USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 761 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 47 THR OG1 : rot 2:sc= 0.9 USER MOD Set 1.2: A 50 GLN : amide:sc= -0.944! C(o=-0.044!,f=-7.7!) USER MOD Set 2.1: A 35 ASN :FLIP amide:sc= -5.2! C(o=-6.7!,f=-5.2!) USER MOD Set 2.2: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 26 SER OG : rot 180:sc=-0.00118 USER MOD Set 3.2: A 29 MET CE :methyl 169:sc= -0.028 (180deg=-0.0194) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 27:sc= 0.563 USER MOD Single : A 14 LYS NZ :NH3+ -132:sc= 0.177 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ -151:sc= -0.147 (180deg=-1.57) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -1.04! C(o=-1!,f=-2.1!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 129:sc= -0.0392 USER MOD Single : A 33 ASN : amide:sc= 0.384 X(o=0.38,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 ASN :FLIP amide:sc= -7.07! C(o=-9.7!,f=-7.1!) USER MOD Single : A 53 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.102) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0718) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.402 USER MOD Single : A 67 LYS NZ :NH3+ -156:sc= -0.0519 (180deg=-0.289) USER MOD Single : A 68 GLN : amide:sc=-0.00552 X(o=-0.0055,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN :FLIP amide:sc= -0.288 F(o=-1.1,f=-0.29) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.367) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN :FLIP amide:sc= -0.655 F(o=-1.6!,f=-0.66) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.648 3.102 19.561 1.00 0.00 N ATOM 2 CA MET A 1 -16.927 4.487 19.223 1.00 0.00 C ATOM 3 C MET A 1 -17.588 4.594 17.848 1.00 0.00 C ATOM 4 O MET A 1 -18.802 4.769 17.750 1.00 0.00 O ATOM 5 CB MET A 1 -15.621 5.286 19.226 1.00 0.00 C ATOM 6 CG MET A 1 -15.401 5.972 20.575 1.00 0.00 C ATOM 7 SD MET A 1 -14.540 7.518 20.342 1.00 0.00 S ATOM 8 CE MET A 1 -14.611 8.166 22.003 1.00 0.00 C ATOM 0 H1 MET A 1 -16.200 3.057 20.498 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.537 2.562 19.576 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.007 2.694 18.851 1.00 0.00 H new ATOM 0 HA MET A 1 -17.613 4.892 19.967 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.784 4.622 19.011 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.646 6.034 18.434 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.360 6.150 21.062 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.825 5.321 21.233 1.00 0.00 H new ATOM 0 HE1 MET A 1 -14.115 9.136 22.037 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.652 8.280 22.305 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.109 7.478 22.684 1.00 0.00 H new ATOM 18 N VAL A 2 -16.761 4.485 16.818 1.00 0.00 N ATOM 19 CA VAL A 2 -17.251 4.567 15.452 1.00 0.00 C ATOM 20 C VAL A 2 -16.206 3.975 14.504 1.00 0.00 C ATOM 21 O VAL A 2 -15.005 4.132 14.721 1.00 0.00 O ATOM 22 CB VAL A 2 -17.614 6.014 15.113 1.00 0.00 C ATOM 23 CG1 VAL A 2 -16.366 6.898 15.077 1.00 0.00 C ATOM 24 CG2 VAL A 2 -18.381 6.091 13.791 1.00 0.00 C ATOM 0 H VAL A 2 -15.755 4.341 16.902 1.00 0.00 H new ATOM 0 HA VAL A 2 -18.163 3.981 15.337 1.00 0.00 H new ATOM 0 HB VAL A 2 -18.267 6.390 15.901 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -16.652 7.921 14.834 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -15.879 6.879 16.052 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -15.677 6.524 14.320 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -18.627 7.130 13.573 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -17.764 5.688 12.988 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -19.300 5.509 13.869 1.00 0.00 H new ATOM 34 N THR A 3 -16.701 3.306 13.474 1.00 0.00 N ATOM 35 CA THR A 3 -15.825 2.690 12.491 1.00 0.00 C ATOM 36 C THR A 3 -16.136 3.222 11.091 1.00 0.00 C ATOM 37 O THR A 3 -16.846 2.577 10.321 1.00 0.00 O ATOM 38 CB THR A 3 -15.975 1.172 12.611 1.00 0.00 C ATOM 39 OG1 THR A 3 -15.173 0.832 13.739 1.00 0.00 O ATOM 40 CG2 THR A 3 -15.318 0.425 11.448 1.00 0.00 C ATOM 0 H THR A 3 -17.697 3.177 13.298 1.00 0.00 H new ATOM 0 HA THR A 3 -14.781 2.945 12.676 1.00 0.00 H new ATOM 0 HB THR A 3 -17.033 0.914 12.656 1.00 0.00 H new ATOM 0 HG1 THR A 3 -15.214 -0.135 13.890 1.00 0.00 H new ATOM 0 HG21 THR A 3 -15.453 -0.648 11.582 1.00 0.00 H new ATOM 0 HG22 THR A 3 -15.779 0.735 10.510 1.00 0.00 H new ATOM 0 HG23 THR A 3 -14.253 0.656 11.423 1.00 0.00 H new ATOM 48 N PRO A 4 -15.574 4.425 10.796 1.00 0.00 N ATOM 49 CA PRO A 4 -15.784 5.052 9.502 1.00 0.00 C ATOM 50 C PRO A 4 -14.957 4.360 8.417 1.00 0.00 C ATOM 51 O PRO A 4 -14.087 3.544 8.720 1.00 0.00 O ATOM 52 CB PRO A 4 -15.401 6.509 9.703 1.00 0.00 C ATOM 53 CG PRO A 4 -14.554 6.547 10.964 1.00 0.00 C ATOM 54 CD PRO A 4 -14.728 5.218 11.682 1.00 0.00 C ATOM 0 HA PRO A 4 -16.815 4.970 9.157 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -14.843 6.888 8.846 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -16.287 7.135 9.809 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -13.506 6.712 10.715 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -14.863 7.372 11.607 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -13.768 4.731 11.852 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -15.194 5.353 12.658 1.00 0.00 H new ATOM 62 N ARG A 5 -15.255 4.712 7.175 1.00 0.00 N ATOM 63 CA ARG A 5 -14.548 4.135 6.043 1.00 0.00 C ATOM 64 C ARG A 5 -15.062 4.738 4.734 1.00 0.00 C ATOM 65 O ARG A 5 -16.266 4.754 4.484 1.00 0.00 O ATOM 66 CB ARG A 5 -14.723 2.616 6.002 1.00 0.00 C ATOM 67 CG ARG A 5 -16.170 2.240 5.677 1.00 0.00 C ATOM 68 CD ARG A 5 -16.408 0.744 5.888 1.00 0.00 C ATOM 69 NE ARG A 5 -17.218 0.197 4.776 1.00 0.00 N ATOM 70 CZ ARG A 5 -17.589 -1.097 4.674 1.00 0.00 C ATOM 71 NH1 ARG A 5 -17.224 -1.990 5.618 1.00 0.00 N ATOM 72 NH2 ARG A 5 -18.313 -1.476 3.637 1.00 0.00 N ATOM 0 H ARG A 5 -15.976 5.389 6.927 1.00 0.00 H new ATOM 0 HA ARG A 5 -13.489 4.364 6.160 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -14.056 2.189 5.253 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -14.439 2.187 6.963 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -16.849 2.813 6.309 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -16.395 2.506 4.644 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -15.454 0.220 5.945 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -16.919 0.579 6.836 1.00 0.00 H new ATOM 0 HE ARG A 5 -17.515 0.838 4.040 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -16.664 -1.689 6.416 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -17.508 -2.966 5.534 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -18.584 -0.795 2.928 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -18.601 -2.450 3.545 1.00 0.00 H new ATOM 86 N GLU A 6 -14.123 5.219 3.933 1.00 0.00 N ATOM 87 CA GLU A 6 -14.466 5.820 2.655 1.00 0.00 C ATOM 88 C GLU A 6 -13.196 6.183 1.881 1.00 0.00 C ATOM 89 O GLU A 6 -12.425 7.038 2.314 1.00 0.00 O ATOM 90 CB GLU A 6 -15.359 7.048 2.849 1.00 0.00 C ATOM 91 CG GLU A 6 -16.003 7.471 1.528 1.00 0.00 C ATOM 92 CD GLU A 6 -15.469 8.830 1.068 1.00 0.00 C ATOM 93 OE1 GLU A 6 -14.268 9.105 1.214 1.00 0.00 O ATOM 94 OE2 GLU A 6 -16.349 9.611 0.540 1.00 0.00 O ATOM 0 H GLU A 6 -13.125 5.205 4.144 1.00 0.00 H new ATOM 0 HA GLU A 6 -15.028 5.091 2.072 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -16.135 6.826 3.581 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -14.769 7.872 3.250 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -15.802 6.720 0.764 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -17.085 7.523 1.647 1.00 0.00 H new ATOM 101 N PRO A 7 -13.015 5.497 0.721 1.00 0.00 N ATOM 102 CA PRO A 7 -11.853 5.738 -0.116 1.00 0.00 C ATOM 103 C PRO A 7 -11.989 7.059 -0.877 1.00 0.00 C ATOM 104 O PRO A 7 -12.947 7.803 -0.669 1.00 0.00 O ATOM 105 CB PRO A 7 -11.771 4.529 -1.034 1.00 0.00 C ATOM 106 CG PRO A 7 -13.147 3.884 -0.995 1.00 0.00 C ATOM 107 CD PRO A 7 -13.908 4.478 0.178 1.00 0.00 C ATOM 0 HA PRO A 7 -10.935 5.846 0.461 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.507 4.826 -2.049 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -11.003 3.833 -0.696 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -13.681 4.067 -1.928 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -13.059 2.803 -0.885 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -14.855 4.912 -0.143 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -14.142 3.718 0.924 1.00 0.00 H new ATOM 115 N LYS A 8 -11.019 7.309 -1.744 1.00 0.00 N ATOM 116 CA LYS A 8 -11.019 8.526 -2.538 1.00 0.00 C ATOM 117 C LYS A 8 -9.861 8.479 -3.536 1.00 0.00 C ATOM 118 O LYS A 8 -8.774 8.005 -3.210 1.00 0.00 O ATOM 119 CB LYS A 8 -10.999 9.757 -1.630 1.00 0.00 C ATOM 120 CG LYS A 8 -11.886 10.869 -2.194 1.00 0.00 C ATOM 121 CD LYS A 8 -11.039 12.004 -2.775 1.00 0.00 C ATOM 122 CE LYS A 8 -11.806 12.759 -3.863 1.00 0.00 C ATOM 123 NZ LYS A 8 -11.087 13.997 -4.237 1.00 0.00 N ATOM 0 H LYS A 8 -10.227 6.689 -1.914 1.00 0.00 H new ATOM 0 HA LYS A 8 -11.938 8.602 -3.119 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.343 9.483 -0.633 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -9.977 10.120 -1.526 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -12.537 10.463 -2.968 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -12.532 11.258 -1.407 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.755 12.694 -1.980 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -10.117 11.598 -3.190 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -11.927 12.123 -4.740 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -12.806 13.005 -3.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -11.620 14.498 -4.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -10.993 14.610 -3.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -10.142 13.754 -4.596 1.00 0.00 H new ATOM 136 N LYS A 9 -10.133 8.977 -4.734 1.00 0.00 N ATOM 137 CA LYS A 9 -9.128 8.998 -5.782 1.00 0.00 C ATOM 138 C LYS A 9 -9.566 9.965 -6.884 1.00 0.00 C ATOM 139 O LYS A 9 -10.641 10.558 -6.803 1.00 0.00 O ATOM 140 CB LYS A 9 -8.848 7.580 -6.284 1.00 0.00 C ATOM 141 CG LYS A 9 -10.083 6.987 -6.967 1.00 0.00 C ATOM 142 CD LYS A 9 -10.707 5.885 -6.108 1.00 0.00 C ATOM 143 CE LYS A 9 -12.038 5.417 -6.700 1.00 0.00 C ATOM 144 NZ LYS A 9 -13.016 5.142 -5.624 1.00 0.00 N ATOM 0 H LYS A 9 -11.036 9.369 -5.001 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.179 9.367 -5.392 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.013 7.596 -6.985 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -8.551 6.946 -5.448 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -10.817 7.773 -7.146 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -9.806 6.582 -7.940 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -10.020 5.042 -6.036 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -10.865 6.254 -5.095 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -12.432 6.180 -7.372 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -11.882 4.518 -7.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -13.914 4.825 -6.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -12.645 4.398 -4.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -13.178 6.009 -5.072 1.00 0.00 H new ATOM 157 N ARG A 10 -8.710 10.096 -7.886 1.00 0.00 N ATOM 158 CA ARG A 10 -8.995 10.982 -9.003 1.00 0.00 C ATOM 159 C ARG A 10 -7.768 11.104 -9.909 1.00 0.00 C ATOM 160 O ARG A 10 -6.652 10.794 -9.495 1.00 0.00 O ATOM 161 CB ARG A 10 -9.399 12.373 -8.512 1.00 0.00 C ATOM 162 CG ARG A 10 -10.774 12.768 -9.057 1.00 0.00 C ATOM 163 CD ARG A 10 -11.290 14.036 -8.374 1.00 0.00 C ATOM 164 NE ARG A 10 -11.057 15.210 -9.245 1.00 0.00 N ATOM 165 CZ ARG A 10 -11.769 15.479 -10.360 1.00 0.00 C ATOM 166 NH1 ARG A 10 -12.768 14.660 -10.749 1.00 0.00 N ATOM 167 NH2 ARG A 10 -11.474 16.556 -11.063 1.00 0.00 N ATOM 0 H ARG A 10 -7.819 9.604 -7.948 1.00 0.00 H new ATOM 0 HA ARG A 10 -9.824 10.553 -9.565 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -9.418 12.387 -7.422 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -8.655 13.104 -8.827 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -10.710 12.930 -10.133 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -11.480 11.953 -8.899 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -12.354 13.937 -8.160 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -10.785 14.176 -7.418 1.00 0.00 H new ATOM 0 HE ARG A 10 -10.312 15.856 -8.986 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -12.990 13.830 -10.199 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -13.301 14.871 -11.593 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -10.718 17.171 -10.761 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -12.002 16.774 -11.908 1.00 0.00 H new ATOM 181 N THR A 11 -8.016 11.559 -11.129 1.00 0.00 N ATOM 182 CA THR A 11 -6.947 11.726 -12.097 1.00 0.00 C ATOM 183 C THR A 11 -7.449 12.498 -13.319 1.00 0.00 C ATOM 184 O THR A 11 -8.572 12.287 -13.772 1.00 0.00 O ATOM 185 CB THR A 11 -6.395 10.340 -12.438 1.00 0.00 C ATOM 186 OG1 THR A 11 -5.352 10.602 -13.373 1.00 0.00 O ATOM 187 CG2 THR A 11 -7.395 9.490 -13.225 1.00 0.00 C ATOM 0 H THR A 11 -8.943 11.817 -11.468 1.00 0.00 H new ATOM 0 HA THR A 11 -6.133 12.323 -11.687 1.00 0.00 H new ATOM 0 HB THR A 11 -6.121 9.822 -11.519 1.00 0.00 H new ATOM 0 HG1 THR A 11 -4.938 9.757 -13.646 1.00 0.00 H new ATOM 0 HG21 THR A 11 -6.954 8.517 -13.441 1.00 0.00 H new ATOM 0 HG22 THR A 11 -8.301 9.355 -12.635 1.00 0.00 H new ATOM 0 HG23 THR A 11 -7.643 9.992 -14.160 1.00 0.00 H new ATOM 195 N THR A 12 -6.592 13.377 -13.817 1.00 0.00 N ATOM 196 CA THR A 12 -6.934 14.181 -14.978 1.00 0.00 C ATOM 197 C THR A 12 -5.683 14.488 -15.802 1.00 0.00 C ATOM 198 O THR A 12 -4.567 14.438 -15.286 1.00 0.00 O ATOM 199 CB THR A 12 -7.660 15.435 -14.486 1.00 0.00 C ATOM 200 OG1 THR A 12 -9.018 15.021 -14.353 1.00 0.00 O ATOM 201 CG2 THR A 12 -7.709 16.537 -15.546 1.00 0.00 C ATOM 0 H THR A 12 -5.661 13.550 -13.438 1.00 0.00 H new ATOM 0 HA THR A 12 -7.602 13.642 -15.649 1.00 0.00 H new ATOM 0 HB THR A 12 -7.165 15.813 -13.592 1.00 0.00 H new ATOM 0 HG1 THR A 12 -9.051 14.057 -14.177 1.00 0.00 H new ATOM 0 HG21 THR A 12 -8.235 17.404 -15.146 1.00 0.00 H new ATOM 0 HG22 THR A 12 -6.694 16.823 -15.821 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.234 16.170 -16.428 1.00 0.00 H new ATOM 209 N ARG A 13 -5.910 14.799 -17.070 1.00 0.00 N ATOM 210 CA ARG A 13 -4.814 15.114 -17.971 1.00 0.00 C ATOM 211 C ARG A 13 -5.356 15.537 -19.339 1.00 0.00 C ATOM 212 O ARG A 13 -6.544 15.373 -19.618 1.00 0.00 O ATOM 213 CB ARG A 13 -3.884 13.912 -18.149 1.00 0.00 C ATOM 214 CG ARG A 13 -4.617 12.745 -18.815 1.00 0.00 C ATOM 215 CD ARG A 13 -4.008 12.425 -20.182 1.00 0.00 C ATOM 216 NE ARG A 13 -4.327 11.030 -20.563 1.00 0.00 N ATOM 217 CZ ARG A 13 -3.901 10.440 -21.700 1.00 0.00 C ATOM 218 NH1 ARG A 13 -3.135 11.120 -22.579 1.00 0.00 N ATOM 219 NH2 ARG A 13 -4.245 9.189 -21.939 1.00 0.00 N ATOM 0 H ARG A 13 -6.836 14.840 -17.495 1.00 0.00 H new ATOM 0 HA ARG A 13 -4.248 15.935 -17.530 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.024 14.199 -18.755 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.500 13.598 -17.178 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.565 11.865 -18.174 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.672 12.992 -18.932 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.396 13.114 -20.933 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -2.927 12.564 -20.150 1.00 0.00 H new ATOM 0 HE ARG A 13 -4.905 10.481 -19.927 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -2.874 12.087 -22.386 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -2.817 10.667 -23.436 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -4.824 8.683 -21.269 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -3.932 8.728 -22.793 1.00 0.00 H new ATOM 233 N LYS A 14 -4.461 16.072 -20.155 1.00 0.00 N ATOM 234 CA LYS A 14 -4.835 16.520 -21.486 1.00 0.00 C ATOM 235 C LYS A 14 -3.765 16.077 -22.486 1.00 0.00 C ATOM 236 O LYS A 14 -2.803 15.407 -22.116 1.00 0.00 O ATOM 237 CB LYS A 14 -5.096 18.027 -21.490 1.00 0.00 C ATOM 238 CG LYS A 14 -6.417 18.352 -22.192 1.00 0.00 C ATOM 239 CD LYS A 14 -7.612 17.951 -21.324 1.00 0.00 C ATOM 240 CE LYS A 14 -8.677 17.234 -22.155 1.00 0.00 C ATOM 241 NZ LYS A 14 -8.898 15.864 -21.642 1.00 0.00 N ATOM 0 H LYS A 14 -3.477 16.206 -19.921 1.00 0.00 H new ATOM 0 HA LYS A 14 -5.772 16.058 -21.796 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -5.123 18.398 -20.465 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -4.277 18.540 -21.993 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.464 19.419 -22.411 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.464 17.828 -23.147 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.277 17.300 -20.516 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.044 18.838 -20.861 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.611 17.796 -22.123 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.365 17.192 -23.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -8.883 15.190 -22.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -8.146 15.621 -20.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.821 15.817 -21.165 1.00 0.00 H new ATOM 254 N LYS A 15 -3.969 16.471 -23.735 1.00 0.00 N ATOM 255 CA LYS A 15 -3.035 16.124 -24.792 1.00 0.00 C ATOM 256 C LYS A 15 -2.941 17.285 -25.785 1.00 0.00 C ATOM 257 O LYS A 15 -3.567 17.252 -26.844 1.00 0.00 O ATOM 258 CB LYS A 15 -3.425 14.793 -25.436 1.00 0.00 C ATOM 259 CG LYS A 15 -2.185 13.999 -25.849 1.00 0.00 C ATOM 260 CD LYS A 15 -2.244 12.568 -25.308 1.00 0.00 C ATOM 261 CE LYS A 15 -1.034 11.757 -25.773 1.00 0.00 C ATOM 262 NZ LYS A 15 0.102 11.939 -24.841 1.00 0.00 N ATOM 0 H LYS A 15 -4.768 17.028 -24.038 1.00 0.00 H new ATOM 0 HA LYS A 15 -2.036 15.972 -24.383 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.020 14.207 -24.736 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.051 14.977 -26.309 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.108 13.978 -26.936 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -1.290 14.496 -25.476 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -2.276 12.588 -24.219 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -3.161 12.085 -25.645 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.298 10.701 -25.832 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -0.743 12.070 -26.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 0.997 11.828 -25.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 0.059 12.891 -24.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 0.049 11.227 -24.085 1.00 0.00 H new ATOM 275 N LYS A 16 -2.155 18.282 -25.408 1.00 0.00 N ATOM 276 CA LYS A 16 -1.972 19.451 -26.252 1.00 0.00 C ATOM 277 C LYS A 16 -0.488 19.600 -26.594 1.00 0.00 C ATOM 278 O LYS A 16 0.342 19.782 -25.704 1.00 0.00 O ATOM 279 CB LYS A 16 -2.579 20.690 -25.592 1.00 0.00 C ATOM 280 CG LYS A 16 -3.696 21.279 -26.454 1.00 0.00 C ATOM 281 CD LYS A 16 -4.965 21.506 -25.630 1.00 0.00 C ATOM 282 CE LYS A 16 -5.959 22.390 -26.385 1.00 0.00 C ATOM 283 NZ LYS A 16 -5.990 23.750 -25.803 1.00 0.00 N ATOM 0 H LYS A 16 -1.637 18.305 -24.529 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.506 19.328 -27.194 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -2.973 20.427 -24.610 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.803 21.439 -25.434 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.366 22.223 -26.887 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.913 20.606 -27.284 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.429 20.547 -25.399 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.707 21.973 -24.680 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -5.680 22.445 -27.437 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.954 21.947 -26.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.670 24.337 -26.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.278 23.694 -24.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.044 24.176 -25.866 1.00 0.00 H new ATOM 296 N ASP A 17 -0.198 19.518 -27.883 1.00 0.00 N ATOM 297 CA ASP A 17 1.171 19.641 -28.354 1.00 0.00 C ATOM 298 C ASP A 17 1.169 20.216 -29.772 1.00 0.00 C ATOM 299 O ASP A 17 0.245 19.967 -30.545 1.00 0.00 O ATOM 300 CB ASP A 17 1.863 18.278 -28.396 1.00 0.00 C ATOM 301 CG ASP A 17 1.686 17.423 -27.140 1.00 0.00 C ATOM 302 OD1 ASP A 17 2.414 17.774 -26.134 1.00 0.00 O ATOM 303 OD2 ASP A 17 0.894 16.469 -27.123 1.00 0.00 O ATOM 0 H ASP A 17 -0.889 19.368 -28.618 1.00 0.00 H new ATOM 0 HA ASP A 17 1.707 20.296 -27.667 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.483 17.721 -29.253 1.00 0.00 H new ATOM 0 HB3 ASP A 17 2.929 18.434 -28.564 1.00 0.00 H new ATOM 308 N PRO A 18 2.242 20.993 -30.078 1.00 0.00 N ATOM 309 CA PRO A 18 2.373 21.604 -31.389 1.00 0.00 C ATOM 310 C PRO A 18 2.780 20.568 -32.440 1.00 0.00 C ATOM 311 O PRO A 18 2.596 19.369 -32.237 1.00 0.00 O ATOM 312 CB PRO A 18 3.406 22.705 -31.210 1.00 0.00 C ATOM 313 CG PRO A 18 4.153 22.369 -29.929 1.00 0.00 C ATOM 314 CD PRO A 18 3.355 21.309 -29.187 1.00 0.00 C ATOM 0 HA PRO A 18 1.432 22.015 -31.756 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.087 22.744 -32.060 1.00 0.00 H new ATOM 0 HB3 PRO A 18 2.928 23.682 -31.139 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.154 22.003 -30.156 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.271 23.259 -29.312 1.00 0.00 H new ATOM 0 HD2 PRO A 18 3.962 20.427 -28.983 1.00 0.00 H new ATOM 0 HD3 PRO A 18 3.000 21.681 -28.226 1.00 0.00 H new ATOM 322 N ASN A 19 3.325 21.069 -33.538 1.00 0.00 N ATOM 323 CA ASN A 19 3.760 20.203 -34.620 1.00 0.00 C ATOM 324 C ASN A 19 4.955 19.370 -34.151 1.00 0.00 C ATOM 325 O ASN A 19 6.097 19.668 -34.499 1.00 0.00 O ATOM 326 CB ASN A 19 4.200 21.019 -35.837 1.00 0.00 C ATOM 327 CG ASN A 19 5.077 22.199 -35.418 1.00 0.00 C ATOM 328 OD1 ASN A 19 4.601 23.263 -35.053 1.00 0.00 O ATOM 329 ND2 ASN A 19 6.383 21.956 -35.487 1.00 0.00 N ATOM 0 H ASN A 19 3.475 22.064 -33.702 1.00 0.00 H new ATOM 0 HA ASN A 19 2.922 19.565 -34.899 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.750 20.380 -36.528 1.00 0.00 H new ATOM 0 HB3 ASN A 19 3.323 21.385 -36.370 1.00 0.00 H new ATOM 0 HD21 ASN A 19 7.051 22.681 -35.226 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.716 21.044 -35.801 1.00 0.00 H new ATOM 336 N ALA A 20 4.651 18.343 -33.371 1.00 0.00 N ATOM 337 CA ALA A 20 5.686 17.465 -32.852 1.00 0.00 C ATOM 338 C ALA A 20 5.266 16.009 -33.060 1.00 0.00 C ATOM 339 O ALA A 20 4.075 15.705 -33.113 1.00 0.00 O ATOM 340 CB ALA A 20 5.943 17.795 -31.381 1.00 0.00 C ATOM 0 H ALA A 20 3.703 18.099 -33.086 1.00 0.00 H new ATOM 0 HA ALA A 20 6.623 17.616 -33.388 1.00 0.00 H new ATOM 0 HB1 ALA A 20 6.719 17.137 -30.991 1.00 0.00 H new ATOM 0 HB2 ALA A 20 6.268 18.832 -31.292 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.025 17.652 -30.810 1.00 0.00 H new ATOM 346 N PRO A 21 6.293 15.125 -33.174 1.00 0.00 N ATOM 347 CA PRO A 21 6.041 13.708 -33.375 1.00 0.00 C ATOM 348 C PRO A 21 5.570 13.046 -32.078 1.00 0.00 C ATOM 349 O PRO A 21 6.321 12.972 -31.106 1.00 0.00 O ATOM 350 CB PRO A 21 7.357 13.144 -33.885 1.00 0.00 C ATOM 351 CG PRO A 21 8.421 14.163 -33.512 1.00 0.00 C ATOM 352 CD PRO A 21 7.714 15.450 -33.115 1.00 0.00 C ATOM 0 HA PRO A 21 5.239 13.520 -34.088 1.00 0.00 H new ATOM 0 HB2 PRO A 21 7.568 12.175 -33.432 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.324 12.991 -34.964 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.032 13.793 -32.689 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.092 14.340 -34.353 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.006 15.770 -32.115 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.963 16.265 -33.795 1.00 0.00 H new ATOM 360 N LYS A 22 4.330 12.582 -32.106 1.00 0.00 N ATOM 361 CA LYS A 22 3.749 11.928 -30.944 1.00 0.00 C ATOM 362 C LYS A 22 4.726 10.876 -30.416 1.00 0.00 C ATOM 363 O LYS A 22 5.260 11.016 -29.318 1.00 0.00 O ATOM 364 CB LYS A 22 2.365 11.369 -31.281 1.00 0.00 C ATOM 365 CG LYS A 22 1.385 11.601 -30.128 1.00 0.00 C ATOM 366 CD LYS A 22 -0.032 11.842 -30.653 1.00 0.00 C ATOM 367 CE LYS A 22 -0.952 10.671 -30.301 1.00 0.00 C ATOM 368 NZ LYS A 22 -2.263 11.167 -29.827 1.00 0.00 N ATOM 0 H LYS A 22 3.711 12.645 -32.914 1.00 0.00 H new ATOM 0 HA LYS A 22 3.590 12.647 -30.141 1.00 0.00 H new ATOM 0 HB2 LYS A 22 1.987 11.845 -32.186 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.441 10.302 -31.490 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.388 10.737 -29.464 1.00 0.00 H new ATOM 0 HG3 LYS A 22 1.709 12.458 -29.538 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -0.430 12.763 -30.227 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.005 11.976 -31.734 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -1.092 10.035 -31.175 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -0.489 10.056 -29.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.875 10.360 -29.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -2.126 11.755 -28.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -2.710 11.735 -30.575 1.00 0.00 H new ATOM 381 N ARG A 23 4.928 9.844 -31.223 1.00 0.00 N ATOM 382 CA ARG A 23 5.830 8.768 -30.851 1.00 0.00 C ATOM 383 C ARG A 23 5.709 7.607 -31.839 1.00 0.00 C ATOM 384 O ARG A 23 4.657 6.976 -31.935 1.00 0.00 O ATOM 385 CB ARG A 23 5.530 8.261 -29.439 1.00 0.00 C ATOM 386 CG ARG A 23 4.034 7.992 -29.260 1.00 0.00 C ATOM 387 CD ARG A 23 3.544 8.500 -27.903 1.00 0.00 C ATOM 388 NE ARG A 23 2.135 8.096 -27.691 1.00 0.00 N ATOM 389 CZ ARG A 23 1.355 8.568 -26.696 1.00 0.00 C ATOM 390 NH1 ARG A 23 1.839 9.467 -25.813 1.00 0.00 N ATOM 391 NH2 ARG A 23 0.111 8.138 -26.599 1.00 0.00 N ATOM 0 H ARG A 23 4.482 9.731 -32.133 1.00 0.00 H new ATOM 0 HA ARG A 23 6.845 9.164 -30.874 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.093 7.347 -29.250 1.00 0.00 H new ATOM 0 HB3 ARG A 23 5.861 8.997 -28.706 1.00 0.00 H new ATOM 0 HG2 ARG A 23 3.475 8.480 -30.058 1.00 0.00 H new ATOM 0 HG3 ARG A 23 3.841 6.923 -29.343 1.00 0.00 H new ATOM 0 HD2 ARG A 23 4.170 8.098 -27.107 1.00 0.00 H new ATOM 0 HD3 ARG A 23 3.631 9.586 -27.859 1.00 0.00 H new ATOM 0 HE ARG A 23 1.729 7.419 -28.337 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.801 9.795 -25.895 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.242 9.818 -25.064 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -0.248 7.459 -27.270 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -0.492 8.485 -25.853 1.00 0.00 H new ATOM 405 N ALA A 24 6.799 7.360 -32.550 1.00 0.00 N ATOM 406 CA ALA A 24 6.827 6.286 -33.528 1.00 0.00 C ATOM 407 C ALA A 24 6.073 5.076 -32.972 1.00 0.00 C ATOM 408 O ALA A 24 6.412 4.564 -31.907 1.00 0.00 O ATOM 409 CB ALA A 24 8.279 5.955 -33.881 1.00 0.00 C ATOM 0 H ALA A 24 7.670 7.885 -32.468 1.00 0.00 H new ATOM 0 HA ALA A 24 6.328 6.592 -34.448 1.00 0.00 H new ATOM 0 HB1 ALA A 24 8.300 5.149 -34.615 1.00 0.00 H new ATOM 0 HB2 ALA A 24 8.763 6.838 -34.298 1.00 0.00 H new ATOM 0 HB3 ALA A 24 8.810 5.641 -32.982 1.00 0.00 H new ATOM 415 N LEU A 25 5.063 4.655 -33.719 1.00 0.00 N ATOM 416 CA LEU A 25 4.257 3.516 -33.315 1.00 0.00 C ATOM 417 C LEU A 25 5.177 2.385 -32.852 1.00 0.00 C ATOM 418 O LEU A 25 6.381 2.415 -33.106 1.00 0.00 O ATOM 419 CB LEU A 25 3.302 3.110 -34.439 1.00 0.00 C ATOM 420 CG LEU A 25 2.275 4.163 -34.860 1.00 0.00 C ATOM 421 CD1 LEU A 25 2.569 4.683 -36.269 1.00 0.00 C ATOM 422 CD2 LEU A 25 0.850 3.620 -34.736 1.00 0.00 C ATOM 0 H LEU A 25 4.784 5.083 -34.602 1.00 0.00 H new ATOM 0 HA LEU A 25 3.623 3.779 -32.468 1.00 0.00 H new ATOM 0 HB2 LEU A 25 3.895 2.840 -35.313 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.767 2.213 -34.128 1.00 0.00 H new ATOM 0 HG LEU A 25 2.357 5.011 -34.180 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.824 5.430 -36.544 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.561 5.134 -36.291 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.531 3.855 -36.977 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.140 4.389 -35.041 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.737 2.746 -35.377 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.657 3.338 -33.701 1.00 0.00 H new ATOM 434 N SER A 26 4.576 1.414 -32.180 1.00 0.00 N ATOM 435 CA SER A 26 5.326 0.275 -31.679 1.00 0.00 C ATOM 436 C SER A 26 5.252 -0.882 -32.677 1.00 0.00 C ATOM 437 O SER A 26 4.304 -0.974 -33.456 1.00 0.00 O ATOM 438 CB SER A 26 4.805 -0.170 -30.311 1.00 0.00 C ATOM 439 OG SER A 26 3.976 0.821 -29.707 1.00 0.00 O ATOM 0 H SER A 26 3.578 1.393 -31.971 1.00 0.00 H new ATOM 0 HA SER A 26 6.366 0.578 -31.560 1.00 0.00 H new ATOM 0 HB2 SER A 26 4.241 -1.096 -30.422 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.648 -0.387 -29.655 1.00 0.00 H new ATOM 0 HG SER A 26 3.662 0.499 -28.836 1.00 0.00 H new ATOM 445 N ALA A 27 6.264 -1.735 -32.623 1.00 0.00 N ATOM 446 CA ALA A 27 6.325 -2.882 -33.512 1.00 0.00 C ATOM 447 C ALA A 27 4.997 -3.639 -33.453 1.00 0.00 C ATOM 448 O ALA A 27 4.583 -4.250 -34.437 1.00 0.00 O ATOM 449 CB ALA A 27 7.516 -3.763 -33.130 1.00 0.00 C ATOM 0 H ALA A 27 7.049 -1.654 -31.977 1.00 0.00 H new ATOM 0 HA ALA A 27 6.476 -2.560 -34.543 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.561 -4.623 -33.798 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.437 -3.187 -33.218 1.00 0.00 H new ATOM 0 HB3 ALA A 27 7.399 -4.107 -32.102 1.00 0.00 H new ATOM 455 N TYR A 28 4.366 -3.573 -32.290 1.00 0.00 N ATOM 456 CA TYR A 28 3.093 -4.245 -32.090 1.00 0.00 C ATOM 457 C TYR A 28 2.014 -3.659 -33.004 1.00 0.00 C ATOM 458 O TYR A 28 1.110 -4.371 -33.439 1.00 0.00 O ATOM 459 CB TYR A 28 2.705 -3.987 -30.633 1.00 0.00 C ATOM 460 CG TYR A 28 1.218 -4.196 -30.338 1.00 0.00 C ATOM 461 CD1 TYR A 28 0.617 -5.399 -30.647 1.00 0.00 C ATOM 462 CD2 TYR A 28 0.478 -3.181 -29.765 1.00 0.00 C ATOM 463 CE1 TYR A 28 -0.783 -5.595 -30.369 1.00 0.00 C ATOM 464 CE2 TYR A 28 -0.920 -3.378 -29.489 1.00 0.00 C ATOM 465 CZ TYR A 28 -1.483 -4.576 -29.804 1.00 0.00 C ATOM 466 OH TYR A 28 -2.804 -4.762 -29.543 1.00 0.00 O ATOM 0 H TYR A 28 4.712 -3.065 -31.476 1.00 0.00 H new ATOM 0 HA TYR A 28 3.180 -5.307 -32.318 1.00 0.00 H new ATOM 0 HB2 TYR A 28 3.288 -4.646 -29.990 1.00 0.00 H new ATOM 0 HB3 TYR A 28 2.977 -2.964 -30.371 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.195 -6.193 -31.097 1.00 0.00 H new ATOM 0 HD2 TYR A 28 0.949 -2.239 -29.524 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -1.266 -6.532 -30.605 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -1.510 -2.592 -29.041 1.00 0.00 H new ATOM 0 HH TYR A 28 -2.991 -4.518 -28.612 1.00 0.00 H new ATOM 476 N MET A 29 2.146 -2.368 -33.268 1.00 0.00 N ATOM 477 CA MET A 29 1.194 -1.677 -34.123 1.00 0.00 C ATOM 478 C MET A 29 1.329 -2.136 -35.576 1.00 0.00 C ATOM 479 O MET A 29 0.333 -2.444 -36.229 1.00 0.00 O ATOM 480 CB MET A 29 1.431 -0.169 -34.038 1.00 0.00 C ATOM 481 CG MET A 29 1.647 0.272 -32.590 1.00 0.00 C ATOM 482 SD MET A 29 0.274 -0.257 -31.580 1.00 0.00 S ATOM 483 CE MET A 29 0.797 0.369 -29.992 1.00 0.00 C ATOM 0 H MET A 29 2.898 -1.781 -32.905 1.00 0.00 H new ATOM 0 HA MET A 29 0.187 -1.914 -33.779 1.00 0.00 H new ATOM 0 HB2 MET A 29 2.301 0.100 -34.637 1.00 0.00 H new ATOM 0 HB3 MET A 29 0.577 0.361 -34.460 1.00 0.00 H new ATOM 0 HG2 MET A 29 2.575 -0.151 -32.207 1.00 0.00 H new ATOM 0 HG3 MET A 29 1.748 1.356 -32.542 1.00 0.00 H new ATOM 0 HE1 MET A 29 -0.029 0.300 -29.284 1.00 0.00 H new ATOM 0 HE2 MET A 29 1.638 -0.221 -29.628 1.00 0.00 H new ATOM 0 HE3 MET A 29 1.101 1.411 -30.094 1.00 0.00 H new ATOM 493 N PHE A 30 2.570 -2.167 -36.040 1.00 0.00 N ATOM 494 CA PHE A 30 2.849 -2.583 -37.404 1.00 0.00 C ATOM 495 C PHE A 30 2.216 -3.944 -37.703 1.00 0.00 C ATOM 496 O PHE A 30 1.649 -4.146 -38.775 1.00 0.00 O ATOM 497 CB PHE A 30 4.368 -2.700 -37.534 1.00 0.00 C ATOM 498 CG PHE A 30 5.098 -1.355 -37.551 1.00 0.00 C ATOM 499 CD1 PHE A 30 5.452 -0.759 -36.381 1.00 0.00 C ATOM 500 CD2 PHE A 30 5.391 -0.756 -38.735 1.00 0.00 C ATOM 501 CE1 PHE A 30 6.129 0.489 -36.396 1.00 0.00 C ATOM 502 CE2 PHE A 30 6.068 0.492 -38.751 1.00 0.00 C ATOM 503 CZ PHE A 30 6.422 1.089 -37.581 1.00 0.00 C ATOM 0 H PHE A 30 3.394 -1.911 -35.495 1.00 0.00 H new ATOM 0 HA PHE A 30 2.436 -1.859 -38.106 1.00 0.00 H new ATOM 0 HB2 PHE A 30 4.748 -3.297 -36.705 1.00 0.00 H new ATOM 0 HB3 PHE A 30 4.603 -3.241 -38.451 1.00 0.00 H new ATOM 0 HD1 PHE A 30 5.218 -1.235 -35.440 1.00 0.00 H new ATOM 0 HD2 PHE A 30 5.109 -1.229 -39.664 1.00 0.00 H new ATOM 0 HE1 PHE A 30 6.411 0.962 -35.467 1.00 0.00 H new ATOM 0 HE2 PHE A 30 6.302 0.967 -39.692 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.936 2.039 -37.593 1.00 0.00 H new ATOM 513 N PHE A 31 2.335 -4.841 -36.736 1.00 0.00 N ATOM 514 CA PHE A 31 1.783 -6.177 -36.881 1.00 0.00 C ATOM 515 C PHE A 31 0.272 -6.173 -36.641 1.00 0.00 C ATOM 516 O PHE A 31 -0.452 -6.990 -37.209 1.00 0.00 O ATOM 517 CB PHE A 31 2.453 -7.056 -35.824 1.00 0.00 C ATOM 518 CG PHE A 31 1.518 -8.088 -35.190 1.00 0.00 C ATOM 519 CD1 PHE A 31 1.343 -9.301 -35.780 1.00 0.00 C ATOM 520 CD2 PHE A 31 0.864 -7.792 -34.035 1.00 0.00 C ATOM 521 CE1 PHE A 31 0.476 -10.258 -35.191 1.00 0.00 C ATOM 522 CE2 PHE A 31 -0.004 -8.750 -33.445 1.00 0.00 C ATOM 523 CZ PHE A 31 -0.180 -9.963 -34.036 1.00 0.00 C ATOM 0 H PHE A 31 2.806 -4.669 -35.848 1.00 0.00 H new ATOM 0 HA PHE A 31 1.964 -6.547 -37.890 1.00 0.00 H new ATOM 0 HB2 PHE A 31 3.296 -7.576 -36.279 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.859 -6.418 -35.039 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.864 -9.536 -36.697 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.004 -6.829 -33.566 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.337 -11.221 -35.660 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.524 -8.515 -32.528 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.840 -10.691 -33.588 1.00 0.00 H new ATOM 533 N ALA A 32 -0.161 -5.246 -35.800 1.00 0.00 N ATOM 534 CA ALA A 32 -1.573 -5.125 -35.479 1.00 0.00 C ATOM 535 C ALA A 32 -2.311 -4.510 -36.669 1.00 0.00 C ATOM 536 O ALA A 32 -3.309 -5.056 -37.135 1.00 0.00 O ATOM 537 CB ALA A 32 -1.737 -4.301 -34.200 1.00 0.00 C ATOM 0 H ALA A 32 0.442 -4.571 -35.330 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.010 -6.106 -35.292 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -2.796 -4.210 -33.959 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.219 -4.797 -33.379 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.313 -3.308 -34.350 1.00 0.00 H new ATOM 543 N ASN A 33 -1.793 -3.379 -37.126 1.00 0.00 N ATOM 544 CA ASN A 33 -2.391 -2.683 -38.252 1.00 0.00 C ATOM 545 C ASN A 33 -2.614 -3.672 -39.398 1.00 0.00 C ATOM 546 O ASN A 33 -3.460 -3.447 -40.261 1.00 0.00 O ATOM 547 CB ASN A 33 -1.474 -1.569 -38.761 1.00 0.00 C ATOM 548 CG ASN A 33 -1.833 -0.226 -38.119 1.00 0.00 C ATOM 549 OD1 ASN A 33 -2.373 0.667 -38.749 1.00 0.00 O ATOM 550 ND2 ASN A 33 -1.504 -0.137 -36.833 1.00 0.00 N ATOM 0 H ASN A 33 -0.965 -2.928 -36.736 1.00 0.00 H new ATOM 0 HA ASN A 33 -3.334 -2.250 -37.918 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.436 -1.817 -38.538 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -1.557 -1.492 -39.845 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -1.703 0.718 -36.314 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.053 -0.924 -36.366 1.00 0.00 H new ATOM 557 N GLU A 34 -1.840 -4.747 -39.367 1.00 0.00 N ATOM 558 CA GLU A 34 -1.942 -5.771 -40.393 1.00 0.00 C ATOM 559 C GLU A 34 -2.763 -6.955 -39.879 1.00 0.00 C ATOM 560 O GLU A 34 -3.551 -7.538 -40.624 1.00 0.00 O ATOM 561 CB GLU A 34 -0.555 -6.225 -40.855 1.00 0.00 C ATOM 562 CG GLU A 34 -0.534 -6.473 -42.365 1.00 0.00 C ATOM 563 CD GLU A 34 0.399 -7.633 -42.717 1.00 0.00 C ATOM 564 OE1 GLU A 34 0.016 -8.803 -42.572 1.00 0.00 O ATOM 565 OE2 GLU A 34 1.562 -7.284 -43.155 1.00 0.00 O ATOM 0 H GLU A 34 -1.140 -4.931 -38.648 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.454 -5.345 -41.256 1.00 0.00 H new ATOM 0 HB2 GLU A 34 0.184 -5.467 -40.597 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -0.273 -7.137 -40.329 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.542 -6.694 -42.715 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.208 -5.570 -42.881 1.00 0.00 H new ATOM 572 N ASN A 35 -2.552 -7.277 -38.612 1.00 0.00 N ATOM 573 CA ASN A 35 -3.262 -8.380 -37.991 1.00 0.00 C ATOM 574 C ASN A 35 -4.480 -7.839 -37.238 1.00 0.00 C ATOM 575 O ASN A 35 -4.893 -8.407 -36.229 1.00 0.00 O ATOM 576 CB ASN A 35 -2.372 -9.113 -36.984 1.00 0.00 C ATOM 577 CG ASN A 35 -1.302 -9.940 -37.699 1.00 0.00 C ATOM 578 OD1 ASN A 35 -0.614 -9.260 -38.613 1.00 0.00 O flip ATOM 579 ND2 ASN A 35 -1.112 -11.116 -37.439 1.00 0.00 N flip ATOM 0 H ASN A 35 -1.898 -6.792 -37.998 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.562 -9.072 -38.778 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.896 -8.391 -36.321 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -2.983 -9.764 -36.360 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.676 -11.578 -36.726 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.389 -11.638 -37.935 1.00 0.00 H new ATOM 586 N ARG A 36 -5.019 -6.747 -37.759 1.00 0.00 N ATOM 587 CA ARG A 36 -6.181 -6.122 -37.150 1.00 0.00 C ATOM 588 C ARG A 36 -7.466 -6.658 -37.784 1.00 0.00 C ATOM 589 O ARG A 36 -8.554 -6.478 -37.239 1.00 0.00 O ATOM 590 CB ARG A 36 -6.137 -4.602 -37.311 1.00 0.00 C ATOM 591 CG ARG A 36 -6.143 -3.905 -35.949 1.00 0.00 C ATOM 592 CD ARG A 36 -7.512 -4.029 -35.276 1.00 0.00 C ATOM 593 NE ARG A 36 -8.449 -3.039 -35.851 1.00 0.00 N ATOM 594 CZ ARG A 36 -8.439 -1.723 -35.549 1.00 0.00 C ATOM 595 NH1 ARG A 36 -7.537 -1.227 -34.675 1.00 0.00 N ATOM 596 NH2 ARG A 36 -9.324 -0.928 -36.121 1.00 0.00 N ATOM 0 H ARG A 36 -4.673 -6.279 -38.596 1.00 0.00 H new ATOM 0 HA ARG A 36 -6.168 -6.364 -36.087 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -5.242 -4.317 -37.865 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.994 -4.270 -37.897 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -5.378 -4.344 -35.309 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -5.889 -2.852 -36.074 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -7.904 -5.036 -35.414 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -7.415 -3.869 -34.202 1.00 0.00 H new ATOM 0 HE ARG A 36 -9.146 -3.371 -36.517 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -6.856 -1.848 -34.237 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -7.536 -0.232 -34.453 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -10.002 -1.310 -36.780 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -9.330 0.069 -35.904 1.00 0.00 H new ATOM 610 N ASP A 37 -7.298 -7.307 -38.928 1.00 0.00 N ATOM 611 CA ASP A 37 -8.431 -7.870 -39.641 1.00 0.00 C ATOM 612 C ASP A 37 -8.290 -9.393 -39.692 1.00 0.00 C ATOM 613 O ASP A 37 -9.228 -10.094 -40.070 1.00 0.00 O ATOM 614 CB ASP A 37 -8.488 -7.353 -41.081 1.00 0.00 C ATOM 615 CG ASP A 37 -8.840 -5.871 -41.222 1.00 0.00 C ATOM 616 OD1 ASP A 37 -8.134 -5.072 -40.497 1.00 0.00 O ATOM 617 OD2 ASP A 37 -9.744 -5.499 -41.985 1.00 0.00 O ATOM 0 H ASP A 37 -6.394 -7.455 -39.378 1.00 0.00 H new ATOM 0 HA ASP A 37 -9.340 -7.576 -39.116 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.521 -7.528 -41.552 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.222 -7.940 -41.633 1.00 0.00 H new ATOM 622 N ILE A 38 -7.113 -9.859 -39.304 1.00 0.00 N ATOM 623 CA ILE A 38 -6.838 -11.286 -39.300 1.00 0.00 C ATOM 624 C ILE A 38 -7.616 -11.948 -38.162 1.00 0.00 C ATOM 625 O ILE A 38 -8.072 -13.082 -38.294 1.00 0.00 O ATOM 626 CB ILE A 38 -5.330 -11.541 -39.245 1.00 0.00 C ATOM 627 CG1 ILE A 38 -4.638 -11.022 -40.507 1.00 0.00 C ATOM 628 CG2 ILE A 38 -5.032 -13.021 -38.996 1.00 0.00 C ATOM 629 CD1 ILE A 38 -3.132 -10.879 -40.288 1.00 0.00 C ATOM 0 H ILE A 38 -6.338 -9.274 -38.990 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.181 -11.743 -40.228 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.921 -10.984 -38.402 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -4.825 -11.705 -41.335 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.061 -10.057 -40.787 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.953 -13.174 -38.962 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -5.472 -13.326 -38.047 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.458 -13.619 -39.802 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.665 -10.509 -41.201 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -2.948 -10.177 -39.475 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -2.708 -11.850 -40.032 1.00 0.00 H new ATOM 641 N VAL A 39 -7.741 -11.211 -37.067 1.00 0.00 N ATOM 642 CA VAL A 39 -8.456 -11.713 -35.906 1.00 0.00 C ATOM 643 C VAL A 39 -9.953 -11.444 -36.078 1.00 0.00 C ATOM 644 O VAL A 39 -10.776 -12.328 -35.851 1.00 0.00 O ATOM 645 CB VAL A 39 -7.880 -11.095 -34.631 1.00 0.00 C ATOM 646 CG1 VAL A 39 -7.975 -12.071 -33.457 1.00 0.00 C ATOM 647 CG2 VAL A 39 -6.437 -10.635 -34.847 1.00 0.00 C ATOM 0 H VAL A 39 -7.359 -10.271 -36.960 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.329 -12.792 -35.815 1.00 0.00 H new ATOM 0 HB VAL A 39 -8.477 -10.217 -34.385 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.559 -11.607 -32.563 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -9.020 -12.327 -33.280 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.414 -12.976 -33.690 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.052 -10.200 -33.925 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.821 -11.489 -35.130 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.408 -9.888 -35.641 1.00 0.00 H new ATOM 657 N ARG A 40 -10.259 -10.218 -36.477 1.00 0.00 N ATOM 658 CA ARG A 40 -11.641 -9.821 -36.683 1.00 0.00 C ATOM 659 C ARG A 40 -12.320 -10.760 -37.683 1.00 0.00 C ATOM 660 O ARG A 40 -13.513 -11.037 -37.568 1.00 0.00 O ATOM 661 CB ARG A 40 -11.732 -8.384 -37.200 1.00 0.00 C ATOM 662 CG ARG A 40 -11.662 -8.346 -38.728 1.00 0.00 C ATOM 663 CD ARG A 40 -11.576 -6.906 -39.237 1.00 0.00 C ATOM 664 NE ARG A 40 -12.937 -6.350 -39.416 1.00 0.00 N ATOM 665 CZ ARG A 40 -13.709 -6.577 -40.499 1.00 0.00 C ATOM 666 NH1 ARG A 40 -13.263 -7.352 -41.510 1.00 0.00 N ATOM 667 NH2 ARG A 40 -14.910 -6.030 -40.554 1.00 0.00 N ATOM 0 H ARG A 40 -9.573 -9.486 -36.663 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.149 -9.880 -35.720 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -12.665 -7.931 -36.864 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -10.920 -7.790 -36.780 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -10.793 -8.909 -39.070 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -12.542 -8.832 -39.148 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -11.015 -6.295 -38.530 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -11.035 -6.878 -40.183 1.00 0.00 H new ATOM 0 HE ARG A 40 -13.314 -5.759 -38.675 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -12.335 -7.772 -41.459 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -13.854 -7.518 -42.325 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -15.240 -5.447 -39.785 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -15.507 -6.191 -41.365 1.00 0.00 H new ATOM 681 N SER A 41 -11.531 -11.222 -38.642 1.00 0.00 N ATOM 682 CA SER A 41 -12.040 -12.122 -39.661 1.00 0.00 C ATOM 683 C SER A 41 -12.493 -13.436 -39.020 1.00 0.00 C ATOM 684 O SER A 41 -13.456 -14.052 -39.473 1.00 0.00 O ATOM 685 CB SER A 41 -10.984 -12.392 -40.735 1.00 0.00 C ATOM 686 OG SER A 41 -11.469 -13.265 -41.752 1.00 0.00 O ATOM 0 H SER A 41 -10.542 -10.989 -38.734 1.00 0.00 H new ATOM 0 HA SER A 41 -12.895 -11.646 -40.142 1.00 0.00 H new ATOM 0 HB2 SER A 41 -10.674 -11.448 -41.184 1.00 0.00 H new ATOM 0 HB3 SER A 41 -10.100 -12.830 -40.272 1.00 0.00 H new ATOM 0 HG SER A 41 -10.767 -13.412 -42.420 1.00 0.00 H new ATOM 692 N GLU A 42 -11.776 -13.826 -37.977 1.00 0.00 N ATOM 693 CA GLU A 42 -12.091 -15.055 -37.269 1.00 0.00 C ATOM 694 C GLU A 42 -13.012 -14.763 -36.082 1.00 0.00 C ATOM 695 O GLU A 42 -13.487 -15.683 -35.419 1.00 0.00 O ATOM 696 CB GLU A 42 -10.816 -15.767 -36.811 1.00 0.00 C ATOM 697 CG GLU A 42 -10.146 -16.495 -37.978 1.00 0.00 C ATOM 698 CD GLU A 42 -10.192 -18.011 -37.778 1.00 0.00 C ATOM 699 OE1 GLU A 42 -11.227 -18.550 -37.357 1.00 0.00 O ATOM 700 OE2 GLU A 42 -9.102 -18.634 -38.077 1.00 0.00 O ATOM 0 H GLU A 42 -10.977 -13.312 -37.605 1.00 0.00 H new ATOM 0 HA GLU A 42 -12.614 -15.722 -37.955 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -10.123 -15.042 -36.384 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -11.057 -16.480 -36.023 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -10.646 -16.232 -38.910 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -9.110 -16.168 -38.069 1.00 0.00 H new ATOM 707 N ASN A 43 -13.237 -13.478 -35.852 1.00 0.00 N ATOM 708 CA ASN A 43 -14.093 -13.053 -34.757 1.00 0.00 C ATOM 709 C ASN A 43 -14.800 -11.752 -35.143 1.00 0.00 C ATOM 710 O ASN A 43 -14.611 -10.723 -34.497 1.00 0.00 O ATOM 711 CB ASN A 43 -13.276 -12.788 -33.490 1.00 0.00 C ATOM 712 CG ASN A 43 -11.976 -13.594 -33.498 1.00 0.00 C ATOM 713 OD1 ASN A 43 -10.878 -12.849 -33.421 1.00 0.00 O flip ATOM 714 ND2 ASN A 43 -11.971 -14.812 -33.570 1.00 0.00 N flip ATOM 0 H ASN A 43 -12.842 -12.717 -36.405 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.812 -13.849 -34.563 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -13.048 -11.725 -33.415 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -13.865 -13.050 -32.611 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.852 -15.323 -33.627 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.086 -15.319 -33.574 1.00 0.00 H new ATOM 721 N PRO A 44 -15.621 -11.844 -36.224 1.00 0.00 N ATOM 722 CA PRO A 44 -16.358 -10.687 -36.705 1.00 0.00 C ATOM 723 C PRO A 44 -17.542 -10.372 -35.788 1.00 0.00 C ATOM 724 O PRO A 44 -18.291 -9.427 -36.037 1.00 0.00 O ATOM 725 CB PRO A 44 -16.781 -11.049 -38.118 1.00 0.00 C ATOM 726 CG PRO A 44 -16.672 -12.563 -38.211 1.00 0.00 C ATOM 727 CD PRO A 44 -15.870 -13.047 -37.014 1.00 0.00 C ATOM 0 HA PRO A 44 -15.759 -9.776 -36.705 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -17.800 -10.718 -38.318 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -16.139 -10.565 -38.854 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -17.663 -13.017 -38.216 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -16.183 -12.854 -39.141 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -16.424 -13.790 -36.440 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -14.937 -13.516 -37.326 1.00 0.00 H new ATOM 735 N ASP A 45 -17.675 -11.180 -34.746 1.00 0.00 N ATOM 736 CA ASP A 45 -18.754 -10.999 -33.791 1.00 0.00 C ATOM 737 C ASP A 45 -18.280 -10.087 -32.657 1.00 0.00 C ATOM 738 O ASP A 45 -19.090 -9.580 -31.883 1.00 0.00 O ATOM 739 CB ASP A 45 -19.177 -12.335 -33.177 1.00 0.00 C ATOM 740 CG ASP A 45 -20.681 -12.613 -33.207 1.00 0.00 C ATOM 741 OD1 ASP A 45 -21.454 -11.880 -33.842 1.00 0.00 O ATOM 742 OD2 ASP A 45 -21.058 -13.646 -32.533 1.00 0.00 O ATOM 0 H ASP A 45 -17.053 -11.962 -34.543 1.00 0.00 H new ATOM 0 HA ASP A 45 -19.601 -10.561 -34.320 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -18.664 -13.139 -33.705 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -18.838 -12.366 -32.142 1.00 0.00 H new ATOM 747 N ILE A 46 -16.969 -9.906 -32.597 1.00 0.00 N ATOM 748 CA ILE A 46 -16.377 -9.064 -31.570 1.00 0.00 C ATOM 749 C ILE A 46 -15.829 -7.789 -32.216 1.00 0.00 C ATOM 750 O ILE A 46 -16.071 -7.533 -33.394 1.00 0.00 O ATOM 751 CB ILE A 46 -15.332 -9.847 -30.773 1.00 0.00 C ATOM 752 CG1 ILE A 46 -14.226 -10.376 -31.687 1.00 0.00 C ATOM 753 CG2 ILE A 46 -15.988 -10.966 -29.961 1.00 0.00 C ATOM 754 CD1 ILE A 46 -13.022 -10.854 -30.873 1.00 0.00 C ATOM 0 H ILE A 46 -16.300 -10.327 -33.242 1.00 0.00 H new ATOM 0 HA ILE A 46 -17.132 -8.757 -30.847 1.00 0.00 H new ATOM 0 HB ILE A 46 -14.863 -9.165 -30.064 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -14.611 -11.198 -32.291 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -13.914 -9.592 -32.377 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -15.224 -11.507 -29.404 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -16.708 -10.536 -29.265 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -16.500 -11.653 -30.635 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -12.251 -11.225 -31.548 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -12.625 -10.024 -30.289 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -13.332 -11.654 -30.201 1.00 0.00 H new ATOM 766 N THR A 47 -15.101 -7.025 -31.416 1.00 0.00 N ATOM 767 CA THR A 47 -14.517 -5.784 -31.894 1.00 0.00 C ATOM 768 C THR A 47 -13.125 -5.582 -31.291 1.00 0.00 C ATOM 769 O THR A 47 -12.622 -6.448 -30.578 1.00 0.00 O ATOM 770 CB THR A 47 -15.490 -4.648 -31.572 1.00 0.00 C ATOM 771 OG1 THR A 47 -15.605 -4.682 -30.152 1.00 0.00 O ATOM 772 CG2 THR A 47 -16.909 -4.934 -32.067 1.00 0.00 C ATOM 0 H THR A 47 -14.902 -7.242 -30.439 1.00 0.00 H new ATOM 0 HA THR A 47 -14.368 -5.807 -32.974 1.00 0.00 H new ATOM 0 HB THR A 47 -15.129 -3.723 -32.021 1.00 0.00 H new ATOM 0 HG1 THR A 47 -15.022 -5.383 -29.793 1.00 0.00 H new ATOM 0 HG21 THR A 47 -17.559 -4.097 -31.813 1.00 0.00 H new ATOM 0 HG22 THR A 47 -16.897 -5.069 -33.149 1.00 0.00 H new ATOM 0 HG23 THR A 47 -17.284 -5.841 -31.593 1.00 0.00 H new ATOM 780 N PHE A 48 -12.543 -4.432 -31.599 1.00 0.00 N ATOM 781 CA PHE A 48 -11.220 -4.104 -31.096 1.00 0.00 C ATOM 782 C PHE A 48 -11.173 -4.203 -29.569 1.00 0.00 C ATOM 783 O PHE A 48 -10.130 -4.510 -28.995 1.00 0.00 O ATOM 784 CB PHE A 48 -10.927 -2.662 -31.511 1.00 0.00 C ATOM 785 CG PHE A 48 -9.439 -2.310 -31.533 1.00 0.00 C ATOM 786 CD1 PHE A 48 -8.539 -3.191 -32.047 1.00 0.00 C ATOM 787 CD2 PHE A 48 -9.015 -1.116 -31.039 1.00 0.00 C ATOM 788 CE1 PHE A 48 -7.157 -2.864 -32.068 1.00 0.00 C ATOM 789 CE2 PHE A 48 -7.633 -0.790 -31.060 1.00 0.00 C ATOM 790 CZ PHE A 48 -6.734 -1.671 -31.574 1.00 0.00 C ATOM 0 H PHE A 48 -12.964 -3.716 -32.191 1.00 0.00 H new ATOM 0 HA PHE A 48 -10.486 -4.800 -31.501 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -11.345 -2.488 -32.502 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -11.439 -1.987 -30.826 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -8.875 -4.139 -32.439 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -9.729 -0.416 -30.631 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -6.443 -3.563 -32.476 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -7.296 0.158 -30.668 1.00 0.00 H new ATOM 0 HZ PHE A 48 -5.683 -1.422 -31.590 1.00 0.00 H new ATOM 800 N GLY A 49 -12.318 -3.936 -28.957 1.00 0.00 N ATOM 801 CA GLY A 49 -12.421 -3.990 -27.508 1.00 0.00 C ATOM 802 C GLY A 49 -11.759 -5.255 -26.959 1.00 0.00 C ATOM 803 O GLY A 49 -11.143 -5.226 -25.895 1.00 0.00 O ATOM 0 H GLY A 49 -13.181 -3.682 -29.437 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -11.948 -3.110 -27.073 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -13.470 -3.967 -27.213 1.00 0.00 H new ATOM 807 N GLN A 50 -11.910 -6.337 -27.709 1.00 0.00 N ATOM 808 CA GLN A 50 -11.335 -7.610 -27.309 1.00 0.00 C ATOM 809 C GLN A 50 -10.301 -8.072 -28.339 1.00 0.00 C ATOM 810 O GLN A 50 -9.425 -8.877 -28.027 1.00 0.00 O ATOM 811 CB GLN A 50 -12.423 -8.667 -27.115 1.00 0.00 C ATOM 812 CG GLN A 50 -13.484 -8.571 -28.214 1.00 0.00 C ATOM 813 CD GLN A 50 -14.445 -7.412 -27.948 1.00 0.00 C ATOM 814 OE1 GLN A 50 -14.285 -6.311 -28.449 1.00 0.00 O ATOM 815 NE2 GLN A 50 -15.453 -7.720 -27.135 1.00 0.00 N ATOM 0 H GLN A 50 -12.422 -6.358 -28.591 1.00 0.00 H new ATOM 0 HA GLN A 50 -10.832 -7.474 -26.352 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -11.975 -9.661 -27.123 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -12.892 -8.537 -26.140 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -13.000 -8.432 -29.181 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -14.042 -9.506 -28.268 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -15.528 -8.661 -26.750 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.150 -7.015 -26.897 1.00 0.00 H new ATOM 824 N VAL A 51 -10.437 -7.542 -29.546 1.00 0.00 N ATOM 825 CA VAL A 51 -9.526 -7.889 -30.623 1.00 0.00 C ATOM 826 C VAL A 51 -8.201 -7.151 -30.422 1.00 0.00 C ATOM 827 O VAL A 51 -7.133 -7.760 -30.473 1.00 0.00 O ATOM 828 CB VAL A 51 -10.177 -7.591 -31.976 1.00 0.00 C ATOM 829 CG1 VAL A 51 -9.128 -7.175 -33.009 1.00 0.00 C ATOM 830 CG2 VAL A 51 -10.988 -8.790 -32.470 1.00 0.00 C ATOM 0 H VAL A 51 -11.165 -6.875 -29.802 1.00 0.00 H new ATOM 0 HA VAL A 51 -9.309 -8.957 -30.610 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.864 -6.755 -31.841 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -9.617 -6.969 -33.961 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.613 -6.278 -32.664 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.406 -7.981 -33.139 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -11.440 -8.552 -33.433 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -10.331 -9.653 -32.581 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -11.772 -9.021 -31.749 1.00 0.00 H new ATOM 840 N GLY A 52 -8.313 -5.850 -30.198 1.00 0.00 N ATOM 841 CA GLY A 52 -7.137 -5.022 -29.989 1.00 0.00 C ATOM 842 C GLY A 52 -6.456 -5.363 -28.661 1.00 0.00 C ATOM 843 O GLY A 52 -5.294 -5.019 -28.449 1.00 0.00 O ATOM 0 H GLY A 52 -9.200 -5.349 -30.157 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -6.435 -5.167 -30.810 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.422 -3.970 -29.996 1.00 0.00 H new ATOM 847 N LYS A 53 -7.209 -6.033 -27.802 1.00 0.00 N ATOM 848 CA LYS A 53 -6.693 -6.423 -26.501 1.00 0.00 C ATOM 849 C LYS A 53 -6.374 -7.919 -26.511 1.00 0.00 C ATOM 850 O LYS A 53 -6.194 -8.527 -25.456 1.00 0.00 O ATOM 851 CB LYS A 53 -7.664 -6.010 -25.393 1.00 0.00 C ATOM 852 CG LYS A 53 -7.030 -4.967 -24.469 1.00 0.00 C ATOM 853 CD LYS A 53 -6.042 -5.622 -23.501 1.00 0.00 C ATOM 854 CE LYS A 53 -5.207 -4.566 -22.775 1.00 0.00 C ATOM 855 NZ LYS A 53 -4.183 -4.001 -23.683 1.00 0.00 N ATOM 0 H LYS A 53 -8.172 -6.316 -27.981 1.00 0.00 H new ATOM 0 HA LYS A 53 -5.761 -5.899 -26.289 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -8.574 -5.604 -25.835 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -7.954 -6.886 -24.813 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -6.516 -4.213 -25.065 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -7.809 -4.452 -23.907 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -6.585 -6.225 -22.773 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.385 -6.298 -24.048 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.855 -3.770 -22.408 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.724 -5.011 -21.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -3.491 -3.457 -23.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.697 -4.773 -24.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.641 -3.375 -24.376 1.00 0.00 H new ATOM 868 N LYS A 54 -6.312 -8.470 -27.715 1.00 0.00 N ATOM 869 CA LYS A 54 -6.017 -9.884 -27.876 1.00 0.00 C ATOM 870 C LYS A 54 -4.787 -10.044 -28.771 1.00 0.00 C ATOM 871 O LYS A 54 -3.912 -10.863 -28.490 1.00 0.00 O ATOM 872 CB LYS A 54 -7.250 -10.634 -28.384 1.00 0.00 C ATOM 873 CG LYS A 54 -6.854 -11.956 -29.046 1.00 0.00 C ATOM 874 CD LYS A 54 -7.790 -13.086 -28.615 1.00 0.00 C ATOM 875 CE LYS A 54 -9.118 -13.017 -29.372 1.00 0.00 C ATOM 876 NZ LYS A 54 -10.253 -12.966 -28.424 1.00 0.00 N ATOM 0 H LYS A 54 -6.461 -7.963 -28.587 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.773 -10.335 -26.914 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.930 -10.828 -27.554 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -7.789 -10.012 -29.099 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.884 -11.847 -30.130 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.827 -12.207 -28.779 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.312 -14.048 -28.798 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.975 -13.021 -27.543 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -9.132 -12.136 -30.013 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -9.218 -13.886 -30.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.146 -12.919 -28.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -10.247 -13.819 -27.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -10.164 -12.123 -27.821 1.00 0.00 H new ATOM 889 N LEU A 55 -4.758 -9.250 -29.831 1.00 0.00 N ATOM 890 CA LEU A 55 -3.650 -9.294 -30.770 1.00 0.00 C ATOM 891 C LEU A 55 -2.331 -9.296 -29.995 1.00 0.00 C ATOM 892 O LEU A 55 -1.387 -9.992 -30.369 1.00 0.00 O ATOM 893 CB LEU A 55 -3.764 -8.158 -31.788 1.00 0.00 C ATOM 894 CG LEU A 55 -4.435 -8.511 -33.116 1.00 0.00 C ATOM 895 CD1 LEU A 55 -4.789 -7.249 -33.904 1.00 0.00 C ATOM 896 CD2 LEU A 55 -3.567 -9.472 -33.931 1.00 0.00 C ATOM 0 H LEU A 55 -5.485 -8.572 -30.061 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.680 -10.215 -31.352 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.320 -7.340 -31.329 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -2.762 -7.784 -31.998 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.370 -9.028 -32.899 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.265 -7.528 -34.844 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.474 -6.635 -33.319 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -3.881 -6.683 -34.111 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.068 -9.707 -34.870 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -2.604 -9.005 -34.139 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.410 -10.390 -33.364 1.00 0.00 H new ATOM 908 N GLY A 56 -2.306 -8.509 -28.929 1.00 0.00 N ATOM 909 CA GLY A 56 -1.120 -8.412 -28.098 1.00 0.00 C ATOM 910 C GLY A 56 -0.610 -9.800 -27.702 1.00 0.00 C ATOM 911 O GLY A 56 0.588 -9.990 -27.501 1.00 0.00 O ATOM 0 H GLY A 56 -3.090 -7.932 -28.622 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -0.339 -7.874 -28.635 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.346 -7.835 -27.201 1.00 0.00 H new ATOM 915 N GLU A 57 -1.546 -10.732 -27.605 1.00 0.00 N ATOM 916 CA GLU A 57 -1.207 -12.097 -27.238 1.00 0.00 C ATOM 917 C GLU A 57 -0.563 -12.820 -28.422 1.00 0.00 C ATOM 918 O GLU A 57 0.237 -13.735 -28.234 1.00 0.00 O ATOM 919 CB GLU A 57 -2.440 -12.852 -26.738 1.00 0.00 C ATOM 920 CG GLU A 57 -3.118 -12.098 -25.592 1.00 0.00 C ATOM 921 CD GLU A 57 -3.416 -13.037 -24.420 1.00 0.00 C ATOM 922 OE1 GLU A 57 -4.132 -14.035 -24.593 1.00 0.00 O ATOM 923 OE2 GLU A 57 -2.875 -12.699 -23.299 1.00 0.00 O ATOM 0 H GLU A 57 -2.539 -10.569 -27.774 1.00 0.00 H new ATOM 0 HA GLU A 57 -0.486 -12.065 -26.421 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -3.146 -12.986 -27.558 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -2.150 -13.847 -26.402 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -2.475 -11.284 -25.257 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -4.045 -11.647 -25.946 1.00 0.00 H new ATOM 930 N LYS A 58 -0.936 -12.383 -29.615 1.00 0.00 N ATOM 931 CA LYS A 58 -0.405 -12.978 -30.830 1.00 0.00 C ATOM 932 C LYS A 58 0.979 -12.391 -31.116 1.00 0.00 C ATOM 933 O LYS A 58 1.886 -13.109 -31.534 1.00 0.00 O ATOM 934 CB LYS A 58 -1.394 -12.812 -31.985 1.00 0.00 C ATOM 935 CG LYS A 58 -2.540 -13.820 -31.875 1.00 0.00 C ATOM 936 CD LYS A 58 -3.736 -13.388 -32.726 1.00 0.00 C ATOM 937 CE LYS A 58 -3.681 -14.029 -34.114 1.00 0.00 C ATOM 938 NZ LYS A 58 -4.982 -14.651 -34.449 1.00 0.00 N ATOM 0 H LYS A 58 -1.600 -11.624 -29.767 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.277 -14.053 -30.704 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.795 -11.798 -31.982 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.876 -12.947 -32.934 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.196 -14.803 -32.197 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.846 -13.915 -30.833 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.663 -13.671 -32.227 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.745 -12.302 -32.823 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.429 -13.275 -34.860 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.893 -14.782 -34.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.881 -15.224 -35.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.289 -15.259 -33.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.692 -13.907 -34.608 1.00 0.00 H new ATOM 951 N TRP A 59 1.096 -11.092 -30.882 1.00 0.00 N ATOM 952 CA TRP A 59 2.353 -10.401 -31.110 1.00 0.00 C ATOM 953 C TRP A 59 3.433 -11.097 -30.279 1.00 0.00 C ATOM 954 O TRP A 59 4.501 -11.428 -30.792 1.00 0.00 O ATOM 955 CB TRP A 59 2.224 -8.909 -30.794 1.00 0.00 C ATOM 956 CG TRP A 59 3.559 -8.160 -30.774 1.00 0.00 C ATOM 957 CD1 TRP A 59 4.138 -7.534 -29.741 1.00 0.00 C ATOM 958 CD2 TRP A 59 4.462 -7.984 -31.885 1.00 0.00 C ATOM 959 NE1 TRP A 59 5.343 -6.968 -30.103 1.00 0.00 N ATOM 960 CE2 TRP A 59 5.547 -7.250 -31.449 1.00 0.00 C ATOM 961 CE3 TRP A 59 4.367 -8.428 -33.215 1.00 0.00 C ATOM 962 CZ2 TRP A 59 6.618 -6.897 -32.278 1.00 0.00 C ATOM 963 CZ3 TRP A 59 5.445 -8.067 -34.032 1.00 0.00 C ATOM 964 CH2 TRP A 59 6.544 -7.330 -33.608 1.00 0.00 C ATOM 0 H TRP A 59 0.340 -10.500 -30.537 1.00 0.00 H new ATOM 0 HA TRP A 59 2.636 -10.452 -32.161 1.00 0.00 H new ATOM 0 HB2 TRP A 59 1.570 -8.446 -31.534 1.00 0.00 H new ATOM 0 HB3 TRP A 59 1.740 -8.794 -29.824 1.00 0.00 H new ATOM 0 HD1 TRP A 59 3.715 -7.479 -28.749 1.00 0.00 H new ATOM 0 HE1 TRP A 59 5.969 -6.440 -29.495 1.00 0.00 H new ATOM 0 HE3 TRP A 59 3.528 -9.003 -33.578 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 7.456 -6.322 -31.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 5.421 -8.384 -35.064 1.00 0.00 H new ATOM 0 HH2 TRP A 59 7.338 -7.092 -34.301 1.00 0.00 H new ATOM 975 N LYS A 60 3.117 -11.300 -29.008 1.00 0.00 N ATOM 976 CA LYS A 60 4.047 -11.951 -28.100 1.00 0.00 C ATOM 977 C LYS A 60 4.165 -13.430 -28.472 1.00 0.00 C ATOM 978 O LYS A 60 5.185 -14.062 -28.202 1.00 0.00 O ATOM 979 CB LYS A 60 3.632 -11.712 -26.647 1.00 0.00 C ATOM 980 CG LYS A 60 2.397 -12.542 -26.287 1.00 0.00 C ATOM 981 CD LYS A 60 2.371 -12.865 -24.791 1.00 0.00 C ATOM 982 CE LYS A 60 1.326 -13.940 -24.481 1.00 0.00 C ATOM 983 NZ LYS A 60 1.781 -14.798 -23.365 1.00 0.00 N ATOM 0 H LYS A 60 2.230 -11.025 -28.586 1.00 0.00 H new ATOM 0 HA LYS A 60 5.042 -11.518 -28.198 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.456 -11.972 -25.982 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.421 -10.654 -26.495 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.495 -11.995 -26.560 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.396 -13.468 -26.863 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.356 -13.207 -24.472 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.148 -11.961 -24.224 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.377 -13.470 -24.222 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.149 -14.549 -25.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.061 -15.522 -23.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.675 -15.261 -23.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.928 -14.215 -22.516 1.00 0.00 H new ATOM 996 N ALA A 61 3.107 -13.938 -29.087 1.00 0.00 N ATOM 997 CA ALA A 61 3.079 -15.332 -29.499 1.00 0.00 C ATOM 998 C ALA A 61 3.559 -15.440 -30.948 1.00 0.00 C ATOM 999 O ALA A 61 3.471 -16.505 -31.556 1.00 0.00 O ATOM 1000 CB ALA A 61 1.669 -15.893 -29.307 1.00 0.00 C ATOM 0 H ALA A 61 2.263 -13.410 -29.310 1.00 0.00 H new ATOM 0 HA ALA A 61 3.753 -15.928 -28.884 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.648 -16.938 -29.616 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.388 -15.819 -28.256 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.965 -15.322 -29.912 1.00 0.00 H new ATOM 1006 N LEU A 62 4.054 -14.323 -31.459 1.00 0.00 N ATOM 1007 CA LEU A 62 4.547 -14.279 -32.825 1.00 0.00 C ATOM 1008 C LEU A 62 5.999 -14.761 -32.854 1.00 0.00 C ATOM 1009 O LEU A 62 6.645 -14.734 -33.901 1.00 0.00 O ATOM 1010 CB LEU A 62 4.351 -12.884 -33.421 1.00 0.00 C ATOM 1011 CG LEU A 62 3.604 -12.823 -34.755 1.00 0.00 C ATOM 1012 CD1 LEU A 62 2.298 -13.617 -34.689 1.00 0.00 C ATOM 1013 CD2 LEU A 62 3.374 -11.374 -35.190 1.00 0.00 C ATOM 0 H LEU A 62 4.124 -13.441 -30.952 1.00 0.00 H new ATOM 0 HA LEU A 62 3.973 -14.955 -33.459 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.811 -12.274 -32.697 1.00 0.00 H new ATOM 0 HB3 LEU A 62 5.331 -12.427 -33.555 1.00 0.00 H new ATOM 0 HG LEU A 62 4.227 -13.292 -35.517 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.787 -13.557 -35.650 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.517 -14.660 -34.459 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.658 -13.201 -33.911 1.00 0.00 H new ATOM 0 HD21 LEU A 62 2.841 -11.360 -36.141 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.782 -10.857 -34.435 1.00 0.00 H new ATOM 0 HD23 LEU A 62 4.335 -10.872 -35.305 1.00 0.00 H new ATOM 1025 N THR A 63 6.470 -15.191 -31.693 1.00 0.00 N ATOM 1026 CA THR A 63 7.833 -15.678 -31.572 1.00 0.00 C ATOM 1027 C THR A 63 8.820 -14.642 -32.114 1.00 0.00 C ATOM 1028 O THR A 63 8.416 -13.666 -32.743 1.00 0.00 O ATOM 1029 CB THR A 63 7.918 -17.029 -32.286 1.00 0.00 C ATOM 1030 OG1 THR A 63 6.557 -17.406 -32.479 1.00 0.00 O ATOM 1031 CG2 THR A 63 8.485 -18.131 -31.389 1.00 0.00 C ATOM 0 H THR A 63 5.931 -15.212 -30.827 1.00 0.00 H new ATOM 0 HA THR A 63 8.108 -15.828 -30.528 1.00 0.00 H new ATOM 0 HB THR A 63 8.539 -16.930 -33.176 1.00 0.00 H new ATOM 0 HG1 THR A 63 6.519 -18.271 -32.938 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.524 -19.068 -31.944 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.490 -17.858 -31.068 1.00 0.00 H new ATOM 0 HG23 THR A 63 7.846 -18.253 -30.515 1.00 0.00 H new ATOM 1039 N PRO A 64 10.128 -14.898 -31.842 1.00 0.00 N ATOM 1040 CA PRO A 64 11.176 -13.998 -32.296 1.00 0.00 C ATOM 1041 C PRO A 64 11.421 -14.154 -33.798 1.00 0.00 C ATOM 1042 O PRO A 64 12.219 -13.422 -34.380 1.00 0.00 O ATOM 1043 CB PRO A 64 12.390 -14.354 -31.456 1.00 0.00 C ATOM 1044 CG PRO A 64 12.118 -15.741 -30.894 1.00 0.00 C ATOM 1045 CD PRO A 64 10.642 -16.044 -31.101 1.00 0.00 C ATOM 0 HA PRO A 64 10.913 -12.948 -32.168 1.00 0.00 H new ATOM 0 HB2 PRO A 64 13.298 -14.349 -32.060 1.00 0.00 H new ATOM 0 HB3 PRO A 64 12.536 -13.630 -30.655 1.00 0.00 H new ATOM 0 HG2 PRO A 64 12.735 -16.485 -31.397 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.371 -15.781 -29.835 1.00 0.00 H new ATOM 0 HD2 PRO A 64 10.502 -16.970 -31.658 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.125 -16.164 -30.149 1.00 0.00 H new ATOM 1053 N GLU A 65 10.718 -15.113 -34.383 1.00 0.00 N ATOM 1054 CA GLU A 65 10.850 -15.376 -35.806 1.00 0.00 C ATOM 1055 C GLU A 65 9.971 -14.412 -36.607 1.00 0.00 C ATOM 1056 O GLU A 65 10.224 -14.171 -37.786 1.00 0.00 O ATOM 1057 CB GLU A 65 10.503 -16.830 -36.130 1.00 0.00 C ATOM 1058 CG GLU A 65 11.692 -17.752 -35.852 1.00 0.00 C ATOM 1059 CD GLU A 65 12.091 -18.527 -37.110 1.00 0.00 C ATOM 1060 OE1 GLU A 65 11.355 -19.424 -37.545 1.00 0.00 O ATOM 1061 OE2 GLU A 65 13.211 -18.167 -37.640 1.00 0.00 O ATOM 0 H GLU A 65 10.055 -15.717 -33.897 1.00 0.00 H new ATOM 0 HA GLU A 65 11.889 -15.213 -36.091 1.00 0.00 H new ATOM 0 HB2 GLU A 65 9.647 -17.145 -35.534 1.00 0.00 H new ATOM 0 HB3 GLU A 65 10.210 -16.913 -37.177 1.00 0.00 H new ATOM 0 HG2 GLU A 65 12.539 -17.163 -35.499 1.00 0.00 H new ATOM 0 HG3 GLU A 65 11.436 -18.451 -35.056 1.00 0.00 H new ATOM 1068 N GLU A 66 8.959 -13.887 -35.933 1.00 0.00 N ATOM 1069 CA GLU A 66 8.042 -12.954 -36.566 1.00 0.00 C ATOM 1070 C GLU A 66 8.087 -11.600 -35.856 1.00 0.00 C ATOM 1071 O GLU A 66 7.551 -10.613 -36.359 1.00 0.00 O ATOM 1072 CB GLU A 66 6.618 -13.515 -36.589 1.00 0.00 C ATOM 1073 CG GLU A 66 6.609 -14.969 -37.063 1.00 0.00 C ATOM 1074 CD GLU A 66 6.237 -15.061 -38.544 1.00 0.00 C ATOM 1075 OE1 GLU A 66 5.525 -14.186 -39.060 1.00 0.00 O ATOM 1076 OE2 GLU A 66 6.715 -16.086 -39.164 1.00 0.00 O ATOM 0 H GLU A 66 8.753 -14.090 -34.955 1.00 0.00 H new ATOM 0 HA GLU A 66 8.357 -12.810 -37.599 1.00 0.00 H new ATOM 0 HB2 GLU A 66 6.182 -13.451 -35.592 1.00 0.00 H new ATOM 0 HB3 GLU A 66 5.996 -12.910 -37.248 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.591 -15.413 -36.903 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.898 -15.544 -36.470 1.00 0.00 H new ATOM 1083 N LYS A 67 8.730 -11.596 -34.698 1.00 0.00 N ATOM 1084 CA LYS A 67 8.851 -10.379 -33.913 1.00 0.00 C ATOM 1085 C LYS A 67 10.150 -9.663 -34.290 1.00 0.00 C ATOM 1086 O LYS A 67 10.248 -8.443 -34.167 1.00 0.00 O ATOM 1087 CB LYS A 67 8.733 -10.691 -32.420 1.00 0.00 C ATOM 1088 CG LYS A 67 9.495 -9.662 -31.583 1.00 0.00 C ATOM 1089 CD LYS A 67 9.348 -9.954 -30.088 1.00 0.00 C ATOM 1090 CE LYS A 67 10.706 -9.909 -29.385 1.00 0.00 C ATOM 1091 NZ LYS A 67 11.568 -11.019 -29.848 1.00 0.00 N ATOM 0 H LYS A 67 9.173 -12.416 -34.284 1.00 0.00 H new ATOM 0 HA LYS A 67 8.032 -9.696 -34.138 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.683 -10.697 -32.128 1.00 0.00 H new ATOM 0 HB3 LYS A 67 9.125 -11.689 -32.221 1.00 0.00 H new ATOM 0 HG2 LYS A 67 10.550 -9.674 -31.858 1.00 0.00 H new ATOM 0 HG3 LYS A 67 9.120 -8.662 -31.800 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.676 -9.225 -29.636 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.894 -10.935 -29.948 1.00 0.00 H new ATOM 0 HE2 LYS A 67 11.194 -8.955 -29.585 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.566 -9.976 -28.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.281 -11.232 -29.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.985 -11.863 -30.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 12.045 -10.743 -30.730 1.00 0.00 H new ATOM 1104 N GLN A 68 11.114 -10.451 -34.741 1.00 0.00 N ATOM 1105 CA GLN A 68 12.402 -9.906 -35.136 1.00 0.00 C ATOM 1106 C GLN A 68 12.286 -9.193 -36.485 1.00 0.00 C ATOM 1107 O GLN A 68 12.982 -8.210 -36.733 1.00 0.00 O ATOM 1108 CB GLN A 68 13.468 -11.002 -35.188 1.00 0.00 C ATOM 1109 CG GLN A 68 13.356 -11.817 -36.477 1.00 0.00 C ATOM 1110 CD GLN A 68 14.731 -12.303 -36.941 1.00 0.00 C ATOM 1111 OE1 GLN A 68 15.573 -11.538 -37.379 1.00 0.00 O ATOM 1112 NE2 GLN A 68 14.911 -13.615 -36.818 1.00 0.00 N ATOM 0 H GLN A 68 11.030 -11.462 -34.842 1.00 0.00 H new ATOM 0 HA GLN A 68 12.711 -9.178 -34.386 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.459 -10.553 -35.123 1.00 0.00 H new ATOM 0 HB3 GLN A 68 13.359 -11.661 -34.327 1.00 0.00 H new ATOM 0 HG2 GLN A 68 12.700 -12.672 -36.315 1.00 0.00 H new ATOM 0 HG3 GLN A 68 12.899 -11.208 -37.257 1.00 0.00 H new ATOM 0 HE21 GLN A 68 14.164 -14.199 -36.443 1.00 0.00 H new ATOM 0 HE22 GLN A 68 15.796 -14.037 -37.098 1.00 0.00 H new ATOM 1121 N PRO A 69 11.375 -9.728 -37.342 1.00 0.00 N ATOM 1122 CA PRO A 69 11.158 -9.152 -38.659 1.00 0.00 C ATOM 1123 C PRO A 69 10.356 -7.854 -38.564 1.00 0.00 C ATOM 1124 O PRO A 69 10.796 -6.812 -39.047 1.00 0.00 O ATOM 1125 CB PRO A 69 10.444 -10.236 -39.448 1.00 0.00 C ATOM 1126 CG PRO A 69 9.875 -11.197 -38.417 1.00 0.00 C ATOM 1127 CD PRO A 69 10.533 -10.892 -37.082 1.00 0.00 C ATOM 0 HA PRO A 69 12.087 -8.865 -39.152 1.00 0.00 H new ATOM 0 HB2 PRO A 69 9.652 -9.812 -40.065 1.00 0.00 H new ATOM 0 HB3 PRO A 69 11.133 -10.748 -40.120 1.00 0.00 H new ATOM 0 HG2 PRO A 69 8.793 -11.082 -38.344 1.00 0.00 H new ATOM 0 HG3 PRO A 69 10.067 -12.229 -38.710 1.00 0.00 H new ATOM 0 HD2 PRO A 69 9.790 -10.680 -36.313 1.00 0.00 H new ATOM 0 HD3 PRO A 69 11.124 -11.737 -36.729 1.00 0.00 H new ATOM 1135 N TYR A 70 9.193 -7.959 -37.937 1.00 0.00 N ATOM 1136 CA TYR A 70 8.324 -6.805 -37.772 1.00 0.00 C ATOM 1137 C TYR A 70 9.047 -5.676 -37.036 1.00 0.00 C ATOM 1138 O TYR A 70 9.060 -4.536 -37.499 1.00 0.00 O ATOM 1139 CB TYR A 70 7.147 -7.282 -36.922 1.00 0.00 C ATOM 1140 CG TYR A 70 5.899 -7.641 -37.730 1.00 0.00 C ATOM 1141 CD1 TYR A 70 5.435 -6.777 -38.702 1.00 0.00 C ATOM 1142 CD2 TYR A 70 5.237 -8.828 -37.489 1.00 0.00 C ATOM 1143 CE1 TYR A 70 4.260 -7.115 -39.463 1.00 0.00 C ATOM 1144 CE2 TYR A 70 4.063 -9.166 -38.251 1.00 0.00 C ATOM 1145 CZ TYR A 70 3.632 -8.292 -39.200 1.00 0.00 C ATOM 1146 OH TYR A 70 2.522 -8.610 -39.920 1.00 0.00 O ATOM 0 H TYR A 70 8.832 -8.825 -37.537 1.00 0.00 H new ATOM 0 HA TYR A 70 8.009 -6.419 -38.742 1.00 0.00 H new ATOM 0 HB2 TYR A 70 7.458 -8.154 -36.347 1.00 0.00 H new ATOM 0 HB3 TYR A 70 6.891 -6.502 -36.205 1.00 0.00 H new ATOM 0 HD1 TYR A 70 5.953 -5.848 -38.891 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.600 -9.504 -36.728 1.00 0.00 H new ATOM 0 HE1 TYR A 70 3.886 -6.448 -40.226 1.00 0.00 H new ATOM 0 HE2 TYR A 70 3.537 -10.092 -38.073 1.00 0.00 H new ATOM 0 HH TYR A 70 2.179 -9.479 -39.625 1.00 0.00 H new ATOM 1156 N GLU A 71 9.632 -6.032 -35.901 1.00 0.00 N ATOM 1157 CA GLU A 71 10.354 -5.063 -35.096 1.00 0.00 C ATOM 1158 C GLU A 71 11.515 -4.469 -35.895 1.00 0.00 C ATOM 1159 O GLU A 71 11.858 -3.299 -35.724 1.00 0.00 O ATOM 1160 CB GLU A 71 10.850 -5.693 -33.793 1.00 0.00 C ATOM 1161 CG GLU A 71 11.148 -4.621 -32.742 1.00 0.00 C ATOM 1162 CD GLU A 71 12.380 -3.800 -33.131 1.00 0.00 C ATOM 1163 OE1 GLU A 71 13.467 -4.481 -33.266 1.00 0.00 O ATOM 1164 OE2 GLU A 71 12.283 -2.574 -33.291 1.00 0.00 O ATOM 0 H GLU A 71 9.620 -6.978 -35.521 1.00 0.00 H new ATOM 0 HA GLU A 71 9.670 -4.256 -34.833 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.099 -6.383 -33.410 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.750 -6.277 -33.987 1.00 0.00 H new ATOM 0 HG2 GLU A 71 10.286 -3.962 -32.635 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.312 -5.092 -31.773 1.00 0.00 H new ATOM 1171 N ALA A 72 12.089 -5.301 -36.750 1.00 0.00 N ATOM 1172 CA ALA A 72 13.206 -4.873 -37.577 1.00 0.00 C ATOM 1173 C ALA A 72 12.752 -3.730 -38.486 1.00 0.00 C ATOM 1174 O ALA A 72 13.531 -2.828 -38.792 1.00 0.00 O ATOM 1175 CB ALA A 72 13.744 -6.067 -38.367 1.00 0.00 C ATOM 0 H ALA A 72 11.802 -6.270 -36.889 1.00 0.00 H new ATOM 0 HA ALA A 72 14.021 -4.499 -36.957 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.581 -5.746 -38.987 1.00 0.00 H new ATOM 0 HB2 ALA A 72 14.080 -6.839 -37.675 1.00 0.00 H new ATOM 0 HB3 ALA A 72 12.955 -6.468 -39.003 1.00 0.00 H new ATOM 1181 N LYS A 73 11.493 -3.802 -38.893 1.00 0.00 N ATOM 1182 CA LYS A 73 10.926 -2.785 -39.760 1.00 0.00 C ATOM 1183 C LYS A 73 10.700 -1.503 -38.957 1.00 0.00 C ATOM 1184 O LYS A 73 10.837 -0.401 -39.486 1.00 0.00 O ATOM 1185 CB LYS A 73 9.664 -3.309 -40.449 1.00 0.00 C ATOM 1186 CG LYS A 73 9.193 -2.344 -41.539 1.00 0.00 C ATOM 1187 CD LYS A 73 9.809 -2.703 -42.892 1.00 0.00 C ATOM 1188 CE LYS A 73 9.692 -1.536 -43.874 1.00 0.00 C ATOM 1189 NZ LYS A 73 10.095 -1.959 -45.234 1.00 0.00 N ATOM 0 H LYS A 73 10.849 -4.551 -38.637 1.00 0.00 H new ATOM 0 HA LYS A 73 11.621 -2.540 -40.563 1.00 0.00 H new ATOM 0 HB2 LYS A 73 9.864 -4.287 -40.886 1.00 0.00 H new ATOM 0 HB3 LYS A 73 8.873 -3.445 -39.712 1.00 0.00 H new ATOM 0 HG2 LYS A 73 8.106 -2.374 -41.611 1.00 0.00 H new ATOM 0 HG3 LYS A 73 9.467 -1.324 -41.270 1.00 0.00 H new ATOM 0 HD2 LYS A 73 10.858 -2.968 -42.759 1.00 0.00 H new ATOM 0 HD3 LYS A 73 9.308 -3.580 -43.302 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.666 -1.169 -43.890 1.00 0.00 H new ATOM 0 HE3 LYS A 73 10.321 -0.710 -43.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 10.009 -1.154 -45.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 11.081 -2.288 -45.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 9.478 -2.732 -45.554 1.00 0.00 H new ATOM 1202 N ALA A 74 10.359 -1.690 -37.690 1.00 0.00 N ATOM 1203 CA ALA A 74 10.113 -0.561 -36.808 1.00 0.00 C ATOM 1204 C ALA A 74 11.438 0.138 -36.498 1.00 0.00 C ATOM 1205 O ALA A 74 11.450 1.248 -35.970 1.00 0.00 O ATOM 1206 CB ALA A 74 9.402 -1.047 -35.543 1.00 0.00 C ATOM 0 H ALA A 74 10.247 -2.605 -37.254 1.00 0.00 H new ATOM 0 HA ALA A 74 9.461 0.167 -37.291 1.00 0.00 H new ATOM 0 HB1 ALA A 74 9.217 -0.201 -34.881 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.453 -1.510 -35.814 1.00 0.00 H new ATOM 0 HB3 ALA A 74 10.029 -1.778 -35.031 1.00 0.00 H new ATOM 1212 N GLN A 75 12.523 -0.542 -36.841 1.00 0.00 N ATOM 1213 CA GLN A 75 13.851 0.000 -36.607 1.00 0.00 C ATOM 1214 C GLN A 75 14.169 1.088 -37.635 1.00 0.00 C ATOM 1215 O GLN A 75 15.080 1.890 -37.434 1.00 0.00 O ATOM 1216 CB GLN A 75 14.907 -1.106 -36.636 1.00 0.00 C ATOM 1217 CG GLN A 75 16.015 -0.832 -35.617 1.00 0.00 C ATOM 1218 CD GLN A 75 15.919 -1.794 -34.430 1.00 0.00 C ATOM 1219 OE1 GLN A 75 14.737 -1.783 -33.820 1.00 0.00 O flip ATOM 1220 NE2 GLN A 75 16.856 -2.497 -34.091 1.00 0.00 N flip ATOM 0 H GLN A 75 12.509 -1.463 -37.279 1.00 0.00 H new ATOM 0 HA GLN A 75 13.869 0.449 -35.614 1.00 0.00 H new ATOM 0 HB2 GLN A 75 14.439 -2.067 -36.420 1.00 0.00 H new ATOM 0 HB3 GLN A 75 15.336 -1.178 -37.635 1.00 0.00 H new ATOM 0 HG2 GLN A 75 16.988 -0.936 -36.096 1.00 0.00 H new ATOM 0 HG3 GLN A 75 15.942 0.196 -35.263 1.00 0.00 H new ATOM 0 HE21 GLN A 75 17.736 -2.456 -34.604 1.00 0.00 H new ATOM 0 HE22 GLN A 75 16.759 -3.126 -33.294 1.00 0.00 H new ATOM 1229 N ALA A 76 13.400 1.081 -38.714 1.00 0.00 N ATOM 1230 CA ALA A 76 13.589 2.057 -39.774 1.00 0.00 C ATOM 1231 C ALA A 76 12.734 3.292 -39.481 1.00 0.00 C ATOM 1232 O ALA A 76 13.187 4.422 -39.662 1.00 0.00 O ATOM 1233 CB ALA A 76 13.249 1.419 -41.123 1.00 0.00 C ATOM 0 H ALA A 76 12.645 0.415 -38.877 1.00 0.00 H new ATOM 0 HA ALA A 76 14.630 2.379 -39.819 1.00 0.00 H new ATOM 0 HB1 ALA A 76 13.391 2.151 -41.918 1.00 0.00 H new ATOM 0 HB2 ALA A 76 13.903 0.564 -41.296 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.211 1.087 -41.117 1.00 0.00 H new ATOM 1239 N ASP A 77 11.514 3.036 -39.034 1.00 0.00 N ATOM 1240 CA ASP A 77 10.592 4.112 -38.716 1.00 0.00 C ATOM 1241 C ASP A 77 11.203 4.995 -37.626 1.00 0.00 C ATOM 1242 O ASP A 77 10.786 6.137 -37.441 1.00 0.00 O ATOM 1243 CB ASP A 77 9.264 3.562 -38.190 1.00 0.00 C ATOM 1244 CG ASP A 77 8.026 3.996 -38.979 1.00 0.00 C ATOM 1245 OD1 ASP A 77 7.947 3.516 -40.174 1.00 0.00 O ATOM 1246 OD2 ASP A 77 7.182 4.753 -38.477 1.00 0.00 O ATOM 0 H ASP A 77 11.142 2.098 -38.884 1.00 0.00 H new ATOM 0 HA ASP A 77 10.411 4.682 -39.627 1.00 0.00 H new ATOM 0 HB2 ASP A 77 9.313 2.473 -38.190 1.00 0.00 H new ATOM 0 HB3 ASP A 77 9.144 3.875 -37.153 1.00 0.00 H new ATOM 1251 N LYS A 78 12.181 4.431 -36.931 1.00 0.00 N ATOM 1252 CA LYS A 78 12.853 5.153 -35.865 1.00 0.00 C ATOM 1253 C LYS A 78 13.564 6.376 -36.451 1.00 0.00 C ATOM 1254 O LYS A 78 13.795 7.358 -35.750 1.00 0.00 O ATOM 1255 CB LYS A 78 13.781 4.217 -35.087 1.00 0.00 C ATOM 1256 CG LYS A 78 14.525 4.975 -33.986 1.00 0.00 C ATOM 1257 CD LYS A 78 15.387 4.023 -33.153 1.00 0.00 C ATOM 1258 CE LYS A 78 16.694 4.696 -32.730 1.00 0.00 C ATOM 1259 NZ LYS A 78 17.712 3.680 -32.380 1.00 0.00 N ATOM 0 H LYS A 78 12.523 3.483 -37.086 1.00 0.00 H new ATOM 0 HA LYS A 78 12.128 5.523 -35.140 1.00 0.00 H new ATOM 0 HB2 LYS A 78 13.200 3.406 -34.647 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.499 3.761 -35.769 1.00 0.00 H new ATOM 0 HG2 LYS A 78 15.154 5.746 -34.431 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.808 5.482 -33.340 1.00 0.00 H new ATOM 0 HD2 LYS A 78 14.834 3.706 -32.269 1.00 0.00 H new ATOM 0 HD3 LYS A 78 15.606 3.125 -33.731 1.00 0.00 H new ATOM 0 HE2 LYS A 78 17.064 5.326 -33.539 1.00 0.00 H new ATOM 0 HE3 LYS A 78 16.514 5.348 -31.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 18.593 4.155 -32.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 17.363 3.096 -31.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 17.896 3.075 -33.205 1.00 0.00 H new ATOM 1272 N LYS A 79 13.890 6.272 -37.731 1.00 0.00 N ATOM 1273 CA LYS A 79 14.570 7.357 -38.419 1.00 0.00 C ATOM 1274 C LYS A 79 13.530 8.335 -38.971 1.00 0.00 C ATOM 1275 O LYS A 79 13.770 9.541 -39.017 1.00 0.00 O ATOM 1276 CB LYS A 79 15.520 6.805 -39.484 1.00 0.00 C ATOM 1277 CG LYS A 79 16.919 7.406 -39.334 1.00 0.00 C ATOM 1278 CD LYS A 79 17.917 6.708 -40.260 1.00 0.00 C ATOM 1279 CE LYS A 79 18.893 7.714 -40.873 1.00 0.00 C ATOM 1280 NZ LYS A 79 18.452 8.102 -42.231 1.00 0.00 N ATOM 0 H LYS A 79 13.696 5.454 -38.309 1.00 0.00 H new ATOM 0 HA LYS A 79 15.197 7.915 -37.724 1.00 0.00 H new ATOM 0 HB2 LYS A 79 15.575 5.720 -39.400 1.00 0.00 H new ATOM 0 HB3 LYS A 79 15.129 7.028 -40.477 1.00 0.00 H new ATOM 0 HG2 LYS A 79 16.888 8.471 -39.564 1.00 0.00 H new ATOM 0 HG3 LYS A 79 17.250 7.312 -38.300 1.00 0.00 H new ATOM 0 HD2 LYS A 79 18.470 5.953 -39.701 1.00 0.00 H new ATOM 0 HD3 LYS A 79 17.380 6.187 -41.053 1.00 0.00 H new ATOM 0 HE2 LYS A 79 18.959 8.598 -40.239 1.00 0.00 H new ATOM 0 HE3 LYS A 79 19.892 7.279 -40.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 19.125 8.785 -42.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 18.412 7.258 -42.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 17.508 8.536 -42.179 1.00 0.00 H new ATOM 1293 N ARG A 80 12.397 7.780 -39.376 1.00 0.00 N ATOM 1294 CA ARG A 80 11.321 8.588 -39.923 1.00 0.00 C ATOM 1295 C ARG A 80 10.731 9.490 -38.838 1.00 0.00 C ATOM 1296 O ARG A 80 10.426 10.654 -39.091 1.00 0.00 O ATOM 1297 CB ARG A 80 10.212 7.708 -40.503 1.00 0.00 C ATOM 1298 CG ARG A 80 10.720 6.904 -41.701 1.00 0.00 C ATOM 1299 CD ARG A 80 9.787 7.063 -42.904 1.00 0.00 C ATOM 1300 NE ARG A 80 9.996 8.385 -43.536 1.00 0.00 N ATOM 1301 CZ ARG A 80 9.395 8.782 -44.677 1.00 0.00 C ATOM 1302 NH1 ARG A 80 8.540 7.960 -45.323 1.00 0.00 N ATOM 1303 NH2 ARG A 80 9.655 9.985 -45.153 1.00 0.00 N ATOM 0 H ARG A 80 12.201 6.780 -39.336 1.00 0.00 H new ATOM 0 HA ARG A 80 11.739 9.200 -40.722 1.00 0.00 H new ATOM 0 HB2 ARG A 80 9.843 7.029 -39.735 1.00 0.00 H new ATOM 0 HB3 ARG A 80 9.371 8.331 -40.809 1.00 0.00 H new ATOM 0 HG2 ARG A 80 11.723 7.237 -41.968 1.00 0.00 H new ATOM 0 HG3 ARG A 80 10.795 5.851 -41.431 1.00 0.00 H new ATOM 0 HD2 ARG A 80 9.976 6.271 -43.628 1.00 0.00 H new ATOM 0 HD3 ARG A 80 8.749 6.963 -42.586 1.00 0.00 H new ATOM 0 HE ARG A 80 10.635 9.037 -43.080 1.00 0.00 H new ATOM 0 HH11 ARG A 80 8.344 7.031 -44.949 1.00 0.00 H new ATOM 0 HH12 ARG A 80 8.090 8.268 -46.185 1.00 0.00 H new ATOM 0 HH21 ARG A 80 10.302 10.600 -44.660 1.00 0.00 H new ATOM 0 HH22 ARG A 80 9.209 10.300 -46.014 1.00 0.00 H new ATOM 1317 N TYR A 81 10.588 8.919 -37.650 1.00 0.00 N ATOM 1318 CA TYR A 81 10.041 9.658 -36.525 1.00 0.00 C ATOM 1319 C TYR A 81 10.884 10.897 -36.220 1.00 0.00 C ATOM 1320 O TYR A 81 10.445 11.789 -35.496 1.00 0.00 O ATOM 1321 CB TYR A 81 10.099 8.707 -35.328 1.00 0.00 C ATOM 1322 CG TYR A 81 10.086 9.414 -33.971 1.00 0.00 C ATOM 1323 CD1 TYR A 81 8.902 9.902 -33.459 1.00 0.00 C ATOM 1324 CD2 TYR A 81 11.259 9.564 -33.260 1.00 0.00 C ATOM 1325 CE1 TYR A 81 8.889 10.567 -32.181 1.00 0.00 C ATOM 1326 CE2 TYR A 81 11.247 10.230 -31.983 1.00 0.00 C ATOM 1327 CZ TYR A 81 10.063 10.699 -31.507 1.00 0.00 C ATOM 1328 OH TYR A 81 10.051 11.327 -30.301 1.00 0.00 O ATOM 0 H TYR A 81 10.842 7.953 -37.443 1.00 0.00 H new ATOM 0 HA TYR A 81 9.027 9.994 -36.743 1.00 0.00 H new ATOM 0 HB2 TYR A 81 9.251 8.024 -35.378 1.00 0.00 H new ATOM 0 HB3 TYR A 81 11.002 8.101 -35.402 1.00 0.00 H new ATOM 0 HD1 TYR A 81 7.984 9.786 -34.016 1.00 0.00 H new ATOM 0 HD2 TYR A 81 12.186 9.182 -33.661 1.00 0.00 H new ATOM 0 HE1 TYR A 81 7.968 10.952 -31.768 1.00 0.00 H new ATOM 0 HE2 TYR A 81 12.158 10.354 -31.416 1.00 0.00 H new ATOM 0 HH TYR A 81 10.959 11.348 -29.934 1.00 0.00 H new ATOM 1338 N GLU A 82 12.082 10.913 -36.787 1.00 0.00 N ATOM 1339 CA GLU A 82 12.991 12.028 -36.584 1.00 0.00 C ATOM 1340 C GLU A 82 12.655 13.169 -37.547 1.00 0.00 C ATOM 1341 O GLU A 82 13.037 14.315 -37.315 1.00 0.00 O ATOM 1342 CB GLU A 82 14.446 11.585 -36.747 1.00 0.00 C ATOM 1343 CG GLU A 82 14.782 10.442 -35.785 1.00 0.00 C ATOM 1344 CD GLU A 82 16.185 10.614 -35.200 1.00 0.00 C ATOM 1345 OE1 GLU A 82 17.068 11.180 -35.861 1.00 0.00 O ATOM 1346 OE2 GLU A 82 16.343 10.134 -34.013 1.00 0.00 O ATOM 0 H GLU A 82 12.444 10.171 -37.387 1.00 0.00 H new ATOM 0 HA GLU A 82 12.868 12.391 -35.564 1.00 0.00 H new ATOM 0 HB2 GLU A 82 14.619 11.264 -37.774 1.00 0.00 H new ATOM 0 HB3 GLU A 82 15.110 12.429 -36.561 1.00 0.00 H new ATOM 0 HG2 GLU A 82 14.049 10.413 -34.979 1.00 0.00 H new ATOM 0 HG3 GLU A 82 14.717 9.489 -36.310 1.00 0.00 H new ATOM 1353 N SER A 83 11.942 12.815 -38.607 1.00 0.00 N ATOM 1354 CA SER A 83 11.550 13.795 -39.605 1.00 0.00 C ATOM 1355 C SER A 83 10.685 14.881 -38.962 1.00 0.00 C ATOM 1356 O SER A 83 10.938 16.071 -39.146 1.00 0.00 O ATOM 1357 CB SER A 83 10.797 13.134 -40.761 1.00 0.00 C ATOM 1358 OG SER A 83 10.961 13.847 -41.984 1.00 0.00 O ATOM 0 H SER A 83 11.626 11.864 -38.796 1.00 0.00 H new ATOM 0 HA SER A 83 12.454 14.251 -40.009 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.153 12.111 -40.887 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.737 13.075 -40.516 1.00 0.00 H new ATOM 0 HG SER A 83 10.466 13.392 -42.697 1.00 0.00 H new ATOM 1364 N GLU A 84 9.684 14.432 -38.219 1.00 0.00 N ATOM 1365 CA GLU A 84 8.781 15.351 -37.547 1.00 0.00 C ATOM 1366 C GLU A 84 9.445 15.929 -36.296 1.00 0.00 C ATOM 1367 O GLU A 84 8.981 16.928 -35.748 1.00 0.00 O ATOM 1368 CB GLU A 84 7.459 14.664 -37.198 1.00 0.00 C ATOM 1369 CG GLU A 84 6.301 15.262 -37.998 1.00 0.00 C ATOM 1370 CD GLU A 84 5.966 16.671 -37.505 1.00 0.00 C ATOM 1371 OE1 GLU A 84 5.285 16.823 -36.480 1.00 0.00 O ATOM 1372 OE2 GLU A 84 6.438 17.628 -38.228 1.00 0.00 O ATOM 0 H GLU A 84 9.478 13.444 -38.068 1.00 0.00 H new ATOM 0 HA GLU A 84 8.557 16.172 -38.228 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.535 13.596 -37.404 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.261 14.769 -36.131 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.563 15.295 -39.055 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.423 14.623 -37.908 1.00 0.00 H new ATOM 1379 N LYS A 85 10.522 15.277 -35.883 1.00 0.00 N ATOM 1380 CA LYS A 85 11.255 15.715 -34.707 1.00 0.00 C ATOM 1381 C LYS A 85 12.172 16.880 -35.087 1.00 0.00 C ATOM 1382 O LYS A 85 12.472 17.734 -34.255 1.00 0.00 O ATOM 1383 CB LYS A 85 11.991 14.537 -34.066 1.00 0.00 C ATOM 1384 CG LYS A 85 12.393 14.859 -32.625 1.00 0.00 C ATOM 1385 CD LYS A 85 13.906 15.050 -32.507 1.00 0.00 C ATOM 1386 CE LYS A 85 14.361 14.939 -31.050 1.00 0.00 C ATOM 1387 NZ LYS A 85 13.446 15.692 -30.163 1.00 0.00 N ATOM 0 H LYS A 85 10.904 14.450 -36.341 1.00 0.00 H new ATOM 0 HA LYS A 85 10.568 16.085 -33.946 1.00 0.00 H new ATOM 0 HB2 LYS A 85 11.353 13.654 -34.080 1.00 0.00 H new ATOM 0 HB3 LYS A 85 12.880 14.298 -34.650 1.00 0.00 H new ATOM 0 HG2 LYS A 85 11.882 15.763 -32.295 1.00 0.00 H new ATOM 0 HG3 LYS A 85 12.072 14.053 -31.965 1.00 0.00 H new ATOM 0 HD2 LYS A 85 14.419 14.301 -33.110 1.00 0.00 H new ATOM 0 HD3 LYS A 85 14.185 16.025 -32.906 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.388 13.891 -30.750 1.00 0.00 H new ATOM 0 HE3 LYS A 85 15.375 15.326 -30.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 13.900 15.838 -29.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.228 16.614 -30.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 12.566 15.154 -30.035 1.00 0.00 H new ATOM 1400 N GLU A 86 12.589 16.877 -36.344 1.00 0.00 N ATOM 1401 CA GLU A 86 13.465 17.922 -36.844 1.00 0.00 C ATOM 1402 C GLU A 86 12.777 19.286 -36.740 1.00 0.00 C ATOM 1403 O GLU A 86 13.350 20.235 -36.206 1.00 0.00 O ATOM 1404 CB GLU A 86 13.897 17.635 -38.283 1.00 0.00 C ATOM 1405 CG GLU A 86 15.060 16.641 -38.318 1.00 0.00 C ATOM 1406 CD GLU A 86 15.323 16.155 -39.745 1.00 0.00 C ATOM 1407 OE1 GLU A 86 15.980 16.979 -40.489 1.00 0.00 O ATOM 1408 OE2 GLU A 86 14.912 15.042 -40.107 1.00 0.00 O ATOM 0 H GLU A 86 12.336 16.167 -37.031 1.00 0.00 H new ATOM 0 HA GLU A 86 14.364 17.941 -36.227 1.00 0.00 H new ATOM 0 HB2 GLU A 86 13.054 17.234 -38.847 1.00 0.00 H new ATOM 0 HB3 GLU A 86 14.193 18.564 -38.770 1.00 0.00 H new ATOM 0 HG2 GLU A 86 15.958 17.112 -37.919 1.00 0.00 H new ATOM 0 HG3 GLU A 86 14.835 15.790 -37.676 1.00 0.00 H new ATOM 1415 N LEU A 87 11.559 19.339 -37.259 1.00 0.00 N ATOM 1416 CA LEU A 87 10.788 20.570 -37.231 1.00 0.00 C ATOM 1417 C LEU A 87 10.533 20.974 -35.778 1.00 0.00 C ATOM 1418 O LEU A 87 10.714 22.135 -35.412 1.00 0.00 O ATOM 1419 CB LEU A 87 9.511 20.420 -38.060 1.00 0.00 C ATOM 1420 CG LEU A 87 9.481 21.177 -39.389 1.00 0.00 C ATOM 1421 CD1 LEU A 87 9.724 20.231 -40.566 1.00 0.00 C ATOM 1422 CD2 LEU A 87 8.176 21.961 -39.545 1.00 0.00 C ATOM 0 H LEU A 87 11.088 18.550 -37.701 1.00 0.00 H new ATOM 0 HA LEU A 87 11.349 21.382 -37.694 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.357 19.361 -38.265 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.668 20.754 -37.455 1.00 0.00 H new ATOM 0 HG LEU A 87 10.295 21.902 -39.386 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.697 20.796 -41.498 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.699 19.757 -40.457 1.00 0.00 H new ATOM 0 HD13 LEU A 87 8.949 19.465 -40.583 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.181 22.490 -40.498 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.332 21.272 -39.517 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.084 22.681 -38.731 1.00 0.00 H new ATOM 1434 N TYR A 88 10.117 19.995 -34.989 1.00 0.00 N ATOM 1435 CA TYR A 88 9.836 20.235 -33.583 1.00 0.00 C ATOM 1436 C TYR A 88 11.064 20.802 -32.867 1.00 0.00 C ATOM 1437 O TYR A 88 10.988 21.859 -32.241 1.00 0.00 O ATOM 1438 CB TYR A 88 9.497 18.869 -32.982 1.00 0.00 C ATOM 1439 CG TYR A 88 8.897 18.940 -31.577 1.00 0.00 C ATOM 1440 CD1 TYR A 88 8.020 19.955 -31.251 1.00 0.00 C ATOM 1441 CD2 TYR A 88 9.231 17.989 -30.635 1.00 0.00 C ATOM 1442 CE1 TYR A 88 7.455 20.022 -29.928 1.00 0.00 C ATOM 1443 CE2 TYR A 88 8.667 18.055 -29.311 1.00 0.00 C ATOM 1444 CZ TYR A 88 7.806 19.068 -29.023 1.00 0.00 C ATOM 1445 OH TYR A 88 7.272 19.131 -27.774 1.00 0.00 O ATOM 0 H TYR A 88 9.968 19.034 -35.296 1.00 0.00 H new ATOM 0 HA TYR A 88 9.025 20.955 -33.471 1.00 0.00 H new ATOM 0 HB2 TYR A 88 8.795 18.358 -33.641 1.00 0.00 H new ATOM 0 HB3 TYR A 88 10.402 18.263 -32.949 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.757 20.699 -31.988 1.00 0.00 H new ATOM 0 HD2 TYR A 88 9.916 17.194 -30.890 1.00 0.00 H new ATOM 0 HE1 TYR A 88 6.768 20.811 -29.660 1.00 0.00 H new ATOM 0 HE2 TYR A 88 8.922 17.317 -28.564 1.00 0.00 H new ATOM 0 HH TYR A 88 7.611 18.386 -27.235 1.00 0.00 H new ATOM 1455 N ASN A 89 12.166 20.076 -32.985 1.00 0.00 N ATOM 1456 CA ASN A 89 13.408 20.494 -32.356 1.00 0.00 C ATOM 1457 C ASN A 89 13.869 21.814 -32.978 1.00 0.00 C ATOM 1458 O ASN A 89 14.468 22.648 -32.300 1.00 0.00 O ATOM 1459 CB ASN A 89 14.511 19.457 -32.574 1.00 0.00 C ATOM 1460 CG ASN A 89 15.888 20.047 -32.260 1.00 0.00 C ATOM 1461 OD1 ASN A 89 16.411 20.756 -33.255 1.00 0.00 O flip ATOM 1462 ND2 ASN A 89 16.437 19.869 -31.185 1.00 0.00 N flip ATOM 0 H ASN A 89 12.225 19.201 -33.506 1.00 0.00 H new ATOM 0 HA ASN A 89 13.225 20.606 -31.287 1.00 0.00 H new ATOM 0 HB2 ASN A 89 14.330 18.589 -31.940 1.00 0.00 H new ATOM 0 HB3 ASN A 89 14.488 19.108 -33.606 1.00 0.00 H new ATOM 0 HD21 ASN A 89 15.978 19.313 -30.464 1.00 0.00 H new ATOM 0 HD22 ASN A 89 17.355 20.276 -31.008 1.00 0.00 H new ATOM 1469 N ALA A 90 13.574 21.961 -34.261 1.00 0.00 N ATOM 1470 CA ALA A 90 13.952 23.165 -34.982 1.00 0.00 C ATOM 1471 C ALA A 90 13.162 24.353 -34.430 1.00 0.00 C ATOM 1472 O ALA A 90 13.613 25.495 -34.511 1.00 0.00 O ATOM 1473 CB ALA A 90 13.723 22.957 -36.480 1.00 0.00 C ATOM 0 H ALA A 90 13.078 21.267 -34.820 1.00 0.00 H new ATOM 0 HA ALA A 90 15.011 23.380 -34.842 1.00 0.00 H new ATOM 0 HB1 ALA A 90 14.007 23.860 -37.020 1.00 0.00 H new ATOM 0 HB2 ALA A 90 14.329 22.121 -36.828 1.00 0.00 H new ATOM 0 HB3 ALA A 90 12.670 22.742 -36.661 1.00 0.00 H new ATOM 1479 N THR A 91 11.995 24.044 -33.883 1.00 0.00 N ATOM 1480 CA THR A 91 11.138 25.072 -33.319 1.00 0.00 C ATOM 1481 C THR A 91 11.530 25.356 -31.868 1.00 0.00 C ATOM 1482 O THR A 91 11.285 26.449 -31.357 1.00 0.00 O ATOM 1483 CB THR A 91 9.686 24.617 -33.478 1.00 0.00 C ATOM 1484 OG1 THR A 91 9.189 25.412 -34.552 1.00 0.00 O ATOM 1485 CG2 THR A 91 8.813 25.013 -32.285 1.00 0.00 C ATOM 0 H THR A 91 11.623 23.096 -33.819 1.00 0.00 H new ATOM 0 HA THR A 91 11.257 26.019 -33.846 1.00 0.00 H new ATOM 0 HB THR A 91 9.657 23.535 -33.604 1.00 0.00 H new ATOM 0 HG1 THR A 91 8.252 25.181 -34.724 1.00 0.00 H new ATOM 0 HG21 THR A 91 7.793 24.666 -32.450 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.209 24.558 -31.377 1.00 0.00 H new ATOM 0 HG23 THR A 91 8.814 26.098 -32.177 1.00 0.00 H new ATOM 1493 N LEU A 92 12.131 24.355 -31.244 1.00 0.00 N ATOM 1494 CA LEU A 92 12.559 24.482 -29.862 1.00 0.00 C ATOM 1495 C LEU A 92 13.570 25.626 -29.749 1.00 0.00 C ATOM 1496 O LEU A 92 13.364 26.568 -28.985 1.00 0.00 O ATOM 1497 CB LEU A 92 13.084 23.144 -29.336 1.00 0.00 C ATOM 1498 CG LEU A 92 12.223 22.457 -28.275 1.00 0.00 C ATOM 1499 CD1 LEU A 92 11.212 21.505 -28.920 1.00 0.00 C ATOM 1500 CD2 LEU A 92 13.094 21.748 -27.237 1.00 0.00 C ATOM 0 H LEU A 92 12.332 23.451 -31.671 1.00 0.00 H new ATOM 0 HA LEU A 92 11.713 24.738 -29.224 1.00 0.00 H new ATOM 0 HB2 LEU A 92 13.197 22.464 -30.180 1.00 0.00 H new ATOM 0 HB3 LEU A 92 14.079 23.305 -28.920 1.00 0.00 H new ATOM 0 HG LEU A 92 11.654 23.224 -27.749 1.00 0.00 H new ATOM 0 HD11 LEU A 92 10.613 21.030 -28.143 1.00 0.00 H new ATOM 0 HD12 LEU A 92 10.560 22.066 -29.589 1.00 0.00 H new ATOM 0 HD13 LEU A 92 11.743 20.740 -29.487 1.00 0.00 H new ATOM 0 HD21 LEU A 92 12.457 21.268 -26.494 1.00 0.00 H new ATOM 0 HD22 LEU A 92 13.707 20.994 -27.731 1.00 0.00 H new ATOM 0 HD23 LEU A 92 13.739 22.476 -26.745 1.00 0.00 H new ATOM 1512 N ALA A 93 14.640 25.506 -30.521 1.00 0.00 N ATOM 1513 CA ALA A 93 15.683 26.517 -30.517 1.00 0.00 C ATOM 1514 C ALA A 93 15.960 26.952 -29.076 1.00 0.00 C ATOM 1515 O ALA A 93 15.361 27.908 -28.586 1.00 0.00 O ATOM 1516 CB ALA A 93 15.262 27.687 -31.409 1.00 0.00 C ATOM 0 H ALA A 93 14.807 24.724 -31.154 1.00 0.00 H new ATOM 0 HA ALA A 93 16.611 26.114 -30.923 1.00 0.00 H new ATOM 0 HB1 ALA A 93 16.044 28.446 -31.407 1.00 0.00 H new ATOM 0 HB2 ALA A 93 15.106 27.330 -32.427 1.00 0.00 H new ATOM 0 HB3 ALA A 93 14.336 28.119 -31.030 1.00 0.00 H new TER 1522 ALA A 93