USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 836 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0296 USER MOD Single : A 6 SER OG : rot 180:sc= 0.0928 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 12 ASN : amide:sc= -0.107 K(o=-0.11,f=-1.2!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 16 THR OG1 : rot -170:sc= 0.108 USER MOD Single : A 22 ASN : amide:sc= 0.0496 X(o=0.05,f=-0.13) USER MOD Single : A 25 CYS SG : rot 27:sc= 0.731 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 18:sc= 0.0443 USER MOD Single : A 43 HIS : no HD1:sc= -0.122 X(o=-0.12,f=-0.46) USER MOD Single : A 46 THR OG1 : rot 180:sc=0.000367 USER MOD Single : A 48 SER OG : rot 180:sc= 0.0728 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 154:sc= 0.176 (180deg=0.0342) USER MOD Single : A 61 SER OG : rot -77:sc= 0.0796 USER MOD Single : A 67 SER OG : rot 180:sc= -0.157 USER MOD Single : A 75 LYS NZ :NH3+ -168:sc=-0.00936 (180deg=-0.26) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0724 K(o=-0.072,f=-0.96) USER MOD Single : A 93 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.737 -4.374 -7.360 1.00 0.00 N ATOM 2 CA GLY A 1 -17.526 -4.302 -8.576 1.00 0.00 C ATOM 3 C GLY A 1 -17.055 -5.283 -9.632 1.00 0.00 C ATOM 4 O GLY A 1 -17.819 -6.137 -10.080 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.099 -3.685 -6.670 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.803 -5.332 -6.960 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.743 -4.157 -7.578 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.571 -4.502 -8.340 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.478 -3.290 -8.977 1.00 0.00 H new ATOM 8 N SER A 2 -15.793 -5.159 -10.031 1.00 0.00 N ATOM 9 CA SER A 2 -15.223 -6.038 -11.045 1.00 0.00 C ATOM 10 C SER A 2 -13.741 -5.739 -11.252 1.00 0.00 C ATOM 11 O SER A 2 -12.900 -6.634 -11.176 1.00 0.00 O ATOM 12 CB SER A 2 -15.976 -5.881 -12.368 1.00 0.00 C ATOM 13 OG SER A 2 -15.104 -6.045 -13.473 1.00 0.00 O ATOM 0 H SER A 2 -15.146 -4.459 -9.668 1.00 0.00 H new ATOM 0 HA SER A 2 -15.324 -7.066 -10.697 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.779 -6.616 -12.422 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.441 -4.896 -12.411 1.00 0.00 H new ATOM 0 HG SER A 2 -15.609 -5.942 -14.306 1.00 0.00 H new ATOM 19 N SER A 3 -13.430 -4.474 -11.513 1.00 0.00 N ATOM 20 CA SER A 3 -12.050 -4.056 -11.735 1.00 0.00 C ATOM 21 C SER A 3 -11.825 -2.634 -11.228 1.00 0.00 C ATOM 22 O SER A 3 -12.764 -1.847 -11.117 1.00 0.00 O ATOM 23 CB SER A 3 -11.702 -4.141 -13.222 1.00 0.00 C ATOM 24 OG SER A 3 -12.467 -3.218 -13.978 1.00 0.00 O ATOM 0 H SER A 3 -14.114 -3.720 -11.576 1.00 0.00 H new ATOM 0 HA SER A 3 -11.398 -4.729 -11.178 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.640 -3.939 -13.362 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.885 -5.153 -13.584 1.00 0.00 H new ATOM 0 HG SER A 3 -12.225 -3.291 -14.925 1.00 0.00 H new ATOM 30 N GLY A 4 -10.572 -2.313 -10.923 1.00 0.00 N ATOM 31 CA GLY A 4 -10.245 -0.987 -10.432 1.00 0.00 C ATOM 32 C GLY A 4 -10.363 0.075 -11.507 1.00 0.00 C ATOM 33 O GLY A 4 -10.932 -0.170 -12.571 1.00 0.00 O ATOM 0 H GLY A 4 -9.777 -2.947 -11.007 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.908 -0.736 -9.604 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.229 -0.989 -10.038 1.00 0.00 H new ATOM 37 N SER A 5 -9.826 1.259 -11.230 1.00 0.00 N ATOM 38 CA SER A 5 -9.879 2.364 -12.179 1.00 0.00 C ATOM 39 C SER A 5 -8.983 2.090 -13.383 1.00 0.00 C ATOM 40 O SER A 5 -7.770 2.289 -13.326 1.00 0.00 O ATOM 41 CB SER A 5 -9.455 3.668 -11.500 1.00 0.00 C ATOM 42 OG SER A 5 -8.860 4.557 -12.430 1.00 0.00 O ATOM 0 H SER A 5 -9.349 1.477 -10.355 1.00 0.00 H new ATOM 0 HA SER A 5 -10.907 2.462 -12.528 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.323 4.143 -11.043 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.750 3.451 -10.697 1.00 0.00 H new ATOM 0 HG SER A 5 -8.599 5.383 -11.972 1.00 0.00 H new ATOM 48 N SER A 6 -9.591 1.631 -14.473 1.00 0.00 N ATOM 49 CA SER A 6 -8.849 1.324 -15.690 1.00 0.00 C ATOM 50 C SER A 6 -8.055 2.539 -16.162 1.00 0.00 C ATOM 51 O SER A 6 -8.471 3.680 -15.968 1.00 0.00 O ATOM 52 CB SER A 6 -9.804 0.865 -16.793 1.00 0.00 C ATOM 53 OG SER A 6 -11.125 1.311 -16.541 1.00 0.00 O ATOM 0 H SER A 6 -10.595 1.464 -14.538 1.00 0.00 H new ATOM 0 HA SER A 6 -8.150 0.518 -15.467 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.465 1.248 -17.755 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.791 -0.223 -16.861 1.00 0.00 H new ATOM 0 HG SER A 6 -11.716 1.006 -17.261 1.00 0.00 H new ATOM 59 N GLY A 7 -6.908 2.283 -16.784 1.00 0.00 N ATOM 60 CA GLY A 7 -6.073 3.364 -17.275 1.00 0.00 C ATOM 61 C GLY A 7 -4.807 3.535 -16.459 1.00 0.00 C ATOM 62 O GLY A 7 -4.802 3.301 -15.250 1.00 0.00 O ATOM 0 H GLY A 7 -6.542 1.347 -16.957 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.808 3.171 -18.315 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.641 4.294 -17.258 1.00 0.00 H new ATOM 66 N LYS A 8 -3.729 3.943 -17.120 1.00 0.00 N ATOM 67 CA LYS A 8 -2.451 4.145 -16.449 1.00 0.00 C ATOM 68 C LYS A 8 -1.787 5.435 -16.920 1.00 0.00 C ATOM 69 O LYS A 8 -2.182 6.014 -17.933 1.00 0.00 O ATOM 70 CB LYS A 8 -1.522 2.957 -16.708 1.00 0.00 C ATOM 71 CG LYS A 8 -1.848 1.734 -15.868 1.00 0.00 C ATOM 72 CD LYS A 8 -0.662 1.307 -15.020 1.00 0.00 C ATOM 73 CE LYS A 8 -1.108 0.536 -13.787 1.00 0.00 C ATOM 74 NZ LYS A 8 -0.226 -0.632 -13.515 1.00 0.00 N ATOM 0 H LYS A 8 -3.715 4.140 -18.121 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.640 4.224 -15.378 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -1.576 2.688 -17.763 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.494 3.260 -16.509 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -2.699 1.952 -15.222 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -2.145 0.912 -16.520 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.008 0.687 -15.616 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -0.096 2.187 -14.715 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -1.107 1.201 -12.923 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.133 0.193 -13.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.563 -1.131 -12.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -0.246 -1.279 -14.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 0.748 -0.303 -13.359 1.00 0.00 H new ATOM 88 N TYR A 9 -0.777 5.879 -16.181 1.00 0.00 N ATOM 89 CA TYR A 9 -0.059 7.102 -16.523 1.00 0.00 C ATOM 90 C TYR A 9 1.449 6.887 -16.448 1.00 0.00 C ATOM 91 O TYR A 9 1.922 5.916 -15.856 1.00 0.00 O ATOM 92 CB TYR A 9 -0.471 8.239 -15.587 1.00 0.00 C ATOM 93 CG TYR A 9 -1.372 9.263 -16.238 1.00 0.00 C ATOM 94 CD1 TYR A 9 -2.628 8.909 -16.717 1.00 0.00 C ATOM 95 CD2 TYR A 9 -0.969 10.586 -16.374 1.00 0.00 C ATOM 96 CE1 TYR A 9 -3.454 9.842 -17.313 1.00 0.00 C ATOM 97 CE2 TYR A 9 -1.789 11.526 -16.968 1.00 0.00 C ATOM 98 CZ TYR A 9 -3.030 11.148 -17.436 1.00 0.00 C ATOM 99 OH TYR A 9 -3.851 12.081 -18.029 1.00 0.00 O ATOM 0 H TYR A 9 -0.436 5.411 -15.341 1.00 0.00 H new ATOM 0 HA TYR A 9 -0.319 7.372 -17.547 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -0.980 7.818 -14.720 1.00 0.00 H new ATOM 0 HB3 TYR A 9 0.425 8.738 -15.219 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -2.964 7.887 -16.622 1.00 0.00 H new ATOM 0 HD2 TYR A 9 0.003 10.885 -16.009 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -4.427 9.550 -17.681 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -1.460 12.550 -17.065 1.00 0.00 H new ATOM 0 HH TYR A 9 -3.404 12.953 -18.036 1.00 0.00 H new ATOM 109 N THR A 10 2.202 7.801 -17.053 1.00 0.00 N ATOM 110 CA THR A 10 3.657 7.713 -17.056 1.00 0.00 C ATOM 111 C THR A 10 4.125 6.371 -17.605 1.00 0.00 C ATOM 112 O THR A 10 4.542 5.493 -16.849 1.00 0.00 O ATOM 113 CB THR A 10 4.234 7.906 -15.641 1.00 0.00 C ATOM 114 OG1 THR A 10 3.542 8.965 -14.970 1.00 0.00 O ATOM 115 CG2 THR A 10 5.721 8.224 -15.702 1.00 0.00 C ATOM 0 H THR A 10 1.828 8.611 -17.547 1.00 0.00 H new ATOM 0 HA THR A 10 4.021 8.513 -17.701 1.00 0.00 H new ATOM 0 HB THR A 10 4.099 6.977 -15.088 1.00 0.00 H new ATOM 0 HG1 THR A 10 3.914 9.080 -14.071 1.00 0.00 H new ATOM 0 HG21 THR A 10 6.107 8.356 -14.691 1.00 0.00 H new ATOM 0 HG22 THR A 10 6.249 7.403 -16.187 1.00 0.00 H new ATOM 0 HG23 THR A 10 5.874 9.141 -16.271 1.00 0.00 H new ATOM 123 N GLN A 11 4.055 6.218 -18.923 1.00 0.00 N ATOM 124 CA GLN A 11 4.472 4.981 -19.572 1.00 0.00 C ATOM 125 C GLN A 11 4.734 5.207 -21.058 1.00 0.00 C ATOM 126 O GLN A 11 3.939 5.845 -21.748 1.00 0.00 O ATOM 127 CB GLN A 11 3.407 3.899 -19.388 1.00 0.00 C ATOM 128 CG GLN A 11 3.856 2.748 -18.502 1.00 0.00 C ATOM 129 CD GLN A 11 3.580 1.393 -19.122 1.00 0.00 C ATOM 130 OE1 GLN A 11 4.072 1.081 -20.207 1.00 0.00 O ATOM 131 NE2 GLN A 11 2.789 0.577 -18.435 1.00 0.00 N ATOM 0 H GLN A 11 3.713 6.935 -19.563 1.00 0.00 H new ATOM 0 HA GLN A 11 5.400 4.650 -19.105 1.00 0.00 H new ATOM 0 HB2 GLN A 11 2.513 4.350 -18.958 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.127 3.506 -20.366 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.924 2.842 -18.304 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.346 2.814 -17.541 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.402 0.876 -17.540 1.00 0.00 H new ATOM 0 HE22 GLN A 11 2.568 -0.348 -18.803 1.00 0.00 H new ATOM 140 N ASN A 12 5.853 4.681 -21.544 1.00 0.00 N ATOM 141 CA ASN A 12 6.219 4.826 -22.948 1.00 0.00 C ATOM 142 C ASN A 12 6.510 3.467 -23.578 1.00 0.00 C ATOM 143 O ASN A 12 5.857 3.065 -24.539 1.00 0.00 O ATOM 144 CB ASN A 12 7.441 5.737 -23.086 1.00 0.00 C ATOM 145 CG ASN A 12 7.060 7.197 -23.231 1.00 0.00 C ATOM 146 OD1 ASN A 12 5.887 7.558 -23.127 1.00 0.00 O ATOM 147 ND2 ASN A 12 8.052 8.046 -23.474 1.00 0.00 N ATOM 0 H ASN A 12 6.522 4.150 -20.986 1.00 0.00 H new ATOM 0 HA ASN A 12 5.377 5.277 -23.473 1.00 0.00 H new ATOM 0 HB2 ASN A 12 8.081 5.616 -22.212 1.00 0.00 H new ATOM 0 HB3 ASN A 12 8.025 5.429 -23.954 1.00 0.00 H new ATOM 0 HD21 ASN A 12 7.857 9.041 -23.582 1.00 0.00 H new ATOM 0 HD22 ASN A 12 9.009 7.703 -23.552 1.00 0.00 H new ATOM 154 N ASN A 13 7.495 2.765 -23.027 1.00 0.00 N ATOM 155 CA ASN A 13 7.873 1.451 -23.535 1.00 0.00 C ATOM 156 C ASN A 13 8.672 0.674 -22.493 1.00 0.00 C ATOM 157 O ASN A 13 9.593 -0.070 -22.829 1.00 0.00 O ATOM 158 CB ASN A 13 8.691 1.593 -24.820 1.00 0.00 C ATOM 159 CG ASN A 13 8.387 0.498 -25.824 1.00 0.00 C ATOM 160 OD1 ASN A 13 7.242 0.326 -26.243 1.00 0.00 O ATOM 161 ND2 ASN A 13 9.413 -0.249 -26.214 1.00 0.00 N ATOM 0 H ASN A 13 8.045 3.084 -22.230 1.00 0.00 H new ATOM 0 HA ASN A 13 6.960 0.897 -23.754 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.486 2.563 -25.272 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.753 1.573 -24.575 1.00 0.00 H new ATOM 0 HD21 ASN A 13 9.269 -1.001 -26.887 1.00 0.00 H new ATOM 0 HD22 ASN A 13 10.345 -0.070 -25.840 1.00 0.00 H new ATOM 168 N PHE A 14 8.312 0.852 -21.226 1.00 0.00 N ATOM 169 CA PHE A 14 8.995 0.168 -20.134 1.00 0.00 C ATOM 170 C PHE A 14 8.058 -0.813 -19.436 1.00 0.00 C ATOM 171 O PHE A 14 6.845 -0.606 -19.393 1.00 0.00 O ATOM 172 CB PHE A 14 9.531 1.185 -19.124 1.00 0.00 C ATOM 173 CG PHE A 14 10.555 2.121 -19.701 1.00 0.00 C ATOM 174 CD1 PHE A 14 10.166 3.198 -20.480 1.00 0.00 C ATOM 175 CD2 PHE A 14 11.905 1.923 -19.464 1.00 0.00 C ATOM 176 CE1 PHE A 14 11.106 4.060 -21.013 1.00 0.00 C ATOM 177 CE2 PHE A 14 12.850 2.782 -19.994 1.00 0.00 C ATOM 178 CZ PHE A 14 12.449 3.853 -20.769 1.00 0.00 C ATOM 0 H PHE A 14 7.551 1.464 -20.930 1.00 0.00 H new ATOM 0 HA PHE A 14 9.830 -0.392 -20.555 1.00 0.00 H new ATOM 0 HB2 PHE A 14 8.698 1.768 -18.731 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.972 0.651 -18.282 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.117 3.366 -20.673 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.223 1.088 -18.858 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.790 4.895 -21.620 1.00 0.00 H new ATOM 0 HE2 PHE A 14 13.900 2.616 -19.802 1.00 0.00 H new ATOM 0 HZ PHE A 14 13.184 4.527 -21.183 1.00 0.00 H new ATOM 188 N ILE A 15 8.630 -1.882 -18.891 1.00 0.00 N ATOM 189 CA ILE A 15 7.847 -2.895 -18.195 1.00 0.00 C ATOM 190 C ILE A 15 8.301 -3.041 -16.746 1.00 0.00 C ATOM 191 O ILE A 15 9.496 -3.009 -16.452 1.00 0.00 O ATOM 192 CB ILE A 15 7.948 -4.263 -18.893 1.00 0.00 C ATOM 193 CG1 ILE A 15 6.979 -5.260 -18.254 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.375 -4.787 -18.827 1.00 0.00 C ATOM 195 CD1 ILE A 15 6.983 -6.619 -18.919 1.00 0.00 C ATOM 0 H ILE A 15 9.632 -2.068 -18.918 1.00 0.00 H new ATOM 0 HA ILE A 15 6.809 -2.562 -18.217 1.00 0.00 H new ATOM 0 HB ILE A 15 7.674 -4.140 -19.941 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.235 -5.379 -17.201 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.970 -4.849 -18.292 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.430 -5.755 -19.325 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.044 -4.084 -19.324 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.674 -4.897 -17.785 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.273 -7.273 -18.414 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.697 -6.513 -19.966 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.982 -7.051 -18.858 1.00 0.00 H new ATOM 207 N THR A 16 7.338 -3.204 -15.844 1.00 0.00 N ATOM 208 CA THR A 16 7.638 -3.357 -14.426 1.00 0.00 C ATOM 209 C THR A 16 8.405 -4.648 -14.161 1.00 0.00 C ATOM 210 O THR A 16 8.353 -5.586 -14.956 1.00 0.00 O ATOM 211 CB THR A 16 6.353 -3.353 -13.576 1.00 0.00 C ATOM 212 OG1 THR A 16 5.204 -3.271 -14.426 1.00 0.00 O ATOM 213 CG2 THR A 16 6.353 -2.186 -12.600 1.00 0.00 C ATOM 0 H THR A 16 6.344 -3.233 -16.071 1.00 0.00 H new ATOM 0 HA THR A 16 8.256 -2.506 -14.141 1.00 0.00 H new ATOM 0 HB THR A 16 6.317 -4.282 -13.007 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.405 -3.110 -13.882 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.436 -2.204 -12.011 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.213 -2.268 -11.935 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.410 -1.249 -13.154 1.00 0.00 H new ATOM 221 N GLY A 17 9.117 -4.689 -13.039 1.00 0.00 N ATOM 222 CA GLY A 17 9.884 -5.870 -12.690 1.00 0.00 C ATOM 223 C GLY A 17 9.003 -7.072 -12.413 1.00 0.00 C ATOM 224 O GLY A 17 9.052 -8.067 -13.138 1.00 0.00 O ATOM 0 H GLY A 17 9.176 -3.925 -12.366 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.571 -6.106 -13.502 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.492 -5.658 -11.810 1.00 0.00 H new ATOM 228 N VAL A 18 8.196 -6.983 -11.361 1.00 0.00 N ATOM 229 CA VAL A 18 7.301 -8.073 -10.990 1.00 0.00 C ATOM 230 C VAL A 18 6.451 -8.515 -12.176 1.00 0.00 C ATOM 231 O VAL A 18 6.127 -9.694 -12.315 1.00 0.00 O ATOM 232 CB VAL A 18 6.371 -7.665 -9.831 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.512 -6.475 -10.228 1.00 0.00 C ATOM 234 CG2 VAL A 18 5.504 -8.841 -9.406 1.00 0.00 C ATOM 0 H VAL A 18 8.143 -6.168 -10.750 1.00 0.00 H new ATOM 0 HA VAL A 18 7.930 -8.903 -10.668 1.00 0.00 H new ATOM 0 HB VAL A 18 6.986 -7.370 -8.981 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.862 -6.202 -9.397 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.154 -5.631 -10.479 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.903 -6.738 -11.093 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.853 -8.536 -8.587 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.896 -9.169 -10.249 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.141 -9.662 -9.077 1.00 0.00 H new ATOM 244 N ARG A 19 6.095 -7.560 -13.030 1.00 0.00 N ATOM 245 CA ARG A 19 5.282 -7.851 -14.205 1.00 0.00 C ATOM 246 C ARG A 19 5.994 -8.836 -15.128 1.00 0.00 C ATOM 247 O ARG A 19 5.378 -9.758 -15.661 1.00 0.00 O ATOM 248 CB ARG A 19 4.966 -6.561 -14.964 1.00 0.00 C ATOM 249 CG ARG A 19 3.521 -6.112 -14.827 1.00 0.00 C ATOM 250 CD ARG A 19 2.843 -5.992 -16.183 1.00 0.00 C ATOM 251 NE ARG A 19 3.172 -4.735 -16.850 1.00 0.00 N ATOM 252 CZ ARG A 19 2.602 -3.573 -16.552 1.00 0.00 C ATOM 253 NH1 ARG A 19 1.678 -3.509 -15.602 1.00 0.00 N ATOM 254 NH2 ARG A 19 2.955 -2.473 -17.203 1.00 0.00 N ATOM 0 H ARG A 19 6.357 -6.579 -12.930 1.00 0.00 H new ATOM 0 HA ARG A 19 4.350 -8.304 -13.868 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.620 -5.767 -14.603 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.194 -6.706 -16.020 1.00 0.00 H new ATOM 0 HG2 ARG A 19 2.975 -6.824 -14.208 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.485 -5.151 -14.315 1.00 0.00 H new ATOM 0 HD2 ARG A 19 3.145 -6.827 -16.815 1.00 0.00 H new ATOM 0 HD3 ARG A 19 1.763 -6.063 -16.056 1.00 0.00 H new ATOM 0 HE ARG A 19 3.879 -4.750 -17.585 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.404 -4.353 -15.099 1.00 0.00 H new ATOM 0 HH12 ARG A 19 1.241 -2.616 -15.375 1.00 0.00 H new ATOM 0 HH21 ARG A 19 3.665 -2.519 -17.934 1.00 0.00 H new ATOM 0 HH22 ARG A 19 2.516 -1.581 -16.973 1.00 0.00 H new ATOM 268 N ALA A 20 7.294 -8.632 -15.313 1.00 0.00 N ATOM 269 CA ALA A 20 8.090 -9.502 -16.170 1.00 0.00 C ATOM 270 C ALA A 20 8.365 -10.840 -15.490 1.00 0.00 C ATOM 271 O ALA A 20 8.323 -11.891 -16.130 1.00 0.00 O ATOM 272 CB ALA A 20 9.397 -8.821 -16.546 1.00 0.00 C ATOM 0 H ALA A 20 7.819 -7.871 -14.881 1.00 0.00 H new ATOM 0 HA ALA A 20 7.520 -9.696 -17.079 1.00 0.00 H new ATOM 0 HB1 ALA A 20 9.981 -9.482 -17.186 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.184 -7.895 -17.080 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.964 -8.597 -15.642 1.00 0.00 H new ATOM 278 N ILE A 21 8.646 -10.792 -14.193 1.00 0.00 N ATOM 279 CA ILE A 21 8.927 -12.000 -13.428 1.00 0.00 C ATOM 280 C ILE A 21 7.747 -12.964 -13.469 1.00 0.00 C ATOM 281 O ILE A 21 7.917 -14.176 -13.339 1.00 0.00 O ATOM 282 CB ILE A 21 9.257 -11.673 -11.959 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.449 -10.716 -11.882 1.00 0.00 C ATOM 284 CG2 ILE A 21 9.545 -12.950 -11.184 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.616 -10.068 -10.526 1.00 0.00 C ATOM 0 H ILE A 21 8.685 -9.930 -13.650 1.00 0.00 H new ATOM 0 HA ILE A 21 9.794 -12.471 -13.891 1.00 0.00 H new ATOM 0 HB ILE A 21 8.393 -11.184 -11.508 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.359 -11.262 -12.130 1.00 0.00 H new ATOM 0 HG13 ILE A 21 10.329 -9.938 -12.636 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.776 -12.703 -10.148 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.670 -13.600 -11.215 1.00 0.00 H new ATOM 0 HG23 ILE A 21 10.395 -13.464 -11.633 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.480 -9.403 -10.544 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.721 -9.494 -10.284 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.768 -10.839 -9.771 1.00 0.00 H new ATOM 297 N ASN A 22 6.549 -12.417 -13.653 1.00 0.00 N ATOM 298 CA ASN A 22 5.339 -13.229 -13.713 1.00 0.00 C ATOM 299 C ASN A 22 5.028 -13.636 -15.150 1.00 0.00 C ATOM 300 O ASN A 22 4.796 -14.810 -15.437 1.00 0.00 O ATOM 301 CB ASN A 22 4.155 -12.462 -13.120 1.00 0.00 C ATOM 302 CG ASN A 22 4.104 -12.559 -11.608 1.00 0.00 C ATOM 303 OD1 ASN A 22 3.706 -13.584 -11.053 1.00 0.00 O ATOM 304 ND2 ASN A 22 4.505 -11.488 -10.933 1.00 0.00 N ATOM 0 H ASN A 22 6.391 -11.415 -13.763 1.00 0.00 H new ATOM 0 HA ASN A 22 5.508 -14.132 -13.127 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.221 -11.414 -13.412 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.227 -12.852 -13.538 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.491 -11.493 -9.913 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.827 -10.660 -11.434 1.00 0.00 H new ATOM 311 N GLU A 23 5.025 -12.656 -16.049 1.00 0.00 N ATOM 312 CA GLU A 23 4.742 -12.913 -17.457 1.00 0.00 C ATOM 313 C GLU A 23 5.785 -13.849 -18.060 1.00 0.00 C ATOM 314 O GLU A 23 5.457 -14.931 -18.546 1.00 0.00 O ATOM 315 CB GLU A 23 4.707 -11.599 -18.240 1.00 0.00 C ATOM 316 CG GLU A 23 3.465 -10.765 -17.974 1.00 0.00 C ATOM 317 CD GLU A 23 2.873 -10.179 -19.241 1.00 0.00 C ATOM 318 OE1 GLU A 23 2.406 -10.960 -20.095 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.878 -8.937 -19.378 1.00 0.00 O ATOM 0 H GLU A 23 5.215 -11.679 -15.828 1.00 0.00 H new ATOM 0 HA GLU A 23 3.766 -13.394 -17.523 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.590 -11.012 -17.987 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.765 -11.819 -19.306 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.716 -11.383 -17.480 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.715 -9.957 -17.287 1.00 0.00 H new ATOM 326 N PHE A 24 7.044 -13.424 -18.024 1.00 0.00 N ATOM 327 CA PHE A 24 8.136 -14.223 -18.569 1.00 0.00 C ATOM 328 C PHE A 24 8.429 -15.424 -17.674 1.00 0.00 C ATOM 329 O PHE A 24 9.096 -16.373 -18.090 1.00 0.00 O ATOM 330 CB PHE A 24 9.395 -13.367 -18.721 1.00 0.00 C ATOM 331 CG PHE A 24 9.270 -12.299 -19.769 1.00 0.00 C ATOM 332 CD1 PHE A 24 9.612 -12.558 -21.086 1.00 0.00 C ATOM 333 CD2 PHE A 24 8.810 -11.034 -19.437 1.00 0.00 C ATOM 334 CE1 PHE A 24 9.498 -11.576 -22.053 1.00 0.00 C ATOM 335 CE2 PHE A 24 8.694 -10.050 -20.399 1.00 0.00 C ATOM 336 CZ PHE A 24 9.039 -10.320 -21.709 1.00 0.00 C ATOM 0 H PHE A 24 7.333 -12.532 -17.624 1.00 0.00 H new ATOM 0 HA PHE A 24 7.832 -14.588 -19.550 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.625 -12.900 -17.763 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.236 -14.013 -18.971 1.00 0.00 H new ATOM 0 HD1 PHE A 24 9.972 -13.538 -21.361 1.00 0.00 H new ATOM 0 HD2 PHE A 24 8.539 -10.816 -18.415 1.00 0.00 H new ATOM 0 HE1 PHE A 24 9.768 -11.791 -23.076 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.333 -9.069 -20.127 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.950 -9.551 -22.462 1.00 0.00 H new ATOM 346 N CYS A 25 7.928 -15.375 -16.445 1.00 0.00 N ATOM 347 CA CYS A 25 8.136 -16.458 -15.490 1.00 0.00 C ATOM 348 C CYS A 25 9.624 -16.692 -15.251 1.00 0.00 C ATOM 349 O CYS A 25 10.141 -17.781 -15.505 1.00 0.00 O ATOM 350 CB CYS A 25 7.480 -17.744 -15.995 1.00 0.00 C ATOM 351 SG CYS A 25 5.722 -17.881 -15.597 1.00 0.00 S ATOM 0 H CYS A 25 7.375 -14.597 -16.086 1.00 0.00 H new ATOM 0 HA CYS A 25 7.675 -16.171 -14.545 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.602 -17.801 -17.077 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.006 -18.599 -15.569 1.00 0.00 H new ATOM 0 HG CYS A 25 5.210 -16.692 -15.476 1.00 0.00 H new ATOM 357 N LEU A 26 10.308 -15.664 -14.761 1.00 0.00 N ATOM 358 CA LEU A 26 11.738 -15.757 -14.488 1.00 0.00 C ATOM 359 C LEU A 26 12.013 -15.683 -12.990 1.00 0.00 C ATOM 360 O LEU A 26 11.088 -15.684 -12.177 1.00 0.00 O ATOM 361 CB LEU A 26 12.489 -14.638 -15.212 1.00 0.00 C ATOM 362 CG LEU A 26 12.042 -14.347 -16.645 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.610 -13.019 -17.122 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.465 -15.475 -17.575 1.00 0.00 C ATOM 0 H LEU A 26 9.896 -14.757 -14.545 1.00 0.00 H new ATOM 0 HA LEU A 26 12.091 -16.721 -14.856 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.388 -13.723 -14.628 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.549 -14.890 -15.228 1.00 0.00 H new ATOM 0 HG LEU A 26 10.954 -14.280 -16.659 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.281 -12.829 -18.144 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.257 -12.218 -16.472 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.699 -13.057 -17.092 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.139 -15.251 -18.591 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.550 -15.574 -17.556 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.009 -16.409 -17.245 1.00 0.00 H new ATOM 376 N LYS A 27 13.290 -15.616 -12.630 1.00 0.00 N ATOM 377 CA LYS A 27 13.688 -15.537 -11.229 1.00 0.00 C ATOM 378 C LYS A 27 13.946 -14.091 -10.817 1.00 0.00 C ATOM 379 O LYS A 27 14.322 -13.259 -11.642 1.00 0.00 O ATOM 380 CB LYS A 27 14.942 -16.380 -10.986 1.00 0.00 C ATOM 381 CG LYS A 27 14.643 -17.805 -10.555 1.00 0.00 C ATOM 382 CD LYS A 27 15.273 -18.816 -11.499 1.00 0.00 C ATOM 383 CE LYS A 27 14.378 -19.091 -12.698 1.00 0.00 C ATOM 384 NZ LYS A 27 14.317 -20.543 -13.023 1.00 0.00 N ATOM 0 H LYS A 27 14.068 -15.615 -13.290 1.00 0.00 H new ATOM 0 HA LYS A 27 12.871 -15.928 -10.622 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.537 -16.403 -11.899 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.551 -15.898 -10.221 1.00 0.00 H new ATOM 0 HG2 LYS A 27 15.018 -17.967 -9.544 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.564 -17.958 -10.523 1.00 0.00 H new ATOM 0 HD2 LYS A 27 16.238 -18.443 -11.842 1.00 0.00 H new ATOM 0 HD3 LYS A 27 15.462 -19.746 -10.964 1.00 0.00 H new ATOM 0 HE2 LYS A 27 13.373 -18.722 -12.493 1.00 0.00 H new ATOM 0 HE3 LYS A 27 14.750 -18.541 -13.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 13.697 -20.689 -13.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 15.272 -20.890 -13.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 13.939 -21.066 -12.207 1.00 0.00 H new ATOM 398 N SER A 28 13.741 -13.800 -9.537 1.00 0.00 N ATOM 399 CA SER A 28 13.949 -12.454 -9.016 1.00 0.00 C ATOM 400 C SER A 28 15.386 -11.998 -9.249 1.00 0.00 C ATOM 401 O SER A 28 15.641 -10.823 -9.515 1.00 0.00 O ATOM 402 CB SER A 28 13.624 -12.407 -7.522 1.00 0.00 C ATOM 403 OG SER A 28 12.900 -11.233 -7.195 1.00 0.00 O ATOM 0 H SER A 28 13.431 -14.478 -8.841 1.00 0.00 H new ATOM 0 HA SER A 28 13.280 -11.778 -9.548 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.042 -13.286 -7.245 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.548 -12.441 -6.944 1.00 0.00 H new ATOM 0 HG SER A 28 12.703 -11.227 -6.235 1.00 0.00 H new ATOM 409 N SER A 29 16.323 -12.936 -9.148 1.00 0.00 N ATOM 410 CA SER A 29 17.735 -12.631 -9.344 1.00 0.00 C ATOM 411 C SER A 29 18.027 -12.331 -10.811 1.00 0.00 C ATOM 412 O SER A 29 18.813 -11.438 -11.129 1.00 0.00 O ATOM 413 CB SER A 29 18.602 -13.798 -8.868 1.00 0.00 C ATOM 414 OG SER A 29 19.964 -13.419 -8.779 1.00 0.00 O ATOM 0 H SER A 29 16.129 -13.914 -8.931 1.00 0.00 H new ATOM 0 HA SER A 29 17.975 -11.746 -8.755 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.253 -14.141 -7.894 1.00 0.00 H new ATOM 0 HB3 SER A 29 18.499 -14.636 -9.557 1.00 0.00 H new ATOM 0 HG SER A 29 20.496 -14.182 -8.471 1.00 0.00 H new ATOM 420 N ASP A 30 17.389 -13.083 -11.701 1.00 0.00 N ATOM 421 CA ASP A 30 17.578 -12.898 -13.135 1.00 0.00 C ATOM 422 C ASP A 30 17.362 -11.440 -13.528 1.00 0.00 C ATOM 423 O ASP A 30 18.210 -10.829 -14.180 1.00 0.00 O ATOM 424 CB ASP A 30 16.621 -13.798 -13.918 1.00 0.00 C ATOM 425 CG ASP A 30 17.211 -15.166 -14.198 1.00 0.00 C ATOM 426 OD1 ASP A 30 18.407 -15.235 -14.552 1.00 0.00 O ATOM 427 OD2 ASP A 30 16.477 -16.168 -14.066 1.00 0.00 O ATOM 0 H ASP A 30 16.736 -13.827 -11.454 1.00 0.00 H new ATOM 0 HA ASP A 30 18.604 -13.173 -13.380 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.694 -13.913 -13.356 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.364 -13.316 -14.861 1.00 0.00 H new ATOM 432 N LEU A 31 16.221 -10.888 -13.130 1.00 0.00 N ATOM 433 CA LEU A 31 15.892 -9.502 -13.441 1.00 0.00 C ATOM 434 C LEU A 31 16.997 -8.561 -12.971 1.00 0.00 C ATOM 435 O LEU A 31 17.431 -7.680 -13.712 1.00 0.00 O ATOM 436 CB LEU A 31 14.564 -9.113 -12.789 1.00 0.00 C ATOM 437 CG LEU A 31 13.302 -9.444 -13.587 1.00 0.00 C ATOM 438 CD1 LEU A 31 13.212 -8.571 -14.829 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.282 -10.917 -13.966 1.00 0.00 C ATOM 0 H LEU A 31 15.508 -11.380 -12.591 1.00 0.00 H new ATOM 0 HA LEU A 31 15.799 -9.411 -14.523 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.498 -9.610 -11.821 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.577 -8.040 -12.597 1.00 0.00 H new ATOM 0 HG LEU A 31 12.434 -9.239 -12.960 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.308 -8.821 -15.384 1.00 0.00 H new ATOM 0 HD12 LEU A 31 13.179 -7.522 -14.535 1.00 0.00 H new ATOM 0 HD13 LEU A 31 14.084 -8.744 -15.459 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.377 -11.134 -14.533 1.00 0.00 H new ATOM 0 HD22 LEU A 31 14.156 -11.148 -14.575 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.298 -11.526 -13.062 1.00 0.00 H new ATOM 451 N GLU A 32 17.448 -8.756 -11.736 1.00 0.00 N ATOM 452 CA GLU A 32 18.503 -7.926 -11.168 1.00 0.00 C ATOM 453 C GLU A 32 19.718 -7.884 -12.091 1.00 0.00 C ATOM 454 O GLU A 32 20.448 -6.894 -12.128 1.00 0.00 O ATOM 455 CB GLU A 32 18.912 -8.452 -9.791 1.00 0.00 C ATOM 456 CG GLU A 32 17.758 -8.546 -8.808 1.00 0.00 C ATOM 457 CD GLU A 32 17.638 -7.315 -7.930 1.00 0.00 C ATOM 458 OE1 GLU A 32 18.635 -6.960 -7.267 1.00 0.00 O ATOM 459 OE2 GLU A 32 16.547 -6.708 -7.906 1.00 0.00 O ATOM 0 H GLU A 32 17.099 -9.482 -11.110 1.00 0.00 H new ATOM 0 HA GLU A 32 18.115 -6.913 -11.060 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.361 -9.439 -9.907 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.680 -7.799 -9.376 1.00 0.00 H new ATOM 0 HG2 GLU A 32 16.828 -8.688 -9.358 1.00 0.00 H new ATOM 0 HG3 GLU A 32 17.893 -9.425 -8.178 1.00 0.00 H new ATOM 466 N GLN A 33 19.928 -8.967 -12.832 1.00 0.00 N ATOM 467 CA GLN A 33 21.055 -9.055 -13.753 1.00 0.00 C ATOM 468 C GLN A 33 20.955 -7.989 -14.839 1.00 0.00 C ATOM 469 O GLN A 33 21.968 -7.468 -15.307 1.00 0.00 O ATOM 470 CB GLN A 33 21.113 -10.445 -14.390 1.00 0.00 C ATOM 471 CG GLN A 33 22.528 -10.964 -14.590 1.00 0.00 C ATOM 472 CD GLN A 33 23.104 -11.588 -13.334 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.604 -10.889 -12.453 1.00 0.00 O ATOM 474 NE2 GLN A 33 23.036 -12.911 -13.246 1.00 0.00 N ATOM 0 H GLN A 33 19.333 -9.795 -12.813 1.00 0.00 H new ATOM 0 HA GLN A 33 21.970 -8.885 -13.185 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.563 -11.146 -13.763 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.606 -10.415 -15.355 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.530 -11.702 -15.392 1.00 0.00 H new ATOM 0 HG3 GLN A 33 23.170 -10.143 -14.911 1.00 0.00 H new ATOM 0 HE21 GLN A 33 22.613 -13.451 -14.001 1.00 0.00 H new ATOM 0 HE22 GLN A 33 23.407 -13.387 -12.424 1.00 0.00 H new ATOM 483 N LEU A 34 19.728 -7.669 -15.235 1.00 0.00 N ATOM 484 CA LEU A 34 19.496 -6.664 -16.267 1.00 0.00 C ATOM 485 C LEU A 34 19.708 -5.258 -15.716 1.00 0.00 C ATOM 486 O LEU A 34 19.692 -5.047 -14.503 1.00 0.00 O ATOM 487 CB LEU A 34 18.078 -6.797 -16.825 1.00 0.00 C ATOM 488 CG LEU A 34 17.668 -8.194 -17.291 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.154 -8.297 -17.401 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.324 -8.526 -18.623 1.00 0.00 C ATOM 0 H LEU A 34 18.879 -8.090 -14.858 1.00 0.00 H new ATOM 0 HA LEU A 34 20.214 -6.831 -17.070 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.375 -6.471 -16.058 1.00 0.00 H new ATOM 0 HB3 LEU A 34 17.974 -6.111 -17.665 1.00 0.00 H new ATOM 0 HG LEU A 34 18.009 -8.917 -16.550 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.881 -9.298 -17.734 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.704 -8.103 -16.427 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.791 -7.564 -18.121 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.021 -9.524 -18.939 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.014 -7.798 -19.373 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.408 -8.494 -18.513 1.00 0.00 H new ATOM 502 N ARG A 35 19.905 -4.299 -16.615 1.00 0.00 N ATOM 503 CA ARG A 35 20.120 -2.913 -16.218 1.00 0.00 C ATOM 504 C ARG A 35 18.954 -2.401 -15.378 1.00 0.00 C ATOM 505 O ARG A 35 17.800 -2.765 -15.609 1.00 0.00 O ATOM 506 CB ARG A 35 20.299 -2.028 -17.453 1.00 0.00 C ATOM 507 CG ARG A 35 20.645 -0.585 -17.125 1.00 0.00 C ATOM 508 CD ARG A 35 22.083 -0.452 -16.648 1.00 0.00 C ATOM 509 NE ARG A 35 22.905 0.299 -17.593 1.00 0.00 N ATOM 510 CZ ARG A 35 24.061 0.868 -17.271 1.00 0.00 C ATOM 511 NH1 ARG A 35 24.530 0.772 -16.034 1.00 0.00 N ATOM 512 NH2 ARG A 35 24.752 1.536 -18.187 1.00 0.00 N ATOM 0 H ARG A 35 19.920 -4.457 -17.623 1.00 0.00 H new ATOM 0 HA ARG A 35 21.027 -2.871 -15.615 1.00 0.00 H new ATOM 0 HB2 ARG A 35 21.086 -2.448 -18.079 1.00 0.00 H new ATOM 0 HB3 ARG A 35 19.381 -2.048 -18.040 1.00 0.00 H new ATOM 0 HG2 ARG A 35 20.494 0.036 -18.008 1.00 0.00 H new ATOM 0 HG3 ARG A 35 19.969 -0.214 -16.355 1.00 0.00 H new ATOM 0 HD2 ARG A 35 22.099 0.046 -15.678 1.00 0.00 H new ATOM 0 HD3 ARG A 35 22.511 -1.444 -16.504 1.00 0.00 H new ATOM 0 HE ARG A 35 22.573 0.392 -18.553 1.00 0.00 H new ATOM 0 HH11 ARG A 35 24.002 0.260 -15.327 1.00 0.00 H new ATOM 0 HH12 ARG A 35 25.418 1.210 -15.790 1.00 0.00 H new ATOM 0 HH21 ARG A 35 24.395 1.613 -19.139 1.00 0.00 H new ATOM 0 HH22 ARG A 35 25.640 1.973 -17.938 1.00 0.00 H new ATOM 526 N LYS A 36 19.262 -1.555 -14.401 1.00 0.00 N ATOM 527 CA LYS A 36 18.241 -0.991 -13.526 1.00 0.00 C ATOM 528 C LYS A 36 18.012 0.485 -13.835 1.00 0.00 C ATOM 529 O LYS A 36 18.777 1.345 -13.398 1.00 0.00 O ATOM 530 CB LYS A 36 18.647 -1.159 -12.060 1.00 0.00 C ATOM 531 CG LYS A 36 18.666 -2.605 -11.595 1.00 0.00 C ATOM 532 CD LYS A 36 18.479 -2.710 -10.091 1.00 0.00 C ATOM 533 CE LYS A 36 19.738 -3.221 -9.407 1.00 0.00 C ATOM 534 NZ LYS A 36 19.455 -3.746 -8.043 1.00 0.00 N ATOM 0 H LYS A 36 20.212 -1.245 -14.195 1.00 0.00 H new ATOM 0 HA LYS A 36 17.310 -1.529 -13.703 1.00 0.00 H new ATOM 0 HB2 LYS A 36 19.637 -0.726 -11.914 1.00 0.00 H new ATOM 0 HB3 LYS A 36 17.957 -0.594 -11.434 1.00 0.00 H new ATOM 0 HG2 LYS A 36 17.876 -3.161 -12.100 1.00 0.00 H new ATOM 0 HG3 LYS A 36 19.612 -3.067 -11.878 1.00 0.00 H new ATOM 0 HD2 LYS A 36 18.215 -1.733 -9.687 1.00 0.00 H new ATOM 0 HD3 LYS A 36 17.647 -3.380 -9.873 1.00 0.00 H new ATOM 0 HE2 LYS A 36 20.186 -4.008 -10.013 1.00 0.00 H new ATOM 0 HE3 LYS A 36 20.468 -2.414 -9.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 20.338 -4.084 -7.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 19.051 -2.988 -7.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 18.778 -4.533 -8.107 1.00 0.00 H new ATOM 548 N ILE A 37 16.956 0.770 -14.590 1.00 0.00 N ATOM 549 CA ILE A 37 16.627 2.142 -14.955 1.00 0.00 C ATOM 550 C ILE A 37 15.563 2.718 -14.026 1.00 0.00 C ATOM 551 O ILE A 37 14.452 2.195 -13.938 1.00 0.00 O ATOM 552 CB ILE A 37 16.127 2.233 -16.408 1.00 0.00 C ATOM 553 CG1 ILE A 37 17.134 1.582 -17.359 1.00 0.00 C ATOM 554 CG2 ILE A 37 15.888 3.685 -16.796 1.00 0.00 C ATOM 555 CD1 ILE A 37 16.870 0.112 -17.604 1.00 0.00 C ATOM 0 H ILE A 37 16.314 0.069 -14.961 1.00 0.00 H new ATOM 0 HA ILE A 37 17.544 2.723 -14.858 1.00 0.00 H new ATOM 0 HB ILE A 37 15.182 1.695 -16.485 1.00 0.00 H new ATOM 0 HG12 ILE A 37 17.115 2.110 -18.312 1.00 0.00 H new ATOM 0 HG13 ILE A 37 18.137 1.699 -16.949 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.535 3.733 -17.826 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.138 4.120 -16.135 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.819 4.244 -16.705 1.00 0.00 H new ATOM 0 HD11 ILE A 37 17.622 -0.284 -18.287 1.00 0.00 H new ATOM 0 HD12 ILE A 37 16.918 -0.429 -16.659 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.880 -0.012 -18.043 1.00 0.00 H new ATOM 567 N ARG A 38 15.911 3.799 -13.336 1.00 0.00 N ATOM 568 CA ARG A 38 14.986 4.447 -12.414 1.00 0.00 C ATOM 569 C ARG A 38 14.456 5.751 -13.002 1.00 0.00 C ATOM 570 O ARG A 38 13.518 6.347 -12.472 1.00 0.00 O ATOM 571 CB ARG A 38 15.674 4.721 -11.075 1.00 0.00 C ATOM 572 CG ARG A 38 16.926 5.575 -11.198 1.00 0.00 C ATOM 573 CD ARG A 38 18.184 4.721 -11.218 1.00 0.00 C ATOM 574 NE ARG A 38 19.162 5.210 -12.185 1.00 0.00 N ATOM 575 CZ ARG A 38 19.858 6.330 -12.024 1.00 0.00 C ATOM 576 NH1 ARG A 38 19.683 7.073 -10.940 1.00 0.00 N ATOM 577 NH2 ARG A 38 20.730 6.709 -12.949 1.00 0.00 N ATOM 0 H ARG A 38 16.826 4.244 -13.398 1.00 0.00 H new ATOM 0 HA ARG A 38 14.144 3.774 -12.251 1.00 0.00 H new ATOM 0 HB2 ARG A 38 14.969 5.218 -10.409 1.00 0.00 H new ATOM 0 HB3 ARG A 38 15.937 3.771 -10.610 1.00 0.00 H new ATOM 0 HG2 ARG A 38 16.874 6.169 -12.110 1.00 0.00 H new ATOM 0 HG3 ARG A 38 16.974 6.275 -10.364 1.00 0.00 H new ATOM 0 HD2 ARG A 38 18.631 4.711 -10.224 1.00 0.00 H new ATOM 0 HD3 ARG A 38 17.919 3.691 -11.459 1.00 0.00 H new ATOM 0 HE ARG A 38 19.320 4.662 -13.031 1.00 0.00 H new ATOM 0 HH11 ARG A 38 19.013 6.785 -10.227 1.00 0.00 H new ATOM 0 HH12 ARG A 38 20.219 7.932 -10.819 1.00 0.00 H new ATOM 0 HH21 ARG A 38 20.866 6.140 -13.785 1.00 0.00 H new ATOM 0 HH22 ARG A 38 21.264 7.569 -12.825 1.00 0.00 H new ATOM 591 N ARG A 39 15.064 6.189 -14.100 1.00 0.00 N ATOM 592 CA ARG A 39 14.655 7.423 -14.759 1.00 0.00 C ATOM 593 C ARG A 39 14.817 8.618 -13.824 1.00 0.00 C ATOM 594 O ARG A 39 15.310 8.481 -12.705 1.00 0.00 O ATOM 595 CB ARG A 39 13.201 7.320 -15.225 1.00 0.00 C ATOM 596 CG ARG A 39 12.876 6.008 -15.921 1.00 0.00 C ATOM 597 CD ARG A 39 11.407 5.930 -16.304 1.00 0.00 C ATOM 598 NE ARG A 39 11.169 6.411 -17.662 1.00 0.00 N ATOM 599 CZ ARG A 39 9.985 6.363 -18.262 1.00 0.00 C ATOM 600 NH1 ARG A 39 8.936 5.859 -17.627 1.00 0.00 N ATOM 601 NH2 ARG A 39 9.848 6.821 -19.500 1.00 0.00 N ATOM 0 H ARG A 39 15.841 5.707 -14.552 1.00 0.00 H new ATOM 0 HA ARG A 39 15.298 7.572 -15.627 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.543 7.437 -14.364 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.987 8.145 -15.905 1.00 0.00 H new ATOM 0 HG2 ARG A 39 13.492 5.907 -16.815 1.00 0.00 H new ATOM 0 HG3 ARG A 39 13.127 5.175 -15.265 1.00 0.00 H new ATOM 0 HD2 ARG A 39 11.065 4.899 -16.220 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.818 6.520 -15.602 1.00 0.00 H new ATOM 0 HE ARG A 39 11.955 6.806 -18.178 1.00 0.00 H new ATOM 0 HH11 ARG A 39 9.037 5.507 -16.675 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.028 5.823 -18.090 1.00 0.00 H new ATOM 0 HH21 ARG A 39 10.652 7.210 -19.992 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.938 6.784 -19.960 1.00 0.00 H new ATOM 615 N ARG A 40 14.399 9.790 -14.292 1.00 0.00 N ATOM 616 CA ARG A 40 14.500 11.009 -13.499 1.00 0.00 C ATOM 617 C ARG A 40 13.483 11.003 -12.361 1.00 0.00 C ATOM 618 O ARG A 40 12.415 10.401 -12.472 1.00 0.00 O ATOM 619 CB ARG A 40 14.282 12.238 -14.384 1.00 0.00 C ATOM 620 CG ARG A 40 15.453 12.540 -15.305 1.00 0.00 C ATOM 621 CD ARG A 40 15.193 12.042 -16.719 1.00 0.00 C ATOM 622 NE ARG A 40 14.065 12.730 -17.342 1.00 0.00 N ATOM 623 CZ ARG A 40 14.108 13.996 -17.743 1.00 0.00 C ATOM 624 NH1 ARG A 40 15.215 14.708 -17.586 1.00 0.00 N ATOM 625 NH2 ARG A 40 13.040 14.552 -18.302 1.00 0.00 N ATOM 0 H ARG A 40 13.987 9.921 -15.216 1.00 0.00 H new ATOM 0 HA ARG A 40 15.501 11.051 -13.070 1.00 0.00 H new ATOM 0 HB2 ARG A 40 13.386 12.087 -14.986 1.00 0.00 H new ATOM 0 HB3 ARG A 40 14.097 13.104 -13.749 1.00 0.00 H new ATOM 0 HG2 ARG A 40 15.634 13.615 -15.324 1.00 0.00 H new ATOM 0 HG3 ARG A 40 16.356 12.071 -14.913 1.00 0.00 H new ATOM 0 HD2 ARG A 40 16.087 12.189 -17.325 1.00 0.00 H new ATOM 0 HD3 ARG A 40 14.996 10.970 -16.696 1.00 0.00 H new ATOM 0 HE ARG A 40 13.198 12.211 -17.476 1.00 0.00 H new ATOM 0 HH11 ARG A 40 16.037 14.284 -17.156 1.00 0.00 H new ATOM 0 HH12 ARG A 40 15.245 15.680 -17.895 1.00 0.00 H new ATOM 0 HH21 ARG A 40 12.186 14.007 -18.424 1.00 0.00 H new ATOM 0 HH22 ARG A 40 13.073 15.524 -18.610 1.00 0.00 H new ATOM 639 N SER A 41 13.824 11.676 -11.267 1.00 0.00 N ATOM 640 CA SER A 41 12.943 11.745 -10.106 1.00 0.00 C ATOM 641 C SER A 41 13.019 13.119 -9.448 1.00 0.00 C ATOM 642 O SER A 41 13.581 13.287 -8.366 1.00 0.00 O ATOM 643 CB SER A 41 13.315 10.660 -9.093 1.00 0.00 C ATOM 644 OG SER A 41 12.759 9.409 -9.459 1.00 0.00 O ATOM 0 H SER A 41 14.704 12.181 -11.160 1.00 0.00 H new ATOM 0 HA SER A 41 11.920 11.580 -10.445 1.00 0.00 H new ATOM 0 HB2 SER A 41 14.400 10.575 -9.029 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.958 10.944 -8.103 1.00 0.00 H new ATOM 0 HG SER A 41 12.504 9.428 -10.405 1.00 0.00 H new ATOM 650 N PRO A 42 12.438 14.127 -10.116 1.00 0.00 N ATOM 651 CA PRO A 42 12.425 15.504 -9.615 1.00 0.00 C ATOM 652 C PRO A 42 11.528 15.668 -8.392 1.00 0.00 C ATOM 653 O PRO A 42 11.788 16.504 -7.526 1.00 0.00 O ATOM 654 CB PRO A 42 11.870 16.306 -10.795 1.00 0.00 C ATOM 655 CG PRO A 42 11.059 15.326 -11.571 1.00 0.00 C ATOM 656 CD PRO A 42 11.749 13.999 -11.411 1.00 0.00 C ATOM 0 HA PRO A 42 13.413 15.828 -9.289 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.260 17.142 -10.453 1.00 0.00 H new ATOM 0 HB3 PRO A 42 12.673 16.724 -11.402 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.036 15.282 -11.196 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.001 15.612 -12.621 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.037 13.174 -11.408 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.451 13.811 -12.223 1.00 0.00 H new ATOM 664 N HIS A 43 10.472 14.864 -8.327 1.00 0.00 N ATOM 665 CA HIS A 43 9.537 14.919 -7.208 1.00 0.00 C ATOM 666 C HIS A 43 9.063 13.520 -6.826 1.00 0.00 C ATOM 667 O HIS A 43 7.873 13.217 -6.897 1.00 0.00 O ATOM 668 CB HIS A 43 8.336 15.797 -7.563 1.00 0.00 C ATOM 669 CG HIS A 43 7.589 16.302 -6.367 1.00 0.00 C ATOM 670 ND1 HIS A 43 8.173 16.462 -5.127 1.00 0.00 N ATOM 671 CD2 HIS A 43 6.299 16.684 -6.225 1.00 0.00 C ATOM 672 CE1 HIS A 43 7.273 16.920 -4.275 1.00 0.00 C ATOM 673 NE2 HIS A 43 6.127 17.064 -4.917 1.00 0.00 N ATOM 0 H HIS A 43 10.242 14.167 -9.035 1.00 0.00 H new ATOM 0 HA HIS A 43 10.056 15.353 -6.354 1.00 0.00 H new ATOM 0 HB2 HIS A 43 8.679 16.647 -8.152 1.00 0.00 H new ATOM 0 HB3 HIS A 43 7.653 15.227 -8.193 1.00 0.00 H new ATOM 0 HD2 HIS A 43 5.544 16.689 -6.998 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.445 17.139 -3.232 1.00 0.00 H new ATOM 0 HE2 HIS A 43 5.256 17.402 -4.507 1.00 0.00 H new ATOM 681 N GLU A 44 10.004 12.672 -6.421 1.00 0.00 N ATOM 682 CA GLU A 44 9.682 11.305 -6.030 1.00 0.00 C ATOM 683 C GLU A 44 10.874 10.639 -5.349 1.00 0.00 C ATOM 684 O GLU A 44 11.988 10.652 -5.871 1.00 0.00 O ATOM 685 CB GLU A 44 9.256 10.488 -7.251 1.00 0.00 C ATOM 686 CG GLU A 44 8.857 9.060 -6.920 1.00 0.00 C ATOM 687 CD GLU A 44 7.383 8.796 -7.155 1.00 0.00 C ATOM 688 OE1 GLU A 44 7.008 8.522 -8.314 1.00 0.00 O ATOM 689 OE2 GLU A 44 6.604 8.865 -6.181 1.00 0.00 O ATOM 0 H GLU A 44 10.994 12.908 -6.355 1.00 0.00 H new ATOM 0 HA GLU A 44 8.855 11.343 -5.321 1.00 0.00 H new ATOM 0 HB2 GLU A 44 8.417 10.987 -7.737 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.076 10.470 -7.969 1.00 0.00 H new ATOM 0 HG2 GLU A 44 9.446 8.372 -7.526 1.00 0.00 H new ATOM 0 HG3 GLU A 44 9.098 8.852 -5.877 1.00 0.00 H new ATOM 696 N ASP A 45 10.630 10.058 -4.179 1.00 0.00 N ATOM 697 CA ASP A 45 11.682 9.386 -3.426 1.00 0.00 C ATOM 698 C ASP A 45 11.092 8.558 -2.288 1.00 0.00 C ATOM 699 O ASP A 45 11.480 8.709 -1.129 1.00 0.00 O ATOM 700 CB ASP A 45 12.673 10.409 -2.868 1.00 0.00 C ATOM 701 CG ASP A 45 13.985 9.776 -2.450 1.00 0.00 C ATOM 702 OD1 ASP A 45 14.651 9.164 -3.312 1.00 0.00 O ATOM 703 OD2 ASP A 45 14.347 9.892 -1.260 1.00 0.00 O ATOM 0 H ASP A 45 9.713 10.039 -3.732 1.00 0.00 H new ATOM 0 HA ASP A 45 12.208 8.715 -4.105 1.00 0.00 H new ATOM 0 HB2 ASP A 45 12.865 11.173 -3.622 1.00 0.00 H new ATOM 0 HB3 ASP A 45 12.227 10.913 -2.011 1.00 0.00 H new ATOM 708 N THR A 46 10.151 7.683 -2.626 1.00 0.00 N ATOM 709 CA THR A 46 9.505 6.833 -1.634 1.00 0.00 C ATOM 710 C THR A 46 9.863 5.367 -1.848 1.00 0.00 C ATOM 711 O THR A 46 10.632 4.788 -1.081 1.00 0.00 O ATOM 712 CB THR A 46 7.973 6.986 -1.674 1.00 0.00 C ATOM 713 OG1 THR A 46 7.569 7.537 -2.933 1.00 0.00 O ATOM 714 CG2 THR A 46 7.489 7.882 -0.544 1.00 0.00 C ATOM 0 H THR A 46 9.819 7.544 -3.580 1.00 0.00 H new ATOM 0 HA THR A 46 9.870 7.155 -0.658 1.00 0.00 H new ATOM 0 HB THR A 46 7.528 5.999 -1.550 1.00 0.00 H new ATOM 0 HG1 THR A 46 6.594 7.630 -2.952 1.00 0.00 H new ATOM 0 HG21 THR A 46 6.404 7.975 -0.593 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.773 7.446 0.414 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.943 8.868 -0.642 1.00 0.00 H new ATOM 722 N GLU A 47 9.302 4.773 -2.897 1.00 0.00 N ATOM 723 CA GLU A 47 9.564 3.373 -3.211 1.00 0.00 C ATOM 724 C GLU A 47 10.323 3.244 -4.529 1.00 0.00 C ATOM 725 O GLU A 47 10.004 3.916 -5.510 1.00 0.00 O ATOM 726 CB GLU A 47 8.252 2.590 -3.287 1.00 0.00 C ATOM 727 CG GLU A 47 7.806 2.018 -1.952 1.00 0.00 C ATOM 728 CD GLU A 47 6.492 2.606 -1.475 1.00 0.00 C ATOM 729 OE1 GLU A 47 5.571 2.751 -2.306 1.00 0.00 O ATOM 730 OE2 GLU A 47 6.385 2.920 -0.271 1.00 0.00 O ATOM 0 H GLU A 47 8.664 5.239 -3.543 1.00 0.00 H new ATOM 0 HA GLU A 47 10.181 2.958 -2.414 1.00 0.00 H new ATOM 0 HB2 GLU A 47 7.470 3.245 -3.672 1.00 0.00 H new ATOM 0 HB3 GLU A 47 8.366 1.775 -4.002 1.00 0.00 H new ATOM 0 HG2 GLU A 47 7.705 0.936 -2.040 1.00 0.00 H new ATOM 0 HG3 GLU A 47 8.577 2.206 -1.205 1.00 0.00 H new ATOM 737 N SER A 48 11.329 2.376 -4.543 1.00 0.00 N ATOM 738 CA SER A 48 12.137 2.161 -5.738 1.00 0.00 C ATOM 739 C SER A 48 11.324 1.467 -6.826 1.00 0.00 C ATOM 740 O SER A 48 10.938 0.306 -6.683 1.00 0.00 O ATOM 741 CB SER A 48 13.375 1.328 -5.399 1.00 0.00 C ATOM 742 OG SER A 48 13.109 0.428 -4.338 1.00 0.00 O ATOM 0 H SER A 48 11.604 1.810 -3.740 1.00 0.00 H new ATOM 0 HA SER A 48 12.455 3.134 -6.112 1.00 0.00 H new ATOM 0 HB2 SER A 48 13.695 0.772 -6.280 1.00 0.00 H new ATOM 0 HB3 SER A 48 14.197 1.988 -5.122 1.00 0.00 H new ATOM 0 HG SER A 48 13.915 -0.094 -4.142 1.00 0.00 H new ATOM 748 N PHE A 49 11.067 2.186 -7.913 1.00 0.00 N ATOM 749 CA PHE A 49 10.299 1.640 -9.026 1.00 0.00 C ATOM 750 C PHE A 49 11.111 0.597 -9.789 1.00 0.00 C ATOM 751 O PHE A 49 10.760 -0.583 -9.815 1.00 0.00 O ATOM 752 CB PHE A 49 9.869 2.761 -9.975 1.00 0.00 C ATOM 753 CG PHE A 49 8.379 2.877 -10.129 1.00 0.00 C ATOM 754 CD1 PHE A 49 7.572 3.116 -9.029 1.00 0.00 C ATOM 755 CD2 PHE A 49 7.786 2.748 -11.375 1.00 0.00 C ATOM 756 CE1 PHE A 49 6.201 3.223 -9.168 1.00 0.00 C ATOM 757 CE2 PHE A 49 6.416 2.854 -11.520 1.00 0.00 C ATOM 758 CZ PHE A 49 5.622 3.093 -10.415 1.00 0.00 C ATOM 0 H PHE A 49 11.379 3.148 -8.047 1.00 0.00 H new ATOM 0 HA PHE A 49 9.411 1.156 -8.619 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.263 3.708 -9.608 1.00 0.00 H new ATOM 0 HB3 PHE A 49 10.315 2.588 -10.954 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.019 3.220 -8.051 1.00 0.00 H new ATOM 0 HD2 PHE A 49 8.402 2.562 -12.243 1.00 0.00 H new ATOM 0 HE1 PHE A 49 5.583 3.408 -8.302 1.00 0.00 H new ATOM 0 HE2 PHE A 49 5.966 2.750 -12.496 1.00 0.00 H new ATOM 0 HZ PHE A 49 4.551 3.178 -10.526 1.00 0.00 H new ATOM 768 N THR A 50 12.200 1.042 -10.409 1.00 0.00 N ATOM 769 CA THR A 50 13.061 0.149 -11.174 1.00 0.00 C ATOM 770 C THR A 50 12.304 -0.487 -12.334 1.00 0.00 C ATOM 771 O THR A 50 11.540 -1.433 -12.145 1.00 0.00 O ATOM 772 CB THR A 50 13.646 -0.965 -10.285 1.00 0.00 C ATOM 773 OG1 THR A 50 13.982 -0.439 -8.997 1.00 0.00 O ATOM 774 CG2 THR A 50 14.882 -1.577 -10.927 1.00 0.00 C ATOM 0 H THR A 50 12.506 2.015 -10.396 1.00 0.00 H new ATOM 0 HA THR A 50 13.876 0.757 -11.567 1.00 0.00 H new ATOM 0 HB THR A 50 12.891 -1.743 -10.173 1.00 0.00 H new ATOM 0 HG1 THR A 50 14.351 -1.154 -8.438 1.00 0.00 H new ATOM 0 HG21 THR A 50 15.277 -2.361 -10.281 1.00 0.00 H new ATOM 0 HG22 THR A 50 14.616 -2.003 -11.894 1.00 0.00 H new ATOM 0 HG23 THR A 50 15.639 -0.806 -11.066 1.00 0.00 H new ATOM 782 N VAL A 51 12.521 0.039 -13.535 1.00 0.00 N ATOM 783 CA VAL A 51 11.860 -0.479 -14.727 1.00 0.00 C ATOM 784 C VAL A 51 12.866 -1.111 -15.683 1.00 0.00 C ATOM 785 O VAL A 51 13.989 -0.627 -15.828 1.00 0.00 O ATOM 786 CB VAL A 51 11.090 0.630 -15.469 1.00 0.00 C ATOM 787 CG1 VAL A 51 9.835 1.013 -14.701 1.00 0.00 C ATOM 788 CG2 VAL A 51 11.983 1.842 -15.687 1.00 0.00 C ATOM 0 H VAL A 51 13.149 0.824 -13.708 1.00 0.00 H new ATOM 0 HA VAL A 51 11.154 -1.239 -14.392 1.00 0.00 H new ATOM 0 HB VAL A 51 10.788 0.250 -16.445 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.304 1.798 -15.240 1.00 0.00 H new ATOM 0 HG12 VAL A 51 9.189 0.141 -14.601 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.111 1.376 -13.711 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.424 2.616 -16.212 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.317 2.226 -14.723 1.00 0.00 H new ATOM 0 HG23 VAL A 51 12.849 1.553 -16.282 1.00 0.00 H new ATOM 798 N TYR A 52 12.455 -2.194 -16.333 1.00 0.00 N ATOM 799 CA TYR A 52 13.321 -2.895 -17.274 1.00 0.00 C ATOM 800 C TYR A 52 12.859 -2.670 -18.711 1.00 0.00 C ATOM 801 O TYR A 52 11.802 -2.085 -18.951 1.00 0.00 O ATOM 802 CB TYR A 52 13.343 -4.392 -16.963 1.00 0.00 C ATOM 803 CG TYR A 52 13.751 -4.709 -15.541 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.004 -4.350 -15.061 1.00 0.00 C ATOM 805 CD2 TYR A 52 12.883 -5.368 -14.679 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.382 -4.637 -13.764 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.251 -5.658 -13.380 1.00 0.00 C ATOM 808 CZ TYR A 52 14.501 -5.291 -12.927 1.00 0.00 C ATOM 809 OH TYR A 52 14.872 -5.580 -11.634 1.00 0.00 O ATOM 0 H TYR A 52 11.528 -2.606 -16.226 1.00 0.00 H new ATOM 0 HA TYR A 52 14.329 -2.494 -17.168 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.353 -4.808 -17.149 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.031 -4.887 -17.648 1.00 0.00 H new ATOM 0 HD1 TYR A 52 15.695 -3.837 -15.714 1.00 0.00 H new ATOM 0 HD2 TYR A 52 11.904 -5.658 -15.031 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.361 -4.352 -13.407 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.564 -6.169 -12.722 1.00 0.00 H new ATOM 0 HH TYR A 52 14.137 -6.041 -11.178 1.00 0.00 H new ATOM 819 N LEU A 53 13.659 -3.138 -19.663 1.00 0.00 N ATOM 820 CA LEU A 53 13.333 -2.989 -21.077 1.00 0.00 C ATOM 821 C LEU A 53 12.764 -4.286 -21.644 1.00 0.00 C ATOM 822 O LEU A 53 13.316 -5.365 -21.427 1.00 0.00 O ATOM 823 CB LEU A 53 14.577 -2.578 -21.866 1.00 0.00 C ATOM 824 CG LEU A 53 14.575 -1.155 -22.428 1.00 0.00 C ATOM 825 CD1 LEU A 53 13.538 -1.019 -23.532 1.00 0.00 C ATOM 826 CD2 LEU A 53 14.313 -0.145 -21.321 1.00 0.00 C ATOM 0 H LEU A 53 14.537 -3.624 -19.482 1.00 0.00 H new ATOM 0 HA LEU A 53 12.576 -2.210 -21.170 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.447 -2.691 -21.219 1.00 0.00 H new ATOM 0 HB3 LEU A 53 14.704 -3.275 -22.695 1.00 0.00 H new ATOM 0 HG LEU A 53 15.558 -0.951 -22.853 1.00 0.00 H new ATOM 0 HD11 LEU A 53 13.551 -0.000 -23.920 1.00 0.00 H new ATOM 0 HD12 LEU A 53 13.770 -1.717 -24.337 1.00 0.00 H new ATOM 0 HD13 LEU A 53 12.549 -1.242 -23.132 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.315 0.862 -21.739 1.00 0.00 H new ATOM 0 HD22 LEU A 53 13.343 -0.347 -20.866 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.093 -0.225 -20.564 1.00 0.00 H new ATOM 838 N ARG A 54 11.658 -4.172 -22.371 1.00 0.00 N ATOM 839 CA ARG A 54 11.014 -5.335 -22.970 1.00 0.00 C ATOM 840 C ARG A 54 11.962 -6.046 -23.932 1.00 0.00 C ATOM 841 O ARG A 54 11.926 -7.270 -24.063 1.00 0.00 O ATOM 842 CB ARG A 54 9.741 -4.917 -23.708 1.00 0.00 C ATOM 843 CG ARG A 54 8.657 -5.982 -23.706 1.00 0.00 C ATOM 844 CD ARG A 54 7.271 -5.367 -23.590 1.00 0.00 C ATOM 845 NE ARG A 54 6.676 -5.108 -24.898 1.00 0.00 N ATOM 846 CZ ARG A 54 6.218 -6.064 -25.699 1.00 0.00 C ATOM 847 NH1 ARG A 54 6.286 -7.334 -25.327 1.00 0.00 N ATOM 848 NH2 ARG A 54 5.689 -5.749 -26.875 1.00 0.00 N ATOM 0 H ARG A 54 11.189 -3.286 -22.560 1.00 0.00 H new ATOM 0 HA ARG A 54 10.751 -6.026 -22.169 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.347 -4.009 -23.250 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.994 -4.670 -24.739 1.00 0.00 H new ATOM 0 HG2 ARG A 54 8.720 -6.569 -24.623 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.822 -6.669 -22.876 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.624 -6.036 -23.023 1.00 0.00 H new ATOM 0 HD3 ARG A 54 7.334 -4.434 -23.029 1.00 0.00 H new ATOM 0 HE ARG A 54 6.608 -4.141 -25.214 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.691 -7.580 -24.424 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.934 -8.066 -25.944 1.00 0.00 H new ATOM 0 HH21 ARG A 54 5.634 -4.772 -27.164 1.00 0.00 H new ATOM 0 HH22 ARG A 54 5.338 -6.484 -27.489 1.00 0.00 H new ATOM 862 N SER A 55 12.808 -5.271 -24.602 1.00 0.00 N ATOM 863 CA SER A 55 13.762 -5.826 -25.555 1.00 0.00 C ATOM 864 C SER A 55 14.839 -6.633 -24.837 1.00 0.00 C ATOM 865 O SER A 55 15.403 -7.573 -25.398 1.00 0.00 O ATOM 866 CB SER A 55 14.409 -4.706 -26.372 1.00 0.00 C ATOM 867 OG SER A 55 15.619 -4.272 -25.775 1.00 0.00 O ATOM 0 H SER A 55 12.852 -4.257 -24.503 1.00 0.00 H new ATOM 0 HA SER A 55 13.221 -6.491 -26.228 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.605 -5.057 -27.385 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.719 -3.866 -26.454 1.00 0.00 H new ATOM 0 HG SER A 55 16.013 -3.557 -26.317 1.00 0.00 H new ATOM 873 N ASP A 56 15.119 -6.260 -23.593 1.00 0.00 N ATOM 874 CA ASP A 56 16.127 -6.950 -22.796 1.00 0.00 C ATOM 875 C ASP A 56 15.546 -8.203 -22.150 1.00 0.00 C ATOM 876 O ASP A 56 16.088 -9.299 -22.296 1.00 0.00 O ATOM 877 CB ASP A 56 16.683 -6.017 -21.720 1.00 0.00 C ATOM 878 CG ASP A 56 17.594 -4.949 -22.293 1.00 0.00 C ATOM 879 OD1 ASP A 56 17.456 -4.633 -23.493 1.00 0.00 O ATOM 880 OD2 ASP A 56 18.446 -4.430 -21.541 1.00 0.00 O ATOM 0 H ASP A 56 14.662 -5.484 -23.115 1.00 0.00 H new ATOM 0 HA ASP A 56 16.937 -7.249 -23.461 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.856 -5.541 -21.194 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.233 -6.603 -20.984 1.00 0.00 H new ATOM 885 N VAL A 57 14.439 -8.034 -21.434 1.00 0.00 N ATOM 886 CA VAL A 57 13.783 -9.151 -20.765 1.00 0.00 C ATOM 887 C VAL A 57 13.470 -10.274 -21.748 1.00 0.00 C ATOM 888 O VAL A 57 13.448 -11.447 -21.378 1.00 0.00 O ATOM 889 CB VAL A 57 12.478 -8.707 -20.079 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.865 -9.860 -19.298 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.733 -7.514 -19.170 1.00 0.00 C ATOM 0 H VAL A 57 13.978 -7.134 -21.302 1.00 0.00 H new ATOM 0 HA VAL A 57 14.477 -9.517 -20.008 1.00 0.00 H new ATOM 0 HB VAL A 57 11.769 -8.404 -20.849 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.944 -9.527 -18.820 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.644 -10.683 -19.978 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.567 -10.197 -18.536 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.800 -7.214 -18.693 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.459 -7.788 -18.405 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.123 -6.684 -19.760 1.00 0.00 H new ATOM 901 N GLU A 58 13.230 -9.905 -23.002 1.00 0.00 N ATOM 902 CA GLU A 58 12.918 -10.882 -24.039 1.00 0.00 C ATOM 903 C GLU A 58 13.983 -11.974 -24.096 1.00 0.00 C ATOM 904 O GLU A 58 13.672 -13.162 -24.034 1.00 0.00 O ATOM 905 CB GLU A 58 12.804 -10.194 -25.401 1.00 0.00 C ATOM 906 CG GLU A 58 12.259 -11.097 -26.495 1.00 0.00 C ATOM 907 CD GLU A 58 11.993 -10.352 -27.788 1.00 0.00 C ATOM 908 OE1 GLU A 58 12.953 -9.792 -28.359 1.00 0.00 O ATOM 909 OE2 GLU A 58 10.825 -10.327 -28.229 1.00 0.00 O ATOM 0 H GLU A 58 13.246 -8.937 -23.325 1.00 0.00 H new ATOM 0 HA GLU A 58 11.962 -11.343 -23.792 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.157 -9.322 -25.305 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.787 -9.830 -25.698 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.969 -11.902 -26.684 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.335 -11.561 -26.151 1.00 0.00 H new ATOM 916 N ALA A 59 15.241 -11.560 -24.214 1.00 0.00 N ATOM 917 CA ALA A 59 16.352 -12.501 -24.278 1.00 0.00 C ATOM 918 C ALA A 59 16.500 -13.265 -22.966 1.00 0.00 C ATOM 919 O ALA A 59 16.837 -14.449 -22.960 1.00 0.00 O ATOM 920 CB ALA A 59 17.644 -11.771 -24.614 1.00 0.00 C ATOM 0 H ALA A 59 15.515 -10.579 -24.267 1.00 0.00 H new ATOM 0 HA ALA A 59 16.140 -13.222 -25.067 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.465 -12.486 -24.658 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.542 -11.276 -25.580 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.852 -11.027 -23.845 1.00 0.00 H new ATOM 926 N LYS A 60 16.246 -12.580 -21.856 1.00 0.00 N ATOM 927 CA LYS A 60 16.350 -13.194 -20.538 1.00 0.00 C ATOM 928 C LYS A 60 15.462 -14.430 -20.441 1.00 0.00 C ATOM 929 O LYS A 60 15.732 -15.341 -19.659 1.00 0.00 O ATOM 930 CB LYS A 60 15.962 -12.187 -19.452 1.00 0.00 C ATOM 931 CG LYS A 60 16.063 -12.744 -18.043 1.00 0.00 C ATOM 932 CD LYS A 60 17.478 -13.198 -17.723 1.00 0.00 C ATOM 933 CE LYS A 60 18.455 -12.033 -17.744 1.00 0.00 C ATOM 934 NZ LYS A 60 19.778 -12.409 -17.173 1.00 0.00 N ATOM 0 H LYS A 60 15.967 -11.599 -21.843 1.00 0.00 H new ATOM 0 HA LYS A 60 17.385 -13.500 -20.388 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.605 -11.311 -19.534 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.940 -11.851 -19.628 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.753 -11.983 -17.327 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.377 -13.584 -17.933 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.496 -13.672 -16.741 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.792 -13.951 -18.446 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.587 -11.688 -18.769 1.00 0.00 H new ATOM 0 HE3 LYS A 60 18.039 -11.200 -17.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.517 -11.800 -17.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.758 -12.288 -16.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.985 -13.402 -17.401 1.00 0.00 H new ATOM 948 N SER A 61 14.401 -14.455 -21.242 1.00 0.00 N ATOM 949 CA SER A 61 13.472 -15.578 -21.244 1.00 0.00 C ATOM 950 C SER A 61 13.994 -16.714 -22.119 1.00 0.00 C ATOM 951 O SER A 61 13.662 -17.881 -21.906 1.00 0.00 O ATOM 952 CB SER A 61 12.096 -15.128 -21.741 1.00 0.00 C ATOM 953 OG SER A 61 11.879 -15.536 -23.081 1.00 0.00 O ATOM 0 H SER A 61 14.164 -13.710 -21.897 1.00 0.00 H new ATOM 0 HA SER A 61 13.380 -15.943 -20.221 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.320 -15.546 -21.100 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.017 -14.043 -21.671 1.00 0.00 H new ATOM 0 HG SER A 61 12.368 -14.942 -23.687 1.00 0.00 H new ATOM 959 N LEU A 62 14.814 -16.364 -23.104 1.00 0.00 N ATOM 960 CA LEU A 62 15.384 -17.353 -24.013 1.00 0.00 C ATOM 961 C LEU A 62 16.615 -18.010 -23.399 1.00 0.00 C ATOM 962 O LEU A 62 16.882 -19.189 -23.631 1.00 0.00 O ATOM 963 CB LEU A 62 15.752 -16.697 -25.345 1.00 0.00 C ATOM 964 CG LEU A 62 14.724 -15.722 -25.921 1.00 0.00 C ATOM 965 CD1 LEU A 62 15.166 -15.225 -27.288 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.355 -16.381 -26.008 1.00 0.00 C ATOM 0 H LEU A 62 15.099 -15.403 -23.294 1.00 0.00 H new ATOM 0 HA LEU A 62 14.634 -18.124 -24.190 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.695 -16.165 -25.217 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.927 -17.484 -26.078 1.00 0.00 H new ATOM 0 HG LEU A 62 14.651 -14.864 -25.252 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.422 -14.533 -27.681 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.125 -14.714 -27.197 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.269 -16.071 -27.967 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.636 -15.673 -26.420 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.413 -17.257 -26.654 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.034 -16.686 -25.012 1.00 0.00 H new ATOM 978 N GLU A 63 17.362 -17.240 -22.613 1.00 0.00 N ATOM 979 CA GLU A 63 18.564 -17.749 -21.965 1.00 0.00 C ATOM 980 C GLU A 63 18.207 -18.672 -20.804 1.00 0.00 C ATOM 981 O GLU A 63 18.991 -19.542 -20.424 1.00 0.00 O ATOM 982 CB GLU A 63 19.429 -16.591 -21.463 1.00 0.00 C ATOM 983 CG GLU A 63 18.875 -15.910 -20.223 1.00 0.00 C ATOM 984 CD GLU A 63 19.597 -16.327 -18.957 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.806 -17.543 -18.765 1.00 0.00 O ATOM 986 OE2 GLU A 63 19.954 -15.436 -18.158 1.00 0.00 O ATOM 0 H GLU A 63 17.155 -16.262 -22.410 1.00 0.00 H new ATOM 0 HA GLU A 63 19.128 -18.322 -22.701 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.430 -16.964 -21.246 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.530 -15.853 -22.258 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.952 -14.829 -20.342 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.815 -16.145 -20.127 1.00 0.00 H new ATOM 993 N VAL A 64 17.019 -18.474 -20.242 1.00 0.00 N ATOM 994 CA VAL A 64 16.556 -19.288 -19.124 1.00 0.00 C ATOM 995 C VAL A 64 15.779 -20.504 -19.614 1.00 0.00 C ATOM 996 O VAL A 64 16.272 -21.631 -19.561 1.00 0.00 O ATOM 997 CB VAL A 64 15.664 -18.474 -18.168 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.148 -19.354 -17.040 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.427 -17.279 -17.617 1.00 0.00 C ATOM 0 H VAL A 64 16.359 -17.757 -20.543 1.00 0.00 H new ATOM 0 HA VAL A 64 17.444 -19.620 -18.586 1.00 0.00 H new ATOM 0 HB VAL A 64 14.806 -18.102 -18.727 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.520 -18.762 -16.375 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.563 -20.174 -17.457 1.00 0.00 H new ATOM 0 HG13 VAL A 64 15.991 -19.758 -16.479 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.782 -16.715 -16.943 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.305 -17.627 -17.072 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.742 -16.637 -18.440 1.00 0.00 H new ATOM 1009 N TRP A 65 14.563 -20.269 -20.092 1.00 0.00 N ATOM 1010 CA TRP A 65 13.717 -21.346 -20.593 1.00 0.00 C ATOM 1011 C TRP A 65 14.382 -22.061 -21.764 1.00 0.00 C ATOM 1012 O TRP A 65 14.108 -23.232 -22.025 1.00 0.00 O ATOM 1013 CB TRP A 65 12.356 -20.796 -21.023 1.00 0.00 C ATOM 1014 CG TRP A 65 11.408 -20.597 -19.879 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.179 -19.437 -19.196 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.563 -21.589 -19.284 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.243 -19.647 -18.212 1.00 0.00 N ATOM 1018 CE2 TRP A 65 9.849 -20.959 -18.246 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.339 -22.946 -19.528 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 8.929 -21.642 -17.455 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.426 -23.623 -18.742 1.00 0.00 C ATOM 1022 CH2 TRP A 65 8.729 -22.970 -17.716 1.00 0.00 C ATOM 0 H TRP A 65 14.140 -19.342 -20.143 1.00 0.00 H new ATOM 0 HA TRP A 65 13.572 -22.065 -19.787 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.502 -19.845 -21.535 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.907 -21.480 -21.743 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.663 -18.493 -19.399 1.00 0.00 H new ATOM 0 HE1 TRP A 65 9.898 -18.941 -17.562 1.00 0.00 H new ATOM 0 HE3 TRP A 65 10.870 -23.457 -20.317 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.392 -21.141 -16.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.246 -24.673 -18.921 1.00 0.00 H new ATOM 0 HH2 TRP A 65 8.020 -23.526 -17.120 1.00 0.00 H new ATOM 1033 N GLY A 66 15.258 -21.349 -22.467 1.00 0.00 N ATOM 1034 CA GLY A 66 15.948 -21.933 -23.602 1.00 0.00 C ATOM 1035 C GLY A 66 15.475 -21.363 -24.924 1.00 0.00 C ATOM 1036 O GLY A 66 16.279 -21.106 -25.820 1.00 0.00 O ATOM 0 H GLY A 66 15.502 -20.378 -22.270 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.020 -21.762 -23.499 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.796 -23.012 -23.600 1.00 0.00 H new ATOM 1040 N SER A 67 14.166 -21.167 -25.048 1.00 0.00 N ATOM 1041 CA SER A 67 13.586 -20.629 -26.273 1.00 0.00 C ATOM 1042 C SER A 67 12.252 -19.947 -25.989 1.00 0.00 C ATOM 1043 O SER A 67 11.612 -20.182 -24.964 1.00 0.00 O ATOM 1044 CB SER A 67 13.393 -21.744 -27.303 1.00 0.00 C ATOM 1045 OG SER A 67 13.978 -22.956 -26.859 1.00 0.00 O ATOM 0 H SER A 67 13.487 -21.373 -24.315 1.00 0.00 H new ATOM 0 HA SER A 67 14.275 -19.886 -26.676 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.329 -21.895 -27.484 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.839 -21.448 -28.252 1.00 0.00 H new ATOM 0 HG SER A 67 13.840 -23.653 -27.534 1.00 0.00 H new ATOM 1051 N PRO A 68 11.821 -19.081 -26.918 1.00 0.00 N ATOM 1052 CA PRO A 68 10.558 -18.347 -26.791 1.00 0.00 C ATOM 1053 C PRO A 68 9.342 -19.256 -26.933 1.00 0.00 C ATOM 1054 O PRO A 68 8.233 -18.888 -26.547 1.00 0.00 O ATOM 1055 CB PRO A 68 10.614 -17.344 -27.946 1.00 0.00 C ATOM 1056 CG PRO A 68 11.515 -17.973 -28.951 1.00 0.00 C ATOM 1057 CD PRO A 68 12.532 -18.753 -28.165 1.00 0.00 C ATOM 0 HA PRO A 68 10.453 -17.884 -25.810 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.623 -17.163 -28.362 1.00 0.00 H new ATOM 0 HB3 PRO A 68 11.002 -16.380 -27.615 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.956 -18.626 -29.622 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.997 -17.217 -29.570 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.847 -19.651 -28.696 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.429 -18.164 -27.973 1.00 0.00 H new ATOM 1065 N GLU A 69 9.559 -20.444 -27.488 1.00 0.00 N ATOM 1066 CA GLU A 69 8.478 -21.405 -27.681 1.00 0.00 C ATOM 1067 C GLU A 69 8.080 -22.048 -26.355 1.00 0.00 C ATOM 1068 O GLU A 69 6.920 -22.403 -26.150 1.00 0.00 O ATOM 1069 CB GLU A 69 8.899 -22.485 -28.679 1.00 0.00 C ATOM 1070 CG GLU A 69 9.488 -21.930 -29.965 1.00 0.00 C ATOM 1071 CD GLU A 69 9.013 -22.679 -31.195 1.00 0.00 C ATOM 1072 OE1 GLU A 69 7.858 -22.457 -31.615 1.00 0.00 O ATOM 1073 OE2 GLU A 69 9.796 -23.487 -31.737 1.00 0.00 O ATOM 0 H GLU A 69 10.472 -20.764 -27.812 1.00 0.00 H new ATOM 0 HA GLU A 69 7.616 -20.870 -28.079 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.632 -23.139 -28.206 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.033 -23.101 -28.922 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.220 -20.878 -30.059 1.00 0.00 H new ATOM 0 HG3 GLU A 69 10.576 -21.978 -29.912 1.00 0.00 H new ATOM 1080 N ALA A 70 9.051 -22.195 -25.460 1.00 0.00 N ATOM 1081 CA ALA A 70 8.803 -22.794 -24.155 1.00 0.00 C ATOM 1082 C ALA A 70 7.893 -21.910 -23.310 1.00 0.00 C ATOM 1083 O ALA A 70 7.003 -22.402 -22.615 1.00 0.00 O ATOM 1084 CB ALA A 70 10.118 -23.046 -23.431 1.00 0.00 C ATOM 0 H ALA A 70 10.017 -21.907 -25.615 1.00 0.00 H new ATOM 0 HA ALA A 70 8.298 -23.747 -24.310 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.917 -23.494 -22.458 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.735 -23.723 -24.022 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.645 -22.102 -23.294 1.00 0.00 H new ATOM 1090 N LEU A 71 8.121 -20.603 -23.372 1.00 0.00 N ATOM 1091 CA LEU A 71 7.321 -19.649 -22.612 1.00 0.00 C ATOM 1092 C LEU A 71 5.932 -19.493 -23.224 1.00 0.00 C ATOM 1093 O LEU A 71 4.931 -19.442 -22.510 1.00 0.00 O ATOM 1094 CB LEU A 71 8.023 -18.291 -22.559 1.00 0.00 C ATOM 1095 CG LEU A 71 7.252 -17.162 -21.876 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.114 -17.435 -20.386 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.939 -15.826 -22.114 1.00 0.00 C ATOM 0 H LEU A 71 8.854 -20.179 -23.941 1.00 0.00 H new ATOM 0 HA LEU A 71 7.210 -20.033 -21.598 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.975 -18.417 -22.044 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.251 -17.983 -23.579 1.00 0.00 H new ATOM 0 HG LEU A 71 6.253 -17.116 -22.310 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.562 -16.621 -19.916 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.576 -18.371 -20.236 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.104 -17.509 -19.936 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.376 -15.034 -21.620 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.950 -15.859 -21.708 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.984 -15.626 -23.184 1.00 0.00 H new ATOM 1109 N ALA A 72 5.881 -19.418 -24.550 1.00 0.00 N ATOM 1110 CA ALA A 72 4.615 -19.272 -25.258 1.00 0.00 C ATOM 1111 C ALA A 72 3.613 -20.332 -24.815 1.00 0.00 C ATOM 1112 O ALA A 72 2.404 -20.100 -24.825 1.00 0.00 O ATOM 1113 CB ALA A 72 4.839 -19.350 -26.761 1.00 0.00 C ATOM 0 H ALA A 72 6.701 -19.456 -25.155 1.00 0.00 H new ATOM 0 HA ALA A 72 4.201 -18.294 -25.014 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.885 -19.240 -27.277 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.514 -18.552 -27.070 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.279 -20.315 -27.014 1.00 0.00 H new ATOM 1119 N ARG A 73 4.122 -21.497 -24.428 1.00 0.00 N ATOM 1120 CA ARG A 73 3.271 -22.594 -23.983 1.00 0.00 C ATOM 1121 C ARG A 73 2.362 -22.148 -22.842 1.00 0.00 C ATOM 1122 O ARG A 73 1.218 -22.591 -22.738 1.00 0.00 O ATOM 1123 CB ARG A 73 4.125 -23.781 -23.535 1.00 0.00 C ATOM 1124 CG ARG A 73 5.101 -24.265 -24.596 1.00 0.00 C ATOM 1125 CD ARG A 73 4.866 -25.726 -24.945 1.00 0.00 C ATOM 1126 NE ARG A 73 6.113 -26.424 -25.245 1.00 0.00 N ATOM 1127 CZ ARG A 73 6.168 -27.586 -25.886 1.00 0.00 C ATOM 1128 NH1 ARG A 73 5.053 -28.177 -26.292 1.00 0.00 N ATOM 1129 NH2 ARG A 73 7.341 -28.160 -26.123 1.00 0.00 N ATOM 0 H ARG A 73 5.120 -21.706 -24.414 1.00 0.00 H new ATOM 0 HA ARG A 73 2.647 -22.901 -24.823 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.683 -23.500 -22.642 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.468 -24.605 -23.255 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.997 -23.654 -25.493 1.00 0.00 H new ATOM 0 HG3 ARG A 73 6.122 -24.135 -24.239 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.364 -26.221 -24.114 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.198 -25.791 -25.804 1.00 0.00 H new ATOM 0 HE ARG A 73 6.989 -25.996 -24.946 1.00 0.00 H new ATOM 0 HH11 ARG A 73 4.149 -27.739 -26.112 1.00 0.00 H new ATOM 0 HH12 ARG A 73 5.099 -29.069 -26.784 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.202 -27.709 -25.813 1.00 0.00 H new ATOM 0 HH22 ARG A 73 7.382 -29.052 -26.615 1.00 0.00 H new ATOM 1143 N GLU A 74 2.879 -21.269 -21.989 1.00 0.00 N ATOM 1144 CA GLU A 74 2.113 -20.765 -20.855 1.00 0.00 C ATOM 1145 C GLU A 74 1.341 -19.506 -21.236 1.00 0.00 C ATOM 1146 O GLU A 74 0.300 -19.201 -20.653 1.00 0.00 O ATOM 1147 CB GLU A 74 3.042 -20.469 -19.675 1.00 0.00 C ATOM 1148 CG GLU A 74 3.287 -21.670 -18.777 1.00 0.00 C ATOM 1149 CD GLU A 74 3.148 -21.336 -17.305 1.00 0.00 C ATOM 1150 OE1 GLU A 74 4.117 -20.805 -16.723 1.00 0.00 O ATOM 1151 OE2 GLU A 74 2.070 -21.606 -16.735 1.00 0.00 O ATOM 0 H GLU A 74 3.824 -20.892 -22.062 1.00 0.00 H new ATOM 0 HA GLU A 74 1.398 -21.534 -20.562 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.998 -20.111 -20.057 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.614 -19.662 -19.080 1.00 0.00 H new ATOM 0 HG2 GLU A 74 2.582 -22.461 -19.034 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.287 -22.061 -18.964 1.00 0.00 H new ATOM 1158 N LYS A 75 1.857 -18.777 -22.219 1.00 0.00 N ATOM 1159 CA LYS A 75 1.218 -17.551 -22.681 1.00 0.00 C ATOM 1160 C LYS A 75 -0.157 -17.844 -23.274 1.00 0.00 C ATOM 1161 O LYS A 75 -1.103 -17.080 -23.083 1.00 0.00 O ATOM 1162 CB LYS A 75 2.096 -16.854 -23.723 1.00 0.00 C ATOM 1163 CG LYS A 75 3.502 -16.554 -23.230 1.00 0.00 C ATOM 1164 CD LYS A 75 3.552 -15.252 -22.449 1.00 0.00 C ATOM 1165 CE LYS A 75 4.041 -15.475 -21.026 1.00 0.00 C ATOM 1166 NZ LYS A 75 2.943 -15.927 -20.127 1.00 0.00 N ATOM 0 H LYS A 75 2.718 -19.015 -22.712 1.00 0.00 H new ATOM 0 HA LYS A 75 1.091 -16.892 -21.822 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.158 -17.481 -24.612 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.618 -15.921 -24.023 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.850 -17.372 -22.599 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.182 -16.496 -24.080 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.212 -14.548 -22.956 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.560 -14.801 -22.428 1.00 0.00 H new ATOM 0 HE2 LYS A 75 4.838 -16.219 -21.028 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.469 -14.550 -20.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.260 -15.873 -19.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.112 -15.315 -20.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.689 -16.909 -20.356 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.260 -18.957 -23.994 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.519 -19.353 -24.613 1.00 0.00 C ATOM 1182 C LYS A 76 -2.600 -19.569 -23.558 1.00 0.00 C ATOM 1183 O LYS A 76 -3.724 -19.084 -23.697 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.328 -20.632 -25.432 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.608 -21.143 -26.070 1.00 0.00 C ATOM 1186 CD LYS A 76 -2.332 -21.852 -27.385 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.782 -23.252 -27.158 1.00 0.00 C ATOM 1188 NZ LYS A 76 -2.546 -24.278 -27.920 1.00 0.00 N ATOM 0 H LYS A 76 0.514 -19.600 -24.163 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.838 -18.549 -25.276 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.591 -20.446 -26.214 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.918 -21.409 -24.786 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -3.109 -21.827 -25.385 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.288 -20.309 -26.241 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.251 -21.911 -27.968 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.620 -21.271 -27.971 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.734 -23.283 -27.457 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.818 -23.488 -26.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -2.140 -25.218 -27.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.541 -24.266 -27.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.491 -24.067 -28.937 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.253 -20.299 -22.503 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.194 -20.578 -21.424 1.00 0.00 C ATOM 1204 C LEU A 77 -3.752 -19.284 -20.840 1.00 0.00 C ATOM 1205 O LEU A 77 -4.966 -19.113 -20.734 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.511 -21.394 -20.325 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.310 -22.881 -20.619 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -1.343 -23.497 -19.620 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -3.643 -23.614 -20.595 1.00 0.00 C ATOM 0 H LEU A 77 -1.328 -20.708 -22.372 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.022 -21.155 -21.836 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.537 -20.949 -20.123 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.100 -21.301 -19.412 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.881 -22.980 -21.616 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.212 -24.555 -19.845 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.380 -22.991 -19.686 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.742 -23.387 -18.612 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.481 -24.671 -20.806 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -4.100 -23.506 -19.611 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.305 -23.190 -21.350 1.00 0.00 H new ATOM 1221 N ARG A 78 -2.857 -18.376 -20.464 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.260 -17.097 -19.892 1.00 0.00 C ATOM 1223 C ARG A 78 -4.003 -16.251 -20.922 1.00 0.00 C ATOM 1224 O ARG A 78 -4.893 -15.473 -20.578 1.00 0.00 O ATOM 1225 CB ARG A 78 -2.037 -16.336 -19.377 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.474 -16.895 -18.081 1.00 0.00 C ATOM 1227 CD ARG A 78 -0.374 -16.005 -17.523 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.782 -15.339 -16.289 1.00 0.00 N ATOM 1229 CZ ARG A 78 -0.847 -15.950 -15.111 1.00 0.00 C ATOM 1230 NH1 ARG A 78 -0.532 -17.233 -15.008 1.00 0.00 N ATOM 1231 NH2 ARG A 78 -1.227 -15.275 -14.033 1.00 0.00 N ATOM 0 H ARG A 78 -1.848 -18.503 -20.545 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.933 -17.296 -19.058 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.259 -16.356 -20.140 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.307 -15.291 -19.225 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -2.274 -16.991 -17.347 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.080 -17.896 -18.256 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.516 -16.605 -17.334 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.102 -15.256 -18.266 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.031 -14.351 -16.334 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.239 -17.754 -15.834 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -0.583 -17.699 -14.102 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -1.469 -14.287 -14.109 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -1.277 -15.744 -13.129 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.630 -16.407 -22.188 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.260 -15.659 -23.270 1.00 0.00 C ATOM 1247 C LYS A 79 -5.717 -16.074 -23.442 1.00 0.00 C ATOM 1248 O LYS A 79 -6.623 -15.248 -23.342 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.498 -15.877 -24.579 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.946 -14.958 -25.703 1.00 0.00 C ATOM 1251 CD LYS A 79 -2.947 -14.951 -26.848 1.00 0.00 C ATOM 1252 CE LYS A 79 -3.642 -14.799 -28.193 1.00 0.00 C ATOM 1253 NZ LYS A 79 -2.807 -14.043 -29.167 1.00 0.00 N ATOM 0 H LYS A 79 -2.894 -17.045 -22.490 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.231 -14.600 -23.012 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.434 -15.726 -24.400 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.624 -16.912 -24.895 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.920 -15.280 -26.071 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.068 -13.945 -25.319 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.238 -14.135 -26.709 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.372 -15.877 -26.837 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.869 -15.785 -28.598 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.593 -14.285 -28.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.316 -13.961 -30.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -2.611 -13.093 -28.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -1.910 -14.546 -29.319 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.935 -17.360 -23.700 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.283 -17.884 -23.885 1.00 0.00 C ATOM 1269 C GLU A 80 -8.162 -17.562 -22.680 1.00 0.00 C ATOM 1270 O GLU A 80 -9.364 -17.337 -22.818 1.00 0.00 O ATOM 1271 CB GLU A 80 -7.240 -19.397 -24.109 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.374 -19.814 -25.286 1.00 0.00 C ATOM 1273 CD GLU A 80 -7.190 -20.309 -26.464 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -8.264 -19.729 -26.727 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -6.754 -21.276 -27.123 1.00 0.00 O ATOM 0 H GLU A 80 -5.196 -18.058 -23.786 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.713 -17.406 -24.765 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.867 -19.879 -23.205 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.255 -19.761 -24.269 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.764 -18.967 -25.601 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.689 -20.600 -24.968 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.553 -17.542 -21.499 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.279 -17.247 -20.270 1.00 0.00 C ATOM 1284 C ALA A 81 -8.915 -15.862 -20.328 1.00 0.00 C ATOM 1285 O ALA A 81 -10.067 -15.682 -19.935 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.349 -17.353 -19.070 1.00 0.00 C ATOM 0 H ALA A 81 -6.559 -17.727 -21.367 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.078 -17.981 -20.163 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.904 -17.130 -18.159 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -6.945 -18.364 -19.011 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.531 -16.641 -19.180 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.157 -14.887 -20.820 1.00 0.00 N ATOM 1293 CA GLU A 82 -8.648 -13.518 -20.927 1.00 0.00 C ATOM 1294 C GLU A 82 -9.789 -13.427 -21.935 1.00 0.00 C ATOM 1295 O GLU A 82 -10.747 -12.679 -21.738 1.00 0.00 O ATOM 1296 CB GLU A 82 -7.513 -12.576 -21.336 1.00 0.00 C ATOM 1297 CG GLU A 82 -6.613 -12.170 -20.182 1.00 0.00 C ATOM 1298 CD GLU A 82 -6.091 -10.753 -20.320 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -6.829 -9.811 -19.963 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -4.945 -10.586 -20.786 1.00 0.00 O ATOM 0 H GLU A 82 -7.201 -15.020 -21.151 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.025 -13.217 -19.950 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -6.909 -13.060 -22.104 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.940 -11.679 -21.785 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.165 -12.260 -19.246 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.771 -12.859 -20.123 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.679 -14.192 -23.016 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.701 -14.198 -24.055 1.00 0.00 C ATOM 1309 C ILE A 83 -12.046 -14.653 -23.500 1.00 0.00 C ATOM 1310 O ILE A 83 -13.085 -14.073 -23.812 1.00 0.00 O ATOM 1311 CB ILE A 83 -10.305 -15.115 -25.228 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.950 -14.693 -25.799 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.375 -15.082 -26.309 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -8.388 -15.671 -26.807 1.00 0.00 C ATOM 0 H ILE A 83 -8.892 -14.816 -23.195 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.789 -13.174 -24.418 1.00 0.00 H new ATOM 0 HB ILE A 83 -10.220 -16.137 -24.859 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.052 -13.716 -26.271 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.239 -14.579 -24.980 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.082 -15.734 -27.131 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.323 -15.425 -25.894 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.489 -14.063 -26.678 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.426 -15.308 -27.169 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -8.253 -16.644 -26.334 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.079 -15.767 -27.645 1.00 0.00 H new ATOM 1326 N GLU A 84 -12.018 -15.695 -22.674 1.00 0.00 N ATOM 1327 CA GLU A 84 -13.236 -16.227 -22.075 1.00 0.00 C ATOM 1328 C GLU A 84 -13.885 -15.196 -21.156 1.00 0.00 C ATOM 1329 O GLU A 84 -15.102 -15.195 -20.967 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.929 -17.504 -21.290 1.00 0.00 C ATOM 1331 CG GLU A 84 -12.259 -18.584 -22.123 1.00 0.00 C ATOM 1332 CD GLU A 84 -13.247 -19.367 -22.966 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -14.415 -19.496 -22.544 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -12.852 -19.850 -24.048 1.00 0.00 O ATOM 0 H GLU A 84 -11.166 -16.187 -22.405 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.933 -16.462 -22.879 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.285 -17.256 -20.446 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.857 -17.899 -20.877 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.514 -18.126 -22.774 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.727 -19.269 -21.463 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.065 -14.320 -20.587 1.00 0.00 N ATOM 1342 CA TYR A 85 -13.558 -13.285 -19.685 1.00 0.00 C ATOM 1343 C TYR A 85 -14.227 -12.157 -20.464 1.00 0.00 C ATOM 1344 O TYR A 85 -15.407 -11.867 -20.268 1.00 0.00 O ATOM 1345 CB TYR A 85 -12.411 -12.726 -18.841 1.00 0.00 C ATOM 1346 CG TYR A 85 -12.803 -11.531 -18.002 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -13.651 -11.673 -16.910 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -12.328 -10.261 -18.302 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -14.012 -10.583 -16.141 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -12.683 -9.166 -17.538 1.00 0.00 C ATOM 1351 CZ TYR A 85 -13.526 -9.333 -16.458 1.00 0.00 C ATOM 1352 OH TYR A 85 -13.883 -8.245 -15.695 1.00 0.00 O ATOM 0 H TYR A 85 -12.056 -14.305 -20.734 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.299 -13.736 -19.026 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.037 -13.512 -18.186 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.590 -12.443 -19.500 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -14.034 -12.651 -16.658 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -11.669 -10.127 -19.147 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -14.672 -10.710 -15.296 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.303 -8.185 -17.784 1.00 0.00 H new ATOM 0 HH TYR A 85 -13.454 -7.440 -16.052 1.00 0.00 H new ATOM 1362 N ARG A 86 -13.464 -11.525 -21.350 1.00 0.00 N ATOM 1363 CA ARG A 86 -13.982 -10.428 -22.159 1.00 0.00 C ATOM 1364 C ARG A 86 -15.119 -10.905 -23.058 1.00 0.00 C ATOM 1365 O ARG A 86 -15.988 -10.123 -23.442 1.00 0.00 O ATOM 1366 CB ARG A 86 -12.864 -9.823 -23.011 1.00 0.00 C ATOM 1367 CG ARG A 86 -12.301 -10.782 -24.047 1.00 0.00 C ATOM 1368 CD ARG A 86 -12.661 -10.351 -25.460 1.00 0.00 C ATOM 1369 NE ARG A 86 -11.665 -9.446 -26.027 1.00 0.00 N ATOM 1370 CZ ARG A 86 -11.844 -8.771 -27.157 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -12.975 -8.897 -27.836 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -10.890 -7.966 -27.609 1.00 0.00 N ATOM 0 H ARG A 86 -12.486 -11.754 -21.526 1.00 0.00 H new ATOM 0 HA ARG A 86 -14.370 -9.665 -21.485 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -13.244 -8.936 -23.518 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -12.057 -9.494 -22.356 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.217 -10.833 -23.946 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -12.685 -11.785 -23.862 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.753 -11.232 -26.095 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.634 -9.860 -25.452 1.00 0.00 H new ATOM 0 HE ARG A 86 -10.784 -9.326 -25.528 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.711 -9.513 -27.491 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.110 -8.377 -28.703 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.019 -7.865 -27.089 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.028 -7.448 -28.477 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.105 -12.192 -23.388 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.135 -12.772 -24.242 1.00 0.00 C ATOM 1388 C GLU A 87 -17.528 -12.457 -23.705 1.00 0.00 C ATOM 1389 O GLU A 87 -18.306 -11.748 -24.345 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.948 -14.287 -24.348 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.331 -14.734 -25.662 1.00 0.00 C ATOM 1392 CD GLU A 87 -16.349 -15.342 -26.608 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -16.778 -16.489 -26.361 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -16.717 -14.671 -27.594 1.00 0.00 O ATOM 0 H GLU A 87 -14.393 -12.853 -23.077 1.00 0.00 H new ATOM 0 HA GLU A 87 -16.038 -12.331 -25.234 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.316 -14.625 -23.526 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.916 -14.773 -24.227 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.856 -13.880 -26.145 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.546 -15.463 -25.461 1.00 0.00 H new ATOM 1401 N ARG A 88 -17.837 -12.989 -22.527 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.136 -12.766 -21.904 1.00 0.00 C ATOM 1403 C ARG A 88 -19.408 -11.274 -21.734 1.00 0.00 C ATOM 1404 O ARG A 88 -20.559 -10.836 -21.754 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.201 -13.466 -20.546 1.00 0.00 C ATOM 1406 CG ARG A 88 -17.995 -13.192 -19.661 1.00 0.00 C ATOM 1407 CD ARG A 88 -18.315 -13.431 -18.194 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.950 -14.779 -17.767 1.00 0.00 N ATOM 1409 CZ ARG A 88 -18.222 -15.267 -16.561 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -18.858 -14.521 -15.669 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -17.857 -16.503 -16.247 1.00 0.00 N ATOM 0 H ARG A 88 -17.205 -13.578 -21.985 1.00 0.00 H new ATOM 0 HA ARG A 88 -19.901 -13.185 -22.557 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.104 -13.147 -20.025 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -19.288 -14.541 -20.705 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -17.167 -13.834 -19.963 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -17.667 -12.162 -19.800 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -17.784 -12.701 -17.583 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -19.380 -13.273 -18.025 1.00 0.00 H new ATOM 0 HE ARG A 88 -17.460 -15.379 -18.430 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -19.140 -13.570 -15.907 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -19.066 -14.898 -14.744 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -17.367 -17.080 -16.931 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -18.066 -16.877 -15.321 1.00 0.00 H new ATOM 1425 N LEU A 89 -18.343 -10.499 -21.565 1.00 0.00 N ATOM 1426 CA LEU A 89 -18.466 -9.056 -21.390 1.00 0.00 C ATOM 1427 C LEU A 89 -18.906 -8.386 -22.688 1.00 0.00 C ATOM 1428 O LEU A 89 -19.574 -7.352 -22.670 1.00 0.00 O ATOM 1429 CB LEU A 89 -17.136 -8.463 -20.922 1.00 0.00 C ATOM 1430 CG LEU A 89 -16.661 -8.894 -19.534 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -15.273 -8.342 -19.250 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -17.647 -8.438 -18.468 1.00 0.00 C ATOM 0 H LEU A 89 -17.384 -10.846 -21.545 1.00 0.00 H new ATOM 0 HA LEU A 89 -19.226 -8.871 -20.631 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -16.367 -8.730 -21.647 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.221 -7.376 -20.934 1.00 0.00 H new ATOM 0 HG LEU A 89 -16.608 -9.982 -19.510 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -14.951 -8.659 -18.258 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -14.572 -8.718 -19.996 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -15.299 -7.253 -19.292 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -17.293 -8.753 -17.486 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -17.732 -7.352 -18.492 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -18.623 -8.882 -18.662 1.00 0.00 H new ATOM 1444 N PHE A 90 -18.528 -8.983 -23.814 1.00 0.00 N ATOM 1445 CA PHE A 90 -18.884 -8.445 -25.121 1.00 0.00 C ATOM 1446 C PHE A 90 -20.313 -8.826 -25.496 1.00 0.00 C ATOM 1447 O PHE A 90 -21.033 -8.044 -26.117 1.00 0.00 O ATOM 1448 CB PHE A 90 -17.912 -8.954 -26.188 1.00 0.00 C ATOM 1449 CG PHE A 90 -17.107 -7.863 -26.835 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -17.599 -7.182 -27.937 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -15.858 -7.521 -26.342 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -16.861 -6.178 -28.534 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -15.116 -6.517 -26.935 1.00 0.00 C ATOM 1454 CZ PHE A 90 -15.617 -5.846 -28.033 1.00 0.00 C ATOM 0 H PHE A 90 -17.975 -9.840 -23.847 1.00 0.00 H new ATOM 0 HA PHE A 90 -18.819 -7.358 -25.068 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -17.233 -9.676 -25.735 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -18.474 -9.485 -26.957 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -18.570 -7.439 -28.334 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -15.460 -8.045 -25.485 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -17.256 -5.653 -29.391 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -14.145 -6.257 -26.540 1.00 0.00 H new ATOM 0 HZ PHE A 90 -15.037 -5.063 -28.499 1.00 0.00 H new ATOM 1464 N ARG A 91 -20.717 -10.033 -25.113 1.00 0.00 N ATOM 1465 CA ARG A 91 -22.058 -10.520 -25.410 1.00 0.00 C ATOM 1466 C ARG A 91 -23.107 -9.730 -24.632 1.00 0.00 C ATOM 1467 O ARG A 91 -24.245 -9.584 -25.078 1.00 0.00 O ATOM 1468 CB ARG A 91 -22.171 -12.008 -25.072 1.00 0.00 C ATOM 1469 CG ARG A 91 -22.600 -12.869 -26.248 1.00 0.00 C ATOM 1470 CD ARG A 91 -23.526 -13.992 -25.808 1.00 0.00 C ATOM 1471 NE ARG A 91 -23.492 -15.123 -26.731 1.00 0.00 N ATOM 1472 CZ ARG A 91 -22.454 -15.945 -26.848 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -21.372 -15.761 -26.105 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -22.498 -16.952 -27.711 1.00 0.00 N ATOM 0 H ARG A 91 -20.134 -10.691 -24.596 1.00 0.00 H new ATOM 0 HA ARG A 91 -22.239 -10.382 -26.476 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -21.208 -12.363 -24.705 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -22.887 -12.134 -24.260 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -23.105 -12.249 -26.989 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -21.719 -13.291 -26.732 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -23.240 -14.329 -24.812 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -24.546 -13.614 -25.736 1.00 0.00 H new ATOM 0 HE ARG A 91 -24.309 -15.291 -27.318 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -21.335 -14.987 -25.441 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -20.577 -16.393 -26.197 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -23.329 -17.096 -28.285 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -21.701 -17.582 -27.800 1.00 0.00 H new ATOM 1488 N ASN A 92 -22.716 -9.224 -23.467 1.00 0.00 N ATOM 1489 CA ASN A 92 -23.623 -8.450 -22.627 1.00 0.00 C ATOM 1490 C ASN A 92 -23.320 -6.958 -22.730 1.00 0.00 C ATOM 1491 O ASN A 92 -23.457 -6.219 -21.756 1.00 0.00 O ATOM 1492 CB ASN A 92 -23.514 -8.904 -21.170 1.00 0.00 C ATOM 1493 CG ASN A 92 -24.871 -9.079 -20.516 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -25.858 -8.479 -20.940 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -24.924 -9.903 -19.476 1.00 0.00 N ATOM 0 H ASN A 92 -21.778 -9.336 -23.083 1.00 0.00 H new ATOM 0 HA ASN A 92 -24.640 -8.622 -22.979 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -22.968 -9.846 -21.126 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -22.934 -8.173 -20.607 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -25.809 -10.060 -18.994 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -24.080 -10.379 -19.159 1.00 0.00 H new ATOM 1502 N GLN A 93 -22.910 -6.524 -23.918 1.00 0.00 N ATOM 1503 CA GLN A 93 -22.589 -5.121 -24.148 1.00 0.00 C ATOM 1504 C GLN A 93 -23.855 -4.303 -24.378 1.00 0.00 C ATOM 1505 O GLN A 93 -24.027 -3.229 -23.801 1.00 0.00 O ATOM 1506 CB GLN A 93 -21.652 -4.981 -25.349 1.00 0.00 C ATOM 1507 CG GLN A 93 -21.341 -3.538 -25.713 1.00 0.00 C ATOM 1508 CD GLN A 93 -20.389 -3.425 -26.888 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -20.086 -4.415 -27.554 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -19.911 -2.213 -27.148 1.00 0.00 N ATOM 0 H GLN A 93 -22.793 -7.123 -24.735 1.00 0.00 H new ATOM 0 HA GLN A 93 -22.088 -4.739 -23.259 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -20.719 -5.502 -25.134 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -22.102 -5.475 -26.210 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -22.269 -3.019 -25.951 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -20.907 -3.035 -24.849 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -20.189 -1.420 -26.570 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -19.266 -2.075 -27.926 1.00 0.00 H new ATOM 1519 N LYS A 94 -24.740 -4.817 -25.226 1.00 0.00 N ATOM 1520 CA LYS A 94 -25.992 -4.136 -25.532 1.00 0.00 C ATOM 1521 C LYS A 94 -26.881 -5.004 -26.417 1.00 0.00 C ATOM 1522 O LYS A 94 -26.448 -6.041 -26.920 1.00 0.00 O ATOM 1523 CB LYS A 94 -25.713 -2.800 -26.225 1.00 0.00 C ATOM 1524 CG LYS A 94 -26.160 -1.592 -25.420 1.00 0.00 C ATOM 1525 CD LYS A 94 -27.054 -0.676 -26.239 1.00 0.00 C ATOM 1526 CE LYS A 94 -26.241 0.198 -27.182 1.00 0.00 C ATOM 1527 NZ LYS A 94 -26.571 -0.070 -28.609 1.00 0.00 N ATOM 0 H LYS A 94 -24.613 -5.704 -25.714 1.00 0.00 H new ATOM 0 HA LYS A 94 -26.515 -3.950 -24.594 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -24.644 -2.719 -26.423 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -26.217 -2.789 -27.191 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -26.695 -1.924 -24.530 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -25.286 -1.038 -25.078 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -27.761 -1.274 -26.814 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -27.640 -0.045 -25.571 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -26.429 1.248 -26.957 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -25.178 0.021 -27.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -25.996 0.545 -29.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -26.368 -1.066 -28.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -27.579 0.123 -28.774 1.00 0.00 H new ATOM 1541 N ILE A 95 -28.124 -4.572 -26.604 1.00 0.00 N ATOM 1542 CA ILE A 95 -29.071 -5.309 -27.431 1.00 0.00 C ATOM 1543 C ILE A 95 -28.511 -5.550 -28.828 1.00 0.00 C ATOM 1544 O ILE A 95 -28.817 -6.558 -29.467 1.00 0.00 O ATOM 1545 CB ILE A 95 -30.413 -4.563 -27.550 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -31.427 -5.412 -28.320 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -30.213 -3.218 -28.233 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -32.814 -5.391 -27.716 1.00 0.00 C ATOM 0 H ILE A 95 -28.498 -3.716 -26.194 1.00 0.00 H new ATOM 0 HA ILE A 95 -29.239 -6.267 -26.940 1.00 0.00 H new ATOM 0 HB ILE A 95 -30.803 -4.385 -26.548 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -31.482 -5.055 -29.348 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -31.072 -6.442 -28.359 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -31.171 -2.703 -28.310 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -29.521 -2.612 -27.648 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -29.804 -3.374 -29.231 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -33.480 -6.014 -28.313 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -32.773 -5.776 -26.697 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -33.189 -4.368 -27.702 1.00 0.00 H new ATOM 1560 N LEU A 96 -27.687 -4.620 -29.297 1.00 0.00 N ATOM 1561 CA LEU A 96 -27.081 -4.731 -30.620 1.00 0.00 C ATOM 1562 C LEU A 96 -28.148 -4.731 -31.710 1.00 0.00 C ATOM 1563 O LEU A 96 -29.343 -4.674 -31.422 1.00 0.00 O ATOM 1564 CB LEU A 96 -26.242 -6.007 -30.712 1.00 0.00 C ATOM 1565 CG LEU A 96 -24.769 -5.817 -31.077 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -24.045 -5.041 -29.988 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -24.099 -7.164 -31.309 1.00 0.00 C ATOM 0 H LEU A 96 -27.423 -3.781 -28.781 1.00 0.00 H new ATOM 0 HA LEU A 96 -26.435 -3.866 -30.770 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -26.294 -6.522 -29.753 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -26.697 -6.665 -31.453 1.00 0.00 H new ATOM 0 HG LEU A 96 -24.715 -5.242 -32.002 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -22.998 -4.916 -30.265 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -24.509 -4.062 -29.869 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -24.108 -5.589 -29.048 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -23.051 -7.010 -31.568 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -24.164 -7.764 -30.401 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -24.601 -7.684 -32.124 1.00 0.00 H new ATOM 1579 N ARG A 97 -27.707 -4.796 -32.962 1.00 0.00 N ATOM 1580 CA ARG A 97 -28.624 -4.804 -34.095 1.00 0.00 C ATOM 1581 C ARG A 97 -28.197 -5.838 -35.133 1.00 0.00 C ATOM 1582 O ARG A 97 -27.134 -6.447 -35.015 1.00 0.00 O ATOM 1583 CB ARG A 97 -28.688 -3.417 -34.737 1.00 0.00 C ATOM 1584 CG ARG A 97 -30.065 -2.777 -34.670 1.00 0.00 C ATOM 1585 CD ARG A 97 -30.278 -2.052 -33.351 1.00 0.00 C ATOM 1586 NE ARG A 97 -31.589 -2.338 -32.775 1.00 0.00 N ATOM 1587 CZ ARG A 97 -32.709 -1.739 -33.163 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -32.678 -0.825 -34.123 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -33.864 -2.053 -32.590 1.00 0.00 N ATOM 0 H ARG A 97 -26.721 -4.844 -33.217 1.00 0.00 H new ATOM 0 HA ARG A 97 -29.614 -5.072 -33.727 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -27.969 -2.764 -34.243 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -28.383 -3.495 -35.781 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -30.182 -2.075 -35.495 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -30.830 -3.543 -34.793 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -29.500 -2.346 -32.646 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -30.177 -0.978 -33.507 1.00 0.00 H new ATOM 0 HE ARG A 97 -31.648 -3.036 -32.034 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -31.792 -0.580 -34.566 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -33.540 -0.367 -34.419 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -33.892 -2.755 -31.851 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -34.723 -1.592 -32.889 1.00 0.00 H new ATOM 1603 N GLU A 98 -29.033 -6.030 -36.149 1.00 0.00 N ATOM 1604 CA GLU A 98 -28.741 -6.990 -37.206 1.00 0.00 C ATOM 1605 C GLU A 98 -29.675 -6.790 -38.396 1.00 0.00 C ATOM 1606 O GLU A 98 -30.576 -5.952 -38.358 1.00 0.00 O ATOM 1607 CB GLU A 98 -28.871 -8.420 -36.677 1.00 0.00 C ATOM 1608 CG GLU A 98 -30.238 -8.731 -36.092 1.00 0.00 C ATOM 1609 CD GLU A 98 -30.206 -9.891 -35.116 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -29.304 -10.746 -35.242 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -31.082 -9.945 -34.228 1.00 0.00 O ATOM 0 H GLU A 98 -29.917 -5.534 -36.262 1.00 0.00 H new ATOM 0 HA GLU A 98 -27.716 -6.825 -37.538 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -28.665 -9.118 -37.488 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -28.112 -8.586 -35.913 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -30.622 -7.846 -35.585 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -30.931 -8.961 -36.901 1.00 0.00 H new ATOM 1618 N TYR A 99 -29.453 -7.565 -39.452 1.00 0.00 N ATOM 1619 CA TYR A 99 -30.272 -7.472 -40.654 1.00 0.00 C ATOM 1620 C TYR A 99 -31.433 -8.460 -40.601 1.00 0.00 C ATOM 1621 O TYR A 99 -31.256 -9.624 -40.240 1.00 0.00 O ATOM 1622 CB TYR A 99 -29.421 -7.734 -41.898 1.00 0.00 C ATOM 1623 CG TYR A 99 -29.038 -9.186 -42.075 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -27.876 -9.693 -41.507 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -29.840 -10.052 -42.809 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -27.522 -11.018 -41.667 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -29.495 -11.379 -42.973 1.00 0.00 C ATOM 1628 CZ TYR A 99 -28.335 -11.858 -42.400 1.00 0.00 C ATOM 1629 OH TYR A 99 -27.986 -13.179 -42.560 1.00 0.00 O ATOM 0 H TYR A 99 -28.712 -8.265 -39.500 1.00 0.00 H new ATOM 0 HA TYR A 99 -30.680 -6.463 -40.707 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -29.969 -7.402 -42.780 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -28.514 -7.132 -41.841 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -27.238 -9.039 -40.930 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -30.749 -9.681 -43.259 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -26.614 -11.395 -41.221 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -30.130 -12.038 -43.547 1.00 0.00 H new ATOM 0 HH TYR A 99 -28.665 -13.634 -43.101 1.00 0.00 H new ATOM 1639 N ARG A 100 -32.621 -7.988 -40.964 1.00 0.00 N ATOM 1640 CA ARG A 100 -33.812 -8.829 -40.957 1.00 0.00 C ATOM 1641 C ARG A 100 -34.614 -8.645 -42.243 1.00 0.00 C ATOM 1642 O ARG A 100 -34.346 -7.737 -43.029 1.00 0.00 O ATOM 1643 CB ARG A 100 -34.687 -8.500 -39.746 1.00 0.00 C ATOM 1644 CG ARG A 100 -33.961 -8.627 -38.417 1.00 0.00 C ATOM 1645 CD ARG A 100 -34.062 -10.038 -37.859 1.00 0.00 C ATOM 1646 NE ARG A 100 -35.437 -10.394 -37.519 1.00 0.00 N ATOM 1647 CZ ARG A 100 -35.777 -11.539 -36.938 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -34.847 -12.434 -36.634 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -37.050 -11.791 -36.659 1.00 0.00 N ATOM 0 H ARG A 100 -32.784 -7.028 -41.267 1.00 0.00 H new ATOM 0 HA ARG A 100 -33.492 -9.869 -40.894 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -35.066 -7.483 -39.848 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -35.552 -9.163 -39.743 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -32.912 -8.360 -38.547 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -34.383 -7.921 -37.702 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -33.675 -10.746 -38.591 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -33.435 -10.123 -36.971 1.00 0.00 H new ATOM 0 HE ARG A 100 -36.176 -9.727 -37.740 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -33.868 -12.244 -36.846 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -35.111 -13.312 -36.188 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -37.768 -11.105 -36.891 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -37.310 -12.671 -36.213 1.00 0.00 H new ATOM 1663 N ASP A 101 -35.598 -9.514 -42.448 1.00 0.00 N ATOM 1664 CA ASP A 101 -36.440 -9.448 -43.638 1.00 0.00 C ATOM 1665 C ASP A 101 -37.804 -8.851 -43.306 1.00 0.00 C ATOM 1666 O ASP A 101 -37.953 -7.631 -43.213 1.00 0.00 O ATOM 1667 CB ASP A 101 -36.613 -10.841 -44.244 1.00 0.00 C ATOM 1668 CG ASP A 101 -35.303 -11.426 -44.734 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -34.503 -11.880 -43.890 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -35.077 -11.429 -45.963 1.00 0.00 O ATOM 0 H ASP A 101 -35.832 -10.272 -41.807 1.00 0.00 H new ATOM 0 HA ASP A 101 -35.948 -8.802 -44.366 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -37.049 -11.507 -43.499 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -37.317 -10.788 -45.074 1.00 0.00 H new TER 1675 ASP A 101