USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 986 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 34 HIS : no HD1:sc= -2.01 K(o=-2.2,f=-5.6!) USER MOD Set 1.2: A 115 HIS : no HD1:sc= -0.145 X(o=-2.2,f=-2.1) USER MOD Set 2.1: A 82 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 86 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Set 3.1: A 66 ASN : amide:sc= -7.92! C(o=-18!,f=-18!) USER MOD Set 3.2: A 75 ASN : amide:sc= -9.85! C(o=-18!,f=-22!) USER MOD Set 4.1: A 33 GLN : amide:sc= -0.693 X(o=-3.1,f=-3.3) USER MOD Set 4.2: A 37 ASN : amide:sc= -2.42 K(o=-3.1,f=-6!) USER MOD Single : A 1 LYS N :NH3+ -124:sc= -1.48 (180deg=-4.52!) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 MET CE :methyl 148:sc= -7.95! (180deg=-15.5!) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -2.64! C(o=-2.6!,f=-12!) USER MOD Single : A 40 THR OG1 : rot -56:sc= -2.03! USER MOD Single : A 43 THR OG1 : rot -98:sc= 0.99 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 TYR OH : rot -67:sc= 0.00024 USER MOD Single : A 46 ASN : amide:sc= -2.65! C(o=-2.6!,f=-3.1!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 28:sc= 0.535 USER MOD Single : A 52 THR OG1 : rot -135:sc= -0.45 USER MOD Single : A 54 TYR OH : rot 139:sc= -1.76! USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 60 ASN : amide:sc= -1.79 K(o=-1.8,f=0.39) USER MOD Single : A 61 SER OG : rot 38:sc= 0.805! USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.0258 X(o=-0.026,f=-0.13) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= -0.0103 X(o=-0.01,f=0) USER MOD Single : A 117 GLN : amide:sc= -0.0152 X(o=-0.015,f=0) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 TYR OH : rot 30:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.297 K(o=-0.3,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 -5.065 6.178 6.496 1.00 0.00 N ATOM 2 CA LYS A 1 -4.777 7.322 7.343 1.00 0.00 C ATOM 3 C LYS A 1 -3.855 6.888 8.483 1.00 0.00 C ATOM 4 O LYS A 1 -2.687 7.275 8.523 1.00 0.00 O ATOM 5 CB LYS A 1 -6.076 7.978 7.819 1.00 0.00 C ATOM 6 CG LYS A 1 -5.790 9.104 8.814 1.00 0.00 C ATOM 7 CD LYS A 1 -5.641 10.447 8.095 1.00 0.00 C ATOM 8 CE LYS A 1 -6.116 11.598 8.983 1.00 0.00 C ATOM 9 NZ LYS A 1 -6.083 12.876 8.236 1.00 0.00 N ATOM 0 H1 LYS A 1 -4.798 6.396 5.515 1.00 0.00 H new ATOM 0 H2 LYS A 1 -4.523 5.355 6.828 1.00 0.00 H new ATOM 0 H3 LYS A 1 -6.082 5.962 6.538 1.00 0.00 H new ATOM 0 HA LYS A 1 -4.248 8.089 6.778 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -6.622 8.375 6.963 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -6.716 7.229 8.286 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -6.599 9.165 9.542 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -4.878 8.881 9.369 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -4.598 10.602 7.819 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -6.217 10.435 7.170 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -7.129 11.401 9.333 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -5.481 11.670 9.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -6.408 13.647 8.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -5.110 13.070 7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -6.707 12.810 7.407 1.00 0.00 H new ATOM 23 N VAL A 2 -4.413 6.090 9.382 1.00 0.00 N ATOM 24 CA VAL A 2 -3.654 5.600 10.520 1.00 0.00 C ATOM 25 C VAL A 2 -4.147 4.199 10.889 1.00 0.00 C ATOM 26 O VAL A 2 -5.313 4.019 11.235 1.00 0.00 O ATOM 27 CB VAL A 2 -3.749 6.592 11.680 1.00 0.00 C ATOM 28 CG1 VAL A 2 -3.498 5.897 13.019 1.00 0.00 C ATOM 29 CG2 VAL A 2 -2.784 7.763 11.481 1.00 0.00 C ATOM 0 H VAL A 2 -5.381 5.771 9.345 1.00 0.00 H new ATOM 0 HA VAL A 2 -2.597 5.518 10.268 1.00 0.00 H new ATOM 0 HB VAL A 2 -4.763 6.992 11.695 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.572 6.625 13.826 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -4.242 5.114 13.168 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -2.502 5.455 13.019 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -2.872 8.453 12.320 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.762 7.387 11.426 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -3.030 8.284 10.555 1.00 0.00 H new ATOM 39 N TYR A 3 -3.233 3.243 10.804 1.00 0.00 N ATOM 40 CA TYR A 3 -3.559 1.864 11.125 1.00 0.00 C ATOM 41 C TYR A 3 -2.291 1.040 11.355 1.00 0.00 C ATOM 42 O TYR A 3 -1.316 1.175 10.618 1.00 0.00 O ATOM 43 CB TYR A 3 -4.299 1.311 9.906 1.00 0.00 C ATOM 44 CG TYR A 3 -5.773 1.714 9.835 1.00 0.00 C ATOM 45 CD1 TYR A 3 -6.558 1.659 10.968 1.00 0.00 C ATOM 46 CD2 TYR A 3 -6.317 2.134 8.638 1.00 0.00 C ATOM 47 CE1 TYR A 3 -7.946 2.039 10.902 1.00 0.00 C ATOM 48 CE2 TYR A 3 -7.704 2.514 8.571 1.00 0.00 C ATOM 49 CZ TYR A 3 -8.450 2.448 9.707 1.00 0.00 C ATOM 50 OH TYR A 3 -9.760 2.806 9.644 1.00 0.00 O ATOM 0 H TYR A 3 -2.266 3.397 10.517 1.00 0.00 H new ATOM 0 HA TYR A 3 -4.157 1.813 12.035 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -3.796 1.654 9.002 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -4.231 0.223 9.915 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -6.132 1.331 11.905 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -5.702 2.178 7.751 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -8.572 2.000 11.781 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -8.142 2.844 7.641 1.00 0.00 H new ATOM 0 HH TYR A 3 -9.981 3.077 8.729 1.00 0.00 H new ATOM 60 N GLU A 4 -2.346 0.204 12.382 1.00 0.00 N ATOM 61 CA GLU A 4 -1.214 -0.642 12.719 1.00 0.00 C ATOM 62 C GLU A 4 -1.424 -2.053 12.168 1.00 0.00 C ATOM 63 O GLU A 4 -2.484 -2.360 11.623 1.00 0.00 O ATOM 64 CB GLU A 4 -0.984 -0.674 14.232 1.00 0.00 C ATOM 65 CG GLU A 4 -2.114 -1.421 14.943 1.00 0.00 C ATOM 66 CD GLU A 4 -1.861 -1.492 16.450 1.00 0.00 C ATOM 67 OE1 GLU A 4 -0.780 -1.022 16.867 1.00 0.00 O ATOM 68 OE2 GLU A 4 -2.755 -2.014 17.152 1.00 0.00 O ATOM 0 H GLU A 4 -3.157 0.095 12.991 1.00 0.00 H new ATOM 0 HA GLU A 4 -0.321 -0.221 12.257 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -0.031 -1.157 14.448 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -0.919 0.344 14.615 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -3.063 -0.919 14.753 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -2.200 -2.429 14.537 1.00 0.00 H new ATOM 75 N ARG A 5 -0.397 -2.875 12.326 1.00 0.00 N ATOM 76 CA ARG A 5 -0.455 -4.247 11.851 1.00 0.00 C ATOM 77 C ARG A 5 -1.855 -4.825 12.066 1.00 0.00 C ATOM 78 O ARG A 5 -2.557 -5.135 11.104 1.00 0.00 O ATOM 79 CB ARG A 5 0.567 -5.125 12.574 1.00 0.00 C ATOM 80 CG ARG A 5 0.885 -4.566 13.963 1.00 0.00 C ATOM 81 CD ARG A 5 1.041 -5.694 14.986 1.00 0.00 C ATOM 82 NE ARG A 5 0.242 -5.395 16.196 1.00 0.00 N ATOM 83 CZ ARG A 5 0.501 -4.384 17.036 1.00 0.00 C ATOM 84 NH1 ARG A 5 1.539 -3.568 16.802 1.00 0.00 N ATOM 85 NH2 ARG A 5 -0.277 -4.187 18.108 1.00 0.00 N ATOM 0 H ARG A 5 0.481 -2.617 12.777 1.00 0.00 H new ATOM 0 HA ARG A 5 -0.221 -4.238 10.786 1.00 0.00 H new ATOM 0 HB2 ARG A 5 0.179 -6.140 12.666 1.00 0.00 H new ATOM 0 HB3 ARG A 5 1.482 -5.186 11.984 1.00 0.00 H new ATOM 0 HG2 ARG A 5 1.802 -3.979 13.921 1.00 0.00 H new ATOM 0 HG3 ARG A 5 0.089 -3.892 14.279 1.00 0.00 H new ATOM 0 HD2 ARG A 5 0.716 -6.639 14.550 1.00 0.00 H new ATOM 0 HD3 ARG A 5 2.091 -5.811 15.253 1.00 0.00 H new ATOM 0 HE ARG A 5 -0.555 -5.996 16.403 1.00 0.00 H new ATOM 0 HH11 ARG A 5 2.131 -3.717 15.985 1.00 0.00 H new ATOM 0 HH12 ARG A 5 1.737 -2.798 17.441 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -1.067 -4.807 18.285 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -0.079 -3.417 18.747 1.00 0.00 H new ATOM 99 N CYS A 6 -2.220 -4.952 13.333 1.00 0.00 N ATOM 100 CA CYS A 6 -3.525 -5.486 13.686 1.00 0.00 C ATOM 101 C CYS A 6 -4.576 -4.811 12.803 1.00 0.00 C ATOM 102 O CYS A 6 -5.085 -5.418 11.862 1.00 0.00 O ATOM 103 CB CYS A 6 -3.827 -5.302 15.175 1.00 0.00 C ATOM 104 SG CYS A 6 -3.950 -6.858 16.131 1.00 0.00 S ATOM 0 H CYS A 6 -1.635 -4.694 14.128 1.00 0.00 H new ATOM 0 HA CYS A 6 -3.541 -6.561 13.509 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -3.046 -4.682 15.616 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -4.764 -4.755 15.276 1.00 0.00 H new ATOM 109 N GLU A 7 -4.871 -3.563 13.136 1.00 0.00 N ATOM 110 CA GLU A 7 -5.852 -2.799 12.385 1.00 0.00 C ATOM 111 C GLU A 7 -5.783 -3.162 10.901 1.00 0.00 C ATOM 112 O GLU A 7 -6.729 -3.724 10.351 1.00 0.00 O ATOM 113 CB GLU A 7 -5.653 -1.297 12.593 1.00 0.00 C ATOM 114 CG GLU A 7 -6.676 -0.739 13.585 1.00 0.00 C ATOM 115 CD GLU A 7 -5.986 0.066 14.689 1.00 0.00 C ATOM 116 OE1 GLU A 7 -5.290 -0.574 15.507 1.00 0.00 O ATOM 117 OE2 GLU A 7 -6.172 1.301 14.690 1.00 0.00 O ATOM 0 H GLU A 7 -4.447 -3.062 13.917 1.00 0.00 H new ATOM 0 HA GLU A 7 -6.845 -3.054 12.755 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -4.644 -1.108 12.961 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -5.747 -0.779 11.639 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -7.389 -0.105 13.059 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -7.243 -1.558 14.027 1.00 0.00 H new ATOM 124 N PHE A 8 -4.655 -2.824 10.294 1.00 0.00 N ATOM 125 CA PHE A 8 -4.451 -3.106 8.883 1.00 0.00 C ATOM 126 C PHE A 8 -4.993 -4.490 8.517 1.00 0.00 C ATOM 127 O PHE A 8 -5.761 -4.628 7.566 1.00 0.00 O ATOM 128 CB PHE A 8 -2.941 -3.082 8.636 1.00 0.00 C ATOM 129 CG PHE A 8 -2.540 -2.450 7.301 1.00 0.00 C ATOM 130 CD1 PHE A 8 -2.985 -1.207 6.976 1.00 0.00 C ATOM 131 CD2 PHE A 8 -1.737 -3.131 6.441 1.00 0.00 C ATOM 132 CE1 PHE A 8 -2.612 -0.620 5.738 1.00 0.00 C ATOM 133 CE2 PHE A 8 -1.364 -2.546 5.203 1.00 0.00 C ATOM 134 CZ PHE A 8 -1.810 -1.302 4.877 1.00 0.00 C ATOM 0 H PHE A 8 -3.873 -2.358 10.753 1.00 0.00 H new ATOM 0 HA PHE A 8 -4.975 -2.367 8.276 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -2.459 -2.534 9.445 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -2.561 -4.103 8.672 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -3.622 -0.666 7.660 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -1.383 -4.118 6.700 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -2.965 0.368 5.480 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -0.727 -3.088 4.520 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.527 -0.857 3.935 1.00 0.00 H new ATOM 144 N ALA A 9 -4.571 -5.479 9.291 1.00 0.00 N ATOM 145 CA ALA A 9 -5.005 -6.847 9.061 1.00 0.00 C ATOM 146 C ALA A 9 -6.532 -6.913 9.136 1.00 0.00 C ATOM 147 O ALA A 9 -7.186 -7.340 8.186 1.00 0.00 O ATOM 148 CB ALA A 9 -4.331 -7.774 10.074 1.00 0.00 C ATOM 0 H ALA A 9 -3.933 -5.361 10.078 1.00 0.00 H new ATOM 0 HA ALA A 9 -4.709 -7.181 8.066 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.657 -8.800 9.901 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -3.249 -7.713 9.959 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -4.607 -7.471 11.084 1.00 0.00 H new ATOM 154 N ARG A 10 -7.056 -6.484 10.275 1.00 0.00 N ATOM 155 CA ARG A 10 -8.493 -6.489 10.486 1.00 0.00 C ATOM 156 C ARG A 10 -9.202 -5.771 9.335 1.00 0.00 C ATOM 157 O ARG A 10 -10.089 -6.338 8.698 1.00 0.00 O ATOM 158 CB ARG A 10 -8.859 -5.806 11.806 1.00 0.00 C ATOM 159 CG ARG A 10 -10.336 -6.017 12.142 1.00 0.00 C ATOM 160 CD ARG A 10 -10.518 -6.374 13.618 1.00 0.00 C ATOM 161 NE ARG A 10 -11.186 -7.688 13.743 1.00 0.00 N ATOM 162 CZ ARG A 10 -10.546 -8.865 13.689 1.00 0.00 C ATOM 163 NH1 ARG A 10 -9.218 -8.897 13.510 1.00 0.00 N ATOM 164 NH2 ARG A 10 -11.233 -10.008 13.811 1.00 0.00 N ATOM 0 H ARG A 10 -6.511 -6.131 11.061 1.00 0.00 H new ATOM 0 HA ARG A 10 -8.818 -7.529 10.525 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -8.239 -6.204 12.609 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -8.647 -4.739 11.738 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -10.898 -5.112 11.911 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -10.744 -6.813 11.519 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -9.549 -6.401 14.116 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -11.111 -5.607 14.116 1.00 0.00 H new ATOM 0 HE ARG A 10 -12.197 -7.699 13.879 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -8.695 -8.026 13.415 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -8.730 -9.792 13.469 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -12.244 -9.984 13.945 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -10.745 -10.903 13.770 1.00 0.00 H new ATOM 178 N THR A 11 -8.783 -4.536 9.103 1.00 0.00 N ATOM 179 CA THR A 11 -9.366 -3.736 8.041 1.00 0.00 C ATOM 180 C THR A 11 -9.367 -4.516 6.724 1.00 0.00 C ATOM 181 O THR A 11 -10.404 -4.646 6.076 1.00 0.00 O ATOM 182 CB THR A 11 -8.595 -2.417 7.964 1.00 0.00 C ATOM 183 OG1 THR A 11 -9.011 -1.704 9.126 1.00 0.00 O ATOM 184 CG2 THR A 11 -9.055 -1.534 6.802 1.00 0.00 C ATOM 0 H THR A 11 -8.046 -4.070 9.633 1.00 0.00 H new ATOM 0 HA THR A 11 -10.411 -3.507 8.248 1.00 0.00 H new ATOM 0 HB THR A 11 -7.530 -2.626 7.861 1.00 0.00 H new ATOM 0 HG1 THR A 11 -8.558 -0.836 9.157 1.00 0.00 H new ATOM 0 HG21 THR A 11 -8.475 -0.611 6.794 1.00 0.00 H new ATOM 0 HG22 THR A 11 -8.906 -2.064 5.861 1.00 0.00 H new ATOM 0 HG23 THR A 11 -10.112 -1.297 6.921 1.00 0.00 H new ATOM 192 N LEU A 12 -8.191 -5.014 6.369 1.00 0.00 N ATOM 193 CA LEU A 12 -8.043 -5.777 5.141 1.00 0.00 C ATOM 194 C LEU A 12 -9.093 -6.890 5.107 1.00 0.00 C ATOM 195 O LEU A 12 -9.885 -6.973 4.170 1.00 0.00 O ATOM 196 CB LEU A 12 -6.606 -6.283 4.994 1.00 0.00 C ATOM 197 CG LEU A 12 -5.769 -5.617 3.901 1.00 0.00 C ATOM 198 CD1 LEU A 12 -5.546 -4.135 4.207 1.00 0.00 C ATOM 199 CD2 LEU A 12 -4.451 -6.364 3.688 1.00 0.00 C ATOM 0 H LEU A 12 -7.333 -4.904 6.910 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.223 -5.141 4.274 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.095 -6.149 5.948 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.638 -7.355 4.797 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.324 -5.671 2.965 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.948 -3.686 3.414 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -6.509 -3.627 4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.022 -4.035 5.158 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.875 -5.870 2.906 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.878 -6.363 4.616 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.659 -7.392 3.391 1.00 0.00 H new ATOM 211 N LYS A 13 -9.066 -7.717 6.142 1.00 0.00 N ATOM 212 CA LYS A 13 -10.005 -8.821 6.243 1.00 0.00 C ATOM 213 C LYS A 13 -11.432 -8.268 6.288 1.00 0.00 C ATOM 214 O LYS A 13 -12.381 -8.961 5.926 1.00 0.00 O ATOM 215 CB LYS A 13 -9.654 -9.715 7.434 1.00 0.00 C ATOM 216 CG LYS A 13 -9.599 -11.186 7.016 1.00 0.00 C ATOM 217 CD LYS A 13 -11.002 -11.794 6.963 1.00 0.00 C ATOM 218 CE LYS A 13 -11.509 -11.881 5.522 1.00 0.00 C ATOM 219 NZ LYS A 13 -11.263 -13.230 4.967 1.00 0.00 N ATOM 0 H LYS A 13 -8.408 -7.644 6.918 1.00 0.00 H new ATOM 0 HA LYS A 13 -9.938 -9.461 5.363 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -8.692 -9.414 7.848 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -10.395 -9.584 8.223 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.124 -11.272 6.039 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.983 -11.745 7.720 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -10.988 -12.789 7.408 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -11.687 -11.189 7.557 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -12.575 -11.658 5.491 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -11.009 -11.132 4.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -11.613 -13.272 3.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -10.242 -13.429 4.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -11.761 -13.939 5.543 1.00 0.00 H new ATOM 233 N ARG A 14 -11.537 -7.025 6.736 1.00 0.00 N ATOM 234 CA ARG A 14 -12.831 -6.373 6.833 1.00 0.00 C ATOM 235 C ARG A 14 -13.246 -5.811 5.472 1.00 0.00 C ATOM 236 O ARG A 14 -14.434 -5.647 5.200 1.00 0.00 O ATOM 237 CB ARG A 14 -12.799 -5.237 7.857 1.00 0.00 C ATOM 238 CG ARG A 14 -14.210 -4.724 8.153 1.00 0.00 C ATOM 239 CD ARG A 14 -14.523 -4.809 9.648 1.00 0.00 C ATOM 240 NE ARG A 14 -15.567 -3.823 10.003 1.00 0.00 N ATOM 241 CZ ARG A 14 -16.337 -3.904 11.097 1.00 0.00 C ATOM 242 NH1 ARG A 14 -16.184 -4.928 11.948 1.00 0.00 N ATOM 243 NH2 ARG A 14 -17.260 -2.963 11.338 1.00 0.00 N ATOM 0 H ARG A 14 -10.747 -6.453 7.035 1.00 0.00 H new ATOM 0 HA ARG A 14 -13.555 -7.120 7.157 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.335 -5.587 8.779 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -12.183 -4.420 7.480 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -14.303 -3.691 7.817 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.939 -5.309 7.592 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -14.860 -5.814 9.901 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -13.620 -4.620 10.228 1.00 0.00 H new ATOM 0 HE ARG A 14 -15.710 -3.032 9.376 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -15.482 -5.645 11.763 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -16.769 -4.991 12.781 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -17.377 -2.185 10.689 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -17.846 -3.025 12.171 1.00 0.00 H new ATOM 257 N ASN A 15 -12.243 -5.533 4.651 1.00 0.00 N ATOM 258 CA ASN A 15 -12.489 -4.994 3.325 1.00 0.00 C ATOM 259 C ASN A 15 -12.636 -6.146 2.329 1.00 0.00 C ATOM 260 O ASN A 15 -13.534 -6.134 1.489 1.00 0.00 O ATOM 261 CB ASN A 15 -11.325 -4.116 2.863 1.00 0.00 C ATOM 262 CG ASN A 15 -11.831 -2.899 2.086 1.00 0.00 C ATOM 263 OD1 ASN A 15 -12.120 -1.852 2.642 1.00 0.00 O ATOM 264 ND2 ASN A 15 -11.920 -3.093 0.773 1.00 0.00 N ATOM 0 H ASN A 15 -11.259 -5.671 4.879 1.00 0.00 H new ATOM 0 HA ASN A 15 -13.398 -4.395 3.369 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -10.748 -3.786 3.727 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -10.652 -4.699 2.234 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -12.246 -2.340 0.167 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -11.662 -3.995 0.372 1.00 0.00 H new ATOM 271 N GLY A 16 -11.742 -7.115 2.459 1.00 0.00 N ATOM 272 CA GLY A 16 -11.760 -8.273 1.581 1.00 0.00 C ATOM 273 C GLY A 16 -10.457 -8.381 0.787 1.00 0.00 C ATOM 274 O GLY A 16 -10.475 -8.674 -0.407 1.00 0.00 O ATOM 0 H GLY A 16 -11.000 -7.122 3.159 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.907 -9.178 2.170 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -12.603 -8.200 0.894 1.00 0.00 H new ATOM 278 N MET A 17 -9.356 -8.138 1.483 1.00 0.00 N ATOM 279 CA MET A 17 -8.046 -8.204 0.859 1.00 0.00 C ATOM 280 C MET A 17 -7.133 -9.184 1.601 1.00 0.00 C ATOM 281 O MET A 17 -6.357 -9.908 0.979 1.00 0.00 O ATOM 282 CB MET A 17 -7.408 -6.813 0.859 1.00 0.00 C ATOM 283 CG MET A 17 -7.277 -6.270 -0.565 1.00 0.00 C ATOM 284 SD MET A 17 -5.585 -5.802 -0.887 1.00 0.00 S ATOM 285 CE MET A 17 -5.389 -6.462 -2.534 1.00 0.00 C ATOM 0 H MET A 17 -9.345 -7.895 2.474 1.00 0.00 H new ATOM 0 HA MET A 17 -8.171 -8.556 -0.165 1.00 0.00 H new ATOM 0 HB2 MET A 17 -8.013 -6.132 1.458 1.00 0.00 H new ATOM 0 HB3 MET A 17 -6.424 -6.860 1.326 1.00 0.00 H new ATOM 0 HG2 MET A 17 -7.597 -7.026 -1.282 1.00 0.00 H new ATOM 0 HG3 MET A 17 -7.932 -5.409 -0.696 1.00 0.00 H new ATOM 0 HE1 MET A 17 -4.698 -5.835 -3.097 1.00 0.00 H new ATOM 0 HE2 MET A 17 -4.994 -7.476 -2.475 1.00 0.00 H new ATOM 0 HE3 MET A 17 -6.356 -6.478 -3.037 1.00 0.00 H new ATOM 295 N ALA A 18 -7.256 -9.173 2.920 1.00 0.00 N ATOM 296 CA ALA A 18 -6.452 -10.052 3.753 1.00 0.00 C ATOM 297 C ALA A 18 -6.531 -11.479 3.207 1.00 0.00 C ATOM 298 O ALA A 18 -7.460 -12.219 3.524 1.00 0.00 O ATOM 299 CB ALA A 18 -6.929 -9.956 5.204 1.00 0.00 C ATOM 0 H ALA A 18 -7.900 -8.570 3.432 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.405 -9.749 3.732 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -6.327 -10.615 5.829 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.825 -8.929 5.554 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -7.975 -10.256 5.264 1.00 0.00 H new ATOM 305 N GLY A 19 -5.542 -11.822 2.394 1.00 0.00 N ATOM 306 CA GLY A 19 -5.487 -13.147 1.800 1.00 0.00 C ATOM 307 C GLY A 19 -5.821 -13.093 0.308 1.00 0.00 C ATOM 308 O GLY A 19 -6.340 -14.058 -0.251 1.00 0.00 O ATOM 0 H GLY A 19 -4.773 -11.205 2.133 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -4.492 -13.571 1.939 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.189 -13.807 2.310 1.00 0.00 H new ATOM 312 N TYR A 20 -5.507 -11.956 -0.295 1.00 0.00 N ATOM 313 CA TYR A 20 -5.766 -11.764 -1.712 1.00 0.00 C ATOM 314 C TYR A 20 -5.285 -12.968 -2.525 1.00 0.00 C ATOM 315 O TYR A 20 -4.722 -13.910 -1.972 1.00 0.00 O ATOM 316 CB TYR A 20 -4.961 -10.531 -2.125 1.00 0.00 C ATOM 317 CG TYR A 20 -5.555 -9.767 -3.310 1.00 0.00 C ATOM 318 CD1 TYR A 20 -6.759 -9.106 -3.172 1.00 0.00 C ATOM 319 CD2 TYR A 20 -4.889 -9.741 -4.518 1.00 0.00 C ATOM 320 CE1 TYR A 20 -7.319 -8.388 -4.288 1.00 0.00 C ATOM 321 CE2 TYR A 20 -5.448 -9.023 -5.634 1.00 0.00 C ATOM 322 CZ TYR A 20 -6.635 -8.382 -5.464 1.00 0.00 C ATOM 323 OH TYR A 20 -7.163 -7.704 -6.518 1.00 0.00 O ATOM 0 H TYR A 20 -5.076 -11.158 0.172 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.834 -11.646 -1.894 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.886 -9.856 -1.272 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -3.947 -10.840 -2.377 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.281 -9.127 -2.227 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -3.948 -10.259 -4.627 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.260 -7.867 -4.193 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -4.936 -8.994 -6.585 1.00 0.00 H new ATOM 0 HH TYR A 20 -6.566 -7.785 -7.291 1.00 0.00 H new ATOM 333 N TYR A 21 -5.525 -12.896 -3.827 1.00 0.00 N ATOM 334 CA TYR A 21 -5.123 -13.968 -4.722 1.00 0.00 C ATOM 335 C TYR A 21 -3.848 -14.650 -4.222 1.00 0.00 C ATOM 336 O TYR A 21 -3.753 -15.876 -4.230 1.00 0.00 O ATOM 337 CB TYR A 21 -4.838 -13.305 -6.071 1.00 0.00 C ATOM 338 CG TYR A 21 -5.823 -13.694 -7.176 1.00 0.00 C ATOM 339 CD1 TYR A 21 -7.072 -13.109 -7.224 1.00 0.00 C ATOM 340 CD2 TYR A 21 -5.462 -14.630 -8.124 1.00 0.00 C ATOM 341 CE1 TYR A 21 -7.999 -13.475 -8.263 1.00 0.00 C ATOM 342 CE2 TYR A 21 -6.389 -14.996 -9.163 1.00 0.00 C ATOM 343 CZ TYR A 21 -7.612 -14.400 -9.182 1.00 0.00 C ATOM 344 OH TYR A 21 -8.487 -14.746 -10.163 1.00 0.00 O ATOM 0 H TYR A 21 -5.992 -12.112 -4.283 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.902 -14.728 -4.786 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -4.859 -12.223 -5.944 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.829 -13.569 -6.388 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -7.354 -12.377 -6.482 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.484 -15.088 -8.086 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.980 -13.025 -8.312 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.120 -15.727 -9.911 1.00 0.00 H new ATOM 0 HH TYR A 21 -8.075 -15.416 -10.748 1.00 0.00 H new ATOM 354 N GLY A 22 -2.900 -13.826 -3.802 1.00 0.00 N ATOM 355 CA GLY A 22 -1.635 -14.334 -3.300 1.00 0.00 C ATOM 356 C GLY A 22 -1.180 -13.552 -2.066 1.00 0.00 C ATOM 357 O GLY A 22 -1.124 -14.099 -0.966 1.00 0.00 O ATOM 0 H GLY A 22 -2.983 -12.809 -3.799 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -1.737 -15.390 -3.048 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -0.876 -14.264 -4.079 1.00 0.00 H new ATOM 361 N VAL A 23 -0.866 -12.285 -2.290 1.00 0.00 N ATOM 362 CA VAL A 23 -0.418 -11.423 -1.210 1.00 0.00 C ATOM 363 C VAL A 23 -1.425 -11.487 -0.060 1.00 0.00 C ATOM 364 O VAL A 23 -2.549 -11.003 -0.186 1.00 0.00 O ATOM 365 CB VAL A 23 -0.198 -10.001 -1.733 1.00 0.00 C ATOM 366 CG1 VAL A 23 -1.385 -9.539 -2.581 1.00 0.00 C ATOM 367 CG2 VAL A 23 0.066 -9.029 -0.582 1.00 0.00 C ATOM 0 H VAL A 23 -0.913 -11.834 -3.204 1.00 0.00 H new ATOM 0 HA VAL A 23 0.541 -11.765 -0.821 1.00 0.00 H new ATOM 0 HB VAL A 23 0.685 -10.011 -2.372 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -1.203 -8.526 -2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -1.507 -10.209 -3.432 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -2.292 -9.552 -1.976 1.00 0.00 H new ATOM 0 HG21 VAL A 23 0.219 -8.026 -0.981 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -0.789 -9.024 0.094 1.00 0.00 H new ATOM 0 HG23 VAL A 23 0.957 -9.343 -0.038 1.00 0.00 H new ATOM 377 N SER A 24 -0.987 -12.090 1.035 1.00 0.00 N ATOM 378 CA SER A 24 -1.835 -12.224 2.207 1.00 0.00 C ATOM 379 C SER A 24 -1.653 -11.014 3.126 1.00 0.00 C ATOM 380 O SER A 24 -0.710 -10.241 2.962 1.00 0.00 O ATOM 381 CB SER A 24 -1.527 -13.517 2.964 1.00 0.00 C ATOM 382 OG SER A 24 -2.083 -14.660 2.317 1.00 0.00 O ATOM 0 H SER A 24 -0.055 -12.492 1.135 1.00 0.00 H new ATOM 0 HA SER A 24 -2.873 -12.267 1.876 1.00 0.00 H new ATOM 0 HB2 SER A 24 -0.447 -13.638 3.050 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.921 -13.446 3.978 1.00 0.00 H new ATOM 0 HG SER A 24 -1.863 -15.466 2.830 1.00 0.00 H new ATOM 388 N LEU A 25 -2.571 -10.889 4.073 1.00 0.00 N ATOM 389 CA LEU A 25 -2.524 -9.786 5.019 1.00 0.00 C ATOM 390 C LEU A 25 -1.118 -9.692 5.616 1.00 0.00 C ATOM 391 O LEU A 25 -0.654 -8.603 5.951 1.00 0.00 O ATOM 392 CB LEU A 25 -3.628 -9.932 6.067 1.00 0.00 C ATOM 393 CG LEU A 25 -3.735 -11.300 6.744 1.00 0.00 C ATOM 394 CD1 LEU A 25 -4.147 -11.157 8.210 1.00 0.00 C ATOM 395 CD2 LEU A 25 -4.681 -12.222 5.970 1.00 0.00 C ATOM 0 H LEU A 25 -3.351 -11.532 4.206 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.720 -8.841 4.513 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.471 -9.178 6.839 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.583 -9.708 5.593 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.749 -11.765 6.731 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.215 -12.144 8.667 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.403 -10.563 8.741 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.116 -10.662 8.269 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.739 -13.188 6.472 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.674 -11.774 5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.304 -12.362 4.957 1.00 0.00 H new ATOM 407 N ALA A 26 -0.480 -10.847 5.731 1.00 0.00 N ATOM 408 CA ALA A 26 0.863 -10.908 6.282 1.00 0.00 C ATOM 409 C ALA A 26 1.809 -10.089 5.400 1.00 0.00 C ATOM 410 O ALA A 26 2.537 -9.231 5.895 1.00 0.00 O ATOM 411 CB ALA A 26 1.299 -12.370 6.403 1.00 0.00 C ATOM 0 H ALA A 26 -0.868 -11.748 5.452 1.00 0.00 H new ATOM 0 HA ALA A 26 0.888 -10.476 7.282 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.307 -12.416 6.816 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.612 -12.901 7.062 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.290 -12.835 5.417 1.00 0.00 H new ATOM 417 N ASP A 27 1.766 -10.384 4.109 1.00 0.00 N ATOM 418 CA ASP A 27 2.610 -9.686 3.154 1.00 0.00 C ATOM 419 C ASP A 27 2.190 -8.216 3.088 1.00 0.00 C ATOM 420 O ASP A 27 3.030 -7.334 2.916 1.00 0.00 O ATOM 421 CB ASP A 27 2.467 -10.283 1.752 1.00 0.00 C ATOM 422 CG ASP A 27 3.441 -9.728 0.711 1.00 0.00 C ATOM 423 OD1 ASP A 27 3.927 -8.598 0.933 1.00 0.00 O ATOM 424 OD2 ASP A 27 3.677 -10.447 -0.284 1.00 0.00 O ATOM 0 H ASP A 27 1.160 -11.097 3.702 1.00 0.00 H new ATOM 0 HA ASP A 27 3.644 -9.784 3.483 1.00 0.00 H new ATOM 0 HB2 ASP A 27 2.604 -11.362 1.817 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.449 -10.112 1.403 1.00 0.00 H new ATOM 429 N TRP A 28 0.891 -7.998 3.227 1.00 0.00 N ATOM 430 CA TRP A 28 0.349 -6.651 3.185 1.00 0.00 C ATOM 431 C TRP A 28 0.868 -5.894 4.409 1.00 0.00 C ATOM 432 O TRP A 28 1.528 -4.864 4.273 1.00 0.00 O ATOM 433 CB TRP A 28 -1.179 -6.677 3.102 1.00 0.00 C ATOM 434 CG TRP A 28 -1.721 -7.067 1.725 1.00 0.00 C ATOM 435 CD1 TRP A 28 -2.330 -8.206 1.371 1.00 0.00 C ATOM 436 CD2 TRP A 28 -1.678 -6.265 0.527 1.00 0.00 C ATOM 437 NE1 TRP A 28 -2.682 -8.198 0.037 1.00 0.00 N ATOM 438 CE2 TRP A 28 -2.272 -6.979 -0.494 1.00 0.00 C ATOM 439 CE3 TRP A 28 -1.154 -4.977 0.310 1.00 0.00 C ATOM 440 CZ2 TRP A 28 -2.399 -6.491 -1.799 1.00 0.00 C ATOM 441 CZ3 TRP A 28 -1.289 -4.504 -1.000 1.00 0.00 C ATOM 442 CH2 TRP A 28 -1.885 -5.211 -2.038 1.00 0.00 C ATOM 0 H TRP A 28 0.197 -8.732 3.369 1.00 0.00 H new ATOM 0 HA TRP A 28 0.681 -6.130 2.287 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.561 -7.379 3.844 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -1.564 -5.692 3.367 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -2.522 -9.028 2.045 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -3.156 -8.948 -0.467 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -0.685 -4.399 1.093 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -2.868 -7.071 -2.580 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -0.903 -3.520 -1.220 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -1.951 -4.775 -3.024 1.00 0.00 H new ATOM 453 N VAL A 29 0.552 -6.433 5.577 1.00 0.00 N ATOM 454 CA VAL A 29 0.980 -5.822 6.824 1.00 0.00 C ATOM 455 C VAL A 29 2.485 -5.551 6.765 1.00 0.00 C ATOM 456 O VAL A 29 2.918 -4.407 6.895 1.00 0.00 O ATOM 457 CB VAL A 29 0.577 -6.706 8.005 1.00 0.00 C ATOM 458 CG1 VAL A 29 0.992 -6.070 9.333 1.00 0.00 C ATOM 459 CG2 VAL A 29 -0.924 -7.001 7.983 1.00 0.00 C ATOM 0 H VAL A 29 0.004 -7.287 5.686 1.00 0.00 H new ATOM 0 HA VAL A 29 0.483 -4.863 6.969 1.00 0.00 H new ATOM 0 HB VAL A 29 1.105 -7.654 7.909 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.694 -6.719 10.156 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.074 -5.936 9.350 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.505 -5.101 9.440 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.183 -7.631 8.834 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.480 -6.065 8.042 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.180 -7.517 7.058 1.00 0.00 H new ATOM 469 N CYS A 30 3.240 -6.622 6.568 1.00 0.00 N ATOM 470 CA CYS A 30 4.686 -6.514 6.491 1.00 0.00 C ATOM 471 C CYS A 30 5.033 -5.454 5.444 1.00 0.00 C ATOM 472 O CYS A 30 5.891 -4.604 5.676 1.00 0.00 O ATOM 473 CB CYS A 30 5.338 -7.862 6.176 1.00 0.00 C ATOM 474 SG CYS A 30 5.499 -8.238 4.392 1.00 0.00 S ATOM 0 H CYS A 30 2.877 -7.569 6.459 1.00 0.00 H new ATOM 0 HA CYS A 30 5.083 -6.210 7.460 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.329 -7.885 6.629 1.00 0.00 H new ATOM 0 HB3 CYS A 30 4.754 -8.652 6.648 1.00 0.00 H new ATOM 479 N LEU A 31 4.348 -5.538 4.313 1.00 0.00 N ATOM 480 CA LEU A 31 4.573 -4.596 3.229 1.00 0.00 C ATOM 481 C LEU A 31 4.396 -3.170 3.754 1.00 0.00 C ATOM 482 O LEU A 31 5.273 -2.327 3.576 1.00 0.00 O ATOM 483 CB LEU A 31 3.675 -4.929 2.036 1.00 0.00 C ATOM 484 CG LEU A 31 3.554 -3.843 0.964 1.00 0.00 C ATOM 485 CD1 LEU A 31 4.919 -3.516 0.358 1.00 0.00 C ATOM 486 CD2 LEU A 31 2.531 -4.237 -0.103 1.00 0.00 C ATOM 0 H LEU A 31 3.637 -6.244 4.123 1.00 0.00 H new ATOM 0 HA LEU A 31 5.596 -4.675 2.860 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.052 -5.837 1.565 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.677 -5.155 2.410 1.00 0.00 H new ATOM 0 HG LEU A 31 3.188 -2.933 1.439 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.804 -2.742 -0.401 1.00 0.00 H new ATOM 0 HD12 LEU A 31 5.589 -3.161 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 31 5.338 -4.412 -0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.465 -3.448 -0.852 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.843 -5.166 -0.581 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.556 -4.378 0.363 1.00 0.00 H new ATOM 498 N ALA A 32 3.255 -2.945 4.389 1.00 0.00 N ATOM 499 CA ALA A 32 2.951 -1.635 4.941 1.00 0.00 C ATOM 500 C ALA A 32 3.920 -1.332 6.085 1.00 0.00 C ATOM 501 O ALA A 32 4.149 -0.170 6.417 1.00 0.00 O ATOM 502 CB ALA A 32 1.489 -1.596 5.389 1.00 0.00 C ATOM 0 H ALA A 32 2.530 -3.648 4.534 1.00 0.00 H new ATOM 0 HA ALA A 32 3.080 -0.860 4.185 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.261 -0.614 5.803 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.841 -1.788 4.534 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.321 -2.358 6.150 1.00 0.00 H new ATOM 508 N GLN A 33 4.462 -2.397 6.657 1.00 0.00 N ATOM 509 CA GLN A 33 5.401 -2.259 7.757 1.00 0.00 C ATOM 510 C GLN A 33 6.717 -1.656 7.260 1.00 0.00 C ATOM 511 O GLN A 33 7.191 -0.658 7.802 1.00 0.00 O ATOM 512 CB GLN A 33 5.641 -3.604 8.446 1.00 0.00 C ATOM 513 CG GLN A 33 6.144 -3.405 9.877 1.00 0.00 C ATOM 514 CD GLN A 33 5.208 -2.486 10.664 1.00 0.00 C ATOM 515 OE1 GLN A 33 4.058 -2.801 10.923 1.00 0.00 O ATOM 516 NE2 GLN A 33 5.763 -1.334 11.030 1.00 0.00 N ATOM 0 H GLN A 33 4.269 -3.359 6.379 1.00 0.00 H new ATOM 0 HA GLN A 33 4.969 -1.582 8.494 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.716 -4.180 8.459 1.00 0.00 H new ATOM 0 HB3 GLN A 33 6.369 -4.183 7.878 1.00 0.00 H new ATOM 0 HG2 GLN A 33 6.218 -4.370 10.378 1.00 0.00 H new ATOM 0 HG3 GLN A 33 7.147 -2.978 9.858 1.00 0.00 H new ATOM 0 HE21 GLN A 33 6.731 -1.132 10.781 1.00 0.00 H new ATOM 0 HE22 GLN A 33 5.220 -0.652 11.560 1.00 0.00 H new ATOM 525 N HIS A 34 7.270 -2.285 6.234 1.00 0.00 N ATOM 526 CA HIS A 34 8.521 -1.823 5.658 1.00 0.00 C ATOM 527 C HIS A 34 8.320 -0.440 5.038 1.00 0.00 C ATOM 528 O HIS A 34 9.275 0.321 4.887 1.00 0.00 O ATOM 529 CB HIS A 34 9.071 -2.845 4.661 1.00 0.00 C ATOM 530 CG HIS A 34 10.567 -2.775 4.469 1.00 0.00 C ATOM 531 ND1 HIS A 34 11.389 -3.884 4.574 1.00 0.00 N ATOM 532 CD2 HIS A 34 11.379 -1.719 4.180 1.00 0.00 C ATOM 533 CE1 HIS A 34 12.638 -3.499 4.355 1.00 0.00 C ATOM 534 NE2 HIS A 34 12.630 -2.157 4.112 1.00 0.00 N ATOM 0 H HIS A 34 6.874 -3.112 5.786 1.00 0.00 H new ATOM 0 HA HIS A 34 9.272 -1.726 6.442 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.805 -3.846 5.000 1.00 0.00 H new ATOM 0 HB3 HIS A 34 8.584 -2.695 3.697 1.00 0.00 H new ATOM 0 HD2 HIS A 34 11.059 -0.698 4.031 1.00 0.00 H new ATOM 0 HE1 HIS A 34 13.510 -4.136 4.367 1.00 0.00 H new ATOM 0 HE2 HIS A 34 13.450 -1.585 3.911 1.00 0.00 H new ATOM 543 N GLU A 35 7.072 -0.154 4.696 1.00 0.00 N ATOM 544 CA GLU A 35 6.734 1.125 4.097 1.00 0.00 C ATOM 545 C GLU A 35 6.604 2.201 5.177 1.00 0.00 C ATOM 546 O GLU A 35 7.325 3.197 5.157 1.00 0.00 O ATOM 547 CB GLU A 35 5.451 1.021 3.270 1.00 0.00 C ATOM 548 CG GLU A 35 5.566 -0.083 2.216 1.00 0.00 C ATOM 549 CD GLU A 35 5.827 0.509 0.829 1.00 0.00 C ATOM 550 OE1 GLU A 35 6.552 1.526 0.773 1.00 0.00 O ATOM 551 OE2 GLU A 35 5.295 -0.068 -0.143 1.00 0.00 O ATOM 0 H GLU A 35 6.282 -0.787 4.823 1.00 0.00 H new ATOM 0 HA GLU A 35 7.541 1.412 3.422 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.606 0.815 3.927 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.250 1.975 2.782 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.375 -0.763 2.483 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.648 -0.671 2.198 1.00 0.00 H new ATOM 558 N SER A 36 5.679 1.961 6.096 1.00 0.00 N ATOM 559 CA SER A 36 5.445 2.897 7.184 1.00 0.00 C ATOM 560 C SER A 36 4.481 2.286 8.200 1.00 0.00 C ATOM 561 O SER A 36 4.855 2.040 9.346 1.00 0.00 O ATOM 562 CB SER A 36 4.894 4.224 6.659 1.00 0.00 C ATOM 563 OG SER A 36 5.559 5.344 7.236 1.00 0.00 O ATOM 0 H SER A 36 5.083 1.133 6.110 1.00 0.00 H new ATOM 0 HA SER A 36 6.398 3.099 7.673 1.00 0.00 H new ATOM 0 HB2 SER A 36 5.002 4.258 5.575 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.827 4.285 6.875 1.00 0.00 H new ATOM 0 HG SER A 36 5.180 6.172 6.874 1.00 0.00 H new ATOM 569 N ASN A 37 3.256 2.059 7.746 1.00 0.00 N ATOM 570 CA ASN A 37 2.235 1.482 8.603 1.00 0.00 C ATOM 571 C ASN A 37 1.910 2.461 9.732 1.00 0.00 C ATOM 572 O ASN A 37 2.499 3.537 9.815 1.00 0.00 O ATOM 573 CB ASN A 37 2.719 0.176 9.234 1.00 0.00 C ATOM 574 CG ASN A 37 1.538 -0.717 9.622 1.00 0.00 C ATOM 575 OD1 ASN A 37 1.392 -1.140 10.756 1.00 0.00 O ATOM 576 ND2 ASN A 37 0.707 -0.980 8.617 1.00 0.00 N ATOM 0 H ASN A 37 2.948 2.265 6.795 1.00 0.00 H new ATOM 0 HA ASN A 37 1.355 1.282 7.991 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.365 -0.353 8.533 1.00 0.00 H new ATOM 0 HB3 ASN A 37 3.319 0.395 10.117 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -0.112 -1.568 8.773 1.00 0.00 H new ATOM 0 HD22 ASN A 37 0.888 -0.593 7.691 1.00 0.00 H new ATOM 583 N TYR A 38 0.973 2.052 10.576 1.00 0.00 N ATOM 584 CA TYR A 38 0.563 2.879 11.698 1.00 0.00 C ATOM 585 C TYR A 38 -0.021 4.209 11.214 1.00 0.00 C ATOM 586 O TYR A 38 -1.194 4.496 11.445 1.00 0.00 O ATOM 587 CB TYR A 38 1.833 3.157 12.503 1.00 0.00 C ATOM 588 CG TYR A 38 2.068 2.174 13.652 1.00 0.00 C ATOM 589 CD1 TYR A 38 2.445 0.874 13.381 1.00 0.00 C ATOM 590 CD2 TYR A 38 1.905 2.587 14.959 1.00 0.00 C ATOM 591 CE1 TYR A 38 2.666 -0.051 14.462 1.00 0.00 C ATOM 592 CE2 TYR A 38 2.128 1.662 16.040 1.00 0.00 C ATOM 593 CZ TYR A 38 2.497 0.388 15.738 1.00 0.00 C ATOM 594 OH TYR A 38 2.706 -0.486 16.759 1.00 0.00 O ATOM 0 H TYR A 38 0.486 1.158 10.505 1.00 0.00 H new ATOM 0 HA TYR A 38 -0.203 2.375 12.287 1.00 0.00 H new ATOM 0 HB2 TYR A 38 2.691 3.127 11.831 1.00 0.00 H new ATOM 0 HB3 TYR A 38 1.781 4.168 12.908 1.00 0.00 H new ATOM 0 HD1 TYR A 38 2.574 0.551 12.359 1.00 0.00 H new ATOM 0 HD2 TYR A 38 1.610 3.604 15.171 1.00 0.00 H new ATOM 0 HE1 TYR A 38 2.960 -1.071 14.264 1.00 0.00 H new ATOM 0 HE2 TYR A 38 2.005 1.973 17.067 1.00 0.00 H new ATOM 0 HH TYR A 38 2.549 -0.034 17.614 1.00 0.00 H new ATOM 604 N ASN A 39 0.826 4.984 10.551 1.00 0.00 N ATOM 605 CA ASN A 39 0.409 6.275 10.034 1.00 0.00 C ATOM 606 C ASN A 39 0.757 6.360 8.547 1.00 0.00 C ATOM 607 O ASN A 39 1.775 5.822 8.112 1.00 0.00 O ATOM 608 CB ASN A 39 1.129 7.417 10.754 1.00 0.00 C ATOM 609 CG ASN A 39 0.987 7.284 12.272 1.00 0.00 C ATOM 610 OD1 ASN A 39 0.595 6.256 12.796 1.00 0.00 O ATOM 611 ND2 ASN A 39 1.325 8.380 12.944 1.00 0.00 N ATOM 0 H ASN A 39 1.798 4.742 10.361 1.00 0.00 H new ATOM 0 HA ASN A 39 -0.665 6.370 10.193 1.00 0.00 H new ATOM 0 HB2 ASN A 39 2.185 7.415 10.482 1.00 0.00 H new ATOM 0 HB3 ASN A 39 0.718 8.373 10.429 1.00 0.00 H new ATOM 0 HD21 ASN A 39 1.264 8.393 13.962 1.00 0.00 H new ATOM 0 HD22 ASN A 39 1.646 9.208 12.442 1.00 0.00 H new ATOM 618 N THR A 40 -0.106 7.040 7.807 1.00 0.00 N ATOM 619 CA THR A 40 0.097 7.202 6.377 1.00 0.00 C ATOM 620 C THR A 40 0.734 8.562 6.080 1.00 0.00 C ATOM 621 O THR A 40 0.199 9.343 5.295 1.00 0.00 O ATOM 622 CB THR A 40 -1.249 6.997 5.681 1.00 0.00 C ATOM 623 OG1 THR A 40 -2.110 7.945 6.305 1.00 0.00 O ATOM 624 CG2 THR A 40 -1.880 5.644 6.015 1.00 0.00 C ATOM 0 H THR A 40 -0.948 7.486 8.171 1.00 0.00 H new ATOM 0 HA THR A 40 0.795 6.459 5.990 1.00 0.00 H new ATOM 0 HB THR A 40 -1.116 7.079 4.602 1.00 0.00 H new ATOM 0 HG1 THR A 40 -2.113 7.797 7.274 1.00 0.00 H new ATOM 0 HG21 THR A 40 -2.834 5.549 5.496 1.00 0.00 H new ATOM 0 HG22 THR A 40 -1.212 4.843 5.698 1.00 0.00 H new ATOM 0 HG23 THR A 40 -2.044 5.575 7.090 1.00 0.00 H new ATOM 632 N ARG A 41 1.867 8.802 6.724 1.00 0.00 N ATOM 633 CA ARG A 41 2.582 10.054 6.539 1.00 0.00 C ATOM 634 C ARG A 41 3.590 9.925 5.395 1.00 0.00 C ATOM 635 O ARG A 41 4.029 10.928 4.834 1.00 0.00 O ATOM 636 CB ARG A 41 3.319 10.462 7.816 1.00 0.00 C ATOM 637 CG ARG A 41 3.944 11.851 7.669 1.00 0.00 C ATOM 638 CD ARG A 41 3.344 12.832 8.678 1.00 0.00 C ATOM 639 NE ARG A 41 4.341 13.865 9.034 1.00 0.00 N ATOM 640 CZ ARG A 41 5.431 13.632 9.778 1.00 0.00 C ATOM 641 NH1 ARG A 41 5.670 12.401 10.250 1.00 0.00 N ATOM 642 NH2 ARG A 41 6.282 14.631 10.051 1.00 0.00 N ATOM 0 H ARG A 41 2.307 8.151 7.374 1.00 0.00 H new ATOM 0 HA ARG A 41 1.848 10.822 6.296 1.00 0.00 H new ATOM 0 HB2 ARG A 41 2.626 10.459 8.657 1.00 0.00 H new ATOM 0 HB3 ARG A 41 4.096 9.732 8.041 1.00 0.00 H new ATOM 0 HG2 ARG A 41 5.022 11.786 7.817 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.783 12.221 6.657 1.00 0.00 H new ATOM 0 HD2 ARG A 41 2.456 13.302 8.256 1.00 0.00 H new ATOM 0 HD3 ARG A 41 3.027 12.297 9.573 1.00 0.00 H new ATOM 0 HE ARG A 41 4.189 14.814 8.692 1.00 0.00 H new ATOM 0 HH11 ARG A 41 5.022 11.641 10.043 1.00 0.00 H new ATOM 0 HH12 ARG A 41 6.500 12.224 10.816 1.00 0.00 H new ATOM 0 HH21 ARG A 41 6.100 15.568 9.692 1.00 0.00 H new ATOM 0 HH22 ARG A 41 7.112 14.454 10.617 1.00 0.00 H new ATOM 656 N ALA A 42 3.928 8.682 5.084 1.00 0.00 N ATOM 657 CA ALA A 42 4.876 8.409 4.017 1.00 0.00 C ATOM 658 C ALA A 42 4.605 9.354 2.845 1.00 0.00 C ATOM 659 O ALA A 42 3.713 9.104 2.035 1.00 0.00 O ATOM 660 CB ALA A 42 4.780 6.936 3.614 1.00 0.00 C ATOM 0 H ALA A 42 3.562 7.853 5.552 1.00 0.00 H new ATOM 0 HA ALA A 42 5.897 8.589 4.355 1.00 0.00 H new ATOM 0 HB1 ALA A 42 5.491 6.731 2.814 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.011 6.308 4.474 1.00 0.00 H new ATOM 0 HB3 ALA A 42 3.770 6.719 3.267 1.00 0.00 H new ATOM 666 N THR A 43 5.390 10.419 2.791 1.00 0.00 N ATOM 667 CA THR A 43 5.247 11.403 1.732 1.00 0.00 C ATOM 668 C THR A 43 6.620 11.823 1.203 1.00 0.00 C ATOM 669 O THR A 43 7.505 12.179 1.979 1.00 0.00 O ATOM 670 CB THR A 43 4.423 12.571 2.280 1.00 0.00 C ATOM 671 OG1 THR A 43 4.935 12.769 3.594 1.00 0.00 O ATOM 672 CG2 THR A 43 2.956 12.200 2.502 1.00 0.00 C ATOM 0 H THR A 43 6.128 10.622 3.465 1.00 0.00 H new ATOM 0 HA THR A 43 4.718 10.987 0.875 1.00 0.00 H new ATOM 0 HB THR A 43 4.483 13.413 1.590 1.00 0.00 H new ATOM 0 HG1 THR A 43 4.349 12.327 4.243 1.00 0.00 H new ATOM 0 HG21 THR A 43 2.417 13.064 2.891 1.00 0.00 H new ATOM 0 HG22 THR A 43 2.512 11.891 1.556 1.00 0.00 H new ATOM 0 HG23 THR A 43 2.892 11.380 3.217 1.00 0.00 H new ATOM 680 N ASN A 44 6.753 11.765 -0.113 1.00 0.00 N ATOM 681 CA ASN A 44 8.005 12.135 -0.755 1.00 0.00 C ATOM 682 C ASN A 44 7.713 12.682 -2.153 1.00 0.00 C ATOM 683 O ASN A 44 7.693 11.931 -3.127 1.00 0.00 O ATOM 684 CB ASN A 44 8.926 10.923 -0.905 1.00 0.00 C ATOM 685 CG ASN A 44 10.180 11.078 -0.043 1.00 0.00 C ATOM 686 OD1 ASN A 44 10.236 10.652 1.099 1.00 0.00 O ATOM 687 ND2 ASN A 44 11.180 11.710 -0.652 1.00 0.00 N ATOM 0 H ASN A 44 6.016 11.468 -0.753 1.00 0.00 H new ATOM 0 HA ASN A 44 8.494 12.885 -0.134 1.00 0.00 H new ATOM 0 HB2 ASN A 44 8.392 10.018 -0.617 1.00 0.00 H new ATOM 0 HB3 ASN A 44 9.211 10.806 -1.950 1.00 0.00 H new ATOM 0 HD21 ASN A 44 12.061 11.863 -0.161 1.00 0.00 H new ATOM 0 HD22 ASN A 44 11.066 12.041 -1.610 1.00 0.00 H new ATOM 694 N TYR A 45 7.493 13.988 -2.209 1.00 0.00 N ATOM 695 CA TYR A 45 7.203 14.645 -3.472 1.00 0.00 C ATOM 696 C TYR A 45 8.489 15.126 -4.148 1.00 0.00 C ATOM 697 O TYR A 45 9.513 15.300 -3.489 1.00 0.00 O ATOM 698 CB TYR A 45 6.337 15.858 -3.127 1.00 0.00 C ATOM 699 CG TYR A 45 4.929 15.502 -2.645 1.00 0.00 C ATOM 700 CD1 TYR A 45 4.746 14.969 -1.386 1.00 0.00 C ATOM 701 CD2 TYR A 45 3.843 15.713 -3.471 1.00 0.00 C ATOM 702 CE1 TYR A 45 3.421 14.633 -0.933 1.00 0.00 C ATOM 703 CE2 TYR A 45 2.518 15.378 -3.017 1.00 0.00 C ATOM 704 CZ TYR A 45 2.373 14.854 -1.770 1.00 0.00 C ATOM 705 OH TYR A 45 1.122 14.538 -1.342 1.00 0.00 O ATOM 0 H TYR A 45 7.510 14.609 -1.400 1.00 0.00 H new ATOM 0 HA TYR A 45 6.706 13.958 -4.157 1.00 0.00 H new ATOM 0 HB2 TYR A 45 6.838 16.441 -2.354 1.00 0.00 H new ATOM 0 HB3 TYR A 45 6.258 16.497 -4.007 1.00 0.00 H new ATOM 0 HD1 TYR A 45 5.596 14.804 -0.740 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.987 16.129 -4.457 1.00 0.00 H new ATOM 0 HE1 TYR A 45 3.263 14.215 0.050 1.00 0.00 H new ATOM 0 HE2 TYR A 45 1.659 15.539 -3.652 1.00 0.00 H new ATOM 0 HH TYR A 45 1.044 13.566 -1.248 1.00 0.00 H new ATOM 715 N ASN A 46 8.394 15.326 -5.454 1.00 0.00 N ATOM 716 CA ASN A 46 9.536 15.784 -6.226 1.00 0.00 C ATOM 717 C ASN A 46 9.051 16.348 -7.563 1.00 0.00 C ATOM 718 O ASN A 46 8.697 15.593 -8.467 1.00 0.00 O ATOM 719 CB ASN A 46 10.499 14.632 -6.520 1.00 0.00 C ATOM 720 CG ASN A 46 11.139 14.108 -5.233 1.00 0.00 C ATOM 721 OD1 ASN A 46 10.658 13.180 -4.604 1.00 0.00 O ATOM 722 ND2 ASN A 46 12.245 14.754 -4.878 1.00 0.00 N ATOM 0 H ASN A 46 7.543 15.179 -5.997 1.00 0.00 H new ATOM 0 HA ASN A 46 10.053 16.547 -5.643 1.00 0.00 H new ATOM 0 HB2 ASN A 46 9.963 13.824 -7.019 1.00 0.00 H new ATOM 0 HB3 ASN A 46 11.276 14.970 -7.205 1.00 0.00 H new ATOM 0 HD21 ASN A 46 12.746 14.481 -4.032 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.593 15.523 -5.451 1.00 0.00 H new ATOM 729 N ARG A 47 9.050 17.670 -7.646 1.00 0.00 N ATOM 730 CA ARG A 47 8.614 18.344 -8.856 1.00 0.00 C ATOM 731 C ARG A 47 9.678 18.214 -9.949 1.00 0.00 C ATOM 732 O ARG A 47 9.353 18.158 -11.134 1.00 0.00 O ATOM 733 CB ARG A 47 8.341 19.826 -8.595 1.00 0.00 C ATOM 734 CG ARG A 47 7.203 20.339 -9.480 1.00 0.00 C ATOM 735 CD ARG A 47 6.089 20.960 -8.636 1.00 0.00 C ATOM 736 NE ARG A 47 5.295 19.896 -7.983 1.00 0.00 N ATOM 737 CZ ARG A 47 4.479 20.101 -6.939 1.00 0.00 C ATOM 738 NH1 ARG A 47 4.344 21.330 -6.425 1.00 0.00 N ATOM 739 NH2 ARG A 47 3.797 19.075 -6.410 1.00 0.00 N ATOM 0 H ARG A 47 9.345 18.293 -6.894 1.00 0.00 H new ATOM 0 HA ARG A 47 7.690 17.869 -9.184 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.085 19.973 -7.546 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.244 20.405 -8.786 1.00 0.00 H new ATOM 0 HG2 ARG A 47 7.588 21.079 -10.181 1.00 0.00 H new ATOM 0 HG3 ARG A 47 6.800 19.518 -10.073 1.00 0.00 H new ATOM 0 HD2 ARG A 47 6.518 21.620 -7.882 1.00 0.00 H new ATOM 0 HD3 ARG A 47 5.443 21.573 -9.265 1.00 0.00 H new ATOM 0 HE ARG A 47 5.373 18.947 -8.350 1.00 0.00 H new ATOM 0 HH11 ARG A 47 4.862 22.111 -6.828 1.00 0.00 H new ATOM 0 HH12 ARG A 47 3.723 21.485 -5.631 1.00 0.00 H new ATOM 0 HH21 ARG A 47 3.899 18.139 -6.802 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.176 19.231 -5.616 1.00 0.00 H new ATOM 753 N GLY A 48 10.928 18.171 -9.511 1.00 0.00 N ATOM 754 CA GLY A 48 12.041 18.049 -10.437 1.00 0.00 C ATOM 755 C GLY A 48 11.660 17.187 -11.642 1.00 0.00 C ATOM 756 O GLY A 48 12.100 17.449 -12.760 1.00 0.00 O ATOM 0 H GLY A 48 11.194 18.218 -8.528 1.00 0.00 H new ATOM 0 HA2 GLY A 48 12.347 19.039 -10.776 1.00 0.00 H new ATOM 0 HA3 GLY A 48 12.897 17.608 -9.926 1.00 0.00 H new ATOM 760 N ASP A 49 10.846 16.177 -11.374 1.00 0.00 N ATOM 761 CA ASP A 49 10.401 15.275 -12.423 1.00 0.00 C ATOM 762 C ASP A 49 8.919 14.954 -12.218 1.00 0.00 C ATOM 763 O ASP A 49 8.470 13.852 -12.529 1.00 0.00 O ATOM 764 CB ASP A 49 11.179 13.959 -12.384 1.00 0.00 C ATOM 765 CG ASP A 49 11.790 13.530 -13.720 1.00 0.00 C ATOM 766 OD1 ASP A 49 11.011 13.052 -14.573 1.00 0.00 O ATOM 767 OD2 ASP A 49 13.023 13.689 -13.858 1.00 0.00 O ATOM 0 H ASP A 49 10.483 15.963 -10.445 1.00 0.00 H new ATOM 0 HA ASP A 49 10.568 15.765 -13.382 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.978 14.048 -11.648 1.00 0.00 H new ATOM 0 HB3 ASP A 49 10.512 13.170 -12.036 1.00 0.00 H new ATOM 772 N GLN A 50 8.200 15.937 -11.697 1.00 0.00 N ATOM 773 CA GLN A 50 6.778 15.774 -11.447 1.00 0.00 C ATOM 774 C GLN A 50 6.474 14.331 -11.037 1.00 0.00 C ATOM 775 O GLN A 50 5.619 13.679 -11.635 1.00 0.00 O ATOM 776 CB GLN A 50 5.956 16.180 -12.672 1.00 0.00 C ATOM 777 CG GLN A 50 4.479 16.352 -12.309 1.00 0.00 C ATOM 778 CD GLN A 50 4.199 17.773 -11.817 1.00 0.00 C ATOM 779 OE1 GLN A 50 4.220 18.734 -12.569 1.00 0.00 O ATOM 780 NE2 GLN A 50 3.933 17.854 -10.516 1.00 0.00 N ATOM 0 H GLN A 50 8.576 16.850 -11.441 1.00 0.00 H new ATOM 0 HA GLN A 50 6.495 16.433 -10.626 1.00 0.00 H new ATOM 0 HB2 GLN A 50 6.344 17.112 -13.082 1.00 0.00 H new ATOM 0 HB3 GLN A 50 6.057 15.423 -13.450 1.00 0.00 H new ATOM 0 HG2 GLN A 50 3.859 16.135 -13.179 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.205 15.635 -11.536 1.00 0.00 H new ATOM 0 HE21 GLN A 50 3.931 17.011 -9.942 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.731 18.759 -10.092 1.00 0.00 H new ATOM 789 N SER A 51 7.191 13.875 -10.020 1.00 0.00 N ATOM 790 CA SER A 51 7.009 12.522 -9.524 1.00 0.00 C ATOM 791 C SER A 51 7.025 12.520 -7.994 1.00 0.00 C ATOM 792 O SER A 51 8.038 12.851 -7.379 1.00 0.00 O ATOM 793 CB SER A 51 8.089 11.585 -10.067 1.00 0.00 C ATOM 794 OG SER A 51 9.392 11.961 -9.628 1.00 0.00 O ATOM 0 H SER A 51 7.899 14.419 -9.526 1.00 0.00 H new ATOM 0 HA SER A 51 6.043 12.157 -9.872 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.879 10.565 -9.746 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.058 11.589 -11.157 1.00 0.00 H new ATOM 0 HG SER A 51 9.327 12.418 -8.763 1.00 0.00 H new ATOM 800 N THR A 52 5.891 12.143 -7.421 1.00 0.00 N ATOM 801 CA THR A 52 5.762 12.094 -5.975 1.00 0.00 C ATOM 802 C THR A 52 5.602 10.647 -5.503 1.00 0.00 C ATOM 803 O THR A 52 5.103 9.801 -6.243 1.00 0.00 O ATOM 804 CB THR A 52 4.594 12.997 -5.573 1.00 0.00 C ATOM 805 OG1 THR A 52 5.142 14.312 -5.616 1.00 0.00 O ATOM 806 CG2 THR A 52 4.186 12.811 -4.110 1.00 0.00 C ATOM 0 H THR A 52 5.053 11.868 -7.933 1.00 0.00 H new ATOM 0 HA THR A 52 6.662 12.465 -5.485 1.00 0.00 H new ATOM 0 HB THR A 52 3.739 12.792 -6.217 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.867 14.807 -4.817 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.354 13.475 -3.877 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.882 11.777 -3.946 1.00 0.00 H new ATOM 0 HG23 THR A 52 5.031 13.048 -3.464 1.00 0.00 H new ATOM 814 N ASP A 53 6.034 10.408 -4.274 1.00 0.00 N ATOM 815 CA ASP A 53 5.945 9.079 -3.695 1.00 0.00 C ATOM 816 C ASP A 53 5.437 9.188 -2.255 1.00 0.00 C ATOM 817 O ASP A 53 6.178 9.594 -1.360 1.00 0.00 O ATOM 818 CB ASP A 53 7.315 8.399 -3.662 1.00 0.00 C ATOM 819 CG ASP A 53 7.773 7.804 -4.995 1.00 0.00 C ATOM 820 OD1 ASP A 53 7.374 6.651 -5.269 1.00 0.00 O ATOM 821 OD2 ASP A 53 8.511 8.515 -5.710 1.00 0.00 O ATOM 0 H ASP A 53 6.447 11.113 -3.663 1.00 0.00 H new ATOM 0 HA ASP A 53 5.264 8.489 -4.309 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.057 9.126 -3.332 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.292 7.605 -2.916 1.00 0.00 H new ATOM 826 N TYR A 54 4.178 8.819 -2.076 1.00 0.00 N ATOM 827 CA TYR A 54 3.562 8.870 -0.761 1.00 0.00 C ATOM 828 C TYR A 54 2.442 7.834 -0.639 1.00 0.00 C ATOM 829 O TYR A 54 2.015 7.256 -1.637 1.00 0.00 O ATOM 830 CB TYR A 54 2.961 10.271 -0.630 1.00 0.00 C ATOM 831 CG TYR A 54 1.796 10.539 -1.585 1.00 0.00 C ATOM 832 CD1 TYR A 54 1.986 10.447 -2.949 1.00 0.00 C ATOM 833 CD2 TYR A 54 0.555 10.875 -1.083 1.00 0.00 C ATOM 834 CE1 TYR A 54 0.890 10.700 -3.847 1.00 0.00 C ATOM 835 CE2 TYR A 54 -0.540 11.129 -1.981 1.00 0.00 C ATOM 836 CZ TYR A 54 -0.320 11.028 -3.319 1.00 0.00 C ATOM 837 OH TYR A 54 -1.355 11.267 -4.168 1.00 0.00 O ATOM 0 H TYR A 54 3.567 8.483 -2.820 1.00 0.00 H new ATOM 0 HA TYR A 54 4.297 8.656 0.015 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.618 10.414 0.395 1.00 0.00 H new ATOM 0 HB3 TYR A 54 3.743 11.009 -0.810 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.957 10.185 -3.342 1.00 0.00 H new ATOM 0 HD2 TYR A 54 0.406 10.947 -0.016 1.00 0.00 H new ATOM 0 HE1 TYR A 54 1.025 10.631 -4.916 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.515 11.394 -1.601 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.172 10.859 -3.811 1.00 0.00 H new ATOM 847 N GLY A 55 1.999 7.632 0.593 1.00 0.00 N ATOM 848 CA GLY A 55 0.937 6.676 0.858 1.00 0.00 C ATOM 849 C GLY A 55 1.416 5.572 1.803 1.00 0.00 C ATOM 850 O GLY A 55 2.614 5.314 1.905 1.00 0.00 O ATOM 0 H GLY A 55 2.356 8.114 1.418 1.00 0.00 H new ATOM 0 HA2 GLY A 55 0.082 7.190 1.297 1.00 0.00 H new ATOM 0 HA3 GLY A 55 0.597 6.235 -0.079 1.00 0.00 H new ATOM 854 N ILE A 56 0.456 4.951 2.472 1.00 0.00 N ATOM 855 CA ILE A 56 0.765 3.882 3.406 1.00 0.00 C ATOM 856 C ILE A 56 1.747 2.908 2.752 1.00 0.00 C ATOM 857 O ILE A 56 2.655 2.402 3.410 1.00 0.00 O ATOM 858 CB ILE A 56 -0.521 3.216 3.902 1.00 0.00 C ATOM 859 CG1 ILE A 56 -0.228 2.244 5.048 1.00 0.00 C ATOM 860 CG2 ILE A 56 -1.268 2.537 2.752 1.00 0.00 C ATOM 861 CD1 ILE A 56 -1.147 2.511 6.241 1.00 0.00 C ATOM 0 H ILE A 56 -0.537 5.168 2.386 1.00 0.00 H new ATOM 0 HA ILE A 56 1.254 4.282 4.294 1.00 0.00 H new ATOM 0 HB ILE A 56 -1.176 3.992 4.297 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.362 1.219 4.703 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.813 2.343 5.357 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -2.177 2.072 3.133 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -1.529 3.280 1.998 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.631 1.774 2.304 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.918 1.807 7.041 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.993 3.529 6.598 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.186 2.387 5.935 1.00 0.00 H new ATOM 873 N PHE A 57 1.533 2.675 1.465 1.00 0.00 N ATOM 874 CA PHE A 57 2.389 1.772 0.716 1.00 0.00 C ATOM 875 C PHE A 57 3.348 2.548 -0.187 1.00 0.00 C ATOM 876 O PHE A 57 3.825 2.021 -1.192 1.00 0.00 O ATOM 877 CB PHE A 57 1.474 0.908 -0.155 1.00 0.00 C ATOM 878 CG PHE A 57 0.760 -0.210 0.609 1.00 0.00 C ATOM 879 CD1 PHE A 57 1.474 -1.059 1.396 1.00 0.00 C ATOM 880 CD2 PHE A 57 -0.588 -0.353 0.502 1.00 0.00 C ATOM 881 CE1 PHE A 57 0.812 -2.095 2.105 1.00 0.00 C ATOM 882 CE2 PHE A 57 -1.250 -1.389 1.212 1.00 0.00 C ATOM 883 CZ PHE A 57 -0.536 -2.238 1.998 1.00 0.00 C ATOM 0 H PHE A 57 0.779 3.096 0.922 1.00 0.00 H new ATOM 0 HA PHE A 57 2.985 1.170 1.402 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.727 1.548 -0.625 1.00 0.00 H new ATOM 0 HB3 PHE A 57 2.065 0.466 -0.957 1.00 0.00 H new ATOM 0 HD1 PHE A 57 2.545 -0.945 1.481 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -1.155 0.321 -0.123 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.379 -2.770 2.729 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -2.321 -1.503 1.128 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.040 -3.026 2.538 1.00 0.00 H new ATOM 893 N GLN A 58 3.604 3.789 0.202 1.00 0.00 N ATOM 894 CA GLN A 58 4.498 4.643 -0.560 1.00 0.00 C ATOM 895 C GLN A 58 4.276 4.441 -2.060 1.00 0.00 C ATOM 896 O GLN A 58 5.064 3.769 -2.724 1.00 0.00 O ATOM 897 CB GLN A 58 5.958 4.384 -0.182 1.00 0.00 C ATOM 898 CG GLN A 58 6.849 5.554 -0.606 1.00 0.00 C ATOM 899 CD GLN A 58 7.882 5.876 0.475 1.00 0.00 C ATOM 900 OE1 GLN A 58 8.438 5.001 1.120 1.00 0.00 O ATOM 901 NE2 GLN A 58 8.108 7.176 0.638 1.00 0.00 N ATOM 0 H GLN A 58 3.207 4.223 1.035 1.00 0.00 H new ATOM 0 HA GLN A 58 4.272 5.681 -0.316 1.00 0.00 H new ATOM 0 HB2 GLN A 58 6.038 4.233 0.895 1.00 0.00 H new ATOM 0 HB3 GLN A 58 6.304 3.467 -0.659 1.00 0.00 H new ATOM 0 HG2 GLN A 58 7.357 5.309 -1.539 1.00 0.00 H new ATOM 0 HG3 GLN A 58 6.234 6.433 -0.800 1.00 0.00 H new ATOM 0 HE21 GLN A 58 7.609 7.856 0.065 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.781 7.493 1.336 1.00 0.00 H new ATOM 910 N ILE A 59 3.197 5.034 -2.551 1.00 0.00 N ATOM 911 CA ILE A 59 2.861 4.928 -3.961 1.00 0.00 C ATOM 912 C ILE A 59 3.390 6.158 -4.702 1.00 0.00 C ATOM 913 O ILE A 59 3.482 7.241 -4.126 1.00 0.00 O ATOM 914 CB ILE A 59 1.358 4.703 -4.138 1.00 0.00 C ATOM 915 CG1 ILE A 59 0.977 3.258 -3.807 1.00 0.00 C ATOM 916 CG2 ILE A 59 0.904 5.110 -5.541 1.00 0.00 C ATOM 917 CD1 ILE A 59 -0.541 3.102 -3.701 1.00 0.00 C ATOM 0 H ILE A 59 2.544 5.589 -1.998 1.00 0.00 H new ATOM 0 HA ILE A 59 3.345 4.057 -4.403 1.00 0.00 H new ATOM 0 HB ILE A 59 0.831 5.344 -3.431 1.00 0.00 H new ATOM 0 HG12 ILE A 59 1.362 2.591 -4.578 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.443 2.961 -2.867 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.168 4.940 -5.640 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.120 6.166 -5.701 1.00 0.00 H new ATOM 0 HG23 ILE A 59 1.436 4.514 -6.283 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.785 2.066 -3.465 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.919 3.752 -2.912 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.002 3.376 -4.650 1.00 0.00 H new ATOM 929 N ASN A 60 3.724 5.949 -5.967 1.00 0.00 N ATOM 930 CA ASN A 60 4.241 7.027 -6.792 1.00 0.00 C ATOM 931 C ASN A 60 3.078 7.724 -7.501 1.00 0.00 C ATOM 932 O ASN A 60 2.185 7.064 -8.031 1.00 0.00 O ATOM 933 CB ASN A 60 5.195 6.493 -7.861 1.00 0.00 C ATOM 934 CG ASN A 60 5.681 5.084 -7.510 1.00 0.00 C ATOM 935 OD1 ASN A 60 6.448 4.877 -6.585 1.00 0.00 O ATOM 936 ND2 ASN A 60 5.191 4.132 -8.299 1.00 0.00 N ATOM 0 H ASN A 60 3.647 5.049 -6.441 1.00 0.00 H new ATOM 0 HA ASN A 60 4.777 7.720 -6.144 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.691 6.477 -8.828 1.00 0.00 H new ATOM 0 HB3 ASN A 60 6.050 7.163 -7.958 1.00 0.00 H new ATOM 0 HD21 ASN A 60 5.454 3.158 -8.147 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.552 4.376 -9.056 1.00 0.00 H new ATOM 943 N SER A 61 3.126 9.048 -7.487 1.00 0.00 N ATOM 944 CA SER A 61 2.088 9.842 -8.123 1.00 0.00 C ATOM 945 C SER A 61 2.476 10.149 -9.570 1.00 0.00 C ATOM 946 O SER A 61 1.736 10.823 -10.285 1.00 0.00 O ATOM 947 CB SER A 61 1.838 11.140 -7.353 1.00 0.00 C ATOM 948 OG SER A 61 1.861 12.280 -8.207 1.00 0.00 O ATOM 0 H SER A 61 3.868 9.591 -7.045 1.00 0.00 H new ATOM 0 HA SER A 61 1.164 9.264 -8.117 1.00 0.00 H new ATOM 0 HB2 SER A 61 0.873 11.083 -6.850 1.00 0.00 H new ATOM 0 HB3 SER A 61 2.595 11.253 -6.577 1.00 0.00 H new ATOM 0 HG SER A 61 1.436 12.057 -9.062 1.00 0.00 H new ATOM 954 N ARG A 62 3.637 9.640 -9.959 1.00 0.00 N ATOM 955 CA ARG A 62 4.132 9.853 -11.308 1.00 0.00 C ATOM 956 C ARG A 62 3.605 8.764 -12.244 1.00 0.00 C ATOM 957 O ARG A 62 3.665 8.906 -13.464 1.00 0.00 O ATOM 958 CB ARG A 62 5.662 9.848 -11.341 1.00 0.00 C ATOM 959 CG ARG A 62 6.187 10.611 -12.558 1.00 0.00 C ATOM 960 CD ARG A 62 7.424 9.925 -13.142 1.00 0.00 C ATOM 961 NE ARG A 62 7.471 10.131 -14.608 1.00 0.00 N ATOM 962 CZ ARG A 62 8.148 9.344 -15.455 1.00 0.00 C ATOM 963 NH1 ARG A 62 8.838 8.293 -14.989 1.00 0.00 N ATOM 964 NH2 ARG A 62 8.135 9.607 -16.769 1.00 0.00 N ATOM 0 H ARG A 62 4.248 9.081 -9.363 1.00 0.00 H new ATOM 0 HA ARG A 62 3.776 10.828 -11.642 1.00 0.00 H new ATOM 0 HB2 ARG A 62 6.050 10.300 -10.429 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.025 8.821 -11.367 1.00 0.00 H new ATOM 0 HG2 ARG A 62 5.408 10.672 -13.318 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.434 11.633 -12.272 1.00 0.00 H new ATOM 0 HD2 ARG A 62 8.326 10.328 -12.681 1.00 0.00 H new ATOM 0 HD3 ARG A 62 7.400 8.859 -12.917 1.00 0.00 H new ATOM 0 HE ARG A 62 6.956 10.921 -14.997 1.00 0.00 H new ATOM 0 HH11 ARG A 62 8.848 8.092 -13.989 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.353 7.694 -15.634 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.610 10.406 -17.124 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.650 9.008 -17.414 1.00 0.00 H new ATOM 978 N TYR A 63 3.103 7.698 -11.638 1.00 0.00 N ATOM 979 CA TYR A 63 2.567 6.585 -12.401 1.00 0.00 C ATOM 980 C TYR A 63 1.115 6.300 -12.010 1.00 0.00 C ATOM 981 O TYR A 63 0.216 6.379 -12.846 1.00 0.00 O ATOM 982 CB TYR A 63 3.427 5.372 -12.040 1.00 0.00 C ATOM 983 CG TYR A 63 4.066 4.681 -13.246 1.00 0.00 C ATOM 984 CD1 TYR A 63 5.268 5.137 -13.746 1.00 0.00 C ATOM 985 CD2 TYR A 63 3.439 3.601 -13.834 1.00 0.00 C ATOM 986 CE1 TYR A 63 5.869 4.487 -14.882 1.00 0.00 C ATOM 987 CE2 TYR A 63 4.040 2.950 -14.969 1.00 0.00 C ATOM 988 CZ TYR A 63 5.225 3.425 -15.437 1.00 0.00 C ATOM 989 OH TYR A 63 5.793 2.810 -16.510 1.00 0.00 O ATOM 0 H TYR A 63 3.056 7.582 -10.626 1.00 0.00 H new ATOM 0 HA TYR A 63 2.585 6.808 -13.468 1.00 0.00 H new ATOM 0 HB2 TYR A 63 4.215 5.689 -11.356 1.00 0.00 H new ATOM 0 HB3 TYR A 63 2.811 4.649 -11.504 1.00 0.00 H new ATOM 0 HD1 TYR A 63 5.759 5.982 -13.285 1.00 0.00 H new ATOM 0 HD2 TYR A 63 2.498 3.244 -13.443 1.00 0.00 H new ATOM 0 HE1 TYR A 63 6.809 4.835 -15.284 1.00 0.00 H new ATOM 0 HE2 TYR A 63 3.560 2.104 -15.438 1.00 0.00 H new ATOM 0 HH TYR A 63 5.223 2.068 -16.801 1.00 0.00 H new ATOM 999 N TRP A 64 0.931 5.974 -10.739 1.00 0.00 N ATOM 1000 CA TRP A 64 -0.396 5.677 -10.227 1.00 0.00 C ATOM 1001 C TRP A 64 -0.990 6.974 -9.673 1.00 0.00 C ATOM 1002 O TRP A 64 -0.259 7.914 -9.365 1.00 0.00 O ATOM 1003 CB TRP A 64 -0.344 4.553 -9.191 1.00 0.00 C ATOM 1004 CG TRP A 64 0.250 3.245 -9.719 1.00 0.00 C ATOM 1005 CD1 TRP A 64 1.507 2.800 -9.594 1.00 0.00 C ATOM 1006 CD2 TRP A 64 -0.446 2.227 -10.469 1.00 0.00 C ATOM 1007 NE1 TRP A 64 1.672 1.574 -10.204 1.00 0.00 N ATOM 1008 CE2 TRP A 64 0.447 1.214 -10.752 1.00 0.00 C ATOM 1009 CE3 TRP A 64 -1.785 2.162 -10.891 1.00 0.00 C ATOM 1010 CZ2 TRP A 64 0.099 0.064 -11.471 1.00 0.00 C ATOM 1011 CZ3 TRP A 64 -2.117 1.007 -11.609 1.00 0.00 C ATOM 1012 CH2 TRP A 64 -1.230 -0.022 -11.903 1.00 0.00 C ATOM 0 H TRP A 64 1.679 5.909 -10.049 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.044 5.310 -11.023 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.244 4.888 -8.336 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -1.354 4.361 -8.828 1.00 0.00 H new ATOM 0 HD1 TRP A 64 2.293 3.334 -9.080 1.00 0.00 H new ATOM 0 HE1 TRP A 64 2.535 1.031 -10.245 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.501 2.942 -10.678 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 0.817 -0.715 -11.681 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.134 0.909 -11.959 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -1.564 -0.884 -12.462 1.00 0.00 H new ATOM 1023 N CYS A 65 -2.309 6.983 -9.563 1.00 0.00 N ATOM 1024 CA CYS A 65 -3.010 8.149 -9.051 1.00 0.00 C ATOM 1025 C CYS A 65 -2.704 9.335 -9.968 1.00 0.00 C ATOM 1026 O CYS A 65 -1.671 9.357 -10.636 1.00 0.00 O ATOM 1027 CB CYS A 65 -2.636 8.441 -7.596 1.00 0.00 C ATOM 1028 SG CYS A 65 -1.342 9.716 -7.378 1.00 0.00 S ATOM 0 H CYS A 65 -2.912 6.201 -9.820 1.00 0.00 H new ATOM 0 HA CYS A 65 -4.083 7.959 -9.050 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -3.532 8.757 -7.062 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -2.297 7.516 -7.130 1.00 0.00 H new ATOM 1033 N ASN A 66 -3.620 10.291 -9.972 1.00 0.00 N ATOM 1034 CA ASN A 66 -3.461 11.477 -10.796 1.00 0.00 C ATOM 1035 C ASN A 66 -3.809 12.718 -9.971 1.00 0.00 C ATOM 1036 O ASN A 66 -3.997 12.628 -8.758 1.00 0.00 O ATOM 1037 CB ASN A 66 -4.395 11.436 -12.006 1.00 0.00 C ATOM 1038 CG ASN A 66 -3.634 11.745 -13.298 1.00 0.00 C ATOM 1039 OD1 ASN A 66 -2.417 11.827 -13.327 1.00 0.00 O ATOM 1040 ND2 ASN A 66 -4.417 11.912 -14.360 1.00 0.00 N ATOM 0 H ASN A 66 -4.476 10.269 -9.417 1.00 0.00 H new ATOM 0 HA ASN A 66 -2.427 11.512 -11.140 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -4.858 10.452 -12.079 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.200 12.158 -11.873 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -4.005 12.123 -15.269 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -5.429 11.829 -14.265 1.00 0.00 H new ATOM 1047 N ASP A 67 -3.887 13.846 -10.661 1.00 0.00 N ATOM 1048 CA ASP A 67 -4.210 15.102 -10.007 1.00 0.00 C ATOM 1049 C ASP A 67 -5.372 15.772 -10.743 1.00 0.00 C ATOM 1050 O ASP A 67 -6.343 16.197 -10.121 1.00 0.00 O ATOM 1051 CB ASP A 67 -3.018 16.061 -10.035 1.00 0.00 C ATOM 1052 CG ASP A 67 -3.229 17.378 -9.287 1.00 0.00 C ATOM 1053 OD1 ASP A 67 -4.409 17.710 -9.044 1.00 0.00 O ATOM 1054 OD2 ASP A 67 -2.205 18.024 -8.975 1.00 0.00 O ATOM 0 H ASP A 67 -3.732 13.916 -11.667 1.00 0.00 H new ATOM 0 HA ASP A 67 -4.474 14.884 -8.972 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -2.153 15.553 -9.609 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.776 16.286 -11.074 1.00 0.00 H new ATOM 1059 N GLY A 68 -5.234 15.843 -12.059 1.00 0.00 N ATOM 1060 CA GLY A 68 -6.260 16.453 -12.887 1.00 0.00 C ATOM 1061 C GLY A 68 -5.808 17.822 -13.401 1.00 0.00 C ATOM 1062 O GLY A 68 -6.544 18.490 -14.127 1.00 0.00 O ATOM 0 H GLY A 68 -4.427 15.488 -12.572 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.487 15.801 -13.730 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -7.179 16.562 -12.312 1.00 0.00 H new ATOM 1066 N LYS A 69 -4.602 18.198 -13.005 1.00 0.00 N ATOM 1067 CA LYS A 69 -4.043 19.475 -13.416 1.00 0.00 C ATOM 1068 C LYS A 69 -2.622 19.259 -13.941 1.00 0.00 C ATOM 1069 O LYS A 69 -1.875 20.218 -14.129 1.00 0.00 O ATOM 1070 CB LYS A 69 -4.130 20.490 -12.274 1.00 0.00 C ATOM 1071 CG LYS A 69 -5.577 20.922 -12.034 1.00 0.00 C ATOM 1072 CD LYS A 69 -5.788 21.349 -10.580 1.00 0.00 C ATOM 1073 CE LYS A 69 -6.994 22.281 -10.450 1.00 0.00 C ATOM 1074 NZ LYS A 69 -8.028 21.674 -9.584 1.00 0.00 N ATOM 0 H LYS A 69 -3.995 17.641 -12.403 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.624 19.900 -14.234 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.721 20.053 -11.363 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.521 21.362 -12.511 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.829 21.748 -12.699 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.251 20.100 -12.277 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.937 20.467 -9.957 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.894 21.852 -10.212 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -6.678 23.238 -10.033 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -7.411 22.485 -11.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -8.839 22.320 -9.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -8.341 20.773 -9.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.631 21.502 -8.638 1.00 0.00 H new ATOM 1088 N THR A 70 -2.293 17.996 -14.163 1.00 0.00 N ATOM 1089 CA THR A 70 -0.976 17.643 -14.664 1.00 0.00 C ATOM 1090 C THR A 70 -1.095 16.712 -15.872 1.00 0.00 C ATOM 1091 O THR A 70 -1.100 15.491 -15.721 1.00 0.00 O ATOM 1092 CB THR A 70 -0.177 17.038 -13.508 1.00 0.00 C ATOM 1093 OG1 THR A 70 0.343 18.169 -12.815 1.00 0.00 O ATOM 1094 CG2 THR A 70 1.069 16.288 -13.984 1.00 0.00 C ATOM 0 H THR A 70 -2.916 17.204 -14.005 1.00 0.00 H new ATOM 0 HA THR A 70 -0.442 18.523 -15.023 1.00 0.00 H new ATOM 0 HB THR A 70 -0.816 16.358 -12.944 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.874 17.867 -12.048 1.00 0.00 H new ATOM 0 HG21 THR A 70 1.598 15.879 -13.123 1.00 0.00 H new ATOM 0 HG22 THR A 70 0.773 15.476 -14.648 1.00 0.00 H new ATOM 0 HG23 THR A 70 1.724 16.974 -14.520 1.00 0.00 H new ATOM 1102 N PRO A 71 -1.190 17.340 -17.074 1.00 0.00 N ATOM 1103 CA PRO A 71 -1.310 16.581 -18.308 1.00 0.00 C ATOM 1104 C PRO A 71 0.032 15.958 -18.701 1.00 0.00 C ATOM 1105 O PRO A 71 0.584 16.278 -19.751 1.00 0.00 O ATOM 1106 CB PRO A 71 -1.826 17.577 -19.333 1.00 0.00 C ATOM 1107 CG PRO A 71 -1.535 18.954 -18.760 1.00 0.00 C ATOM 1108 CD PRO A 71 -1.187 18.783 -17.291 1.00 0.00 C ATOM 0 HA PRO A 71 -1.991 15.734 -18.217 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -1.330 17.441 -20.294 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -2.894 17.443 -19.504 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.710 19.424 -19.296 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.401 19.606 -18.874 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.213 19.216 -17.062 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.915 19.281 -16.651 1.00 0.00 H new ATOM 1116 N ARG A 72 0.516 15.081 -17.835 1.00 0.00 N ATOM 1117 CA ARG A 72 1.782 14.410 -18.078 1.00 0.00 C ATOM 1118 C ARG A 72 1.774 13.015 -17.447 1.00 0.00 C ATOM 1119 O ARG A 72 1.883 12.013 -18.150 1.00 0.00 O ATOM 1120 CB ARG A 72 2.950 15.215 -17.504 1.00 0.00 C ATOM 1121 CG ARG A 72 3.903 15.664 -18.614 1.00 0.00 C ATOM 1122 CD ARG A 72 4.222 17.155 -18.493 1.00 0.00 C ATOM 1123 NE ARG A 72 5.416 17.485 -19.302 1.00 0.00 N ATOM 1124 CZ ARG A 72 6.653 17.048 -19.029 1.00 0.00 C ATOM 1125 NH1 ARG A 72 6.866 16.260 -17.966 1.00 0.00 N ATOM 1126 NH2 ARG A 72 7.678 17.397 -19.818 1.00 0.00 N ATOM 0 H ARG A 72 0.055 14.819 -16.964 1.00 0.00 H new ATOM 0 HA ARG A 72 1.910 14.323 -19.157 1.00 0.00 H new ATOM 0 HB2 ARG A 72 2.569 16.087 -16.972 1.00 0.00 H new ATOM 0 HB3 ARG A 72 3.492 14.609 -16.777 1.00 0.00 H new ATOM 0 HG2 ARG A 72 4.826 15.086 -18.562 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.455 15.462 -19.587 1.00 0.00 H new ATOM 0 HD2 ARG A 72 3.370 17.746 -18.829 1.00 0.00 H new ATOM 0 HD3 ARG A 72 4.397 17.414 -17.449 1.00 0.00 H new ATOM 0 HE ARG A 72 5.290 18.083 -20.119 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.087 15.993 -17.365 1.00 0.00 H new ATOM 0 HH12 ARG A 72 7.808 15.927 -17.758 1.00 0.00 H new ATOM 0 HH21 ARG A 72 7.517 17.996 -20.628 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.619 17.064 -19.609 1.00 0.00 H new ATOM 1140 N ALA A 73 1.644 12.998 -16.129 1.00 0.00 N ATOM 1141 CA ALA A 73 1.620 11.744 -15.396 1.00 0.00 C ATOM 1142 C ALA A 73 0.706 10.753 -16.120 1.00 0.00 C ATOM 1143 O ALA A 73 -0.106 11.147 -16.954 1.00 0.00 O ATOM 1144 CB ALA A 73 1.175 12.002 -13.956 1.00 0.00 C ATOM 0 H ALA A 73 1.554 13.833 -15.550 1.00 0.00 H new ATOM 0 HA ALA A 73 2.617 11.305 -15.355 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.157 11.061 -13.407 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.873 12.689 -13.477 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.177 12.441 -13.957 1.00 0.00 H new ATOM 1150 N VAL A 74 0.870 9.484 -15.774 1.00 0.00 N ATOM 1151 CA VAL A 74 0.071 8.434 -16.379 1.00 0.00 C ATOM 1152 C VAL A 74 -0.665 7.661 -15.283 1.00 0.00 C ATOM 1153 O VAL A 74 -0.475 6.454 -15.134 1.00 0.00 O ATOM 1154 CB VAL A 74 0.955 7.538 -17.251 1.00 0.00 C ATOM 1155 CG1 VAL A 74 2.066 6.893 -16.421 1.00 0.00 C ATOM 1156 CG2 VAL A 74 0.121 6.478 -17.972 1.00 0.00 C ATOM 0 H VAL A 74 1.545 9.160 -15.082 1.00 0.00 H new ATOM 0 HA VAL A 74 -0.684 8.863 -17.038 1.00 0.00 H new ATOM 0 HB VAL A 74 1.424 8.165 -18.009 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.680 6.262 -17.063 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.687 7.671 -15.977 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.624 6.286 -15.631 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.774 5.856 -18.584 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.390 5.855 -17.238 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.616 6.966 -18.609 1.00 0.00 H new ATOM 1166 N ASN A 75 -1.488 8.388 -14.541 1.00 0.00 N ATOM 1167 CA ASN A 75 -2.252 7.785 -13.462 1.00 0.00 C ATOM 1168 C ASN A 75 -2.823 6.446 -13.932 1.00 0.00 C ATOM 1169 O ASN A 75 -3.867 6.404 -14.581 1.00 0.00 O ATOM 1170 CB ASN A 75 -3.425 8.679 -13.052 1.00 0.00 C ATOM 1171 CG ASN A 75 -4.182 9.188 -14.279 1.00 0.00 C ATOM 1172 OD1 ASN A 75 -3.624 9.388 -15.347 1.00 0.00 O ATOM 1173 ND2 ASN A 75 -5.481 9.386 -14.071 1.00 0.00 N ATOM 0 H ASN A 75 -1.642 9.389 -14.666 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.584 7.650 -12.611 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.104 8.121 -12.407 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.057 9.525 -12.471 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -6.073 9.725 -14.829 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -5.885 9.199 -13.153 1.00 0.00 H new ATOM 1180 N ALA A 76 -2.110 5.383 -13.589 1.00 0.00 N ATOM 1181 CA ALA A 76 -2.531 4.045 -13.967 1.00 0.00 C ATOM 1182 C ALA A 76 -3.628 3.570 -13.011 1.00 0.00 C ATOM 1183 O ALA A 76 -4.262 2.544 -13.249 1.00 0.00 O ATOM 1184 CB ALA A 76 -1.320 3.111 -13.975 1.00 0.00 C ATOM 0 H ALA A 76 -1.243 5.422 -13.053 1.00 0.00 H new ATOM 0 HA ALA A 76 -2.949 4.045 -14.974 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.637 2.107 -14.259 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -0.584 3.476 -14.692 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.875 3.084 -12.980 1.00 0.00 H new ATOM 1190 N CYS A 77 -3.817 4.340 -11.950 1.00 0.00 N ATOM 1191 CA CYS A 77 -4.825 4.011 -10.957 1.00 0.00 C ATOM 1192 C CYS A 77 -6.131 4.706 -11.349 1.00 0.00 C ATOM 1193 O CYS A 77 -7.216 4.201 -11.065 1.00 0.00 O ATOM 1194 CB CYS A 77 -4.376 4.396 -9.545 1.00 0.00 C ATOM 1195 SG CYS A 77 -5.122 3.400 -8.204 1.00 0.00 S ATOM 0 H CYS A 77 -3.289 5.191 -11.756 1.00 0.00 H new ATOM 0 HA CYS A 77 -4.980 2.932 -10.937 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.291 4.304 -9.486 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -4.617 5.446 -9.376 1.00 0.00 H new ATOM 1200 N GLY A 78 -5.982 5.852 -11.996 1.00 0.00 N ATOM 1201 CA GLY A 78 -7.136 6.621 -12.431 1.00 0.00 C ATOM 1202 C GLY A 78 -7.986 7.056 -11.236 1.00 0.00 C ATOM 1203 O GLY A 78 -9.211 6.939 -11.266 1.00 0.00 O ATOM 0 H GLY A 78 -5.080 6.267 -12.230 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -6.805 7.499 -12.985 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -7.740 6.023 -13.113 1.00 0.00 H new ATOM 1207 N ILE A 79 -7.304 7.547 -10.212 1.00 0.00 N ATOM 1208 CA ILE A 79 -7.982 7.999 -9.009 1.00 0.00 C ATOM 1209 C ILE A 79 -7.350 9.309 -8.533 1.00 0.00 C ATOM 1210 O ILE A 79 -6.298 9.709 -9.030 1.00 0.00 O ATOM 1211 CB ILE A 79 -7.985 6.897 -7.949 1.00 0.00 C ATOM 1212 CG1 ILE A 79 -7.030 7.236 -6.802 1.00 0.00 C ATOM 1213 CG2 ILE A 79 -7.672 5.535 -8.572 1.00 0.00 C ATOM 1214 CD1 ILE A 79 -5.593 7.377 -7.310 1.00 0.00 C ATOM 0 H ILE A 79 -6.289 7.642 -10.190 1.00 0.00 H new ATOM 0 HA ILE A 79 -9.031 8.209 -9.220 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.987 6.834 -7.525 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -7.344 8.164 -6.325 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.076 6.456 -6.042 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.681 4.769 -7.796 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -8.424 5.298 -9.324 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.688 5.566 -9.040 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.934 7.618 -6.476 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.274 6.439 -7.765 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.546 8.174 -8.052 1.00 0.00 H new ATOM 1226 N ASN A 80 -8.017 9.938 -7.578 1.00 0.00 N ATOM 1227 CA ASN A 80 -7.532 11.193 -7.029 1.00 0.00 C ATOM 1228 C ASN A 80 -6.308 10.924 -6.152 1.00 0.00 C ATOM 1229 O ASN A 80 -6.387 10.165 -5.187 1.00 0.00 O ATOM 1230 CB ASN A 80 -8.599 11.863 -6.161 1.00 0.00 C ATOM 1231 CG ASN A 80 -9.619 12.609 -7.022 1.00 0.00 C ATOM 1232 OD1 ASN A 80 -9.961 12.199 -8.119 1.00 0.00 O ATOM 1233 ND2 ASN A 80 -10.084 13.724 -6.467 1.00 0.00 N ATOM 0 H ASN A 80 -8.890 9.603 -7.170 1.00 0.00 H new ATOM 0 HA ASN A 80 -7.280 11.850 -7.862 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -9.108 11.110 -5.559 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -8.125 12.558 -5.468 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -10.769 14.293 -6.963 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -9.755 14.010 -5.545 1.00 0.00 H new ATOM 1240 N CYS A 81 -5.205 11.560 -6.518 1.00 0.00 N ATOM 1241 CA CYS A 81 -3.967 11.398 -5.776 1.00 0.00 C ATOM 1242 C CYS A 81 -4.260 11.642 -4.294 1.00 0.00 C ATOM 1243 O CYS A 81 -3.600 11.071 -3.425 1.00 0.00 O ATOM 1244 CB CYS A 81 -2.867 12.325 -6.300 1.00 0.00 C ATOM 1245 SG CYS A 81 -1.725 11.555 -7.505 1.00 0.00 S ATOM 0 H CYS A 81 -5.143 12.189 -7.319 1.00 0.00 H new ATOM 0 HA CYS A 81 -3.591 10.384 -5.909 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -3.334 13.193 -6.766 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -2.286 12.692 -5.453 1.00 0.00 H new ATOM 1250 N SER A 82 -5.248 12.489 -4.050 1.00 0.00 N ATOM 1251 CA SER A 82 -5.636 12.814 -2.688 1.00 0.00 C ATOM 1252 C SER A 82 -6.071 11.546 -1.950 1.00 0.00 C ATOM 1253 O SER A 82 -6.023 11.491 -0.723 1.00 0.00 O ATOM 1254 CB SER A 82 -6.760 13.852 -2.669 1.00 0.00 C ATOM 1255 OG SER A 82 -8.047 13.246 -2.755 1.00 0.00 O ATOM 0 H SER A 82 -5.792 12.961 -4.773 1.00 0.00 H new ATOM 0 HA SER A 82 -4.773 13.243 -2.180 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.696 14.439 -1.753 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.629 14.544 -3.501 1.00 0.00 H new ATOM 0 HG SER A 82 -8.738 13.941 -2.738 1.00 0.00 H new ATOM 1261 N ALA A 83 -6.484 10.558 -2.730 1.00 0.00 N ATOM 1262 CA ALA A 83 -6.927 9.295 -2.166 1.00 0.00 C ATOM 1263 C ALA A 83 -5.742 8.599 -1.495 1.00 0.00 C ATOM 1264 O ALA A 83 -5.919 7.606 -0.790 1.00 0.00 O ATOM 1265 CB ALA A 83 -7.560 8.439 -3.266 1.00 0.00 C ATOM 0 H ALA A 83 -6.521 10.607 -3.748 1.00 0.00 H new ATOM 0 HA ALA A 83 -7.688 9.460 -1.403 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -7.893 7.491 -2.843 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -8.414 8.966 -3.691 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.825 8.249 -4.048 1.00 0.00 H new ATOM 1271 N LEU A 84 -4.560 9.146 -1.736 1.00 0.00 N ATOM 1272 CA LEU A 84 -3.346 8.589 -1.163 1.00 0.00 C ATOM 1273 C LEU A 84 -2.917 9.438 0.035 1.00 0.00 C ATOM 1274 O LEU A 84 -1.851 9.217 0.607 1.00 0.00 O ATOM 1275 CB LEU A 84 -2.264 8.446 -2.235 1.00 0.00 C ATOM 1276 CG LEU A 84 -2.693 7.760 -3.534 1.00 0.00 C ATOM 1277 CD1 LEU A 84 -1.479 7.431 -4.406 1.00 0.00 C ATOM 1278 CD2 LEU A 84 -3.544 6.523 -3.245 1.00 0.00 C ATOM 0 H LEU A 84 -4.417 9.970 -2.321 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.528 7.581 -0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.889 9.440 -2.479 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.431 7.886 -1.810 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.316 8.454 -4.098 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.811 6.944 -5.323 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.950 8.351 -4.655 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.811 6.763 -3.862 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.836 6.054 -4.185 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.967 5.815 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -4.437 6.817 -2.694 1.00 0.00 H new ATOM 1290 N LEU A 85 -3.769 10.392 0.379 1.00 0.00 N ATOM 1291 CA LEU A 85 -3.492 11.275 1.499 1.00 0.00 C ATOM 1292 C LEU A 85 -4.803 11.619 2.209 1.00 0.00 C ATOM 1293 O LEU A 85 -4.861 12.572 2.985 1.00 0.00 O ATOM 1294 CB LEU A 85 -2.706 12.502 1.032 1.00 0.00 C ATOM 1295 CG LEU A 85 -1.817 13.170 2.083 1.00 0.00 C ATOM 1296 CD1 LEU A 85 -0.558 12.341 2.342 1.00 0.00 C ATOM 1297 CD2 LEU A 85 -1.483 14.610 1.684 1.00 0.00 C ATOM 0 H LEU A 85 -4.652 10.573 -0.098 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.855 10.775 2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.080 12.209 0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.414 13.243 0.660 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.371 13.216 3.020 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.057 12.838 3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.841 11.352 2.702 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.009 12.242 1.416 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.850 15.062 2.448 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.956 14.610 0.730 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.404 15.185 1.590 1.00 0.00 H new ATOM 1309 N GLN A 86 -5.823 10.824 1.918 1.00 0.00 N ATOM 1310 CA GLN A 86 -7.128 11.031 2.521 1.00 0.00 C ATOM 1311 C GLN A 86 -7.245 10.239 3.824 1.00 0.00 C ATOM 1312 O GLN A 86 -6.265 9.661 4.293 1.00 0.00 O ATOM 1313 CB GLN A 86 -8.246 10.653 1.547 1.00 0.00 C ATOM 1314 CG GLN A 86 -8.352 11.673 0.410 1.00 0.00 C ATOM 1315 CD GLN A 86 -9.730 12.337 0.394 1.00 0.00 C ATOM 1316 OE1 GLN A 86 -10.202 12.869 1.386 1.00 0.00 O ATOM 1317 NE2 GLN A 86 -10.347 12.275 -0.782 1.00 0.00 N ATOM 0 H GLN A 86 -5.771 10.036 1.273 1.00 0.00 H new ATOM 0 HA GLN A 86 -7.235 12.090 2.754 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -8.054 9.662 1.135 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -9.195 10.598 2.081 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -7.580 12.433 0.526 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.172 11.179 -0.545 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -9.895 11.814 -1.572 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -11.273 12.688 -0.895 1.00 0.00 H new ATOM 1326 N ASP A 87 -8.451 10.235 4.372 1.00 0.00 N ATOM 1327 CA ASP A 87 -8.708 9.522 5.611 1.00 0.00 C ATOM 1328 C ASP A 87 -8.870 8.031 5.313 1.00 0.00 C ATOM 1329 O ASP A 87 -8.005 7.228 5.657 1.00 0.00 O ATOM 1330 CB ASP A 87 -9.997 10.016 6.273 1.00 0.00 C ATOM 1331 CG ASP A 87 -10.416 9.245 7.526 1.00 0.00 C ATOM 1332 OD1 ASP A 87 -10.842 8.082 7.361 1.00 0.00 O ATOM 1333 OD2 ASP A 87 -10.300 9.837 8.621 1.00 0.00 O ATOM 0 H ASP A 87 -9.261 10.715 3.980 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.867 9.698 6.282 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -9.873 11.067 6.535 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -10.806 9.962 5.544 1.00 0.00 H new ATOM 1338 N ASP A 88 -9.986 7.705 4.675 1.00 0.00 N ATOM 1339 CA ASP A 88 -10.272 6.324 4.327 1.00 0.00 C ATOM 1340 C ASP A 88 -9.128 5.770 3.475 1.00 0.00 C ATOM 1341 O ASP A 88 -8.570 6.480 2.640 1.00 0.00 O ATOM 1342 CB ASP A 88 -11.562 6.219 3.511 1.00 0.00 C ATOM 1343 CG ASP A 88 -12.842 6.562 4.277 1.00 0.00 C ATOM 1344 OD1 ASP A 88 -13.330 5.665 4.998 1.00 0.00 O ATOM 1345 OD2 ASP A 88 -13.302 7.714 4.124 1.00 0.00 O ATOM 0 H ASP A 88 -10.702 8.374 4.391 1.00 0.00 H new ATOM 0 HA ASP A 88 -10.382 5.758 5.252 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -11.484 6.882 2.649 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -11.648 5.203 3.125 1.00 0.00 H new ATOM 1350 N ILE A 89 -8.812 4.506 3.717 1.00 0.00 N ATOM 1351 CA ILE A 89 -7.745 3.848 2.983 1.00 0.00 C ATOM 1352 C ILE A 89 -8.343 3.073 1.807 1.00 0.00 C ATOM 1353 O ILE A 89 -7.616 2.438 1.045 1.00 0.00 O ATOM 1354 CB ILE A 89 -6.902 2.984 3.924 1.00 0.00 C ATOM 1355 CG1 ILE A 89 -7.643 1.700 4.301 1.00 0.00 C ATOM 1356 CG2 ILE A 89 -6.466 3.779 5.156 1.00 0.00 C ATOM 1357 CD1 ILE A 89 -6.660 0.581 4.649 1.00 0.00 C ATOM 0 H ILE A 89 -9.276 3.920 4.411 1.00 0.00 H new ATOM 0 HA ILE A 89 -7.060 4.585 2.564 1.00 0.00 H new ATOM 0 HB ILE A 89 -5.996 2.688 3.396 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -8.298 1.890 5.151 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -8.278 1.386 3.473 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -5.869 3.141 5.808 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.871 4.637 4.843 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -7.347 4.126 5.696 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -7.213 -0.320 4.913 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -6.022 0.376 3.789 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -6.043 0.888 5.493 1.00 0.00 H new ATOM 1369 N THR A 90 -9.661 3.151 1.697 1.00 0.00 N ATOM 1370 CA THR A 90 -10.364 2.465 0.627 1.00 0.00 C ATOM 1371 C THR A 90 -9.613 2.630 -0.696 1.00 0.00 C ATOM 1372 O THR A 90 -9.566 1.705 -1.506 1.00 0.00 O ATOM 1373 CB THR A 90 -11.797 3.001 0.583 1.00 0.00 C ATOM 1374 OG1 THR A 90 -12.412 2.262 -0.469 1.00 0.00 O ATOM 1375 CG2 THR A 90 -11.864 4.454 0.109 1.00 0.00 C ATOM 0 H THR A 90 -10.260 3.679 2.331 1.00 0.00 H new ATOM 0 HA THR A 90 -10.408 1.391 0.808 1.00 0.00 H new ATOM 0 HB THR A 90 -12.245 2.922 1.574 1.00 0.00 H new ATOM 0 HG1 THR A 90 -13.345 2.545 -0.566 1.00 0.00 H new ATOM 0 HG21 THR A 90 -12.902 4.785 0.096 1.00 0.00 H new ATOM 0 HG22 THR A 90 -11.290 5.085 0.788 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.447 4.529 -0.895 1.00 0.00 H new ATOM 1383 N ALA A 91 -9.046 3.814 -0.874 1.00 0.00 N ATOM 1384 CA ALA A 91 -8.299 4.111 -2.085 1.00 0.00 C ATOM 1385 C ALA A 91 -6.958 3.376 -2.046 1.00 0.00 C ATOM 1386 O ALA A 91 -6.533 2.799 -3.046 1.00 0.00 O ATOM 1387 CB ALA A 91 -8.131 5.626 -2.222 1.00 0.00 C ATOM 0 H ALA A 91 -9.089 4.579 -0.200 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.840 3.762 -2.965 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -7.571 5.849 -3.130 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -9.112 6.098 -2.276 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.590 6.012 -1.358 1.00 0.00 H new ATOM 1393 N ALA A 92 -6.328 3.422 -0.881 1.00 0.00 N ATOM 1394 CA ALA A 92 -5.045 2.766 -0.699 1.00 0.00 C ATOM 1395 C ALA A 92 -5.180 1.283 -1.045 1.00 0.00 C ATOM 1396 O ALA A 92 -4.294 0.705 -1.674 1.00 0.00 O ATOM 1397 CB ALA A 92 -4.556 2.989 0.735 1.00 0.00 C ATOM 0 H ALA A 92 -6.682 3.903 -0.054 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.298 3.193 -1.368 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -3.593 2.497 0.872 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.447 4.058 0.920 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -5.280 2.572 1.435 1.00 0.00 H new ATOM 1403 N ILE A 93 -6.294 0.707 -0.619 1.00 0.00 N ATOM 1404 CA ILE A 93 -6.556 -0.698 -0.876 1.00 0.00 C ATOM 1405 C ILE A 93 -6.909 -0.885 -2.354 1.00 0.00 C ATOM 1406 O ILE A 93 -6.293 -1.695 -3.045 1.00 0.00 O ATOM 1407 CB ILE A 93 -7.625 -1.228 0.082 1.00 0.00 C ATOM 1408 CG1 ILE A 93 -7.351 -0.770 1.516 1.00 0.00 C ATOM 1409 CG2 ILE A 93 -7.748 -2.750 -0.021 1.00 0.00 C ATOM 1410 CD1 ILE A 93 -8.316 -1.437 2.499 1.00 0.00 C ATOM 0 H ILE A 93 -7.026 1.189 -0.097 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.663 -1.293 -0.683 1.00 0.00 H new ATOM 0 HB ILE A 93 -8.587 -0.807 -0.212 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -6.324 -1.012 1.789 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -7.451 0.313 1.581 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -8.514 -3.101 0.670 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -8.024 -3.025 -1.039 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -6.793 -3.210 0.232 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -8.099 -1.094 3.511 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -9.341 -1.173 2.238 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -8.196 -2.519 2.449 1.00 0.00 H new ATOM 1422 N GLN A 94 -7.898 -0.122 -2.794 1.00 0.00 N ATOM 1423 CA GLN A 94 -8.339 -0.193 -4.177 1.00 0.00 C ATOM 1424 C GLN A 94 -7.158 0.031 -5.123 1.00 0.00 C ATOM 1425 O GLN A 94 -7.009 -0.683 -6.114 1.00 0.00 O ATOM 1426 CB GLN A 94 -9.458 0.815 -4.448 1.00 0.00 C ATOM 1427 CG GLN A 94 -10.250 0.432 -5.699 1.00 0.00 C ATOM 1428 CD GLN A 94 -11.739 0.281 -5.382 1.00 0.00 C ATOM 1429 OE1 GLN A 94 -12.133 -0.344 -4.410 1.00 0.00 O ATOM 1430 NE2 GLN A 94 -12.542 0.887 -6.253 1.00 0.00 N ATOM 0 H GLN A 94 -8.407 0.549 -2.218 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.741 -1.190 -4.359 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -10.128 0.860 -3.589 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -9.033 1.811 -4.573 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.114 1.193 -6.467 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -9.865 -0.503 -6.105 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.146 1.393 -7.045 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -13.554 0.845 -6.129 1.00 0.00 H new ATOM 1439 N CYS A 95 -6.350 1.024 -4.784 1.00 0.00 N ATOM 1440 CA CYS A 95 -5.187 1.351 -5.591 1.00 0.00 C ATOM 1441 C CYS A 95 -4.155 0.235 -5.421 1.00 0.00 C ATOM 1442 O CYS A 95 -3.551 -0.211 -6.396 1.00 0.00 O ATOM 1443 CB CYS A 95 -4.611 2.721 -5.226 1.00 0.00 C ATOM 1444 SG CYS A 95 -3.802 3.607 -6.607 1.00 0.00 S ATOM 0 H CYS A 95 -6.478 1.613 -3.961 1.00 0.00 H new ATOM 0 HA CYS A 95 -5.477 1.420 -6.639 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -5.415 3.345 -4.834 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -3.887 2.592 -4.422 1.00 0.00 H new ATOM 1449 N ALA A 96 -3.984 -0.184 -4.176 1.00 0.00 N ATOM 1450 CA ALA A 96 -3.035 -1.241 -3.866 1.00 0.00 C ATOM 1451 C ALA A 96 -3.300 -2.441 -4.775 1.00 0.00 C ATOM 1452 O ALA A 96 -2.368 -3.020 -5.333 1.00 0.00 O ATOM 1453 CB ALA A 96 -3.137 -1.599 -2.382 1.00 0.00 C ATOM 0 H ALA A 96 -4.486 0.189 -3.370 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.014 -0.907 -4.051 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.426 -2.391 -2.149 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -2.911 -0.720 -1.779 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.147 -1.941 -2.159 1.00 0.00 H new ATOM 1459 N LYS A 97 -4.574 -2.780 -4.899 1.00 0.00 N ATOM 1460 CA LYS A 97 -4.973 -3.902 -5.732 1.00 0.00 C ATOM 1461 C LYS A 97 -4.830 -3.514 -7.205 1.00 0.00 C ATOM 1462 O LYS A 97 -4.317 -4.292 -8.008 1.00 0.00 O ATOM 1463 CB LYS A 97 -6.378 -4.376 -5.356 1.00 0.00 C ATOM 1464 CG LYS A 97 -7.407 -3.264 -5.568 1.00 0.00 C ATOM 1465 CD LYS A 97 -8.834 -3.809 -5.462 1.00 0.00 C ATOM 1466 CE LYS A 97 -9.771 -3.084 -6.428 1.00 0.00 C ATOM 1467 NZ LYS A 97 -10.313 -4.027 -7.431 1.00 0.00 N ATOM 0 H LYS A 97 -5.344 -2.297 -4.436 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.317 -4.755 -5.561 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.646 -5.244 -5.958 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.391 -4.695 -4.314 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.258 -2.479 -4.826 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.259 -2.809 -6.547 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.836 -4.877 -5.680 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.197 -3.692 -4.441 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.589 -2.624 -5.874 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.234 -2.279 -6.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.947 -3.518 -8.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.530 -4.447 -7.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -10.843 -4.780 -6.948 1.00 0.00 H new ATOM 1481 N ARG A 98 -5.291 -2.312 -7.516 1.00 0.00 N ATOM 1482 CA ARG A 98 -5.219 -1.811 -8.878 1.00 0.00 C ATOM 1483 C ARG A 98 -3.763 -1.731 -9.339 1.00 0.00 C ATOM 1484 O ARG A 98 -3.479 -1.832 -10.531 1.00 0.00 O ATOM 1485 CB ARG A 98 -5.859 -0.425 -8.989 1.00 0.00 C ATOM 1486 CG ARG A 98 -5.964 0.014 -10.451 1.00 0.00 C ATOM 1487 CD ARG A 98 -7.183 -0.616 -11.128 1.00 0.00 C ATOM 1488 NE ARG A 98 -7.165 -0.323 -12.578 1.00 0.00 N ATOM 1489 CZ ARG A 98 -8.244 -0.379 -13.369 1.00 0.00 C ATOM 1490 NH1 ARG A 98 -9.435 -0.716 -12.856 1.00 0.00 N ATOM 1491 NH2 ARG A 98 -8.134 -0.098 -14.675 1.00 0.00 N ATOM 0 H ARG A 98 -5.716 -1.670 -6.848 1.00 0.00 H new ATOM 0 HA ARG A 98 -5.767 -2.505 -9.516 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -6.851 -0.441 -8.538 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -5.267 0.299 -8.430 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -6.036 1.100 -10.504 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -5.058 -0.272 -10.986 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -7.182 -1.694 -10.967 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -8.098 -0.228 -10.682 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.275 -0.062 -13.002 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -9.520 -0.930 -11.862 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -10.257 -0.758 -13.459 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -7.228 0.159 -15.067 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -8.956 -0.141 -15.277 1.00 0.00 H new ATOM 1505 N VAL A 99 -2.878 -1.551 -8.369 1.00 0.00 N ATOM 1506 CA VAL A 99 -1.457 -1.457 -8.660 1.00 0.00 C ATOM 1507 C VAL A 99 -0.872 -2.865 -8.785 1.00 0.00 C ATOM 1508 O VAL A 99 -0.282 -3.208 -9.808 1.00 0.00 O ATOM 1509 CB VAL A 99 -0.759 -0.611 -7.594 1.00 0.00 C ATOM 1510 CG1 VAL A 99 0.751 -0.856 -7.601 1.00 0.00 C ATOM 1511 CG2 VAL A 99 -1.075 0.875 -7.779 1.00 0.00 C ATOM 0 H VAL A 99 -3.117 -1.468 -7.381 1.00 0.00 H new ATOM 0 HA VAL A 99 -1.295 -0.953 -9.613 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.143 -0.916 -6.620 1.00 0.00 H new ATOM 0 HG11 VAL A 99 1.223 -0.242 -6.834 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.950 -1.908 -7.397 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.158 -0.593 -8.577 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.566 1.454 -7.008 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.733 1.200 -8.762 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.151 1.031 -7.699 1.00 0.00 H new ATOM 1521 N VAL A 100 -1.055 -3.643 -7.728 1.00 0.00 N ATOM 1522 CA VAL A 100 -0.553 -5.006 -7.706 1.00 0.00 C ATOM 1523 C VAL A 100 -1.083 -5.760 -8.927 1.00 0.00 C ATOM 1524 O VAL A 100 -0.422 -6.664 -9.438 1.00 0.00 O ATOM 1525 CB VAL A 100 -0.921 -5.678 -6.382 1.00 0.00 C ATOM 1526 CG1 VAL A 100 -0.814 -7.201 -6.491 1.00 0.00 C ATOM 1527 CG2 VAL A 100 -0.055 -5.148 -5.238 1.00 0.00 C ATOM 0 H VAL A 100 -1.544 -3.355 -6.881 1.00 0.00 H new ATOM 0 HA VAL A 100 0.535 -5.013 -7.767 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.959 -5.430 -6.158 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.081 -7.654 -5.536 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -1.493 -7.559 -7.265 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.208 -7.476 -6.750 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.338 -5.642 -4.309 1.00 0.00 H new ATOM 0 HG22 VAL A 100 0.994 -5.350 -5.452 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -0.204 -4.073 -5.137 1.00 0.00 H new ATOM 1537 N ARG A 101 -2.270 -5.362 -9.360 1.00 0.00 N ATOM 1538 CA ARG A 101 -2.896 -5.989 -10.511 1.00 0.00 C ATOM 1539 C ARG A 101 -1.894 -6.108 -11.661 1.00 0.00 C ATOM 1540 O ARG A 101 -2.054 -6.949 -12.544 1.00 0.00 O ATOM 1541 CB ARG A 101 -4.110 -5.187 -10.983 1.00 0.00 C ATOM 1542 CG ARG A 101 -5.163 -6.102 -11.611 1.00 0.00 C ATOM 1543 CD ARG A 101 -6.575 -5.579 -11.342 1.00 0.00 C ATOM 1544 NE ARG A 101 -7.326 -5.475 -12.612 1.00 0.00 N ATOM 1545 CZ ARG A 101 -7.969 -6.499 -13.191 1.00 0.00 C ATOM 1546 NH1 ARG A 101 -7.956 -7.708 -12.617 1.00 0.00 N ATOM 1547 NH2 ARG A 101 -8.625 -6.311 -14.345 1.00 0.00 N ATOM 0 H ARG A 101 -2.815 -4.612 -8.934 1.00 0.00 H new ATOM 0 HA ARG A 101 -3.227 -6.982 -10.208 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -4.546 -4.651 -10.140 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -3.795 -4.438 -11.709 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -4.996 -6.171 -12.686 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -5.062 -7.109 -11.208 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -7.095 -6.248 -10.656 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -6.524 -4.603 -10.859 1.00 0.00 H new ATOM 0 HE ARG A 101 -7.357 -4.567 -13.076 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -7.457 -7.850 -11.739 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -8.445 -8.487 -13.058 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -8.635 -5.389 -14.782 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -9.114 -7.090 -14.786 1.00 0.00 H new ATOM 1561 N ASP A 102 -0.881 -5.256 -11.612 1.00 0.00 N ATOM 1562 CA ASP A 102 0.148 -5.254 -12.639 1.00 0.00 C ATOM 1563 C ASP A 102 0.797 -6.639 -12.705 1.00 0.00 C ATOM 1564 O ASP A 102 0.492 -7.511 -11.893 1.00 0.00 O ATOM 1565 CB ASP A 102 1.242 -4.233 -12.321 1.00 0.00 C ATOM 1566 CG ASP A 102 2.485 -4.808 -11.639 1.00 0.00 C ATOM 1567 OD1 ASP A 102 2.329 -5.305 -10.502 1.00 0.00 O ATOM 1568 OD2 ASP A 102 3.562 -4.738 -12.269 1.00 0.00 O ATOM 0 H ASP A 102 -0.750 -4.561 -10.877 1.00 0.00 H new ATOM 0 HA ASP A 102 -0.322 -4.994 -13.588 1.00 0.00 H new ATOM 0 HB2 ASP A 102 1.546 -3.748 -13.249 1.00 0.00 H new ATOM 0 HB3 ASP A 102 0.820 -3.459 -11.680 1.00 0.00 H new ATOM 1573 N PRO A 103 1.703 -6.800 -13.705 1.00 0.00 N ATOM 1574 CA PRO A 103 2.399 -8.063 -13.888 1.00 0.00 C ATOM 1575 C PRO A 103 3.484 -8.250 -12.826 1.00 0.00 C ATOM 1576 O PRO A 103 3.736 -9.369 -12.382 1.00 0.00 O ATOM 1577 CB PRO A 103 2.953 -8.005 -15.302 1.00 0.00 C ATOM 1578 CG PRO A 103 2.949 -6.537 -15.692 1.00 0.00 C ATOM 1579 CD PRO A 103 2.090 -5.789 -14.686 1.00 0.00 C ATOM 0 HA PRO A 103 1.745 -8.926 -13.767 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.961 -8.417 -15.343 1.00 0.00 H new ATOM 0 HB3 PRO A 103 2.340 -8.592 -15.986 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.964 -6.141 -15.696 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.553 -6.411 -16.700 1.00 0.00 H new ATOM 0 HD2 PRO A 103 2.645 -4.976 -14.219 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.216 -5.346 -15.163 1.00 0.00 H new ATOM 1587 N GLN A 104 4.098 -7.137 -12.452 1.00 0.00 N ATOM 1588 CA GLN A 104 5.151 -7.164 -11.451 1.00 0.00 C ATOM 1589 C GLN A 104 4.635 -7.791 -10.154 1.00 0.00 C ATOM 1590 O GLN A 104 5.133 -8.829 -9.720 1.00 0.00 O ATOM 1591 CB GLN A 104 5.704 -5.761 -11.199 1.00 0.00 C ATOM 1592 CG GLN A 104 6.105 -5.085 -12.513 1.00 0.00 C ATOM 1593 CD GLN A 104 7.626 -5.019 -12.653 1.00 0.00 C ATOM 1594 OE1 GLN A 104 8.306 -6.021 -12.809 1.00 0.00 O ATOM 1595 NE2 GLN A 104 8.123 -3.786 -12.590 1.00 0.00 N ATOM 0 H GLN A 104 3.887 -6.211 -12.824 1.00 0.00 H new ATOM 0 HA GLN A 104 5.968 -7.778 -11.829 1.00 0.00 H new ATOM 0 HB2 GLN A 104 4.954 -5.157 -10.689 1.00 0.00 H new ATOM 0 HB3 GLN A 104 6.569 -5.820 -10.538 1.00 0.00 H new ATOM 0 HG2 GLN A 104 5.682 -5.636 -13.353 1.00 0.00 H new ATOM 0 HG3 GLN A 104 5.689 -4.078 -12.550 1.00 0.00 H new ATOM 0 HE21 GLN A 104 7.498 -2.990 -12.458 1.00 0.00 H new ATOM 0 HE22 GLN A 104 9.129 -3.637 -12.674 1.00 0.00 H new ATOM 1604 N GLY A 105 3.642 -7.134 -9.571 1.00 0.00 N ATOM 1605 CA GLY A 105 3.054 -7.614 -8.333 1.00 0.00 C ATOM 1606 C GLY A 105 3.772 -7.021 -7.118 1.00 0.00 C ATOM 1607 O GLY A 105 4.698 -6.227 -7.268 1.00 0.00 O ATOM 0 H GLY A 105 3.231 -6.274 -9.934 1.00 0.00 H new ATOM 0 HA2 GLY A 105 1.997 -7.348 -8.301 1.00 0.00 H new ATOM 0 HA3 GLY A 105 3.110 -8.702 -8.298 1.00 0.00 H new ATOM 1611 N ILE A 106 3.317 -7.433 -5.943 1.00 0.00 N ATOM 1612 CA ILE A 106 3.905 -6.953 -4.705 1.00 0.00 C ATOM 1613 C ILE A 106 5.426 -6.884 -4.859 1.00 0.00 C ATOM 1614 O ILE A 106 6.081 -6.055 -4.229 1.00 0.00 O ATOM 1615 CB ILE A 106 3.445 -7.812 -3.525 1.00 0.00 C ATOM 1616 CG1 ILE A 106 2.038 -7.416 -3.074 1.00 0.00 C ATOM 1617 CG2 ILE A 106 4.454 -7.752 -2.377 1.00 0.00 C ATOM 1618 CD1 ILE A 106 2.075 -6.163 -2.197 1.00 0.00 C ATOM 0 H ILE A 106 2.549 -8.093 -5.823 1.00 0.00 H new ATOM 0 HA ILE A 106 3.561 -5.942 -4.488 1.00 0.00 H new ATOM 0 HB ILE A 106 3.396 -8.849 -3.856 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.410 -7.235 -3.946 1.00 0.00 H new ATOM 0 HG13 ILE A 106 1.585 -8.238 -2.520 1.00 0.00 H new ATOM 0 HG21 ILE A 106 4.103 -8.371 -1.551 1.00 0.00 H new ATOM 0 HG22 ILE A 106 5.420 -8.121 -2.722 1.00 0.00 H new ATOM 0 HG23 ILE A 106 4.559 -6.721 -2.039 1.00 0.00 H new ATOM 0 HD11 ILE A 106 1.062 -5.903 -1.890 1.00 0.00 H new ATOM 0 HD12 ILE A 106 2.684 -6.355 -1.313 1.00 0.00 H new ATOM 0 HD13 ILE A 106 2.506 -5.336 -2.762 1.00 0.00 H new ATOM 1630 N ARG A 107 5.943 -7.767 -5.701 1.00 0.00 N ATOM 1631 CA ARG A 107 7.375 -7.817 -5.946 1.00 0.00 C ATOM 1632 C ARG A 107 7.954 -6.402 -5.997 1.00 0.00 C ATOM 1633 O ARG A 107 9.056 -6.161 -5.507 1.00 0.00 O ATOM 1634 CB ARG A 107 7.683 -8.534 -7.262 1.00 0.00 C ATOM 1635 CG ARG A 107 9.100 -9.111 -7.253 1.00 0.00 C ATOM 1636 CD ARG A 107 9.110 -10.547 -7.783 1.00 0.00 C ATOM 1637 NE ARG A 107 10.496 -10.959 -8.100 1.00 0.00 N ATOM 1638 CZ ARG A 107 10.868 -12.225 -8.334 1.00 0.00 C ATOM 1639 NH1 ARG A 107 9.960 -13.209 -8.291 1.00 0.00 N ATOM 1640 NH2 ARG A 107 12.148 -12.506 -8.613 1.00 0.00 N ATOM 0 H ARG A 107 5.397 -8.453 -6.222 1.00 0.00 H new ATOM 0 HA ARG A 107 7.833 -8.372 -5.127 1.00 0.00 H new ATOM 0 HB2 ARG A 107 6.961 -9.335 -7.421 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.575 -7.838 -8.094 1.00 0.00 H new ATOM 0 HG2 ARG A 107 9.754 -8.489 -7.865 1.00 0.00 H new ATOM 0 HG3 ARG A 107 9.498 -9.091 -6.239 1.00 0.00 H new ATOM 0 HD2 ARG A 107 8.682 -11.221 -7.040 1.00 0.00 H new ATOM 0 HD3 ARG A 107 8.487 -10.619 -8.675 1.00 0.00 H new ATOM 0 HE ARG A 107 11.212 -10.234 -8.143 1.00 0.00 H new ATOM 0 HH11 ARG A 107 8.985 -12.995 -8.080 1.00 0.00 H new ATOM 0 HH12 ARG A 107 10.243 -14.173 -8.469 1.00 0.00 H new ATOM 0 HH21 ARG A 107 12.839 -11.756 -8.647 1.00 0.00 H new ATOM 0 HH22 ARG A 107 12.431 -13.469 -8.791 1.00 0.00 H new ATOM 1654 N ALA A 108 7.185 -5.502 -6.593 1.00 0.00 N ATOM 1655 CA ALA A 108 7.608 -4.118 -6.714 1.00 0.00 C ATOM 1656 C ALA A 108 8.272 -3.676 -5.409 1.00 0.00 C ATOM 1657 O ALA A 108 9.244 -2.922 -5.427 1.00 0.00 O ATOM 1658 CB ALA A 108 6.405 -3.246 -7.079 1.00 0.00 C ATOM 0 H ALA A 108 6.271 -5.705 -6.997 1.00 0.00 H new ATOM 0 HA ALA A 108 8.343 -4.011 -7.512 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.723 -2.207 -7.170 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.987 -3.582 -8.028 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.647 -3.327 -6.300 1.00 0.00 H new ATOM 1664 N TRP A 109 7.722 -4.165 -4.306 1.00 0.00 N ATOM 1665 CA TRP A 109 8.249 -3.830 -2.994 1.00 0.00 C ATOM 1666 C TRP A 109 9.186 -4.959 -2.560 1.00 0.00 C ATOM 1667 O TRP A 109 8.894 -5.681 -1.608 1.00 0.00 O ATOM 1668 CB TRP A 109 7.117 -3.575 -1.998 1.00 0.00 C ATOM 1669 CG TRP A 109 6.188 -2.425 -2.392 1.00 0.00 C ATOM 1670 CD1 TRP A 109 6.372 -1.112 -2.194 1.00 0.00 C ATOM 1671 CD2 TRP A 109 4.915 -2.538 -3.062 1.00 0.00 C ATOM 1672 NE1 TRP A 109 5.315 -0.374 -2.686 1.00 0.00 N ATOM 1673 CE2 TRP A 109 4.401 -1.269 -3.231 1.00 0.00 C ATOM 1674 CE3 TRP A 109 4.222 -3.676 -3.511 1.00 0.00 C ATOM 1675 CZ2 TRP A 109 3.171 -1.016 -3.850 1.00 0.00 C ATOM 1676 CZ3 TRP A 109 2.994 -3.406 -4.127 1.00 0.00 C ATOM 1677 CH2 TRP A 109 2.462 -2.135 -4.306 1.00 0.00 C ATOM 0 H TRP A 109 6.917 -4.791 -4.295 1.00 0.00 H new ATOM 0 HA TRP A 109 8.818 -2.901 -3.031 1.00 0.00 H new ATOM 0 HB2 TRP A 109 6.527 -4.486 -1.894 1.00 0.00 H new ATOM 0 HB3 TRP A 109 7.549 -3.361 -1.020 1.00 0.00 H new ATOM 0 HD1 TRP A 109 7.238 -0.686 -1.710 1.00 0.00 H new ATOM 0 HE1 TRP A 109 5.221 0.641 -2.656 1.00 0.00 H new ATOM 0 HE3 TRP A 109 4.606 -4.678 -3.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 2.789 -0.013 -3.969 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 2.419 -4.246 -4.489 1.00 0.00 H new ATOM 0 HH2 TRP A 109 1.507 -2.010 -4.794 1.00 0.00 H new ATOM 1688 N VAL A 110 10.293 -5.075 -3.278 1.00 0.00 N ATOM 1689 CA VAL A 110 11.276 -6.104 -2.978 1.00 0.00 C ATOM 1690 C VAL A 110 11.588 -6.082 -1.480 1.00 0.00 C ATOM 1691 O VAL A 110 12.033 -7.084 -0.922 1.00 0.00 O ATOM 1692 CB VAL A 110 12.517 -5.912 -3.851 1.00 0.00 C ATOM 1693 CG1 VAL A 110 13.198 -4.575 -3.550 1.00 0.00 C ATOM 1694 CG2 VAL A 110 13.495 -7.076 -3.676 1.00 0.00 C ATOM 0 H VAL A 110 10.532 -4.474 -4.067 1.00 0.00 H new ATOM 0 HA VAL A 110 10.880 -7.092 -3.213 1.00 0.00 H new ATOM 0 HB VAL A 110 12.195 -5.897 -4.892 1.00 0.00 H new ATOM 0 HG11 VAL A 110 14.077 -4.464 -4.184 1.00 0.00 H new ATOM 0 HG12 VAL A 110 12.502 -3.760 -3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 110 13.500 -4.548 -2.503 1.00 0.00 H new ATOM 0 HG21 VAL A 110 14.369 -6.915 -4.308 1.00 0.00 H new ATOM 0 HG22 VAL A 110 13.807 -7.136 -2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 110 13.007 -8.008 -3.962 1.00 0.00 H new ATOM 1704 N ALA A 111 11.342 -4.931 -0.873 1.00 0.00 N ATOM 1705 CA ALA A 111 11.592 -4.767 0.549 1.00 0.00 C ATOM 1706 C ALA A 111 10.950 -5.927 1.313 1.00 0.00 C ATOM 1707 O ALA A 111 11.542 -6.461 2.249 1.00 0.00 O ATOM 1708 CB ALA A 111 11.065 -3.405 1.006 1.00 0.00 C ATOM 0 H ALA A 111 10.972 -4.103 -1.340 1.00 0.00 H new ATOM 0 HA ALA A 111 12.662 -4.789 0.756 1.00 0.00 H new ATOM 0 HB1 ALA A 111 11.252 -3.282 2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.574 -2.614 0.454 1.00 0.00 H new ATOM 0 HB3 ALA A 111 9.993 -3.348 0.817 1.00 0.00 H new ATOM 1714 N TRP A 112 9.748 -6.282 0.884 1.00 0.00 N ATOM 1715 CA TRP A 112 9.018 -7.368 1.515 1.00 0.00 C ATOM 1716 C TRP A 112 9.794 -8.665 1.267 1.00 0.00 C ATOM 1717 O TRP A 112 9.760 -9.579 2.089 1.00 0.00 O ATOM 1718 CB TRP A 112 7.576 -7.428 1.009 1.00 0.00 C ATOM 1719 CG TRP A 112 7.136 -8.819 0.547 1.00 0.00 C ATOM 1720 CD1 TRP A 112 6.310 -9.672 1.170 1.00 0.00 C ATOM 1721 CD2 TRP A 112 7.532 -9.487 -0.669 1.00 0.00 C ATOM 1722 NE1 TRP A 112 6.147 -10.836 0.447 1.00 0.00 N ATOM 1723 CE2 TRP A 112 6.915 -10.721 -0.706 1.00 0.00 C ATOM 1724 CE3 TRP A 112 8.386 -9.064 -1.703 1.00 0.00 C ATOM 1725 CZ2 TRP A 112 7.083 -11.631 -1.756 1.00 0.00 C ATOM 1726 CZ3 TRP A 112 8.545 -9.986 -2.745 1.00 0.00 C ATOM 1727 CH2 TRP A 112 7.930 -11.230 -2.798 1.00 0.00 C ATOM 0 H TRP A 112 9.261 -5.836 0.106 1.00 0.00 H new ATOM 0 HA TRP A 112 8.941 -7.207 2.590 1.00 0.00 H new ATOM 0 HB2 TRP A 112 6.909 -7.092 1.803 1.00 0.00 H new ATOM 0 HB3 TRP A 112 7.463 -6.729 0.181 1.00 0.00 H new ATOM 0 HD1 TRP A 112 5.833 -9.473 2.118 1.00 0.00 H new ATOM 0 HE1 TRP A 112 5.569 -11.634 0.710 1.00 0.00 H new ATOM 0 HE3 TRP A 112 8.880 -8.104 -1.694 1.00 0.00 H new ATOM 0 HZ2 TRP A 112 6.587 -12.590 -1.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 112 9.191 -9.710 -3.565 1.00 0.00 H new ATOM 0 HH2 TRP A 112 8.104 -11.886 -3.639 1.00 0.00 H new ATOM 1738 N ARG A 113 10.473 -8.702 0.130 1.00 0.00 N ATOM 1739 CA ARG A 113 11.255 -9.871 -0.236 1.00 0.00 C ATOM 1740 C ARG A 113 12.438 -10.039 0.719 1.00 0.00 C ATOM 1741 O ARG A 113 13.057 -11.100 0.764 1.00 0.00 O ATOM 1742 CB ARG A 113 11.777 -9.756 -1.670 1.00 0.00 C ATOM 1743 CG ARG A 113 12.107 -11.136 -2.245 1.00 0.00 C ATOM 1744 CD ARG A 113 12.852 -11.010 -3.575 1.00 0.00 C ATOM 1745 NE ARG A 113 13.522 -12.289 -3.902 1.00 0.00 N ATOM 1746 CZ ARG A 113 14.270 -12.487 -4.995 1.00 0.00 C ATOM 1747 NH1 ARG A 113 14.450 -11.491 -5.874 1.00 0.00 N ATOM 1748 NH2 ARG A 113 14.840 -13.681 -5.210 1.00 0.00 N ATOM 0 H ARG A 113 10.498 -7.942 -0.550 1.00 0.00 H new ATOM 0 HA ARG A 113 10.603 -10.742 -0.167 1.00 0.00 H new ATOM 0 HB2 ARG A 113 11.030 -9.267 -2.295 1.00 0.00 H new ATOM 0 HB3 ARG A 113 12.668 -9.128 -1.687 1.00 0.00 H new ATOM 0 HG2 ARG A 113 12.716 -11.694 -1.534 1.00 0.00 H new ATOM 0 HG3 ARG A 113 11.187 -11.703 -2.391 1.00 0.00 H new ATOM 0 HD2 ARG A 113 12.154 -10.742 -4.368 1.00 0.00 H new ATOM 0 HD3 ARG A 113 13.589 -10.209 -3.514 1.00 0.00 H new ATOM 0 HE ARG A 113 13.407 -13.068 -3.254 1.00 0.00 H new ATOM 0 HH11 ARG A 113 14.017 -10.582 -5.710 1.00 0.00 H new ATOM 0 HH12 ARG A 113 15.020 -11.642 -6.706 1.00 0.00 H new ATOM 0 HH21 ARG A 113 14.704 -14.439 -4.541 1.00 0.00 H new ATOM 0 HH22 ARG A 113 15.410 -13.832 -6.043 1.00 0.00 H new ATOM 1762 N ALA A 114 12.716 -8.975 1.459 1.00 0.00 N ATOM 1763 CA ALA A 114 13.814 -8.992 2.410 1.00 0.00 C ATOM 1764 C ALA A 114 13.289 -8.607 3.795 1.00 0.00 C ATOM 1765 O ALA A 114 14.010 -8.009 4.592 1.00 0.00 O ATOM 1766 CB ALA A 114 14.923 -8.056 1.926 1.00 0.00 C ATOM 0 H ALA A 114 12.200 -8.096 1.419 1.00 0.00 H new ATOM 0 HA ALA A 114 14.241 -9.992 2.485 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.747 -8.069 2.639 1.00 0.00 H new ATOM 0 HB2 ALA A 114 15.281 -8.389 0.952 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.532 -7.042 1.841 1.00 0.00 H new ATOM 1772 N HIS A 115 12.037 -8.964 4.039 1.00 0.00 N ATOM 1773 CA HIS A 115 11.406 -8.664 5.313 1.00 0.00 C ATOM 1774 C HIS A 115 10.355 -9.730 5.629 1.00 0.00 C ATOM 1775 O HIS A 115 10.282 -10.219 6.756 1.00 0.00 O ATOM 1776 CB HIS A 115 10.833 -7.246 5.314 1.00 0.00 C ATOM 1777 CG HIS A 115 11.270 -6.408 6.492 1.00 0.00 C ATOM 1778 ND1 HIS A 115 10.374 -5.756 7.321 1.00 0.00 N ATOM 1779 CD2 HIS A 115 12.515 -6.122 6.970 1.00 0.00 C ATOM 1780 CE1 HIS A 115 11.061 -5.109 8.252 1.00 0.00 C ATOM 1781 NE2 HIS A 115 12.387 -5.338 8.032 1.00 0.00 N ATOM 0 H HIS A 115 11.442 -9.459 3.375 1.00 0.00 H new ATOM 0 HA HIS A 115 12.151 -8.692 6.108 1.00 0.00 H new ATOM 0 HB2 HIS A 115 11.131 -6.744 4.394 1.00 0.00 H new ATOM 0 HB3 HIS A 115 9.745 -7.305 5.307 1.00 0.00 H new ATOM 0 HD2 HIS A 115 13.447 -6.474 6.554 1.00 0.00 H new ATOM 0 HE1 HIS A 115 10.644 -4.506 9.045 1.00 0.00 H new ATOM 0 HE2 HIS A 115 13.155 -4.967 8.592 1.00 0.00 H new ATOM 1790 N CYS A 116 9.567 -10.057 4.616 1.00 0.00 N ATOM 1791 CA CYS A 116 8.523 -11.056 4.772 1.00 0.00 C ATOM 1792 C CYS A 116 9.121 -12.429 4.462 1.00 0.00 C ATOM 1793 O CYS A 116 9.036 -13.347 5.277 1.00 0.00 O ATOM 1794 CB CYS A 116 7.311 -10.749 3.891 1.00 0.00 C ATOM 1795 SG CYS A 116 5.776 -10.358 4.807 1.00 0.00 S ATOM 0 H CYS A 116 9.630 -9.648 3.684 1.00 0.00 H new ATOM 0 HA CYS A 116 8.156 -11.045 5.798 1.00 0.00 H new ATOM 0 HB2 CYS A 116 7.555 -9.908 3.242 1.00 0.00 H new ATOM 0 HB3 CYS A 116 7.123 -11.606 3.244 1.00 0.00 H new ATOM 1800 N GLN A 117 9.715 -12.527 3.281 1.00 0.00 N ATOM 1801 CA GLN A 117 10.327 -13.774 2.853 1.00 0.00 C ATOM 1802 C GLN A 117 11.528 -14.108 3.741 1.00 0.00 C ATOM 1803 O GLN A 117 12.084 -15.201 3.653 1.00 0.00 O ATOM 1804 CB GLN A 117 10.736 -13.707 1.380 1.00 0.00 C ATOM 1805 CG GLN A 117 10.643 -15.084 0.722 1.00 0.00 C ATOM 1806 CD GLN A 117 9.546 -15.109 -0.344 1.00 0.00 C ATOM 1807 OE1 GLN A 117 8.387 -14.828 -0.086 1.00 0.00 O ATOM 1808 NE2 GLN A 117 9.975 -15.460 -1.554 1.00 0.00 N ATOM 0 H GLN A 117 9.785 -11.764 2.608 1.00 0.00 H new ATOM 0 HA GLN A 117 9.591 -14.571 2.956 1.00 0.00 H new ATOM 0 HB2 GLN A 117 10.092 -13.004 0.852 1.00 0.00 H new ATOM 0 HB3 GLN A 117 11.755 -13.329 1.299 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.601 -15.340 0.269 1.00 0.00 H new ATOM 0 HG3 GLN A 117 10.436 -15.840 1.480 1.00 0.00 H new ATOM 0 HE21 GLN A 117 10.959 -15.683 -1.701 1.00 0.00 H new ATOM 0 HE22 GLN A 117 9.319 -15.506 -2.334 1.00 0.00 H new ATOM 1817 N ASN A 118 11.891 -13.146 4.576 1.00 0.00 N ATOM 1818 CA ASN A 118 13.015 -13.324 5.480 1.00 0.00 C ATOM 1819 C ASN A 118 12.643 -14.347 6.555 1.00 0.00 C ATOM 1820 O ASN A 118 13.237 -15.422 6.626 1.00 0.00 O ATOM 1821 CB ASN A 118 13.373 -12.012 6.180 1.00 0.00 C ATOM 1822 CG ASN A 118 14.832 -12.016 6.641 1.00 0.00 C ATOM 1823 OD1 ASN A 118 15.742 -11.663 5.909 1.00 0.00 O ATOM 1824 ND2 ASN A 118 15.002 -12.433 7.892 1.00 0.00 N ATOM 0 H ASN A 118 11.427 -12.240 4.646 1.00 0.00 H new ATOM 0 HA ASN A 118 13.868 -13.664 4.893 1.00 0.00 H new ATOM 0 HB2 ASN A 118 13.205 -11.176 5.501 1.00 0.00 H new ATOM 0 HB3 ASN A 118 12.717 -11.863 7.038 1.00 0.00 H new ATOM 0 HD21 ASN A 118 15.939 -12.472 8.294 1.00 0.00 H new ATOM 0 HD22 ASN A 118 14.196 -12.714 8.450 1.00 0.00 H new ATOM 1831 N ARG A 119 11.661 -13.977 7.364 1.00 0.00 N ATOM 1832 CA ARG A 119 11.203 -14.850 8.432 1.00 0.00 C ATOM 1833 C ARG A 119 9.684 -15.018 8.365 1.00 0.00 C ATOM 1834 O ARG A 119 9.048 -14.581 7.406 1.00 0.00 O ATOM 1835 CB ARG A 119 11.587 -14.290 9.804 1.00 0.00 C ATOM 1836 CG ARG A 119 11.931 -15.418 10.779 1.00 0.00 C ATOM 1837 CD ARG A 119 13.247 -15.133 11.505 1.00 0.00 C ATOM 1838 NE ARG A 119 13.999 -16.392 11.704 1.00 0.00 N ATOM 1839 CZ ARG A 119 15.242 -16.455 12.198 1.00 0.00 C ATOM 1840 NH1 ARG A 119 15.882 -15.331 12.547 1.00 0.00 N ATOM 1841 NH2 ARG A 119 15.847 -17.642 12.344 1.00 0.00 N ATOM 0 H ARG A 119 11.170 -13.085 7.302 1.00 0.00 H new ATOM 0 HA ARG A 119 11.686 -15.818 8.299 1.00 0.00 H new ATOM 0 HB2 ARG A 119 12.441 -13.620 9.701 1.00 0.00 H new ATOM 0 HB3 ARG A 119 10.763 -13.698 10.203 1.00 0.00 H new ATOM 0 HG2 ARG A 119 11.127 -15.532 11.507 1.00 0.00 H new ATOM 0 HG3 ARG A 119 12.007 -16.361 10.238 1.00 0.00 H new ATOM 0 HD2 ARG A 119 13.846 -14.430 10.926 1.00 0.00 H new ATOM 0 HD3 ARG A 119 13.046 -14.664 12.468 1.00 0.00 H new ATOM 0 HE ARG A 119 13.541 -17.267 11.449 1.00 0.00 H new ATOM 0 HH11 ARG A 119 15.422 -14.427 12.436 1.00 0.00 H new ATOM 0 HH12 ARG A 119 16.829 -15.379 12.923 1.00 0.00 H new ATOM 0 HH21 ARG A 119 15.361 -18.498 12.079 1.00 0.00 H new ATOM 0 HH22 ARG A 119 16.794 -17.689 12.720 1.00 0.00 H new ATOM 1855 N ASP A 120 9.144 -15.651 9.396 1.00 0.00 N ATOM 1856 CA ASP A 120 7.711 -15.882 9.466 1.00 0.00 C ATOM 1857 C ASP A 120 7.030 -14.653 10.072 1.00 0.00 C ATOM 1858 O ASP A 120 7.061 -14.458 11.287 1.00 0.00 O ATOM 1859 CB ASP A 120 7.390 -17.087 10.353 1.00 0.00 C ATOM 1860 CG ASP A 120 5.952 -17.599 10.251 1.00 0.00 C ATOM 1861 OD1 ASP A 120 5.387 -17.486 9.141 1.00 0.00 O ATOM 1862 OD2 ASP A 120 5.451 -18.094 11.283 1.00 0.00 O ATOM 0 H ASP A 120 9.673 -16.011 10.190 1.00 0.00 H new ATOM 0 HA ASP A 120 7.350 -16.072 8.455 1.00 0.00 H new ATOM 0 HB2 ASP A 120 8.069 -17.900 10.095 1.00 0.00 H new ATOM 0 HB3 ASP A 120 7.592 -16.820 11.390 1.00 0.00 H new ATOM 1867 N LEU A 121 6.431 -13.856 9.200 1.00 0.00 N ATOM 1868 CA LEU A 121 5.744 -12.652 9.634 1.00 0.00 C ATOM 1869 C LEU A 121 4.272 -12.977 9.896 1.00 0.00 C ATOM 1870 O LEU A 121 3.447 -12.074 10.023 1.00 0.00 O ATOM 1871 CB LEU A 121 5.954 -11.521 8.625 1.00 0.00 C ATOM 1872 CG LEU A 121 5.707 -10.104 9.145 1.00 0.00 C ATOM 1873 CD1 LEU A 121 6.792 -9.143 8.652 1.00 0.00 C ATOM 1874 CD2 LEU A 121 4.303 -9.621 8.776 1.00 0.00 C ATOM 0 H LEU A 121 6.407 -14.021 8.194 1.00 0.00 H new ATOM 0 HA LEU A 121 6.164 -12.291 10.573 1.00 0.00 H new ATOM 0 HB2 LEU A 121 6.977 -11.577 8.254 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.296 -11.694 7.773 1.00 0.00 H new ATOM 0 HG LEU A 121 5.764 -10.124 10.233 1.00 0.00 H new ATOM 0 HD11 LEU A 121 6.593 -8.142 9.036 1.00 0.00 H new ATOM 0 HD12 LEU A 121 7.766 -9.481 9.007 1.00 0.00 H new ATOM 0 HD13 LEU A 121 6.791 -9.121 7.562 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.154 -8.611 9.158 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.192 -9.619 7.692 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.561 -10.288 9.215 1.00 0.00 H new ATOM 1886 N SER A 122 3.988 -14.270 9.970 1.00 0.00 N ATOM 1887 CA SER A 122 2.630 -14.725 10.215 1.00 0.00 C ATOM 1888 C SER A 122 2.239 -14.445 11.667 1.00 0.00 C ATOM 1889 O SER A 122 1.063 -14.242 11.969 1.00 0.00 O ATOM 1890 CB SER A 122 2.484 -16.215 9.903 1.00 0.00 C ATOM 1891 OG SER A 122 2.177 -16.445 8.530 1.00 0.00 O ATOM 0 H SER A 122 4.675 -15.016 9.865 1.00 0.00 H new ATOM 0 HA SER A 122 1.960 -14.176 9.553 1.00 0.00 H new ATOM 0 HB2 SER A 122 3.409 -16.731 10.159 1.00 0.00 H new ATOM 0 HB3 SER A 122 1.698 -16.641 10.527 1.00 0.00 H new ATOM 0 HG SER A 122 2.093 -17.408 8.370 1.00 0.00 H new ATOM 1897 N GLN A 123 3.246 -14.444 12.529 1.00 0.00 N ATOM 1898 CA GLN A 123 3.022 -14.192 13.942 1.00 0.00 C ATOM 1899 C GLN A 123 2.633 -12.730 14.166 1.00 0.00 C ATOM 1900 O GLN A 123 2.178 -12.364 15.249 1.00 0.00 O ATOM 1901 CB GLN A 123 4.254 -14.565 14.767 1.00 0.00 C ATOM 1902 CG GLN A 123 3.980 -14.406 16.264 1.00 0.00 C ATOM 1903 CD GLN A 123 4.197 -15.727 17.004 1.00 0.00 C ATOM 1904 OE1 GLN A 123 5.236 -15.977 17.593 1.00 0.00 O ATOM 1905 NE2 GLN A 123 3.159 -16.558 16.942 1.00 0.00 N ATOM 0 H GLN A 123 4.219 -14.614 12.275 1.00 0.00 H new ATOM 0 HA GLN A 123 2.197 -14.821 14.277 1.00 0.00 H new ATOM 0 HB2 GLN A 123 4.541 -15.595 14.554 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.094 -13.934 14.478 1.00 0.00 H new ATOM 0 HG2 GLN A 123 4.636 -13.641 16.678 1.00 0.00 H new ATOM 0 HG3 GLN A 123 2.956 -14.064 16.416 1.00 0.00 H new ATOM 0 HE21 GLN A 123 2.318 -16.287 16.432 1.00 0.00 H new ATOM 0 HE22 GLN A 123 3.204 -17.466 17.405 1.00 0.00 H new ATOM 1914 N TYR A 124 2.826 -11.932 13.126 1.00 0.00 N ATOM 1915 CA TYR A 124 2.502 -10.518 13.195 1.00 0.00 C ATOM 1916 C TYR A 124 0.991 -10.296 13.091 1.00 0.00 C ATOM 1917 O TYR A 124 0.453 -9.372 13.698 1.00 0.00 O ATOM 1918 CB TYR A 124 3.185 -9.869 11.990 1.00 0.00 C ATOM 1919 CG TYR A 124 3.831 -8.516 12.295 1.00 0.00 C ATOM 1920 CD1 TYR A 124 4.954 -8.452 13.097 1.00 0.00 C ATOM 1921 CD2 TYR A 124 3.291 -7.359 11.769 1.00 0.00 C ATOM 1922 CE1 TYR A 124 5.561 -7.178 13.384 1.00 0.00 C ATOM 1923 CE2 TYR A 124 3.900 -6.086 12.057 1.00 0.00 C ATOM 1924 CZ TYR A 124 5.004 -6.058 12.849 1.00 0.00 C ATOM 1925 OH TYR A 124 5.578 -4.856 13.121 1.00 0.00 O ATOM 0 H TYR A 124 3.203 -12.239 12.230 1.00 0.00 H new ATOM 0 HA TYR A 124 2.835 -10.094 14.142 1.00 0.00 H new ATOM 0 HB2 TYR A 124 3.949 -10.547 11.609 1.00 0.00 H new ATOM 0 HB3 TYR A 124 2.450 -9.738 11.196 1.00 0.00 H new ATOM 0 HD1 TYR A 124 5.376 -9.357 13.508 1.00 0.00 H new ATOM 0 HD2 TYR A 124 2.413 -7.409 11.142 1.00 0.00 H new ATOM 0 HE1 TYR A 124 6.439 -7.113 14.010 1.00 0.00 H new ATOM 0 HE2 TYR A 124 3.488 -5.173 11.652 1.00 0.00 H new ATOM 0 HH TYR A 124 6.541 -4.977 13.259 1.00 0.00 H new ATOM 1935 N ILE A 125 0.352 -11.159 12.315 1.00 0.00 N ATOM 1936 CA ILE A 125 -1.086 -11.069 12.123 1.00 0.00 C ATOM 1937 C ILE A 125 -1.790 -11.957 13.150 1.00 0.00 C ATOM 1938 O ILE A 125 -2.825 -11.580 13.697 1.00 0.00 O ATOM 1939 CB ILE A 125 -1.454 -11.393 10.674 1.00 0.00 C ATOM 1940 CG1 ILE A 125 -0.906 -12.761 10.263 1.00 0.00 C ATOM 1941 CG2 ILE A 125 -0.993 -10.283 9.729 1.00 0.00 C ATOM 1942 CD1 ILE A 125 -1.637 -13.296 9.029 1.00 0.00 C ATOM 0 H ILE A 125 0.803 -11.923 11.812 1.00 0.00 H new ATOM 0 HA ILE A 125 -1.430 -10.049 12.294 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.540 -11.446 10.601 1.00 0.00 H new ATOM 0 HG12 ILE A 125 0.160 -12.681 10.052 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -1.016 -13.464 11.089 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.267 -10.539 8.706 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.472 -9.345 10.009 1.00 0.00 H new ATOM 0 HG23 ILE A 125 0.089 -10.173 9.798 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -1.228 -14.269 8.758 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.699 -13.397 9.251 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.504 -12.603 8.198 1.00 0.00 H new ATOM 1954 N ARG A 126 -1.200 -13.121 13.382 1.00 0.00 N ATOM 1955 CA ARG A 126 -1.759 -14.067 14.334 1.00 0.00 C ATOM 1956 C ARG A 126 -1.617 -13.530 15.760 1.00 0.00 C ATOM 1957 O ARG A 126 -0.541 -13.608 16.352 1.00 0.00 O ATOM 1958 CB ARG A 126 -1.061 -15.425 14.235 1.00 0.00 C ATOM 1959 CG ARG A 126 -1.765 -16.468 15.105 1.00 0.00 C ATOM 1960 CD ARG A 126 -0.861 -16.931 16.248 1.00 0.00 C ATOM 1961 NE ARG A 126 -1.429 -18.140 16.886 1.00 0.00 N ATOM 1962 CZ ARG A 126 -1.266 -19.384 16.416 1.00 0.00 C ATOM 1963 NH1 ARG A 126 -0.550 -19.592 15.303 1.00 0.00 N ATOM 1964 NH2 ARG A 126 -1.819 -20.421 17.061 1.00 0.00 N ATOM 0 H ARG A 126 -0.341 -13.430 12.927 1.00 0.00 H new ATOM 0 HA ARG A 126 -2.814 -14.196 14.094 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.052 -15.758 13.197 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -0.021 -15.327 14.548 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -2.684 -16.046 15.512 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -2.050 -17.324 14.493 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.138 -17.146 15.868 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -0.757 -16.135 16.986 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.979 -18.018 17.737 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.129 -18.803 14.813 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -0.426 -20.539 14.946 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -2.363 -20.263 17.909 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.695 -21.368 16.704 1.00 0.00 H new ATOM 1978 N ASN A 127 -2.718 -12.998 16.270 1.00 0.00 N ATOM 1979 CA ASN A 127 -2.730 -12.449 17.616 1.00 0.00 C ATOM 1980 C ASN A 127 -3.937 -11.523 17.773 1.00 0.00 C ATOM 1981 O ASN A 127 -4.443 -11.339 18.879 1.00 0.00 O ATOM 1982 CB ASN A 127 -1.466 -11.631 17.887 1.00 0.00 C ATOM 1983 CG ASN A 127 -0.623 -12.273 18.990 1.00 0.00 C ATOM 1984 OD1 ASN A 127 -0.700 -13.462 19.253 1.00 0.00 O ATOM 1985 ND2 ASN A 127 0.185 -11.424 19.618 1.00 0.00 N ATOM 0 H ASN A 127 -3.608 -12.935 15.776 1.00 0.00 H new ATOM 0 HA ASN A 127 -2.779 -13.280 18.320 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -0.877 -11.552 16.973 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -1.740 -10.617 18.178 1.00 0.00 H new ATOM 0 HD21 ASN A 127 0.789 -11.756 20.370 1.00 0.00 H new ATOM 0 HD22 ASN A 127 0.201 -10.440 19.348 1.00 0.00 H new ATOM 1992 N CYS A 128 -4.364 -10.963 16.650 1.00 0.00 N ATOM 1993 CA CYS A 128 -5.503 -10.061 16.649 1.00 0.00 C ATOM 1994 C CYS A 128 -6.771 -10.887 16.862 1.00 0.00 C ATOM 1995 O CYS A 128 -7.779 -10.372 17.344 1.00 0.00 O ATOM 1996 CB CYS A 128 -5.568 -9.234 15.363 1.00 0.00 C ATOM 1997 SG CYS A 128 -5.906 -7.454 15.611 1.00 0.00 S ATOM 0 H CYS A 128 -3.941 -11.117 15.735 1.00 0.00 H new ATOM 0 HA CYS A 128 -5.401 -9.341 17.461 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -4.622 -9.339 14.832 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -6.343 -9.650 14.719 1.00 0.00 H new ATOM 2002 N GLY A 129 -6.681 -12.157 16.492 1.00 0.00 N ATOM 2003 CA GLY A 129 -7.811 -13.060 16.637 1.00 0.00 C ATOM 2004 C GLY A 129 -8.471 -13.334 15.285 1.00 0.00 C ATOM 2005 O GLY A 129 -9.671 -13.595 15.217 1.00 0.00 O ATOM 0 H GLY A 129 -5.844 -12.581 16.093 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.477 -13.998 17.079 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -8.541 -12.628 17.321 1.00 0.00 H new ATOM 2009 N VAL A 130 -7.657 -13.264 14.241 1.00 0.00 N ATOM 2010 CA VAL A 130 -8.148 -13.501 12.893 1.00 0.00 C ATOM 2011 C VAL A 130 -8.029 -14.990 12.567 1.00 0.00 C ATOM 2012 O VAL A 130 -9.035 -15.665 12.356 1.00 0.00 O ATOM 2013 CB VAL A 130 -7.400 -12.609 11.900 1.00 0.00 C ATOM 2014 CG1 VAL A 130 -6.217 -13.353 11.279 1.00 0.00 C ATOM 2015 CG2 VAL A 130 -8.345 -12.081 10.819 1.00 0.00 C ATOM 0 H VAL A 130 -6.662 -13.047 14.301 1.00 0.00 H new ATOM 0 HA VAL A 130 -9.202 -13.235 12.817 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.006 -11.753 12.448 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -5.702 -12.697 10.577 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.526 -13.657 12.065 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.579 -14.236 10.752 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -7.789 -11.450 10.126 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -8.781 -12.919 10.276 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.139 -11.497 11.284 1.00 0.00 H new TER 2025 VAL A 130