USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 828 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 31 CYS SG : rot 70:sc= -0.866 USER MOD Set 1.2: A 54 SER OG : rot -164:sc= 1.16 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot -10:sc= 0.946 USER MOD Single : A 26 SER OG : rot 61:sc= 0.24 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0066 X(o=-0.0066,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= -1.23 USER MOD Single : A 47 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-3.2!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -89:sc= 0.709 USER MOD Single : A 64 GLN : amide:sc= -1.58 K(o=-1.6,f=-3) USER MOD Single : A 69 ASN : amide:sc= -6.53! C(o=-6.5!,f=-6.7!) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.216 X(o=-0.22,f=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.611 K(o=-0.61,f=-1.8) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN :FLIP amide:sc= -0.305 F(o=-1.3,f=-0.3) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0156 USER MOD Single : A 90 SER OG : rot 180:sc= 0.00132 USER MOD Single : A 92 THR OG1 : rot -85:sc= -3.01! USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 105 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.555 -21.292 -53.893 1.00 0.00 N ATOM 2 CA GLY A 1 7.890 -21.282 -52.601 1.00 0.00 C ATOM 3 C GLY A 1 8.883 -20.987 -51.475 1.00 0.00 C ATOM 4 O GLY A 1 9.662 -21.856 -51.087 1.00 0.00 O ATOM 0 H1 GLY A 1 7.860 -21.494 -54.640 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.990 -20.363 -54.067 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.292 -22.026 -53.898 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.100 -20.531 -52.600 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.413 -22.246 -52.426 1.00 0.00 H new ATOM 8 N SER A 2 8.822 -19.759 -50.983 1.00 0.00 N ATOM 9 CA SER A 2 9.707 -19.339 -49.909 1.00 0.00 C ATOM 10 C SER A 2 9.308 -17.946 -49.418 1.00 0.00 C ATOM 11 O SER A 2 9.746 -16.939 -49.973 1.00 0.00 O ATOM 12 CB SER A 2 11.167 -19.343 -50.365 1.00 0.00 C ATOM 13 OG SER A 2 12.056 -18.978 -49.312 1.00 0.00 O ATOM 0 H SER A 2 8.174 -19.041 -51.308 1.00 0.00 H new ATOM 0 HA SER A 2 9.610 -20.049 -49.088 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.429 -20.335 -50.733 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.289 -18.651 -51.198 1.00 0.00 H new ATOM 0 HG SER A 2 12.978 -18.994 -49.642 1.00 0.00 H new ATOM 19 N SER A 3 8.483 -17.932 -48.382 1.00 0.00 N ATOM 20 CA SER A 3 8.020 -16.679 -47.809 1.00 0.00 C ATOM 21 C SER A 3 7.076 -16.956 -46.638 1.00 0.00 C ATOM 22 O SER A 3 6.429 -18.001 -46.591 1.00 0.00 O ATOM 23 CB SER A 3 7.321 -15.818 -48.863 1.00 0.00 C ATOM 24 OG SER A 3 6.278 -16.527 -49.526 1.00 0.00 O ATOM 0 H SER A 3 8.123 -18.769 -47.924 1.00 0.00 H new ATOM 0 HA SER A 3 8.887 -16.128 -47.445 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.909 -14.927 -48.388 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.052 -15.479 -49.597 1.00 0.00 H new ATOM 0 HG SER A 3 5.856 -15.943 -50.190 1.00 0.00 H new ATOM 30 N GLY A 4 7.028 -16.002 -45.720 1.00 0.00 N ATOM 31 CA GLY A 4 6.174 -16.129 -44.551 1.00 0.00 C ATOM 32 C GLY A 4 6.646 -15.208 -43.424 1.00 0.00 C ATOM 33 O GLY A 4 7.591 -15.532 -42.707 1.00 0.00 O ATOM 0 H GLY A 4 7.567 -15.137 -45.762 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.146 -15.884 -44.819 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.176 -17.163 -44.205 1.00 0.00 H new ATOM 37 N SER A 5 5.965 -14.078 -43.303 1.00 0.00 N ATOM 38 CA SER A 5 6.303 -13.107 -42.276 1.00 0.00 C ATOM 39 C SER A 5 5.371 -11.898 -42.372 1.00 0.00 C ATOM 40 O SER A 5 5.735 -10.873 -42.946 1.00 0.00 O ATOM 41 CB SER A 5 7.762 -12.664 -42.395 1.00 0.00 C ATOM 42 OG SER A 5 8.386 -12.533 -41.121 1.00 0.00 O ATOM 0 H SER A 5 5.181 -13.813 -43.899 1.00 0.00 H new ATOM 0 HA SER A 5 6.174 -13.580 -41.303 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.313 -13.388 -42.996 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.810 -11.711 -42.922 1.00 0.00 H new ATOM 0 HG SER A 5 9.317 -12.250 -41.240 1.00 0.00 H new ATOM 48 N SER A 6 4.185 -12.057 -41.801 1.00 0.00 N ATOM 49 CA SER A 6 3.198 -10.991 -41.816 1.00 0.00 C ATOM 50 C SER A 6 3.033 -10.413 -40.409 1.00 0.00 C ATOM 51 O SER A 6 2.666 -9.249 -40.252 1.00 0.00 O ATOM 52 CB SER A 6 1.854 -11.493 -42.345 1.00 0.00 C ATOM 53 OG SER A 6 1.278 -10.587 -43.283 1.00 0.00 O ATOM 0 H SER A 6 3.886 -12.908 -41.325 1.00 0.00 H new ATOM 0 HA SER A 6 3.550 -10.206 -42.486 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.991 -12.466 -42.817 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.167 -11.637 -41.511 1.00 0.00 H new ATOM 0 HG SER A 6 0.422 -10.944 -43.599 1.00 0.00 H new ATOM 59 N GLY A 7 3.310 -11.252 -39.422 1.00 0.00 N ATOM 60 CA GLY A 7 3.196 -10.839 -38.034 1.00 0.00 C ATOM 61 C GLY A 7 1.734 -10.828 -37.583 1.00 0.00 C ATOM 62 O GLY A 7 0.852 -10.415 -38.335 1.00 0.00 O ATOM 0 H GLY A 7 3.613 -12.217 -39.556 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.770 -11.516 -37.401 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.626 -9.845 -37.910 1.00 0.00 H new ATOM 66 N SER A 8 1.522 -11.286 -36.358 1.00 0.00 N ATOM 67 CA SER A 8 0.182 -11.334 -35.798 1.00 0.00 C ATOM 68 C SER A 8 0.015 -10.236 -34.747 1.00 0.00 C ATOM 69 O SER A 8 0.706 -10.235 -33.729 1.00 0.00 O ATOM 70 CB SER A 8 -0.110 -12.705 -35.185 1.00 0.00 C ATOM 71 OG SER A 8 -0.855 -13.538 -36.070 1.00 0.00 O ATOM 0 H SER A 8 2.256 -11.627 -35.737 1.00 0.00 H new ATOM 0 HA SER A 8 -0.532 -11.168 -36.605 1.00 0.00 H new ATOM 0 HB2 SER A 8 0.829 -13.196 -34.930 1.00 0.00 H new ATOM 0 HB3 SER A 8 -0.665 -12.576 -34.256 1.00 0.00 H new ATOM 0 HG SER A 8 -1.020 -14.405 -35.643 1.00 0.00 H new ATOM 77 N PRO A 9 -0.931 -9.302 -35.036 1.00 0.00 N ATOM 78 CA PRO A 9 -1.198 -8.201 -34.126 1.00 0.00 C ATOM 79 C PRO A 9 -1.990 -8.676 -32.907 1.00 0.00 C ATOM 80 O PRO A 9 -2.716 -9.667 -32.981 1.00 0.00 O ATOM 81 CB PRO A 9 -1.950 -7.176 -34.960 1.00 0.00 C ATOM 82 CG PRO A 9 -2.482 -7.930 -36.168 1.00 0.00 C ATOM 83 CD PRO A 9 -1.769 -9.271 -36.231 1.00 0.00 C ATOM 0 HA PRO A 9 -0.288 -7.768 -33.711 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -2.764 -6.729 -34.389 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -1.292 -6.363 -35.266 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -3.559 -8.074 -36.084 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -2.306 -7.361 -37.081 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -2.480 -10.097 -36.238 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -1.170 -9.359 -37.137 1.00 0.00 H new ATOM 91 N GLY A 10 -1.824 -7.948 -31.812 1.00 0.00 N ATOM 92 CA GLY A 10 -2.515 -8.283 -30.579 1.00 0.00 C ATOM 93 C GLY A 10 -2.317 -7.191 -29.526 1.00 0.00 C ATOM 94 O GLY A 10 -1.319 -6.472 -29.551 1.00 0.00 O ATOM 0 H GLY A 10 -1.221 -7.127 -31.754 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.579 -8.413 -30.778 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.144 -9.234 -30.197 1.00 0.00 H new ATOM 98 N ASN A 11 -3.284 -7.100 -28.625 1.00 0.00 N ATOM 99 CA ASN A 11 -3.229 -6.107 -27.565 1.00 0.00 C ATOM 100 C ASN A 11 -4.177 -6.518 -26.437 1.00 0.00 C ATOM 101 O ASN A 11 -5.396 -6.453 -26.591 1.00 0.00 O ATOM 102 CB ASN A 11 -3.668 -4.733 -28.075 1.00 0.00 C ATOM 103 CG ASN A 11 -2.954 -3.613 -27.315 1.00 0.00 C ATOM 104 OD1 ASN A 11 -3.367 -3.191 -26.247 1.00 0.00 O ATOM 105 ND2 ASN A 11 -1.864 -3.156 -27.924 1.00 0.00 N ATOM 0 H ASN A 11 -4.110 -7.698 -28.607 1.00 0.00 H new ATOM 0 HA ASN A 11 -2.200 -6.048 -27.211 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -3.452 -4.650 -29.140 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -4.747 -4.626 -27.960 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -1.318 -2.407 -27.498 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -1.574 -3.554 -28.817 1.00 0.00 H new ATOM 112 N ARG A 12 -3.581 -6.932 -25.328 1.00 0.00 N ATOM 113 CA ARG A 12 -4.358 -7.354 -24.175 1.00 0.00 C ATOM 114 C ARG A 12 -4.042 -6.466 -22.969 1.00 0.00 C ATOM 115 O ARG A 12 -2.901 -6.416 -22.513 1.00 0.00 O ATOM 116 CB ARG A 12 -4.064 -8.812 -23.816 1.00 0.00 C ATOM 117 CG ARG A 12 -5.332 -9.664 -23.899 1.00 0.00 C ATOM 118 CD ARG A 12 -5.276 -10.618 -25.093 1.00 0.00 C ATOM 119 NE ARG A 12 -4.972 -11.990 -24.631 1.00 0.00 N ATOM 120 CZ ARG A 12 -4.695 -13.014 -25.450 1.00 0.00 C ATOM 121 NH1 ARG A 12 -4.683 -12.827 -26.777 1.00 0.00 N ATOM 122 NH2 ARG A 12 -4.430 -14.226 -24.942 1.00 0.00 N ATOM 0 H ARG A 12 -2.570 -6.984 -25.204 1.00 0.00 H new ATOM 0 HA ARG A 12 -5.413 -7.261 -24.434 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -3.308 -9.211 -24.492 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -3.651 -8.866 -22.809 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.451 -10.235 -22.978 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -6.204 -9.016 -23.987 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.228 -10.607 -25.623 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -4.515 -10.286 -25.799 1.00 0.00 H new ATOM 0 HE ARG A 12 -4.973 -12.168 -23.627 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -4.885 -11.905 -27.164 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -4.472 -13.607 -27.400 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -4.439 -14.369 -23.932 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -4.219 -15.005 -25.565 1.00 0.00 H new ATOM 136 N GLU A 13 -5.073 -5.788 -22.488 1.00 0.00 N ATOM 137 CA GLU A 13 -4.920 -4.905 -21.344 1.00 0.00 C ATOM 138 C GLU A 13 -6.291 -4.525 -20.780 1.00 0.00 C ATOM 139 O GLU A 13 -7.172 -4.090 -21.521 1.00 0.00 O ATOM 140 CB GLU A 13 -4.116 -3.659 -21.718 1.00 0.00 C ATOM 141 CG GLU A 13 -3.356 -3.113 -20.507 1.00 0.00 C ATOM 142 CD GLU A 13 -2.078 -2.393 -20.941 1.00 0.00 C ATOM 143 OE1 GLU A 13 -2.151 -1.672 -21.960 1.00 0.00 O ATOM 144 OE2 GLU A 13 -1.057 -2.579 -20.244 1.00 0.00 O ATOM 0 H GLU A 13 -6.018 -5.832 -22.869 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.365 -5.436 -20.570 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.412 -3.901 -22.514 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -4.786 -2.893 -22.107 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.994 -2.426 -19.952 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.105 -3.931 -19.831 1.00 0.00 H new ATOM 151 N ASN A 14 -6.428 -4.702 -19.475 1.00 0.00 N ATOM 152 CA ASN A 14 -7.677 -4.383 -18.803 1.00 0.00 C ATOM 153 C ASN A 14 -7.457 -4.407 -17.289 1.00 0.00 C ATOM 154 O ASN A 14 -7.637 -3.393 -16.616 1.00 0.00 O ATOM 155 CB ASN A 14 -8.761 -5.408 -19.140 1.00 0.00 C ATOM 156 CG ASN A 14 -10.136 -4.743 -19.232 1.00 0.00 C ATOM 157 OD1 ASN A 14 -10.425 -3.762 -18.567 1.00 0.00 O ATOM 158 ND2 ASN A 14 -10.963 -5.328 -20.093 1.00 0.00 N ATOM 0 H ASN A 14 -5.695 -5.062 -18.864 1.00 0.00 H new ATOM 0 HA ASN A 14 -7.998 -3.396 -19.137 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.525 -5.895 -20.086 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.780 -6.186 -18.377 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -11.904 -4.958 -20.229 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -10.657 -6.147 -20.618 1.00 0.00 H new ATOM 165 N LYS A 15 -7.071 -5.575 -16.798 1.00 0.00 N ATOM 166 CA LYS A 15 -6.825 -5.744 -15.376 1.00 0.00 C ATOM 167 C LYS A 15 -5.394 -5.309 -15.055 1.00 0.00 C ATOM 168 O LYS A 15 -4.602 -5.052 -15.960 1.00 0.00 O ATOM 169 CB LYS A 15 -7.144 -7.177 -14.944 1.00 0.00 C ATOM 170 CG LYS A 15 -6.070 -8.150 -15.435 1.00 0.00 C ATOM 171 CD LYS A 15 -6.610 -9.043 -16.554 1.00 0.00 C ATOM 172 CE LYS A 15 -5.479 -9.523 -17.466 1.00 0.00 C ATOM 173 NZ LYS A 15 -5.683 -10.939 -17.843 1.00 0.00 N ATOM 0 H LYS A 15 -6.922 -6.414 -17.359 1.00 0.00 H new ATOM 0 HA LYS A 15 -7.490 -5.105 -14.796 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -7.215 -7.226 -13.857 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -8.116 -7.472 -15.340 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.206 -7.592 -15.795 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.727 -8.768 -14.605 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.124 -9.902 -16.123 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -7.346 -8.493 -17.140 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.439 -8.904 -18.362 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.521 -9.410 -16.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.907 -11.249 -18.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -5.698 -11.528 -16.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -6.588 -11.037 -18.347 1.00 0.00 H new ATOM 187 N GLU A 16 -5.106 -5.240 -13.764 1.00 0.00 N ATOM 188 CA GLU A 16 -3.784 -4.840 -13.312 1.00 0.00 C ATOM 189 C GLU A 16 -3.495 -3.397 -13.728 1.00 0.00 C ATOM 190 O GLU A 16 -3.278 -3.118 -14.906 1.00 0.00 O ATOM 191 CB GLU A 16 -2.711 -5.790 -13.848 1.00 0.00 C ATOM 192 CG GLU A 16 -2.472 -6.950 -12.879 1.00 0.00 C ATOM 193 CD GLU A 16 -1.421 -7.917 -13.430 1.00 0.00 C ATOM 194 OE1 GLU A 16 -1.641 -8.413 -14.556 1.00 0.00 O ATOM 195 OE2 GLU A 16 -0.422 -8.137 -12.712 1.00 0.00 O ATOM 0 H GLU A 16 -5.766 -5.454 -13.016 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.761 -4.895 -12.224 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.017 -6.180 -14.819 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.781 -5.243 -14.003 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.144 -6.562 -11.915 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.407 -7.483 -12.707 1.00 0.00 H new ATOM 202 N LYS A 17 -3.501 -2.517 -12.737 1.00 0.00 N ATOM 203 CA LYS A 17 -3.243 -1.109 -12.985 1.00 0.00 C ATOM 204 C LYS A 17 -2.114 -0.633 -12.068 1.00 0.00 C ATOM 205 O LYS A 17 -2.036 -1.041 -10.911 1.00 0.00 O ATOM 206 CB LYS A 17 -4.531 -0.295 -12.848 1.00 0.00 C ATOM 207 CG LYS A 17 -4.971 -0.208 -11.385 1.00 0.00 C ATOM 208 CD LYS A 17 -5.690 1.114 -11.106 1.00 0.00 C ATOM 209 CE LYS A 17 -7.110 0.868 -10.592 1.00 0.00 C ATOM 210 NZ LYS A 17 -8.081 1.702 -11.334 1.00 0.00 N ATOM 0 H LYS A 17 -3.681 -2.752 -11.761 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.907 -0.959 -14.011 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.376 0.708 -13.245 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.321 -0.754 -13.442 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.632 -1.042 -11.150 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.101 -0.297 -10.734 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.128 1.690 -10.371 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -5.728 1.711 -12.017 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.366 -0.186 -10.704 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.163 1.098 -9.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.040 1.523 -10.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.845 2.707 -11.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.042 1.463 -12.345 1.00 0.00 H new ATOM 224 N LYS A 18 -1.268 0.224 -12.621 1.00 0.00 N ATOM 225 CA LYS A 18 -0.147 0.760 -11.867 1.00 0.00 C ATOM 226 C LYS A 18 -0.561 2.081 -11.216 1.00 0.00 C ATOM 227 O LYS A 18 -1.031 2.992 -11.895 1.00 0.00 O ATOM 228 CB LYS A 18 1.092 0.875 -12.759 1.00 0.00 C ATOM 229 CG LYS A 18 2.301 1.360 -11.956 1.00 0.00 C ATOM 230 CD LYS A 18 2.762 2.737 -12.437 1.00 0.00 C ATOM 231 CE LYS A 18 3.806 2.609 -13.548 1.00 0.00 C ATOM 232 NZ LYS A 18 3.822 3.827 -14.388 1.00 0.00 N ATOM 0 H LYS A 18 -1.336 0.560 -13.582 1.00 0.00 H new ATOM 0 HA LYS A 18 0.130 0.081 -11.061 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.313 -0.094 -13.207 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.893 1.567 -13.577 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.044 1.408 -10.898 1.00 0.00 H new ATOM 0 HG3 LYS A 18 3.118 0.645 -12.054 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.906 3.304 -12.802 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.182 3.296 -11.601 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.792 2.448 -13.112 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.584 1.738 -14.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.536 3.723 -15.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 2.886 3.964 -14.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.056 4.652 -13.799 1.00 0.00 H new ATOM 246 N VAL A 19 -0.371 2.143 -9.906 1.00 0.00 N ATOM 247 CA VAL A 19 -0.719 3.337 -9.155 1.00 0.00 C ATOM 248 C VAL A 19 0.472 3.755 -8.290 1.00 0.00 C ATOM 249 O VAL A 19 0.944 2.979 -7.461 1.00 0.00 O ATOM 250 CB VAL A 19 -1.992 3.091 -8.342 1.00 0.00 C ATOM 251 CG1 VAL A 19 -3.237 3.213 -9.223 1.00 0.00 C ATOM 252 CG2 VAL A 19 -1.944 1.730 -7.646 1.00 0.00 C ATOM 0 H VAL A 19 0.020 1.385 -9.346 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.936 4.164 -9.831 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.051 3.859 -7.571 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -4.128 3.034 -8.621 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.284 4.215 -9.650 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.188 2.478 -10.026 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.861 1.581 -7.075 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.849 0.942 -8.393 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -1.088 1.696 -6.973 1.00 0.00 H new ATOM 262 N PHE A 20 0.923 4.981 -8.513 1.00 0.00 N ATOM 263 CA PHE A 20 2.049 5.511 -7.764 1.00 0.00 C ATOM 264 C PHE A 20 1.575 6.444 -6.647 1.00 0.00 C ATOM 265 O PHE A 20 0.990 7.492 -6.916 1.00 0.00 O ATOM 266 CB PHE A 20 2.906 6.309 -8.749 1.00 0.00 C ATOM 267 CG PHE A 20 4.409 6.064 -8.606 1.00 0.00 C ATOM 268 CD1 PHE A 20 4.993 6.115 -7.379 1.00 0.00 C ATOM 269 CD2 PHE A 20 5.162 5.798 -9.707 1.00 0.00 C ATOM 270 CE1 PHE A 20 6.388 5.888 -7.246 1.00 0.00 C ATOM 271 CE2 PHE A 20 6.558 5.571 -9.574 1.00 0.00 C ATOM 272 CZ PHE A 20 7.141 5.621 -8.347 1.00 0.00 C ATOM 0 H PHE A 20 0.529 5.622 -9.202 1.00 0.00 H new ATOM 0 HA PHE A 20 2.608 4.695 -7.306 1.00 0.00 H new ATOM 0 HB2 PHE A 20 2.602 6.058 -9.765 1.00 0.00 H new ATOM 0 HB3 PHE A 20 2.707 7.372 -8.610 1.00 0.00 H new ATOM 0 HD1 PHE A 20 4.395 6.328 -6.505 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.699 5.759 -10.682 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.851 5.927 -6.271 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.156 5.359 -10.448 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.202 5.449 -8.246 1.00 0.00 H new ATOM 282 N ILE A 21 1.845 6.029 -5.419 1.00 0.00 N ATOM 283 CA ILE A 21 1.454 6.814 -4.260 1.00 0.00 C ATOM 284 C ILE A 21 2.648 7.642 -3.784 1.00 0.00 C ATOM 285 O ILE A 21 3.676 7.090 -3.394 1.00 0.00 O ATOM 286 CB ILE A 21 0.860 5.911 -3.177 1.00 0.00 C ATOM 287 CG1 ILE A 21 -0.449 5.275 -3.650 1.00 0.00 C ATOM 288 CG2 ILE A 21 0.684 6.675 -1.863 1.00 0.00 C ATOM 289 CD1 ILE A 21 -1.533 6.335 -3.852 1.00 0.00 C ATOM 0 H ILE A 21 2.330 5.159 -5.201 1.00 0.00 H new ATOM 0 HA ILE A 21 0.664 7.517 -4.525 1.00 0.00 H new ATOM 0 HB ILE A 21 1.562 5.099 -2.986 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.280 4.740 -4.584 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -0.786 4.541 -2.918 1.00 0.00 H new ATOM 0 HG21 ILE A 21 0.260 6.011 -1.110 1.00 0.00 H new ATOM 0 HG22 ILE A 21 1.653 7.040 -1.522 1.00 0.00 H new ATOM 0 HG23 ILE A 21 0.013 7.520 -2.020 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -2.452 5.856 -4.188 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -1.717 6.852 -2.910 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.204 7.054 -4.602 1.00 0.00 H new ATOM 301 N SER A 22 2.474 8.955 -3.830 1.00 0.00 N ATOM 302 CA SER A 22 3.525 9.865 -3.408 1.00 0.00 C ATOM 303 C SER A 22 3.096 10.608 -2.141 1.00 0.00 C ATOM 304 O SER A 22 2.279 11.526 -2.202 1.00 0.00 O ATOM 305 CB SER A 22 3.869 10.862 -4.517 1.00 0.00 C ATOM 306 OG SER A 22 2.947 11.947 -4.564 1.00 0.00 O ATOM 0 H SER A 22 1.620 9.410 -4.153 1.00 0.00 H new ATOM 0 HA SER A 22 4.419 9.279 -3.193 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.876 11.248 -4.358 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.873 10.348 -5.478 1.00 0.00 H new ATOM 0 HG SER A 22 2.188 11.757 -3.974 1.00 0.00 H new ATOM 312 N LEU A 23 3.665 10.183 -1.023 1.00 0.00 N ATOM 313 CA LEU A 23 3.352 10.797 0.257 1.00 0.00 C ATOM 314 C LEU A 23 4.129 12.108 0.392 1.00 0.00 C ATOM 315 O LEU A 23 5.145 12.163 1.082 1.00 0.00 O ATOM 316 CB LEU A 23 3.605 9.811 1.399 1.00 0.00 C ATOM 317 CG LEU A 23 2.610 8.655 1.520 1.00 0.00 C ATOM 318 CD1 LEU A 23 3.171 7.380 0.887 1.00 0.00 C ATOM 319 CD2 LEU A 23 2.196 8.438 2.977 1.00 0.00 C ATOM 0 H LEU A 23 4.341 9.421 -0.976 1.00 0.00 H new ATOM 0 HA LEU A 23 2.293 11.047 0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.604 9.393 1.277 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.604 10.365 2.338 1.00 0.00 H new ATOM 0 HG LEU A 23 1.710 8.920 0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.444 6.574 0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.374 7.557 -0.169 1.00 0.00 H new ATOM 0 HD13 LEU A 23 4.095 7.099 1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.489 7.611 3.035 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.077 8.204 3.575 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.727 9.344 3.361 1.00 0.00 H new ATOM 331 N VAL A 24 3.620 13.132 -0.277 1.00 0.00 N ATOM 332 CA VAL A 24 4.253 14.439 -0.240 1.00 0.00 C ATOM 333 C VAL A 24 3.213 15.495 0.139 1.00 0.00 C ATOM 334 O VAL A 24 2.014 15.283 -0.042 1.00 0.00 O ATOM 335 CB VAL A 24 4.937 14.728 -1.578 1.00 0.00 C ATOM 336 CG1 VAL A 24 5.664 13.487 -2.101 1.00 0.00 C ATOM 337 CG2 VAL A 24 3.931 15.248 -2.607 1.00 0.00 C ATOM 0 H VAL A 24 2.776 13.083 -0.848 1.00 0.00 H new ATOM 0 HA VAL A 24 5.033 14.463 0.521 1.00 0.00 H new ATOM 0 HB VAL A 24 5.681 15.508 -1.413 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.142 13.719 -3.053 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.422 13.179 -1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.947 12.678 -2.242 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.443 15.446 -3.549 1.00 0.00 H new ATOM 0 HG22 VAL A 24 3.154 14.500 -2.766 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.478 16.169 -2.240 1.00 0.00 H new ATOM 347 N GLY A 25 3.708 16.608 0.659 1.00 0.00 N ATOM 348 CA GLY A 25 2.836 17.697 1.066 1.00 0.00 C ATOM 349 C GLY A 25 1.752 17.202 2.025 1.00 0.00 C ATOM 350 O GLY A 25 1.996 16.313 2.839 1.00 0.00 O ATOM 0 H GLY A 25 4.702 16.780 0.808 1.00 0.00 H new ATOM 0 HA2 GLY A 25 3.424 18.478 1.548 1.00 0.00 H new ATOM 0 HA3 GLY A 25 2.372 18.144 0.187 1.00 0.00 H new ATOM 354 N SER A 26 0.576 17.799 1.897 1.00 0.00 N ATOM 355 CA SER A 26 -0.547 17.430 2.742 1.00 0.00 C ATOM 356 C SER A 26 -1.258 16.206 2.162 1.00 0.00 C ATOM 357 O SER A 26 -2.459 16.247 1.901 1.00 0.00 O ATOM 358 CB SER A 26 -1.530 18.593 2.891 1.00 0.00 C ATOM 359 OG SER A 26 -2.066 19.004 1.636 1.00 0.00 O ATOM 0 H SER A 26 0.377 18.536 1.221 1.00 0.00 H new ATOM 0 HA SER A 26 -0.163 17.185 3.732 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.344 18.297 3.553 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.025 19.436 3.363 1.00 0.00 H new ATOM 0 HG SER A 26 -2.551 18.257 1.227 1.00 0.00 H new ATOM 365 N ARG A 27 -0.486 15.145 1.977 1.00 0.00 N ATOM 366 CA ARG A 27 -1.027 13.911 1.433 1.00 0.00 C ATOM 367 C ARG A 27 -0.173 12.719 1.869 1.00 0.00 C ATOM 368 O ARG A 27 0.832 12.404 1.233 1.00 0.00 O ATOM 369 CB ARG A 27 -1.079 13.960 -0.096 1.00 0.00 C ATOM 370 CG ARG A 27 -2.431 14.488 -0.581 1.00 0.00 C ATOM 371 CD ARG A 27 -2.470 14.571 -2.109 1.00 0.00 C ATOM 372 NE ARG A 27 -2.045 15.918 -2.553 1.00 0.00 N ATOM 373 CZ ARG A 27 -2.767 17.031 -2.371 1.00 0.00 C ATOM 374 NH1 ARG A 27 -3.955 16.967 -1.753 1.00 0.00 N ATOM 375 NH2 ARG A 27 -2.303 18.210 -2.808 1.00 0.00 N ATOM 0 H ARG A 27 0.510 15.115 2.194 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.041 13.796 1.817 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -0.279 14.599 -0.471 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -0.907 12.963 -0.502 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.229 13.834 -0.228 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -2.615 15.474 -0.155 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -1.815 13.814 -2.540 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -3.478 14.362 -2.467 1.00 0.00 H new ATOM 0 HE ARG A 27 -1.146 16.004 -3.027 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -4.310 16.070 -1.421 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -4.504 17.815 -1.615 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -1.400 18.260 -3.279 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -2.853 19.058 -2.669 1.00 0.00 H new ATOM 389 N GLY A 28 -0.604 12.088 2.952 1.00 0.00 N ATOM 390 CA GLY A 28 0.109 10.938 3.480 1.00 0.00 C ATOM 391 C GLY A 28 -0.774 9.689 3.459 1.00 0.00 C ATOM 392 O GLY A 28 -0.901 8.997 4.468 1.00 0.00 O ATOM 0 H GLY A 28 -1.438 12.352 3.477 1.00 0.00 H new ATOM 0 HA2 GLY A 28 1.009 10.762 2.891 1.00 0.00 H new ATOM 0 HA3 GLY A 28 0.431 11.143 4.501 1.00 0.00 H new ATOM 396 N LEU A 29 -1.362 9.438 2.299 1.00 0.00 N ATOM 397 CA LEU A 29 -2.229 8.284 2.133 1.00 0.00 C ATOM 398 C LEU A 29 -3.479 8.463 2.997 1.00 0.00 C ATOM 399 O LEU A 29 -3.416 9.062 4.070 1.00 0.00 O ATOM 400 CB LEU A 29 -1.463 6.992 2.420 1.00 0.00 C ATOM 401 CG LEU A 29 -2.058 5.713 1.828 1.00 0.00 C ATOM 402 CD1 LEU A 29 -1.266 5.257 0.601 1.00 0.00 C ATOM 403 CD2 LEU A 29 -2.159 4.613 2.886 1.00 0.00 C ATOM 0 H LEU A 29 -1.255 10.014 1.464 1.00 0.00 H new ATOM 0 HA LEU A 29 -2.564 8.205 1.099 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.447 7.104 2.043 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.390 6.869 3.501 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.072 5.932 1.494 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.710 4.346 0.199 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.291 6.038 -0.159 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.233 5.062 0.887 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.585 3.715 2.438 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.165 4.389 3.273 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.799 4.950 3.702 1.00 0.00 H new ATOM 415 N GLY A 30 -4.586 7.933 2.497 1.00 0.00 N ATOM 416 CA GLY A 30 -5.849 8.027 3.210 1.00 0.00 C ATOM 417 C GLY A 30 -6.706 6.782 2.973 1.00 0.00 C ATOM 418 O GLY A 30 -7.926 6.826 3.121 1.00 0.00 O ATOM 0 H GLY A 30 -4.634 7.437 1.607 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.660 8.145 4.277 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.391 8.914 2.882 1.00 0.00 H new ATOM 422 N CYS A 31 -6.033 5.700 2.610 1.00 0.00 N ATOM 423 CA CYS A 31 -6.717 4.444 2.352 1.00 0.00 C ATOM 424 C CYS A 31 -6.328 3.450 3.448 1.00 0.00 C ATOM 425 O CYS A 31 -5.215 3.499 3.968 1.00 0.00 O ATOM 426 CB CYS A 31 -6.402 3.905 0.955 1.00 0.00 C ATOM 427 SG CYS A 31 -4.595 3.704 0.755 1.00 0.00 S ATOM 0 H CYS A 31 -5.021 5.667 2.488 1.00 0.00 H new ATOM 0 HA CYS A 31 -7.795 4.603 2.374 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -6.902 2.948 0.804 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -6.786 4.588 0.197 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.183 2.720 1.498 1.00 0.00 H new ATOM 433 N SER A 32 -7.268 2.572 3.767 1.00 0.00 N ATOM 434 CA SER A 32 -7.037 1.568 4.792 1.00 0.00 C ATOM 435 C SER A 32 -6.755 0.212 4.142 1.00 0.00 C ATOM 436 O SER A 32 -7.366 -0.135 3.132 1.00 0.00 O ATOM 437 CB SER A 32 -8.233 1.464 5.740 1.00 0.00 C ATOM 438 OG SER A 32 -7.846 1.600 7.105 1.00 0.00 O ATOM 0 H SER A 32 -8.191 2.535 3.334 1.00 0.00 H new ATOM 0 HA SER A 32 -6.169 1.870 5.378 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.961 2.236 5.491 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.726 0.503 5.597 1.00 0.00 H new ATOM 0 HG SER A 32 -8.638 1.530 7.678 1.00 0.00 H new ATOM 444 N ILE A 33 -5.830 -0.518 4.748 1.00 0.00 N ATOM 445 CA ILE A 33 -5.460 -1.828 4.241 1.00 0.00 C ATOM 446 C ILE A 33 -5.784 -2.888 5.295 1.00 0.00 C ATOM 447 O ILE A 33 -5.676 -2.631 6.493 1.00 0.00 O ATOM 448 CB ILE A 33 -3.998 -1.835 3.791 1.00 0.00 C ATOM 449 CG1 ILE A 33 -3.066 -1.467 4.948 1.00 0.00 C ATOM 450 CG2 ILE A 33 -3.793 -0.926 2.578 1.00 0.00 C ATOM 451 CD1 ILE A 33 -1.709 -2.157 4.800 1.00 0.00 C ATOM 0 H ILE A 33 -5.326 -0.227 5.586 1.00 0.00 H new ATOM 0 HA ILE A 33 -6.044 -2.072 3.353 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.741 -2.848 3.481 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -2.927 -0.386 4.978 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.524 -1.756 5.894 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.745 -0.949 2.279 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -4.414 -1.275 1.753 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.074 0.095 2.837 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.066 -1.878 5.635 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.849 -3.238 4.795 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -1.243 -1.847 3.864 1.00 0.00 H new ATOM 463 N SER A 34 -6.176 -4.058 4.811 1.00 0.00 N ATOM 464 CA SER A 34 -6.517 -5.158 5.697 1.00 0.00 C ATOM 465 C SER A 34 -5.878 -6.454 5.192 1.00 0.00 C ATOM 466 O SER A 34 -5.365 -6.503 4.075 1.00 0.00 O ATOM 467 CB SER A 34 -8.033 -5.324 5.811 1.00 0.00 C ATOM 468 OG SER A 34 -8.429 -5.724 7.120 1.00 0.00 O ATOM 0 H SER A 34 -6.265 -4.268 3.817 1.00 0.00 H new ATOM 0 HA SER A 34 -6.128 -4.931 6.689 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.521 -4.383 5.556 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.372 -6.065 5.087 1.00 0.00 H new ATOM 0 HG SER A 34 -9.404 -5.818 7.153 1.00 0.00 H new ATOM 474 N SER A 35 -5.929 -7.471 6.040 1.00 0.00 N ATOM 475 CA SER A 35 -5.362 -8.763 5.693 1.00 0.00 C ATOM 476 C SER A 35 -6.456 -9.688 5.157 1.00 0.00 C ATOM 477 O SER A 35 -7.590 -9.654 5.632 1.00 0.00 O ATOM 478 CB SER A 35 -4.670 -9.401 6.899 1.00 0.00 C ATOM 479 OG SER A 35 -5.605 -9.832 7.885 1.00 0.00 O ATOM 0 H SER A 35 -6.354 -7.426 6.966 1.00 0.00 H new ATOM 0 HA SER A 35 -4.612 -8.611 4.916 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.075 -10.252 6.567 1.00 0.00 H new ATOM 0 HB3 SER A 35 -3.980 -8.683 7.343 1.00 0.00 H new ATOM 0 HG SER A 35 -5.124 -10.235 8.638 1.00 0.00 H new ATOM 485 N GLY A 36 -6.077 -10.493 4.176 1.00 0.00 N ATOM 486 CA GLY A 36 -7.012 -11.426 3.570 1.00 0.00 C ATOM 487 C GLY A 36 -6.901 -12.810 4.214 1.00 0.00 C ATOM 488 O GLY A 36 -5.929 -13.098 4.911 1.00 0.00 O ATOM 0 H GLY A 36 -5.135 -10.519 3.785 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.029 -11.050 3.680 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.814 -11.502 2.501 1.00 0.00 H new ATOM 492 N PRO A 37 -7.937 -13.651 3.952 1.00 0.00 N ATOM 493 CA PRO A 37 -7.965 -14.997 4.499 1.00 0.00 C ATOM 494 C PRO A 37 -6.990 -15.911 3.754 1.00 0.00 C ATOM 495 O PRO A 37 -6.207 -15.447 2.926 1.00 0.00 O ATOM 496 CB PRO A 37 -9.412 -15.443 4.371 1.00 0.00 C ATOM 497 CG PRO A 37 -10.044 -14.520 3.342 1.00 0.00 C ATOM 498 CD PRO A 37 -9.105 -13.343 3.132 1.00 0.00 C ATOM 0 HA PRO A 37 -7.640 -15.036 5.539 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -9.473 -16.483 4.052 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.928 -15.372 5.328 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.208 -15.050 2.404 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -11.018 -14.174 3.687 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.834 -13.235 2.082 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.569 -12.406 3.440 1.00 0.00 H new ATOM 506 N ILE A 38 -7.069 -17.194 4.076 1.00 0.00 N ATOM 507 CA ILE A 38 -6.203 -18.177 3.448 1.00 0.00 C ATOM 508 C ILE A 38 -6.647 -18.391 1.999 1.00 0.00 C ATOM 509 O ILE A 38 -5.829 -18.698 1.134 1.00 0.00 O ATOM 510 CB ILE A 38 -6.164 -19.463 4.275 1.00 0.00 C ATOM 511 CG1 ILE A 38 -5.350 -20.548 3.566 1.00 0.00 C ATOM 512 CG2 ILE A 38 -7.578 -19.939 4.616 1.00 0.00 C ATOM 513 CD1 ILE A 38 -3.950 -20.665 4.171 1.00 0.00 C ATOM 0 H ILE A 38 -7.719 -17.575 4.763 1.00 0.00 H new ATOM 0 HA ILE A 38 -5.176 -17.814 3.417 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.660 -19.247 5.217 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.866 -21.505 3.645 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.273 -20.315 2.504 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.522 -20.855 5.204 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -8.092 -19.169 5.191 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -8.129 -20.132 3.695 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.392 -21.443 3.650 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.428 -19.713 4.068 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.030 -20.922 5.227 1.00 0.00 H new ATOM 525 N GLN A 39 -7.943 -18.220 1.780 1.00 0.00 N ATOM 526 CA GLN A 39 -8.506 -18.390 0.451 1.00 0.00 C ATOM 527 C GLN A 39 -8.218 -17.158 -0.409 1.00 0.00 C ATOM 528 O GLN A 39 -8.088 -17.264 -1.627 1.00 0.00 O ATOM 529 CB GLN A 39 -10.008 -18.669 0.524 1.00 0.00 C ATOM 530 CG GLN A 39 -10.764 -17.460 1.078 1.00 0.00 C ATOM 531 CD GLN A 39 -12.166 -17.857 1.547 1.00 0.00 C ATOM 532 OE1 GLN A 39 -12.971 -18.388 0.800 1.00 0.00 O ATOM 533 NE2 GLN A 39 -12.410 -17.572 2.823 1.00 0.00 N ATOM 0 H GLN A 39 -8.619 -17.966 2.500 1.00 0.00 H new ATOM 0 HA GLN A 39 -8.032 -19.253 -0.016 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.385 -18.914 -0.469 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.190 -19.537 1.157 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.207 -17.028 1.910 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.838 -16.690 0.310 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -11.691 -17.127 3.393 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.316 -17.799 3.232 1.00 0.00 H new ATOM 542 N LYS A 40 -8.128 -16.017 0.259 1.00 0.00 N ATOM 543 CA LYS A 40 -7.858 -14.766 -0.429 1.00 0.00 C ATOM 544 C LYS A 40 -6.813 -13.972 0.357 1.00 0.00 C ATOM 545 O LYS A 40 -7.088 -12.866 0.819 1.00 0.00 O ATOM 546 CB LYS A 40 -9.158 -13.999 -0.674 1.00 0.00 C ATOM 547 CG LYS A 40 -8.898 -12.719 -1.471 1.00 0.00 C ATOM 548 CD LYS A 40 -9.841 -12.618 -2.671 1.00 0.00 C ATOM 549 CE LYS A 40 -9.097 -12.897 -3.978 1.00 0.00 C ATOM 550 NZ LYS A 40 -9.895 -13.789 -4.849 1.00 0.00 N ATOM 0 H LYS A 40 -8.237 -15.933 1.270 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.437 -14.957 -1.416 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.861 -14.632 -1.215 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.622 -13.750 0.280 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.032 -11.851 -0.825 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.864 -12.704 -1.815 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -10.660 -13.328 -2.556 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.285 -11.623 -2.706 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -8.895 -11.959 -4.496 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.132 -13.357 -3.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -9.375 -13.968 -5.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -10.066 -14.690 -4.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.805 -13.336 -5.069 1.00 0.00 H new ATOM 564 N PRO A 41 -5.605 -14.583 0.488 1.00 0.00 N ATOM 565 CA PRO A 41 -4.518 -13.945 1.210 1.00 0.00 C ATOM 566 C PRO A 41 -3.897 -12.818 0.382 1.00 0.00 C ATOM 567 O PRO A 41 -3.837 -12.904 -0.844 1.00 0.00 O ATOM 568 CB PRO A 41 -3.538 -15.065 1.517 1.00 0.00 C ATOM 569 CG PRO A 41 -3.883 -16.194 0.559 1.00 0.00 C ATOM 570 CD PRO A 41 -5.244 -15.893 -0.046 1.00 0.00 C ATOM 0 HA PRO A 41 -4.850 -13.462 2.129 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.509 -14.734 1.376 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.629 -15.390 2.553 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -3.128 -16.276 -0.223 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -3.902 -17.148 1.085 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.199 -15.878 -1.135 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.977 -16.650 0.232 1.00 0.00 H new ATOM 578 N GLY A 42 -3.451 -11.787 1.085 1.00 0.00 N ATOM 579 CA GLY A 42 -2.836 -10.645 0.430 1.00 0.00 C ATOM 580 C GLY A 42 -3.224 -9.339 1.127 1.00 0.00 C ATOM 581 O GLY A 42 -3.710 -9.355 2.257 1.00 0.00 O ATOM 0 H GLY A 42 -3.503 -11.719 2.101 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.752 -10.757 0.437 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.146 -10.610 -0.615 1.00 0.00 H new ATOM 585 N ILE A 43 -2.995 -8.239 0.424 1.00 0.00 N ATOM 586 CA ILE A 43 -3.314 -6.928 0.962 1.00 0.00 C ATOM 587 C ILE A 43 -4.401 -6.280 0.101 1.00 0.00 C ATOM 588 O ILE A 43 -4.196 -6.044 -1.089 1.00 0.00 O ATOM 589 CB ILE A 43 -2.048 -6.080 1.095 1.00 0.00 C ATOM 590 CG1 ILE A 43 -0.955 -6.842 1.847 1.00 0.00 C ATOM 591 CG2 ILE A 43 -2.357 -4.730 1.744 1.00 0.00 C ATOM 592 CD1 ILE A 43 -1.220 -6.835 3.354 1.00 0.00 C ATOM 0 H ILE A 43 -2.592 -8.229 -0.513 1.00 0.00 H new ATOM 0 HA ILE A 43 -3.716 -7.018 1.971 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.667 -5.875 0.094 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -0.910 -7.870 1.487 1.00 0.00 H new ATOM 0 HG13 ILE A 43 0.015 -6.389 1.643 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.439 -4.147 1.826 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.077 -4.188 1.131 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.775 -4.891 2.738 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.429 -7.383 3.865 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -1.241 -5.807 3.715 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.180 -7.310 3.557 1.00 0.00 H new ATOM 604 N PHE A 44 -5.532 -6.010 0.736 1.00 0.00 N ATOM 605 CA PHE A 44 -6.650 -5.394 0.044 1.00 0.00 C ATOM 606 C PHE A 44 -7.125 -4.138 0.778 1.00 0.00 C ATOM 607 O PHE A 44 -7.176 -4.115 2.007 1.00 0.00 O ATOM 608 CB PHE A 44 -7.785 -6.419 0.026 1.00 0.00 C ATOM 609 CG PHE A 44 -7.336 -7.839 -0.325 1.00 0.00 C ATOM 610 CD1 PHE A 44 -6.539 -8.532 0.533 1.00 0.00 C ATOM 611 CD2 PHE A 44 -7.733 -8.408 -1.494 1.00 0.00 C ATOM 612 CE1 PHE A 44 -6.122 -9.849 0.207 1.00 0.00 C ATOM 613 CE2 PHE A 44 -7.315 -9.726 -1.820 1.00 0.00 C ATOM 614 CZ PHE A 44 -6.519 -10.419 -0.963 1.00 0.00 C ATOM 0 H PHE A 44 -5.698 -6.207 1.723 1.00 0.00 H new ATOM 0 HA PHE A 44 -6.349 -5.102 -0.962 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -8.264 -6.432 1.005 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -8.538 -6.099 -0.694 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -6.224 -8.080 1.462 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.366 -7.858 -2.175 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -5.489 -10.399 0.888 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.630 -10.178 -2.749 1.00 0.00 H new ATOM 0 HZ PHE A 44 -6.202 -11.421 -1.211 1.00 0.00 H new ATOM 624 N ILE A 45 -7.461 -3.124 -0.007 1.00 0.00 N ATOM 625 CA ILE A 45 -7.930 -1.868 0.553 1.00 0.00 C ATOM 626 C ILE A 45 -9.282 -2.092 1.235 1.00 0.00 C ATOM 627 O ILE A 45 -10.089 -2.896 0.772 1.00 0.00 O ATOM 628 CB ILE A 45 -7.955 -0.779 -0.521 1.00 0.00 C ATOM 629 CG1 ILE A 45 -6.539 -0.306 -0.856 1.00 0.00 C ATOM 630 CG2 ILE A 45 -8.863 0.380 -0.105 1.00 0.00 C ATOM 631 CD1 ILE A 45 -6.568 0.823 -1.887 1.00 0.00 C ATOM 0 H ILE A 45 -7.418 -3.147 -1.026 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.242 -1.511 1.319 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.375 -1.207 -1.431 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.042 0.038 0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -5.955 -1.141 -1.242 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.863 1.141 -0.886 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.878 0.012 0.043 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.496 0.815 0.825 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.549 1.141 -2.107 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.043 0.468 -2.802 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.132 1.666 -1.488 1.00 0.00 H new ATOM 643 N SER A 46 -9.487 -1.365 2.324 1.00 0.00 N ATOM 644 CA SER A 46 -10.726 -1.474 3.074 1.00 0.00 C ATOM 645 C SER A 46 -11.565 -0.208 2.884 1.00 0.00 C ATOM 646 O SER A 46 -12.790 -0.278 2.797 1.00 0.00 O ATOM 647 CB SER A 46 -10.452 -1.711 4.560 1.00 0.00 C ATOM 648 OG SER A 46 -10.644 -0.530 5.334 1.00 0.00 O ATOM 0 H SER A 46 -8.815 -0.698 2.704 1.00 0.00 H new ATOM 0 HA SER A 46 -11.281 -2.331 2.694 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.111 -2.497 4.929 1.00 0.00 H new ATOM 0 HB3 SER A 46 -9.429 -2.066 4.688 1.00 0.00 H new ATOM 0 HG SER A 46 -10.461 -0.724 6.277 1.00 0.00 H new ATOM 654 N HIS A 47 -10.872 0.920 2.826 1.00 0.00 N ATOM 655 CA HIS A 47 -11.537 2.199 2.649 1.00 0.00 C ATOM 656 C HIS A 47 -10.534 3.232 2.134 1.00 0.00 C ATOM 657 O HIS A 47 -9.331 3.100 2.356 1.00 0.00 O ATOM 658 CB HIS A 47 -12.227 2.636 3.943 1.00 0.00 C ATOM 659 CG HIS A 47 -13.160 3.812 3.774 1.00 0.00 C ATOM 660 ND1 HIS A 47 -12.711 5.090 3.490 1.00 0.00 N ATOM 661 CD2 HIS A 47 -14.519 3.889 3.852 1.00 0.00 C ATOM 662 CE1 HIS A 47 -13.762 5.892 3.404 1.00 0.00 C ATOM 663 NE2 HIS A 47 -14.881 5.147 3.629 1.00 0.00 N ATOM 0 H HIS A 47 -9.856 0.974 2.899 1.00 0.00 H new ATOM 0 HA HIS A 47 -12.324 2.103 1.901 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.790 1.794 4.345 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -11.466 2.892 4.680 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -15.187 3.067 4.060 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -13.737 6.951 3.193 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -15.839 5.498 3.626 1.00 0.00 H new ATOM 671 N VAL A 48 -11.065 4.238 1.455 1.00 0.00 N ATOM 672 CA VAL A 48 -10.231 5.294 0.906 1.00 0.00 C ATOM 673 C VAL A 48 -11.031 6.598 0.860 1.00 0.00 C ATOM 674 O VAL A 48 -12.134 6.634 0.318 1.00 0.00 O ATOM 675 CB VAL A 48 -9.691 4.875 -0.463 1.00 0.00 C ATOM 676 CG1 VAL A 48 -10.765 4.153 -1.279 1.00 0.00 C ATOM 677 CG2 VAL A 48 -9.140 6.081 -1.227 1.00 0.00 C ATOM 0 H VAL A 48 -12.063 4.344 1.272 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.364 5.467 1.544 1.00 0.00 H new ATOM 0 HB VAL A 48 -8.869 4.177 -0.300 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -10.355 3.866 -2.247 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -11.090 3.261 -0.744 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -11.616 4.817 -1.428 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -8.762 5.756 -2.197 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -9.934 6.813 -1.374 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -8.330 6.535 -0.656 1.00 0.00 H new ATOM 687 N LYS A 49 -10.442 7.636 1.435 1.00 0.00 N ATOM 688 CA LYS A 49 -11.085 8.938 1.467 1.00 0.00 C ATOM 689 C LYS A 49 -11.159 9.500 0.046 1.00 0.00 C ATOM 690 O LYS A 49 -10.347 9.148 -0.808 1.00 0.00 O ATOM 691 CB LYS A 49 -10.376 9.863 2.458 1.00 0.00 C ATOM 692 CG LYS A 49 -11.241 10.109 3.695 1.00 0.00 C ATOM 693 CD LYS A 49 -10.404 10.667 4.848 1.00 0.00 C ATOM 694 CE LYS A 49 -10.649 9.877 6.135 1.00 0.00 C ATOM 695 NZ LYS A 49 -10.682 10.786 7.303 1.00 0.00 N ATOM 0 H LYS A 49 -9.526 7.602 1.883 1.00 0.00 H new ATOM 0 HA LYS A 49 -12.109 8.848 1.829 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -9.425 9.421 2.757 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -10.148 10.813 1.975 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -12.041 10.808 3.450 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -11.715 9.177 4.003 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.346 10.626 4.588 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.652 11.716 5.008 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -11.592 9.335 6.062 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.863 9.133 6.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.849 10.234 8.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.773 11.284 7.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -11.448 11.479 7.182 1.00 0.00 H new ATOM 709 N PRO A 50 -12.167 10.388 -0.170 1.00 0.00 N ATOM 710 CA PRO A 50 -12.358 11.002 -1.473 1.00 0.00 C ATOM 711 C PRO A 50 -11.305 12.083 -1.729 1.00 0.00 C ATOM 712 O PRO A 50 -11.088 12.954 -0.888 1.00 0.00 O ATOM 713 CB PRO A 50 -13.776 11.548 -1.447 1.00 0.00 C ATOM 714 CG PRO A 50 -14.163 11.632 0.021 1.00 0.00 C ATOM 715 CD PRO A 50 -13.148 10.828 0.817 1.00 0.00 C ATOM 0 HA PRO A 50 -12.233 10.295 -2.294 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -13.826 12.528 -1.921 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.456 10.895 -1.994 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -14.174 12.670 0.354 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -15.167 11.237 0.174 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.683 11.435 1.594 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -13.617 9.979 1.314 1.00 0.00 H new ATOM 723 N GLY A 51 -10.680 11.990 -2.893 1.00 0.00 N ATOM 724 CA GLY A 51 -9.655 12.949 -3.270 1.00 0.00 C ATOM 725 C GLY A 51 -8.341 12.662 -2.542 1.00 0.00 C ATOM 726 O GLY A 51 -7.369 13.402 -2.692 1.00 0.00 O ATOM 0 H GLY A 51 -10.863 11.266 -3.588 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -9.494 12.910 -4.347 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -9.992 13.958 -3.035 1.00 0.00 H new ATOM 730 N SER A 52 -8.352 11.586 -1.768 1.00 0.00 N ATOM 731 CA SER A 52 -7.173 11.193 -1.016 1.00 0.00 C ATOM 732 C SER A 52 -5.986 11.007 -1.963 1.00 0.00 C ATOM 733 O SER A 52 -6.021 11.464 -3.105 1.00 0.00 O ATOM 734 CB SER A 52 -7.428 9.907 -0.226 1.00 0.00 C ATOM 735 OG SER A 52 -7.551 8.772 -1.078 1.00 0.00 O ATOM 0 H SER A 52 -9.159 10.974 -1.646 1.00 0.00 H new ATOM 0 HA SER A 52 -6.941 11.985 -0.304 1.00 0.00 H new ATOM 0 HB2 SER A 52 -6.611 9.746 0.477 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.338 10.018 0.363 1.00 0.00 H new ATOM 0 HG SER A 52 -8.488 8.662 -1.343 1.00 0.00 H new ATOM 741 N LEU A 53 -4.964 10.334 -1.455 1.00 0.00 N ATOM 742 CA LEU A 53 -3.769 10.082 -2.242 1.00 0.00 C ATOM 743 C LEU A 53 -3.988 8.843 -3.111 1.00 0.00 C ATOM 744 O LEU A 53 -3.300 8.654 -4.114 1.00 0.00 O ATOM 745 CB LEU A 53 -2.540 9.988 -1.334 1.00 0.00 C ATOM 746 CG LEU A 53 -1.188 9.893 -2.044 1.00 0.00 C ATOM 747 CD1 LEU A 53 -0.980 11.079 -2.988 1.00 0.00 C ATOM 748 CD2 LEU A 53 -0.047 9.759 -1.033 1.00 0.00 C ATOM 0 H LEU A 53 -4.939 9.956 -0.508 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.575 10.915 -2.918 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.526 10.862 -0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.653 9.115 -0.692 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.185 8.990 -2.655 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.012 10.987 -3.480 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.769 11.089 -3.740 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.011 12.008 -2.418 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.903 9.693 -1.563 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.037 10.630 -0.378 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.193 8.858 -0.437 1.00 0.00 H new ATOM 760 N SER A 54 -4.948 8.030 -2.696 1.00 0.00 N ATOM 761 CA SER A 54 -5.266 6.813 -3.424 1.00 0.00 C ATOM 762 C SER A 54 -6.415 7.073 -4.400 1.00 0.00 C ATOM 763 O SER A 54 -6.467 6.478 -5.476 1.00 0.00 O ATOM 764 CB SER A 54 -5.630 5.677 -2.467 1.00 0.00 C ATOM 765 OG SER A 54 -4.747 5.617 -1.350 1.00 0.00 O ATOM 0 H SER A 54 -5.516 8.190 -1.864 1.00 0.00 H new ATOM 0 HA SER A 54 -4.382 6.509 -3.985 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.652 5.814 -2.114 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.602 4.728 -3.003 1.00 0.00 H new ATOM 0 HG SER A 54 -4.837 4.747 -0.908 1.00 0.00 H new ATOM 771 N ALA A 55 -7.307 7.963 -3.991 1.00 0.00 N ATOM 772 CA ALA A 55 -8.452 8.309 -4.816 1.00 0.00 C ATOM 773 C ALA A 55 -7.972 9.073 -6.052 1.00 0.00 C ATOM 774 O ALA A 55 -8.585 8.988 -7.115 1.00 0.00 O ATOM 775 CB ALA A 55 -9.454 9.114 -3.986 1.00 0.00 C ATOM 0 H ALA A 55 -7.260 8.455 -3.099 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.962 7.410 -5.162 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.313 9.374 -4.604 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -9.786 8.517 -3.137 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.978 10.026 -3.625 1.00 0.00 H new ATOM 781 N GLU A 56 -6.880 9.801 -5.871 1.00 0.00 N ATOM 782 CA GLU A 56 -6.311 10.579 -6.959 1.00 0.00 C ATOM 783 C GLU A 56 -5.835 9.654 -8.081 1.00 0.00 C ATOM 784 O GLU A 56 -5.914 10.006 -9.256 1.00 0.00 O ATOM 785 CB GLU A 56 -5.170 11.467 -6.459 1.00 0.00 C ATOM 786 CG GLU A 56 -4.109 10.639 -5.733 1.00 0.00 C ATOM 787 CD GLU A 56 -2.720 11.259 -5.900 1.00 0.00 C ATOM 788 OE1 GLU A 56 -2.606 12.476 -5.637 1.00 0.00 O ATOM 789 OE2 GLU A 56 -1.803 10.503 -6.287 1.00 0.00 O ATOM 0 H GLU A 56 -6.374 9.869 -4.988 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.087 11.232 -7.358 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.715 11.990 -7.301 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.565 12.229 -5.787 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.357 10.573 -4.674 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.106 9.622 -6.124 1.00 0.00 H new ATOM 796 N VAL A 57 -5.351 8.488 -7.678 1.00 0.00 N ATOM 797 CA VAL A 57 -4.863 7.510 -8.634 1.00 0.00 C ATOM 798 C VAL A 57 -6.041 6.695 -9.172 1.00 0.00 C ATOM 799 O VAL A 57 -5.950 6.097 -10.243 1.00 0.00 O ATOM 800 CB VAL A 57 -3.781 6.641 -7.988 1.00 0.00 C ATOM 801 CG1 VAL A 57 -2.638 7.502 -7.446 1.00 0.00 C ATOM 802 CG2 VAL A 57 -4.372 5.758 -6.888 1.00 0.00 C ATOM 0 H VAL A 57 -5.287 8.199 -6.702 1.00 0.00 H new ATOM 0 HA VAL A 57 -4.397 8.008 -9.484 1.00 0.00 H new ATOM 0 HB VAL A 57 -3.372 5.987 -8.758 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.883 6.860 -6.992 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.190 8.068 -8.263 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -3.026 8.192 -6.696 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -3.582 5.151 -6.445 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -4.821 6.386 -6.119 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.135 5.107 -7.315 1.00 0.00 H new ATOM 812 N GLY A 58 -7.120 6.698 -8.403 1.00 0.00 N ATOM 813 CA GLY A 58 -8.315 5.967 -8.789 1.00 0.00 C ATOM 814 C GLY A 58 -8.396 4.624 -8.059 1.00 0.00 C ATOM 815 O GLY A 58 -8.808 3.622 -8.641 1.00 0.00 O ATOM 0 H GLY A 58 -7.192 7.195 -7.515 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.199 6.562 -8.562 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -8.311 5.800 -9.866 1.00 0.00 H new ATOM 819 N LEU A 59 -7.997 4.649 -6.796 1.00 0.00 N ATOM 820 CA LEU A 59 -8.019 3.446 -5.981 1.00 0.00 C ATOM 821 C LEU A 59 -9.407 3.282 -5.359 1.00 0.00 C ATOM 822 O LEU A 59 -10.030 4.263 -4.957 1.00 0.00 O ATOM 823 CB LEU A 59 -6.884 3.473 -4.955 1.00 0.00 C ATOM 824 CG LEU A 59 -5.524 2.973 -5.446 1.00 0.00 C ATOM 825 CD1 LEU A 59 -4.461 3.116 -4.355 1.00 0.00 C ATOM 826 CD2 LEU A 59 -5.623 1.537 -5.964 1.00 0.00 C ATOM 0 H LEU A 59 -7.657 5.483 -6.317 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.839 2.565 -6.597 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.766 4.497 -4.600 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.182 2.871 -4.097 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.212 3.597 -6.283 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.504 2.753 -4.730 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.367 4.165 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.754 2.532 -3.483 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.643 1.206 -6.307 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.967 0.884 -5.162 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.330 1.497 -6.793 1.00 0.00 H new ATOM 838 N GLU A 60 -9.850 2.035 -5.299 1.00 0.00 N ATOM 839 CA GLU A 60 -11.153 1.730 -4.732 1.00 0.00 C ATOM 840 C GLU A 60 -11.055 0.524 -3.796 1.00 0.00 C ATOM 841 O GLU A 60 -10.014 -0.127 -3.723 1.00 0.00 O ATOM 842 CB GLU A 60 -12.187 1.488 -5.834 1.00 0.00 C ATOM 843 CG GLU A 60 -12.215 2.653 -6.825 1.00 0.00 C ATOM 844 CD GLU A 60 -13.463 2.590 -7.708 1.00 0.00 C ATOM 845 OE1 GLU A 60 -14.562 2.452 -7.129 1.00 0.00 O ATOM 846 OE2 GLU A 60 -13.289 2.681 -8.943 1.00 0.00 O ATOM 0 H GLU A 60 -9.330 1.224 -5.634 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.486 2.590 -4.150 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -11.952 0.563 -6.361 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -13.174 1.360 -5.390 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -12.196 3.598 -6.282 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.322 2.626 -7.449 1.00 0.00 H new ATOM 853 N ILE A 61 -12.154 0.262 -3.103 1.00 0.00 N ATOM 854 CA ILE A 61 -12.206 -0.854 -2.175 1.00 0.00 C ATOM 855 C ILE A 61 -12.130 -2.166 -2.958 1.00 0.00 C ATOM 856 O ILE A 61 -12.941 -2.409 -3.850 1.00 0.00 O ATOM 857 CB ILE A 61 -13.438 -0.746 -1.274 1.00 0.00 C ATOM 858 CG1 ILE A 61 -13.267 0.374 -0.245 1.00 0.00 C ATOM 859 CG2 ILE A 61 -13.753 -2.089 -0.613 1.00 0.00 C ATOM 860 CD1 ILE A 61 -14.625 0.925 0.195 1.00 0.00 C ATOM 0 H ILE A 61 -13.016 0.804 -3.166 1.00 0.00 H new ATOM 0 HA ILE A 61 -11.347 -0.832 -1.504 1.00 0.00 H new ATOM 0 HB ILE A 61 -14.295 -0.485 -1.895 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -12.725 -0.003 0.622 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -12.666 1.177 -0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -14.633 -1.985 0.022 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -13.947 -2.836 -1.382 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -12.904 -2.404 -0.007 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -14.476 1.719 0.926 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -15.154 1.323 -0.671 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -15.214 0.125 0.644 1.00 0.00 H new ATOM 872 N GLY A 62 -11.148 -2.979 -2.595 1.00 0.00 N ATOM 873 CA GLY A 62 -10.956 -4.261 -3.253 1.00 0.00 C ATOM 874 C GLY A 62 -9.575 -4.340 -3.905 1.00 0.00 C ATOM 875 O GLY A 62 -8.959 -5.405 -3.934 1.00 0.00 O ATOM 0 H GLY A 62 -10.477 -2.775 -1.854 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -11.066 -5.067 -2.527 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -11.728 -4.405 -4.009 1.00 0.00 H new ATOM 879 N ASP A 63 -9.129 -3.201 -4.413 1.00 0.00 N ATOM 880 CA ASP A 63 -7.831 -3.128 -5.063 1.00 0.00 C ATOM 881 C ASP A 63 -6.787 -3.824 -4.188 1.00 0.00 C ATOM 882 O ASP A 63 -6.283 -3.237 -3.232 1.00 0.00 O ATOM 883 CB ASP A 63 -7.393 -1.676 -5.258 1.00 0.00 C ATOM 884 CG ASP A 63 -8.256 -0.864 -6.225 1.00 0.00 C ATOM 885 OD1 ASP A 63 -9.077 -1.498 -6.922 1.00 0.00 O ATOM 886 OD2 ASP A 63 -8.075 0.373 -6.247 1.00 0.00 O ATOM 0 H ASP A 63 -9.643 -2.321 -4.388 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.914 -3.613 -6.036 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -7.395 -1.179 -4.288 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.364 -1.668 -5.619 1.00 0.00 H new ATOM 891 N GLN A 64 -6.493 -5.066 -4.546 1.00 0.00 N ATOM 892 CA GLN A 64 -5.518 -5.848 -3.805 1.00 0.00 C ATOM 893 C GLN A 64 -4.101 -5.508 -4.271 1.00 0.00 C ATOM 894 O GLN A 64 -3.814 -5.534 -5.467 1.00 0.00 O ATOM 895 CB GLN A 64 -5.797 -7.345 -3.944 1.00 0.00 C ATOM 896 CG GLN A 64 -4.660 -8.173 -3.341 1.00 0.00 C ATOM 897 CD GLN A 64 -4.812 -9.654 -3.696 1.00 0.00 C ATOM 898 OE1 GLN A 64 -5.745 -10.066 -4.365 1.00 0.00 O ATOM 899 NE2 GLN A 64 -3.845 -10.428 -3.211 1.00 0.00 N ATOM 0 H GLN A 64 -6.913 -5.550 -5.340 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.603 -5.593 -2.749 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.735 -7.592 -3.446 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -5.918 -7.600 -4.997 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -3.702 -7.804 -3.708 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -4.654 -8.054 -2.258 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -3.093 -10.018 -2.658 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -3.856 -11.432 -3.392 1.00 0.00 H new ATOM 908 N ILE A 65 -3.252 -5.198 -3.303 1.00 0.00 N ATOM 909 CA ILE A 65 -1.872 -4.854 -3.599 1.00 0.00 C ATOM 910 C ILE A 65 -1.079 -6.134 -3.872 1.00 0.00 C ATOM 911 O ILE A 65 -0.878 -6.948 -2.972 1.00 0.00 O ATOM 912 CB ILE A 65 -1.283 -3.992 -2.480 1.00 0.00 C ATOM 913 CG1 ILE A 65 -2.047 -2.674 -2.343 1.00 0.00 C ATOM 914 CG2 ILE A 65 0.216 -3.767 -2.693 1.00 0.00 C ATOM 915 CD1 ILE A 65 -1.840 -2.062 -0.956 1.00 0.00 C ATOM 0 H ILE A 65 -3.493 -5.178 -2.312 1.00 0.00 H new ATOM 0 HA ILE A 65 -1.816 -4.246 -4.502 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.397 -4.529 -1.538 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.711 -1.973 -3.107 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.110 -2.846 -2.514 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.610 -3.152 -1.884 1.00 0.00 H new ATOM 0 HG22 ILE A 65 0.731 -4.728 -2.702 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.376 -3.261 -3.645 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.394 -1.126 -0.885 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.200 -2.755 -0.195 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.779 -1.869 -0.798 1.00 0.00 H new ATOM 927 N VAL A 66 -0.651 -6.272 -5.118 1.00 0.00 N ATOM 928 CA VAL A 66 0.116 -7.439 -5.521 1.00 0.00 C ATOM 929 C VAL A 66 1.598 -7.067 -5.602 1.00 0.00 C ATOM 930 O VAL A 66 2.464 -7.938 -5.540 1.00 0.00 O ATOM 931 CB VAL A 66 -0.434 -7.997 -6.835 1.00 0.00 C ATOM 932 CG1 VAL A 66 -1.932 -8.289 -6.723 1.00 0.00 C ATOM 933 CG2 VAL A 66 -0.146 -7.046 -7.998 1.00 0.00 C ATOM 0 H VAL A 66 -0.821 -5.595 -5.862 1.00 0.00 H new ATOM 0 HA VAL A 66 0.021 -8.234 -4.781 1.00 0.00 H new ATOM 0 HB VAL A 66 0.076 -8.939 -7.038 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.297 -8.685 -7.671 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.102 -9.022 -5.934 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.465 -7.369 -6.484 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.547 -7.467 -8.920 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.616 -6.082 -7.804 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.931 -6.911 -8.100 1.00 0.00 H new ATOM 943 N GLU A 67 1.843 -5.773 -5.741 1.00 0.00 N ATOM 944 CA GLU A 67 3.206 -5.275 -5.831 1.00 0.00 C ATOM 945 C GLU A 67 3.266 -3.810 -5.396 1.00 0.00 C ATOM 946 O GLU A 67 2.295 -3.071 -5.553 1.00 0.00 O ATOM 947 CB GLU A 67 3.760 -5.449 -7.247 1.00 0.00 C ATOM 948 CG GLU A 67 5.109 -4.744 -7.398 1.00 0.00 C ATOM 949 CD GLU A 67 5.568 -4.745 -8.858 1.00 0.00 C ATOM 950 OE1 GLU A 67 5.739 -5.860 -9.398 1.00 0.00 O ATOM 951 OE2 GLU A 67 5.738 -3.632 -9.400 1.00 0.00 O ATOM 0 H GLU A 67 1.122 -5.054 -5.794 1.00 0.00 H new ATOM 0 HA GLU A 67 3.831 -5.860 -5.156 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.873 -6.510 -7.469 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.052 -5.046 -7.971 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.029 -3.718 -7.039 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.855 -5.242 -6.778 1.00 0.00 H new ATOM 958 N VAL A 68 4.416 -3.433 -4.856 1.00 0.00 N ATOM 959 CA VAL A 68 4.615 -2.069 -4.396 1.00 0.00 C ATOM 960 C VAL A 68 6.088 -1.690 -4.562 1.00 0.00 C ATOM 961 O VAL A 68 6.963 -2.302 -3.952 1.00 0.00 O ATOM 962 CB VAL A 68 4.119 -1.925 -2.956 1.00 0.00 C ATOM 963 CG1 VAL A 68 4.322 -0.496 -2.447 1.00 0.00 C ATOM 964 CG2 VAL A 68 2.654 -2.347 -2.835 1.00 0.00 C ATOM 0 H VAL A 68 5.219 -4.048 -4.727 1.00 0.00 H new ATOM 0 HA VAL A 68 4.030 -1.373 -4.998 1.00 0.00 H new ATOM 0 HB VAL A 68 4.712 -2.592 -2.330 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.961 -0.420 -1.421 1.00 0.00 H new ATOM 0 HG12 VAL A 68 5.382 -0.246 -2.478 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.767 0.198 -3.079 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.327 -2.235 -1.801 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.040 -1.719 -3.480 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.549 -3.389 -3.137 1.00 0.00 H new ATOM 974 N ASN A 69 6.317 -0.682 -5.392 1.00 0.00 N ATOM 975 CA ASN A 69 7.668 -0.214 -5.646 1.00 0.00 C ATOM 976 C ASN A 69 8.537 -1.392 -6.090 1.00 0.00 C ATOM 977 O ASN A 69 9.755 -1.369 -5.921 1.00 0.00 O ATOM 978 CB ASN A 69 8.291 0.383 -4.382 1.00 0.00 C ATOM 979 CG ASN A 69 8.794 1.805 -4.638 1.00 0.00 C ATOM 980 OD1 ASN A 69 8.782 2.305 -5.750 1.00 0.00 O ATOM 981 ND2 ASN A 69 9.236 2.427 -3.548 1.00 0.00 N ATOM 0 H ASN A 69 5.589 -0.177 -5.897 1.00 0.00 H new ATOM 0 HA ASN A 69 7.619 0.551 -6.420 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.554 0.393 -3.579 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.117 -0.244 -4.048 1.00 0.00 H new ATOM 0 HD21 ASN A 69 9.593 3.380 -3.614 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.218 1.950 -2.646 1.00 0.00 H new ATOM 988 N GLY A 70 7.876 -2.395 -6.649 1.00 0.00 N ATOM 989 CA GLY A 70 8.572 -3.581 -7.119 1.00 0.00 C ATOM 990 C GLY A 70 8.704 -4.618 -6.002 1.00 0.00 C ATOM 991 O GLY A 70 9.541 -5.515 -6.078 1.00 0.00 O ATOM 0 H GLY A 70 6.866 -2.411 -6.787 1.00 0.00 H new ATOM 0 HA2 GLY A 70 8.032 -4.015 -7.961 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.562 -3.306 -7.483 1.00 0.00 H new ATOM 995 N VAL A 71 7.863 -4.460 -4.990 1.00 0.00 N ATOM 996 CA VAL A 71 7.875 -5.372 -3.858 1.00 0.00 C ATOM 997 C VAL A 71 6.844 -6.478 -4.090 1.00 0.00 C ATOM 998 O VAL A 71 5.910 -6.308 -4.872 1.00 0.00 O ATOM 999 CB VAL A 71 7.640 -4.598 -2.560 1.00 0.00 C ATOM 1000 CG1 VAL A 71 7.641 -5.538 -1.353 1.00 0.00 C ATOM 1001 CG2 VAL A 71 8.676 -3.485 -2.389 1.00 0.00 C ATOM 0 H VAL A 71 7.169 -3.715 -4.930 1.00 0.00 H new ATOM 0 HA VAL A 71 8.850 -5.851 -3.763 1.00 0.00 H new ATOM 0 HB VAL A 71 6.656 -4.133 -2.622 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.472 -4.962 -0.443 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.848 -6.277 -1.467 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.604 -6.045 -1.288 1.00 0.00 H new ATOM 0 HG21 VAL A 71 8.486 -2.951 -1.458 1.00 0.00 H new ATOM 0 HG22 VAL A 71 9.675 -3.919 -2.360 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.606 -2.791 -3.227 1.00 0.00 H new ATOM 1011 N ASP A 72 7.048 -7.588 -3.395 1.00 0.00 N ATOM 1012 CA ASP A 72 6.147 -8.722 -3.515 1.00 0.00 C ATOM 1013 C ASP A 72 5.074 -8.632 -2.429 1.00 0.00 C ATOM 1014 O ASP A 72 5.246 -9.167 -1.334 1.00 0.00 O ATOM 1015 CB ASP A 72 6.898 -10.043 -3.330 1.00 0.00 C ATOM 1016 CG ASP A 72 6.371 -11.209 -4.169 1.00 0.00 C ATOM 1017 OD1 ASP A 72 5.539 -10.935 -5.062 1.00 0.00 O ATOM 1018 OD2 ASP A 72 6.812 -12.347 -3.899 1.00 0.00 O ATOM 0 H ASP A 72 7.824 -7.726 -2.747 1.00 0.00 H new ATOM 0 HA ASP A 72 5.702 -8.696 -4.510 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.948 -9.884 -3.575 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.855 -10.324 -2.278 1.00 0.00 H new ATOM 1023 N PHE A 73 3.989 -7.953 -2.769 1.00 0.00 N ATOM 1024 CA PHE A 73 2.887 -7.786 -1.836 1.00 0.00 C ATOM 1025 C PHE A 73 1.809 -8.848 -2.065 1.00 0.00 C ATOM 1026 O PHE A 73 0.657 -8.662 -1.678 1.00 0.00 O ATOM 1027 CB PHE A 73 2.286 -6.403 -2.096 1.00 0.00 C ATOM 1028 CG PHE A 73 2.906 -5.287 -1.253 1.00 0.00 C ATOM 1029 CD1 PHE A 73 4.249 -5.076 -1.285 1.00 0.00 C ATOM 1030 CD2 PHE A 73 2.114 -4.506 -0.470 1.00 0.00 C ATOM 1031 CE1 PHE A 73 4.825 -4.041 -0.502 1.00 0.00 C ATOM 1032 CE2 PHE A 73 2.689 -3.470 0.312 1.00 0.00 C ATOM 1033 CZ PHE A 73 4.032 -3.259 0.280 1.00 0.00 C ATOM 0 H PHE A 73 3.849 -7.512 -3.678 1.00 0.00 H new ATOM 0 HA PHE A 73 3.248 -7.887 -0.812 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.408 -6.158 -3.151 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.215 -6.441 -1.899 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.878 -5.696 -1.906 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.047 -4.674 -0.443 1.00 0.00 H new ATOM 0 HE1 PHE A 73 5.892 -3.874 -0.527 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.060 -2.849 0.932 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.469 -2.471 0.875 1.00 0.00 H new ATOM 1043 N SER A 74 2.223 -9.939 -2.694 1.00 0.00 N ATOM 1044 CA SER A 74 1.307 -11.030 -2.979 1.00 0.00 C ATOM 1045 C SER A 74 1.035 -11.832 -1.704 1.00 0.00 C ATOM 1046 O SER A 74 -0.046 -12.394 -1.539 1.00 0.00 O ATOM 1047 CB SER A 74 1.864 -11.945 -4.072 1.00 0.00 C ATOM 1048 OG SER A 74 0.868 -12.307 -5.024 1.00 0.00 O ATOM 0 H SER A 74 3.180 -10.090 -3.014 1.00 0.00 H new ATOM 0 HA SER A 74 0.371 -10.605 -3.340 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.686 -11.442 -4.581 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.274 -12.846 -3.616 1.00 0.00 H new ATOM 0 HG SER A 74 1.263 -12.890 -5.706 1.00 0.00 H new ATOM 1054 N ASN A 75 2.035 -11.858 -0.836 1.00 0.00 N ATOM 1055 CA ASN A 75 1.918 -12.581 0.419 1.00 0.00 C ATOM 1056 C ASN A 75 2.640 -11.804 1.521 1.00 0.00 C ATOM 1057 O ASN A 75 3.400 -12.381 2.297 1.00 0.00 O ATOM 1058 CB ASN A 75 2.559 -13.966 0.319 1.00 0.00 C ATOM 1059 CG ASN A 75 1.566 -14.993 -0.229 1.00 0.00 C ATOM 1060 OD1 ASN A 75 0.976 -15.774 0.499 1.00 0.00 O ATOM 1061 ND2 ASN A 75 1.415 -14.948 -1.549 1.00 0.00 N ATOM 0 H ASN A 75 2.930 -11.390 -0.977 1.00 0.00 H new ATOM 0 HA ASN A 75 0.858 -12.690 0.647 1.00 0.00 H new ATOM 0 HB2 ASN A 75 3.434 -13.919 -0.329 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.907 -14.281 1.303 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.774 -15.593 -2.011 1.00 0.00 H new ATOM 0 HD22 ASN A 75 1.940 -14.269 -2.100 1.00 0.00 H new ATOM 1068 N LEU A 76 2.379 -10.505 1.554 1.00 0.00 N ATOM 1069 CA LEU A 76 2.995 -9.642 2.547 1.00 0.00 C ATOM 1070 C LEU A 76 2.201 -9.726 3.852 1.00 0.00 C ATOM 1071 O LEU A 76 1.382 -10.627 4.028 1.00 0.00 O ATOM 1072 CB LEU A 76 3.139 -8.219 2.005 1.00 0.00 C ATOM 1073 CG LEU A 76 4.545 -7.809 1.562 1.00 0.00 C ATOM 1074 CD1 LEU A 76 4.609 -6.311 1.259 1.00 0.00 C ATOM 1075 CD2 LEU A 76 5.590 -8.229 2.597 1.00 0.00 C ATOM 0 H LEU A 76 1.749 -10.029 0.908 1.00 0.00 H new ATOM 0 HA LEU A 76 4.008 -9.978 2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.464 -8.105 1.156 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.804 -7.523 2.774 1.00 0.00 H new ATOM 0 HG LEU A 76 4.779 -8.335 0.636 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.619 -6.046 0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.907 -6.071 0.460 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.346 -5.747 2.154 1.00 0.00 H new ATOM 0 HD21 LEU A 76 6.580 -7.926 2.258 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.371 -7.749 3.551 1.00 0.00 H new ATOM 0 HD23 LEU A 76 5.565 -9.312 2.721 1.00 0.00 H new ATOM 1087 N ASP A 77 2.470 -8.774 4.734 1.00 0.00 N ATOM 1088 CA ASP A 77 1.790 -8.729 6.017 1.00 0.00 C ATOM 1089 C ASP A 77 1.276 -7.310 6.268 1.00 0.00 C ATOM 1090 O ASP A 77 1.632 -6.381 5.545 1.00 0.00 O ATOM 1091 CB ASP A 77 2.742 -9.095 7.158 1.00 0.00 C ATOM 1092 CG ASP A 77 2.127 -9.039 8.557 1.00 0.00 C ATOM 1093 OD1 ASP A 77 0.985 -9.530 8.695 1.00 0.00 O ATOM 1094 OD2 ASP A 77 2.811 -8.507 9.457 1.00 0.00 O ATOM 0 H ASP A 77 3.150 -8.028 4.585 1.00 0.00 H new ATOM 0 HA ASP A 77 0.969 -9.445 5.988 1.00 0.00 H new ATOM 0 HB2 ASP A 77 3.122 -10.102 6.985 1.00 0.00 H new ATOM 0 HB3 ASP A 77 3.598 -8.421 7.127 1.00 0.00 H new ATOM 1099 N HIS A 78 0.447 -7.188 7.294 1.00 0.00 N ATOM 1100 CA HIS A 78 -0.119 -5.898 7.649 1.00 0.00 C ATOM 1101 C HIS A 78 0.966 -5.011 8.262 1.00 0.00 C ATOM 1102 O HIS A 78 0.737 -3.830 8.518 1.00 0.00 O ATOM 1103 CB HIS A 78 -1.332 -6.070 8.566 1.00 0.00 C ATOM 1104 CG HIS A 78 -2.048 -4.780 8.886 1.00 0.00 C ATOM 1105 ND1 HIS A 78 -1.609 -3.901 9.860 1.00 0.00 N ATOM 1106 CD2 HIS A 78 -3.176 -4.231 8.351 1.00 0.00 C ATOM 1107 CE1 HIS A 78 -2.444 -2.872 9.902 1.00 0.00 C ATOM 1108 NE2 HIS A 78 -3.414 -3.079 8.966 1.00 0.00 N ATOM 0 H HIS A 78 0.154 -7.961 7.891 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.483 -5.398 6.751 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.036 -6.757 8.096 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.008 -6.534 9.497 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -3.774 -4.661 7.561 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.369 -2.020 10.561 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -4.194 -2.452 8.771 1.00 0.00 H new ATOM 1116 N LYS A 79 2.126 -5.615 8.479 1.00 0.00 N ATOM 1117 CA LYS A 79 3.248 -4.895 9.057 1.00 0.00 C ATOM 1118 C LYS A 79 4.322 -4.690 7.987 1.00 0.00 C ATOM 1119 O LYS A 79 5.003 -3.666 7.974 1.00 0.00 O ATOM 1120 CB LYS A 79 3.756 -5.612 10.309 1.00 0.00 C ATOM 1121 CG LYS A 79 2.680 -5.646 11.396 1.00 0.00 C ATOM 1122 CD LYS A 79 3.184 -4.996 12.687 1.00 0.00 C ATOM 1123 CE LYS A 79 2.242 -5.295 13.855 1.00 0.00 C ATOM 1124 NZ LYS A 79 2.902 -4.991 15.144 1.00 0.00 N ATOM 0 H LYS A 79 2.313 -6.595 8.265 1.00 0.00 H new ATOM 0 HA LYS A 79 2.936 -3.905 9.389 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.053 -6.629 10.054 1.00 0.00 H new ATOM 0 HB3 LYS A 79 4.644 -5.106 10.687 1.00 0.00 H new ATOM 0 HG2 LYS A 79 1.788 -5.125 11.047 1.00 0.00 H new ATOM 0 HG3 LYS A 79 2.390 -6.678 11.593 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.184 -5.364 12.918 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.266 -3.918 12.548 1.00 0.00 H new ATOM 0 HE2 LYS A 79 1.332 -4.703 13.757 1.00 0.00 H new ATOM 0 HE3 LYS A 79 1.944 -6.343 13.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.249 -5.200 15.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 3.757 -5.574 15.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.164 -3.985 15.171 1.00 0.00 H new ATOM 1138 N GLU A 80 4.441 -5.681 7.115 1.00 0.00 N ATOM 1139 CA GLU A 80 5.421 -5.622 6.044 1.00 0.00 C ATOM 1140 C GLU A 80 4.905 -4.748 4.900 1.00 0.00 C ATOM 1141 O GLU A 80 5.672 -4.010 4.284 1.00 0.00 O ATOM 1142 CB GLU A 80 5.774 -7.025 5.546 1.00 0.00 C ATOM 1143 CG GLU A 80 6.373 -7.872 6.671 1.00 0.00 C ATOM 1144 CD GLU A 80 7.823 -8.247 6.361 1.00 0.00 C ATOM 1145 OE1 GLU A 80 8.060 -8.706 5.223 1.00 0.00 O ATOM 1146 OE2 GLU A 80 8.663 -8.067 7.270 1.00 0.00 O ATOM 0 H GLU A 80 3.875 -6.529 7.129 1.00 0.00 H new ATOM 0 HA GLU A 80 6.333 -5.171 6.437 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.880 -7.512 5.156 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.484 -6.954 4.722 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.329 -7.320 7.610 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.780 -8.777 6.805 1.00 0.00 H new ATOM 1153 N ALA A 81 3.608 -4.860 4.650 1.00 0.00 N ATOM 1154 CA ALA A 81 2.981 -4.089 3.591 1.00 0.00 C ATOM 1155 C ALA A 81 2.922 -2.617 4.003 1.00 0.00 C ATOM 1156 O ALA A 81 2.922 -1.729 3.152 1.00 0.00 O ATOM 1157 CB ALA A 81 1.596 -4.666 3.291 1.00 0.00 C ATOM 0 H ALA A 81 2.975 -5.473 5.163 1.00 0.00 H new ATOM 0 HA ALA A 81 3.566 -4.151 2.674 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.125 -4.087 2.496 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.695 -5.704 2.974 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.980 -4.618 4.189 1.00 0.00 H new ATOM 1163 N VAL A 82 2.875 -2.403 5.310 1.00 0.00 N ATOM 1164 CA VAL A 82 2.817 -1.054 5.846 1.00 0.00 C ATOM 1165 C VAL A 82 4.237 -0.502 5.983 1.00 0.00 C ATOM 1166 O VAL A 82 4.477 0.676 5.723 1.00 0.00 O ATOM 1167 CB VAL A 82 2.044 -1.048 7.166 1.00 0.00 C ATOM 1168 CG1 VAL A 82 2.296 0.245 7.944 1.00 0.00 C ATOM 1169 CG2 VAL A 82 0.548 -1.262 6.927 1.00 0.00 C ATOM 0 H VAL A 82 2.876 -3.142 6.013 1.00 0.00 H new ATOM 0 HA VAL A 82 2.277 -0.396 5.165 1.00 0.00 H new ATOM 0 HB VAL A 82 2.408 -1.879 7.771 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.735 0.223 8.878 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.360 0.337 8.162 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.973 1.098 7.347 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.022 -1.253 7.882 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.163 -0.463 6.293 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.392 -2.222 6.435 1.00 0.00 H new ATOM 1179 N ASN A 83 5.142 -1.380 6.389 1.00 0.00 N ATOM 1180 CA ASN A 83 6.533 -0.995 6.563 1.00 0.00 C ATOM 1181 C ASN A 83 7.128 -0.621 5.204 1.00 0.00 C ATOM 1182 O ASN A 83 7.867 0.356 5.094 1.00 0.00 O ATOM 1183 CB ASN A 83 7.356 -2.150 7.138 1.00 0.00 C ATOM 1184 CG ASN A 83 8.816 -1.737 7.336 1.00 0.00 C ATOM 1185 OD1 ASN A 83 9.546 -1.783 6.226 1.00 0.00 O flip ATOM 1186 ND2 ASN A 83 9.250 -1.398 8.425 1.00 0.00 N flip ATOM 0 H ASN A 83 4.940 -2.357 6.603 1.00 0.00 H new ATOM 0 HA ASN A 83 6.566 -0.151 7.252 1.00 0.00 H new ATOM 0 HB2 ASN A 83 6.931 -2.465 8.091 1.00 0.00 H new ATOM 0 HB3 ASN A 83 7.305 -3.007 6.467 1.00 0.00 H new ATOM 0 HD21 ASN A 83 8.634 -1.385 9.238 1.00 0.00 H new ATOM 0 HD22 ASN A 83 10.229 -1.128 8.522 1.00 0.00 H new ATOM 1193 N VAL A 84 6.784 -1.419 4.204 1.00 0.00 N ATOM 1194 CA VAL A 84 7.275 -1.184 2.857 1.00 0.00 C ATOM 1195 C VAL A 84 6.553 0.026 2.259 1.00 0.00 C ATOM 1196 O VAL A 84 7.094 0.710 1.391 1.00 0.00 O ATOM 1197 CB VAL A 84 7.116 -2.450 2.013 1.00 0.00 C ATOM 1198 CG1 VAL A 84 7.477 -2.184 0.551 1.00 0.00 C ATOM 1199 CG2 VAL A 84 7.953 -3.597 2.585 1.00 0.00 C ATOM 0 H VAL A 84 6.171 -2.229 4.300 1.00 0.00 H new ATOM 0 HA VAL A 84 8.340 -0.952 2.875 1.00 0.00 H new ATOM 0 HB VAL A 84 6.068 -2.748 2.049 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.355 -3.100 -0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.821 -1.412 0.149 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.513 -1.850 0.487 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.823 -4.486 1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 84 9.005 -3.311 2.593 1.00 0.00 H new ATOM 0 HG23 VAL A 84 7.628 -3.812 3.603 1.00 0.00 H new ATOM 1209 N LEU A 85 5.343 0.254 2.748 1.00 0.00 N ATOM 1210 CA LEU A 85 4.542 1.369 2.273 1.00 0.00 C ATOM 1211 C LEU A 85 4.999 2.653 2.969 1.00 0.00 C ATOM 1212 O LEU A 85 5.098 3.704 2.338 1.00 0.00 O ATOM 1213 CB LEU A 85 3.051 1.072 2.450 1.00 0.00 C ATOM 1214 CG LEU A 85 2.397 0.242 1.343 1.00 0.00 C ATOM 1215 CD1 LEU A 85 0.992 -0.205 1.751 1.00 0.00 C ATOM 1216 CD2 LEU A 85 2.394 1.004 0.016 1.00 0.00 C ATOM 0 H LEU A 85 4.898 -0.315 3.468 1.00 0.00 H new ATOM 0 HA LEU A 85 4.690 1.515 1.203 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.915 0.550 3.397 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.519 2.020 2.529 1.00 0.00 H new ATOM 0 HG LEU A 85 2.991 -0.660 1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.549 -0.793 0.947 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.051 -0.812 2.654 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.373 0.671 1.943 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.924 0.392 -0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.837 1.934 0.131 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.420 1.230 -0.276 1.00 0.00 H new ATOM 1228 N LYS A 86 5.266 2.525 4.261 1.00 0.00 N ATOM 1229 CA LYS A 86 5.710 3.662 5.049 1.00 0.00 C ATOM 1230 C LYS A 86 7.220 3.837 4.876 1.00 0.00 C ATOM 1231 O LYS A 86 7.805 4.777 5.413 1.00 0.00 O ATOM 1232 CB LYS A 86 5.272 3.507 6.507 1.00 0.00 C ATOM 1233 CG LYS A 86 6.360 2.825 7.337 1.00 0.00 C ATOM 1234 CD LYS A 86 5.921 2.668 8.794 1.00 0.00 C ATOM 1235 CE LYS A 86 4.823 1.610 8.925 1.00 0.00 C ATOM 1236 NZ LYS A 86 4.667 1.197 10.338 1.00 0.00 N ATOM 0 H LYS A 86 5.183 1.652 4.781 1.00 0.00 H new ATOM 0 HA LYS A 86 5.239 4.579 4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.048 4.487 6.929 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.353 2.922 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.585 1.846 6.914 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.278 3.411 7.291 1.00 0.00 H new ATOM 0 HD2 LYS A 86 6.777 2.387 9.407 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.558 3.623 9.173 1.00 0.00 H new ATOM 0 HE2 LYS A 86 3.880 2.008 8.550 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.070 0.743 8.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 3.918 0.479 10.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 5.563 0.798 10.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 4.410 2.023 10.915 1.00 0.00 H new ATOM 1250 N SER A 87 7.809 2.918 4.125 1.00 0.00 N ATOM 1251 CA SER A 87 9.239 2.960 3.875 1.00 0.00 C ATOM 1252 C SER A 87 9.625 4.308 3.263 1.00 0.00 C ATOM 1253 O SER A 87 10.463 5.024 3.808 1.00 0.00 O ATOM 1254 CB SER A 87 9.671 1.816 2.954 1.00 0.00 C ATOM 1255 OG SER A 87 10.958 1.310 3.299 1.00 0.00 O ATOM 0 H SER A 87 7.321 2.140 3.681 1.00 0.00 H new ATOM 0 HA SER A 87 9.756 2.840 4.827 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.938 1.011 3.008 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.684 2.167 1.922 1.00 0.00 H new ATOM 0 HG SER A 87 11.197 0.581 2.690 1.00 0.00 H new ATOM 1261 N SER A 88 8.994 4.613 2.138 1.00 0.00 N ATOM 1262 CA SER A 88 9.261 5.863 1.446 1.00 0.00 C ATOM 1263 C SER A 88 7.949 6.604 1.181 1.00 0.00 C ATOM 1264 O SER A 88 6.899 6.217 1.691 1.00 0.00 O ATOM 1265 CB SER A 88 10.007 5.617 0.133 1.00 0.00 C ATOM 1266 OG SER A 88 10.870 6.700 -0.201 1.00 0.00 O ATOM 0 H SER A 88 8.299 4.017 1.689 1.00 0.00 H new ATOM 0 HA SER A 88 9.896 6.478 2.083 1.00 0.00 H new ATOM 0 HB2 SER A 88 10.591 4.700 0.214 1.00 0.00 H new ATOM 0 HB3 SER A 88 9.286 5.466 -0.671 1.00 0.00 H new ATOM 0 HG SER A 88 11.329 6.504 -1.044 1.00 0.00 H new ATOM 1272 N ARG A 89 8.052 7.656 0.382 1.00 0.00 N ATOM 1273 CA ARG A 89 6.887 8.455 0.043 1.00 0.00 C ATOM 1274 C ARG A 89 6.347 8.050 -1.330 1.00 0.00 C ATOM 1275 O ARG A 89 5.163 7.750 -1.472 1.00 0.00 O ATOM 1276 CB ARG A 89 7.227 9.947 0.029 1.00 0.00 C ATOM 1277 CG ARG A 89 8.059 10.331 1.254 1.00 0.00 C ATOM 1278 CD ARG A 89 7.195 10.358 2.517 1.00 0.00 C ATOM 1279 NE ARG A 89 7.350 11.658 3.208 1.00 0.00 N ATOM 1280 CZ ARG A 89 6.467 12.151 4.087 1.00 0.00 C ATOM 1281 NH1 ARG A 89 5.362 11.456 4.388 1.00 0.00 N ATOM 1282 NH2 ARG A 89 6.689 13.339 4.665 1.00 0.00 N ATOM 0 H ARG A 89 8.924 7.973 -0.040 1.00 0.00 H new ATOM 0 HA ARG A 89 6.128 8.274 0.804 1.00 0.00 H new ATOM 0 HB2 ARG A 89 7.778 10.190 -0.880 1.00 0.00 H new ATOM 0 HB3 ARG A 89 6.308 10.533 0.011 1.00 0.00 H new ATOM 0 HG2 ARG A 89 8.874 9.619 1.382 1.00 0.00 H new ATOM 0 HG3 ARG A 89 8.512 11.310 1.098 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.149 10.198 2.256 1.00 0.00 H new ATOM 0 HD3 ARG A 89 7.485 9.546 3.183 1.00 0.00 H new ATOM 0 HE ARG A 89 8.181 12.213 3.002 1.00 0.00 H new ATOM 0 HH11 ARG A 89 5.193 10.551 3.948 1.00 0.00 H new ATOM 0 HH12 ARG A 89 4.690 11.831 5.057 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.530 13.868 4.436 1.00 0.00 H new ATOM 0 HH22 ARG A 89 6.017 13.714 5.334 1.00 0.00 H new ATOM 1296 N SER A 90 7.242 8.053 -2.307 1.00 0.00 N ATOM 1297 CA SER A 90 6.871 7.689 -3.664 1.00 0.00 C ATOM 1298 C SER A 90 7.055 6.184 -3.871 1.00 0.00 C ATOM 1299 O SER A 90 8.182 5.691 -3.897 1.00 0.00 O ATOM 1300 CB SER A 90 7.694 8.471 -4.689 1.00 0.00 C ATOM 1301 OG SER A 90 8.255 9.656 -4.131 1.00 0.00 O ATOM 0 H SER A 90 8.224 8.302 -2.186 1.00 0.00 H new ATOM 0 HA SER A 90 5.821 7.944 -3.812 1.00 0.00 H new ATOM 0 HB2 SER A 90 8.494 7.837 -5.072 1.00 0.00 H new ATOM 0 HB3 SER A 90 7.062 8.734 -5.537 1.00 0.00 H new ATOM 0 HG SER A 90 8.774 10.126 -4.816 1.00 0.00 H new ATOM 1307 N LEU A 91 5.932 5.497 -4.014 1.00 0.00 N ATOM 1308 CA LEU A 91 5.955 4.058 -4.218 1.00 0.00 C ATOM 1309 C LEU A 91 5.013 3.695 -5.367 1.00 0.00 C ATOM 1310 O LEU A 91 3.998 4.359 -5.576 1.00 0.00 O ATOM 1311 CB LEU A 91 5.641 3.326 -2.911 1.00 0.00 C ATOM 1312 CG LEU A 91 6.543 3.661 -1.722 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.729 4.239 -0.562 1.00 0.00 C ATOM 1314 CD2 LEU A 91 7.364 2.442 -1.295 1.00 0.00 C ATOM 0 H LEU A 91 4.999 5.910 -3.993 1.00 0.00 H new ATOM 0 HA LEU A 91 6.953 3.731 -4.508 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.610 3.546 -2.633 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.700 2.253 -3.095 1.00 0.00 H new ATOM 0 HG LEU A 91 7.249 4.430 -2.035 1.00 0.00 H new ATOM 0 HD11 LEU A 91 6.394 4.469 0.270 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.228 5.150 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.985 3.510 -0.241 1.00 0.00 H new ATOM 0 HD21 LEU A 91 7.996 2.708 -0.448 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.692 1.634 -1.007 1.00 0.00 H new ATOM 0 HD23 LEU A 91 7.989 2.115 -2.126 1.00 0.00 H new ATOM 1326 N THR A 92 5.382 2.643 -6.083 1.00 0.00 N ATOM 1327 CA THR A 92 4.583 2.184 -7.206 1.00 0.00 C ATOM 1328 C THR A 92 3.776 0.945 -6.815 1.00 0.00 C ATOM 1329 O THR A 92 4.309 -0.163 -6.780 1.00 0.00 O ATOM 1330 CB THR A 92 5.523 1.948 -8.391 1.00 0.00 C ATOM 1331 OG1 THR A 92 6.053 3.240 -8.675 1.00 0.00 O ATOM 1332 CG2 THR A 92 4.771 1.565 -9.667 1.00 0.00 C ATOM 0 H THR A 92 6.224 2.095 -5.907 1.00 0.00 H new ATOM 0 HA THR A 92 3.848 2.933 -7.500 1.00 0.00 H new ATOM 0 HB THR A 92 6.235 1.162 -8.139 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.440 3.722 -9.269 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.484 1.409 -10.477 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.209 0.647 -9.496 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.083 2.366 -9.938 1.00 0.00 H new ATOM 1340 N ILE A 93 2.502 1.174 -6.530 1.00 0.00 N ATOM 1341 CA ILE A 93 1.616 0.089 -6.143 1.00 0.00 C ATOM 1342 C ILE A 93 0.974 -0.512 -7.395 1.00 0.00 C ATOM 1343 O ILE A 93 0.560 0.217 -8.295 1.00 0.00 O ATOM 1344 CB ILE A 93 0.601 0.572 -5.104 1.00 0.00 C ATOM 1345 CG1 ILE A 93 1.307 1.155 -3.878 1.00 0.00 C ATOM 1346 CG2 ILE A 93 -0.371 -0.547 -4.726 1.00 0.00 C ATOM 1347 CD1 ILE A 93 0.442 2.221 -3.202 1.00 0.00 C ATOM 0 H ILE A 93 2.063 2.094 -6.559 1.00 0.00 H new ATOM 0 HA ILE A 93 2.180 -0.709 -5.659 1.00 0.00 H new ATOM 0 HB ILE A 93 0.012 1.374 -5.549 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.529 0.358 -3.168 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.261 1.591 -4.176 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -1.081 -0.177 -3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.910 -0.876 -5.614 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.185 -1.386 -4.307 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.967 2.619 -2.334 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.242 3.028 -3.907 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -0.501 1.776 -2.883 1.00 0.00 H new ATOM 1359 N SER A 94 0.913 -1.835 -7.413 1.00 0.00 N ATOM 1360 CA SER A 94 0.330 -2.542 -8.540 1.00 0.00 C ATOM 1361 C SER A 94 -0.820 -3.431 -8.061 1.00 0.00 C ATOM 1362 O SER A 94 -0.590 -4.502 -7.501 1.00 0.00 O ATOM 1363 CB SER A 94 1.381 -3.381 -9.268 1.00 0.00 C ATOM 1364 OG SER A 94 1.599 -2.925 -10.601 1.00 0.00 O ATOM 0 H SER A 94 1.258 -2.436 -6.665 1.00 0.00 H new ATOM 0 HA SER A 94 -0.057 -1.804 -9.243 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.320 -3.346 -8.715 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.062 -4.423 -9.289 1.00 0.00 H new ATOM 0 HG SER A 94 2.278 -3.485 -11.032 1.00 0.00 H new ATOM 1370 N ILE A 95 -2.033 -2.955 -8.299 1.00 0.00 N ATOM 1371 CA ILE A 95 -3.219 -3.693 -7.900 1.00 0.00 C ATOM 1372 C ILE A 95 -3.789 -4.430 -9.113 1.00 0.00 C ATOM 1373 O ILE A 95 -3.266 -4.308 -10.220 1.00 0.00 O ATOM 1374 CB ILE A 95 -4.224 -2.763 -7.217 1.00 0.00 C ATOM 1375 CG1 ILE A 95 -4.461 -1.504 -8.053 1.00 0.00 C ATOM 1376 CG2 ILE A 95 -3.783 -2.430 -5.791 1.00 0.00 C ATOM 1377 CD1 ILE A 95 -5.951 -1.162 -8.120 1.00 0.00 C ATOM 0 H ILE A 95 -2.220 -2.066 -8.764 1.00 0.00 H new ATOM 0 HA ILE A 95 -2.965 -4.450 -7.158 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.178 -3.286 -7.144 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.911 -0.668 -7.621 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.073 -1.654 -9.061 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.515 -1.768 -5.329 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -3.707 -3.349 -5.210 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.812 -1.936 -5.817 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -6.091 -0.263 -8.720 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.494 -1.990 -8.575 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -6.330 -0.989 -7.113 1.00 0.00 H new ATOM 1389 N VAL A 96 -4.853 -5.179 -8.865 1.00 0.00 N ATOM 1390 CA VAL A 96 -5.499 -5.936 -9.923 1.00 0.00 C ATOM 1391 C VAL A 96 -6.918 -5.403 -10.133 1.00 0.00 C ATOM 1392 O VAL A 96 -7.835 -6.167 -10.429 1.00 0.00 O ATOM 1393 CB VAL A 96 -5.465 -7.430 -9.594 1.00 0.00 C ATOM 1394 CG1 VAL A 96 -6.249 -8.238 -10.630 1.00 0.00 C ATOM 1395 CG2 VAL A 96 -4.025 -7.934 -9.482 1.00 0.00 C ATOM 0 H VAL A 96 -5.284 -5.278 -7.946 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.962 -5.811 -10.863 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.946 -7.570 -8.626 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.209 -9.296 -10.372 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -7.287 -7.906 -10.640 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.810 -8.088 -11.616 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.029 -8.998 -9.248 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.508 -7.773 -10.428 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.510 -7.390 -8.690 1.00 0.00 H new ATOM 1405 N ALA A 97 -7.054 -4.095 -9.971 1.00 0.00 N ATOM 1406 CA ALA A 97 -8.345 -3.450 -10.139 1.00 0.00 C ATOM 1407 C ALA A 97 -9.418 -4.272 -9.420 1.00 0.00 C ATOM 1408 O ALA A 97 -9.972 -5.210 -9.991 1.00 0.00 O ATOM 1409 CB ALA A 97 -8.642 -3.282 -11.630 1.00 0.00 C ATOM 0 H ALA A 97 -6.291 -3.464 -9.725 1.00 0.00 H new ATOM 0 HA ALA A 97 -8.338 -2.455 -9.694 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -9.611 -2.798 -11.756 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.867 -2.668 -12.088 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.660 -4.261 -12.110 1.00 0.00 H new ATOM 1415 N ALA A 98 -9.678 -3.889 -8.179 1.00 0.00 N ATOM 1416 CA ALA A 98 -10.674 -4.578 -7.376 1.00 0.00 C ATOM 1417 C ALA A 98 -10.480 -6.089 -7.518 1.00 0.00 C ATOM 1418 O ALA A 98 -11.390 -6.798 -7.948 1.00 0.00 O ATOM 1419 CB ALA A 98 -12.073 -4.127 -7.801 1.00 0.00 C ATOM 0 H ALA A 98 -9.216 -3.110 -7.710 1.00 0.00 H new ATOM 0 HA ALA A 98 -10.557 -4.328 -6.321 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -12.820 -4.644 -7.199 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -12.169 -3.051 -7.654 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -12.228 -4.364 -8.854 1.00 0.00 H new ATOM 1425 N ALA A 99 -9.290 -6.538 -7.149 1.00 0.00 N ATOM 1426 CA ALA A 99 -8.965 -7.952 -7.230 1.00 0.00 C ATOM 1427 C ALA A 99 -9.907 -8.740 -6.318 1.00 0.00 C ATOM 1428 O ALA A 99 -10.806 -9.432 -6.795 1.00 0.00 O ATOM 1429 CB ALA A 99 -7.493 -8.160 -6.868 1.00 0.00 C ATOM 0 H ALA A 99 -8.538 -5.947 -6.793 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.105 -8.320 -8.246 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.250 -9.221 -6.929 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.865 -7.603 -7.564 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.314 -7.804 -5.853 1.00 0.00 H new ATOM 1435 N GLY A 100 -9.669 -8.610 -5.021 1.00 0.00 N ATOM 1436 CA GLY A 100 -10.485 -9.302 -4.037 1.00 0.00 C ATOM 1437 C GLY A 100 -11.463 -8.338 -3.361 1.00 0.00 C ATOM 1438 O GLY A 100 -11.463 -8.205 -2.138 1.00 0.00 O ATOM 0 H GLY A 100 -8.923 -8.036 -4.629 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -11.038 -10.108 -4.520 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.843 -9.761 -3.285 1.00 0.00 H new ATOM 1442 N ARG A 101 -12.272 -7.691 -4.187 1.00 0.00 N ATOM 1443 CA ARG A 101 -13.253 -6.744 -3.684 1.00 0.00 C ATOM 1444 C ARG A 101 -14.395 -7.484 -2.986 1.00 0.00 C ATOM 1445 O ARG A 101 -15.071 -6.920 -2.126 1.00 0.00 O ATOM 1446 CB ARG A 101 -13.824 -5.890 -4.818 1.00 0.00 C ATOM 1447 CG ARG A 101 -14.422 -6.768 -5.919 1.00 0.00 C ATOM 1448 CD ARG A 101 -15.573 -6.052 -6.628 1.00 0.00 C ATOM 1449 NE ARG A 101 -15.603 -6.435 -8.057 1.00 0.00 N ATOM 1450 CZ ARG A 101 -16.686 -6.331 -8.840 1.00 0.00 C ATOM 1451 NH1 ARG A 101 -17.833 -5.855 -8.336 1.00 0.00 N ATOM 1452 NH2 ARG A 101 -16.622 -6.703 -10.125 1.00 0.00 N ATOM 0 H ARG A 101 -12.268 -7.804 -5.201 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.750 -6.091 -2.971 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -14.590 -5.222 -4.424 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -13.038 -5.262 -5.236 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -13.649 -7.026 -6.643 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -14.781 -7.703 -5.489 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -16.520 -6.310 -6.154 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -15.453 -4.973 -6.535 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.746 -6.801 -8.472 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -17.881 -5.572 -7.357 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -18.657 -5.776 -8.931 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -15.749 -7.066 -10.508 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -17.446 -6.624 -10.721 1.00 0.00 H new ATOM 1466 N GLU A 102 -14.577 -8.735 -3.382 1.00 0.00 N ATOM 1467 CA GLU A 102 -15.627 -9.558 -2.805 1.00 0.00 C ATOM 1468 C GLU A 102 -15.474 -9.623 -1.284 1.00 0.00 C ATOM 1469 O GLU A 102 -16.446 -9.858 -0.568 1.00 0.00 O ATOM 1470 CB GLU A 102 -15.623 -10.960 -3.417 1.00 0.00 C ATOM 1471 CG GLU A 102 -14.314 -11.689 -3.110 1.00 0.00 C ATOM 1472 CD GLU A 102 -14.409 -13.169 -3.487 1.00 0.00 C ATOM 1473 OE1 GLU A 102 -15.129 -13.893 -2.766 1.00 0.00 O ATOM 1474 OE2 GLU A 102 -13.759 -13.543 -4.487 1.00 0.00 O ATOM 0 H GLU A 102 -14.015 -9.199 -4.096 1.00 0.00 H new ATOM 0 HA GLU A 102 -16.589 -9.100 -3.035 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -16.463 -11.534 -3.026 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -15.760 -10.890 -4.496 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -13.496 -11.222 -3.659 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -14.081 -11.594 -2.049 1.00 0.00 H new ATOM 1481 N LEU A 103 -14.246 -9.411 -0.835 1.00 0.00 N ATOM 1482 CA LEU A 103 -13.953 -9.442 0.588 1.00 0.00 C ATOM 1483 C LEU A 103 -14.847 -8.433 1.311 1.00 0.00 C ATOM 1484 O LEU A 103 -15.366 -8.718 2.389 1.00 0.00 O ATOM 1485 CB LEU A 103 -12.458 -9.226 0.833 1.00 0.00 C ATOM 1486 CG LEU A 103 -11.516 -10.212 0.140 1.00 0.00 C ATOM 1487 CD1 LEU A 103 -10.053 -9.853 0.408 1.00 0.00 C ATOM 1488 CD2 LEU A 103 -11.835 -11.653 0.546 1.00 0.00 C ATOM 0 H LEU A 103 -13.442 -9.217 -1.432 1.00 0.00 H new ATOM 0 HA LEU A 103 -14.181 -10.424 1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.199 -8.218 0.509 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -12.275 -9.273 1.907 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.675 -10.137 -0.936 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.404 -10.570 -0.096 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.849 -8.851 0.030 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.862 -9.882 1.481 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -11.151 -12.334 0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.721 -11.761 1.625 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.860 -11.892 0.264 1.00 0.00 H new ATOM 1500 N PHE A 104 -14.999 -7.273 0.688 1.00 0.00 N ATOM 1501 CA PHE A 104 -15.821 -6.219 1.258 1.00 0.00 C ATOM 1502 C PHE A 104 -17.172 -6.131 0.545 1.00 0.00 C ATOM 1503 O PHE A 104 -17.614 -5.043 0.177 1.00 0.00 O ATOM 1504 CB PHE A 104 -15.065 -4.904 1.059 1.00 0.00 C ATOM 1505 CG PHE A 104 -13.561 -5.006 1.318 1.00 0.00 C ATOM 1506 CD1 PHE A 104 -12.734 -5.478 0.347 1.00 0.00 C ATOM 1507 CD2 PHE A 104 -13.050 -4.624 2.519 1.00 0.00 C ATOM 1508 CE1 PHE A 104 -11.338 -5.573 0.587 1.00 0.00 C ATOM 1509 CE2 PHE A 104 -11.654 -4.719 2.760 1.00 0.00 C ATOM 1510 CZ PHE A 104 -10.827 -5.191 1.789 1.00 0.00 C ATOM 0 H PHE A 104 -14.567 -7.040 -0.206 1.00 0.00 H new ATOM 0 HA PHE A 104 -16.010 -6.423 2.312 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -15.225 -4.556 0.039 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -15.487 -4.150 1.723 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.139 -5.781 -0.607 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -13.706 -4.248 3.290 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -10.682 -5.948 -0.184 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -11.249 -4.416 3.714 1.00 0.00 H new ATOM 0 HZ PHE A 104 -9.765 -5.263 1.972 1.00 0.00 H new ATOM 1520 N MET A 105 -17.790 -7.290 0.370 1.00 0.00 N ATOM 1521 CA MET A 105 -19.081 -7.357 -0.293 1.00 0.00 C ATOM 1522 C MET A 105 -20.153 -6.627 0.519 1.00 0.00 C ATOM 1523 O MET A 105 -20.562 -7.100 1.579 1.00 0.00 O ATOM 1524 CB MET A 105 -19.486 -8.821 -0.475 1.00 0.00 C ATOM 1525 CG MET A 105 -19.194 -9.297 -1.899 1.00 0.00 C ATOM 1526 SD MET A 105 -20.611 -10.160 -2.558 1.00 0.00 S ATOM 1527 CE MET A 105 -21.174 -8.961 -3.755 1.00 0.00 C ATOM 0 H MET A 105 -17.420 -8.190 0.676 1.00 0.00 H new ATOM 0 HA MET A 105 -18.995 -6.871 -1.265 1.00 0.00 H new ATOM 0 HB2 MET A 105 -18.945 -9.443 0.238 1.00 0.00 H new ATOM 0 HB3 MET A 105 -20.548 -8.938 -0.259 1.00 0.00 H new ATOM 0 HG2 MET A 105 -18.950 -8.445 -2.533 1.00 0.00 H new ATOM 0 HG3 MET A 105 -18.325 -9.955 -1.900 1.00 0.00 H new ATOM 0 HE1 MET A 105 -22.060 -9.342 -4.263 1.00 0.00 H new ATOM 0 HE2 MET A 105 -21.420 -8.028 -3.248 1.00 0.00 H new ATOM 0 HE3 MET A 105 -20.386 -8.779 -4.486 1.00 0.00 H new ATOM 1537 N THR A 106 -20.577 -5.489 -0.008 1.00 0.00 N ATOM 1538 CA THR A 106 -21.594 -4.690 0.655 1.00 0.00 C ATOM 1539 C THR A 106 -21.101 -4.234 2.029 1.00 0.00 C ATOM 1540 O THR A 106 -20.324 -4.933 2.678 1.00 0.00 O ATOM 1541 CB THR A 106 -22.881 -5.515 0.713 1.00 0.00 C ATOM 1542 OG1 THR A 106 -23.254 -5.674 -0.653 1.00 0.00 O ATOM 1543 CG2 THR A 106 -24.046 -4.740 1.331 1.00 0.00 C ATOM 0 H THR A 106 -20.235 -5.100 -0.887 1.00 0.00 H new ATOM 0 HA THR A 106 -21.803 -3.776 0.100 1.00 0.00 H new ATOM 0 HB THR A 106 -22.704 -6.423 1.289 1.00 0.00 H new ATOM 0 HG1 THR A 106 -24.079 -6.200 -0.708 1.00 0.00 H new ATOM 0 HG21 THR A 106 -24.935 -5.371 1.348 1.00 0.00 H new ATOM 0 HG22 THR A 106 -23.789 -4.447 2.349 1.00 0.00 H new ATOM 0 HG23 THR A 106 -24.246 -3.848 0.737 1.00 0.00 H new ATOM 1551 N ASP A 107 -21.574 -3.064 2.434 1.00 0.00 N ATOM 1552 CA ASP A 107 -21.191 -2.506 3.720 1.00 0.00 C ATOM 1553 C ASP A 107 -21.945 -1.195 3.947 1.00 0.00 C ATOM 1554 O ASP A 107 -21.751 -0.228 3.212 1.00 0.00 O ATOM 1555 CB ASP A 107 -19.692 -2.204 3.765 1.00 0.00 C ATOM 1556 CG ASP A 107 -18.976 -2.671 5.034 1.00 0.00 C ATOM 1557 OD1 ASP A 107 -19.432 -3.687 5.602 1.00 0.00 O ATOM 1558 OD2 ASP A 107 -17.989 -2.001 5.408 1.00 0.00 O ATOM 0 H ASP A 107 -22.219 -2.487 1.894 1.00 0.00 H new ATOM 0 HA ASP A 107 -21.434 -3.237 4.491 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -19.216 -2.673 2.904 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -19.550 -1.128 3.661 1.00 0.00 H new ATOM 1563 N ARG A 108 -22.790 -1.204 4.968 1.00 0.00 N ATOM 1564 CA ARG A 108 -23.574 -0.027 5.301 1.00 0.00 C ATOM 1565 C ARG A 108 -22.672 1.066 5.879 1.00 0.00 C ATOM 1566 O ARG A 108 -23.000 2.249 5.806 1.00 0.00 O ATOM 1567 CB ARG A 108 -24.669 -0.364 6.315 1.00 0.00 C ATOM 1568 CG ARG A 108 -24.115 -1.214 7.459 1.00 0.00 C ATOM 1569 CD ARG A 108 -24.706 -0.780 8.802 1.00 0.00 C ATOM 1570 NE ARG A 108 -25.880 -1.618 9.133 1.00 0.00 N ATOM 1571 CZ ARG A 108 -26.813 -1.282 10.034 1.00 0.00 C ATOM 1572 NH1 ARG A 108 -26.715 -0.123 10.699 1.00 0.00 N ATOM 1573 NH2 ARG A 108 -27.844 -2.105 10.270 1.00 0.00 N ATOM 0 H ARG A 108 -22.949 -2.008 5.575 1.00 0.00 H new ATOM 0 HA ARG A 108 -24.041 0.331 4.384 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -25.095 0.556 6.715 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -25.477 -0.900 5.818 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -24.344 -2.265 7.280 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -23.029 -1.125 7.490 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -23.953 -0.868 9.585 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -24.999 0.269 8.758 1.00 0.00 H new ATOM 0 HE ARG A 108 -25.986 -2.507 8.645 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -25.930 0.503 10.519 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -27.425 0.133 11.385 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -27.918 -2.987 9.764 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -28.554 -1.849 10.956 1.00 0.00 H new ATOM 1587 N SER A 109 -21.554 0.630 6.441 1.00 0.00 N ATOM 1588 CA SER A 109 -20.602 1.556 7.031 1.00 0.00 C ATOM 1589 C SER A 109 -21.195 2.180 8.295 1.00 0.00 C ATOM 1590 O SER A 109 -20.865 1.772 9.407 1.00 0.00 O ATOM 1591 CB SER A 109 -20.207 2.648 6.035 1.00 0.00 C ATOM 1592 OG SER A 109 -18.876 2.477 5.556 1.00 0.00 O ATOM 0 H SER A 109 -21.286 -0.352 6.500 1.00 0.00 H new ATOM 0 HA SER A 109 -19.702 1.000 7.295 1.00 0.00 H new ATOM 0 HB2 SER A 109 -20.899 2.639 5.193 1.00 0.00 H new ATOM 0 HB3 SER A 109 -20.298 3.624 6.512 1.00 0.00 H new ATOM 0 HG SER A 109 -18.662 3.193 4.922 1.00 0.00 H new ATOM 1598 N GLY A 110 -22.061 3.161 8.083 1.00 0.00 N ATOM 1599 CA GLY A 110 -22.703 3.846 9.192 1.00 0.00 C ATOM 1600 C GLY A 110 -22.420 5.349 9.146 1.00 0.00 C ATOM 1601 O GLY A 110 -21.463 5.785 8.509 1.00 0.00 O ATOM 0 H GLY A 110 -22.333 3.498 7.159 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -23.779 3.674 9.157 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -22.345 3.434 10.135 1.00 0.00 H new ATOM 1605 N PRO A 111 -23.294 6.119 9.847 1.00 0.00 N ATOM 1606 CA PRO A 111 -23.148 7.564 9.892 1.00 0.00 C ATOM 1607 C PRO A 111 -21.996 7.971 10.814 1.00 0.00 C ATOM 1608 O PRO A 111 -21.113 8.727 10.413 1.00 0.00 O ATOM 1609 CB PRO A 111 -24.497 8.081 10.365 1.00 0.00 C ATOM 1610 CG PRO A 111 -25.196 6.895 11.009 1.00 0.00 C ATOM 1611 CD PRO A 111 -24.440 5.637 10.613 1.00 0.00 C ATOM 0 HA PRO A 111 -22.890 7.991 8.923 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -24.375 8.896 11.078 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -25.080 8.472 9.531 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -25.213 7.005 12.093 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -26.233 6.837 10.678 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -24.121 5.074 11.490 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -25.064 4.972 10.016 1.00 0.00 H new ATOM 1619 N SER A 112 -22.043 7.450 12.031 1.00 0.00 N ATOM 1620 CA SER A 112 -21.014 7.749 13.013 1.00 0.00 C ATOM 1621 C SER A 112 -20.969 9.254 13.282 1.00 0.00 C ATOM 1622 O SER A 112 -20.486 10.022 12.451 1.00 0.00 O ATOM 1623 CB SER A 112 -19.645 7.252 12.545 1.00 0.00 C ATOM 1624 OG SER A 112 -19.419 5.892 12.904 1.00 0.00 O ATOM 0 H SER A 112 -22.777 6.823 12.360 1.00 0.00 H new ATOM 0 HA SER A 112 -21.262 7.229 13.938 1.00 0.00 H new ATOM 0 HB2 SER A 112 -19.572 7.358 11.463 1.00 0.00 H new ATOM 0 HB3 SER A 112 -18.865 7.876 12.980 1.00 0.00 H new ATOM 0 HG SER A 112 -18.535 5.612 12.586 1.00 0.00 H new ATOM 1630 N SER A 113 -21.479 9.631 14.445 1.00 0.00 N ATOM 1631 CA SER A 113 -21.503 11.031 14.833 1.00 0.00 C ATOM 1632 C SER A 113 -20.441 11.296 15.902 1.00 0.00 C ATOM 1633 O SER A 113 -20.646 10.990 17.076 1.00 0.00 O ATOM 1634 CB SER A 113 -22.886 11.436 15.348 1.00 0.00 C ATOM 1635 OG SER A 113 -23.795 11.702 14.283 1.00 0.00 O ATOM 0 H SER A 113 -21.879 8.991 15.131 1.00 0.00 H new ATOM 0 HA SER A 113 -21.282 11.634 13.952 1.00 0.00 H new ATOM 0 HB2 SER A 113 -23.286 10.640 15.976 1.00 0.00 H new ATOM 0 HB3 SER A 113 -22.794 12.322 15.976 1.00 0.00 H new ATOM 0 HG SER A 113 -24.667 11.955 14.652 1.00 0.00 H new ATOM 1641 N GLY A 114 -19.328 11.861 15.457 1.00 0.00 N ATOM 1642 CA GLY A 114 -18.233 12.171 16.361 1.00 0.00 C ATOM 1643 C GLY A 114 -18.325 13.614 16.860 1.00 0.00 C ATOM 1644 O GLY A 114 -17.939 13.910 17.990 1.00 0.00 O ATOM 0 H GLY A 114 -19.161 12.112 14.483 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -18.253 11.487 17.210 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -17.282 12.019 15.851 1.00 0.00 H new TER 1648 GLY A 114