USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1086 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 19 MET CE :methyl -112:sc= -0.0544 (180deg=-1.2) USER MOD Set 1.2: A 115 MET CE :methyl -115:sc= -3.95! (180deg=-5.7!) USER MOD Set 2.1: A 110 HIS : no HD1:sc= 0 X(o=-0.22,f=-0.4) USER MOD Set 2.2: A 113 LYS NZ :NH3+ 139:sc= -0.223 (180deg=-1.02) USER MOD Set 3.1: A 55 LYS NZ :NH3+ -110:sc= 0.699 (180deg=0.0042) USER MOD Set 3.2: A 108 GLN : amide:sc= -4.92! K(o=-4.2!,f=-2) USER MOD Set 4.1: A 6 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 10 GLN : amide:sc= -0.828 X(o=-0.83,f=-0.54) 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 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -3.11! C(o=-3.1!,f=-4.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.73) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 170:sc= -0.261 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0468 USER MOD Single : A 44 ASN : amide:sc= -1.24 K(o=-1.2,f=-5.6!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot -179:sc= 0.521 USER MOD Single : A 67 GLN : amide:sc= -0.0124 X(o=-0.012,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 80 SER OG : rot 170:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -0.342 K(o=-0.34,f=-2.2) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot -86:sc= 0.0328 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 170:sc= 0 USER MOD Single : A 93 THR OG1 : rot 77:sc= 0.446 USER MOD Single : A 94 HIS : no HD1:sc= -0.213 X(o=-0.21,f=0) USER MOD Single : A 95 ASN : amide:sc= -1.31 X(o=-1.3,f=-1) USER MOD Single : A 97 LYS NZ :NH3+ -139:sc= 0.601 (180deg=-0.623) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -115:sc= 0.048 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot -32:sc= 0.903 USER MOD Single : A 119 SER OG : rot 180:sc= 0.0104 USER MOD Single : A 120 TYR OH : rot -13:sc= 0.906 USER MOD Single : A 126 SER OG : rot 165:sc= 0.0808 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 139:sc= -1.64 USER MOD Single : A 130 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.4!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.429 12.014 13.033 1.00 0.00 N ATOM 2 CA GLY A 1 -10.608 11.761 13.841 1.00 0.00 C ATOM 3 C GLY A 1 -11.610 12.897 13.775 1.00 0.00 C ATOM 4 O GLY A 1 -12.116 13.348 14.802 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.775 11.209 13.111 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.709 12.137 12.039 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.957 12.878 13.369 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -11.085 10.840 13.505 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.308 11.605 14.877 1.00 0.00 H new ATOM 8 N SER A 2 -11.897 13.361 12.563 1.00 0.00 N ATOM 9 CA SER A 2 -12.841 14.455 12.367 1.00 0.00 C ATOM 10 C SER A 2 -14.196 13.927 11.904 1.00 0.00 C ATOM 11 O SER A 2 -14.297 12.816 11.384 1.00 0.00 O ATOM 12 CB SER A 2 -12.293 15.453 11.345 1.00 0.00 C ATOM 13 OG SER A 2 -11.081 16.031 11.796 1.00 0.00 O ATOM 0 H SER A 2 -11.489 12.996 11.702 1.00 0.00 H new ATOM 0 HA SER A 2 -12.975 14.962 13.323 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.127 14.949 10.393 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.029 16.237 11.167 1.00 0.00 H new ATOM 0 HG SER A 2 -10.751 16.664 11.124 1.00 0.00 H new ATOM 19 N SER A 3 -15.235 14.733 12.097 1.00 0.00 N ATOM 20 CA SER A 3 -16.585 14.347 11.703 1.00 0.00 C ATOM 21 C SER A 3 -17.151 15.322 10.675 1.00 0.00 C ATOM 22 O SER A 3 -17.274 16.517 10.939 1.00 0.00 O ATOM 23 CB SER A 3 -17.500 14.291 12.928 1.00 0.00 C ATOM 24 OG SER A 3 -17.133 13.229 13.791 1.00 0.00 O ATOM 0 H SER A 3 -15.168 15.657 12.524 1.00 0.00 H new ATOM 0 HA SER A 3 -16.536 13.357 11.250 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.448 15.237 13.468 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.534 14.163 12.608 1.00 0.00 H new ATOM 0 HG SER A 3 -17.732 13.216 14.567 1.00 0.00 H new ATOM 30 N GLY A 4 -17.494 14.802 9.501 1.00 0.00 N ATOM 31 CA GLY A 4 -18.043 15.639 8.450 1.00 0.00 C ATOM 32 C GLY A 4 -19.432 15.205 8.029 1.00 0.00 C ATOM 33 O GLY A 4 -19.826 14.059 8.250 1.00 0.00 O ATOM 0 H GLY A 4 -17.402 13.816 9.259 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.077 16.673 8.794 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.380 15.613 7.585 1.00 0.00 H new ATOM 37 N SER A 5 -20.179 16.122 7.421 1.00 0.00 N ATOM 38 CA SER A 5 -21.535 15.829 6.973 1.00 0.00 C ATOM 39 C SER A 5 -21.518 14.921 5.748 1.00 0.00 C ATOM 40 O SER A 5 -22.227 13.916 5.696 1.00 0.00 O ATOM 41 CB SER A 5 -22.279 17.126 6.650 1.00 0.00 C ATOM 42 OG SER A 5 -23.465 16.866 5.920 1.00 0.00 O ATOM 0 H SER A 5 -19.867 17.074 7.228 1.00 0.00 H new ATOM 0 HA SER A 5 -22.054 15.312 7.780 1.00 0.00 H new ATOM 0 HB2 SER A 5 -22.525 17.648 7.575 1.00 0.00 H new ATOM 0 HB3 SER A 5 -21.631 17.787 6.074 1.00 0.00 H new ATOM 0 HG SER A 5 -23.923 17.711 5.728 1.00 0.00 H new ATOM 48 N SER A 6 -20.703 15.283 4.762 1.00 0.00 N ATOM 49 CA SER A 6 -20.595 14.503 3.534 1.00 0.00 C ATOM 50 C SER A 6 -20.532 13.010 3.842 1.00 0.00 C ATOM 51 O SER A 6 -21.285 12.217 3.280 1.00 0.00 O ATOM 52 CB SER A 6 -19.355 14.926 2.744 1.00 0.00 C ATOM 53 OG SER A 6 -19.463 14.546 1.383 1.00 0.00 O ATOM 0 H SER A 6 -20.108 16.111 4.789 1.00 0.00 H new ATOM 0 HA SER A 6 -21.483 14.694 2.932 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.226 16.006 2.814 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.467 14.470 3.183 1.00 0.00 H new ATOM 0 HG SER A 6 -18.659 14.829 0.900 1.00 0.00 H new ATOM 59 N GLY A 7 -19.626 12.635 4.740 1.00 0.00 N ATOM 60 CA GLY A 7 -19.480 11.239 5.108 1.00 0.00 C ATOM 61 C GLY A 7 -18.185 10.638 4.599 1.00 0.00 C ATOM 62 O GLY A 7 -17.277 11.360 4.188 1.00 0.00 O ATOM 0 H GLY A 7 -18.991 13.273 5.219 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -19.518 11.147 6.193 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.321 10.672 4.710 1.00 0.00 H new ATOM 66 N SER A 8 -18.098 9.312 4.627 1.00 0.00 N ATOM 67 CA SER A 8 -16.903 8.614 4.170 1.00 0.00 C ATOM 68 C SER A 8 -17.100 8.063 2.761 1.00 0.00 C ATOM 69 O SER A 8 -16.179 8.074 1.945 1.00 0.00 O ATOM 70 CB SER A 8 -16.552 7.476 5.131 1.00 0.00 C ATOM 71 OG SER A 8 -15.572 6.619 4.571 1.00 0.00 O ATOM 0 H SER A 8 -18.842 8.699 4.962 1.00 0.00 H new ATOM 0 HA SER A 8 -16.081 9.329 4.149 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.184 7.889 6.070 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.450 6.903 5.365 1.00 0.00 H new ATOM 0 HG SER A 8 -15.364 5.901 5.205 1.00 0.00 H new ATOM 77 N GLN A 9 -18.308 7.582 2.485 1.00 0.00 N ATOM 78 CA GLN A 9 -18.627 7.026 1.175 1.00 0.00 C ATOM 79 C GLN A 9 -18.073 7.907 0.060 1.00 0.00 C ATOM 80 O GLN A 9 -17.496 7.410 -0.907 1.00 0.00 O ATOM 81 CB GLN A 9 -20.140 6.874 1.017 1.00 0.00 C ATOM 82 CG GLN A 9 -20.567 6.449 -0.379 1.00 0.00 C ATOM 83 CD GLN A 9 -21.991 5.931 -0.422 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.476 5.334 0.540 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.670 6.157 -1.540 1.00 0.00 N ATOM 0 H GLN A 9 -19.081 7.566 3.150 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.161 6.043 1.102 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.500 6.139 1.737 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.619 7.822 1.262 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.472 7.297 -1.057 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.892 5.674 -0.741 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -22.229 6.656 -2.313 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.633 5.832 -1.626 1.00 0.00 H new ATOM 94 N GLN A 10 -18.253 9.216 0.203 1.00 0.00 N ATOM 95 CA GLN A 10 -17.772 10.166 -0.794 1.00 0.00 C ATOM 96 C GLN A 10 -16.248 10.165 -0.855 1.00 0.00 C ATOM 97 O GLN A 10 -15.661 10.213 -1.936 1.00 0.00 O ATOM 98 CB GLN A 10 -18.281 11.573 -0.475 1.00 0.00 C ATOM 99 CG GLN A 10 -19.686 11.842 -0.988 1.00 0.00 C ATOM 100 CD GLN A 10 -20.728 10.965 -0.323 1.00 0.00 C ATOM 101 OE1 GLN A 10 -21.336 11.351 0.676 1.00 0.00 O ATOM 102 NE2 GLN A 10 -20.941 9.776 -0.875 1.00 0.00 N ATOM 0 H GLN A 10 -18.728 9.643 0.998 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.157 9.860 -1.767 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.263 11.721 0.605 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.599 12.304 -0.908 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.936 12.889 -0.818 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.713 11.678 -2.065 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -20.415 9.496 -1.703 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.631 9.143 -0.471 1.00 0.00 H new ATOM 111 N ARG A 11 -15.614 10.112 0.311 1.00 0.00 N ATOM 112 CA ARG A 11 -14.158 10.107 0.390 1.00 0.00 C ATOM 113 C ARG A 11 -13.577 8.919 -0.372 1.00 0.00 C ATOM 114 O ARG A 11 -12.748 9.087 -1.266 1.00 0.00 O ATOM 115 CB ARG A 11 -13.705 10.061 1.850 1.00 0.00 C ATOM 116 CG ARG A 11 -12.302 10.604 2.069 1.00 0.00 C ATOM 117 CD ARG A 11 -12.091 11.035 3.512 1.00 0.00 C ATOM 118 NE ARG A 11 -10.717 11.463 3.760 1.00 0.00 N ATOM 119 CZ ARG A 11 -10.398 12.641 4.286 1.00 0.00 C ATOM 120 NH1 ARG A 11 -11.350 13.503 4.617 1.00 0.00 N ATOM 121 NH2 ARG A 11 -9.125 12.959 4.481 1.00 0.00 N ATOM 0 H ARG A 11 -16.085 10.072 1.215 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.791 11.026 -0.068 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.406 10.633 2.457 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -13.746 9.030 2.202 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -11.570 9.841 1.805 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.131 11.452 1.406 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -12.773 11.851 3.750 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.339 10.208 4.177 1.00 0.00 H new ATOM 0 HE ARG A 11 -9.961 10.823 3.516 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -12.330 13.263 4.468 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -11.102 14.406 5.021 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -8.390 12.299 4.227 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -8.881 13.863 4.885 1.00 0.00 H new ATOM 135 N VAL A 12 -14.018 7.718 -0.011 1.00 0.00 N ATOM 136 CA VAL A 12 -13.542 6.502 -0.659 1.00 0.00 C ATOM 137 C VAL A 12 -13.428 6.692 -2.168 1.00 0.00 C ATOM 138 O VAL A 12 -12.479 6.222 -2.795 1.00 0.00 O ATOM 139 CB VAL A 12 -14.475 5.311 -0.372 1.00 0.00 C ATOM 140 CG1 VAL A 12 -13.993 4.066 -1.102 1.00 0.00 C ATOM 141 CG2 VAL A 12 -14.570 5.057 1.125 1.00 0.00 C ATOM 0 H VAL A 12 -14.704 7.561 0.727 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.556 6.289 -0.247 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.471 5.556 -0.740 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.665 3.235 -0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -13.982 4.255 -2.175 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -12.987 3.815 -0.767 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.233 4.212 1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -13.579 4.833 1.520 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -14.966 5.944 1.620 1.00 0.00 H new ATOM 151 N LYS A 13 -14.403 7.386 -2.746 1.00 0.00 N ATOM 152 CA LYS A 13 -14.413 7.642 -4.181 1.00 0.00 C ATOM 153 C LYS A 13 -13.094 8.259 -4.634 1.00 0.00 C ATOM 154 O LYS A 13 -12.485 7.805 -5.602 1.00 0.00 O ATOM 155 CB LYS A 13 -15.575 8.569 -4.547 1.00 0.00 C ATOM 156 CG LYS A 13 -15.694 8.835 -6.037 1.00 0.00 C ATOM 157 CD LYS A 13 -16.354 7.673 -6.761 1.00 0.00 C ATOM 158 CE LYS A 13 -16.150 7.765 -8.265 1.00 0.00 C ATOM 159 NZ LYS A 13 -16.930 8.884 -8.863 1.00 0.00 N ATOM 0 H LYS A 13 -15.197 7.781 -2.242 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.542 6.689 -4.693 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.506 8.129 -4.189 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.450 9.518 -4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.274 9.743 -6.200 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.703 9.010 -6.456 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.942 6.733 -6.394 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.421 7.662 -6.537 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -15.091 7.905 -8.480 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.448 6.825 -8.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -16.764 8.913 -9.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -17.943 8.738 -8.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -16.628 9.784 -8.438 1.00 0.00 H new ATOM 173 N ARG A 14 -12.658 9.296 -3.925 1.00 0.00 N ATOM 174 CA ARG A 14 -11.411 9.976 -4.254 1.00 0.00 C ATOM 175 C ARG A 14 -10.337 8.972 -4.664 1.00 0.00 C ATOM 176 O ARG A 14 -9.727 9.100 -5.726 1.00 0.00 O ATOM 177 CB ARG A 14 -10.924 10.800 -3.061 1.00 0.00 C ATOM 178 CG ARG A 14 -11.503 12.205 -3.015 1.00 0.00 C ATOM 179 CD ARG A 14 -10.721 13.158 -3.906 1.00 0.00 C ATOM 180 NE ARG A 14 -11.000 14.556 -3.589 1.00 0.00 N ATOM 181 CZ ARG A 14 -12.014 15.240 -4.110 1.00 0.00 C ATOM 182 NH1 ARG A 14 -12.840 14.657 -4.967 1.00 0.00 N ATOM 183 NH2 ARG A 14 -12.202 16.509 -3.772 1.00 0.00 N ATOM 0 H ARG A 14 -13.150 9.683 -3.120 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.601 10.644 -5.094 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.184 10.279 -2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -9.836 10.865 -3.095 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -12.545 12.181 -3.332 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -11.491 12.572 -1.989 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -9.654 12.967 -3.793 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -10.971 12.966 -4.950 1.00 0.00 H new ATOM 0 HE ARG A 14 -10.383 15.034 -2.932 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -12.699 13.681 -5.228 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -13.617 15.184 -5.365 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -11.568 16.960 -3.112 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -12.980 17.033 -4.172 1.00 0.00 H new ATOM 197 N TRP A 15 -10.110 7.976 -3.815 1.00 0.00 N ATOM 198 CA TRP A 15 -9.109 6.951 -4.089 1.00 0.00 C ATOM 199 C TRP A 15 -9.390 6.257 -5.417 1.00 0.00 C ATOM 200 O TRP A 15 -8.476 5.996 -6.198 1.00 0.00 O ATOM 201 CB TRP A 15 -9.080 5.922 -2.958 1.00 0.00 C ATOM 202 CG TRP A 15 -9.319 6.520 -1.605 1.00 0.00 C ATOM 203 CD1 TRP A 15 -8.874 7.730 -1.153 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.058 5.935 -0.527 1.00 0.00 C ATOM 205 NE1 TRP A 15 -9.292 7.932 0.140 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.020 6.846 0.547 1.00 0.00 C ATOM 207 CE3 TRP A 15 -10.749 4.731 -0.366 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -10.647 6.588 1.763 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.370 4.477 0.842 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.316 5.401 1.894 1.00 0.00 C ATOM 0 H TRP A 15 -10.605 7.856 -2.931 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.136 7.437 -4.153 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -9.836 5.161 -3.150 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.113 5.418 -2.959 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.281 8.426 -1.728 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.092 8.757 0.705 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.797 4.012 -1.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -10.607 7.299 2.575 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.907 3.550 0.978 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -11.812 5.172 2.826 1.00 0.00 H new ATOM 221 N GLY A 16 -10.662 5.961 -5.669 1.00 0.00 N ATOM 222 CA GLY A 16 -11.040 5.300 -6.904 1.00 0.00 C ATOM 223 C GLY A 16 -10.386 5.926 -8.120 1.00 0.00 C ATOM 224 O GLY A 16 -10.173 5.259 -9.132 1.00 0.00 O ATOM 0 H GLY A 16 -11.437 6.168 -5.039 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.764 4.247 -6.848 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -12.123 5.340 -7.017 1.00 0.00 H new ATOM 228 N PHE A 17 -10.069 7.213 -8.022 1.00 0.00 N ATOM 229 CA PHE A 17 -9.438 7.931 -9.124 1.00 0.00 C ATOM 230 C PHE A 17 -8.023 7.415 -9.370 1.00 0.00 C ATOM 231 O PHE A 17 -7.635 7.152 -10.507 1.00 0.00 O ATOM 232 CB PHE A 17 -9.402 9.431 -8.829 1.00 0.00 C ATOM 233 CG PHE A 17 -10.731 10.108 -9.002 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.337 10.169 -10.247 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.376 10.685 -7.919 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.560 10.791 -10.409 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.600 11.308 -8.075 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.192 11.362 -9.322 1.00 0.00 C ATOM 0 H PHE A 17 -10.239 7.780 -7.191 1.00 0.00 H new ATOM 0 HA PHE A 17 -10.030 7.759 -10.023 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.056 9.584 -7.807 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.673 9.905 -9.487 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.847 9.725 -11.101 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.917 10.647 -6.942 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.021 10.831 -11.385 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.093 11.752 -7.223 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.147 11.850 -9.447 1.00 0.00 H new ATOM 248 N GLY A 18 -7.256 7.273 -8.293 1.00 0.00 N ATOM 249 CA GLY A 18 -5.892 6.791 -8.412 1.00 0.00 C ATOM 250 C GLY A 18 -5.164 6.776 -7.083 1.00 0.00 C ATOM 251 O GLY A 18 -5.651 7.327 -6.095 1.00 0.00 O ATOM 0 H GLY A 18 -7.555 7.483 -7.341 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.901 5.784 -8.829 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.347 7.422 -9.114 1.00 0.00 H new ATOM 255 N MET A 19 -3.996 6.144 -7.057 1.00 0.00 N ATOM 256 CA MET A 19 -3.200 6.059 -5.838 1.00 0.00 C ATOM 257 C MET A 19 -3.032 7.436 -5.202 1.00 0.00 C ATOM 258 O MET A 19 -3.202 7.596 -3.993 1.00 0.00 O ATOM 259 CB MET A 19 -1.828 5.453 -6.140 1.00 0.00 C ATOM 260 CG MET A 19 -1.176 4.795 -4.935 1.00 0.00 C ATOM 261 SD MET A 19 -0.057 3.458 -5.395 1.00 0.00 S ATOM 262 CE MET A 19 1.363 4.388 -5.969 1.00 0.00 C ATOM 0 H MET A 19 -3.579 5.683 -7.866 1.00 0.00 H new ATOM 0 HA MET A 19 -3.726 5.414 -5.134 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.933 4.714 -6.935 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.169 6.235 -6.517 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.625 5.546 -4.369 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.951 4.404 -4.275 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.477 4.251 -7.044 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.217 5.446 -5.751 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.260 4.033 -5.461 1.00 0.00 H new ATOM 272 N ASP A 20 -2.698 8.425 -6.023 1.00 0.00 N ATOM 273 CA ASP A 20 -2.508 9.788 -5.541 1.00 0.00 C ATOM 274 C ASP A 20 -3.583 10.160 -4.524 1.00 0.00 C ATOM 275 O ASP A 20 -3.278 10.506 -3.383 1.00 0.00 O ATOM 276 CB ASP A 20 -2.531 10.774 -6.710 1.00 0.00 C ATOM 277 CG ASP A 20 -2.363 12.211 -6.259 1.00 0.00 C ATOM 278 OD1 ASP A 20 -3.378 12.843 -5.898 1.00 0.00 O ATOM 279 OD2 ASP A 20 -1.216 12.704 -6.267 1.00 0.00 O ATOM 0 H ASP A 20 -2.553 8.308 -7.026 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.536 9.841 -5.051 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.735 10.521 -7.411 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.474 10.673 -7.248 1.00 0.00 H new ATOM 284 N GLU A 21 -4.841 10.086 -4.947 1.00 0.00 N ATOM 285 CA GLU A 21 -5.961 10.417 -4.074 1.00 0.00 C ATOM 286 C GLU A 21 -6.045 9.441 -2.904 1.00 0.00 C ATOM 287 O GLU A 21 -6.564 9.775 -1.839 1.00 0.00 O ATOM 288 CB GLU A 21 -7.273 10.401 -4.861 1.00 0.00 C ATOM 289 CG GLU A 21 -7.262 11.306 -6.081 1.00 0.00 C ATOM 290 CD GLU A 21 -7.760 12.705 -5.774 1.00 0.00 C ATOM 291 OE1 GLU A 21 -7.613 13.147 -4.616 1.00 0.00 O ATOM 292 OE2 GLU A 21 -8.299 13.357 -6.693 1.00 0.00 O ATOM 0 H GLU A 21 -5.110 9.800 -5.888 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.796 11.419 -3.678 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.484 9.380 -5.179 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.086 10.704 -4.202 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.248 11.364 -6.477 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.884 10.866 -6.861 1.00 0.00 H new ATOM 299 N ALA A 22 -5.530 8.233 -3.111 1.00 0.00 N ATOM 300 CA ALA A 22 -5.546 7.209 -2.074 1.00 0.00 C ATOM 301 C ALA A 22 -4.482 7.482 -1.016 1.00 0.00 C ATOM 302 O ALA A 22 -4.656 7.145 0.156 1.00 0.00 O ATOM 303 CB ALA A 22 -5.339 5.832 -2.689 1.00 0.00 C ATOM 0 H ALA A 22 -5.097 7.940 -3.987 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.521 7.236 -1.587 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.353 5.077 -1.903 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.138 5.628 -3.402 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.378 5.804 -3.202 1.00 0.00 H new ATOM 309 N LEU A 23 -3.381 8.095 -1.436 1.00 0.00 N ATOM 310 CA LEU A 23 -2.288 8.414 -0.524 1.00 0.00 C ATOM 311 C LEU A 23 -2.576 9.700 0.244 1.00 0.00 C ATOM 312 O LEU A 23 -2.558 9.720 1.474 1.00 0.00 O ATOM 313 CB LEU A 23 -0.976 8.552 -1.298 1.00 0.00 C ATOM 314 CG LEU A 23 -0.614 7.386 -2.219 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.335 7.847 -3.315 1.00 0.00 C ATOM 316 CD2 LEU A 23 0.004 6.248 -1.420 1.00 0.00 C ATOM 0 H LEU A 23 -3.221 8.381 -2.402 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.196 7.598 0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.025 9.461 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.167 8.687 -0.581 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.528 7.020 -2.688 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.582 7.004 -3.961 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.143 8.629 -3.905 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.247 8.239 -2.865 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.255 5.427 -2.091 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.908 6.601 -0.924 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.708 5.900 -0.672 1.00 0.00 H new ATOM 328 N LYS A 24 -2.845 10.774 -0.491 1.00 0.00 N ATOM 329 CA LYS A 24 -3.142 12.065 0.118 1.00 0.00 C ATOM 330 C LYS A 24 -3.984 11.890 1.378 1.00 0.00 C ATOM 331 O LYS A 24 -3.784 12.590 2.371 1.00 0.00 O ATOM 332 CB LYS A 24 -3.876 12.966 -0.877 1.00 0.00 C ATOM 333 CG LYS A 24 -5.302 12.526 -1.160 1.00 0.00 C ATOM 334 CD LYS A 24 -5.986 13.454 -2.150 1.00 0.00 C ATOM 335 CE LYS A 24 -6.416 14.755 -1.489 1.00 0.00 C ATOM 336 NZ LYS A 24 -6.782 15.792 -2.493 1.00 0.00 N ATOM 0 H LYS A 24 -2.863 10.776 -1.511 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.198 12.534 0.394 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.889 13.985 -0.490 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.319 12.988 -1.814 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.299 11.510 -1.555 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.869 12.504 -0.229 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.308 13.671 -2.975 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.857 12.956 -2.576 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.267 14.566 -0.835 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.607 15.128 -0.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.069 16.663 -2.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.962 15.991 -3.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.571 15.447 -3.077 1.00 0.00 H new ATOM 350 N ASP A 25 -4.924 10.953 1.331 1.00 0.00 N ATOM 351 CA ASP A 25 -5.795 10.685 2.470 1.00 0.00 C ATOM 352 C ASP A 25 -5.160 9.667 3.412 1.00 0.00 C ATOM 353 O ASP A 25 -4.488 8.727 2.987 1.00 0.00 O ATOM 354 CB ASP A 25 -7.155 10.176 1.990 1.00 0.00 C ATOM 355 CG ASP A 25 -7.983 11.264 1.335 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.827 11.474 0.114 1.00 0.00 O ATOM 357 OD2 ASP A 25 -8.787 11.905 2.044 1.00 0.00 O ATOM 0 H ASP A 25 -5.103 10.366 0.516 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.937 11.618 3.015 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.005 9.361 1.281 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.705 9.765 2.836 1.00 0.00 H new ATOM 362 N PRO A 26 -5.375 9.858 4.722 1.00 0.00 N ATOM 363 CA PRO A 26 -4.831 8.967 5.751 1.00 0.00 C ATOM 364 C PRO A 26 -5.498 7.596 5.742 1.00 0.00 C ATOM 365 O PRO A 26 -4.823 6.566 5.714 1.00 0.00 O ATOM 366 CB PRO A 26 -5.141 9.703 7.057 1.00 0.00 C ATOM 367 CG PRO A 26 -6.320 10.557 6.740 1.00 0.00 C ATOM 368 CD PRO A 26 -6.165 10.958 5.299 1.00 0.00 C ATOM 0 HA PRO A 26 -3.770 8.768 5.599 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.364 9.003 7.862 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.293 10.305 7.383 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.250 10.011 6.895 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.353 11.433 7.388 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.131 11.061 4.805 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.653 11.915 5.201 1.00 0.00 H new ATOM 376 N VAL A 27 -6.827 7.589 5.765 1.00 0.00 N ATOM 377 CA VAL A 27 -7.585 6.343 5.757 1.00 0.00 C ATOM 378 C VAL A 27 -7.342 5.560 4.472 1.00 0.00 C ATOM 379 O VAL A 27 -7.127 4.349 4.502 1.00 0.00 O ATOM 380 CB VAL A 27 -9.096 6.605 5.907 1.00 0.00 C ATOM 381 CG1 VAL A 27 -9.874 5.300 5.827 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.383 7.327 7.215 1.00 0.00 C ATOM 0 H VAL A 27 -7.401 8.432 5.789 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.239 5.756 6.608 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.420 7.245 5.086 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -10.939 5.504 5.935 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.691 4.826 4.863 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -9.550 4.633 6.626 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.455 7.504 7.305 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.045 6.714 8.051 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.855 8.281 7.228 1.00 0.00 H new ATOM 392 N GLY A 28 -7.377 6.260 3.342 1.00 0.00 N ATOM 393 CA GLY A 28 -7.158 5.614 2.061 1.00 0.00 C ATOM 394 C GLY A 28 -5.841 4.866 2.007 1.00 0.00 C ATOM 395 O GLY A 28 -5.707 3.884 1.276 1.00 0.00 O ATOM 0 H GLY A 28 -7.553 7.263 3.291 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -7.975 4.920 1.863 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.179 6.364 1.271 1.00 0.00 H new ATOM 399 N ARG A 29 -4.866 5.331 2.780 1.00 0.00 N ATOM 400 CA ARG A 29 -3.552 4.701 2.815 1.00 0.00 C ATOM 401 C ARG A 29 -3.634 3.306 3.428 1.00 0.00 C ATOM 402 O ARG A 29 -3.151 2.334 2.848 1.00 0.00 O ATOM 403 CB ARG A 29 -2.570 5.562 3.612 1.00 0.00 C ATOM 404 CG ARG A 29 -1.799 6.555 2.757 1.00 0.00 C ATOM 405 CD ARG A 29 -0.728 7.271 3.565 1.00 0.00 C ATOM 406 NE ARG A 29 0.190 6.335 4.209 1.00 0.00 N ATOM 407 CZ ARG A 29 0.963 6.656 5.241 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.929 7.883 5.742 1.00 0.00 N ATOM 409 NH2 ARG A 29 1.772 5.749 5.773 1.00 0.00 N ATOM 0 H ARG A 29 -4.961 6.142 3.391 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.194 4.609 1.789 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.118 6.106 4.381 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -1.862 4.911 4.125 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.336 6.033 1.919 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.489 7.287 2.336 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.166 7.938 2.911 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.202 7.894 4.324 1.00 0.00 H new ATOM 0 HE ARG A 29 0.240 5.383 3.847 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.309 8.583 5.335 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.523 8.127 6.534 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.801 4.804 5.390 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.365 5.997 6.565 1.00 0.00 H new ATOM 423 N GLU A 30 -4.248 3.216 4.603 1.00 0.00 N ATOM 424 CA GLU A 30 -4.391 1.940 5.294 1.00 0.00 C ATOM 425 C GLU A 30 -5.388 1.039 4.571 1.00 0.00 C ATOM 426 O GLU A 30 -5.141 -0.152 4.386 1.00 0.00 O ATOM 427 CB GLU A 30 -4.845 2.165 6.738 1.00 0.00 C ATOM 428 CG GLU A 30 -6.352 2.271 6.894 1.00 0.00 C ATOM 429 CD GLU A 30 -6.775 2.524 8.328 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.236 3.466 8.947 1.00 0.00 O ATOM 431 OE2 GLU A 30 -7.643 1.782 8.831 1.00 0.00 O ATOM 0 H GLU A 30 -4.654 4.011 5.096 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.419 1.447 5.299 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.481 1.344 7.356 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.384 3.077 7.117 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -6.723 3.078 6.262 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.816 1.350 6.540 1.00 0.00 H new ATOM 438 N GLN A 31 -6.514 1.617 4.166 1.00 0.00 N ATOM 439 CA GLN A 31 -7.549 0.866 3.465 1.00 0.00 C ATOM 440 C GLN A 31 -6.979 0.180 2.228 1.00 0.00 C ATOM 441 O GLN A 31 -7.011 -1.046 2.116 1.00 0.00 O ATOM 442 CB GLN A 31 -8.698 1.793 3.065 1.00 0.00 C ATOM 443 CG GLN A 31 -9.709 2.024 4.177 1.00 0.00 C ATOM 444 CD GLN A 31 -10.411 0.750 4.602 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.090 0.106 3.802 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.252 0.379 5.867 1.00 0.00 N ATOM 0 H GLN A 31 -6.733 2.603 4.311 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.928 0.100 4.141 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.287 2.753 2.753 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.211 1.370 2.201 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.203 2.460 5.038 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.451 2.749 3.843 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.680 0.943 6.496 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.702 -0.470 6.210 1.00 0.00 H new ATOM 455 N PHE A 32 -6.459 0.977 1.301 1.00 0.00 N ATOM 456 CA PHE A 32 -5.884 0.446 0.071 1.00 0.00 C ATOM 457 C PHE A 32 -4.809 -0.592 0.378 1.00 0.00 C ATOM 458 O PHE A 32 -4.638 -1.563 -0.361 1.00 0.00 O ATOM 459 CB PHE A 32 -5.290 1.578 -0.769 1.00 0.00 C ATOM 460 CG PHE A 32 -4.208 1.125 -1.707 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.472 0.179 -2.685 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.927 1.644 -1.612 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.479 -0.241 -3.549 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.929 1.228 -2.473 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.206 0.285 -3.444 1.00 0.00 C ATOM 0 H PHE A 32 -6.424 1.993 1.378 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.681 -0.037 -0.494 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.087 2.048 -1.346 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.886 2.341 -0.103 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.466 -0.235 -2.773 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.705 2.383 -0.856 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.698 -0.980 -4.306 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.934 1.639 -2.387 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.429 -0.040 -4.120 1.00 0.00 H new ATOM 475 N LEU A 33 -4.086 -0.381 1.472 1.00 0.00 N ATOM 476 CA LEU A 33 -3.026 -1.298 1.878 1.00 0.00 C ATOM 477 C LEU A 33 -3.597 -2.667 2.233 1.00 0.00 C ATOM 478 O LEU A 33 -3.213 -3.683 1.652 1.00 0.00 O ATOM 479 CB LEU A 33 -2.260 -0.727 3.072 1.00 0.00 C ATOM 480 CG LEU A 33 -1.468 -1.735 3.906 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.066 -1.910 3.342 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.409 -1.294 5.361 1.00 0.00 C ATOM 0 H LEU A 33 -4.214 0.417 2.094 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.341 -1.417 1.038 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.570 0.033 2.706 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.971 -0.223 3.727 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.978 -2.697 3.860 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.483 -2.631 3.948 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.129 -2.272 2.316 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.454 -0.952 3.357 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.842 -2.023 5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.923 -0.321 5.427 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.421 -1.222 5.761 1.00 0.00 H new ATOM 494 N LYS A 34 -4.519 -2.688 3.190 1.00 0.00 N ATOM 495 CA LYS A 34 -5.147 -3.931 3.622 1.00 0.00 C ATOM 496 C LYS A 34 -5.310 -4.894 2.450 1.00 0.00 C ATOM 497 O LYS A 34 -4.717 -5.973 2.433 1.00 0.00 O ATOM 498 CB LYS A 34 -6.511 -3.645 4.254 1.00 0.00 C ATOM 499 CG LYS A 34 -6.445 -2.700 5.441 1.00 0.00 C ATOM 500 CD LYS A 34 -7.545 -2.992 6.448 1.00 0.00 C ATOM 501 CE LYS A 34 -7.590 -1.941 7.546 1.00 0.00 C ATOM 502 NZ LYS A 34 -6.734 -2.313 8.706 1.00 0.00 N ATOM 0 H LYS A 34 -4.848 -1.857 3.682 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.500 -4.397 4.365 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.170 -3.219 3.498 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -6.958 -4.586 4.574 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.473 -2.791 5.926 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.533 -1.671 5.093 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.507 -3.027 5.937 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.383 -3.975 6.890 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.261 -0.982 7.145 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.619 -1.810 7.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.792 -1.571 9.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.063 -3.215 9.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.748 -2.413 8.392 1.00 0.00 H new ATOM 516 N PHE A 35 -6.116 -4.496 1.471 1.00 0.00 N ATOM 517 CA PHE A 35 -6.356 -5.324 0.295 1.00 0.00 C ATOM 518 C PHE A 35 -5.057 -5.949 -0.204 1.00 0.00 C ATOM 519 O PHE A 35 -5.010 -7.137 -0.528 1.00 0.00 O ATOM 520 CB PHE A 35 -6.995 -4.491 -0.819 1.00 0.00 C ATOM 521 CG PHE A 35 -6.890 -5.126 -2.177 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.616 -6.265 -2.481 1.00 0.00 C ATOM 523 CD2 PHE A 35 -6.065 -4.582 -3.148 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.523 -6.851 -3.730 1.00 0.00 C ATOM 525 CE2 PHE A 35 -5.968 -5.163 -4.398 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.696 -6.300 -4.689 1.00 0.00 C ATOM 0 H PHE A 35 -6.614 -3.606 1.469 1.00 0.00 H new ATOM 0 HA PHE A 35 -7.039 -6.125 0.578 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -8.047 -4.329 -0.583 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.520 -3.511 -0.847 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.263 -6.701 -1.734 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.492 -3.694 -2.926 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.096 -7.738 -3.955 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.323 -4.728 -5.147 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.619 -6.757 -5.664 1.00 0.00 H new ATOM 536 N LEU A 36 -4.003 -5.142 -0.265 1.00 0.00 N ATOM 537 CA LEU A 36 -2.702 -5.615 -0.725 1.00 0.00 C ATOM 538 C LEU A 36 -2.227 -6.800 0.111 1.00 0.00 C ATOM 539 O LEU A 36 -1.863 -7.844 -0.428 1.00 0.00 O ATOM 540 CB LEU A 36 -1.674 -4.485 -0.659 1.00 0.00 C ATOM 541 CG LEU A 36 -2.044 -3.197 -1.396 1.00 0.00 C ATOM 542 CD1 LEU A 36 -1.048 -2.093 -1.075 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.108 -3.441 -2.896 1.00 0.00 C ATOM 0 H LEU A 36 -4.024 -4.157 -0.002 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.807 -5.942 -1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.497 -4.242 0.389 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.732 -4.854 -1.064 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.030 -2.878 -1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.328 -1.184 -1.608 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.052 -1.900 -0.002 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.050 -2.403 -1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.373 -2.514 -3.404 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.136 -3.785 -3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.861 -4.199 -3.109 1.00 0.00 H new ATOM 555 N GLU A 37 -2.235 -6.629 1.429 1.00 0.00 N ATOM 556 CA GLU A 37 -1.806 -7.685 2.338 1.00 0.00 C ATOM 557 C GLU A 37 -2.280 -9.050 1.849 1.00 0.00 C ATOM 558 O GLU A 37 -1.557 -10.042 1.947 1.00 0.00 O ATOM 559 CB GLU A 37 -2.340 -7.422 3.748 1.00 0.00 C ATOM 560 CG GLU A 37 -1.896 -6.090 4.329 1.00 0.00 C ATOM 561 CD GLU A 37 -2.584 -5.768 5.641 1.00 0.00 C ATOM 562 OE1 GLU A 37 -3.709 -6.266 5.859 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.999 -5.018 6.450 1.00 0.00 O ATOM 0 H GLU A 37 -2.534 -5.770 1.891 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.716 -7.687 2.364 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.429 -7.454 3.727 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.010 -8.225 4.408 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.817 -6.107 4.483 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.103 -5.297 3.610 1.00 0.00 H new ATOM 570 N SER A 38 -3.500 -9.093 1.322 1.00 0.00 N ATOM 571 CA SER A 38 -4.073 -10.336 0.821 1.00 0.00 C ATOM 572 C SER A 38 -3.194 -10.939 -0.270 1.00 0.00 C ATOM 573 O SER A 38 -2.676 -12.045 -0.124 1.00 0.00 O ATOM 574 CB SER A 38 -5.482 -10.091 0.279 1.00 0.00 C ATOM 575 OG SER A 38 -6.397 -9.839 1.332 1.00 0.00 O ATOM 0 H SER A 38 -4.110 -8.281 1.231 1.00 0.00 H new ATOM 0 HA SER A 38 -4.128 -11.041 1.650 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.469 -9.244 -0.406 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.811 -10.959 -0.293 1.00 0.00 H new ATOM 0 HG SER A 38 -7.290 -9.684 0.959 1.00 0.00 H new ATOM 581 N GLU A 39 -3.031 -10.202 -1.364 1.00 0.00 N ATOM 582 CA GLU A 39 -2.216 -10.664 -2.482 1.00 0.00 C ATOM 583 C GLU A 39 -0.734 -10.645 -2.118 1.00 0.00 C ATOM 584 O GLU A 39 0.124 -10.949 -2.947 1.00 0.00 O ATOM 585 CB GLU A 39 -2.460 -9.792 -3.715 1.00 0.00 C ATOM 586 CG GLU A 39 -2.393 -8.301 -3.430 1.00 0.00 C ATOM 587 CD GLU A 39 -3.753 -7.704 -3.123 1.00 0.00 C ATOM 588 OE1 GLU A 39 -4.585 -8.407 -2.511 1.00 0.00 O ATOM 589 OE2 GLU A 39 -3.986 -6.535 -3.495 1.00 0.00 O ATOM 0 H GLU A 39 -3.452 -9.283 -1.500 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.505 -11.690 -2.709 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -1.722 -10.041 -4.477 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.439 -10.030 -4.130 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.725 -8.126 -2.587 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.962 -7.789 -4.290 1.00 0.00 H new ATOM 596 N PHE A 40 -0.441 -10.286 -0.872 1.00 0.00 N ATOM 597 CA PHE A 40 0.937 -10.225 -0.398 1.00 0.00 C ATOM 598 C PHE A 40 1.764 -9.268 -1.250 1.00 0.00 C ATOM 599 O PHE A 40 2.914 -9.552 -1.584 1.00 0.00 O ATOM 600 CB PHE A 40 1.567 -11.619 -0.419 1.00 0.00 C ATOM 601 CG PHE A 40 0.851 -12.614 0.450 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.237 -13.321 -0.036 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.267 -12.842 1.752 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.898 -14.236 0.762 1.00 0.00 C ATOM 605 CE2 PHE A 40 0.610 -13.757 2.554 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.473 -14.455 2.058 1.00 0.00 C ATOM 0 H PHE A 40 -1.139 -10.033 -0.173 1.00 0.00 H new ATOM 0 HA PHE A 40 0.926 -9.853 0.627 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.580 -11.988 -1.445 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.605 -11.545 -0.094 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.572 -13.155 -1.049 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.114 -12.299 2.145 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.746 -14.779 0.372 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.944 -13.925 3.567 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.987 -15.171 2.682 1.00 0.00 H new ATOM 616 N SER A 41 1.169 -8.132 -1.600 1.00 0.00 N ATOM 617 CA SER A 41 1.849 -7.133 -2.417 1.00 0.00 C ATOM 618 C SER A 41 2.156 -5.881 -1.602 1.00 0.00 C ATOM 619 O SER A 41 3.031 -5.093 -1.960 1.00 0.00 O ATOM 620 CB SER A 41 0.992 -6.768 -3.631 1.00 0.00 C ATOM 621 OG SER A 41 -0.260 -6.238 -3.230 1.00 0.00 O ATOM 0 H SER A 41 0.218 -7.880 -1.331 1.00 0.00 H new ATOM 0 HA SER A 41 2.791 -7.561 -2.761 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.519 -6.039 -4.246 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.835 -7.652 -4.249 1.00 0.00 H new ATOM 0 HG SER A 41 -0.722 -5.865 -4.010 1.00 0.00 H new ATOM 627 N SER A 42 1.428 -5.705 -0.503 1.00 0.00 N ATOM 628 CA SER A 42 1.619 -4.547 0.362 1.00 0.00 C ATOM 629 C SER A 42 3.094 -4.166 0.443 1.00 0.00 C ATOM 630 O SER A 42 3.444 -2.986 0.412 1.00 0.00 O ATOM 631 CB SER A 42 1.078 -4.837 1.764 1.00 0.00 C ATOM 632 OG SER A 42 1.900 -5.769 2.445 1.00 0.00 O ATOM 0 H SER A 42 0.701 -6.349 -0.191 1.00 0.00 H new ATOM 0 HA SER A 42 1.069 -3.710 -0.067 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.023 -3.910 2.335 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.063 -5.227 1.692 1.00 0.00 H new ATOM 0 HG SER A 42 1.534 -5.936 3.339 1.00 0.00 H new ATOM 638 N GLU A 43 3.955 -5.174 0.546 1.00 0.00 N ATOM 639 CA GLU A 43 5.392 -4.945 0.632 1.00 0.00 C ATOM 640 C GLU A 43 5.810 -3.775 -0.254 1.00 0.00 C ATOM 641 O GLU A 43 6.565 -2.901 0.170 1.00 0.00 O ATOM 642 CB GLU A 43 6.157 -6.206 0.225 1.00 0.00 C ATOM 643 CG GLU A 43 5.831 -6.690 -1.177 1.00 0.00 C ATOM 644 CD GLU A 43 6.592 -7.947 -1.553 1.00 0.00 C ATOM 645 OE1 GLU A 43 7.040 -8.665 -0.635 1.00 0.00 O ATOM 646 OE2 GLU A 43 6.740 -8.212 -2.764 1.00 0.00 O ATOM 0 H GLU A 43 3.682 -6.156 0.572 1.00 0.00 H new ATOM 0 HA GLU A 43 5.634 -4.700 1.666 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.227 -6.009 0.293 1.00 0.00 H new ATOM 0 HB3 GLU A 43 5.934 -7.001 0.936 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.761 -6.882 -1.251 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.064 -5.901 -1.893 1.00 0.00 H new ATOM 653 N ASN A 44 5.315 -3.767 -1.487 1.00 0.00 N ATOM 654 CA ASN A 44 5.637 -2.706 -2.434 1.00 0.00 C ATOM 655 C ASN A 44 5.296 -1.337 -1.854 1.00 0.00 C ATOM 656 O ASN A 44 6.124 -0.425 -1.855 1.00 0.00 O ATOM 657 CB ASN A 44 4.881 -2.919 -3.747 1.00 0.00 C ATOM 658 CG ASN A 44 5.325 -4.174 -4.473 1.00 0.00 C ATOM 659 OD1 ASN A 44 6.035 -5.010 -3.913 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.908 -4.312 -5.726 1.00 0.00 N ATOM 0 H ASN A 44 4.689 -4.484 -1.854 1.00 0.00 H new ATOM 0 HA ASN A 44 6.709 -2.741 -2.630 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.812 -2.980 -3.542 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.032 -2.055 -4.394 1.00 0.00 H new ATOM 0 HD21 ASN A 44 5.175 -5.136 -6.264 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.321 -3.594 -6.150 1.00 0.00 H new ATOM 667 N LEU A 45 4.071 -1.199 -1.358 1.00 0.00 N ATOM 668 CA LEU A 45 3.619 0.058 -0.773 1.00 0.00 C ATOM 669 C LEU A 45 4.342 0.339 0.540 1.00 0.00 C ATOM 670 O LEU A 45 5.006 1.366 0.687 1.00 0.00 O ATOM 671 CB LEU A 45 2.108 0.020 -0.538 1.00 0.00 C ATOM 672 CG LEU A 45 1.513 1.219 0.202 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.638 2.480 -0.638 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.058 0.956 0.560 1.00 0.00 C ATOM 0 H LEU A 45 3.373 -1.943 -1.349 1.00 0.00 H new ATOM 0 HA LEU A 45 3.852 0.860 -1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.612 -0.067 -1.505 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.871 -0.883 0.025 1.00 0.00 H new ATOM 0 HG LEU A 45 2.073 1.366 1.126 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.209 3.323 -0.095 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.690 2.678 -0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.104 2.345 -1.579 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.349 1.820 1.086 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.515 0.782 -0.351 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.006 0.077 1.202 1.00 0.00 H new ATOM 686 N ARG A 46 4.210 -0.580 1.491 1.00 0.00 N ATOM 687 CA ARG A 46 4.852 -0.431 2.791 1.00 0.00 C ATOM 688 C ARG A 46 6.211 0.249 2.652 1.00 0.00 C ATOM 689 O ARG A 46 6.527 1.184 3.388 1.00 0.00 O ATOM 690 CB ARG A 46 5.019 -1.797 3.460 1.00 0.00 C ATOM 691 CG ARG A 46 3.799 -2.241 4.251 1.00 0.00 C ATOM 692 CD ARG A 46 4.058 -3.545 4.989 1.00 0.00 C ATOM 693 NE ARG A 46 2.822 -4.158 5.467 1.00 0.00 N ATOM 694 CZ ARG A 46 2.784 -5.110 6.393 1.00 0.00 C ATOM 695 NH1 ARG A 46 3.908 -5.555 6.937 1.00 0.00 N ATOM 696 NH2 ARG A 46 1.619 -5.618 6.776 1.00 0.00 N ATOM 0 H ARG A 46 3.664 -1.435 1.385 1.00 0.00 H new ATOM 0 HA ARG A 46 4.214 0.196 3.414 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.237 -2.543 2.695 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.881 -1.763 4.126 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.525 -1.465 4.966 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.952 -2.366 3.576 1.00 0.00 H new ATOM 0 HD2 ARG A 46 4.575 -4.240 4.327 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.720 -3.358 5.834 1.00 0.00 H new ATOM 0 HE ARG A 46 1.939 -3.838 5.068 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.805 -5.166 6.645 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.876 -6.286 7.648 1.00 0.00 H new ATOM 0 HH21 ARG A 46 0.752 -5.278 6.359 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.590 -6.349 7.487 1.00 0.00 H new ATOM 710 N PHE A 47 7.011 -0.228 1.705 1.00 0.00 N ATOM 711 CA PHE A 47 8.337 0.332 1.470 1.00 0.00 C ATOM 712 C PHE A 47 8.239 1.779 0.995 1.00 0.00 C ATOM 713 O PHE A 47 8.996 2.642 1.440 1.00 0.00 O ATOM 714 CB PHE A 47 9.093 -0.506 0.437 1.00 0.00 C ATOM 715 CG PHE A 47 10.107 0.278 -0.345 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.081 1.019 0.306 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.087 0.275 -1.730 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.015 1.742 -0.412 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.019 0.995 -2.453 1.00 0.00 C ATOM 720 CZ PHE A 47 11.985 1.729 -1.793 1.00 0.00 C ATOM 0 H PHE A 47 6.764 -1.001 1.087 1.00 0.00 H new ATOM 0 HA PHE A 47 8.884 0.313 2.412 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.595 -1.329 0.946 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.376 -0.949 -0.254 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.110 1.032 1.386 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.334 -0.297 -2.251 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.768 2.317 0.107 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.992 0.984 -3.533 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.715 2.292 -2.355 1.00 0.00 H new ATOM 730 N TRP A 48 7.304 2.035 0.088 1.00 0.00 N ATOM 731 CA TRP A 48 7.107 3.377 -0.449 1.00 0.00 C ATOM 732 C TRP A 48 6.833 4.376 0.669 1.00 0.00 C ATOM 733 O TRP A 48 7.513 5.397 0.784 1.00 0.00 O ATOM 734 CB TRP A 48 5.951 3.384 -1.450 1.00 0.00 C ATOM 735 CG TRP A 48 5.826 4.672 -2.206 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.585 5.077 -3.267 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.888 5.724 -1.957 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.176 6.317 -3.692 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.135 6.736 -2.905 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.862 5.910 -1.026 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.394 7.914 -2.947 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.128 7.080 -1.068 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.396 8.069 -2.024 1.00 0.00 C ATOM 0 H TRP A 48 6.670 1.332 -0.291 1.00 0.00 H new ATOM 0 HA TRP A 48 8.023 3.674 -0.960 1.00 0.00 H new ATOM 0 HB2 TRP A 48 6.089 2.567 -2.159 1.00 0.00 H new ATOM 0 HB3 TRP A 48 5.019 3.191 -0.919 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.389 4.506 -3.707 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.581 6.841 -4.468 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.647 5.153 -0.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.600 8.678 -3.682 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.334 7.235 -0.352 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.803 8.972 -2.032 1.00 0.00 H new ATOM 754 N LEU A 49 5.834 4.077 1.493 1.00 0.00 N ATOM 755 CA LEU A 49 5.471 4.950 2.603 1.00 0.00 C ATOM 756 C LEU A 49 6.659 5.170 3.534 1.00 0.00 C ATOM 757 O LEU A 49 6.901 6.286 3.995 1.00 0.00 O ATOM 758 CB LEU A 49 4.300 4.352 3.385 1.00 0.00 C ATOM 759 CG LEU A 49 3.032 4.066 2.580 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.057 3.233 3.398 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.379 5.366 2.133 1.00 0.00 C ATOM 0 H LEU A 49 5.261 3.237 1.413 1.00 0.00 H new ATOM 0 HA LEU A 49 5.172 5.914 2.192 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.633 3.421 3.843 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.045 5.034 4.197 1.00 0.00 H new ATOM 0 HG LEU A 49 3.309 3.497 1.692 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.161 3.039 2.809 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.525 2.286 3.668 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.786 3.775 4.304 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.478 5.143 1.561 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.116 5.961 3.008 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.075 5.927 1.509 1.00 0.00 H new ATOM 773 N ALA A 50 7.398 4.100 3.805 1.00 0.00 N ATOM 774 CA ALA A 50 8.564 4.177 4.677 1.00 0.00 C ATOM 775 C ALA A 50 9.523 5.269 4.217 1.00 0.00 C ATOM 776 O ALA A 50 10.051 6.029 5.029 1.00 0.00 O ATOM 777 CB ALA A 50 9.276 2.833 4.727 1.00 0.00 C ATOM 0 H ALA A 50 7.210 3.169 3.433 1.00 0.00 H new ATOM 0 HA ALA A 50 8.220 4.431 5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.144 2.905 5.382 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.594 2.074 5.111 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.600 2.555 3.724 1.00 0.00 H new ATOM 783 N VAL A 51 9.744 5.343 2.908 1.00 0.00 N ATOM 784 CA VAL A 51 10.640 6.343 2.339 1.00 0.00 C ATOM 785 C VAL A 51 10.176 7.754 2.682 1.00 0.00 C ATOM 786 O VAL A 51 10.966 8.586 3.128 1.00 0.00 O ATOM 787 CB VAL A 51 10.736 6.203 0.808 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.628 7.291 0.228 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.251 4.823 0.431 1.00 0.00 C ATOM 0 H VAL A 51 9.315 4.722 2.222 1.00 0.00 H new ATOM 0 HA VAL A 51 11.625 6.172 2.774 1.00 0.00 H new ATOM 0 HB VAL A 51 9.738 6.321 0.386 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.684 7.177 -0.855 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.212 8.269 0.468 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.628 7.207 0.654 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.313 4.742 -0.654 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.241 4.673 0.863 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.570 4.063 0.814 1.00 0.00 H new ATOM 799 N GLU A 52 8.890 8.016 2.471 1.00 0.00 N ATOM 800 CA GLU A 52 8.322 9.328 2.757 1.00 0.00 C ATOM 801 C GLU A 52 8.527 9.701 4.223 1.00 0.00 C ATOM 802 O GLU A 52 9.081 10.756 4.534 1.00 0.00 O ATOM 803 CB GLU A 52 6.830 9.347 2.418 1.00 0.00 C ATOM 804 CG GLU A 52 6.545 9.385 0.926 1.00 0.00 C ATOM 805 CD GLU A 52 6.952 10.699 0.288 1.00 0.00 C ATOM 806 OE1 GLU A 52 6.499 11.758 0.768 1.00 0.00 O ATOM 807 OE2 GLU A 52 7.725 10.666 -0.693 1.00 0.00 O ATOM 0 H GLU A 52 8.223 7.338 2.103 1.00 0.00 H new ATOM 0 HA GLU A 52 8.837 10.062 2.138 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.357 8.464 2.847 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.370 10.215 2.889 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.076 8.568 0.437 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.481 9.218 0.759 1.00 0.00 H new ATOM 814 N ASP A 53 8.075 8.829 5.117 1.00 0.00 N ATOM 815 CA ASP A 53 8.208 9.066 6.550 1.00 0.00 C ATOM 816 C ASP A 53 9.674 9.226 6.940 1.00 0.00 C ATOM 817 O ASP A 53 10.033 10.137 7.689 1.00 0.00 O ATOM 818 CB ASP A 53 7.581 7.916 7.339 1.00 0.00 C ATOM 819 CG ASP A 53 7.218 8.316 8.756 1.00 0.00 C ATOM 820 OD1 ASP A 53 8.102 8.252 9.636 1.00 0.00 O ATOM 821 OD2 ASP A 53 6.050 8.693 8.984 1.00 0.00 O ATOM 0 H ASP A 53 7.614 7.952 4.875 1.00 0.00 H new ATOM 0 HA ASP A 53 7.683 9.990 6.791 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.686 7.570 6.822 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.277 7.077 7.368 1.00 0.00 H new ATOM 826 N LEU A 54 10.518 8.336 6.430 1.00 0.00 N ATOM 827 CA LEU A 54 11.946 8.378 6.726 1.00 0.00 C ATOM 828 C LEU A 54 12.445 9.818 6.798 1.00 0.00 C ATOM 829 O LEU A 54 12.995 10.245 7.813 1.00 0.00 O ATOM 830 CB LEU A 54 12.730 7.608 5.662 1.00 0.00 C ATOM 831 CG LEU A 54 14.238 7.854 5.630 1.00 0.00 C ATOM 832 CD1 LEU A 54 14.886 7.372 6.918 1.00 0.00 C ATOM 833 CD2 LEU A 54 14.866 7.167 4.425 1.00 0.00 C ATOM 0 H LEU A 54 10.238 7.576 5.809 1.00 0.00 H new ATOM 0 HA LEU A 54 12.105 7.909 7.697 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.559 6.542 5.814 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.320 7.860 4.684 1.00 0.00 H new ATOM 0 HG LEU A 54 14.409 8.927 5.541 1.00 0.00 H new ATOM 0 HD11 LEU A 54 15.960 7.556 6.876 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.458 7.910 7.764 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.705 6.304 7.039 1.00 0.00 H new ATOM 0 HD21 LEU A 54 15.940 7.353 4.419 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.684 6.094 4.482 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.424 7.562 3.510 1.00 0.00 H new ATOM 845 N LYS A 55 12.248 10.562 5.715 1.00 0.00 N ATOM 846 CA LYS A 55 12.674 11.955 5.656 1.00 0.00 C ATOM 847 C LYS A 55 12.256 12.706 6.916 1.00 0.00 C ATOM 848 O LYS A 55 13.062 13.405 7.531 1.00 0.00 O ATOM 849 CB LYS A 55 12.081 12.639 4.422 1.00 0.00 C ATOM 850 CG LYS A 55 12.416 11.937 3.118 1.00 0.00 C ATOM 851 CD LYS A 55 11.459 12.337 2.007 1.00 0.00 C ATOM 852 CE LYS A 55 11.262 11.208 1.007 1.00 0.00 C ATOM 853 NZ LYS A 55 10.433 11.635 -0.154 1.00 0.00 N ATOM 0 H LYS A 55 11.796 10.223 4.866 1.00 0.00 H new ATOM 0 HA LYS A 55 13.762 11.973 5.587 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.998 12.689 4.530 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.444 13.666 4.376 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.437 12.180 2.825 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.375 10.858 3.264 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.497 12.615 2.437 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.845 13.217 1.492 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.233 10.863 0.653 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.785 10.363 1.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 9.506 11.165 -0.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.300 12.666 -0.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.913 11.373 -1.039 1.00 0.00 H new ATOM 867 N LYS A 56 10.993 12.556 7.298 1.00 0.00 N ATOM 868 CA LYS A 56 10.468 13.217 8.487 1.00 0.00 C ATOM 869 C LYS A 56 11.345 12.930 9.701 1.00 0.00 C ATOM 870 O LYS A 56 11.675 13.835 10.468 1.00 0.00 O ATOM 871 CB LYS A 56 9.034 12.757 8.760 1.00 0.00 C ATOM 872 CG LYS A 56 8.055 13.133 7.661 1.00 0.00 C ATOM 873 CD LYS A 56 7.526 14.545 7.845 1.00 0.00 C ATOM 874 CE LYS A 56 6.472 14.608 8.940 1.00 0.00 C ATOM 875 NZ LYS A 56 5.634 15.834 8.834 1.00 0.00 N ATOM 0 H LYS A 56 10.313 11.982 6.801 1.00 0.00 H new ATOM 0 HA LYS A 56 10.470 14.292 8.305 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.027 11.674 8.887 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.695 13.191 9.701 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.546 13.051 6.691 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.223 12.429 7.657 1.00 0.00 H new ATOM 0 HD2 LYS A 56 8.350 15.214 8.093 1.00 0.00 H new ATOM 0 HD3 LYS A 56 7.099 14.900 6.907 1.00 0.00 H new ATOM 0 HE2 LYS A 56 5.834 13.726 8.881 1.00 0.00 H new ATOM 0 HE3 LYS A 56 6.959 14.584 9.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.928 15.839 9.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.239 16.676 8.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.149 15.844 7.914 1.00 0.00 H new ATOM 889 N ARG A 57 11.721 11.666 9.868 1.00 0.00 N ATOM 890 CA ARG A 57 12.561 11.261 10.989 1.00 0.00 C ATOM 891 C ARG A 57 13.812 12.130 11.074 1.00 0.00 C ATOM 892 O ARG A 57 14.408 12.503 10.063 1.00 0.00 O ATOM 893 CB ARG A 57 12.958 9.790 10.851 1.00 0.00 C ATOM 894 CG ARG A 57 11.797 8.826 11.035 1.00 0.00 C ATOM 895 CD ARG A 57 11.344 8.769 12.485 1.00 0.00 C ATOM 896 NE ARG A 57 9.974 8.280 12.613 1.00 0.00 N ATOM 897 CZ ARG A 57 9.503 7.688 13.705 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.289 7.514 14.759 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.245 7.270 13.744 1.00 0.00 N ATOM 0 H ARG A 57 11.457 10.905 9.242 1.00 0.00 H new ATOM 0 HA ARG A 57 11.986 11.391 11.906 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.398 9.632 9.866 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.730 9.560 11.586 1.00 0.00 H new ATOM 0 HG2 ARG A 57 10.963 9.134 10.404 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.094 7.830 10.706 1.00 0.00 H new ATOM 0 HD2 ARG A 57 12.014 8.120 13.049 1.00 0.00 H new ATOM 0 HD3 ARG A 57 11.417 9.763 12.927 1.00 0.00 H new ATOM 0 HE ARG A 57 9.344 8.400 11.820 1.00 0.00 H new ATOM 0 HH11 ARG A 57 11.257 7.835 14.732 1.00 0.00 H new ATOM 0 HH12 ARG A 57 9.926 7.059 15.597 1.00 0.00 H new ATOM 0 HH21 ARG A 57 7.638 7.403 12.935 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.884 6.816 14.583 1.00 0.00 H new ATOM 913 N PRO A 58 14.219 12.463 12.308 1.00 0.00 N ATOM 914 CA PRO A 58 15.403 13.292 12.554 1.00 0.00 C ATOM 915 C PRO A 58 16.700 12.566 12.214 1.00 0.00 C ATOM 916 O PRO A 58 16.715 11.346 12.050 1.00 0.00 O ATOM 917 CB PRO A 58 15.328 13.580 14.055 1.00 0.00 C ATOM 918 CG PRO A 58 14.546 12.444 14.620 1.00 0.00 C ATOM 919 CD PRO A 58 13.557 12.054 13.558 1.00 0.00 C ATOM 0 HA PRO A 58 15.409 14.188 11.934 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.323 13.635 14.498 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.839 14.534 14.251 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.199 11.608 14.872 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.037 12.739 15.538 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.353 10.983 13.573 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.602 12.562 13.692 1.00 0.00 H new ATOM 927 N ILE A 59 17.787 13.324 12.112 1.00 0.00 N ATOM 928 CA ILE A 59 19.089 12.751 11.794 1.00 0.00 C ATOM 929 C ILE A 59 19.418 11.586 12.720 1.00 0.00 C ATOM 930 O ILE A 59 20.117 10.648 12.334 1.00 0.00 O ATOM 931 CB ILE A 59 20.208 13.805 11.896 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.558 13.184 11.535 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.249 14.399 13.296 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.772 13.027 10.045 1.00 0.00 C ATOM 0 H ILE A 59 17.792 14.335 12.245 1.00 0.00 H new ATOM 0 HA ILE A 59 19.033 12.391 10.767 1.00 0.00 H new ATOM 0 HB ILE A 59 19.998 14.607 11.188 1.00 0.00 H new ATOM 0 HG12 ILE A 59 22.355 13.804 11.945 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.638 12.206 12.010 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.044 15.142 13.353 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.293 14.873 13.518 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.439 13.608 14.021 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.750 12.581 9.863 1.00 0.00 H new ATOM 0 HD12 ILE A 59 20.996 12.382 9.632 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.725 14.005 9.566 1.00 0.00 H new ATOM 946 N LYS A 60 18.909 11.649 13.946 1.00 0.00 N ATOM 947 CA LYS A 60 19.146 10.598 14.929 1.00 0.00 C ATOM 948 C LYS A 60 18.452 9.303 14.518 1.00 0.00 C ATOM 949 O LYS A 60 18.922 8.210 14.834 1.00 0.00 O ATOM 950 CB LYS A 60 18.649 11.039 16.307 1.00 0.00 C ATOM 951 CG LYS A 60 17.161 11.342 16.350 1.00 0.00 C ATOM 952 CD LYS A 60 16.715 11.755 17.742 1.00 0.00 C ATOM 953 CE LYS A 60 16.993 13.227 18.003 1.00 0.00 C ATOM 954 NZ LYS A 60 16.214 13.742 19.163 1.00 0.00 N ATOM 0 H LYS A 60 18.329 12.418 14.283 1.00 0.00 H new ATOM 0 HA LYS A 60 20.220 10.416 14.978 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.873 10.256 17.032 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.201 11.927 16.616 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.931 12.138 15.642 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.601 10.462 16.034 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.649 11.559 17.857 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.232 11.149 18.486 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.058 13.368 18.189 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.746 13.806 17.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 16.432 14.749 19.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.197 13.631 18.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.468 13.206 20.017 1.00 0.00 H new ATOM 968 N GLU A 61 17.335 9.434 13.810 1.00 0.00 N ATOM 969 CA GLU A 61 16.578 8.273 13.356 1.00 0.00 C ATOM 970 C GLU A 61 16.583 8.183 11.832 1.00 0.00 C ATOM 971 O GLU A 61 15.817 7.421 11.242 1.00 0.00 O ATOM 972 CB GLU A 61 15.139 8.342 13.869 1.00 0.00 C ATOM 973 CG GLU A 61 14.996 7.962 15.333 1.00 0.00 C ATOM 974 CD GLU A 61 15.698 6.661 15.670 1.00 0.00 C ATOM 975 OE1 GLU A 61 15.433 5.651 14.985 1.00 0.00 O ATOM 976 OE2 GLU A 61 16.511 6.653 16.618 1.00 0.00 O ATOM 0 H GLU A 61 16.934 10.332 13.538 1.00 0.00 H new ATOM 0 HA GLU A 61 17.056 7.380 13.757 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.759 9.354 13.726 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.516 7.680 13.268 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.403 8.761 15.953 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.938 7.874 15.580 1.00 0.00 H new ATOM 983 N VAL A 62 17.452 8.966 11.202 1.00 0.00 N ATOM 984 CA VAL A 62 17.558 8.975 9.748 1.00 0.00 C ATOM 985 C VAL A 62 18.304 7.745 9.243 1.00 0.00 C ATOM 986 O VAL A 62 17.799 6.973 8.428 1.00 0.00 O ATOM 987 CB VAL A 62 18.278 10.241 9.245 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.045 9.946 7.965 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.283 11.371 9.032 1.00 0.00 C ATOM 0 H VAL A 62 18.093 9.603 11.676 1.00 0.00 H new ATOM 0 HA VAL A 62 16.541 8.965 9.357 1.00 0.00 H new ATOM 0 HB VAL A 62 18.993 10.557 10.004 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.547 10.852 7.625 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.786 9.170 8.156 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.352 9.605 7.196 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.809 12.257 8.677 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.542 11.068 8.292 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.784 11.599 9.974 1.00 0.00 H new ATOM 999 N PRO A 63 19.536 7.556 9.738 1.00 0.00 N ATOM 1000 CA PRO A 63 20.379 6.420 9.352 1.00 0.00 C ATOM 1001 C PRO A 63 19.851 5.097 9.896 1.00 0.00 C ATOM 1002 O PRO A 63 19.609 4.157 9.139 1.00 0.00 O ATOM 1003 CB PRO A 63 21.734 6.754 9.981 1.00 0.00 C ATOM 1004 CG PRO A 63 21.409 7.644 11.131 1.00 0.00 C ATOM 1005 CD PRO A 63 20.202 8.437 10.713 1.00 0.00 C ATOM 0 HA PRO A 63 20.417 6.289 8.271 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.250 5.853 10.312 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.390 7.253 9.267 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.201 7.062 12.029 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.246 8.302 11.364 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.554 8.660 11.561 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.483 9.391 10.267 1.00 0.00 H new ATOM 1013 N SER A 64 19.676 5.030 11.212 1.00 0.00 N ATOM 1014 CA SER A 64 19.180 3.820 11.856 1.00 0.00 C ATOM 1015 C SER A 64 18.066 3.183 11.032 1.00 0.00 C ATOM 1016 O SER A 64 17.962 1.959 10.950 1.00 0.00 O ATOM 1017 CB SER A 64 18.671 4.139 13.263 1.00 0.00 C ATOM 1018 OG SER A 64 17.377 4.716 13.219 1.00 0.00 O ATOM 0 H SER A 64 19.870 5.799 11.853 1.00 0.00 H new ATOM 0 HA SER A 64 20.005 3.111 11.927 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.646 3.227 13.859 1.00 0.00 H new ATOM 0 HB3 SER A 64 19.361 4.823 13.756 1.00 0.00 H new ATOM 0 HG SER A 64 17.077 4.917 14.130 1.00 0.00 H new ATOM 1024 N ARG A 65 17.234 4.022 10.423 1.00 0.00 N ATOM 1025 CA ARG A 65 16.127 3.542 9.606 1.00 0.00 C ATOM 1026 C ARG A 65 16.620 3.085 8.236 1.00 0.00 C ATOM 1027 O ARG A 65 16.255 2.009 7.760 1.00 0.00 O ATOM 1028 CB ARG A 65 15.074 4.640 9.440 1.00 0.00 C ATOM 1029 CG ARG A 65 13.656 4.109 9.309 1.00 0.00 C ATOM 1030 CD ARG A 65 13.135 3.576 10.634 1.00 0.00 C ATOM 1031 NE ARG A 65 12.434 4.604 11.399 1.00 0.00 N ATOM 1032 CZ ARG A 65 12.448 4.670 12.726 1.00 0.00 C ATOM 1033 NH1 ARG A 65 13.124 3.774 13.431 1.00 0.00 N ATOM 1034 NH2 ARG A 65 11.785 5.635 13.350 1.00 0.00 N ATOM 0 H ARG A 65 17.306 5.038 10.480 1.00 0.00 H new ATOM 0 HA ARG A 65 15.677 2.689 10.114 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.124 5.312 10.297 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.314 5.232 8.557 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.001 4.904 8.952 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.631 3.316 8.562 1.00 0.00 H new ATOM 0 HD2 ARG A 65 12.461 2.739 10.449 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.968 3.191 11.222 1.00 0.00 H new ATOM 0 HE ARG A 65 11.905 5.310 10.887 1.00 0.00 H new ATOM 0 HH11 ARG A 65 13.636 3.031 12.955 1.00 0.00 H new ATOM 0 HH12 ARG A 65 13.133 3.828 14.450 1.00 0.00 H new ATOM 0 HH21 ARG A 65 11.264 6.327 12.811 1.00 0.00 H new ATOM 0 HH22 ARG A 65 11.796 5.685 14.369 1.00 0.00 H new ATOM 1048 N VAL A 66 17.451 3.909 7.607 1.00 0.00 N ATOM 1049 CA VAL A 66 17.995 3.590 6.292 1.00 0.00 C ATOM 1050 C VAL A 66 18.197 2.087 6.131 1.00 0.00 C ATOM 1051 O VAL A 66 17.508 1.440 5.343 1.00 0.00 O ATOM 1052 CB VAL A 66 19.338 4.305 6.051 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.055 3.705 4.851 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.118 5.798 5.859 1.00 0.00 C ATOM 0 H VAL A 66 17.763 4.803 7.987 1.00 0.00 H new ATOM 0 HA VAL A 66 17.269 3.938 5.557 1.00 0.00 H new ATOM 0 HB VAL A 66 19.969 4.163 6.929 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.002 4.223 4.696 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.246 2.647 5.032 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.432 3.814 3.963 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.077 6.288 5.690 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.470 5.963 4.998 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.650 6.214 6.751 1.00 0.00 H new ATOM 1064 N GLN A 67 19.145 1.539 6.884 1.00 0.00 N ATOM 1065 CA GLN A 67 19.437 0.111 6.824 1.00 0.00 C ATOM 1066 C GLN A 67 18.183 -0.713 7.100 1.00 0.00 C ATOM 1067 O GLN A 67 17.874 -1.651 6.367 1.00 0.00 O ATOM 1068 CB GLN A 67 20.530 -0.250 7.831 1.00 0.00 C ATOM 1069 CG GLN A 67 20.053 -0.248 9.274 1.00 0.00 C ATOM 1070 CD GLN A 67 21.186 -0.437 10.264 1.00 0.00 C ATOM 1071 OE1 GLN A 67 21.793 -1.506 10.333 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.477 0.603 11.037 1.00 0.00 N ATOM 0 H GLN A 67 19.724 2.061 7.542 1.00 0.00 H new ATOM 0 HA GLN A 67 19.788 -0.121 5.818 1.00 0.00 H new ATOM 0 HB2 GLN A 67 20.924 -1.237 7.589 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.354 0.456 7.729 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.546 0.694 9.484 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.319 -1.042 9.411 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.948 1.470 10.946 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.230 0.535 11.722 1.00 0.00 H new ATOM 1081 N GLU A 68 17.467 -0.355 8.161 1.00 0.00 N ATOM 1082 CA GLU A 68 16.248 -1.063 8.533 1.00 0.00 C ATOM 1083 C GLU A 68 15.325 -1.227 7.329 1.00 0.00 C ATOM 1084 O GLU A 68 15.025 -2.345 6.911 1.00 0.00 O ATOM 1085 CB GLU A 68 15.518 -0.315 9.651 1.00 0.00 C ATOM 1086 CG GLU A 68 16.125 -0.536 11.027 1.00 0.00 C ATOM 1087 CD GLU A 68 16.120 -1.995 11.440 1.00 0.00 C ATOM 1088 OE1 GLU A 68 16.976 -2.755 10.941 1.00 0.00 O ATOM 1089 OE2 GLU A 68 15.261 -2.376 12.262 1.00 0.00 O ATOM 0 H GLU A 68 17.710 0.420 8.778 1.00 0.00 H new ATOM 0 HA GLU A 68 16.529 -2.053 8.891 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.524 0.752 9.427 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.475 -0.631 9.668 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.150 -0.165 11.032 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.571 0.048 11.762 1.00 0.00 H new ATOM 1096 N ILE A 69 14.877 -0.104 6.778 1.00 0.00 N ATOM 1097 CA ILE A 69 13.989 -0.122 5.622 1.00 0.00 C ATOM 1098 C ILE A 69 14.532 -1.031 4.525 1.00 0.00 C ATOM 1099 O ILE A 69 13.782 -1.774 3.892 1.00 0.00 O ATOM 1100 CB ILE A 69 13.784 1.292 5.047 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.123 2.199 6.087 1.00 0.00 C ATOM 1102 CG2 ILE A 69 12.945 1.231 3.779 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.331 3.673 5.822 1.00 0.00 C ATOM 0 H ILE A 69 15.114 0.830 7.113 1.00 0.00 H new ATOM 0 HA ILE A 69 13.030 -0.507 5.968 1.00 0.00 H new ATOM 0 HB ILE A 69 14.758 1.711 4.795 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.054 1.990 6.112 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.519 1.956 7.073 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.809 2.238 3.384 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.453 0.616 3.036 1.00 0.00 H new ATOM 0 HG23 ILE A 69 11.972 0.796 4.007 1.00 0.00 H new ATOM 0 HD11 ILE A 69 12.835 4.256 6.598 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.398 3.896 5.826 1.00 0.00 H new ATOM 0 HD13 ILE A 69 12.910 3.931 4.850 1.00 0.00 H new ATOM 1115 N TRP A 70 15.841 -0.969 4.308 1.00 0.00 N ATOM 1116 CA TRP A 70 16.486 -1.788 3.288 1.00 0.00 C ATOM 1117 C TRP A 70 16.551 -3.248 3.724 1.00 0.00 C ATOM 1118 O TRP A 70 16.715 -4.144 2.896 1.00 0.00 O ATOM 1119 CB TRP A 70 17.894 -1.266 3.001 1.00 0.00 C ATOM 1120 CG TRP A 70 18.888 -2.355 2.728 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.491 -3.163 3.650 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.393 -2.754 1.450 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.342 -4.040 3.021 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.299 -3.810 1.671 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.168 -2.323 0.140 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 20.978 -4.438 0.630 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 19.842 -2.948 -0.892 1.00 0.00 C ATOM 1128 CH2 TRP A 70 20.738 -3.996 -0.643 1.00 0.00 C ATOM 0 H TRP A 70 16.476 -0.360 4.824 1.00 0.00 H new ATOM 0 HA TRP A 70 15.891 -1.726 2.377 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.857 -0.595 2.143 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.236 -0.677 3.852 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.324 -3.119 4.716 1.00 0.00 H new ATOM 0 HE1 TRP A 70 20.913 -4.747 3.484 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.480 -1.516 -0.062 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 21.670 -5.245 0.820 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.675 -2.623 -1.908 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.249 -4.464 -1.471 1.00 0.00 H new ATOM 1139 N GLN A 71 16.420 -3.479 5.026 1.00 0.00 N ATOM 1140 CA GLN A 71 16.464 -4.831 5.570 1.00 0.00 C ATOM 1141 C GLN A 71 15.063 -5.425 5.668 1.00 0.00 C ATOM 1142 O GLN A 71 14.894 -6.578 6.062 1.00 0.00 O ATOM 1143 CB GLN A 71 17.127 -4.828 6.948 1.00 0.00 C ATOM 1144 CG GLN A 71 18.632 -4.616 6.899 1.00 0.00 C ATOM 1145 CD GLN A 71 19.353 -5.283 8.053 1.00 0.00 C ATOM 1146 OE1 GLN A 71 18.805 -5.419 9.147 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.590 -5.702 7.816 1.00 0.00 N ATOM 0 H GLN A 71 16.283 -2.748 5.724 1.00 0.00 H new ATOM 0 HA GLN A 71 17.054 -5.448 4.892 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.678 -4.043 7.556 1.00 0.00 H new ATOM 0 HB3 GLN A 71 16.918 -5.775 7.445 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.020 -5.007 5.958 1.00 0.00 H new ATOM 0 HG3 GLN A 71 18.845 -3.547 6.912 1.00 0.00 H new ATOM 0 HE21 GLN A 71 21.006 -5.569 6.894 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.125 -6.157 8.556 1.00 0.00 H new ATOM 1156 N GLU A 72 14.061 -4.628 5.307 1.00 0.00 N ATOM 1157 CA GLU A 72 12.674 -5.075 5.357 1.00 0.00 C ATOM 1158 C GLU A 72 12.194 -5.513 3.976 1.00 0.00 C ATOM 1159 O GLU A 72 11.558 -6.557 3.830 1.00 0.00 O ATOM 1160 CB GLU A 72 11.774 -3.960 5.891 1.00 0.00 C ATOM 1161 CG GLU A 72 10.293 -4.295 5.838 1.00 0.00 C ATOM 1162 CD GLU A 72 9.469 -3.453 6.793 1.00 0.00 C ATOM 1163 OE1 GLU A 72 9.498 -2.211 6.665 1.00 0.00 O ATOM 1164 OE2 GLU A 72 8.796 -4.036 7.668 1.00 0.00 O ATOM 0 H GLU A 72 14.184 -3.671 4.977 1.00 0.00 H new ATOM 0 HA GLU A 72 12.619 -5.930 6.031 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.052 -3.743 6.922 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.953 -3.052 5.315 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.927 -4.148 4.822 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.154 -5.349 6.077 1.00 0.00 H new ATOM 1171 N PHE A 73 12.504 -4.708 2.965 1.00 0.00 N ATOM 1172 CA PHE A 73 12.104 -5.011 1.596 1.00 0.00 C ATOM 1173 C PHE A 73 13.325 -5.194 0.700 1.00 0.00 C ATOM 1174 O PHE A 73 13.360 -6.088 -0.146 1.00 0.00 O ATOM 1175 CB PHE A 73 11.215 -3.894 1.044 1.00 0.00 C ATOM 1176 CG PHE A 73 10.284 -3.308 2.066 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.754 -2.423 3.024 1.00 0.00 C ATOM 1178 CD2 PHE A 73 8.939 -3.640 2.069 1.00 0.00 C ATOM 1179 CE1 PHE A 73 9.900 -1.883 3.966 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.080 -3.103 3.009 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.561 -2.222 3.958 1.00 0.00 C ATOM 0 H PHE A 73 13.031 -3.841 3.068 1.00 0.00 H new ATOM 0 HA PHE A 73 11.540 -5.944 1.606 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.847 -3.102 0.644 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.629 -4.285 0.212 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.800 -2.153 3.034 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.557 -4.327 1.328 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.279 -1.196 4.708 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.034 -3.372 3.002 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.891 -1.799 4.692 1.00 0.00 H new ATOM 1191 N LEU A 74 14.326 -4.341 0.892 1.00 0.00 N ATOM 1192 CA LEU A 74 15.550 -4.407 0.102 1.00 0.00 C ATOM 1193 C LEU A 74 16.501 -5.462 0.659 1.00 0.00 C ATOM 1194 O LEU A 74 17.694 -5.457 0.357 1.00 0.00 O ATOM 1195 CB LEU A 74 16.240 -3.042 0.079 1.00 0.00 C ATOM 1196 CG LEU A 74 15.350 -1.846 -0.258 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.168 -0.563 -0.286 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.649 -2.062 -1.591 1.00 0.00 C ATOM 0 H LEU A 74 14.313 -3.596 1.588 1.00 0.00 H new ATOM 0 HA LEU A 74 15.282 -4.688 -0.916 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.692 -2.869 1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.053 -3.080 -0.646 1.00 0.00 H new ATOM 0 HG LEU A 74 14.591 -1.752 0.518 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.518 0.278 -0.528 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.624 -0.401 0.691 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.949 -0.646 -1.041 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.020 -1.201 -1.815 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.393 -2.182 -2.378 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.031 -2.958 -1.536 1.00 0.00 H new ATOM 1210 N ALA A 75 15.964 -6.366 1.471 1.00 0.00 N ATOM 1211 CA ALA A 75 16.764 -7.429 2.066 1.00 0.00 C ATOM 1212 C ALA A 75 16.304 -8.800 1.580 1.00 0.00 C ATOM 1213 O ALA A 75 15.138 -9.007 1.246 1.00 0.00 O ATOM 1214 CB ALA A 75 16.694 -7.355 3.584 1.00 0.00 C ATOM 0 H ALA A 75 14.978 -6.384 1.732 1.00 0.00 H new ATOM 0 HA ALA A 75 17.799 -7.290 1.753 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.296 -8.155 4.015 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.077 -6.391 3.919 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.659 -7.466 3.906 1.00 0.00 H new ATOM 1220 N PRO A 76 17.241 -9.758 1.539 1.00 0.00 N ATOM 1221 CA PRO A 76 16.956 -11.126 1.094 1.00 0.00 C ATOM 1222 C PRO A 76 16.081 -11.887 2.085 1.00 0.00 C ATOM 1223 O PRO A 76 15.043 -12.435 1.718 1.00 0.00 O ATOM 1224 CB PRO A 76 18.343 -11.766 1.003 1.00 0.00 C ATOM 1225 CG PRO A 76 19.183 -10.988 1.956 1.00 0.00 C ATOM 1226 CD PRO A 76 18.652 -9.581 1.923 1.00 0.00 C ATOM 0 HA PRO A 76 16.402 -11.142 0.155 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.311 -12.821 1.274 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.739 -11.710 -0.011 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.121 -11.405 2.961 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.233 -11.016 1.664 1.00 0.00 H new ATOM 0 HD2 PRO A 76 18.746 -9.093 2.893 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.190 -8.965 1.203 1.00 0.00 H new ATOM 1234 N GLY A 77 16.509 -11.915 3.344 1.00 0.00 N ATOM 1235 CA GLY A 77 15.752 -12.611 4.369 1.00 0.00 C ATOM 1236 C GLY A 77 14.759 -11.707 5.071 1.00 0.00 C ATOM 1237 O GLY A 77 14.755 -11.613 6.298 1.00 0.00 O ATOM 0 H GLY A 77 17.365 -11.469 3.672 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.220 -13.448 3.918 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.440 -13.029 5.104 1.00 0.00 H new ATOM 1241 N ALA A 78 13.916 -11.038 4.291 1.00 0.00 N ATOM 1242 CA ALA A 78 12.913 -10.137 4.846 1.00 0.00 C ATOM 1243 C ALA A 78 11.511 -10.533 4.398 1.00 0.00 C ATOM 1244 O ALA A 78 11.321 -11.167 3.359 1.00 0.00 O ATOM 1245 CB ALA A 78 13.213 -8.701 4.442 1.00 0.00 C ATOM 0 H ALA A 78 13.908 -11.103 3.273 1.00 0.00 H new ATOM 0 HA ALA A 78 12.953 -10.213 5.933 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.456 -8.039 4.863 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.195 -8.415 4.818 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.202 -8.619 3.355 1.00 0.00 H new ATOM 1251 N PRO A 79 10.503 -10.153 5.198 1.00 0.00 N ATOM 1252 CA PRO A 79 9.100 -10.459 4.903 1.00 0.00 C ATOM 1253 C PRO A 79 8.575 -9.674 3.705 1.00 0.00 C ATOM 1254 O PRO A 79 8.023 -10.249 2.768 1.00 0.00 O ATOM 1255 CB PRO A 79 8.370 -10.037 6.180 1.00 0.00 C ATOM 1256 CG PRO A 79 9.247 -9.001 6.794 1.00 0.00 C ATOM 1257 CD PRO A 79 10.656 -9.396 6.451 1.00 0.00 C ATOM 0 HA PRO A 79 8.957 -11.507 4.640 1.00 0.00 H new ATOM 0 HB2 PRO A 79 7.381 -9.637 5.957 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.227 -10.883 6.852 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.013 -8.011 6.404 1.00 0.00 H new ATOM 0 HG3 PRO A 79 9.105 -8.960 7.874 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.297 -8.524 6.318 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.105 -10.005 7.236 1.00 0.00 H new ATOM 1265 N SER A 80 8.752 -8.357 3.744 1.00 0.00 N ATOM 1266 CA SER A 80 8.293 -7.492 2.662 1.00 0.00 C ATOM 1267 C SER A 80 9.334 -7.414 1.550 1.00 0.00 C ATOM 1268 O SER A 80 9.303 -6.508 0.719 1.00 0.00 O ATOM 1269 CB SER A 80 7.992 -6.090 3.195 1.00 0.00 C ATOM 1270 OG SER A 80 7.175 -6.147 4.351 1.00 0.00 O ATOM 0 H SER A 80 9.209 -7.866 4.512 1.00 0.00 H new ATOM 0 HA SER A 80 7.379 -7.920 2.250 1.00 0.00 H new ATOM 0 HB2 SER A 80 8.926 -5.579 3.431 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.494 -5.503 2.423 1.00 0.00 H new ATOM 0 HG SER A 80 7.130 -5.259 4.764 1.00 0.00 H new ATOM 1276 N ALA A 81 10.255 -8.372 1.542 1.00 0.00 N ATOM 1277 CA ALA A 81 11.305 -8.414 0.532 1.00 0.00 C ATOM 1278 C ALA A 81 10.731 -8.204 -0.865 1.00 0.00 C ATOM 1279 O ALA A 81 10.110 -9.103 -1.433 1.00 0.00 O ATOM 1280 CB ALA A 81 12.053 -9.737 0.603 1.00 0.00 C ATOM 0 H ALA A 81 10.295 -9.130 2.224 1.00 0.00 H new ATOM 0 HA ALA A 81 12.004 -7.602 0.736 1.00 0.00 H new ATOM 0 HB1 ALA A 81 12.834 -9.755 -0.157 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.504 -9.848 1.589 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.358 -10.558 0.428 1.00 0.00 H new ATOM 1286 N ILE A 82 10.941 -7.011 -1.413 1.00 0.00 N ATOM 1287 CA ILE A 82 10.445 -6.684 -2.743 1.00 0.00 C ATOM 1288 C ILE A 82 11.485 -7.002 -3.812 1.00 0.00 C ATOM 1289 O ILE A 82 12.567 -7.504 -3.510 1.00 0.00 O ATOM 1290 CB ILE A 82 10.054 -5.198 -2.849 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.273 -4.309 -2.593 1.00 0.00 C ATOM 1292 CG2 ILE A 82 8.939 -4.872 -1.867 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.083 -2.878 -3.047 1.00 0.00 C ATOM 0 H ILE A 82 11.451 -6.256 -0.956 1.00 0.00 H new ATOM 0 HA ILE A 82 9.559 -7.297 -2.908 1.00 0.00 H new ATOM 0 HB ILE A 82 9.691 -5.004 -3.858 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.501 -4.316 -1.527 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.136 -4.733 -3.106 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.674 -3.818 -1.954 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.066 -5.485 -2.091 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.277 -5.078 -0.851 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.986 -2.306 -2.834 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.886 -2.859 -4.119 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.240 -2.436 -2.515 1.00 0.00 H new ATOM 1305 N ASN A 83 11.151 -6.703 -5.063 1.00 0.00 N ATOM 1306 CA ASN A 83 12.057 -6.955 -6.178 1.00 0.00 C ATOM 1307 C ASN A 83 12.250 -5.697 -7.018 1.00 0.00 C ATOM 1308 O ASN A 83 11.282 -5.036 -7.398 1.00 0.00 O ATOM 1309 CB ASN A 83 11.519 -8.089 -7.053 1.00 0.00 C ATOM 1310 CG ASN A 83 12.312 -8.256 -8.335 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.502 -7.946 -8.387 1.00 0.00 O ATOM 1312 ND2 ASN A 83 11.653 -8.747 -9.378 1.00 0.00 N ATOM 0 H ASN A 83 10.259 -6.286 -5.330 1.00 0.00 H new ATOM 0 HA ASN A 83 13.024 -7.248 -5.769 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.544 -9.022 -6.490 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.475 -7.892 -7.298 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.133 -8.881 -10.268 1.00 0.00 H new ATOM 0 HD22 ASN A 83 10.666 -8.990 -9.289 1.00 0.00 H new ATOM 1319 N LEU A 84 13.505 -5.370 -7.305 1.00 0.00 N ATOM 1320 CA LEU A 84 13.826 -4.191 -8.101 1.00 0.00 C ATOM 1321 C LEU A 84 14.635 -4.572 -9.337 1.00 0.00 C ATOM 1322 O LEU A 84 15.342 -5.580 -9.342 1.00 0.00 O ATOM 1323 CB LEU A 84 14.606 -3.179 -7.259 1.00 0.00 C ATOM 1324 CG LEU A 84 13.816 -2.474 -6.156 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.741 -1.628 -5.295 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.710 -1.618 -6.755 1.00 0.00 C ATOM 0 H LEU A 84 14.317 -5.905 -6.998 1.00 0.00 H new ATOM 0 HA LEU A 84 12.890 -3.738 -8.427 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.452 -3.692 -6.801 1.00 0.00 H new ATOM 0 HB3 LEU A 84 15.016 -2.421 -7.926 1.00 0.00 H new ATOM 0 HG LEU A 84 13.357 -3.233 -5.523 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.161 -1.134 -4.515 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.496 -2.266 -4.836 1.00 0.00 H new ATOM 0 HD13 LEU A 84 15.229 -0.877 -5.915 1.00 0.00 H new ATOM 0 HD21 LEU A 84 12.159 -1.124 -5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 84 13.147 -0.866 -7.412 1.00 0.00 H new ATOM 0 HD23 LEU A 84 12.031 -2.250 -7.328 1.00 0.00 H new ATOM 1338 N ASP A 85 14.529 -3.758 -10.381 1.00 0.00 N ATOM 1339 CA ASP A 85 15.253 -4.007 -11.622 1.00 0.00 C ATOM 1340 C ASP A 85 16.757 -4.057 -11.373 1.00 0.00 C ATOM 1341 O ASP A 85 17.278 -3.342 -10.516 1.00 0.00 O ATOM 1342 CB ASP A 85 14.930 -2.925 -12.653 1.00 0.00 C ATOM 1343 CG ASP A 85 15.028 -3.434 -14.077 1.00 0.00 C ATOM 1344 OD1 ASP A 85 15.834 -4.355 -14.323 1.00 0.00 O ATOM 1345 OD2 ASP A 85 14.300 -2.910 -14.947 1.00 0.00 O ATOM 0 H ASP A 85 13.948 -2.919 -10.393 1.00 0.00 H new ATOM 0 HA ASP A 85 14.935 -4.974 -12.011 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.924 -2.546 -12.474 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.614 -2.087 -12.522 1.00 0.00 H new ATOM 1350 N SER A 86 17.449 -4.906 -12.126 1.00 0.00 N ATOM 1351 CA SER A 86 18.893 -5.052 -11.983 1.00 0.00 C ATOM 1352 C SER A 86 19.577 -3.689 -11.957 1.00 0.00 C ATOM 1353 O SER A 86 20.521 -3.469 -11.196 1.00 0.00 O ATOM 1354 CB SER A 86 19.457 -5.896 -13.128 1.00 0.00 C ATOM 1355 OG SER A 86 19.314 -7.280 -12.859 1.00 0.00 O ATOM 0 H SER A 86 17.033 -5.503 -12.841 1.00 0.00 H new ATOM 0 HA SER A 86 19.090 -5.556 -11.037 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.941 -5.647 -14.056 1.00 0.00 H new ATOM 0 HB3 SER A 86 20.510 -5.658 -13.275 1.00 0.00 H new ATOM 0 HG SER A 86 19.680 -7.798 -13.606 1.00 0.00 H new ATOM 1361 N LYS A 87 19.095 -2.775 -12.793 1.00 0.00 N ATOM 1362 CA LYS A 87 19.658 -1.432 -12.866 1.00 0.00 C ATOM 1363 C LYS A 87 19.369 -0.651 -11.589 1.00 0.00 C ATOM 1364 O LYS A 87 20.287 -0.226 -10.888 1.00 0.00 O ATOM 1365 CB LYS A 87 19.089 -0.684 -14.074 1.00 0.00 C ATOM 1366 CG LYS A 87 19.249 0.824 -13.987 1.00 0.00 C ATOM 1367 CD LYS A 87 19.052 1.485 -15.341 1.00 0.00 C ATOM 1368 CE LYS A 87 17.580 1.736 -15.630 1.00 0.00 C ATOM 1369 NZ LYS A 87 17.388 2.545 -16.865 1.00 0.00 N ATOM 0 H LYS A 87 18.315 -2.940 -13.430 1.00 0.00 H new ATOM 0 HA LYS A 87 20.738 -1.523 -12.978 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.583 -1.042 -14.978 1.00 0.00 H new ATOM 0 HB3 LYS A 87 18.030 -0.923 -14.173 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.528 1.227 -13.276 1.00 0.00 H new ATOM 0 HG3 LYS A 87 20.241 1.064 -13.605 1.00 0.00 H new ATOM 0 HD2 LYS A 87 19.595 2.429 -15.368 1.00 0.00 H new ATOM 0 HD3 LYS A 87 19.474 0.852 -16.121 1.00 0.00 H new ATOM 0 HE2 LYS A 87 17.063 0.782 -15.736 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.126 2.252 -14.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.372 2.694 -17.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 17.860 3.465 -16.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 17.798 2.041 -17.677 1.00 0.00 H new ATOM 1383 N SER A 88 18.087 -0.465 -11.291 1.00 0.00 N ATOM 1384 CA SER A 88 17.677 0.268 -10.099 1.00 0.00 C ATOM 1385 C SER A 88 18.347 -0.303 -8.853 1.00 0.00 C ATOM 1386 O SER A 88 19.038 0.409 -8.124 1.00 0.00 O ATOM 1387 CB SER A 88 16.156 0.218 -9.941 1.00 0.00 C ATOM 1388 OG SER A 88 15.524 1.163 -10.787 1.00 0.00 O ATOM 0 H SER A 88 17.314 -0.812 -11.859 1.00 0.00 H new ATOM 0 HA SER A 88 17.989 1.306 -10.216 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.796 -0.783 -10.176 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.888 0.418 -8.903 1.00 0.00 H new ATOM 0 HG SER A 88 14.553 1.110 -10.669 1.00 0.00 H new ATOM 1394 N TYR A 89 18.139 -1.594 -8.616 1.00 0.00 N ATOM 1395 CA TYR A 89 18.720 -2.262 -7.457 1.00 0.00 C ATOM 1396 C TYR A 89 20.196 -1.906 -7.308 1.00 0.00 C ATOM 1397 O TYR A 89 20.624 -1.405 -6.268 1.00 0.00 O ATOM 1398 CB TYR A 89 18.559 -3.777 -7.582 1.00 0.00 C ATOM 1399 CG TYR A 89 18.711 -4.513 -6.270 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.753 -4.396 -5.271 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.814 -5.323 -6.028 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.888 -5.066 -4.070 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.956 -5.997 -4.831 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.991 -5.865 -3.855 1.00 0.00 C ATOM 1405 OH TYR A 89 19.130 -6.533 -2.660 1.00 0.00 O ATOM 0 H TYR A 89 17.572 -2.198 -9.211 1.00 0.00 H new ATOM 0 HA TYR A 89 18.190 -1.920 -6.568 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.576 -3.996 -8.000 1.00 0.00 H new ATOM 0 HB3 TYR A 89 19.298 -4.155 -8.289 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.888 -3.771 -5.436 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.573 -5.427 -6.789 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.134 -4.964 -3.304 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.818 -6.624 -4.660 1.00 0.00 H new ATOM 0 HH TYR A 89 19.564 -5.946 -2.006 1.00 0.00 H new ATOM 1415 N ASP A 90 20.970 -2.170 -8.355 1.00 0.00 N ATOM 1416 CA ASP A 90 22.399 -1.877 -8.343 1.00 0.00 C ATOM 1417 C ASP A 90 22.666 -0.496 -7.752 1.00 0.00 C ATOM 1418 O ASP A 90 23.494 -0.343 -6.854 1.00 0.00 O ATOM 1419 CB ASP A 90 22.970 -1.958 -9.760 1.00 0.00 C ATOM 1420 CG ASP A 90 24.470 -1.740 -9.793 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.941 -0.760 -9.178 1.00 0.00 O ATOM 1422 OD2 ASP A 90 25.173 -2.549 -10.433 1.00 0.00 O ATOM 0 H ASP A 90 20.632 -2.586 -9.223 1.00 0.00 H new ATOM 0 HA ASP A 90 22.892 -2.621 -7.718 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.738 -2.934 -10.187 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.483 -1.212 -10.388 1.00 0.00 H new ATOM 1427 N LYS A 91 21.959 0.507 -8.262 1.00 0.00 N ATOM 1428 CA LYS A 91 22.118 1.875 -7.786 1.00 0.00 C ATOM 1429 C LYS A 91 21.807 1.973 -6.295 1.00 0.00 C ATOM 1430 O LYS A 91 22.635 2.430 -5.506 1.00 0.00 O ATOM 1431 CB LYS A 91 21.205 2.820 -8.570 1.00 0.00 C ATOM 1432 CG LYS A 91 21.297 4.268 -8.121 1.00 0.00 C ATOM 1433 CD LYS A 91 22.403 5.010 -8.852 1.00 0.00 C ATOM 1434 CE LYS A 91 22.288 6.514 -8.659 1.00 0.00 C ATOM 1435 NZ LYS A 91 23.580 7.207 -8.916 1.00 0.00 N ATOM 0 H LYS A 91 21.270 0.397 -9.006 1.00 0.00 H new ATOM 0 HA LYS A 91 23.156 2.168 -7.943 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.458 2.760 -9.629 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.174 2.482 -8.469 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.344 4.766 -8.299 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.480 4.306 -7.047 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.373 4.669 -8.489 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.359 4.774 -9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.525 6.909 -9.330 1.00 0.00 H new ATOM 0 HE3 LYS A 91 21.959 6.725 -7.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 23.459 8.230 -8.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.303 6.849 -8.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 23.882 7.027 -9.895 1.00 0.00 H new ATOM 1449 N THR A 92 20.610 1.538 -5.916 1.00 0.00 N ATOM 1450 CA THR A 92 20.190 1.576 -4.520 1.00 0.00 C ATOM 1451 C THR A 92 21.237 0.939 -3.614 1.00 0.00 C ATOM 1452 O THR A 92 21.804 1.600 -2.742 1.00 0.00 O ATOM 1453 CB THR A 92 18.845 0.852 -4.319 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.833 1.466 -5.125 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.426 0.887 -2.857 1.00 0.00 C ATOM 0 H THR A 92 19.914 1.155 -6.556 1.00 0.00 H new ATOM 0 HA THR A 92 20.073 2.626 -4.253 1.00 0.00 H new ATOM 0 HB THR A 92 18.968 -0.188 -4.621 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.027 0.909 -5.118 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.474 0.370 -2.739 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.185 0.394 -2.249 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.319 1.922 -2.534 1.00 0.00 H new ATOM 1463 N THR A 93 21.492 -0.348 -3.825 1.00 0.00 N ATOM 1464 CA THR A 93 22.472 -1.074 -3.026 1.00 0.00 C ATOM 1465 C THR A 93 23.716 -0.229 -2.780 1.00 0.00 C ATOM 1466 O THR A 93 24.276 -0.235 -1.684 1.00 0.00 O ATOM 1467 CB THR A 93 22.886 -2.392 -3.707 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.724 -3.104 -4.147 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.691 -3.264 -2.755 1.00 0.00 C ATOM 0 H THR A 93 21.034 -0.910 -4.543 1.00 0.00 H new ATOM 0 HA THR A 93 21.996 -1.301 -2.072 1.00 0.00 H new ATOM 0 HB THR A 93 23.509 -2.149 -4.567 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.377 -2.690 -4.964 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.972 -4.189 -3.258 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.590 -2.731 -2.446 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.088 -3.497 -1.877 1.00 0.00 H new ATOM 1477 N HIS A 94 24.144 0.498 -3.807 1.00 0.00 N ATOM 1478 CA HIS A 94 25.323 1.351 -3.702 1.00 0.00 C ATOM 1479 C HIS A 94 25.030 2.580 -2.847 1.00 0.00 C ATOM 1480 O HIS A 94 25.840 2.971 -2.007 1.00 0.00 O ATOM 1481 CB HIS A 94 25.792 1.782 -5.092 1.00 0.00 C ATOM 1482 CG HIS A 94 26.886 2.805 -5.064 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.224 2.478 -5.131 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.834 4.155 -4.977 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.948 3.582 -5.085 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.128 4.614 -4.992 1.00 0.00 N ATOM 0 H HIS A 94 23.692 0.514 -4.721 1.00 0.00 H new ATOM 0 HA HIS A 94 26.115 0.777 -3.222 1.00 0.00 H new ATOM 0 HB2 HIS A 94 26.140 0.905 -5.637 1.00 0.00 H new ATOM 0 HB3 HIS A 94 24.943 2.185 -5.644 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.941 4.759 -4.909 1.00 0.00 H new ATOM 0 HE1 HIS A 94 30.026 3.632 -5.118 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.410 5.593 -4.940 1.00 0.00 H new ATOM 1494 N ASN A 95 23.867 3.184 -3.067 1.00 0.00 N ATOM 1495 CA ASN A 95 23.468 4.370 -2.317 1.00 0.00 C ATOM 1496 C ASN A 95 23.386 4.067 -0.824 1.00 0.00 C ATOM 1497 O ASN A 95 23.848 4.851 0.005 1.00 0.00 O ATOM 1498 CB ASN A 95 22.118 4.886 -2.820 1.00 0.00 C ATOM 1499 CG ASN A 95 22.253 5.746 -4.061 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.168 6.563 -4.167 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.340 5.564 -5.009 1.00 0.00 N ATOM 0 H ASN A 95 23.184 2.872 -3.758 1.00 0.00 H new ATOM 0 HA ASN A 95 24.224 5.140 -2.472 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.467 4.039 -3.037 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.637 5.464 -2.031 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.380 6.113 -5.868 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.599 4.875 -4.878 1.00 0.00 H new ATOM 1508 N VAL A 96 22.795 2.925 -0.489 1.00 0.00 N ATOM 1509 CA VAL A 96 22.653 2.517 0.903 1.00 0.00 C ATOM 1510 C VAL A 96 23.924 2.809 1.694 1.00 0.00 C ATOM 1511 O VAL A 96 23.868 3.293 2.824 1.00 0.00 O ATOM 1512 CB VAL A 96 22.324 1.016 1.018 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.204 0.606 2.478 1.00 0.00 C ATOM 1514 CG2 VAL A 96 21.048 0.691 0.258 1.00 0.00 C ATOM 0 H VAL A 96 22.407 2.266 -1.163 1.00 0.00 H new ATOM 0 HA VAL A 96 21.828 3.095 1.319 1.00 0.00 H new ATOM 0 HB VAL A 96 23.140 0.448 0.572 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.971 -0.457 2.539 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.147 0.801 2.989 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.408 1.180 2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.831 -0.373 0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.221 1.267 0.672 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.176 0.946 -0.794 1.00 0.00 H new ATOM 1524 N LYS A 97 25.070 2.512 1.091 1.00 0.00 N ATOM 1525 CA LYS A 97 26.357 2.744 1.736 1.00 0.00 C ATOM 1526 C LYS A 97 26.294 3.962 2.652 1.00 0.00 C ATOM 1527 O LYS A 97 26.703 3.899 3.811 1.00 0.00 O ATOM 1528 CB LYS A 97 27.450 2.941 0.684 1.00 0.00 C ATOM 1529 CG LYS A 97 28.137 1.650 0.272 1.00 0.00 C ATOM 1530 CD LYS A 97 27.156 0.669 -0.347 1.00 0.00 C ATOM 1531 CE LYS A 97 27.842 -0.630 -0.744 1.00 0.00 C ATOM 1532 NZ LYS A 97 27.061 -1.379 -1.766 1.00 0.00 N ATOM 0 H LYS A 97 25.134 2.110 0.156 1.00 0.00 H new ATOM 0 HA LYS A 97 26.596 1.868 2.340 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.013 3.408 -0.199 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.197 3.632 1.074 1.00 0.00 H new ATOM 0 HG2 LYS A 97 28.931 1.871 -0.441 1.00 0.00 H new ATOM 0 HG3 LYS A 97 28.609 1.194 1.142 1.00 0.00 H new ATOM 0 HD2 LYS A 97 26.356 0.457 0.362 1.00 0.00 H new ATOM 0 HD3 LYS A 97 26.693 1.120 -1.225 1.00 0.00 H new ATOM 0 HE2 LYS A 97 28.836 -0.411 -1.135 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.977 -1.254 0.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 27.079 -2.394 -1.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 26.077 -1.042 -1.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 27.481 -1.225 -2.705 1.00 0.00 H new ATOM 1546 N GLU A 98 25.778 5.068 2.125 1.00 0.00 N ATOM 1547 CA GLU A 98 25.662 6.299 2.898 1.00 0.00 C ATOM 1548 C GLU A 98 24.201 6.613 3.205 1.00 0.00 C ATOM 1549 O GLU A 98 23.407 6.928 2.318 1.00 0.00 O ATOM 1550 CB GLU A 98 26.296 7.466 2.137 1.00 0.00 C ATOM 1551 CG GLU A 98 25.842 7.569 0.691 1.00 0.00 C ATOM 1552 CD GLU A 98 24.577 8.390 0.534 1.00 0.00 C ATOM 1553 OE1 GLU A 98 24.495 9.475 1.147 1.00 0.00 O ATOM 1554 OE2 GLU A 98 23.669 7.948 -0.201 1.00 0.00 O ATOM 0 H GLU A 98 25.434 5.137 1.167 1.00 0.00 H new ATOM 0 HA GLU A 98 26.191 6.157 3.840 1.00 0.00 H new ATOM 0 HB2 GLU A 98 26.056 8.397 2.651 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.380 7.358 2.162 1.00 0.00 H new ATOM 0 HG2 GLU A 98 26.638 8.017 0.095 1.00 0.00 H new ATOM 0 HG3 GLU A 98 25.672 6.568 0.295 1.00 0.00 H new ATOM 1561 N PRO A 99 23.835 6.524 4.493 1.00 0.00 N ATOM 1562 CA PRO A 99 22.468 6.793 4.948 1.00 0.00 C ATOM 1563 C PRO A 99 22.104 8.270 4.845 1.00 0.00 C ATOM 1564 O PRO A 99 22.823 9.134 5.346 1.00 0.00 O ATOM 1565 CB PRO A 99 22.488 6.348 6.413 1.00 0.00 C ATOM 1566 CG PRO A 99 23.914 6.470 6.827 1.00 0.00 C ATOM 1567 CD PRO A 99 24.729 6.153 5.603 1.00 0.00 C ATOM 0 HA PRO A 99 21.726 6.274 4.341 1.00 0.00 H new ATOM 0 HB2 PRO A 99 21.843 6.977 7.026 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.131 5.324 6.520 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.130 7.475 7.190 1.00 0.00 H new ATOM 0 HG3 PRO A 99 24.145 5.781 7.639 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.657 6.724 5.579 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.002 5.098 5.564 1.00 0.00 H new ATOM 1575 N GLY A 100 20.981 8.554 4.193 1.00 0.00 N ATOM 1576 CA GLY A 100 20.541 9.929 4.037 1.00 0.00 C ATOM 1577 C GLY A 100 19.031 10.059 4.056 1.00 0.00 C ATOM 1578 O GLY A 100 18.355 9.409 4.854 1.00 0.00 O ATOM 0 H GLY A 100 20.368 7.857 3.770 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.965 10.536 4.837 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.925 10.326 3.097 1.00 0.00 H new ATOM 1582 N ARG A 101 18.500 10.903 3.177 1.00 0.00 N ATOM 1583 CA ARG A 101 17.060 11.120 3.099 1.00 0.00 C ATOM 1584 C ARG A 101 16.522 10.704 1.733 1.00 0.00 C ATOM 1585 O ARG A 101 15.401 10.207 1.622 1.00 0.00 O ATOM 1586 CB ARG A 101 16.729 12.589 3.365 1.00 0.00 C ATOM 1587 CG ARG A 101 16.996 13.025 4.796 1.00 0.00 C ATOM 1588 CD ARG A 101 16.362 14.374 5.095 1.00 0.00 C ATOM 1589 NE ARG A 101 16.947 15.005 6.275 1.00 0.00 N ATOM 1590 CZ ARG A 101 18.112 15.644 6.265 1.00 0.00 C ATOM 1591 NH1 ARG A 101 18.811 15.737 5.142 1.00 0.00 N ATOM 1592 NH2 ARG A 101 18.579 16.192 7.380 1.00 0.00 N ATOM 0 H ARG A 101 19.045 11.448 2.509 1.00 0.00 H new ATOM 0 HA ARG A 101 16.582 10.504 3.861 1.00 0.00 H new ATOM 0 HB2 ARG A 101 17.314 13.212 2.689 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.679 12.764 3.131 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.604 12.277 5.485 1.00 0.00 H new ATOM 0 HG3 ARG A 101 18.071 13.082 4.966 1.00 0.00 H new ATOM 0 HD2 ARG A 101 16.485 15.031 4.234 1.00 0.00 H new ATOM 0 HD3 ARG A 101 15.290 14.245 5.247 1.00 0.00 H new ATOM 0 HE ARG A 101 16.433 14.952 7.155 1.00 0.00 H new ATOM 0 HH11 ARG A 101 18.455 15.318 4.283 1.00 0.00 H new ATOM 0 HH12 ARG A 101 19.705 16.228 5.137 1.00 0.00 H new ATOM 0 HH21 ARG A 101 18.044 16.123 8.245 1.00 0.00 H new ATOM 0 HH22 ARG A 101 19.473 16.682 7.371 1.00 0.00 H new ATOM 1606 N TYR A 102 17.327 10.912 0.697 1.00 0.00 N ATOM 1607 CA TYR A 102 16.930 10.562 -0.661 1.00 0.00 C ATOM 1608 C TYR A 102 17.627 9.285 -1.121 1.00 0.00 C ATOM 1609 O TYR A 102 17.684 8.989 -2.315 1.00 0.00 O ATOM 1610 CB TYR A 102 17.256 11.708 -1.621 1.00 0.00 C ATOM 1611 CG TYR A 102 16.653 13.032 -1.211 1.00 0.00 C ATOM 1612 CD1 TYR A 102 15.311 13.129 -0.864 1.00 0.00 C ATOM 1613 CD2 TYR A 102 17.426 14.186 -1.168 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.756 14.337 -0.489 1.00 0.00 C ATOM 1615 CE2 TYR A 102 16.879 15.398 -0.793 1.00 0.00 C ATOM 1616 CZ TYR A 102 15.544 15.469 -0.455 1.00 0.00 C ATOM 1617 OH TYR A 102 14.995 16.674 -0.081 1.00 0.00 O ATOM 0 H TYR A 102 18.258 11.321 0.772 1.00 0.00 H new ATOM 0 HA TYR A 102 15.854 10.388 -0.664 1.00 0.00 H new ATOM 0 HB2 TYR A 102 18.338 11.817 -1.689 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.899 11.449 -2.618 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.691 12.245 -0.888 1.00 0.00 H new ATOM 0 HD2 TYR A 102 18.472 14.135 -1.432 1.00 0.00 H new ATOM 0 HE1 TYR A 102 13.711 14.395 -0.224 1.00 0.00 H new ATOM 0 HE2 TYR A 102 17.494 16.285 -0.765 1.00 0.00 H new ATOM 0 HH TYR A 102 15.684 17.370 -0.109 1.00 0.00 H new ATOM 1627 N THR A 103 18.157 8.531 -0.163 1.00 0.00 N ATOM 1628 CA THR A 103 18.851 7.286 -0.466 1.00 0.00 C ATOM 1629 C THR A 103 17.972 6.353 -1.291 1.00 0.00 C ATOM 1630 O THR A 103 18.417 5.783 -2.288 1.00 0.00 O ATOM 1631 CB THR A 103 19.288 6.558 0.819 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.210 7.371 1.553 1.00 0.00 O ATOM 1633 CG2 THR A 103 19.933 5.220 0.491 1.00 0.00 C ATOM 0 H THR A 103 18.119 8.761 0.830 1.00 0.00 H new ATOM 0 HA THR A 103 19.737 7.551 -1.043 1.00 0.00 H new ATOM 0 HB THR A 103 18.401 6.376 1.426 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.083 6.927 1.587 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.233 4.725 1.414 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.218 4.592 -0.042 1.00 0.00 H new ATOM 0 HG23 THR A 103 20.810 5.383 -0.135 1.00 0.00 H new ATOM 1641 N PHE A 104 16.720 6.202 -0.871 1.00 0.00 N ATOM 1642 CA PHE A 104 15.777 5.338 -1.571 1.00 0.00 C ATOM 1643 C PHE A 104 14.852 6.155 -2.468 1.00 0.00 C ATOM 1644 O PHE A 104 13.796 5.681 -2.884 1.00 0.00 O ATOM 1645 CB PHE A 104 14.951 4.530 -0.568 1.00 0.00 C ATOM 1646 CG PHE A 104 15.765 3.959 0.558 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.366 2.717 0.435 1.00 0.00 C ATOM 1648 CD2 PHE A 104 15.929 4.665 1.739 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.116 2.189 1.469 1.00 0.00 C ATOM 1650 CE2 PHE A 104 16.679 4.143 2.776 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.272 2.903 2.641 1.00 0.00 C ATOM 0 H PHE A 104 16.335 6.667 -0.049 1.00 0.00 H new ATOM 0 HA PHE A 104 16.348 4.652 -2.197 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.171 5.169 -0.154 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.451 3.716 -1.093 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.247 2.155 -0.479 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.466 5.634 1.850 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.579 1.220 1.361 1.00 0.00 H new ATOM 0 HE2 PHE A 104 16.801 4.704 3.691 1.00 0.00 H new ATOM 0 HZ PHE A 104 17.857 2.492 3.451 1.00 0.00 H new ATOM 1661 N GLU A 105 15.258 7.387 -2.760 1.00 0.00 N ATOM 1662 CA GLU A 105 14.465 8.271 -3.606 1.00 0.00 C ATOM 1663 C GLU A 105 14.155 7.609 -4.945 1.00 0.00 C ATOM 1664 O GLU A 105 13.033 7.692 -5.446 1.00 0.00 O ATOM 1665 CB GLU A 105 15.205 9.591 -3.837 1.00 0.00 C ATOM 1666 CG GLU A 105 14.295 10.732 -4.261 1.00 0.00 C ATOM 1667 CD GLU A 105 15.008 11.757 -5.121 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.940 12.414 -4.612 1.00 0.00 O ATOM 1669 OE2 GLU A 105 14.634 11.903 -6.304 1.00 0.00 O ATOM 0 H GLU A 105 16.130 7.795 -2.424 1.00 0.00 H new ATOM 0 HA GLU A 105 13.524 8.474 -3.094 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.724 9.872 -2.921 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.967 9.442 -4.602 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.445 10.329 -4.812 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.896 11.223 -3.373 1.00 0.00 H new ATOM 1676 N ASP A 106 15.156 6.952 -5.520 1.00 0.00 N ATOM 1677 CA ASP A 106 14.991 6.275 -6.801 1.00 0.00 C ATOM 1678 C ASP A 106 13.998 5.123 -6.682 1.00 0.00 C ATOM 1679 O ASP A 106 12.930 5.146 -7.293 1.00 0.00 O ATOM 1680 CB ASP A 106 16.338 5.754 -7.304 1.00 0.00 C ATOM 1681 CG ASP A 106 17.311 6.873 -7.619 1.00 0.00 C ATOM 1682 OD1 ASP A 106 16.901 7.843 -8.289 1.00 0.00 O ATOM 1683 OD2 ASP A 106 18.482 6.778 -7.195 1.00 0.00 O ATOM 0 H ASP A 106 16.091 6.874 -5.119 1.00 0.00 H new ATOM 0 HA ASP A 106 14.599 6.996 -7.518 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.775 5.098 -6.551 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.180 5.151 -8.198 1.00 0.00 H new ATOM 1688 N ALA A 107 14.359 4.116 -5.893 1.00 0.00 N ATOM 1689 CA ALA A 107 13.500 2.956 -5.693 1.00 0.00 C ATOM 1690 C ALA A 107 12.059 3.379 -5.429 1.00 0.00 C ATOM 1691 O ALA A 107 11.125 2.835 -6.019 1.00 0.00 O ATOM 1692 CB ALA A 107 14.021 2.104 -4.545 1.00 0.00 C ATOM 0 H ALA A 107 15.241 4.081 -5.382 1.00 0.00 H new ATOM 0 HA ALA A 107 13.515 2.362 -6.607 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.369 1.241 -4.407 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.031 1.763 -4.774 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.037 2.696 -3.630 1.00 0.00 H new ATOM 1698 N GLN A 108 11.886 4.351 -4.539 1.00 0.00 N ATOM 1699 CA GLN A 108 10.557 4.845 -4.197 1.00 0.00 C ATOM 1700 C GLN A 108 9.773 5.213 -5.452 1.00 0.00 C ATOM 1701 O GLN A 108 8.569 4.974 -5.534 1.00 0.00 O ATOM 1702 CB GLN A 108 10.664 6.059 -3.273 1.00 0.00 C ATOM 1703 CG GLN A 108 9.322 6.691 -2.941 1.00 0.00 C ATOM 1704 CD GLN A 108 9.454 7.903 -2.040 1.00 0.00 C ATOM 1705 OE1 GLN A 108 10.166 8.855 -2.362 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.768 7.875 -0.904 1.00 0.00 N ATOM 0 H GLN A 108 12.648 4.812 -4.042 1.00 0.00 H new ATOM 0 HA GLN A 108 10.023 4.049 -3.679 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.154 5.758 -2.347 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.302 6.807 -3.743 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.824 6.983 -3.865 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.686 5.950 -2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 108 8.190 7.066 -0.677 1.00 0.00 H new ATOM 0 HE22 GLN A 108 8.819 8.663 -0.258 1.00 0.00 H new ATOM 1715 N GLU A 109 10.465 5.796 -6.426 1.00 0.00 N ATOM 1716 CA GLU A 109 9.831 6.198 -7.677 1.00 0.00 C ATOM 1717 C GLU A 109 9.473 4.979 -8.522 1.00 0.00 C ATOM 1718 O GLU A 109 8.366 4.880 -9.052 1.00 0.00 O ATOM 1719 CB GLU A 109 10.756 7.126 -8.467 1.00 0.00 C ATOM 1720 CG GLU A 109 10.414 7.211 -9.945 1.00 0.00 C ATOM 1721 CD GLU A 109 11.356 8.120 -10.710 1.00 0.00 C ATOM 1722 OE1 GLU A 109 12.559 8.146 -10.376 1.00 0.00 O ATOM 1723 OE2 GLU A 109 10.890 8.806 -11.644 1.00 0.00 O ATOM 0 H GLU A 109 11.463 6.000 -6.373 1.00 0.00 H new ATOM 0 HA GLU A 109 8.912 6.732 -7.434 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.711 8.125 -8.034 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.784 6.779 -8.360 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.446 6.212 -10.380 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.393 7.575 -10.058 1.00 0.00 H new ATOM 1730 N HIS A 110 10.418 4.052 -8.643 1.00 0.00 N ATOM 1731 CA HIS A 110 10.203 2.839 -9.424 1.00 0.00 C ATOM 1732 C HIS A 110 8.931 2.124 -8.977 1.00 0.00 C ATOM 1733 O HIS A 110 8.042 1.856 -9.786 1.00 0.00 O ATOM 1734 CB HIS A 110 11.403 1.901 -9.289 1.00 0.00 C ATOM 1735 CG HIS A 110 11.501 0.892 -10.391 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.767 1.232 -11.701 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.370 -0.455 -10.373 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.792 0.138 -12.441 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.555 -0.900 -11.659 1.00 0.00 N ATOM 0 H HIS A 110 11.339 4.118 -8.211 1.00 0.00 H new ATOM 0 HA HIS A 110 10.090 3.125 -10.470 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.317 2.494 -9.268 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.340 1.379 -8.334 1.00 0.00 H new ATOM 0 HD2 HIS A 110 11.159 -1.066 -9.508 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.975 0.099 -13.505 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.516 -1.873 -11.961 1.00 0.00 H new ATOM 1747 N ILE A 111 8.852 1.817 -7.687 1.00 0.00 N ATOM 1748 CA ILE A 111 7.690 1.134 -7.134 1.00 0.00 C ATOM 1749 C ILE A 111 6.421 1.954 -7.340 1.00 0.00 C ATOM 1750 O ILE A 111 5.374 1.416 -7.702 1.00 0.00 O ATOM 1751 CB ILE A 111 7.865 0.850 -5.630 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.102 -0.019 -5.394 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.622 0.176 -5.070 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.075 -1.327 -6.152 1.00 0.00 C ATOM 0 H ILE A 111 9.580 2.031 -7.005 1.00 0.00 H new ATOM 0 HA ILE A 111 7.599 0.187 -7.666 1.00 0.00 H new ATOM 0 HB ILE A 111 8.005 1.798 -5.110 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.991 0.542 -5.684 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.191 -0.228 -4.328 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.761 -0.018 -4.007 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.760 0.828 -5.210 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.453 -0.766 -5.592 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.983 -1.891 -5.937 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.205 -1.908 -5.844 1.00 0.00 H new ATOM 0 HD13 ILE A 111 9.017 -1.126 -7.222 1.00 0.00 H new ATOM 1766 N TYR A 112 6.522 3.258 -7.110 1.00 0.00 N ATOM 1767 CA TYR A 112 5.382 4.153 -7.270 1.00 0.00 C ATOM 1768 C TYR A 112 4.792 4.039 -8.673 1.00 0.00 C ATOM 1769 O TYR A 112 3.605 3.759 -8.840 1.00 0.00 O ATOM 1770 CB TYR A 112 5.800 5.599 -6.996 1.00 0.00 C ATOM 1771 CG TYR A 112 4.762 6.618 -7.411 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.541 6.908 -8.751 1.00 0.00 C ATOM 1773 CD2 TYR A 112 4.001 7.289 -6.461 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.595 7.839 -9.134 1.00 0.00 C ATOM 1775 CE2 TYR A 112 3.052 8.220 -6.834 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.853 8.492 -8.172 1.00 0.00 C ATOM 1777 OH TYR A 112 1.908 9.419 -8.549 1.00 0.00 O ATOM 0 H TYR A 112 7.382 3.719 -6.812 1.00 0.00 H new ATOM 0 HA TYR A 112 4.618 3.860 -6.550 1.00 0.00 H new ATOM 0 HB2 TYR A 112 6.005 5.714 -5.932 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.731 5.806 -7.524 1.00 0.00 H new ATOM 0 HD1 TYR A 112 5.119 6.397 -9.507 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.155 7.079 -5.413 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.437 8.054 -10.181 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.469 8.732 -6.083 1.00 0.00 H new ATOM 0 HH TYR A 112 1.473 9.786 -7.751 1.00 0.00 H new ATOM 1787 N LYS A 113 5.632 4.257 -9.680 1.00 0.00 N ATOM 1788 CA LYS A 113 5.197 4.178 -11.069 1.00 0.00 C ATOM 1789 C LYS A 113 4.573 2.819 -11.367 1.00 0.00 C ATOM 1790 O LYS A 113 3.923 2.635 -12.397 1.00 0.00 O ATOM 1791 CB LYS A 113 6.379 4.426 -12.009 1.00 0.00 C ATOM 1792 CG LYS A 113 7.070 5.759 -11.780 1.00 0.00 C ATOM 1793 CD LYS A 113 8.298 5.910 -12.662 1.00 0.00 C ATOM 1794 CE LYS A 113 9.441 5.030 -12.182 1.00 0.00 C ATOM 1795 NZ LYS A 113 9.511 3.749 -12.939 1.00 0.00 N ATOM 0 H LYS A 113 6.618 4.490 -9.559 1.00 0.00 H new ATOM 0 HA LYS A 113 4.443 4.948 -11.232 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.106 3.623 -11.884 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.028 4.381 -13.040 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.372 6.571 -11.984 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.360 5.844 -10.733 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.044 5.649 -13.689 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.617 6.952 -12.667 1.00 0.00 H new ATOM 0 HE2 LYS A 113 10.383 5.567 -12.290 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.315 4.818 -11.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.505 3.520 -13.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.089 2.987 -12.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 8.988 3.845 -13.833 1.00 0.00 H new ATOM 1809 N LEU A 114 4.773 1.869 -10.460 1.00 0.00 N ATOM 1810 CA LEU A 114 4.229 0.526 -10.625 1.00 0.00 C ATOM 1811 C LEU A 114 2.891 0.388 -9.904 1.00 0.00 C ATOM 1812 O LEU A 114 1.842 0.282 -10.538 1.00 0.00 O ATOM 1813 CB LEU A 114 5.216 -0.515 -10.095 1.00 0.00 C ATOM 1814 CG LEU A 114 4.636 -1.896 -9.789 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.745 -2.803 -11.004 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.341 -2.517 -8.592 1.00 0.00 C ATOM 0 H LEU A 114 5.308 2.004 -9.602 1.00 0.00 H new ATOM 0 HA LEU A 114 4.067 0.355 -11.689 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.016 -0.633 -10.826 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.671 -0.124 -9.185 1.00 0.00 H new ATOM 0 HG LEU A 114 3.581 -1.779 -9.543 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.327 -3.781 -10.766 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.193 -2.365 -11.836 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.793 -2.914 -11.282 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.915 -3.500 -8.389 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.404 -2.620 -8.809 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.209 -1.877 -7.720 1.00 0.00 H new ATOM 1828 N MET A 115 2.938 0.393 -8.576 1.00 0.00 N ATOM 1829 CA MET A 115 1.729 0.272 -7.769 1.00 0.00 C ATOM 1830 C MET A 115 0.607 1.135 -8.338 1.00 0.00 C ATOM 1831 O MET A 115 -0.562 0.751 -8.306 1.00 0.00 O ATOM 1832 CB MET A 115 2.015 0.675 -6.321 1.00 0.00 C ATOM 1833 CG MET A 115 3.182 -0.075 -5.701 1.00 0.00 C ATOM 1834 SD MET A 115 3.499 0.421 -3.996 1.00 0.00 S ATOM 1835 CE MET A 115 4.051 2.109 -4.232 1.00 0.00 C ATOM 0 H MET A 115 3.799 0.479 -8.036 1.00 0.00 H new ATOM 0 HA MET A 115 1.409 -0.770 -7.792 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.220 1.745 -6.284 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.122 0.501 -5.721 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.979 -1.145 -5.732 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.078 0.097 -6.298 1.00 0.00 H new ATOM 0 HE1 MET A 115 5.094 2.197 -3.928 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.956 2.379 -5.284 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.439 2.780 -3.628 1.00 0.00 H new ATOM 1845 N LYS A 116 0.971 2.302 -8.858 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.004 3.220 -9.435 1.00 0.00 C ATOM 1847 C LYS A 116 -0.930 2.492 -10.405 1.00 0.00 C ATOM 1848 O LYS A 116 -2.152 2.608 -10.317 1.00 0.00 O ATOM 1849 CB LYS A 116 0.708 4.366 -10.156 1.00 0.00 C ATOM 1850 CG LYS A 116 1.542 3.914 -11.342 1.00 0.00 C ATOM 1851 CD LYS A 116 2.226 5.087 -12.024 1.00 0.00 C ATOM 1852 CE LYS A 116 1.263 5.847 -12.923 1.00 0.00 C ATOM 1853 NZ LYS A 116 1.957 6.451 -14.094 1.00 0.00 N ATOM 0 H LYS A 116 1.935 2.635 -8.892 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.606 3.628 -8.623 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.035 5.086 -10.499 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.352 4.886 -9.447 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.293 3.198 -11.008 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.905 3.396 -12.059 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.631 5.762 -11.270 1.00 0.00 H new ATOM 0 HD3 LYS A 116 3.068 4.726 -12.614 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.482 5.171 -13.272 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.772 6.632 -12.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 1.267 6.960 -14.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 2.685 7.115 -13.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.405 5.700 -14.657 1.00 0.00 H new ATOM 1867 N SER A 117 -0.338 1.740 -11.328 1.00 0.00 N ATOM 1868 CA SER A 117 -1.110 0.995 -12.316 1.00 0.00 C ATOM 1869 C SER A 117 -0.873 -0.505 -12.171 1.00 0.00 C ATOM 1870 O SER A 117 -1.188 -1.284 -13.070 1.00 0.00 O ATOM 1871 CB SER A 117 -0.740 1.447 -13.730 1.00 0.00 C ATOM 1872 OG SER A 117 -1.536 0.789 -14.700 1.00 0.00 O ATOM 0 H SER A 117 0.673 1.631 -11.412 1.00 0.00 H new ATOM 0 HA SER A 117 -2.167 1.197 -12.143 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.873 2.525 -13.817 1.00 0.00 H new ATOM 0 HB3 SER A 117 0.313 1.239 -13.918 1.00 0.00 H new ATOM 0 HG SER A 117 -1.759 -0.112 -14.384 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.315 -0.902 -11.032 1.00 0.00 N ATOM 1879 CA ASP A 118 -0.036 -2.309 -10.767 1.00 0.00 C ATOM 1880 C ASP A 118 -1.038 -2.883 -9.771 1.00 0.00 C ATOM 1881 O ASP A 118 -1.761 -3.831 -10.078 1.00 0.00 O ATOM 1882 CB ASP A 118 1.387 -2.477 -10.233 1.00 0.00 C ATOM 1883 CG ASP A 118 1.865 -3.914 -10.300 1.00 0.00 C ATOM 1884 OD1 ASP A 118 1.605 -4.671 -9.341 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.498 -4.282 -11.312 1.00 0.00 O ATOM 0 H ASP A 118 -0.047 -0.270 -10.278 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.130 -2.856 -11.705 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.064 -1.845 -10.807 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.427 -2.132 -9.200 1.00 0.00 H new ATOM 1890 N SER A 119 -1.075 -2.303 -8.575 1.00 0.00 N ATOM 1891 CA SER A 119 -1.984 -2.760 -7.531 1.00 0.00 C ATOM 1892 C SER A 119 -3.273 -1.944 -7.538 1.00 0.00 C ATOM 1893 O SER A 119 -4.371 -2.496 -7.621 1.00 0.00 O ATOM 1894 CB SER A 119 -1.312 -2.662 -6.160 1.00 0.00 C ATOM 1895 OG SER A 119 -0.686 -1.402 -5.989 1.00 0.00 O ATOM 0 H SER A 119 -0.486 -1.515 -8.305 1.00 0.00 H new ATOM 0 HA SER A 119 -2.233 -3.802 -7.731 1.00 0.00 H new ATOM 0 HB2 SER A 119 -2.054 -2.813 -5.376 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.573 -3.456 -6.056 1.00 0.00 H new ATOM 0 HG SER A 119 -0.265 -1.363 -5.105 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.132 -0.626 -7.450 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.284 0.268 -7.444 1.00 0.00 C ATOM 1903 C TYR A 120 -5.391 -0.264 -8.349 1.00 0.00 C ATOM 1904 O TYR A 120 -6.555 -0.361 -7.958 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.871 1.670 -7.895 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.983 2.441 -8.569 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.989 3.043 -7.823 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.027 2.569 -9.952 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -7.007 3.748 -8.435 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.040 3.273 -10.572 1.00 0.00 C ATOM 1911 CZ TYR A 120 -7.028 3.861 -9.810 1.00 0.00 C ATOM 1912 OH TYR A 120 -8.040 4.563 -10.423 1.00 0.00 O ATOM 0 H TYR A 120 -2.231 -0.153 -7.382 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.666 0.320 -6.424 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.523 2.233 -7.029 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -3.029 1.588 -8.582 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -5.975 2.958 -6.746 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -4.255 2.110 -10.552 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -7.782 4.208 -7.841 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.059 3.363 -11.648 1.00 0.00 H new ATOM 0 HH TYR A 120 -8.758 4.732 -9.778 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.022 -0.618 -9.588 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.967 -1.148 -10.575 1.00 0.00 C ATOM 1924 C PRO A 121 -6.847 -2.253 -10.001 1.00 0.00 C ATOM 1925 O PRO A 121 -8.074 -2.167 -10.042 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.058 -1.705 -11.674 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.800 -0.915 -11.562 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.652 -0.530 -10.122 1.00 0.00 C ATOM 0 HA PRO A 121 -6.662 -0.384 -10.924 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.871 -2.769 -11.531 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.511 -1.590 -12.659 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.944 -1.503 -11.894 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.843 -0.029 -12.196 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.975 -1.203 -9.596 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.246 0.476 -10.017 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.212 -3.290 -9.465 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.937 -4.413 -8.882 1.00 0.00 C ATOM 1938 C ARG A 122 -7.883 -3.937 -7.783 1.00 0.00 C ATOM 1939 O ARG A 122 -9.024 -4.391 -7.692 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.957 -5.442 -8.317 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.232 -6.243 -9.386 1.00 0.00 C ATOM 1942 CD ARG A 122 -6.028 -7.472 -9.798 1.00 0.00 C ATOM 1943 NE ARG A 122 -5.246 -8.374 -10.639 1.00 0.00 N ATOM 1944 CZ ARG A 122 -5.023 -9.649 -10.341 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -5.521 -10.170 -9.228 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -4.302 -10.406 -11.157 1.00 0.00 N ATOM 0 H ARG A 122 -5.197 -3.376 -9.422 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.529 -4.880 -9.669 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.221 -4.929 -7.698 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.499 -6.128 -7.666 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.057 -5.613 -10.258 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.255 -6.549 -9.012 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -6.360 -8.004 -8.907 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -6.924 -7.160 -10.336 1.00 0.00 H new ATOM 0 HE ARG A 122 -4.849 -8.005 -11.503 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -6.077 -9.591 -8.598 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -5.348 -11.149 -9.002 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -3.918 -10.009 -12.015 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -4.131 -11.385 -10.927 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.400 -3.021 -6.950 1.00 0.00 N ATOM 1961 CA PHE A 123 -8.201 -2.486 -5.855 1.00 0.00 C ATOM 1962 C PHE A 123 -9.605 -2.128 -6.334 1.00 0.00 C ATOM 1963 O PHE A 123 -10.598 -2.491 -5.702 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.524 -1.251 -5.257 1.00 0.00 C ATOM 1965 CG PHE A 123 -8.009 -0.911 -3.877 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.020 -1.870 -2.876 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.455 0.367 -3.580 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.466 -1.560 -1.605 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.901 0.682 -2.310 1.00 0.00 C ATOM 1970 CZ PHE A 123 -8.907 -0.283 -1.322 1.00 0.00 C ATOM 0 H PHE A 123 -6.458 -2.634 -7.012 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.283 -3.255 -5.087 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.447 -1.417 -5.224 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.696 -0.398 -5.914 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.676 -2.871 -3.092 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.454 1.125 -4.349 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -8.469 -2.316 -0.834 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.245 1.682 -2.091 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.256 -0.039 -0.330 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.679 -1.415 -7.452 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.961 -1.009 -8.016 1.00 0.00 C ATOM 1982 C ILE A 124 -11.828 -2.221 -8.339 1.00 0.00 C ATOM 1983 O ILE A 124 -13.026 -2.233 -8.057 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.774 -0.170 -9.293 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.999 1.112 -8.979 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.124 0.159 -9.913 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.502 0.966 -9.132 1.00 0.00 C ATOM 0 H ILE A 124 -8.867 -1.106 -7.986 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.459 -0.400 -7.261 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.198 -0.753 -10.012 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.347 1.908 -9.637 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -10.223 1.422 -7.958 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.975 0.753 -10.815 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.642 -0.765 -10.168 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.723 0.726 -9.200 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.018 1.913 -8.894 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.141 0.193 -8.454 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -8.267 0.687 -10.159 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.213 -3.240 -8.932 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.929 -4.458 -9.294 1.00 0.00 C ATOM 2001 C ARG A 125 -12.405 -5.198 -8.048 1.00 0.00 C ATOM 2002 O ARG A 125 -13.531 -5.694 -8.001 1.00 0.00 O ATOM 2003 CB ARG A 125 -11.032 -5.371 -10.132 1.00 0.00 C ATOM 2004 CG ARG A 125 -10.864 -4.907 -11.569 1.00 0.00 C ATOM 2005 CD ARG A 125 -9.987 -3.668 -11.656 1.00 0.00 C ATOM 2006 NE ARG A 125 -9.756 -3.257 -13.038 1.00 0.00 N ATOM 2007 CZ ARG A 125 -10.691 -2.712 -13.809 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -11.913 -2.514 -13.336 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -10.403 -2.364 -15.057 1.00 0.00 N ATOM 0 H ARG A 125 -10.222 -3.246 -9.172 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.801 -4.177 -9.884 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.050 -5.433 -9.662 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.450 -6.378 -10.131 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -10.423 -5.708 -12.162 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -11.842 -4.693 -12.000 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -10.458 -2.851 -11.109 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.031 -3.866 -11.172 1.00 0.00 H new ATOM 0 HE ARG A 125 -8.826 -3.396 -13.433 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -12.138 -2.780 -12.377 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -12.628 -2.095 -13.931 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -9.464 -2.515 -15.425 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.121 -1.946 -15.648 1.00 0.00 H new ATOM 2023 N SER A 126 -11.541 -5.270 -7.041 1.00 0.00 N ATOM 2024 CA SER A 126 -11.872 -5.954 -5.797 1.00 0.00 C ATOM 2025 C SER A 126 -13.087 -5.315 -5.132 1.00 0.00 C ATOM 2026 O SER A 126 -13.254 -4.095 -5.162 1.00 0.00 O ATOM 2027 CB SER A 126 -10.678 -5.924 -4.840 1.00 0.00 C ATOM 2028 OG SER A 126 -10.945 -6.674 -3.668 1.00 0.00 O ATOM 0 H SER A 126 -10.606 -4.863 -7.062 1.00 0.00 H new ATOM 0 HA SER A 126 -12.113 -6.990 -6.034 1.00 0.00 H new ATOM 0 HB2 SER A 126 -9.797 -6.326 -5.340 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.449 -4.893 -4.571 1.00 0.00 H new ATOM 0 HG SER A 126 -10.106 -6.848 -3.193 1.00 0.00 H new ATOM 2034 N SER A 127 -13.932 -6.147 -4.532 1.00 0.00 N ATOM 2035 CA SER A 127 -15.134 -5.664 -3.862 1.00 0.00 C ATOM 2036 C SER A 127 -14.775 -4.782 -2.670 1.00 0.00 C ATOM 2037 O SER A 127 -15.423 -3.767 -2.418 1.00 0.00 O ATOM 2038 CB SER A 127 -15.993 -6.842 -3.399 1.00 0.00 C ATOM 2039 OG SER A 127 -17.292 -6.412 -3.029 1.00 0.00 O ATOM 0 H SER A 127 -13.807 -7.159 -4.496 1.00 0.00 H new ATOM 0 HA SER A 127 -15.702 -5.067 -4.575 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.065 -7.580 -4.198 1.00 0.00 H new ATOM 0 HB3 SER A 127 -15.515 -7.334 -2.552 1.00 0.00 H new ATOM 0 HG SER A 127 -17.822 -7.184 -2.738 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.737 -5.178 -1.940 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.289 -4.424 -0.776 1.00 0.00 C ATOM 2047 C ALA A 128 -13.435 -2.924 -1.005 1.00 0.00 C ATOM 2048 O ALA A 128 -13.837 -2.185 -0.106 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.846 -4.772 -0.445 1.00 0.00 C ATOM 0 H ALA A 128 -13.191 -6.017 -2.135 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.920 -4.699 0.069 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.525 -4.201 0.426 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -11.769 -5.838 -0.229 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.209 -4.527 -1.294 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.105 -2.479 -2.212 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.196 -1.066 -2.558 1.00 0.00 C ATOM 2057 C TYR A 129 -14.644 -0.660 -2.814 1.00 0.00 C ATOM 2058 O TYR A 129 -15.107 0.370 -2.325 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.344 -0.765 -3.792 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.738 0.509 -4.504 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -13.786 0.523 -5.417 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -12.063 1.699 -4.265 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -14.149 1.684 -6.070 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.420 2.866 -4.913 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.464 2.854 -5.814 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.822 4.013 -6.463 1.00 0.00 O ATOM 0 H TYR A 129 -12.772 -3.077 -2.968 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.819 -0.487 -1.715 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.298 -0.695 -3.493 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.421 -1.600 -4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.326 -0.390 -5.619 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.245 1.712 -3.560 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.965 1.676 -6.778 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -11.884 3.783 -4.715 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.794 4.763 -5.833 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.354 -1.478 -3.585 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.749 -1.205 -3.907 1.00 0.00 C ATOM 2078 C GLN A 130 -17.597 -1.137 -2.640 1.00 0.00 C ATOM 2079 O GLN A 130 -18.278 -0.143 -2.391 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.298 -2.281 -4.845 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.592 -2.335 -6.189 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.184 -1.371 -7.199 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.384 -1.092 -7.178 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.345 -0.857 -8.090 1.00 0.00 N ATOM 0 H GLN A 130 -14.986 -2.335 -3.998 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.798 -0.238 -4.407 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.211 -3.253 -4.359 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.360 -2.100 -5.009 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.536 -2.106 -6.050 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.648 -3.349 -6.584 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.359 -1.116 -8.070 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -16.687 -0.203 -8.794 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.550 -2.201 -1.845 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.315 -2.261 -0.605 1.00 0.00 C ATOM 2095 C GLU A 131 -18.288 -0.916 0.117 1.00 0.00 C ATOM 2096 O GLU A 131 -19.306 -0.458 0.637 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.760 -3.354 0.311 1.00 0.00 C ATOM 2098 CG GLU A 131 -16.298 -3.159 0.675 1.00 0.00 C ATOM 2099 CD GLU A 131 -15.853 -4.064 1.807 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -15.463 -5.217 1.526 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -15.894 -3.620 2.974 1.00 0.00 O ATOM 0 H GLU A 131 -16.991 -3.032 -2.037 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.348 -2.498 -0.858 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.352 -3.385 1.226 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.878 -4.321 -0.178 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -15.680 -3.350 -0.202 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.134 -2.120 0.960 1.00 0.00 H new ATOM 2108 N LEU A 132 -17.118 -0.290 0.144 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.957 1.002 0.802 1.00 0.00 C ATOM 2110 C LEU A 132 -17.888 2.044 0.190 1.00 0.00 C ATOM 2111 O LEU A 132 -18.621 2.731 0.903 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.505 1.474 0.695 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.457 0.574 1.351 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.068 0.901 0.825 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -14.504 0.717 2.865 1.00 0.00 C ATOM 0 H LEU A 132 -16.266 -0.655 -0.282 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.217 0.881 1.854 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.255 1.579 -0.361 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.433 2.466 1.140 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.684 -0.461 1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.335 0.251 1.303 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -13.042 0.746 -0.254 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -12.830 1.941 1.048 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -13.752 0.069 3.315 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.302 1.753 3.139 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -15.492 0.432 3.227 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.855 2.156 -1.133 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.698 3.112 -1.842 1.00 0.00 C ATOM 2129 C LEU A 133 -20.173 2.859 -1.549 1.00 0.00 C ATOM 2130 O LEU A 133 -20.866 3.720 -1.006 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.443 3.029 -3.348 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.189 3.742 -3.856 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -16.682 3.085 -5.130 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.473 5.218 -4.092 1.00 0.00 C ATOM 0 H LEU A 133 -17.253 1.596 -1.737 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.444 4.112 -1.492 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.378 1.978 -3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.308 3.444 -3.866 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.413 3.659 -3.095 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -15.789 3.605 -5.477 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.439 2.042 -4.929 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.454 3.137 -5.898 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.569 5.709 -4.453 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.264 5.322 -4.835 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -17.789 5.682 -3.158 1.00 0.00 H new ATOM 2146 N SER A 134 -20.648 1.671 -1.912 1.00 0.00 N ATOM 2147 CA SER A 134 -22.042 1.305 -1.690 1.00 0.00 C ATOM 2148 C SER A 134 -22.426 1.492 -0.225 1.00 0.00 C ATOM 2149 O SER A 134 -23.410 2.161 0.089 1.00 0.00 O ATOM 2150 CB SER A 134 -22.282 -0.146 -2.111 1.00 0.00 C ATOM 2151 OG SER A 134 -23.583 -0.574 -1.745 1.00 0.00 O ATOM 0 H SER A 134 -20.088 0.946 -2.361 1.00 0.00 H new ATOM 0 HA SER A 134 -22.666 1.961 -2.297 1.00 0.00 H new ATOM 0 HB2 SER A 134 -22.154 -0.241 -3.189 1.00 0.00 H new ATOM 0 HB3 SER A 134 -21.538 -0.791 -1.644 1.00 0.00 H new ATOM 0 HG SER A 134 -23.713 -1.504 -2.026 1.00 0.00 H new ATOM 2157 N GLY A 135 -21.642 0.896 0.667 1.00 0.00 N ATOM 2158 CA GLY A 135 -21.915 1.008 2.088 1.00 0.00 C ATOM 2159 C GLY A 135 -22.932 -0.010 2.565 1.00 0.00 C ATOM 2160 O GLY A 135 -24.122 0.280 2.690 1.00 0.00 O ATOM 0 H GLY A 135 -20.822 0.337 0.431 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -20.987 0.878 2.644 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -22.280 2.012 2.307 1.00 0.00 H new ATOM 2164 N PRO A 136 -22.463 -1.237 2.838 1.00 0.00 N ATOM 2165 CA PRO A 136 -23.324 -2.327 3.307 1.00 0.00 C ATOM 2166 C PRO A 136 -23.829 -2.097 4.727 1.00 0.00 C ATOM 2167 O PRO A 136 -24.693 -2.826 5.215 1.00 0.00 O ATOM 2168 CB PRO A 136 -22.405 -3.550 3.258 1.00 0.00 C ATOM 2169 CG PRO A 136 -21.029 -2.996 3.389 1.00 0.00 C ATOM 2170 CD PRO A 136 -21.057 -1.654 2.711 1.00 0.00 C ATOM 0 HA PRO A 136 -24.223 -2.427 2.699 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -22.630 -4.247 4.066 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -22.524 -4.097 2.323 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.746 -2.898 4.437 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.297 -3.654 2.921 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -20.383 -0.946 3.193 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -20.752 -1.725 1.667 1.00 0.00 H new ATOM 2178 N SER A 137 -23.286 -1.078 5.386 1.00 0.00 N ATOM 2179 CA SER A 137 -23.680 -0.754 6.752 1.00 0.00 C ATOM 2180 C SER A 137 -25.182 -0.500 6.838 1.00 0.00 C ATOM 2181 O SER A 137 -25.802 -0.043 5.878 1.00 0.00 O ATOM 2182 CB SER A 137 -22.914 0.474 7.248 1.00 0.00 C ATOM 2183 OG SER A 137 -23.084 1.571 6.367 1.00 0.00 O ATOM 0 H SER A 137 -22.572 -0.463 4.996 1.00 0.00 H new ATOM 0 HA SER A 137 -23.436 -1.606 7.387 1.00 0.00 H new ATOM 0 HB2 SER A 137 -23.263 0.746 8.244 1.00 0.00 H new ATOM 0 HB3 SER A 137 -21.854 0.235 7.336 1.00 0.00 H new ATOM 0 HG SER A 137 -22.586 2.344 6.707 1.00 0.00 H new ATOM 2189 N SER A 138 -25.761 -0.801 7.996 1.00 0.00 N ATOM 2190 CA SER A 138 -27.191 -0.610 8.209 1.00 0.00 C ATOM 2191 C SER A 138 -27.489 0.823 8.638 1.00 0.00 C ATOM 2192 O SER A 138 -26.773 1.401 9.455 1.00 0.00 O ATOM 2193 CB SER A 138 -27.707 -1.589 9.265 1.00 0.00 C ATOM 2194 OG SER A 138 -29.113 -1.493 9.405 1.00 0.00 O ATOM 0 H SER A 138 -25.262 -1.178 8.801 1.00 0.00 H new ATOM 0 HA SER A 138 -27.703 -0.803 7.266 1.00 0.00 H new ATOM 0 HB2 SER A 138 -27.435 -2.607 8.986 1.00 0.00 H new ATOM 0 HB3 SER A 138 -27.228 -1.382 10.222 1.00 0.00 H new ATOM 0 HG SER A 138 -29.418 -2.130 10.084 1.00 0.00 H new ATOM 2200 N GLY A 139 -28.554 1.392 8.081 1.00 0.00 N ATOM 2201 CA GLY A 139 -28.930 2.753 8.418 1.00 0.00 C ATOM 2202 C GLY A 139 -30.330 3.100 7.952 1.00 0.00 C ATOM 2203 O GLY A 139 -31.274 3.092 8.742 1.00 0.00 O ATOM 0 H GLY A 139 -29.163 0.935 7.402 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -28.866 2.888 9.498 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -28.219 3.445 7.968 1.00 0.00 H new TER 2207 GLY A 139