358 37.978 50.669 1.00 0.00 N ATOM 1521 CA LYS A 102 66.226 38.574 51.386 1.00 0.00 C ATOM 1522 C LYS A 102 65.808 39.925 50.781 1.00 0.00 C ATOM 1523 O LYS A 102 66.424 40.441 49.850 1.00 0.00 O ATOM 1524 CB LYS A 102 66.556 38.696 52.872 1.00 0.00 C ATOM 1525 CG LYS A 102 67.188 37.446 53.515 1.00 0.00 C ATOM 1526 CD LYS A 102 67.424 37.544 55.032 1.00 0.00 C ATOM 1527 CE LYS A 102 68.394 38.674 55.399 1.00 0.00 C ATOM 1528 NZ LYS A 102 68.834 38.596 56.813 1.00 0.00 N ATOM 0 H LYS A 102 68.214 38.521 50.783 1.00 0.00 H new ATOM 0 HA LYS A 102 65.367 37.912 51.277 1.00 0.00 H new ATOM 0 HB2 LYS A 102 67.236 39.537 53.008 1.00 0.00 H new ATOM 0 HB3 LYS A 102 65.640 38.937 53.411 1.00 0.00 H new ATOM 0 HG2 LYS A 102 66.544 36.589 53.317 1.00 0.00 H new ATOM 0 HG3 LYS A 102 68.142 37.247 53.026 1.00 0.00 H new ATOM 0 HD2 LYS A 102 66.471 37.708 55.536 1.00 0.00 H new ATOM 0 HD3 LYS A 102 67.819 36.596 55.398 1.00 0.00 H new ATOM 0 HE2 LYS A 102 69.266 38.629 54.746 1.00 0.00 H new ATOM 0 HE3 LYS A 102 67.913 39.636 55.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 69.622 39.256 56.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 68.042 38.849 57.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 69.147 37.627 57.026 1.00 0.00 H new ATOM 1542 N PHE A 103 64.747 40.509 51.331 1.00 0.00 N ATOM 1543 CA PHE A 103 64.057 41.692 50.848 1.00 0.00 C ATOM 1544 C PHE A 103 63.687 42.617 52.011 1.00 0.00 C ATOM 1545 O PHE A 103 63.186 42.173 53.044 1.00 0.00 O ATOM 1546 CB PHE A 103 62.806 41.208 50.113 1.00 0.00 C ATOM 1547 CG PHE A 103 62.056 42.276 49.334 1.00 0.00 C ATOM 1548 CD1 PHE A 103 62.694 42.986 48.299 1.00 0.00 C ATOM 1549 CD2 PHE A 103 60.713 42.566 49.642 1.00 0.00 C ATOM 1550 CE1 PHE A 103 62.007 43.991 47.595 1.00 0.00 C ATOM 1551 CE2 PHE A 103 60.020 43.560 48.928 1.00 0.00 C ATOM 1552 CZ PHE A 103 60.668 44.280 47.911 1.00 0.00 C ATOM 0 H PHE A 103 64.322 40.141 52.182 1.00 0.00 H new ATOM 0 HA PHE A 103 64.696 42.268 50.179 1.00 0.00 H new ATOM 0 HB2 PHE A 103 63.094 40.414 49.424 1.00 0.00 H new ATOM 0 HB3 PHE A 103 62.125 40.767 50.841 1.00 0.00 H new ATOM 0 HD1 PHE A 103 63.718 42.757 48.044 1.00 0.00 H new ATOM 0 HD2 PHE A 103 60.213 42.023 50.430 1.00 0.00 H new ATOM 0 HE1 PHE A 103 62.508 44.541 46.812 1.00 0.00 H new ATOM 0 HE2 PHE A 103 58.987 43.770 49.162 1.00 0.00 H new ATOM 0 HZ PHE A 103 60.139 45.053 47.373 1.00 0.00 H new ATOM 1562 N VAL A 104 63.928 43.909 51.824 1.00 0.00 N ATOM 1563 CA VAL A 104 63.571 44.997 52.736 1.00 0.00 C ATOM 1564 C VAL A 104 62.660 46.017 52.032 1.00 0.00 C ATOM 1565 O VAL A 104 63.137 46.947 51.373 1.00 0.00 O ATOM 1566 CB VAL A 104 64.834 45.588 53.398 1.00 0.00 C ATOM 1567 CG1 VAL A 104 65.847 46.274 52.471 1.00 0.00 C ATOM 1568 CG2 VAL A 104 64.456 46.556 54.525 1.00 0.00 C ATOM 0 H VAL A 104 64.403 44.248 50.988 1.00 0.00 H new ATOM 0 HA VAL A 104 62.975 44.613 53.563 1.00 0.00 H new ATOM 0 HB VAL A 104 65.348 44.704 53.776 1.00 0.00 H new ATOM 0 HG11 VAL A 104 66.686 46.645 53.060 1.00 0.00 H new ATOM 0 HG12 VAL A 104 66.210 45.557 51.734 1.00 0.00 H new ATOM 0 HG13 VAL A 104 65.366 47.108 51.960 1.00 0.00 H new ATOM 0 HG21 VAL A 104 65.362 46.960 54.977 1.00 0.00 H new ATOM 0 HG22 VAL A 104 63.858 47.372 54.119 1.00 0.00 H new ATOM 0 HG23 VAL A 104 63.879 46.025 55.282 1.00 0.00 H new ATOM 1578 N PRO A 105 61.327 45.865 52.131 1.00 0.00 N ATOM 1579 CA PRO A 105 60.403 46.883 51.662 1.00 0.00 C ATOM 1580 C PRO A 105 60.307 48.041 52.657 1.00 0.00 C ATOM 1581 O PRO A 105 60.491 47.865 53.868 1.00 0.00 O ATOM 1582 CB PRO A 105 59.062 46.180 51.467 1.00 0.00 C ATOM 1583 CG PRO A 105 59.106 45.056 52.504 1.00 0.00 C ATOM 1584 CD PRO A 105 60.593 44.724 52.661 1.00 0.00 C ATOM 0 HA PRO A 105 60.740 47.330 50.727 1.00 0.00 H new ATOM 0 HB2 PRO A 105 58.224 46.855 51.640 1.00 0.00 H new ATOM 0 HB3 PRO A 105 58.954 45.791 50.455 1.00 0.00 H new ATOM 0 HG2 PRO A 105 58.670 45.375 53.451 1.00 0.00 H new ATOM 0 HG3 PRO A 105 58.540 44.187 52.169 1.00 0.00 H new ATOM 0 HD2 PRO A 105 60.844 44.553 53.708 1.00 0.00 H new ATOM 0 HD3 PRO A 105 60.847 43.813 52.119 1.00 0.00 H new ATOM 1592 N LYS A 106 60.021 49.238 52.142 1.00 0.00 N ATOM 1593 CA LYS A 106 59.939 50.478 52.873 1.00 0.00 C ATOM 1594 C LYS A 106 58.766 50.545 53.853 1.00 0.00 C ATOM 1595 O LYS A 106 57.744 49.874 53.735 1.00 0.00 O ATOM 1596 CB LYS A 106 59.855 51.577 51.825 1.00 0.00 C ATOM 1597 CG LYS A 106 61.184 51.903 51.121 1.00 0.00 C ATOM 1598 CD LYS A 106 61.891 53.110 51.758 1.00 0.00 C ATOM 1599 CE LYS A 106 61.375 54.450 51.212 1.00 0.00 C ATOM 1600 NZ LYS A 106 61.966 55.599 51.938 1.00 0.00 N ATOM 0 H LYS A 106 59.832 49.362 51.147 1.00 0.00 H new ATOM 0 HA LYS A 106 60.817 50.585 53.510 1.00 0.00 H new ATOM 0 HB2 LYS A 106 59.123 51.285 51.072 1.00 0.00 H new ATOM 0 HB3 LYS A 106 59.480 52.484 52.300 1.00 0.00 H new ATOM 0 HG2 LYS A 106 61.840 51.034 51.165 1.00 0.00 H new ATOM 0 HG3 LYS A 106 60.996 52.108 50.067 1.00 0.00 H new ATOM 0 HD2 LYS A 106 61.748 53.082 52.838 1.00 0.00 H new ATOM 0 HD3 LYS A 106 62.963 53.036 51.577 1.00 0.00 H new ATOM 0 HE2 LYS A 106 61.614 54.527 50.151 1.00 0.00 H new ATOM 0 HE3 LYS A 106 60.289 54.484 51.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 62.238 56.337 51.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 61.268 55.984 52.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 62.808 55.283 52.461 1.00 0.00 H new ATOM 1614 N GLY A 107 58.904 51.511 54.749 1.00 0.00 N ATOM 1615 CA GLY A 107 57.897 52.007 55.662 1.00 0.00 C ATOM 1616 C GLY A 107 57.877 53.525 55.559 1.00 0.00 C ATOM 1617 O GLY A 107 57.158 54.067 54.719 1.00 0.00 O ATOM 0 H GLY A 107 59.791 52.002 54.861 1.00 0.00 H new ATOM 0 HA2 GLY A 107 56.919 51.595 55.412 1.00 0.00 H new ATOM 0 HA3 GLY A 107 58.122 51.697 56.683 1.00 0.00 H new ATOM 1621 N LYS A 108 58.745 54.204 56.319 1.00 0.00 N ATOM 1622 CA LYS A 108 59.085 55.607 56.151 1.00 0.00 C ATOM 1623 C LYS A 108 60.466 55.737 55.489 1.00 0.00 C ATOM 1624 O LYS A 108 60.576 56.135 54.331 1.00 0.00 O ATOM 1625 CB LYS A 108 59.002 56.259 57.530 1.00 0.00 C ATOM 1626 CG LYS A 108 57.625 56.824 57.927 1.00 0.00 C ATOM 1627 CD LYS A 108 56.601 55.710 58.205 1.00 0.00 C ATOM 1628 CE LYS A 108 55.299 56.260 58.776 1.00 0.00 C ATOM 1629 NZ LYS A 108 54.351 55.166 59.098 1.00 0.00 N ATOM 0 H LYS A 108 59.244 53.768 57.094 1.00 0.00 H new ATOM 0 HA LYS A 108 58.393 56.122 55.485 1.00 0.00 H new ATOM 0 HB2 LYS A 108 59.300 55.523 58.277 1.00 0.00 H new ATOM 0 HB3 LYS A 108 59.731 57.068 57.572 1.00 0.00 H new ATOM 0 HG2 LYS A 108 57.732 57.448 58.815 1.00 0.00 H new ATOM 0 HG3 LYS A 108 57.253 57.467 57.129 1.00 0.00 H new ATOM 0 HD2 LYS A 108 56.392 55.171 57.281 1.00 0.00 H new ATOM 0 HD3 LYS A 108 57.028 54.991 58.904 1.00 0.00 H new ATOM 0 HE2 LYS A 108 55.509 56.839 59.675 1.00 0.00 H new ATOM 0 HE3 LYS A 108 54.842 56.941 58.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 53.474 55.569 59.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 54.134 54.629 58.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 54.780 54.531 59.801 1.00 0.00 H new ATOM 1643 N GLU A 109 61.513 55.300 56.188 1.00 0.00 N ATOM 1644 CA GLU A 109 62.916 55.592 55.884 1.00 0.00 C ATOM 1645 C GLU A 109 63.618 54.471 55.092 1.00 0.00 C ATOM 1646 O GLU A 109 63.643 54.530 53.864 1.00 0.00 O ATOM 1647 CB GLU A 109 63.633 56.001 57.178 1.00 0.00 C ATOM 1648 CG GLU A 109 64.795 56.957 57.013 1.00 0.00 C ATOM 1649 CD GLU A 109 64.838 58.082 58.061 1.00 0.00 C ATOM 1650 OE1 GLU A 109 63.791 58.650 58.446 1.00 0.00 O ATOM 1651 OE2 GLU A 109 65.941 58.392 58.570 1.00 0.00 O ATOM 0 H GLU A 109 61.405 54.710 57.013 1.00 0.00 H new ATOM 0 HA GLU A 109 62.961 56.437 55.197 1.00 0.00 H new ATOM 0 HB2 GLU A 109 62.903 56.458 57.847 1.00 0.00 H new ATOM 0 HB3 GLU A 109 63.996 55.099 57.671 1.00 0.00 H new ATOM 0 HG2 GLU A 109 65.726 56.392 57.064 1.00 0.00 H new ATOM 0 HG3 GLU A 109 64.746 57.403 56.019 1.00 0.00 H new ATOM 1658 N ALA A 110 64.077 53.428 55.797 1.00 0.00 N ATOM 1659 CA ALA A 110 64.789 52.224 55.325 1.00 0.00 C ATOM 1660 C ALA A 110 66.125 52.425 54.557 1.00 0.00 C ATOM 1661 O ALA A 110 66.405 53.489 54.004 1.00 0.00 O ATOM 1662 CB ALA A 110 63.805 51.303 54.587 1.00 0.00 C ATOM 0 H ALA A 110 63.949 53.400 56.809 1.00 0.00 H new ATOM 0 HA ALA A 110 65.154 51.745 56.233 1.00 0.00 H new ATOM 0 HB1 ALA A 110 64.330 50.414 54.238 1.00 0.00 H new ATOM 0 HB2 ALA A 110 63.004 51.009 55.265 1.00 0.00 H new ATOM 0 HB3 ALA A 110 63.382 51.832 53.733 1.00 0.00 H new ATOM 1668 N ALA A 111 66.917 51.341 54.511 1.00 0.00 N ATOM 1669 CA ALA A 111 68.282 51.223 53.967 1.00 0.00 C ATOM 1670 C ALA A 111 69.348 52.093 54.667 1.00 0.00 C ATOM 1671 O ALA A 111 69.047 53.149 55.228 1.00 0.00 O ATOM 1672 CB ALA A 111 68.266 51.378 52.439 1.00 0.00 C ATOM 0 H ALA A 111 66.592 50.449 54.885 1.00 0.00 H new ATOM 0 HA ALA A 111 68.616 50.212 54.201 1.00 0.00 H new ATOM 0 HB1 ALA A 111 69.282 51.288 52.054 1.00 0.00 H new ATOM 0 HB2 ALA A 111 67.641 50.599 52.001 1.00 0.00 H new ATOM 0 HB3 ALA A 111 67.864 52.356 52.177 1.00 0.00 H new ATOM 1678 N ALA A 112 70.606 51.633 54.653 1.00 0.00 N ATOM 1679 CA ALA A 112 71.702 52.170 55.469 1.00 0.00 C ATOM 1680 C ALA A 112 71.285 52.326 56.944 1.00 0.00 C ATOM 1681 O ALA A 112 71.301 53.411 57.530 1.00 0.00 O ATOM 1682 CB ALA A 112 72.284 53.432 54.814 1.00 0.00 C ATOM 0 H ALA A 112 70.897 50.857 54.058 1.00 0.00 H new ATOM 0 HA ALA A 112 72.523 51.454 55.501 1.00 0.00 H new ATOM 0 HB1 ALA A 112 73.096 53.820 55.429 1.00 0.00 H new ATOM 0 HB2 ALA A 112 72.666 53.185 53.823 1.00 0.00 H new ATOM 0 HB3 ALA A 112 71.504 54.188 54.724 1.00 0.00 H new ATOM 1688 N SER A 113 70.826 51.214 57.519 1.00 0.00 N ATOM 1689 CA SER A 113 70.086 51.150 58.772 1.00 0.00 C ATOM 1690 C SER A 113 70.449 49.917 59.598 1.00 0.00 C ATOM 1691 O SER A 113 70.450 48.805 59.073 1.00 0.00 O ATOM 1692 CB SER A 113 68.577 51.168 58.486 1.00 0.00 C ATOM 1693 OG SER A 113 68.203 50.100 57.630 1.00 0.00 O ATOM 0 H SER A 113 70.968 50.294 57.102 1.00 0.00 H new ATOM 0 HA SER A 113 70.362 52.025 59.361 1.00 0.00 H new ATOM 0 HB2 SER A 113 68.026 51.096 59.424 1.00 0.00 H new ATOM 0 HB3 SER A 113 68.303 52.118 58.027 1.00 0.00 H new ATOM 0 HG SER A 113 68.844 49.365 57.725 1.00 0.00 H new ATOM 1699 N GLN A 114 70.703 50.109 60.895 1.00 0.00 N ATOM 1700 CA GLN A 114 71.017 49.044 61.842 1.00 0.00 C ATOM 1701 C GLN A 114 69.800 48.143 62.127 1.00 0.00 C ATOM 1702 O GLN A 114 68.657 48.572 61.970 1.00 0.00 O ATOM 1703 CB GLN A 114 71.612 49.680 63.098 1.00 0.00 C ATOM 1704 CG GLN A 114 73.111 49.400 63.276 1.00 0.00 C ATOM 1705 CD GLN A 114 73.935 49.989 62.134 1.00 0.00 C ATOM 1706 OE1 GLN A 114 74.171 49.358 61.116 1.00 0.00 O ATOM 1707 NE2 GLN A 114 74.361 51.228 62.212 1.00 0.00 N ATOM 0 H GLN A 114 70.695 51.035 61.323 1.00 0.00 H new ATOM 0 HA GLN A 114 71.757 48.369 61.412 1.00 0.00 H new ATOM 0 HB2 GLN A 114 71.454 50.758 63.059 1.00 0.00 H new ATOM 0 HB3 GLN A 114 71.075 49.310 63.972 1.00 0.00 H new ATOM 0 HG2 GLN A 114 73.450 49.820 64.223 1.00 0.00 H new ATOM 0 HG3 GLN A 114 73.277 48.324 63.327 1.00 0.00 H new ATOM 0 HE21 GLN A 114 74.178 51.778 63.051 1.00 0.00 H new ATOM 0 HE22 GLN A 114 74.875 51.640 61.434 1.00 0.00 H new ATOM 1716 N GLY A 115 70.045 46.893 62.537 1.00 0.00 N ATOM 1717 CA GLY A 115 69.012 45.854 62.616 1.00 0.00 C ATOM 1718 C GLY A 115 69.125 44.915 63.819 1.00 0.00 C ATOM 1719 O GLY A 115 69.700 45.264 64.852 1.00 0.00 O ATOM 0 H GLY A 115 70.970 46.573 62.825 1.00 0.00 H new ATOM 0 HA2 GLY A 115 68.035 46.336 62.642 1.00 0.00 H new ATOM 0 HA3 GLY A 115 69.049 45.257 61.705 1.00 0.00 H new ATOM 1723 N HIS A 116 68.512 43.737 63.668 1.00 0.00 N ATOM 1724 CA HIS A 116 68.424 42.637 64.634 1.00 0.00 C ATOM 1725 C HIS A 116 68.170 41.301 63.901 1.00 0.00 C ATOM 1726 O HIS A 116 67.771 41.294 62.731 1.00 0.00 O ATOM 1727 CB HIS A 116 67.316 42.940 65.659 1.00 0.00 C ATOM 1728 CG HIS A 116 65.972 43.314 65.071 1.00 0.00 C ATOM 1729 ND1 HIS A 116 65.478 44.593 64.942 1.00 0.00 N ATOM 1730 CD2 HIS A 116 65.016 42.469 64.570 1.00 0.00 C ATOM 1731 CE1 HIS A 116 64.276 44.527 64.350 1.00 0.00 C ATOM 1732 NE2 HIS A 116 63.929 43.246 64.136 1.00 0.00 N ATOM 0 H HIS A 116 68.027 43.510 62.800 1.00 0.00 H new ATOM 0 HA HIS A 116 69.369 42.543 65.170 1.00 0.00 H new ATOM 0 HB2 HIS A 116 67.184 42.065 66.296 1.00 0.00 H new ATOM 0 HB3 HIS A 116 67.652 43.754 66.302 1.00 0.00 H new ATOM 0 HD2 HIS A 116 65.086 41.393 64.518 1.00 0.00 H new ATOM 0 HE1 HIS A 116 63.673 45.382 64.083 1.00 0.00 H new ATOM 0 HE2 HIS A 116 63.053 42.907 63.739 1.00 0.00 H new ATOM 1740 N LEU A 117 68.376 40.164 64.577 1.00 0.00 N ATOM 1741 CA LEU A 117 68.093 38.824 64.035 1.00 0.00 C ATOM 1742 C LEU A 117 66.586 38.649 63.767 1.00 0.00 C ATOM 1743 O LEU A 117 65.769 38.918 64.650 1.00 0.00 O ATOM 1744 CB LEU A 117 68.589 37.739 65.016 1.00 0.00 C ATOM 1745 CG LEU A 117 70.068 37.818 65.435 1.00 0.00 C ATOM 1746 CD1 LEU A 117 70.406 36.653 66.367 1.00 0.00 C ATOM 1747 CD2 LEU A 117 71.026 37.779 64.246 1.00 0.00 C ATOM 0 H LEU A 117 68.748 40.146 65.527 1.00 0.00 H new ATOM 0 HA LEU A 117 68.624 38.717 63.089 1.00 0.00 H new ATOM 0 HB2 LEU A 117 67.976 37.787 65.916 1.00 0.00 H new ATOM 0 HB3 LEU A 117 68.414 36.763 64.563 1.00 0.00 H new ATOM 0 HG LEU A 117 70.197 38.776 65.939 1.00 0.00 H new ATOM 0 HD11 LEU A 117 71.454 36.714 66.660 1.00 0.00 H new ATOM 0 HD12 LEU A 117 69.777 36.704 67.256 1.00 0.00 H new ATOM 0 HD13 LEU A 117 70.228 35.710 65.850 1.00 0.00 H new ATOM 0 HD21 LEU A 117 72.054 37.838 64.605 1.00 0.00 H new ATOM 0 HD22 LEU A 117 70.886 36.848 63.697 1.00 0.00 H new ATOM 0 HD23 LEU A 117 70.823 38.623 63.587 1.00 0.00 H new ATOM 1759 N GLU A 118 66.192 38.182 62.578 1.00 0.00 N ATOM 1760 CA GLU A 118 64.777 38.035 62.194 1.00 0.00 C ATOM 1761 C GLU A 118 64.253 36.603 62.392 1.00 0.00 C ATOM 1762 O GLU A 118 64.974 35.623 62.200 1.00 0.00 O ATOM 1763 CB GLU A 118 64.475 38.645 60.821 1.00 0.00 C ATOM 1764 CG GLU A 118 65.032 37.855 59.644 1.00 0.00 C ATOM 1765 CD GLU A 118 66.543 38.032 59.477 1.00 0.00 C ATOM 1766 OE1 GLU A 118 66.958 38.992 58.784 1.00 0.00 O ATOM 1767 OE2 GLU A 118 67.331 37.237 60.040 1.00 0.00 O ATOM 0 H GLU A 118 66.845 37.893 61.849 1.00 0.00 H new ATOM 0 HA GLU A 118 64.194 38.634 62.894 1.00 0.00 H new ATOM 0 HB2 GLU A 118 63.395 38.732 60.706 1.00 0.00 H new ATOM 0 HB3 GLU A 118 64.881 39.656 60.789 1.00 0.00 H new ATOM 0 HG2 GLU A 118 64.807 36.797 59.782 1.00 0.00 H new ATOM 0 HG3 GLU A 118 64.530 38.171 58.729 1.00 0.00 H new ATOM 1774 N HIS A 119 63.003 36.478 62.844 1.00 0.00 N ATOM 1775 CA HIS A 119 62.463 35.236 63.398 1.00 0.00 C ATOM 1776 C HIS A 119 60.937 35.139 63.210 1.00 0.00 C ATOM 1777 O HIS A 119 60.218 36.138 63.282 1.00 0.00 O ATOM 1778 CB HIS A 119 62.903 35.108 64.867 1.00 0.00 C ATOM 1779 CG HIS A 119 62.761 36.365 65.694 1.00 0.00 C ATOM 1780 ND1 HIS A 119 63.683 37.389 65.802 1.00 0.00 N ATOM 1781 CD2 HIS A 119 61.687 36.715 66.466 1.00 0.00 C ATOM 1782 CE1 HIS A 119 63.172 38.332 66.606 1.00 0.00 C ATOM 1783 NE2 HIS A 119 61.971 37.950 67.063 1.00 0.00 N ATOM 0 H HIS A 119 62.331 37.245 62.835 1.00 0.00 H new ATOM 0 HA HIS A 119 62.869 34.386 62.849 1.00 0.00 H new ATOM 0 HB2 HIS A 119 62.320 34.316 65.336 1.00 0.00 H new ATOM 0 HB3 HIS A 119 63.946 34.793 64.891 1.00 0.00 H new ATOM 0 HD1 HIS A 119 64.596 37.422 65.348 1.00 0.00 H new ATOM 0 HD2 HIS A 119 60.781 36.141 66.593 1.00 0.00 H new ATOM 0 HE1 HIS A 119 63.658 39.265 66.850 1.00 0.00 H new ATOM 1791 N HIS A 120 60.456 33.919 62.931 1.00 0.00 N ATOM 1792 CA HIS A 120 59.146 33.687 62.301 1.00 0.00 C ATOM 1793 C HIS A 120 58.296 32.623 63.028 1.00 0.00 C ATOM 1794 O HIS A 120 57.219 32.930 63.546 1.00 0.00 O ATOM 1795 CB HIS A 120 59.338 33.332 60.818 1.00 0.00 C ATOM 1796 CG HIS A 120 60.222 34.263 60.015 1.00 0.00 C ATOM 1797 ND1 HIS A 120 59.810 35.143 59.038 1.00 0.00 N ATOM 1798 CD2 HIS A 120 61.591 34.332 60.050 1.00 0.00 C ATOM 1799 CE1 HIS A 120 60.898 35.745 58.531 1.00 0.00 C ATOM 1800 NE2 HIS A 120 62.010 35.287 59.123 1.00 0.00 N ATOM 0 H HIS A 120 60.967 33.060 63.137 1.00 0.00 H new ATOM 0 HA HIS A 120 58.581 34.616 62.381 1.00 0.00 H new ATOM 0 HB2 HIS A 120 59.756 32.327 60.758 1.00 0.00 H new ATOM 0 HB3 HIS A 120 58.357 33.298 60.344 1.00 0.00 H new ATOM 0 HD2 HIS A 120 62.236 33.746 60.688 1.00 0.00 H new ATOM 0 HE1 HIS A 120 60.880 36.495 57.754 1.00 0.00 H new ATOM 0 HE2 HIS A 120 62.969 35.578 58.934 1.00 0.00 H new ATOM 1808 N HIS A 121 58.766 31.368 63.032 1.00 0.00 N ATOM 1809 CA HIS A 121 58.027 30.170 63.456 1.00 0.00 C ATOM 1810 C HIS A 121 58.947 28.931 63.493 1.00 0.00 C ATOM 1811 O HIS A 121 59.913 28.860 62.732 1.00 0.00 O ATOM 1812 CB HIS A 121 56.875 29.911 62.460 1.00 0.00 C ATOM 1813 CG HIS A 121 57.254 30.058 60.998 1.00 0.00 C ATOM 1814 ND1 HIS A 121 58.370 29.537 60.380 1.00 0.00 N ATOM 1815 CD2 HIS A 121 56.598 30.814 60.063 1.00 0.00 C ATOM 1816 CE1 HIS A 121 58.384 29.964 59.106 1.00 0.00 C ATOM 1817 NE2 HIS A 121 57.323 30.754 58.867 1.00 0.00 N ATOM 0 H HIS A 121 59.714 31.150 62.726 1.00 0.00 H new ATOM 0 HA HIS A 121 57.637 30.341 64.459 1.00 0.00 H new ATOM 0 HB2 HIS A 121 56.493 28.903 62.622 1.00 0.00 H new ATOM 0 HB3 HIS A 121 56.060 30.601 62.681 1.00 0.00 H new ATOM 0 HD1 HIS A 121 59.066 28.931 60.815 1.00 0.00 H new ATOM 0 HD2 HIS A 121 55.681 31.361 60.221 1.00 0.00 H new ATOM 0 HE1 HIS A 121 59.140 29.709 58.378 1.00 0.00 H new ATOM 1825 N HIS A 122 58.601 27.928 64.304 1.00 0.00 N ATOM 1826 CA HIS A 122 59.132 26.551 64.258 1.00 0.00 C ATOM 1827 C HIS A 122 57.969 25.541 64.102 1.00 0.00 C ATOM 1828 O HIS A 122 56.818 25.906 64.339 1.00 0.00 O ATOM 1829 CB HIS A 122 59.983 26.278 65.516 1.00 0.00 C ATOM 1830 CG HIS A 122 61.469 26.494 65.327 1.00 0.00 C ATOM 1831 ND1 HIS A 122 62.432 25.515 65.400 1.00 0.00 N ATOM 1832 CD2 HIS A 122 62.123 27.675 65.089 1.00 0.00 C ATOM 1833 CE1 HIS A 122 63.632 26.080 65.191 1.00 0.00 C ATOM 1834 NE2 HIS A 122 63.500 27.408 65.016 1.00 0.00 N ATOM 0 H HIS A 122 57.913 28.053 65.046 1.00 0.00 H new ATOM 0 HA HIS A 122 59.782 26.431 63.391 1.00 0.00 H new ATOM 0 HB2 HIS A 122 59.634 26.923 66.322 1.00 0.00 H new ATOM 0 HB3 HIS A 122 59.816 25.250 65.836 1.00 0.00 H new ATOM 0 HD1 HIS A 122 62.263 24.526 65.582 1.00 0.00 H new ATOM 0 HD2 HIS A 122 61.659 28.644 64.977 1.00 0.00 H new ATOM 0 HE1 HIS A 122 64.570 25.545 65.167 1.00 0.00 H new ATOM 1842 N HIS A 123 58.233 24.289 63.703 1.00 0.00 N ATOM 1843 CA HIS A 123 57.184 23.277 63.456 1.00 0.00 C ATOM 1844 C HIS A 123 57.204 22.138 64.495 1.00 0.00 C ATOM 1845 O HIS A 123 56.518 22.233 65.515 1.00 0.00 O ATOM 1846 CB HIS A 123 57.236 22.811 61.988 1.00 0.00 C ATOM 1847 CG HIS A 123 56.012 22.042 61.549 1.00 0.00 C ATOM 1848 ND1 HIS A 123 54.855 22.596 61.050 1.00 0.00 N ATOM 1849 CD2 HIS A 123 55.837 20.682 61.529 1.00 0.00 C ATOM 1850 CE1 HIS A 123 54.006 21.605 60.745 1.00 0.00 C ATOM 1851 NE2 HIS A 123 54.565 20.414 61.004 1.00 0.00 N ATOM 0 H HIS A 123 59.179 23.944 63.541 1.00 0.00 H new ATOM 0 HA HIS A 123 56.207 23.738 63.600 1.00 0.00 H new ATOM 0 HB2 HIS A 123 57.357 23.682 61.344 1.00 0.00 H new ATOM 0 HB3 HIS A 123 58.117 22.185 61.846 1.00 0.00 H new ATOM 0 HD2 HIS A 123 56.554 19.946 61.860 1.00 0.00 H new ATOM 0 HE1 HIS A 123 53.012 21.746 60.347 1.00 0.00 H new ATOM 0 HE2 HIS A 123 54.148 19.496 60.850 1.00 0.00 H new ATOM 1859 N HIS A 124 58.043 21.118 64.269 1.00 0.00 N ATOM 1860 CA HIS A 124 58.195 19.902 65.088 1.00 0.00 C ATOM 1861 C HIS A 124 56.885 19.110 65.278 1.00 0.00 C ATOM 1862 O HIS A 124 56.614 18.622 66.399 1.00 0.00 O ATOM 1863 CB HIS A 124 58.941 20.237 66.394 1.00 0.00 C ATOM 1864 CG HIS A 124 60.207 21.033 66.191 1.00 0.00 C ATOM 1865 ND1 HIS A 124 61.406 20.553 65.721 1.00 0.00 N ATOM 1866 CD2 HIS A 124 60.376 22.369 66.431 1.00 0.00 C ATOM 1867 CE1 HIS A 124 62.282 21.571 65.680 1.00 0.00 C ATOM 1868 NE2 HIS A 124 61.701 22.703 66.111 1.00 0.00 N ATOM 1869 OXT HIS A 124 56.187 18.906 64.260 1.00 0.00 O ATOM 0 H HIS A 124 58.670 21.117 63.465 1.00 0.00 H new ATOM 0 HA HIS A 124 58.818 19.198 64.536 1.00 0.00 H new ATOM 0 HB2 HIS A 124 58.273 20.797 67.049 1.00 0.00 H new ATOM 0 HB3 HIS A 124 59.187 19.308 66.909 1.00 0.00 H new ATOM 0 HD1 HIS A 124 61.598 19.589 65.450 1.00 0.00 H new ATOM 0 HD2 HIS A 124 59.622 23.048 66.802 1.00 0.00 H new ATOM 0 HE1 HIS A 124 63.307 21.491 65.348 1.00 0.00 H new TER 1877 HIS A 124 HETATM 1878 ZN ZN A 125 76.531 37.367 50.608 1.00 0.00 ZN