USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 898 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 Single : A 1 GLY N :NH3+ 178:sc= -0.404 (180deg=-0.405) USER MOD Single : A 2 SER OG : rot -20:sc= 0.66 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -52:sc= 0.903 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 SER OG : rot 41:sc= 0.489 USER MOD Single : A 16 LYS NZ :NH3+ -157:sc= 0.34 (180deg=-0.00888) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 130:sc= -2.85 USER MOD Single : A 26 ASN : amide:sc= -0.735 K(o=-0.74,f=-2.4!) USER MOD Single : A 27 SER OG : rot 108:sc= -1.48 USER MOD Single : A 31 THR OG1 : rot -150:sc= 0.0139 USER MOD Single : A 35 GLN : amide:sc= -11.4! C(o=-11!,f=-13!) USER MOD Single : A 46 ASN : amide:sc= -1.63 K(o=-1.6,f=-2.2) USER MOD Single : A 48 GLN : amide:sc= 0.233 K(o=0.23,f=-4.5!) USER MOD Single : A 51 TYR OH : rot 94:sc= 0.00359 USER MOD Single : A 57 THR OG1 : rot 130:sc= -3.57! USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -1.95 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= -0.114 X(o=-0.11,f=-0.31) USER MOD Single : A 85 ASN : amide:sc= 0.0631 K(o=0.063,f=-2.1!) USER MOD Single : A 86 GLN : amide:sc= -1.53! K(o=-1.5!,f=0.21) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 MET CE :methyl -164:sc= 0 (180deg=-0.234) USER MOD Single : A 98 GLN : amide:sc= -2.9! C(o=-2.9!,f=-3!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 39:sc= 0.15 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -1.38! X(o=-1.4!,f=-1.9) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.129 20.014 5.451 1.00 0.00 N ATOM 2 CA GLY A 1 -8.477 21.417 5.319 1.00 0.00 C ATOM 3 C GLY A 1 -9.178 21.958 6.549 1.00 0.00 C ATOM 4 O GLY A 1 -8.721 21.752 7.673 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.683 19.683 4.572 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.465 19.894 6.243 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.989 19.459 5.633 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.572 21.997 5.135 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.122 21.548 4.450 1.00 0.00 H new ATOM 8 N SER A 2 -10.289 22.655 6.336 1.00 0.00 N ATOM 9 CA SER A 2 -11.052 23.234 7.436 1.00 0.00 C ATOM 10 C SER A 2 -10.123 23.870 8.466 1.00 0.00 C ATOM 11 O SER A 2 -10.322 23.724 9.672 1.00 0.00 O ATOM 12 CB SER A 2 -11.915 22.162 8.105 1.00 0.00 C ATOM 13 OG SER A 2 -11.127 21.301 8.909 1.00 0.00 O ATOM 0 H SER A 2 -10.681 22.833 5.411 1.00 0.00 H new ATOM 0 HA SER A 2 -11.699 24.010 7.028 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.681 22.637 8.718 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.433 21.580 7.343 1.00 0.00 H new ATOM 0 HG SER A 2 -10.191 21.353 8.624 1.00 0.00 H new ATOM 19 N SER A 3 -9.107 24.576 7.980 1.00 0.00 N ATOM 20 CA SER A 3 -8.143 25.232 8.856 1.00 0.00 C ATOM 21 C SER A 3 -7.742 24.313 10.006 1.00 0.00 C ATOM 22 O SER A 3 -7.667 24.738 11.158 1.00 0.00 O ATOM 23 CB SER A 3 -8.728 26.533 9.409 1.00 0.00 C ATOM 24 OG SER A 3 -9.017 27.446 8.364 1.00 0.00 O ATOM 0 H SER A 3 -8.930 24.708 6.984 1.00 0.00 H new ATOM 0 HA SER A 3 -7.253 25.462 8.270 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.637 26.317 9.970 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.023 26.985 10.107 1.00 0.00 H new ATOM 0 HG SER A 3 -9.391 28.269 8.743 1.00 0.00 H new ATOM 30 N GLY A 4 -7.484 23.049 9.684 1.00 0.00 N ATOM 31 CA GLY A 4 -7.094 22.089 10.699 1.00 0.00 C ATOM 32 C GLY A 4 -5.666 21.609 10.525 1.00 0.00 C ATOM 33 O GLY A 4 -5.418 20.611 9.848 1.00 0.00 O ATOM 0 H GLY A 4 -7.538 22.673 8.737 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.204 22.542 11.684 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.768 21.233 10.664 1.00 0.00 H new ATOM 37 N SER A 5 -4.725 22.322 11.136 1.00 0.00 N ATOM 38 CA SER A 5 -3.315 21.966 11.041 1.00 0.00 C ATOM 39 C SER A 5 -2.903 21.759 9.587 1.00 0.00 C ATOM 40 O SER A 5 -2.174 20.822 9.263 1.00 0.00 O ATOM 41 CB SER A 5 -3.031 20.698 11.848 1.00 0.00 C ATOM 42 OG SER A 5 -1.656 20.357 11.796 1.00 0.00 O ATOM 0 H SER A 5 -4.914 23.149 11.702 1.00 0.00 H new ATOM 0 HA SER A 5 -2.731 22.789 11.453 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.333 20.848 12.885 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.628 19.874 11.458 1.00 0.00 H new ATOM 0 HG SER A 5 -1.363 20.321 10.862 1.00 0.00 H new ATOM 48 N SER A 6 -3.377 22.642 8.713 1.00 0.00 N ATOM 49 CA SER A 6 -3.063 22.555 7.292 1.00 0.00 C ATOM 50 C SER A 6 -1.667 23.104 7.009 1.00 0.00 C ATOM 51 O SER A 6 -1.510 24.259 6.616 1.00 0.00 O ATOM 52 CB SER A 6 -4.101 23.323 6.471 1.00 0.00 C ATOM 53 OG SER A 6 -3.977 23.029 5.090 1.00 0.00 O ATOM 0 H SER A 6 -3.980 23.425 8.965 1.00 0.00 H new ATOM 0 HA SER A 6 -3.087 21.504 7.004 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.103 23.065 6.813 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.976 24.394 6.631 1.00 0.00 H new ATOM 0 HG SER A 6 -4.652 23.531 4.587 1.00 0.00 H new ATOM 59 N GLY A 7 -0.656 22.265 7.213 1.00 0.00 N ATOM 60 CA GLY A 7 0.713 22.683 6.976 1.00 0.00 C ATOM 61 C GLY A 7 1.672 22.148 8.023 1.00 0.00 C ATOM 62 O GLY A 7 2.017 22.849 8.973 1.00 0.00 O ATOM 0 H GLY A 7 -0.761 21.304 7.538 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.029 22.341 5.990 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.761 23.772 6.966 1.00 0.00 H new ATOM 66 N ASN A 8 2.100 20.902 7.849 1.00 0.00 N ATOM 67 CA ASN A 8 3.023 20.274 8.787 1.00 0.00 C ATOM 68 C ASN A 8 4.469 20.620 8.443 1.00 0.00 C ATOM 69 O ASN A 8 5.346 19.757 8.465 1.00 0.00 O ATOM 70 CB ASN A 8 2.835 18.755 8.780 1.00 0.00 C ATOM 71 CG ASN A 8 1.499 18.336 9.363 1.00 0.00 C ATOM 72 OD1 ASN A 8 1.092 18.818 10.420 1.00 0.00 O ATOM 73 ND2 ASN A 8 0.811 17.433 8.674 1.00 0.00 N ATOM 0 H ASN A 8 1.823 20.308 7.068 1.00 0.00 H new ATOM 0 HA ASN A 8 2.804 20.656 9.784 1.00 0.00 H new ATOM 0 HB2 ASN A 8 2.914 18.386 7.757 1.00 0.00 H new ATOM 0 HB3 ASN A 8 3.639 18.289 9.350 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -0.094 17.111 9.017 1.00 0.00 H new ATOM 0 HD22 ASN A 8 1.188 17.061 7.802 1.00 0.00 H new ATOM 80 N ASP A 9 4.708 21.887 8.127 1.00 0.00 N ATOM 81 CA ASP A 9 6.048 22.349 7.780 1.00 0.00 C ATOM 82 C ASP A 9 6.475 21.803 6.421 1.00 0.00 C ATOM 83 O ASP A 9 7.601 21.334 6.256 1.00 0.00 O ATOM 84 CB ASP A 9 7.051 21.923 8.853 1.00 0.00 C ATOM 85 CG ASP A 9 6.557 22.218 10.256 1.00 0.00 C ATOM 86 OD1 ASP A 9 6.575 23.401 10.656 1.00 0.00 O ATOM 87 OD2 ASP A 9 6.152 21.265 10.954 1.00 0.00 O ATOM 0 H ASP A 9 3.992 22.613 8.104 1.00 0.00 H new ATOM 0 HA ASP A 9 6.028 23.437 7.725 1.00 0.00 H new ATOM 0 HB2 ASP A 9 7.249 20.855 8.758 1.00 0.00 H new ATOM 0 HB3 ASP A 9 7.997 22.439 8.688 1.00 0.00 H new ATOM 92 N ASN A 10 5.569 21.866 5.452 1.00 0.00 N ATOM 93 CA ASN A 10 5.852 21.377 4.107 1.00 0.00 C ATOM 94 C ASN A 10 6.606 20.051 4.159 1.00 0.00 C ATOM 95 O ASN A 10 7.565 19.842 3.416 1.00 0.00 O ATOM 96 CB ASN A 10 6.667 22.410 3.327 1.00 0.00 C ATOM 97 CG ASN A 10 5.922 23.719 3.150 1.00 0.00 C ATOM 98 OD1 ASN A 10 5.020 23.826 2.319 1.00 0.00 O ATOM 99 ND2 ASN A 10 6.299 24.724 3.932 1.00 0.00 N ATOM 0 H ASN A 10 4.632 22.251 5.572 1.00 0.00 H new ATOM 0 HA ASN A 10 4.902 21.215 3.598 1.00 0.00 H new ATOM 0 HB2 ASN A 10 7.606 22.597 3.848 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.921 22.004 2.348 1.00 0.00 H new ATOM 0 HD21 ASN A 10 5.836 25.630 3.858 1.00 0.00 H new ATOM 0 HD22 ASN A 10 7.052 24.590 4.607 1.00 0.00 H new ATOM 106 N SER A 11 6.165 19.160 5.041 1.00 0.00 N ATOM 107 CA SER A 11 6.800 17.856 5.192 1.00 0.00 C ATOM 108 C SER A 11 5.906 16.749 4.640 1.00 0.00 C ATOM 109 O SER A 11 4.701 16.709 4.887 1.00 0.00 O ATOM 110 CB SER A 11 7.116 17.586 6.664 1.00 0.00 C ATOM 111 OG SER A 11 7.931 18.610 7.207 1.00 0.00 O ATOM 0 H SER A 11 5.371 19.317 5.662 1.00 0.00 H new ATOM 0 HA SER A 11 7.730 17.865 4.624 1.00 0.00 H new ATOM 0 HB2 SER A 11 6.188 17.516 7.231 1.00 0.00 H new ATOM 0 HB3 SER A 11 7.622 16.625 6.760 1.00 0.00 H new ATOM 0 HG SER A 11 7.620 19.481 6.884 1.00 0.00 H new ATOM 117 N PRO A 12 6.510 15.828 3.874 1.00 0.00 N ATOM 118 CA PRO A 12 5.789 14.703 3.272 1.00 0.00 C ATOM 119 C PRO A 12 5.334 13.683 4.310 1.00 0.00 C ATOM 120 O PRO A 12 6.131 13.209 5.119 1.00 0.00 O ATOM 121 CB PRO A 12 6.823 14.082 2.330 1.00 0.00 C ATOM 122 CG PRO A 12 8.141 14.461 2.912 1.00 0.00 C ATOM 123 CD PRO A 12 7.944 15.814 3.538 1.00 0.00 C ATOM 0 HA PRO A 12 4.876 15.026 2.772 1.00 0.00 H new ATOM 0 HB2 PRO A 12 6.710 12.999 2.277 1.00 0.00 H new ATOM 0 HB3 PRO A 12 6.714 14.464 1.315 1.00 0.00 H new ATOM 0 HG2 PRO A 12 8.464 13.731 3.654 1.00 0.00 H new ATOM 0 HG3 PRO A 12 8.912 14.496 2.142 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.566 15.941 4.424 1.00 0.00 H new ATOM 0 HD3 PRO A 12 8.203 16.618 2.849 1.00 0.00 H new ATOM 131 N ARG A 13 4.047 13.350 4.281 1.00 0.00 N ATOM 132 CA ARG A 13 3.487 12.387 5.221 1.00 0.00 C ATOM 133 C ARG A 13 2.739 11.280 4.483 1.00 0.00 C ATOM 134 O ARG A 13 1.724 11.529 3.833 1.00 0.00 O ATOM 135 CB ARG A 13 2.544 13.088 6.201 1.00 0.00 C ATOM 136 CG ARG A 13 3.261 13.963 7.215 1.00 0.00 C ATOM 137 CD ARG A 13 3.775 13.148 8.391 1.00 0.00 C ATOM 138 NE ARG A 13 5.129 12.651 8.163 1.00 0.00 N ATOM 139 CZ ARG A 13 6.220 13.393 8.320 1.00 0.00 C ATOM 140 NH1 ARG A 13 6.116 14.658 8.703 1.00 0.00 N ATOM 141 NH2 ARG A 13 7.418 12.870 8.093 1.00 0.00 N ATOM 0 H ARG A 13 3.374 13.733 3.617 1.00 0.00 H new ATOM 0 HA ARG A 13 4.310 11.938 5.777 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.839 13.701 5.639 1.00 0.00 H new ATOM 0 HB3 ARG A 13 1.960 12.336 6.731 1.00 0.00 H new ATOM 0 HG2 ARG A 13 4.095 14.472 6.732 1.00 0.00 H new ATOM 0 HG3 ARG A 13 2.581 14.735 7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 13 3.761 13.762 9.291 1.00 0.00 H new ATOM 0 HD3 ARG A 13 3.105 12.307 8.569 1.00 0.00 H new ATOM 0 HE ARG A 13 5.243 11.682 7.867 1.00 0.00 H new ATOM 0 HH11 ARG A 13 5.197 15.064 8.878 1.00 0.00 H new ATOM 0 HH12 ARG A 13 6.955 15.225 8.823 1.00 0.00 H new ATOM 0 HH21 ARG A 13 7.502 11.897 7.798 1.00 0.00 H new ATOM 0 HH22 ARG A 13 8.255 13.441 8.214 1.00 0.00 H new ATOM 155 N PHE A 14 3.249 10.057 4.589 1.00 0.00 N ATOM 156 CA PHE A 14 2.631 8.912 3.931 1.00 0.00 C ATOM 157 C PHE A 14 1.177 8.753 4.367 1.00 0.00 C ATOM 158 O PHE A 14 0.860 8.855 5.552 1.00 0.00 O ATOM 159 CB PHE A 14 3.412 7.634 4.244 1.00 0.00 C ATOM 160 CG PHE A 14 4.459 7.305 3.219 1.00 0.00 C ATOM 161 CD1 PHE A 14 4.101 7.021 1.911 1.00 0.00 C ATOM 162 CD2 PHE A 14 5.801 7.281 3.563 1.00 0.00 C ATOM 163 CE1 PHE A 14 5.063 6.717 0.965 1.00 0.00 C ATOM 164 CE2 PHE A 14 6.767 6.978 2.621 1.00 0.00 C ATOM 165 CZ PHE A 14 6.397 6.697 1.321 1.00 0.00 C ATOM 0 H PHE A 14 4.088 9.834 5.124 1.00 0.00 H new ATOM 0 HA PHE A 14 2.652 9.088 2.856 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.889 7.739 5.218 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.714 6.800 4.319 1.00 0.00 H new ATOM 0 HD1 PHE A 14 3.059 7.037 1.627 1.00 0.00 H new ATOM 0 HD2 PHE A 14 6.096 7.501 4.578 1.00 0.00 H new ATOM 0 HE1 PHE A 14 4.771 6.496 -0.051 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.810 6.961 2.902 1.00 0.00 H new ATOM 0 HZ PHE A 14 7.150 6.462 0.583 1.00 0.00 H new ATOM 175 N GLU A 15 0.299 8.503 3.401 1.00 0.00 N ATOM 176 CA GLU A 15 -1.121 8.331 3.686 1.00 0.00 C ATOM 177 C GLU A 15 -1.327 7.652 5.036 1.00 0.00 C ATOM 178 O GLU A 15 -2.184 8.054 5.823 1.00 0.00 O ATOM 179 CB GLU A 15 -1.789 7.510 2.582 1.00 0.00 C ATOM 180 CG GLU A 15 -1.592 8.086 1.190 1.00 0.00 C ATOM 181 CD GLU A 15 -2.687 7.672 0.226 1.00 0.00 C ATOM 182 OE1 GLU A 15 -2.616 6.544 -0.304 1.00 0.00 O ATOM 183 OE2 GLU A 15 -3.616 8.477 0.004 1.00 0.00 O ATOM 0 H GLU A 15 0.545 8.415 2.415 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.580 9.319 3.723 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.392 6.495 2.605 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.857 7.440 2.789 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.560 9.174 1.252 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.628 7.761 0.800 1.00 0.00 H new ATOM 190 N LYS A 16 -0.534 6.618 5.299 1.00 0.00 N ATOM 191 CA LYS A 16 -0.627 5.881 6.554 1.00 0.00 C ATOM 192 C LYS A 16 0.758 5.483 7.054 1.00 0.00 C ATOM 193 O LYS A 16 1.705 5.382 6.275 1.00 0.00 O ATOM 194 CB LYS A 16 -1.494 4.634 6.373 1.00 0.00 C ATOM 195 CG LYS A 16 -2.639 4.825 5.394 1.00 0.00 C ATOM 196 CD LYS A 16 -3.011 3.521 4.709 1.00 0.00 C ATOM 197 CE LYS A 16 -2.225 3.322 3.422 1.00 0.00 C ATOM 198 NZ LYS A 16 -2.553 2.026 2.766 1.00 0.00 N ATOM 0 H LYS A 16 0.181 6.271 4.659 1.00 0.00 H new ATOM 0 HA LYS A 16 -1.089 6.532 7.296 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.866 3.812 6.029 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.900 4.341 7.341 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.507 5.221 5.921 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -2.358 5.564 4.644 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -2.821 2.687 5.385 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.079 3.516 4.489 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.439 4.141 2.735 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.157 3.359 3.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -1.767 1.741 2.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.703 1.297 3.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.418 2.133 2.199 1.00 0.00 H new ATOM 212 N SER A 17 0.868 5.257 8.359 1.00 0.00 N ATOM 213 CA SER A 17 2.138 4.871 8.964 1.00 0.00 C ATOM 214 C SER A 17 2.578 3.496 8.473 1.00 0.00 C ATOM 215 O SER A 17 3.770 3.194 8.422 1.00 0.00 O ATOM 216 CB SER A 17 2.020 4.867 10.490 1.00 0.00 C ATOM 217 OG SER A 17 1.786 6.173 10.987 1.00 0.00 O ATOM 0 H SER A 17 0.093 5.334 9.018 1.00 0.00 H new ATOM 0 HA SER A 17 2.891 5.601 8.667 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.206 4.208 10.793 1.00 0.00 H new ATOM 0 HB3 SER A 17 2.934 4.466 10.928 1.00 0.00 H new ATOM 0 HG SER A 17 1.713 6.143 11.964 1.00 0.00 H new ATOM 223 N VAL A 18 1.606 2.664 8.112 1.00 0.00 N ATOM 224 CA VAL A 18 1.891 1.320 7.624 1.00 0.00 C ATOM 225 C VAL A 18 0.837 0.864 6.621 1.00 0.00 C ATOM 226 O VAL A 18 -0.303 0.581 6.989 1.00 0.00 O ATOM 227 CB VAL A 18 1.957 0.305 8.780 1.00 0.00 C ATOM 228 CG1 VAL A 18 2.235 -1.093 8.249 1.00 0.00 C ATOM 229 CG2 VAL A 18 3.013 0.719 9.793 1.00 0.00 C ATOM 0 H VAL A 18 0.614 2.897 8.148 1.00 0.00 H new ATOM 0 HA VAL A 18 2.863 1.362 7.132 1.00 0.00 H new ATOM 0 HB VAL A 18 0.990 0.291 9.283 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.278 -1.796 9.081 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.439 -1.388 7.566 1.00 0.00 H new ATOM 0 HG13 VAL A 18 3.188 -1.098 7.720 1.00 0.00 H new ATOM 0 HG21 VAL A 18 3.046 -0.010 10.603 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.987 0.764 9.306 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.764 1.700 10.198 1.00 0.00 H new ATOM 239 N TYR A 19 1.226 0.795 5.353 1.00 0.00 N ATOM 240 CA TYR A 19 0.314 0.375 4.296 1.00 0.00 C ATOM 241 C TYR A 19 0.070 -1.129 4.353 1.00 0.00 C ATOM 242 O TYR A 19 0.839 -1.915 3.800 1.00 0.00 O ATOM 243 CB TYR A 19 0.876 0.760 2.926 1.00 0.00 C ATOM 244 CG TYR A 19 0.832 2.246 2.649 1.00 0.00 C ATOM 245 CD1 TYR A 19 1.264 3.163 3.598 1.00 0.00 C ATOM 246 CD2 TYR A 19 0.358 2.732 1.436 1.00 0.00 C ATOM 247 CE1 TYR A 19 1.225 4.521 3.350 1.00 0.00 C ATOM 248 CE2 TYR A 19 0.316 4.089 1.178 1.00 0.00 C ATOM 249 CZ TYR A 19 0.750 4.979 2.138 1.00 0.00 C ATOM 250 OH TYR A 19 0.710 6.331 1.886 1.00 0.00 O ATOM 0 H TYR A 19 2.167 1.024 5.032 1.00 0.00 H new ATOM 0 HA TYR A 19 -0.637 0.885 4.448 1.00 0.00 H new ATOM 0 HB2 TYR A 19 1.908 0.416 2.856 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.313 0.238 2.152 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.637 2.808 4.547 1.00 0.00 H new ATOM 0 HD2 TYR A 19 0.017 2.037 0.683 1.00 0.00 H new ATOM 0 HE1 TYR A 19 1.564 5.220 4.100 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -0.055 4.450 0.230 1.00 0.00 H new ATOM 0 HH TYR A 19 1.130 6.515 1.020 1.00 0.00 H new ATOM 260 N GLU A 20 -1.008 -1.522 5.026 1.00 0.00 N ATOM 261 CA GLU A 20 -1.354 -2.933 5.156 1.00 0.00 C ATOM 262 C GLU A 20 -2.141 -3.414 3.940 1.00 0.00 C ATOM 263 O GLU A 20 -3.275 -2.991 3.714 1.00 0.00 O ATOM 264 CB GLU A 20 -2.169 -3.165 6.429 1.00 0.00 C ATOM 265 CG GLU A 20 -2.193 -4.616 6.881 1.00 0.00 C ATOM 266 CD GLU A 20 -2.631 -4.770 8.324 1.00 0.00 C ATOM 267 OE1 GLU A 20 -2.194 -3.958 9.166 1.00 0.00 O ATOM 268 OE2 GLU A 20 -3.410 -5.703 8.612 1.00 0.00 O ATOM 0 H GLU A 20 -1.656 -0.884 5.489 1.00 0.00 H new ATOM 0 HA GLU A 20 -0.428 -3.504 5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -1.758 -2.550 7.230 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -3.192 -2.828 6.262 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -2.867 -5.182 6.238 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -1.199 -5.047 6.759 1.00 0.00 H new ATOM 275 N ALA A 21 -1.531 -4.300 3.160 1.00 0.00 N ATOM 276 CA ALA A 21 -2.174 -4.840 1.969 1.00 0.00 C ATOM 277 C ALA A 21 -2.187 -6.364 1.995 1.00 0.00 C ATOM 278 O ALA A 21 -1.634 -6.984 2.904 1.00 0.00 O ATOM 279 CB ALA A 21 -1.471 -4.338 0.716 1.00 0.00 C ATOM 0 H ALA A 21 -0.592 -4.659 3.332 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.208 -4.494 1.956 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.962 -4.749 -0.166 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -1.519 -3.250 0.683 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.428 -4.655 0.732 1.00 0.00 H new ATOM 285 N ASP A 22 -2.823 -6.963 0.994 1.00 0.00 N ATOM 286 CA ASP A 22 -2.908 -8.416 0.902 1.00 0.00 C ATOM 287 C ASP A 22 -2.445 -8.902 -0.468 1.00 0.00 C ATOM 288 O ASP A 22 -3.177 -8.803 -1.453 1.00 0.00 O ATOM 289 CB ASP A 22 -4.340 -8.882 1.165 1.00 0.00 C ATOM 290 CG ASP A 22 -5.314 -8.383 0.115 1.00 0.00 C ATOM 291 OD1 ASP A 22 -4.992 -7.387 -0.567 1.00 0.00 O ATOM 292 OD2 ASP A 22 -6.396 -8.989 -0.025 1.00 0.00 O ATOM 0 H ASP A 22 -3.287 -6.465 0.235 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.251 -8.842 1.660 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -4.365 -9.971 1.191 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -4.658 -8.532 2.147 1.00 0.00 H new ATOM 297 N LEU A 23 -1.226 -9.427 -0.522 1.00 0.00 N ATOM 298 CA LEU A 23 -0.664 -9.928 -1.772 1.00 0.00 C ATOM 299 C LEU A 23 -0.803 -11.444 -1.862 1.00 0.00 C ATOM 300 O LEU A 23 -0.382 -12.171 -0.963 1.00 0.00 O ATOM 301 CB LEU A 23 0.809 -9.532 -1.887 1.00 0.00 C ATOM 302 CG LEU A 23 1.448 -9.717 -3.264 1.00 0.00 C ATOM 303 CD1 LEU A 23 1.712 -11.189 -3.537 1.00 0.00 C ATOM 304 CD2 LEU A 23 0.560 -9.123 -4.348 1.00 0.00 C ATOM 0 H LEU A 23 -0.608 -9.517 0.284 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.219 -9.481 -2.596 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.906 -8.485 -1.601 1.00 0.00 H new ATOM 0 HB3 LEU A 23 1.379 -10.114 -1.163 1.00 0.00 H new ATOM 0 HG LEU A 23 2.402 -9.190 -3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.167 -11.301 -4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.387 -11.584 -2.778 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.771 -11.739 -3.507 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.030 -9.264 -5.321 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.409 -9.621 -4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.422 -8.058 -4.162 1.00 0.00 H new ATOM 316 N ALA A 24 -1.395 -11.915 -2.955 1.00 0.00 N ATOM 317 CA ALA A 24 -1.586 -13.345 -3.165 1.00 0.00 C ATOM 318 C ALA A 24 -0.311 -13.998 -3.689 1.00 0.00 C ATOM 319 O ALA A 24 0.291 -13.520 -4.650 1.00 0.00 O ATOM 320 CB ALA A 24 -2.739 -13.588 -4.127 1.00 0.00 C ATOM 0 H ALA A 24 -1.751 -11.327 -3.709 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.827 -13.799 -2.204 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.870 -14.660 -4.274 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.654 -13.164 -3.713 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.520 -13.114 -5.084 1.00 0.00 H new ATOM 326 N GLU A 25 0.094 -15.091 -3.051 1.00 0.00 N ATOM 327 CA GLU A 25 1.299 -15.808 -3.454 1.00 0.00 C ATOM 328 C GLU A 25 1.250 -16.163 -4.937 1.00 0.00 C ATOM 329 O GLU A 25 2.281 -16.216 -5.607 1.00 0.00 O ATOM 330 CB GLU A 25 1.466 -17.079 -2.619 1.00 0.00 C ATOM 331 CG GLU A 25 0.380 -18.114 -2.862 1.00 0.00 C ATOM 332 CD GLU A 25 0.869 -19.533 -2.647 1.00 0.00 C ATOM 333 OE1 GLU A 25 1.895 -19.905 -3.255 1.00 0.00 O ATOM 334 OE2 GLU A 25 0.227 -20.272 -1.871 1.00 0.00 O ATOM 0 H GLU A 25 -0.394 -15.500 -2.254 1.00 0.00 H new ATOM 0 HA GLU A 25 2.154 -15.155 -3.283 1.00 0.00 H new ATOM 0 HB2 GLU A 25 2.436 -17.524 -2.840 1.00 0.00 H new ATOM 0 HB3 GLU A 25 1.471 -16.811 -1.562 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -0.460 -17.918 -2.195 1.00 0.00 H new ATOM 0 HG3 GLU A 25 0.008 -18.012 -3.881 1.00 0.00 H new ATOM 341 N ASN A 26 0.045 -16.406 -5.442 1.00 0.00 N ATOM 342 CA ASN A 26 -0.138 -16.758 -6.846 1.00 0.00 C ATOM 343 C ASN A 26 -0.069 -15.517 -7.731 1.00 0.00 C ATOM 344 O ASN A 26 0.080 -15.618 -8.949 1.00 0.00 O ATOM 345 CB ASN A 26 -1.480 -17.466 -7.044 1.00 0.00 C ATOM 346 CG ASN A 26 -1.701 -17.893 -8.483 1.00 0.00 C ATOM 347 OD1 ASN A 26 -0.756 -17.986 -9.267 1.00 0.00 O ATOM 348 ND2 ASN A 26 -2.954 -18.154 -8.836 1.00 0.00 N ATOM 0 H ASN A 26 -0.819 -16.366 -4.901 1.00 0.00 H new ATOM 0 HA ASN A 26 0.668 -17.433 -7.134 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -1.525 -18.342 -6.397 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -2.287 -16.801 -6.737 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.165 -18.445 -9.791 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -3.706 -18.064 -8.153 1.00 0.00 H new ATOM 355 N SER A 27 -0.178 -14.347 -7.110 1.00 0.00 N ATOM 356 CA SER A 27 -0.131 -13.086 -7.841 1.00 0.00 C ATOM 357 C SER A 27 0.963 -13.115 -8.904 1.00 0.00 C ATOM 358 O SER A 27 2.061 -13.618 -8.666 1.00 0.00 O ATOM 359 CB SER A 27 0.109 -11.922 -6.878 1.00 0.00 C ATOM 360 OG SER A 27 -0.959 -11.796 -5.955 1.00 0.00 O ATOM 0 H SER A 27 -0.299 -14.246 -6.102 1.00 0.00 H new ATOM 0 HA SER A 27 -1.092 -12.946 -8.336 1.00 0.00 H new ATOM 0 HB2 SER A 27 1.043 -12.079 -6.339 1.00 0.00 H new ATOM 0 HB3 SER A 27 0.218 -10.996 -7.442 1.00 0.00 H new ATOM 0 HG SER A 27 -0.662 -12.090 -5.069 1.00 0.00 H new ATOM 366 N ALA A 28 0.654 -12.572 -10.077 1.00 0.00 N ATOM 367 CA ALA A 28 1.611 -12.534 -11.176 1.00 0.00 C ATOM 368 C ALA A 28 2.759 -11.577 -10.872 1.00 0.00 C ATOM 369 O ALA A 28 2.701 -10.776 -9.938 1.00 0.00 O ATOM 370 CB ALA A 28 0.914 -12.130 -12.468 1.00 0.00 C ATOM 0 H ALA A 28 -0.251 -12.153 -10.291 1.00 0.00 H new ATOM 0 HA ALA A 28 2.028 -13.534 -11.297 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.640 -12.105 -13.281 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.132 -12.853 -12.701 1.00 0.00 H new ATOM 0 HB3 ALA A 28 0.470 -11.142 -12.348 1.00 0.00 H new ATOM 376 N PRO A 29 3.829 -11.661 -11.676 1.00 0.00 N ATOM 377 CA PRO A 29 5.012 -10.810 -11.511 1.00 0.00 C ATOM 378 C PRO A 29 4.733 -9.355 -11.871 1.00 0.00 C ATOM 379 O PRO A 29 5.635 -8.519 -11.858 1.00 0.00 O ATOM 380 CB PRO A 29 6.024 -11.418 -12.486 1.00 0.00 C ATOM 381 CG PRO A 29 5.194 -12.095 -13.521 1.00 0.00 C ATOM 382 CD PRO A 29 3.967 -12.592 -12.808 1.00 0.00 C ATOM 0 HA PRO A 29 5.357 -10.786 -10.477 1.00 0.00 H new ATOM 0 HB2 PRO A 29 6.659 -10.650 -12.928 1.00 0.00 H new ATOM 0 HB3 PRO A 29 6.683 -12.125 -11.982 1.00 0.00 H new ATOM 0 HG2 PRO A 29 4.928 -11.404 -14.321 1.00 0.00 H new ATOM 0 HG3 PRO A 29 5.739 -12.919 -13.980 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.090 -12.571 -13.455 1.00 0.00 H new ATOM 0 HD3 PRO A 29 4.088 -13.621 -12.469 1.00 0.00 H new ATOM 390 N GLY A 30 3.477 -9.059 -12.191 1.00 0.00 N ATOM 391 CA GLY A 30 3.102 -7.703 -12.549 1.00 0.00 C ATOM 392 C GLY A 30 1.744 -7.313 -12.002 1.00 0.00 C ATOM 393 O GLY A 30 0.984 -6.599 -12.656 1.00 0.00 O ATOM 0 H GLY A 30 2.712 -9.734 -12.209 1.00 0.00 H new ATOM 0 HA2 GLY A 30 3.854 -7.010 -12.173 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.094 -7.606 -13.635 1.00 0.00 H new ATOM 397 N THR A 31 1.435 -7.785 -10.797 1.00 0.00 N ATOM 398 CA THR A 31 0.158 -7.484 -10.163 1.00 0.00 C ATOM 399 C THR A 31 0.269 -6.263 -9.256 1.00 0.00 C ATOM 400 O THR A 31 1.159 -6.167 -8.411 1.00 0.00 O ATOM 401 CB THR A 31 -0.354 -8.678 -9.337 1.00 0.00 C ATOM 402 OG1 THR A 31 -0.473 -9.836 -10.171 1.00 0.00 O ATOM 403 CG2 THR A 31 -1.701 -8.361 -8.705 1.00 0.00 C ATOM 0 H THR A 31 2.052 -8.377 -10.241 1.00 0.00 H new ATOM 0 HA THR A 31 -0.551 -7.275 -10.964 1.00 0.00 H new ATOM 0 HB THR A 31 0.365 -8.876 -8.542 1.00 0.00 H new ATOM 0 HG1 THR A 31 -1.193 -10.409 -9.834 1.00 0.00 H new ATOM 0 HG21 THR A 31 -2.042 -9.219 -8.126 1.00 0.00 H new ATOM 0 HG22 THR A 31 -1.600 -7.497 -8.048 1.00 0.00 H new ATOM 0 HG23 THR A 31 -2.427 -8.139 -9.487 1.00 0.00 H new ATOM 411 N PRO A 32 -0.656 -5.308 -9.434 1.00 0.00 N ATOM 412 CA PRO A 32 -0.683 -4.076 -8.639 1.00 0.00 C ATOM 413 C PRO A 32 -1.082 -4.330 -7.190 1.00 0.00 C ATOM 414 O PRO A 32 -2.058 -5.030 -6.918 1.00 0.00 O ATOM 415 CB PRO A 32 -1.742 -3.223 -9.344 1.00 0.00 C ATOM 416 CG PRO A 32 -2.629 -4.207 -10.024 1.00 0.00 C ATOM 417 CD PRO A 32 -1.745 -5.356 -10.423 1.00 0.00 C ATOM 0 HA PRO A 32 0.298 -3.604 -8.585 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -2.299 -2.614 -8.631 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -1.287 -2.539 -10.060 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.425 -4.540 -9.358 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.108 -3.762 -10.896 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -2.279 -6.305 -10.387 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -1.370 -5.240 -11.440 1.00 0.00 H new ATOM 425 N ILE A 33 -0.323 -3.757 -6.262 1.00 0.00 N ATOM 426 CA ILE A 33 -0.599 -3.921 -4.841 1.00 0.00 C ATOM 427 C ILE A 33 -1.323 -2.702 -4.277 1.00 0.00 C ATOM 428 O ILE A 33 -2.460 -2.801 -3.815 1.00 0.00 O ATOM 429 CB ILE A 33 0.695 -4.151 -4.038 1.00 0.00 C ATOM 430 CG1 ILE A 33 1.440 -5.377 -4.571 1.00 0.00 C ATOM 431 CG2 ILE A 33 0.379 -4.318 -2.560 1.00 0.00 C ATOM 432 CD1 ILE A 33 2.936 -5.316 -4.355 1.00 0.00 C ATOM 0 H ILE A 33 0.488 -3.175 -6.469 1.00 0.00 H new ATOM 0 HA ILE A 33 -1.238 -4.799 -4.744 1.00 0.00 H new ATOM 0 HB ILE A 33 1.338 -3.279 -4.155 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.047 -6.270 -4.086 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.239 -5.479 -5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.304 -4.480 -2.006 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -0.113 -3.419 -2.189 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.280 -5.175 -2.423 1.00 0.00 H new ATOM 0 HD11 ILE A 33 3.399 -6.217 -4.757 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.342 -4.442 -4.864 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.147 -5.245 -3.288 1.00 0.00 H new ATOM 444 N LEU A 34 -0.657 -1.554 -4.320 1.00 0.00 N ATOM 445 CA LEU A 34 -1.238 -0.314 -3.816 1.00 0.00 C ATOM 446 C LEU A 34 -0.586 0.899 -4.472 1.00 0.00 C ATOM 447 O LEU A 34 0.409 0.770 -5.186 1.00 0.00 O ATOM 448 CB LEU A 34 -1.078 -0.234 -2.297 1.00 0.00 C ATOM 449 CG LEU A 34 0.332 -0.478 -1.757 1.00 0.00 C ATOM 450 CD1 LEU A 34 1.148 0.805 -1.796 1.00 0.00 C ATOM 451 CD2 LEU A 34 0.272 -1.031 -0.340 1.00 0.00 C ATOM 0 H LEU A 34 0.285 -1.455 -4.698 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.299 -0.311 -4.064 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.406 0.752 -1.969 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.751 -0.961 -1.842 1.00 0.00 H new ATOM 0 HG LEU A 34 0.822 -1.215 -2.393 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.148 0.612 -1.408 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.220 1.159 -2.824 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.662 1.564 -1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.284 -1.199 0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.236 -0.317 0.308 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.275 -1.974 -0.340 1.00 0.00 H new ATOM 463 N GLN A 35 -1.151 2.076 -4.223 1.00 0.00 N ATOM 464 CA GLN A 35 -0.623 3.312 -4.789 1.00 0.00 C ATOM 465 C GLN A 35 -0.491 4.388 -3.716 1.00 0.00 C ATOM 466 O GLN A 35 -1.483 4.981 -3.290 1.00 0.00 O ATOM 467 CB GLN A 35 -1.529 3.808 -5.917 1.00 0.00 C ATOM 468 CG GLN A 35 -1.136 5.174 -6.456 1.00 0.00 C ATOM 469 CD GLN A 35 -2.054 5.651 -7.564 1.00 0.00 C ATOM 470 OE1 GLN A 35 -3.232 5.293 -7.607 1.00 0.00 O ATOM 471 NE2 GLN A 35 -1.520 6.465 -8.467 1.00 0.00 N ATOM 0 H GLN A 35 -1.974 2.200 -3.633 1.00 0.00 H new ATOM 0 HA GLN A 35 0.368 3.104 -5.193 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -1.509 3.085 -6.733 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -2.556 3.851 -5.555 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -1.148 5.899 -5.642 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -0.113 5.132 -6.830 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -0.539 6.736 -8.393 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -2.090 6.819 -9.235 1.00 0.00 H new ATOM 480 N LEU A 36 0.741 4.635 -3.283 1.00 0.00 N ATOM 481 CA LEU A 36 1.004 5.641 -2.259 1.00 0.00 C ATOM 482 C LEU A 36 0.702 7.042 -2.782 1.00 0.00 C ATOM 483 O LEU A 36 1.094 7.398 -3.893 1.00 0.00 O ATOM 484 CB LEU A 36 2.460 5.558 -1.798 1.00 0.00 C ATOM 485 CG LEU A 36 2.976 4.162 -1.451 1.00 0.00 C ATOM 486 CD1 LEU A 36 3.640 3.522 -2.660 1.00 0.00 C ATOM 487 CD2 LEU A 36 3.946 4.227 -0.280 1.00 0.00 C ATOM 0 H LEU A 36 1.573 4.153 -3.625 1.00 0.00 H new ATOM 0 HA LEU A 36 0.349 5.442 -1.411 1.00 0.00 H new ATOM 0 HB2 LEU A 36 3.093 5.972 -2.583 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.580 6.196 -0.922 1.00 0.00 H new ATOM 0 HG LEU A 36 2.126 3.544 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.001 2.529 -2.393 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.917 3.440 -3.471 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.479 4.138 -2.983 1.00 0.00 H new ATOM 0 HD21 LEU A 36 4.303 3.224 -0.047 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.792 4.861 -0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.438 4.643 0.590 1.00 0.00 H new ATOM 499 N ARG A 37 0.006 7.832 -1.972 1.00 0.00 N ATOM 500 CA ARG A 37 -0.347 9.195 -2.352 1.00 0.00 C ATOM 501 C ARG A 37 0.349 10.209 -1.449 1.00 0.00 C ATOM 502 O ARG A 37 0.060 11.404 -1.503 1.00 0.00 O ATOM 503 CB ARG A 37 -1.863 9.390 -2.282 1.00 0.00 C ATOM 504 CG ARG A 37 -2.654 8.223 -2.849 1.00 0.00 C ATOM 505 CD ARG A 37 -2.696 8.264 -4.369 1.00 0.00 C ATOM 506 NE ARG A 37 -3.522 7.195 -4.923 1.00 0.00 N ATOM 507 CZ ARG A 37 -4.848 7.247 -4.983 1.00 0.00 C ATOM 508 NH1 ARG A 37 -5.494 8.311 -4.527 1.00 0.00 N ATOM 509 NH2 ARG A 37 -5.530 6.234 -5.502 1.00 0.00 N ATOM 0 H ARG A 37 -0.325 7.552 -1.049 1.00 0.00 H new ATOM 0 HA ARG A 37 -0.013 9.358 -3.377 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -2.153 9.544 -1.243 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -2.130 10.297 -2.825 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.206 7.285 -2.522 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.670 8.245 -2.455 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -3.085 9.229 -4.695 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -1.683 8.180 -4.762 1.00 0.00 H new ATOM 0 HE ARG A 37 -3.055 6.363 -5.284 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -4.973 9.092 -4.129 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -6.512 8.348 -4.574 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -5.036 5.414 -5.855 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -6.548 6.275 -5.548 1.00 0.00 H new ATOM 523 N ALA A 38 1.267 9.723 -0.620 1.00 0.00 N ATOM 524 CA ALA A 38 2.005 10.587 0.294 1.00 0.00 C ATOM 525 C ALA A 38 1.170 11.795 0.703 1.00 0.00 C ATOM 526 O ALA A 38 1.647 12.929 0.676 1.00 0.00 O ATOM 527 CB ALA A 38 3.311 11.037 -0.345 1.00 0.00 C ATOM 0 H ALA A 38 1.518 8.736 -0.562 1.00 0.00 H new ATOM 0 HA ALA A 38 2.231 10.014 1.193 1.00 0.00 H new ATOM 0 HB1 ALA A 38 3.852 11.681 0.348 1.00 0.00 H new ATOM 0 HB2 ALA A 38 3.920 10.165 -0.580 1.00 0.00 H new ATOM 0 HB3 ALA A 38 3.097 11.588 -1.261 1.00 0.00 H new ATOM 533 N ALA A 39 -0.080 11.544 1.080 1.00 0.00 N ATOM 534 CA ALA A 39 -0.981 12.611 1.496 1.00 0.00 C ATOM 535 C ALA A 39 -2.139 12.061 2.322 1.00 0.00 C ATOM 536 O ALA A 39 -2.329 10.848 2.411 1.00 0.00 O ATOM 537 CB ALA A 39 -1.506 13.362 0.281 1.00 0.00 C ATOM 0 H ALA A 39 -0.491 10.611 1.106 1.00 0.00 H new ATOM 0 HA ALA A 39 -0.419 13.304 2.123 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.178 14.156 0.606 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.670 13.796 -0.268 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -2.047 12.672 -0.367 1.00 0.00 H new ATOM 543 N ASP A 40 -2.909 12.961 2.924 1.00 0.00 N ATOM 544 CA ASP A 40 -4.050 12.565 3.743 1.00 0.00 C ATOM 545 C ASP A 40 -5.342 13.167 3.201 1.00 0.00 C ATOM 546 O ASP A 40 -6.382 12.507 3.171 1.00 0.00 O ATOM 547 CB ASP A 40 -3.838 13.001 5.193 1.00 0.00 C ATOM 548 CG ASP A 40 -3.099 11.958 6.009 1.00 0.00 C ATOM 549 OD1 ASP A 40 -2.292 11.209 5.422 1.00 0.00 O ATOM 550 OD2 ASP A 40 -3.330 11.891 7.235 1.00 0.00 O ATOM 0 H ASP A 40 -2.764 13.969 2.861 1.00 0.00 H new ATOM 0 HA ASP A 40 -4.134 11.479 3.707 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -3.277 13.936 5.210 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -4.805 13.201 5.654 1.00 0.00 H new ATOM 555 N LEU A 41 -5.271 14.423 2.774 1.00 0.00 N ATOM 556 CA LEU A 41 -6.436 15.115 2.234 1.00 0.00 C ATOM 557 C LEU A 41 -6.103 15.786 0.906 1.00 0.00 C ATOM 558 O LEU A 41 -6.963 15.925 0.036 1.00 0.00 O ATOM 559 CB LEU A 41 -6.942 16.158 3.232 1.00 0.00 C ATOM 560 CG LEU A 41 -7.376 15.625 4.598 1.00 0.00 C ATOM 561 CD1 LEU A 41 -7.432 16.751 5.618 1.00 0.00 C ATOM 562 CD2 LEU A 41 -8.726 14.929 4.495 1.00 0.00 C ATOM 0 H LEU A 41 -4.419 14.983 2.791 1.00 0.00 H new ATOM 0 HA LEU A 41 -7.219 14.376 2.061 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.155 16.896 3.386 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.787 16.681 2.783 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.638 14.896 4.933 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.743 16.352 6.584 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.446 17.205 5.713 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.148 17.504 5.289 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.019 14.556 5.476 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -9.474 15.637 4.138 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.653 14.095 3.797 1.00 0.00 H new ATOM 574 N ASP A 42 -4.849 16.199 0.755 1.00 0.00 N ATOM 575 CA ASP A 42 -4.402 16.853 -0.469 1.00 0.00 C ATOM 576 C ASP A 42 -5.229 18.102 -0.752 1.00 0.00 C ATOM 577 O ASP A 42 -5.592 18.373 -1.897 1.00 0.00 O ATOM 578 CB ASP A 42 -4.493 15.887 -1.651 1.00 0.00 C ATOM 579 CG ASP A 42 -4.097 14.472 -1.275 1.00 0.00 C ATOM 580 OD1 ASP A 42 -4.768 13.880 -0.405 1.00 0.00 O ATOM 581 OD2 ASP A 42 -3.115 13.958 -1.851 1.00 0.00 O ATOM 0 H ASP A 42 -4.124 16.092 1.465 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.363 17.152 -0.333 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -5.512 15.885 -2.037 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -3.848 16.240 -2.455 1.00 0.00 H new ATOM 586 N VAL A 43 -5.527 18.860 0.299 1.00 0.00 N ATOM 587 CA VAL A 43 -6.312 20.081 0.163 1.00 0.00 C ATOM 588 C VAL A 43 -5.674 21.036 -0.839 1.00 0.00 C ATOM 589 O VAL A 43 -6.294 22.010 -1.265 1.00 0.00 O ATOM 590 CB VAL A 43 -6.466 20.802 1.516 1.00 0.00 C ATOM 591 CG1 VAL A 43 -5.218 20.618 2.365 1.00 0.00 C ATOM 592 CG2 VAL A 43 -6.763 22.278 1.301 1.00 0.00 C ATOM 0 H VAL A 43 -5.236 18.650 1.254 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.297 19.786 -0.198 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.307 20.360 2.050 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -5.346 21.134 3.316 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.055 19.556 2.548 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.357 21.032 1.840 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.869 22.772 2.267 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.945 22.737 0.746 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.689 22.384 0.736 1.00 0.00 H new ATOM 602 N GLY A 44 -4.431 20.750 -1.214 1.00 0.00 N ATOM 603 CA GLY A 44 -3.730 21.592 -2.164 1.00 0.00 C ATOM 604 C GLY A 44 -2.223 21.494 -2.025 1.00 0.00 C ATOM 605 O GLY A 44 -1.547 22.497 -1.794 1.00 0.00 O ATOM 0 H GLY A 44 -3.897 19.949 -0.876 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -4.017 21.309 -3.177 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.038 22.628 -2.023 1.00 0.00 H new ATOM 609 N VAL A 45 -1.695 20.282 -2.163 1.00 0.00 N ATOM 610 CA VAL A 45 -0.259 20.057 -2.051 1.00 0.00 C ATOM 611 C VAL A 45 0.425 20.186 -3.407 1.00 0.00 C ATOM 612 O VAL A 45 1.641 20.358 -3.486 1.00 0.00 O ATOM 613 CB VAL A 45 0.046 18.665 -1.464 1.00 0.00 C ATOM 614 CG1 VAL A 45 -0.468 17.572 -2.389 1.00 0.00 C ATOM 615 CG2 VAL A 45 1.539 18.508 -1.217 1.00 0.00 C ATOM 0 H VAL A 45 -2.240 19.441 -2.353 1.00 0.00 H new ATOM 0 HA VAL A 45 0.130 20.821 -1.378 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.469 18.571 -0.508 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.244 16.596 -1.959 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.546 17.676 -2.511 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.017 17.660 -3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 45 1.737 17.520 -0.802 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.077 18.622 -2.158 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.874 19.270 -0.513 1.00 0.00 H new ATOM 625 N ASN A 46 -0.365 20.103 -4.472 1.00 0.00 N ATOM 626 CA ASN A 46 0.165 20.211 -5.827 1.00 0.00 C ATOM 627 C ASN A 46 1.565 19.609 -5.913 1.00 0.00 C ATOM 628 O ASN A 46 2.424 20.110 -6.636 1.00 0.00 O ATOM 629 CB ASN A 46 0.201 21.676 -6.268 1.00 0.00 C ATOM 630 CG ASN A 46 0.904 22.566 -5.261 1.00 0.00 C ATOM 631 OD1 ASN A 46 0.333 22.929 -4.233 1.00 0.00 O ATOM 632 ND2 ASN A 46 2.149 22.922 -5.555 1.00 0.00 N ATOM 0 H ASN A 46 -1.374 19.961 -4.424 1.00 0.00 H new ATOM 0 HA ASN A 46 -0.493 19.654 -6.493 1.00 0.00 H new ATOM 0 HB2 ASN A 46 0.707 21.751 -7.230 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -0.818 22.033 -6.415 1.00 0.00 H new ATOM 0 HD21 ASN A 46 2.673 23.521 -4.916 1.00 0.00 H new ATOM 0 HD22 ASN A 46 2.582 22.597 -6.419 1.00 0.00 H new ATOM 639 N GLY A 47 1.785 18.528 -5.170 1.00 0.00 N ATOM 640 CA GLY A 47 3.080 17.874 -5.177 1.00 0.00 C ATOM 641 C GLY A 47 2.985 16.395 -4.861 1.00 0.00 C ATOM 642 O GLY A 47 2.681 16.014 -3.731 1.00 0.00 O ATOM 0 H GLY A 47 1.089 18.094 -4.564 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.544 18.004 -6.155 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.731 18.357 -4.448 1.00 0.00 H new ATOM 646 N GLN A 48 3.244 15.560 -5.863 1.00 0.00 N ATOM 647 CA GLN A 48 3.183 14.114 -5.686 1.00 0.00 C ATOM 648 C GLN A 48 4.511 13.572 -5.168 1.00 0.00 C ATOM 649 O GLN A 48 5.311 13.029 -5.931 1.00 0.00 O ATOM 650 CB GLN A 48 2.821 13.432 -7.006 1.00 0.00 C ATOM 651 CG GLN A 48 1.514 13.925 -7.607 1.00 0.00 C ATOM 652 CD GLN A 48 1.710 15.101 -8.544 1.00 0.00 C ATOM 653 OE1 GLN A 48 2.817 15.620 -8.685 1.00 0.00 O ATOM 654 NE2 GLN A 48 0.631 15.529 -9.190 1.00 0.00 N ATOM 0 H GLN A 48 3.498 15.860 -6.804 1.00 0.00 H new ATOM 0 HA GLN A 48 2.410 13.896 -4.949 1.00 0.00 H new ATOM 0 HB2 GLN A 48 3.626 13.596 -7.723 1.00 0.00 H new ATOM 0 HB3 GLN A 48 2.754 12.356 -6.843 1.00 0.00 H new ATOM 0 HG2 GLN A 48 1.037 13.109 -8.149 1.00 0.00 H new ATOM 0 HG3 GLN A 48 0.835 14.214 -6.804 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -0.267 15.069 -9.043 1.00 0.00 H new ATOM 0 HE22 GLN A 48 0.701 16.318 -9.833 1.00 0.00 H new ATOM 663 N ILE A 49 4.740 13.724 -3.868 1.00 0.00 N ATOM 664 CA ILE A 49 5.971 13.249 -3.249 1.00 0.00 C ATOM 665 C ILE A 49 6.484 11.991 -3.940 1.00 0.00 C ATOM 666 O ILE A 49 5.701 11.159 -4.397 1.00 0.00 O ATOM 667 CB ILE A 49 5.770 12.953 -1.751 1.00 0.00 C ATOM 668 CG1 ILE A 49 5.340 14.221 -1.011 1.00 0.00 C ATOM 669 CG2 ILE A 49 7.047 12.388 -1.147 1.00 0.00 C ATOM 670 CD1 ILE A 49 6.306 15.373 -1.174 1.00 0.00 C ATOM 0 H ILE A 49 4.089 14.172 -3.223 1.00 0.00 H new ATOM 0 HA ILE A 49 6.707 14.046 -3.358 1.00 0.00 H new ATOM 0 HB ILE A 49 4.981 12.209 -1.646 1.00 0.00 H new ATOM 0 HG12 ILE A 49 4.358 14.527 -1.372 1.00 0.00 H new ATOM 0 HG13 ILE A 49 5.233 13.994 0.050 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.889 12.184 -0.088 1.00 0.00 H new ATOM 0 HG22 ILE A 49 7.314 11.463 -1.659 1.00 0.00 H new ATOM 0 HG23 ILE A 49 7.854 13.111 -1.261 1.00 0.00 H new ATOM 0 HD11 ILE A 49 5.937 16.238 -0.623 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.284 15.086 -0.787 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.395 15.627 -2.230 1.00 0.00 H new ATOM 682 N GLU A 50 7.805 11.858 -4.011 1.00 0.00 N ATOM 683 CA GLU A 50 8.423 10.700 -4.646 1.00 0.00 C ATOM 684 C GLU A 50 8.224 9.445 -3.800 1.00 0.00 C ATOM 685 O GLU A 50 7.599 9.491 -2.740 1.00 0.00 O ATOM 686 CB GLU A 50 9.916 10.947 -4.868 1.00 0.00 C ATOM 687 CG GLU A 50 10.210 11.934 -5.985 1.00 0.00 C ATOM 688 CD GLU A 50 9.320 11.727 -7.196 1.00 0.00 C ATOM 689 OE1 GLU A 50 8.208 12.295 -7.218 1.00 0.00 O ATOM 690 OE2 GLU A 50 9.735 10.997 -8.120 1.00 0.00 O ATOM 0 H GLU A 50 8.467 12.538 -3.637 1.00 0.00 H new ATOM 0 HA GLU A 50 7.941 10.547 -5.611 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.356 11.317 -3.942 1.00 0.00 H new ATOM 0 HB3 GLU A 50 10.403 9.999 -5.095 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.078 12.949 -5.611 1.00 0.00 H new ATOM 0 HG3 GLU A 50 11.253 11.837 -6.285 1.00 0.00 H new ATOM 697 N TYR A 51 8.760 8.327 -4.276 1.00 0.00 N ATOM 698 CA TYR A 51 8.640 7.059 -3.566 1.00 0.00 C ATOM 699 C TYR A 51 9.784 6.119 -3.933 1.00 0.00 C ATOM 700 O TYR A 51 9.891 5.669 -5.074 1.00 0.00 O ATOM 701 CB TYR A 51 7.298 6.397 -3.884 1.00 0.00 C ATOM 702 CG TYR A 51 6.149 7.375 -3.981 1.00 0.00 C ATOM 703 CD1 TYR A 51 5.584 7.928 -2.839 1.00 0.00 C ATOM 704 CD2 TYR A 51 5.629 7.746 -5.215 1.00 0.00 C ATOM 705 CE1 TYR A 51 4.533 8.821 -2.922 1.00 0.00 C ATOM 706 CE2 TYR A 51 4.579 8.639 -5.308 1.00 0.00 C ATOM 707 CZ TYR A 51 4.034 9.173 -4.159 1.00 0.00 C ATOM 708 OH TYR A 51 2.988 10.063 -4.247 1.00 0.00 O ATOM 0 H TYR A 51 9.282 8.273 -5.151 1.00 0.00 H new ATOM 0 HA TYR A 51 8.691 7.264 -2.497 1.00 0.00 H new ATOM 0 HB2 TYR A 51 7.384 5.855 -4.826 1.00 0.00 H new ATOM 0 HB3 TYR A 51 7.073 5.661 -3.112 1.00 0.00 H new ATOM 0 HD1 TYR A 51 5.973 7.655 -1.869 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.053 7.329 -6.117 1.00 0.00 H new ATOM 0 HE1 TYR A 51 4.105 9.241 -2.024 1.00 0.00 H new ATOM 0 HE2 TYR A 51 4.187 8.917 -6.275 1.00 0.00 H new ATOM 0 HH TYR A 51 3.339 10.970 -4.367 1.00 0.00 H new ATOM 718 N VAL A 52 10.636 5.825 -2.957 1.00 0.00 N ATOM 719 CA VAL A 52 11.772 4.936 -3.175 1.00 0.00 C ATOM 720 C VAL A 52 11.881 3.901 -2.061 1.00 0.00 C ATOM 721 O VAL A 52 11.268 4.044 -1.003 1.00 0.00 O ATOM 722 CB VAL A 52 13.093 5.724 -3.260 1.00 0.00 C ATOM 723 CG1 VAL A 52 13.118 6.591 -4.509 1.00 0.00 C ATOM 724 CG2 VAL A 52 13.290 6.570 -2.010 1.00 0.00 C ATOM 0 H VAL A 52 10.562 6.189 -2.007 1.00 0.00 H new ATOM 0 HA VAL A 52 11.599 4.428 -4.124 1.00 0.00 H new ATOM 0 HB VAL A 52 13.917 5.013 -3.324 1.00 0.00 H new ATOM 0 HG11 VAL A 52 14.059 7.140 -4.552 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.026 5.959 -5.392 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.287 7.296 -4.479 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.228 7.120 -2.087 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.464 7.274 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.320 5.923 -1.134 1.00 0.00 H new ATOM 734 N PHE A 53 12.667 2.858 -2.306 1.00 0.00 N ATOM 735 CA PHE A 53 12.857 1.797 -1.324 1.00 0.00 C ATOM 736 C PHE A 53 13.783 2.255 -0.200 1.00 0.00 C ATOM 737 O PHE A 53 15.003 2.136 -0.299 1.00 0.00 O ATOM 738 CB PHE A 53 13.431 0.548 -1.996 1.00 0.00 C ATOM 739 CG PHE A 53 12.380 -0.392 -2.513 1.00 0.00 C ATOM 740 CD1 PHE A 53 11.488 -1.000 -1.645 1.00 0.00 C ATOM 741 CD2 PHE A 53 12.285 -0.667 -3.868 1.00 0.00 C ATOM 742 CE1 PHE A 53 10.519 -1.865 -2.118 1.00 0.00 C ATOM 743 CE2 PHE A 53 11.318 -1.531 -4.347 1.00 0.00 C ATOM 744 CZ PHE A 53 10.434 -2.131 -3.471 1.00 0.00 C ATOM 0 H PHE A 53 13.183 2.725 -3.176 1.00 0.00 H new ATOM 0 HA PHE A 53 11.885 1.556 -0.894 1.00 0.00 H new ATOM 0 HB2 PHE A 53 14.073 0.853 -2.823 1.00 0.00 H new ATOM 0 HB3 PHE A 53 14.061 0.018 -1.282 1.00 0.00 H new ATOM 0 HD1 PHE A 53 11.550 -0.796 -0.586 1.00 0.00 H new ATOM 0 HD2 PHE A 53 12.974 -0.201 -4.557 1.00 0.00 H new ATOM 0 HE1 PHE A 53 9.829 -2.332 -1.431 1.00 0.00 H new ATOM 0 HE2 PHE A 53 11.254 -1.737 -5.405 1.00 0.00 H new ATOM 0 HZ PHE A 53 9.678 -2.807 -3.843 1.00 0.00 H new ATOM 754 N GLY A 54 13.191 2.780 0.869 1.00 0.00 N ATOM 755 CA GLY A 54 13.977 3.249 1.995 1.00 0.00 C ATOM 756 C GLY A 54 14.775 2.138 2.648 1.00 0.00 C ATOM 757 O GLY A 54 15.993 2.063 2.488 1.00 0.00 O ATOM 0 H GLY A 54 12.182 2.889 0.975 1.00 0.00 H new ATOM 0 HA2 GLY A 54 14.657 4.031 1.658 1.00 0.00 H new ATOM 0 HA3 GLY A 54 13.314 3.699 2.734 1.00 0.00 H new ATOM 761 N ALA A 55 14.088 1.273 3.388 1.00 0.00 N ATOM 762 CA ALA A 55 14.741 0.161 4.067 1.00 0.00 C ATOM 763 C ALA A 55 14.131 -1.172 3.648 1.00 0.00 C ATOM 764 O ALA A 55 13.317 -1.748 4.369 1.00 0.00 O ATOM 765 CB ALA A 55 14.647 0.335 5.576 1.00 0.00 C ATOM 0 H ALA A 55 13.079 1.321 3.532 1.00 0.00 H new ATOM 0 HA ALA A 55 15.792 0.157 3.777 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.139 -0.503 6.070 1.00 0.00 H new ATOM 0 HB2 ALA A 55 15.136 1.265 5.866 1.00 0.00 H new ATOM 0 HB3 ALA A 55 13.599 0.367 5.874 1.00 0.00 H new ATOM 771 N ALA A 56 14.530 -1.658 2.477 1.00 0.00 N ATOM 772 CA ALA A 56 14.023 -2.924 1.962 1.00 0.00 C ATOM 773 C ALA A 56 15.154 -3.927 1.762 1.00 0.00 C ATOM 774 O ALA A 56 16.331 -3.564 1.776 1.00 0.00 O ATOM 775 CB ALA A 56 13.276 -2.702 0.656 1.00 0.00 C ATOM 0 H ALA A 56 15.203 -1.194 1.867 1.00 0.00 H new ATOM 0 HA ALA A 56 13.332 -3.336 2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 56 12.903 -3.656 0.283 1.00 0.00 H new ATOM 0 HB2 ALA A 56 12.438 -2.027 0.827 1.00 0.00 H new ATOM 0 HB3 ALA A 56 13.951 -2.264 -0.079 1.00 0.00 H new ATOM 781 N THR A 57 14.791 -5.193 1.578 1.00 0.00 N ATOM 782 CA THR A 57 15.775 -6.249 1.377 1.00 0.00 C ATOM 783 C THR A 57 16.123 -6.403 -0.099 1.00 0.00 C ATOM 784 O THR A 57 15.620 -5.664 -0.945 1.00 0.00 O ATOM 785 CB THR A 57 15.268 -7.599 1.917 1.00 0.00 C ATOM 786 OG1 THR A 57 14.172 -8.065 1.121 1.00 0.00 O ATOM 787 CG2 THR A 57 14.829 -7.472 3.368 1.00 0.00 C ATOM 0 H THR A 57 13.822 -5.511 1.564 1.00 0.00 H new ATOM 0 HA THR A 57 16.668 -5.958 1.929 1.00 0.00 H new ATOM 0 HB THR A 57 16.087 -8.317 1.863 1.00 0.00 H new ATOM 0 HG1 THR A 57 14.333 -8.994 0.855 1.00 0.00 H new ATOM 0 HG21 THR A 57 14.475 -8.438 3.727 1.00 0.00 H new ATOM 0 HG22 THR A 57 15.673 -7.146 3.976 1.00 0.00 H new ATOM 0 HG23 THR A 57 14.024 -6.741 3.442 1.00 0.00 H new ATOM 795 N GLU A 58 16.987 -7.368 -0.401 1.00 0.00 N ATOM 796 CA GLU A 58 17.401 -7.617 -1.777 1.00 0.00 C ATOM 797 C GLU A 58 16.396 -8.514 -2.494 1.00 0.00 C ATOM 798 O GLU A 58 16.308 -8.508 -3.721 1.00 0.00 O ATOM 799 CB GLU A 58 18.788 -8.263 -1.805 1.00 0.00 C ATOM 800 CG GLU A 58 18.837 -9.630 -1.145 1.00 0.00 C ATOM 801 CD GLU A 58 18.927 -9.545 0.367 1.00 0.00 C ATOM 802 OE1 GLU A 58 20.051 -9.371 0.885 1.00 0.00 O ATOM 803 OE2 GLU A 58 17.876 -9.652 1.031 1.00 0.00 O ATOM 0 H GLU A 58 17.413 -7.989 0.287 1.00 0.00 H new ATOM 0 HA GLU A 58 17.442 -6.660 -2.297 1.00 0.00 H new ATOM 0 HB2 GLU A 58 19.115 -8.357 -2.841 1.00 0.00 H new ATOM 0 HB3 GLU A 58 19.497 -7.603 -1.306 1.00 0.00 H new ATOM 0 HG2 GLU A 58 17.947 -10.195 -1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 58 19.696 -10.183 -1.526 1.00 0.00 H new ATOM 810 N SER A 59 15.641 -9.285 -1.718 1.00 0.00 N ATOM 811 CA SER A 59 14.644 -10.190 -2.278 1.00 0.00 C ATOM 812 C SER A 59 13.308 -9.479 -2.467 1.00 0.00 C ATOM 813 O SER A 59 12.456 -9.927 -3.234 1.00 0.00 O ATOM 814 CB SER A 59 14.462 -11.407 -1.369 1.00 0.00 C ATOM 815 OG SER A 59 15.441 -12.397 -1.639 1.00 0.00 O ATOM 0 H SER A 59 15.701 -9.301 -0.700 1.00 0.00 H new ATOM 0 HA SER A 59 14.999 -10.523 -3.253 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.530 -11.099 -0.326 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.466 -11.827 -1.513 1.00 0.00 H new ATOM 0 HG SER A 59 15.304 -13.163 -1.044 1.00 0.00 H new ATOM 821 N VAL A 60 13.133 -8.366 -1.761 1.00 0.00 N ATOM 822 CA VAL A 60 11.902 -7.590 -1.851 1.00 0.00 C ATOM 823 C VAL A 60 11.998 -6.530 -2.943 1.00 0.00 C ATOM 824 O VAL A 60 11.176 -6.490 -3.858 1.00 0.00 O ATOM 825 CB VAL A 60 11.572 -6.903 -0.512 1.00 0.00 C ATOM 826 CG1 VAL A 60 10.305 -6.071 -0.637 1.00 0.00 C ATOM 827 CG2 VAL A 60 11.434 -7.936 0.596 1.00 0.00 C ATOM 0 H VAL A 60 13.828 -7.982 -1.121 1.00 0.00 H new ATOM 0 HA VAL A 60 11.104 -8.291 -2.098 1.00 0.00 H new ATOM 0 HB VAL A 60 12.393 -6.234 -0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.088 -5.593 0.318 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.446 -5.307 -1.401 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.472 -6.716 -0.918 1.00 0.00 H new ATOM 0 HG21 VAL A 60 11.201 -7.434 1.535 1.00 0.00 H new ATOM 0 HG22 VAL A 60 10.632 -8.631 0.348 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.370 -8.485 0.701 1.00 0.00 H new ATOM 837 N ARG A 61 13.009 -5.673 -2.840 1.00 0.00 N ATOM 838 CA ARG A 61 13.213 -4.612 -3.819 1.00 0.00 C ATOM 839 C ARG A 61 13.199 -5.171 -5.238 1.00 0.00 C ATOM 840 O ARG A 61 12.944 -4.446 -6.199 1.00 0.00 O ATOM 841 CB ARG A 61 14.538 -3.894 -3.555 1.00 0.00 C ATOM 842 CG ARG A 61 15.761 -4.717 -3.924 1.00 0.00 C ATOM 843 CD ARG A 61 17.040 -3.906 -3.789 1.00 0.00 C ATOM 844 NE ARG A 61 18.223 -4.758 -3.713 1.00 0.00 N ATOM 845 CZ ARG A 61 19.410 -4.332 -3.295 1.00 0.00 C ATOM 846 NH1 ARG A 61 19.570 -3.072 -2.917 1.00 0.00 N ATOM 847 NH2 ARG A 61 20.440 -5.169 -3.254 1.00 0.00 N ATOM 0 H ARG A 61 13.699 -5.693 -2.089 1.00 0.00 H new ATOM 0 HA ARG A 61 12.395 -3.899 -3.720 1.00 0.00 H new ATOM 0 HB2 ARG A 61 14.555 -2.961 -4.119 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.594 -3.629 -2.499 1.00 0.00 H new ATOM 0 HG2 ARG A 61 15.817 -5.596 -3.282 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.663 -5.077 -4.948 1.00 0.00 H new ATOM 0 HD2 ARG A 61 17.133 -3.232 -4.640 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.983 -3.285 -2.895 1.00 0.00 H new ATOM 0 HE ARG A 61 18.133 -5.734 -3.996 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.781 -2.427 -2.947 1.00 0.00 H new ATOM 0 HH12 ARG A 61 20.482 -2.748 -2.597 1.00 0.00 H new ATOM 0 HH21 ARG A 61 20.320 -6.140 -3.544 1.00 0.00 H new ATOM 0 HH22 ARG A 61 21.351 -4.841 -2.933 1.00 0.00 H new ATOM 861 N ARG A 62 13.476 -6.465 -5.361 1.00 0.00 N ATOM 862 CA ARG A 62 13.497 -7.121 -6.663 1.00 0.00 C ATOM 863 C ARG A 62 12.216 -7.917 -6.892 1.00 0.00 C ATOM 864 O ARG A 62 11.768 -8.080 -8.028 1.00 0.00 O ATOM 865 CB ARG A 62 14.711 -8.046 -6.772 1.00 0.00 C ATOM 866 CG ARG A 62 14.582 -9.319 -5.951 1.00 0.00 C ATOM 867 CD ARG A 62 15.907 -10.060 -5.861 1.00 0.00 C ATOM 868 NE ARG A 62 16.186 -10.830 -7.070 1.00 0.00 N ATOM 869 CZ ARG A 62 17.411 -11.170 -7.459 1.00 0.00 C ATOM 870 NH1 ARG A 62 18.463 -10.808 -6.737 1.00 0.00 N ATOM 871 NH2 ARG A 62 17.584 -11.872 -8.571 1.00 0.00 N ATOM 0 H ARG A 62 13.689 -7.080 -4.575 1.00 0.00 H new ATOM 0 HA ARG A 62 13.566 -6.349 -7.429 1.00 0.00 H new ATOM 0 HB2 ARG A 62 14.862 -8.312 -7.818 1.00 0.00 H new ATOM 0 HB3 ARG A 62 15.600 -7.504 -6.450 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.233 -9.073 -4.948 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.830 -9.968 -6.400 1.00 0.00 H new ATOM 0 HD2 ARG A 62 16.712 -9.344 -5.693 1.00 0.00 H new ATOM 0 HD3 ARG A 62 15.891 -10.729 -5.001 1.00 0.00 H new ATOM 0 HE ARG A 62 15.398 -11.123 -7.648 1.00 0.00 H new ATOM 0 HH11 ARG A 62 18.333 -10.268 -5.882 1.00 0.00 H new ATOM 0 HH12 ARG A 62 19.402 -11.070 -7.037 1.00 0.00 H new ATOM 0 HH21 ARG A 62 16.777 -12.151 -9.128 1.00 0.00 H new ATOM 0 HH22 ARG A 62 18.524 -12.132 -8.869 1.00 0.00 H new ATOM 885 N LEU A 63 11.630 -8.410 -5.807 1.00 0.00 N ATOM 886 CA LEU A 63 10.399 -9.190 -5.888 1.00 0.00 C ATOM 887 C LEU A 63 9.196 -8.283 -6.124 1.00 0.00 C ATOM 888 O LEU A 63 8.139 -8.738 -6.566 1.00 0.00 O ATOM 889 CB LEU A 63 10.199 -9.999 -4.606 1.00 0.00 C ATOM 890 CG LEU A 63 8.816 -10.623 -4.415 1.00 0.00 C ATOM 891 CD1 LEU A 63 8.514 -11.603 -5.538 1.00 0.00 C ATOM 892 CD2 LEU A 63 8.725 -11.314 -3.062 1.00 0.00 C ATOM 0 H LEU A 63 11.987 -8.284 -4.860 1.00 0.00 H new ATOM 0 HA LEU A 63 10.486 -9.875 -6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.942 -10.797 -4.584 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.403 -9.350 -3.755 1.00 0.00 H new ATOM 0 HG LEU A 63 8.072 -9.827 -4.445 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.526 -12.037 -5.386 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.537 -11.079 -6.494 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.262 -12.395 -5.540 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.734 -11.752 -2.943 1.00 0.00 H new ATOM 0 HD22 LEU A 63 9.479 -12.099 -3.003 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.897 -10.586 -2.269 1.00 0.00 H new ATOM 904 N LEU A 64 9.362 -6.999 -5.829 1.00 0.00 N ATOM 905 CA LEU A 64 8.289 -6.027 -6.011 1.00 0.00 C ATOM 906 C LEU A 64 8.818 -4.745 -6.648 1.00 0.00 C ATOM 907 O LEU A 64 9.931 -4.308 -6.355 1.00 0.00 O ATOM 908 CB LEU A 64 7.630 -5.708 -4.668 1.00 0.00 C ATOM 909 CG LEU A 64 7.134 -6.909 -3.862 1.00 0.00 C ATOM 910 CD1 LEU A 64 7.206 -6.617 -2.371 1.00 0.00 C ATOM 911 CD2 LEU A 64 5.713 -7.274 -4.268 1.00 0.00 C ATOM 0 H LEU A 64 10.229 -6.606 -5.463 1.00 0.00 H new ATOM 0 HA LEU A 64 7.546 -6.463 -6.679 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.345 -5.156 -4.057 1.00 0.00 H new ATOM 0 HB3 LEU A 64 6.785 -5.043 -4.849 1.00 0.00 H new ATOM 0 HG LEU A 64 7.781 -7.759 -4.077 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.849 -7.483 -1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.238 -6.405 -2.091 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.583 -5.754 -2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.376 -8.131 -3.684 1.00 0.00 H new ATOM 0 HD22 LEU A 64 5.053 -6.427 -4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.691 -7.526 -5.328 1.00 0.00 H new ATOM 923 N ARG A 65 8.012 -4.147 -7.519 1.00 0.00 N ATOM 924 CA ARG A 65 8.398 -2.915 -8.196 1.00 0.00 C ATOM 925 C ARG A 65 7.597 -1.730 -7.667 1.00 0.00 C ATOM 926 O ARG A 65 6.375 -1.803 -7.531 1.00 0.00 O ATOM 927 CB ARG A 65 8.190 -3.052 -9.706 1.00 0.00 C ATOM 928 CG ARG A 65 8.960 -2.026 -10.522 1.00 0.00 C ATOM 929 CD ARG A 65 10.433 -2.389 -10.624 1.00 0.00 C ATOM 930 NE ARG A 65 11.098 -1.676 -11.712 1.00 0.00 N ATOM 931 CZ ARG A 65 12.409 -1.467 -11.760 1.00 0.00 C ATOM 932 NH1 ARG A 65 13.191 -1.915 -10.788 1.00 0.00 N ATOM 933 NH2 ARG A 65 12.940 -0.810 -12.784 1.00 0.00 N ATOM 0 H ARG A 65 7.088 -4.496 -7.772 1.00 0.00 H new ATOM 0 HA ARG A 65 9.454 -2.735 -7.996 1.00 0.00 H new ATOM 0 HB2 ARG A 65 8.492 -4.052 -10.017 1.00 0.00 H new ATOM 0 HB3 ARG A 65 7.127 -2.957 -9.928 1.00 0.00 H new ATOM 0 HG2 ARG A 65 8.531 -1.958 -11.522 1.00 0.00 H new ATOM 0 HG3 ARG A 65 8.857 -1.043 -10.063 1.00 0.00 H new ATOM 0 HD2 ARG A 65 10.930 -2.157 -9.682 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.532 -3.463 -10.781 1.00 0.00 H new ATOM 0 HE ARG A 65 10.524 -1.319 -12.476 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.786 -2.422 -10.001 1.00 0.00 H new ATOM 0 HH12 ARG A 65 14.197 -1.753 -10.827 1.00 0.00 H new ATOM 0 HH21 ARG A 65 12.341 -0.465 -13.534 1.00 0.00 H new ATOM 0 HH22 ARG A 65 13.947 -0.650 -12.820 1.00 0.00 H new ATOM 947 N LEU A 66 8.293 -0.638 -7.368 1.00 0.00 N ATOM 948 CA LEU A 66 7.647 0.564 -6.853 1.00 0.00 C ATOM 949 C LEU A 66 8.068 1.793 -7.652 1.00 0.00 C ATOM 950 O LEU A 66 9.256 2.098 -7.760 1.00 0.00 O ATOM 951 CB LEU A 66 7.992 0.759 -5.375 1.00 0.00 C ATOM 952 CG LEU A 66 7.644 2.123 -4.779 1.00 0.00 C ATOM 953 CD1 LEU A 66 8.692 3.156 -5.162 1.00 0.00 C ATOM 954 CD2 LEU A 66 6.262 2.568 -5.236 1.00 0.00 C ATOM 0 H LEU A 66 9.305 -0.561 -7.473 1.00 0.00 H new ATOM 0 HA LEU A 66 6.569 0.439 -6.954 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.477 -0.009 -4.798 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.061 0.591 -5.247 1.00 0.00 H new ATOM 0 HG LEU A 66 7.634 2.031 -3.693 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.427 4.121 -4.729 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.666 2.844 -4.785 1.00 0.00 H new ATOM 0 HD13 LEU A 66 8.735 3.245 -6.247 1.00 0.00 H new ATOM 0 HD21 LEU A 66 6.031 3.541 -4.802 1.00 0.00 H new ATOM 0 HD22 LEU A 66 6.245 2.642 -6.323 1.00 0.00 H new ATOM 0 HD23 LEU A 66 5.519 1.840 -4.910 1.00 0.00 H new ATOM 966 N ASP A 67 7.087 2.496 -8.206 1.00 0.00 N ATOM 967 CA ASP A 67 7.355 3.695 -8.993 1.00 0.00 C ATOM 968 C ASP A 67 7.483 4.919 -8.091 1.00 0.00 C ATOM 969 O ASP A 67 6.593 5.208 -7.292 1.00 0.00 O ATOM 970 CB ASP A 67 6.243 3.917 -10.019 1.00 0.00 C ATOM 971 CG ASP A 67 6.239 2.859 -11.106 1.00 0.00 C ATOM 972 OD1 ASP A 67 7.319 2.583 -11.669 1.00 0.00 O ATOM 973 OD2 ASP A 67 5.157 2.307 -11.392 1.00 0.00 O ATOM 0 H ASP A 67 6.099 2.257 -8.125 1.00 0.00 H new ATOM 0 HA ASP A 67 8.299 3.552 -9.518 1.00 0.00 H new ATOM 0 HB2 ASP A 67 5.278 3.916 -9.511 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.363 4.900 -10.473 1.00 0.00 H new ATOM 978 N GLU A 68 8.596 5.633 -8.225 1.00 0.00 N ATOM 979 CA GLU A 68 8.841 6.824 -7.420 1.00 0.00 C ATOM 980 C GLU A 68 8.196 8.052 -8.057 1.00 0.00 C ATOM 981 O GLU A 68 7.828 9.003 -7.367 1.00 0.00 O ATOM 982 CB GLU A 68 10.344 7.053 -7.251 1.00 0.00 C ATOM 983 CG GLU A 68 10.959 7.895 -8.356 1.00 0.00 C ATOM 984 CD GLU A 68 11.005 7.169 -9.687 1.00 0.00 C ATOM 985 OE1 GLU A 68 11.124 5.926 -9.681 1.00 0.00 O ATOM 986 OE2 GLU A 68 10.920 7.844 -10.734 1.00 0.00 O ATOM 0 H GLU A 68 9.342 5.408 -8.883 1.00 0.00 H new ATOM 0 HA GLU A 68 8.393 6.667 -6.439 1.00 0.00 H new ATOM 0 HB2 GLU A 68 10.523 7.540 -6.292 1.00 0.00 H new ATOM 0 HB3 GLU A 68 10.849 6.087 -7.218 1.00 0.00 H new ATOM 0 HG2 GLU A 68 10.386 8.815 -8.468 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.970 8.183 -8.068 1.00 0.00 H new ATOM 993 N THR A 69 8.063 8.025 -9.379 1.00 0.00 N ATOM 994 CA THR A 69 7.466 9.135 -10.111 1.00 0.00 C ATOM 995 C THR A 69 5.945 9.113 -9.997 1.00 0.00 C ATOM 996 O THR A 69 5.306 10.160 -9.899 1.00 0.00 O ATOM 997 CB THR A 69 7.859 9.103 -11.600 1.00 0.00 C ATOM 998 OG1 THR A 69 7.244 10.196 -12.292 1.00 0.00 O ATOM 999 CG2 THR A 69 7.440 7.789 -12.242 1.00 0.00 C ATOM 0 H THR A 69 8.361 7.245 -9.965 1.00 0.00 H new ATOM 0 HA THR A 69 7.848 10.052 -9.663 1.00 0.00 H new ATOM 0 HB THR A 69 8.943 9.193 -11.670 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.500 10.170 -13.238 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.728 7.790 -13.293 1.00 0.00 H new ATOM 0 HG22 THR A 69 7.932 6.961 -11.731 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.359 7.673 -12.162 1.00 0.00 H new ATOM 1007 N SER A 70 5.373 7.913 -10.011 1.00 0.00 N ATOM 1008 CA SER A 70 3.927 7.756 -9.913 1.00 0.00 C ATOM 1009 C SER A 70 3.518 7.361 -8.498 1.00 0.00 C ATOM 1010 O SER A 70 2.625 7.966 -7.905 1.00 0.00 O ATOM 1011 CB SER A 70 3.438 6.702 -10.910 1.00 0.00 C ATOM 1012 OG SER A 70 4.051 5.448 -10.667 1.00 0.00 O ATOM 0 H SER A 70 5.889 7.036 -10.089 1.00 0.00 H new ATOM 0 HA SER A 70 3.466 8.714 -10.152 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.355 6.602 -10.836 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.659 7.028 -11.926 1.00 0.00 H new ATOM 0 HG SER A 70 3.721 4.791 -11.315 1.00 0.00 H new ATOM 1018 N GLY A 71 4.179 6.340 -7.961 1.00 0.00 N ATOM 1019 CA GLY A 71 3.871 5.880 -6.619 1.00 0.00 C ATOM 1020 C GLY A 71 3.014 4.630 -6.616 1.00 0.00 C ATOM 1021 O GLY A 71 2.320 4.347 -5.640 1.00 0.00 O ATOM 0 H GLY A 71 4.922 5.823 -8.431 1.00 0.00 H new ATOM 0 HA2 GLY A 71 4.800 5.681 -6.085 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.355 6.672 -6.077 1.00 0.00 H new ATOM 1025 N TRP A 72 3.060 3.881 -7.712 1.00 0.00 N ATOM 1026 CA TRP A 72 2.280 2.655 -7.833 1.00 0.00 C ATOM 1027 C TRP A 72 3.118 1.437 -7.460 1.00 0.00 C ATOM 1028 O TRP A 72 4.039 1.059 -8.186 1.00 0.00 O ATOM 1029 CB TRP A 72 1.745 2.505 -9.259 1.00 0.00 C ATOM 1030 CG TRP A 72 0.390 3.114 -9.452 1.00 0.00 C ATOM 1031 CD1 TRP A 72 0.105 4.297 -10.074 1.00 0.00 C ATOM 1032 CD2 TRP A 72 -0.863 2.573 -9.021 1.00 0.00 C ATOM 1033 NE1 TRP A 72 -1.251 4.523 -10.054 1.00 0.00 N ATOM 1034 CE2 TRP A 72 -1.866 3.480 -9.414 1.00 0.00 C ATOM 1035 CE3 TRP A 72 -1.235 1.410 -8.341 1.00 0.00 C ATOM 1036 CZ2 TRP A 72 -3.215 3.258 -9.150 1.00 0.00 C ATOM 1037 CZ3 TRP A 72 -2.574 1.192 -8.079 1.00 0.00 C ATOM 1038 CH2 TRP A 72 -3.551 2.111 -8.483 1.00 0.00 C ATOM 0 H TRP A 72 3.629 4.101 -8.529 1.00 0.00 H new ATOM 0 HA TRP A 72 1.439 2.719 -7.142 1.00 0.00 H new ATOM 0 HB2 TRP A 72 2.446 2.969 -9.953 1.00 0.00 H new ATOM 0 HB3 TRP A 72 1.699 1.446 -9.513 1.00 0.00 H new ATOM 0 HD1 TRP A 72 0.837 4.957 -10.516 1.00 0.00 H new ATOM 0 HE1 TRP A 72 -1.722 5.336 -10.451 1.00 0.00 H new ATOM 0 HE3 TRP A 72 -0.490 0.695 -8.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 -3.969 3.966 -9.461 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 -2.873 0.297 -7.553 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -4.589 1.911 -8.264 1.00 0.00 H new ATOM 1049 N LEU A 73 2.794 0.826 -6.326 1.00 0.00 N ATOM 1050 CA LEU A 73 3.518 -0.350 -5.857 1.00 0.00 C ATOM 1051 C LEU A 73 2.865 -1.631 -6.367 1.00 0.00 C ATOM 1052 O LEU A 73 1.700 -1.903 -6.077 1.00 0.00 O ATOM 1053 CB LEU A 73 3.571 -0.365 -4.328 1.00 0.00 C ATOM 1054 CG LEU A 73 4.857 -0.909 -3.706 1.00 0.00 C ATOM 1055 CD1 LEU A 73 4.755 -0.917 -2.189 1.00 0.00 C ATOM 1056 CD2 LEU A 73 5.153 -2.307 -4.230 1.00 0.00 C ATOM 0 H LEU A 73 2.035 1.125 -5.714 1.00 0.00 H new ATOM 0 HA LEU A 73 4.534 -0.301 -6.249 1.00 0.00 H new ATOM 0 HB2 LEU A 73 3.420 0.653 -3.969 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.734 -0.959 -3.961 1.00 0.00 H new ATOM 0 HG LEU A 73 5.680 -0.254 -3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 73 5.680 -1.307 -1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 73 4.591 0.099 -1.830 1.00 0.00 H new ATOM 0 HD13 LEU A 73 3.921 -1.548 -1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.072 -2.679 -3.777 1.00 0.00 H new ATOM 0 HD22 LEU A 73 4.328 -2.973 -3.976 1.00 0.00 H new ATOM 0 HD23 LEU A 73 5.271 -2.272 -5.313 1.00 0.00 H new ATOM 1068 N SER A 74 3.624 -2.414 -7.126 1.00 0.00 N ATOM 1069 CA SER A 74 3.118 -3.666 -7.677 1.00 0.00 C ATOM 1070 C SER A 74 4.171 -4.766 -7.583 1.00 0.00 C ATOM 1071 O SER A 74 5.265 -4.551 -7.060 1.00 0.00 O ATOM 1072 CB SER A 74 2.696 -3.472 -9.135 1.00 0.00 C ATOM 1073 OG SER A 74 3.826 -3.335 -9.979 1.00 0.00 O ATOM 0 H SER A 74 4.591 -2.204 -7.374 1.00 0.00 H new ATOM 0 HA SER A 74 2.250 -3.967 -7.091 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.097 -4.323 -9.460 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.065 -2.587 -9.220 1.00 0.00 H new ATOM 0 HG SER A 74 3.530 -3.214 -10.905 1.00 0.00 H new ATOM 1079 N VAL A 75 3.833 -5.946 -8.093 1.00 0.00 N ATOM 1080 CA VAL A 75 4.748 -7.081 -8.068 1.00 0.00 C ATOM 1081 C VAL A 75 5.649 -7.087 -9.298 1.00 0.00 C ATOM 1082 O VAL A 75 5.243 -6.664 -10.381 1.00 0.00 O ATOM 1083 CB VAL A 75 3.985 -8.416 -7.998 1.00 0.00 C ATOM 1084 CG1 VAL A 75 4.956 -9.587 -7.999 1.00 0.00 C ATOM 1085 CG2 VAL A 75 3.091 -8.455 -6.767 1.00 0.00 C ATOM 0 H VAL A 75 2.932 -6.141 -8.529 1.00 0.00 H new ATOM 0 HA VAL A 75 5.360 -6.974 -7.173 1.00 0.00 H new ATOM 0 HB VAL A 75 3.352 -8.499 -8.881 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.398 -10.522 -7.949 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.549 -9.567 -8.913 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.617 -9.512 -7.136 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.559 -9.406 -6.734 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.702 -8.349 -5.870 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.371 -7.638 -6.814 1.00 0.00 H new ATOM 1095 N LEU A 76 6.875 -7.569 -9.124 1.00 0.00 N ATOM 1096 CA LEU A 76 7.835 -7.631 -10.220 1.00 0.00 C ATOM 1097 C LEU A 76 8.124 -9.078 -10.609 1.00 0.00 C ATOM 1098 O LEU A 76 8.256 -9.399 -11.790 1.00 0.00 O ATOM 1099 CB LEU A 76 9.135 -6.928 -9.826 1.00 0.00 C ATOM 1100 CG LEU A 76 10.178 -6.774 -10.934 1.00 0.00 C ATOM 1101 CD1 LEU A 76 9.641 -5.897 -12.054 1.00 0.00 C ATOM 1102 CD2 LEU A 76 11.470 -6.197 -10.374 1.00 0.00 C ATOM 0 H LEU A 76 7.227 -7.922 -8.234 1.00 0.00 H new ATOM 0 HA LEU A 76 7.400 -7.122 -11.080 1.00 0.00 H new ATOM 0 HB2 LEU A 76 8.888 -5.936 -9.447 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.588 -7.480 -9.003 1.00 0.00 H new ATOM 0 HG LEU A 76 10.393 -7.761 -11.344 1.00 0.00 H new ATOM 0 HD11 LEU A 76 10.397 -5.799 -12.833 1.00 0.00 H new ATOM 0 HD12 LEU A 76 8.744 -6.352 -12.474 1.00 0.00 H new ATOM 0 HD13 LEU A 76 9.397 -4.911 -11.659 1.00 0.00 H new ATOM 0 HD21 LEU A 76 12.201 -6.094 -11.176 1.00 0.00 H new ATOM 0 HD22 LEU A 76 11.272 -5.219 -9.936 1.00 0.00 H new ATOM 0 HD23 LEU A 76 11.864 -6.864 -9.608 1.00 0.00 H new ATOM 1114 N HIS A 77 8.220 -9.947 -9.608 1.00 0.00 N ATOM 1115 CA HIS A 77 8.490 -11.360 -9.845 1.00 0.00 C ATOM 1116 C HIS A 77 7.489 -12.238 -9.100 1.00 0.00 C ATOM 1117 O HIS A 77 6.968 -11.851 -8.054 1.00 0.00 O ATOM 1118 CB HIS A 77 9.914 -11.709 -9.410 1.00 0.00 C ATOM 1119 CG HIS A 77 10.953 -11.374 -10.436 1.00 0.00 C ATOM 1120 ND1 HIS A 77 10.790 -11.627 -11.782 1.00 0.00 N ATOM 1121 CD2 HIS A 77 12.172 -10.801 -10.307 1.00 0.00 C ATOM 1122 CE1 HIS A 77 11.866 -11.226 -12.436 1.00 0.00 C ATOM 1123 NE2 HIS A 77 12.719 -10.721 -11.564 1.00 0.00 N ATOM 0 H HIS A 77 8.115 -9.697 -8.625 1.00 0.00 H new ATOM 0 HA HIS A 77 8.387 -11.549 -10.914 1.00 0.00 H new ATOM 0 HB2 HIS A 77 10.143 -11.178 -8.486 1.00 0.00 H new ATOM 0 HB3 HIS A 77 9.966 -12.775 -9.187 1.00 0.00 H new ATOM 0 HD2 HIS A 77 12.629 -10.469 -9.387 1.00 0.00 H new ATOM 0 HE1 HIS A 77 12.021 -11.299 -13.502 1.00 0.00 H new ATOM 0 HE2 HIS A 77 13.636 -10.334 -11.788 1.00 0.00 H new ATOM 1132 N ARG A 78 7.223 -13.420 -9.647 1.00 0.00 N ATOM 1133 CA ARG A 78 6.283 -14.351 -9.036 1.00 0.00 C ATOM 1134 C ARG A 78 6.621 -14.577 -7.565 1.00 0.00 C ATOM 1135 O ARG A 78 7.752 -14.347 -7.136 1.00 0.00 O ATOM 1136 CB ARG A 78 6.294 -15.685 -9.784 1.00 0.00 C ATOM 1137 CG ARG A 78 5.660 -15.614 -11.164 1.00 0.00 C ATOM 1138 CD ARG A 78 5.178 -16.980 -11.626 1.00 0.00 C ATOM 1139 NE ARG A 78 4.081 -17.481 -10.802 1.00 0.00 N ATOM 1140 CZ ARG A 78 3.272 -18.467 -11.174 1.00 0.00 C ATOM 1141 NH1 ARG A 78 3.437 -19.055 -12.352 1.00 0.00 N ATOM 1142 NH2 ARG A 78 2.297 -18.867 -10.368 1.00 0.00 N ATOM 0 H ARG A 78 7.646 -13.755 -10.513 1.00 0.00 H new ATOM 0 HA ARG A 78 5.286 -13.916 -9.099 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.324 -16.028 -9.884 1.00 0.00 H new ATOM 0 HB3 ARG A 78 5.766 -16.430 -9.189 1.00 0.00 H new ATOM 0 HG2 ARG A 78 4.821 -14.918 -11.145 1.00 0.00 H new ATOM 0 HG3 ARG A 78 6.384 -15.221 -11.878 1.00 0.00 H new ATOM 0 HD2 ARG A 78 4.852 -16.917 -12.664 1.00 0.00 H new ATOM 0 HD3 ARG A 78 6.007 -17.687 -11.594 1.00 0.00 H new ATOM 0 HE ARG A 78 3.928 -17.050 -9.890 1.00 0.00 H new ATOM 0 HH11 ARG A 78 4.186 -18.750 -12.974 1.00 0.00 H new ATOM 0 HH12 ARG A 78 2.815 -19.812 -12.636 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.168 -18.417 -9.462 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.677 -19.624 -10.655 1.00 0.00 H new ATOM 1156 N ILE A 79 5.634 -15.029 -6.799 1.00 0.00 N ATOM 1157 CA ILE A 79 5.827 -15.287 -5.378 1.00 0.00 C ATOM 1158 C ILE A 79 5.352 -16.687 -5.003 1.00 0.00 C ATOM 1159 O ILE A 79 4.454 -17.239 -5.639 1.00 0.00 O ATOM 1160 CB ILE A 79 5.081 -14.255 -4.512 1.00 0.00 C ATOM 1161 CG1 ILE A 79 5.472 -12.834 -4.923 1.00 0.00 C ATOM 1162 CG2 ILE A 79 5.379 -14.487 -3.038 1.00 0.00 C ATOM 1163 CD1 ILE A 79 4.543 -12.225 -5.949 1.00 0.00 C ATOM 0 H ILE A 79 4.692 -15.224 -7.139 1.00 0.00 H new ATOM 0 HA ILE A 79 6.897 -15.206 -5.186 1.00 0.00 H new ATOM 0 HB ILE A 79 4.009 -14.377 -4.670 1.00 0.00 H new ATOM 0 HG12 ILE A 79 5.488 -12.199 -4.037 1.00 0.00 H new ATOM 0 HG13 ILE A 79 6.485 -12.846 -5.324 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.845 -13.750 -2.438 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.056 -15.489 -2.755 1.00 0.00 H new ATOM 0 HG23 ILE A 79 6.450 -14.389 -2.864 1.00 0.00 H new ATOM 0 HD11 ILE A 79 4.881 -11.218 -6.193 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.545 -12.837 -6.851 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.532 -12.180 -5.543 1.00 0.00 H new ATOM 1175 N ASP A 80 5.959 -17.254 -3.967 1.00 0.00 N ATOM 1176 CA ASP A 80 5.596 -18.589 -3.505 1.00 0.00 C ATOM 1177 C ASP A 80 5.482 -18.626 -1.984 1.00 0.00 C ATOM 1178 O ASP A 80 6.479 -18.500 -1.274 1.00 0.00 O ATOM 1179 CB ASP A 80 6.629 -19.614 -3.976 1.00 0.00 C ATOM 1180 CG ASP A 80 6.038 -21.000 -4.137 1.00 0.00 C ATOM 1181 OD1 ASP A 80 4.811 -21.102 -4.341 1.00 0.00 O ATOM 1182 OD2 ASP A 80 6.803 -21.985 -4.057 1.00 0.00 O ATOM 0 H ASP A 80 6.705 -16.810 -3.431 1.00 0.00 H new ATOM 0 HA ASP A 80 4.625 -18.842 -3.931 1.00 0.00 H new ATOM 0 HB2 ASP A 80 7.051 -19.289 -4.927 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.450 -19.653 -3.260 1.00 0.00 H new ATOM 1187 N ARG A 81 4.259 -18.797 -1.492 1.00 0.00 N ATOM 1188 CA ARG A 81 4.014 -18.847 -0.056 1.00 0.00 C ATOM 1189 C ARG A 81 5.111 -19.635 0.656 1.00 0.00 C ATOM 1190 O ARG A 81 5.501 -19.301 1.774 1.00 0.00 O ATOM 1191 CB ARG A 81 2.651 -19.480 0.229 1.00 0.00 C ATOM 1192 CG ARG A 81 2.086 -19.122 1.594 1.00 0.00 C ATOM 1193 CD ARG A 81 3.004 -19.584 2.715 1.00 0.00 C ATOM 1194 NE ARG A 81 2.262 -19.917 3.928 1.00 0.00 N ATOM 1195 CZ ARG A 81 1.597 -21.055 4.093 1.00 0.00 C ATOM 1196 NH1 ARG A 81 1.582 -21.965 3.129 1.00 0.00 N ATOM 1197 NH2 ARG A 81 0.946 -21.286 5.226 1.00 0.00 N ATOM 0 H ARG A 81 3.423 -18.903 -2.067 1.00 0.00 H new ATOM 0 HA ARG A 81 4.019 -17.825 0.323 1.00 0.00 H new ATOM 0 HB2 ARG A 81 1.946 -19.165 -0.540 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.741 -20.564 0.155 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.945 -18.043 1.659 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.104 -19.580 1.714 1.00 0.00 H new ATOM 0 HD2 ARG A 81 3.569 -20.456 2.385 1.00 0.00 H new ATOM 0 HD3 ARG A 81 3.728 -18.800 2.937 1.00 0.00 H new ATOM 0 HE ARG A 81 2.254 -19.239 4.690 1.00 0.00 H new ATOM 0 HH11 ARG A 81 2.082 -21.792 2.257 1.00 0.00 H new ATOM 0 HH12 ARG A 81 1.070 -22.838 3.259 1.00 0.00 H new ATOM 0 HH21 ARG A 81 0.956 -20.589 5.971 1.00 0.00 H new ATOM 0 HH22 ARG A 81 0.436 -22.160 5.352 1.00 0.00 H new ATOM 1211 N GLU A 82 5.603 -20.680 -0.002 1.00 0.00 N ATOM 1212 CA GLU A 82 6.653 -21.515 0.569 1.00 0.00 C ATOM 1213 C GLU A 82 7.947 -20.724 0.734 1.00 0.00 C ATOM 1214 O GLU A 82 8.646 -20.861 1.737 1.00 0.00 O ATOM 1215 CB GLU A 82 6.899 -22.740 -0.315 1.00 0.00 C ATOM 1216 CG GLU A 82 5.766 -23.751 -0.283 1.00 0.00 C ATOM 1217 CD GLU A 82 6.204 -25.132 -0.729 1.00 0.00 C ATOM 1218 OE1 GLU A 82 6.730 -25.889 0.113 1.00 0.00 O ATOM 1219 OE2 GLU A 82 6.020 -25.456 -1.922 1.00 0.00 O ATOM 0 H GLU A 82 5.292 -20.968 -0.930 1.00 0.00 H new ATOM 0 HA GLU A 82 6.323 -21.847 1.553 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.052 -22.411 -1.343 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.820 -23.229 0.004 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.365 -23.810 0.729 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.957 -23.405 -0.926 1.00 0.00 H new ATOM 1226 N GLU A 83 8.260 -19.899 -0.260 1.00 0.00 N ATOM 1227 CA GLU A 83 9.471 -19.087 -0.226 1.00 0.00 C ATOM 1228 C GLU A 83 9.305 -17.901 0.719 1.00 0.00 C ATOM 1229 O GLU A 83 10.276 -17.413 1.298 1.00 0.00 O ATOM 1230 CB GLU A 83 9.818 -18.589 -1.631 1.00 0.00 C ATOM 1231 CG GLU A 83 8.929 -17.454 -2.111 1.00 0.00 C ATOM 1232 CD GLU A 83 9.647 -16.511 -3.056 1.00 0.00 C ATOM 1233 OE1 GLU A 83 10.887 -16.406 -2.962 1.00 0.00 O ATOM 1234 OE2 GLU A 83 8.967 -15.876 -3.890 1.00 0.00 O ATOM 0 H GLU A 83 7.692 -19.775 -1.098 1.00 0.00 H new ATOM 0 HA GLU A 83 10.285 -19.711 0.142 1.00 0.00 H new ATOM 0 HB2 GLU A 83 10.856 -18.257 -1.643 1.00 0.00 H new ATOM 0 HB3 GLU A 83 9.741 -19.421 -2.331 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.055 -17.869 -2.613 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.566 -16.893 -1.250 1.00 0.00 H new ATOM 1241 N VAL A 84 8.067 -17.442 0.871 1.00 0.00 N ATOM 1242 CA VAL A 84 7.772 -16.313 1.746 1.00 0.00 C ATOM 1243 C VAL A 84 6.388 -16.449 2.370 1.00 0.00 C ATOM 1244 O VAL A 84 5.448 -16.913 1.726 1.00 0.00 O ATOM 1245 CB VAL A 84 7.850 -14.977 0.984 1.00 0.00 C ATOM 1246 CG1 VAL A 84 9.299 -14.600 0.713 1.00 0.00 C ATOM 1247 CG2 VAL A 84 7.060 -15.057 -0.314 1.00 0.00 C ATOM 0 H VAL A 84 7.252 -17.834 0.400 1.00 0.00 H new ATOM 0 HA VAL A 84 8.525 -16.318 2.534 1.00 0.00 H new ATOM 0 HB VAL A 84 7.407 -14.198 1.605 1.00 0.00 H new ATOM 0 HG11 VAL A 84 9.334 -13.653 0.174 1.00 0.00 H new ATOM 0 HG12 VAL A 84 9.832 -14.499 1.659 1.00 0.00 H new ATOM 0 HG13 VAL A 84 9.771 -15.377 0.112 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.126 -14.104 -0.839 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.471 -15.847 -0.942 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.016 -15.277 -0.091 1.00 0.00 H new ATOM 1257 N ASN A 85 6.270 -16.041 3.630 1.00 0.00 N ATOM 1258 CA ASN A 85 5.000 -16.117 4.342 1.00 0.00 C ATOM 1259 C ASN A 85 4.432 -14.723 4.593 1.00 0.00 C ATOM 1260 O ASN A 85 3.227 -14.558 4.782 1.00 0.00 O ATOM 1261 CB ASN A 85 5.181 -16.853 5.672 1.00 0.00 C ATOM 1262 CG ASN A 85 5.937 -16.025 6.693 1.00 0.00 C ATOM 1263 OD1 ASN A 85 7.061 -15.588 6.444 1.00 0.00 O ATOM 1264 ND2 ASN A 85 5.322 -15.806 7.849 1.00 0.00 N ATOM 0 H ASN A 85 7.038 -15.655 4.178 1.00 0.00 H new ATOM 0 HA ASN A 85 4.296 -16.670 3.720 1.00 0.00 H new ATOM 0 HB2 ASN A 85 4.203 -17.116 6.074 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.716 -17.787 5.498 1.00 0.00 H new ATOM 0 HD21 ASN A 85 5.781 -15.256 8.575 1.00 0.00 H new ATOM 0 HD22 ASN A 85 4.390 -16.188 8.011 1.00 0.00 H new ATOM 1271 N GLN A 86 5.309 -13.724 4.592 1.00 0.00 N ATOM 1272 CA GLN A 86 4.894 -12.345 4.819 1.00 0.00 C ATOM 1273 C GLN A 86 6.047 -11.380 4.561 1.00 0.00 C ATOM 1274 O GLN A 86 7.031 -11.359 5.303 1.00 0.00 O ATOM 1275 CB GLN A 86 4.381 -12.173 6.250 1.00 0.00 C ATOM 1276 CG GLN A 86 4.059 -10.732 6.612 1.00 0.00 C ATOM 1277 CD GLN A 86 3.590 -10.582 8.046 1.00 0.00 C ATOM 1278 OE1 GLN A 86 2.612 -11.205 8.460 1.00 0.00 O ATOM 1279 NE2 GLN A 86 4.287 -9.752 8.813 1.00 0.00 N ATOM 0 H GLN A 86 6.310 -13.844 4.437 1.00 0.00 H new ATOM 0 HA GLN A 86 4.088 -12.115 4.122 1.00 0.00 H new ATOM 0 HB2 GLN A 86 3.486 -12.781 6.382 1.00 0.00 H new ATOM 0 HB3 GLN A 86 5.130 -12.555 6.944 1.00 0.00 H new ATOM 0 HG2 GLN A 86 4.945 -10.116 6.457 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.287 -10.356 5.940 1.00 0.00 H new ATOM 0 HE21 GLN A 86 5.091 -9.256 8.428 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.018 -9.610 9.787 1.00 0.00 H new ATOM 1288 N LEU A 87 5.921 -10.584 3.505 1.00 0.00 N ATOM 1289 CA LEU A 87 6.953 -9.617 3.148 1.00 0.00 C ATOM 1290 C LEU A 87 6.852 -8.367 4.017 1.00 0.00 C ATOM 1291 O LEU A 87 5.774 -8.022 4.502 1.00 0.00 O ATOM 1292 CB LEU A 87 6.834 -9.236 1.672 1.00 0.00 C ATOM 1293 CG LEU A 87 6.770 -10.400 0.681 1.00 0.00 C ATOM 1294 CD1 LEU A 87 5.981 -10.004 -0.557 1.00 0.00 C ATOM 1295 CD2 LEU A 87 8.172 -10.852 0.300 1.00 0.00 C ATOM 0 H LEU A 87 5.114 -10.589 2.881 1.00 0.00 H new ATOM 0 HA LEU A 87 7.925 -10.080 3.320 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.938 -8.628 1.546 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.685 -8.608 1.410 1.00 0.00 H new ATOM 0 HG LEU A 87 6.258 -11.234 1.161 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.946 -10.844 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.966 -9.729 -0.269 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.464 -9.155 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.108 -11.681 -0.405 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.709 -10.023 -0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.705 -11.177 1.194 1.00 0.00 H new ATOM 1307 N ARG A 88 7.981 -7.692 4.207 1.00 0.00 N ATOM 1308 CA ARG A 88 8.019 -6.480 5.017 1.00 0.00 C ATOM 1309 C ARG A 88 9.171 -5.576 4.587 1.00 0.00 C ATOM 1310 O ARG A 88 10.326 -6.001 4.548 1.00 0.00 O ATOM 1311 CB ARG A 88 8.160 -6.835 6.498 1.00 0.00 C ATOM 1312 CG ARG A 88 7.499 -5.833 7.430 1.00 0.00 C ATOM 1313 CD ARG A 88 7.689 -6.218 8.888 1.00 0.00 C ATOM 1314 NE ARG A 88 7.124 -7.532 9.186 1.00 0.00 N ATOM 1315 CZ ARG A 88 7.016 -8.024 10.415 1.00 0.00 C ATOM 1316 NH1 ARG A 88 7.433 -7.316 11.455 1.00 0.00 N ATOM 1317 NH2 ARG A 88 6.490 -9.228 10.604 1.00 0.00 N ATOM 0 H ARG A 88 8.881 -7.964 3.811 1.00 0.00 H new ATOM 0 HA ARG A 88 7.082 -5.943 4.867 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.725 -7.820 6.670 1.00 0.00 H new ATOM 0 HB3 ARG A 88 9.219 -6.906 6.747 1.00 0.00 H new ATOM 0 HG2 ARG A 88 7.918 -4.842 7.257 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.434 -5.772 7.204 1.00 0.00 H new ATOM 0 HD2 ARG A 88 8.752 -6.218 9.127 1.00 0.00 H new ATOM 0 HD3 ARG A 88 7.219 -5.469 9.525 1.00 0.00 H new ATOM 0 HE ARG A 88 6.794 -8.103 8.408 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.838 -6.391 11.313 1.00 0.00 H new ATOM 0 HH12 ARG A 88 7.349 -7.696 12.398 1.00 0.00 H new ATOM 0 HH21 ARG A 88 6.169 -9.775 9.805 1.00 0.00 H new ATOM 0 HH22 ARG A 88 6.407 -9.606 11.548 1.00 0.00 H new ATOM 1331 N PHE A 89 8.848 -4.328 4.266 1.00 0.00 N ATOM 1332 CA PHE A 89 9.855 -3.364 3.838 1.00 0.00 C ATOM 1333 C PHE A 89 9.440 -1.943 4.208 1.00 0.00 C ATOM 1334 O PHE A 89 8.415 -1.732 4.857 1.00 0.00 O ATOM 1335 CB PHE A 89 10.079 -3.465 2.328 1.00 0.00 C ATOM 1336 CG PHE A 89 8.805 -3.492 1.533 1.00 0.00 C ATOM 1337 CD1 PHE A 89 8.056 -4.654 1.439 1.00 0.00 C ATOM 1338 CD2 PHE A 89 8.355 -2.355 0.882 1.00 0.00 C ATOM 1339 CE1 PHE A 89 6.883 -4.681 0.708 1.00 0.00 C ATOM 1340 CE2 PHE A 89 7.183 -2.376 0.149 1.00 0.00 C ATOM 1341 CZ PHE A 89 6.445 -3.541 0.064 1.00 0.00 C ATOM 0 H PHE A 89 7.897 -3.960 4.294 1.00 0.00 H new ATOM 0 HA PHE A 89 10.787 -3.597 4.353 1.00 0.00 H new ATOM 0 HB2 PHE A 89 10.684 -2.619 2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 89 10.651 -4.368 2.113 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.392 -5.548 1.942 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.927 -1.441 0.948 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.309 -5.594 0.641 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.845 -1.483 -0.356 1.00 0.00 H new ATOM 0 HZ PHE A 89 5.527 -3.560 -0.505 1.00 0.00 H new ATOM 1351 N THR A 90 10.245 -0.970 3.792 1.00 0.00 N ATOM 1352 CA THR A 90 9.964 0.430 4.081 1.00 0.00 C ATOM 1353 C THR A 90 10.189 1.301 2.850 1.00 0.00 C ATOM 1354 O THR A 90 11.092 1.046 2.053 1.00 0.00 O ATOM 1355 CB THR A 90 10.842 0.954 5.234 1.00 0.00 C ATOM 1356 OG1 THR A 90 10.948 -0.040 6.259 1.00 0.00 O ATOM 1357 CG2 THR A 90 10.261 2.232 5.818 1.00 0.00 C ATOM 0 H THR A 90 11.097 -1.127 3.254 1.00 0.00 H new ATOM 0 HA THR A 90 8.917 0.487 4.377 1.00 0.00 H new ATOM 0 HB THR A 90 11.833 1.173 4.837 1.00 0.00 H new ATOM 0 HG1 THR A 90 11.509 0.300 6.987 1.00 0.00 H new ATOM 0 HG21 THR A 90 10.898 2.583 6.630 1.00 0.00 H new ATOM 0 HG22 THR A 90 10.208 2.996 5.042 1.00 0.00 H new ATOM 0 HG23 THR A 90 9.260 2.035 6.201 1.00 0.00 H new ATOM 1365 N VAL A 91 9.363 2.332 2.701 1.00 0.00 N ATOM 1366 CA VAL A 91 9.473 3.242 1.567 1.00 0.00 C ATOM 1367 C VAL A 91 9.728 4.671 2.033 1.00 0.00 C ATOM 1368 O VAL A 91 9.168 5.118 3.034 1.00 0.00 O ATOM 1369 CB VAL A 91 8.200 3.216 0.701 1.00 0.00 C ATOM 1370 CG1 VAL A 91 8.094 1.899 -0.053 1.00 0.00 C ATOM 1371 CG2 VAL A 91 6.966 3.449 1.559 1.00 0.00 C ATOM 0 H VAL A 91 8.610 2.558 3.351 1.00 0.00 H new ATOM 0 HA VAL A 91 10.318 2.901 0.968 1.00 0.00 H new ATOM 0 HB VAL A 91 8.263 4.022 -0.030 1.00 0.00 H new ATOM 0 HG11 VAL A 91 7.188 1.899 -0.660 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.964 1.779 -0.699 1.00 0.00 H new ATOM 0 HG13 VAL A 91 8.054 1.074 0.659 1.00 0.00 H new ATOM 0 HG21 VAL A 91 6.076 3.427 0.930 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.895 2.667 2.315 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.041 4.420 2.048 1.00 0.00 H new ATOM 1381 N MET A 92 10.577 5.384 1.300 1.00 0.00 N ATOM 1382 CA MET A 92 10.904 6.765 1.637 1.00 0.00 C ATOM 1383 C MET A 92 10.195 7.737 0.700 1.00 0.00 C ATOM 1384 O MET A 92 9.885 7.397 -0.442 1.00 0.00 O ATOM 1385 CB MET A 92 12.417 6.983 1.569 1.00 0.00 C ATOM 1386 CG MET A 92 13.131 6.710 2.883 1.00 0.00 C ATOM 1387 SD MET A 92 14.637 7.683 3.071 1.00 0.00 S ATOM 1388 CE MET A 92 15.477 7.308 1.535 1.00 0.00 C ATOM 0 H MET A 92 11.051 5.029 0.469 1.00 0.00 H new ATOM 0 HA MET A 92 10.562 6.956 2.654 1.00 0.00 H new ATOM 0 HB2 MET A 92 12.834 6.336 0.797 1.00 0.00 H new ATOM 0 HB3 MET A 92 12.614 8.011 1.265 1.00 0.00 H new ATOM 0 HG2 MET A 92 12.456 6.929 3.711 1.00 0.00 H new ATOM 0 HG3 MET A 92 13.378 5.650 2.944 1.00 0.00 H new ATOM 0 HE1 MET A 92 16.526 7.594 1.615 1.00 0.00 H new ATOM 0 HE2 MET A 92 15.406 6.239 1.333 1.00 0.00 H new ATOM 0 HE3 MET A 92 15.011 7.863 0.721 1.00 0.00 H new ATOM 1398 N ALA A 93 9.943 8.946 1.189 1.00 0.00 N ATOM 1399 CA ALA A 93 9.272 9.967 0.394 1.00 0.00 C ATOM 1400 C ALA A 93 10.003 11.302 0.485 1.00 0.00 C ATOM 1401 O ALA A 93 10.090 11.901 1.557 1.00 0.00 O ATOM 1402 CB ALA A 93 7.827 10.122 0.844 1.00 0.00 C ATOM 0 H ALA A 93 10.193 9.243 2.132 1.00 0.00 H new ATOM 0 HA ALA A 93 9.284 9.647 -0.648 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.338 10.888 0.242 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.304 9.174 0.720 1.00 0.00 H new ATOM 0 HB3 ALA A 93 7.802 10.415 1.893 1.00 0.00 H new ATOM 1408 N ARG A 94 10.528 11.763 -0.646 1.00 0.00 N ATOM 1409 CA ARG A 94 11.254 13.026 -0.692 1.00 0.00 C ATOM 1410 C ARG A 94 10.332 14.167 -1.114 1.00 0.00 C ATOM 1411 O ARG A 94 9.536 14.024 -2.042 1.00 0.00 O ATOM 1412 CB ARG A 94 12.434 12.926 -1.660 1.00 0.00 C ATOM 1413 CG ARG A 94 13.154 11.588 -1.606 1.00 0.00 C ATOM 1414 CD ARG A 94 14.296 11.529 -2.608 1.00 0.00 C ATOM 1415 NE ARG A 94 13.815 11.353 -3.976 1.00 0.00 N ATOM 1416 CZ ARG A 94 14.563 11.572 -5.052 1.00 0.00 C ATOM 1417 NH1 ARG A 94 15.820 11.972 -4.919 1.00 0.00 N ATOM 1418 NH2 ARG A 94 14.054 11.390 -6.264 1.00 0.00 N ATOM 0 H ARG A 94 10.464 11.280 -1.542 1.00 0.00 H new ATOM 0 HA ARG A 94 11.631 13.236 0.309 1.00 0.00 H new ATOM 0 HB2 ARG A 94 12.076 13.095 -2.675 1.00 0.00 H new ATOM 0 HB3 ARG A 94 13.145 13.721 -1.436 1.00 0.00 H new ATOM 0 HG2 ARG A 94 13.542 11.423 -0.601 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.447 10.784 -1.811 1.00 0.00 H new ATOM 0 HD2 ARG A 94 14.882 12.446 -2.545 1.00 0.00 H new ATOM 0 HD3 ARG A 94 14.963 10.707 -2.350 1.00 0.00 H new ATOM 0 HE ARG A 94 12.852 11.045 -4.113 1.00 0.00 H new ATOM 0 HH11 ARG A 94 16.215 12.112 -3.989 1.00 0.00 H new ATOM 0 HH12 ARG A 94 16.392 12.139 -5.747 1.00 0.00 H new ATOM 0 HH21 ARG A 94 13.088 11.082 -6.370 1.00 0.00 H new ATOM 0 HH22 ARG A 94 14.629 11.558 -7.089 1.00 0.00 H new ATOM 1432 N ASP A 95 10.446 15.298 -0.426 1.00 0.00 N ATOM 1433 CA ASP A 95 9.624 16.463 -0.729 1.00 0.00 C ATOM 1434 C ASP A 95 10.444 17.537 -1.436 1.00 0.00 C ATOM 1435 O ASP A 95 11.674 17.496 -1.433 1.00 0.00 O ATOM 1436 CB ASP A 95 9.014 17.031 0.554 1.00 0.00 C ATOM 1437 CG ASP A 95 8.586 18.478 0.400 1.00 0.00 C ATOM 1438 OD1 ASP A 95 9.474 19.351 0.299 1.00 0.00 O ATOM 1439 OD2 ASP A 95 7.365 18.737 0.382 1.00 0.00 O ATOM 0 H ASP A 95 11.100 15.432 0.345 1.00 0.00 H new ATOM 0 HA ASP A 95 8.821 16.147 -1.395 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.152 16.429 0.841 1.00 0.00 H new ATOM 0 HB3 ASP A 95 9.740 16.954 1.363 1.00 0.00 H new ATOM 1444 N ARG A 96 9.754 18.498 -2.042 1.00 0.00 N ATOM 1445 CA ARG A 96 10.418 19.582 -2.756 1.00 0.00 C ATOM 1446 C ARG A 96 11.097 20.539 -1.781 1.00 0.00 C ATOM 1447 O ARG A 96 10.544 21.581 -1.431 1.00 0.00 O ATOM 1448 CB ARG A 96 9.412 20.345 -3.619 1.00 0.00 C ATOM 1449 CG ARG A 96 8.779 19.497 -4.710 1.00 0.00 C ATOM 1450 CD ARG A 96 7.508 20.138 -5.246 1.00 0.00 C ATOM 1451 NE ARG A 96 6.415 20.078 -4.279 1.00 0.00 N ATOM 1452 CZ ARG A 96 5.349 20.870 -4.325 1.00 0.00 C ATOM 1453 NH1 ARG A 96 5.234 21.777 -5.286 1.00 0.00 N ATOM 1454 NH2 ARG A 96 4.396 20.756 -3.409 1.00 0.00 N ATOM 0 H ARG A 96 8.735 18.548 -2.053 1.00 0.00 H new ATOM 0 HA ARG A 96 11.181 19.145 -3.400 1.00 0.00 H new ATOM 0 HB2 ARG A 96 8.626 20.744 -2.978 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.913 21.198 -4.078 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.490 19.360 -5.525 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.550 18.507 -4.316 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.707 21.178 -5.504 1.00 0.00 H new ATOM 0 HD3 ARG A 96 7.207 19.634 -6.165 1.00 0.00 H new ATOM 0 HE ARG A 96 6.473 19.391 -3.528 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.965 21.868 -5.992 1.00 0.00 H new ATOM 0 HH12 ARG A 96 4.415 22.384 -5.319 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.481 20.060 -2.668 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.578 21.365 -3.445 1.00 0.00 H new ATOM 1468 N GLY A 97 12.300 20.177 -1.344 1.00 0.00 N ATOM 1469 CA GLY A 97 13.034 21.014 -0.413 1.00 0.00 C ATOM 1470 C GLY A 97 14.422 20.478 -0.123 1.00 0.00 C ATOM 1471 O GLY A 97 14.750 19.352 -0.496 1.00 0.00 O ATOM 0 H GLY A 97 12.779 19.319 -1.618 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.115 22.022 -0.821 1.00 0.00 H new ATOM 0 HA3 GLY A 97 12.475 21.091 0.520 1.00 0.00 H new ATOM 1475 N GLN A 98 15.240 21.287 0.544 1.00 0.00 N ATOM 1476 CA GLN A 98 16.601 20.887 0.882 1.00 0.00 C ATOM 1477 C GLN A 98 17.001 21.424 2.252 1.00 0.00 C ATOM 1478 O GLN A 98 17.004 22.630 2.497 1.00 0.00 O ATOM 1479 CB GLN A 98 17.580 21.388 -0.181 1.00 0.00 C ATOM 1480 CG GLN A 98 17.555 22.896 -0.370 1.00 0.00 C ATOM 1481 CD GLN A 98 18.522 23.615 0.550 1.00 0.00 C ATOM 1482 OE1 GLN A 98 18.148 24.561 1.246 1.00 0.00 O ATOM 1483 NE2 GLN A 98 19.773 23.171 0.559 1.00 0.00 N ATOM 0 H GLN A 98 14.984 22.222 0.861 1.00 0.00 H new ATOM 0 HA GLN A 98 16.636 19.798 0.914 1.00 0.00 H new ATOM 0 HB2 GLN A 98 18.589 21.081 0.094 1.00 0.00 H new ATOM 0 HB3 GLN A 98 17.348 20.907 -1.131 1.00 0.00 H new ATOM 0 HG2 GLN A 98 17.800 23.133 -1.405 1.00 0.00 H new ATOM 0 HG3 GLN A 98 16.545 23.264 -0.189 1.00 0.00 H new ATOM 0 HE21 GLN A 98 20.039 22.385 -0.033 1.00 0.00 H new ATOM 0 HE22 GLN A 98 20.468 23.616 1.158 1.00 0.00 H new ATOM 1492 N PRO A 99 17.347 20.508 3.169 1.00 0.00 N ATOM 1493 CA PRO A 99 17.346 19.069 2.889 1.00 0.00 C ATOM 1494 C PRO A 99 15.937 18.511 2.721 1.00 0.00 C ATOM 1495 O PRO A 99 15.011 18.868 3.450 1.00 0.00 O ATOM 1496 CB PRO A 99 18.015 18.467 4.127 1.00 0.00 C ATOM 1497 CG PRO A 99 17.765 19.457 5.212 1.00 0.00 C ATOM 1498 CD PRO A 99 17.764 20.806 4.549 1.00 0.00 C ATOM 0 HA PRO A 99 17.857 18.836 1.955 1.00 0.00 H new ATOM 0 HB2 PRO A 99 17.590 17.494 4.373 1.00 0.00 H new ATOM 0 HB3 PRO A 99 19.083 18.317 3.966 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.812 19.264 5.705 1.00 0.00 H new ATOM 0 HG3 PRO A 99 18.538 19.399 5.979 1.00 0.00 H new ATOM 0 HD2 PRO A 99 17.074 21.493 5.038 1.00 0.00 H new ATOM 0 HD3 PRO A 99 18.750 21.269 4.580 1.00 0.00 H new ATOM 1506 N PRO A 100 15.767 17.615 1.738 1.00 0.00 N ATOM 1507 CA PRO A 100 14.473 16.988 1.452 1.00 0.00 C ATOM 1508 C PRO A 100 14.046 16.016 2.546 1.00 0.00 C ATOM 1509 O PRO A 100 14.637 14.948 2.708 1.00 0.00 O ATOM 1510 CB PRO A 100 14.723 16.241 0.140 1.00 0.00 C ATOM 1511 CG PRO A 100 16.189 15.976 0.128 1.00 0.00 C ATOM 1512 CD PRO A 100 16.826 17.143 0.830 1.00 0.00 C ATOM 0 HA PRO A 100 13.669 17.721 1.394 1.00 0.00 H new ATOM 0 HB2 PRO A 100 14.153 15.313 0.098 1.00 0.00 H new ATOM 0 HB3 PRO A 100 14.422 16.839 -0.720 1.00 0.00 H new ATOM 0 HG2 PRO A 100 16.421 15.040 0.637 1.00 0.00 H new ATOM 0 HG3 PRO A 100 16.561 15.884 -0.893 1.00 0.00 H new ATOM 0 HD2 PRO A 100 17.720 16.844 1.377 1.00 0.00 H new ATOM 0 HD3 PRO A 100 17.128 17.919 0.127 1.00 0.00 H new ATOM 1520 N LYS A 101 13.014 16.391 3.294 1.00 0.00 N ATOM 1521 CA LYS A 101 12.505 15.552 4.373 1.00 0.00 C ATOM 1522 C LYS A 101 12.054 14.195 3.840 1.00 0.00 C ATOM 1523 O LYS A 101 11.155 14.113 3.003 1.00 0.00 O ATOM 1524 CB LYS A 101 11.339 16.246 5.081 1.00 0.00 C ATOM 1525 CG LYS A 101 10.870 15.524 6.331 1.00 0.00 C ATOM 1526 CD LYS A 101 11.739 15.864 7.531 1.00 0.00 C ATOM 1527 CE LYS A 101 10.967 15.729 8.834 1.00 0.00 C ATOM 1528 NZ LYS A 101 11.864 15.416 9.981 1.00 0.00 N ATOM 0 H LYS A 101 12.513 17.271 3.173 1.00 0.00 H new ATOM 0 HA LYS A 101 13.313 15.393 5.087 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.638 17.260 5.348 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.503 16.333 4.387 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.835 15.794 6.542 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.890 14.448 6.160 1.00 0.00 H new ATOM 0 HD2 LYS A 101 12.607 15.205 7.551 1.00 0.00 H new ATOM 0 HD3 LYS A 101 12.114 16.883 7.433 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.430 16.656 9.036 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.219 14.943 8.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 11.299 15.332 10.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 12.358 14.519 9.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.562 16.179 10.094 1.00 0.00 H new ATOM 1542 N THR A 102 12.684 13.132 4.331 1.00 0.00 N ATOM 1543 CA THR A 102 12.347 11.780 3.904 1.00 0.00 C ATOM 1544 C THR A 102 11.598 11.029 4.999 1.00 0.00 C ATOM 1545 O THR A 102 12.105 10.859 6.107 1.00 0.00 O ATOM 1546 CB THR A 102 13.608 10.982 3.521 1.00 0.00 C ATOM 1547 OG1 THR A 102 14.603 11.117 4.542 1.00 0.00 O ATOM 1548 CG2 THR A 102 14.169 11.463 2.191 1.00 0.00 C ATOM 0 H THR A 102 13.430 13.182 5.025 1.00 0.00 H new ATOM 0 HA THR A 102 11.706 11.875 3.028 1.00 0.00 H new ATOM 0 HB THR A 102 13.331 9.932 3.422 1.00 0.00 H new ATOM 0 HG1 THR A 102 14.173 11.102 5.422 1.00 0.00 H new ATOM 0 HG21 THR A 102 15.059 10.885 1.941 1.00 0.00 H new ATOM 0 HG22 THR A 102 13.419 11.331 1.411 1.00 0.00 H new ATOM 0 HG23 THR A 102 14.431 12.518 2.267 1.00 0.00 H new ATOM 1556 N ASP A 103 10.388 10.582 4.681 1.00 0.00 N ATOM 1557 CA ASP A 103 9.568 9.847 5.637 1.00 0.00 C ATOM 1558 C ASP A 103 9.539 8.360 5.298 1.00 0.00 C ATOM 1559 O ASP A 103 9.303 7.977 4.152 1.00 0.00 O ATOM 1560 CB ASP A 103 8.145 10.406 5.657 1.00 0.00 C ATOM 1561 CG ASP A 103 7.227 9.620 6.573 1.00 0.00 C ATOM 1562 OD1 ASP A 103 7.732 9.019 7.544 1.00 0.00 O ATOM 1563 OD2 ASP A 103 6.005 9.606 6.319 1.00 0.00 O ATOM 0 H ASP A 103 9.953 10.716 3.768 1.00 0.00 H new ATOM 0 HA ASP A 103 10.011 9.967 6.626 1.00 0.00 H new ATOM 0 HB2 ASP A 103 8.171 11.447 5.980 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.740 10.396 4.645 1.00 0.00 H new ATOM 1568 N LYS A 104 9.783 7.524 6.302 1.00 0.00 N ATOM 1569 CA LYS A 104 9.785 6.079 6.112 1.00 0.00 C ATOM 1570 C LYS A 104 8.431 5.480 6.478 1.00 0.00 C ATOM 1571 O LYS A 104 7.809 5.882 7.461 1.00 0.00 O ATOM 1572 CB LYS A 104 10.885 5.434 6.958 1.00 0.00 C ATOM 1573 CG LYS A 104 12.211 5.298 6.230 1.00 0.00 C ATOM 1574 CD LYS A 104 13.359 5.068 7.200 1.00 0.00 C ATOM 1575 CE LYS A 104 13.916 6.382 7.726 1.00 0.00 C ATOM 1576 NZ LYS A 104 15.293 6.222 8.271 1.00 0.00 N ATOM 0 H LYS A 104 9.982 7.824 7.256 1.00 0.00 H new ATOM 0 HA LYS A 104 9.979 5.877 5.059 1.00 0.00 H new ATOM 0 HB2 LYS A 104 11.034 6.028 7.859 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.553 4.447 7.279 1.00 0.00 H new ATOM 0 HG2 LYS A 104 12.157 4.468 5.526 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.401 6.199 5.647 1.00 0.00 H new ATOM 0 HD2 LYS A 104 13.015 4.457 8.035 1.00 0.00 H new ATOM 0 HD3 LYS A 104 14.151 4.509 6.702 1.00 0.00 H new ATOM 0 HE2 LYS A 104 13.926 7.119 6.923 1.00 0.00 H new ATOM 0 HE3 LYS A 104 13.260 6.769 8.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 15.637 7.139 8.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.279 5.537 9.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 15.925 5.877 7.521 1.00 0.00 H new ATOM 1590 N ALA A 105 7.981 4.515 5.682 1.00 0.00 N ATOM 1591 CA ALA A 105 6.702 3.859 5.925 1.00 0.00 C ATOM 1592 C ALA A 105 6.795 2.360 5.659 1.00 0.00 C ATOM 1593 O ALA A 105 7.273 1.933 4.608 1.00 0.00 O ATOM 1594 CB ALA A 105 5.616 4.483 5.061 1.00 0.00 C ATOM 0 H ALA A 105 8.483 4.171 4.864 1.00 0.00 H new ATOM 0 HA ALA A 105 6.443 4.001 6.974 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.666 3.983 5.253 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.524 5.542 5.301 1.00 0.00 H new ATOM 0 HB3 ALA A 105 5.879 4.371 4.009 1.00 0.00 H new ATOM 1600 N THR A 106 6.336 1.564 6.620 1.00 0.00 N ATOM 1601 CA THR A 106 6.369 0.113 6.491 1.00 0.00 C ATOM 1602 C THR A 106 5.199 -0.392 5.653 1.00 0.00 C ATOM 1603 O THR A 106 4.052 -0.002 5.873 1.00 0.00 O ATOM 1604 CB THR A 106 6.334 -0.575 7.869 1.00 0.00 C ATOM 1605 OG1 THR A 106 7.264 0.056 8.755 1.00 0.00 O ATOM 1606 CG2 THR A 106 6.667 -2.054 7.744 1.00 0.00 C ATOM 0 H THR A 106 5.937 1.900 7.496 1.00 0.00 H new ATOM 0 HA THR A 106 7.305 -0.138 5.992 1.00 0.00 H new ATOM 0 HB THR A 106 5.326 -0.479 8.273 1.00 0.00 H new ATOM 0 HG1 THR A 106 7.234 -0.386 9.629 1.00 0.00 H new ATOM 0 HG21 THR A 106 6.636 -2.518 8.730 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.939 -2.537 7.092 1.00 0.00 H new ATOM 0 HG23 THR A 106 7.665 -2.168 7.320 1.00 0.00 H new ATOM 1614 N VAL A 107 5.496 -1.261 4.693 1.00 0.00 N ATOM 1615 CA VAL A 107 4.468 -1.821 3.823 1.00 0.00 C ATOM 1616 C VAL A 107 4.290 -3.314 4.074 1.00 0.00 C ATOM 1617 O VAL A 107 4.988 -4.141 3.486 1.00 0.00 O ATOM 1618 CB VAL A 107 4.807 -1.597 2.338 1.00 0.00 C ATOM 1619 CG1 VAL A 107 3.790 -2.293 1.447 1.00 0.00 C ATOM 1620 CG2 VAL A 107 4.873 -0.110 2.025 1.00 0.00 C ATOM 0 H VAL A 107 6.440 -1.593 4.497 1.00 0.00 H new ATOM 0 HA VAL A 107 3.538 -1.303 4.057 1.00 0.00 H new ATOM 0 HB VAL A 107 5.787 -2.031 2.138 1.00 0.00 H new ATOM 0 HG11 VAL A 107 4.046 -2.123 0.401 1.00 0.00 H new ATOM 0 HG12 VAL A 107 3.797 -3.363 1.653 1.00 0.00 H new ATOM 0 HG13 VAL A 107 2.796 -1.892 1.647 1.00 0.00 H new ATOM 0 HG21 VAL A 107 5.114 0.030 0.971 1.00 0.00 H new ATOM 0 HG22 VAL A 107 3.909 0.350 2.241 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.644 0.357 2.638 1.00 0.00 H new ATOM 1630 N VAL A 108 3.350 -3.654 4.949 1.00 0.00 N ATOM 1631 CA VAL A 108 3.078 -5.048 5.277 1.00 0.00 C ATOM 1632 C VAL A 108 2.217 -5.707 4.204 1.00 0.00 C ATOM 1633 O VAL A 108 1.139 -5.214 3.869 1.00 0.00 O ATOM 1634 CB VAL A 108 2.370 -5.177 6.638 1.00 0.00 C ATOM 1635 CG1 VAL A 108 2.131 -6.640 6.980 1.00 0.00 C ATOM 1636 CG2 VAL A 108 3.181 -4.493 7.728 1.00 0.00 C ATOM 0 H VAL A 108 2.763 -2.982 5.444 1.00 0.00 H new ATOM 0 HA VAL A 108 4.042 -5.555 5.328 1.00 0.00 H new ATOM 0 HB VAL A 108 1.402 -4.681 6.572 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.630 -6.711 7.945 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.506 -7.096 6.212 1.00 0.00 H new ATOM 0 HG13 VAL A 108 3.086 -7.163 7.028 1.00 0.00 H new ATOM 0 HG21 VAL A 108 2.665 -4.594 8.683 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.165 -4.958 7.796 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.295 -3.436 7.488 1.00 0.00 H new ATOM 1646 N LEU A 109 2.700 -6.823 3.670 1.00 0.00 N ATOM 1647 CA LEU A 109 1.975 -7.551 2.634 1.00 0.00 C ATOM 1648 C LEU A 109 1.709 -8.990 3.065 1.00 0.00 C ATOM 1649 O LEU A 109 2.588 -9.846 2.981 1.00 0.00 O ATOM 1650 CB LEU A 109 2.765 -7.537 1.325 1.00 0.00 C ATOM 1651 CG LEU A 109 3.007 -6.162 0.702 1.00 0.00 C ATOM 1652 CD1 LEU A 109 3.714 -6.299 -0.638 1.00 0.00 C ATOM 1653 CD2 LEU A 109 1.693 -5.411 0.539 1.00 0.00 C ATOM 0 H LEU A 109 3.590 -7.244 3.937 1.00 0.00 H new ATOM 0 HA LEU A 109 1.017 -7.054 2.478 1.00 0.00 H new ATOM 0 HB2 LEU A 109 3.732 -8.009 1.502 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.237 -8.155 0.599 1.00 0.00 H new ATOM 0 HG LEU A 109 3.649 -5.590 1.372 1.00 0.00 H new ATOM 0 HD11 LEU A 109 3.878 -5.310 -1.066 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.674 -6.795 -0.494 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.098 -6.890 -1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.885 -4.435 0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.026 -5.980 -0.109 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.226 -5.280 1.515 1.00 0.00 H new ATOM 1665 N ASN A 110 0.489 -9.249 3.525 1.00 0.00 N ATOM 1666 CA ASN A 110 0.106 -10.584 3.968 1.00 0.00 C ATOM 1667 C ASN A 110 -0.003 -11.539 2.783 1.00 0.00 C ATOM 1668 O ASN A 110 -0.903 -11.412 1.951 1.00 0.00 O ATOM 1669 CB ASN A 110 -1.225 -10.533 4.720 1.00 0.00 C ATOM 1670 CG ASN A 110 -1.097 -9.865 6.076 1.00 0.00 C ATOM 1671 OD1 ASN A 110 -0.857 -10.526 7.086 1.00 0.00 O ATOM 1672 ND2 ASN A 110 -1.258 -8.547 6.103 1.00 0.00 N ATOM 0 H ASN A 110 -0.251 -8.551 3.601 1.00 0.00 H new ATOM 0 HA ASN A 110 0.881 -10.953 4.640 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -1.958 -9.994 4.120 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -1.604 -11.546 4.851 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -1.184 -8.042 6.986 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -1.456 -8.040 5.241 1.00 0.00 H new ATOM 1679 N ILE A 111 0.917 -12.495 2.713 1.00 0.00 N ATOM 1680 CA ILE A 111 0.923 -13.472 1.632 1.00 0.00 C ATOM 1681 C ILE A 111 -0.290 -14.394 1.717 1.00 0.00 C ATOM 1682 O ILE A 111 -0.297 -15.360 2.480 1.00 0.00 O ATOM 1683 CB ILE A 111 2.204 -14.326 1.651 1.00 0.00 C ATOM 1684 CG1 ILE A 111 3.433 -13.446 1.412 1.00 0.00 C ATOM 1685 CG2 ILE A 111 2.123 -15.427 0.604 1.00 0.00 C ATOM 1686 CD1 ILE A 111 3.392 -12.694 0.100 1.00 0.00 C ATOM 0 H ILE A 111 1.668 -12.614 3.393 1.00 0.00 H new ATOM 0 HA ILE A 111 0.885 -12.910 0.699 1.00 0.00 H new ATOM 0 HB ILE A 111 2.298 -14.791 2.632 1.00 0.00 H new ATOM 0 HG12 ILE A 111 3.522 -12.730 2.229 1.00 0.00 H new ATOM 0 HG13 ILE A 111 4.327 -14.070 1.436 1.00 0.00 H new ATOM 0 HG21 ILE A 111 3.036 -16.022 0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 111 1.267 -16.067 0.815 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.008 -14.982 -0.384 1.00 0.00 H new ATOM 0 HD11 ILE A 111 4.294 -12.091 -0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 111 3.335 -13.404 -0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.517 -12.044 0.080 1.00 0.00 H new ATOM 1698 N LYS A 112 -1.314 -14.089 0.927 1.00 0.00 N ATOM 1699 CA LYS A 112 -2.532 -14.891 0.909 1.00 0.00 C ATOM 1700 C LYS A 112 -2.443 -15.991 -0.143 1.00 0.00 C ATOM 1701 O LYS A 112 -1.561 -15.973 -1.002 1.00 0.00 O ATOM 1702 CB LYS A 112 -3.747 -14.003 0.633 1.00 0.00 C ATOM 1703 CG LYS A 112 -3.896 -12.854 1.616 1.00 0.00 C ATOM 1704 CD LYS A 112 -4.739 -13.252 2.816 1.00 0.00 C ATOM 1705 CE LYS A 112 -6.213 -13.345 2.456 1.00 0.00 C ATOM 1706 NZ LYS A 112 -7.054 -13.674 3.640 1.00 0.00 N ATOM 0 H LYS A 112 -1.325 -13.292 0.291 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.645 -15.357 1.888 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -3.670 -13.599 -0.376 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -4.648 -14.615 0.663 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -2.911 -12.532 1.953 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -4.355 -12.002 1.114 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.396 -14.213 3.200 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.604 -12.523 3.615 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.543 -12.398 2.028 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.352 -14.107 1.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -8.052 -13.728 3.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.757 -14.590 4.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.941 -12.934 4.362 1.00 0.00 H new ATOM 1720 N ASP A 113 -3.363 -16.947 -0.072 1.00 0.00 N ATOM 1721 CA ASP A 113 -3.391 -18.055 -1.020 1.00 0.00 C ATOM 1722 C ASP A 113 -4.623 -17.972 -1.916 1.00 0.00 C ATOM 1723 O ASP A 113 -5.743 -18.221 -1.471 1.00 0.00 O ATOM 1724 CB ASP A 113 -3.374 -19.391 -0.277 1.00 0.00 C ATOM 1725 CG ASP A 113 -4.549 -19.542 0.669 1.00 0.00 C ATOM 1726 OD1 ASP A 113 -4.619 -18.779 1.655 1.00 0.00 O ATOM 1727 OD2 ASP A 113 -5.399 -20.425 0.424 1.00 0.00 O ATOM 0 H ASP A 113 -4.100 -16.977 0.633 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.502 -17.987 -1.647 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -3.387 -20.206 -1.001 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -2.445 -19.479 0.286 1.00 0.00 H new ATOM 1732 N GLU A 114 -4.407 -17.620 -3.179 1.00 0.00 N ATOM 1733 CA GLU A 114 -5.501 -17.503 -4.137 1.00 0.00 C ATOM 1734 C GLU A 114 -6.024 -18.880 -4.536 1.00 0.00 C ATOM 1735 O GLU A 114 -7.231 -19.119 -4.541 1.00 0.00 O ATOM 1736 CB GLU A 114 -5.040 -16.740 -5.381 1.00 0.00 C ATOM 1737 CG GLU A 114 -6.136 -16.542 -6.414 1.00 0.00 C ATOM 1738 CD GLU A 114 -7.402 -15.958 -5.817 1.00 0.00 C ATOM 1739 OE1 GLU A 114 -8.143 -16.707 -5.147 1.00 0.00 O ATOM 1740 OE2 GLU A 114 -7.651 -14.751 -6.020 1.00 0.00 O ATOM 0 H GLU A 114 -3.485 -17.411 -3.563 1.00 0.00 H new ATOM 0 HA GLU A 114 -6.310 -16.950 -3.660 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -4.657 -15.765 -5.078 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -4.212 -17.279 -5.841 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -5.773 -15.882 -7.202 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.367 -17.499 -6.881 1.00 0.00 H new ATOM 1747 N ASN A 115 -5.106 -19.781 -4.869 1.00 0.00 N ATOM 1748 CA ASN A 115 -5.475 -21.134 -5.271 1.00 0.00 C ATOM 1749 C ASN A 115 -6.380 -21.783 -4.229 1.00 0.00 C ATOM 1750 O ASN A 115 -7.500 -22.195 -4.535 1.00 0.00 O ATOM 1751 CB ASN A 115 -4.221 -21.987 -5.475 1.00 0.00 C ATOM 1752 CG ASN A 115 -3.154 -21.705 -4.436 1.00 0.00 C ATOM 1753 OD1 ASN A 115 -3.106 -22.350 -3.388 1.00 0.00 O ATOM 1754 ND2 ASN A 115 -2.291 -20.736 -4.721 1.00 0.00 N ATOM 0 H ASN A 115 -4.102 -19.600 -4.869 1.00 0.00 H new ATOM 0 HA ASN A 115 -6.021 -21.071 -6.212 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -4.492 -23.042 -5.436 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.815 -21.799 -6.469 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -1.551 -20.501 -4.059 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -2.368 -20.227 -5.602 1.00 0.00 H new ATOM 1761 N ASP A 116 -5.889 -21.871 -2.998 1.00 0.00 N ATOM 1762 CA ASP A 116 -6.654 -22.468 -1.910 1.00 0.00 C ATOM 1763 C ASP A 116 -7.305 -23.773 -2.356 1.00 0.00 C ATOM 1764 O ASP A 116 -8.450 -24.057 -2.009 1.00 0.00 O ATOM 1765 CB ASP A 116 -7.723 -21.493 -1.415 1.00 0.00 C ATOM 1766 CG ASP A 116 -8.530 -22.056 -0.260 1.00 0.00 C ATOM 1767 OD1 ASP A 116 -7.947 -22.782 0.573 1.00 0.00 O ATOM 1768 OD2 ASP A 116 -9.743 -21.770 -0.190 1.00 0.00 O ATOM 0 H ASP A 116 -4.964 -21.536 -2.729 1.00 0.00 H new ATOM 0 HA ASP A 116 -5.967 -22.687 -1.093 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.247 -20.564 -1.103 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -8.394 -21.246 -2.237 1.00 0.00 H new ATOM 1773 N ASN A 117 -6.566 -24.563 -3.128 1.00 0.00 N ATOM 1774 CA ASN A 117 -7.073 -25.838 -3.624 1.00 0.00 C ATOM 1775 C ASN A 117 -7.577 -26.707 -2.475 1.00 0.00 C ATOM 1776 O ASN A 117 -6.794 -27.362 -1.788 1.00 0.00 O ATOM 1777 CB ASN A 117 -5.979 -26.579 -4.396 1.00 0.00 C ATOM 1778 CG ASN A 117 -6.439 -27.938 -4.888 1.00 0.00 C ATOM 1779 OD1 ASN A 117 -6.381 -28.928 -4.157 1.00 0.00 O ATOM 1780 ND2 ASN A 117 -6.899 -27.992 -6.132 1.00 0.00 N ATOM 0 H ASN A 117 -5.615 -24.343 -3.424 1.00 0.00 H new ATOM 0 HA ASN A 117 -7.908 -25.633 -4.295 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -5.665 -25.974 -5.247 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -5.106 -26.704 -3.755 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -7.223 -28.879 -6.518 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -6.929 -27.147 -6.702 1.00 0.00 H new ATOM 1787 N VAL A 118 -8.891 -26.706 -2.273 1.00 0.00 N ATOM 1788 CA VAL A 118 -9.501 -27.495 -1.210 1.00 0.00 C ATOM 1789 C VAL A 118 -9.680 -28.948 -1.636 1.00 0.00 C ATOM 1790 O VAL A 118 -10.336 -29.252 -2.633 1.00 0.00 O ATOM 1791 CB VAL A 118 -10.870 -26.920 -0.799 1.00 0.00 C ATOM 1792 CG1 VAL A 118 -11.671 -26.519 -2.028 1.00 0.00 C ATOM 1793 CG2 VAL A 118 -11.639 -27.926 0.044 1.00 0.00 C ATOM 0 H VAL A 118 -9.553 -26.168 -2.832 1.00 0.00 H new ATOM 0 HA VAL A 118 -8.825 -27.451 -0.356 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.704 -26.027 -0.196 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -12.635 -26.115 -1.718 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -11.123 -25.761 -2.588 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -11.830 -27.393 -2.660 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -12.603 -27.503 0.325 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -11.797 -28.838 -0.532 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -11.069 -28.159 0.943 1.00 0.00 H new ATOM 1803 N PRO A 119 -9.084 -29.868 -0.864 1.00 0.00 N ATOM 1804 CA PRO A 119 -9.164 -31.306 -1.141 1.00 0.00 C ATOM 1805 C PRO A 119 -10.561 -31.866 -0.900 1.00 0.00 C ATOM 1806 O PRO A 119 -11.411 -31.204 -0.304 1.00 0.00 O ATOM 1807 CB PRO A 119 -8.166 -31.914 -0.153 1.00 0.00 C ATOM 1808 CG PRO A 119 -8.093 -30.931 0.965 1.00 0.00 C ATOM 1809 CD PRO A 119 -8.286 -29.578 0.339 1.00 0.00 C ATOM 0 HA PRO A 119 -8.944 -31.533 -2.184 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -8.502 -32.890 0.199 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -7.190 -32.060 -0.616 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -8.863 -31.130 1.710 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -7.132 -30.991 1.476 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -8.806 -28.895 1.011 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -7.333 -29.113 0.086 1.00 0.00 H new TER 1817 PRO A 119