USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1024 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 21 LYS NZ :NH3+ 148:sc= -0.0803 (180deg=0) USER MOD Set 1.2: A 23 ASN : amide:sc= -1.39 X(o=-1.5,f=-1.8!) USER MOD Single : A 8 LYS NZ :NH3+ 148:sc= -0.0527 (180deg=-0.352) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 129:sc= 0.00281 (180deg=-0.241) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 168:sc= -2.92! USER MOD Single : A 32 SER OG : rot -45:sc= -0.253 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.0498 USER MOD Single : A 35 ASN : amide:sc= -1.39 K(o=-1.4,f=-3.8!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 167:sc= 0.403 (180deg=0.313) USER MOD Single : A 42 TYR OH : rot -73:sc= 0.737 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0111) USER MOD Single : A 49 LYS NZ :NH3+ -150:sc= -1.46 (180deg=-2.15) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -70:sc= -0.0395 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0899 USER MOD Single : A 62 TYR OH : rot 130:sc= -2.62 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc=-0.00799 X(o=-0.008,f=0) USER MOD Single : A 79 TYR OH : rot -99:sc= 1.16 USER MOD Single : A 84 MET CE :methyl 148:sc= -1.43 (180deg=-5.24!) USER MOD Single : A 97 ASN : amide:sc= -5.9! C(o=-5.9!,f=-15!) USER MOD Single : A 100 TYR OH : rot -111:sc= 1.19 USER MOD Single : A 101 ASN : amide:sc= -0.0946 K(o=-0.095,f=-1) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0341 USER MOD Single : A 111 THR OG1 : rot 84:sc= 0.205 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.34) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0.0253 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc=-0.00598 X(o=-0.006,f=-0.36) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 8 5.307 -1.546 -26.601 1.00 0.00 N ATOM 2 CA LYS A 8 4.724 -2.786 -26.025 1.00 0.00 C ATOM 3 C LYS A 8 3.968 -2.491 -24.733 1.00 0.00 C ATOM 4 O LYS A 8 3.958 -1.358 -24.252 1.00 0.00 O ATOM 5 CB LYS A 8 5.857 -3.779 -25.762 1.00 0.00 C ATOM 6 CG LYS A 8 6.002 -4.836 -26.845 1.00 0.00 C ATOM 7 CD LYS A 8 7.306 -5.605 -26.704 1.00 0.00 C ATOM 8 CE LYS A 8 7.407 -6.722 -27.729 1.00 0.00 C ATOM 9 NZ LYS A 8 7.102 -6.243 -29.105 1.00 0.00 N ATOM 0 HA LYS A 8 4.010 -3.209 -26.732 1.00 0.00 H new ATOM 0 HB2 LYS A 8 6.795 -3.232 -25.672 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.682 -4.272 -24.806 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.162 -5.529 -26.793 1.00 0.00 H new ATOM 0 HG3 LYS A 8 5.963 -4.361 -27.825 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.147 -4.922 -26.824 1.00 0.00 H new ATOM 0 HD3 LYS A 8 7.376 -6.024 -25.700 1.00 0.00 H new ATOM 0 HE2 LYS A 8 8.411 -7.146 -27.706 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.717 -7.523 -27.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.661 -6.786 -29.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 6.089 -6.374 -29.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 7.342 -5.234 -29.183 1.00 0.00 H new ATOM 25 N MET A 9 3.338 -3.520 -24.174 1.00 0.00 N ATOM 26 CA MET A 9 2.580 -3.371 -22.937 1.00 0.00 C ATOM 27 C MET A 9 3.375 -3.897 -21.745 1.00 0.00 C ATOM 28 O MET A 9 4.439 -4.494 -21.911 1.00 0.00 O ATOM 29 CB MET A 9 1.245 -4.111 -23.041 1.00 0.00 C ATOM 30 CG MET A 9 0.245 -3.433 -23.962 1.00 0.00 C ATOM 31 SD MET A 9 -0.890 -2.346 -23.077 1.00 0.00 S ATOM 32 CE MET A 9 -2.135 -3.517 -22.544 1.00 0.00 C ATOM 0 H MET A 9 3.338 -4.465 -24.558 1.00 0.00 H new ATOM 0 HA MET A 9 2.388 -2.309 -22.783 1.00 0.00 H new ATOM 0 HB2 MET A 9 1.427 -5.124 -23.399 1.00 0.00 H new ATOM 0 HB3 MET A 9 0.809 -4.198 -22.046 1.00 0.00 H new ATOM 0 HG2 MET A 9 0.783 -2.855 -24.714 1.00 0.00 H new ATOM 0 HG3 MET A 9 -0.327 -4.194 -24.494 1.00 0.00 H new ATOM 0 HE1 MET A 9 -2.909 -2.995 -21.981 1.00 0.00 H new ATOM 0 HE2 MET A 9 -2.581 -3.996 -23.416 1.00 0.00 H new ATOM 0 HE3 MET A 9 -1.674 -4.275 -21.910 1.00 0.00 H new ATOM 42 N SER A 10 2.851 -3.671 -20.545 1.00 0.00 N ATOM 43 CA SER A 10 3.512 -4.122 -19.326 1.00 0.00 C ATOM 44 C SER A 10 2.523 -4.816 -18.394 1.00 0.00 C ATOM 45 O SER A 10 1.338 -4.482 -18.371 1.00 0.00 O ATOM 46 CB SER A 10 4.165 -2.941 -18.606 1.00 0.00 C ATOM 47 OG SER A 10 5.374 -3.330 -17.979 1.00 0.00 O ATOM 0 H SER A 10 1.971 -3.179 -20.391 1.00 0.00 H new ATOM 0 HA SER A 10 4.284 -4.839 -19.607 1.00 0.00 H new ATOM 0 HB2 SER A 10 4.363 -2.141 -19.319 1.00 0.00 H new ATOM 0 HB3 SER A 10 3.478 -2.541 -17.861 1.00 0.00 H new ATOM 0 HG SER A 10 5.772 -2.557 -17.528 1.00 0.00 H new ATOM 53 N GLU A 11 3.018 -5.782 -17.627 1.00 0.00 N ATOM 54 CA GLU A 11 2.177 -6.523 -16.694 1.00 0.00 C ATOM 55 C GLU A 11 1.867 -5.684 -15.458 1.00 0.00 C ATOM 56 O GLU A 11 2.773 -5.257 -14.741 1.00 0.00 O ATOM 57 CB GLU A 11 2.865 -7.826 -16.281 1.00 0.00 C ATOM 58 CG GLU A 11 2.911 -8.867 -17.387 1.00 0.00 C ATOM 59 CD GLU A 11 4.183 -8.789 -18.207 1.00 0.00 C ATOM 60 OE1 GLU A 11 5.260 -9.116 -17.666 1.00 0.00 O ATOM 61 OE2 GLU A 11 4.102 -8.402 -19.392 1.00 0.00 O ATOM 0 H GLU A 11 3.997 -6.070 -17.633 1.00 0.00 H new ATOM 0 HA GLU A 11 1.239 -6.758 -17.196 1.00 0.00 H new ATOM 0 HB2 GLU A 11 3.883 -7.604 -15.960 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.344 -8.245 -15.420 1.00 0.00 H new ATOM 0 HG2 GLU A 11 2.826 -9.861 -16.949 1.00 0.00 H new ATOM 0 HG3 GLU A 11 2.051 -8.733 -18.043 1.00 0.00 H new ATOM 68 N LYS A 12 0.581 -5.450 -15.214 1.00 0.00 N ATOM 69 CA LYS A 12 0.152 -4.659 -14.066 1.00 0.00 C ATOM 70 C LYS A 12 -0.847 -5.433 -13.211 1.00 0.00 C ATOM 71 O LYS A 12 -1.666 -6.191 -13.729 1.00 0.00 O ATOM 72 CB LYS A 12 -0.471 -3.343 -14.535 1.00 0.00 C ATOM 73 CG LYS A 12 -1.772 -3.523 -15.304 1.00 0.00 C ATOM 74 CD LYS A 12 -1.844 -2.594 -16.505 1.00 0.00 C ATOM 75 CE LYS A 12 -3.269 -2.135 -16.768 1.00 0.00 C ATOM 76 NZ LYS A 12 -3.593 -0.880 -16.036 1.00 0.00 N ATOM 0 H LYS A 12 -0.182 -5.797 -15.796 1.00 0.00 H new ATOM 0 HA LYS A 12 1.029 -4.443 -13.457 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -0.656 -2.709 -13.668 1.00 0.00 H new ATOM 0 HB3 LYS A 12 0.245 -2.817 -15.167 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.858 -4.557 -15.637 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -2.616 -3.330 -14.642 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.207 -1.726 -16.334 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -1.457 -3.106 -17.386 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -3.408 -1.977 -17.838 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -3.964 -2.919 -16.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.573 -0.601 -16.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -3.485 -1.037 -15.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.947 -0.124 -16.340 1.00 0.00 H new ATOM 90 N LEU A 13 -0.775 -5.234 -11.898 1.00 0.00 N ATOM 91 CA LEU A 13 -1.675 -5.910 -10.973 1.00 0.00 C ATOM 92 C LEU A 13 -2.990 -5.149 -10.845 1.00 0.00 C ATOM 93 O LEU A 13 -3.006 -3.919 -10.830 1.00 0.00 O ATOM 94 CB LEU A 13 -1.018 -6.050 -9.598 1.00 0.00 C ATOM 95 CG LEU A 13 -1.700 -7.042 -8.652 1.00 0.00 C ATOM 96 CD1 LEU A 13 -1.325 -8.470 -9.017 1.00 0.00 C ATOM 97 CD2 LEU A 13 -1.327 -6.742 -7.208 1.00 0.00 C ATOM 0 H LEU A 13 -0.102 -4.610 -11.452 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.885 -6.903 -11.369 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.018 -6.358 -9.737 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -0.998 -5.071 -9.120 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.780 -6.934 -8.757 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -1.819 -9.162 -8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.642 -8.680 -10.038 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -0.245 -8.593 -8.940 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.820 -7.456 -6.549 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.247 -6.823 -7.087 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.646 -5.732 -6.952 1.00 0.00 H new ATOM 109 N ARG A 14 -4.093 -5.886 -10.757 1.00 0.00 N ATOM 110 CA ARG A 14 -5.409 -5.273 -10.634 1.00 0.00 C ATOM 111 C ARG A 14 -5.615 -4.696 -9.239 1.00 0.00 C ATOM 112 O ARG A 14 -5.934 -5.419 -8.295 1.00 0.00 O ATOM 113 CB ARG A 14 -6.506 -6.291 -10.939 1.00 0.00 C ATOM 114 CG ARG A 14 -6.267 -7.083 -12.213 1.00 0.00 C ATOM 115 CD ARG A 14 -6.769 -6.335 -13.437 1.00 0.00 C ATOM 116 NE ARG A 14 -6.818 -7.191 -14.619 1.00 0.00 N ATOM 117 CZ ARG A 14 -7.792 -8.066 -14.861 1.00 0.00 C ATOM 118 NH1 ARG A 14 -8.797 -8.204 -14.004 1.00 0.00 N ATOM 119 NH2 ARG A 14 -7.761 -8.805 -15.961 1.00 0.00 N ATOM 0 H ARG A 14 -4.101 -6.906 -10.769 1.00 0.00 H new ATOM 0 HA ARG A 14 -5.466 -4.460 -11.358 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -6.590 -6.984 -10.101 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -7.460 -5.771 -11.019 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -5.202 -7.287 -12.321 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -6.770 -8.047 -12.143 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -7.764 -5.937 -13.236 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -6.118 -5.483 -13.633 1.00 0.00 H new ATOM 0 HE ARG A 14 -6.062 -7.114 -15.299 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -8.825 -7.638 -13.156 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -9.541 -8.876 -14.194 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -6.991 -8.703 -16.622 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -8.507 -9.475 -16.146 1.00 0.00 H new ATOM 133 N ILE A 15 -5.429 -3.389 -9.121 1.00 0.00 N ATOM 134 CA ILE A 15 -5.592 -2.703 -7.847 1.00 0.00 C ATOM 135 C ILE A 15 -6.260 -1.345 -8.042 1.00 0.00 C ATOM 136 O ILE A 15 -5.679 -0.436 -8.635 1.00 0.00 O ATOM 137 CB ILE A 15 -4.235 -2.508 -7.149 1.00 0.00 C ATOM 138 CG1 ILE A 15 -3.531 -3.855 -6.980 1.00 0.00 C ATOM 139 CG2 ILE A 15 -4.418 -1.827 -5.800 1.00 0.00 C ATOM 140 CD1 ILE A 15 -2.115 -3.736 -6.465 1.00 0.00 C ATOM 0 H ILE A 15 -5.164 -2.780 -9.895 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.228 -3.327 -7.219 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.613 -1.865 -7.772 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.108 -4.474 -6.293 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.518 -4.372 -7.940 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.447 -1.698 -5.323 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.883 -0.852 -5.945 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -5.056 -2.442 -5.165 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.678 -4.730 -6.370 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.523 -3.144 -7.163 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.122 -3.248 -5.490 1.00 0.00 H new ATOM 152 N LYS A 16 -7.482 -1.216 -7.539 1.00 0.00 N ATOM 153 CA LYS A 16 -8.229 0.031 -7.656 1.00 0.00 C ATOM 154 C LYS A 16 -8.720 0.496 -6.290 1.00 0.00 C ATOM 155 O LYS A 16 -9.382 -0.250 -5.571 1.00 0.00 O ATOM 156 CB LYS A 16 -9.416 -0.148 -8.604 1.00 0.00 C ATOM 157 CG LYS A 16 -9.023 -0.198 -10.072 1.00 0.00 C ATOM 158 CD LYS A 16 -9.391 1.089 -10.793 1.00 0.00 C ATOM 159 CE LYS A 16 -8.190 2.012 -10.933 1.00 0.00 C ATOM 160 NZ LYS A 16 -8.128 3.015 -9.834 1.00 0.00 N ATOM 0 H LYS A 16 -7.977 -1.959 -7.046 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.562 0.791 -8.062 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.940 -1.068 -8.346 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.118 0.672 -8.452 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.950 -0.369 -10.157 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.519 -1.041 -10.554 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -9.787 0.853 -11.781 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.183 1.601 -10.245 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.275 1.419 -10.935 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -8.238 2.527 -11.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.180 3.003 -9.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.323 3.962 -10.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -8.837 2.781 -9.110 1.00 0.00 H new ATOM 174 N VAL A 17 -8.387 1.732 -5.935 1.00 0.00 N ATOM 175 CA VAL A 17 -8.795 2.289 -4.651 1.00 0.00 C ATOM 176 C VAL A 17 -9.754 3.458 -4.840 1.00 0.00 C ATOM 177 O VAL A 17 -9.336 4.575 -5.147 1.00 0.00 O ATOM 178 CB VAL A 17 -7.584 2.763 -3.820 1.00 0.00 C ATOM 179 CG1 VAL A 17 -7.907 2.710 -2.337 1.00 0.00 C ATOM 180 CG2 VAL A 17 -6.350 1.926 -4.130 1.00 0.00 C ATOM 0 H VAL A 17 -7.838 2.365 -6.516 1.00 0.00 H new ATOM 0 HA VAL A 17 -9.299 1.487 -4.111 1.00 0.00 H new ATOM 0 HB VAL A 17 -7.367 3.796 -4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.043 3.047 -1.764 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.758 3.358 -2.126 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.152 1.686 -2.054 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -5.511 2.280 -3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.550 0.881 -3.892 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.105 2.017 -5.188 1.00 0.00 H new ATOM 190 N ASP A 18 -11.043 3.195 -4.653 1.00 0.00 N ATOM 191 CA ASP A 18 -12.064 4.226 -4.802 1.00 0.00 C ATOM 192 C ASP A 18 -12.962 4.286 -3.569 1.00 0.00 C ATOM 193 O ASP A 18 -14.111 4.720 -3.649 1.00 0.00 O ATOM 194 CB ASP A 18 -12.908 3.961 -6.049 1.00 0.00 C ATOM 195 CG ASP A 18 -13.275 5.237 -6.781 1.00 0.00 C ATOM 196 OD1 ASP A 18 -12.500 6.214 -6.696 1.00 0.00 O ATOM 197 OD2 ASP A 18 -14.336 5.262 -7.437 1.00 0.00 O ATOM 0 H ASP A 18 -11.406 2.276 -4.398 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.561 5.187 -4.910 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -12.359 3.304 -6.723 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.819 3.435 -5.763 1.00 0.00 H new ATOM 202 N ASP A 19 -12.432 3.848 -2.431 1.00 0.00 N ATOM 203 CA ASP A 19 -13.188 3.855 -1.184 1.00 0.00 C ATOM 204 C ASP A 19 -12.377 4.491 -0.061 1.00 0.00 C ATOM 205 O ASP A 19 -11.196 4.193 0.112 1.00 0.00 O ATOM 206 CB ASP A 19 -13.586 2.430 -0.798 1.00 0.00 C ATOM 207 CG ASP A 19 -14.949 2.044 -1.340 1.00 0.00 C ATOM 208 OD1 ASP A 19 -15.131 2.090 -2.575 1.00 0.00 O ATOM 209 OD2 ASP A 19 -15.834 1.698 -0.530 1.00 0.00 O ATOM 0 H ASP A 19 -11.483 3.484 -2.347 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.090 4.448 -1.337 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -12.838 1.732 -1.174 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -13.591 2.338 0.288 1.00 0.00 H new ATOM 214 N VAL A 20 -13.018 5.372 0.700 1.00 0.00 N ATOM 215 CA VAL A 20 -12.355 6.052 1.806 1.00 0.00 C ATOM 216 C VAL A 20 -13.348 6.414 2.904 1.00 0.00 C ATOM 217 O VAL A 20 -14.236 7.242 2.702 1.00 0.00 O ATOM 218 CB VAL A 20 -11.640 7.330 1.333 1.00 0.00 C ATOM 219 CG1 VAL A 20 -10.790 7.913 2.452 1.00 0.00 C ATOM 220 CG2 VAL A 20 -10.792 7.045 0.102 1.00 0.00 C ATOM 0 H VAL A 20 -13.996 5.632 0.571 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.615 5.358 2.205 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.396 8.067 1.061 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.292 8.816 2.098 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -11.426 8.159 3.302 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -10.041 7.183 2.758 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.295 7.961 -0.217 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -10.043 6.290 0.343 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.430 6.679 -0.703 1.00 0.00 H new ATOM 230 N LYS A 21 -13.190 5.792 4.067 1.00 0.00 N ATOM 231 CA LYS A 21 -14.073 6.054 5.197 1.00 0.00 C ATOM 232 C LYS A 21 -13.459 7.089 6.134 1.00 0.00 C ATOM 233 O LYS A 21 -12.540 6.784 6.896 1.00 0.00 O ATOM 234 CB LYS A 21 -14.359 4.760 5.962 1.00 0.00 C ATOM 235 CG LYS A 21 -15.759 4.699 6.551 1.00 0.00 C ATOM 236 CD LYS A 21 -16.016 3.370 7.244 1.00 0.00 C ATOM 237 CE LYS A 21 -16.840 3.552 8.509 1.00 0.00 C ATOM 238 NZ LYS A 21 -15.991 3.547 9.733 1.00 0.00 N ATOM 0 H LYS A 21 -12.460 5.104 4.252 1.00 0.00 H new ATOM 0 HA LYS A 21 -15.012 6.450 4.809 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -14.219 3.912 5.291 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.631 4.654 6.766 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -15.891 5.513 7.264 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.494 4.846 5.760 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -16.537 2.698 6.562 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -15.065 2.898 7.492 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -17.389 4.492 8.452 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -17.580 2.755 8.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -16.414 4.169 10.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -15.928 2.579 10.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -15.038 3.889 9.496 1.00 0.00 H new ATOM 252 N ILE A 22 -13.970 8.313 6.070 1.00 0.00 N ATOM 253 CA ILE A 22 -13.472 9.395 6.908 1.00 0.00 C ATOM 254 C ILE A 22 -13.921 9.224 8.355 1.00 0.00 C ATOM 255 O ILE A 22 -15.045 9.579 8.712 1.00 0.00 O ATOM 256 CB ILE A 22 -13.949 10.767 6.395 1.00 0.00 C ATOM 257 CG1 ILE A 22 -13.743 10.877 4.883 1.00 0.00 C ATOM 258 CG2 ILE A 22 -13.212 11.882 7.117 1.00 0.00 C ATOM 259 CD1 ILE A 22 -12.301 10.713 4.456 1.00 0.00 C ATOM 0 H ILE A 22 -14.730 8.580 5.445 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.384 9.354 6.861 1.00 0.00 H new ATOM 0 HB ILE A 22 -15.015 10.864 6.601 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -14.349 10.120 4.386 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -14.105 11.848 4.545 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.558 12.847 6.746 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -13.407 11.814 8.187 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -12.141 11.787 6.937 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.230 10.803 3.372 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.693 11.486 4.925 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.940 9.732 4.763 1.00 0.00 H new ATOM 271 N ASN A 23 -13.037 8.680 9.185 1.00 0.00 N ATOM 272 CA ASN A 23 -13.346 8.466 10.594 1.00 0.00 C ATOM 273 C ASN A 23 -12.825 9.622 11.445 1.00 0.00 C ATOM 274 O ASN A 23 -11.775 10.196 11.152 1.00 0.00 O ATOM 275 CB ASN A 23 -12.741 7.145 11.078 1.00 0.00 C ATOM 276 CG ASN A 23 -13.676 6.384 11.997 1.00 0.00 C ATOM 277 OD1 ASN A 23 -13.558 6.456 13.220 1.00 0.00 O ATOM 278 ND2 ASN A 23 -14.613 5.648 11.411 1.00 0.00 N ATOM 0 H ASN A 23 -12.103 8.380 8.907 1.00 0.00 H new ATOM 0 HA ASN A 23 -14.430 8.419 10.700 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -12.497 6.523 10.217 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.806 7.347 11.601 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -15.271 5.114 11.978 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -14.675 5.617 10.393 1.00 0.00 H new ATOM 285 N PRO A 24 -13.557 9.986 12.513 1.00 0.00 N ATOM 286 CA PRO A 24 -13.164 11.085 13.405 1.00 0.00 C ATOM 287 C PRO A 24 -11.764 10.904 13.986 1.00 0.00 C ATOM 288 O PRO A 24 -11.147 11.864 14.447 1.00 0.00 O ATOM 289 CB PRO A 24 -14.211 11.035 14.522 1.00 0.00 C ATOM 290 CG PRO A 24 -15.386 10.351 13.915 1.00 0.00 C ATOM 291 CD PRO A 24 -14.824 9.361 12.935 1.00 0.00 C ATOM 0 HA PRO A 24 -13.128 12.036 12.874 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -13.839 10.488 15.388 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -14.471 12.036 14.865 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -15.983 9.850 14.677 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -16.040 11.066 13.416 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -14.659 8.387 13.396 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -15.496 9.204 12.091 1.00 0.00 H new ATOM 299 N LYS A 25 -11.268 9.669 13.972 1.00 0.00 N ATOM 300 CA LYS A 25 -9.947 9.376 14.506 1.00 0.00 C ATOM 301 C LYS A 25 -8.920 9.242 13.379 1.00 0.00 C ATOM 302 O LYS A 25 -7.740 9.539 13.567 1.00 0.00 O ATOM 303 CB LYS A 25 -10.017 8.100 15.361 1.00 0.00 C ATOM 304 CG LYS A 25 -8.778 7.223 15.299 1.00 0.00 C ATOM 305 CD LYS A 25 -7.588 7.882 15.976 1.00 0.00 C ATOM 306 CE LYS A 25 -6.822 6.894 16.843 1.00 0.00 C ATOM 307 NZ LYS A 25 -5.588 6.403 16.168 1.00 0.00 N ATOM 0 H LYS A 25 -11.762 8.859 13.597 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.621 10.202 15.138 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.192 8.384 16.399 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.877 7.512 15.042 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.985 6.266 15.778 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.533 7.012 14.258 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.922 8.297 15.220 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -7.932 8.715 16.589 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -6.555 7.370 17.786 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.465 6.048 17.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.095 5.732 16.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.844 5.926 15.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.962 7.207 15.961 1.00 0.00 H new ATOM 321 N TYR A 26 -9.374 8.802 12.207 1.00 0.00 N ATOM 322 CA TYR A 26 -8.488 8.641 11.056 1.00 0.00 C ATOM 323 C TYR A 26 -9.276 8.331 9.787 1.00 0.00 C ATOM 324 O TYR A 26 -10.436 7.923 9.844 1.00 0.00 O ATOM 325 CB TYR A 26 -7.452 7.538 11.309 1.00 0.00 C ATOM 326 CG TYR A 26 -7.982 6.332 12.057 1.00 0.00 C ATOM 327 CD1 TYR A 26 -9.325 5.974 11.995 1.00 0.00 C ATOM 328 CD2 TYR A 26 -7.132 5.548 12.828 1.00 0.00 C ATOM 329 CE1 TYR A 26 -9.802 4.871 12.679 1.00 0.00 C ATOM 330 CE2 TYR A 26 -7.602 4.444 13.514 1.00 0.00 C ATOM 331 CZ TYR A 26 -8.938 4.110 13.436 1.00 0.00 C ATOM 332 OH TYR A 26 -9.410 3.012 14.118 1.00 0.00 O ATOM 0 H TYR A 26 -10.347 8.551 12.030 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.966 9.588 10.915 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -7.052 7.207 10.351 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.621 7.962 11.872 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -10.006 6.567 11.403 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -6.085 5.806 12.892 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -10.848 4.607 12.620 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.927 3.846 14.108 1.00 0.00 H new ATOM 0 HH TYR A 26 -8.672 2.585 14.602 1.00 0.00 H new ATOM 342 N VAL A 27 -8.636 8.532 8.640 1.00 0.00 N ATOM 343 CA VAL A 27 -9.272 8.273 7.353 1.00 0.00 C ATOM 344 C VAL A 27 -8.797 6.947 6.768 1.00 0.00 C ATOM 345 O VAL A 27 -7.609 6.765 6.502 1.00 0.00 O ATOM 346 CB VAL A 27 -8.981 9.402 6.347 1.00 0.00 C ATOM 347 CG1 VAL A 27 -9.778 9.200 5.067 1.00 0.00 C ATOM 348 CG2 VAL A 27 -9.285 10.759 6.966 1.00 0.00 C ATOM 0 H VAL A 27 -7.677 8.874 8.575 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.346 8.226 7.530 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.921 9.372 6.093 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.558 10.008 4.370 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.505 8.247 4.615 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.843 9.200 5.298 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -9.074 11.545 6.241 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -10.336 10.802 7.251 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.663 10.903 7.850 1.00 0.00 H new ATOM 358 N LEU A 28 -9.732 6.022 6.575 1.00 0.00 N ATOM 359 CA LEU A 28 -9.407 4.709 6.025 1.00 0.00 C ATOM 360 C LEU A 28 -9.503 4.712 4.503 1.00 0.00 C ATOM 361 O LEU A 28 -10.159 5.569 3.913 1.00 0.00 O ATOM 362 CB LEU A 28 -10.343 3.646 6.604 1.00 0.00 C ATOM 363 CG LEU A 28 -10.322 3.525 8.129 1.00 0.00 C ATOM 364 CD1 LEU A 28 -11.213 2.381 8.586 1.00 0.00 C ATOM 365 CD2 LEU A 28 -8.898 3.326 8.627 1.00 0.00 C ATOM 0 H LEU A 28 -10.720 6.156 6.791 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.380 4.473 6.303 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -11.362 3.869 6.287 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.080 2.679 6.175 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.709 4.451 8.554 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.185 2.310 9.673 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.237 2.565 8.260 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.856 1.447 8.153 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.901 3.242 9.714 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.485 2.415 8.194 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.287 4.178 8.331 1.00 0.00 H new ATOM 377 N TYR A 29 -8.843 3.743 3.876 1.00 0.00 N ATOM 378 CA TYR A 29 -8.853 3.629 2.422 1.00 0.00 C ATOM 379 C TYR A 29 -9.165 2.200 1.992 1.00 0.00 C ATOM 380 O TYR A 29 -8.470 1.260 2.376 1.00 0.00 O ATOM 381 CB TYR A 29 -7.504 4.062 1.847 1.00 0.00 C ATOM 382 CG TYR A 29 -7.348 5.561 1.737 1.00 0.00 C ATOM 383 CD1 TYR A 29 -6.887 6.311 2.812 1.00 0.00 C ATOM 384 CD2 TYR A 29 -7.661 6.226 0.559 1.00 0.00 C ATOM 385 CE1 TYR A 29 -6.742 7.681 2.716 1.00 0.00 C ATOM 386 CE2 TYR A 29 -7.518 7.597 0.454 1.00 0.00 C ATOM 387 CZ TYR A 29 -7.059 8.320 1.535 1.00 0.00 C ATOM 388 OH TYR A 29 -6.917 9.684 1.435 1.00 0.00 O ATOM 0 H TYR A 29 -8.295 3.026 4.352 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.633 4.285 2.036 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.706 3.667 2.476 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -7.380 3.618 0.859 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.638 5.814 3.738 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -8.022 5.663 -0.289 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.382 8.249 3.561 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.764 8.099 -0.470 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.991 9.953 0.495 1.00 0.00 H new ATOM 398 N GLY A 30 -10.213 2.044 1.190 1.00 0.00 N ATOM 399 CA GLY A 30 -10.598 0.727 0.721 1.00 0.00 C ATOM 400 C GLY A 30 -9.904 0.346 -0.570 1.00 0.00 C ATOM 401 O GLY A 30 -10.241 0.859 -1.638 1.00 0.00 O ATOM 0 H GLY A 30 -10.802 2.807 0.857 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.363 -0.011 1.488 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.677 0.699 0.572 1.00 0.00 H new ATOM 405 N VAL A 31 -8.934 -0.558 -0.475 1.00 0.00 N ATOM 406 CA VAL A 31 -8.190 -1.006 -1.646 1.00 0.00 C ATOM 407 C VAL A 31 -8.898 -2.170 -2.328 1.00 0.00 C ATOM 408 O VAL A 31 -9.038 -3.249 -1.753 1.00 0.00 O ATOM 409 CB VAL A 31 -6.756 -1.435 -1.275 1.00 0.00 C ATOM 410 CG1 VAL A 31 -5.947 -1.739 -2.526 1.00 0.00 C ATOM 411 CG2 VAL A 31 -6.075 -0.361 -0.439 1.00 0.00 C ATOM 0 H VAL A 31 -8.645 -0.994 0.401 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.138 -0.160 -2.332 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.814 -2.345 -0.678 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.938 -2.040 -2.243 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -6.424 -2.547 -3.081 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.898 -0.849 -3.153 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.064 -0.682 -0.187 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.030 0.568 -1.007 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.643 -0.198 0.477 1.00 0.00 H new ATOM 421 N SER A 32 -9.349 -1.940 -3.557 1.00 0.00 N ATOM 422 CA SER A 32 -10.051 -2.969 -4.317 1.00 0.00 C ATOM 423 C SER A 32 -9.081 -3.790 -5.164 1.00 0.00 C ATOM 424 O SER A 32 -8.399 -3.260 -6.040 1.00 0.00 O ATOM 425 CB SER A 32 -11.124 -2.334 -5.207 1.00 0.00 C ATOM 426 OG SER A 32 -10.652 -2.138 -6.529 1.00 0.00 O ATOM 0 H SER A 32 -9.241 -1.052 -4.047 1.00 0.00 H new ATOM 0 HA SER A 32 -10.531 -3.642 -3.607 1.00 0.00 H new ATOM 0 HB2 SER A 32 -12.007 -2.972 -5.226 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.431 -1.378 -4.783 1.00 0.00 H new ATOM 0 HG SER A 32 -9.752 -1.751 -6.501 1.00 0.00 H new ATOM 432 N THR A 33 -9.032 -5.091 -4.893 1.00 0.00 N ATOM 433 CA THR A 33 -8.154 -6.001 -5.624 1.00 0.00 C ATOM 434 C THR A 33 -8.737 -7.415 -5.609 1.00 0.00 C ATOM 435 O THR A 33 -9.761 -7.658 -4.972 1.00 0.00 O ATOM 436 CB THR A 33 -6.748 -6.002 -5.009 1.00 0.00 C ATOM 437 OG1 THR A 33 -6.675 -6.902 -3.918 1.00 0.00 O ATOM 438 CG2 THR A 33 -6.302 -4.644 -4.511 1.00 0.00 C ATOM 0 H THR A 33 -9.593 -5.541 -4.169 1.00 0.00 H new ATOM 0 HA THR A 33 -8.079 -5.659 -6.656 1.00 0.00 H new ATOM 0 HB THR A 33 -6.086 -6.306 -5.820 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.770 -6.888 -3.542 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.300 -4.722 -4.090 1.00 0.00 H new ATOM 0 HG22 THR A 33 -6.293 -3.937 -5.341 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.992 -4.293 -3.743 1.00 0.00 H new ATOM 446 N PRO A 34 -8.101 -8.373 -6.308 1.00 0.00 N ATOM 447 CA PRO A 34 -8.581 -9.758 -6.354 1.00 0.00 C ATOM 448 C PRO A 34 -8.838 -10.324 -4.959 1.00 0.00 C ATOM 449 O PRO A 34 -9.657 -11.226 -4.783 1.00 0.00 O ATOM 450 CB PRO A 34 -7.436 -10.507 -7.039 1.00 0.00 C ATOM 451 CG PRO A 34 -6.766 -9.475 -7.876 1.00 0.00 C ATOM 452 CD PRO A 34 -6.873 -8.189 -7.105 1.00 0.00 C ATOM 0 HA PRO A 34 -9.534 -9.847 -6.876 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.748 -10.934 -6.309 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -7.808 -11.331 -7.647 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -5.724 -9.736 -8.058 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.248 -9.388 -8.850 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.002 -8.027 -6.470 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.949 -7.327 -7.768 1.00 0.00 H new ATOM 460 N ASN A 35 -8.133 -9.780 -3.971 1.00 0.00 N ATOM 461 CA ASN A 35 -8.280 -10.217 -2.585 1.00 0.00 C ATOM 462 C ASN A 35 -9.527 -9.611 -1.943 1.00 0.00 C ATOM 463 O ASN A 35 -9.907 -9.994 -0.837 1.00 0.00 O ATOM 464 CB ASN A 35 -7.049 -9.811 -1.781 1.00 0.00 C ATOM 465 CG ASN A 35 -6.842 -10.681 -0.557 1.00 0.00 C ATOM 466 OD1 ASN A 35 -5.920 -11.495 -0.509 1.00 0.00 O ATOM 467 ND2 ASN A 35 -7.701 -10.513 0.442 1.00 0.00 N ATOM 0 H ASN A 35 -7.452 -9.033 -4.105 1.00 0.00 H new ATOM 0 HA ASN A 35 -8.383 -11.302 -2.583 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -6.167 -9.871 -2.418 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -7.148 -8.771 -1.471 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.611 -11.070 1.291 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -8.451 -9.826 0.360 1.00 0.00 H new ATOM 474 N LYS A 36 -10.138 -8.654 -2.648 1.00 0.00 N ATOM 475 CA LYS A 36 -11.341 -7.945 -2.191 1.00 0.00 C ATOM 476 C LYS A 36 -10.966 -6.585 -1.610 1.00 0.00 C ATOM 477 O LYS A 36 -9.839 -6.120 -1.785 1.00 0.00 O ATOM 478 CB LYS A 36 -12.147 -8.762 -1.168 1.00 0.00 C ATOM 479 CG LYS A 36 -12.580 -10.128 -1.680 1.00 0.00 C ATOM 480 CD LYS A 36 -13.598 -10.776 -0.752 1.00 0.00 C ATOM 481 CE LYS A 36 -14.970 -10.865 -1.403 1.00 0.00 C ATOM 482 NZ LYS A 36 -15.557 -9.519 -1.648 1.00 0.00 N ATOM 0 H LYS A 36 -9.809 -8.345 -3.563 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.981 -7.800 -3.061 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -11.546 -8.895 -0.268 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -13.032 -8.195 -0.880 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -13.009 -10.025 -2.677 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.708 -10.775 -1.774 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.258 -11.775 -0.479 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.669 -10.200 0.171 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.889 -11.403 -2.347 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.638 -11.442 -0.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -16.491 -9.623 -2.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -15.658 -9.015 -0.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -14.932 -8.977 -2.279 1.00 0.00 H new ATOM 496 N ARG A 37 -11.910 -5.943 -0.930 1.00 0.00 N ATOM 497 CA ARG A 37 -11.661 -4.631 -0.344 1.00 0.00 C ATOM 498 C ARG A 37 -10.913 -4.751 0.979 1.00 0.00 C ATOM 499 O ARG A 37 -11.312 -5.506 1.867 1.00 0.00 O ATOM 500 CB ARG A 37 -12.978 -3.882 -0.134 1.00 0.00 C ATOM 501 CG ARG A 37 -12.906 -2.410 -0.512 1.00 0.00 C ATOM 502 CD ARG A 37 -14.029 -2.019 -1.459 1.00 0.00 C ATOM 503 NE ARG A 37 -15.294 -1.822 -0.755 1.00 0.00 N ATOM 504 CZ ARG A 37 -16.323 -1.145 -1.257 1.00 0.00 C ATOM 505 NH1 ARG A 37 -16.245 -0.600 -2.464 1.00 0.00 N ATOM 506 NH2 ARG A 37 -17.438 -1.013 -0.549 1.00 0.00 N ATOM 0 H ARG A 37 -12.849 -6.307 -0.772 1.00 0.00 H new ATOM 0 HA ARG A 37 -11.038 -4.068 -1.039 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.758 -4.363 -0.724 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -13.272 -3.966 0.912 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -12.960 -1.799 0.389 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.945 -2.201 -0.981 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.759 -1.102 -1.983 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.152 -2.794 -2.216 1.00 0.00 H new ATOM 0 HE ARG A 37 -15.394 -2.227 0.176 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.392 -0.699 -3.014 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -17.038 -0.082 -2.842 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.505 -1.431 0.379 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -18.228 -0.494 -0.933 1.00 0.00 H new ATOM 520 N LEU A 38 -9.824 -3.999 1.098 1.00 0.00 N ATOM 521 CA LEU A 38 -9.009 -4.010 2.304 1.00 0.00 C ATOM 522 C LEU A 38 -8.793 -2.591 2.821 1.00 0.00 C ATOM 523 O LEU A 38 -8.177 -1.764 2.151 1.00 0.00 O ATOM 524 CB LEU A 38 -7.661 -4.676 2.019 1.00 0.00 C ATOM 525 CG LEU A 38 -7.507 -6.089 2.584 1.00 0.00 C ATOM 526 CD1 LEU A 38 -6.764 -6.982 1.602 1.00 0.00 C ATOM 527 CD2 LEU A 38 -6.785 -6.047 3.920 1.00 0.00 C ATOM 0 H LEU A 38 -9.485 -3.371 0.369 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.534 -4.580 3.071 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.512 -4.714 0.940 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.869 -4.049 2.428 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.501 -6.509 2.740 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.665 -7.983 2.023 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.320 -7.036 0.666 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.773 -6.569 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.683 -7.060 4.310 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.796 -5.608 3.786 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.357 -5.443 4.624 1.00 0.00 H new ATOM 539 N TYR A 39 -9.309 -2.315 4.015 1.00 0.00 N ATOM 540 CA TYR A 39 -9.173 -0.994 4.616 1.00 0.00 C ATOM 541 C TYR A 39 -7.854 -0.871 5.374 1.00 0.00 C ATOM 542 O TYR A 39 -7.522 -1.717 6.204 1.00 0.00 O ATOM 543 CB TYR A 39 -10.344 -0.716 5.560 1.00 0.00 C ATOM 544 CG TYR A 39 -11.696 -0.781 4.885 1.00 0.00 C ATOM 545 CD1 TYR A 39 -12.163 0.281 4.121 1.00 0.00 C ATOM 546 CD2 TYR A 39 -12.503 -1.905 5.009 1.00 0.00 C ATOM 547 CE1 TYR A 39 -13.397 0.227 3.501 1.00 0.00 C ATOM 548 CE2 TYR A 39 -13.738 -1.967 4.392 1.00 0.00 C ATOM 549 CZ TYR A 39 -14.181 -0.900 3.640 1.00 0.00 C ATOM 550 OH TYR A 39 -15.410 -0.957 3.025 1.00 0.00 O ATOM 0 H TYR A 39 -9.824 -2.987 4.584 1.00 0.00 H new ATOM 0 HA TYR A 39 -9.179 -0.257 3.813 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.320 -1.437 6.377 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -10.216 0.272 6.003 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -11.551 1.164 4.010 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -12.160 -2.744 5.597 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.746 1.062 2.911 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -14.354 -2.848 4.499 1.00 0.00 H new ATOM 0 HH TYR A 39 -15.834 -1.818 3.221 1.00 0.00 H new ATOM 560 N LYS A 40 -7.107 0.188 5.081 1.00 0.00 N ATOM 561 CA LYS A 40 -5.825 0.425 5.735 1.00 0.00 C ATOM 562 C LYS A 40 -5.639 1.907 6.042 1.00 0.00 C ATOM 563 O LYS A 40 -6.460 2.740 5.656 1.00 0.00 O ATOM 564 CB LYS A 40 -4.680 -0.073 4.852 1.00 0.00 C ATOM 565 CG LYS A 40 -4.299 -1.522 5.109 1.00 0.00 C ATOM 566 CD LYS A 40 -3.412 -1.656 6.337 1.00 0.00 C ATOM 567 CE LYS A 40 -3.385 -3.086 6.853 1.00 0.00 C ATOM 568 NZ LYS A 40 -3.331 -3.139 8.340 1.00 0.00 N ATOM 0 H LYS A 40 -7.367 0.896 4.395 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.816 -0.127 6.675 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.964 0.039 3.806 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.806 0.558 5.014 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -5.202 -2.118 5.244 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -3.780 -1.923 4.238 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -2.399 -1.338 6.091 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -3.773 -0.992 7.122 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -4.271 -3.615 6.503 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -2.520 -3.605 6.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -3.534 -4.107 8.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -2.383 -2.859 8.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.038 -2.487 8.737 1.00 0.00 H new ATOM 582 N ARG A 41 -4.556 2.231 6.740 1.00 0.00 N ATOM 583 CA ARG A 41 -4.262 3.614 7.100 1.00 0.00 C ATOM 584 C ARG A 41 -3.048 4.132 6.335 1.00 0.00 C ATOM 585 O ARG A 41 -2.202 3.355 5.894 1.00 0.00 O ATOM 586 CB ARG A 41 -4.018 3.730 8.605 1.00 0.00 C ATOM 587 CG ARG A 41 -4.435 5.072 9.187 1.00 0.00 C ATOM 588 CD ARG A 41 -4.391 5.061 10.706 1.00 0.00 C ATOM 589 NE ARG A 41 -3.282 5.857 11.229 1.00 0.00 N ATOM 590 CZ ARG A 41 -2.812 5.750 12.469 1.00 0.00 C ATOM 591 NH1 ARG A 41 -3.351 4.883 13.318 1.00 0.00 N ATOM 592 NH2 ARG A 41 -1.801 6.512 12.863 1.00 0.00 N ATOM 0 H ARG A 41 -3.867 1.555 7.068 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.125 4.223 6.830 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.564 2.936 9.115 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.959 3.569 8.807 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.776 5.854 8.809 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.444 5.316 8.853 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.331 5.448 11.098 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.297 4.034 11.058 1.00 0.00 H new ATOM 0 HE ARG A 41 -2.842 6.535 10.606 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.129 4.295 13.021 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.987 4.805 14.268 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -1.384 7.180 12.215 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -1.441 6.430 13.814 1.00 0.00 H new ATOM 606 N TYR A 42 -2.969 5.450 6.184 1.00 0.00 N ATOM 607 CA TYR A 42 -1.859 6.075 5.474 1.00 0.00 C ATOM 608 C TYR A 42 -0.527 5.724 6.131 1.00 0.00 C ATOM 609 O TYR A 42 0.415 5.298 5.461 1.00 0.00 O ATOM 610 CB TYR A 42 -2.039 7.593 5.440 1.00 0.00 C ATOM 611 CG TYR A 42 -1.002 8.309 4.605 1.00 0.00 C ATOM 612 CD1 TYR A 42 -1.082 8.314 3.218 1.00 0.00 C ATOM 613 CD2 TYR A 42 0.055 8.982 5.203 1.00 0.00 C ATOM 614 CE1 TYR A 42 -0.137 8.968 2.452 1.00 0.00 C ATOM 615 CE2 TYR A 42 1.004 9.638 4.443 1.00 0.00 C ATOM 616 CZ TYR A 42 0.905 9.628 3.068 1.00 0.00 C ATOM 617 OH TYR A 42 1.848 10.282 2.308 1.00 0.00 O ATOM 0 H TYR A 42 -3.661 6.107 6.544 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.852 5.694 4.453 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -3.030 7.824 5.049 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -2.001 7.978 6.459 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.896 7.798 2.731 1.00 0.00 H new ATOM 0 HD2 TYR A 42 0.137 8.993 6.280 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -0.214 8.962 1.375 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.820 10.157 4.924 1.00 0.00 H new ATOM 0 HH TYR A 42 2.426 9.625 1.867 1.00 0.00 H new ATOM 627 N SER A 43 -0.456 5.904 7.446 1.00 0.00 N ATOM 628 CA SER A 43 0.759 5.605 8.194 1.00 0.00 C ATOM 629 C SER A 43 1.153 4.142 8.026 1.00 0.00 C ATOM 630 O SER A 43 2.334 3.795 8.088 1.00 0.00 O ATOM 631 CB SER A 43 0.562 5.925 9.677 1.00 0.00 C ATOM 632 OG SER A 43 -0.228 4.935 10.313 1.00 0.00 O ATOM 0 H SER A 43 -1.226 6.256 8.015 1.00 0.00 H new ATOM 0 HA SER A 43 1.562 6.227 7.799 1.00 0.00 H new ATOM 0 HB2 SER A 43 1.532 5.992 10.170 1.00 0.00 H new ATOM 0 HB3 SER A 43 0.083 6.899 9.781 1.00 0.00 H new ATOM 0 HG SER A 43 -0.337 5.162 11.260 1.00 0.00 H new ATOM 638 N GLU A 44 0.159 3.286 7.813 1.00 0.00 N ATOM 639 CA GLU A 44 0.402 1.861 7.634 1.00 0.00 C ATOM 640 C GLU A 44 1.277 1.609 6.410 1.00 0.00 C ATOM 641 O GLU A 44 2.222 0.821 6.461 1.00 0.00 O ATOM 642 CB GLU A 44 -0.925 1.109 7.495 1.00 0.00 C ATOM 643 CG GLU A 44 -1.106 0.001 8.521 1.00 0.00 C ATOM 644 CD GLU A 44 -0.077 -1.103 8.374 1.00 0.00 C ATOM 645 OE1 GLU A 44 1.063 -0.802 7.960 1.00 0.00 O ATOM 646 OE2 GLU A 44 -0.411 -2.270 8.671 1.00 0.00 O ATOM 0 H GLU A 44 -0.823 3.556 7.760 1.00 0.00 H new ATOM 0 HA GLU A 44 0.928 1.493 8.515 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.747 1.819 7.590 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.987 0.681 6.495 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.039 0.424 9.523 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.105 -0.423 8.420 1.00 0.00 H new ATOM 653 N PHE A 45 0.959 2.285 5.311 1.00 0.00 N ATOM 654 CA PHE A 45 1.718 2.137 4.074 1.00 0.00 C ATOM 655 C PHE A 45 3.182 2.503 4.290 1.00 0.00 C ATOM 656 O PHE A 45 4.083 1.755 3.909 1.00 0.00 O ATOM 657 CB PHE A 45 1.113 3.009 2.972 1.00 0.00 C ATOM 658 CG PHE A 45 0.297 2.236 1.977 1.00 0.00 C ATOM 659 CD1 PHE A 45 0.891 1.682 0.854 1.00 0.00 C ATOM 660 CD2 PHE A 45 -1.066 2.064 2.162 1.00 0.00 C ATOM 661 CE1 PHE A 45 0.142 0.971 -0.063 1.00 0.00 C ATOM 662 CE2 PHE A 45 -1.820 1.354 1.249 1.00 0.00 C ATOM 663 CZ PHE A 45 -1.215 0.806 0.134 1.00 0.00 C ATOM 0 H PHE A 45 0.180 2.941 5.252 1.00 0.00 H new ATOM 0 HA PHE A 45 1.667 1.093 3.765 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.485 3.774 3.429 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.916 3.527 2.447 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.952 1.808 0.694 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -1.544 2.491 3.031 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.617 0.544 -0.934 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.881 1.227 1.406 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.802 0.250 -0.582 1.00 0.00 H new ATOM 673 N TRP A 46 3.415 3.659 4.906 1.00 0.00 N ATOM 674 CA TRP A 46 4.771 4.122 5.175 1.00 0.00 C ATOM 675 C TRP A 46 5.517 3.124 6.055 1.00 0.00 C ATOM 676 O TRP A 46 6.722 2.924 5.902 1.00 0.00 O ATOM 677 CB TRP A 46 4.740 5.496 5.851 1.00 0.00 C ATOM 678 CG TRP A 46 6.100 6.010 6.217 1.00 0.00 C ATOM 679 CD1 TRP A 46 6.835 5.670 7.316 1.00 0.00 C ATOM 680 CD2 TRP A 46 6.886 6.958 5.485 1.00 0.00 C ATOM 681 NE1 TRP A 46 8.031 6.347 7.312 1.00 0.00 N ATOM 682 CE2 TRP A 46 8.086 7.143 6.198 1.00 0.00 C ATOM 683 CE3 TRP A 46 6.693 7.666 4.295 1.00 0.00 C ATOM 684 CZ2 TRP A 46 9.086 8.007 5.760 1.00 0.00 C ATOM 685 CZ3 TRP A 46 7.687 8.524 3.863 1.00 0.00 C ATOM 686 CH2 TRP A 46 8.870 8.688 4.593 1.00 0.00 C ATOM 0 H TRP A 46 2.682 4.291 5.228 1.00 0.00 H new ATOM 0 HA TRP A 46 5.297 4.207 4.224 1.00 0.00 H new ATOM 0 HB2 TRP A 46 4.257 6.210 5.184 1.00 0.00 H new ATOM 0 HB3 TRP A 46 4.128 5.436 6.751 1.00 0.00 H new ATOM 0 HD1 TRP A 46 6.522 4.971 8.078 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.759 6.270 8.022 1.00 0.00 H new ATOM 0 HE3 TRP A 46 5.784 7.545 3.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.000 8.135 6.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 7.548 9.078 2.946 1.00 0.00 H new ATOM 0 HH2 TRP A 46 9.628 9.366 4.228 1.00 0.00 H new ATOM 697 N LYS A 47 4.791 2.499 6.977 1.00 0.00 N ATOM 698 CA LYS A 47 5.383 1.521 7.882 1.00 0.00 C ATOM 699 C LYS A 47 5.908 0.312 7.114 1.00 0.00 C ATOM 700 O LYS A 47 6.830 -0.365 7.563 1.00 0.00 O ATOM 701 CB LYS A 47 4.354 1.070 8.921 1.00 0.00 C ATOM 702 CG LYS A 47 4.143 2.073 10.044 1.00 0.00 C ATOM 703 CD LYS A 47 3.104 1.581 11.039 1.00 0.00 C ATOM 704 CE LYS A 47 3.133 2.395 12.323 1.00 0.00 C ATOM 705 NZ LYS A 47 4.278 2.017 13.197 1.00 0.00 N ATOM 0 H LYS A 47 3.792 2.653 7.117 1.00 0.00 H new ATOM 0 HA LYS A 47 6.222 1.997 8.390 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.402 0.890 8.422 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.674 0.120 9.349 1.00 0.00 H new ATOM 0 HG2 LYS A 47 5.087 2.249 10.559 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.825 3.028 9.626 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.112 1.642 10.591 1.00 0.00 H new ATOM 0 HD3 LYS A 47 3.287 0.531 11.268 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.198 3.455 12.079 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.199 2.249 12.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 4.204 2.521 14.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 4.260 0.991 13.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 5.171 2.274 12.730 1.00 0.00 H new ATOM 719 N LEU A 48 5.311 0.046 5.955 1.00 0.00 N ATOM 720 CA LEU A 48 5.718 -1.083 5.125 1.00 0.00 C ATOM 721 C LEU A 48 6.881 -0.702 4.214 1.00 0.00 C ATOM 722 O LEU A 48 7.738 -1.530 3.907 1.00 0.00 O ATOM 723 CB LEU A 48 4.536 -1.573 4.286 1.00 0.00 C ATOM 724 CG LEU A 48 4.861 -2.694 3.297 1.00 0.00 C ATOM 725 CD1 LEU A 48 5.150 -3.990 4.039 1.00 0.00 C ATOM 726 CD2 LEU A 48 3.718 -2.882 2.311 1.00 0.00 C ATOM 0 H LEU A 48 4.544 0.597 5.570 1.00 0.00 H new ATOM 0 HA LEU A 48 6.048 -1.886 5.784 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.752 -1.920 4.959 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.129 -0.727 3.732 1.00 0.00 H new ATOM 0 HG LEU A 48 5.753 -2.414 2.737 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.379 -4.777 3.321 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.002 -3.846 4.704 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.277 -4.276 4.625 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.966 -3.683 1.615 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.809 -3.141 2.853 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.559 -1.957 1.757 1.00 0.00 H new ATOM 738 N LYS A 49 6.899 0.554 3.781 1.00 0.00 N ATOM 739 CA LYS A 49 7.952 1.048 2.899 1.00 0.00 C ATOM 740 C LYS A 49 9.335 0.828 3.505 1.00 0.00 C ATOM 741 O LYS A 49 10.097 -0.026 3.050 1.00 0.00 O ATOM 742 CB LYS A 49 7.741 2.537 2.608 1.00 0.00 C ATOM 743 CG LYS A 49 7.860 2.890 1.135 1.00 0.00 C ATOM 744 CD LYS A 49 9.313 3.051 0.717 1.00 0.00 C ATOM 745 CE LYS A 49 9.928 4.310 1.307 1.00 0.00 C ATOM 746 NZ LYS A 49 9.151 5.529 0.948 1.00 0.00 N ATOM 0 H LYS A 49 6.195 1.250 4.027 1.00 0.00 H new ATOM 0 HA LYS A 49 7.898 0.486 1.967 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.755 2.833 2.966 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.472 3.116 3.172 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.391 2.111 0.534 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.318 3.815 0.936 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.884 2.180 1.040 1.00 0.00 H new ATOM 0 HD3 LYS A 49 9.377 3.089 -0.370 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.976 4.217 2.392 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.953 4.415 0.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 9.791 6.347 0.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 8.695 5.390 0.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 8.423 5.702 1.671 1.00 0.00 H new ATOM 760 N THR A 50 9.655 1.609 4.533 1.00 0.00 N ATOM 761 CA THR A 50 10.950 1.509 5.202 1.00 0.00 C ATOM 762 C THR A 50 11.239 0.077 5.639 1.00 0.00 C ATOM 763 O THR A 50 12.393 -0.347 5.680 1.00 0.00 O ATOM 764 CB THR A 50 10.997 2.446 6.411 1.00 0.00 C ATOM 765 OG1 THR A 50 12.053 2.087 7.285 1.00 0.00 O ATOM 766 CG2 THR A 50 9.716 2.454 7.218 1.00 0.00 C ATOM 0 H THR A 50 9.035 2.319 4.922 1.00 0.00 H new ATOM 0 HA THR A 50 11.718 1.807 4.488 1.00 0.00 H new ATOM 0 HB THR A 50 11.149 3.442 5.995 1.00 0.00 H new ATOM 0 HG1 THR A 50 12.067 2.699 8.050 1.00 0.00 H new ATOM 0 HG21 THR A 50 9.820 3.139 8.059 1.00 0.00 H new ATOM 0 HG22 THR A 50 8.890 2.778 6.586 1.00 0.00 H new ATOM 0 HG23 THR A 50 9.515 1.450 7.591 1.00 0.00 H new ATOM 774 N ARG A 51 10.187 -0.667 5.963 1.00 0.00 N ATOM 775 CA ARG A 51 10.340 -2.052 6.392 1.00 0.00 C ATOM 776 C ARG A 51 11.036 -2.875 5.313 1.00 0.00 C ATOM 777 O ARG A 51 12.133 -3.389 5.525 1.00 0.00 O ATOM 778 CB ARG A 51 8.977 -2.662 6.720 1.00 0.00 C ATOM 779 CG ARG A 51 9.057 -3.828 7.689 1.00 0.00 C ATOM 780 CD ARG A 51 9.684 -3.417 9.012 1.00 0.00 C ATOM 781 NE ARG A 51 8.798 -3.680 10.143 1.00 0.00 N ATOM 782 CZ ARG A 51 8.631 -4.881 10.689 1.00 0.00 C ATOM 783 NH1 ARG A 51 9.286 -5.932 10.213 1.00 0.00 N ATOM 784 NH2 ARG A 51 7.806 -5.033 11.717 1.00 0.00 N ATOM 0 H ARG A 51 9.223 -0.336 5.937 1.00 0.00 H new ATOM 0 HA ARG A 51 10.957 -2.065 7.291 1.00 0.00 H new ATOM 0 HB2 ARG A 51 8.334 -1.890 7.144 1.00 0.00 H new ATOM 0 HB3 ARG A 51 8.506 -2.998 5.796 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.057 -4.222 7.867 1.00 0.00 H new ATOM 0 HG3 ARG A 51 9.642 -4.632 7.243 1.00 0.00 H new ATOM 0 HD2 ARG A 51 10.621 -3.956 9.152 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.929 -2.355 8.983 1.00 0.00 H new ATOM 0 HE ARG A 51 8.277 -2.897 10.537 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.922 -5.822 9.424 1.00 0.00 H new ATOM 0 HH12 ARG A 51 9.153 -6.850 10.637 1.00 0.00 H new ATOM 0 HH21 ARG A 51 7.300 -4.229 12.088 1.00 0.00 H new ATOM 0 HH22 ARG A 51 7.678 -5.954 12.136 1.00 0.00 H new ATOM 798 N LEU A 52 10.392 -2.988 4.155 1.00 0.00 N ATOM 799 CA LEU A 52 10.949 -3.739 3.031 1.00 0.00 C ATOM 800 C LEU A 52 12.421 -3.396 2.824 1.00 0.00 C ATOM 801 O LEU A 52 13.219 -4.242 2.423 1.00 0.00 O ATOM 802 CB LEU A 52 10.169 -3.437 1.749 1.00 0.00 C ATOM 803 CG LEU A 52 8.666 -3.712 1.816 1.00 0.00 C ATOM 804 CD1 LEU A 52 7.933 -2.943 0.729 1.00 0.00 C ATOM 805 CD2 LEU A 52 8.395 -5.203 1.691 1.00 0.00 C ATOM 0 H LEU A 52 9.481 -2.568 3.969 1.00 0.00 H new ATOM 0 HA LEU A 52 10.865 -4.801 3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 52 10.318 -2.388 1.491 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.594 -4.028 0.938 1.00 0.00 H new ATOM 0 HG LEU A 52 8.295 -3.373 2.783 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.865 -3.152 0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.103 -1.874 0.862 1.00 0.00 H new ATOM 0 HD13 LEU A 52 8.305 -3.251 -0.248 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.321 -5.383 1.740 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.780 -5.564 0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.889 -5.732 2.506 1.00 0.00 H new ATOM 817 N GLU A 53 12.768 -2.143 3.100 1.00 0.00 N ATOM 818 CA GLU A 53 14.143 -1.679 2.944 1.00 0.00 C ATOM 819 C GLU A 53 15.059 -2.329 3.978 1.00 0.00 C ATOM 820 O GLU A 53 16.211 -2.650 3.686 1.00 0.00 O ATOM 821 CB GLU A 53 14.207 -0.156 3.074 1.00 0.00 C ATOM 822 CG GLU A 53 13.984 0.575 1.761 1.00 0.00 C ATOM 823 CD GLU A 53 14.929 1.747 1.578 1.00 0.00 C ATOM 824 OE1 GLU A 53 16.155 1.546 1.707 1.00 0.00 O ATOM 825 OE2 GLU A 53 14.443 2.865 1.308 1.00 0.00 O ATOM 0 H GLU A 53 12.117 -1.431 3.432 1.00 0.00 H new ATOM 0 HA GLU A 53 14.486 -1.967 1.950 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.457 0.171 3.794 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.180 0.126 3.477 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.113 -0.123 0.934 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.955 0.933 1.719 1.00 0.00 H new ATOM 832 N ARG A 54 14.538 -2.515 5.186 1.00 0.00 N ATOM 833 CA ARG A 54 15.309 -3.125 6.265 1.00 0.00 C ATOM 834 C ARG A 54 15.130 -4.641 6.283 1.00 0.00 C ATOM 835 O ARG A 54 15.968 -5.366 6.821 1.00 0.00 O ATOM 836 CB ARG A 54 14.885 -2.537 7.612 1.00 0.00 C ATOM 837 CG ARG A 54 14.785 -1.019 7.611 1.00 0.00 C ATOM 838 CD ARG A 54 15.922 -0.379 8.392 1.00 0.00 C ATOM 839 NE ARG A 54 17.208 -0.529 7.711 1.00 0.00 N ATOM 840 CZ ARG A 54 18.122 -1.445 8.028 1.00 0.00 C ATOM 841 NH1 ARG A 54 17.907 -2.302 9.021 1.00 0.00 N ATOM 842 NH2 ARG A 54 19.259 -1.504 7.350 1.00 0.00 N ATOM 0 H ARG A 54 13.586 -2.253 5.443 1.00 0.00 H new ATOM 0 HA ARG A 54 16.363 -2.907 6.090 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.919 -2.956 7.894 1.00 0.00 H new ATOM 0 HB3 ARG A 54 15.600 -2.845 8.374 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.799 -0.654 6.584 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.831 -0.717 8.044 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.710 0.680 8.538 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.981 -0.831 9.382 1.00 0.00 H new ATOM 0 HE ARG A 54 17.419 0.109 6.944 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.035 -2.262 9.549 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.614 -2.999 9.255 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.433 -0.849 6.588 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.961 -2.204 7.591 1.00 0.00 H new ATOM 856 N ASP A 55 14.036 -5.115 5.694 1.00 0.00 N ATOM 857 CA ASP A 55 13.752 -6.544 5.645 1.00 0.00 C ATOM 858 C ASP A 55 14.383 -7.179 4.412 1.00 0.00 C ATOM 859 O ASP A 55 14.936 -8.278 4.480 1.00 0.00 O ATOM 860 CB ASP A 55 12.240 -6.785 5.645 1.00 0.00 C ATOM 861 CG ASP A 55 11.816 -7.798 6.690 1.00 0.00 C ATOM 862 OD1 ASP A 55 12.025 -9.008 6.462 1.00 0.00 O ATOM 863 OD2 ASP A 55 11.275 -7.382 7.736 1.00 0.00 O ATOM 0 H ASP A 55 13.332 -4.530 5.244 1.00 0.00 H new ATOM 0 HA ASP A 55 14.185 -7.008 6.531 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.725 -5.842 5.827 1.00 0.00 H new ATOM 0 HB3 ASP A 55 11.930 -7.133 4.659 1.00 0.00 H new ATOM 868 N VAL A 56 14.301 -6.478 3.288 1.00 0.00 N ATOM 869 CA VAL A 56 14.865 -6.968 2.038 1.00 0.00 C ATOM 870 C VAL A 56 16.332 -6.578 1.917 1.00 0.00 C ATOM 871 O VAL A 56 17.132 -7.303 1.325 1.00 0.00 O ATOM 872 CB VAL A 56 14.101 -6.413 0.822 1.00 0.00 C ATOM 873 CG1 VAL A 56 14.579 -7.079 -0.458 1.00 0.00 C ATOM 874 CG2 VAL A 56 12.602 -6.596 1.001 1.00 0.00 C ATOM 0 H VAL A 56 13.848 -5.567 3.217 1.00 0.00 H new ATOM 0 HA VAL A 56 14.774 -8.054 2.050 1.00 0.00 H new ATOM 0 HB VAL A 56 14.304 -5.345 0.746 1.00 0.00 H new ATOM 0 HG11 VAL A 56 14.028 -6.674 -1.307 1.00 0.00 H new ATOM 0 HG12 VAL A 56 15.644 -6.887 -0.592 1.00 0.00 H new ATOM 0 HG13 VAL A 56 14.409 -8.154 -0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.080 -6.197 0.131 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.375 -7.657 1.106 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.275 -6.065 1.895 1.00 0.00 H new ATOM 884 N GLY A 57 16.675 -5.426 2.480 1.00 0.00 N ATOM 885 CA GLY A 57 18.045 -4.954 2.426 1.00 0.00 C ATOM 886 C GLY A 57 18.380 -4.296 1.101 1.00 0.00 C ATOM 887 O GLY A 57 19.550 -4.181 0.736 1.00 0.00 O ATOM 0 H GLY A 57 16.029 -4.810 2.973 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.213 -4.242 3.234 1.00 0.00 H new ATOM 0 HA3 GLY A 57 18.722 -5.792 2.593 1.00 0.00 H new ATOM 891 N SER A 58 17.351 -3.864 0.378 1.00 0.00 N ATOM 892 CA SER A 58 17.542 -3.215 -0.913 1.00 0.00 C ATOM 893 C SER A 58 16.778 -1.897 -0.976 1.00 0.00 C ATOM 894 O SER A 58 15.801 -1.699 -0.254 1.00 0.00 O ATOM 895 CB SER A 58 17.084 -4.138 -2.044 1.00 0.00 C ATOM 896 OG SER A 58 17.690 -5.415 -1.938 1.00 0.00 O ATOM 0 H SER A 58 16.376 -3.952 0.665 1.00 0.00 H new ATOM 0 HA SER A 58 18.605 -3.005 -1.033 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.999 -4.243 -2.015 1.00 0.00 H new ATOM 0 HB3 SER A 58 17.335 -3.692 -3.006 1.00 0.00 H new ATOM 0 HG SER A 58 18.645 -5.342 -2.147 1.00 0.00 H new ATOM 902 N THR A 59 17.230 -0.998 -1.843 1.00 0.00 N ATOM 903 CA THR A 59 16.587 0.302 -1.999 1.00 0.00 C ATOM 904 C THR A 59 15.281 0.171 -2.775 1.00 0.00 C ATOM 905 O THR A 59 15.248 -0.408 -3.861 1.00 0.00 O ATOM 906 CB THR A 59 17.525 1.279 -2.713 1.00 0.00 C ATOM 907 OG1 THR A 59 18.560 0.582 -3.386 1.00 0.00 O ATOM 908 CG2 THR A 59 18.176 2.274 -1.776 1.00 0.00 C ATOM 0 H THR A 59 18.038 -1.145 -2.448 1.00 0.00 H new ATOM 0 HA THR A 59 16.362 0.690 -1.006 1.00 0.00 H new ATOM 0 HB THR A 59 16.895 1.823 -3.416 1.00 0.00 H new ATOM 0 HG1 THR A 59 19.147 1.224 -3.837 1.00 0.00 H new ATOM 0 HG21 THR A 59 18.828 2.937 -2.345 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.406 2.863 -1.278 1.00 0.00 H new ATOM 0 HG23 THR A 59 18.764 1.740 -1.030 1.00 0.00 H new ATOM 916 N ILE A 60 14.207 0.713 -2.212 1.00 0.00 N ATOM 917 CA ILE A 60 12.898 0.656 -2.851 1.00 0.00 C ATOM 918 C ILE A 60 12.746 1.772 -3.886 1.00 0.00 C ATOM 919 O ILE A 60 13.022 2.936 -3.595 1.00 0.00 O ATOM 920 CB ILE A 60 11.760 0.762 -1.816 1.00 0.00 C ATOM 921 CG1 ILE A 60 10.409 0.496 -2.480 1.00 0.00 C ATOM 922 CG2 ILE A 60 11.767 2.130 -1.147 1.00 0.00 C ATOM 923 CD1 ILE A 60 9.982 -0.955 -2.419 1.00 0.00 C ATOM 0 H ILE A 60 14.217 1.197 -1.314 1.00 0.00 H new ATOM 0 HA ILE A 60 12.828 -0.310 -3.351 1.00 0.00 H new ATOM 0 HB ILE A 60 11.923 0.006 -1.048 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.649 1.111 -1.998 1.00 0.00 H new ATOM 0 HG13 ILE A 60 10.458 0.809 -3.523 1.00 0.00 H new ATOM 0 HG21 ILE A 60 10.956 2.184 -0.420 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.720 2.282 -0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 60 11.630 2.905 -1.901 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.015 -1.071 -2.909 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.722 -1.574 -2.926 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.901 -1.267 -1.378 1.00 0.00 H new ATOM 935 N PRO A 61 12.308 1.434 -5.114 1.00 0.00 N ATOM 936 CA PRO A 61 12.129 2.410 -6.185 1.00 0.00 C ATOM 937 C PRO A 61 10.751 3.068 -6.168 1.00 0.00 C ATOM 938 O PRO A 61 10.238 3.480 -7.209 1.00 0.00 O ATOM 939 CB PRO A 61 12.294 1.552 -7.435 1.00 0.00 C ATOM 940 CG PRO A 61 11.744 0.220 -7.049 1.00 0.00 C ATOM 941 CD PRO A 61 11.963 0.070 -5.561 1.00 0.00 C ATOM 0 HA PRO A 61 12.828 3.243 -6.107 1.00 0.00 H new ATOM 0 HB2 PRO A 61 11.752 1.975 -8.281 1.00 0.00 H new ATOM 0 HB3 PRO A 61 13.341 1.479 -7.731 1.00 0.00 H new ATOM 0 HG2 PRO A 61 10.683 0.155 -7.292 1.00 0.00 H new ATOM 0 HG3 PRO A 61 12.246 -0.578 -7.596 1.00 0.00 H new ATOM 0 HD2 PRO A 61 11.068 -0.300 -5.061 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.764 -0.636 -5.344 1.00 0.00 H new ATOM 949 N TYR A 62 10.154 3.170 -4.983 1.00 0.00 N ATOM 950 CA TYR A 62 8.839 3.781 -4.843 1.00 0.00 C ATOM 951 C TYR A 62 8.951 5.188 -4.268 1.00 0.00 C ATOM 952 O TYR A 62 9.713 5.428 -3.331 1.00 0.00 O ATOM 953 CB TYR A 62 7.946 2.920 -3.948 1.00 0.00 C ATOM 954 CG TYR A 62 7.532 1.614 -4.587 1.00 0.00 C ATOM 955 CD1 TYR A 62 7.072 1.576 -5.896 1.00 0.00 C ATOM 956 CD2 TYR A 62 7.603 0.420 -3.880 1.00 0.00 C ATOM 957 CE1 TYR A 62 6.692 0.383 -6.484 1.00 0.00 C ATOM 958 CE2 TYR A 62 7.226 -0.776 -4.461 1.00 0.00 C ATOM 959 CZ TYR A 62 6.771 -0.789 -5.762 1.00 0.00 C ATOM 960 OH TYR A 62 6.394 -1.977 -6.343 1.00 0.00 O ATOM 0 H TYR A 62 10.561 2.838 -4.109 1.00 0.00 H new ATOM 0 HA TYR A 62 8.390 3.849 -5.834 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.473 2.709 -3.018 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.052 3.487 -3.687 1.00 0.00 H new ATOM 0 HD1 TYR A 62 7.010 2.492 -6.464 1.00 0.00 H new ATOM 0 HD2 TYR A 62 7.958 0.427 -2.860 1.00 0.00 H new ATOM 0 HE1 TYR A 62 6.335 0.370 -7.503 1.00 0.00 H new ATOM 0 HE2 TYR A 62 7.288 -1.696 -3.898 1.00 0.00 H new ATOM 0 HH TYR A 62 7.099 -2.644 -6.210 1.00 0.00 H new ATOM 970 N ASP A 63 8.186 6.116 -4.832 1.00 0.00 N ATOM 971 CA ASP A 63 8.200 7.502 -4.375 1.00 0.00 C ATOM 972 C ASP A 63 7.130 7.735 -3.313 1.00 0.00 C ATOM 973 O ASP A 63 5.934 7.691 -3.602 1.00 0.00 O ATOM 974 CB ASP A 63 7.981 8.451 -5.553 1.00 0.00 C ATOM 975 CG ASP A 63 6.766 8.075 -6.380 1.00 0.00 C ATOM 976 OD1 ASP A 63 6.703 6.920 -6.851 1.00 0.00 O ATOM 977 OD2 ASP A 63 5.877 8.935 -6.555 1.00 0.00 O ATOM 0 H ASP A 63 7.548 5.934 -5.607 1.00 0.00 H new ATOM 0 HA ASP A 63 9.176 7.703 -3.932 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.862 9.468 -5.180 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.866 8.446 -6.189 1.00 0.00 H new ATOM 982 N PHE A 64 7.567 7.985 -2.083 1.00 0.00 N ATOM 983 CA PHE A 64 6.644 8.226 -0.979 1.00 0.00 C ATOM 984 C PHE A 64 7.103 9.414 -0.134 1.00 0.00 C ATOM 985 O PHE A 64 7.944 9.265 0.753 1.00 0.00 O ATOM 986 CB PHE A 64 6.529 6.977 -0.104 1.00 0.00 C ATOM 987 CG PHE A 64 5.217 6.872 0.622 1.00 0.00 C ATOM 988 CD1 PHE A 64 4.788 7.892 1.456 1.00 0.00 C ATOM 989 CD2 PHE A 64 4.415 5.753 0.471 1.00 0.00 C ATOM 990 CE1 PHE A 64 3.584 7.798 2.125 1.00 0.00 C ATOM 991 CE2 PHE A 64 3.210 5.652 1.138 1.00 0.00 C ATOM 992 CZ PHE A 64 2.793 6.676 1.966 1.00 0.00 C ATOM 0 H PHE A 64 8.553 8.026 -1.825 1.00 0.00 H new ATOM 0 HA PHE A 64 5.666 8.459 -1.399 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.662 6.093 -0.727 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.339 6.978 0.625 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.403 8.771 1.584 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.736 4.950 -0.176 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.261 8.600 2.772 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.594 4.774 1.012 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.851 6.600 2.488 1.00 0.00 H new ATOM 1002 N PRO A 65 6.555 10.614 -0.397 1.00 0.00 N ATOM 1003 CA PRO A 65 6.913 11.824 0.343 1.00 0.00 C ATOM 1004 C PRO A 65 6.198 11.920 1.687 1.00 0.00 C ATOM 1005 O PRO A 65 4.971 11.996 1.743 1.00 0.00 O ATOM 1006 CB PRO A 65 6.450 12.942 -0.589 1.00 0.00 C ATOM 1007 CG PRO A 65 5.277 12.365 -1.303 1.00 0.00 C ATOM 1008 CD PRO A 65 5.546 10.887 -1.440 1.00 0.00 C ATOM 0 HA PRO A 65 7.974 11.858 0.588 1.00 0.00 H new ATOM 0 HB2 PRO A 65 6.175 13.837 -0.031 1.00 0.00 H new ATOM 0 HB3 PRO A 65 7.237 13.230 -1.286 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.357 12.542 -0.745 1.00 0.00 H new ATOM 0 HG3 PRO A 65 5.151 12.829 -2.281 1.00 0.00 H new ATOM 0 HD2 PRO A 65 4.641 10.300 -1.284 1.00 0.00 H new ATOM 0 HD3 PRO A 65 5.920 10.639 -2.433 1.00 0.00 H new ATOM 1016 N GLU A 66 6.973 11.919 2.768 1.00 0.00 N ATOM 1017 CA GLU A 66 6.409 12.010 4.110 1.00 0.00 C ATOM 1018 C GLU A 66 5.853 13.407 4.371 1.00 0.00 C ATOM 1019 O GLU A 66 6.127 14.345 3.623 1.00 0.00 O ATOM 1020 CB GLU A 66 7.472 11.662 5.156 1.00 0.00 C ATOM 1021 CG GLU A 66 7.045 10.563 6.114 1.00 0.00 C ATOM 1022 CD GLU A 66 6.229 11.089 7.279 1.00 0.00 C ATOM 1023 OE1 GLU A 66 6.768 11.896 8.066 1.00 0.00 O ATOM 1024 OE2 GLU A 66 5.050 10.694 7.405 1.00 0.00 O ATOM 0 H GLU A 66 7.991 11.856 2.741 1.00 0.00 H new ATOM 0 HA GLU A 66 5.590 11.295 4.185 1.00 0.00 H new ATOM 0 HB2 GLU A 66 8.385 11.354 4.646 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.714 12.558 5.728 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.460 9.820 5.571 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.930 10.055 6.496 1.00 0.00 H new ATOM 1031 N LYS A 67 5.071 13.537 5.438 1.00 0.00 N ATOM 1032 CA LYS A 67 4.478 14.819 5.798 1.00 0.00 C ATOM 1033 C LYS A 67 4.571 15.060 7.303 1.00 0.00 C ATOM 1034 O LYS A 67 3.716 14.609 8.065 1.00 0.00 O ATOM 1035 CB LYS A 67 3.014 14.868 5.354 1.00 0.00 C ATOM 1036 CG LYS A 67 2.838 14.894 3.843 1.00 0.00 C ATOM 1037 CD LYS A 67 3.280 16.224 3.254 1.00 0.00 C ATOM 1038 CE LYS A 67 3.787 16.061 1.830 1.00 0.00 C ATOM 1039 NZ LYS A 67 2.740 16.395 0.826 1.00 0.00 N ATOM 0 H LYS A 67 4.834 12.770 6.068 1.00 0.00 H new ATOM 0 HA LYS A 67 5.035 15.605 5.287 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.491 14.001 5.758 1.00 0.00 H new ATOM 0 HB3 LYS A 67 2.542 15.753 5.782 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.416 14.086 3.394 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.792 14.714 3.594 1.00 0.00 H new ATOM 0 HD2 LYS A 67 2.445 16.924 3.266 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.066 16.655 3.874 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.654 16.704 1.678 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.121 15.034 1.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 3.126 16.271 -0.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 1.922 15.765 0.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.439 17.382 0.953 1.00 0.00 H new ATOM 1053 N PRO A 68 5.616 15.778 7.755 1.00 0.00 N ATOM 1054 CA PRO A 68 5.812 16.073 9.178 1.00 0.00 C ATOM 1055 C PRO A 68 4.761 17.038 9.719 1.00 0.00 C ATOM 1056 O PRO A 68 4.374 17.991 9.043 1.00 0.00 O ATOM 1057 CB PRO A 68 7.200 16.714 9.224 1.00 0.00 C ATOM 1058 CG PRO A 68 7.402 17.281 7.862 1.00 0.00 C ATOM 1059 CD PRO A 68 6.685 16.356 6.918 1.00 0.00 C ATOM 0 HA PRO A 68 5.723 15.178 9.794 1.00 0.00 H new ATOM 0 HB2 PRO A 68 7.252 17.490 9.987 1.00 0.00 H new ATOM 0 HB3 PRO A 68 7.968 15.978 9.464 1.00 0.00 H new ATOM 0 HG2 PRO A 68 7.001 18.292 7.797 1.00 0.00 H new ATOM 0 HG3 PRO A 68 8.463 17.342 7.618 1.00 0.00 H new ATOM 0 HD2 PRO A 68 6.279 16.892 6.060 1.00 0.00 H new ATOM 0 HD3 PRO A 68 7.350 15.586 6.527 1.00 0.00 H new ATOM 1067 N GLY A 69 4.303 16.781 10.939 1.00 0.00 N ATOM 1068 CA GLY A 69 3.301 17.635 11.550 1.00 0.00 C ATOM 1069 C GLY A 69 3.614 17.950 12.999 1.00 0.00 C ATOM 1070 O GLY A 69 2.955 17.444 13.907 1.00 0.00 O ATOM 0 H GLY A 69 4.607 15.997 11.516 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.228 18.565 10.987 1.00 0.00 H new ATOM 0 HA3 GLY A 69 2.327 17.149 11.489 1.00 0.00 H new ATOM 1074 N VAL A 70 4.621 18.789 13.216 1.00 0.00 N ATOM 1075 CA VAL A 70 5.020 19.172 14.564 1.00 0.00 C ATOM 1076 C VAL A 70 4.320 20.459 14.999 1.00 0.00 C ATOM 1077 O VAL A 70 3.344 20.421 15.749 1.00 0.00 O ATOM 1078 CB VAL A 70 6.549 19.357 14.664 1.00 0.00 C ATOM 1079 CG1 VAL A 70 6.949 19.834 16.053 1.00 0.00 C ATOM 1080 CG2 VAL A 70 7.264 18.060 14.315 1.00 0.00 C ATOM 0 H VAL A 70 5.176 19.217 12.475 1.00 0.00 H new ATOM 0 HA VAL A 70 4.721 18.363 15.230 1.00 0.00 H new ATOM 0 HB VAL A 70 6.848 20.121 13.947 1.00 0.00 H new ATOM 0 HG11 VAL A 70 8.031 19.957 16.098 1.00 0.00 H new ATOM 0 HG12 VAL A 70 6.466 20.789 16.263 1.00 0.00 H new ATOM 0 HG13 VAL A 70 6.636 19.099 16.794 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.341 18.207 14.390 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.955 17.277 15.007 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.008 17.766 13.297 1.00 0.00 H new ATOM 1090 N LEU A 71 4.823 21.594 14.526 1.00 0.00 N ATOM 1091 CA LEU A 71 4.243 22.887 14.869 1.00 0.00 C ATOM 1092 C LEU A 71 3.409 23.435 13.714 1.00 0.00 C ATOM 1093 O LEU A 71 3.653 24.538 13.224 1.00 0.00 O ATOM 1094 CB LEU A 71 5.348 23.881 15.239 1.00 0.00 C ATOM 1095 CG LEU A 71 5.014 24.817 16.401 1.00 0.00 C ATOM 1096 CD1 LEU A 71 3.833 25.707 16.049 1.00 0.00 C ATOM 1097 CD2 LEU A 71 4.722 24.016 17.662 1.00 0.00 C ATOM 0 H LEU A 71 5.630 21.645 13.905 1.00 0.00 H new ATOM 0 HA LEU A 71 3.587 22.748 15.728 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.249 23.322 15.490 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.581 24.484 14.362 1.00 0.00 H new ATOM 0 HG LEU A 71 5.878 25.454 16.589 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.611 26.366 16.889 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.078 26.307 15.172 1.00 0.00 H new ATOM 0 HD13 LEU A 71 2.962 25.088 15.833 1.00 0.00 H new ATOM 0 HD21 LEU A 71 4.486 24.697 18.479 1.00 0.00 H new ATOM 0 HD22 LEU A 71 3.874 23.355 17.485 1.00 0.00 H new ATOM 0 HD23 LEU A 71 5.597 23.422 17.926 1.00 0.00 H new ATOM 1109 N ASP A 72 2.422 22.656 13.284 1.00 0.00 N ATOM 1110 CA ASP A 72 1.550 23.062 12.188 1.00 0.00 C ATOM 1111 C ASP A 72 0.677 24.244 12.597 1.00 0.00 C ATOM 1112 O ASP A 72 -0.189 24.119 13.462 1.00 0.00 O ATOM 1113 CB ASP A 72 0.670 21.891 11.747 1.00 0.00 C ATOM 1114 CG ASP A 72 1.480 20.734 11.197 1.00 0.00 C ATOM 1115 OD1 ASP A 72 2.335 20.973 10.317 1.00 0.00 O ATOM 1116 OD2 ASP A 72 1.261 19.589 11.645 1.00 0.00 O ATOM 0 H ASP A 72 2.206 21.740 13.678 1.00 0.00 H new ATOM 0 HA ASP A 72 2.178 23.369 11.352 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.078 21.546 12.595 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.032 22.234 10.986 1.00 0.00 H new ATOM 1121 N ARG A 73 0.913 25.392 11.969 1.00 0.00 N ATOM 1122 CA ARG A 73 0.148 26.597 12.270 1.00 0.00 C ATOM 1123 C ARG A 73 -0.299 27.292 10.990 1.00 0.00 C ATOM 1124 O ARG A 73 -1.493 27.447 10.735 1.00 0.00 O ATOM 1125 CB ARG A 73 0.981 27.558 13.120 1.00 0.00 C ATOM 1126 CG ARG A 73 1.517 26.933 14.397 1.00 0.00 C ATOM 1127 CD ARG A 73 0.604 27.209 15.582 1.00 0.00 C ATOM 1128 NE ARG A 73 1.268 28.003 16.612 1.00 0.00 N ATOM 1129 CZ ARG A 73 0.847 28.085 17.873 1.00 0.00 C ATOM 1130 NH1 ARG A 73 -0.236 27.423 18.262 1.00 0.00 N ATOM 1131 NH2 ARG A 73 1.510 28.829 18.747 1.00 0.00 N ATOM 0 H ARG A 73 1.626 25.513 11.250 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.739 26.302 12.831 1.00 0.00 H new ATOM 0 HB2 ARG A 73 1.818 27.923 12.525 1.00 0.00 H new ATOM 0 HB3 ARG A 73 0.371 28.424 13.378 1.00 0.00 H new ATOM 0 HG2 ARG A 73 1.621 25.857 14.260 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.512 27.325 14.605 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.287 27.734 15.238 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.272 26.264 16.011 1.00 0.00 H new ATOM 0 HE ARG A 73 2.104 28.526 16.350 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.750 26.848 17.594 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.554 27.489 19.229 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.343 29.339 18.454 1.00 0.00 H new ATOM 0 HH22 ARG A 73 1.187 28.891 19.712 1.00 0.00 H new ATOM 1145 N ARG A 74 0.673 27.712 10.191 1.00 0.00 N ATOM 1146 CA ARG A 74 0.392 28.396 8.934 1.00 0.00 C ATOM 1147 C ARG A 74 0.050 27.400 7.832 1.00 0.00 C ATOM 1148 O ARG A 74 -0.836 27.644 7.014 1.00 0.00 O ATOM 1149 CB ARG A 74 1.593 29.246 8.515 1.00 0.00 C ATOM 1150 CG ARG A 74 2.847 28.433 8.238 1.00 0.00 C ATOM 1151 CD ARG A 74 4.054 29.330 8.018 1.00 0.00 C ATOM 1152 NE ARG A 74 4.159 29.777 6.631 1.00 0.00 N ATOM 1153 CZ ARG A 74 5.228 30.391 6.129 1.00 0.00 C ATOM 1154 NH1 ARG A 74 6.283 30.635 6.897 1.00 0.00 N ATOM 1155 NH2 ARG A 74 5.241 30.764 4.857 1.00 0.00 N ATOM 0 H ARG A 74 1.666 27.591 10.391 1.00 0.00 H new ATOM 0 HA ARG A 74 -0.470 29.045 9.088 1.00 0.00 H new ATOM 0 HB2 ARG A 74 1.332 29.812 7.621 1.00 0.00 H new ATOM 0 HB3 ARG A 74 1.806 29.971 9.301 1.00 0.00 H new ATOM 0 HG2 ARG A 74 3.039 27.761 9.075 1.00 0.00 H new ATOM 0 HG3 ARG A 74 2.691 27.809 7.358 1.00 0.00 H new ATOM 0 HD2 ARG A 74 3.985 30.198 8.674 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.961 28.792 8.295 1.00 0.00 H new ATOM 0 HE ARG A 74 3.367 29.609 6.011 1.00 0.00 H new ATOM 0 HH11 ARG A 74 6.277 30.352 7.877 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.100 31.106 6.507 1.00 0.00 H new ATOM 0 HH21 ARG A 74 4.432 30.580 4.263 1.00 0.00 H new ATOM 0 HH22 ARG A 74 6.060 31.235 4.472 1.00 0.00 H new ATOM 1169 N TRP A 75 0.758 26.275 7.816 1.00 0.00 N ATOM 1170 CA TRP A 75 0.528 25.242 6.812 1.00 0.00 C ATOM 1171 C TRP A 75 -0.291 24.092 7.390 1.00 0.00 C ATOM 1172 O TRP A 75 -0.136 22.941 6.983 1.00 0.00 O ATOM 1173 CB TRP A 75 1.858 24.717 6.270 1.00 0.00 C ATOM 1174 CG TRP A 75 2.848 24.371 7.342 1.00 0.00 C ATOM 1175 CD1 TRP A 75 2.573 23.921 8.602 1.00 0.00 C ATOM 1176 CD2 TRP A 75 4.275 24.447 7.245 1.00 0.00 C ATOM 1177 NE1 TRP A 75 3.742 23.714 9.293 1.00 0.00 N ATOM 1178 CE2 TRP A 75 4.800 24.029 8.483 1.00 0.00 C ATOM 1179 CE3 TRP A 75 5.159 24.828 6.232 1.00 0.00 C ATOM 1180 CZ2 TRP A 75 6.169 23.982 8.733 1.00 0.00 C ATOM 1181 CZ3 TRP A 75 6.519 24.781 6.482 1.00 0.00 C ATOM 1182 CH2 TRP A 75 7.011 24.360 7.723 1.00 0.00 C ATOM 0 H TRP A 75 1.495 26.056 8.486 1.00 0.00 H new ATOM 0 HA TRP A 75 -0.036 25.689 5.993 1.00 0.00 H new ATOM 0 HB2 TRP A 75 1.669 23.832 5.662 1.00 0.00 H new ATOM 0 HB3 TRP A 75 2.295 25.468 5.612 1.00 0.00 H new ATOM 0 HD1 TRP A 75 1.582 23.753 8.997 1.00 0.00 H new ATOM 0 HE1 TRP A 75 3.811 23.380 10.254 1.00 0.00 H new ATOM 0 HE3 TRP A 75 4.787 25.153 5.272 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 6.552 23.659 9.690 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 7.212 25.074 5.707 1.00 0.00 H new ATOM 0 HH2 TRP A 75 8.078 24.333 7.887 1.00 0.00 H new ATOM 1193 N GLN A 76 -1.162 24.414 8.341 1.00 0.00 N ATOM 1194 CA GLN A 76 -2.007 23.408 8.975 1.00 0.00 C ATOM 1195 C GLN A 76 -2.869 22.690 7.940 1.00 0.00 C ATOM 1196 O GLN A 76 -3.319 23.293 6.965 1.00 0.00 O ATOM 1197 CB GLN A 76 -2.897 24.058 10.039 1.00 0.00 C ATOM 1198 CG GLN A 76 -2.571 23.617 11.457 1.00 0.00 C ATOM 1199 CD GLN A 76 -3.690 23.923 12.433 1.00 0.00 C ATOM 1200 OE1 GLN A 76 -3.553 24.786 13.300 1.00 0.00 O ATOM 1201 NE2 GLN A 76 -4.804 23.215 12.298 1.00 0.00 N ATOM 0 H GLN A 76 -1.301 25.363 8.689 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.360 22.673 9.453 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.797 25.141 9.972 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.939 23.820 9.824 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.371 22.546 11.464 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -1.659 24.114 11.788 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.874 22.509 11.565 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.590 23.376 12.927 1.00 0.00 H new ATOM 1210 N ARG A 77 -3.095 21.399 8.159 1.00 0.00 N ATOM 1211 CA ARG A 77 -3.904 20.599 7.246 1.00 0.00 C ATOM 1212 C ARG A 77 -4.823 19.658 8.017 1.00 0.00 C ATOM 1213 O ARG A 77 -4.597 19.378 9.194 1.00 0.00 O ATOM 1214 CB ARG A 77 -3.005 19.796 6.305 1.00 0.00 C ATOM 1215 CG ARG A 77 -1.904 20.624 5.661 1.00 0.00 C ATOM 1216 CD ARG A 77 -1.361 19.952 4.409 1.00 0.00 C ATOM 1217 NE ARG A 77 0.091 20.082 4.306 1.00 0.00 N ATOM 1218 CZ ARG A 77 0.952 19.329 4.986 1.00 0.00 C ATOM 1219 NH1 ARG A 77 0.513 18.396 5.822 1.00 0.00 N ATOM 1220 NH2 ARG A 77 2.257 19.509 4.831 1.00 0.00 N ATOM 0 H ARG A 77 -2.730 20.884 8.960 1.00 0.00 H new ATOM 0 HA ARG A 77 -4.521 21.277 6.656 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -2.553 18.975 6.861 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -3.619 19.351 5.522 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -2.291 21.611 5.407 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -1.094 20.773 6.375 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -1.631 18.896 4.418 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.828 20.393 3.529 1.00 0.00 H new ATOM 0 HE ARG A 77 0.466 20.791 3.676 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -0.489 18.253 5.946 1.00 0.00 H new ATOM 0 HH12 ARG A 77 1.178 17.822 6.340 1.00 0.00 H new ATOM 0 HH21 ARG A 77 2.601 20.225 4.191 1.00 0.00 H new ATOM 0 HH22 ARG A 77 2.917 18.932 5.352 1.00 0.00 H new ATOM 1234 N ARG A 78 -5.861 19.171 7.344 1.00 0.00 N ATOM 1235 CA ARG A 78 -6.815 18.260 7.966 1.00 0.00 C ATOM 1236 C ARG A 78 -6.703 16.862 7.365 1.00 0.00 C ATOM 1237 O ARG A 78 -6.582 16.705 6.151 1.00 0.00 O ATOM 1238 CB ARG A 78 -8.241 18.789 7.800 1.00 0.00 C ATOM 1239 CG ARG A 78 -9.106 18.602 9.037 1.00 0.00 C ATOM 1240 CD ARG A 78 -9.984 19.817 9.292 1.00 0.00 C ATOM 1241 NE ARG A 78 -10.778 20.177 8.118 1.00 0.00 N ATOM 1242 CZ ARG A 78 -11.858 20.953 8.164 1.00 0.00 C ATOM 1243 NH1 ARG A 78 -12.278 21.451 9.320 1.00 0.00 N ATOM 1244 NH2 ARG A 78 -12.521 21.230 7.049 1.00 0.00 N ATOM 0 H ARG A 78 -6.063 19.392 6.369 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.581 18.198 9.029 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -8.200 19.850 7.552 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.712 18.283 6.957 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -9.732 17.719 8.914 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -8.470 18.423 9.904 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -10.650 19.613 10.131 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -9.358 20.662 9.579 1.00 0.00 H new ATOM 0 HE ARG A 78 -10.487 19.812 7.211 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -11.772 21.240 10.180 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -13.107 22.045 9.348 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.203 20.848 6.158 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.349 21.825 7.082 1.00 0.00 H new ATOM 1258 N TYR A 79 -6.745 15.850 8.225 1.00 0.00 N ATOM 1259 CA TYR A 79 -6.649 14.464 7.780 1.00 0.00 C ATOM 1260 C TYR A 79 -7.911 14.037 7.036 1.00 0.00 C ATOM 1261 O TYR A 79 -7.874 13.127 6.209 1.00 0.00 O ATOM 1262 CB TYR A 79 -6.410 13.540 8.976 1.00 0.00 C ATOM 1263 CG TYR A 79 -7.525 13.565 9.996 1.00 0.00 C ATOM 1264 CD1 TYR A 79 -7.546 14.518 11.006 1.00 0.00 C ATOM 1265 CD2 TYR A 79 -8.556 12.636 9.949 1.00 0.00 C ATOM 1266 CE1 TYR A 79 -8.564 14.545 11.940 1.00 0.00 C ATOM 1267 CE2 TYR A 79 -9.578 12.656 10.880 1.00 0.00 C ATOM 1268 CZ TYR A 79 -9.577 13.613 11.873 1.00 0.00 C ATOM 1269 OH TYR A 79 -10.592 13.638 12.801 1.00 0.00 O ATOM 0 H TYR A 79 -6.845 15.963 9.234 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.805 14.388 7.094 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -6.282 12.519 8.615 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.477 13.825 9.463 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -6.754 15.250 11.062 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -8.560 11.885 9.172 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -8.566 15.293 12.719 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -10.373 11.926 10.830 1.00 0.00 H new ATOM 0 HH TYR A 79 -10.417 12.968 13.495 1.00 0.00 H new ATOM 1279 N ASP A 80 -9.026 14.699 7.334 1.00 0.00 N ATOM 1280 CA ASP A 80 -10.296 14.381 6.691 1.00 0.00 C ATOM 1281 C ASP A 80 -10.608 15.375 5.576 1.00 0.00 C ATOM 1282 O ASP A 80 -11.773 15.641 5.278 1.00 0.00 O ATOM 1283 CB ASP A 80 -11.427 14.380 7.720 1.00 0.00 C ATOM 1284 CG ASP A 80 -11.503 15.680 8.497 1.00 0.00 C ATOM 1285 OD1 ASP A 80 -11.471 16.755 7.861 1.00 0.00 O ATOM 1286 OD2 ASP A 80 -11.595 15.624 9.742 1.00 0.00 O ATOM 0 H ASP A 80 -9.075 15.457 8.015 1.00 0.00 H new ATOM 0 HA ASP A 80 -10.212 13.387 6.252 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -12.376 14.207 7.212 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -11.282 13.553 8.415 1.00 0.00 H new ATOM 1291 N ASP A 81 -9.563 15.919 4.961 1.00 0.00 N ATOM 1292 CA ASP A 81 -9.730 16.881 3.877 1.00 0.00 C ATOM 1293 C ASP A 81 -9.634 16.189 2.518 1.00 0.00 C ATOM 1294 O ASP A 81 -8.735 15.380 2.288 1.00 0.00 O ATOM 1295 CB ASP A 81 -8.672 17.982 3.979 1.00 0.00 C ATOM 1296 CG ASP A 81 -9.179 19.204 4.719 1.00 0.00 C ATOM 1297 OD1 ASP A 81 -10.169 19.076 5.469 1.00 0.00 O ATOM 1298 OD2 ASP A 81 -8.586 20.290 4.548 1.00 0.00 O ATOM 0 H ASP A 81 -8.592 15.710 5.194 1.00 0.00 H new ATOM 0 HA ASP A 81 -10.720 17.329 3.968 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.792 17.590 4.490 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.356 18.272 2.977 1.00 0.00 H new ATOM 1303 N PRO A 82 -10.564 16.496 1.594 1.00 0.00 N ATOM 1304 CA PRO A 82 -10.574 15.893 0.256 1.00 0.00 C ATOM 1305 C PRO A 82 -9.328 16.245 -0.550 1.00 0.00 C ATOM 1306 O PRO A 82 -8.827 15.427 -1.321 1.00 0.00 O ATOM 1307 CB PRO A 82 -11.823 16.489 -0.404 1.00 0.00 C ATOM 1308 CG PRO A 82 -12.114 17.729 0.369 1.00 0.00 C ATOM 1309 CD PRO A 82 -11.673 17.448 1.776 1.00 0.00 C ATOM 0 HA PRO A 82 -10.584 14.804 0.306 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -11.645 16.712 -1.456 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.661 15.793 -0.363 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.578 18.583 -0.045 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -13.176 17.972 0.333 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -11.346 18.355 2.285 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -12.478 17.020 2.373 1.00 0.00 H new ATOM 1317 N GLU A 83 -8.831 17.464 -0.369 1.00 0.00 N ATOM 1318 CA GLU A 83 -7.642 17.916 -1.083 1.00 0.00 C ATOM 1319 C GLU A 83 -6.448 17.019 -0.767 1.00 0.00 C ATOM 1320 O GLU A 83 -5.628 16.732 -1.639 1.00 0.00 O ATOM 1321 CB GLU A 83 -7.319 19.368 -0.724 1.00 0.00 C ATOM 1322 CG GLU A 83 -7.361 19.652 0.769 1.00 0.00 C ATOM 1323 CD GLU A 83 -6.072 20.260 1.286 1.00 0.00 C ATOM 1324 OE1 GLU A 83 -5.700 21.354 0.812 1.00 0.00 O ATOM 1325 OE2 GLU A 83 -5.434 19.642 2.165 1.00 0.00 O ATOM 0 H GLU A 83 -9.232 18.156 0.265 1.00 0.00 H new ATOM 0 HA GLU A 83 -7.847 17.857 -2.152 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.328 19.615 -1.104 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.027 20.024 -1.230 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -8.188 20.329 0.983 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -7.561 18.725 1.306 1.00 0.00 H new ATOM 1332 N MET A 84 -6.361 16.576 0.483 1.00 0.00 N ATOM 1333 CA MET A 84 -5.271 15.707 0.912 1.00 0.00 C ATOM 1334 C MET A 84 -5.624 14.244 0.666 1.00 0.00 C ATOM 1335 O MET A 84 -4.754 13.426 0.365 1.00 0.00 O ATOM 1336 CB MET A 84 -4.964 15.929 2.393 1.00 0.00 C ATOM 1337 CG MET A 84 -3.811 15.082 2.909 1.00 0.00 C ATOM 1338 SD MET A 84 -4.034 14.578 4.626 1.00 0.00 S ATOM 1339 CE MET A 84 -5.590 13.699 4.523 1.00 0.00 C ATOM 0 H MET A 84 -7.032 16.804 1.217 1.00 0.00 H new ATOM 0 HA MET A 84 -4.385 15.956 0.327 1.00 0.00 H new ATOM 0 HB2 MET A 84 -4.731 16.982 2.553 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.857 15.708 2.978 1.00 0.00 H new ATOM 0 HG2 MET A 84 -3.709 14.195 2.284 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.882 15.645 2.817 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.601 12.892 5.256 1.00 0.00 H new ATOM 0 HE2 MET A 84 -6.411 14.387 4.728 1.00 0.00 H new ATOM 0 HE3 MET A 84 -5.707 13.282 3.523 1.00 0.00 H new ATOM 1349 N ILE A 85 -6.906 13.925 0.798 1.00 0.00 N ATOM 1350 CA ILE A 85 -7.385 12.565 0.592 1.00 0.00 C ATOM 1351 C ILE A 85 -7.341 12.188 -0.888 1.00 0.00 C ATOM 1352 O ILE A 85 -7.017 11.055 -1.241 1.00 0.00 O ATOM 1353 CB ILE A 85 -8.825 12.397 1.131 1.00 0.00 C ATOM 1354 CG1 ILE A 85 -8.819 12.413 2.660 1.00 0.00 C ATOM 1355 CG2 ILE A 85 -9.458 11.113 0.613 1.00 0.00 C ATOM 1356 CD1 ILE A 85 -10.081 12.987 3.265 1.00 0.00 C ATOM 0 H ILE A 85 -7.635 14.593 1.048 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.723 11.898 1.144 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.424 13.233 0.772 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -8.682 11.395 3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -7.964 12.994 3.006 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -10.470 11.021 1.008 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -9.495 11.139 -0.476 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -8.863 10.258 0.936 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -10.005 12.966 4.352 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -10.210 14.016 2.930 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.939 12.393 2.950 1.00 0.00 H new ATOM 1368 N ASP A 86 -7.670 13.147 -1.749 1.00 0.00 N ATOM 1369 CA ASP A 86 -7.668 12.917 -3.190 1.00 0.00 C ATOM 1370 C ASP A 86 -6.333 12.343 -3.654 1.00 0.00 C ATOM 1371 O ASP A 86 -6.288 11.306 -4.315 1.00 0.00 O ATOM 1372 CB ASP A 86 -7.961 14.220 -3.937 1.00 0.00 C ATOM 1373 CG ASP A 86 -8.340 13.983 -5.386 1.00 0.00 C ATOM 1374 OD1 ASP A 86 -7.742 13.085 -6.016 1.00 0.00 O ATOM 1375 OD2 ASP A 86 -9.232 14.695 -5.890 1.00 0.00 O ATOM 0 H ASP A 86 -7.941 14.091 -1.473 1.00 0.00 H new ATOM 0 HA ASP A 86 -8.450 12.192 -3.414 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.770 14.750 -3.435 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.083 14.865 -3.895 1.00 0.00 H new ATOM 1380 N GLU A 87 -5.246 13.023 -3.301 1.00 0.00 N ATOM 1381 CA GLU A 87 -3.911 12.576 -3.681 1.00 0.00 C ATOM 1382 C GLU A 87 -3.578 11.243 -3.023 1.00 0.00 C ATOM 1383 O GLU A 87 -3.009 10.353 -3.653 1.00 0.00 O ATOM 1384 CB GLU A 87 -2.866 13.628 -3.296 1.00 0.00 C ATOM 1385 CG GLU A 87 -2.932 14.048 -1.838 1.00 0.00 C ATOM 1386 CD GLU A 87 -1.784 14.955 -1.440 1.00 0.00 C ATOM 1387 OE1 GLU A 87 -0.652 14.448 -1.290 1.00 0.00 O ATOM 1388 OE2 GLU A 87 -2.016 16.171 -1.278 1.00 0.00 O ATOM 0 H GLU A 87 -5.264 13.884 -2.754 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.894 12.441 -4.762 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.872 13.234 -3.507 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -3.000 14.508 -3.925 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.876 14.561 -1.654 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.924 13.159 -1.207 1.00 0.00 H new ATOM 1395 N ARG A 88 -3.945 11.106 -1.754 1.00 0.00 N ATOM 1396 CA ARG A 88 -3.690 9.873 -1.019 1.00 0.00 C ATOM 1397 C ARG A 88 -4.372 8.686 -1.696 1.00 0.00 C ATOM 1398 O ARG A 88 -3.995 7.535 -1.480 1.00 0.00 O ATOM 1399 CB ARG A 88 -4.177 10.006 0.426 1.00 0.00 C ATOM 1400 CG ARG A 88 -3.071 10.362 1.408 1.00 0.00 C ATOM 1401 CD ARG A 88 -3.412 11.608 2.209 1.00 0.00 C ATOM 1402 NE ARG A 88 -3.012 11.486 3.609 1.00 0.00 N ATOM 1403 CZ ARG A 88 -1.761 11.644 4.039 1.00 0.00 C ATOM 1404 NH1 ARG A 88 -0.788 11.930 3.183 1.00 0.00 N ATOM 1405 NH2 ARG A 88 -1.483 11.515 5.329 1.00 0.00 N ATOM 0 H ARG A 88 -4.418 11.831 -1.214 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.615 9.695 -1.015 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.952 10.771 0.471 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.637 9.067 0.734 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.905 9.526 2.088 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -2.139 10.522 0.865 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.917 12.471 1.765 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -4.485 11.792 2.153 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.732 11.267 4.297 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.996 12.030 2.189 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.168 12.050 3.519 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -2.227 11.295 5.991 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.525 11.636 5.659 1.00 0.00 H new ATOM 1419 N ARG A 89 -5.379 8.975 -2.518 1.00 0.00 N ATOM 1420 CA ARG A 89 -6.112 7.933 -3.227 1.00 0.00 C ATOM 1421 C ARG A 89 -5.230 7.254 -4.271 1.00 0.00 C ATOM 1422 O ARG A 89 -5.404 6.072 -4.565 1.00 0.00 O ATOM 1423 CB ARG A 89 -7.356 8.523 -3.896 1.00 0.00 C ATOM 1424 CG ARG A 89 -8.618 7.709 -3.659 1.00 0.00 C ATOM 1425 CD ARG A 89 -9.750 8.574 -3.130 1.00 0.00 C ATOM 1426 NE ARG A 89 -11.007 7.834 -3.035 1.00 0.00 N ATOM 1427 CZ ARG A 89 -12.203 8.413 -2.951 1.00 0.00 C ATOM 1428 NH1 ARG A 89 -12.309 9.737 -2.948 1.00 0.00 N ATOM 1429 NH2 ARG A 89 -13.297 7.668 -2.867 1.00 0.00 N ATOM 0 H ARG A 89 -5.705 9.923 -2.708 1.00 0.00 H new ATOM 0 HA ARG A 89 -6.419 7.182 -2.499 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.512 9.536 -3.525 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -7.179 8.600 -4.969 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -8.926 7.235 -4.591 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -8.408 6.909 -2.949 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.482 8.960 -2.147 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.885 9.435 -3.785 1.00 0.00 H new ATOM 0 HE ARG A 89 -10.965 6.815 -3.033 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -11.471 10.316 -3.010 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -13.228 10.175 -2.883 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -13.222 6.651 -2.867 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -14.213 8.112 -2.803 1.00 0.00 H new ATOM 1443 N ILE A 90 -4.283 8.005 -4.826 1.00 0.00 N ATOM 1444 CA ILE A 90 -3.378 7.460 -5.835 1.00 0.00 C ATOM 1445 C ILE A 90 -1.965 7.310 -5.283 1.00 0.00 C ATOM 1446 O ILE A 90 -1.618 7.905 -4.264 1.00 0.00 O ATOM 1447 CB ILE A 90 -3.335 8.326 -7.115 1.00 0.00 C ATOM 1448 CG1 ILE A 90 -3.430 9.819 -6.783 1.00 0.00 C ATOM 1449 CG2 ILE A 90 -4.455 7.922 -8.062 1.00 0.00 C ATOM 1450 CD1 ILE A 90 -2.146 10.403 -6.232 1.00 0.00 C ATOM 0 H ILE A 90 -4.122 8.986 -4.597 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.772 6.479 -6.099 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.377 8.154 -7.605 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -3.710 10.365 -7.684 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.229 9.971 -6.057 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.413 8.540 -8.959 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.338 6.874 -8.337 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.417 8.063 -7.569 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -2.290 11.463 -6.021 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.875 9.883 -5.313 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.348 10.284 -6.965 1.00 0.00 H new ATOM 1462 N GLY A 91 -1.156 6.503 -5.962 1.00 0.00 N ATOM 1463 CA GLY A 91 0.210 6.280 -5.525 1.00 0.00 C ATOM 1464 C GLY A 91 0.354 5.015 -4.703 1.00 0.00 C ATOM 1465 O GLY A 91 1.401 4.369 -4.722 1.00 0.00 O ATOM 0 H GLY A 91 -1.422 5.999 -6.808 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.862 6.220 -6.396 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.544 7.134 -4.935 1.00 0.00 H new ATOM 1469 N LEU A 92 -0.704 4.659 -3.981 1.00 0.00 N ATOM 1470 CA LEU A 92 -0.695 3.461 -3.148 1.00 0.00 C ATOM 1471 C LEU A 92 -0.910 2.209 -3.993 1.00 0.00 C ATOM 1472 O LEU A 92 -0.204 1.214 -3.836 1.00 0.00 O ATOM 1473 CB LEU A 92 -1.779 3.555 -2.071 1.00 0.00 C ATOM 1474 CG LEU A 92 -1.731 4.819 -1.213 1.00 0.00 C ATOM 1475 CD1 LEU A 92 -3.093 5.095 -0.595 1.00 0.00 C ATOM 1476 CD2 LEU A 92 -0.669 4.688 -0.131 1.00 0.00 C ATOM 0 H LEU A 92 -1.579 5.183 -3.956 1.00 0.00 H new ATOM 0 HA LEU A 92 0.281 3.390 -2.667 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -2.755 3.499 -2.553 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.696 2.687 -1.417 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.467 5.661 -1.853 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.041 5.998 0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.830 5.232 -1.386 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.386 4.253 0.032 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.648 5.597 0.471 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.903 3.836 0.507 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.306 4.538 -0.594 1.00 0.00 H new ATOM 1488 N GLU A 93 -1.889 2.268 -4.890 1.00 0.00 N ATOM 1489 CA GLU A 93 -2.200 1.139 -5.761 1.00 0.00 C ATOM 1490 C GLU A 93 -0.983 0.743 -6.592 1.00 0.00 C ATOM 1491 O GLU A 93 -0.686 -0.441 -6.750 1.00 0.00 O ATOM 1492 CB GLU A 93 -3.371 1.486 -6.681 1.00 0.00 C ATOM 1493 CG GLU A 93 -3.165 2.767 -7.472 1.00 0.00 C ATOM 1494 CD GLU A 93 -4.303 3.047 -8.435 1.00 0.00 C ATOM 1495 OE1 GLU A 93 -5.360 3.533 -7.979 1.00 0.00 O ATOM 1496 OE2 GLU A 93 -4.138 2.780 -9.644 1.00 0.00 O ATOM 0 H GLU A 93 -2.481 3.086 -5.033 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.480 0.293 -5.133 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.533 0.662 -7.376 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.277 1.580 -6.082 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -3.064 3.604 -6.781 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.231 2.699 -8.029 1.00 0.00 H new ATOM 1503 N ARG A 94 -0.283 1.742 -7.119 1.00 0.00 N ATOM 1504 CA ARG A 94 0.903 1.496 -7.933 1.00 0.00 C ATOM 1505 C ARG A 94 2.027 0.910 -7.085 1.00 0.00 C ATOM 1506 O ARG A 94 2.813 0.090 -7.560 1.00 0.00 O ATOM 1507 CB ARG A 94 1.370 2.794 -8.594 1.00 0.00 C ATOM 1508 CG ARG A 94 0.249 3.578 -9.257 1.00 0.00 C ATOM 1509 CD ARG A 94 0.792 4.727 -10.090 1.00 0.00 C ATOM 1510 NE ARG A 94 1.560 5.673 -9.283 1.00 0.00 N ATOM 1511 CZ ARG A 94 2.486 6.492 -9.777 1.00 0.00 C ATOM 1512 NH1 ARG A 94 2.761 6.492 -11.076 1.00 0.00 N ATOM 1513 NH2 ARG A 94 3.137 7.317 -8.970 1.00 0.00 N ATOM 0 H ARG A 94 -0.515 2.728 -6.998 1.00 0.00 H new ATOM 0 HA ARG A 94 0.642 0.776 -8.709 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.847 3.423 -7.842 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.128 2.559 -9.341 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.337 2.912 -9.891 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.425 3.967 -8.494 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.424 4.331 -10.885 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.035 5.249 -10.571 1.00 0.00 H new ATOM 0 HE ARG A 94 1.375 5.708 -8.280 1.00 0.00 H new ATOM 0 HH11 ARG A 94 2.261 5.861 -11.703 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.472 7.123 -11.447 1.00 0.00 H new ATOM 0 HH21 ARG A 94 2.928 7.324 -7.972 1.00 0.00 H new ATOM 0 HH22 ARG A 94 3.847 7.945 -9.347 1.00 0.00 H new ATOM 1527 N PHE A 95 2.094 1.336 -5.829 1.00 0.00 N ATOM 1528 CA PHE A 95 3.121 0.855 -4.910 1.00 0.00 C ATOM 1529 C PHE A 95 3.062 -0.664 -4.777 1.00 0.00 C ATOM 1530 O PHE A 95 4.093 -1.327 -4.650 1.00 0.00 O ATOM 1531 CB PHE A 95 2.947 1.508 -3.537 1.00 0.00 C ATOM 1532 CG PHE A 95 4.006 1.120 -2.544 1.00 0.00 C ATOM 1533 CD1 PHE A 95 5.174 1.857 -2.431 1.00 0.00 C ATOM 1534 CD2 PHE A 95 3.830 0.020 -1.719 1.00 0.00 C ATOM 1535 CE1 PHE A 95 6.147 1.503 -1.515 1.00 0.00 C ATOM 1536 CE2 PHE A 95 4.798 -0.338 -0.801 1.00 0.00 C ATOM 1537 CZ PHE A 95 5.959 0.404 -0.699 1.00 0.00 C ATOM 0 H PHE A 95 1.449 2.014 -5.423 1.00 0.00 H new ATOM 0 HA PHE A 95 4.096 1.127 -5.314 1.00 0.00 H new ATOM 0 HB2 PHE A 95 2.953 2.591 -3.657 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.970 1.237 -3.137 1.00 0.00 H new ATOM 0 HD1 PHE A 95 5.326 2.718 -3.066 1.00 0.00 H new ATOM 0 HD2 PHE A 95 2.925 -0.564 -1.795 1.00 0.00 H new ATOM 0 HE1 PHE A 95 7.053 2.085 -1.437 1.00 0.00 H new ATOM 0 HE2 PHE A 95 4.648 -1.197 -0.164 1.00 0.00 H new ATOM 0 HZ PHE A 95 6.718 0.126 0.017 1.00 0.00 H new ATOM 1547 N LEU A 96 1.850 -1.210 -4.805 1.00 0.00 N ATOM 1548 CA LEU A 96 1.656 -2.651 -4.686 1.00 0.00 C ATOM 1549 C LEU A 96 1.733 -3.332 -6.050 1.00 0.00 C ATOM 1550 O LEU A 96 2.236 -4.448 -6.170 1.00 0.00 O ATOM 1551 CB LEU A 96 0.308 -2.955 -4.031 1.00 0.00 C ATOM 1552 CG LEU A 96 -0.088 -2.014 -2.893 1.00 0.00 C ATOM 1553 CD1 LEU A 96 -1.577 -2.125 -2.603 1.00 0.00 C ATOM 1554 CD2 LEU A 96 0.724 -2.320 -1.643 1.00 0.00 C ATOM 0 H LEU A 96 0.987 -0.676 -4.909 1.00 0.00 H new ATOM 0 HA LEU A 96 2.456 -3.044 -4.059 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.467 -2.919 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.330 -3.975 -3.647 1.00 0.00 H new ATOM 0 HG LEU A 96 0.126 -0.991 -3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.841 -1.448 -1.790 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.142 -1.858 -3.496 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.816 -3.149 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.430 -1.641 -0.843 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.540 -3.349 -1.332 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.785 -2.190 -1.857 1.00 0.00 H new ATOM 1566 N ASN A 97 1.224 -2.656 -7.076 1.00 0.00 N ATOM 1567 CA ASN A 97 1.227 -3.200 -8.431 1.00 0.00 C ATOM 1568 C ASN A 97 2.621 -3.672 -8.836 1.00 0.00 C ATOM 1569 O ASN A 97 2.824 -4.848 -9.135 1.00 0.00 O ATOM 1570 CB ASN A 97 0.725 -2.150 -9.423 1.00 0.00 C ATOM 1571 CG ASN A 97 -0.780 -1.974 -9.368 1.00 0.00 C ATOM 1572 OD1 ASN A 97 -1.512 -2.896 -9.006 1.00 0.00 O ATOM 1573 ND2 ASN A 97 -1.251 -0.786 -9.727 1.00 0.00 N ATOM 0 H ASN A 97 0.804 -1.730 -6.995 1.00 0.00 H new ATOM 0 HA ASN A 97 0.558 -4.061 -8.447 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.207 -1.196 -9.212 1.00 0.00 H new ATOM 0 HB3 ASN A 97 1.017 -2.439 -10.432 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.255 -0.609 -9.709 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.609 -0.050 -10.020 1.00 0.00 H new ATOM 1580 N GLU A 98 3.576 -2.749 -8.849 1.00 0.00 N ATOM 1581 CA GLU A 98 4.949 -3.072 -9.225 1.00 0.00 C ATOM 1582 C GLU A 98 5.582 -4.050 -8.237 1.00 0.00 C ATOM 1583 O GLU A 98 6.534 -4.752 -8.574 1.00 0.00 O ATOM 1584 CB GLU A 98 5.789 -1.795 -9.309 1.00 0.00 C ATOM 1585 CG GLU A 98 7.245 -2.044 -9.670 1.00 0.00 C ATOM 1586 CD GLU A 98 7.769 -1.059 -10.696 1.00 0.00 C ATOM 1587 OE1 GLU A 98 7.055 -0.798 -11.687 1.00 0.00 O ATOM 1588 OE2 GLU A 98 8.893 -0.547 -10.507 1.00 0.00 O ATOM 0 H GLU A 98 3.426 -1.770 -8.604 1.00 0.00 H new ATOM 0 HA GLU A 98 4.923 -3.551 -10.204 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.349 -1.129 -10.051 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.745 -1.278 -8.351 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.854 -1.982 -8.768 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.351 -3.057 -10.058 1.00 0.00 H new ATOM 1595 N LEU A 99 5.053 -4.091 -7.016 1.00 0.00 N ATOM 1596 CA LEU A 99 5.580 -4.984 -5.991 1.00 0.00 C ATOM 1597 C LEU A 99 5.054 -6.405 -6.165 1.00 0.00 C ATOM 1598 O LEU A 99 5.826 -7.343 -6.361 1.00 0.00 O ATOM 1599 CB LEU A 99 5.220 -4.473 -4.601 1.00 0.00 C ATOM 1600 CG LEU A 99 5.925 -5.205 -3.462 1.00 0.00 C ATOM 1601 CD1 LEU A 99 6.334 -4.231 -2.374 1.00 0.00 C ATOM 1602 CD2 LEU A 99 5.031 -6.298 -2.905 1.00 0.00 C ATOM 0 H LEU A 99 4.264 -3.519 -6.715 1.00 0.00 H new ATOM 0 HA LEU A 99 6.664 -5.002 -6.100 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.464 -3.412 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.142 -4.561 -4.462 1.00 0.00 H new ATOM 0 HG LEU A 99 6.830 -5.670 -3.854 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.835 -4.772 -1.571 1.00 0.00 H new ATOM 0 HD12 LEU A 99 7.013 -3.486 -2.789 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.448 -3.734 -1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.547 -6.812 -2.094 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.109 -5.856 -2.527 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.795 -7.012 -3.694 1.00 0.00 H new ATOM 1614 N TYR A 100 3.738 -6.558 -6.087 1.00 0.00 N ATOM 1615 CA TYR A 100 3.110 -7.866 -6.228 1.00 0.00 C ATOM 1616 C TYR A 100 3.290 -8.415 -7.640 1.00 0.00 C ATOM 1617 O TYR A 100 3.265 -9.628 -7.850 1.00 0.00 O ATOM 1618 CB TYR A 100 1.624 -7.780 -5.877 1.00 0.00 C ATOM 1619 CG TYR A 100 1.367 -7.664 -4.390 1.00 0.00 C ATOM 1620 CD1 TYR A 100 1.499 -6.445 -3.737 1.00 0.00 C ATOM 1621 CD2 TYR A 100 0.999 -8.774 -3.641 1.00 0.00 C ATOM 1622 CE1 TYR A 100 1.271 -6.336 -2.377 1.00 0.00 C ATOM 1623 CE2 TYR A 100 0.768 -8.672 -2.282 1.00 0.00 C ATOM 1624 CZ TYR A 100 0.906 -7.452 -1.655 1.00 0.00 C ATOM 1625 OH TYR A 100 0.678 -7.348 -0.303 1.00 0.00 O ATOM 0 H TYR A 100 3.084 -5.792 -5.927 1.00 0.00 H new ATOM 0 HA TYR A 100 3.599 -8.552 -5.536 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.187 -6.919 -6.383 1.00 0.00 H new ATOM 0 HB3 TYR A 100 1.116 -8.665 -6.259 1.00 0.00 H new ATOM 0 HD1 TYR A 100 1.784 -5.569 -4.300 1.00 0.00 H new ATOM 0 HD2 TYR A 100 0.892 -9.732 -4.128 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.378 -5.381 -1.883 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.481 -9.544 -1.714 1.00 0.00 H new ATOM 0 HH TYR A 100 1.384 -7.821 0.185 1.00 0.00 H new ATOM 1635 N ASN A 101 3.480 -7.520 -8.606 1.00 0.00 N ATOM 1636 CA ASN A 101 3.674 -7.928 -9.992 1.00 0.00 C ATOM 1637 C ASN A 101 5.150 -8.186 -10.274 1.00 0.00 C ATOM 1638 O ASN A 101 5.735 -7.600 -11.186 1.00 0.00 O ATOM 1639 CB ASN A 101 3.137 -6.856 -10.943 1.00 0.00 C ATOM 1640 CG ASN A 101 2.905 -7.390 -12.343 1.00 0.00 C ATOM 1641 OD1 ASN A 101 1.768 -7.636 -12.746 1.00 0.00 O ATOM 1642 ND2 ASN A 101 3.985 -7.572 -13.093 1.00 0.00 N ATOM 0 H ASN A 101 3.504 -6.512 -8.454 1.00 0.00 H new ATOM 0 HA ASN A 101 3.122 -8.853 -10.157 1.00 0.00 H new ATOM 0 HB2 ASN A 101 2.201 -6.460 -10.548 1.00 0.00 H new ATOM 0 HB3 ASN A 101 3.842 -6.026 -10.986 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.891 -7.929 -14.044 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.909 -7.355 -12.718 1.00 0.00 H new ATOM 1649 N ASP A 102 5.749 -9.064 -9.477 1.00 0.00 N ATOM 1650 CA ASP A 102 7.160 -9.402 -9.629 1.00 0.00 C ATOM 1651 C ASP A 102 7.440 -9.994 -11.007 1.00 0.00 C ATOM 1652 O ASP A 102 6.578 -10.637 -11.605 1.00 0.00 O ATOM 1653 CB ASP A 102 7.584 -10.393 -8.545 1.00 0.00 C ATOM 1654 CG ASP A 102 6.658 -11.592 -8.465 1.00 0.00 C ATOM 1655 OD1 ASP A 102 5.559 -11.454 -7.887 1.00 0.00 O ATOM 1656 OD2 ASP A 102 7.032 -12.666 -8.980 1.00 0.00 O ATOM 0 H ASP A 102 5.278 -9.556 -8.717 1.00 0.00 H new ATOM 0 HA ASP A 102 7.738 -8.484 -9.526 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.600 -10.734 -8.745 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.602 -9.886 -7.580 1.00 0.00 H new ATOM 1661 N ARG A 103 8.654 -9.772 -11.500 1.00 0.00 N ATOM 1662 CA ARG A 103 9.057 -10.285 -12.804 1.00 0.00 C ATOM 1663 C ARG A 103 10.146 -11.342 -12.652 1.00 0.00 C ATOM 1664 O ARG A 103 9.939 -12.512 -12.973 1.00 0.00 O ATOM 1665 CB ARG A 103 9.558 -9.145 -13.692 1.00 0.00 C ATOM 1666 CG ARG A 103 8.465 -8.178 -14.117 1.00 0.00 C ATOM 1667 CD ARG A 103 9.046 -6.887 -14.673 1.00 0.00 C ATOM 1668 NE ARG A 103 8.439 -6.519 -15.950 1.00 0.00 N ATOM 1669 CZ ARG A 103 8.984 -5.660 -16.808 1.00 0.00 C ATOM 1670 NH1 ARG A 103 10.145 -5.079 -16.531 1.00 0.00 N ATOM 1671 NH2 ARG A 103 8.366 -5.380 -17.949 1.00 0.00 N ATOM 0 H ARG A 103 9.377 -9.240 -11.015 1.00 0.00 H new ATOM 0 HA ARG A 103 8.187 -10.744 -13.274 1.00 0.00 H new ATOM 0 HB2 ARG A 103 10.332 -8.593 -13.158 1.00 0.00 H new ATOM 0 HB3 ARG A 103 10.024 -9.567 -14.582 1.00 0.00 H new ATOM 0 HG2 ARG A 103 7.835 -8.649 -14.871 1.00 0.00 H new ATOM 0 HG3 ARG A 103 7.826 -7.952 -13.263 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.894 -6.082 -13.954 1.00 0.00 H new ATOM 0 HD3 ARG A 103 10.122 -7.000 -14.802 1.00 0.00 H new ATOM 0 HE ARG A 103 7.546 -6.945 -16.198 1.00 0.00 H new ATOM 0 HH11 ARG A 103 10.625 -5.290 -15.656 1.00 0.00 H new ATOM 0 HH12 ARG A 103 10.557 -4.422 -17.193 1.00 0.00 H new ATOM 0 HH21 ARG A 103 7.474 -5.823 -18.168 1.00 0.00 H new ATOM 0 HH22 ARG A 103 8.783 -4.722 -18.607 1.00 0.00 H new ATOM 1685 N PHE A 104 11.304 -10.918 -12.159 1.00 0.00 N ATOM 1686 CA PHE A 104 12.431 -11.825 -11.961 1.00 0.00 C ATOM 1687 C PHE A 104 12.765 -11.967 -10.478 1.00 0.00 C ATOM 1688 O PHE A 104 13.299 -12.990 -10.049 1.00 0.00 O ATOM 1689 CB PHE A 104 13.657 -11.321 -12.725 1.00 0.00 C ATOM 1690 CG PHE A 104 13.630 -11.654 -14.189 1.00 0.00 C ATOM 1691 CD1 PHE A 104 12.852 -10.918 -15.067 1.00 0.00 C ATOM 1692 CD2 PHE A 104 14.384 -12.706 -14.686 1.00 0.00 C ATOM 1693 CE1 PHE A 104 12.827 -11.223 -16.415 1.00 0.00 C ATOM 1694 CE2 PHE A 104 14.362 -13.016 -16.033 1.00 0.00 C ATOM 1695 CZ PHE A 104 13.582 -12.273 -16.898 1.00 0.00 C ATOM 0 H PHE A 104 11.488 -9.952 -11.889 1.00 0.00 H new ATOM 0 HA PHE A 104 12.147 -12.805 -12.345 1.00 0.00 H new ATOM 0 HB2 PHE A 104 13.729 -10.240 -12.608 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.554 -11.750 -12.279 1.00 0.00 H new ATOM 0 HD1 PHE A 104 12.258 -10.097 -14.694 1.00 0.00 H new ATOM 0 HD2 PHE A 104 14.995 -13.290 -14.013 1.00 0.00 H new ATOM 0 HE1 PHE A 104 12.217 -10.640 -17.090 1.00 0.00 H new ATOM 0 HE2 PHE A 104 14.954 -13.838 -16.409 1.00 0.00 H new ATOM 0 HZ PHE A 104 13.563 -12.513 -17.951 1.00 0.00 H new ATOM 1705 N ASP A 105 12.450 -10.935 -9.700 1.00 0.00 N ATOM 1706 CA ASP A 105 12.720 -10.949 -8.266 1.00 0.00 C ATOM 1707 C ASP A 105 11.471 -10.579 -7.472 1.00 0.00 C ATOM 1708 O ASP A 105 10.969 -9.459 -7.570 1.00 0.00 O ATOM 1709 CB ASP A 105 13.855 -9.978 -7.933 1.00 0.00 C ATOM 1710 CG ASP A 105 15.217 -10.642 -7.976 1.00 0.00 C ATOM 1711 OD1 ASP A 105 15.332 -11.794 -7.506 1.00 0.00 O ATOM 1712 OD2 ASP A 105 16.169 -10.011 -8.481 1.00 0.00 O ATOM 0 H ASP A 105 12.008 -10.080 -10.038 1.00 0.00 H new ATOM 0 HA ASP A 105 13.019 -11.960 -7.987 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.837 -9.147 -8.638 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.690 -9.558 -6.941 1.00 0.00 H new ATOM 1717 N SER A 106 10.976 -11.529 -6.685 1.00 0.00 N ATOM 1718 CA SER A 106 9.787 -11.302 -5.871 1.00 0.00 C ATOM 1719 C SER A 106 10.163 -10.968 -4.430 1.00 0.00 C ATOM 1720 O SER A 106 9.347 -11.103 -3.520 1.00 0.00 O ATOM 1721 CB SER A 106 8.889 -12.538 -5.894 1.00 0.00 C ATOM 1722 OG SER A 106 9.639 -13.712 -6.152 1.00 0.00 O ATOM 0 H SER A 106 11.379 -12.462 -6.594 1.00 0.00 H new ATOM 0 HA SER A 106 9.248 -10.454 -6.293 1.00 0.00 H new ATOM 0 HB2 SER A 106 8.375 -12.635 -4.938 1.00 0.00 H new ATOM 0 HB3 SER A 106 8.121 -12.419 -6.658 1.00 0.00 H new ATOM 0 HG SER A 106 9.040 -14.488 -6.159 1.00 0.00 H new ATOM 1728 N ARG A 107 11.403 -10.535 -4.229 1.00 0.00 N ATOM 1729 CA ARG A 107 11.889 -10.183 -2.899 1.00 0.00 C ATOM 1730 C ARG A 107 10.934 -9.223 -2.194 1.00 0.00 C ATOM 1731 O ARG A 107 10.667 -9.359 -0.999 1.00 0.00 O ATOM 1732 CB ARG A 107 13.274 -9.545 -3.004 1.00 0.00 C ATOM 1733 CG ARG A 107 13.348 -8.433 -4.038 1.00 0.00 C ATOM 1734 CD ARG A 107 14.641 -8.494 -4.834 1.00 0.00 C ATOM 1735 NE ARG A 107 15.765 -7.932 -4.091 1.00 0.00 N ATOM 1736 CZ ARG A 107 16.929 -7.602 -4.646 1.00 0.00 C ATOM 1737 NH1 ARG A 107 17.126 -7.778 -5.947 1.00 0.00 N ATOM 1738 NH2 ARG A 107 17.899 -7.095 -3.898 1.00 0.00 N ATOM 0 H ARG A 107 12.092 -10.419 -4.972 1.00 0.00 H new ATOM 0 HA ARG A 107 11.949 -11.098 -2.310 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.557 -9.145 -2.030 1.00 0.00 H new ATOM 0 HB3 ARG A 107 14.003 -10.315 -3.256 1.00 0.00 H new ATOM 0 HG2 ARG A 107 12.498 -8.509 -4.717 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.272 -7.467 -3.540 1.00 0.00 H new ATOM 0 HD2 ARG A 107 14.859 -9.530 -5.093 1.00 0.00 H new ATOM 0 HD3 ARG A 107 14.517 -7.950 -5.771 1.00 0.00 H new ATOM 0 HE ARG A 107 15.652 -7.784 -3.088 1.00 0.00 H new ATOM 0 HH11 ARG A 107 16.383 -8.168 -6.527 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.020 -7.523 -6.366 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.753 -6.958 -2.898 1.00 0.00 H new ATOM 0 HH22 ARG A 107 18.791 -6.842 -4.323 1.00 0.00 H new ATOM 1752 N TRP A 108 10.438 -8.243 -2.939 1.00 0.00 N ATOM 1753 CA TRP A 108 9.530 -7.243 -2.390 1.00 0.00 C ATOM 1754 C TRP A 108 8.142 -7.817 -2.109 1.00 0.00 C ATOM 1755 O TRP A 108 7.467 -7.383 -1.176 1.00 0.00 O ATOM 1756 CB TRP A 108 9.423 -6.054 -3.345 1.00 0.00 C ATOM 1757 CG TRP A 108 10.756 -5.542 -3.795 1.00 0.00 C ATOM 1758 CD1 TRP A 108 11.405 -5.853 -4.955 1.00 0.00 C ATOM 1759 CD2 TRP A 108 11.606 -4.631 -3.090 1.00 0.00 C ATOM 1760 NE1 TRP A 108 12.608 -5.192 -5.014 1.00 0.00 N ATOM 1761 CE2 TRP A 108 12.754 -4.434 -3.882 1.00 0.00 C ATOM 1762 CE3 TRP A 108 11.510 -3.962 -1.867 1.00 0.00 C ATOM 1763 CZ2 TRP A 108 13.795 -3.596 -3.489 1.00 0.00 C ATOM 1764 CZ3 TRP A 108 12.543 -3.131 -1.478 1.00 0.00 C ATOM 1765 CH2 TRP A 108 13.673 -2.954 -2.286 1.00 0.00 C ATOM 0 H TRP A 108 10.650 -8.119 -3.929 1.00 0.00 H new ATOM 0 HA TRP A 108 9.944 -6.912 -1.438 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.840 -6.348 -4.218 1.00 0.00 H new ATOM 0 HB3 TRP A 108 8.878 -5.248 -2.853 1.00 0.00 H new ATOM 0 HD1 TRP A 108 11.028 -6.521 -5.715 1.00 0.00 H new ATOM 0 HE1 TRP A 108 13.283 -5.255 -5.776 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.643 -4.092 -1.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 14.667 -3.458 -4.111 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 12.478 -2.609 -0.535 1.00 0.00 H new ATOM 0 HH2 TRP A 108 14.464 -2.298 -1.954 1.00 0.00 H new ATOM 1776 N ARG A 109 7.709 -8.787 -2.913 1.00 0.00 N ATOM 1777 CA ARG A 109 6.394 -9.389 -2.722 1.00 0.00 C ATOM 1778 C ARG A 109 6.487 -10.709 -1.956 1.00 0.00 C ATOM 1779 O ARG A 109 5.477 -11.374 -1.729 1.00 0.00 O ATOM 1780 CB ARG A 109 5.703 -9.609 -4.069 1.00 0.00 C ATOM 1781 CG ARG A 109 6.440 -10.568 -4.989 1.00 0.00 C ATOM 1782 CD ARG A 109 5.960 -11.998 -4.804 1.00 0.00 C ATOM 1783 NE ARG A 109 4.530 -12.140 -5.072 1.00 0.00 N ATOM 1784 CZ ARG A 109 3.922 -13.311 -5.251 1.00 0.00 C ATOM 1785 NH1 ARG A 109 4.615 -14.442 -5.187 1.00 0.00 N ATOM 1786 NH2 ARG A 109 2.619 -13.352 -5.493 1.00 0.00 N ATOM 0 H ARG A 109 8.244 -9.168 -3.694 1.00 0.00 H new ATOM 0 HA ARG A 109 5.799 -8.696 -2.127 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.697 -9.991 -3.892 1.00 0.00 H new ATOM 0 HB3 ARG A 109 5.595 -8.648 -4.572 1.00 0.00 H new ATOM 0 HG2 ARG A 109 6.292 -10.265 -6.026 1.00 0.00 H new ATOM 0 HG3 ARG A 109 7.510 -10.514 -4.790 1.00 0.00 H new ATOM 0 HD2 ARG A 109 6.520 -12.656 -5.469 1.00 0.00 H new ATOM 0 HD3 ARG A 109 6.171 -12.321 -3.784 1.00 0.00 H new ATOM 0 HE ARG A 109 3.965 -11.292 -5.125 1.00 0.00 H new ATOM 0 HH11 ARG A 109 5.617 -14.416 -5.000 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.145 -15.337 -5.325 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.082 -12.486 -5.542 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.154 -14.249 -5.630 1.00 0.00 H new ATOM 1800 N ASP A 110 7.700 -11.082 -1.553 1.00 0.00 N ATOM 1801 CA ASP A 110 7.907 -12.317 -0.808 1.00 0.00 C ATOM 1802 C ASP A 110 8.015 -12.033 0.686 1.00 0.00 C ATOM 1803 O ASP A 110 7.701 -12.888 1.515 1.00 0.00 O ATOM 1804 CB ASP A 110 9.169 -13.030 -1.296 1.00 0.00 C ATOM 1805 CG ASP A 110 9.217 -14.483 -0.862 1.00 0.00 C ATOM 1806 OD1 ASP A 110 9.593 -14.743 0.300 1.00 0.00 O ATOM 1807 OD2 ASP A 110 8.876 -15.359 -1.684 1.00 0.00 O ATOM 0 H ASP A 110 8.550 -10.547 -1.730 1.00 0.00 H new ATOM 0 HA ASP A 110 7.047 -12.965 -0.979 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.215 -12.977 -2.384 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.048 -12.510 -0.914 1.00 0.00 H new ATOM 1812 N THR A 111 8.459 -10.825 1.024 1.00 0.00 N ATOM 1813 CA THR A 111 8.610 -10.419 2.415 1.00 0.00 C ATOM 1814 C THR A 111 7.347 -10.720 3.221 1.00 0.00 C ATOM 1815 O THR A 111 6.231 -10.571 2.724 1.00 0.00 O ATOM 1816 CB THR A 111 8.929 -8.926 2.491 1.00 0.00 C ATOM 1817 OG1 THR A 111 9.196 -8.401 1.201 1.00 0.00 O ATOM 1818 CG2 THR A 111 10.123 -8.618 3.364 1.00 0.00 C ATOM 0 H THR A 111 8.721 -10.108 0.348 1.00 0.00 H new ATOM 0 HA THR A 111 9.432 -10.990 2.846 1.00 0.00 H new ATOM 0 HB THR A 111 8.045 -8.463 2.929 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.352 -8.168 0.762 1.00 0.00 H new ATOM 0 HG21 THR A 111 10.297 -7.542 3.376 1.00 0.00 H new ATOM 0 HG22 THR A 111 9.931 -8.966 4.379 1.00 0.00 H new ATOM 0 HG23 THR A 111 11.004 -9.123 2.968 1.00 0.00 H new ATOM 1826 N LYS A 112 7.534 -11.142 4.467 1.00 0.00 N ATOM 1827 CA LYS A 112 6.412 -11.461 5.342 1.00 0.00 C ATOM 1828 C LYS A 112 5.535 -10.232 5.565 1.00 0.00 C ATOM 1829 O LYS A 112 4.327 -10.349 5.772 1.00 0.00 O ATOM 1830 CB LYS A 112 6.918 -11.990 6.685 1.00 0.00 C ATOM 1831 CG LYS A 112 7.726 -10.973 7.474 1.00 0.00 C ATOM 1832 CD LYS A 112 8.316 -11.587 8.733 1.00 0.00 C ATOM 1833 CE LYS A 112 7.270 -11.718 9.829 1.00 0.00 C ATOM 1834 NZ LYS A 112 7.567 -12.850 10.749 1.00 0.00 N ATOM 0 H LYS A 112 8.452 -11.271 4.893 1.00 0.00 H new ATOM 0 HA LYS A 112 5.813 -12.233 4.859 1.00 0.00 H new ATOM 0 HB2 LYS A 112 6.066 -12.309 7.285 1.00 0.00 H new ATOM 0 HB3 LYS A 112 7.533 -12.873 6.510 1.00 0.00 H new ATOM 0 HG2 LYS A 112 8.528 -10.580 6.849 1.00 0.00 H new ATOM 0 HG3 LYS A 112 7.089 -10.130 7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 112 8.728 -12.569 8.502 1.00 0.00 H new ATOM 0 HD3 LYS A 112 9.142 -10.970 9.088 1.00 0.00 H new ATOM 0 HE2 LYS A 112 7.223 -10.790 10.399 1.00 0.00 H new ATOM 0 HE3 LYS A 112 6.289 -11.865 9.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.830 -12.905 11.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.586 -13.739 10.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 8.492 -12.698 11.199 1.00 0.00 H new ATOM 1848 N ILE A 113 6.152 -9.056 5.521 1.00 0.00 N ATOM 1849 CA ILE A 113 5.429 -7.805 5.718 1.00 0.00 C ATOM 1850 C ILE A 113 4.477 -7.533 4.559 1.00 0.00 C ATOM 1851 O ILE A 113 3.357 -7.062 4.760 1.00 0.00 O ATOM 1852 CB ILE A 113 6.395 -6.614 5.867 1.00 0.00 C ATOM 1853 CG1 ILE A 113 7.264 -6.469 4.618 1.00 0.00 C ATOM 1854 CG2 ILE A 113 7.269 -6.787 7.100 1.00 0.00 C ATOM 1855 CD1 ILE A 113 8.231 -5.308 4.685 1.00 0.00 C ATOM 0 H ILE A 113 7.151 -8.943 5.351 1.00 0.00 H new ATOM 0 HA ILE A 113 4.855 -7.913 6.638 1.00 0.00 H new ATOM 0 HB ILE A 113 5.803 -5.706 5.985 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.826 -7.391 4.467 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.618 -6.344 3.749 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.945 -5.937 7.189 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.639 -6.844 7.988 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.850 -7.704 7.008 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.814 -5.267 3.765 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.675 -4.378 4.804 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.901 -5.441 5.534 1.00 0.00 H new ATOM 1867 N ALA A 114 4.927 -7.834 3.345 1.00 0.00 N ATOM 1868 CA ALA A 114 4.113 -7.622 2.155 1.00 0.00 C ATOM 1869 C ALA A 114 2.924 -8.576 2.130 1.00 0.00 C ATOM 1870 O ALA A 114 1.803 -8.180 1.811 1.00 0.00 O ATOM 1871 CB ALA A 114 4.956 -7.792 0.898 1.00 0.00 C ATOM 0 H ALA A 114 5.851 -8.225 3.160 1.00 0.00 H new ATOM 0 HA ALA A 114 3.729 -6.602 2.184 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.334 -7.631 0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 114 5.770 -7.067 0.905 1.00 0.00 H new ATOM 0 HB3 ALA A 114 5.369 -8.800 0.870 1.00 0.00 H new ATOM 1877 N GLN A 115 3.177 -9.835 2.471 1.00 0.00 N ATOM 1878 CA GLN A 115 2.127 -10.846 2.491 1.00 0.00 C ATOM 1879 C GLN A 115 1.129 -10.570 3.610 1.00 0.00 C ATOM 1880 O GLN A 115 -0.058 -10.867 3.483 1.00 0.00 O ATOM 1881 CB GLN A 115 2.733 -12.239 2.666 1.00 0.00 C ATOM 1882 CG GLN A 115 3.371 -12.789 1.401 1.00 0.00 C ATOM 1883 CD GLN A 115 2.416 -12.796 0.224 1.00 0.00 C ATOM 1884 OE1 GLN A 115 1.449 -13.558 0.198 1.00 0.00 O ATOM 1885 NE2 GLN A 115 2.682 -11.945 -0.760 1.00 0.00 N ATOM 0 H GLN A 115 4.100 -10.179 2.737 1.00 0.00 H new ATOM 0 HA GLN A 115 1.600 -10.804 1.538 1.00 0.00 H new ATOM 0 HB2 GLN A 115 3.484 -12.203 3.455 1.00 0.00 H new ATOM 0 HB3 GLN A 115 1.954 -12.926 2.998 1.00 0.00 H new ATOM 0 HG2 GLN A 115 4.247 -12.191 1.150 1.00 0.00 H new ATOM 0 HG3 GLN A 115 3.721 -13.804 1.587 1.00 0.00 H new ATOM 0 HE21 GLN A 115 3.494 -11.331 -0.698 1.00 0.00 H new ATOM 0 HE22 GLN A 115 2.074 -11.905 -1.578 1.00 0.00 H new ATOM 1894 N ASP A 116 1.619 -9.997 4.704 1.00 0.00 N ATOM 1895 CA ASP A 116 0.769 -9.678 5.846 1.00 0.00 C ATOM 1896 C ASP A 116 0.019 -8.367 5.626 1.00 0.00 C ATOM 1897 O ASP A 116 -0.999 -8.109 6.268 1.00 0.00 O ATOM 1898 CB ASP A 116 1.610 -9.590 7.122 1.00 0.00 C ATOM 1899 CG ASP A 116 0.802 -9.889 8.369 1.00 0.00 C ATOM 1900 OD1 ASP A 116 -0.096 -10.755 8.303 1.00 0.00 O ATOM 1901 OD2 ASP A 116 1.067 -9.256 9.414 1.00 0.00 O ATOM 0 H ASP A 116 2.600 -9.744 4.824 1.00 0.00 H new ATOM 0 HA ASP A 116 0.035 -10.477 5.953 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.442 -10.291 7.055 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.040 -8.592 7.202 1.00 0.00 H new ATOM 1906 N PHE A 117 0.529 -7.538 4.717 1.00 0.00 N ATOM 1907 CA PHE A 117 -0.091 -6.252 4.416 1.00 0.00 C ATOM 1908 C PHE A 117 -1.578 -6.410 4.106 1.00 0.00 C ATOM 1909 O PHE A 117 -2.409 -5.653 4.608 1.00 0.00 O ATOM 1910 CB PHE A 117 0.617 -5.592 3.232 1.00 0.00 C ATOM 1911 CG PHE A 117 0.349 -4.119 3.120 1.00 0.00 C ATOM 1912 CD1 PHE A 117 0.841 -3.240 4.071 1.00 0.00 C ATOM 1913 CD2 PHE A 117 -0.393 -3.614 2.065 1.00 0.00 C ATOM 1914 CE1 PHE A 117 0.597 -1.883 3.972 1.00 0.00 C ATOM 1915 CE2 PHE A 117 -0.640 -2.259 1.960 1.00 0.00 C ATOM 1916 CZ PHE A 117 -0.145 -1.391 2.914 1.00 0.00 C ATOM 0 H PHE A 117 1.371 -7.736 4.176 1.00 0.00 H new ATOM 0 HA PHE A 117 0.007 -5.619 5.298 1.00 0.00 H new ATOM 0 HB2 PHE A 117 1.691 -5.752 3.326 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.301 -6.082 2.311 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.422 -3.619 4.899 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.783 -4.287 1.316 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.985 -1.208 4.720 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -1.220 -1.878 1.132 1.00 0.00 H new ATOM 0 HZ PHE A 117 -0.337 -0.331 2.834 1.00 0.00 H new ATOM 1926 N LEU A 118 -1.907 -7.395 3.276 1.00 0.00 N ATOM 1927 CA LEU A 118 -3.294 -7.644 2.899 1.00 0.00 C ATOM 1928 C LEU A 118 -3.817 -8.930 3.534 1.00 0.00 C ATOM 1929 O LEU A 118 -4.720 -9.574 3.000 1.00 0.00 O ATOM 1930 CB LEU A 118 -3.425 -7.725 1.376 1.00 0.00 C ATOM 1931 CG LEU A 118 -2.848 -6.533 0.603 1.00 0.00 C ATOM 1932 CD1 LEU A 118 -3.307 -6.567 -0.845 1.00 0.00 C ATOM 1933 CD2 LEU A 118 -3.252 -5.219 1.259 1.00 0.00 C ATOM 0 H LEU A 118 -1.233 -8.033 2.852 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.894 -6.812 3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.929 -8.633 1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.481 -7.824 1.124 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.761 -6.606 0.624 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.889 -5.714 -1.379 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.967 -7.491 -1.313 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.395 -6.520 -0.883 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.832 -4.386 0.695 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.339 -5.138 1.271 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.875 -5.191 2.281 1.00 0.00 H new ATOM 1945 N GLN A 119 -3.247 -9.301 4.678 1.00 0.00 N ATOM 1946 CA GLN A 119 -3.662 -10.509 5.382 1.00 0.00 C ATOM 1947 C GLN A 119 -3.523 -11.736 4.486 1.00 0.00 C ATOM 1948 O GLN A 119 -4.372 -12.629 4.500 1.00 0.00 O ATOM 1949 CB GLN A 119 -5.108 -10.375 5.864 1.00 0.00 C ATOM 1950 CG GLN A 119 -5.367 -9.109 6.664 1.00 0.00 C ATOM 1951 CD GLN A 119 -6.663 -9.172 7.449 1.00 0.00 C ATOM 1952 OE1 GLN A 119 -6.682 -8.941 8.658 1.00 0.00 O ATOM 1953 NE2 GLN A 119 -7.755 -9.486 6.763 1.00 0.00 N ATOM 0 H GLN A 119 -2.497 -8.782 5.136 1.00 0.00 H new ATOM 0 HA GLN A 119 -3.010 -10.637 6.246 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -5.773 -10.392 5.001 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -5.360 -11.240 6.477 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -4.538 -8.942 7.351 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -5.397 -8.255 5.987 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -7.693 -9.670 5.762 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -8.656 -9.544 7.237 1.00 0.00 H new ATOM 1962 N LEU A 120 -2.449 -11.771 3.707 1.00 0.00 N ATOM 1963 CA LEU A 120 -2.194 -12.883 2.800 1.00 0.00 C ATOM 1964 C LEU A 120 -1.298 -13.930 3.458 1.00 0.00 C ATOM 1965 O LEU A 120 -0.394 -14.473 2.825 1.00 0.00 O ATOM 1966 CB LEU A 120 -1.542 -12.377 1.511 1.00 0.00 C ATOM 1967 CG LEU A 120 -1.997 -10.988 1.054 1.00 0.00 C ATOM 1968 CD1 LEU A 120 -0.954 -10.356 0.147 1.00 0.00 C ATOM 1969 CD2 LEU A 120 -3.342 -11.076 0.348 1.00 0.00 C ATOM 0 H LEU A 120 -1.738 -11.040 3.685 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.150 -13.348 2.559 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -0.461 -12.360 1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.749 -13.091 0.713 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.112 -10.355 1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.295 -9.370 -0.168 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.012 -10.259 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.805 -10.985 -0.730 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.651 -10.081 0.029 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.254 -11.725 -0.523 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.086 -11.486 1.032 1.00 0.00 H new ATOM 1981 N SER A 121 -1.555 -14.208 4.732 1.00 0.00 N ATOM 1982 CA SER A 121 -0.771 -15.188 5.473 1.00 0.00 C ATOM 1983 C SER A 121 -1.342 -16.591 5.291 1.00 0.00 C ATOM 1984 O SER A 121 -2.226 -16.810 4.462 1.00 0.00 O ATOM 1985 CB SER A 121 -0.737 -14.828 6.959 1.00 0.00 C ATOM 1986 OG SER A 121 0.460 -15.281 7.567 1.00 0.00 O ATOM 0 H SER A 121 -2.300 -13.768 5.272 1.00 0.00 H new ATOM 0 HA SER A 121 0.246 -15.175 5.080 1.00 0.00 H new ATOM 0 HB2 SER A 121 -0.822 -13.748 7.077 1.00 0.00 H new ATOM 0 HB3 SER A 121 -1.595 -15.272 7.463 1.00 0.00 H new ATOM 0 HG SER A 121 0.458 -15.037 8.516 1.00 0.00 H new ATOM 1992 N LYS A 122 -0.830 -17.538 6.071 1.00 0.00 N ATOM 1993 CA LYS A 122 -1.288 -18.920 5.996 1.00 0.00 C ATOM 1994 C LYS A 122 -1.852 -19.381 7.339 1.00 0.00 C ATOM 1995 O LYS A 122 -1.121 -19.907 8.179 1.00 0.00 O ATOM 1996 CB LYS A 122 -0.139 -19.837 5.569 1.00 0.00 C ATOM 1997 CG LYS A 122 -0.118 -20.130 4.078 1.00 0.00 C ATOM 1998 CD LYS A 122 0.655 -21.403 3.771 1.00 0.00 C ATOM 1999 CE LYS A 122 0.886 -21.565 2.277 1.00 0.00 C ATOM 2000 NZ LYS A 122 1.767 -22.726 1.973 1.00 0.00 N ATOM 0 H LYS A 122 -0.098 -17.373 6.762 1.00 0.00 H new ATOM 0 HA LYS A 122 -2.083 -18.974 5.252 1.00 0.00 H new ATOM 0 HB2 LYS A 122 0.807 -19.377 5.854 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -0.213 -20.778 6.115 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -1.140 -20.226 3.711 1.00 0.00 H new ATOM 0 HG3 LYS A 122 0.334 -19.292 3.548 1.00 0.00 H new ATOM 0 HD2 LYS A 122 1.614 -21.382 4.289 1.00 0.00 H new ATOM 0 HD3 LYS A 122 0.106 -22.264 4.151 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -0.072 -21.695 1.774 1.00 0.00 H new ATOM 0 HE3 LYS A 122 1.335 -20.655 1.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 1.899 -22.801 0.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 2.690 -22.591 2.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 1.328 -23.598 2.330 1.00 0.00 H new ATOM 2014 N PRO A 123 -3.164 -19.191 7.561 1.00 0.00 N ATOM 2015 CA PRO A 123 -3.819 -19.592 8.810 1.00 0.00 C ATOM 2016 C PRO A 123 -3.891 -21.107 8.965 1.00 0.00 C ATOM 2017 O PRO A 123 -4.450 -21.802 8.116 1.00 0.00 O ATOM 2018 CB PRO A 123 -5.225 -19.000 8.683 1.00 0.00 C ATOM 2019 CG PRO A 123 -5.453 -18.875 7.217 1.00 0.00 C ATOM 2020 CD PRO A 123 -4.110 -18.572 6.613 1.00 0.00 C ATOM 0 HA PRO A 123 -3.273 -19.241 9.686 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -5.970 -19.647 9.146 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -5.293 -18.031 9.178 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -5.867 -19.796 6.807 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -6.167 -18.081 7.000 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -4.013 -18.996 5.614 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -3.943 -17.499 6.521 1.00 0.00 H new ATOM 2028 N ASN A 124 -3.321 -21.614 10.053 1.00 0.00 N ATOM 2029 CA ASN A 124 -3.320 -23.047 10.319 1.00 0.00 C ATOM 2030 C ASN A 124 -2.598 -23.805 9.210 1.00 0.00 C ATOM 2031 O ASN A 124 -1.829 -23.166 8.461 1.00 0.00 O ATOM 2032 CB ASN A 124 -4.754 -23.563 10.455 1.00 0.00 C ATOM 2033 CG ASN A 124 -5.219 -23.609 11.897 1.00 0.00 C ATOM 2034 OD1 ASN A 124 -4.786 -22.808 12.727 1.00 0.00 O ATOM 2035 ND2 ASN A 124 -6.104 -24.550 12.205 1.00 0.00 N ATOM 2036 OXT ASN A 124 -2.805 -25.033 9.101 1.00 0.00 O ATOM 0 H ASN A 124 -2.854 -21.053 10.765 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.790 -23.217 11.256 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -5.423 -22.922 9.881 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -4.820 -24.562 10.023 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -6.452 -24.630 13.161 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -6.436 -25.193 11.486 1.00 0.00 H new TER 2043 ASN A 124