USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1028 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 ASN : amide:sc= -0.37 K(o=-3,f=-4.5!) USER MOD Set 1.2: A 108 HIS : no HD1:sc= -2.63! C(o=-3!,f=-3.1!) USER MOD Set 2.1: A 86 TYR OH : rot 180:sc= -0.554 USER MOD Set 2.2: A 98 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.337) USER MOD Set 3.1: A 22 MET CE :methyl 144:sc= -6.07! (180deg=-4.18!) USER MOD Set 3.2: A 74 ASN :FLIP amide:sc= -0.314 F(o=-9.7,f=-6.9) USER MOD Set 3.3: A 77 TYR OH : rot 15:sc= -0.516 USER MOD Single : A 1 GLY N :NH3+ 174:sc= 0 (180deg=-0.0398) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.237 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 159:sc= -0.0493 (180deg=-0.316) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot 46:sc= 0.195 USER MOD Single : A 39 HIS : no HD1:sc= -0.0282 X(o=-0.028,f=-0.034) USER MOD Single : A 40 CYS SG : rot -67:sc= -0.232! USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 47 TYR OH : rot 180:sc= -0.857 USER MOD Single : A 48 THR OG1 : rot 59:sc= 0.125 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= -1.81 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN :FLIP amide:sc= -1.13 F(o=-1.8!,f=-1.1) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl -148:sc= -0.669 (180deg=-4.09!) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.634 USER MOD Single : A 70 ASN : amide:sc= 0.256 K(o=0.26,f=-2.3!) USER MOD Single : A 73 THR OG1 : rot 174:sc= 0.287 USER MOD Single : A 76 GLN : amide:sc= -1.14 X(o=-1.1,f=-0.73) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 116:sc= 0.417 USER MOD Single : A 90 SER OG : rot 15:sc= 1.03 USER MOD Single : A 93 LYS NZ :NH3+ -172:sc= -6.27! (180deg=-7.45!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 SER OG : rot -99:sc= 0.42 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 HIS : no HD1:sc= -9.56! C(o=-9.6!,f=-12!) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 38:sc= 0.848 USER MOD Single : A 123 THR OG1 : rot -68:sc= 0.0595 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 35:sc= 0.171 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.601 -4.847 -22.708 1.00 0.00 N ATOM 2 CA GLY A 1 3.714 -5.777 -22.667 1.00 0.00 C ATOM 3 C GLY A 1 5.054 -5.074 -22.575 1.00 0.00 C ATOM 4 O GLY A 1 6.018 -5.473 -23.228 1.00 0.00 O ATOM 0 H1 GLY A 1 1.717 -5.370 -22.873 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.539 -4.339 -21.802 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.748 -4.164 -23.478 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.597 -6.442 -21.811 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.695 -6.401 -23.561 1.00 0.00 H new ATOM 8 N SER A 2 5.114 -4.023 -21.763 1.00 0.00 N ATOM 9 CA SER A 2 6.345 -3.259 -21.593 1.00 0.00 C ATOM 10 C SER A 2 6.634 -3.019 -20.114 1.00 0.00 C ATOM 11 O SER A 2 5.755 -3.169 -19.266 1.00 0.00 O ATOM 12 CB SER A 2 6.245 -1.921 -22.328 1.00 0.00 C ATOM 13 OG SER A 2 7.527 -1.347 -22.518 1.00 0.00 O ATOM 0 H SER A 2 4.326 -3.681 -21.213 1.00 0.00 H new ATOM 0 HA SER A 2 7.165 -3.838 -22.017 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.762 -2.068 -23.294 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.617 -1.236 -21.759 1.00 0.00 H new ATOM 0 HG SER A 2 7.436 -0.494 -22.991 1.00 0.00 H new ATOM 19 N SER A 3 7.874 -2.645 -19.813 1.00 0.00 N ATOM 20 CA SER A 3 8.282 -2.388 -18.437 1.00 0.00 C ATOM 21 C SER A 3 7.865 -0.987 -18.000 1.00 0.00 C ATOM 22 O SER A 3 7.231 -0.812 -16.960 1.00 0.00 O ATOM 23 CB SER A 3 9.797 -2.550 -18.294 1.00 0.00 C ATOM 24 OG SER A 3 10.181 -3.905 -18.445 1.00 0.00 O ATOM 0 H SER A 3 8.613 -2.513 -20.504 1.00 0.00 H new ATOM 0 HA SER A 3 7.784 -3.114 -17.794 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.303 -1.940 -19.042 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.114 -2.185 -17.317 1.00 0.00 H new ATOM 0 HG SER A 3 11.153 -3.982 -18.351 1.00 0.00 H new ATOM 30 N GLY A 4 8.227 0.009 -18.802 1.00 0.00 N ATOM 31 CA GLY A 4 7.883 1.382 -18.482 1.00 0.00 C ATOM 32 C GLY A 4 9.095 2.292 -18.454 1.00 0.00 C ATOM 33 O GLY A 4 9.949 2.173 -17.576 1.00 0.00 O ATOM 0 H GLY A 4 8.753 -0.110 -19.668 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.169 1.755 -19.217 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.387 1.412 -17.512 1.00 0.00 H new ATOM 37 N SER A 5 9.171 3.203 -19.419 1.00 0.00 N ATOM 38 CA SER A 5 10.291 4.134 -19.505 1.00 0.00 C ATOM 39 C SER A 5 10.222 5.170 -18.387 1.00 0.00 C ATOM 40 O SER A 5 11.172 5.337 -17.621 1.00 0.00 O ATOM 41 CB SER A 5 10.296 4.834 -20.865 1.00 0.00 C ATOM 42 OG SER A 5 11.464 5.621 -21.029 1.00 0.00 O ATOM 0 H SER A 5 8.471 3.316 -20.152 1.00 0.00 H new ATOM 0 HA SER A 5 11.214 3.565 -19.394 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.240 4.091 -21.660 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.412 5.466 -20.956 1.00 0.00 H new ATOM 0 HG SER A 5 11.444 6.057 -21.907 1.00 0.00 H new ATOM 48 N SER A 6 9.092 5.864 -18.300 1.00 0.00 N ATOM 49 CA SER A 6 8.900 6.888 -17.279 1.00 0.00 C ATOM 50 C SER A 6 7.888 6.428 -16.234 1.00 0.00 C ATOM 51 O SER A 6 6.908 5.757 -16.554 1.00 0.00 O ATOM 52 CB SER A 6 8.430 8.195 -17.920 1.00 0.00 C ATOM 53 OG SER A 6 9.526 8.939 -18.424 1.00 0.00 O ATOM 0 H SER A 6 8.295 5.736 -18.924 1.00 0.00 H new ATOM 0 HA SER A 6 9.856 7.058 -16.784 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.732 7.977 -18.728 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.890 8.791 -17.184 1.00 0.00 H new ATOM 0 HG SER A 6 9.199 9.769 -18.830 1.00 0.00 H new ATOM 59 N GLY A 7 8.134 6.796 -14.980 1.00 0.00 N ATOM 60 CA GLY A 7 7.237 6.413 -13.905 1.00 0.00 C ATOM 61 C GLY A 7 7.135 4.910 -13.743 1.00 0.00 C ATOM 62 O GLY A 7 6.351 4.243 -14.418 1.00 0.00 O ATOM 0 H GLY A 7 8.938 7.352 -14.690 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.586 6.853 -12.971 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.246 6.822 -14.100 1.00 0.00 H new ATOM 66 N PRO A 8 7.944 4.353 -12.829 1.00 0.00 N ATOM 67 CA PRO A 8 7.960 2.912 -12.559 1.00 0.00 C ATOM 68 C PRO A 8 6.688 2.437 -11.866 1.00 0.00 C ATOM 69 O PRO A 8 6.086 1.440 -12.265 1.00 0.00 O ATOM 70 CB PRO A 8 9.169 2.738 -11.636 1.00 0.00 C ATOM 71 CG PRO A 8 9.335 4.062 -10.975 1.00 0.00 C ATOM 72 CD PRO A 8 8.904 5.087 -11.987 1.00 0.00 C ATOM 0 HA PRO A 8 8.018 2.326 -13.476 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.998 1.949 -10.904 1.00 0.00 H new ATOM 0 HB3 PRO A 8 10.061 2.462 -12.199 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.728 4.126 -10.072 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.371 4.221 -10.675 1.00 0.00 H new ATOM 0 HD2 PRO A 8 8.442 5.952 -11.511 1.00 0.00 H new ATOM 0 HD3 PRO A 8 9.748 5.457 -12.569 1.00 0.00 H new ATOM 80 N VAL A 9 6.282 3.158 -10.825 1.00 0.00 N ATOM 81 CA VAL A 9 5.080 2.811 -10.077 1.00 0.00 C ATOM 82 C VAL A 9 3.842 2.881 -10.964 1.00 0.00 C ATOM 83 O VAL A 9 3.503 3.939 -11.494 1.00 0.00 O ATOM 84 CB VAL A 9 4.884 3.742 -8.866 1.00 0.00 C ATOM 85 CG1 VAL A 9 3.667 3.319 -8.058 1.00 0.00 C ATOM 86 CG2 VAL A 9 6.132 3.755 -7.997 1.00 0.00 C ATOM 0 H VAL A 9 6.768 3.986 -10.481 1.00 0.00 H new ATOM 0 HA VAL A 9 5.212 1.789 -9.722 1.00 0.00 H new ATOM 0 HB VAL A 9 4.713 4.754 -9.232 1.00 0.00 H new ATOM 0 HG11 VAL A 9 3.545 3.989 -7.207 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.778 3.366 -8.687 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.804 2.299 -7.700 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.976 4.418 -7.146 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.336 2.746 -7.638 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.980 4.110 -8.583 1.00 0.00 H new ATOM 96 N LYS A 10 3.168 1.746 -11.121 1.00 0.00 N ATOM 97 CA LYS A 10 1.965 1.677 -11.942 1.00 0.00 C ATOM 98 C LYS A 10 0.792 2.359 -11.246 1.00 0.00 C ATOM 99 O LYS A 10 0.584 2.186 -10.045 1.00 0.00 O ATOM 100 CB LYS A 10 1.615 0.219 -12.247 1.00 0.00 C ATOM 101 CG LYS A 10 0.394 0.061 -13.137 1.00 0.00 C ATOM 102 CD LYS A 10 0.488 -1.190 -13.995 1.00 0.00 C ATOM 103 CE LYS A 10 -0.727 -1.338 -14.898 1.00 0.00 C ATOM 104 NZ LYS A 10 -0.479 -2.300 -16.008 1.00 0.00 N ATOM 0 H LYS A 10 3.435 0.861 -10.690 1.00 0.00 H new ATOM 0 HA LYS A 10 2.162 2.200 -12.878 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.469 -0.258 -12.728 1.00 0.00 H new ATOM 0 HB3 LYS A 10 1.441 -0.308 -11.309 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -0.503 0.014 -12.520 1.00 0.00 H new ATOM 0 HG3 LYS A 10 0.294 0.937 -13.778 1.00 0.00 H new ATOM 0 HD2 LYS A 10 1.392 -1.149 -14.603 1.00 0.00 H new ATOM 0 HD3 LYS A 10 0.575 -2.067 -13.354 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -1.579 -1.676 -14.308 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -0.992 -0.365 -15.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -1.330 -2.373 -16.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 0.318 -1.965 -16.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -0.251 -3.235 -15.613 1.00 0.00 H new ATOM 118 N VAL A 11 0.025 3.132 -12.008 1.00 0.00 N ATOM 119 CA VAL A 11 -1.130 3.837 -11.465 1.00 0.00 C ATOM 120 C VAL A 11 -2.416 3.058 -11.715 1.00 0.00 C ATOM 121 O VAL A 11 -2.650 2.562 -12.816 1.00 0.00 O ATOM 122 CB VAL A 11 -1.267 5.244 -12.077 1.00 0.00 C ATOM 123 CG1 VAL A 11 0.103 5.833 -12.374 1.00 0.00 C ATOM 124 CG2 VAL A 11 -2.120 5.196 -13.336 1.00 0.00 C ATOM 0 H VAL A 11 0.183 3.286 -13.004 1.00 0.00 H new ATOM 0 HA VAL A 11 -0.968 3.930 -10.391 1.00 0.00 H new ATOM 0 HB VAL A 11 -1.764 5.889 -11.353 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -0.014 6.827 -12.806 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.677 5.904 -11.450 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.630 5.191 -13.080 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.206 6.198 -13.755 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.653 4.536 -14.067 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.113 4.819 -13.089 1.00 0.00 H new ATOM 134 N VAL A 12 -3.249 2.956 -10.683 1.00 0.00 N ATOM 135 CA VAL A 12 -4.514 2.239 -10.791 1.00 0.00 C ATOM 136 C VAL A 12 -5.684 3.124 -10.375 1.00 0.00 C ATOM 137 O VAL A 12 -5.603 3.856 -9.388 1.00 0.00 O ATOM 138 CB VAL A 12 -4.513 0.967 -9.923 1.00 0.00 C ATOM 139 CG1 VAL A 12 -5.835 0.226 -10.059 1.00 0.00 C ATOM 140 CG2 VAL A 12 -3.347 0.066 -10.299 1.00 0.00 C ATOM 0 H VAL A 12 -3.070 3.361 -9.764 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.630 1.956 -11.837 1.00 0.00 H new ATOM 0 HB VAL A 12 -4.394 1.261 -8.880 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.815 -0.670 -9.439 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.650 0.874 -9.736 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.988 -0.057 -11.100 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.362 -0.828 -9.675 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.432 -0.221 -11.347 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.410 0.600 -10.144 1.00 0.00 H new ATOM 150 N VAL A 13 -6.772 3.052 -11.135 1.00 0.00 N ATOM 151 CA VAL A 13 -7.961 3.845 -10.845 1.00 0.00 C ATOM 152 C VAL A 13 -9.113 2.960 -10.383 1.00 0.00 C ATOM 153 O VAL A 13 -8.998 1.735 -10.360 1.00 0.00 O ATOM 154 CB VAL A 13 -8.411 4.652 -12.077 1.00 0.00 C ATOM 155 CG1 VAL A 13 -7.453 5.804 -12.340 1.00 0.00 C ATOM 156 CG2 VAL A 13 -8.517 3.748 -13.296 1.00 0.00 C ATOM 0 H VAL A 13 -6.855 2.453 -11.956 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.694 4.535 -10.045 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.397 5.070 -11.875 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -7.787 6.363 -13.214 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.432 6.465 -11.473 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.453 5.411 -12.521 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.836 4.335 -14.157 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.545 3.300 -13.502 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.246 2.961 -13.103 1.00 0.00 H new ATOM 166 N GLY A 14 -10.225 3.589 -10.015 1.00 0.00 N ATOM 167 CA GLY A 14 -11.383 2.843 -9.558 1.00 0.00 C ATOM 168 C GLY A 14 -11.916 1.896 -10.614 1.00 0.00 C ATOM 169 O GLY A 14 -12.496 0.858 -10.293 1.00 0.00 O ATOM 0 H GLY A 14 -10.345 4.602 -10.025 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.117 2.275 -8.666 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.170 3.540 -9.269 1.00 0.00 H new ATOM 173 N LYS A 15 -11.721 2.253 -11.879 1.00 0.00 N ATOM 174 CA LYS A 15 -12.187 1.428 -12.988 1.00 0.00 C ATOM 175 C LYS A 15 -11.340 0.166 -13.120 1.00 0.00 C ATOM 176 O LYS A 15 -11.815 -0.868 -13.592 1.00 0.00 O ATOM 177 CB LYS A 15 -12.145 2.222 -14.295 1.00 0.00 C ATOM 178 CG LYS A 15 -10.866 2.019 -15.089 1.00 0.00 C ATOM 179 CD LYS A 15 -10.901 2.778 -16.406 1.00 0.00 C ATOM 180 CE LYS A 15 -9.562 2.710 -17.124 1.00 0.00 C ATOM 181 NZ LYS A 15 -9.356 3.876 -18.026 1.00 0.00 N ATOM 0 H LYS A 15 -11.243 3.109 -12.162 1.00 0.00 H new ATOM 0 HA LYS A 15 -13.216 1.134 -12.782 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -12.996 1.934 -14.913 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -12.259 3.282 -14.070 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -10.013 2.353 -14.498 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -10.722 0.956 -15.284 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -11.680 2.363 -17.046 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -11.163 3.820 -16.220 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -8.758 2.673 -16.389 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -9.507 1.788 -17.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -8.432 3.792 -18.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -10.109 3.898 -18.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -9.383 4.754 -17.470 1.00 0.00 H new ATOM 195 N THR A 16 -10.082 0.256 -12.700 1.00 0.00 N ATOM 196 CA THR A 16 -9.169 -0.878 -12.771 1.00 0.00 C ATOM 197 C THR A 16 -8.616 -1.225 -11.394 1.00 0.00 C ATOM 198 O THR A 16 -7.597 -1.908 -11.277 1.00 0.00 O ATOM 199 CB THR A 16 -7.995 -0.594 -13.727 1.00 0.00 C ATOM 200 OG1 THR A 16 -7.137 0.406 -13.166 1.00 0.00 O ATOM 201 CG2 THR A 16 -8.502 -0.131 -15.085 1.00 0.00 C ATOM 0 H THR A 16 -9.672 1.103 -12.307 1.00 0.00 H new ATOM 0 HA THR A 16 -9.742 -1.723 -13.152 1.00 0.00 H new ATOM 0 HB THR A 16 -7.434 -1.519 -13.863 1.00 0.00 H new ATOM 0 HG1 THR A 16 -6.392 0.579 -13.779 1.00 0.00 H new ATOM 0 HG21 THR A 16 -7.655 0.063 -15.743 1.00 0.00 H new ATOM 0 HG22 THR A 16 -9.131 -0.907 -15.522 1.00 0.00 H new ATOM 0 HG23 THR A 16 -9.084 0.782 -14.964 1.00 0.00 H new ATOM 209 N PHE A 17 -9.293 -0.753 -10.353 1.00 0.00 N ATOM 210 CA PHE A 17 -8.868 -1.014 -8.982 1.00 0.00 C ATOM 211 C PHE A 17 -9.166 -2.457 -8.586 1.00 0.00 C ATOM 212 O PHE A 17 -8.301 -3.160 -8.064 1.00 0.00 O ATOM 213 CB PHE A 17 -9.567 -0.054 -8.018 1.00 0.00 C ATOM 214 CG PHE A 17 -9.087 -0.174 -6.600 1.00 0.00 C ATOM 215 CD1 PHE A 17 -9.644 -1.109 -5.742 1.00 0.00 C ATOM 216 CD2 PHE A 17 -8.078 0.649 -6.124 1.00 0.00 C ATOM 217 CE1 PHE A 17 -9.204 -1.222 -4.437 1.00 0.00 C ATOM 218 CE2 PHE A 17 -7.634 0.540 -4.820 1.00 0.00 C ATOM 219 CZ PHE A 17 -8.198 -0.396 -3.975 1.00 0.00 C ATOM 0 H PHE A 17 -10.138 -0.188 -10.432 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.791 -0.855 -8.925 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.412 0.969 -8.360 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -10.641 -0.240 -8.047 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.431 -1.757 -6.098 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.634 1.383 -6.780 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -9.646 -1.955 -3.779 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.846 1.186 -4.462 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.853 -0.482 -2.955 1.00 0.00 H new ATOM 229 N ASP A 18 -10.396 -2.892 -8.839 1.00 0.00 N ATOM 230 CA ASP A 18 -10.809 -4.251 -8.510 1.00 0.00 C ATOM 231 C ASP A 18 -10.171 -5.259 -9.461 1.00 0.00 C ATOM 232 O ASP A 18 -10.285 -6.468 -9.267 1.00 0.00 O ATOM 233 CB ASP A 18 -12.333 -4.371 -8.566 1.00 0.00 C ATOM 234 CG ASP A 18 -12.998 -3.910 -7.285 1.00 0.00 C ATOM 235 OD1 ASP A 18 -12.453 -4.195 -6.198 1.00 0.00 O ATOM 236 OD2 ASP A 18 -14.064 -3.264 -7.368 1.00 0.00 O ATOM 0 H ASP A 18 -11.124 -2.323 -9.271 1.00 0.00 H new ATOM 0 HA ASP A 18 -10.472 -4.472 -7.497 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -12.710 -3.780 -9.401 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -12.606 -5.408 -8.760 1.00 0.00 H new ATOM 241 N ALA A 19 -9.501 -4.750 -10.491 1.00 0.00 N ATOM 242 CA ALA A 19 -8.845 -5.606 -11.472 1.00 0.00 C ATOM 243 C ALA A 19 -7.358 -5.753 -11.164 1.00 0.00 C ATOM 244 O ALA A 19 -6.801 -6.847 -11.260 1.00 0.00 O ATOM 245 CB ALA A 19 -9.043 -5.049 -12.874 1.00 0.00 C ATOM 0 H ALA A 19 -9.399 -3.751 -10.667 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.300 -6.595 -11.418 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -8.548 -5.698 -13.597 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -10.108 -5.001 -13.099 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.615 -4.048 -12.932 1.00 0.00 H new ATOM 251 N ILE A 20 -6.723 -4.646 -10.796 1.00 0.00 N ATOM 252 CA ILE A 20 -5.301 -4.653 -10.474 1.00 0.00 C ATOM 253 C ILE A 20 -5.078 -4.797 -8.972 1.00 0.00 C ATOM 254 O ILE A 20 -4.606 -5.832 -8.500 1.00 0.00 O ATOM 255 CB ILE A 20 -4.607 -3.369 -10.964 1.00 0.00 C ATOM 256 CG1 ILE A 20 -4.678 -3.275 -12.489 1.00 0.00 C ATOM 257 CG2 ILE A 20 -3.161 -3.336 -10.493 1.00 0.00 C ATOM 258 CD1 ILE A 20 -4.438 -1.879 -13.021 1.00 0.00 C ATOM 0 H ILE A 20 -7.170 -3.733 -10.713 1.00 0.00 H new ATOM 0 HA ILE A 20 -4.865 -5.510 -10.987 1.00 0.00 H new ATOM 0 HB ILE A 20 -5.126 -2.509 -10.541 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -3.941 -3.951 -12.921 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -5.658 -3.618 -12.821 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -2.684 -2.422 -10.847 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.132 -3.361 -9.404 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.629 -4.201 -10.890 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.503 -1.888 -14.109 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.191 -1.202 -12.618 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -3.447 -1.540 -12.720 1.00 0.00 H new ATOM 270 N VAL A 21 -5.422 -3.753 -8.226 1.00 0.00 N ATOM 271 CA VAL A 21 -5.262 -3.763 -6.776 1.00 0.00 C ATOM 272 C VAL A 21 -5.904 -5.002 -6.162 1.00 0.00 C ATOM 273 O VAL A 21 -5.522 -5.438 -5.076 1.00 0.00 O ATOM 274 CB VAL A 21 -5.879 -2.506 -6.134 1.00 0.00 C ATOM 275 CG1 VAL A 21 -5.537 -2.440 -4.654 1.00 0.00 C ATOM 276 CG2 VAL A 21 -5.406 -1.253 -6.856 1.00 0.00 C ATOM 0 H VAL A 21 -5.813 -2.889 -8.601 1.00 0.00 H new ATOM 0 HA VAL A 21 -4.191 -3.775 -6.575 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.963 -2.565 -6.229 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.981 -1.546 -4.217 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -5.930 -3.323 -4.150 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -4.454 -2.404 -4.532 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -5.851 -0.374 -6.390 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.320 -1.185 -6.794 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -5.707 -1.300 -7.902 1.00 0.00 H new ATOM 286 N MET A 22 -6.882 -5.565 -6.864 1.00 0.00 N ATOM 287 CA MET A 22 -7.576 -6.755 -6.387 1.00 0.00 C ATOM 288 C MET A 22 -7.351 -7.931 -7.333 1.00 0.00 C ATOM 289 O MET A 22 -8.259 -8.725 -7.579 1.00 0.00 O ATOM 290 CB MET A 22 -9.074 -6.477 -6.249 1.00 0.00 C ATOM 291 CG MET A 22 -9.401 -5.405 -5.223 1.00 0.00 C ATOM 292 SD MET A 22 -9.300 -6.012 -3.528 1.00 0.00 S ATOM 293 CE MET A 22 -8.655 -4.568 -2.688 1.00 0.00 C ATOM 0 H MET A 22 -7.211 -5.217 -7.764 1.00 0.00 H new ATOM 0 HA MET A 22 -7.170 -7.014 -5.409 1.00 0.00 H new ATOM 0 HB2 MET A 22 -9.470 -6.173 -7.218 1.00 0.00 H new ATOM 0 HB3 MET A 22 -9.583 -7.400 -5.972 1.00 0.00 H new ATOM 0 HG2 MET A 22 -8.714 -4.568 -5.347 1.00 0.00 H new ATOM 0 HG3 MET A 22 -10.405 -5.024 -5.409 1.00 0.00 H new ATOM 0 HE1 MET A 22 -9.098 -4.497 -1.694 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.572 -4.653 -2.598 1.00 0.00 H new ATOM 0 HE3 MET A 22 -8.902 -3.674 -3.260 1.00 0.00 H new ATOM 303 N ASP A 23 -6.136 -8.036 -7.860 1.00 0.00 N ATOM 304 CA ASP A 23 -5.791 -9.115 -8.778 1.00 0.00 C ATOM 305 C ASP A 23 -5.362 -10.363 -8.012 1.00 0.00 C ATOM 306 O ASP A 23 -4.295 -10.409 -7.400 1.00 0.00 O ATOM 307 CB ASP A 23 -4.674 -8.672 -9.723 1.00 0.00 C ATOM 308 CG ASP A 23 -4.758 -9.349 -11.077 1.00 0.00 C ATOM 309 OD1 ASP A 23 -5.875 -9.436 -11.629 1.00 0.00 O ATOM 310 OD2 ASP A 23 -3.707 -9.792 -11.585 1.00 0.00 O ATOM 0 H ASP A 23 -5.373 -7.387 -7.667 1.00 0.00 H new ATOM 0 HA ASP A 23 -6.677 -9.357 -9.365 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -4.723 -7.591 -9.857 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -3.708 -8.894 -9.269 1.00 0.00 H new ATOM 315 N PRO A 24 -6.212 -11.400 -8.046 1.00 0.00 N ATOM 316 CA PRO A 24 -5.943 -12.667 -7.360 1.00 0.00 C ATOM 317 C PRO A 24 -4.809 -13.450 -8.013 1.00 0.00 C ATOM 318 O PRO A 24 -4.499 -14.570 -7.607 1.00 0.00 O ATOM 319 CB PRO A 24 -7.264 -13.430 -7.492 1.00 0.00 C ATOM 320 CG PRO A 24 -7.909 -12.862 -8.709 1.00 0.00 C ATOM 321 CD PRO A 24 -7.502 -11.415 -8.756 1.00 0.00 C ATOM 0 HA PRO A 24 -5.625 -12.512 -6.329 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -7.094 -14.501 -7.598 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -7.891 -13.292 -6.611 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -7.582 -13.389 -9.606 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -8.993 -12.961 -8.658 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -7.400 -11.059 -9.781 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -8.237 -10.775 -8.268 1.00 0.00 H new ATOM 329 N LYS A 25 -4.192 -12.853 -9.028 1.00 0.00 N ATOM 330 CA LYS A 25 -3.090 -13.493 -9.737 1.00 0.00 C ATOM 331 C LYS A 25 -1.755 -13.172 -9.072 1.00 0.00 C ATOM 332 O LYS A 25 -0.812 -13.960 -9.136 1.00 0.00 O ATOM 333 CB LYS A 25 -3.066 -13.040 -11.198 1.00 0.00 C ATOM 334 CG LYS A 25 -4.418 -13.128 -11.885 1.00 0.00 C ATOM 335 CD LYS A 25 -4.270 -13.296 -13.388 1.00 0.00 C ATOM 336 CE LYS A 25 -4.059 -11.958 -14.080 1.00 0.00 C ATOM 337 NZ LYS A 25 -4.133 -12.082 -15.562 1.00 0.00 N ATOM 0 H LYS A 25 -4.437 -11.927 -9.378 1.00 0.00 H new ATOM 0 HA LYS A 25 -3.244 -14.571 -9.699 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.711 -12.011 -11.245 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -2.349 -13.650 -11.747 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -4.980 -13.968 -11.478 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -4.994 -12.227 -11.674 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.427 -13.954 -13.600 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.160 -13.779 -13.791 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.812 -11.249 -13.737 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -3.087 -11.552 -13.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.984 -11.149 -15.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.398 -12.739 -15.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.069 -12.445 -15.834 1.00 0.00 H new ATOM 351 N LYS A 26 -1.683 -12.009 -8.432 1.00 0.00 N ATOM 352 CA LYS A 26 -0.465 -11.584 -7.753 1.00 0.00 C ATOM 353 C LYS A 26 -0.762 -10.478 -6.745 1.00 0.00 C ATOM 354 O LYS A 26 -1.750 -9.755 -6.876 1.00 0.00 O ATOM 355 CB LYS A 26 0.568 -11.097 -8.771 1.00 0.00 C ATOM 356 CG LYS A 26 0.029 -10.053 -9.733 1.00 0.00 C ATOM 357 CD LYS A 26 1.113 -9.080 -10.164 1.00 0.00 C ATOM 358 CE LYS A 26 1.865 -9.588 -11.385 1.00 0.00 C ATOM 359 NZ LYS A 26 1.013 -9.573 -12.607 1.00 0.00 N ATOM 0 H LYS A 26 -2.454 -11.344 -8.370 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.060 -12.442 -7.216 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.423 -10.681 -8.238 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.933 -11.951 -9.342 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.388 -10.547 -10.611 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.785 -9.505 -9.258 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.666 -8.111 -10.388 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.813 -8.926 -9.343 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.748 -8.971 -11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.216 -10.603 -11.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.619 -9.575 -13.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.403 -10.416 -12.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.421 -8.718 -12.607 1.00 0.00 H new ATOM 373 N ASP A 27 0.100 -10.351 -5.742 1.00 0.00 N ATOM 374 CA ASP A 27 -0.069 -9.330 -4.714 1.00 0.00 C ATOM 375 C ASP A 27 0.244 -7.944 -5.268 1.00 0.00 C ATOM 376 O ASP A 27 1.257 -7.746 -5.938 1.00 0.00 O ATOM 377 CB ASP A 27 0.832 -9.630 -3.515 1.00 0.00 C ATOM 378 CG ASP A 27 0.856 -11.104 -3.162 1.00 0.00 C ATOM 379 OD1 ASP A 27 -0.225 -11.665 -2.888 1.00 0.00 O ATOM 380 OD2 ASP A 27 1.955 -11.696 -3.160 1.00 0.00 O ATOM 0 H ASP A 27 0.922 -10.942 -5.619 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.109 -9.345 -4.389 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.846 -9.295 -3.734 1.00 0.00 H new ATOM 0 HB3 ASP A 27 0.487 -9.059 -2.653 1.00 0.00 H new ATOM 385 N VAL A 28 -0.634 -6.987 -4.984 1.00 0.00 N ATOM 386 CA VAL A 28 -0.452 -5.618 -5.454 1.00 0.00 C ATOM 387 C VAL A 28 -0.484 -4.630 -4.293 1.00 0.00 C ATOM 388 O VAL A 28 -1.475 -4.542 -3.566 1.00 0.00 O ATOM 389 CB VAL A 28 -1.534 -5.227 -6.477 1.00 0.00 C ATOM 390 CG1 VAL A 28 -1.360 -3.780 -6.912 1.00 0.00 C ATOM 391 CG2 VAL A 28 -1.494 -6.161 -7.677 1.00 0.00 C ATOM 0 H VAL A 28 -1.478 -7.134 -4.431 1.00 0.00 H new ATOM 0 HA VAL A 28 0.525 -5.576 -5.936 1.00 0.00 H new ATOM 0 HB VAL A 28 -2.510 -5.324 -6.002 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.134 -3.522 -7.635 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -1.442 -3.127 -6.043 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.379 -3.653 -7.370 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.265 -5.870 -8.390 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.516 -6.098 -8.154 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.672 -7.185 -7.347 1.00 0.00 H new ATOM 401 N LEU A 29 0.604 -3.887 -4.125 1.00 0.00 N ATOM 402 CA LEU A 29 0.701 -2.903 -3.053 1.00 0.00 C ATOM 403 C LEU A 29 0.163 -1.550 -3.505 1.00 0.00 C ATOM 404 O LEU A 29 0.828 -0.821 -4.241 1.00 0.00 O ATOM 405 CB LEU A 29 2.153 -2.760 -2.595 1.00 0.00 C ATOM 406 CG LEU A 29 2.399 -1.799 -1.432 1.00 0.00 C ATOM 407 CD1 LEU A 29 2.115 -2.483 -0.104 1.00 0.00 C ATOM 408 CD2 LEU A 29 3.826 -1.271 -1.468 1.00 0.00 C ATOM 0 H LEU A 29 1.432 -3.947 -4.718 1.00 0.00 H new ATOM 0 HA LEU A 29 0.096 -3.253 -2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 29 2.522 -3.745 -2.310 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.750 -2.430 -3.445 1.00 0.00 H new ATOM 0 HG LEU A 29 1.718 -0.954 -1.535 1.00 0.00 H new ATOM 0 HD11 LEU A 29 2.296 -1.783 0.712 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.075 -2.810 -0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 29 2.770 -3.347 0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 29 3.983 -0.589 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 29 4.524 -2.104 -1.392 1.00 0.00 H new ATOM 0 HD23 LEU A 29 3.994 -0.741 -2.406 1.00 0.00 H new ATOM 420 N ILE A 30 -1.045 -1.220 -3.059 1.00 0.00 N ATOM 421 CA ILE A 30 -1.670 0.047 -3.415 1.00 0.00 C ATOM 422 C ILE A 30 -1.336 1.131 -2.396 1.00 0.00 C ATOM 423 O ILE A 30 -1.455 0.919 -1.190 1.00 0.00 O ATOM 424 CB ILE A 30 -3.201 -0.090 -3.519 1.00 0.00 C ATOM 425 CG1 ILE A 30 -3.789 1.088 -4.299 1.00 0.00 C ATOM 426 CG2 ILE A 30 -3.820 -0.175 -2.132 1.00 0.00 C ATOM 427 CD1 ILE A 30 -3.341 1.140 -5.743 1.00 0.00 C ATOM 0 H ILE A 30 -1.610 -1.813 -2.451 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.272 0.332 -4.389 1.00 0.00 H new ATOM 0 HB ILE A 30 -3.433 -1.009 -4.057 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -4.877 1.028 -4.266 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.506 2.018 -3.805 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -4.902 -0.271 -2.222 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.421 -1.043 -1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.582 0.729 -1.571 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.796 2.000 -6.234 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.256 1.231 -5.784 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.648 0.226 -6.252 1.00 0.00 H new ATOM 439 N GLU A 31 -0.920 2.293 -2.891 1.00 0.00 N ATOM 440 CA GLU A 31 -0.570 3.411 -2.022 1.00 0.00 C ATOM 441 C GLU A 31 -1.426 4.634 -2.338 1.00 0.00 C ATOM 442 O GLU A 31 -1.251 5.278 -3.372 1.00 0.00 O ATOM 443 CB GLU A 31 0.912 3.759 -2.174 1.00 0.00 C ATOM 444 CG GLU A 31 1.341 4.966 -1.358 1.00 0.00 C ATOM 445 CD GLU A 31 0.915 6.278 -1.989 1.00 0.00 C ATOM 446 OE1 GLU A 31 1.306 6.532 -3.147 1.00 0.00 O ATOM 447 OE2 GLU A 31 0.193 7.050 -1.324 1.00 0.00 O ATOM 0 H GLU A 31 -0.817 2.484 -3.888 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.762 3.111 -0.992 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.511 2.898 -1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 31 1.126 3.948 -3.226 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.915 4.893 -0.357 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.425 4.957 -1.245 1.00 0.00 H new ATOM 454 N PHE A 32 -2.353 4.947 -1.439 1.00 0.00 N ATOM 455 CA PHE A 32 -3.239 6.092 -1.621 1.00 0.00 C ATOM 456 C PHE A 32 -2.503 7.399 -1.339 1.00 0.00 C ATOM 457 O PHE A 32 -2.201 7.718 -0.189 1.00 0.00 O ATOM 458 CB PHE A 32 -4.458 5.972 -0.704 1.00 0.00 C ATOM 459 CG PHE A 32 -5.185 4.665 -0.843 1.00 0.00 C ATOM 460 CD1 PHE A 32 -5.646 4.242 -2.079 1.00 0.00 C ATOM 461 CD2 PHE A 32 -5.409 3.861 0.263 1.00 0.00 C ATOM 462 CE1 PHE A 32 -6.316 3.040 -2.210 1.00 0.00 C ATOM 463 CE2 PHE A 32 -6.078 2.658 0.138 1.00 0.00 C ATOM 464 CZ PHE A 32 -6.533 2.248 -1.099 1.00 0.00 C ATOM 0 H PHE A 32 -2.511 4.424 -0.577 1.00 0.00 H new ATOM 0 HA PHE A 32 -3.573 6.100 -2.658 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -4.138 6.092 0.331 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -5.148 6.787 -0.921 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.480 4.858 -2.950 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -5.057 4.178 1.234 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -6.669 2.721 -3.179 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.245 2.039 1.007 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.058 1.309 -1.198 1.00 0.00 H new ATOM 474 N TYR A 33 -2.217 8.149 -2.397 1.00 0.00 N ATOM 475 CA TYR A 33 -1.514 9.420 -2.266 1.00 0.00 C ATOM 476 C TYR A 33 -2.452 10.592 -2.538 1.00 0.00 C ATOM 477 O TYR A 33 -3.380 10.486 -3.339 1.00 0.00 O ATOM 478 CB TYR A 33 -0.324 9.471 -3.226 1.00 0.00 C ATOM 479 CG TYR A 33 -0.724 9.508 -4.683 1.00 0.00 C ATOM 480 CD1 TYR A 33 -1.072 10.705 -5.298 1.00 0.00 C ATOM 481 CD2 TYR A 33 -0.755 8.348 -5.446 1.00 0.00 C ATOM 482 CE1 TYR A 33 -1.438 10.745 -6.629 1.00 0.00 C ATOM 483 CE2 TYR A 33 -1.119 8.378 -6.779 1.00 0.00 C ATOM 484 CZ TYR A 33 -1.460 9.578 -7.365 1.00 0.00 C ATOM 485 OH TYR A 33 -1.824 9.612 -8.692 1.00 0.00 O ATOM 0 H TYR A 33 -2.461 7.899 -3.355 1.00 0.00 H new ATOM 0 HA TYR A 33 -1.149 9.500 -1.242 1.00 0.00 H new ATOM 0 HB2 TYR A 33 0.277 10.352 -3.000 1.00 0.00 H new ATOM 0 HB3 TYR A 33 0.309 8.601 -3.053 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -1.056 11.620 -4.725 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -0.490 7.406 -4.990 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -1.705 11.684 -7.091 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -1.136 7.467 -7.358 1.00 0.00 H new ATOM 0 HH TYR A 33 -1.786 8.706 -9.065 1.00 0.00 H new ATOM 495 N ALA A 34 -2.201 11.710 -1.864 1.00 0.00 N ATOM 496 CA ALA A 34 -3.020 12.904 -2.034 1.00 0.00 C ATOM 497 C ALA A 34 -2.256 13.993 -2.779 1.00 0.00 C ATOM 498 O ALA A 34 -1.189 14.438 -2.354 1.00 0.00 O ATOM 499 CB ALA A 34 -3.491 13.418 -0.682 1.00 0.00 C ATOM 0 H ALA A 34 -1.437 11.814 -1.196 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.891 12.634 -2.631 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.101 14.310 -0.824 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.083 12.649 -0.186 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.627 13.665 -0.065 1.00 0.00 H new ATOM 505 N PRO A 35 -2.811 14.434 -3.918 1.00 0.00 N ATOM 506 CA PRO A 35 -2.197 15.476 -4.746 1.00 0.00 C ATOM 507 C PRO A 35 -2.241 16.847 -4.079 1.00 0.00 C ATOM 508 O PRO A 35 -1.746 17.831 -4.629 1.00 0.00 O ATOM 509 CB PRO A 35 -3.053 15.471 -6.015 1.00 0.00 C ATOM 510 CG PRO A 35 -4.374 14.937 -5.579 1.00 0.00 C ATOM 511 CD PRO A 35 -4.080 13.948 -4.485 1.00 0.00 C ATOM 0 HA PRO A 35 -1.140 15.282 -4.928 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -3.149 16.474 -6.431 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -2.609 14.845 -6.789 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -5.019 15.738 -5.218 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -4.894 14.458 -6.408 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -4.873 13.928 -3.737 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -3.984 12.935 -4.875 1.00 0.00 H new ATOM 519 N TRP A 36 -2.835 16.903 -2.893 1.00 0.00 N ATOM 520 CA TRP A 36 -2.943 18.155 -2.151 1.00 0.00 C ATOM 521 C TRP A 36 -2.320 18.022 -0.766 1.00 0.00 C ATOM 522 O TRP A 36 -2.529 18.869 0.103 1.00 0.00 O ATOM 523 CB TRP A 36 -4.409 18.573 -2.026 1.00 0.00 C ATOM 524 CG TRP A 36 -5.332 17.426 -1.745 1.00 0.00 C ATOM 525 CD1 TRP A 36 -6.105 16.755 -2.650 1.00 0.00 C ATOM 526 CD2 TRP A 36 -5.580 16.817 -0.473 1.00 0.00 C ATOM 527 NE1 TRP A 36 -6.818 15.766 -2.017 1.00 0.00 N ATOM 528 CE2 TRP A 36 -6.513 15.782 -0.681 1.00 0.00 C ATOM 529 CE3 TRP A 36 -5.103 17.044 0.820 1.00 0.00 C ATOM 530 CZ2 TRP A 36 -6.977 14.980 0.357 1.00 0.00 C ATOM 531 CZ3 TRP A 36 -5.565 16.246 1.850 1.00 0.00 C ATOM 532 CH2 TRP A 36 -6.494 15.224 1.614 1.00 0.00 C ATOM 0 H TRP A 36 -3.249 16.097 -2.424 1.00 0.00 H new ATOM 0 HA TRP A 36 -2.399 18.923 -2.702 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -4.503 19.309 -1.228 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -4.720 19.062 -2.949 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -6.149 16.970 -3.707 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.469 15.124 -2.468 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -4.386 17.829 1.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -7.694 14.192 0.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -5.204 16.413 2.854 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -6.835 14.617 2.440 1.00 0.00 H new ATOM 543 N CYS A 37 -1.554 16.955 -0.567 1.00 0.00 N ATOM 544 CA CYS A 37 -0.900 16.712 0.714 1.00 0.00 C ATOM 545 C CYS A 37 0.611 16.879 0.594 1.00 0.00 C ATOM 546 O CYS A 37 1.193 16.618 -0.458 1.00 0.00 O ATOM 547 CB CYS A 37 -1.231 15.307 1.221 1.00 0.00 C ATOM 548 SG CYS A 37 -0.470 14.897 2.809 1.00 0.00 S ATOM 0 H CYS A 37 -1.371 16.245 -1.276 1.00 0.00 H new ATOM 0 HA CYS A 37 -1.273 17.446 1.429 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -2.313 15.211 1.313 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.909 14.579 0.477 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.621 15.892 3.632 1.00 0.00 H new ATOM 554 N GLY A 38 1.241 17.319 1.679 1.00 0.00 N ATOM 555 CA GLY A 38 2.679 17.516 1.674 1.00 0.00 C ATOM 556 C GLY A 38 3.430 16.317 2.217 1.00 0.00 C ATOM 557 O GLY A 38 4.598 16.105 1.887 1.00 0.00 O ATOM 0 H GLY A 38 0.781 17.543 2.562 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.011 17.718 0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 38 2.924 18.395 2.270 1.00 0.00 H new ATOM 561 N HIS A 39 2.761 15.530 3.054 1.00 0.00 N ATOM 562 CA HIS A 39 3.374 14.346 3.646 1.00 0.00 C ATOM 563 C HIS A 39 3.614 13.273 2.588 1.00 0.00 C ATOM 564 O HIS A 39 4.318 12.293 2.833 1.00 0.00 O ATOM 565 CB HIS A 39 2.488 13.791 4.761 1.00 0.00 C ATOM 566 CG HIS A 39 2.044 14.828 5.746 1.00 0.00 C ATOM 567 ND1 HIS A 39 0.748 14.923 6.206 1.00 0.00 N ATOM 568 CD2 HIS A 39 2.734 15.817 6.361 1.00 0.00 C ATOM 569 CE1 HIS A 39 0.659 15.927 7.060 1.00 0.00 C ATOM 570 NE2 HIS A 39 1.850 16.486 7.172 1.00 0.00 N ATOM 0 H HIS A 39 1.794 15.691 3.338 1.00 0.00 H new ATOM 0 HA HIS A 39 4.336 14.637 4.068 1.00 0.00 H new ATOM 0 HB2 HIS A 39 1.609 13.324 4.317 1.00 0.00 H new ATOM 0 HB3 HIS A 39 3.032 13.008 5.290 1.00 0.00 H new ATOM 0 HD2 HIS A 39 3.784 16.039 6.237 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -0.236 16.238 7.579 1.00 0.00 H new ATOM 0 HE2 HIS A 39 2.077 17.285 7.764 1.00 0.00 H new ATOM 579 N CYS A 40 3.023 13.464 1.414 1.00 0.00 N ATOM 580 CA CYS A 40 3.172 12.512 0.319 1.00 0.00 C ATOM 581 C CYS A 40 4.379 12.861 -0.546 1.00 0.00 C ATOM 582 O CYS A 40 5.172 11.991 -0.904 1.00 0.00 O ATOM 583 CB CYS A 40 1.905 12.486 -0.538 1.00 0.00 C ATOM 584 SG CYS A 40 1.663 13.971 -1.541 1.00 0.00 S ATOM 0 H CYS A 40 2.436 14.269 1.196 1.00 0.00 H new ATOM 0 HA CYS A 40 3.331 11.523 0.750 1.00 0.00 H new ATOM 0 HB2 CYS A 40 1.942 11.618 -1.196 1.00 0.00 H new ATOM 0 HB3 CYS A 40 1.041 12.356 0.114 1.00 0.00 H new ATOM 0 HG CYS A 40 1.433 14.987 -0.763 1.00 0.00 H new ATOM 590 N LYS A 41 4.510 14.140 -0.880 1.00 0.00 N ATOM 591 CA LYS A 41 5.619 14.606 -1.703 1.00 0.00 C ATOM 592 C LYS A 41 6.941 14.021 -1.217 1.00 0.00 C ATOM 593 O LYS A 41 7.837 13.741 -2.014 1.00 0.00 O ATOM 594 CB LYS A 41 5.689 16.135 -1.684 1.00 0.00 C ATOM 595 CG LYS A 41 6.312 16.700 -0.419 1.00 0.00 C ATOM 596 CD LYS A 41 5.666 18.016 -0.020 1.00 0.00 C ATOM 597 CE LYS A 41 6.427 19.205 -0.585 1.00 0.00 C ATOM 598 NZ LYS A 41 5.760 20.496 -0.260 1.00 0.00 N ATOM 0 H LYS A 41 3.861 14.873 -0.593 1.00 0.00 H new ATOM 0 HA LYS A 41 5.446 14.269 -2.725 1.00 0.00 H new ATOM 0 HB2 LYS A 41 6.264 16.475 -2.545 1.00 0.00 H new ATOM 0 HB3 LYS A 41 4.682 16.538 -1.794 1.00 0.00 H new ATOM 0 HG2 LYS A 41 6.206 15.980 0.393 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.380 16.850 -0.574 1.00 0.00 H new ATOM 0 HD2 LYS A 41 4.636 18.040 -0.376 1.00 0.00 H new ATOM 0 HD3 LYS A 41 5.629 18.090 1.067 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.441 19.210 -0.186 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.511 19.102 -1.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 6.310 21.282 -0.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 4.801 20.502 -0.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 5.703 20.607 0.772 1.00 0.00 H new ATOM 612 N GLN A 42 7.055 13.837 0.095 1.00 0.00 N ATOM 613 CA GLN A 42 8.268 13.284 0.685 1.00 0.00 C ATOM 614 C GLN A 42 8.433 11.814 0.314 1.00 0.00 C ATOM 615 O GLN A 42 9.553 11.319 0.181 1.00 0.00 O ATOM 616 CB GLN A 42 8.235 13.438 2.207 1.00 0.00 C ATOM 617 CG GLN A 42 7.547 12.285 2.920 1.00 0.00 C ATOM 618 CD GLN A 42 7.536 12.454 4.427 1.00 0.00 C ATOM 619 OE1 GLN A 42 6.485 12.675 5.030 1.00 0.00 O ATOM 620 NE2 GLN A 42 8.707 12.350 5.043 1.00 0.00 N ATOM 0 H GLN A 42 6.323 14.063 0.768 1.00 0.00 H new ATOM 0 HA GLN A 42 9.120 13.837 0.289 1.00 0.00 H new ATOM 0 HB2 GLN A 42 9.256 13.526 2.577 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.724 14.367 2.459 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.522 12.200 2.560 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.052 11.353 2.666 1.00 0.00 H new ATOM 0 HE21 GLN A 42 9.553 12.166 4.503 1.00 0.00 H new ATOM 0 HE22 GLN A 42 8.761 12.454 6.056 1.00 0.00 H new ATOM 629 N LEU A 43 7.312 11.122 0.149 1.00 0.00 N ATOM 630 CA LEU A 43 7.332 9.707 -0.207 1.00 0.00 C ATOM 631 C LEU A 43 7.163 9.522 -1.712 1.00 0.00 C ATOM 632 O LEU A 43 7.444 8.451 -2.250 1.00 0.00 O ATOM 633 CB LEU A 43 6.226 8.958 0.538 1.00 0.00 C ATOM 634 CG LEU A 43 6.171 7.446 0.315 1.00 0.00 C ATOM 635 CD1 LEU A 43 7.361 6.766 0.975 1.00 0.00 C ATOM 636 CD2 LEU A 43 4.865 6.875 0.847 1.00 0.00 C ATOM 0 H LEU A 43 6.378 11.517 0.256 1.00 0.00 H new ATOM 0 HA LEU A 43 8.299 9.298 0.084 1.00 0.00 H new ATOM 0 HB2 LEU A 43 6.345 9.143 1.606 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.266 9.383 0.245 1.00 0.00 H new ATOM 0 HG LEU A 43 6.217 7.254 -0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.305 5.691 0.806 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.285 7.153 0.546 1.00 0.00 H new ATOM 0 HD13 LEU A 43 7.346 6.966 2.046 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.844 5.798 0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.788 7.078 1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.027 7.339 0.328 1.00 0.00 H new ATOM 648 N GLU A 44 6.703 10.572 -2.385 1.00 0.00 N ATOM 649 CA GLU A 44 6.498 10.525 -3.827 1.00 0.00 C ATOM 650 C GLU A 44 7.684 9.864 -4.524 1.00 0.00 C ATOM 651 O GLU A 44 7.544 8.866 -5.232 1.00 0.00 O ATOM 652 CB GLU A 44 6.288 11.935 -4.382 1.00 0.00 C ATOM 653 CG GLU A 44 4.828 12.344 -4.468 1.00 0.00 C ATOM 654 CD GLU A 44 4.563 13.332 -5.588 1.00 0.00 C ATOM 655 OE1 GLU A 44 4.887 13.010 -6.750 1.00 0.00 O ATOM 656 OE2 GLU A 44 4.034 14.426 -5.302 1.00 0.00 O ATOM 0 H GLU A 44 6.465 11.465 -1.954 1.00 0.00 H new ATOM 0 HA GLU A 44 5.606 9.930 -4.021 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.820 12.647 -3.751 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.733 11.995 -5.375 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.214 11.456 -4.619 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.522 12.785 -3.519 1.00 0.00 H new ATOM 663 N PRO A 45 8.882 10.432 -4.319 1.00 0.00 N ATOM 664 CA PRO A 45 10.116 9.916 -4.918 1.00 0.00 C ATOM 665 C PRO A 45 10.538 8.580 -4.316 1.00 0.00 C ATOM 666 O PRO A 45 10.970 7.675 -5.030 1.00 0.00 O ATOM 667 CB PRO A 45 11.148 10.999 -4.594 1.00 0.00 C ATOM 668 CG PRO A 45 10.622 11.669 -3.372 1.00 0.00 C ATOM 669 CD PRO A 45 9.123 11.623 -3.487 1.00 0.00 C ATOM 0 HA PRO A 45 10.002 9.723 -5.985 1.00 0.00 H new ATOM 0 HB2 PRO A 45 12.133 10.567 -4.416 1.00 0.00 H new ATOM 0 HB3 PRO A 45 11.254 11.705 -5.418 1.00 0.00 H new ATOM 0 HG2 PRO A 45 10.960 11.158 -2.471 1.00 0.00 H new ATOM 0 HG3 PRO A 45 10.977 12.698 -3.307 1.00 0.00 H new ATOM 0 HD2 PRO A 45 8.647 11.534 -2.510 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.728 12.526 -3.953 1.00 0.00 H new ATOM 677 N ILE A 46 10.410 8.464 -2.998 1.00 0.00 N ATOM 678 CA ILE A 46 10.777 7.238 -2.301 1.00 0.00 C ATOM 679 C ILE A 46 10.020 6.039 -2.862 1.00 0.00 C ATOM 680 O ILE A 46 10.577 4.949 -3.000 1.00 0.00 O ATOM 681 CB ILE A 46 10.500 7.345 -0.790 1.00 0.00 C ATOM 682 CG1 ILE A 46 11.370 8.437 -0.165 1.00 0.00 C ATOM 683 CG2 ILE A 46 10.749 6.007 -0.109 1.00 0.00 C ATOM 684 CD1 ILE A 46 10.847 8.943 1.161 1.00 0.00 C ATOM 0 H ILE A 46 10.055 9.204 -2.392 1.00 0.00 H new ATOM 0 HA ILE A 46 11.846 7.095 -2.457 1.00 0.00 H new ATOM 0 HB ILE A 46 9.454 7.614 -0.646 1.00 0.00 H new ATOM 0 HG12 ILE A 46 12.379 8.050 -0.024 1.00 0.00 H new ATOM 0 HG13 ILE A 46 11.444 9.273 -0.860 1.00 0.00 H new ATOM 0 HG21 ILE A 46 10.549 6.099 0.958 1.00 0.00 H new ATOM 0 HG22 ILE A 46 10.090 5.252 -0.538 1.00 0.00 H new ATOM 0 HG23 ILE A 46 11.787 5.710 -0.259 1.00 0.00 H new ATOM 0 HD11 ILE A 46 11.514 9.715 1.545 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.850 9.361 1.023 1.00 0.00 H new ATOM 0 HD13 ILE A 46 10.800 8.118 1.872 1.00 0.00 H new ATOM 696 N TYR A 47 8.749 6.247 -3.184 1.00 0.00 N ATOM 697 CA TYR A 47 7.914 5.184 -3.730 1.00 0.00 C ATOM 698 C TYR A 47 8.350 4.822 -5.146 1.00 0.00 C ATOM 699 O TYR A 47 8.224 3.673 -5.574 1.00 0.00 O ATOM 700 CB TYR A 47 6.445 5.609 -3.730 1.00 0.00 C ATOM 701 CG TYR A 47 5.479 4.450 -3.615 1.00 0.00 C ATOM 702 CD1 TYR A 47 5.508 3.603 -2.515 1.00 0.00 C ATOM 703 CD2 TYR A 47 4.538 4.204 -4.607 1.00 0.00 C ATOM 704 CE1 TYR A 47 4.628 2.543 -2.406 1.00 0.00 C ATOM 705 CE2 TYR A 47 3.654 3.148 -4.507 1.00 0.00 C ATOM 706 CZ TYR A 47 3.703 2.320 -3.405 1.00 0.00 C ATOM 707 OH TYR A 47 2.824 1.266 -3.300 1.00 0.00 O ATOM 0 H TYR A 47 8.274 7.143 -3.076 1.00 0.00 H new ATOM 0 HA TYR A 47 8.031 4.304 -3.097 1.00 0.00 H new ATOM 0 HB2 TYR A 47 6.274 6.297 -2.902 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.234 6.157 -4.648 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.231 3.776 -1.731 1.00 0.00 H new ATOM 0 HD2 TYR A 47 4.497 4.850 -5.472 1.00 0.00 H new ATOM 0 HE1 TYR A 47 4.664 1.893 -1.544 1.00 0.00 H new ATOM 0 HE2 TYR A 47 2.928 2.971 -5.287 1.00 0.00 H new ATOM 0 HH TYR A 47 2.238 1.249 -4.086 1.00 0.00 H new ATOM 717 N THR A 48 8.865 5.810 -5.871 1.00 0.00 N ATOM 718 CA THR A 48 9.319 5.598 -7.240 1.00 0.00 C ATOM 719 C THR A 48 10.320 4.451 -7.315 1.00 0.00 C ATOM 720 O THR A 48 10.116 3.484 -8.048 1.00 0.00 O ATOM 721 CB THR A 48 9.968 6.869 -7.819 1.00 0.00 C ATOM 722 OG1 THR A 48 9.006 7.929 -7.874 1.00 0.00 O ATOM 723 CG2 THR A 48 10.521 6.607 -9.212 1.00 0.00 C ATOM 0 H THR A 48 8.978 6.766 -5.533 1.00 0.00 H new ATOM 0 HA THR A 48 8.438 5.347 -7.831 1.00 0.00 H new ATOM 0 HB THR A 48 10.791 7.160 -7.167 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.660 8.104 -6.974 1.00 0.00 H new ATOM 0 HG21 THR A 48 10.974 7.519 -9.601 1.00 0.00 H new ATOM 0 HG22 THR A 48 11.273 5.820 -9.163 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.712 6.294 -9.872 1.00 0.00 H new ATOM 731 N SER A 49 11.402 4.565 -6.551 1.00 0.00 N ATOM 732 CA SER A 49 12.437 3.537 -6.534 1.00 0.00 C ATOM 733 C SER A 49 11.898 2.233 -5.956 1.00 0.00 C ATOM 734 O SER A 49 12.346 1.145 -6.322 1.00 0.00 O ATOM 735 CB SER A 49 13.641 4.011 -5.718 1.00 0.00 C ATOM 736 OG SER A 49 14.067 5.296 -6.136 1.00 0.00 O ATOM 0 H SER A 49 11.585 5.358 -5.936 1.00 0.00 H new ATOM 0 HA SER A 49 12.752 3.355 -7.562 1.00 0.00 H new ATOM 0 HB2 SER A 49 13.379 4.038 -4.660 1.00 0.00 H new ATOM 0 HB3 SER A 49 14.460 3.300 -5.826 1.00 0.00 H new ATOM 0 HG SER A 49 14.836 5.577 -5.598 1.00 0.00 H new ATOM 742 N LEU A 50 10.933 2.349 -5.050 1.00 0.00 N ATOM 743 CA LEU A 50 10.331 1.179 -4.419 1.00 0.00 C ATOM 744 C LEU A 50 9.635 0.301 -5.454 1.00 0.00 C ATOM 745 O LEU A 50 9.489 -0.906 -5.262 1.00 0.00 O ATOM 746 CB LEU A 50 9.331 1.612 -3.345 1.00 0.00 C ATOM 747 CG LEU A 50 8.768 0.497 -2.464 1.00 0.00 C ATOM 748 CD1 LEU A 50 9.783 0.088 -1.407 1.00 0.00 C ATOM 749 CD2 LEU A 50 7.465 0.938 -1.813 1.00 0.00 C ATOM 0 H LEU A 50 10.551 3.241 -4.736 1.00 0.00 H new ATOM 0 HA LEU A 50 11.127 0.598 -3.952 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.815 2.347 -2.702 1.00 0.00 H new ATOM 0 HB3 LEU A 50 8.498 2.116 -3.835 1.00 0.00 H new ATOM 0 HG LEU A 50 8.561 -0.368 -3.094 1.00 0.00 H new ATOM 0 HD11 LEU A 50 9.365 -0.707 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 50 10.691 -0.270 -1.893 1.00 0.00 H new ATOM 0 HD13 LEU A 50 10.022 0.947 -0.780 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.079 0.132 -1.190 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.646 1.818 -1.197 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.736 1.180 -2.586 1.00 0.00 H new ATOM 761 N GLY A 51 9.208 0.915 -6.553 1.00 0.00 N ATOM 762 CA GLY A 51 8.534 0.173 -7.603 1.00 0.00 C ATOM 763 C GLY A 51 9.484 -0.280 -8.694 1.00 0.00 C ATOM 764 O GLY A 51 9.475 -1.445 -9.092 1.00 0.00 O ATOM 0 H GLY A 51 9.317 1.913 -6.735 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.042 -0.698 -7.170 1.00 0.00 H new ATOM 0 HA3 GLY A 51 7.754 0.796 -8.040 1.00 0.00 H new ATOM 768 N LYS A 52 10.306 0.643 -9.182 1.00 0.00 N ATOM 769 CA LYS A 52 11.267 0.334 -10.234 1.00 0.00 C ATOM 770 C LYS A 52 12.277 -0.706 -9.760 1.00 0.00 C ATOM 771 O LYS A 52 12.945 -1.351 -10.569 1.00 0.00 O ATOM 772 CB LYS A 52 11.996 1.605 -10.676 1.00 0.00 C ATOM 773 CG LYS A 52 13.264 1.884 -9.888 1.00 0.00 C ATOM 774 CD LYS A 52 13.814 3.268 -10.188 1.00 0.00 C ATOM 775 CE LYS A 52 14.466 3.323 -11.562 1.00 0.00 C ATOM 776 NZ LYS A 52 14.786 4.719 -11.968 1.00 0.00 N ATOM 0 H LYS A 52 10.326 1.612 -8.865 1.00 0.00 H new ATOM 0 HA LYS A 52 10.720 -0.077 -11.082 1.00 0.00 H new ATOM 0 HB2 LYS A 52 12.246 1.521 -11.733 1.00 0.00 H new ATOM 0 HB3 LYS A 52 11.321 2.455 -10.575 1.00 0.00 H new ATOM 0 HG2 LYS A 52 13.057 1.797 -8.821 1.00 0.00 H new ATOM 0 HG3 LYS A 52 14.016 1.133 -10.129 1.00 0.00 H new ATOM 0 HD2 LYS A 52 13.008 4.000 -10.137 1.00 0.00 H new ATOM 0 HD3 LYS A 52 14.544 3.544 -9.427 1.00 0.00 H new ATOM 0 HE2 LYS A 52 15.380 2.728 -11.555 1.00 0.00 H new ATOM 0 HE3 LYS A 52 13.800 2.874 -12.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 15.229 4.714 -12.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 13.911 5.280 -12.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 15.442 5.139 -11.279 1.00 0.00 H new ATOM 790 N LYS A 53 12.383 -0.865 -8.445 1.00 0.00 N ATOM 791 CA LYS A 53 13.309 -1.829 -7.863 1.00 0.00 C ATOM 792 C LYS A 53 12.615 -3.162 -7.605 1.00 0.00 C ATOM 793 O LYS A 53 13.179 -4.226 -7.863 1.00 0.00 O ATOM 794 CB LYS A 53 13.891 -1.283 -6.557 1.00 0.00 C ATOM 795 CG LYS A 53 12.988 -1.494 -5.354 1.00 0.00 C ATOM 796 CD LYS A 53 13.548 -0.821 -4.112 1.00 0.00 C ATOM 797 CE LYS A 53 15.033 -1.104 -3.946 1.00 0.00 C ATOM 798 NZ LYS A 53 15.448 -1.071 -2.516 1.00 0.00 N ATOM 0 H LYS A 53 11.839 -0.338 -7.762 1.00 0.00 H new ATOM 0 HA LYS A 53 14.119 -1.993 -8.574 1.00 0.00 H new ATOM 0 HB2 LYS A 53 14.851 -1.763 -6.368 1.00 0.00 H new ATOM 0 HB3 LYS A 53 14.085 -0.217 -6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 53 11.996 -1.097 -5.568 1.00 0.00 H new ATOM 0 HG3 LYS A 53 12.871 -2.562 -5.169 1.00 0.00 H new ATOM 0 HD2 LYS A 53 13.387 0.255 -4.176 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.009 -1.172 -3.232 1.00 0.00 H new ATOM 0 HE2 LYS A 53 15.266 -2.081 -4.369 1.00 0.00 H new ATOM 0 HE3 LYS A 53 15.608 -0.368 -4.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 16.467 -1.269 -2.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.249 -0.131 -2.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.918 -1.791 -1.984 1.00 0.00 H new ATOM 812 N TYR A 54 11.390 -3.098 -7.096 1.00 0.00 N ATOM 813 CA TYR A 54 10.620 -4.301 -6.802 1.00 0.00 C ATOM 814 C TYR A 54 9.923 -4.821 -8.055 1.00 0.00 C ATOM 815 O TYR A 54 9.205 -5.820 -8.011 1.00 0.00 O ATOM 816 CB TYR A 54 9.586 -4.016 -5.711 1.00 0.00 C ATOM 817 CG TYR A 54 10.135 -4.144 -4.308 1.00 0.00 C ATOM 818 CD1 TYR A 54 10.828 -3.098 -3.713 1.00 0.00 C ATOM 819 CD2 TYR A 54 9.959 -5.313 -3.577 1.00 0.00 C ATOM 820 CE1 TYR A 54 11.332 -3.211 -2.432 1.00 0.00 C ATOM 821 CE2 TYR A 54 10.458 -5.435 -2.294 1.00 0.00 C ATOM 822 CZ TYR A 54 11.144 -4.382 -1.726 1.00 0.00 C ATOM 823 OH TYR A 54 11.643 -4.498 -0.449 1.00 0.00 O ATOM 0 H TYR A 54 10.908 -2.226 -6.878 1.00 0.00 H new ATOM 0 HA TYR A 54 11.311 -5.066 -6.448 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.194 -3.008 -5.848 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.748 -4.703 -5.828 1.00 0.00 H new ATOM 0 HD1 TYR A 54 10.976 -2.180 -4.262 1.00 0.00 H new ATOM 0 HD2 TYR A 54 9.423 -6.140 -4.019 1.00 0.00 H new ATOM 0 HE1 TYR A 54 11.870 -2.388 -1.985 1.00 0.00 H new ATOM 0 HE2 TYR A 54 10.312 -6.350 -1.739 1.00 0.00 H new ATOM 0 HH TYR A 54 11.424 -5.384 -0.091 1.00 0.00 H new ATOM 833 N LYS A 55 10.142 -4.137 -9.173 1.00 0.00 N ATOM 834 CA LYS A 55 9.538 -4.529 -10.441 1.00 0.00 C ATOM 835 C LYS A 55 10.064 -5.886 -10.898 1.00 0.00 C ATOM 836 O LYS A 55 9.415 -6.585 -11.674 1.00 0.00 O ATOM 837 CB LYS A 55 9.822 -3.473 -11.512 1.00 0.00 C ATOM 838 CG LYS A 55 11.220 -3.562 -12.099 1.00 0.00 C ATOM 839 CD LYS A 55 11.304 -2.864 -13.446 1.00 0.00 C ATOM 840 CE LYS A 55 11.236 -1.352 -13.296 1.00 0.00 C ATOM 841 NZ LYS A 55 11.786 -0.651 -14.488 1.00 0.00 N ATOM 0 H LYS A 55 10.734 -3.308 -9.227 1.00 0.00 H new ATOM 0 HA LYS A 55 8.461 -4.608 -10.293 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.093 -3.577 -12.315 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.681 -2.482 -11.080 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.934 -3.112 -11.410 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.502 -4.609 -12.212 1.00 0.00 H new ATOM 0 HD2 LYS A 55 12.234 -3.140 -13.942 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.489 -3.204 -14.085 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.200 -1.049 -13.142 1.00 0.00 H new ATOM 0 HE3 LYS A 55 11.792 -1.050 -12.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.722 0.377 -14.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.782 -0.921 -14.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.240 -0.919 -15.331 1.00 0.00 H new ATOM 855 N GLY A 56 11.245 -6.253 -10.409 1.00 0.00 N ATOM 856 CA GLY A 56 11.838 -7.525 -10.777 1.00 0.00 C ATOM 857 C GLY A 56 11.526 -8.621 -9.778 1.00 0.00 C ATOM 858 O GLY A 56 12.316 -9.547 -9.596 1.00 0.00 O ATOM 0 H GLY A 56 11.801 -5.692 -9.764 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.474 -7.821 -11.761 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.919 -7.409 -10.858 1.00 0.00 H new ATOM 862 N GLN A 57 10.372 -8.515 -9.127 1.00 0.00 N ATOM 863 CA GLN A 57 9.959 -9.505 -8.138 1.00 0.00 C ATOM 864 C GLN A 57 9.093 -10.585 -8.778 1.00 0.00 C ATOM 865 O GLN A 57 8.782 -10.523 -9.968 1.00 0.00 O ATOM 866 CB GLN A 57 9.194 -8.830 -6.999 1.00 0.00 C ATOM 867 CG GLN A 57 10.088 -8.350 -5.866 1.00 0.00 C ATOM 868 CD GLN A 57 10.721 -9.494 -5.098 1.00 0.00 C ATOM 869 OE1 GLN A 57 10.144 -9.826 -3.949 1.00 0.00 O flip ATOM 870 NE2 GLN A 57 11.717 -10.073 -5.533 1.00 0.00 N flip ATOM 0 H GLN A 57 9.707 -7.754 -9.266 1.00 0.00 H new ATOM 0 HA GLN A 57 10.856 -9.975 -7.735 1.00 0.00 H new ATOM 0 HB2 GLN A 57 8.640 -7.981 -7.398 1.00 0.00 H new ATOM 0 HB3 GLN A 57 8.460 -9.530 -6.600 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.873 -7.712 -6.273 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.502 -7.737 -5.181 1.00 0.00 H new ATOM 0 HE21 GLN A 57 12.128 -9.784 -6.421 1.00 0.00 H new ATOM 0 HE22 GLN A 57 12.131 -10.841 -5.005 1.00 0.00 H new ATOM 879 N LYS A 58 8.706 -11.575 -7.981 1.00 0.00 N ATOM 880 CA LYS A 58 7.875 -12.669 -8.468 1.00 0.00 C ATOM 881 C LYS A 58 6.407 -12.432 -8.126 1.00 0.00 C ATOM 882 O LYS A 58 5.978 -12.663 -6.996 1.00 0.00 O ATOM 883 CB LYS A 58 8.340 -13.997 -7.866 1.00 0.00 C ATOM 884 CG LYS A 58 9.849 -14.172 -7.874 1.00 0.00 C ATOM 885 CD LYS A 58 10.324 -14.867 -9.139 1.00 0.00 C ATOM 886 CE LYS A 58 10.615 -13.868 -10.248 1.00 0.00 C ATOM 887 NZ LYS A 58 11.978 -13.281 -10.122 1.00 0.00 N ATOM 0 H LYS A 58 8.955 -11.642 -6.994 1.00 0.00 H new ATOM 0 HA LYS A 58 7.975 -12.712 -9.552 1.00 0.00 H new ATOM 0 HB2 LYS A 58 7.980 -14.067 -6.840 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.884 -14.817 -8.421 1.00 0.00 H new ATOM 0 HG2 LYS A 58 10.329 -13.197 -7.791 1.00 0.00 H new ATOM 0 HG3 LYS A 58 10.153 -14.752 -7.003 1.00 0.00 H new ATOM 0 HD2 LYS A 58 11.223 -15.444 -8.923 1.00 0.00 H new ATOM 0 HD3 LYS A 58 9.565 -15.573 -9.474 1.00 0.00 H new ATOM 0 HE2 LYS A 58 10.520 -14.361 -11.215 1.00 0.00 H new ATOM 0 HE3 LYS A 58 9.872 -13.071 -10.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 12.138 -12.605 -10.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 12.061 -12.788 -9.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 12.688 -14.039 -10.172 1.00 0.00 H new ATOM 901 N ASP A 59 5.643 -11.969 -9.109 1.00 0.00 N ATOM 902 CA ASP A 59 4.223 -11.703 -8.913 1.00 0.00 C ATOM 903 C ASP A 59 4.016 -10.548 -7.938 1.00 0.00 C ATOM 904 O ASP A 59 3.204 -10.638 -7.017 1.00 0.00 O ATOM 905 CB ASP A 59 3.513 -12.956 -8.397 1.00 0.00 C ATOM 906 CG ASP A 59 4.235 -14.231 -8.787 1.00 0.00 C ATOM 907 OD1 ASP A 59 4.834 -14.264 -9.882 1.00 0.00 O ATOM 908 OD2 ASP A 59 4.201 -15.197 -7.995 1.00 0.00 O ATOM 0 H ASP A 59 5.983 -11.770 -10.050 1.00 0.00 H new ATOM 0 HA ASP A 59 3.795 -11.424 -9.876 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.434 -12.904 -7.311 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.497 -12.982 -8.790 1.00 0.00 H new ATOM 913 N LEU A 60 4.757 -9.465 -8.146 1.00 0.00 N ATOM 914 CA LEU A 60 4.656 -8.292 -7.285 1.00 0.00 C ATOM 915 C LEU A 60 4.727 -7.007 -8.104 1.00 0.00 C ATOM 916 O LEU A 60 5.729 -6.736 -8.766 1.00 0.00 O ATOM 917 CB LEU A 60 5.771 -8.306 -6.238 1.00 0.00 C ATOM 918 CG LEU A 60 5.680 -7.241 -5.145 1.00 0.00 C ATOM 919 CD1 LEU A 60 4.748 -7.697 -4.033 1.00 0.00 C ATOM 920 CD2 LEU A 60 7.061 -6.926 -4.590 1.00 0.00 C ATOM 0 H LEU A 60 5.434 -9.375 -8.903 1.00 0.00 H new ATOM 0 HA LEU A 60 3.691 -8.325 -6.779 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.782 -9.286 -5.762 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.725 -8.190 -6.752 1.00 0.00 H new ATOM 0 HG LEU A 60 5.271 -6.331 -5.584 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.695 -6.927 -3.264 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.752 -7.871 -4.441 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.127 -8.621 -3.596 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.976 -6.166 -3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 60 7.498 -7.830 -4.167 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.700 -6.556 -5.392 1.00 0.00 H new ATOM 932 N VAL A 61 3.659 -6.218 -8.051 1.00 0.00 N ATOM 933 CA VAL A 61 3.602 -4.960 -8.785 1.00 0.00 C ATOM 934 C VAL A 61 3.178 -3.812 -7.876 1.00 0.00 C ATOM 935 O VAL A 61 2.013 -3.713 -7.487 1.00 0.00 O ATOM 936 CB VAL A 61 2.625 -5.047 -9.973 1.00 0.00 C ATOM 937 CG1 VAL A 61 2.688 -3.779 -10.811 1.00 0.00 C ATOM 938 CG2 VAL A 61 2.928 -6.272 -10.823 1.00 0.00 C ATOM 0 H VAL A 61 2.822 -6.428 -7.508 1.00 0.00 H new ATOM 0 HA VAL A 61 4.606 -4.769 -9.163 1.00 0.00 H new ATOM 0 HB VAL A 61 1.613 -5.145 -9.581 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.991 -3.859 -11.645 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.419 -2.922 -10.194 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.700 -3.646 -11.195 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.228 -6.318 -11.658 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.946 -6.206 -11.206 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.827 -7.171 -10.215 1.00 0.00 H new ATOM 948 N ILE A 62 4.129 -2.947 -7.541 1.00 0.00 N ATOM 949 CA ILE A 62 3.854 -1.805 -6.679 1.00 0.00 C ATOM 950 C ILE A 62 3.156 -0.689 -7.450 1.00 0.00 C ATOM 951 O ILE A 62 3.791 0.048 -8.204 1.00 0.00 O ATOM 952 CB ILE A 62 5.145 -1.250 -6.050 1.00 0.00 C ATOM 953 CG1 ILE A 62 5.687 -2.222 -5.001 1.00 0.00 C ATOM 954 CG2 ILE A 62 4.889 0.117 -5.432 1.00 0.00 C ATOM 955 CD1 ILE A 62 6.932 -1.724 -4.301 1.00 0.00 C ATOM 0 H ILE A 62 5.097 -3.016 -7.854 1.00 0.00 H new ATOM 0 HA ILE A 62 3.197 -2.160 -5.885 1.00 0.00 H new ATOM 0 HB ILE A 62 5.894 -1.138 -6.834 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.913 -2.410 -4.257 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.907 -3.176 -5.481 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.811 0.496 -4.992 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.545 0.806 -6.203 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.127 0.029 -4.658 1.00 0.00 H new ATOM 0 HD11 ILE A 62 7.260 -2.464 -3.571 1.00 0.00 H new ATOM 0 HD12 ILE A 62 7.722 -1.563 -5.034 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.713 -0.785 -3.792 1.00 0.00 H new ATOM 967 N ALA A 63 1.847 -0.571 -7.254 1.00 0.00 N ATOM 968 CA ALA A 63 1.064 0.458 -7.928 1.00 0.00 C ATOM 969 C ALA A 63 0.458 1.432 -6.924 1.00 0.00 C ATOM 970 O ALA A 63 0.420 1.160 -5.724 1.00 0.00 O ATOM 971 CB ALA A 63 -0.028 -0.180 -8.773 1.00 0.00 C ATOM 0 H ALA A 63 1.306 -1.175 -6.634 1.00 0.00 H new ATOM 0 HA ALA A 63 1.732 1.020 -8.581 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -0.605 0.599 -9.271 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.424 -0.830 -9.522 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -0.687 -0.767 -8.133 1.00 0.00 H new ATOM 977 N LYS A 64 -0.016 2.569 -7.422 1.00 0.00 N ATOM 978 CA LYS A 64 -0.621 3.585 -6.569 1.00 0.00 C ATOM 979 C LYS A 64 -1.936 4.080 -7.163 1.00 0.00 C ATOM 980 O LYS A 64 -2.158 3.986 -8.369 1.00 0.00 O ATOM 981 CB LYS A 64 0.340 4.761 -6.380 1.00 0.00 C ATOM 982 CG LYS A 64 0.708 5.460 -7.677 1.00 0.00 C ATOM 983 CD LYS A 64 1.659 6.620 -7.434 1.00 0.00 C ATOM 984 CE LYS A 64 2.561 6.862 -8.635 1.00 0.00 C ATOM 985 NZ LYS A 64 3.033 8.273 -8.699 1.00 0.00 N ATOM 0 H LYS A 64 0.007 2.810 -8.413 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.827 3.133 -5.599 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.114 5.485 -5.703 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.250 4.402 -5.900 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.170 4.746 -8.358 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.196 5.825 -8.164 1.00 0.00 H new ATOM 0 HD2 LYS A 64 1.087 7.523 -7.220 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.269 6.414 -6.555 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.420 6.194 -8.584 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.021 6.618 -9.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.645 8.397 -9.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.214 8.910 -8.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.570 8.499 -7.838 1.00 0.00 H new ATOM 999 N MET A 65 -2.804 4.610 -6.307 1.00 0.00 N ATOM 1000 CA MET A 65 -4.096 5.122 -6.748 1.00 0.00 C ATOM 1001 C MET A 65 -4.517 6.328 -5.913 1.00 0.00 C ATOM 1002 O MET A 65 -4.178 6.426 -4.733 1.00 0.00 O ATOM 1003 CB MET A 65 -5.161 4.028 -6.658 1.00 0.00 C ATOM 1004 CG MET A 65 -6.552 4.499 -7.052 1.00 0.00 C ATOM 1005 SD MET A 65 -7.495 5.127 -5.650 1.00 0.00 S ATOM 1006 CE MET A 65 -8.961 4.100 -5.741 1.00 0.00 C ATOM 0 H MET A 65 -2.636 4.696 -5.305 1.00 0.00 H new ATOM 0 HA MET A 65 -3.998 5.438 -7.787 1.00 0.00 H new ATOM 0 HB2 MET A 65 -4.872 3.197 -7.302 1.00 0.00 H new ATOM 0 HB3 MET A 65 -5.191 3.645 -5.638 1.00 0.00 H new ATOM 0 HG2 MET A 65 -6.466 5.281 -7.807 1.00 0.00 H new ATOM 0 HG3 MET A 65 -7.095 3.672 -7.509 1.00 0.00 H new ATOM 0 HE1 MET A 65 -9.823 4.664 -5.385 1.00 0.00 H new ATOM 0 HE2 MET A 65 -9.128 3.795 -6.774 1.00 0.00 H new ATOM 0 HE3 MET A 65 -8.825 3.215 -5.119 1.00 0.00 H new ATOM 1016 N ASP A 66 -5.256 7.242 -6.532 1.00 0.00 N ATOM 1017 CA ASP A 66 -5.724 8.440 -5.845 1.00 0.00 C ATOM 1018 C ASP A 66 -7.083 8.199 -5.196 1.00 0.00 C ATOM 1019 O ASP A 66 -8.097 8.077 -5.883 1.00 0.00 O ATOM 1020 CB ASP A 66 -5.813 9.612 -6.823 1.00 0.00 C ATOM 1021 CG ASP A 66 -5.991 10.942 -6.118 1.00 0.00 C ATOM 1022 OD1 ASP A 66 -5.363 11.141 -5.058 1.00 0.00 O ATOM 1023 OD2 ASP A 66 -6.761 11.785 -6.626 1.00 0.00 O ATOM 0 H ASP A 66 -5.544 7.176 -7.508 1.00 0.00 H new ATOM 0 HA ASP A 66 -5.006 8.684 -5.062 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -4.908 9.644 -7.430 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -6.649 9.450 -7.504 1.00 0.00 H new ATOM 1028 N ALA A 67 -7.095 8.130 -3.869 1.00 0.00 N ATOM 1029 CA ALA A 67 -8.329 7.904 -3.127 1.00 0.00 C ATOM 1030 C ALA A 67 -9.173 9.173 -3.066 1.00 0.00 C ATOM 1031 O ALA A 67 -10.393 9.114 -2.906 1.00 0.00 O ATOM 1032 CB ALA A 67 -8.018 7.407 -1.723 1.00 0.00 C ATOM 0 H ALA A 67 -6.264 8.227 -3.286 1.00 0.00 H new ATOM 0 HA ALA A 67 -8.904 7.141 -3.651 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -8.949 7.243 -1.181 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.463 6.471 -1.783 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -7.419 8.151 -1.198 1.00 0.00 H new ATOM 1038 N THR A 68 -8.516 10.322 -3.194 1.00 0.00 N ATOM 1039 CA THR A 68 -9.206 11.605 -3.152 1.00 0.00 C ATOM 1040 C THR A 68 -10.172 11.749 -4.322 1.00 0.00 C ATOM 1041 O THR A 68 -11.229 12.367 -4.194 1.00 0.00 O ATOM 1042 CB THR A 68 -8.209 12.779 -3.176 1.00 0.00 C ATOM 1043 OG1 THR A 68 -7.591 12.871 -4.464 1.00 0.00 O ATOM 1044 CG2 THR A 68 -7.141 12.605 -2.106 1.00 0.00 C ATOM 0 H THR A 68 -7.507 10.390 -3.328 1.00 0.00 H new ATOM 0 HA THR A 68 -9.766 11.632 -2.217 1.00 0.00 H new ATOM 0 HB THR A 68 -8.759 13.698 -2.971 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.960 13.620 -4.471 1.00 0.00 H new ATOM 0 HG21 THR A 68 -6.449 13.446 -2.143 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.613 12.566 -1.124 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.595 11.678 -2.284 1.00 0.00 H new ATOM 1052 N ALA A 69 -9.802 11.176 -5.462 1.00 0.00 N ATOM 1053 CA ALA A 69 -10.638 11.238 -6.655 1.00 0.00 C ATOM 1054 C ALA A 69 -11.397 9.932 -6.863 1.00 0.00 C ATOM 1055 O ALA A 69 -12.594 9.938 -7.148 1.00 0.00 O ATOM 1056 CB ALA A 69 -9.790 11.558 -7.877 1.00 0.00 C ATOM 0 H ALA A 69 -8.929 10.663 -5.585 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.369 12.034 -6.515 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -10.427 11.601 -8.761 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.298 12.521 -7.737 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.037 10.782 -8.010 1.00 0.00 H new ATOM 1062 N ASN A 70 -10.693 8.814 -6.718 1.00 0.00 N ATOM 1063 CA ASN A 70 -11.301 7.500 -6.892 1.00 0.00 C ATOM 1064 C ASN A 70 -11.851 6.977 -5.568 1.00 0.00 C ATOM 1065 O ASN A 70 -11.147 6.951 -4.559 1.00 0.00 O ATOM 1066 CB ASN A 70 -10.278 6.513 -7.458 1.00 0.00 C ATOM 1067 CG ASN A 70 -9.943 6.796 -8.909 1.00 0.00 C ATOM 1068 OD1 ASN A 70 -10.741 6.526 -9.807 1.00 0.00 O ATOM 1069 ND2 ASN A 70 -8.757 7.344 -9.146 1.00 0.00 N ATOM 0 H ASN A 70 -9.701 8.792 -6.481 1.00 0.00 H new ATOM 0 HA ASN A 70 -12.128 7.599 -7.595 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -9.366 6.557 -6.862 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -10.668 5.499 -7.369 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -8.476 7.558 -10.103 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -8.127 7.551 -8.371 1.00 0.00 H new ATOM 1076 N ASP A 71 -13.113 6.560 -5.582 1.00 0.00 N ATOM 1077 CA ASP A 71 -13.758 6.036 -4.384 1.00 0.00 C ATOM 1078 C ASP A 71 -13.477 4.545 -4.224 1.00 0.00 C ATOM 1079 O ASP A 71 -13.948 3.727 -5.015 1.00 0.00 O ATOM 1080 CB ASP A 71 -15.266 6.280 -4.443 1.00 0.00 C ATOM 1081 CG ASP A 71 -15.609 7.745 -4.624 1.00 0.00 C ATOM 1082 OD1 ASP A 71 -14.958 8.409 -5.458 1.00 0.00 O ATOM 1083 OD2 ASP A 71 -16.530 8.229 -3.933 1.00 0.00 O ATOM 0 H ASP A 71 -13.709 6.575 -6.410 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.347 6.560 -3.521 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -15.692 5.706 -5.266 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -15.727 5.913 -3.526 1.00 0.00 H new ATOM 1088 N ILE A 72 -12.706 4.200 -3.198 1.00 0.00 N ATOM 1089 CA ILE A 72 -12.363 2.808 -2.936 1.00 0.00 C ATOM 1090 C ILE A 72 -13.612 1.974 -2.670 1.00 0.00 C ATOM 1091 O ILE A 72 -14.187 2.026 -1.582 1.00 0.00 O ATOM 1092 CB ILE A 72 -11.409 2.681 -1.733 1.00 0.00 C ATOM 1093 CG1 ILE A 72 -10.165 3.545 -1.948 1.00 0.00 C ATOM 1094 CG2 ILE A 72 -11.019 1.226 -1.519 1.00 0.00 C ATOM 1095 CD1 ILE A 72 -9.288 3.657 -0.720 1.00 0.00 C ATOM 0 H ILE A 72 -12.307 4.865 -2.535 1.00 0.00 H new ATOM 0 HA ILE A 72 -11.862 2.433 -3.829 1.00 0.00 H new ATOM 0 HB ILE A 72 -11.924 3.035 -0.840 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -9.579 3.127 -2.766 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -10.475 4.544 -2.256 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -10.345 1.152 -0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -11.914 0.634 -1.327 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -10.519 0.849 -2.411 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -8.425 4.284 -0.945 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -9.858 4.103 0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -8.948 2.665 -0.424 1.00 0.00 H new ATOM 1107 N THR A 73 -14.028 1.204 -3.671 1.00 0.00 N ATOM 1108 CA THR A 73 -15.208 0.359 -3.545 1.00 0.00 C ATOM 1109 C THR A 73 -15.101 -0.559 -2.333 1.00 0.00 C ATOM 1110 O THR A 73 -16.084 -0.792 -1.631 1.00 0.00 O ATOM 1111 CB THR A 73 -15.421 -0.499 -4.807 1.00 0.00 C ATOM 1112 OG1 THR A 73 -14.220 -1.212 -5.123 1.00 0.00 O ATOM 1113 CG2 THR A 73 -15.828 0.368 -5.989 1.00 0.00 C ATOM 0 H THR A 73 -13.565 1.149 -4.578 1.00 0.00 H new ATOM 0 HA THR A 73 -16.061 1.025 -3.418 1.00 0.00 H new ATOM 0 HB THR A 73 -16.223 -1.210 -4.605 1.00 0.00 H new ATOM 0 HG1 THR A 73 -14.392 -1.832 -5.862 1.00 0.00 H new ATOM 0 HG21 THR A 73 -15.973 -0.260 -6.868 1.00 0.00 H new ATOM 0 HG22 THR A 73 -16.758 0.887 -5.757 1.00 0.00 H new ATOM 0 HG23 THR A 73 -15.045 1.099 -6.190 1.00 0.00 H new ATOM 1121 N ASN A 74 -13.901 -1.076 -2.092 1.00 0.00 N ATOM 1122 CA ASN A 74 -13.666 -1.969 -0.963 1.00 0.00 C ATOM 1123 C ASN A 74 -14.244 -1.384 0.322 1.00 0.00 C ATOM 1124 O ASN A 74 -14.781 -0.276 0.326 1.00 0.00 O ATOM 1125 CB ASN A 74 -12.167 -2.224 -0.791 1.00 0.00 C ATOM 1126 CG ASN A 74 -11.691 -3.427 -1.583 1.00 0.00 C ATOM 1127 OD1 ASN A 74 -11.348 -3.205 -2.846 1.00 0.00 O flip ATOM 1128 ND2 ASN A 74 -11.632 -4.541 -1.064 1.00 0.00 N flip ATOM 0 H ASN A 74 -13.076 -0.892 -2.663 1.00 0.00 H new ATOM 0 HA ASN A 74 -14.167 -2.915 -1.169 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -11.612 -1.341 -1.108 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -11.946 -2.377 0.265 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -11.906 -4.665 -0.089 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -11.309 -5.341 -1.608 1.00 0.00 H new ATOM 1135 N ASP A 75 -14.130 -2.136 1.411 1.00 0.00 N ATOM 1136 CA ASP A 75 -14.639 -1.692 2.704 1.00 0.00 C ATOM 1137 C ASP A 75 -13.533 -1.695 3.754 1.00 0.00 C ATOM 1138 O ASP A 75 -13.524 -0.862 4.661 1.00 0.00 O ATOM 1139 CB ASP A 75 -15.792 -2.590 3.157 1.00 0.00 C ATOM 1140 CG ASP A 75 -16.802 -2.835 2.054 1.00 0.00 C ATOM 1141 OD1 ASP A 75 -16.506 -3.641 1.146 1.00 0.00 O ATOM 1142 OD2 ASP A 75 -17.890 -2.223 2.099 1.00 0.00 O ATOM 0 H ASP A 75 -13.690 -3.056 1.425 1.00 0.00 H new ATOM 0 HA ASP A 75 -15.005 -0.672 2.592 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -15.392 -3.545 3.499 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -16.293 -2.131 4.009 1.00 0.00 H new ATOM 1147 N GLN A 76 -12.604 -2.636 3.625 1.00 0.00 N ATOM 1148 CA GLN A 76 -11.494 -2.747 4.565 1.00 0.00 C ATOM 1149 C GLN A 76 -10.427 -1.698 4.273 1.00 0.00 C ATOM 1150 O GLN A 76 -9.510 -1.493 5.069 1.00 0.00 O ATOM 1151 CB GLN A 76 -10.881 -4.147 4.499 1.00 0.00 C ATOM 1152 CG GLN A 76 -11.896 -5.265 4.678 1.00 0.00 C ATOM 1153 CD GLN A 76 -12.502 -5.720 3.365 1.00 0.00 C ATOM 1154 OE1 GLN A 76 -13.723 -5.770 3.217 1.00 0.00 O ATOM 1155 NE2 GLN A 76 -11.649 -6.053 2.403 1.00 0.00 N ATOM 0 H GLN A 76 -12.597 -3.332 2.880 1.00 0.00 H new ATOM 0 HA GLN A 76 -11.882 -2.575 5.569 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -10.382 -4.271 3.538 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -10.115 -4.236 5.270 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -11.414 -6.113 5.164 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -12.691 -4.926 5.342 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -10.644 -5.996 2.570 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -11.999 -6.365 1.497 1.00 0.00 H new ATOM 1164 N TYR A 77 -10.552 -1.035 3.129 1.00 0.00 N ATOM 1165 CA TYR A 77 -9.597 -0.008 2.731 1.00 0.00 C ATOM 1166 C TYR A 77 -10.123 1.384 3.065 1.00 0.00 C ATOM 1167 O TYR A 77 -10.950 1.939 2.341 1.00 0.00 O ATOM 1168 CB TYR A 77 -9.302 -0.109 1.234 1.00 0.00 C ATOM 1169 CG TYR A 77 -8.707 -1.436 0.821 1.00 0.00 C ATOM 1170 CD1 TYR A 77 -9.393 -2.625 1.036 1.00 0.00 C ATOM 1171 CD2 TYR A 77 -7.458 -1.501 0.215 1.00 0.00 C ATOM 1172 CE1 TYR A 77 -8.852 -3.839 0.662 1.00 0.00 C ATOM 1173 CE2 TYR A 77 -6.910 -2.711 -0.164 1.00 0.00 C ATOM 1174 CZ TYR A 77 -7.611 -3.877 0.062 1.00 0.00 C ATOM 1175 OH TYR A 77 -7.069 -5.085 -0.314 1.00 0.00 O ATOM 0 H TYR A 77 -11.306 -1.191 2.460 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.674 -0.171 3.288 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -10.226 0.054 0.679 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.616 0.690 0.953 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -10.366 -2.599 1.504 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.906 -0.590 0.037 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -9.398 -4.754 0.838 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.938 -2.744 -0.634 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.767 -5.773 -0.309 1.00 0.00 H new ATOM 1185 N LYS A 78 -9.637 1.944 4.168 1.00 0.00 N ATOM 1186 CA LYS A 78 -10.055 3.273 4.600 1.00 0.00 C ATOM 1187 C LYS A 78 -8.863 4.222 4.668 1.00 0.00 C ATOM 1188 O LYS A 78 -7.945 4.027 5.464 1.00 0.00 O ATOM 1189 CB LYS A 78 -10.737 3.195 5.968 1.00 0.00 C ATOM 1190 CG LYS A 78 -12.235 2.953 5.887 1.00 0.00 C ATOM 1191 CD LYS A 78 -12.889 3.053 7.255 1.00 0.00 C ATOM 1192 CE LYS A 78 -13.109 4.501 7.664 1.00 0.00 C ATOM 1193 NZ LYS A 78 -14.343 5.069 7.054 1.00 0.00 N ATOM 0 H LYS A 78 -8.953 1.498 4.779 1.00 0.00 H new ATOM 0 HA LYS A 78 -10.764 3.660 3.868 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -10.279 2.394 6.548 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -10.556 4.124 6.509 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -12.686 3.681 5.212 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.423 1.966 5.464 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -13.844 2.529 7.242 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.263 2.556 7.996 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.178 4.565 8.750 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.248 5.098 7.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.457 6.057 7.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.267 5.032 6.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.168 4.515 7.361 1.00 0.00 H new ATOM 1207 N VAL A 79 -8.885 5.252 3.828 1.00 0.00 N ATOM 1208 CA VAL A 79 -7.807 6.234 3.794 1.00 0.00 C ATOM 1209 C VAL A 79 -8.077 7.379 4.764 1.00 0.00 C ATOM 1210 O VAL A 79 -8.658 8.397 4.391 1.00 0.00 O ATOM 1211 CB VAL A 79 -7.617 6.810 2.378 1.00 0.00 C ATOM 1212 CG1 VAL A 79 -6.490 7.832 2.365 1.00 0.00 C ATOM 1213 CG2 VAL A 79 -7.346 5.693 1.382 1.00 0.00 C ATOM 0 H VAL A 79 -9.637 5.428 3.162 1.00 0.00 H new ATOM 0 HA VAL A 79 -6.896 5.715 4.092 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.537 7.315 2.082 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.370 8.228 1.357 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.729 8.646 3.049 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.562 7.355 2.680 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.214 6.117 0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.441 5.159 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -8.188 5.001 1.373 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.649 7.204 6.011 1.00 0.00 N ATOM 1224 CA GLU A 80 -7.845 8.223 7.035 1.00 0.00 C ATOM 1225 C GLU A 80 -6.948 9.431 6.779 1.00 0.00 C ATOM 1226 O GLU A 80 -7.251 10.544 7.206 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.558 7.646 8.423 1.00 0.00 C ATOM 1228 CG GLU A 80 -8.556 6.585 8.858 1.00 0.00 C ATOM 1229 CD GLU A 80 -9.795 7.178 9.500 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -9.671 7.770 10.593 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -10.888 7.051 8.911 1.00 0.00 O ATOM 0 H GLU A 80 -7.165 6.367 6.336 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.885 8.548 6.993 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.557 7.215 8.429 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.561 8.456 9.152 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.849 5.990 7.993 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.075 5.907 9.563 1.00 0.00 H new ATOM 1238 N GLY A 81 -5.841 9.201 6.080 1.00 0.00 N ATOM 1239 CA GLY A 81 -4.916 10.278 5.780 1.00 0.00 C ATOM 1240 C GLY A 81 -3.970 9.931 4.647 1.00 0.00 C ATOM 1241 O GLY A 81 -4.257 9.050 3.836 1.00 0.00 O ATOM 0 H GLY A 81 -5.568 8.288 5.716 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.479 11.174 5.518 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.337 10.515 6.673 1.00 0.00 H new ATOM 1245 N PHE A 82 -2.838 10.625 4.590 1.00 0.00 N ATOM 1246 CA PHE A 82 -1.848 10.388 3.546 1.00 0.00 C ATOM 1247 C PHE A 82 -0.449 10.759 4.029 1.00 0.00 C ATOM 1248 O PHE A 82 -0.263 11.686 4.817 1.00 0.00 O ATOM 1249 CB PHE A 82 -2.196 11.191 2.291 1.00 0.00 C ATOM 1250 CG PHE A 82 -3.632 11.057 1.873 1.00 0.00 C ATOM 1251 CD1 PHE A 82 -4.618 11.820 2.478 1.00 0.00 C ATOM 1252 CD2 PHE A 82 -3.997 10.167 0.875 1.00 0.00 C ATOM 1253 CE1 PHE A 82 -5.941 11.699 2.095 1.00 0.00 C ATOM 1254 CE2 PHE A 82 -5.318 10.042 0.488 1.00 0.00 C ATOM 1255 CZ PHE A 82 -6.291 10.808 1.099 1.00 0.00 C ATOM 0 H PHE A 82 -2.584 11.356 5.254 1.00 0.00 H new ATOM 0 HA PHE A 82 -1.860 9.325 3.304 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -1.975 12.243 2.470 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.555 10.865 1.472 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -4.350 12.517 3.258 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -3.241 9.564 0.394 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.700 12.300 2.574 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -5.589 9.346 -0.292 1.00 0.00 H new ATOM 0 HZ PHE A 82 -7.324 10.711 0.799 1.00 0.00 H new ATOM 1265 N PRO A 83 0.559 10.018 3.546 1.00 0.00 N ATOM 1266 CA PRO A 83 0.350 8.911 2.608 1.00 0.00 C ATOM 1267 C PRO A 83 -0.343 7.720 3.262 1.00 0.00 C ATOM 1268 O PRO A 83 -0.610 7.727 4.464 1.00 0.00 O ATOM 1269 CB PRO A 83 1.770 8.535 2.180 1.00 0.00 C ATOM 1270 CG PRO A 83 2.635 8.974 3.311 1.00 0.00 C ATOM 1271 CD PRO A 83 1.982 10.203 3.880 1.00 0.00 C ATOM 0 HA PRO A 83 -0.298 9.196 1.779 1.00 0.00 H new ATOM 0 HB2 PRO A 83 1.860 7.463 2.006 1.00 0.00 H new ATOM 0 HB3 PRO A 83 2.049 9.033 1.252 1.00 0.00 H new ATOM 0 HG2 PRO A 83 2.718 8.192 4.065 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.646 9.193 2.967 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.136 10.278 4.956 1.00 0.00 H new ATOM 0 HD3 PRO A 83 2.384 11.114 3.436 1.00 0.00 H new ATOM 1279 N THR A 84 -0.630 6.697 2.463 1.00 0.00 N ATOM 1280 CA THR A 84 -1.292 5.499 2.964 1.00 0.00 C ATOM 1281 C THR A 84 -1.016 4.301 2.063 1.00 0.00 C ATOM 1282 O THR A 84 -1.577 4.191 0.972 1.00 0.00 O ATOM 1283 CB THR A 84 -2.815 5.703 3.075 1.00 0.00 C ATOM 1284 OG1 THR A 84 -3.096 6.899 3.811 1.00 0.00 O ATOM 1285 CG2 THR A 84 -3.472 4.514 3.759 1.00 0.00 C ATOM 0 H THR A 84 -0.414 6.674 1.466 1.00 0.00 H new ATOM 0 HA THR A 84 -0.886 5.305 3.957 1.00 0.00 H new ATOM 0 HB THR A 84 -3.222 5.792 2.068 1.00 0.00 H new ATOM 0 HG1 THR A 84 -3.543 7.546 3.226 1.00 0.00 H new ATOM 0 HG21 THR A 84 -4.547 4.681 3.826 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.281 3.610 3.181 1.00 0.00 H new ATOM 0 HG23 THR A 84 -3.060 4.398 4.761 1.00 0.00 H new ATOM 1293 N ILE A 85 -0.150 3.406 2.525 1.00 0.00 N ATOM 1294 CA ILE A 85 0.199 2.215 1.761 1.00 0.00 C ATOM 1295 C ILE A 85 -0.615 1.010 2.219 1.00 0.00 C ATOM 1296 O ILE A 85 -0.920 0.868 3.404 1.00 0.00 O ATOM 1297 CB ILE A 85 1.698 1.885 1.885 1.00 0.00 C ATOM 1298 CG1 ILE A 85 2.544 3.063 1.398 1.00 0.00 C ATOM 1299 CG2 ILE A 85 2.030 0.626 1.097 1.00 0.00 C ATOM 1300 CD1 ILE A 85 3.887 3.168 2.086 1.00 0.00 C ATOM 0 H ILE A 85 0.323 3.483 3.425 1.00 0.00 H new ATOM 0 HA ILE A 85 -0.032 2.431 0.718 1.00 0.00 H new ATOM 0 HB ILE A 85 1.930 1.705 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.702 2.967 0.324 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.990 3.988 1.557 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.093 0.406 1.194 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.449 -0.210 1.486 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.786 0.780 0.046 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.432 4.025 1.691 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.738 3.296 3.158 1.00 0.00 H new ATOM 0 HD13 ILE A 85 4.460 2.259 1.905 1.00 0.00 H new ATOM 1312 N TYR A 86 -0.963 0.144 1.274 1.00 0.00 N ATOM 1313 CA TYR A 86 -1.743 -1.050 1.580 1.00 0.00 C ATOM 1314 C TYR A 86 -1.281 -2.233 0.736 1.00 0.00 C ATOM 1315 O TYR A 86 -1.046 -2.100 -0.466 1.00 0.00 O ATOM 1316 CB TYR A 86 -3.231 -0.788 1.342 1.00 0.00 C ATOM 1317 CG TYR A 86 -3.955 -0.260 2.559 1.00 0.00 C ATOM 1318 CD1 TYR A 86 -4.431 -1.124 3.538 1.00 0.00 C ATOM 1319 CD2 TYR A 86 -4.165 1.103 2.731 1.00 0.00 C ATOM 1320 CE1 TYR A 86 -5.095 -0.646 4.651 1.00 0.00 C ATOM 1321 CE2 TYR A 86 -4.826 1.590 3.842 1.00 0.00 C ATOM 1322 CZ TYR A 86 -5.289 0.711 4.799 1.00 0.00 C ATOM 1323 OH TYR A 86 -5.949 1.192 5.907 1.00 0.00 O ATOM 0 H TYR A 86 -0.717 0.246 0.289 1.00 0.00 H new ATOM 0 HA TYR A 86 -1.588 -1.295 2.631 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -3.339 -0.073 0.526 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -3.707 -1.714 1.020 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -4.279 -2.187 3.427 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -3.805 1.794 1.983 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -5.460 -1.332 5.401 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -4.979 2.652 3.961 1.00 0.00 H new ATOM 0 HH TYR A 86 -6.001 2.169 5.858 1.00 0.00 H new ATOM 1333 N PHE A 87 -1.154 -3.393 1.373 1.00 0.00 N ATOM 1334 CA PHE A 87 -0.721 -4.601 0.682 1.00 0.00 C ATOM 1335 C PHE A 87 -1.878 -5.583 0.524 1.00 0.00 C ATOM 1336 O PHE A 87 -2.370 -6.141 1.504 1.00 0.00 O ATOM 1337 CB PHE A 87 0.427 -5.267 1.444 1.00 0.00 C ATOM 1338 CG PHE A 87 1.100 -6.366 0.674 1.00 0.00 C ATOM 1339 CD1 PHE A 87 0.398 -7.502 0.303 1.00 0.00 C ATOM 1340 CD2 PHE A 87 2.437 -6.265 0.321 1.00 0.00 C ATOM 1341 CE1 PHE A 87 1.015 -8.515 -0.406 1.00 0.00 C ATOM 1342 CE2 PHE A 87 3.059 -7.274 -0.388 1.00 0.00 C ATOM 1343 CZ PHE A 87 2.347 -8.402 -0.751 1.00 0.00 C ATOM 0 H PHE A 87 -1.345 -3.521 2.367 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.372 -4.315 -0.310 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.167 -4.510 1.704 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.044 -5.672 2.380 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -0.644 -7.597 0.571 1.00 0.00 H new ATOM 0 HD2 PHE A 87 2.999 -5.387 0.604 1.00 0.00 H new ATOM 0 HE1 PHE A 87 0.456 -9.394 -0.690 1.00 0.00 H new ATOM 0 HE2 PHE A 87 4.101 -7.182 -0.659 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.832 -9.193 -1.303 1.00 0.00 H new ATOM 1353 N ALA A 88 -2.309 -5.786 -0.716 1.00 0.00 N ATOM 1354 CA ALA A 88 -3.408 -6.701 -1.003 1.00 0.00 C ATOM 1355 C ALA A 88 -2.890 -8.027 -1.548 1.00 0.00 C ATOM 1356 O ALA A 88 -2.607 -8.170 -2.738 1.00 0.00 O ATOM 1357 CB ALA A 88 -4.378 -6.066 -1.988 1.00 0.00 C ATOM 0 H ALA A 88 -1.914 -5.330 -1.538 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.934 -6.903 -0.070 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.194 -6.759 -2.194 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.781 -5.148 -1.561 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.855 -5.835 -2.916 1.00 0.00 H new ATOM 1363 N PRO A 89 -2.760 -9.023 -0.659 1.00 0.00 N ATOM 1364 CA PRO A 89 -2.275 -10.356 -1.028 1.00 0.00 C ATOM 1365 C PRO A 89 -3.278 -11.121 -1.885 1.00 0.00 C ATOM 1366 O PRO A 89 -4.398 -11.393 -1.454 1.00 0.00 O ATOM 1367 CB PRO A 89 -2.087 -11.052 0.323 1.00 0.00 C ATOM 1368 CG PRO A 89 -3.026 -10.352 1.243 1.00 0.00 C ATOM 1369 CD PRO A 89 -3.078 -8.924 0.776 1.00 0.00 C ATOM 0 HA PRO A 89 -1.366 -10.307 -1.628 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -2.317 -12.115 0.256 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -1.057 -10.970 0.671 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -4.015 -10.809 1.212 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -2.679 -10.413 2.275 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -4.061 -8.483 0.940 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -2.357 -8.301 1.306 1.00 0.00 H new ATOM 1377 N SER A 90 -2.868 -11.465 -3.102 1.00 0.00 N ATOM 1378 CA SER A 90 -3.732 -12.196 -4.022 1.00 0.00 C ATOM 1379 C SER A 90 -4.283 -13.457 -3.363 1.00 0.00 C ATOM 1380 O SER A 90 -3.558 -14.428 -3.151 1.00 0.00 O ATOM 1381 CB SER A 90 -2.964 -12.564 -5.292 1.00 0.00 C ATOM 1382 OG SER A 90 -1.986 -13.556 -5.028 1.00 0.00 O ATOM 0 H SER A 90 -1.943 -11.249 -3.474 1.00 0.00 H new ATOM 0 HA SER A 90 -4.569 -11.550 -4.287 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.659 -12.927 -6.049 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.484 -11.675 -5.701 1.00 0.00 H new ATOM 0 HG SER A 90 -2.164 -13.967 -4.157 1.00 0.00 H new ATOM 1388 N GLY A 91 -5.573 -13.433 -3.041 1.00 0.00 N ATOM 1389 CA GLY A 91 -6.200 -14.579 -2.410 1.00 0.00 C ATOM 1390 C GLY A 91 -6.793 -14.243 -1.056 1.00 0.00 C ATOM 1391 O GLY A 91 -7.914 -14.646 -0.744 1.00 0.00 O ATOM 0 H GLY A 91 -6.194 -12.641 -3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -6.985 -14.964 -3.061 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -5.463 -15.374 -2.293 1.00 0.00 H new ATOM 1395 N ASP A 92 -6.039 -13.504 -0.249 1.00 0.00 N ATOM 1396 CA ASP A 92 -6.496 -13.114 1.080 1.00 0.00 C ATOM 1397 C ASP A 92 -6.623 -11.598 1.188 1.00 0.00 C ATOM 1398 O ASP A 92 -6.348 -11.014 2.236 1.00 0.00 O ATOM 1399 CB ASP A 92 -5.533 -13.635 2.147 1.00 0.00 C ATOM 1400 CG ASP A 92 -6.155 -13.651 3.530 1.00 0.00 C ATOM 1401 OD1 ASP A 92 -7.363 -13.951 3.635 1.00 0.00 O ATOM 1402 OD2 ASP A 92 -5.433 -13.365 4.508 1.00 0.00 O ATOM 0 H ASP A 92 -5.109 -13.163 -0.492 1.00 0.00 H new ATOM 0 HA ASP A 92 -7.479 -13.555 1.243 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -5.214 -14.643 1.883 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -4.639 -13.012 2.161 1.00 0.00 H new ATOM 1407 N LYS A 93 -7.039 -10.965 0.096 1.00 0.00 N ATOM 1408 CA LYS A 93 -7.202 -9.516 0.066 1.00 0.00 C ATOM 1409 C LYS A 93 -8.206 -9.060 1.120 1.00 0.00 C ATOM 1410 O LYS A 93 -8.061 -7.988 1.708 1.00 0.00 O ATOM 1411 CB LYS A 93 -7.661 -9.062 -1.321 1.00 0.00 C ATOM 1412 CG LYS A 93 -6.791 -9.585 -2.451 1.00 0.00 C ATOM 1413 CD LYS A 93 -6.770 -8.625 -3.629 1.00 0.00 C ATOM 1414 CE LYS A 93 -5.731 -9.034 -4.662 1.00 0.00 C ATOM 1415 NZ LYS A 93 -6.157 -10.237 -5.430 1.00 0.00 N ATOM 0 H LYS A 93 -7.270 -11.433 -0.780 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.236 -9.062 0.289 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -8.687 -9.392 -1.481 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -7.668 -7.973 -1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.775 -9.739 -2.088 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -7.163 -10.556 -2.778 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -7.755 -8.596 -4.094 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.555 -7.617 -3.275 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -5.557 -8.207 -5.350 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.784 -9.238 -4.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.370 -10.565 -6.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -6.429 -10.993 -4.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -6.970 -9.995 -6.032 1.00 0.00 H new ATOM 1429 N LYS A 94 -9.223 -9.881 1.357 1.00 0.00 N ATOM 1430 CA LYS A 94 -10.250 -9.564 2.342 1.00 0.00 C ATOM 1431 C LYS A 94 -9.656 -8.801 3.521 1.00 0.00 C ATOM 1432 O LYS A 94 -10.293 -7.909 4.080 1.00 0.00 O ATOM 1433 CB LYS A 94 -10.923 -10.846 2.837 1.00 0.00 C ATOM 1434 CG LYS A 94 -11.641 -11.618 1.744 1.00 0.00 C ATOM 1435 CD LYS A 94 -13.063 -11.119 1.550 1.00 0.00 C ATOM 1436 CE LYS A 94 -14.016 -11.748 2.555 1.00 0.00 C ATOM 1437 NZ LYS A 94 -15.432 -11.672 2.099 1.00 0.00 N ATOM 0 H LYS A 94 -9.358 -10.772 0.880 1.00 0.00 H new ATOM 0 HA LYS A 94 -10.996 -8.931 1.862 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.169 -11.490 3.290 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.638 -10.592 3.620 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.090 -11.523 0.808 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.658 -12.678 1.997 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.087 -10.034 1.654 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -13.396 -11.349 0.538 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.741 -12.791 2.713 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.916 -11.243 3.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -16.050 -12.111 2.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -15.703 -10.676 1.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -15.533 -12.176 1.195 1.00 0.00 H new ATOM 1451 N ASN A 95 -8.430 -9.157 3.893 1.00 0.00 N ATOM 1452 CA ASN A 95 -7.750 -8.504 5.006 1.00 0.00 C ATOM 1453 C ASN A 95 -6.551 -7.699 4.513 1.00 0.00 C ATOM 1454 O ASN A 95 -5.447 -8.218 4.353 1.00 0.00 O ATOM 1455 CB ASN A 95 -7.294 -9.543 6.032 1.00 0.00 C ATOM 1456 CG ASN A 95 -8.379 -9.878 7.037 1.00 0.00 C ATOM 1457 OD1 ASN A 95 -8.323 -9.457 8.192 1.00 0.00 O ATOM 1458 ND2 ASN A 95 -9.375 -10.640 6.599 1.00 0.00 N ATOM 0 H ASN A 95 -7.888 -9.893 3.440 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.454 -7.820 5.480 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.990 -10.452 5.514 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -6.417 -9.168 6.560 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -10.134 -10.899 7.229 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -9.380 -10.967 5.633 1.00 0.00 H new ATOM 1465 N PRO A 96 -6.772 -6.399 4.268 1.00 0.00 N ATOM 1466 CA PRO A 96 -5.722 -5.494 3.791 1.00 0.00 C ATOM 1467 C PRO A 96 -4.670 -5.214 4.859 1.00 0.00 C ATOM 1468 O PRO A 96 -4.986 -5.112 6.044 1.00 0.00 O ATOM 1469 CB PRO A 96 -6.487 -4.214 3.446 1.00 0.00 C ATOM 1470 CG PRO A 96 -7.706 -4.258 4.301 1.00 0.00 C ATOM 1471 CD PRO A 96 -8.064 -5.712 4.437 1.00 0.00 C ATOM 0 HA PRO A 96 -5.170 -5.916 2.951 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.889 -3.327 3.655 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -6.747 -4.181 2.388 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.515 -3.810 5.276 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -8.522 -3.696 3.847 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -8.509 -5.927 5.408 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -8.785 -6.021 3.680 1.00 0.00 H new ATOM 1479 N ILE A 97 -3.418 -5.091 4.431 1.00 0.00 N ATOM 1480 CA ILE A 97 -2.320 -4.821 5.350 1.00 0.00 C ATOM 1481 C ILE A 97 -1.748 -3.424 5.130 1.00 0.00 C ATOM 1482 O ILE A 97 -1.125 -3.151 4.104 1.00 0.00 O ATOM 1483 CB ILE A 97 -1.189 -5.856 5.196 1.00 0.00 C ATOM 1484 CG1 ILE A 97 -1.764 -7.274 5.184 1.00 0.00 C ATOM 1485 CG2 ILE A 97 -0.172 -5.700 6.317 1.00 0.00 C ATOM 1486 CD1 ILE A 97 -0.906 -8.267 4.433 1.00 0.00 C ATOM 0 H ILE A 97 -3.139 -5.174 3.453 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.729 -4.889 6.358 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.683 -5.681 4.246 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -1.887 -7.616 6.212 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.757 -7.251 4.735 1.00 0.00 H new ATOM 0 HG21 ILE A 97 0.621 -6.438 6.194 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.256 -4.698 6.283 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.664 -5.852 7.278 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -1.375 -9.251 4.466 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.804 -7.948 3.396 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.080 -8.319 4.895 1.00 0.00 H new ATOM 1498 N LYS A 98 -1.964 -2.543 6.101 1.00 0.00 N ATOM 1499 CA LYS A 98 -1.469 -1.174 6.016 1.00 0.00 C ATOM 1500 C LYS A 98 -0.079 -1.059 6.636 1.00 0.00 C ATOM 1501 O LYS A 98 0.276 -1.824 7.533 1.00 0.00 O ATOM 1502 CB LYS A 98 -2.433 -0.217 6.719 1.00 0.00 C ATOM 1503 CG LYS A 98 -1.885 1.190 6.879 1.00 0.00 C ATOM 1504 CD LYS A 98 -2.999 2.204 7.081 1.00 0.00 C ATOM 1505 CE LYS A 98 -3.347 2.363 8.553 1.00 0.00 C ATOM 1506 NZ LYS A 98 -4.309 1.323 9.011 1.00 0.00 N ATOM 0 H LYS A 98 -2.479 -2.753 6.956 1.00 0.00 H new ATOM 0 HA LYS A 98 -1.402 -0.903 4.962 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.364 -0.173 6.154 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.676 -0.617 7.703 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -1.205 1.222 7.730 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -1.304 1.458 5.996 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -2.694 3.167 6.672 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -3.884 1.889 6.529 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -2.437 2.304 9.150 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.774 3.352 8.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -4.802 1.657 9.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -5.004 1.138 8.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -3.794 0.446 9.230 1.00 0.00 H new ATOM 1520 N PHE A 99 0.701 -0.098 6.153 1.00 0.00 N ATOM 1521 CA PHE A 99 2.051 0.117 6.660 1.00 0.00 C ATOM 1522 C PHE A 99 2.042 1.090 7.836 1.00 0.00 C ATOM 1523 O PHE A 99 1.912 2.299 7.653 1.00 0.00 O ATOM 1524 CB PHE A 99 2.957 0.651 5.549 1.00 0.00 C ATOM 1525 CG PHE A 99 4.364 0.920 6.000 1.00 0.00 C ATOM 1526 CD1 PHE A 99 5.122 -0.083 6.583 1.00 0.00 C ATOM 1527 CD2 PHE A 99 4.929 2.175 5.841 1.00 0.00 C ATOM 1528 CE1 PHE A 99 6.418 0.161 6.999 1.00 0.00 C ATOM 1529 CE2 PHE A 99 6.224 2.424 6.254 1.00 0.00 C ATOM 1530 CZ PHE A 99 6.969 1.416 6.835 1.00 0.00 C ATOM 0 H PHE A 99 0.422 0.544 5.411 1.00 0.00 H new ATOM 0 HA PHE A 99 2.439 -0.841 7.007 1.00 0.00 H new ATOM 0 HB2 PHE A 99 2.978 -0.069 4.731 1.00 0.00 H new ATOM 0 HB3 PHE A 99 2.529 1.572 5.153 1.00 0.00 H new ATOM 0 HD1 PHE A 99 4.696 -1.067 6.714 1.00 0.00 H new ATOM 0 HD2 PHE A 99 4.351 2.968 5.389 1.00 0.00 H new ATOM 0 HE1 PHE A 99 6.998 -0.629 7.452 1.00 0.00 H new ATOM 0 HE2 PHE A 99 6.654 3.406 6.123 1.00 0.00 H new ATOM 0 HZ PHE A 99 7.981 1.610 7.160 1.00 0.00 H new ATOM 1540 N GLU A 100 2.179 0.550 9.043 1.00 0.00 N ATOM 1541 CA GLU A 100 2.185 1.370 10.249 1.00 0.00 C ATOM 1542 C GLU A 100 3.508 1.229 10.997 1.00 0.00 C ATOM 1543 O GLU A 100 3.614 0.462 11.953 1.00 0.00 O ATOM 1544 CB GLU A 100 1.024 0.978 11.165 1.00 0.00 C ATOM 1545 CG GLU A 100 -0.264 1.727 10.870 1.00 0.00 C ATOM 1546 CD GLU A 100 -1.140 1.886 12.098 1.00 0.00 C ATOM 1547 OE1 GLU A 100 -0.607 2.258 13.164 1.00 0.00 O ATOM 1548 OE2 GLU A 100 -2.360 1.640 11.991 1.00 0.00 O ATOM 0 H GLU A 100 2.287 -0.450 9.212 1.00 0.00 H new ATOM 0 HA GLU A 100 2.066 2.411 9.950 1.00 0.00 H new ATOM 0 HB2 GLU A 100 0.842 -0.092 11.069 1.00 0.00 H new ATOM 0 HB3 GLU A 100 1.312 1.161 12.200 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -0.024 2.712 10.470 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -0.820 1.196 10.098 1.00 0.00 H new ATOM 1555 N GLY A 101 4.515 1.975 10.553 1.00 0.00 N ATOM 1556 CA GLY A 101 5.818 1.918 11.190 1.00 0.00 C ATOM 1557 C GLY A 101 6.227 3.247 11.792 1.00 0.00 C ATOM 1558 O GLY A 101 5.379 4.079 12.113 1.00 0.00 O ATOM 0 H GLY A 101 4.452 2.618 9.764 1.00 0.00 H new ATOM 0 HA2 GLY A 101 5.804 1.158 11.971 1.00 0.00 H new ATOM 0 HA3 GLY A 101 6.564 1.609 10.458 1.00 0.00 H new ATOM 1562 N GLY A 102 7.532 3.448 11.949 1.00 0.00 N ATOM 1563 CA GLY A 102 8.029 4.686 12.518 1.00 0.00 C ATOM 1564 C GLY A 102 8.458 5.681 11.458 1.00 0.00 C ATOM 1565 O GLY A 102 8.405 6.891 11.675 1.00 0.00 O ATOM 0 H GLY A 102 8.254 2.775 11.692 1.00 0.00 H new ATOM 0 HA2 GLY A 102 7.253 5.134 13.139 1.00 0.00 H new ATOM 0 HA3 GLY A 102 8.874 4.468 13.171 1.00 0.00 H new ATOM 1569 N ASN A 103 8.886 5.170 10.308 1.00 0.00 N ATOM 1570 CA ASN A 103 9.328 6.023 9.210 1.00 0.00 C ATOM 1571 C ASN A 103 8.850 5.474 7.869 1.00 0.00 C ATOM 1572 O ASN A 103 8.644 4.270 7.717 1.00 0.00 O ATOM 1573 CB ASN A 103 10.853 6.141 9.211 1.00 0.00 C ATOM 1574 CG ASN A 103 11.331 7.464 8.643 1.00 0.00 C ATOM 1575 OD1 ASN A 103 10.590 8.447 8.623 1.00 0.00 O ATOM 1576 ND2 ASN A 103 12.574 7.493 8.179 1.00 0.00 N ATOM 0 H ASN A 103 8.936 4.170 10.112 1.00 0.00 H new ATOM 0 HA ASN A 103 8.894 7.012 9.353 1.00 0.00 H new ATOM 0 HB2 ASN A 103 11.222 6.032 10.231 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.278 5.324 8.629 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.951 8.355 7.785 1.00 0.00 H new ATOM 0 HD22 ASN A 103 13.152 6.653 8.216 1.00 0.00 H new ATOM 1583 N ARG A 104 8.678 6.365 6.898 1.00 0.00 N ATOM 1584 CA ARG A 104 8.225 5.971 5.570 1.00 0.00 C ATOM 1585 C ARG A 104 9.299 6.253 4.523 1.00 0.00 C ATOM 1586 O ARG A 104 9.168 7.176 3.719 1.00 0.00 O ATOM 1587 CB ARG A 104 6.936 6.711 5.207 1.00 0.00 C ATOM 1588 CG ARG A 104 5.673 5.975 5.625 1.00 0.00 C ATOM 1589 CD ARG A 104 4.424 6.692 5.136 1.00 0.00 C ATOM 1590 NE ARG A 104 3.946 7.678 6.101 1.00 0.00 N ATOM 1591 CZ ARG A 104 3.233 7.367 7.177 1.00 0.00 C ATOM 1592 NH1 ARG A 104 2.917 6.104 7.426 1.00 0.00 N ATOM 1593 NH2 ARG A 104 2.834 8.322 8.009 1.00 0.00 N ATOM 0 H ARG A 104 8.846 7.365 7.007 1.00 0.00 H new ATOM 0 HA ARG A 104 8.029 4.899 5.584 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.946 7.694 5.678 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.912 6.874 4.130 1.00 0.00 H new ATOM 0 HG2 ARG A 104 5.692 4.961 5.225 1.00 0.00 H new ATOM 0 HG3 ARG A 104 5.643 5.889 6.711 1.00 0.00 H new ATOM 0 HD2 ARG A 104 4.637 7.186 4.188 1.00 0.00 H new ATOM 0 HD3 ARG A 104 3.638 5.961 4.945 1.00 0.00 H new ATOM 0 HE ARG A 104 4.172 8.659 5.940 1.00 0.00 H new ATOM 0 HH11 ARG A 104 3.222 5.367 6.790 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.369 5.869 8.254 1.00 0.00 H new ATOM 0 HH21 ARG A 104 3.075 9.295 7.822 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.286 8.082 8.835 1.00 0.00 H new ATOM 1607 N ASP A 105 10.359 5.453 4.540 1.00 0.00 N ATOM 1608 CA ASP A 105 11.455 5.617 3.592 1.00 0.00 C ATOM 1609 C ASP A 105 11.597 4.382 2.708 1.00 0.00 C ATOM 1610 O ASP A 105 10.784 3.459 2.776 1.00 0.00 O ATOM 1611 CB ASP A 105 12.765 5.881 4.336 1.00 0.00 C ATOM 1612 CG ASP A 105 13.780 6.612 3.479 1.00 0.00 C ATOM 1613 OD1 ASP A 105 13.606 7.830 3.264 1.00 0.00 O ATOM 1614 OD2 ASP A 105 14.747 5.967 3.023 1.00 0.00 O ATOM 0 H ASP A 105 10.483 4.685 5.199 1.00 0.00 H new ATOM 0 HA ASP A 105 11.229 6.473 2.956 1.00 0.00 H new ATOM 0 HB2 ASP A 105 12.559 6.468 5.231 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.189 4.933 4.667 1.00 0.00 H new ATOM 1619 N LEU A 106 12.635 4.371 1.878 1.00 0.00 N ATOM 1620 CA LEU A 106 12.884 3.249 0.979 1.00 0.00 C ATOM 1621 C LEU A 106 13.458 2.059 1.740 1.00 0.00 C ATOM 1622 O LEU A 106 13.465 0.935 1.238 1.00 0.00 O ATOM 1623 CB LEU A 106 13.843 3.668 -0.136 1.00 0.00 C ATOM 1624 CG LEU A 106 14.135 2.611 -1.202 1.00 0.00 C ATOM 1625 CD1 LEU A 106 13.023 2.578 -2.239 1.00 0.00 C ATOM 1626 CD2 LEU A 106 15.477 2.880 -1.866 1.00 0.00 C ATOM 0 H LEU A 106 13.317 5.126 1.809 1.00 0.00 H new ATOM 0 HA LEU A 106 11.933 2.949 0.538 1.00 0.00 H new ATOM 0 HB2 LEU A 106 13.432 4.549 -0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 106 14.787 3.968 0.318 1.00 0.00 H new ATOM 0 HG LEU A 106 14.181 1.636 -0.717 1.00 0.00 H new ATOM 0 HD11 LEU A 106 13.248 1.820 -2.990 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.078 2.337 -1.752 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.945 3.553 -2.720 1.00 0.00 H new ATOM 0 HD21 LEU A 106 15.668 2.118 -2.622 1.00 0.00 H new ATOM 0 HD22 LEU A 106 15.459 3.862 -2.338 1.00 0.00 H new ATOM 0 HD23 LEU A 106 16.267 2.852 -1.115 1.00 0.00 H new ATOM 1638 N GLU A 107 13.937 2.313 2.953 1.00 0.00 N ATOM 1639 CA GLU A 107 14.512 1.261 3.783 1.00 0.00 C ATOM 1640 C GLU A 107 13.449 0.635 4.682 1.00 0.00 C ATOM 1641 O GLU A 107 13.452 -0.574 4.916 1.00 0.00 O ATOM 1642 CB GLU A 107 15.652 1.820 4.637 1.00 0.00 C ATOM 1643 CG GLU A 107 16.697 0.782 5.012 1.00 0.00 C ATOM 1644 CD GLU A 107 17.590 1.238 6.150 1.00 0.00 C ATOM 1645 OE1 GLU A 107 17.173 2.141 6.905 1.00 0.00 O ATOM 1646 OE2 GLU A 107 18.705 0.693 6.285 1.00 0.00 O ATOM 0 H GLU A 107 13.938 3.238 3.383 1.00 0.00 H new ATOM 0 HA GLU A 107 14.907 0.488 3.123 1.00 0.00 H new ATOM 0 HB2 GLU A 107 16.137 2.632 4.095 1.00 0.00 H new ATOM 0 HB3 GLU A 107 15.235 2.249 5.548 1.00 0.00 H new ATOM 0 HG2 GLU A 107 16.198 -0.145 5.296 1.00 0.00 H new ATOM 0 HG3 GLU A 107 17.312 0.559 4.140 1.00 0.00 H new ATOM 1653 N HIS A 108 12.541 1.466 5.182 1.00 0.00 N ATOM 1654 CA HIS A 108 11.471 0.995 6.055 1.00 0.00 C ATOM 1655 C HIS A 108 10.379 0.300 5.248 1.00 0.00 C ATOM 1656 O HIS A 108 9.806 -0.697 5.690 1.00 0.00 O ATOM 1657 CB HIS A 108 10.876 2.162 6.843 1.00 0.00 C ATOM 1658 CG HIS A 108 11.829 2.771 7.825 1.00 0.00 C ATOM 1659 ND1 HIS A 108 12.664 3.822 7.510 1.00 0.00 N ATOM 1660 CD2 HIS A 108 12.076 2.471 9.121 1.00 0.00 C ATOM 1661 CE1 HIS A 108 13.385 4.141 8.570 1.00 0.00 C ATOM 1662 NE2 HIS A 108 13.047 3.337 9.562 1.00 0.00 N ATOM 0 H HIS A 108 12.524 2.469 4.998 1.00 0.00 H new ATOM 0 HA HIS A 108 11.896 0.275 6.754 1.00 0.00 H new ATOM 0 HB2 HIS A 108 10.547 2.931 6.144 1.00 0.00 H new ATOM 0 HB3 HIS A 108 9.990 1.816 7.376 1.00 0.00 H new ATOM 0 HD2 HIS A 108 11.599 1.695 9.701 1.00 0.00 H new ATOM 0 HE1 HIS A 108 14.125 4.926 8.617 1.00 0.00 H new ATOM 0 HE2 HIS A 108 13.442 3.356 10.502 1.00 0.00 H new ATOM 1671 N LEU A 109 10.093 0.833 4.065 1.00 0.00 N ATOM 1672 CA LEU A 109 9.068 0.264 3.197 1.00 0.00 C ATOM 1673 C LEU A 109 9.449 -1.145 2.756 1.00 0.00 C ATOM 1674 O LEU A 109 8.660 -2.081 2.884 1.00 0.00 O ATOM 1675 CB LEU A 109 8.858 1.156 1.972 1.00 0.00 C ATOM 1676 CG LEU A 109 8.153 2.488 2.225 1.00 0.00 C ATOM 1677 CD1 LEU A 109 8.241 3.380 0.996 1.00 0.00 C ATOM 1678 CD2 LEU A 109 6.700 2.258 2.615 1.00 0.00 C ATOM 0 H LEU A 109 10.557 1.658 3.685 1.00 0.00 H new ATOM 0 HA LEU A 109 8.137 0.208 3.762 1.00 0.00 H new ATOM 0 HB2 LEU A 109 9.831 1.362 1.526 1.00 0.00 H new ATOM 0 HB3 LEU A 109 8.282 0.597 1.235 1.00 0.00 H new ATOM 0 HG LEU A 109 8.655 2.991 3.052 1.00 0.00 H new ATOM 0 HD11 LEU A 109 7.734 4.324 1.195 1.00 0.00 H new ATOM 0 HD12 LEU A 109 9.288 3.573 0.761 1.00 0.00 H new ATOM 0 HD13 LEU A 109 7.765 2.883 0.151 1.00 0.00 H new ATOM 0 HD21 LEU A 109 6.214 3.218 2.791 1.00 0.00 H new ATOM 0 HD22 LEU A 109 6.186 1.733 1.810 1.00 0.00 H new ATOM 0 HD23 LEU A 109 6.658 1.658 3.524 1.00 0.00 H new ATOM 1690 N SER A 110 10.665 -1.289 2.237 1.00 0.00 N ATOM 1691 CA SER A 110 11.150 -2.584 1.775 1.00 0.00 C ATOM 1692 C SER A 110 11.069 -3.624 2.888 1.00 0.00 C ATOM 1693 O SER A 110 10.815 -4.802 2.637 1.00 0.00 O ATOM 1694 CB SER A 110 12.592 -2.464 1.278 1.00 0.00 C ATOM 1695 OG SER A 110 13.425 -1.884 2.266 1.00 0.00 O ATOM 0 H SER A 110 11.332 -0.525 2.126 1.00 0.00 H new ATOM 0 HA SER A 110 10.515 -2.909 0.951 1.00 0.00 H new ATOM 0 HB2 SER A 110 12.971 -3.450 1.011 1.00 0.00 H new ATOM 0 HB3 SER A 110 12.619 -1.857 0.373 1.00 0.00 H new ATOM 0 HG SER A 110 13.546 -0.931 2.073 1.00 0.00 H new ATOM 1701 N LYS A 111 11.286 -3.179 4.121 1.00 0.00 N ATOM 1702 CA LYS A 111 11.236 -4.068 5.276 1.00 0.00 C ATOM 1703 C LYS A 111 9.804 -4.506 5.565 1.00 0.00 C ATOM 1704 O LYS A 111 9.575 -5.495 6.260 1.00 0.00 O ATOM 1705 CB LYS A 111 11.826 -3.374 6.506 1.00 0.00 C ATOM 1706 CG LYS A 111 13.332 -3.184 6.433 1.00 0.00 C ATOM 1707 CD LYS A 111 13.807 -2.118 7.406 1.00 0.00 C ATOM 1708 CE LYS A 111 13.893 -2.657 8.826 1.00 0.00 C ATOM 1709 NZ LYS A 111 14.034 -1.563 9.827 1.00 0.00 N ATOM 0 H LYS A 111 11.498 -2.207 4.346 1.00 0.00 H new ATOM 0 HA LYS A 111 11.829 -4.954 5.046 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.351 -2.401 6.627 1.00 0.00 H new ATOM 0 HB3 LYS A 111 11.584 -3.959 7.394 1.00 0.00 H new ATOM 0 HG2 LYS A 111 13.830 -4.128 6.654 1.00 0.00 H new ATOM 0 HG3 LYS A 111 13.616 -2.904 5.418 1.00 0.00 H new ATOM 0 HD2 LYS A 111 14.785 -1.750 7.095 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.124 -1.269 7.379 1.00 0.00 H new ATOM 0 HE2 LYS A 111 12.999 -3.239 9.048 1.00 0.00 H new ATOM 0 HE3 LYS A 111 14.743 -3.335 8.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.089 -1.971 10.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.901 -1.022 9.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 13.211 -0.930 9.768 1.00 0.00 H new ATOM 1723 N PHE A 112 8.843 -3.763 5.025 1.00 0.00 N ATOM 1724 CA PHE A 112 7.433 -4.076 5.224 1.00 0.00 C ATOM 1725 C PHE A 112 6.895 -4.921 4.073 1.00 0.00 C ATOM 1726 O PHE A 112 6.017 -5.763 4.265 1.00 0.00 O ATOM 1727 CB PHE A 112 6.616 -2.788 5.351 1.00 0.00 C ATOM 1728 CG PHE A 112 5.132 -3.011 5.290 1.00 0.00 C ATOM 1729 CD1 PHE A 112 4.428 -3.389 6.422 1.00 0.00 C ATOM 1730 CD2 PHE A 112 4.441 -2.842 4.101 1.00 0.00 C ATOM 1731 CE1 PHE A 112 3.062 -3.595 6.369 1.00 0.00 C ATOM 1732 CE2 PHE A 112 3.075 -3.046 4.043 1.00 0.00 C ATOM 1733 CZ PHE A 112 2.385 -3.423 5.178 1.00 0.00 C ATOM 0 H PHE A 112 9.015 -2.941 4.447 1.00 0.00 H new ATOM 0 HA PHE A 112 7.341 -4.650 6.146 1.00 0.00 H new ATOM 0 HB2 PHE A 112 6.864 -2.302 6.294 1.00 0.00 H new ATOM 0 HB3 PHE A 112 6.906 -2.103 4.554 1.00 0.00 H new ATOM 0 HD1 PHE A 112 4.952 -3.524 7.356 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.975 -2.548 3.210 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.525 -3.890 7.258 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.548 -2.911 3.110 1.00 0.00 H new ATOM 0 HZ PHE A 112 1.318 -3.583 5.134 1.00 0.00 H new ATOM 1743 N ILE A 113 7.427 -4.690 2.878 1.00 0.00 N ATOM 1744 CA ILE A 113 7.002 -5.430 1.697 1.00 0.00 C ATOM 1745 C ILE A 113 7.420 -6.894 1.784 1.00 0.00 C ATOM 1746 O ILE A 113 6.578 -7.792 1.780 1.00 0.00 O ATOM 1747 CB ILE A 113 7.584 -4.818 0.409 1.00 0.00 C ATOM 1748 CG1 ILE A 113 6.992 -3.428 0.166 1.00 0.00 C ATOM 1749 CG2 ILE A 113 7.315 -5.729 -0.779 1.00 0.00 C ATOM 1750 CD1 ILE A 113 7.727 -2.634 -0.891 1.00 0.00 C ATOM 0 H ILE A 113 8.153 -3.996 2.702 1.00 0.00 H new ATOM 0 HA ILE A 113 5.914 -5.367 1.661 1.00 0.00 H new ATOM 0 HB ILE A 113 8.663 -4.717 0.528 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.948 -3.533 -0.131 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.003 -2.869 1.102 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.732 -5.283 -1.682 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.780 -6.700 -0.606 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.240 -5.858 -0.902 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.252 -1.660 -1.010 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.765 -2.497 -0.587 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.694 -3.172 -1.838 1.00 0.00 H new ATOM 1762 N ASP A 114 8.725 -7.126 1.866 1.00 0.00 N ATOM 1763 CA ASP A 114 9.256 -8.481 1.958 1.00 0.00 C ATOM 1764 C ASP A 114 8.544 -9.271 3.052 1.00 0.00 C ATOM 1765 O ASP A 114 7.963 -10.324 2.791 1.00 0.00 O ATOM 1766 CB ASP A 114 10.760 -8.445 2.235 1.00 0.00 C ATOM 1767 CG ASP A 114 11.343 -9.828 2.445 1.00 0.00 C ATOM 1768 OD1 ASP A 114 11.413 -10.597 1.464 1.00 0.00 O ATOM 1769 OD2 ASP A 114 11.730 -10.142 3.591 1.00 0.00 O ATOM 0 H ASP A 114 9.435 -6.394 1.871 1.00 0.00 H new ATOM 0 HA ASP A 114 9.082 -8.978 1.004 1.00 0.00 H new ATOM 0 HB2 ASP A 114 11.269 -7.962 1.401 1.00 0.00 H new ATOM 0 HB3 ASP A 114 10.949 -7.836 3.119 1.00 0.00 H new ATOM 1774 N GLU A 115 8.594 -8.754 4.276 1.00 0.00 N ATOM 1775 CA GLU A 115 7.954 -9.413 5.409 1.00 0.00 C ATOM 1776 C GLU A 115 6.655 -10.089 4.982 1.00 0.00 C ATOM 1777 O GLU A 115 6.505 -11.305 5.106 1.00 0.00 O ATOM 1778 CB GLU A 115 7.674 -8.402 6.523 1.00 0.00 C ATOM 1779 CG GLU A 115 8.903 -8.044 7.342 1.00 0.00 C ATOM 1780 CD GLU A 115 9.137 -9.003 8.492 1.00 0.00 C ATOM 1781 OE1 GLU A 115 9.800 -10.039 8.276 1.00 0.00 O ATOM 1782 OE2 GLU A 115 8.658 -8.717 9.610 1.00 0.00 O ATOM 0 H GLU A 115 9.070 -7.882 4.508 1.00 0.00 H new ATOM 0 HA GLU A 115 8.634 -10.177 5.784 1.00 0.00 H new ATOM 0 HB2 GLU A 115 7.264 -7.493 6.083 1.00 0.00 H new ATOM 0 HB3 GLU A 115 6.911 -8.808 7.187 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.779 -8.040 6.693 1.00 0.00 H new ATOM 0 HG3 GLU A 115 8.792 -7.033 7.734 1.00 0.00 H new ATOM 1789 N HIS A 116 5.717 -9.293 4.480 1.00 0.00 N ATOM 1790 CA HIS A 116 4.429 -9.813 4.035 1.00 0.00 C ATOM 1791 C HIS A 116 4.572 -10.556 2.709 1.00 0.00 C ATOM 1792 O HIS A 116 3.765 -11.425 2.384 1.00 0.00 O ATOM 1793 CB HIS A 116 3.418 -8.676 3.889 1.00 0.00 C ATOM 1794 CG HIS A 116 2.712 -8.335 5.165 1.00 0.00 C ATOM 1795 ND1 HIS A 116 1.834 -9.195 5.792 1.00 0.00 N ATOM 1796 CD2 HIS A 116 2.759 -7.222 5.933 1.00 0.00 C ATOM 1797 CE1 HIS A 116 1.371 -8.624 6.890 1.00 0.00 C ATOM 1798 NE2 HIS A 116 1.917 -7.426 6.998 1.00 0.00 N ATOM 0 H HIS A 116 5.825 -8.285 4.371 1.00 0.00 H new ATOM 0 HA HIS A 116 4.069 -10.514 4.788 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.932 -7.789 3.520 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.679 -8.952 3.137 1.00 0.00 H new ATOM 0 HD2 HIS A 116 3.349 -6.338 5.743 1.00 0.00 H new ATOM 0 HE1 HIS A 116 0.666 -9.062 7.581 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.741 -6.760 7.751 1.00 0.00 H new ATOM 1807 N ALA A 117 5.604 -10.205 1.949 1.00 0.00 N ATOM 1808 CA ALA A 117 5.853 -10.839 0.660 1.00 0.00 C ATOM 1809 C ALA A 117 5.973 -12.352 0.806 1.00 0.00 C ATOM 1810 O ALA A 117 5.770 -12.900 1.890 1.00 0.00 O ATOM 1811 CB ALA A 117 7.112 -10.266 0.025 1.00 0.00 C ATOM 0 H ALA A 117 6.281 -9.486 2.203 1.00 0.00 H new ATOM 0 HA ALA A 117 5.004 -10.630 0.010 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.286 -10.748 -0.937 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.989 -9.193 -0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.964 -10.446 0.680 1.00 0.00 H new ATOM 1817 N THR A 118 6.305 -13.024 -0.292 1.00 0.00 N ATOM 1818 CA THR A 118 6.450 -14.474 -0.287 1.00 0.00 C ATOM 1819 C THR A 118 7.891 -14.881 -0.001 1.00 0.00 C ATOM 1820 O THR A 118 8.371 -15.898 -0.503 1.00 0.00 O ATOM 1821 CB THR A 118 6.011 -15.087 -1.630 1.00 0.00 C ATOM 1822 OG1 THR A 118 4.674 -14.682 -1.941 1.00 0.00 O ATOM 1823 CG2 THR A 118 6.088 -16.606 -1.582 1.00 0.00 C ATOM 0 H THR A 118 6.479 -12.586 -1.197 1.00 0.00 H new ATOM 0 HA THR A 118 5.804 -14.854 0.505 1.00 0.00 H new ATOM 0 HB THR A 118 6.688 -14.728 -2.406 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.404 -15.075 -2.797 1.00 0.00 H new ATOM 0 HG21 THR A 118 5.773 -17.017 -2.541 1.00 0.00 H new ATOM 0 HG22 THR A 118 7.114 -16.912 -1.375 1.00 0.00 H new ATOM 0 HG23 THR A 118 5.432 -16.979 -0.795 1.00 0.00 H new ATOM 1831 N LYS A 119 8.577 -14.081 0.808 1.00 0.00 N ATOM 1832 CA LYS A 119 9.964 -14.359 1.162 1.00 0.00 C ATOM 1833 C LYS A 119 10.731 -14.914 -0.034 1.00 0.00 C ATOM 1834 O LYS A 119 11.706 -15.648 0.129 1.00 0.00 O ATOM 1835 CB LYS A 119 10.026 -15.351 2.326 1.00 0.00 C ATOM 1836 CG LYS A 119 11.378 -15.396 3.016 1.00 0.00 C ATOM 1837 CD LYS A 119 11.242 -15.752 4.487 1.00 0.00 C ATOM 1838 CE LYS A 119 11.013 -17.243 4.680 1.00 0.00 C ATOM 1839 NZ LYS A 119 12.277 -18.020 4.553 1.00 0.00 N ATOM 0 H LYS A 119 8.195 -13.235 1.231 1.00 0.00 H new ATOM 0 HA LYS A 119 10.430 -13.421 1.466 1.00 0.00 H new ATOM 0 HB2 LYS A 119 9.263 -15.087 3.058 1.00 0.00 H new ATOM 0 HB3 LYS A 119 9.783 -16.347 1.957 1.00 0.00 H new ATOM 0 HG2 LYS A 119 12.016 -16.128 2.521 1.00 0.00 H new ATOM 0 HG3 LYS A 119 11.869 -14.428 2.919 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.143 -15.449 5.021 1.00 0.00 H new ATOM 0 HD3 LYS A 119 10.412 -15.196 4.922 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.576 -17.419 5.663 1.00 0.00 H new ATOM 0 HE3 LYS A 119 10.293 -17.598 3.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 12.078 -19.031 4.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 12.681 -17.873 3.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.956 -17.699 5.273 1.00 0.00 H new ATOM 1853 N ARG A 120 10.285 -14.557 -1.234 1.00 0.00 N ATOM 1854 CA ARG A 120 10.930 -15.020 -2.457 1.00 0.00 C ATOM 1855 C ARG A 120 12.356 -14.486 -2.555 1.00 0.00 C ATOM 1856 O ARG A 120 13.252 -15.167 -3.055 1.00 0.00 O ATOM 1857 CB ARG A 120 10.125 -14.581 -3.681 1.00 0.00 C ATOM 1858 CG ARG A 120 9.801 -13.096 -3.696 1.00 0.00 C ATOM 1859 CD ARG A 120 8.445 -12.828 -4.332 1.00 0.00 C ATOM 1860 NE ARG A 120 7.821 -11.619 -3.801 1.00 0.00 N ATOM 1861 CZ ARG A 120 6.519 -11.370 -3.876 1.00 0.00 C ATOM 1862 NH1 ARG A 120 5.707 -12.243 -4.457 1.00 0.00 N ATOM 1863 NH2 ARG A 120 6.026 -10.247 -3.369 1.00 0.00 N ATOM 0 H ARG A 120 9.480 -13.949 -1.385 1.00 0.00 H new ATOM 0 HA ARG A 120 10.969 -16.109 -2.428 1.00 0.00 H new ATOM 0 HB2 ARG A 120 10.685 -14.831 -4.582 1.00 0.00 H new ATOM 0 HB3 ARG A 120 9.195 -15.148 -3.716 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.809 -12.710 -2.676 1.00 0.00 H new ATOM 0 HG3 ARG A 120 10.574 -12.559 -4.245 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.564 -12.731 -5.411 1.00 0.00 H new ATOM 0 HD3 ARG A 120 7.789 -13.681 -4.159 1.00 0.00 H new ATOM 0 HE ARG A 120 8.418 -10.928 -3.347 1.00 0.00 H new ATOM 0 HH11 ARG A 120 6.082 -13.107 -4.847 1.00 0.00 H new ATOM 0 HH12 ARG A 120 4.707 -12.050 -4.514 1.00 0.00 H new ATOM 0 HH21 ARG A 120 6.648 -9.574 -2.921 1.00 0.00 H new ATOM 0 HH22 ARG A 120 5.026 -10.057 -3.427 1.00 0.00 H new ATOM 1877 N SER A 121 12.560 -13.264 -2.074 1.00 0.00 N ATOM 1878 CA SER A 121 13.875 -12.636 -2.111 1.00 0.00 C ATOM 1879 C SER A 121 14.793 -13.235 -1.050 1.00 0.00 C ATOM 1880 O SER A 121 14.721 -12.873 0.125 1.00 0.00 O ATOM 1881 CB SER A 121 13.750 -11.126 -1.900 1.00 0.00 C ATOM 1882 OG SER A 121 13.163 -10.834 -0.644 1.00 0.00 O ATOM 0 H SER A 121 11.830 -12.689 -1.654 1.00 0.00 H new ATOM 0 HA SER A 121 14.311 -12.823 -3.092 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.736 -10.664 -1.961 1.00 0.00 H new ATOM 0 HB3 SER A 121 13.146 -10.693 -2.697 1.00 0.00 H new ATOM 0 HG SER A 121 13.490 -11.471 0.026 1.00 0.00 H new ATOM 1888 N ARG A 122 15.655 -14.154 -1.472 1.00 0.00 N ATOM 1889 CA ARG A 122 16.586 -14.805 -0.558 1.00 0.00 C ATOM 1890 C ARG A 122 17.572 -13.796 0.023 1.00 0.00 C ATOM 1891 O ARG A 122 18.473 -13.321 -0.669 1.00 0.00 O ATOM 1892 CB ARG A 122 17.347 -15.920 -1.280 1.00 0.00 C ATOM 1893 CG ARG A 122 18.067 -16.873 -0.340 1.00 0.00 C ATOM 1894 CD ARG A 122 17.095 -17.818 0.348 1.00 0.00 C ATOM 1895 NE ARG A 122 17.786 -18.855 1.110 1.00 0.00 N ATOM 1896 CZ ARG A 122 18.420 -18.625 2.255 1.00 0.00 C ATOM 1897 NH1 ARG A 122 18.449 -17.403 2.767 1.00 0.00 N ATOM 1898 NH2 ARG A 122 19.025 -19.621 2.890 1.00 0.00 N ATOM 0 H ARG A 122 15.728 -14.465 -2.441 1.00 0.00 H new ATOM 0 HA ARG A 122 16.010 -15.238 0.260 1.00 0.00 H new ATOM 0 HB2 ARG A 122 16.647 -16.488 -1.893 1.00 0.00 H new ATOM 0 HB3 ARG A 122 18.074 -15.472 -1.957 1.00 0.00 H new ATOM 0 HG2 ARG A 122 18.803 -17.450 -0.899 1.00 0.00 H new ATOM 0 HG3 ARG A 122 18.613 -16.302 0.410 1.00 0.00 H new ATOM 0 HD2 ARG A 122 16.447 -17.249 1.015 1.00 0.00 H new ATOM 0 HD3 ARG A 122 16.453 -18.284 -0.399 1.00 0.00 H new ATOM 0 HE ARG A 122 17.782 -19.807 0.744 1.00 0.00 H new ATOM 0 HH11 ARG A 122 17.984 -16.636 2.282 1.00 0.00 H new ATOM 0 HH12 ARG A 122 18.936 -17.230 3.646 1.00 0.00 H new ATOM 0 HH21 ARG A 122 19.003 -20.563 2.499 1.00 0.00 H new ATOM 0 HH22 ARG A 122 19.512 -19.445 3.769 1.00 0.00 H new ATOM 1912 N THR A 123 17.396 -13.473 1.301 1.00 0.00 N ATOM 1913 CA THR A 123 18.268 -12.519 1.975 1.00 0.00 C ATOM 1914 C THR A 123 18.300 -12.772 3.478 1.00 0.00 C ATOM 1915 O THR A 123 17.268 -13.036 4.096 1.00 0.00 O ATOM 1916 CB THR A 123 17.819 -11.068 1.719 1.00 0.00 C ATOM 1917 OG1 THR A 123 16.435 -10.917 2.055 1.00 0.00 O ATOM 1918 CG2 THR A 123 18.038 -10.683 0.264 1.00 0.00 C ATOM 0 H THR A 123 16.657 -13.858 1.890 1.00 0.00 H new ATOM 0 HA THR A 123 19.268 -12.659 1.564 1.00 0.00 H new ATOM 0 HB THR A 123 18.419 -10.409 2.347 1.00 0.00 H new ATOM 0 HG1 THR A 123 15.887 -11.425 1.421 1.00 0.00 H new ATOM 0 HG21 THR A 123 17.714 -9.654 0.107 1.00 0.00 H new ATOM 0 HG22 THR A 123 19.097 -10.771 0.020 1.00 0.00 H new ATOM 0 HG23 THR A 123 17.461 -11.347 -0.379 1.00 0.00 H new ATOM 1926 N LYS A 124 19.490 -12.688 4.062 1.00 0.00 N ATOM 1927 CA LYS A 124 19.658 -12.905 5.494 1.00 0.00 C ATOM 1928 C LYS A 124 19.261 -11.661 6.283 1.00 0.00 C ATOM 1929 O LYS A 124 20.093 -11.047 6.949 1.00 0.00 O ATOM 1930 CB LYS A 124 21.108 -13.280 5.808 1.00 0.00 C ATOM 1931 CG LYS A 124 21.389 -14.768 5.696 1.00 0.00 C ATOM 1932 CD LYS A 124 21.302 -15.246 4.257 1.00 0.00 C ATOM 1933 CE LYS A 124 22.579 -14.941 3.490 1.00 0.00 C ATOM 1934 NZ LYS A 124 22.356 -14.942 2.017 1.00 0.00 N ATOM 0 H LYS A 124 20.354 -12.471 3.565 1.00 0.00 H new ATOM 0 HA LYS A 124 19.005 -13.726 5.791 1.00 0.00 H new ATOM 0 HB2 LYS A 124 21.769 -12.742 5.129 1.00 0.00 H new ATOM 0 HB3 LYS A 124 21.350 -12.948 6.818 1.00 0.00 H new ATOM 0 HG2 LYS A 124 22.382 -14.982 6.092 1.00 0.00 H new ATOM 0 HG3 LYS A 124 20.676 -15.321 6.307 1.00 0.00 H new ATOM 0 HD2 LYS A 124 21.114 -16.319 4.240 1.00 0.00 H new ATOM 0 HD3 LYS A 124 20.457 -14.766 3.764 1.00 0.00 H new ATOM 0 HE2 LYS A 124 22.964 -13.969 3.798 1.00 0.00 H new ATOM 0 HE3 LYS A 124 23.339 -15.680 3.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 23.250 -14.730 1.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 22.013 -15.877 1.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 21.649 -14.219 1.772 1.00 0.00 H new ATOM 1948 N GLU A 125 17.984 -11.298 6.203 1.00 0.00 N ATOM 1949 CA GLU A 125 17.479 -10.128 6.911 1.00 0.00 C ATOM 1950 C GLU A 125 16.473 -10.534 7.985 1.00 0.00 C ATOM 1951 O GLU A 125 15.264 -10.509 7.758 1.00 0.00 O ATOM 1952 CB GLU A 125 16.827 -9.152 5.929 1.00 0.00 C ATOM 1953 CG GLU A 125 16.700 -7.738 6.469 1.00 0.00 C ATOM 1954 CD GLU A 125 15.394 -7.509 7.205 1.00 0.00 C ATOM 1955 OE1 GLU A 125 15.211 -8.105 8.287 1.00 0.00 O ATOM 1956 OE2 GLU A 125 14.556 -6.733 6.699 1.00 0.00 O ATOM 0 H GLU A 125 17.282 -11.797 5.656 1.00 0.00 H new ATOM 0 HA GLU A 125 18.323 -9.636 7.395 1.00 0.00 H new ATOM 0 HB2 GLU A 125 17.412 -9.129 5.010 1.00 0.00 H new ATOM 0 HB3 GLU A 125 15.836 -9.522 5.667 1.00 0.00 H new ATOM 0 HG2 GLU A 125 17.533 -7.534 7.142 1.00 0.00 H new ATOM 0 HG3 GLU A 125 16.777 -7.030 5.644 1.00 0.00 H new ATOM 1963 N GLU A 126 16.983 -10.907 9.154 1.00 0.00 N ATOM 1964 CA GLU A 126 16.130 -11.320 10.262 1.00 0.00 C ATOM 1965 C GLU A 126 16.449 -10.520 11.522 1.00 0.00 C ATOM 1966 O GLU A 126 17.572 -10.555 12.026 1.00 0.00 O ATOM 1967 CB GLU A 126 16.301 -12.815 10.538 1.00 0.00 C ATOM 1968 CG GLU A 126 15.298 -13.370 11.535 1.00 0.00 C ATOM 1969 CD GLU A 126 13.876 -12.940 11.231 1.00 0.00 C ATOM 1970 OE1 GLU A 126 13.439 -13.108 10.073 1.00 0.00 O ATOM 1971 OE2 GLU A 126 13.199 -12.436 12.152 1.00 0.00 O ATOM 0 H GLU A 126 17.982 -10.932 9.358 1.00 0.00 H new ATOM 0 HA GLU A 126 15.095 -11.126 9.981 1.00 0.00 H new ATOM 0 HB2 GLU A 126 16.208 -13.362 9.600 1.00 0.00 H new ATOM 0 HB3 GLU A 126 17.309 -12.994 10.912 1.00 0.00 H new ATOM 0 HG2 GLU A 126 15.353 -14.459 11.533 1.00 0.00 H new ATOM 0 HG3 GLU A 126 15.567 -13.039 12.538 1.00 0.00 H new ATOM 1978 N LEU A 127 15.453 -9.799 12.026 1.00 0.00 N ATOM 1979 CA LEU A 127 15.626 -8.989 13.226 1.00 0.00 C ATOM 1980 C LEU A 127 14.468 -9.198 14.196 1.00 0.00 C ATOM 1981 O LEU A 127 13.341 -8.779 13.932 1.00 0.00 O ATOM 1982 CB LEU A 127 15.734 -7.509 12.855 1.00 0.00 C ATOM 1983 CG LEU A 127 17.101 -7.040 12.356 1.00 0.00 C ATOM 1984 CD1 LEU A 127 17.034 -5.592 11.897 1.00 0.00 C ATOM 1985 CD2 LEU A 127 18.153 -7.209 13.443 1.00 0.00 C ATOM 0 H LEU A 127 14.517 -9.759 11.622 1.00 0.00 H new ATOM 0 HA LEU A 127 16.548 -9.303 13.716 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.995 -7.294 12.084 1.00 0.00 H new ATOM 0 HB3 LEU A 127 15.465 -6.915 13.729 1.00 0.00 H new ATOM 0 HG LEU A 127 17.386 -7.657 11.504 1.00 0.00 H new ATOM 0 HD11 LEU A 127 18.016 -5.276 11.545 1.00 0.00 H new ATOM 0 HD12 LEU A 127 16.311 -5.500 11.086 1.00 0.00 H new ATOM 0 HD13 LEU A 127 16.726 -4.960 12.730 1.00 0.00 H new ATOM 0 HD21 LEU A 127 19.119 -6.870 13.070 1.00 0.00 H new ATOM 0 HD22 LEU A 127 17.873 -6.618 14.315 1.00 0.00 H new ATOM 0 HD23 LEU A 127 18.221 -8.260 13.724 1.00 0.00 H new ATOM 1997 N SER A 128 14.754 -9.848 15.320 1.00 0.00 N ATOM 1998 CA SER A 128 13.735 -10.114 16.329 1.00 0.00 C ATOM 1999 C SER A 128 13.768 -9.055 17.427 1.00 0.00 C ATOM 2000 O SER A 128 12.785 -8.351 17.654 1.00 0.00 O ATOM 2001 CB SER A 128 13.942 -11.502 16.939 1.00 0.00 C ATOM 2002 OG SER A 128 13.367 -12.508 16.123 1.00 0.00 O ATOM 0 H SER A 128 15.682 -10.200 15.555 1.00 0.00 H new ATOM 0 HA SER A 128 12.760 -10.079 15.843 1.00 0.00 H new ATOM 0 HB2 SER A 128 15.008 -11.694 17.061 1.00 0.00 H new ATOM 0 HB3 SER A 128 13.496 -11.536 17.933 1.00 0.00 H new ATOM 0 HG SER A 128 13.514 -13.386 16.533 1.00 0.00 H new ATOM 2008 N GLY A 129 14.906 -8.948 18.105 1.00 0.00 N ATOM 2009 CA GLY A 129 15.047 -7.973 19.170 1.00 0.00 C ATOM 2010 C GLY A 129 15.345 -8.616 20.510 1.00 0.00 C ATOM 2011 O GLY A 129 15.740 -9.780 20.589 1.00 0.00 O ATOM 0 H GLY A 129 15.734 -9.520 17.936 1.00 0.00 H new ATOM 0 HA2 GLY A 129 15.848 -7.278 18.918 1.00 0.00 H new ATOM 0 HA3 GLY A 129 14.130 -7.389 19.247 1.00 0.00 H new ATOM 2015 N PRO A 130 15.158 -7.850 21.594 1.00 0.00 N ATOM 2016 CA PRO A 130 15.406 -8.331 22.956 1.00 0.00 C ATOM 2017 C PRO A 130 14.384 -9.374 23.397 1.00 0.00 C ATOM 2018 O PRO A 130 13.192 -9.244 23.121 1.00 0.00 O ATOM 2019 CB PRO A 130 15.279 -7.066 23.808 1.00 0.00 C ATOM 2020 CG PRO A 130 14.393 -6.165 23.019 1.00 0.00 C ATOM 2021 CD PRO A 130 14.690 -6.454 21.574 1.00 0.00 C ATOM 0 HA PRO A 130 16.374 -8.825 23.044 1.00 0.00 H new ATOM 0 HB2 PRO A 130 14.849 -7.288 24.785 1.00 0.00 H new ATOM 0 HB3 PRO A 130 16.252 -6.608 23.985 1.00 0.00 H new ATOM 0 HG2 PRO A 130 13.344 -6.352 23.247 1.00 0.00 H new ATOM 0 HG3 PRO A 130 14.589 -5.119 23.256 1.00 0.00 H new ATOM 0 HD2 PRO A 130 13.804 -6.336 20.950 1.00 0.00 H new ATOM 0 HD3 PRO A 130 15.450 -5.781 21.178 1.00 0.00 H new ATOM 2029 N SER A 131 14.860 -10.408 24.083 1.00 0.00 N ATOM 2030 CA SER A 131 13.988 -11.476 24.559 1.00 0.00 C ATOM 2031 C SER A 131 13.043 -10.963 25.642 1.00 0.00 C ATOM 2032 O SER A 131 13.481 -10.437 26.665 1.00 0.00 O ATOM 2033 CB SER A 131 14.820 -12.639 25.102 1.00 0.00 C ATOM 2034 OG SER A 131 15.764 -12.188 26.058 1.00 0.00 O ATOM 0 H SER A 131 15.844 -10.529 24.322 1.00 0.00 H new ATOM 0 HA SER A 131 13.392 -11.827 23.717 1.00 0.00 H new ATOM 0 HB2 SER A 131 14.162 -13.379 25.557 1.00 0.00 H new ATOM 0 HB3 SER A 131 15.338 -13.134 24.281 1.00 0.00 H new ATOM 0 HG SER A 131 15.382 -11.445 26.570 1.00 0.00 H new ATOM 2040 N SER A 132 11.744 -11.120 25.408 1.00 0.00 N ATOM 2041 CA SER A 132 10.736 -10.671 26.360 1.00 0.00 C ATOM 2042 C SER A 132 10.260 -11.827 27.235 1.00 0.00 C ATOM 2043 O SER A 132 9.234 -12.447 26.959 1.00 0.00 O ATOM 2044 CB SER A 132 9.547 -10.052 25.622 1.00 0.00 C ATOM 2045 OG SER A 132 9.803 -8.699 25.286 1.00 0.00 O ATOM 0 H SER A 132 11.365 -11.555 24.567 1.00 0.00 H new ATOM 0 HA SER A 132 11.190 -9.916 27.002 1.00 0.00 H new ATOM 0 HB2 SER A 132 9.341 -10.622 24.716 1.00 0.00 H new ATOM 0 HB3 SER A 132 8.656 -10.112 26.247 1.00 0.00 H new ATOM 0 HG SER A 132 9.029 -8.327 24.814 1.00 0.00 H new ATOM 2051 N GLY A 133 11.015 -12.111 28.292 1.00 0.00 N ATOM 2052 CA GLY A 133 10.656 -13.191 29.191 1.00 0.00 C ATOM 2053 C GLY A 133 9.202 -13.133 29.616 1.00 0.00 C ATOM 2054 O GLY A 133 8.881 -12.615 30.685 1.00 0.00 O ATOM 0 H GLY A 133 11.869 -11.612 28.541 1.00 0.00 H new ATOM 0 HA2 GLY A 133 10.851 -14.146 28.703 1.00 0.00 H new ATOM 0 HA3 GLY A 133 11.292 -13.150 30.075 1.00 0.00 H new TER 2058 GLY A 133