USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 949 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 GLN : amide:sc= -0.0553 X(o=-0.055,f=-0.11) USER MOD Set 1.2: A 93 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0233) USER MOD Set 2.1: A 3 THR OG1 : rot 40:sc= 0.16 USER MOD Set 2.2: A 34 SER OG : rot 180:sc= -0.892 USER MOD Set 3.1: A 31 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 94 THR OG1 : rot 74:sc= -0.199 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 94:sc= -0.24 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= 0.295 X(o=0.29,f=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.418 USER MOD Single : A 30 LYS NZ :NH3+ 170:sc= -0.166 (180deg=-0.295) USER MOD Single : A 35 THR OG1 : rot -115:sc= 0.917 USER MOD Single : A 41 GLN : amide:sc= -0.352 X(o=-0.35,f=0) USER MOD Single : A 45 TYR OH : rot 130:sc= 0.182 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 HIS : no HD1:sc= -0.143 X(o=-0.14,f=-0.39) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.327 X(o=-0.33,f=-0.1) USER MOD Single : A 52 CYS SG : rot -28:sc= -1.6 USER MOD Single : A 53 THR OG1 : rot 127:sc= 1.18 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.219 USER MOD Single : A 74 SER OG : rot -28:sc= 0.514 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -99:sc= -2.21 USER MOD Single : A 85 ASN : amide:sc= -0.0964 X(o=-0.096,f=-0.027) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0556 USER MOD Single : A 98 LYS NZ :NH3+ 160:sc= 0.66 (180deg=0.529) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0378) USER MOD Single : A 115 SER OG : rot 55:sc= 0.425 USER MOD Single : A 118 LYS NZ :NH3+ -156:sc= 1.15 (180deg=0.455) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.00063) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 13 N THR A 3 -4.675 -17.709 -11.188 1.00 0.00 N ATOM 14 CA THR A 3 -4.744 -16.697 -10.139 1.00 0.00 C ATOM 15 C THR A 3 -5.819 -15.665 -10.462 1.00 0.00 C ATOM 16 O THR A 3 -5.608 -14.771 -11.283 1.00 0.00 O ATOM 17 CB THR A 3 -3.387 -16.010 -9.971 1.00 0.00 C ATOM 18 OG1 THR A 3 -2.357 -16.967 -9.795 1.00 0.00 O ATOM 19 CG2 THR A 3 -3.336 -15.058 -8.795 1.00 0.00 C ATOM 0 HA THR A 3 -5.005 -17.190 -9.203 1.00 0.00 H new ATOM 0 HB THR A 3 -3.241 -15.437 -10.886 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.512 -17.728 -10.392 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.346 -14.606 -8.735 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.084 -14.276 -8.927 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.541 -15.605 -7.875 1.00 0.00 H new ATOM 27 N LYS A 4 -6.975 -15.802 -9.818 1.00 0.00 N ATOM 28 CA LYS A 4 -8.088 -14.885 -10.039 1.00 0.00 C ATOM 29 C LYS A 4 -8.099 -13.768 -8.998 1.00 0.00 C ATOM 30 O LYS A 4 -7.365 -13.817 -8.010 1.00 0.00 O ATOM 31 CB LYS A 4 -9.418 -15.646 -10.004 1.00 0.00 C ATOM 32 CG LYS A 4 -9.600 -16.604 -11.171 1.00 0.00 C ATOM 33 CD LYS A 4 -10.836 -17.473 -10.997 1.00 0.00 C ATOM 34 CE LYS A 4 -10.594 -18.888 -11.499 1.00 0.00 C ATOM 35 NZ LYS A 4 -10.427 -19.859 -10.380 1.00 0.00 N ATOM 0 H LYS A 4 -7.165 -16.539 -9.139 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.959 -14.433 -11.022 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -9.483 -16.206 -9.071 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -10.238 -14.928 -10.002 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.681 -16.037 -12.098 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.719 -17.239 -11.262 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -11.117 -17.502 -9.944 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -11.673 -17.031 -11.538 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -11.430 -19.198 -12.126 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.703 -18.902 -12.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.264 -20.810 -10.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.613 -19.579 -9.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.287 -19.866 -9.795 1.00 0.00 H new ATOM 49 N ILE A 5 -8.940 -12.764 -9.229 1.00 0.00 N ATOM 50 CA ILE A 5 -9.060 -11.634 -8.315 1.00 0.00 C ATOM 51 C ILE A 5 -10.524 -11.384 -7.960 1.00 0.00 C ATOM 52 O ILE A 5 -11.365 -11.210 -8.845 1.00 0.00 O ATOM 53 CB ILE A 5 -8.443 -10.349 -8.917 1.00 0.00 C ATOM 54 CG1 ILE A 5 -8.540 -9.188 -7.924 1.00 0.00 C ATOM 55 CG2 ILE A 5 -9.123 -9.985 -10.231 1.00 0.00 C ATOM 56 CD1 ILE A 5 -7.357 -8.244 -7.978 1.00 0.00 C ATOM 0 H ILE A 5 -9.550 -12.711 -10.045 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.508 -11.887 -7.410 1.00 0.00 H new ATOM 0 HB ILE A 5 -7.390 -10.542 -9.120 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.452 -8.626 -8.123 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.627 -9.590 -6.915 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.672 -9.078 -10.635 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.999 -10.801 -10.943 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -10.185 -9.815 -10.056 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.494 -7.447 -7.248 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.443 -8.792 -7.749 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.281 -7.813 -8.976 1.00 0.00 H new ATOM 68 N ASP A 6 -10.823 -11.373 -6.663 1.00 0.00 N ATOM 69 CA ASP A 6 -12.188 -11.149 -6.199 1.00 0.00 C ATOM 70 C ASP A 6 -12.573 -9.682 -6.350 1.00 0.00 C ATOM 71 O ASP A 6 -12.116 -8.827 -5.589 1.00 0.00 O ATOM 72 CB ASP A 6 -12.348 -11.585 -4.738 1.00 0.00 C ATOM 73 CG ASP A 6 -12.465 -13.090 -4.588 1.00 0.00 C ATOM 74 OD1 ASP A 6 -13.243 -13.708 -5.348 1.00 0.00 O ATOM 75 OD2 ASP A 6 -11.781 -13.651 -3.709 1.00 0.00 O ATOM 0 H ASP A 6 -10.141 -11.516 -5.918 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.854 -11.753 -6.816 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.493 -11.231 -4.161 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -13.235 -11.111 -4.316 1.00 0.00 H new ATOM 80 N LYS A 7 -13.416 -9.399 -7.342 1.00 0.00 N ATOM 81 CA LYS A 7 -13.870 -8.035 -7.602 1.00 0.00 C ATOM 82 C LYS A 7 -14.759 -7.536 -6.468 1.00 0.00 C ATOM 83 O LYS A 7 -14.678 -6.375 -6.072 1.00 0.00 O ATOM 84 CB LYS A 7 -14.632 -7.968 -8.928 1.00 0.00 C ATOM 85 CG LYS A 7 -13.738 -7.740 -10.139 1.00 0.00 C ATOM 86 CD LYS A 7 -13.903 -8.849 -11.169 1.00 0.00 C ATOM 87 CE LYS A 7 -12.629 -9.058 -11.976 1.00 0.00 C ATOM 88 NZ LYS A 7 -12.454 -8.012 -13.025 1.00 0.00 N ATOM 0 H LYS A 7 -13.798 -10.098 -7.979 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.991 -7.393 -7.665 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -15.185 -8.897 -9.066 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -15.367 -7.165 -8.874 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.979 -6.780 -10.595 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.697 -7.690 -9.820 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.172 -9.777 -10.665 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.724 -8.602 -11.842 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.769 -9.047 -11.306 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -12.654 -10.041 -12.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.575 -8.192 -13.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -13.261 -8.039 -13.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -12.404 -7.075 -12.576 1.00 0.00 H new ATOM 102 N GLU A 8 -15.605 -8.427 -5.949 1.00 0.00 N ATOM 103 CA GLU A 8 -16.512 -8.087 -4.856 1.00 0.00 C ATOM 104 C GLU A 8 -15.739 -7.562 -3.648 1.00 0.00 C ATOM 105 O GLU A 8 -16.039 -6.485 -3.130 1.00 0.00 O ATOM 106 CB GLU A 8 -17.337 -9.315 -4.455 1.00 0.00 C ATOM 107 CG GLU A 8 -18.832 -9.135 -4.656 1.00 0.00 C ATOM 108 CD GLU A 8 -19.548 -8.746 -3.378 1.00 0.00 C ATOM 109 OE1 GLU A 8 -19.638 -9.593 -2.465 1.00 0.00 O ATOM 110 OE2 GLU A 8 -20.017 -7.592 -3.289 1.00 0.00 O ATOM 0 H GLU A 8 -15.680 -9.392 -6.270 1.00 0.00 H new ATOM 0 HA GLU A 8 -17.183 -7.301 -5.202 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -17.001 -10.174 -5.037 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.145 -9.545 -3.407 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -19.004 -8.369 -5.412 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -19.258 -10.062 -5.039 1.00 0.00 H new ATOM 117 N ALA A 9 -14.741 -8.330 -3.208 1.00 0.00 N ATOM 118 CA ALA A 9 -13.919 -7.948 -2.063 1.00 0.00 C ATOM 119 C ALA A 9 -13.076 -6.714 -2.373 1.00 0.00 C ATOM 120 O ALA A 9 -13.109 -5.731 -1.631 1.00 0.00 O ATOM 121 CB ALA A 9 -13.032 -9.112 -1.640 1.00 0.00 C ATOM 0 H ALA A 9 -14.483 -9.222 -3.630 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.584 -7.695 -1.237 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.424 -8.814 -0.786 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.655 -9.963 -1.363 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.381 -9.393 -2.468 1.00 0.00 H new ATOM 127 N CYS A 10 -12.325 -6.770 -3.474 1.00 0.00 N ATOM 128 CA CYS A 10 -11.474 -5.656 -3.886 1.00 0.00 C ATOM 129 C CYS A 10 -12.269 -4.352 -3.970 1.00 0.00 C ATOM 130 O CYS A 10 -11.833 -3.319 -3.457 1.00 0.00 O ATOM 131 CB CYS A 10 -10.827 -5.964 -5.237 1.00 0.00 C ATOM 132 SG CYS A 10 -9.287 -6.903 -5.117 1.00 0.00 S ATOM 0 H CYS A 10 -12.290 -7.577 -4.097 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.696 -5.528 -3.134 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -11.535 -6.523 -5.848 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.629 -5.026 -5.756 1.00 0.00 H new ATOM 0 HG CYS A 10 -9.543 -8.172 -5.233 1.00 0.00 H new ATOM 138 N ARG A 11 -13.439 -4.408 -4.610 1.00 0.00 N ATOM 139 CA ARG A 11 -14.296 -3.230 -4.751 1.00 0.00 C ATOM 140 C ARG A 11 -14.805 -2.766 -3.388 1.00 0.00 C ATOM 141 O ARG A 11 -14.835 -1.566 -3.107 1.00 0.00 O ATOM 142 CB ARG A 11 -15.477 -3.526 -5.680 1.00 0.00 C ATOM 143 CG ARG A 11 -16.109 -2.279 -6.281 1.00 0.00 C ATOM 144 CD ARG A 11 -17.516 -2.553 -6.796 1.00 0.00 C ATOM 145 NE ARG A 11 -17.696 -2.094 -8.174 1.00 0.00 N ATOM 146 CZ ARG A 11 -17.749 -0.810 -8.539 1.00 0.00 C ATOM 147 NH1 ARG A 11 -17.654 0.156 -7.629 1.00 0.00 N ATOM 148 NH2 ARG A 11 -17.900 -0.492 -9.820 1.00 0.00 N ATOM 0 H ARG A 11 -13.814 -5.255 -5.038 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.699 -2.431 -5.191 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.139 -4.176 -6.487 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.236 -4.076 -5.124 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -16.144 -1.490 -5.529 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -15.487 -1.914 -7.098 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.720 -3.622 -6.741 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -18.241 -2.056 -6.151 1.00 0.00 H new ATOM 0 HE ARG A 11 -17.787 -2.801 -8.904 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -17.540 -0.081 -6.644 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -17.695 1.134 -7.917 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -17.975 -1.228 -10.523 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -17.941 0.488 -10.101 1.00 0.00 H new ATOM 162 N ALA A 12 -15.192 -3.725 -2.541 1.00 0.00 N ATOM 163 CA ALA A 12 -15.685 -3.413 -1.202 1.00 0.00 C ATOM 164 C ALA A 12 -14.669 -2.570 -0.437 1.00 0.00 C ATOM 165 O ALA A 12 -15.025 -1.568 0.186 1.00 0.00 O ATOM 166 CB ALA A 12 -15.997 -4.693 -0.438 1.00 0.00 C ATOM 0 H ALA A 12 -15.172 -4.721 -2.761 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.604 -2.836 -1.301 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.363 -4.442 0.558 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.759 -5.259 -0.973 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.092 -5.295 -0.351 1.00 0.00 H new ATOM 172 N ALA A 13 -13.397 -2.975 -0.506 1.00 0.00 N ATOM 173 CA ALA A 13 -12.323 -2.248 0.163 1.00 0.00 C ATOM 174 C ALA A 13 -12.213 -0.825 -0.379 1.00 0.00 C ATOM 175 O ALA A 13 -12.056 0.125 0.386 1.00 0.00 O ATOM 176 CB ALA A 13 -10.999 -2.980 -0.002 1.00 0.00 C ATOM 0 H ALA A 13 -13.090 -3.802 -1.019 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.560 -2.194 1.225 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.210 -2.423 0.503 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.077 -3.976 0.434 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.761 -3.066 -1.062 1.00 0.00 H new ATOM 182 N TYR A 14 -12.311 -0.690 -1.706 1.00 0.00 N ATOM 183 CA TYR A 14 -12.234 0.617 -2.359 1.00 0.00 C ATOM 184 C TYR A 14 -13.334 1.548 -1.851 1.00 0.00 C ATOM 185 O TYR A 14 -13.092 2.730 -1.603 1.00 0.00 O ATOM 186 CB TYR A 14 -12.345 0.461 -3.879 1.00 0.00 C ATOM 187 CG TYR A 14 -11.763 1.623 -4.655 1.00 0.00 C ATOM 188 CD1 TYR A 14 -12.382 2.867 -4.651 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.595 1.475 -5.394 1.00 0.00 C ATOM 190 CE1 TYR A 14 -11.853 3.929 -5.357 1.00 0.00 C ATOM 191 CE2 TYR A 14 -10.060 2.532 -6.102 1.00 0.00 C ATOM 192 CZ TYR A 14 -10.694 3.757 -6.083 1.00 0.00 C ATOM 193 OH TYR A 14 -10.164 4.812 -6.790 1.00 0.00 O ATOM 0 H TYR A 14 -12.444 -1.472 -2.347 1.00 0.00 H new ATOM 0 HA TYR A 14 -11.268 1.058 -2.115 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.837 -0.455 -4.179 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.395 0.346 -4.148 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -13.292 3.005 -4.086 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -10.098 0.517 -5.414 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -12.345 4.890 -5.341 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.150 2.401 -6.668 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.346 4.523 -7.245 1.00 0.00 H new ATOM 203 N ASN A 15 -14.543 1.006 -1.697 1.00 0.00 N ATOM 204 CA ASN A 15 -15.680 1.787 -1.217 1.00 0.00 C ATOM 205 C ASN A 15 -15.475 2.221 0.236 1.00 0.00 C ATOM 206 O ASN A 15 -15.787 3.356 0.601 1.00 0.00 O ATOM 207 CB ASN A 15 -16.971 0.973 -1.336 1.00 0.00 C ATOM 208 CG ASN A 15 -17.573 1.030 -2.728 1.00 0.00 C ATOM 209 OD1 ASN A 15 -18.232 2.004 -3.090 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.347 -0.014 -3.518 1.00 0.00 N ATOM 0 H ASN A 15 -14.758 0.029 -1.898 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.759 2.680 -1.837 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -16.766 -0.065 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.698 1.345 -0.615 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.726 -0.028 -4.465 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.795 -0.801 -3.177 1.00 0.00 H new ATOM 217 N LEU A 16 -14.953 1.307 1.058 1.00 0.00 N ATOM 218 CA LEU A 16 -14.711 1.586 2.473 1.00 0.00 C ATOM 219 C LEU A 16 -13.544 2.554 2.665 1.00 0.00 C ATOM 220 O LEU A 16 -13.657 3.530 3.409 1.00 0.00 O ATOM 221 CB LEU A 16 -14.441 0.283 3.229 1.00 0.00 C ATOM 222 CG LEU A 16 -14.864 0.286 4.699 1.00 0.00 C ATOM 223 CD1 LEU A 16 -16.380 0.344 4.823 1.00 0.00 C ATOM 224 CD2 LEU A 16 -14.317 -0.942 5.409 1.00 0.00 C ATOM 0 H LEU A 16 -14.690 0.366 0.766 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.607 2.059 2.875 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.960 -0.529 2.719 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.375 0.064 3.174 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.450 1.175 5.174 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -16.659 0.345 5.877 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.749 1.253 4.349 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -16.819 -0.525 4.332 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -14.626 -0.926 6.454 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.704 -1.842 4.930 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -13.228 -0.940 5.353 1.00 0.00 H new ATOM 236 N VAL A 17 -12.423 2.282 1.992 1.00 0.00 N ATOM 237 CA VAL A 17 -11.238 3.135 2.094 1.00 0.00 C ATOM 238 C VAL A 17 -11.526 4.552 1.588 1.00 0.00 C ATOM 239 O VAL A 17 -10.925 5.519 2.060 1.00 0.00 O ATOM 240 CB VAL A 17 -10.035 2.537 1.326 1.00 0.00 C ATOM 241 CG1 VAL A 17 -10.274 2.565 -0.178 1.00 0.00 C ATOM 242 CG2 VAL A 17 -8.749 3.272 1.682 1.00 0.00 C ATOM 0 H VAL A 17 -12.312 1.480 1.372 1.00 0.00 H new ATOM 0 HA VAL A 17 -10.978 3.187 3.151 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.929 1.495 1.628 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.412 2.139 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -11.163 1.982 -0.416 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -10.418 3.595 -0.504 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -7.916 2.835 1.131 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -8.847 4.325 1.418 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -8.563 3.182 2.752 1.00 0.00 H new ATOM 252 N ARG A 18 -12.458 4.672 0.634 1.00 0.00 N ATOM 253 CA ARG A 18 -12.830 5.975 0.082 1.00 0.00 C ATOM 254 C ARG A 18 -13.396 6.882 1.173 1.00 0.00 C ATOM 255 O ARG A 18 -13.188 8.098 1.150 1.00 0.00 O ATOM 256 CB ARG A 18 -13.853 5.808 -1.046 1.00 0.00 C ATOM 257 CG ARG A 18 -13.232 5.805 -2.433 1.00 0.00 C ATOM 258 CD ARG A 18 -14.266 6.107 -3.509 1.00 0.00 C ATOM 259 NE ARG A 18 -14.161 7.479 -4.006 1.00 0.00 N ATOM 260 CZ ARG A 18 -15.135 8.114 -4.665 1.00 0.00 C ATOM 261 NH1 ARG A 18 -16.297 7.510 -4.903 1.00 0.00 N ATOM 262 NH2 ARG A 18 -14.947 9.360 -5.083 1.00 0.00 N ATOM 0 H ARG A 18 -12.965 3.884 0.231 1.00 0.00 H new ATOM 0 HA ARG A 18 -11.932 6.440 -0.325 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.396 4.875 -0.898 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -14.583 6.615 -0.986 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.433 6.546 -2.477 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -12.777 4.834 -2.627 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -14.139 5.411 -4.338 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -15.266 5.944 -3.106 1.00 0.00 H new ATOM 0 HE ARG A 18 -13.290 7.983 -3.839 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -16.450 6.554 -4.582 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -17.034 8.003 -5.407 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -14.061 9.831 -4.901 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -15.689 9.847 -5.586 1.00 0.00 H new ATOM 276 N ASP A 19 -14.103 6.279 2.134 1.00 0.00 N ATOM 277 CA ASP A 19 -14.688 7.024 3.242 1.00 0.00 C ATOM 278 C ASP A 19 -13.597 7.521 4.187 1.00 0.00 C ATOM 279 O ASP A 19 -13.088 6.762 5.017 1.00 0.00 O ATOM 280 CB ASP A 19 -15.689 6.154 4.010 1.00 0.00 C ATOM 281 CG ASP A 19 -16.644 6.977 4.852 1.00 0.00 C ATOM 282 OD1 ASP A 19 -16.222 7.472 5.919 1.00 0.00 O ATOM 283 OD2 ASP A 19 -17.815 7.130 4.443 1.00 0.00 O ATOM 0 H ASP A 19 -14.282 5.275 2.163 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.217 7.884 2.831 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.259 5.551 3.303 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.146 5.462 4.653 1.00 0.00 H new ATOM 318 N ALA A 23 -12.301 5.858 10.710 1.00 0.00 N ATOM 319 CA ALA A 23 -10.911 5.595 11.079 1.00 0.00 C ATOM 320 C ALA A 23 -10.283 4.541 10.165 1.00 0.00 C ATOM 321 O ALA A 23 -9.757 3.529 10.634 1.00 0.00 O ATOM 322 CB ALA A 23 -10.826 5.160 12.538 1.00 0.00 C ATOM 0 HA ALA A 23 -10.347 6.519 10.954 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.786 4.967 12.800 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.221 5.950 13.177 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.411 4.251 12.681 1.00 0.00 H new ATOM 328 N VAL A 24 -10.341 4.790 8.858 1.00 0.00 N ATOM 329 CA VAL A 24 -9.780 3.871 7.872 1.00 0.00 C ATOM 330 C VAL A 24 -8.922 4.626 6.856 1.00 0.00 C ATOM 331 O VAL A 24 -9.445 5.212 5.906 1.00 0.00 O ATOM 332 CB VAL A 24 -10.889 3.091 7.129 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.287 2.027 6.222 1.00 0.00 C ATOM 334 CG2 VAL A 24 -11.866 2.462 8.115 1.00 0.00 C ATOM 0 H VAL A 24 -10.772 5.623 8.457 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.157 3.158 8.413 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.439 3.799 6.509 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.086 1.491 5.710 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.638 2.501 5.486 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.705 1.326 6.820 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.636 1.919 7.568 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.331 1.773 8.768 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.331 3.244 8.716 1.00 0.00 H new ATOM 344 N ILE A 25 -7.604 4.612 7.062 1.00 0.00 N ATOM 345 CA ILE A 25 -6.680 5.302 6.160 1.00 0.00 C ATOM 346 C ILE A 25 -5.937 4.325 5.248 1.00 0.00 C ATOM 347 O ILE A 25 -5.588 4.673 4.119 1.00 0.00 O ATOM 348 CB ILE A 25 -5.649 6.163 6.926 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.793 5.299 7.859 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.347 7.260 7.713 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.305 5.498 7.665 1.00 0.00 C ATOM 0 H ILE A 25 -7.154 4.133 7.842 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.299 5.959 5.549 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.989 6.626 6.192 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.051 5.528 8.893 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.036 4.249 7.695 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.605 7.855 8.245 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.903 7.901 7.029 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.035 6.812 8.430 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -2.759 4.857 8.357 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.034 5.241 6.641 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.049 6.540 7.858 1.00 0.00 H new ATOM 363 N TRP A 26 -5.694 3.108 5.738 1.00 0.00 N ATOM 364 CA TRP A 26 -4.990 2.096 4.954 1.00 0.00 C ATOM 365 C TRP A 26 -5.714 0.752 4.992 1.00 0.00 C ATOM 366 O TRP A 26 -6.488 0.476 5.911 1.00 0.00 O ATOM 367 CB TRP A 26 -3.545 1.934 5.451 1.00 0.00 C ATOM 368 CG TRP A 26 -3.431 1.339 6.827 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.142 2.007 7.983 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.593 -0.040 7.193 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.122 1.133 9.042 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.396 -0.128 8.583 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.891 -1.209 6.482 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.486 -1.333 9.275 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -3.979 -2.405 7.171 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.780 -2.457 8.551 1.00 0.00 C ATOM 0 H TRP A 26 -5.973 2.802 6.670 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.972 2.438 3.919 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.999 1.304 4.748 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.060 2.910 5.448 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.956 3.069 8.054 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -2.934 1.382 10.013 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.049 -1.177 5.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.330 -1.379 10.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.205 -3.313 6.632 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.860 -3.406 9.060 1.00 0.00 H new ATOM 387 N VAL A 27 -5.441 -0.082 3.990 1.00 0.00 N ATOM 388 CA VAL A 27 -6.045 -1.409 3.896 1.00 0.00 C ATOM 389 C VAL A 27 -5.030 -2.421 3.378 1.00 0.00 C ATOM 390 O VAL A 27 -4.133 -2.074 2.604 1.00 0.00 O ATOM 391 CB VAL A 27 -7.306 -1.411 2.998 1.00 0.00 C ATOM 392 CG1 VAL A 27 -7.186 -0.386 1.876 1.00 0.00 C ATOM 393 CG2 VAL A 27 -7.594 -2.797 2.427 1.00 0.00 C ATOM 0 H VAL A 27 -4.801 0.140 3.227 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.356 -1.694 4.901 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.148 -1.131 3.631 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.087 -0.411 1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.066 0.609 2.304 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -6.320 -0.622 1.258 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.487 -2.755 1.803 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.746 -3.126 1.826 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.755 -3.501 3.244 1.00 0.00 H new ATOM 403 N THR A 28 -5.175 -3.668 3.811 1.00 0.00 N ATOM 404 CA THR A 28 -4.260 -4.728 3.387 1.00 0.00 C ATOM 405 C THR A 28 -4.754 -5.393 2.102 1.00 0.00 C ATOM 406 O THR A 28 -5.922 -5.258 1.739 1.00 0.00 O ATOM 407 CB THR A 28 -4.100 -5.770 4.504 1.00 0.00 C ATOM 408 OG1 THR A 28 -3.595 -5.171 5.684 1.00 0.00 O ATOM 409 CG2 THR A 28 -3.174 -6.914 4.144 1.00 0.00 C ATOM 0 H THR A 28 -5.910 -3.971 4.450 1.00 0.00 H new ATOM 0 HA THR A 28 -3.287 -4.280 3.184 1.00 0.00 H new ATOM 0 HB THR A 28 -5.102 -6.172 4.657 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.503 -5.852 6.383 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.111 -7.609 4.982 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.562 -7.435 3.269 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.181 -6.522 3.922 1.00 0.00 H new ATOM 417 N PHE A 29 -3.861 -6.107 1.418 1.00 0.00 N ATOM 418 CA PHE A 29 -4.215 -6.792 0.178 1.00 0.00 C ATOM 419 C PHE A 29 -3.398 -8.073 0.013 1.00 0.00 C ATOM 420 O PHE A 29 -2.260 -8.042 -0.461 1.00 0.00 O ATOM 421 CB PHE A 29 -4.008 -5.868 -1.025 1.00 0.00 C ATOM 422 CG PHE A 29 -5.240 -5.089 -1.396 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.534 -3.891 -0.764 1.00 0.00 C ATOM 424 CD2 PHE A 29 -6.104 -5.559 -2.372 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.667 -3.175 -1.100 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.240 -4.846 -2.713 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.520 -3.653 -2.077 1.00 0.00 C ATOM 0 H PHE A 29 -2.889 -6.225 1.702 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.270 -7.063 0.229 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.199 -5.172 -0.804 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.691 -6.463 -1.881 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.870 -3.513 -0.001 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.889 -6.492 -2.872 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.886 -2.243 -0.600 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.906 -5.222 -3.475 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.405 -3.094 -2.343 1.00 0.00 H new ATOM 437 N LYS A 30 -3.993 -9.195 0.413 1.00 0.00 N ATOM 438 CA LYS A 30 -3.339 -10.499 0.317 1.00 0.00 C ATOM 439 C LYS A 30 -4.196 -11.467 -0.494 1.00 0.00 C ATOM 440 O LYS A 30 -5.421 -11.338 -0.537 1.00 0.00 O ATOM 441 CB LYS A 30 -3.085 -11.077 1.714 1.00 0.00 C ATOM 442 CG LYS A 30 -2.392 -10.115 2.667 1.00 0.00 C ATOM 443 CD LYS A 30 -2.898 -10.286 4.090 1.00 0.00 C ATOM 444 CE LYS A 30 -1.874 -9.808 5.108 1.00 0.00 C ATOM 445 NZ LYS A 30 -0.955 -10.900 5.536 1.00 0.00 N ATOM 0 H LYS A 30 -4.932 -9.227 0.809 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.383 -10.364 -0.188 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.038 -11.380 2.149 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.478 -11.977 1.618 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -1.316 -10.284 2.639 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -2.562 -9.089 2.339 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -3.826 -9.728 4.217 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.130 -11.336 4.271 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.292 -8.992 4.680 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.391 -9.407 5.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -0.175 -10.498 6.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.478 -11.587 6.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.570 -11.378 4.697 1.00 0.00 H new ATOM 459 N TYR A 31 -3.554 -12.440 -1.135 1.00 0.00 N ATOM 460 CA TYR A 31 -4.276 -13.422 -1.937 1.00 0.00 C ATOM 461 C TYR A 31 -4.342 -14.771 -1.224 1.00 0.00 C ATOM 462 O TYR A 31 -3.315 -15.392 -0.947 1.00 0.00 O ATOM 463 CB TYR A 31 -3.641 -13.575 -3.327 1.00 0.00 C ATOM 464 CG TYR A 31 -2.143 -13.793 -3.318 1.00 0.00 C ATOM 465 CD1 TYR A 31 -1.610 -15.073 -3.252 1.00 0.00 C ATOM 466 CD2 TYR A 31 -1.265 -12.719 -3.393 1.00 0.00 C ATOM 467 CE1 TYR A 31 -0.244 -15.278 -3.256 1.00 0.00 C ATOM 468 CE2 TYR A 31 0.103 -12.915 -3.402 1.00 0.00 C ATOM 469 CZ TYR A 31 0.608 -14.196 -3.333 1.00 0.00 C ATOM 470 OH TYR A 31 1.970 -14.397 -3.345 1.00 0.00 O ATOM 0 H TYR A 31 -2.542 -12.569 -1.115 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.295 -13.057 -2.068 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.114 -14.415 -3.837 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.861 -12.682 -3.912 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -2.274 -15.923 -3.197 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -1.658 -11.714 -3.445 1.00 0.00 H new ATOM 0 HE1 TYR A 31 0.155 -16.280 -3.199 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.772 -12.070 -3.463 1.00 0.00 H new ATOM 0 HH TYR A 31 2.428 -13.532 -3.404 1.00 0.00 H new ATOM 480 N ASP A 32 -5.565 -15.210 -0.924 1.00 0.00 N ATOM 481 CA ASP A 32 -5.784 -16.481 -0.241 1.00 0.00 C ATOM 482 C ASP A 32 -5.474 -17.646 -1.173 1.00 0.00 C ATOM 483 O ASP A 32 -6.345 -18.116 -1.913 1.00 0.00 O ATOM 484 CB ASP A 32 -7.227 -16.569 0.269 1.00 0.00 C ATOM 485 CG ASP A 32 -7.426 -15.814 1.570 1.00 0.00 C ATOM 486 OD1 ASP A 32 -7.192 -14.586 1.587 1.00 0.00 O ATOM 487 OD2 ASP A 32 -7.815 -16.449 2.573 1.00 0.00 O ATOM 0 H ASP A 32 -6.420 -14.700 -1.145 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.111 -16.537 0.614 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.902 -16.169 -0.487 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.495 -17.615 0.414 1.00 0.00 H new ATOM 492 N GLY A 33 -4.219 -18.094 -1.147 1.00 0.00 N ATOM 493 CA GLY A 33 -3.794 -19.188 -2.002 1.00 0.00 C ATOM 494 C GLY A 33 -3.544 -18.737 -3.428 1.00 0.00 C ATOM 495 O GLY A 33 -2.443 -18.909 -3.957 1.00 0.00 O ATOM 0 H GLY A 33 -3.487 -17.715 -0.545 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -2.883 -19.630 -1.598 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.556 -19.967 -1.998 1.00 0.00 H new ATOM 499 N SER A 34 -4.569 -18.156 -4.049 1.00 0.00 N ATOM 500 CA SER A 34 -4.467 -17.674 -5.424 1.00 0.00 C ATOM 501 C SER A 34 -5.377 -16.466 -5.673 1.00 0.00 C ATOM 502 O SER A 34 -5.019 -15.565 -6.431 1.00 0.00 O ATOM 503 CB SER A 34 -4.821 -18.796 -6.404 1.00 0.00 C ATOM 504 OG SER A 34 -4.183 -18.607 -7.657 1.00 0.00 O ATOM 0 H SER A 34 -5.482 -18.008 -3.619 1.00 0.00 H new ATOM 0 HA SER A 34 -3.436 -17.358 -5.584 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.523 -19.756 -5.983 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.901 -18.831 -6.545 1.00 0.00 H new ATOM 0 HG SER A 34 -4.426 -19.339 -8.262 1.00 0.00 H new ATOM 510 N THR A 35 -6.554 -16.452 -5.041 1.00 0.00 N ATOM 511 CA THR A 35 -7.498 -15.352 -5.218 1.00 0.00 C ATOM 512 C THR A 35 -7.117 -14.149 -4.358 1.00 0.00 C ATOM 513 O THR A 35 -6.865 -14.282 -3.159 1.00 0.00 O ATOM 514 CB THR A 35 -8.926 -15.812 -4.900 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.870 -14.843 -5.329 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.170 -16.085 -3.427 1.00 0.00 C ATOM 0 H THR A 35 -6.872 -17.185 -4.407 1.00 0.00 H new ATOM 0 HA THR A 35 -7.457 -15.041 -6.262 1.00 0.00 H new ATOM 0 HB THR A 35 -9.049 -16.751 -5.439 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.337 -14.474 -4.550 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.202 -16.406 -3.282 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.495 -16.870 -3.086 1.00 0.00 H new ATOM 0 HG23 THR A 35 -8.989 -15.176 -2.854 1.00 0.00 H new ATOM 524 N ILE A 36 -7.076 -12.976 -4.986 1.00 0.00 N ATOM 525 CA ILE A 36 -6.725 -11.740 -4.291 1.00 0.00 C ATOM 526 C ILE A 36 -7.914 -11.199 -3.497 1.00 0.00 C ATOM 527 O ILE A 36 -9.057 -11.260 -3.955 1.00 0.00 O ATOM 528 CB ILE A 36 -6.233 -10.657 -5.277 1.00 0.00 C ATOM 529 CG1 ILE A 36 -5.172 -11.237 -6.219 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.676 -9.458 -4.522 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.750 -10.288 -7.321 1.00 0.00 C ATOM 0 H ILE A 36 -7.282 -12.856 -5.978 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.915 -11.982 -3.603 1.00 0.00 H new ATOM 0 HB ILE A 36 -7.082 -10.322 -5.873 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.294 -11.515 -5.636 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.559 -12.152 -6.668 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.335 -8.706 -5.234 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -6.455 -9.032 -3.890 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.839 -9.776 -3.901 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.998 -10.768 -7.946 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.616 -10.029 -7.930 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.332 -9.383 -6.881 1.00 0.00 H new ATOM 543 N VAL A 37 -7.636 -10.673 -2.303 1.00 0.00 N ATOM 544 CA VAL A 37 -8.680 -10.125 -1.438 1.00 0.00 C ATOM 545 C VAL A 37 -8.091 -9.141 -0.419 1.00 0.00 C ATOM 546 O VAL A 37 -7.028 -9.391 0.151 1.00 0.00 O ATOM 547 CB VAL A 37 -9.436 -11.254 -0.694 1.00 0.00 C ATOM 548 CG1 VAL A 37 -8.481 -12.079 0.157 1.00 0.00 C ATOM 549 CG2 VAL A 37 -10.568 -10.688 0.156 1.00 0.00 C ATOM 0 H VAL A 37 -6.695 -10.615 -1.913 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.384 -9.591 -2.076 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.875 -11.912 -1.444 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -9.036 -12.865 0.669 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.721 -12.529 -0.482 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -8.001 -11.435 0.894 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -11.082 -11.502 0.667 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -10.159 -9.998 0.894 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.274 -10.159 -0.484 1.00 0.00 H new ATOM 559 N PRO A 38 -8.774 -8.003 -0.176 1.00 0.00 N ATOM 560 CA PRO A 38 -8.309 -6.986 0.781 1.00 0.00 C ATOM 561 C PRO A 38 -8.164 -7.543 2.198 1.00 0.00 C ATOM 562 O PRO A 38 -8.708 -8.602 2.517 1.00 0.00 O ATOM 563 CB PRO A 38 -9.400 -5.910 0.733 1.00 0.00 C ATOM 564 CG PRO A 38 -10.590 -6.587 0.143 1.00 0.00 C ATOM 565 CD PRO A 38 -10.047 -7.614 -0.807 1.00 0.00 C ATOM 0 HA PRO A 38 -7.319 -6.611 0.521 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.619 -5.526 1.729 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.089 -5.060 0.125 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.198 -7.054 0.918 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.229 -5.873 -0.377 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.722 -8.463 -0.913 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.894 -7.202 -1.804 1.00 0.00 H new ATOM 573 N GLY A 39 -7.423 -6.822 3.042 1.00 0.00 N ATOM 574 CA GLY A 39 -7.209 -7.250 4.404 1.00 0.00 C ATOM 575 C GLY A 39 -7.457 -6.144 5.411 1.00 0.00 C ATOM 576 O GLY A 39 -8.265 -5.247 5.174 1.00 0.00 O ATOM 0 H GLY A 39 -6.967 -5.943 2.796 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.867 -8.090 4.624 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.186 -7.610 4.511 1.00 0.00 H new ATOM 580 N GLU A 40 -6.750 -6.221 6.535 1.00 0.00 N ATOM 581 CA GLU A 40 -6.872 -5.256 7.626 1.00 0.00 C ATOM 582 C GLU A 40 -7.046 -3.826 7.123 1.00 0.00 C ATOM 583 O GLU A 40 -6.431 -3.418 6.140 1.00 0.00 O ATOM 584 CB GLU A 40 -5.655 -5.345 8.550 1.00 0.00 C ATOM 585 CG GLU A 40 -6.009 -5.489 10.024 1.00 0.00 C ATOM 586 CD GLU A 40 -5.290 -4.477 10.891 1.00 0.00 C ATOM 587 OE1 GLU A 40 -5.751 -3.319 10.956 1.00 0.00 O ATOM 588 OE2 GLU A 40 -4.262 -4.842 11.501 1.00 0.00 O ATOM 0 H GLU A 40 -6.071 -6.960 6.717 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.773 -5.514 8.183 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.044 -6.195 8.248 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.045 -4.451 8.418 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.085 -5.372 10.150 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.757 -6.495 10.359 1.00 0.00 H new ATOM 595 N GLN A 41 -7.894 -3.079 7.820 1.00 0.00 N ATOM 596 CA GLN A 41 -8.177 -1.685 7.477 1.00 0.00 C ATOM 597 C GLN A 41 -8.268 -0.839 8.746 1.00 0.00 C ATOM 598 O GLN A 41 -9.299 -0.828 9.421 1.00 0.00 O ATOM 599 CB GLN A 41 -9.484 -1.580 6.680 1.00 0.00 C ATOM 600 CG GLN A 41 -9.577 -2.557 5.516 1.00 0.00 C ATOM 601 CD GLN A 41 -10.742 -2.257 4.587 1.00 0.00 C ATOM 602 OE1 GLN A 41 -11.640 -3.081 4.417 1.00 0.00 O ATOM 603 NE2 GLN A 41 -10.733 -1.074 3.978 1.00 0.00 N ATOM 0 H GLN A 41 -8.404 -3.418 8.636 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.362 -1.310 6.858 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.324 -1.752 7.354 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.584 -0.564 6.298 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.648 -2.527 4.947 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.680 -3.570 5.905 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -9.969 -0.419 4.147 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.490 -0.822 3.343 1.00 0.00 H new ATOM 612 N GLY A 42 -7.179 -0.142 9.074 1.00 0.00 N ATOM 613 CA GLY A 42 -7.154 0.683 10.272 1.00 0.00 C ATOM 614 C GLY A 42 -6.599 2.074 10.032 1.00 0.00 C ATOM 615 O GLY A 42 -5.980 2.336 9.000 1.00 0.00 O ATOM 0 H GLY A 42 -6.315 -0.135 8.532 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.166 0.767 10.668 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.553 0.186 11.034 1.00 0.00 H new ATOM 619 N ALA A 43 -6.818 2.961 11.001 1.00 0.00 N ATOM 620 CA ALA A 43 -6.329 4.334 10.916 1.00 0.00 C ATOM 621 C ALA A 43 -4.904 4.438 11.454 1.00 0.00 C ATOM 622 O ALA A 43 -4.173 5.372 11.119 1.00 0.00 O ATOM 623 CB ALA A 43 -7.251 5.274 11.681 1.00 0.00 C ATOM 0 H ALA A 43 -7.333 2.751 11.856 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.321 4.627 9.866 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.873 6.294 11.608 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.253 5.227 11.255 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.288 4.975 12.728 1.00 0.00 H new ATOM 629 N GLU A 44 -4.515 3.473 12.289 1.00 0.00 N ATOM 630 CA GLU A 44 -3.178 3.452 12.872 1.00 0.00 C ATOM 631 C GLU A 44 -2.261 2.529 12.075 1.00 0.00 C ATOM 632 O GLU A 44 -2.603 1.371 11.821 1.00 0.00 O ATOM 633 CB GLU A 44 -3.238 3.008 14.338 1.00 0.00 C ATOM 634 CG GLU A 44 -3.898 1.651 14.548 1.00 0.00 C ATOM 635 CD GLU A 44 -5.246 1.759 15.235 1.00 0.00 C ATOM 636 OE1 GLU A 44 -6.190 2.289 14.610 1.00 0.00 O ATOM 637 OE2 GLU A 44 -5.358 1.316 16.398 1.00 0.00 O ATOM 0 H GLU A 44 -5.110 2.696 12.575 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.771 4.462 12.833 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.225 2.974 14.738 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.782 3.758 14.912 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.024 1.159 13.584 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -3.240 1.019 15.144 1.00 0.00 H new ATOM 644 N TYR A 45 -1.099 3.044 11.674 1.00 0.00 N ATOM 645 CA TYR A 45 -0.144 2.254 10.899 1.00 0.00 C ATOM 646 C TYR A 45 0.567 1.218 11.768 1.00 0.00 C ATOM 647 O TYR A 45 1.103 0.239 11.247 1.00 0.00 O ATOM 648 CB TYR A 45 0.885 3.151 10.218 1.00 0.00 C ATOM 649 CG TYR A 45 1.560 2.489 9.037 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.895 2.336 7.828 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.861 2.015 9.133 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.508 1.731 6.748 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.484 1.411 8.057 1.00 0.00 C ATOM 654 CZ TYR A 45 2.803 1.271 6.866 1.00 0.00 C ATOM 655 OH TYR A 45 3.419 0.673 5.790 1.00 0.00 O ATOM 0 H TYR A 45 -0.798 3.998 11.871 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.714 1.726 10.134 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.396 4.066 9.883 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.643 3.442 10.946 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.119 2.696 7.730 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.396 2.120 10.065 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.976 1.619 5.815 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.498 1.051 8.148 1.00 0.00 H new ATOM 0 HH TYR A 45 4.300 1.079 5.650 1.00 0.00 H new ATOM 665 N GLN A 46 0.565 1.427 13.089 1.00 0.00 N ATOM 666 CA GLN A 46 1.205 0.494 14.014 1.00 0.00 C ATOM 667 C GLN A 46 0.782 -0.940 13.700 1.00 0.00 C ATOM 668 O GLN A 46 1.601 -1.861 13.729 1.00 0.00 O ATOM 669 CB GLN A 46 0.836 0.844 15.456 1.00 0.00 C ATOM 670 CG GLN A 46 1.800 1.817 16.113 1.00 0.00 C ATOM 671 CD GLN A 46 1.366 3.263 15.949 1.00 0.00 C ATOM 672 OE1 GLN A 46 0.729 3.833 16.834 1.00 0.00 O ATOM 673 NE2 GLN A 46 1.706 3.864 14.812 1.00 0.00 N ATOM 0 H GLN A 46 0.128 2.232 13.538 1.00 0.00 H new ATOM 0 HA GLN A 46 2.286 0.575 13.896 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -0.166 1.273 15.472 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.800 -0.072 16.045 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.881 1.583 17.175 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.793 1.687 15.682 1.00 0.00 H new ATOM 0 HE21 GLN A 46 2.235 3.354 14.104 1.00 0.00 H new ATOM 0 HE22 GLN A 46 1.438 4.834 14.648 1.00 0.00 H new ATOM 682 N HIS A 47 -0.505 -1.111 13.388 1.00 0.00 N ATOM 683 CA HIS A 47 -1.053 -2.419 13.051 1.00 0.00 C ATOM 684 C HIS A 47 -0.369 -3.005 11.818 1.00 0.00 C ATOM 685 O HIS A 47 -0.099 -4.205 11.766 1.00 0.00 O ATOM 686 CB HIS A 47 -2.561 -2.312 12.801 1.00 0.00 C ATOM 687 CG HIS A 47 -3.397 -2.600 14.010 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.880 -2.691 15.287 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.727 -2.821 14.129 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.856 -2.957 16.137 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.985 -3.040 15.460 1.00 0.00 N ATOM 0 H HIS A 47 -1.187 -0.353 13.363 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.870 -3.085 13.895 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.790 -1.308 12.443 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.838 -3.004 12.006 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.450 -2.824 13.327 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.748 -3.085 17.204 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.902 -3.235 15.861 1.00 0.00 H new ATOM 700 N PHE A 48 -0.084 -2.152 10.828 1.00 0.00 N ATOM 701 CA PHE A 48 0.574 -2.604 9.608 1.00 0.00 C ATOM 702 C PHE A 48 2.017 -3.005 9.890 1.00 0.00 C ATOM 703 O PHE A 48 2.477 -4.050 9.433 1.00 0.00 O ATOM 704 CB PHE A 48 0.532 -1.512 8.535 1.00 0.00 C ATOM 705 CG PHE A 48 0.643 -2.052 7.140 1.00 0.00 C ATOM 706 CD1 PHE A 48 1.871 -2.436 6.627 1.00 0.00 C ATOM 707 CD2 PHE A 48 -0.482 -2.186 6.344 1.00 0.00 C ATOM 708 CE1 PHE A 48 1.975 -2.943 5.347 1.00 0.00 C ATOM 709 CE2 PHE A 48 -0.385 -2.692 5.063 1.00 0.00 C ATOM 710 CZ PHE A 48 0.846 -3.071 4.564 1.00 0.00 C ATOM 0 H PHE A 48 -0.298 -1.155 10.851 1.00 0.00 H new ATOM 0 HA PHE A 48 0.036 -3.477 9.239 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.400 -0.954 8.629 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.344 -0.807 8.711 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.758 -2.338 7.236 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.447 -1.891 6.730 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.939 -3.239 4.959 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -1.270 -2.791 4.452 1.00 0.00 H new ATOM 0 HZ PHE A 48 0.925 -3.467 3.562 1.00 0.00 H new ATOM 720 N ILE A 49 2.724 -2.171 10.653 1.00 0.00 N ATOM 721 CA ILE A 49 4.118 -2.437 11.007 1.00 0.00 C ATOM 722 C ILE A 49 4.264 -3.784 11.721 1.00 0.00 C ATOM 723 O ILE A 49 5.214 -4.526 11.473 1.00 0.00 O ATOM 724 CB ILE A 49 4.696 -1.322 11.911 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.517 0.052 11.258 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.168 -1.578 12.209 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.546 1.200 12.245 1.00 0.00 C ATOM 0 H ILE A 49 2.352 -1.303 11.039 1.00 0.00 H new ATOM 0 HA ILE A 49 4.678 -2.463 10.072 1.00 0.00 H new ATOM 0 HB ILE A 49 4.146 -1.332 12.852 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.304 0.199 10.519 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.569 0.069 10.721 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.554 -0.782 12.846 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.275 -2.535 12.719 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.730 -1.600 11.275 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.413 2.142 11.712 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.741 1.077 12.970 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.504 1.209 12.765 1.00 0.00 H new ATOM 739 N GLN A 50 3.316 -4.087 12.612 1.00 0.00 N ATOM 740 CA GLN A 50 3.336 -5.338 13.371 1.00 0.00 C ATOM 741 C GLN A 50 3.090 -6.556 12.477 1.00 0.00 C ATOM 742 O GLN A 50 3.714 -7.603 12.662 1.00 0.00 O ATOM 743 CB GLN A 50 2.287 -5.289 14.485 1.00 0.00 C ATOM 744 CG GLN A 50 2.442 -6.387 15.526 1.00 0.00 C ATOM 745 CD GLN A 50 1.608 -6.133 16.767 1.00 0.00 C ATOM 746 OE1 GLN A 50 2.141 -5.982 17.866 1.00 0.00 O ATOM 747 NE2 GLN A 50 0.289 -6.086 16.602 1.00 0.00 N ATOM 0 H GLN A 50 2.524 -3.481 12.825 1.00 0.00 H new ATOM 0 HA GLN A 50 4.330 -5.444 13.805 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.344 -4.320 14.982 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.295 -5.361 14.040 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.153 -7.342 15.087 1.00 0.00 H new ATOM 0 HG3 GLN A 50 3.492 -6.470 15.808 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -0.114 -6.216 15.674 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -0.320 -5.920 17.403 1.00 0.00 H new ATOM 756 N GLN A 51 2.175 -6.421 11.517 1.00 0.00 N ATOM 757 CA GLN A 51 1.849 -7.521 10.609 1.00 0.00 C ATOM 758 C GLN A 51 2.728 -7.513 9.353 1.00 0.00 C ATOM 759 O GLN A 51 2.576 -8.374 8.485 1.00 0.00 O ATOM 760 CB GLN A 51 0.372 -7.453 10.203 1.00 0.00 C ATOM 761 CG GLN A 51 -0.592 -7.444 11.381 1.00 0.00 C ATOM 762 CD GLN A 51 -0.324 -8.565 12.369 1.00 0.00 C ATOM 763 OE1 GLN A 51 -0.671 -9.720 12.123 1.00 0.00 O ATOM 764 NE2 GLN A 51 0.298 -8.231 13.496 1.00 0.00 N ATOM 0 H GLN A 51 1.648 -5.564 11.348 1.00 0.00 H new ATOM 0 HA GLN A 51 2.043 -8.450 11.146 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.210 -6.555 9.607 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.141 -8.305 9.564 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -0.520 -6.486 11.897 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.613 -7.530 11.010 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.569 -7.262 13.661 1.00 0.00 H new ATOM 0 HE22 GLN A 51 0.504 -8.944 14.195 1.00 0.00 H new ATOM 773 N CYS A 52 3.641 -6.543 9.254 1.00 0.00 N ATOM 774 CA CYS A 52 4.522 -6.441 8.094 1.00 0.00 C ATOM 775 C CYS A 52 5.966 -6.789 8.457 1.00 0.00 C ATOM 776 O CYS A 52 6.767 -5.909 8.780 1.00 0.00 O ATOM 777 CB CYS A 52 4.449 -5.032 7.500 1.00 0.00 C ATOM 778 SG CYS A 52 4.975 -4.925 5.775 1.00 0.00 S ATOM 0 H CYS A 52 3.787 -5.822 9.961 1.00 0.00 H new ATOM 0 HA CYS A 52 4.183 -7.161 7.350 1.00 0.00 H new ATOM 0 HB2 CYS A 52 3.424 -4.670 7.578 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.069 -4.365 8.099 1.00 0.00 H new ATOM 0 HG CYS A 52 5.835 -5.867 5.524 1.00 0.00 H new ATOM 784 N THR A 53 6.296 -8.080 8.387 1.00 0.00 N ATOM 785 CA THR A 53 7.648 -8.549 8.691 1.00 0.00 C ATOM 786 C THR A 53 8.448 -8.749 7.400 1.00 0.00 C ATOM 787 O THR A 53 7.918 -8.579 6.302 1.00 0.00 O ATOM 788 CB THR A 53 7.605 -9.859 9.487 1.00 0.00 C ATOM 789 OG1 THR A 53 6.490 -10.646 9.110 1.00 0.00 O ATOM 790 CG2 THR A 53 7.537 -9.651 10.985 1.00 0.00 C ATOM 0 H THR A 53 5.645 -8.819 8.122 1.00 0.00 H new ATOM 0 HA THR A 53 8.140 -7.789 9.299 1.00 0.00 H new ATOM 0 HB THR A 53 8.540 -10.366 9.250 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.792 -11.545 8.864 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.509 -10.619 11.486 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.415 -9.096 11.316 1.00 0.00 H new ATOM 0 HG23 THR A 53 6.637 -9.088 11.234 1.00 0.00 H new ATOM 798 N ASP A 54 9.725 -9.113 7.536 1.00 0.00 N ATOM 799 CA ASP A 54 10.589 -9.333 6.376 1.00 0.00 C ATOM 800 C ASP A 54 10.428 -10.748 5.797 1.00 0.00 C ATOM 801 O ASP A 54 11.302 -11.232 5.074 1.00 0.00 O ATOM 802 CB ASP A 54 12.049 -9.083 6.758 1.00 0.00 C ATOM 803 CG ASP A 54 12.419 -7.613 6.692 1.00 0.00 C ATOM 804 OD1 ASP A 54 12.008 -6.856 7.597 1.00 0.00 O ATOM 805 OD2 ASP A 54 13.117 -7.219 5.735 1.00 0.00 O ATOM 0 H ASP A 54 10.182 -9.261 8.436 1.00 0.00 H new ATOM 0 HA ASP A 54 10.288 -8.628 5.602 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.227 -9.455 7.767 1.00 0.00 H new ATOM 0 HB3 ASP A 54 12.699 -9.649 6.090 1.00 0.00 H new ATOM 810 N ASP A 55 9.311 -11.407 6.119 1.00 0.00 N ATOM 811 CA ASP A 55 9.033 -12.751 5.638 1.00 0.00 C ATOM 812 C ASP A 55 7.607 -12.834 5.109 1.00 0.00 C ATOM 813 O ASP A 55 6.721 -13.375 5.773 1.00 0.00 O ATOM 814 CB ASP A 55 9.228 -13.763 6.770 1.00 0.00 C ATOM 815 CG ASP A 55 9.041 -13.151 8.148 1.00 0.00 C ATOM 816 OD1 ASP A 55 7.877 -12.955 8.557 1.00 0.00 O ATOM 817 OD2 ASP A 55 10.057 -12.864 8.813 1.00 0.00 O ATOM 0 H ASP A 55 8.581 -11.021 6.718 1.00 0.00 H new ATOM 0 HA ASP A 55 9.725 -12.985 4.829 1.00 0.00 H new ATOM 0 HB2 ASP A 55 8.521 -14.583 6.643 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.228 -14.190 6.700 1.00 0.00 H new ATOM 822 N VAL A 56 7.381 -12.283 3.917 1.00 0.00 N ATOM 823 CA VAL A 56 6.045 -12.286 3.324 1.00 0.00 C ATOM 824 C VAL A 56 6.050 -11.706 1.910 1.00 0.00 C ATOM 825 O VAL A 56 7.106 -11.423 1.349 1.00 0.00 O ATOM 826 CB VAL A 56 5.040 -11.483 4.197 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.236 -12.417 5.086 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.755 -10.431 5.038 1.00 0.00 C ATOM 0 H VAL A 56 8.098 -11.833 3.348 1.00 0.00 H new ATOM 0 HA VAL A 56 5.731 -13.329 3.275 1.00 0.00 H new ATOM 0 HB VAL A 56 4.355 -10.967 3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.539 -11.835 5.689 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.680 -13.121 4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.912 -12.966 5.742 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.025 -9.887 5.637 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.474 -10.919 5.697 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.278 -9.735 4.382 1.00 0.00 H new ATOM 838 N ARG A 57 4.856 -11.533 1.344 1.00 0.00 N ATOM 839 CA ARG A 57 4.705 -10.983 0.000 1.00 0.00 C ATOM 840 C ARG A 57 3.248 -10.593 -0.255 1.00 0.00 C ATOM 841 O ARG A 57 2.419 -11.433 -0.611 1.00 0.00 O ATOM 842 CB ARG A 57 5.196 -11.984 -1.054 1.00 0.00 C ATOM 843 CG ARG A 57 4.492 -13.338 -1.016 1.00 0.00 C ATOM 844 CD ARG A 57 5.088 -14.255 0.042 1.00 0.00 C ATOM 845 NE ARG A 57 4.181 -14.454 1.173 1.00 0.00 N ATOM 846 CZ ARG A 57 4.430 -15.279 2.192 1.00 0.00 C ATOM 847 NH1 ARG A 57 5.548 -16.001 2.218 1.00 0.00 N ATOM 848 NH2 ARG A 57 3.557 -15.385 3.186 1.00 0.00 N ATOM 0 H ARG A 57 3.975 -11.768 1.800 1.00 0.00 H new ATOM 0 HA ARG A 57 5.318 -10.085 -0.078 1.00 0.00 H new ATOM 0 HB2 ARG A 57 5.062 -11.546 -2.043 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.266 -12.141 -0.917 1.00 0.00 H new ATOM 0 HG2 ARG A 57 3.431 -13.191 -0.813 1.00 0.00 H new ATOM 0 HG3 ARG A 57 4.567 -13.814 -1.994 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.324 -15.220 -0.407 1.00 0.00 H new ATOM 0 HD3 ARG A 57 6.026 -13.832 0.401 1.00 0.00 H new ATOM 0 HE ARG A 57 3.306 -13.931 1.183 1.00 0.00 H new ATOM 0 HH11 ARG A 57 6.221 -15.926 1.456 1.00 0.00 H new ATOM 0 HH12 ARG A 57 5.731 -16.629 3.000 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.697 -14.836 3.170 1.00 0.00 H new ATOM 0 HH22 ARG A 57 3.746 -16.015 3.966 1.00 0.00 H new ATOM 862 N LEU A 58 2.937 -9.315 -0.053 1.00 0.00 N ATOM 863 CA LEU A 58 1.574 -8.822 -0.249 1.00 0.00 C ATOM 864 C LEU A 58 1.565 -7.345 -0.638 1.00 0.00 C ATOM 865 O LEU A 58 2.604 -6.684 -0.638 1.00 0.00 O ATOM 866 CB LEU A 58 0.748 -9.040 1.023 1.00 0.00 C ATOM 867 CG LEU A 58 1.299 -8.368 2.283 1.00 0.00 C ATOM 868 CD1 LEU A 58 0.446 -7.168 2.668 1.00 0.00 C ATOM 869 CD2 LEU A 58 1.369 -9.364 3.431 1.00 0.00 C ATOM 0 H LEU A 58 3.605 -8.604 0.245 1.00 0.00 H new ATOM 0 HA LEU A 58 1.127 -9.385 -1.068 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.263 -8.672 0.848 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.670 -10.112 1.207 1.00 0.00 H new ATOM 0 HG LEU A 58 2.308 -8.016 2.070 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.854 -6.704 3.566 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.448 -6.444 1.853 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.576 -7.495 2.861 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.763 -8.869 4.319 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.370 -9.747 3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.024 -10.191 3.156 1.00 0.00 H new ATOM 881 N PHE A 59 0.382 -6.835 -0.974 1.00 0.00 N ATOM 882 CA PHE A 59 0.230 -5.437 -1.374 1.00 0.00 C ATOM 883 C PHE A 59 -0.456 -4.623 -0.280 1.00 0.00 C ATOM 884 O PHE A 59 -1.066 -5.181 0.635 1.00 0.00 O ATOM 885 CB PHE A 59 -0.565 -5.343 -2.679 1.00 0.00 C ATOM 886 CG PHE A 59 -0.204 -6.408 -3.675 1.00 0.00 C ATOM 887 CD1 PHE A 59 1.002 -6.358 -4.356 1.00 0.00 C ATOM 888 CD2 PHE A 59 -1.068 -7.462 -3.923 1.00 0.00 C ATOM 889 CE1 PHE A 59 1.339 -7.340 -5.266 1.00 0.00 C ATOM 890 CE2 PHE A 59 -0.735 -8.446 -4.832 1.00 0.00 C ATOM 891 CZ PHE A 59 0.470 -8.385 -5.504 1.00 0.00 C ATOM 0 H PHE A 59 -0.487 -7.370 -0.977 1.00 0.00 H new ATOM 0 HA PHE A 59 1.225 -5.021 -1.533 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.629 -5.413 -2.453 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -0.398 -4.364 -3.128 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.685 -5.542 -4.173 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -2.011 -7.514 -3.400 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.282 -7.290 -5.791 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.416 -9.263 -5.018 1.00 0.00 H new ATOM 0 HZ PHE A 59 0.732 -9.155 -6.215 1.00 0.00 H new ATOM 901 N ALA A 60 -0.347 -3.300 -0.383 1.00 0.00 N ATOM 902 CA ALA A 60 -0.950 -2.397 0.591 1.00 0.00 C ATOM 903 C ALA A 60 -1.489 -1.142 -0.087 1.00 0.00 C ATOM 904 O ALA A 60 -1.108 -0.820 -1.215 1.00 0.00 O ATOM 905 CB ALA A 60 0.066 -2.024 1.661 1.00 0.00 C ATOM 0 H ALA A 60 0.156 -2.829 -1.135 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.787 -2.913 1.062 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.396 -1.350 2.382 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.404 -2.926 2.172 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.919 -1.529 1.196 1.00 0.00 H new ATOM 911 N PHE A 61 -2.380 -0.438 0.606 1.00 0.00 N ATOM 912 CA PHE A 61 -2.975 0.780 0.071 1.00 0.00 C ATOM 913 C PHE A 61 -3.288 1.773 1.187 1.00 0.00 C ATOM 914 O PHE A 61 -3.961 1.431 2.159 1.00 0.00 O ATOM 915 CB PHE A 61 -4.250 0.439 -0.703 1.00 0.00 C ATOM 916 CG PHE A 61 -4.522 1.362 -1.855 1.00 0.00 C ATOM 917 CD1 PHE A 61 -3.739 1.313 -2.998 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.561 2.276 -1.796 1.00 0.00 C ATOM 919 CE1 PHE A 61 -3.988 2.161 -4.060 1.00 0.00 C ATOM 920 CE2 PHE A 61 -5.814 3.126 -2.853 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.027 3.069 -3.988 1.00 0.00 C ATOM 0 H PHE A 61 -2.705 -0.691 1.539 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.257 1.245 -0.604 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.175 -0.582 -1.077 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.098 0.467 -0.019 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.926 0.605 -3.059 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.180 2.324 -0.912 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.371 2.114 -4.945 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.626 3.835 -2.794 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.224 3.733 -4.817 1.00 0.00 H new ATOM 931 N VAL A 62 -2.797 3.003 1.038 1.00 0.00 N ATOM 932 CA VAL A 62 -3.029 4.048 2.031 1.00 0.00 C ATOM 933 C VAL A 62 -3.420 5.367 1.364 1.00 0.00 C ATOM 934 O VAL A 62 -2.846 5.753 0.342 1.00 0.00 O ATOM 935 CB VAL A 62 -1.787 4.269 2.927 1.00 0.00 C ATOM 936 CG1 VAL A 62 -0.630 4.853 2.126 1.00 0.00 C ATOM 937 CG2 VAL A 62 -2.130 5.166 4.109 1.00 0.00 C ATOM 0 H VAL A 62 -2.236 3.299 0.239 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.853 3.709 2.659 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.473 3.299 3.312 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.229 4.998 2.781 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.362 4.168 1.322 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -0.928 5.812 1.702 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -1.243 5.309 4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.477 6.132 3.744 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.915 4.700 4.704 1.00 0.00 H new ATOM 947 N ARG A 63 -4.398 6.052 1.954 1.00 0.00 N ATOM 948 CA ARG A 63 -4.871 7.329 1.429 1.00 0.00 C ATOM 949 C ARG A 63 -4.298 8.487 2.243 1.00 0.00 C ATOM 950 O ARG A 63 -4.715 8.724 3.379 1.00 0.00 O ATOM 951 CB ARG A 63 -6.403 7.376 1.450 1.00 0.00 C ATOM 952 CG ARG A 63 -7.012 8.084 0.249 1.00 0.00 C ATOM 953 CD ARG A 63 -7.912 9.233 0.678 1.00 0.00 C ATOM 954 NE ARG A 63 -8.463 9.961 -0.464 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.149 11.100 -0.359 1.00 0.00 C ATOM 956 NH1 ARG A 63 -9.360 11.653 0.832 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.625 11.690 -1.450 1.00 0.00 N ATOM 0 H ARG A 63 -4.879 5.742 2.798 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.530 7.427 0.398 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.788 6.357 1.493 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.729 7.879 2.360 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.217 8.463 -0.393 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.587 7.371 -0.342 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.728 8.845 1.287 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.345 9.921 1.306 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.314 9.575 -1.396 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.996 11.206 1.674 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.886 12.524 0.904 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -9.466 11.272 -2.367 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.150 12.561 -1.371 1.00 0.00 H new ATOM 971 N PHE A 64 -3.336 9.202 1.661 1.00 0.00 N ATOM 972 CA PHE A 64 -2.705 10.332 2.338 1.00 0.00 C ATOM 973 C PHE A 64 -3.129 11.655 1.705 1.00 0.00 C ATOM 974 O PHE A 64 -3.240 11.763 0.481 1.00 0.00 O ATOM 975 CB PHE A 64 -1.181 10.192 2.310 1.00 0.00 C ATOM 976 CG PHE A 64 -0.601 9.771 3.630 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.492 8.429 3.960 1.00 0.00 C ATOM 978 CD2 PHE A 64 -0.164 10.718 4.544 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.038 8.040 5.174 1.00 0.00 C ATOM 980 CE2 PHE A 64 0.367 10.334 5.760 1.00 0.00 C ATOM 981 CZ PHE A 64 0.470 8.994 6.076 1.00 0.00 C ATOM 0 H PHE A 64 -2.978 9.019 0.724 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.036 10.330 3.376 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.904 9.462 1.549 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.741 11.144 2.014 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.826 7.679 3.259 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.240 11.768 4.302 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.115 6.991 5.419 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.702 11.082 6.464 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.887 8.692 7.025 1.00 0.00 H new ATOM 991 N THR A 65 -3.365 12.659 2.550 1.00 0.00 N ATOM 992 CA THR A 65 -3.783 13.976 2.078 1.00 0.00 C ATOM 993 C THR A 65 -3.084 15.084 2.863 1.00 0.00 C ATOM 994 O THR A 65 -3.017 15.037 4.093 1.00 0.00 O ATOM 995 CB THR A 65 -5.305 14.125 2.195 1.00 0.00 C ATOM 996 OG1 THR A 65 -5.967 13.067 1.522 1.00 0.00 O ATOM 997 CG2 THR A 65 -5.833 15.426 1.625 1.00 0.00 C ATOM 0 H THR A 65 -3.274 12.584 3.563 1.00 0.00 H new ATOM 0 HA THR A 65 -3.498 14.067 1.030 1.00 0.00 H new ATOM 0 HB THR A 65 -5.509 14.107 3.266 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.937 13.179 1.610 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.916 15.462 1.743 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.383 16.265 2.155 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.581 15.488 0.566 1.00 0.00 H new ATOM 1122 N SER A 74 -5.320 15.344 -1.796 1.00 0.00 N ATOM 1123 CA SER A 74 -5.520 13.910 -1.590 1.00 0.00 C ATOM 1124 C SER A 74 -4.873 13.098 -2.708 1.00 0.00 C ATOM 1125 O SER A 74 -5.010 13.431 -3.887 1.00 0.00 O ATOM 1126 CB SER A 74 -7.015 13.586 -1.506 1.00 0.00 C ATOM 1127 OG SER A 74 -7.779 14.454 -2.329 1.00 0.00 O ATOM 0 HA SER A 74 -5.043 13.638 -0.649 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.183 12.553 -1.810 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.350 13.673 -0.473 1.00 0.00 H new ATOM 0 HG SER A 74 -7.312 15.310 -2.424 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.171 12.031 -2.329 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.501 11.168 -3.298 1.00 0.00 C ATOM 1135 C LYS A 75 -3.497 9.715 -2.827 1.00 0.00 C ATOM 1136 O LYS A 75 -3.405 9.440 -1.627 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.063 11.641 -3.527 1.00 0.00 C ATOM 1138 CG LYS A 75 -1.939 12.754 -4.556 1.00 0.00 C ATOM 1139 CD LYS A 75 -0.517 12.865 -5.089 1.00 0.00 C ATOM 1140 CE LYS A 75 0.225 14.040 -4.469 1.00 0.00 C ATOM 1141 NZ LYS A 75 -0.145 15.333 -5.109 1.00 0.00 N ATOM 0 H LYS A 75 -4.052 11.744 -1.357 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.052 11.227 -4.236 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.649 11.987 -2.580 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.458 10.793 -3.848 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.625 12.565 -5.382 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.235 13.702 -4.106 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.023 11.942 -4.880 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -0.542 12.981 -6.173 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.004 14.087 -3.403 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.299 13.882 -4.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.382 16.107 -4.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.089 15.299 -6.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.166 15.497 -4.995 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.587 8.789 -3.779 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.585 7.362 -3.468 1.00 0.00 C ATOM 1157 C PHE A 76 -2.202 6.768 -3.706 1.00 0.00 C ATOM 1158 O PHE A 76 -1.599 6.981 -4.760 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.621 6.618 -4.317 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.982 7.253 -4.305 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.915 6.903 -3.344 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.326 8.200 -5.257 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -8.168 7.486 -3.331 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.576 8.787 -5.248 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.499 8.429 -4.284 1.00 0.00 C ATOM 0 H PHE A 76 -3.662 9.002 -4.774 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.847 7.246 -2.416 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.264 6.565 -5.345 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.705 5.593 -3.956 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.661 6.166 -2.596 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -5.609 8.482 -6.014 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.887 7.204 -2.576 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -7.832 9.525 -5.994 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.478 8.886 -4.276 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.701 6.025 -2.722 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.388 5.404 -2.830 1.00 0.00 C ATOM 1177 C ALA A 77 -0.474 3.892 -2.650 1.00 0.00 C ATOM 1178 O ALA A 77 -1.024 3.405 -1.658 1.00 0.00 O ATOM 1179 CB ALA A 77 0.570 6.010 -1.815 1.00 0.00 C ATOM 0 H ALA A 77 -2.185 5.840 -1.843 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.005 5.598 -3.832 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.547 5.535 -1.908 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.667 7.080 -2.000 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.183 5.849 -0.809 1.00 0.00 H new ATOM 1185 N LEU A 78 0.079 3.156 -3.612 1.00 0.00 N ATOM 1186 CA LEU A 78 0.076 1.698 -3.562 1.00 0.00 C ATOM 1187 C LEU A 78 1.431 1.180 -3.093 1.00 0.00 C ATOM 1188 O LEU A 78 2.418 1.237 -3.831 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.269 1.115 -4.934 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.933 -0.263 -4.902 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -1.832 -0.451 -6.115 1.00 0.00 C ATOM 1192 CD2 LEU A 78 0.120 -1.359 -4.840 1.00 0.00 C ATOM 0 H LEU A 78 0.535 3.547 -4.436 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.685 1.379 -2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.932 1.809 -5.451 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.645 1.048 -5.524 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.550 -0.328 -4.006 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.296 -1.437 -6.075 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.607 0.315 -6.115 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.238 -0.366 -7.025 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.369 -2.333 -4.818 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.763 -1.296 -5.718 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.722 -1.235 -3.940 1.00 0.00 H new ATOM 1204 N ILE A 79 1.475 0.687 -1.859 1.00 0.00 N ATOM 1205 CA ILE A 79 2.713 0.172 -1.284 1.00 0.00 C ATOM 1206 C ILE A 79 2.772 -1.351 -1.356 1.00 0.00 C ATOM 1207 O ILE A 79 2.113 -2.043 -0.580 1.00 0.00 O ATOM 1208 CB ILE A 79 2.880 0.613 0.186 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.673 2.125 0.322 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.253 0.215 0.706 1.00 0.00 C ATOM 1211 CD1 ILE A 79 1.698 2.504 1.415 1.00 0.00 C ATOM 0 H ILE A 79 0.668 0.633 -1.238 1.00 0.00 H new ATOM 0 HA ILE A 79 3.527 0.589 -1.877 1.00 0.00 H new ATOM 0 HB ILE A 79 2.122 0.108 0.785 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.634 2.599 0.523 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.314 2.522 -0.628 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.355 0.533 1.744 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.365 -0.868 0.645 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.024 0.694 0.102 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.600 3.589 1.455 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.725 2.059 1.205 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.065 2.138 2.374 1.00 0.00 H new ATOM 1223 N THR A 80 3.581 -1.865 -2.280 1.00 0.00 N ATOM 1224 CA THR A 80 3.742 -3.307 -2.439 1.00 0.00 C ATOM 1225 C THR A 80 4.868 -3.806 -1.535 1.00 0.00 C ATOM 1226 O THR A 80 6.025 -3.410 -1.694 1.00 0.00 O ATOM 1227 CB THR A 80 4.036 -3.660 -3.904 1.00 0.00 C ATOM 1228 OG1 THR A 80 5.314 -3.192 -4.292 1.00 0.00 O ATOM 1229 CG2 THR A 80 3.029 -3.088 -4.879 1.00 0.00 C ATOM 0 H THR A 80 4.134 -1.305 -2.929 1.00 0.00 H new ATOM 0 HA THR A 80 2.812 -3.797 -2.151 1.00 0.00 H new ATOM 0 HB THR A 80 3.982 -4.748 -3.946 1.00 0.00 H new ATOM 0 HG1 THR A 80 5.219 -2.348 -4.780 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.300 -3.378 -5.894 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.036 -3.473 -4.645 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.024 -2.001 -4.801 1.00 0.00 H new ATOM 1237 N TRP A 81 4.525 -4.662 -0.573 1.00 0.00 N ATOM 1238 CA TRP A 81 5.514 -5.193 0.363 1.00 0.00 C ATOM 1239 C TRP A 81 5.961 -6.600 -0.022 1.00 0.00 C ATOM 1240 O TRP A 81 5.153 -7.433 -0.437 1.00 0.00 O ATOM 1241 CB TRP A 81 4.953 -5.201 1.789 1.00 0.00 C ATOM 1242 CG TRP A 81 5.886 -5.804 2.799 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.769 -7.026 3.399 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.084 -5.216 3.323 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.816 -7.228 4.265 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.636 -6.134 4.236 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.742 -4.001 3.112 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.814 -5.876 4.934 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 8.910 -3.748 3.805 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.435 -4.681 4.706 1.00 0.00 C ATOM 0 H TRP A 81 3.575 -5.001 -0.422 1.00 0.00 H new ATOM 0 HA TRP A 81 6.384 -4.538 0.319 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.722 -4.178 2.085 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.014 -5.755 1.798 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.970 -7.730 3.219 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.959 -8.060 4.837 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.345 -3.273 2.420 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.221 -6.595 5.630 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.427 -2.813 3.648 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.350 -4.452 5.232 1.00 0.00 H new ATOM 1261 N ILE A 82 7.255 -6.859 0.140 1.00 0.00 N ATOM 1262 CA ILE A 82 7.820 -8.166 -0.166 1.00 0.00 C ATOM 1263 C ILE A 82 8.936 -8.514 0.817 1.00 0.00 C ATOM 1264 O ILE A 82 10.063 -8.030 0.694 1.00 0.00 O ATOM 1265 CB ILE A 82 8.366 -8.236 -1.609 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.336 -7.691 -2.605 1.00 0.00 C ATOM 1267 CG2 ILE A 82 8.742 -9.668 -1.963 1.00 0.00 C ATOM 1268 CD1 ILE A 82 7.819 -7.689 -4.040 1.00 0.00 C ATOM 0 H ILE A 82 7.933 -6.178 0.483 1.00 0.00 H new ATOM 0 HA ILE A 82 7.011 -8.891 -0.072 1.00 0.00 H new ATOM 0 HB ILE A 82 9.260 -7.616 -1.669 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.427 -8.289 -2.538 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.070 -6.673 -2.319 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.125 -9.702 -2.983 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.509 -10.023 -1.275 1.00 0.00 H new ATOM 0 HG23 ILE A 82 7.861 -10.305 -1.885 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.037 -7.290 -4.686 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.711 -7.067 -4.123 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.057 -8.708 -4.345 1.00 0.00 H new ATOM 1280 N GLY A 83 8.608 -9.356 1.795 1.00 0.00 N ATOM 1281 CA GLY A 83 9.587 -9.760 2.792 1.00 0.00 C ATOM 1282 C GLY A 83 10.625 -10.710 2.226 1.00 0.00 C ATOM 1283 O GLY A 83 10.274 -11.745 1.667 1.00 0.00 O ATOM 0 H GLY A 83 7.682 -9.766 1.915 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.085 -8.875 3.189 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.076 -10.239 3.627 1.00 0.00 H new ATOM 1287 N GLU A 84 11.899 -10.329 2.372 1.00 0.00 N ATOM 1288 CA GLU A 84 13.052 -11.102 1.876 1.00 0.00 C ATOM 1289 C GLU A 84 12.852 -12.614 1.909 1.00 0.00 C ATOM 1290 O GLU A 84 13.171 -13.303 0.938 1.00 0.00 O ATOM 1291 CB GLU A 84 14.282 -10.776 2.708 1.00 0.00 C ATOM 1292 CG GLU A 84 14.974 -9.479 2.315 1.00 0.00 C ATOM 1293 CD GLU A 84 15.658 -9.563 0.964 1.00 0.00 C ATOM 1294 OE1 GLU A 84 16.820 -10.017 0.914 1.00 0.00 O ATOM 1295 OE2 GLU A 84 15.031 -9.172 -0.043 1.00 0.00 O ATOM 0 H GLU A 84 12.166 -9.465 2.843 1.00 0.00 H new ATOM 0 HA GLU A 84 13.172 -10.811 0.832 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.992 -10.717 3.757 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.994 -11.596 2.620 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.241 -8.673 2.296 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.712 -9.221 3.075 1.00 0.00 H new ATOM 1302 N ASN A 85 12.351 -13.132 3.030 1.00 0.00 N ATOM 1303 CA ASN A 85 12.142 -14.573 3.178 1.00 0.00 C ATOM 1304 C ASN A 85 11.253 -15.142 2.072 1.00 0.00 C ATOM 1305 O ASN A 85 11.150 -16.359 1.919 1.00 0.00 O ATOM 1306 CB ASN A 85 11.550 -14.886 4.550 1.00 0.00 C ATOM 1307 CG ASN A 85 12.629 -15.139 5.579 1.00 0.00 C ATOM 1308 OD1 ASN A 85 12.683 -16.205 6.191 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.500 -14.155 5.772 1.00 0.00 N ATOM 0 H ASN A 85 12.084 -12.580 3.845 1.00 0.00 H new ATOM 0 HA ASN A 85 13.117 -15.053 3.091 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.925 -14.055 4.875 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.904 -15.761 4.477 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.253 -14.266 6.451 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.416 -13.288 5.241 1.00 0.00 H new ATOM 1316 N VAL A 86 10.631 -14.258 1.300 1.00 0.00 N ATOM 1317 CA VAL A 86 9.764 -14.667 0.196 1.00 0.00 C ATOM 1318 C VAL A 86 10.482 -15.654 -0.729 1.00 0.00 C ATOM 1319 O VAL A 86 11.577 -15.377 -1.224 1.00 0.00 O ATOM 1320 CB VAL A 86 9.275 -13.452 -0.628 1.00 0.00 C ATOM 1321 CG1 VAL A 86 10.444 -12.720 -1.276 1.00 0.00 C ATOM 1322 CG2 VAL A 86 8.268 -13.890 -1.681 1.00 0.00 C ATOM 0 H VAL A 86 10.710 -13.248 1.418 1.00 0.00 H new ATOM 0 HA VAL A 86 8.897 -15.156 0.640 1.00 0.00 H new ATOM 0 HB VAL A 86 8.783 -12.760 0.055 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.070 -11.871 -1.848 1.00 0.00 H new ATOM 0 HG12 VAL A 86 11.124 -12.364 -0.502 1.00 0.00 H new ATOM 0 HG13 VAL A 86 10.975 -13.400 -1.942 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.936 -13.022 -2.250 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.735 -14.608 -2.355 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.411 -14.354 -1.194 1.00 0.00 H new ATOM 1332 N SER A 87 9.858 -16.808 -0.951 1.00 0.00 N ATOM 1333 CA SER A 87 10.435 -17.842 -1.810 1.00 0.00 C ATOM 1334 C SER A 87 10.332 -17.453 -3.285 1.00 0.00 C ATOM 1335 O SER A 87 9.558 -16.565 -3.651 1.00 0.00 O ATOM 1336 CB SER A 87 9.737 -19.185 -1.572 1.00 0.00 C ATOM 1337 OG SER A 87 10.656 -20.261 -1.643 1.00 0.00 O ATOM 0 H SER A 87 8.953 -17.052 -0.549 1.00 0.00 H new ATOM 0 HA SER A 87 11.490 -17.939 -1.554 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.255 -19.179 -0.594 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.951 -19.325 -2.314 1.00 0.00 H new ATOM 0 HG SER A 87 10.184 -21.105 -1.486 1.00 0.00 H new ATOM 1343 N GLY A 88 11.121 -18.124 -4.126 1.00 0.00 N ATOM 1344 CA GLY A 88 11.116 -17.843 -5.555 1.00 0.00 C ATOM 1345 C GLY A 88 9.726 -17.912 -6.164 1.00 0.00 C ATOM 1346 O GLY A 88 9.301 -16.984 -6.855 1.00 0.00 O ATOM 0 H GLY A 88 11.766 -18.861 -3.841 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.534 -16.851 -5.727 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.766 -18.555 -6.063 1.00 0.00 H new ATOM 1350 N LEU A 89 9.014 -19.010 -5.903 1.00 0.00 N ATOM 1351 CA LEU A 89 7.661 -19.193 -6.427 1.00 0.00 C ATOM 1352 C LEU A 89 6.733 -18.088 -5.928 1.00 0.00 C ATOM 1353 O LEU A 89 5.895 -17.585 -6.677 1.00 0.00 O ATOM 1354 CB LEU A 89 7.108 -20.563 -6.025 1.00 0.00 C ATOM 1355 CG LEU A 89 6.425 -21.343 -7.154 1.00 0.00 C ATOM 1356 CD1 LEU A 89 7.395 -22.329 -7.785 1.00 0.00 C ATOM 1357 CD2 LEU A 89 5.194 -22.068 -6.632 1.00 0.00 C ATOM 0 H LEU A 89 9.352 -19.785 -5.332 1.00 0.00 H new ATOM 0 HA LEU A 89 7.711 -19.140 -7.515 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.925 -21.166 -5.630 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.393 -20.426 -5.214 1.00 0.00 H new ATOM 0 HG LEU A 89 6.109 -20.634 -7.919 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.892 -22.873 -8.584 1.00 0.00 H new ATOM 0 HD12 LEU A 89 8.248 -21.788 -8.195 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.741 -23.033 -7.029 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.722 -22.616 -7.447 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.488 -22.766 -5.848 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.489 -21.342 -6.227 1.00 0.00 H new ATOM 1369 N GLN A 90 6.898 -17.708 -4.659 1.00 0.00 N ATOM 1370 CA GLN A 90 6.090 -16.657 -4.058 1.00 0.00 C ATOM 1371 C GLN A 90 6.308 -15.332 -4.785 1.00 0.00 C ATOM 1372 O GLN A 90 5.351 -14.617 -5.091 1.00 0.00 O ATOM 1373 CB GLN A 90 6.445 -16.506 -2.578 1.00 0.00 C ATOM 1374 CG GLN A 90 6.402 -17.811 -1.793 1.00 0.00 C ATOM 1375 CD GLN A 90 5.165 -18.644 -2.090 1.00 0.00 C ATOM 1376 OE1 GLN A 90 4.037 -18.190 -1.898 1.00 0.00 O ATOM 1377 NE2 GLN A 90 5.373 -19.868 -2.566 1.00 0.00 N ATOM 0 H GLN A 90 7.588 -18.118 -4.030 1.00 0.00 H new ATOM 0 HA GLN A 90 5.039 -16.933 -4.147 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.444 -16.078 -2.497 1.00 0.00 H new ATOM 0 HB3 GLN A 90 5.756 -15.796 -2.120 1.00 0.00 H new ATOM 0 HG2 GLN A 90 7.292 -18.397 -2.024 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.435 -17.588 -0.727 1.00 0.00 H new ATOM 0 HE21 GLN A 90 6.325 -20.204 -2.710 1.00 0.00 H new ATOM 0 HE22 GLN A 90 4.580 -20.471 -2.787 1.00 0.00 H new ATOM 1386 N ARG A 91 7.577 -15.023 -5.066 1.00 0.00 N ATOM 1387 CA ARG A 91 7.941 -13.795 -5.768 1.00 0.00 C ATOM 1388 C ARG A 91 7.233 -13.714 -7.119 1.00 0.00 C ATOM 1389 O ARG A 91 6.641 -12.686 -7.456 1.00 0.00 O ATOM 1390 CB ARG A 91 9.458 -13.732 -5.970 1.00 0.00 C ATOM 1391 CG ARG A 91 10.016 -12.319 -5.987 1.00 0.00 C ATOM 1392 CD ARG A 91 11.355 -12.255 -6.708 1.00 0.00 C ATOM 1393 NE ARG A 91 11.987 -10.943 -6.572 1.00 0.00 N ATOM 1394 CZ ARG A 91 13.270 -10.698 -6.848 1.00 0.00 C ATOM 1395 NH1 ARG A 91 14.065 -11.669 -7.289 1.00 0.00 N ATOM 1396 NH2 ARG A 91 13.759 -9.474 -6.684 1.00 0.00 N ATOM 0 H ARG A 91 8.371 -15.612 -4.815 1.00 0.00 H new ATOM 0 HA ARG A 91 7.626 -12.947 -5.160 1.00 0.00 H new ATOM 0 HB2 ARG A 91 9.945 -14.295 -5.174 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.711 -14.224 -6.909 1.00 0.00 H new ATOM 0 HG2 ARG A 91 9.306 -11.653 -6.477 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.135 -11.962 -4.964 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.019 -13.021 -6.308 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.209 -12.480 -7.765 1.00 0.00 H new ATOM 0 HE ARG A 91 11.411 -10.167 -6.246 1.00 0.00 H new ATOM 0 HH11 ARG A 91 13.696 -12.611 -7.419 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.044 -11.472 -7.497 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.155 -8.724 -6.348 1.00 0.00 H new ATOM 0 HH22 ARG A 91 14.739 -9.284 -6.894 1.00 0.00 H new ATOM 1410 N ALA A 92 7.290 -14.807 -7.883 1.00 0.00 N ATOM 1411 CA ALA A 92 6.644 -14.861 -9.191 1.00 0.00 C ATOM 1412 C ALA A 92 5.146 -14.595 -9.063 1.00 0.00 C ATOM 1413 O ALA A 92 4.576 -13.820 -9.835 1.00 0.00 O ATOM 1414 CB ALA A 92 6.897 -16.205 -9.862 1.00 0.00 C ATOM 0 H ALA A 92 7.776 -15.663 -7.617 1.00 0.00 H new ATOM 0 HA ALA A 92 7.077 -14.081 -9.818 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.407 -16.224 -10.835 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.969 -16.350 -9.993 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.496 -17.004 -9.238 1.00 0.00 H new ATOM 1420 N LYS A 93 4.517 -15.230 -8.067 1.00 0.00 N ATOM 1421 CA LYS A 93 3.090 -15.048 -7.824 1.00 0.00 C ATOM 1422 C LYS A 93 2.773 -13.567 -7.610 1.00 0.00 C ATOM 1423 O LYS A 93 1.929 -13.004 -8.307 1.00 0.00 O ATOM 1424 CB LYS A 93 2.638 -15.878 -6.612 1.00 0.00 C ATOM 1425 CG LYS A 93 2.158 -17.277 -6.978 1.00 0.00 C ATOM 1426 CD LYS A 93 1.191 -17.840 -5.943 1.00 0.00 C ATOM 1427 CE LYS A 93 1.884 -18.802 -4.986 1.00 0.00 C ATOM 1428 NZ LYS A 93 1.213 -18.853 -3.654 1.00 0.00 N ATOM 0 H LYS A 93 4.976 -15.872 -7.421 1.00 0.00 H new ATOM 0 HA LYS A 93 2.542 -15.397 -8.699 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.466 -15.959 -5.908 1.00 0.00 H new ATOM 0 HB3 LYS A 93 1.834 -15.349 -6.099 1.00 0.00 H new ATOM 0 HG2 LYS A 93 1.670 -17.249 -7.952 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.017 -17.942 -7.071 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.747 -17.021 -5.377 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.376 -18.356 -6.450 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.897 -19.800 -5.423 1.00 0.00 H new ATOM 0 HE3 LYS A 93 2.923 -18.498 -4.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.677 -19.569 -3.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.283 -17.923 -3.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.211 -19.103 -3.779 1.00 0.00 H new ATOM 1442 N THR A 94 3.471 -12.940 -6.654 1.00 0.00 N ATOM 1443 CA THR A 94 3.279 -11.518 -6.353 1.00 0.00 C ATOM 1444 C THR A 94 3.304 -10.668 -7.624 1.00 0.00 C ATOM 1445 O THR A 94 2.514 -9.735 -7.763 1.00 0.00 O ATOM 1446 CB THR A 94 4.356 -11.030 -5.376 1.00 0.00 C ATOM 1447 OG1 THR A 94 4.457 -11.906 -4.268 1.00 0.00 O ATOM 1448 CG2 THR A 94 4.098 -9.638 -4.833 1.00 0.00 C ATOM 0 H THR A 94 4.175 -13.398 -6.075 1.00 0.00 H new ATOM 0 HA THR A 94 2.298 -11.407 -5.892 1.00 0.00 H new ATOM 0 HB THR A 94 5.279 -11.008 -5.956 1.00 0.00 H new ATOM 0 HG1 THR A 94 4.900 -12.735 -4.546 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.900 -9.360 -4.149 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.061 -8.927 -5.658 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.147 -9.626 -4.301 1.00 0.00 H new ATOM 1456 N GLY A 95 4.207 -10.993 -8.553 1.00 0.00 N ATOM 1457 CA GLY A 95 4.294 -10.244 -9.797 1.00 0.00 C ATOM 1458 C GLY A 95 2.984 -10.263 -10.564 1.00 0.00 C ATOM 1459 O GLY A 95 2.458 -9.209 -10.931 1.00 0.00 O ATOM 0 H GLY A 95 4.876 -11.758 -8.465 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.573 -9.213 -9.581 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.085 -10.664 -10.419 1.00 0.00 H new ATOM 1463 N THR A 96 2.453 -11.464 -10.789 1.00 0.00 N ATOM 1464 CA THR A 96 1.187 -11.629 -11.501 1.00 0.00 C ATOM 1465 C THR A 96 0.043 -10.964 -10.735 1.00 0.00 C ATOM 1466 O THR A 96 -0.858 -10.378 -11.334 1.00 0.00 O ATOM 1467 CB THR A 96 0.879 -13.116 -11.712 1.00 0.00 C ATOM 1468 OG1 THR A 96 2.074 -13.868 -11.836 1.00 0.00 O ATOM 1469 CG2 THR A 96 0.041 -13.384 -12.945 1.00 0.00 C ATOM 0 H THR A 96 2.881 -12.339 -10.487 1.00 0.00 H new ATOM 0 HA THR A 96 1.282 -11.146 -12.474 1.00 0.00 H new ATOM 0 HB THR A 96 0.313 -13.419 -10.831 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.853 -14.814 -11.968 1.00 0.00 H new ATOM 0 HG21 THR A 96 -0.141 -14.455 -13.036 1.00 0.00 H new ATOM 0 HG22 THR A 96 -0.911 -12.860 -12.859 1.00 0.00 H new ATOM 0 HG23 THR A 96 0.571 -13.030 -13.829 1.00 0.00 H new ATOM 1477 N ASP A 97 0.088 -11.056 -9.407 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.944 -10.458 -8.563 1.00 0.00 C ATOM 1479 C ASP A 97 -0.860 -8.930 -8.585 1.00 0.00 C ATOM 1480 O ASP A 97 -1.886 -8.248 -8.542 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.821 -10.968 -7.124 1.00 0.00 C ATOM 1482 CG ASP A 97 -1.344 -12.383 -6.960 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -2.562 -12.593 -7.149 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -0.536 -13.283 -6.644 1.00 0.00 O ATOM 0 H ASP A 97 0.826 -11.538 -8.894 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.914 -10.753 -8.964 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.225 -10.933 -6.818 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.370 -10.302 -6.458 1.00 0.00 H new ATOM 1489 N LYS A 98 0.363 -8.401 -8.656 1.00 0.00 N ATOM 1490 CA LYS A 98 0.579 -6.954 -8.688 1.00 0.00 C ATOM 1491 C LYS A 98 -0.072 -6.322 -9.920 1.00 0.00 C ATOM 1492 O LYS A 98 -0.526 -5.176 -9.870 1.00 0.00 O ATOM 1493 CB LYS A 98 2.082 -6.640 -8.674 1.00 0.00 C ATOM 1494 CG LYS A 98 2.423 -5.273 -8.094 1.00 0.00 C ATOM 1495 CD LYS A 98 3.396 -4.510 -8.983 1.00 0.00 C ATOM 1496 CE LYS A 98 2.697 -3.915 -10.197 1.00 0.00 C ATOM 1497 NZ LYS A 98 2.158 -2.554 -9.922 1.00 0.00 N ATOM 0 H LYS A 98 1.219 -8.954 -8.692 1.00 0.00 H new ATOM 0 HA LYS A 98 0.113 -6.528 -7.799 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.598 -7.407 -8.097 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.464 -6.697 -9.693 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.509 -4.691 -7.972 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.857 -5.397 -7.102 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.868 -3.714 -8.407 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.191 -5.179 -9.312 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.398 -3.865 -11.030 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.883 -4.572 -10.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.001 -2.055 -10.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 1.257 -2.635 -9.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.839 -2.021 -9.344 1.00 0.00 H new ATOM 1511 N THR A 99 -0.125 -7.075 -11.024 1.00 0.00 N ATOM 1512 CA THR A 99 -0.729 -6.577 -12.258 1.00 0.00 C ATOM 1513 C THR A 99 -2.254 -6.706 -12.212 1.00 0.00 C ATOM 1514 O THR A 99 -2.970 -5.866 -12.759 1.00 0.00 O ATOM 1515 CB THR A 99 -0.153 -7.306 -13.483 1.00 0.00 C ATOM 1516 OG1 THR A 99 -0.483 -6.618 -14.679 1.00 0.00 O ATOM 1517 CG2 THR A 99 -0.630 -8.737 -13.633 1.00 0.00 C ATOM 0 H THR A 99 0.241 -8.025 -11.086 1.00 0.00 H new ATOM 0 HA THR A 99 -0.484 -5.519 -12.349 1.00 0.00 H new ATOM 0 HB THR A 99 0.924 -7.324 -13.313 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.106 -7.097 -15.446 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.178 -9.180 -14.520 1.00 0.00 H new ATOM 0 HG22 THR A 99 -0.340 -9.311 -12.753 1.00 0.00 H new ATOM 0 HG23 THR A 99 -1.715 -8.750 -13.734 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.741 -7.754 -11.542 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.175 -7.987 -11.408 1.00 0.00 C ATOM 1527 C LEU A 100 -4.833 -6.862 -10.608 1.00 0.00 C ATOM 1528 O LEU A 100 -5.899 -6.364 -10.979 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.426 -9.332 -10.724 1.00 0.00 C ATOM 1530 CG LEU A 100 -4.253 -10.557 -11.624 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -4.167 -11.826 -10.790 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -5.397 -10.652 -12.622 1.00 0.00 C ATOM 0 H LEU A 100 -2.158 -8.455 -11.084 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.616 -8.005 -12.405 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.747 -9.424 -9.876 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.439 -9.335 -10.323 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.321 -10.446 -12.178 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.044 -12.686 -11.448 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.314 -11.761 -10.115 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.082 -11.942 -10.208 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.257 -11.529 -13.254 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.342 -10.738 -12.085 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.413 -9.757 -13.243 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.183 -6.462 -9.511 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.690 -5.391 -8.655 1.00 0.00 C ATOM 1546 C VAL A 101 -4.636 -4.044 -9.377 1.00 0.00 C ATOM 1547 O VAL A 101 -5.580 -3.256 -9.302 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.892 -5.298 -7.334 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -4.506 -4.265 -6.400 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.822 -6.660 -6.656 1.00 0.00 C ATOM 0 H VAL A 101 -3.301 -6.867 -9.196 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.727 -5.631 -8.420 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.877 -4.978 -7.571 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.927 -4.218 -5.478 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.499 -3.288 -6.883 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.533 -4.548 -6.169 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.257 -6.576 -5.728 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.831 -7.009 -6.436 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.328 -7.371 -7.318 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.529 -3.793 -10.082 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.357 -2.545 -10.829 1.00 0.00 C ATOM 1562 C LYS A 102 -4.464 -2.372 -11.869 1.00 0.00 C ATOM 1563 O LYS A 102 -4.941 -1.260 -12.097 1.00 0.00 O ATOM 1564 CB LYS A 102 -1.988 -2.518 -11.515 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.260 -1.191 -11.365 1.00 0.00 C ATOM 1566 CD LYS A 102 -0.466 -0.843 -12.616 1.00 0.00 C ATOM 1567 CE LYS A 102 0.720 0.054 -12.291 1.00 0.00 C ATOM 1568 NZ LYS A 102 1.822 -0.090 -13.287 1.00 0.00 N ATOM 0 H LYS A 102 -2.740 -4.436 -10.151 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.417 -1.719 -10.121 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.367 -3.313 -11.101 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.118 -2.734 -12.575 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.982 -0.400 -11.160 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.588 -1.239 -10.508 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.112 -1.758 -13.090 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -1.116 -0.343 -13.334 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.391 1.093 -12.262 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.096 -0.189 -11.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.609 0.538 -13.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.154 -1.075 -13.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.472 0.167 -14.232 1.00 0.00 H new ATOM 1582 N GLU A 103 -4.871 -3.479 -12.492 1.00 0.00 N ATOM 1583 CA GLU A 103 -5.929 -3.451 -13.500 1.00 0.00 C ATOM 1584 C GLU A 103 -7.262 -3.041 -12.875 1.00 0.00 C ATOM 1585 O GLU A 103 -8.006 -2.241 -13.448 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.064 -4.823 -14.167 1.00 0.00 C ATOM 1587 CG GLU A 103 -5.355 -4.924 -15.508 1.00 0.00 C ATOM 1588 CD GLU A 103 -5.776 -6.150 -16.297 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -6.968 -6.244 -16.657 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -4.912 -7.015 -16.556 1.00 0.00 O ATOM 0 H GLU A 103 -4.483 -4.406 -12.315 1.00 0.00 H new ATOM 0 HA GLU A 103 -5.659 -2.714 -14.256 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.664 -5.584 -13.497 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.122 -5.046 -14.308 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -5.564 -4.029 -16.094 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -4.278 -4.953 -15.344 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.550 -3.589 -11.692 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.787 -3.284 -10.977 1.00 0.00 C ATOM 1599 C VAL A 104 -8.777 -1.845 -10.458 1.00 0.00 C ATOM 1600 O VAL A 104 -9.789 -1.145 -10.534 1.00 0.00 O ATOM 1601 CB VAL A 104 -9.008 -4.256 -9.795 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -10.347 -3.996 -9.117 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -8.922 -5.702 -10.266 1.00 0.00 C ATOM 0 H VAL A 104 -6.939 -4.248 -11.209 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.606 -3.403 -11.686 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.218 -4.082 -9.064 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.477 -4.693 -8.289 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -10.371 -2.974 -8.738 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -11.153 -4.134 -9.838 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -9.080 -6.370 -9.420 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.687 -5.885 -11.021 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.937 -5.887 -10.695 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.627 -1.411 -9.936 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.484 -0.054 -9.410 1.00 0.00 C ATOM 1615 C VAL A 105 -6.499 0.757 -10.251 1.00 0.00 C ATOM 1616 O VAL A 105 -5.283 0.662 -10.069 1.00 0.00 O ATOM 1617 CB VAL A 105 -7.020 -0.061 -7.937 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -7.011 1.351 -7.366 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -7.909 -0.973 -7.103 1.00 0.00 C ATOM 0 H VAL A 105 -6.783 -1.980 -9.867 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.468 0.413 -9.461 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.001 -0.447 -7.901 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -6.681 1.321 -6.328 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.330 1.974 -7.946 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.016 1.770 -7.415 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.568 -0.966 -6.068 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.939 -0.618 -7.148 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.858 -1.989 -7.495 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.037 1.550 -11.176 1.00 0.00 N ATOM 1630 CA GLN A 106 -6.215 2.378 -12.058 1.00 0.00 C ATOM 1631 C GLN A 106 -6.082 3.809 -11.525 1.00 0.00 C ATOM 1632 O GLN A 106 -5.134 4.518 -11.871 1.00 0.00 O ATOM 1633 CB GLN A 106 -6.809 2.392 -13.469 1.00 0.00 C ATOM 1634 CG GLN A 106 -6.525 1.120 -14.254 1.00 0.00 C ATOM 1635 CD GLN A 106 -7.145 1.132 -15.639 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -6.704 1.868 -16.520 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -8.175 0.314 -15.839 1.00 0.00 N ATOM 0 H GLN A 106 -8.041 1.637 -11.335 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.216 1.942 -12.092 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.887 2.535 -13.400 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.408 3.245 -14.016 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.447 0.988 -14.345 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -6.905 0.263 -13.698 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -8.509 -0.280 -15.080 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -8.630 0.281 -16.751 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.026 4.227 -10.680 1.00 0.00 N ATOM 1647 CA ASN A 107 -6.998 5.568 -10.100 1.00 0.00 C ATOM 1648 C ASN A 107 -6.013 5.626 -8.931 1.00 0.00 C ATOM 1649 O ASN A 107 -6.407 5.550 -7.765 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.404 5.979 -9.636 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.071 6.961 -10.584 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.517 8.031 -10.169 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.148 6.604 -11.863 1.00 0.00 N ATOM 0 H ASN A 107 -7.818 3.656 -10.383 1.00 0.00 H new ATOM 0 HA ASN A 107 -6.666 6.269 -10.866 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.026 5.089 -9.544 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.339 6.426 -8.644 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -9.589 7.226 -12.540 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -8.766 5.708 -12.166 1.00 0.00 H new ATOM 1660 N PHE A 108 -4.726 5.760 -9.256 1.00 0.00 N ATOM 1661 CA PHE A 108 -3.674 5.828 -8.243 1.00 0.00 C ATOM 1662 C PHE A 108 -2.768 7.035 -8.484 1.00 0.00 C ATOM 1663 O PHE A 108 -2.892 7.718 -9.502 1.00 0.00 O ATOM 1664 CB PHE A 108 -2.845 4.536 -8.246 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.305 4.156 -9.599 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.260 4.866 -10.169 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -2.844 3.087 -10.300 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -0.762 4.518 -11.409 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.349 2.734 -11.540 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.307 3.450 -12.096 1.00 0.00 C ATOM 0 H PHE A 108 -4.387 5.824 -10.216 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.147 5.941 -7.267 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.012 4.650 -7.553 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.462 3.720 -7.871 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.830 5.702 -9.637 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.660 2.524 -9.871 1.00 0.00 H new ATOM 0 HE1 PHE A 108 0.053 5.080 -11.841 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -2.776 1.899 -12.075 1.00 0.00 H new ATOM 0 HZ PHE A 108 -0.919 3.176 -13.066 1.00 0.00 H new ATOM 1680 N ALA A 109 -1.857 7.293 -7.545 1.00 0.00 N ATOM 1681 CA ALA A 109 -0.933 8.418 -7.668 1.00 0.00 C ATOM 1682 C ALA A 109 0.516 7.947 -7.740 1.00 0.00 C ATOM 1683 O ALA A 109 1.246 8.311 -8.663 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.110 9.389 -6.508 1.00 0.00 C ATOM 0 H ALA A 109 -1.740 6.741 -6.695 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.168 8.933 -8.600 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.413 10.219 -6.619 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.131 9.771 -6.505 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.913 8.873 -5.568 1.00 0.00 H new ATOM 1690 N LYS A 110 0.933 7.149 -6.758 1.00 0.00 N ATOM 1691 CA LYS A 110 2.302 6.648 -6.713 1.00 0.00 C ATOM 1692 C LYS A 110 2.364 5.241 -6.121 1.00 0.00 C ATOM 1693 O LYS A 110 1.880 5.001 -5.013 1.00 0.00 O ATOM 1694 CB LYS A 110 3.175 7.602 -5.894 1.00 0.00 C ATOM 1695 CG LYS A 110 4.532 7.875 -6.523 1.00 0.00 C ATOM 1696 CD LYS A 110 5.622 7.036 -5.877 1.00 0.00 C ATOM 1697 CE LYS A 110 6.901 7.835 -5.681 1.00 0.00 C ATOM 1698 NZ LYS A 110 7.438 8.362 -6.968 1.00 0.00 N ATOM 0 H LYS A 110 0.343 6.838 -5.986 1.00 0.00 H new ATOM 0 HA LYS A 110 2.678 6.596 -7.735 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.646 8.547 -5.767 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.323 7.183 -4.899 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.490 7.660 -7.591 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.776 8.932 -6.421 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.273 6.664 -4.913 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.828 6.165 -6.499 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.708 8.666 -5.002 1.00 0.00 H new ATOM 0 HE3 LYS A 110 7.653 7.204 -5.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.353 8.827 -6.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.568 7.577 -7.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 6.769 9.051 -7.367 1.00 0.00 H new ATOM 1712 N GLU A 111 2.970 4.317 -6.868 1.00 0.00 N ATOM 1713 CA GLU A 111 3.108 2.932 -6.425 1.00 0.00 C ATOM 1714 C GLU A 111 4.574 2.499 -6.465 1.00 0.00 C ATOM 1715 O GLU A 111 5.250 2.666 -7.481 1.00 0.00 O ATOM 1716 CB GLU A 111 2.253 2.002 -7.296 1.00 0.00 C ATOM 1717 CG GLU A 111 2.615 2.031 -8.778 1.00 0.00 C ATOM 1718 CD GLU A 111 3.175 0.712 -9.297 1.00 0.00 C ATOM 1719 OE1 GLU A 111 3.190 -0.282 -8.536 1.00 0.00 O ATOM 1720 OE2 GLU A 111 3.598 0.672 -10.472 1.00 0.00 O ATOM 0 H GLU A 111 3.374 4.505 -7.786 1.00 0.00 H new ATOM 0 HA GLU A 111 2.756 2.864 -5.396 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.355 0.981 -6.928 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.205 2.278 -7.183 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.727 2.291 -9.355 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.348 2.819 -8.949 1.00 0.00 H new ATOM 1727 N PHE A 112 5.063 1.952 -5.350 1.00 0.00 N ATOM 1728 CA PHE A 112 6.455 1.508 -5.263 1.00 0.00 C ATOM 1729 C PHE A 112 6.588 0.242 -4.415 1.00 0.00 C ATOM 1730 O PHE A 112 5.691 -0.101 -3.641 1.00 0.00 O ATOM 1731 CB PHE A 112 7.345 2.620 -4.695 1.00 0.00 C ATOM 1732 CG PHE A 112 6.734 3.365 -3.543 1.00 0.00 C ATOM 1733 CD1 PHE A 112 5.806 4.370 -3.764 1.00 0.00 C ATOM 1734 CD2 PHE A 112 7.093 3.063 -2.240 1.00 0.00 C ATOM 1735 CE1 PHE A 112 5.247 5.059 -2.706 1.00 0.00 C ATOM 1736 CE2 PHE A 112 6.537 3.748 -1.179 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.613 4.748 -1.412 1.00 0.00 C ATOM 0 H PHE A 112 4.519 1.807 -4.500 1.00 0.00 H new ATOM 0 HA PHE A 112 6.787 1.273 -6.274 1.00 0.00 H new ATOM 0 HB2 PHE A 112 8.291 2.185 -4.372 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.576 3.328 -5.491 1.00 0.00 H new ATOM 0 HD1 PHE A 112 5.517 4.617 -4.775 1.00 0.00 H new ATOM 0 HD2 PHE A 112 7.816 2.283 -2.052 1.00 0.00 H new ATOM 0 HE1 PHE A 112 4.524 5.840 -2.891 1.00 0.00 H new ATOM 0 HE2 PHE A 112 6.824 3.502 -0.167 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.178 5.286 -0.583 1.00 0.00 H new ATOM 1747 N VAL A 113 7.717 -0.445 -4.580 1.00 0.00 N ATOM 1748 CA VAL A 113 7.993 -1.681 -3.852 1.00 0.00 C ATOM 1749 C VAL A 113 8.933 -1.435 -2.672 1.00 0.00 C ATOM 1750 O VAL A 113 9.873 -0.644 -2.771 1.00 0.00 O ATOM 1751 CB VAL A 113 8.624 -2.749 -4.778 1.00 0.00 C ATOM 1752 CG1 VAL A 113 8.675 -4.105 -4.087 1.00 0.00 C ATOM 1753 CG2 VAL A 113 7.866 -2.848 -6.098 1.00 0.00 C ATOM 0 H VAL A 113 8.461 -0.163 -5.218 1.00 0.00 H new ATOM 0 HA VAL A 113 7.036 -2.045 -3.479 1.00 0.00 H new ATOM 0 HB VAL A 113 9.645 -2.438 -4.997 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.122 -4.839 -4.758 1.00 0.00 H new ATOM 0 HG12 VAL A 113 9.275 -4.029 -3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.664 -4.419 -3.828 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.331 -3.606 -6.729 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.830 -3.124 -5.903 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.895 -1.885 -6.607 1.00 0.00 H new ATOM 1763 N ILE A 114 8.678 -2.130 -1.562 1.00 0.00 N ATOM 1764 CA ILE A 114 9.502 -2.005 -0.360 1.00 0.00 C ATOM 1765 C ILE A 114 9.796 -3.380 0.236 1.00 0.00 C ATOM 1766 O ILE A 114 8.905 -4.226 0.334 1.00 0.00 O ATOM 1767 CB ILE A 114 8.826 -1.124 0.715 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.380 0.211 0.115 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.773 -0.888 1.884 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.383 0.959 0.975 1.00 0.00 C ATOM 0 H ILE A 114 7.904 -2.788 -1.471 1.00 0.00 H new ATOM 0 HA ILE A 114 10.433 -1.526 -0.664 1.00 0.00 H new ATOM 0 HB ILE A 114 7.944 -1.649 1.082 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.256 0.840 -0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.938 0.030 -0.865 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.281 -0.266 2.631 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.045 -1.844 2.330 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.672 -0.385 1.528 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.112 1.895 0.487 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.490 0.349 1.111 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.828 1.172 1.947 1.00 0.00 H new ATOM 1782 N SER A 115 11.051 -3.598 0.626 1.00 0.00 N ATOM 1783 CA SER A 115 11.463 -4.875 1.207 1.00 0.00 C ATOM 1784 C SER A 115 11.980 -4.713 2.642 1.00 0.00 C ATOM 1785 O SER A 115 12.083 -5.696 3.379 1.00 0.00 O ATOM 1786 CB SER A 115 12.539 -5.523 0.333 1.00 0.00 C ATOM 1787 OG SER A 115 12.824 -6.844 0.763 1.00 0.00 O ATOM 0 H SER A 115 11.799 -2.908 0.550 1.00 0.00 H new ATOM 0 HA SER A 115 10.584 -5.519 1.245 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.206 -5.540 -0.705 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.448 -4.923 0.367 1.00 0.00 H new ATOM 0 HG SER A 115 11.994 -7.365 0.792 1.00 0.00 H new ATOM 1793 N ASP A 116 12.297 -3.477 3.040 1.00 0.00 N ATOM 1794 CA ASP A 116 12.796 -3.207 4.389 1.00 0.00 C ATOM 1795 C ASP A 116 11.814 -2.343 5.173 1.00 0.00 C ATOM 1796 O ASP A 116 11.060 -1.558 4.594 1.00 0.00 O ATOM 1797 CB ASP A 116 14.167 -2.528 4.338 1.00 0.00 C ATOM 1798 CG ASP A 116 14.149 -1.230 3.556 1.00 0.00 C ATOM 1799 OD1 ASP A 116 14.214 -1.287 2.311 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.069 -0.160 4.190 1.00 0.00 O ATOM 0 H ASP A 116 12.217 -2.650 2.448 1.00 0.00 H new ATOM 0 HA ASP A 116 12.900 -4.164 4.900 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.508 -2.330 5.354 1.00 0.00 H new ATOM 0 HB3 ASP A 116 14.888 -3.209 3.887 1.00 0.00 H new ATOM 1805 N ARG A 117 11.830 -2.501 6.494 1.00 0.00 N ATOM 1806 CA ARG A 117 10.946 -1.753 7.380 1.00 0.00 C ATOM 1807 C ARG A 117 11.254 -0.247 7.378 1.00 0.00 C ATOM 1808 O ARG A 117 10.392 0.561 7.729 1.00 0.00 O ATOM 1809 CB ARG A 117 11.052 -2.309 8.800 1.00 0.00 C ATOM 1810 CG ARG A 117 12.458 -2.246 9.382 1.00 0.00 C ATOM 1811 CD ARG A 117 12.539 -1.268 10.544 1.00 0.00 C ATOM 1812 NE ARG A 117 13.051 -1.901 11.759 1.00 0.00 N ATOM 1813 CZ ARG A 117 12.938 -1.370 12.977 1.00 0.00 C ATOM 1814 NH1 ARG A 117 12.324 -0.203 13.149 1.00 0.00 N ATOM 1815 NH2 ARG A 117 13.439 -2.011 14.027 1.00 0.00 N ATOM 0 H ARG A 117 12.453 -3.148 6.977 1.00 0.00 H new ATOM 0 HA ARG A 117 9.928 -1.873 7.008 1.00 0.00 H new ATOM 0 HB2 ARG A 117 10.375 -1.753 9.449 1.00 0.00 H new ATOM 0 HB3 ARG A 117 10.715 -3.346 8.800 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.758 -3.238 9.719 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.161 -1.948 8.605 1.00 0.00 H new ATOM 0 HD2 ARG A 117 13.184 -0.433 10.271 1.00 0.00 H new ATOM 0 HD3 ARG A 117 11.549 -0.855 10.740 1.00 0.00 H new ATOM 0 HE ARG A 117 13.522 -2.801 11.669 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.936 0.292 12.346 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.241 0.197 14.084 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.909 -2.907 13.901 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.354 -1.607 14.960 1.00 0.00 H new ATOM 1829 N LYS A 118 12.478 0.130 6.987 1.00 0.00 N ATOM 1830 CA LYS A 118 12.868 1.544 6.952 1.00 0.00 C ATOM 1831 C LYS A 118 12.016 2.317 5.946 1.00 0.00 C ATOM 1832 O LYS A 118 11.374 3.309 6.299 1.00 0.00 O ATOM 1833 CB LYS A 118 14.355 1.695 6.598 1.00 0.00 C ATOM 1834 CG LYS A 118 15.028 2.897 7.250 1.00 0.00 C ATOM 1835 CD LYS A 118 14.563 4.213 6.637 1.00 0.00 C ATOM 1836 CE LYS A 118 14.052 5.177 7.699 1.00 0.00 C ATOM 1837 NZ LYS A 118 12.799 4.690 8.345 1.00 0.00 N ATOM 0 H LYS A 118 13.209 -0.518 6.693 1.00 0.00 H new ATOM 0 HA LYS A 118 12.701 1.958 7.947 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.883 0.789 6.897 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.454 1.779 5.516 1.00 0.00 H new ATOM 0 HG2 LYS A 118 14.812 2.898 8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 118 16.109 2.809 7.143 1.00 0.00 H new ATOM 0 HD2 LYS A 118 15.388 4.674 6.094 1.00 0.00 H new ATOM 0 HD3 LYS A 118 13.773 4.018 5.912 1.00 0.00 H new ATOM 0 HE2 LYS A 118 14.820 5.318 8.460 1.00 0.00 H new ATOM 0 HE3 LYS A 118 13.870 6.151 7.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 12.273 5.498 8.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 12.211 4.203 7.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 13.038 4.029 9.112 1.00 0.00 H new ATOM 1851 N GLU A 119 12.014 1.850 4.697 1.00 0.00 N ATOM 1852 CA GLU A 119 11.240 2.489 3.635 1.00 0.00 C ATOM 1853 C GLU A 119 9.745 2.201 3.794 1.00 0.00 C ATOM 1854 O GLU A 119 8.907 3.021 3.415 1.00 0.00 O ATOM 1855 CB GLU A 119 11.725 2.017 2.262 1.00 0.00 C ATOM 1856 CG GLU A 119 12.847 2.870 1.691 1.00 0.00 C ATOM 1857 CD GLU A 119 14.221 2.415 2.138 1.00 0.00 C ATOM 1858 OE1 GLU A 119 14.622 2.762 3.269 1.00 0.00 O ATOM 1859 OE2 GLU A 119 14.897 1.716 1.354 1.00 0.00 O ATOM 0 H GLU A 119 12.541 1.030 4.397 1.00 0.00 H new ATOM 0 HA GLU A 119 11.390 3.566 3.711 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.067 0.985 2.341 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.885 2.022 1.567 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.798 2.844 0.602 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.697 3.907 1.992 1.00 0.00 H new ATOM 1866 N LEU A 120 9.418 1.038 4.366 1.00 0.00 N ATOM 1867 CA LEU A 120 8.029 0.646 4.587 1.00 0.00 C ATOM 1868 C LEU A 120 7.381 1.530 5.656 1.00 0.00 C ATOM 1869 O LEU A 120 6.161 1.713 5.667 1.00 0.00 O ATOM 1870 CB LEU A 120 7.963 -0.838 4.988 1.00 0.00 C ATOM 1871 CG LEU A 120 6.827 -1.228 5.936 1.00 0.00 C ATOM 1872 CD1 LEU A 120 5.517 -1.373 5.174 1.00 0.00 C ATOM 1873 CD2 LEU A 120 7.167 -2.518 6.672 1.00 0.00 C ATOM 0 H LEU A 120 10.102 0.351 4.684 1.00 0.00 H new ATOM 0 HA LEU A 120 7.472 0.782 3.660 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.873 -1.435 4.081 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.909 -1.110 5.456 1.00 0.00 H new ATOM 0 HG LEU A 120 6.705 -0.434 6.672 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.722 -1.651 5.866 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.267 -0.426 4.696 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.622 -2.147 4.413 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.349 -2.781 7.342 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.317 -3.320 5.950 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.079 -2.377 7.252 1.00 0.00 H new ATOM 1885 N GLU A 121 8.210 2.080 6.548 1.00 0.00 N ATOM 1886 CA GLU A 121 7.736 2.948 7.615 1.00 0.00 C ATOM 1887 C GLU A 121 6.967 4.137 7.042 1.00 0.00 C ATOM 1888 O GLU A 121 7.382 4.741 6.050 1.00 0.00 O ATOM 1889 CB GLU A 121 8.918 3.441 8.455 1.00 0.00 C ATOM 1890 CG GLU A 121 8.516 4.043 9.792 1.00 0.00 C ATOM 1891 CD GLU A 121 9.702 4.582 10.569 1.00 0.00 C ATOM 1892 OE1 GLU A 121 10.406 5.469 10.041 1.00 0.00 O ATOM 1893 OE2 GLU A 121 9.928 4.115 11.705 1.00 0.00 O ATOM 0 H GLU A 121 9.220 1.934 6.546 1.00 0.00 H new ATOM 0 HA GLU A 121 7.061 2.376 8.251 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.597 2.607 8.633 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.471 4.187 7.884 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.801 4.848 9.623 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.009 3.286 10.390 1.00 0.00 H new ATOM 1900 N GLU A 122 5.845 4.458 7.676 1.00 0.00 N ATOM 1901 CA GLU A 122 4.998 5.570 7.242 1.00 0.00 C ATOM 1902 C GLU A 122 5.790 6.874 7.109 1.00 0.00 C ATOM 1903 O GLU A 122 5.457 7.724 6.282 1.00 0.00 O ATOM 1904 CB GLU A 122 3.841 5.769 8.222 1.00 0.00 C ATOM 1905 CG GLU A 122 2.772 6.722 7.713 1.00 0.00 C ATOM 1906 CD GLU A 122 1.394 6.396 8.255 1.00 0.00 C ATOM 1907 OE1 GLU A 122 0.682 5.587 7.625 1.00 0.00 O ATOM 1908 OE2 GLU A 122 1.028 6.951 9.313 1.00 0.00 O ATOM 0 H GLU A 122 5.497 3.963 8.497 1.00 0.00 H new ATOM 0 HA GLU A 122 4.606 5.313 6.258 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.384 4.802 8.433 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.235 6.148 9.165 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.037 7.742 7.993 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.748 6.687 6.624 1.00 0.00 H new ATOM 1915 N ASN A 123 6.840 7.025 7.918 1.00 0.00 N ATOM 1916 CA ASN A 123 7.676 8.219 7.882 1.00 0.00 C ATOM 1917 C ASN A 123 8.300 8.390 6.502 1.00 0.00 C ATOM 1918 O ASN A 123 8.269 9.477 5.923 1.00 0.00 O ATOM 1919 CB ASN A 123 8.775 8.124 8.943 1.00 0.00 C ATOM 1920 CG ASN A 123 8.272 8.449 10.338 1.00 0.00 C ATOM 1921 OD1 ASN A 123 7.602 7.636 10.973 1.00 0.00 O ATOM 1922 ND2 ASN A 123 8.597 9.643 10.823 1.00 0.00 N ATOM 0 H ASN A 123 7.130 6.331 8.607 1.00 0.00 H new ATOM 0 HA ASN A 123 7.051 9.086 8.094 1.00 0.00 H new ATOM 0 HB2 ASN A 123 9.194 7.118 8.937 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.584 8.807 8.685 1.00 0.00 H new ATOM 0 HD21 ASN A 123 8.289 9.915 11.756 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.155 10.287 10.262 1.00 0.00 H new ATOM 1929 N PHE A 124 8.855 7.298 5.980 1.00 0.00 N ATOM 1930 CA PHE A 124 9.480 7.306 4.665 1.00 0.00 C ATOM 1931 C PHE A 124 8.434 7.498 3.566 1.00 0.00 C ATOM 1932 O PHE A 124 8.602 8.341 2.682 1.00 0.00 O ATOM 1933 CB PHE A 124 10.250 6.004 4.441 1.00 0.00 C ATOM 1934 CG PHE A 124 11.147 6.044 3.237 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.634 5.825 1.969 1.00 0.00 C ATOM 1936 CD2 PHE A 124 12.501 6.310 3.373 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.452 5.871 0.858 1.00 0.00 C ATOM 1938 CE2 PHE A 124 13.325 6.357 2.264 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.800 6.136 1.005 1.00 0.00 C ATOM 0 H PHE A 124 8.883 6.394 6.452 1.00 0.00 H new ATOM 0 HA PHE A 124 10.177 8.143 4.621 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.850 5.788 5.325 1.00 0.00 H new ATOM 0 HB3 PHE A 124 9.540 5.185 4.329 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.581 5.616 1.848 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.916 6.482 4.355 1.00 0.00 H new ATOM 0 HE1 PHE A 124 11.039 5.700 -0.125 1.00 0.00 H new ATOM 0 HE2 PHE A 124 14.378 6.566 2.381 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.442 6.170 0.137 1.00 0.00 H new ATOM 1949 N ILE A 125 7.352 6.718 3.638 1.00 0.00 N ATOM 1950 CA ILE A 125 6.268 6.803 2.656 1.00 0.00 C ATOM 1951 C ILE A 125 5.740 8.234 2.550 1.00 0.00 C ATOM 1952 O ILE A 125 5.513 8.741 1.451 1.00 0.00 O ATOM 1953 CB ILE A 125 5.097 5.857 3.020 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.602 4.423 3.219 1.00 0.00 C ATOM 1955 CG2 ILE A 125 4.021 5.893 1.942 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.549 3.480 3.764 1.00 0.00 C ATOM 0 H ILE A 125 7.203 6.020 4.367 1.00 0.00 H new ATOM 0 HA ILE A 125 6.683 6.496 1.696 1.00 0.00 H new ATOM 0 HB ILE A 125 4.660 6.204 3.957 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.964 4.038 2.265 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.453 4.437 3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.208 5.222 2.217 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.636 6.908 1.846 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.448 5.575 0.991 1.00 0.00 H new ATOM 0 HD11 ILE A 125 4.977 2.484 3.879 1.00 0.00 H new ATOM 0 HD12 ILE A 125 4.204 3.841 4.733 1.00 0.00 H new ATOM 0 HD13 ILE A 125 3.707 3.436 3.073 1.00 0.00 H new ATOM 1968 N LYS A 126 5.557 8.877 3.706 1.00 0.00 N ATOM 1969 CA LYS A 126 5.065 10.254 3.763 1.00 0.00 C ATOM 1970 C LYS A 126 5.960 11.194 2.956 1.00 0.00 C ATOM 1971 O LYS A 126 5.468 12.052 2.222 1.00 0.00 O ATOM 1972 CB LYS A 126 4.993 10.729 5.217 1.00 0.00 C ATOM 1973 CG LYS A 126 3.589 11.084 5.680 1.00 0.00 C ATOM 1974 CD LYS A 126 3.604 11.701 7.070 1.00 0.00 C ATOM 1975 CE LYS A 126 3.108 13.140 7.052 1.00 0.00 C ATOM 1976 NZ LYS A 126 3.926 14.022 7.934 1.00 0.00 N ATOM 0 H LYS A 126 5.744 8.463 4.619 1.00 0.00 H new ATOM 0 HA LYS A 126 4.066 10.272 3.326 1.00 0.00 H new ATOM 0 HB2 LYS A 126 5.392 9.948 5.864 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.636 11.601 5.336 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.137 11.782 4.975 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.968 10.188 5.684 1.00 0.00 H new ATOM 0 HD2 LYS A 126 2.979 11.109 7.738 1.00 0.00 H new ATOM 0 HD3 LYS A 126 4.617 11.670 7.471 1.00 0.00 H new ATOM 0 HE2 LYS A 126 3.136 13.521 6.031 1.00 0.00 H new ATOM 0 HE3 LYS A 126 2.067 13.169 7.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 3.556 14.993 7.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 3.879 13.674 8.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 4.915 14.015 7.611 1.00 0.00 H new ATOM 1990 N SER A 127 7.276 11.020 3.098 1.00 0.00 N ATOM 1991 CA SER A 127 8.247 11.848 2.384 1.00 0.00 C ATOM 1992 C SER A 127 8.155 11.615 0.876 1.00 0.00 C ATOM 1993 O SER A 127 8.109 12.569 0.097 1.00 0.00 O ATOM 1994 CB SER A 127 9.665 11.545 2.874 1.00 0.00 C ATOM 1995 OG SER A 127 10.479 12.704 2.828 1.00 0.00 O ATOM 0 H SER A 127 7.693 10.312 3.702 1.00 0.00 H new ATOM 0 HA SER A 127 8.016 12.894 2.587 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.627 11.164 3.894 1.00 0.00 H new ATOM 0 HB3 SER A 127 10.107 10.762 2.258 1.00 0.00 H new ATOM 0 HG SER A 127 11.379 12.485 3.148 1.00 0.00 H new ATOM 2001 N GLU A 128 8.125 10.343 0.476 1.00 0.00 N ATOM 2002 CA GLU A 128 8.033 9.978 -0.937 1.00 0.00 C ATOM 2003 C GLU A 128 6.749 10.522 -1.564 1.00 0.00 C ATOM 2004 O GLU A 128 6.768 11.038 -2.680 1.00 0.00 O ATOM 2005 CB GLU A 128 8.090 8.458 -1.100 1.00 0.00 C ATOM 2006 CG GLU A 128 8.250 8.005 -2.543 1.00 0.00 C ATOM 2007 CD GLU A 128 9.186 6.821 -2.687 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.365 6.941 -2.291 1.00 0.00 O ATOM 2009 OE2 GLU A 128 8.741 5.773 -3.198 1.00 0.00 O ATOM 0 H GLU A 128 8.163 9.547 1.113 1.00 0.00 H new ATOM 0 HA GLU A 128 8.883 10.424 -1.454 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.921 8.069 -0.512 1.00 0.00 H new ATOM 0 HB3 GLU A 128 7.178 8.023 -0.690 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.273 7.741 -2.946 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.627 8.835 -3.140 1.00 0.00 H new ATOM 2016 N LEU A 129 5.638 10.404 -0.837 1.00 0.00 N ATOM 2017 CA LEU A 129 4.346 10.886 -1.320 1.00 0.00 C ATOM 2018 C LEU A 129 4.302 12.416 -1.354 1.00 0.00 C ATOM 2019 O LEU A 129 3.629 13.004 -2.203 1.00 0.00 O ATOM 2020 CB LEU A 129 3.213 10.353 -0.437 1.00 0.00 C ATOM 2021 CG LEU A 129 1.804 10.524 -1.014 1.00 0.00 C ATOM 2022 CD1 LEU A 129 0.961 9.286 -0.748 1.00 0.00 C ATOM 2023 CD2 LEU A 129 1.136 11.760 -0.433 1.00 0.00 C ATOM 0 H LEU A 129 5.608 9.978 0.089 1.00 0.00 H new ATOM 0 HA LEU A 129 4.213 10.516 -2.337 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.386 9.293 -0.251 1.00 0.00 H new ATOM 0 HB3 LEU A 129 3.257 10.858 0.528 1.00 0.00 H new ATOM 0 HG LEU A 129 1.889 10.654 -2.093 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.036 9.428 -1.166 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.430 8.419 -1.214 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.884 9.122 0.327 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.136 11.865 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.065 11.660 0.650 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.728 12.642 -0.678 1.00 0.00 H new ATOM 2035 N LYS A 130 5.016 13.053 -0.423 1.00 0.00 N ATOM 2036 CA LYS A 130 5.056 14.512 -0.339 1.00 0.00 C ATOM 2037 C LYS A 130 5.536 15.142 -1.648 1.00 0.00 C ATOM 2038 O LYS A 130 4.811 15.923 -2.267 1.00 0.00 O ATOM 2039 CB LYS A 130 5.963 14.955 0.815 1.00 0.00 C ATOM 2040 CG LYS A 130 5.456 16.183 1.555 1.00 0.00 C ATOM 2041 CD LYS A 130 5.500 17.425 0.679 1.00 0.00 C ATOM 2042 CE LYS A 130 5.457 18.697 1.510 1.00 0.00 C ATOM 2043 NZ LYS A 130 6.780 19.014 2.119 1.00 0.00 N ATOM 0 H LYS A 130 5.576 12.578 0.285 1.00 0.00 H new ATOM 0 HA LYS A 130 4.039 14.856 -0.153 1.00 0.00 H new ATOM 0 HB2 LYS A 130 6.064 14.132 1.522 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.959 15.163 0.423 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.433 16.010 1.890 1.00 0.00 H new ATOM 0 HG3 LYS A 130 6.060 16.345 2.447 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.408 17.414 0.076 1.00 0.00 H new ATOM 0 HD3 LYS A 130 4.658 17.413 -0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 130 5.139 19.529 0.882 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.712 18.589 2.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.705 19.889 2.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 7.073 18.232 2.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.487 19.143 1.367 1.00 0.00 H new