USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 890 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: B 18 GLN : amide:sc= -7.15! C(o=-6.7!,f=-8.3!) USER MOD Set 1.2: B 61 TYR OH : rot 177:sc= 0.501 USER MOD Set 2.1: A 18 GLN : amide:sc= -7.18! C(o=-6.7!,f=-8.4!) USER MOD Set 2.2: A 61 TYR OH : rot 173:sc= 0.457 USER MOD Single : A 6 THR OG1 : rot 60:sc= 1.12 USER MOD Single : A 8 THR OG1 : rot 147:sc= -0.213! USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= -0.367 USER MOD Single : A 15 THR OG1 : rot 160:sc= 0.0236 USER MOD Single : A 16 SER OG : rot 180:sc= 0.0924 USER MOD Single : A 21 GLN : amide:sc= -4.16! C(o=-4.2!,f=-2.3!) USER MOD Single : A 22 ASN : amide:sc= -0.075 K(o=-0.075,f=-1.6!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -136:sc= -1.61! USER MOD Single : A 31 SER OG : rot 63:sc= 1.2 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.716 X(o=-0.72,f=-0.58) USER MOD Single : A 35 SER OG : rot 28:sc= 0.878 USER MOD Single : A 36 LYS NZ :NH3+ -179:sc= 1.23 (180deg=1.2) USER MOD Single : A 43 THR OG1 : rot 150:sc= 0.0751 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -12.9! C(o=-13!,f=-18!) USER MOD Single : A 54 SER OG : rot 31:sc= 0.404 USER MOD Single : A 59 GLN : amide:sc= -0.71 K(o=-0.71,f=-2.4) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot 53:sc= 1.12 USER MOD Single : B 8 THR OG1 : rot 158:sc= 0.358 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 TYR OH : rot 180:sc= -0.375 USER MOD Single : B 15 THR OG1 : rot 160:sc= 0.0226 USER MOD Single : B 16 SER OG : rot 180:sc= 0.0771 USER MOD Single : B 21 GLN : amide:sc= -4.34! C(o=-4.3!,f=-2.4!) USER MOD Single : B 22 ASN : amide:sc= -0.0819 K(o=-0.082,f=-1.5!) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -123:sc= -1.59! USER MOD Single : B 31 SER OG : rot 40:sc= 1.22 USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 GLN : amide:sc= -0.819 X(o=-0.82,f=-0.66) USER MOD Single : B 35 SER OG : rot 36:sc= 0.987 USER MOD Single : B 36 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.25) USER MOD Single : B 43 THR OG1 : rot 150:sc= 0.0675 USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -11.7! C(o=-12!,f=-17!) USER MOD Single : B 54 SER OG : rot 29:sc= 0.402 USER MOD Single : B 59 GLN : amide:sc= -0.793 K(o=-0.79,f=-2.4) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 53 N ASP A 5 53.651 -6.345 -7.447 1.00 0.00 N ATOM 54 CA ASP A 5 52.525 -6.777 -6.571 1.00 0.00 C ATOM 55 C ASP A 5 52.479 -5.879 -5.332 1.00 0.00 C ATOM 56 O ASP A 5 52.799 -6.295 -4.236 1.00 0.00 O ATOM 57 CB ASP A 5 52.741 -8.232 -6.143 1.00 0.00 C ATOM 58 CG ASP A 5 53.253 -9.045 -7.335 1.00 0.00 C ATOM 59 OD1 ASP A 5 52.437 -9.436 -8.153 1.00 0.00 O ATOM 60 OD2 ASP A 5 54.451 -9.262 -7.407 1.00 0.00 O ATOM 0 HA ASP A 5 51.584 -6.697 -7.115 1.00 0.00 H new ATOM 0 HB2 ASP A 5 53.458 -8.278 -5.323 1.00 0.00 H new ATOM 0 HB3 ASP A 5 51.807 -8.656 -5.774 1.00 0.00 H new ATOM 65 N THR A 6 52.089 -4.645 -5.501 1.00 0.00 N ATOM 66 CA THR A 6 52.027 -3.712 -4.341 1.00 0.00 C ATOM 67 C THR A 6 51.899 -2.275 -4.867 1.00 0.00 C ATOM 68 O THR A 6 52.445 -1.947 -5.902 1.00 0.00 O ATOM 69 CB THR A 6 53.308 -3.881 -3.497 1.00 0.00 C ATOM 70 OG1 THR A 6 53.018 -4.708 -2.379 1.00 0.00 O ATOM 71 CG2 THR A 6 53.832 -2.527 -2.996 1.00 0.00 C ATOM 0 H THR A 6 51.810 -4.242 -6.395 1.00 0.00 H new ATOM 0 HA THR A 6 51.164 -3.931 -3.712 1.00 0.00 H new ATOM 0 HB THR A 6 54.076 -4.334 -4.124 1.00 0.00 H new ATOM 0 HG1 THR A 6 52.703 -5.582 -2.691 1.00 0.00 H new ATOM 0 HG21 THR A 6 54.735 -2.682 -2.405 1.00 0.00 H new ATOM 0 HG22 THR A 6 54.062 -1.888 -3.848 1.00 0.00 H new ATOM 0 HG23 THR A 6 53.072 -2.049 -2.378 1.00 0.00 H new ATOM 79 N PRO A 7 51.180 -1.462 -4.135 1.00 0.00 N ATOM 80 CA PRO A 7 50.965 -0.053 -4.498 1.00 0.00 C ATOM 81 C PRO A 7 52.219 0.766 -4.179 1.00 0.00 C ATOM 82 O PRO A 7 53.180 0.256 -3.639 1.00 0.00 O ATOM 83 CB PRO A 7 49.785 0.371 -3.617 1.00 0.00 C ATOM 84 CG PRO A 7 49.762 -0.609 -2.422 1.00 0.00 C ATOM 85 CD PRO A 7 50.523 -1.870 -2.874 1.00 0.00 C ATOM 0 HA PRO A 7 50.764 0.098 -5.559 1.00 0.00 H new ATOM 0 HB2 PRO A 7 49.905 1.399 -3.275 1.00 0.00 H new ATOM 0 HB3 PRO A 7 48.849 0.328 -4.174 1.00 0.00 H new ATOM 0 HG2 PRO A 7 50.235 -0.164 -1.546 1.00 0.00 H new ATOM 0 HG3 PRO A 7 48.738 -0.854 -2.141 1.00 0.00 H new ATOM 0 HD2 PRO A 7 51.253 -2.184 -2.128 1.00 0.00 H new ATOM 0 HD3 PRO A 7 49.846 -2.710 -3.031 1.00 0.00 H new ATOM 93 N THR A 8 52.223 2.028 -4.509 1.00 0.00 N ATOM 94 CA THR A 8 53.423 2.862 -4.220 1.00 0.00 C ATOM 95 C THR A 8 53.552 3.058 -2.708 1.00 0.00 C ATOM 96 O THR A 8 52.663 3.572 -2.059 1.00 0.00 O ATOM 97 CB THR A 8 53.279 4.219 -4.911 1.00 0.00 C ATOM 98 OG1 THR A 8 53.473 4.054 -6.309 1.00 0.00 O ATOM 99 CG2 THR A 8 54.324 5.190 -4.364 1.00 0.00 C ATOM 0 H THR A 8 51.451 2.516 -4.964 1.00 0.00 H new ATOM 0 HA THR A 8 54.316 2.363 -4.595 1.00 0.00 H new ATOM 0 HB THR A 8 52.283 4.619 -4.722 1.00 0.00 H new ATOM 0 HG1 THR A 8 52.915 4.696 -6.795 1.00 0.00 H new ATOM 0 HG21 THR A 8 54.218 6.155 -4.859 1.00 0.00 H new ATOM 0 HG22 THR A 8 54.179 5.314 -3.291 1.00 0.00 H new ATOM 0 HG23 THR A 8 55.322 4.794 -4.551 1.00 0.00 H new ATOM 107 N ALA A 9 54.651 2.637 -2.142 1.00 0.00 N ATOM 108 CA ALA A 9 54.842 2.779 -0.670 1.00 0.00 C ATOM 109 C ALA A 9 54.711 4.247 -0.258 1.00 0.00 C ATOM 110 O ALA A 9 55.286 5.128 -0.864 1.00 0.00 O ATOM 111 CB ALA A 9 56.233 2.267 -0.287 1.00 0.00 C ATOM 0 H ALA A 9 55.427 2.199 -2.638 1.00 0.00 H new ATOM 0 HA ALA A 9 54.078 2.197 -0.156 1.00 0.00 H new ATOM 0 HB1 ALA A 9 56.375 2.370 0.789 1.00 0.00 H new ATOM 0 HB2 ALA A 9 56.324 1.217 -0.566 1.00 0.00 H new ATOM 0 HB3 ALA A 9 56.992 2.849 -0.810 1.00 0.00 H new ATOM 117 N CYS A 10 53.963 4.512 0.781 1.00 0.00 N ATOM 118 CA CYS A 10 53.798 5.918 1.251 1.00 0.00 C ATOM 119 C CYS A 10 53.075 5.916 2.603 1.00 0.00 C ATOM 120 O CYS A 10 51.945 6.350 2.710 1.00 0.00 O ATOM 121 CB CYS A 10 52.977 6.713 0.228 1.00 0.00 C ATOM 122 SG CYS A 10 52.906 8.452 0.732 1.00 0.00 S ATOM 0 H CYS A 10 53.458 3.813 1.325 1.00 0.00 H new ATOM 0 HA CYS A 10 54.778 6.383 1.361 1.00 0.00 H new ATOM 0 HB2 CYS A 10 53.427 6.628 -0.761 1.00 0.00 H new ATOM 0 HB3 CYS A 10 51.970 6.303 0.156 1.00 0.00 H new ATOM 127 N CYS A 11 53.713 5.428 3.637 1.00 0.00 N ATOM 128 CA CYS A 11 53.048 5.404 4.971 1.00 0.00 C ATOM 129 C CYS A 11 52.960 6.834 5.513 1.00 0.00 C ATOM 130 O CYS A 11 53.863 7.629 5.343 1.00 0.00 O ATOM 131 CB CYS A 11 53.839 4.491 5.933 1.00 0.00 C ATOM 132 SG CYS A 11 55.110 5.418 6.840 1.00 0.00 S ATOM 0 H CYS A 11 54.659 5.048 3.614 1.00 0.00 H new ATOM 0 HA CYS A 11 52.039 5.002 4.879 1.00 0.00 H new ATOM 0 HB2 CYS A 11 53.153 4.026 6.641 1.00 0.00 H new ATOM 0 HB3 CYS A 11 54.309 3.686 5.368 1.00 0.00 H new ATOM 137 N PHE A 12 51.880 7.170 6.159 1.00 0.00 N ATOM 138 CA PHE A 12 51.742 8.549 6.699 1.00 0.00 C ATOM 139 C PHE A 12 51.784 8.511 8.226 1.00 0.00 C ATOM 140 O PHE A 12 51.492 9.488 8.887 1.00 0.00 O ATOM 141 CB PHE A 12 50.411 9.147 6.235 1.00 0.00 C ATOM 142 CG PHE A 12 50.542 9.623 4.807 1.00 0.00 C ATOM 143 CD1 PHE A 12 50.380 8.720 3.750 1.00 0.00 C ATOM 144 CD2 PHE A 12 50.826 10.969 4.539 1.00 0.00 C ATOM 145 CE1 PHE A 12 50.502 9.160 2.426 1.00 0.00 C ATOM 146 CE2 PHE A 12 50.948 11.409 3.215 1.00 0.00 C ATOM 147 CZ PHE A 12 50.786 10.504 2.159 1.00 0.00 C ATOM 0 H PHE A 12 51.089 6.551 6.336 1.00 0.00 H new ATOM 0 HA PHE A 12 52.564 9.165 6.333 1.00 0.00 H new ATOM 0 HB2 PHE A 12 49.620 8.401 6.310 1.00 0.00 H new ATOM 0 HB3 PHE A 12 50.128 9.978 6.882 1.00 0.00 H new ATOM 0 HD1 PHE A 12 50.161 7.683 3.956 1.00 0.00 H new ATOM 0 HD2 PHE A 12 50.951 11.667 5.354 1.00 0.00 H new ATOM 0 HE1 PHE A 12 50.377 8.462 1.611 1.00 0.00 H new ATOM 0 HE2 PHE A 12 51.167 12.446 3.009 1.00 0.00 H new ATOM 0 HZ PHE A 12 50.880 10.843 1.138 1.00 0.00 H new ATOM 157 N SER A 13 52.144 7.393 8.799 1.00 0.00 N ATOM 158 CA SER A 13 52.199 7.315 10.285 1.00 0.00 C ATOM 159 C SER A 13 53.192 6.233 10.716 1.00 0.00 C ATOM 160 O SER A 13 53.088 5.087 10.323 1.00 0.00 O ATOM 161 CB SER A 13 50.809 6.977 10.824 1.00 0.00 C ATOM 162 OG SER A 13 49.980 6.553 9.749 1.00 0.00 O ATOM 0 H SER A 13 52.400 6.538 8.306 1.00 0.00 H new ATOM 0 HA SER A 13 52.525 8.275 10.684 1.00 0.00 H new ATOM 0 HB2 SER A 13 50.879 6.192 11.576 1.00 0.00 H new ATOM 0 HB3 SER A 13 50.374 7.849 11.313 1.00 0.00 H new ATOM 0 HG SER A 13 49.088 6.334 10.091 1.00 0.00 H new ATOM 168 N TYR A 14 54.151 6.587 11.530 1.00 0.00 N ATOM 169 CA TYR A 14 55.145 5.579 11.995 1.00 0.00 C ATOM 170 C TYR A 14 54.730 5.076 13.381 1.00 0.00 C ATOM 171 O TYR A 14 53.829 5.608 13.998 1.00 0.00 O ATOM 172 CB TYR A 14 56.536 6.219 12.066 1.00 0.00 C ATOM 173 CG TYR A 14 56.674 7.234 10.955 1.00 0.00 C ATOM 174 CD1 TYR A 14 56.499 6.842 9.622 1.00 0.00 C ATOM 175 CD2 TYR A 14 56.977 8.568 11.259 1.00 0.00 C ATOM 176 CE1 TYR A 14 56.625 7.784 8.592 1.00 0.00 C ATOM 177 CE2 TYR A 14 57.104 9.509 10.230 1.00 0.00 C ATOM 178 CZ TYR A 14 56.928 9.117 8.897 1.00 0.00 C ATOM 179 OH TYR A 14 57.052 10.046 7.883 1.00 0.00 O ATOM 0 H TYR A 14 54.288 7.531 11.892 1.00 0.00 H new ATOM 0 HA TYR A 14 55.178 4.743 11.297 1.00 0.00 H new ATOM 0 HB2 TYR A 14 56.679 6.700 13.034 1.00 0.00 H new ATOM 0 HB3 TYR A 14 57.307 5.454 11.973 1.00 0.00 H new ATOM 0 HD1 TYR A 14 56.267 5.814 9.388 1.00 0.00 H new ATOM 0 HD2 TYR A 14 57.113 8.870 12.287 1.00 0.00 H new ATOM 0 HE1 TYR A 14 56.489 7.482 7.564 1.00 0.00 H new ATOM 0 HE2 TYR A 14 57.338 10.537 10.464 1.00 0.00 H new ATOM 0 HH TYR A 14 57.263 10.923 8.267 1.00 0.00 H new ATOM 189 N THR A 15 55.370 4.048 13.871 1.00 0.00 N ATOM 190 CA THR A 15 54.994 3.513 15.212 1.00 0.00 C ATOM 191 C THR A 15 55.977 4.015 16.270 1.00 0.00 C ATOM 192 O THR A 15 57.097 4.380 15.970 1.00 0.00 O ATOM 193 CB THR A 15 55.030 1.983 15.180 1.00 0.00 C ATOM 194 OG1 THR A 15 56.146 1.552 14.414 1.00 0.00 O ATOM 195 CG2 THR A 15 53.742 1.452 14.551 1.00 0.00 C ATOM 0 H THR A 15 56.133 3.558 13.404 1.00 0.00 H new ATOM 0 HA THR A 15 53.989 3.855 15.461 1.00 0.00 H new ATOM 0 HB THR A 15 55.118 1.601 16.197 1.00 0.00 H new ATOM 0 HG1 THR A 15 56.363 0.625 14.646 1.00 0.00 H new ATOM 0 HG21 THR A 15 53.770 0.363 14.529 1.00 0.00 H new ATOM 0 HG22 THR A 15 52.886 1.781 15.141 1.00 0.00 H new ATOM 0 HG23 THR A 15 53.650 1.833 13.534 1.00 0.00 H new ATOM 203 N SER A 16 55.569 4.027 17.509 1.00 0.00 N ATOM 204 CA SER A 16 56.481 4.492 18.590 1.00 0.00 C ATOM 205 C SER A 16 57.287 3.301 19.112 1.00 0.00 C ATOM 206 O SER A 16 58.154 3.446 19.952 1.00 0.00 O ATOM 207 CB SER A 16 55.660 5.091 19.733 1.00 0.00 C ATOM 208 OG SER A 16 54.342 4.558 19.693 1.00 0.00 O ATOM 0 H SER A 16 54.642 3.734 17.819 1.00 0.00 H new ATOM 0 HA SER A 16 57.157 5.251 18.196 1.00 0.00 H new ATOM 0 HB2 SER A 16 56.128 4.863 20.691 1.00 0.00 H new ATOM 0 HB3 SER A 16 55.629 6.177 19.644 1.00 0.00 H new ATOM 0 HG SER A 16 53.813 4.938 20.425 1.00 0.00 H new ATOM 214 N ARG A 17 57.008 2.124 18.621 1.00 0.00 N ATOM 215 CA ARG A 17 57.757 0.927 19.089 1.00 0.00 C ATOM 216 C ARG A 17 58.734 0.475 18.002 1.00 0.00 C ATOM 217 O ARG A 17 58.667 0.907 16.868 1.00 0.00 O ATOM 218 CB ARG A 17 56.773 -0.204 19.396 1.00 0.00 C ATOM 219 CG ARG A 17 55.716 0.295 20.383 1.00 0.00 C ATOM 220 CD ARG A 17 56.382 0.628 21.718 1.00 0.00 C ATOM 221 NE ARG A 17 56.080 -0.445 22.707 1.00 0.00 N ATOM 222 CZ ARG A 17 56.429 -0.299 23.955 1.00 0.00 C ATOM 223 NH1 ARG A 17 57.572 0.257 24.251 1.00 0.00 N ATOM 224 NH2 ARG A 17 55.635 -0.707 24.907 1.00 0.00 N ATOM 0 H ARG A 17 56.294 1.941 17.916 1.00 0.00 H new ATOM 0 HA ARG A 17 58.313 1.179 19.992 1.00 0.00 H new ATOM 0 HB2 ARG A 17 56.296 -0.545 18.477 1.00 0.00 H new ATOM 0 HB3 ARG A 17 57.304 -1.058 19.816 1.00 0.00 H new ATOM 0 HG2 ARG A 17 55.218 1.178 19.983 1.00 0.00 H new ATOM 0 HG3 ARG A 17 54.949 -0.466 20.527 1.00 0.00 H new ATOM 0 HD2 ARG A 17 57.460 0.722 21.585 1.00 0.00 H new ATOM 0 HD3 ARG A 17 56.022 1.588 22.086 1.00 0.00 H new ATOM 0 HE ARG A 17 55.600 -1.294 22.408 1.00 0.00 H new ATOM 0 HH11 ARG A 17 58.191 0.577 23.506 1.00 0.00 H new ATOM 0 HH12 ARG A 17 57.846 0.372 25.227 1.00 0.00 H new ATOM 0 HH21 ARG A 17 54.741 -1.140 24.675 1.00 0.00 H new ATOM 0 HH22 ARG A 17 55.908 -0.593 25.883 1.00 0.00 H new ATOM 238 N GLN A 18 59.644 -0.388 18.348 1.00 0.00 N ATOM 239 CA GLN A 18 60.642 -0.877 17.355 1.00 0.00 C ATOM 240 C GLN A 18 60.243 -2.249 16.834 1.00 0.00 C ATOM 241 O GLN A 18 59.178 -2.770 17.107 1.00 0.00 O ATOM 242 CB GLN A 18 61.990 -1.032 18.043 1.00 0.00 C ATOM 243 CG GLN A 18 63.133 -0.716 17.094 1.00 0.00 C ATOM 244 CD GLN A 18 63.975 -1.982 16.890 1.00 0.00 C ATOM 245 OE1 GLN A 18 64.459 -2.236 15.807 1.00 0.00 O ATOM 246 NE2 GLN A 18 64.155 -2.806 17.888 1.00 0.00 N ATOM 0 H GLN A 18 59.742 -0.780 19.284 1.00 0.00 H new ATOM 0 HA GLN A 18 60.691 -0.162 16.534 1.00 0.00 H new ATOM 0 HB2 GLN A 18 62.038 -0.369 18.907 1.00 0.00 H new ATOM 0 HB3 GLN A 18 62.095 -2.051 18.416 1.00 0.00 H new ATOM 0 HG2 GLN A 18 62.743 -0.365 16.139 1.00 0.00 H new ATOM 0 HG3 GLN A 18 63.750 0.085 17.501 1.00 0.00 H new ATOM 0 HE21 GLN A 18 63.750 -2.598 18.801 1.00 0.00 H new ATOM 0 HE22 GLN A 18 64.700 -3.658 17.754 1.00 0.00 H new ATOM 255 N ILE A 19 61.139 -2.831 16.112 1.00 0.00 N ATOM 256 CA ILE A 19 60.960 -4.172 15.549 1.00 0.00 C ATOM 257 C ILE A 19 62.360 -4.608 15.121 1.00 0.00 C ATOM 258 O ILE A 19 62.927 -4.056 14.199 1.00 0.00 O ATOM 259 CB ILE A 19 60.020 -4.143 14.353 1.00 0.00 C ATOM 260 CG1 ILE A 19 59.785 -2.703 13.887 1.00 0.00 C ATOM 261 CG2 ILE A 19 58.686 -4.761 14.761 1.00 0.00 C ATOM 262 CD1 ILE A 19 59.199 -2.715 12.476 1.00 0.00 C ATOM 0 H ILE A 19 62.035 -2.403 15.880 1.00 0.00 H new ATOM 0 HA ILE A 19 60.515 -4.858 16.270 1.00 0.00 H new ATOM 0 HB ILE A 19 60.468 -4.707 13.535 1.00 0.00 H new ATOM 0 HG12 ILE A 19 59.105 -2.194 14.571 1.00 0.00 H new ATOM 0 HG13 ILE A 19 60.723 -2.148 13.898 1.00 0.00 H new ATOM 0 HG21 ILE A 19 58.003 -4.746 13.912 1.00 0.00 H new ATOM 0 HG22 ILE A 19 58.845 -5.791 15.081 1.00 0.00 H new ATOM 0 HG23 ILE A 19 58.256 -4.188 15.583 1.00 0.00 H new ATOM 0 HD11 ILE A 19 59.031 -1.691 12.143 1.00 0.00 H new ATOM 0 HD12 ILE A 19 59.895 -3.208 11.797 1.00 0.00 H new ATOM 0 HD13 ILE A 19 58.252 -3.255 12.480 1.00 0.00 H new ATOM 274 N PRO A 20 62.896 -5.546 15.836 1.00 0.00 N ATOM 275 CA PRO A 20 64.261 -6.038 15.596 1.00 0.00 C ATOM 276 C PRO A 20 64.364 -6.765 14.258 1.00 0.00 C ATOM 277 O PRO A 20 63.385 -7.217 13.706 1.00 0.00 O ATOM 278 CB PRO A 20 64.520 -6.958 16.794 1.00 0.00 C ATOM 279 CG PRO A 20 63.130 -7.340 17.351 1.00 0.00 C ATOM 280 CD PRO A 20 62.181 -6.228 16.928 1.00 0.00 C ATOM 0 HA PRO A 20 65.002 -5.242 15.523 1.00 0.00 H new ATOM 0 HB2 PRO A 20 65.075 -7.845 16.491 1.00 0.00 H new ATOM 0 HB3 PRO A 20 65.118 -6.452 17.552 1.00 0.00 H new ATOM 0 HG2 PRO A 20 62.803 -8.302 16.955 1.00 0.00 H new ATOM 0 HG3 PRO A 20 63.159 -7.435 18.436 1.00 0.00 H new ATOM 0 HD2 PRO A 20 61.224 -6.627 16.591 1.00 0.00 H new ATOM 0 HD3 PRO A 20 61.970 -5.548 17.753 1.00 0.00 H new ATOM 288 N GLN A 21 65.551 -6.852 13.724 1.00 0.00 N ATOM 289 CA GLN A 21 65.732 -7.523 12.411 1.00 0.00 C ATOM 290 C GLN A 21 65.135 -8.930 12.470 1.00 0.00 C ATOM 291 O GLN A 21 64.729 -9.483 11.467 1.00 0.00 O ATOM 292 CB GLN A 21 67.224 -7.574 12.073 1.00 0.00 C ATOM 293 CG GLN A 21 67.668 -6.174 11.635 1.00 0.00 C ATOM 294 CD GLN A 21 67.732 -6.116 10.109 1.00 0.00 C ATOM 295 OE1 GLN A 21 68.795 -6.206 9.529 1.00 0.00 O ATOM 296 NE2 GLN A 21 66.627 -5.968 9.431 1.00 0.00 N ATOM 0 H GLN A 21 66.405 -6.485 14.144 1.00 0.00 H new ATOM 0 HA GLN A 21 65.217 -6.964 11.630 1.00 0.00 H new ATOM 0 HB2 GLN A 21 67.798 -7.900 12.940 1.00 0.00 H new ATOM 0 HB3 GLN A 21 67.408 -8.297 11.278 1.00 0.00 H new ATOM 0 HG2 GLN A 21 66.970 -5.425 12.009 1.00 0.00 H new ATOM 0 HG3 GLN A 21 68.644 -5.940 12.060 1.00 0.00 H new ATOM 0 HE21 GLN A 21 65.735 -5.893 9.920 1.00 0.00 H new ATOM 0 HE22 GLN A 21 66.655 -5.928 8.412 1.00 0.00 H new ATOM 305 N ASN A 22 65.047 -9.506 13.639 1.00 0.00 N ATOM 306 CA ASN A 22 64.439 -10.861 13.748 1.00 0.00 C ATOM 307 C ASN A 22 62.924 -10.708 13.626 1.00 0.00 C ATOM 308 O ASN A 22 62.249 -11.516 13.019 1.00 0.00 O ATOM 309 CB ASN A 22 64.788 -11.485 15.101 1.00 0.00 C ATOM 310 CG ASN A 22 64.864 -13.006 14.953 1.00 0.00 C ATOM 311 OD1 ASN A 22 64.377 -13.558 13.987 1.00 0.00 O ATOM 312 ND2 ASN A 22 65.459 -13.712 15.875 1.00 0.00 N ATOM 0 H ASN A 22 65.368 -9.099 14.517 1.00 0.00 H new ATOM 0 HA ASN A 22 64.822 -11.510 12.960 1.00 0.00 H new ATOM 0 HB2 ASN A 22 65.741 -11.095 15.459 1.00 0.00 H new ATOM 0 HB3 ASN A 22 64.035 -11.218 15.843 1.00 0.00 H new ATOM 0 HD21 ASN A 22 65.515 -14.726 15.784 1.00 0.00 H new ATOM 0 HD22 ASN A 22 65.868 -13.249 16.687 1.00 0.00 H new ATOM 319 N PHE A 23 62.393 -9.652 14.184 1.00 0.00 N ATOM 320 CA PHE A 23 60.928 -9.403 14.094 1.00 0.00 C ATOM 321 C PHE A 23 60.654 -8.555 12.850 1.00 0.00 C ATOM 322 O PHE A 23 59.533 -8.175 12.577 1.00 0.00 O ATOM 323 CB PHE A 23 60.470 -8.633 15.333 1.00 0.00 C ATOM 324 CG PHE A 23 59.210 -9.245 15.887 1.00 0.00 C ATOM 325 CD1 PHE A 23 58.018 -9.179 15.160 1.00 0.00 C ATOM 326 CD2 PHE A 23 59.235 -9.872 17.137 1.00 0.00 C ATOM 327 CE1 PHE A 23 56.848 -9.743 15.683 1.00 0.00 C ATOM 328 CE2 PHE A 23 58.069 -10.434 17.661 1.00 0.00 C ATOM 329 CZ PHE A 23 56.874 -10.371 16.935 1.00 0.00 C ATOM 0 H PHE A 23 62.918 -8.947 14.702 1.00 0.00 H new ATOM 0 HA PHE A 23 60.391 -10.349 14.032 1.00 0.00 H new ATOM 0 HB2 PHE A 23 61.254 -8.648 16.090 1.00 0.00 H new ATOM 0 HB3 PHE A 23 60.294 -7.588 15.077 1.00 0.00 H new ATOM 0 HD1 PHE A 23 57.999 -8.693 14.196 1.00 0.00 H new ATOM 0 HD2 PHE A 23 60.157 -9.922 17.697 1.00 0.00 H new ATOM 0 HE1 PHE A 23 55.927 -9.694 15.122 1.00 0.00 H new ATOM 0 HE2 PHE A 23 58.089 -10.917 18.627 1.00 0.00 H new ATOM 0 HZ PHE A 23 55.972 -10.806 17.340 1.00 0.00 H new ATOM 339 N ILE A 24 61.679 -8.251 12.099 1.00 0.00 N ATOM 340 CA ILE A 24 61.498 -7.424 10.879 1.00 0.00 C ATOM 341 C ILE A 24 62.004 -8.213 9.670 1.00 0.00 C ATOM 342 O ILE A 24 62.627 -9.248 9.805 1.00 0.00 O ATOM 343 CB ILE A 24 62.293 -6.110 11.049 1.00 0.00 C ATOM 344 CG1 ILE A 24 61.324 -4.931 11.089 1.00 0.00 C ATOM 345 CG2 ILE A 24 63.290 -5.893 9.900 1.00 0.00 C ATOM 346 CD1 ILE A 24 62.023 -3.747 11.746 1.00 0.00 C ATOM 0 H ILE A 24 62.639 -8.544 12.283 1.00 0.00 H new ATOM 0 HA ILE A 24 60.446 -7.182 10.725 1.00 0.00 H new ATOM 0 HB ILE A 24 62.854 -6.181 11.981 1.00 0.00 H new ATOM 0 HG12 ILE A 24 61.005 -4.669 10.080 1.00 0.00 H new ATOM 0 HG13 ILE A 24 60.427 -5.198 11.648 1.00 0.00 H new ATOM 0 HG21 ILE A 24 63.829 -4.959 10.057 1.00 0.00 H new ATOM 0 HG22 ILE A 24 63.999 -6.720 9.872 1.00 0.00 H new ATOM 0 HG23 ILE A 24 62.750 -5.846 8.954 1.00 0.00 H new ATOM 0 HD11 ILE A 24 61.342 -2.897 11.782 1.00 0.00 H new ATOM 0 HD12 ILE A 24 62.320 -4.017 12.759 1.00 0.00 H new ATOM 0 HD13 ILE A 24 62.907 -3.480 11.168 1.00 0.00 H new ATOM 358 N ALA A 25 61.750 -7.725 8.492 1.00 0.00 N ATOM 359 CA ALA A 25 62.228 -8.439 7.280 1.00 0.00 C ATOM 360 C ALA A 25 62.348 -7.455 6.117 1.00 0.00 C ATOM 361 O ALA A 25 63.317 -7.465 5.383 1.00 0.00 O ATOM 362 CB ALA A 25 61.234 -9.542 6.911 1.00 0.00 C ATOM 0 H ALA A 25 61.233 -6.864 8.316 1.00 0.00 H new ATOM 0 HA ALA A 25 63.204 -8.880 7.484 1.00 0.00 H new ATOM 0 HB1 ALA A 25 61.585 -10.066 6.022 1.00 0.00 H new ATOM 0 HB2 ALA A 25 61.150 -10.247 7.738 1.00 0.00 H new ATOM 0 HB3 ALA A 25 60.258 -9.100 6.710 1.00 0.00 H new ATOM 368 N ALA A 26 61.371 -6.610 5.931 1.00 0.00 N ATOM 369 CA ALA A 26 61.440 -5.639 4.799 1.00 0.00 C ATOM 370 C ALA A 26 61.797 -4.249 5.302 1.00 0.00 C ATOM 371 O ALA A 26 62.000 -4.028 6.475 1.00 0.00 O ATOM 372 CB ALA A 26 60.082 -5.556 4.117 1.00 0.00 C ATOM 0 H ALA A 26 60.533 -6.549 6.509 1.00 0.00 H new ATOM 0 HA ALA A 26 62.204 -5.985 4.103 1.00 0.00 H new ATOM 0 HB1 ALA A 26 60.133 -4.847 3.291 1.00 0.00 H new ATOM 0 HB2 ALA A 26 59.806 -6.539 3.735 1.00 0.00 H new ATOM 0 HB3 ALA A 26 59.334 -5.222 4.836 1.00 0.00 H new ATOM 378 N TYR A 27 61.831 -3.301 4.410 1.00 0.00 N ATOM 379 CA TYR A 27 62.119 -1.908 4.825 1.00 0.00 C ATOM 380 C TYR A 27 61.550 -0.916 3.784 1.00 0.00 C ATOM 381 O TYR A 27 60.665 -0.146 4.084 1.00 0.00 O ATOM 382 CB TYR A 27 63.623 -1.705 5.009 1.00 0.00 C ATOM 383 CG TYR A 27 64.351 -2.123 3.759 1.00 0.00 C ATOM 384 CD1 TYR A 27 64.324 -3.460 3.348 1.00 0.00 C ATOM 385 CD2 TYR A 27 65.039 -1.170 3.002 1.00 0.00 C ATOM 386 CE1 TYR A 27 64.989 -3.844 2.176 1.00 0.00 C ATOM 387 CE2 TYR A 27 65.702 -1.552 1.832 1.00 0.00 C ATOM 388 CZ TYR A 27 65.678 -2.889 1.417 1.00 0.00 C ATOM 389 OH TYR A 27 66.329 -3.264 0.260 1.00 0.00 O ATOM 0 H TYR A 27 61.671 -3.434 3.411 1.00 0.00 H new ATOM 0 HA TYR A 27 61.634 -1.717 5.783 1.00 0.00 H new ATOM 0 HB2 TYR A 27 63.834 -0.659 5.231 1.00 0.00 H new ATOM 0 HB3 TYR A 27 63.977 -2.288 5.859 1.00 0.00 H new ATOM 0 HD1 TYR A 27 63.791 -4.195 3.933 1.00 0.00 H new ATOM 0 HD2 TYR A 27 65.058 -0.138 3.321 1.00 0.00 H new ATOM 0 HE1 TYR A 27 64.970 -4.876 1.858 1.00 0.00 H new ATOM 0 HE2 TYR A 27 66.233 -0.815 1.248 1.00 0.00 H new ATOM 0 HH TYR A 27 66.755 -2.480 -0.145 1.00 0.00 H new ATOM 399 N PHE A 28 62.031 -0.941 2.563 1.00 0.00 N ATOM 400 CA PHE A 28 61.505 -0.015 1.503 1.00 0.00 C ATOM 401 C PHE A 28 61.510 1.436 1.977 1.00 0.00 C ATOM 402 O PHE A 28 60.821 1.805 2.906 1.00 0.00 O ATOM 403 CB PHE A 28 60.074 -0.407 1.129 1.00 0.00 C ATOM 404 CG PHE A 28 60.089 -1.813 0.604 1.00 0.00 C ATOM 405 CD1 PHE A 28 60.409 -2.847 1.472 1.00 0.00 C ATOM 406 CD2 PHE A 28 59.808 -2.082 -0.739 1.00 0.00 C ATOM 407 CE1 PHE A 28 60.453 -4.161 1.014 1.00 0.00 C ATOM 408 CE2 PHE A 28 59.852 -3.401 -1.208 1.00 0.00 C ATOM 409 CZ PHE A 28 60.177 -4.443 -0.329 1.00 0.00 C ATOM 0 H PHE A 28 62.772 -1.568 2.251 1.00 0.00 H new ATOM 0 HA PHE A 28 62.159 -0.103 0.636 1.00 0.00 H new ATOM 0 HB2 PHE A 28 59.421 -0.334 1.999 1.00 0.00 H new ATOM 0 HB3 PHE A 28 59.679 0.275 0.376 1.00 0.00 H new ATOM 0 HD1 PHE A 28 60.625 -2.632 2.508 1.00 0.00 H new ATOM 0 HD2 PHE A 28 59.558 -1.276 -1.412 1.00 0.00 H new ATOM 0 HE1 PHE A 28 60.700 -4.962 1.695 1.00 0.00 H new ATOM 0 HE2 PHE A 28 59.636 -3.615 -2.244 1.00 0.00 H new ATOM 0 HZ PHE A 28 60.214 -5.461 -0.687 1.00 0.00 H new ATOM 419 N GLU A 29 62.252 2.277 1.313 1.00 0.00 N ATOM 420 CA GLU A 29 62.261 3.714 1.705 1.00 0.00 C ATOM 421 C GLU A 29 61.149 4.413 0.935 1.00 0.00 C ATOM 422 O GLU A 29 61.377 5.342 0.187 1.00 0.00 O ATOM 423 CB GLU A 29 63.612 4.377 1.389 1.00 0.00 C ATOM 424 CG GLU A 29 64.554 3.385 0.707 1.00 0.00 C ATOM 425 CD GLU A 29 65.980 3.940 0.716 1.00 0.00 C ATOM 426 OE1 GLU A 29 66.209 4.920 1.407 1.00 0.00 O ATOM 427 OE2 GLU A 29 66.818 3.375 0.035 1.00 0.00 O ATOM 0 H GLU A 29 62.848 2.035 0.522 1.00 0.00 H new ATOM 0 HA GLU A 29 62.104 3.796 2.781 1.00 0.00 H new ATOM 0 HB2 GLU A 29 63.456 5.241 0.743 1.00 0.00 H new ATOM 0 HB3 GLU A 29 64.067 4.744 2.309 1.00 0.00 H new ATOM 0 HG2 GLU A 29 64.523 2.426 1.223 1.00 0.00 H new ATOM 0 HG3 GLU A 29 64.229 3.206 -0.318 1.00 0.00 H new ATOM 434 N THR A 30 59.944 3.951 1.115 1.00 0.00 N ATOM 435 CA THR A 30 58.787 4.556 0.406 1.00 0.00 C ATOM 436 C THR A 30 59.036 4.530 -1.103 1.00 0.00 C ATOM 437 O THR A 30 59.457 3.527 -1.644 1.00 0.00 O ATOM 438 CB THR A 30 58.587 5.985 0.901 1.00 0.00 C ATOM 439 OG1 THR A 30 59.616 6.822 0.392 1.00 0.00 O ATOM 440 CG2 THR A 30 58.625 5.982 2.428 1.00 0.00 C ATOM 0 H THR A 30 59.711 3.172 1.730 1.00 0.00 H new ATOM 0 HA THR A 30 57.882 3.984 0.612 1.00 0.00 H new ATOM 0 HB THR A 30 57.626 6.367 0.555 1.00 0.00 H new ATOM 0 HG1 THR A 30 59.949 7.403 1.108 1.00 0.00 H new ATOM 0 HG21 THR A 30 58.483 6.998 2.797 1.00 0.00 H new ATOM 0 HG22 THR A 30 57.830 5.342 2.810 1.00 0.00 H new ATOM 0 HG23 THR A 30 59.589 5.604 2.767 1.00 0.00 H new ATOM 448 N SER A 31 58.764 5.601 -1.801 1.00 0.00 N ATOM 449 CA SER A 31 58.978 5.570 -3.273 1.00 0.00 C ATOM 450 C SER A 31 58.778 6.960 -3.880 1.00 0.00 C ATOM 451 O SER A 31 58.469 7.913 -3.193 1.00 0.00 O ATOM 452 CB SER A 31 57.953 4.617 -3.875 1.00 0.00 C ATOM 453 OG SER A 31 58.555 3.347 -4.083 1.00 0.00 O ATOM 0 H SER A 31 58.410 6.479 -1.423 1.00 0.00 H new ATOM 0 HA SER A 31 59.996 5.243 -3.485 1.00 0.00 H new ATOM 0 HB2 SER A 31 57.095 4.521 -3.210 1.00 0.00 H new ATOM 0 HB3 SER A 31 57.581 5.015 -4.819 1.00 0.00 H new ATOM 0 HG SER A 31 58.826 2.968 -3.221 1.00 0.00 H new ATOM 459 N SER A 32 58.938 7.072 -5.172 1.00 0.00 N ATOM 460 CA SER A 32 58.741 8.388 -5.842 1.00 0.00 C ATOM 461 C SER A 32 57.268 8.775 -5.727 1.00 0.00 C ATOM 462 O SER A 32 56.574 8.305 -4.852 1.00 0.00 O ATOM 463 CB SER A 32 59.131 8.274 -7.317 1.00 0.00 C ATOM 464 OG SER A 32 59.892 9.415 -7.691 1.00 0.00 O ATOM 0 H SER A 32 59.197 6.306 -5.793 1.00 0.00 H new ATOM 0 HA SER A 32 59.363 9.147 -5.369 1.00 0.00 H new ATOM 0 HB2 SER A 32 59.710 7.366 -7.483 1.00 0.00 H new ATOM 0 HB3 SER A 32 58.237 8.199 -7.937 1.00 0.00 H new ATOM 0 HG SER A 32 60.145 9.344 -8.635 1.00 0.00 H new ATOM 470 N GLN A 33 56.783 9.621 -6.600 1.00 0.00 N ATOM 471 CA GLN A 33 55.347 10.029 -6.525 1.00 0.00 C ATOM 472 C GLN A 33 55.025 10.462 -5.094 1.00 0.00 C ATOM 473 O GLN A 33 55.153 11.619 -4.746 1.00 0.00 O ATOM 474 CB GLN A 33 54.457 8.847 -6.914 1.00 0.00 C ATOM 475 CG GLN A 33 54.370 8.750 -8.439 1.00 0.00 C ATOM 476 CD GLN A 33 53.904 10.090 -9.014 1.00 0.00 C ATOM 477 OE1 GLN A 33 54.450 10.571 -9.987 1.00 0.00 O ATOM 478 NE2 GLN A 33 52.906 10.716 -8.450 1.00 0.00 N ATOM 0 H GLN A 33 57.317 10.045 -7.359 1.00 0.00 H new ATOM 0 HA GLN A 33 55.164 10.857 -7.210 1.00 0.00 H new ATOM 0 HB2 GLN A 33 54.863 7.923 -6.503 1.00 0.00 H new ATOM 0 HB3 GLN A 33 53.461 8.974 -6.490 1.00 0.00 H new ATOM 0 HG2 GLN A 33 55.343 8.484 -8.852 1.00 0.00 H new ATOM 0 HG3 GLN A 33 53.676 7.960 -8.724 1.00 0.00 H new ATOM 0 HE21 GLN A 33 52.447 10.313 -7.633 1.00 0.00 H new ATOM 0 HE22 GLN A 33 52.585 11.608 -8.826 1.00 0.00 H new ATOM 487 N CYS A 34 54.623 9.539 -4.261 1.00 0.00 N ATOM 488 CA CYS A 34 54.316 9.882 -2.844 1.00 0.00 C ATOM 489 C CYS A 34 55.636 9.990 -2.071 1.00 0.00 C ATOM 490 O CYS A 34 55.981 9.125 -1.291 1.00 0.00 O ATOM 491 CB CYS A 34 53.457 8.771 -2.233 1.00 0.00 C ATOM 492 SG CYS A 34 52.389 9.459 -0.944 1.00 0.00 S ATOM 0 H CYS A 34 54.494 8.557 -4.504 1.00 0.00 H new ATOM 0 HA CYS A 34 53.776 10.827 -2.793 1.00 0.00 H new ATOM 0 HB2 CYS A 34 52.851 8.300 -3.007 1.00 0.00 H new ATOM 0 HB3 CYS A 34 54.096 7.995 -1.812 1.00 0.00 H new ATOM 497 N SER A 35 56.384 11.039 -2.294 1.00 0.00 N ATOM 498 CA SER A 35 57.685 11.193 -1.585 1.00 0.00 C ATOM 499 C SER A 35 57.482 10.995 -0.085 1.00 0.00 C ATOM 500 O SER A 35 56.862 11.801 0.579 1.00 0.00 O ATOM 501 CB SER A 35 58.242 12.594 -1.844 1.00 0.00 C ATOM 502 OG SER A 35 57.313 13.563 -1.376 1.00 0.00 O ATOM 0 H SER A 35 56.149 11.795 -2.937 1.00 0.00 H new ATOM 0 HA SER A 35 58.388 10.446 -1.954 1.00 0.00 H new ATOM 0 HB2 SER A 35 59.199 12.717 -1.337 1.00 0.00 H new ATOM 0 HB3 SER A 35 58.425 12.734 -2.909 1.00 0.00 H new ATOM 0 HG SER A 35 56.791 13.186 -0.637 1.00 0.00 H new ATOM 508 N LYS A 36 58.004 9.930 0.459 1.00 0.00 N ATOM 509 CA LYS A 36 57.841 9.696 1.919 1.00 0.00 C ATOM 510 C LYS A 36 59.203 9.357 2.541 1.00 0.00 C ATOM 511 O LYS A 36 59.998 8.661 1.941 1.00 0.00 O ATOM 512 CB LYS A 36 56.869 8.541 2.153 1.00 0.00 C ATOM 513 CG LYS A 36 55.444 9.086 2.272 1.00 0.00 C ATOM 514 CD LYS A 36 55.348 10.018 3.485 1.00 0.00 C ATOM 515 CE LYS A 36 53.880 10.347 3.760 1.00 0.00 C ATOM 516 NZ LYS A 36 53.800 11.474 4.734 1.00 0.00 N ATOM 0 H LYS A 36 58.533 9.216 -0.042 1.00 0.00 H new ATOM 0 HA LYS A 36 57.444 10.598 2.385 1.00 0.00 H new ATOM 0 HB2 LYS A 36 56.929 7.829 1.330 1.00 0.00 H new ATOM 0 HB3 LYS A 36 57.140 8.002 3.061 1.00 0.00 H new ATOM 0 HG2 LYS A 36 55.173 9.625 1.364 1.00 0.00 H new ATOM 0 HG3 LYS A 36 54.737 8.263 2.376 1.00 0.00 H new ATOM 0 HD2 LYS A 36 55.795 9.543 4.358 1.00 0.00 H new ATOM 0 HD3 LYS A 36 55.908 10.934 3.298 1.00 0.00 H new ATOM 0 HE2 LYS A 36 53.376 10.617 2.832 1.00 0.00 H new ATOM 0 HE3 LYS A 36 53.368 9.471 4.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 52.803 11.688 4.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 54.282 11.206 5.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 54.260 12.315 4.330 1.00 0.00 H new ATOM 530 N PRO A 37 59.432 9.873 3.724 1.00 0.00 N ATOM 531 CA PRO A 37 60.692 9.661 4.461 1.00 0.00 C ATOM 532 C PRO A 37 60.673 8.332 5.224 1.00 0.00 C ATOM 533 O PRO A 37 61.315 7.373 4.843 1.00 0.00 O ATOM 534 CB PRO A 37 60.716 10.824 5.456 1.00 0.00 C ATOM 535 CG PRO A 37 59.244 11.271 5.642 1.00 0.00 C ATOM 536 CD PRO A 37 58.459 10.724 4.434 1.00 0.00 C ATOM 0 HA PRO A 37 61.559 9.624 3.801 1.00 0.00 H new ATOM 0 HB2 PRO A 37 61.151 10.513 6.406 1.00 0.00 H new ATOM 0 HB3 PRO A 37 61.327 11.645 5.079 1.00 0.00 H new ATOM 0 HG2 PRO A 37 58.837 10.883 6.576 1.00 0.00 H new ATOM 0 HG3 PRO A 37 59.173 12.358 5.690 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.587 10.152 4.752 1.00 0.00 H new ATOM 0 HD3 PRO A 37 58.096 11.530 3.797 1.00 0.00 H new ATOM 544 N GLY A 38 59.953 8.289 6.314 1.00 0.00 N ATOM 545 CA GLY A 38 59.889 7.050 7.144 1.00 0.00 C ATOM 546 C GLY A 38 59.892 5.799 6.261 1.00 0.00 C ATOM 547 O GLY A 38 59.256 5.747 5.228 1.00 0.00 O ATOM 0 H GLY A 38 59.400 9.069 6.669 1.00 0.00 H new ATOM 0 HA2 GLY A 38 60.739 7.020 7.826 1.00 0.00 H new ATOM 0 HA3 GLY A 38 58.988 7.065 7.757 1.00 0.00 H new ATOM 551 N VAL A 39 60.601 4.784 6.680 1.00 0.00 N ATOM 552 CA VAL A 39 60.652 3.518 5.895 1.00 0.00 C ATOM 553 C VAL A 39 59.488 2.628 6.334 1.00 0.00 C ATOM 554 O VAL A 39 58.957 2.792 7.406 1.00 0.00 O ATOM 555 CB VAL A 39 61.997 2.804 6.182 1.00 0.00 C ATOM 556 CG1 VAL A 39 61.766 1.367 6.688 1.00 0.00 C ATOM 557 CG2 VAL A 39 62.836 2.747 4.904 1.00 0.00 C ATOM 0 H VAL A 39 61.151 4.779 7.539 1.00 0.00 H new ATOM 0 HA VAL A 39 60.574 3.724 4.828 1.00 0.00 H new ATOM 0 HB VAL A 39 62.520 3.371 6.953 1.00 0.00 H new ATOM 0 HG11 VAL A 39 62.727 0.890 6.881 1.00 0.00 H new ATOM 0 HG12 VAL A 39 61.183 1.395 7.609 1.00 0.00 H new ATOM 0 HG13 VAL A 39 61.224 0.798 5.933 1.00 0.00 H new ATOM 0 HG21 VAL A 39 63.781 2.244 5.111 1.00 0.00 H new ATOM 0 HG22 VAL A 39 62.292 2.196 4.136 1.00 0.00 H new ATOM 0 HG23 VAL A 39 63.034 3.760 4.553 1.00 0.00 H new ATOM 567 N ILE A 40 59.125 1.662 5.536 1.00 0.00 N ATOM 568 CA ILE A 40 58.034 0.727 5.936 1.00 0.00 C ATOM 569 C ILE A 40 58.697 -0.587 6.370 1.00 0.00 C ATOM 570 O ILE A 40 59.875 -0.776 6.165 1.00 0.00 O ATOM 571 CB ILE A 40 57.090 0.496 4.746 1.00 0.00 C ATOM 572 CG1 ILE A 40 56.029 1.600 4.731 1.00 0.00 C ATOM 573 CG2 ILE A 40 56.399 -0.866 4.872 1.00 0.00 C ATOM 574 CD1 ILE A 40 56.096 2.362 3.407 1.00 0.00 C ATOM 0 H ILE A 40 59.538 1.479 4.621 1.00 0.00 H new ATOM 0 HA ILE A 40 57.442 1.136 6.755 1.00 0.00 H new ATOM 0 HB ILE A 40 57.668 0.515 3.822 1.00 0.00 H new ATOM 0 HG12 ILE A 40 55.038 1.167 4.862 1.00 0.00 H new ATOM 0 HG13 ILE A 40 56.191 2.284 5.564 1.00 0.00 H new ATOM 0 HG21 ILE A 40 55.733 -1.016 4.022 1.00 0.00 H new ATOM 0 HG22 ILE A 40 57.151 -1.655 4.888 1.00 0.00 H new ATOM 0 HG23 ILE A 40 55.821 -0.897 5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 40 55.340 3.147 3.400 1.00 0.00 H new ATOM 0 HD12 ILE A 40 57.084 2.809 3.294 1.00 0.00 H new ATOM 0 HD13 ILE A 40 55.913 1.674 2.582 1.00 0.00 H new ATOM 586 N PHE A 41 57.981 -1.492 6.978 1.00 0.00 N ATOM 587 CA PHE A 41 58.635 -2.758 7.413 1.00 0.00 C ATOM 588 C PHE A 41 57.671 -3.933 7.252 1.00 0.00 C ATOM 589 O PHE A 41 56.466 -3.773 7.275 1.00 0.00 O ATOM 590 CB PHE A 41 59.014 -2.644 8.887 1.00 0.00 C ATOM 591 CG PHE A 41 60.386 -2.034 9.009 1.00 0.00 C ATOM 592 CD1 PHE A 41 61.517 -2.802 8.719 1.00 0.00 C ATOM 593 CD2 PHE A 41 60.528 -0.701 9.410 1.00 0.00 C ATOM 594 CE1 PHE A 41 62.794 -2.237 8.827 1.00 0.00 C ATOM 595 CE2 PHE A 41 61.803 -0.136 9.519 1.00 0.00 C ATOM 596 CZ PHE A 41 62.936 -0.905 9.227 1.00 0.00 C ATOM 0 H PHE A 41 56.986 -1.413 7.190 1.00 0.00 H new ATOM 0 HA PHE A 41 59.521 -2.926 6.800 1.00 0.00 H new ATOM 0 HB2 PHE A 41 58.284 -2.030 9.414 1.00 0.00 H new ATOM 0 HB3 PHE A 41 59.000 -3.629 9.354 1.00 0.00 H new ATOM 0 HD1 PHE A 41 61.406 -3.831 8.412 1.00 0.00 H new ATOM 0 HD2 PHE A 41 59.654 -0.109 9.635 1.00 0.00 H new ATOM 0 HE1 PHE A 41 63.668 -2.830 8.601 1.00 0.00 H new ATOM 0 HE2 PHE A 41 61.913 0.893 9.828 1.00 0.00 H new ATOM 0 HZ PHE A 41 63.920 -0.469 9.311 1.00 0.00 H new ATOM 606 N LEU A 42 58.195 -5.118 7.118 1.00 0.00 N ATOM 607 CA LEU A 42 57.326 -6.313 6.988 1.00 0.00 C ATOM 608 C LEU A 42 57.671 -7.279 8.108 1.00 0.00 C ATOM 609 O LEU A 42 58.276 -8.311 7.891 1.00 0.00 O ATOM 610 CB LEU A 42 57.570 -6.987 5.647 1.00 0.00 C ATOM 611 CG LEU A 42 56.607 -6.401 4.619 1.00 0.00 C ATOM 612 CD1 LEU A 42 57.385 -5.967 3.379 1.00 0.00 C ATOM 613 CD2 LEU A 42 55.572 -7.458 4.230 1.00 0.00 C ATOM 0 H LEU A 42 59.197 -5.309 7.093 1.00 0.00 H new ATOM 0 HA LEU A 42 56.278 -6.018 7.049 1.00 0.00 H new ATOM 0 HB2 LEU A 42 58.601 -6.832 5.329 1.00 0.00 H new ATOM 0 HB3 LEU A 42 57.421 -8.063 5.733 1.00 0.00 H new ATOM 0 HG LEU A 42 56.100 -5.537 5.048 1.00 0.00 H new ATOM 0 HD11 LEU A 42 56.696 -5.549 2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 42 58.121 -5.213 3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 42 57.894 -6.829 2.948 1.00 0.00 H new ATOM 0 HD21 LEU A 42 54.884 -7.040 3.496 1.00 0.00 H new ATOM 0 HD22 LEU A 42 56.079 -8.323 3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 42 55.015 -7.765 5.115 1.00 0.00 H new ATOM 625 N THR A 43 57.305 -6.942 9.307 1.00 0.00 N ATOM 626 CA THR A 43 57.616 -7.826 10.458 1.00 0.00 C ATOM 627 C THR A 43 57.341 -9.282 10.070 1.00 0.00 C ATOM 628 O THR A 43 56.711 -9.561 9.069 1.00 0.00 O ATOM 629 CB THR A 43 56.749 -7.422 11.651 1.00 0.00 C ATOM 630 OG1 THR A 43 55.438 -7.936 11.476 1.00 0.00 O ATOM 631 CG2 THR A 43 56.694 -5.892 11.748 1.00 0.00 C ATOM 0 H THR A 43 56.801 -6.087 9.542 1.00 0.00 H new ATOM 0 HA THR A 43 58.666 -7.726 10.731 1.00 0.00 H new ATOM 0 HB THR A 43 57.178 -7.827 12.568 1.00 0.00 H new ATOM 0 HG1 THR A 43 55.038 -8.117 12.352 1.00 0.00 H new ATOM 0 HG21 THR A 43 56.076 -5.603 12.598 1.00 0.00 H new ATOM 0 HG22 THR A 43 57.702 -5.499 11.882 1.00 0.00 H new ATOM 0 HG23 THR A 43 56.265 -5.485 10.833 1.00 0.00 H new ATOM 639 N LYS A 44 57.820 -10.211 10.847 1.00 0.00 N ATOM 640 CA LYS A 44 57.606 -11.650 10.520 1.00 0.00 C ATOM 641 C LYS A 44 56.143 -12.024 10.748 1.00 0.00 C ATOM 642 O LYS A 44 55.667 -13.028 10.253 1.00 0.00 O ATOM 643 CB LYS A 44 58.506 -12.511 11.407 1.00 0.00 C ATOM 644 CG LYS A 44 59.968 -12.109 11.192 1.00 0.00 C ATOM 645 CD LYS A 44 60.253 -11.976 9.692 1.00 0.00 C ATOM 646 CE LYS A 44 59.891 -13.283 8.987 1.00 0.00 C ATOM 647 NZ LYS A 44 60.475 -13.287 7.616 1.00 0.00 N ATOM 0 H LYS A 44 58.353 -10.036 11.699 1.00 0.00 H new ATOM 0 HA LYS A 44 57.855 -11.823 9.473 1.00 0.00 H new ATOM 0 HB2 LYS A 44 58.233 -12.383 12.454 1.00 0.00 H new ATOM 0 HB3 LYS A 44 58.369 -13.566 11.168 1.00 0.00 H new ATOM 0 HG2 LYS A 44 60.173 -11.165 11.696 1.00 0.00 H new ATOM 0 HG3 LYS A 44 60.629 -12.855 11.633 1.00 0.00 H new ATOM 0 HD2 LYS A 44 59.675 -11.152 9.273 1.00 0.00 H new ATOM 0 HD3 LYS A 44 61.305 -11.742 9.530 1.00 0.00 H new ATOM 0 HE2 LYS A 44 60.268 -14.132 9.557 1.00 0.00 H new ATOM 0 HE3 LYS A 44 58.808 -13.391 8.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 60.229 -14.176 7.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 60.095 -12.485 7.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 61.510 -13.203 7.679 1.00 0.00 H new ATOM 661 N ARG A 45 55.421 -11.226 11.481 1.00 0.00 N ATOM 662 CA ARG A 45 53.987 -11.543 11.719 1.00 0.00 C ATOM 663 C ARG A 45 53.159 -11.003 10.551 1.00 0.00 C ATOM 664 O ARG A 45 51.947 -10.949 10.609 1.00 0.00 O ATOM 665 CB ARG A 45 53.521 -10.887 13.021 1.00 0.00 C ATOM 666 CG ARG A 45 52.193 -11.509 13.456 1.00 0.00 C ATOM 667 CD ARG A 45 52.430 -12.945 13.930 1.00 0.00 C ATOM 668 NE ARG A 45 51.676 -13.889 13.056 1.00 0.00 N ATOM 669 CZ ARG A 45 50.455 -13.606 12.690 1.00 0.00 C ATOM 670 NH1 ARG A 45 49.521 -13.465 13.589 1.00 0.00 N ATOM 671 NH2 ARG A 45 50.169 -13.465 11.425 1.00 0.00 N ATOM 0 H ARG A 45 55.759 -10.372 11.924 1.00 0.00 H new ATOM 0 HA ARG A 45 53.859 -12.623 11.798 1.00 0.00 H new ATOM 0 HB2 ARG A 45 54.272 -11.024 13.799 1.00 0.00 H new ATOM 0 HB3 ARG A 45 53.403 -9.813 12.878 1.00 0.00 H new ATOM 0 HG2 ARG A 45 51.749 -10.919 14.258 1.00 0.00 H new ATOM 0 HG3 ARG A 45 51.487 -11.501 12.626 1.00 0.00 H new ATOM 0 HD2 ARG A 45 53.495 -13.178 13.901 1.00 0.00 H new ATOM 0 HD3 ARG A 45 52.108 -13.055 14.965 1.00 0.00 H new ATOM 0 HE ARG A 45 52.114 -14.756 12.744 1.00 0.00 H new ATOM 0 HH11 ARG A 45 49.744 -13.576 14.578 1.00 0.00 H new ATOM 0 HH12 ARG A 45 48.567 -13.244 13.303 1.00 0.00 H new ATOM 0 HH21 ARG A 45 50.899 -13.576 10.722 1.00 0.00 H new ATOM 0 HH22 ARG A 45 49.215 -13.244 11.139 1.00 0.00 H new ATOM 685 N SER A 46 53.807 -10.600 9.490 1.00 0.00 N ATOM 686 CA SER A 46 53.061 -10.061 8.322 1.00 0.00 C ATOM 687 C SER A 46 52.372 -8.758 8.726 1.00 0.00 C ATOM 688 O SER A 46 51.262 -8.479 8.317 1.00 0.00 O ATOM 689 CB SER A 46 52.009 -11.078 7.877 1.00 0.00 C ATOM 690 OG SER A 46 52.418 -11.672 6.653 1.00 0.00 O ATOM 0 H SER A 46 54.821 -10.622 9.384 1.00 0.00 H new ATOM 0 HA SER A 46 53.751 -9.872 7.500 1.00 0.00 H new ATOM 0 HB2 SER A 46 51.881 -11.844 8.642 1.00 0.00 H new ATOM 0 HB3 SER A 46 51.043 -10.588 7.752 1.00 0.00 H new ATOM 0 HG SER A 46 51.747 -12.326 6.366 1.00 0.00 H new ATOM 696 N ARG A 47 53.015 -7.956 9.532 1.00 0.00 N ATOM 697 CA ARG A 47 52.381 -6.677 9.958 1.00 0.00 C ATOM 698 C ARG A 47 53.167 -5.490 9.393 1.00 0.00 C ATOM 699 O ARG A 47 54.239 -5.163 9.862 1.00 0.00 O ATOM 700 CB ARG A 47 52.366 -6.604 11.488 1.00 0.00 C ATOM 701 CG ARG A 47 50.961 -6.929 12.000 1.00 0.00 C ATOM 702 CD ARG A 47 50.465 -5.792 12.896 1.00 0.00 C ATOM 703 NE ARG A 47 50.532 -6.217 14.323 1.00 0.00 N ATOM 704 CZ ARG A 47 49.799 -7.211 14.741 1.00 0.00 C ATOM 705 NH1 ARG A 47 48.503 -7.175 14.597 1.00 0.00 N ATOM 706 NH2 ARG A 47 50.363 -8.244 15.305 1.00 0.00 N ATOM 0 H ARG A 47 53.946 -8.130 9.911 1.00 0.00 H new ATOM 0 HA ARG A 47 51.359 -6.638 9.580 1.00 0.00 H new ATOM 0 HB2 ARG A 47 53.088 -7.307 11.903 1.00 0.00 H new ATOM 0 HB3 ARG A 47 52.664 -5.609 11.818 1.00 0.00 H new ATOM 0 HG2 ARG A 47 50.280 -7.067 11.160 1.00 0.00 H new ATOM 0 HG3 ARG A 47 50.974 -7.866 12.557 1.00 0.00 H new ATOM 0 HD2 ARG A 47 51.074 -4.901 12.742 1.00 0.00 H new ATOM 0 HD3 ARG A 47 49.441 -5.527 12.632 1.00 0.00 H new ATOM 0 HE ARG A 47 51.151 -5.731 14.972 1.00 0.00 H new ATOM 0 HH11 ARG A 47 48.061 -6.368 14.157 1.00 0.00 H new ATOM 0 HH12 ARG A 47 47.932 -7.954 14.925 1.00 0.00 H new ATOM 0 HH21 ARG A 47 51.376 -8.273 15.418 1.00 0.00 H new ATOM 0 HH22 ARG A 47 49.791 -9.022 15.632 1.00 0.00 H new ATOM 720 N GLN A 48 52.639 -4.839 8.392 1.00 0.00 N ATOM 721 CA GLN A 48 53.351 -3.670 7.801 1.00 0.00 C ATOM 722 C GLN A 48 53.540 -2.601 8.878 1.00 0.00 C ATOM 723 O GLN A 48 52.679 -2.386 9.708 1.00 0.00 O ATOM 724 CB GLN A 48 52.521 -3.094 6.649 1.00 0.00 C ATOM 725 CG GLN A 48 53.037 -1.697 6.288 1.00 0.00 C ATOM 726 CD GLN A 48 52.334 -0.650 7.159 1.00 0.00 C ATOM 727 OE1 GLN A 48 51.655 -0.992 8.108 1.00 0.00 O ATOM 728 NE2 GLN A 48 52.469 0.619 6.878 1.00 0.00 N ATOM 0 H GLN A 48 51.745 -5.066 7.958 1.00 0.00 H new ATOM 0 HA GLN A 48 54.323 -3.986 7.422 1.00 0.00 H new ATOM 0 HB2 GLN A 48 52.582 -3.750 5.781 1.00 0.00 H new ATOM 0 HB3 GLN A 48 51.471 -3.041 6.936 1.00 0.00 H new ATOM 0 HG2 GLN A 48 54.115 -1.646 6.439 1.00 0.00 H new ATOM 0 HG3 GLN A 48 52.853 -1.491 5.234 1.00 0.00 H new ATOM 0 HE21 GLN A 48 53.038 0.907 6.082 1.00 0.00 H new ATOM 0 HE22 GLN A 48 52.005 1.321 7.454 1.00 0.00 H new ATOM 737 N VAL A 49 54.658 -1.926 8.874 1.00 0.00 N ATOM 738 CA VAL A 49 54.885 -0.876 9.904 1.00 0.00 C ATOM 739 C VAL A 49 55.465 0.383 9.247 1.00 0.00 C ATOM 740 O VAL A 49 55.149 0.712 8.121 1.00 0.00 O ATOM 741 CB VAL A 49 55.859 -1.402 10.964 1.00 0.00 C ATOM 742 CG1 VAL A 49 55.571 -0.724 12.306 1.00 0.00 C ATOM 743 CG2 VAL A 49 55.685 -2.916 11.115 1.00 0.00 C ATOM 0 H VAL A 49 55.418 -2.056 8.206 1.00 0.00 H new ATOM 0 HA VAL A 49 53.936 -0.625 10.377 1.00 0.00 H new ATOM 0 HB VAL A 49 56.881 -1.181 10.655 1.00 0.00 H new ATOM 0 HG11 VAL A 49 56.264 -1.099 13.059 1.00 0.00 H new ATOM 0 HG12 VAL A 49 55.695 0.354 12.203 1.00 0.00 H new ATOM 0 HG13 VAL A 49 54.548 -0.944 12.613 1.00 0.00 H new ATOM 0 HG21 VAL A 49 56.378 -3.289 11.869 1.00 0.00 H new ATOM 0 HG22 VAL A 49 54.662 -3.136 11.422 1.00 0.00 H new ATOM 0 HG23 VAL A 49 55.890 -3.403 10.162 1.00 0.00 H new ATOM 753 N CYS A 50 56.317 1.080 9.950 1.00 0.00 N ATOM 754 CA CYS A 50 56.938 2.314 9.409 1.00 0.00 C ATOM 755 C CYS A 50 57.686 2.991 10.554 1.00 0.00 C ATOM 756 O CYS A 50 57.264 2.930 11.692 1.00 0.00 O ATOM 757 CB CYS A 50 55.870 3.265 8.854 1.00 0.00 C ATOM 758 SG CYS A 50 56.491 4.025 7.328 1.00 0.00 S ATOM 0 H CYS A 50 56.612 0.837 10.896 1.00 0.00 H new ATOM 0 HA CYS A 50 57.615 2.063 8.593 1.00 0.00 H new ATOM 0 HB2 CYS A 50 54.947 2.720 8.655 1.00 0.00 H new ATOM 0 HB3 CYS A 50 55.633 4.035 9.588 1.00 0.00 H new ATOM 763 N ALA A 51 58.800 3.610 10.292 1.00 0.00 N ATOM 764 CA ALA A 51 59.547 4.243 11.413 1.00 0.00 C ATOM 765 C ALA A 51 60.231 5.529 10.962 1.00 0.00 C ATOM 766 O ALA A 51 60.415 5.777 9.786 1.00 0.00 O ATOM 767 CB ALA A 51 60.608 3.265 11.910 1.00 0.00 C ATOM 0 H ALA A 51 59.221 3.705 9.368 1.00 0.00 H new ATOM 0 HA ALA A 51 58.842 4.488 12.207 1.00 0.00 H new ATOM 0 HB1 ALA A 51 61.163 3.717 12.732 1.00 0.00 H new ATOM 0 HB2 ALA A 51 60.126 2.351 12.257 1.00 0.00 H new ATOM 0 HB3 ALA A 51 61.294 3.028 11.097 1.00 0.00 H new ATOM 773 N ASP A 52 60.621 6.341 11.909 1.00 0.00 N ATOM 774 CA ASP A 52 61.316 7.616 11.580 1.00 0.00 C ATOM 775 C ASP A 52 62.314 7.363 10.445 1.00 0.00 C ATOM 776 O ASP A 52 62.675 6.232 10.184 1.00 0.00 O ATOM 777 CB ASP A 52 62.063 8.103 12.827 1.00 0.00 C ATOM 778 CG ASP A 52 61.638 9.535 13.158 1.00 0.00 C ATOM 779 OD1 ASP A 52 60.503 9.877 12.868 1.00 0.00 O ATOM 780 OD2 ASP A 52 62.452 10.264 13.698 1.00 0.00 O ATOM 0 H ASP A 52 60.485 6.172 12.906 1.00 0.00 H new ATOM 0 HA ASP A 52 60.596 8.371 11.265 1.00 0.00 H new ATOM 0 HB2 ASP A 52 61.849 7.446 13.670 1.00 0.00 H new ATOM 0 HB3 ASP A 52 63.139 8.063 12.657 1.00 0.00 H new ATOM 785 N PRO A 53 62.733 8.423 9.802 1.00 0.00 N ATOM 786 CA PRO A 53 63.693 8.343 8.687 1.00 0.00 C ATOM 787 C PRO A 53 65.114 8.116 9.214 1.00 0.00 C ATOM 788 O PRO A 53 66.073 8.142 8.468 1.00 0.00 O ATOM 789 CB PRO A 53 63.570 9.708 8.006 1.00 0.00 C ATOM 790 CG PRO A 53 62.993 10.673 9.068 1.00 0.00 C ATOM 791 CD PRO A 53 62.293 9.797 10.125 1.00 0.00 C ATOM 0 HA PRO A 53 63.490 7.515 8.007 1.00 0.00 H new ATOM 0 HB2 PRO A 53 64.541 10.055 7.652 1.00 0.00 H new ATOM 0 HB3 PRO A 53 62.916 9.651 7.136 1.00 0.00 H new ATOM 0 HG2 PRO A 53 63.785 11.269 9.521 1.00 0.00 H new ATOM 0 HG3 PRO A 53 62.289 11.371 8.615 1.00 0.00 H new ATOM 0 HD2 PRO A 53 62.585 10.082 11.136 1.00 0.00 H new ATOM 0 HD3 PRO A 53 61.209 9.892 10.067 1.00 0.00 H new ATOM 799 N SER A 54 65.259 7.890 10.491 1.00 0.00 N ATOM 800 CA SER A 54 66.617 7.659 11.055 1.00 0.00 C ATOM 801 C SER A 54 66.509 6.787 12.307 1.00 0.00 C ATOM 802 O SER A 54 67.325 6.873 13.203 1.00 0.00 O ATOM 803 CB SER A 54 67.250 9.001 11.424 1.00 0.00 C ATOM 804 OG SER A 54 67.938 9.524 10.296 1.00 0.00 O ATOM 0 H SER A 54 64.496 7.856 11.167 1.00 0.00 H new ATOM 0 HA SER A 54 67.237 7.155 10.313 1.00 0.00 H new ATOM 0 HB2 SER A 54 66.481 9.701 11.751 1.00 0.00 H new ATOM 0 HB3 SER A 54 67.940 8.873 12.258 1.00 0.00 H new ATOM 0 HG SER A 54 67.489 9.232 9.475 1.00 0.00 H new ATOM 810 N GLU A 55 65.512 5.946 12.380 1.00 0.00 N ATOM 811 CA GLU A 55 65.368 5.076 13.580 1.00 0.00 C ATOM 812 C GLU A 55 66.588 4.191 13.717 1.00 0.00 C ATOM 813 O GLU A 55 66.904 3.380 12.874 1.00 0.00 O ATOM 814 CB GLU A 55 64.106 4.217 13.474 1.00 0.00 C ATOM 815 CG GLU A 55 62.871 5.113 13.573 1.00 0.00 C ATOM 816 CD GLU A 55 62.660 5.545 15.028 1.00 0.00 C ATOM 817 OE1 GLU A 55 63.636 5.880 15.677 1.00 0.00 O ATOM 818 OE2 GLU A 55 61.522 5.536 15.468 1.00 0.00 O ATOM 0 H GLU A 55 64.795 5.825 11.664 1.00 0.00 H new ATOM 0 HA GLU A 55 65.280 5.709 14.463 1.00 0.00 H new ATOM 0 HB2 GLU A 55 64.100 3.675 12.528 1.00 0.00 H new ATOM 0 HB3 GLU A 55 64.093 3.472 14.269 1.00 0.00 H new ATOM 0 HG2 GLU A 55 62.995 5.990 12.938 1.00 0.00 H new ATOM 0 HG3 GLU A 55 61.992 4.579 13.211 1.00 0.00 H new ATOM 825 N GLU A 56 67.261 4.372 14.798 1.00 0.00 N ATOM 826 CA GLU A 56 68.482 3.593 15.104 1.00 0.00 C ATOM 827 C GLU A 56 68.390 2.167 14.538 1.00 0.00 C ATOM 828 O GLU A 56 69.383 1.578 14.158 1.00 0.00 O ATOM 829 CB GLU A 56 68.602 3.555 16.623 1.00 0.00 C ATOM 830 CG GLU A 56 69.491 2.389 17.068 1.00 0.00 C ATOM 831 CD GLU A 56 70.157 2.730 18.402 1.00 0.00 C ATOM 832 OE1 GLU A 56 69.973 3.843 18.866 1.00 0.00 O ATOM 833 OE2 GLU A 56 70.840 1.872 18.937 1.00 0.00 O ATOM 0 H GLU A 56 67.010 5.054 15.514 1.00 0.00 H new ATOM 0 HA GLU A 56 69.356 4.056 14.647 1.00 0.00 H new ATOM 0 HB2 GLU A 56 69.020 4.495 16.983 1.00 0.00 H new ATOM 0 HB3 GLU A 56 67.612 3.455 17.068 1.00 0.00 H new ATOM 0 HG2 GLU A 56 68.895 1.482 17.169 1.00 0.00 H new ATOM 0 HG3 GLU A 56 70.250 2.188 16.312 1.00 0.00 H new ATOM 840 N TRP A 57 67.219 1.598 14.506 1.00 0.00 N ATOM 841 CA TRP A 57 67.076 0.210 14.000 1.00 0.00 C ATOM 842 C TRP A 57 66.757 0.179 12.504 1.00 0.00 C ATOM 843 O TRP A 57 67.230 -0.686 11.793 1.00 0.00 O ATOM 844 CB TRP A 57 65.982 -0.481 14.798 1.00 0.00 C ATOM 845 CG TRP A 57 64.727 0.335 14.865 1.00 0.00 C ATOM 846 CD1 TRP A 57 64.494 1.323 15.754 1.00 0.00 C ATOM 847 CD2 TRP A 57 63.515 0.221 14.067 1.00 0.00 C ATOM 848 NE1 TRP A 57 63.220 1.807 15.569 1.00 0.00 N ATOM 849 CE2 TRP A 57 62.578 1.170 14.534 1.00 0.00 C ATOM 850 CE3 TRP A 57 63.142 -0.604 13.000 1.00 0.00 C ATOM 851 CZ2 TRP A 57 61.315 1.291 13.968 1.00 0.00 C ATOM 852 CZ3 TRP A 57 61.867 -0.484 12.424 1.00 0.00 C ATOM 853 CH2 TRP A 57 60.955 0.460 12.909 1.00 0.00 C ATOM 0 H TRP A 57 66.351 2.039 14.811 1.00 0.00 H new ATOM 0 HA TRP A 57 68.023 -0.314 14.128 1.00 0.00 H new ATOM 0 HB2 TRP A 57 65.761 -1.448 14.346 1.00 0.00 H new ATOM 0 HB3 TRP A 57 66.340 -0.676 15.809 1.00 0.00 H new ATOM 0 HD1 TRP A 57 65.197 1.678 16.494 1.00 0.00 H new ATOM 0 HE1 TRP A 57 62.802 2.548 16.131 1.00 0.00 H new ATOM 0 HE3 TRP A 57 63.838 -1.336 12.618 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 60.617 2.024 14.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 61.588 -1.125 11.601 1.00 0.00 H new ATOM 0 HH2 TRP A 57 59.975 0.544 12.464 1.00 0.00 H new ATOM 864 N VAL A 58 65.975 1.090 11.999 1.00 0.00 N ATOM 865 CA VAL A 58 65.677 1.041 10.541 1.00 0.00 C ATOM 866 C VAL A 58 66.922 1.437 9.744 1.00 0.00 C ATOM 867 O VAL A 58 67.034 1.140 8.574 1.00 0.00 O ATOM 868 CB VAL A 58 64.534 1.983 10.182 1.00 0.00 C ATOM 869 CG1 VAL A 58 64.976 3.431 10.387 1.00 0.00 C ATOM 870 CG2 VAL A 58 64.176 1.763 8.714 1.00 0.00 C ATOM 0 H VAL A 58 65.537 1.851 12.518 1.00 0.00 H new ATOM 0 HA VAL A 58 65.382 0.022 10.291 1.00 0.00 H new ATOM 0 HB VAL A 58 63.671 1.784 10.817 1.00 0.00 H new ATOM 0 HG11 VAL A 58 64.156 4.102 10.129 1.00 0.00 H new ATOM 0 HG12 VAL A 58 65.254 3.582 11.430 1.00 0.00 H new ATOM 0 HG13 VAL A 58 65.833 3.644 9.748 1.00 0.00 H new ATOM 0 HG21 VAL A 58 63.359 2.428 8.435 1.00 0.00 H new ATOM 0 HG22 VAL A 58 65.045 1.976 8.092 1.00 0.00 H new ATOM 0 HG23 VAL A 58 63.868 0.728 8.566 1.00 0.00 H new ATOM 880 N GLN A 59 67.861 2.094 10.366 1.00 0.00 N ATOM 881 CA GLN A 59 69.098 2.483 9.633 1.00 0.00 C ATOM 882 C GLN A 59 69.892 1.216 9.341 1.00 0.00 C ATOM 883 O GLN A 59 70.410 1.021 8.260 1.00 0.00 O ATOM 884 CB GLN A 59 69.936 3.417 10.504 1.00 0.00 C ATOM 885 CG GLN A 59 69.585 4.870 10.182 1.00 0.00 C ATOM 886 CD GLN A 59 69.815 5.132 8.692 1.00 0.00 C ATOM 887 OE1 GLN A 59 70.565 4.425 8.048 1.00 0.00 O ATOM 888 NE2 GLN A 59 69.199 6.125 8.114 1.00 0.00 N ATOM 0 H GLN A 59 67.826 2.377 11.345 1.00 0.00 H new ATOM 0 HA GLN A 59 68.843 2.996 8.706 1.00 0.00 H new ATOM 0 HB2 GLN A 59 69.750 3.212 11.558 1.00 0.00 H new ATOM 0 HB3 GLN A 59 70.997 3.241 10.328 1.00 0.00 H new ATOM 0 HG2 GLN A 59 68.545 5.070 10.441 1.00 0.00 H new ATOM 0 HG3 GLN A 59 70.198 5.545 10.780 1.00 0.00 H new ATOM 0 HE21 GLN A 59 68.569 6.719 8.654 1.00 0.00 H new ATOM 0 HE22 GLN A 59 69.347 6.308 7.122 1.00 0.00 H new ATOM 897 N LYS A 60 69.973 0.346 10.307 1.00 0.00 N ATOM 898 CA LYS A 60 70.711 -0.930 10.110 1.00 0.00 C ATOM 899 C LYS A 60 69.916 -1.807 9.145 1.00 0.00 C ATOM 900 O LYS A 60 70.465 -2.456 8.277 1.00 0.00 O ATOM 901 CB LYS A 60 70.851 -1.643 11.467 1.00 0.00 C ATOM 902 CG LYS A 60 71.075 -3.150 11.267 1.00 0.00 C ATOM 903 CD LYS A 60 72.246 -3.607 12.141 1.00 0.00 C ATOM 904 CE LYS A 60 72.516 -5.095 11.903 1.00 0.00 C ATOM 905 NZ LYS A 60 73.973 -5.368 12.060 1.00 0.00 N ATOM 0 H LYS A 60 69.557 0.465 11.230 1.00 0.00 H new ATOM 0 HA LYS A 60 71.703 -0.738 9.701 1.00 0.00 H new ATOM 0 HB2 LYS A 60 71.686 -1.217 12.023 1.00 0.00 H new ATOM 0 HB3 LYS A 60 69.954 -1.480 12.064 1.00 0.00 H new ATOM 0 HG2 LYS A 60 70.173 -3.702 11.530 1.00 0.00 H new ATOM 0 HG3 LYS A 60 71.284 -3.362 10.219 1.00 0.00 H new ATOM 0 HD2 LYS A 60 73.137 -3.024 11.907 1.00 0.00 H new ATOM 0 HD3 LYS A 60 72.018 -3.432 13.192 1.00 0.00 H new ATOM 0 HE2 LYS A 60 71.944 -5.697 12.610 1.00 0.00 H new ATOM 0 HE3 LYS A 60 72.188 -5.380 10.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 74.156 -6.379 11.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 74.508 -4.804 11.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 74.273 -5.112 13.022 1.00 0.00 H new ATOM 919 N TYR A 61 68.625 -1.860 9.321 1.00 0.00 N ATOM 920 CA TYR A 61 67.788 -2.730 8.445 1.00 0.00 C ATOM 921 C TYR A 61 67.686 -2.128 7.041 1.00 0.00 C ATOM 922 O TYR A 61 67.392 -2.817 6.083 1.00 0.00 O ATOM 923 CB TYR A 61 66.393 -2.899 9.062 1.00 0.00 C ATOM 924 CG TYR A 61 66.493 -3.057 10.556 1.00 0.00 C ATOM 925 CD1 TYR A 61 67.715 -3.352 11.172 1.00 0.00 C ATOM 926 CD2 TYR A 61 65.349 -2.894 11.326 1.00 0.00 C ATOM 927 CE1 TYR A 61 67.788 -3.475 12.552 1.00 0.00 C ATOM 928 CE2 TYR A 61 65.418 -3.022 12.707 1.00 0.00 C ATOM 929 CZ TYR A 61 66.639 -3.309 13.328 1.00 0.00 C ATOM 930 OH TYR A 61 66.704 -3.434 14.701 1.00 0.00 O ATOM 0 H TYR A 61 68.113 -1.339 10.033 1.00 0.00 H new ATOM 0 HA TYR A 61 68.257 -3.711 8.363 1.00 0.00 H new ATOM 0 HB2 TYR A 61 65.776 -2.033 8.822 1.00 0.00 H new ATOM 0 HB3 TYR A 61 65.901 -3.771 8.630 1.00 0.00 H new ATOM 0 HD1 TYR A 61 68.603 -3.484 10.572 1.00 0.00 H new ATOM 0 HD2 TYR A 61 64.406 -2.668 10.851 1.00 0.00 H new ATOM 0 HE1 TYR A 61 68.732 -3.699 13.026 1.00 0.00 H new ATOM 0 HE2 TYR A 61 64.526 -2.900 13.304 1.00 0.00 H new ATOM 0 HH TYR A 61 65.843 -3.178 15.094 1.00 0.00 H new ATOM 940 N VAL A 62 67.935 -0.857 6.905 1.00 0.00 N ATOM 941 CA VAL A 62 67.865 -0.221 5.559 1.00 0.00 C ATOM 942 C VAL A 62 69.279 -0.033 4.998 1.00 0.00 C ATOM 943 O VAL A 62 69.459 0.295 3.842 1.00 0.00 O ATOM 944 CB VAL A 62 67.186 1.144 5.672 1.00 0.00 C ATOM 945 CG1 VAL A 62 67.120 1.794 4.289 1.00 0.00 C ATOM 946 CG2 VAL A 62 65.769 0.966 6.217 1.00 0.00 C ATOM 0 H VAL A 62 68.185 -0.229 7.669 1.00 0.00 H new ATOM 0 HA VAL A 62 67.291 -0.864 4.892 1.00 0.00 H new ATOM 0 HB VAL A 62 67.758 1.780 6.348 1.00 0.00 H new ATOM 0 HG11 VAL A 62 66.636 2.768 4.367 1.00 0.00 H new ATOM 0 HG12 VAL A 62 68.130 1.921 3.898 1.00 0.00 H new ATOM 0 HG13 VAL A 62 66.547 1.157 3.615 1.00 0.00 H new ATOM 0 HG21 VAL A 62 65.285 1.939 6.297 1.00 0.00 H new ATOM 0 HG22 VAL A 62 65.196 0.331 5.541 1.00 0.00 H new ATOM 0 HG23 VAL A 62 65.814 0.501 7.202 1.00 0.00 H new ATOM 956 N SER A 63 70.284 -0.219 5.810 1.00 0.00 N ATOM 957 CA SER A 63 71.682 -0.029 5.324 1.00 0.00 C ATOM 958 C SER A 63 72.209 -1.322 4.694 1.00 0.00 C ATOM 959 O SER A 63 73.024 -1.292 3.794 1.00 0.00 O ATOM 960 CB SER A 63 72.581 0.362 6.497 1.00 0.00 C ATOM 961 OG SER A 63 73.930 0.050 6.178 1.00 0.00 O ATOM 0 H SER A 63 70.198 -0.494 6.788 1.00 0.00 H new ATOM 0 HA SER A 63 71.687 0.760 4.572 1.00 0.00 H new ATOM 0 HB2 SER A 63 72.482 1.427 6.707 1.00 0.00 H new ATOM 0 HB3 SER A 63 72.276 -0.170 7.398 1.00 0.00 H new ATOM 0 HG SER A 63 74.510 0.301 6.927 1.00 0.00 H new ATOM 1107 N ASP B 5 47.665 -0.551 10.640 1.00 0.00 N ATOM 1108 CA ASP B 5 48.767 -1.446 10.189 1.00 0.00 C ATOM 1109 C ASP B 5 48.827 -1.439 8.659 1.00 0.00 C ATOM 1110 O ASP B 5 48.485 -2.406 8.008 1.00 0.00 O ATOM 1111 CB ASP B 5 48.506 -2.871 10.687 1.00 0.00 C ATOM 1112 CG ASP B 5 47.982 -2.822 12.125 1.00 0.00 C ATOM 1113 OD1 ASP B 5 48.794 -2.687 13.025 1.00 0.00 O ATOM 1114 OD2 ASP B 5 46.779 -2.920 12.300 1.00 0.00 O ATOM 0 HA ASP B 5 49.715 -1.092 10.593 1.00 0.00 H new ATOM 0 HB2 ASP B 5 47.781 -3.366 10.041 1.00 0.00 H new ATOM 0 HB3 ASP B 5 49.424 -3.457 10.643 1.00 0.00 H new ATOM 1119 N THR B 6 49.255 -0.348 8.082 1.00 0.00 N ATOM 1120 CA THR B 6 49.333 -0.269 6.596 1.00 0.00 C ATOM 1121 C THR B 6 49.509 1.202 6.189 1.00 0.00 C ATOM 1122 O THR B 6 48.982 2.087 6.835 1.00 0.00 O ATOM 1123 CB THR B 6 48.039 -0.860 5.997 1.00 0.00 C ATOM 1124 OG1 THR B 6 48.294 -2.190 5.572 1.00 0.00 O ATOM 1125 CG2 THR B 6 47.549 -0.036 4.797 1.00 0.00 C ATOM 0 H THR B 6 49.554 0.492 8.577 1.00 0.00 H new ATOM 0 HA THR B 6 50.182 -0.840 6.219 1.00 0.00 H new ATOM 0 HB THR B 6 47.265 -0.840 6.764 1.00 0.00 H new ATOM 0 HG1 THR B 6 48.692 -2.698 6.309 1.00 0.00 H new ATOM 0 HG21 THR B 6 46.636 -0.480 4.399 1.00 0.00 H new ATOM 0 HG22 THR B 6 47.346 0.986 5.116 1.00 0.00 H new ATOM 0 HG23 THR B 6 48.316 -0.029 4.023 1.00 0.00 H new ATOM 1133 N PRO B 7 50.242 1.413 5.126 1.00 0.00 N ATOM 1134 CA PRO B 7 50.503 2.766 4.603 1.00 0.00 C ATOM 1135 C PRO B 7 49.270 3.282 3.856 1.00 0.00 C ATOM 1136 O PRO B 7 48.289 2.581 3.704 1.00 0.00 O ATOM 1137 CB PRO B 7 51.686 2.561 3.650 1.00 0.00 C ATOM 1138 CG PRO B 7 51.667 1.068 3.249 1.00 0.00 C ATOM 1139 CD PRO B 7 50.875 0.329 4.345 1.00 0.00 C ATOM 0 HA PRO B 7 50.719 3.501 5.379 1.00 0.00 H new ATOM 0 HB2 PRO B 7 51.593 3.200 2.772 1.00 0.00 H new ATOM 0 HB3 PRO B 7 52.626 2.821 4.136 1.00 0.00 H new ATOM 0 HG2 PRO B 7 51.197 0.934 2.274 1.00 0.00 H new ATOM 0 HG3 PRO B 7 52.681 0.675 3.171 1.00 0.00 H new ATOM 0 HD2 PRO B 7 50.130 -0.340 3.915 1.00 0.00 H new ATOM 0 HD3 PRO B 7 51.530 -0.281 4.968 1.00 0.00 H new ATOM 1147 N THR B 8 49.306 4.498 3.389 1.00 0.00 N ATOM 1148 CA THR B 8 48.129 5.044 2.659 1.00 0.00 C ATOM 1149 C THR B 8 47.990 4.325 1.313 1.00 0.00 C ATOM 1150 O THR B 8 48.886 4.338 0.494 1.00 0.00 O ATOM 1151 CB THR B 8 48.320 6.545 2.431 1.00 0.00 C ATOM 1152 OG1 THR B 8 48.137 7.230 3.662 1.00 0.00 O ATOM 1153 CG2 THR B 8 47.297 7.045 1.412 1.00 0.00 C ATOM 0 H THR B 8 50.097 5.136 3.481 1.00 0.00 H new ATOM 0 HA THR B 8 47.225 4.885 3.247 1.00 0.00 H new ATOM 0 HB THR B 8 49.325 6.732 2.052 1.00 0.00 H new ATOM 0 HG1 THR B 8 48.590 8.098 3.624 1.00 0.00 H new ATOM 0 HG21 THR B 8 47.436 8.114 1.252 1.00 0.00 H new ATOM 0 HG22 THR B 8 47.434 6.516 0.469 1.00 0.00 H new ATOM 0 HG23 THR B 8 46.290 6.862 1.787 1.00 0.00 H new ATOM 1161 N ALA B 9 46.873 3.686 1.089 1.00 0.00 N ATOM 1162 CA ALA B 9 46.672 2.950 -0.192 1.00 0.00 C ATOM 1163 C ALA B 9 46.841 3.900 -1.381 1.00 0.00 C ATOM 1164 O ALA B 9 46.299 4.987 -1.406 1.00 0.00 O ATOM 1165 CB ALA B 9 45.264 2.353 -0.218 1.00 0.00 C ATOM 0 H ALA B 9 46.089 3.642 1.740 1.00 0.00 H new ATOM 0 HA ALA B 9 47.414 2.155 -0.264 1.00 0.00 H new ATOM 0 HB1 ALA B 9 45.114 1.814 -1.154 1.00 0.00 H new ATOM 0 HB2 ALA B 9 45.145 1.666 0.620 1.00 0.00 H new ATOM 0 HB3 ALA B 9 44.528 3.153 -0.138 1.00 0.00 H new ATOM 1171 N CYS B 10 47.586 3.488 -2.372 1.00 0.00 N ATOM 1172 CA CYS B 10 47.788 4.352 -3.572 1.00 0.00 C ATOM 1173 C CYS B 10 48.497 3.541 -4.663 1.00 0.00 C ATOM 1174 O CYS B 10 49.638 3.798 -4.993 1.00 0.00 O ATOM 1175 CB CYS B 10 48.642 5.570 -3.196 1.00 0.00 C ATOM 1176 SG CYS B 10 48.758 6.687 -4.619 1.00 0.00 S ATOM 0 H CYS B 10 48.065 2.588 -2.402 1.00 0.00 H new ATOM 0 HA CYS B 10 46.822 4.695 -3.941 1.00 0.00 H new ATOM 0 HB2 CYS B 10 48.199 6.090 -2.347 1.00 0.00 H new ATOM 0 HB3 CYS B 10 49.638 5.249 -2.889 1.00 0.00 H new ATOM 1181 N CYS B 11 47.834 2.563 -5.227 1.00 0.00 N ATOM 1182 CA CYS B 11 48.485 1.747 -6.291 1.00 0.00 C ATOM 1183 C CYS B 11 48.609 2.589 -7.564 1.00 0.00 C ATOM 1184 O CYS B 11 47.731 3.361 -7.895 1.00 0.00 O ATOM 1185 CB CYS B 11 47.658 0.468 -6.548 1.00 0.00 C ATOM 1186 SG CYS B 11 46.406 0.731 -7.838 1.00 0.00 S ATOM 0 H CYS B 11 46.876 2.297 -4.997 1.00 0.00 H new ATOM 0 HA CYS B 11 49.483 1.445 -5.973 1.00 0.00 H new ATOM 0 HB2 CYS B 11 48.323 -0.343 -6.845 1.00 0.00 H new ATOM 0 HB3 CYS B 11 47.170 0.157 -5.624 1.00 0.00 H new ATOM 1191 N PHE B 12 49.693 2.455 -8.273 1.00 0.00 N ATOM 1192 CA PHE B 12 49.865 3.257 -9.514 1.00 0.00 C ATOM 1193 C PHE B 12 49.807 2.337 -10.735 1.00 0.00 C ATOM 1194 O PHE B 12 50.120 2.737 -11.838 1.00 0.00 O ATOM 1195 CB PHE B 12 51.218 3.973 -9.474 1.00 0.00 C ATOM 1196 CG PHE B 12 51.115 5.197 -8.591 1.00 0.00 C ATOM 1197 CD1 PHE B 12 51.260 5.072 -7.204 1.00 0.00 C ATOM 1198 CD2 PHE B 12 50.873 6.453 -9.160 1.00 0.00 C ATOM 1199 CE1 PHE B 12 51.165 6.204 -6.386 1.00 0.00 C ATOM 1200 CE2 PHE B 12 50.778 7.585 -8.341 1.00 0.00 C ATOM 1201 CZ PHE B 12 50.923 7.461 -6.954 1.00 0.00 C ATOM 0 H PHE B 12 50.465 1.827 -8.048 1.00 0.00 H new ATOM 0 HA PHE B 12 49.065 3.994 -9.582 1.00 0.00 H new ATOM 0 HB2 PHE B 12 51.986 3.300 -9.093 1.00 0.00 H new ATOM 0 HB3 PHE B 12 51.518 4.262 -10.481 1.00 0.00 H new ATOM 0 HD1 PHE B 12 51.445 4.103 -6.765 1.00 0.00 H new ATOM 0 HD2 PHE B 12 50.760 6.549 -10.230 1.00 0.00 H new ATOM 0 HE1 PHE B 12 51.278 6.108 -5.316 1.00 0.00 H new ATOM 0 HE2 PHE B 12 50.593 8.554 -8.780 1.00 0.00 H new ATOM 0 HZ PHE B 12 50.848 8.334 -6.323 1.00 0.00 H new ATOM 1211 N SER B 13 49.408 1.106 -10.553 1.00 0.00 N ATOM 1212 CA SER B 13 49.336 0.180 -11.716 1.00 0.00 C ATOM 1213 C SER B 13 48.309 -0.922 -11.445 1.00 0.00 C ATOM 1214 O SER B 13 48.383 -1.627 -10.458 1.00 0.00 O ATOM 1215 CB SER B 13 50.710 -0.449 -11.945 1.00 0.00 C ATOM 1216 OG SER B 13 51.537 -0.193 -10.817 1.00 0.00 O ATOM 0 H SER B 13 49.131 0.706 -9.656 1.00 0.00 H new ATOM 0 HA SER B 13 49.033 0.738 -12.602 1.00 0.00 H new ATOM 0 HB2 SER B 13 50.610 -1.523 -12.101 1.00 0.00 H new ATOM 0 HB3 SER B 13 51.166 -0.037 -12.846 1.00 0.00 H new ATOM 0 HG SER B 13 52.419 -0.596 -10.959 1.00 0.00 H new ATOM 1222 N TYR B 14 47.352 -1.080 -12.321 1.00 0.00 N ATOM 1223 CA TYR B 14 46.324 -2.140 -12.122 1.00 0.00 C ATOM 1224 C TYR B 14 46.709 -3.368 -12.951 1.00 0.00 C ATOM 1225 O TYR B 14 47.619 -3.322 -13.756 1.00 0.00 O ATOM 1226 CB TYR B 14 44.952 -1.619 -12.564 1.00 0.00 C ATOM 1227 CG TYR B 14 44.853 -0.144 -12.253 1.00 0.00 C ATOM 1228 CD1 TYR B 14 45.032 0.310 -10.940 1.00 0.00 C ATOM 1229 CD2 TYR B 14 44.588 0.772 -13.279 1.00 0.00 C ATOM 1230 CE1 TYR B 14 44.944 1.678 -10.652 1.00 0.00 C ATOM 1231 CE2 TYR B 14 44.498 2.139 -12.992 1.00 0.00 C ATOM 1232 CZ TYR B 14 44.677 2.593 -11.678 1.00 0.00 C ATOM 1233 OH TYR B 14 44.590 3.941 -11.396 1.00 0.00 O ATOM 0 H TYR B 14 47.239 -0.520 -13.166 1.00 0.00 H new ATOM 0 HA TYR B 14 46.273 -2.413 -11.068 1.00 0.00 H new ATOM 0 HB2 TYR B 14 44.813 -1.787 -13.632 1.00 0.00 H new ATOM 0 HB3 TYR B 14 44.160 -2.164 -12.050 1.00 0.00 H new ATOM 0 HD1 TYR B 14 45.238 -0.396 -10.149 1.00 0.00 H new ATOM 0 HD2 TYR B 14 44.453 0.423 -14.292 1.00 0.00 H new ATOM 0 HE1 TYR B 14 45.082 2.027 -9.639 1.00 0.00 H new ATOM 0 HE2 TYR B 14 44.291 2.844 -13.783 1.00 0.00 H new ATOM 0 HH TYR B 14 44.401 4.436 -12.220 1.00 0.00 H new ATOM 1243 N THR B 15 46.035 -4.468 -12.758 1.00 0.00 N ATOM 1244 CA THR B 15 46.381 -5.695 -13.532 1.00 0.00 C ATOM 1245 C THR B 15 45.403 -5.872 -14.694 1.00 0.00 C ATOM 1246 O THR B 15 44.298 -5.369 -14.672 1.00 0.00 O ATOM 1247 CB THR B 15 46.302 -6.918 -12.616 1.00 0.00 C ATOM 1248 OG1 THR B 15 45.180 -6.789 -11.752 1.00 0.00 O ATOM 1249 CG2 THR B 15 47.580 -7.022 -11.784 1.00 0.00 C ATOM 0 H THR B 15 45.262 -4.571 -12.100 1.00 0.00 H new ATOM 0 HA THR B 15 47.393 -5.594 -13.924 1.00 0.00 H new ATOM 0 HB THR B 15 46.194 -7.818 -13.222 1.00 0.00 H new ATOM 0 HG1 THR B 15 44.934 -7.671 -11.402 1.00 0.00 H new ATOM 0 HG21 THR B 15 47.520 -7.894 -11.133 1.00 0.00 H new ATOM 0 HG22 THR B 15 48.439 -7.123 -12.447 1.00 0.00 H new ATOM 0 HG23 THR B 15 47.693 -6.123 -11.178 1.00 0.00 H new ATOM 1257 N SER B 16 45.800 -6.598 -15.704 1.00 0.00 N ATOM 1258 CA SER B 16 44.890 -6.823 -16.862 1.00 0.00 C ATOM 1259 C SER B 16 44.045 -8.070 -16.600 1.00 0.00 C ATOM 1260 O SER B 16 43.175 -8.416 -17.374 1.00 0.00 O ATOM 1261 CB SER B 16 45.718 -7.026 -18.133 1.00 0.00 C ATOM 1262 OG SER B 16 47.020 -7.475 -17.778 1.00 0.00 O ATOM 0 H SER B 16 46.714 -7.044 -15.777 1.00 0.00 H new ATOM 0 HA SER B 16 44.240 -5.958 -16.990 1.00 0.00 H new ATOM 0 HB2 SER B 16 45.234 -7.755 -18.784 1.00 0.00 H new ATOM 0 HB3 SER B 16 45.782 -6.093 -18.692 1.00 0.00 H new ATOM 0 HG SER B 16 47.553 -7.608 -18.590 1.00 0.00 H new ATOM 1268 N ARG B 17 44.294 -8.749 -15.512 1.00 0.00 N ATOM 1269 CA ARG B 17 43.505 -9.972 -15.202 1.00 0.00 C ATOM 1270 C ARG B 17 42.528 -9.677 -14.065 1.00 0.00 C ATOM 1271 O ARG B 17 42.618 -8.667 -13.395 1.00 0.00 O ATOM 1272 CB ARG B 17 44.453 -11.099 -14.784 1.00 0.00 C ATOM 1273 CG ARG B 17 45.514 -11.299 -15.868 1.00 0.00 C ATOM 1274 CD ARG B 17 44.845 -11.786 -17.155 1.00 0.00 C ATOM 1275 NE ARG B 17 45.106 -13.242 -17.330 1.00 0.00 N ATOM 1276 CZ ARG B 17 44.749 -13.840 -18.434 1.00 0.00 C ATOM 1277 NH1 ARG B 17 43.619 -13.528 -19.007 1.00 0.00 N ATOM 1278 NH2 ARG B 17 45.520 -14.750 -18.963 1.00 0.00 N ATOM 0 H ARG B 17 45.010 -8.508 -14.826 1.00 0.00 H new ATOM 0 HA ARG B 17 42.947 -10.277 -16.087 1.00 0.00 H new ATOM 0 HB2 ARG B 17 44.929 -10.855 -13.834 1.00 0.00 H new ATOM 0 HB3 ARG B 17 43.894 -12.022 -14.632 1.00 0.00 H new ATOM 0 HG2 ARG B 17 46.042 -10.363 -16.052 1.00 0.00 H new ATOM 0 HG3 ARG B 17 46.257 -12.024 -15.535 1.00 0.00 H new ATOM 0 HD2 ARG B 17 43.772 -11.601 -17.112 1.00 0.00 H new ATOM 0 HD3 ARG B 17 45.230 -11.231 -18.010 1.00 0.00 H new ATOM 0 HE ARG B 17 45.563 -13.771 -16.588 1.00 0.00 H new ATOM 0 HH11 ARG B 17 43.016 -12.818 -18.592 1.00 0.00 H new ATOM 0 HH12 ARG B 17 43.339 -13.994 -19.870 1.00 0.00 H new ATOM 0 HH21 ARG B 17 46.402 -14.995 -18.514 1.00 0.00 H new ATOM 0 HH22 ARG B 17 45.240 -15.217 -19.826 1.00 0.00 H new ATOM 1292 N GLN B 18 41.588 -10.553 -13.851 1.00 0.00 N ATOM 1293 CA GLN B 18 40.587 -10.342 -12.768 1.00 0.00 C ATOM 1294 C GLN B 18 40.952 -11.167 -11.542 1.00 0.00 C ATOM 1295 O GLN B 18 41.997 -11.780 -11.451 1.00 0.00 O ATOM 1296 CB GLN B 18 39.229 -10.829 -13.249 1.00 0.00 C ATOM 1297 CG GLN B 18 38.104 -9.986 -12.673 1.00 0.00 C ATOM 1298 CD GLN B 18 37.227 -10.872 -11.776 1.00 0.00 C ATOM 1299 OE1 GLN B 18 36.746 -10.433 -10.754 1.00 0.00 O ATOM 1300 NE2 GLN B 18 37.014 -12.116 -12.110 1.00 0.00 N ATOM 0 H GLN B 18 41.469 -11.414 -14.384 1.00 0.00 H new ATOM 0 HA GLN B 18 40.567 -9.282 -12.517 1.00 0.00 H new ATOM 0 HB2 GLN B 18 39.192 -10.793 -14.338 1.00 0.00 H new ATOM 0 HB3 GLN B 18 39.090 -11.871 -12.960 1.00 0.00 H new ATOM 0 HG2 GLN B 18 38.512 -9.155 -12.098 1.00 0.00 H new ATOM 0 HG3 GLN B 18 37.507 -9.555 -13.476 1.00 0.00 H new ATOM 0 HE21 GLN B 18 37.417 -12.489 -12.969 1.00 0.00 H new ATOM 0 HE22 GLN B 18 36.445 -12.714 -11.512 1.00 0.00 H new ATOM 1309 N ILE B 19 40.046 -11.191 -10.625 1.00 0.00 N ATOM 1310 CA ILE B 19 40.191 -11.959 -9.385 1.00 0.00 C ATOM 1311 C ILE B 19 38.784 -12.022 -8.794 1.00 0.00 C ATOM 1312 O ILE B 19 38.242 -11.020 -8.373 1.00 0.00 O ATOM 1313 CB ILE B 19 41.144 -11.267 -8.421 1.00 0.00 C ATOM 1314 CG1 ILE B 19 41.425 -9.832 -8.879 1.00 0.00 C ATOM 1315 CG2 ILE B 19 42.455 -12.046 -8.381 1.00 0.00 C ATOM 1316 CD1 ILE B 19 42.024 -9.037 -7.719 1.00 0.00 C ATOM 0 H ILE B 19 39.166 -10.680 -10.693 1.00 0.00 H new ATOM 0 HA ILE B 19 40.607 -12.949 -9.569 1.00 0.00 H new ATOM 0 HB ILE B 19 40.689 -11.236 -7.431 1.00 0.00 H new ATOM 0 HG12 ILE B 19 42.113 -9.837 -9.725 1.00 0.00 H new ATOM 0 HG13 ILE B 19 40.503 -9.360 -9.220 1.00 0.00 H new ATOM 0 HG21 ILE B 19 43.147 -11.559 -7.693 1.00 0.00 H new ATOM 0 HG22 ILE B 19 42.263 -13.064 -8.043 1.00 0.00 H new ATOM 0 HG23 ILE B 19 42.894 -12.072 -9.379 1.00 0.00 H new ATOM 0 HD11 ILE B 19 42.225 -8.016 -8.043 1.00 0.00 H new ATOM 0 HD12 ILE B 19 41.320 -9.022 -6.887 1.00 0.00 H new ATOM 0 HD13 ILE B 19 42.955 -9.506 -7.399 1.00 0.00 H new ATOM 1328 N PRO B 20 38.213 -13.185 -8.835 1.00 0.00 N ATOM 1329 CA PRO B 20 36.837 -13.405 -8.366 1.00 0.00 C ATOM 1330 C PRO B 20 36.725 -13.214 -6.856 1.00 0.00 C ATOM 1331 O PRO B 20 37.696 -13.288 -6.134 1.00 0.00 O ATOM 1332 CB PRO B 20 36.538 -14.841 -8.806 1.00 0.00 C ATOM 1333 CG PRO B 20 37.911 -15.516 -9.024 1.00 0.00 C ATOM 1334 CD PRO B 20 38.896 -14.396 -9.320 1.00 0.00 C ATOM 0 HA PRO B 20 36.121 -12.694 -8.777 1.00 0.00 H new ATOM 0 HB2 PRO B 20 35.960 -15.369 -8.047 1.00 0.00 H new ATOM 0 HB3 PRO B 20 35.948 -14.853 -9.722 1.00 0.00 H new ATOM 0 HG2 PRO B 20 38.214 -16.076 -8.139 1.00 0.00 H new ATOM 0 HG3 PRO B 20 37.869 -16.225 -9.851 1.00 0.00 H new ATOM 0 HD2 PRO B 20 39.845 -14.552 -8.806 1.00 0.00 H new ATOM 0 HD3 PRO B 20 39.117 -14.330 -10.385 1.00 0.00 H new ATOM 1342 N GLN B 21 35.542 -12.937 -6.382 1.00 0.00 N ATOM 1343 CA GLN B 21 35.355 -12.713 -4.925 1.00 0.00 C ATOM 1344 C GLN B 21 35.910 -13.908 -4.148 1.00 0.00 C ATOM 1345 O GLN B 21 36.309 -13.784 -3.008 1.00 0.00 O ATOM 1346 CB GLN B 21 33.865 -12.514 -4.634 1.00 0.00 C ATOM 1347 CG GLN B 21 33.466 -11.107 -5.096 1.00 0.00 C ATOM 1348 CD GLN B 21 33.420 -10.170 -3.890 1.00 0.00 C ATOM 1349 OE1 GLN B 21 32.359 -9.873 -3.376 1.00 0.00 O ATOM 1350 NE2 GLN B 21 34.535 -9.687 -3.416 1.00 0.00 N ATOM 0 H GLN B 21 34.695 -12.856 -6.945 1.00 0.00 H new ATOM 0 HA GLN B 21 35.895 -11.820 -4.610 1.00 0.00 H new ATOM 0 HB2 GLN B 21 33.273 -13.266 -5.155 1.00 0.00 H new ATOM 0 HB3 GLN B 21 33.667 -12.634 -3.569 1.00 0.00 H new ATOM 0 HG2 GLN B 21 34.181 -10.737 -5.831 1.00 0.00 H new ATOM 0 HG3 GLN B 21 32.492 -11.136 -5.585 1.00 0.00 H new ATOM 0 HE21 GLN B 21 35.424 -9.937 -3.849 1.00 0.00 H new ATOM 0 HE22 GLN B 21 34.518 -9.059 -2.613 1.00 0.00 H new ATOM 1359 N ASN B 22 35.969 -15.059 -4.762 1.00 0.00 N ATOM 1360 CA ASN B 22 36.535 -16.242 -4.057 1.00 0.00 C ATOM 1361 C ASN B 22 38.056 -16.092 -4.033 1.00 0.00 C ATOM 1362 O ASN B 22 38.713 -16.414 -3.064 1.00 0.00 O ATOM 1363 CB ASN B 22 36.155 -17.527 -4.797 1.00 0.00 C ATOM 1364 CG ASN B 22 36.037 -18.673 -3.791 1.00 0.00 C ATOM 1365 OD1 ASN B 22 36.516 -18.573 -2.680 1.00 0.00 O ATOM 1366 ND2 ASN B 22 35.412 -19.767 -4.135 1.00 0.00 N ATOM 0 H ASN B 22 35.651 -15.230 -5.716 1.00 0.00 H new ATOM 0 HA ASN B 22 36.140 -16.299 -3.043 1.00 0.00 H new ATOM 0 HB2 ASN B 22 35.210 -17.391 -5.324 1.00 0.00 H new ATOM 0 HB3 ASN B 22 36.908 -17.764 -5.549 1.00 0.00 H new ATOM 0 HD21 ASN B 22 35.327 -20.536 -3.470 1.00 0.00 H new ATOM 0 HD22 ASN B 22 35.009 -19.852 -5.068 1.00 0.00 H new ATOM 1373 N PHE B 23 38.611 -15.575 -5.096 1.00 0.00 N ATOM 1374 CA PHE B 23 40.085 -15.362 -5.155 1.00 0.00 C ATOM 1375 C PHE B 23 40.396 -13.957 -4.636 1.00 0.00 C ATOM 1376 O PHE B 23 41.530 -13.522 -4.624 1.00 0.00 O ATOM 1377 CB PHE B 23 40.552 -15.473 -6.608 1.00 0.00 C ATOM 1378 CG PHE B 23 41.788 -16.330 -6.690 1.00 0.00 C ATOM 1379 CD1 PHE B 23 42.989 -15.887 -6.126 1.00 0.00 C ATOM 1380 CD2 PHE B 23 41.732 -17.566 -7.341 1.00 0.00 C ATOM 1381 CE1 PHE B 23 44.136 -16.685 -6.213 1.00 0.00 C ATOM 1382 CE2 PHE B 23 42.876 -18.362 -7.430 1.00 0.00 C ATOM 1383 CZ PHE B 23 44.080 -17.923 -6.866 1.00 0.00 C ATOM 0 H PHE B 23 38.102 -15.289 -5.932 1.00 0.00 H new ATOM 0 HA PHE B 23 40.596 -16.110 -4.548 1.00 0.00 H new ATOM 0 HB2 PHE B 23 39.760 -15.904 -7.221 1.00 0.00 H new ATOM 0 HB3 PHE B 23 40.761 -14.481 -7.008 1.00 0.00 H new ATOM 0 HD1 PHE B 23 43.031 -14.931 -5.625 1.00 0.00 H new ATOM 0 HD2 PHE B 23 40.803 -17.905 -7.775 1.00 0.00 H new ATOM 0 HE1 PHE B 23 45.064 -16.346 -5.777 1.00 0.00 H new ATOM 0 HE2 PHE B 23 42.832 -19.316 -7.934 1.00 0.00 H new ATOM 0 HZ PHE B 23 44.965 -18.538 -6.934 1.00 0.00 H new ATOM 1393 N ILE B 24 39.388 -13.243 -4.211 1.00 0.00 N ATOM 1394 CA ILE B 24 39.604 -11.864 -3.699 1.00 0.00 C ATOM 1395 C ILE B 24 39.088 -11.787 -2.261 1.00 0.00 C ATOM 1396 O ILE B 24 38.435 -12.689 -1.775 1.00 0.00 O ATOM 1397 CB ILE B 24 38.847 -10.874 -4.611 1.00 0.00 C ATOM 1398 CG1 ILE B 24 39.850 -9.967 -5.319 1.00 0.00 C ATOM 1399 CG2 ILE B 24 37.869 -10.000 -3.811 1.00 0.00 C ATOM 1400 CD1 ILE B 24 39.178 -9.367 -6.550 1.00 0.00 C ATOM 0 H ILE B 24 38.419 -13.561 -4.198 1.00 0.00 H new ATOM 0 HA ILE B 24 40.663 -11.607 -3.705 1.00 0.00 H new ATOM 0 HB ILE B 24 38.277 -11.457 -5.334 1.00 0.00 H new ATOM 0 HG12 ILE B 24 40.185 -9.176 -4.648 1.00 0.00 H new ATOM 0 HG13 ILE B 24 40.734 -10.534 -5.609 1.00 0.00 H new ATOM 0 HG21 ILE B 24 37.355 -9.316 -4.487 1.00 0.00 H new ATOM 0 HG22 ILE B 24 37.137 -10.636 -3.312 1.00 0.00 H new ATOM 0 HG23 ILE B 24 38.420 -9.427 -3.065 1.00 0.00 H new ATOM 0 HD11 ILE B 24 39.882 -8.716 -7.068 1.00 0.00 H new ATOM 0 HD12 ILE B 24 38.864 -10.168 -7.220 1.00 0.00 H new ATOM 0 HD13 ILE B 24 38.307 -8.788 -6.243 1.00 0.00 H new ATOM 1412 N ALA B 25 39.367 -10.713 -1.586 1.00 0.00 N ATOM 1413 CA ALA B 25 38.882 -10.573 -0.189 1.00 0.00 C ATOM 1414 C ALA B 25 38.802 -9.092 0.183 1.00 0.00 C ATOM 1415 O ALA B 25 37.840 -8.646 0.776 1.00 0.00 O ATOM 1416 CB ALA B 25 39.846 -11.285 0.761 1.00 0.00 C ATOM 0 H ALA B 25 39.910 -9.925 -1.940 1.00 0.00 H new ATOM 0 HA ALA B 25 37.892 -11.021 -0.106 1.00 0.00 H new ATOM 0 HB1 ALA B 25 39.489 -11.182 1.786 1.00 0.00 H new ATOM 0 HB2 ALA B 25 39.900 -12.342 0.500 1.00 0.00 H new ATOM 0 HB3 ALA B 25 40.837 -10.839 0.675 1.00 0.00 H new ATOM 1422 N ALA B 26 39.806 -8.327 -0.149 1.00 0.00 N ATOM 1423 CA ALA B 26 39.776 -6.877 0.204 1.00 0.00 C ATOM 1424 C ALA B 26 39.455 -6.030 -1.016 1.00 0.00 C ATOM 1425 O ALA B 26 39.247 -6.527 -2.100 1.00 0.00 O ATOM 1426 CB ALA B 26 41.143 -6.453 0.724 1.00 0.00 C ATOM 0 H ALA B 26 40.640 -8.639 -0.646 1.00 0.00 H new ATOM 0 HA ALA B 26 39.008 -6.730 0.963 1.00 0.00 H new ATOM 0 HB1 ALA B 26 41.122 -5.394 0.982 1.00 0.00 H new ATOM 0 HB2 ALA B 26 41.393 -7.037 1.610 1.00 0.00 H new ATOM 0 HB3 ALA B 26 41.894 -6.624 -0.047 1.00 0.00 H new ATOM 1432 N TYR B 27 39.458 -4.740 -0.845 1.00 0.00 N ATOM 1433 CA TYR B 27 39.206 -3.841 -1.995 1.00 0.00 C ATOM 1434 C TYR B 27 39.815 -2.445 -1.721 1.00 0.00 C ATOM 1435 O TYR B 27 40.719 -2.021 -2.407 1.00 0.00 O ATOM 1436 CB TYR B 27 37.706 -3.740 -2.276 1.00 0.00 C ATOM 1437 CG TYR B 27 36.980 -3.329 -1.022 1.00 0.00 C ATOM 1438 CD1 TYR B 27 36.973 -4.177 0.091 1.00 0.00 C ATOM 1439 CD2 TYR B 27 36.327 -2.094 -0.969 1.00 0.00 C ATOM 1440 CE1 TYR B 27 36.307 -3.787 1.261 1.00 0.00 C ATOM 1441 CE2 TYR B 27 35.666 -1.702 0.200 1.00 0.00 C ATOM 1442 CZ TYR B 27 35.654 -2.549 1.315 1.00 0.00 C ATOM 1443 OH TYR B 27 35.004 -2.159 2.467 1.00 0.00 O ATOM 0 H TYR B 27 39.625 -4.271 0.045 1.00 0.00 H new ATOM 0 HA TYR B 27 39.686 -4.257 -2.881 1.00 0.00 H new ATOM 0 HB2 TYR B 27 37.523 -3.014 -3.068 1.00 0.00 H new ATOM 0 HB3 TYR B 27 37.327 -4.699 -2.629 1.00 0.00 H new ATOM 0 HD1 TYR B 27 37.480 -5.130 0.049 1.00 0.00 H new ATOM 0 HD2 TYR B 27 36.333 -1.443 -1.830 1.00 0.00 H new ATOM 0 HE1 TYR B 27 36.297 -4.441 2.121 1.00 0.00 H new ATOM 0 HE2 TYR B 27 35.165 -0.746 0.242 1.00 0.00 H new ATOM 0 HH TYR B 27 34.606 -1.274 2.334 1.00 0.00 H new ATOM 1453 N PHE B 28 39.346 -1.741 -0.718 1.00 0.00 N ATOM 1454 CA PHE B 28 39.908 -0.387 -0.391 1.00 0.00 C ATOM 1455 C PHE B 28 39.941 0.516 -1.621 1.00 0.00 C ATOM 1456 O PHE B 28 40.631 0.254 -2.585 1.00 0.00 O ATOM 1457 CB PHE B 28 41.331 -0.530 0.154 1.00 0.00 C ATOM 1458 CG PHE B 28 41.281 -1.366 1.399 1.00 0.00 C ATOM 1459 CD1 PHE B 28 40.922 -2.702 1.293 1.00 0.00 C ATOM 1460 CD2 PHE B 28 41.567 -0.810 2.650 1.00 0.00 C ATOM 1461 CE1 PHE B 28 40.844 -3.502 2.430 1.00 0.00 C ATOM 1462 CE2 PHE B 28 41.490 -1.609 3.799 1.00 0.00 C ATOM 1463 CZ PHE B 28 41.125 -2.957 3.689 1.00 0.00 C ATOM 0 H PHE B 28 38.591 -2.048 -0.105 1.00 0.00 H new ATOM 0 HA PHE B 28 39.260 0.066 0.359 1.00 0.00 H new ATOM 0 HB2 PHE B 28 41.977 -0.996 -0.590 1.00 0.00 H new ATOM 0 HB3 PHE B 28 41.753 0.451 0.373 1.00 0.00 H new ATOM 0 HD1 PHE B 28 40.702 -3.124 0.323 1.00 0.00 H new ATOM 0 HD2 PHE B 28 41.846 0.230 2.730 1.00 0.00 H new ATOM 0 HE1 PHE B 28 40.567 -4.542 2.341 1.00 0.00 H new ATOM 0 HE2 PHE B 28 41.712 -1.186 4.768 1.00 0.00 H new ATOM 0 HZ PHE B 28 41.060 -3.574 4.573 1.00 0.00 H new ATOM 1473 N GLU B 29 39.230 1.608 -1.578 1.00 0.00 N ATOM 1474 CA GLU B 29 39.260 2.547 -2.732 1.00 0.00 C ATOM 1475 C GLU B 29 40.399 3.531 -2.503 1.00 0.00 C ATOM 1476 O GLU B 29 40.206 4.728 -2.441 1.00 0.00 O ATOM 1477 CB GLU B 29 37.932 3.310 -2.875 1.00 0.00 C ATOM 1478 CG GLU B 29 36.969 2.929 -1.750 1.00 0.00 C ATOM 1479 CD GLU B 29 35.560 3.416 -2.094 1.00 0.00 C ATOM 1480 OE1 GLU B 29 35.353 3.818 -3.228 1.00 0.00 O ATOM 1481 OE2 GLU B 29 34.711 3.380 -1.218 1.00 0.00 O ATOM 0 H GLU B 29 38.634 1.889 -0.800 1.00 0.00 H new ATOM 0 HA GLU B 29 39.410 1.982 -3.652 1.00 0.00 H new ATOM 0 HB2 GLU B 29 38.119 4.384 -2.853 1.00 0.00 H new ATOM 0 HB3 GLU B 29 37.479 3.085 -3.841 1.00 0.00 H new ATOM 0 HG2 GLU B 29 36.967 1.848 -1.610 1.00 0.00 H new ATOM 0 HG3 GLU B 29 37.298 3.372 -0.810 1.00 0.00 H new ATOM 1488 N THR B 30 41.589 3.016 -2.370 1.00 0.00 N ATOM 1489 CA THR B 30 42.771 3.885 -2.137 1.00 0.00 C ATOM 1490 C THR B 30 42.536 4.750 -0.897 1.00 0.00 C ATOM 1491 O THR B 30 42.091 4.263 0.124 1.00 0.00 O ATOM 1492 CB THR B 30 43.008 4.752 -3.369 1.00 0.00 C ATOM 1493 OG1 THR B 30 42.008 5.758 -3.452 1.00 0.00 O ATOM 1494 CG2 THR B 30 42.953 3.862 -4.610 1.00 0.00 C ATOM 0 H THR B 30 41.793 2.018 -2.414 1.00 0.00 H new ATOM 0 HA THR B 30 43.656 3.273 -1.965 1.00 0.00 H new ATOM 0 HB THR B 30 43.983 5.234 -3.301 1.00 0.00 H new ATOM 0 HG1 THR B 30 41.542 5.686 -4.311 1.00 0.00 H new ATOM 0 HG21 THR B 30 43.121 4.468 -5.500 1.00 0.00 H new ATOM 0 HG22 THR B 30 43.725 3.095 -4.542 1.00 0.00 H new ATOM 0 HG23 THR B 30 41.974 3.387 -4.674 1.00 0.00 H new ATOM 1502 N SER B 31 42.846 6.018 -0.951 1.00 0.00 N ATOM 1503 CA SER B 31 42.647 6.856 0.262 1.00 0.00 C ATOM 1504 C SER B 31 42.892 8.333 -0.053 1.00 0.00 C ATOM 1505 O SER B 31 43.222 8.699 -1.163 1.00 0.00 O ATOM 1506 CB SER B 31 43.648 6.403 1.316 1.00 0.00 C ATOM 1507 OG SER B 31 43.011 5.510 2.220 1.00 0.00 O ATOM 0 H SER B 31 43.221 6.501 -1.767 1.00 0.00 H new ATOM 0 HA SER B 31 41.622 6.743 0.616 1.00 0.00 H new ATOM 0 HB2 SER B 31 44.497 5.912 0.840 1.00 0.00 H new ATOM 0 HB3 SER B 31 44.040 7.265 1.855 1.00 0.00 H new ATOM 0 HG SER B 31 42.414 4.912 1.723 1.00 0.00 H new ATOM 1513 N SER B 32 42.749 9.182 0.932 1.00 0.00 N ATOM 1514 CA SER B 32 42.990 10.634 0.713 1.00 0.00 C ATOM 1515 C SER B 32 44.474 10.838 0.406 1.00 0.00 C ATOM 1516 O SER B 32 45.145 9.928 -0.026 1.00 0.00 O ATOM 1517 CB SER B 32 42.613 11.412 1.973 1.00 0.00 C ATOM 1518 OG SER B 32 41.890 12.580 1.607 1.00 0.00 O ATOM 0 H SER B 32 42.475 8.928 1.881 1.00 0.00 H new ATOM 0 HA SER B 32 42.384 10.993 -0.119 1.00 0.00 H new ATOM 0 HB2 SER B 32 42.009 10.788 2.632 1.00 0.00 H new ATOM 0 HB3 SER B 32 43.511 11.685 2.527 1.00 0.00 H new ATOM 0 HG SER B 32 41.646 13.080 2.414 1.00 0.00 H new ATOM 1524 N GLN B 33 44.991 12.019 0.627 1.00 0.00 N ATOM 1525 CA GLN B 33 46.438 12.265 0.341 1.00 0.00 C ATOM 1526 C GLN B 33 46.757 11.775 -1.071 1.00 0.00 C ATOM 1527 O GLN B 33 46.659 12.515 -2.028 1.00 0.00 O ATOM 1528 CB GLN B 33 47.297 11.505 1.355 1.00 0.00 C ATOM 1529 CG GLN B 33 47.396 12.312 2.652 1.00 0.00 C ATOM 1530 CD GLN B 33 47.907 13.721 2.343 1.00 0.00 C ATOM 1531 OE1 GLN B 33 47.385 14.694 2.848 1.00 0.00 O ATOM 1532 NE2 GLN B 33 48.917 13.873 1.529 1.00 0.00 N ATOM 0 H GLN B 33 44.477 12.821 0.992 1.00 0.00 H new ATOM 0 HA GLN B 33 46.653 13.331 0.417 1.00 0.00 H new ATOM 0 HB2 GLN B 33 46.860 10.527 1.556 1.00 0.00 H new ATOM 0 HB3 GLN B 33 48.292 11.332 0.946 1.00 0.00 H new ATOM 0 HG2 GLN B 33 46.420 12.366 3.134 1.00 0.00 H new ATOM 0 HG3 GLN B 33 48.069 11.815 3.351 1.00 0.00 H new ATOM 0 HE21 GLN B 33 49.357 13.057 1.104 1.00 0.00 H new ATOM 0 HE22 GLN B 33 49.266 14.808 1.318 1.00 0.00 H new ATOM 1541 N CYS B 34 47.123 10.528 -1.207 1.00 0.00 N ATOM 1542 CA CYS B 34 47.428 9.973 -2.556 1.00 0.00 C ATOM 1543 C CYS B 34 46.104 9.650 -3.259 1.00 0.00 C ATOM 1544 O CYS B 34 45.726 8.503 -3.393 1.00 0.00 O ATOM 1545 CB CYS B 34 48.248 8.689 -2.398 1.00 0.00 C ATOM 1546 SG CYS B 34 49.323 8.465 -3.837 1.00 0.00 S ATOM 0 H CYS B 34 47.224 9.867 -0.437 1.00 0.00 H new ATOM 0 HA CYS B 34 47.996 10.695 -3.143 1.00 0.00 H new ATOM 0 HB2 CYS B 34 48.848 8.739 -1.489 1.00 0.00 H new ATOM 0 HB3 CYS B 34 47.582 7.832 -2.293 1.00 0.00 H new ATOM 1551 N SER B 35 45.389 10.653 -3.695 1.00 0.00 N ATOM 1552 CA SER B 35 44.086 10.405 -4.372 1.00 0.00 C ATOM 1553 C SER B 35 44.267 9.363 -5.475 1.00 0.00 C ATOM 1554 O SER B 35 44.903 9.614 -6.479 1.00 0.00 O ATOM 1555 CB SER B 35 43.573 11.710 -4.983 1.00 0.00 C ATOM 1556 OG SER B 35 44.525 12.197 -5.919 1.00 0.00 O ATOM 0 H SER B 35 45.653 11.635 -3.611 1.00 0.00 H new ATOM 0 HA SER B 35 43.366 10.035 -3.642 1.00 0.00 H new ATOM 0 HB2 SER B 35 42.615 11.542 -5.475 1.00 0.00 H new ATOM 0 HB3 SER B 35 43.404 12.450 -4.200 1.00 0.00 H new ATOM 0 HG SER B 35 44.938 11.442 -6.388 1.00 0.00 H new ATOM 1562 N LYS B 36 43.709 8.197 -5.303 1.00 0.00 N ATOM 1563 CA LYS B 36 43.850 7.152 -6.351 1.00 0.00 C ATOM 1564 C LYS B 36 42.473 6.555 -6.671 1.00 0.00 C ATOM 1565 O LYS B 36 41.664 6.363 -5.786 1.00 0.00 O ATOM 1566 CB LYS B 36 44.786 6.050 -5.862 1.00 0.00 C ATOM 1567 CG LYS B 36 46.224 6.381 -6.263 1.00 0.00 C ATOM 1568 CD LYS B 36 46.337 6.428 -7.789 1.00 0.00 C ATOM 1569 CE LYS B 36 47.810 6.492 -8.193 1.00 0.00 C ATOM 1570 NZ LYS B 36 47.913 6.838 -9.639 1.00 0.00 N ATOM 0 H LYS B 36 43.164 7.925 -4.485 1.00 0.00 H new ATOM 0 HA LYS B 36 44.268 7.602 -7.252 1.00 0.00 H new ATOM 0 HB2 LYS B 36 44.714 5.952 -4.779 1.00 0.00 H new ATOM 0 HB3 LYS B 36 44.490 5.092 -6.289 1.00 0.00 H new ATOM 0 HG2 LYS B 36 46.519 7.340 -5.837 1.00 0.00 H new ATOM 0 HG3 LYS B 36 46.905 5.631 -5.861 1.00 0.00 H new ATOM 0 HD2 LYS B 36 45.868 5.546 -8.226 1.00 0.00 H new ATOM 0 HD3 LYS B 36 45.805 7.297 -8.176 1.00 0.00 H new ATOM 0 HE2 LYS B 36 48.331 7.237 -7.592 1.00 0.00 H new ATOM 0 HE3 LYS B 36 48.293 5.534 -8.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 48.915 6.915 -9.907 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 47.459 6.095 -10.207 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 47.437 7.746 -9.813 1.00 0.00 H new ATOM 1584 N PRO B 37 42.248 6.292 -7.935 1.00 0.00 N ATOM 1585 CA PRO B 37 40.974 5.729 -8.423 1.00 0.00 C ATOM 1586 C PRO B 37 40.948 4.204 -8.268 1.00 0.00 C ATOM 1587 O PRO B 37 40.282 3.665 -7.407 1.00 0.00 O ATOM 1588 CB PRO B 37 40.974 6.094 -9.909 1.00 0.00 C ATOM 1589 CG PRO B 37 42.456 6.306 -10.307 1.00 0.00 C ATOM 1590 CD PRO B 37 43.239 6.541 -8.999 1.00 0.00 C ATOM 0 HA PRO B 37 40.113 6.110 -7.874 1.00 0.00 H new ATOM 0 HB2 PRO B 37 40.522 5.300 -10.504 1.00 0.00 H new ATOM 0 HB3 PRO B 37 40.391 6.998 -10.087 1.00 0.00 H new ATOM 0 HG2 PRO B 37 42.842 5.436 -10.838 1.00 0.00 H new ATOM 0 HG3 PRO B 37 42.558 7.159 -10.977 1.00 0.00 H new ATOM 0 HD2 PRO B 37 44.090 5.865 -8.917 1.00 0.00 H new ATOM 0 HD3 PRO B 37 43.633 7.556 -8.947 1.00 0.00 H new ATOM 1598 N GLY B 38 41.655 3.512 -9.124 1.00 0.00 N ATOM 1599 CA GLY B 38 41.674 2.021 -9.076 1.00 0.00 C ATOM 1600 C GLY B 38 41.642 1.519 -7.630 1.00 0.00 C ATOM 1601 O GLY B 38 42.287 2.059 -6.754 1.00 0.00 O ATOM 0 H GLY B 38 42.226 3.923 -9.863 1.00 0.00 H new ATOM 0 HA2 GLY B 38 40.817 1.625 -9.621 1.00 0.00 H new ATOM 0 HA3 GLY B 38 42.569 1.649 -9.574 1.00 0.00 H new ATOM 1605 N VAL B 39 40.900 0.472 -7.385 1.00 0.00 N ATOM 1606 CA VAL B 39 40.820 -0.098 -6.011 1.00 0.00 C ATOM 1607 C VAL B 39 41.954 -1.112 -5.840 1.00 0.00 C ATOM 1608 O VAL B 39 42.478 -1.619 -6.802 1.00 0.00 O ATOM 1609 CB VAL B 39 39.452 -0.807 -5.841 1.00 0.00 C ATOM 1610 CG1 VAL B 39 39.636 -2.275 -5.413 1.00 0.00 C ATOM 1611 CG2 VAL B 39 38.626 -0.083 -4.776 1.00 0.00 C ATOM 0 H VAL B 39 40.341 -0.016 -8.085 1.00 0.00 H new ATOM 0 HA VAL B 39 40.914 0.689 -5.263 1.00 0.00 H new ATOM 0 HB VAL B 39 38.938 -0.782 -6.802 1.00 0.00 H new ATOM 0 HG11 VAL B 39 38.660 -2.747 -5.302 1.00 0.00 H new ATOM 0 HG12 VAL B 39 40.211 -2.806 -6.172 1.00 0.00 H new ATOM 0 HG13 VAL B 39 40.168 -2.313 -4.462 1.00 0.00 H new ATOM 0 HG21 VAL B 39 37.665 -0.583 -4.659 1.00 0.00 H new ATOM 0 HG22 VAL B 39 39.162 -0.099 -3.827 1.00 0.00 H new ATOM 0 HG23 VAL B 39 38.462 0.950 -5.083 1.00 0.00 H new ATOM 1621 N ILE B 40 42.295 -1.443 -4.625 1.00 0.00 N ATOM 1622 CA ILE B 40 43.355 -2.467 -4.396 1.00 0.00 C ATOM 1623 C ILE B 40 42.649 -3.768 -3.990 1.00 0.00 C ATOM 1624 O ILE B 40 41.468 -3.768 -3.725 1.00 0.00 O ATOM 1625 CB ILE B 40 44.304 -1.991 -3.285 1.00 0.00 C ATOM 1626 CG1 ILE B 40 45.397 -1.117 -3.906 1.00 0.00 C ATOM 1627 CG2 ILE B 40 44.954 -3.191 -2.588 1.00 0.00 C ATOM 1628 CD1 ILE B 40 45.365 0.276 -3.276 1.00 0.00 C ATOM 0 H ILE B 40 41.885 -1.048 -3.779 1.00 0.00 H new ATOM 0 HA ILE B 40 43.951 -2.627 -5.295 1.00 0.00 H new ATOM 0 HB ILE B 40 43.736 -1.421 -2.550 1.00 0.00 H new ATOM 0 HG12 ILE B 40 46.374 -1.575 -3.750 1.00 0.00 H new ATOM 0 HG13 ILE B 40 45.248 -1.043 -4.983 1.00 0.00 H new ATOM 0 HG21 ILE B 40 45.623 -2.838 -1.804 1.00 0.00 H new ATOM 0 HG22 ILE B 40 44.180 -3.820 -2.148 1.00 0.00 H new ATOM 0 HG23 ILE B 40 45.522 -3.771 -3.316 1.00 0.00 H new ATOM 0 HD11 ILE B 40 46.144 0.895 -3.721 1.00 0.00 H new ATOM 0 HD12 ILE B 40 44.392 0.734 -3.455 1.00 0.00 H new ATOM 0 HD13 ILE B 40 45.536 0.194 -2.203 1.00 0.00 H new ATOM 1640 N PHE B 41 43.332 -4.879 -3.951 1.00 0.00 N ATOM 1641 CA PHE B 41 42.638 -6.142 -3.573 1.00 0.00 C ATOM 1642 C PHE B 41 43.569 -7.031 -2.749 1.00 0.00 C ATOM 1643 O PHE B 41 44.776 -6.950 -2.851 1.00 0.00 O ATOM 1644 CB PHE B 41 42.249 -6.896 -4.842 1.00 0.00 C ATOM 1645 CG PHE B 41 40.892 -6.431 -5.308 1.00 0.00 C ATOM 1646 CD1 PHE B 41 39.742 -6.852 -4.635 1.00 0.00 C ATOM 1647 CD2 PHE B 41 40.786 -5.576 -6.410 1.00 0.00 C ATOM 1648 CE1 PHE B 41 38.481 -6.420 -5.063 1.00 0.00 C ATOM 1649 CE2 PHE B 41 39.527 -5.143 -6.840 1.00 0.00 C ATOM 1650 CZ PHE B 41 38.374 -5.565 -6.165 1.00 0.00 C ATOM 0 H PHE B 41 44.326 -4.967 -4.161 1.00 0.00 H new ATOM 0 HA PHE B 41 41.754 -5.896 -2.985 1.00 0.00 H new ATOM 0 HB2 PHE B 41 42.991 -6.725 -5.622 1.00 0.00 H new ATOM 0 HB3 PHE B 41 42.231 -7.969 -4.649 1.00 0.00 H new ATOM 0 HD1 PHE B 41 39.826 -7.511 -3.784 1.00 0.00 H new ATOM 0 HD2 PHE B 41 41.676 -5.250 -6.929 1.00 0.00 H new ATOM 0 HE1 PHE B 41 37.592 -6.746 -4.543 1.00 0.00 H new ATOM 0 HE2 PHE B 41 39.444 -4.484 -7.692 1.00 0.00 H new ATOM 0 HZ PHE B 41 37.402 -5.230 -6.496 1.00 0.00 H new ATOM 1660 N LEU B 42 43.011 -7.901 -1.956 1.00 0.00 N ATOM 1661 CA LEU B 42 43.845 -8.821 -1.147 1.00 0.00 C ATOM 1662 C LEU B 42 43.462 -10.249 -1.498 1.00 0.00 C ATOM 1663 O LEU B 42 42.829 -10.943 -0.725 1.00 0.00 O ATOM 1664 CB LEU B 42 43.597 -8.581 0.334 1.00 0.00 C ATOM 1665 CG LEU B 42 44.586 -7.535 0.838 1.00 0.00 C ATOM 1666 CD1 LEU B 42 43.834 -6.437 1.586 1.00 0.00 C ATOM 1667 CD2 LEU B 42 45.595 -8.197 1.778 1.00 0.00 C ATOM 0 H LEU B 42 42.004 -8.012 -1.835 1.00 0.00 H new ATOM 0 HA LEU B 42 44.900 -8.647 -1.360 1.00 0.00 H new ATOM 0 HB2 LEU B 42 42.574 -8.241 0.494 1.00 0.00 H new ATOM 0 HB3 LEU B 42 43.715 -9.510 0.891 1.00 0.00 H new ATOM 0 HG LEU B 42 45.113 -7.098 -0.010 1.00 0.00 H new ATOM 0 HD11 LEU B 42 44.542 -5.691 1.945 1.00 0.00 H new ATOM 0 HD12 LEU B 42 43.118 -5.964 0.914 1.00 0.00 H new ATOM 0 HD13 LEU B 42 43.304 -6.872 2.433 1.00 0.00 H new ATOM 0 HD21 LEU B 42 46.302 -7.449 2.138 1.00 0.00 H new ATOM 0 HD22 LEU B 42 45.069 -8.637 2.625 1.00 0.00 H new ATOM 0 HD23 LEU B 42 46.135 -8.977 1.241 1.00 0.00 H new ATOM 1679 N THR B 43 43.827 -10.683 -2.665 1.00 0.00 N ATOM 1680 CA THR B 43 43.477 -12.062 -3.089 1.00 0.00 C ATOM 1681 C THR B 43 43.715 -13.027 -1.923 1.00 0.00 C ATOM 1682 O THR B 43 44.346 -12.689 -0.941 1.00 0.00 O ATOM 1683 CB THR B 43 44.344 -12.455 -4.287 1.00 0.00 C ATOM 1684 OG1 THR B 43 45.642 -12.809 -3.833 1.00 0.00 O ATOM 1685 CG2 THR B 43 44.442 -11.269 -5.254 1.00 0.00 C ATOM 0 H THR B 43 44.355 -10.140 -3.348 1.00 0.00 H new ATOM 0 HA THR B 43 42.427 -12.108 -3.378 1.00 0.00 H new ATOM 0 HB THR B 43 43.896 -13.305 -4.801 1.00 0.00 H new ATOM 0 HG1 THR B 43 46.028 -13.479 -4.436 1.00 0.00 H new ATOM 0 HG21 THR B 43 45.059 -11.546 -6.109 1.00 0.00 H new ATOM 0 HG22 THR B 43 43.444 -10.998 -5.600 1.00 0.00 H new ATOM 0 HG23 THR B 43 44.892 -10.418 -4.742 1.00 0.00 H new ATOM 1693 N LYS B 44 43.200 -14.220 -2.019 1.00 0.00 N ATOM 1694 CA LYS B 44 43.376 -15.204 -0.912 1.00 0.00 C ATOM 1695 C LYS B 44 44.823 -15.686 -0.866 1.00 0.00 C ATOM 1696 O LYS B 44 45.275 -16.227 0.124 1.00 0.00 O ATOM 1697 CB LYS B 44 42.441 -16.394 -1.139 1.00 0.00 C ATOM 1698 CG LYS B 44 40.994 -15.900 -1.212 1.00 0.00 C ATOM 1699 CD LYS B 44 40.728 -14.910 -0.074 1.00 0.00 C ATOM 1700 CE LYS B 44 41.060 -15.572 1.265 1.00 0.00 C ATOM 1701 NZ LYS B 44 40.489 -14.760 2.377 1.00 0.00 N ATOM 0 H LYS B 44 42.663 -14.558 -2.818 1.00 0.00 H new ATOM 0 HA LYS B 44 43.134 -14.726 0.037 1.00 0.00 H new ATOM 0 HB2 LYS B 44 42.708 -16.909 -2.062 1.00 0.00 H new ATOM 0 HB3 LYS B 44 42.550 -17.115 -0.329 1.00 0.00 H new ATOM 0 HG2 LYS B 44 40.811 -15.421 -2.174 1.00 0.00 H new ATOM 0 HG3 LYS B 44 40.308 -16.744 -1.141 1.00 0.00 H new ATOM 0 HD2 LYS B 44 41.333 -14.013 -0.209 1.00 0.00 H new ATOM 0 HD3 LYS B 44 39.684 -14.595 -0.088 1.00 0.00 H new ATOM 0 HE2 LYS B 44 40.654 -16.583 1.293 1.00 0.00 H new ATOM 0 HE3 LYS B 44 42.140 -15.659 1.382 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 40.715 -15.210 3.287 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 40.897 -13.804 2.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 39.457 -14.699 2.268 1.00 0.00 H new ATOM 1715 N ARG B 45 45.562 -15.485 -1.920 1.00 0.00 N ATOM 1716 CA ARG B 45 46.984 -15.923 -1.918 1.00 0.00 C ATOM 1717 C ARG B 45 47.838 -14.830 -1.276 1.00 0.00 C ATOM 1718 O ARG B 45 49.050 -14.855 -1.343 1.00 0.00 O ATOM 1719 CB ARG B 45 47.455 -16.163 -3.353 1.00 0.00 C ATOM 1720 CG ARG B 45 48.760 -16.960 -3.333 1.00 0.00 C ATOM 1721 CD ARG B 45 48.476 -18.395 -2.885 1.00 0.00 C ATOM 1722 NE ARG B 45 49.211 -18.677 -1.618 1.00 0.00 N ATOM 1723 CZ ARG B 45 50.443 -18.269 -1.474 1.00 0.00 C ATOM 1724 NH1 ARG B 45 51.372 -18.706 -2.280 1.00 0.00 N ATOM 1725 NH2 ARG B 45 50.746 -17.427 -0.525 1.00 0.00 N ATOM 0 H ARG B 45 45.244 -15.038 -2.780 1.00 0.00 H new ATOM 0 HA ARG B 45 47.081 -16.850 -1.353 1.00 0.00 H new ATOM 0 HB2 ARG B 45 46.693 -16.706 -3.911 1.00 0.00 H new ATOM 0 HB3 ARG B 45 47.605 -15.211 -3.862 1.00 0.00 H new ATOM 0 HG2 ARG B 45 49.213 -16.960 -4.324 1.00 0.00 H new ATOM 0 HG3 ARG B 45 49.474 -16.491 -2.656 1.00 0.00 H new ATOM 0 HD2 ARG B 45 47.405 -18.535 -2.735 1.00 0.00 H new ATOM 0 HD3 ARG B 45 48.784 -19.097 -3.660 1.00 0.00 H new ATOM 0 HE ARG B 45 48.751 -19.188 -0.864 1.00 0.00 H new ATOM 0 HH11 ARG B 45 51.135 -19.365 -3.021 1.00 0.00 H new ATOM 0 HH12 ARG B 45 52.335 -18.388 -2.169 1.00 0.00 H new ATOM 0 HH21 ARG B 45 50.020 -17.087 0.106 1.00 0.00 H new ATOM 0 HH22 ARG B 45 51.709 -17.109 -0.414 1.00 0.00 H new ATOM 1739 N SER B 46 47.212 -13.865 -0.654 1.00 0.00 N ATOM 1740 CA SER B 46 47.987 -12.770 -0.011 1.00 0.00 C ATOM 1741 C SER B 46 48.710 -11.966 -1.092 1.00 0.00 C ATOM 1742 O SER B 46 49.831 -11.534 -0.912 1.00 0.00 O ATOM 1743 CB SER B 46 49.013 -13.368 0.953 1.00 0.00 C ATOM 1744 OG SER B 46 48.598 -13.126 2.291 1.00 0.00 O ATOM 0 H SER B 46 46.199 -13.790 -0.565 1.00 0.00 H new ATOM 0 HA SER B 46 47.311 -12.117 0.542 1.00 0.00 H new ATOM 0 HB2 SER B 46 49.111 -14.440 0.779 1.00 0.00 H new ATOM 0 HB3 SER B 46 49.994 -12.926 0.779 1.00 0.00 H new ATOM 0 HG SER B 46 49.253 -13.510 2.911 1.00 0.00 H new ATOM 1750 N ARG B 47 48.081 -11.765 -2.219 1.00 0.00 N ATOM 1751 CA ARG B 47 48.749 -10.993 -3.305 1.00 0.00 C ATOM 1752 C ARG B 47 48.003 -9.677 -3.543 1.00 0.00 C ATOM 1753 O ARG B 47 46.936 -9.652 -4.125 1.00 0.00 O ATOM 1754 CB ARG B 47 48.751 -11.824 -4.591 1.00 0.00 C ATOM 1755 CG ARG B 47 50.140 -12.428 -4.806 1.00 0.00 C ATOM 1756 CD ARG B 47 50.660 -12.040 -6.192 1.00 0.00 C ATOM 1757 NE ARG B 47 50.567 -13.214 -7.104 1.00 0.00 N ATOM 1758 CZ ARG B 47 51.266 -14.289 -6.859 1.00 0.00 C ATOM 1759 NH1 ARG B 47 52.564 -14.213 -6.752 1.00 0.00 N ATOM 1760 NH2 ARG B 47 50.665 -15.438 -6.722 1.00 0.00 N ATOM 0 H ARG B 47 47.141 -12.099 -2.433 1.00 0.00 H new ATOM 0 HA ARG B 47 49.775 -10.772 -3.012 1.00 0.00 H new ATOM 0 HB2 ARG B 47 48.005 -12.616 -4.526 1.00 0.00 H new ATOM 0 HB3 ARG B 47 48.479 -11.198 -5.441 1.00 0.00 H new ATOM 0 HG2 ARG B 47 50.825 -12.072 -4.037 1.00 0.00 H new ATOM 0 HG3 ARG B 47 50.094 -13.513 -4.715 1.00 0.00 H new ATOM 0 HD2 ARG B 47 50.078 -11.209 -6.591 1.00 0.00 H new ATOM 0 HD3 ARG B 47 51.694 -11.701 -6.123 1.00 0.00 H new ATOM 0 HE ARG B 47 49.957 -13.178 -7.921 1.00 0.00 H new ATOM 0 HH11 ARG B 47 53.033 -13.314 -6.860 1.00 0.00 H new ATOM 0 HH12 ARG B 47 53.110 -15.053 -6.561 1.00 0.00 H new ATOM 0 HH21 ARG B 47 49.650 -15.496 -6.806 1.00 0.00 H new ATOM 0 HH22 ARG B 47 51.210 -16.279 -6.531 1.00 0.00 H new ATOM 1774 N GLN B 48 48.560 -8.580 -3.104 1.00 0.00 N ATOM 1775 CA GLN B 48 47.888 -7.266 -3.310 1.00 0.00 C ATOM 1776 C GLN B 48 47.719 -7.016 -4.810 1.00 0.00 C ATOM 1777 O GLN B 48 48.578 -7.352 -5.603 1.00 0.00 O ATOM 1778 CB GLN B 48 48.747 -6.151 -2.702 1.00 0.00 C ATOM 1779 CG GLN B 48 48.277 -4.790 -3.228 1.00 0.00 C ATOM 1780 CD GLN B 48 49.000 -4.469 -4.539 1.00 0.00 C ATOM 1781 OE1 GLN B 48 49.659 -5.318 -5.104 1.00 0.00 O ATOM 1782 NE2 GLN B 48 48.905 -3.269 -5.050 1.00 0.00 N ATOM 0 H GLN B 48 49.452 -8.538 -2.611 1.00 0.00 H new ATOM 0 HA GLN B 48 46.911 -7.276 -2.827 1.00 0.00 H new ATOM 0 HB2 GLN B 48 48.675 -6.176 -1.615 1.00 0.00 H new ATOM 0 HB3 GLN B 48 49.795 -6.307 -2.956 1.00 0.00 H new ATOM 0 HG2 GLN B 48 47.199 -4.804 -3.389 1.00 0.00 H new ATOM 0 HG3 GLN B 48 48.479 -4.014 -2.490 1.00 0.00 H new ATOM 0 HE21 GLN B 48 48.352 -2.555 -4.576 1.00 0.00 H new ATOM 0 HE22 GLN B 48 49.384 -3.047 -5.923 1.00 0.00 H new ATOM 1791 N VAL B 49 46.623 -6.435 -5.209 1.00 0.00 N ATOM 1792 CA VAL B 49 46.416 -6.174 -6.661 1.00 0.00 C ATOM 1793 C VAL B 49 45.879 -4.751 -6.865 1.00 0.00 C ATOM 1794 O VAL B 49 46.217 -3.838 -6.139 1.00 0.00 O ATOM 1795 CB VAL B 49 45.416 -7.190 -7.224 1.00 0.00 C ATOM 1796 CG1 VAL B 49 45.710 -7.428 -8.708 1.00 0.00 C ATOM 1797 CG2 VAL B 49 45.544 -8.512 -6.464 1.00 0.00 C ATOM 0 H VAL B 49 45.865 -6.131 -4.597 1.00 0.00 H new ATOM 0 HA VAL B 49 47.367 -6.272 -7.184 1.00 0.00 H new ATOM 0 HB VAL B 49 44.404 -6.801 -7.109 1.00 0.00 H new ATOM 0 HG11 VAL B 49 44.999 -8.151 -9.108 1.00 0.00 H new ATOM 0 HG12 VAL B 49 45.618 -6.488 -9.252 1.00 0.00 H new ATOM 0 HG13 VAL B 49 46.723 -7.815 -8.821 1.00 0.00 H new ATOM 0 HG21 VAL B 49 44.832 -9.233 -6.866 1.00 0.00 H new ATOM 0 HG22 VAL B 49 46.556 -8.900 -6.577 1.00 0.00 H new ATOM 0 HG23 VAL B 49 45.335 -8.346 -5.407 1.00 0.00 H new ATOM 1807 N CYS B 50 45.042 -4.568 -7.850 1.00 0.00 N ATOM 1808 CA CYS B 50 44.462 -3.233 -8.134 1.00 0.00 C ATOM 1809 C CYS B 50 43.723 -3.327 -9.465 1.00 0.00 C ATOM 1810 O CYS B 50 44.132 -4.052 -10.352 1.00 0.00 O ATOM 1811 CB CYS B 50 45.563 -2.169 -8.226 1.00 0.00 C ATOM 1812 SG CYS B 50 44.980 -0.645 -7.435 1.00 0.00 S ATOM 0 H CYS B 50 44.732 -5.307 -8.481 1.00 0.00 H new ATOM 0 HA CYS B 50 43.785 -2.942 -7.331 1.00 0.00 H new ATOM 0 HB2 CYS B 50 46.471 -2.523 -7.737 1.00 0.00 H new ATOM 0 HB3 CYS B 50 45.816 -1.979 -9.269 1.00 0.00 H new ATOM 1817 N ALA B 51 42.630 -2.639 -9.623 1.00 0.00 N ATOM 1818 CA ALA B 51 41.890 -2.756 -10.909 1.00 0.00 C ATOM 1819 C ALA B 51 41.250 -1.426 -11.298 1.00 0.00 C ATOM 1820 O ALA B 51 41.085 -0.536 -10.488 1.00 0.00 O ATOM 1821 CB ALA B 51 40.797 -3.808 -10.754 1.00 0.00 C ATOM 0 H ALA B 51 42.221 -2.011 -8.931 1.00 0.00 H new ATOM 0 HA ALA B 51 42.593 -3.042 -11.691 1.00 0.00 H new ATOM 0 HB1 ALA B 51 40.248 -3.903 -11.691 1.00 0.00 H new ATOM 0 HB2 ALA B 51 41.248 -4.767 -10.500 1.00 0.00 H new ATOM 0 HB3 ALA B 51 40.113 -3.507 -9.961 1.00 0.00 H new ATOM 1827 N ASP B 52 40.874 -1.307 -12.543 1.00 0.00 N ATOM 1828 CA ASP B 52 40.219 -0.059 -13.024 1.00 0.00 C ATOM 1829 C ASP B 52 39.225 0.425 -11.964 1.00 0.00 C ATOM 1830 O ASP B 52 38.835 -0.331 -11.096 1.00 0.00 O ATOM 1831 CB ASP B 52 39.475 -0.368 -14.329 1.00 0.00 C ATOM 1832 CG ASP B 52 39.939 0.590 -15.428 1.00 0.00 C ATOM 1833 OD1 ASP B 52 41.085 1.004 -15.381 1.00 0.00 O ATOM 1834 OD2 ASP B 52 39.140 0.892 -16.299 1.00 0.00 O ATOM 0 H ASP B 52 40.994 -2.029 -13.253 1.00 0.00 H new ATOM 0 HA ASP B 52 40.964 0.717 -13.200 1.00 0.00 H new ATOM 0 HB2 ASP B 52 39.662 -1.399 -14.630 1.00 0.00 H new ATOM 0 HB3 ASP B 52 38.400 -0.270 -14.178 1.00 0.00 H new ATOM 1839 N PRO B 53 38.844 1.673 -12.062 1.00 0.00 N ATOM 1840 CA PRO B 53 37.894 2.285 -11.117 1.00 0.00 C ATOM 1841 C PRO B 53 36.461 1.837 -11.426 1.00 0.00 C ATOM 1842 O PRO B 53 35.511 2.320 -10.843 1.00 0.00 O ATOM 1843 CB PRO B 53 38.063 3.787 -11.357 1.00 0.00 C ATOM 1844 CG PRO B 53 38.658 3.936 -12.778 1.00 0.00 C ATOM 1845 CD PRO B 53 39.322 2.589 -13.119 1.00 0.00 C ATOM 0 HA PRO B 53 38.080 2.001 -10.081 1.00 0.00 H new ATOM 0 HB2 PRO B 53 37.106 4.303 -11.280 1.00 0.00 H new ATOM 0 HB3 PRO B 53 38.724 4.228 -10.611 1.00 0.00 H new ATOM 0 HG2 PRO B 53 37.879 4.178 -13.501 1.00 0.00 H new ATOM 0 HG3 PRO B 53 39.386 4.746 -12.810 1.00 0.00 H new ATOM 0 HD2 PRO B 53 39.031 2.241 -14.110 1.00 0.00 H new ATOM 0 HD3 PRO B 53 40.409 2.668 -13.116 1.00 0.00 H new ATOM 1853 N SER B 54 36.297 0.914 -12.334 1.00 0.00 N ATOM 1854 CA SER B 54 34.927 0.438 -12.670 1.00 0.00 C ATOM 1855 C SER B 54 34.997 -1.003 -13.179 1.00 0.00 C ATOM 1856 O SER B 54 34.177 -1.431 -13.966 1.00 0.00 O ATOM 1857 CB SER B 54 34.330 1.332 -13.757 1.00 0.00 C ATOM 1858 OG SER B 54 33.670 2.434 -13.150 1.00 0.00 O ATOM 0 H SER B 54 37.052 0.470 -12.857 1.00 0.00 H new ATOM 0 HA SER B 54 34.300 0.479 -11.779 1.00 0.00 H new ATOM 0 HB2 SER B 54 35.116 1.687 -14.424 1.00 0.00 H new ATOM 0 HB3 SER B 54 33.627 0.763 -14.366 1.00 0.00 H new ATOM 0 HG SER B 54 34.099 2.641 -12.293 1.00 0.00 H new ATOM 1864 N GLU B 55 35.969 -1.757 -12.740 1.00 0.00 N ATOM 1865 CA GLU B 55 36.075 -3.169 -13.208 1.00 0.00 C ATOM 1866 C GLU B 55 34.829 -3.930 -12.815 1.00 0.00 C ATOM 1867 O GLU B 55 34.496 -4.089 -11.660 1.00 0.00 O ATOM 1868 CB GLU B 55 37.312 -3.841 -12.609 1.00 0.00 C ATOM 1869 CG GLU B 55 38.572 -3.208 -13.202 1.00 0.00 C ATOM 1870 CD GLU B 55 38.781 -3.709 -14.634 1.00 0.00 C ATOM 1871 OE1 GLU B 55 37.809 -3.785 -15.365 1.00 0.00 O ATOM 1872 OE2 GLU B 55 39.914 -4.007 -14.976 1.00 0.00 O ATOM 0 H GLU B 55 36.689 -1.459 -12.082 1.00 0.00 H new ATOM 0 HA GLU B 55 36.172 -3.174 -14.294 1.00 0.00 H new ATOM 0 HB2 GLU B 55 37.311 -3.729 -11.525 1.00 0.00 H new ATOM 0 HB3 GLU B 55 37.296 -4.911 -12.819 1.00 0.00 H new ATOM 0 HG2 GLU B 55 38.481 -2.122 -13.197 1.00 0.00 H new ATOM 0 HG3 GLU B 55 39.438 -3.458 -12.590 1.00 0.00 H new ATOM 1879 N GLU B 56 34.150 -4.394 -13.805 1.00 0.00 N ATOM 1880 CA GLU B 56 32.904 -5.168 -13.611 1.00 0.00 C ATOM 1881 C GLU B 56 32.959 -6.000 -12.319 1.00 0.00 C ATOM 1882 O GLU B 56 31.954 -6.228 -11.677 1.00 0.00 O ATOM 1883 CB GLU B 56 32.767 -6.079 -14.826 1.00 0.00 C ATOM 1884 CG GLU B 56 31.840 -7.259 -14.515 1.00 0.00 C ATOM 1885 CD GLU B 56 31.171 -7.739 -15.804 1.00 0.00 C ATOM 1886 OE1 GLU B 56 31.383 -7.111 -16.829 1.00 0.00 O ATOM 1887 OE2 GLU B 56 30.458 -8.728 -15.746 1.00 0.00 O ATOM 0 H GLU B 56 34.414 -4.266 -14.782 1.00 0.00 H new ATOM 0 HA GLU B 56 32.048 -4.500 -13.516 1.00 0.00 H new ATOM 0 HB2 GLU B 56 32.372 -5.512 -15.669 1.00 0.00 H new ATOM 0 HB3 GLU B 56 33.749 -6.449 -15.122 1.00 0.00 H new ATOM 0 HG2 GLU B 56 32.409 -8.072 -14.064 1.00 0.00 H new ATOM 0 HG3 GLU B 56 31.083 -6.959 -13.790 1.00 0.00 H new ATOM 1894 N TRP B 57 34.114 -6.477 -11.952 1.00 0.00 N ATOM 1895 CA TRP B 57 34.220 -7.315 -10.731 1.00 0.00 C ATOM 1896 C TRP B 57 34.553 -6.479 -9.493 1.00 0.00 C ATOM 1897 O TRP B 57 34.064 -6.753 -8.416 1.00 0.00 O ATOM 1898 CB TRP B 57 35.288 -8.374 -10.968 1.00 0.00 C ATOM 1899 CG TRP B 57 36.564 -7.786 -11.486 1.00 0.00 C ATOM 1900 CD1 TRP B 57 36.817 -7.509 -12.782 1.00 0.00 C ATOM 1901 CD2 TRP B 57 37.780 -7.451 -10.760 1.00 0.00 C ATOM 1902 NE1 TRP B 57 38.107 -7.044 -12.903 1.00 0.00 N ATOM 1903 CE2 TRP B 57 38.741 -6.980 -11.684 1.00 0.00 C ATOM 1904 CE3 TRP B 57 38.140 -7.511 -9.409 1.00 0.00 C ATOM 1905 CZ2 TRP B 57 40.011 -6.589 -11.284 1.00 0.00 C ATOM 1906 CZ3 TRP B 57 39.423 -7.116 -8.999 1.00 0.00 C ATOM 1907 CH2 TRP B 57 40.357 -6.659 -9.936 1.00 0.00 C ATOM 0 H TRP B 57 34.991 -6.321 -12.448 1.00 0.00 H new ATOM 0 HA TRP B 57 33.256 -7.787 -10.539 1.00 0.00 H new ATOM 0 HB2 TRP B 57 35.486 -8.903 -10.036 1.00 0.00 H new ATOM 0 HB3 TRP B 57 34.915 -9.111 -11.679 1.00 0.00 H new ATOM 0 HD1 TRP B 57 36.118 -7.633 -13.596 1.00 0.00 H new ATOM 0 HE1 TRP B 57 38.540 -6.779 -13.788 1.00 0.00 H new ATOM 0 HE3 TRP B 57 37.427 -7.863 -8.678 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 40.725 -6.233 -12.012 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 39.691 -7.165 -7.954 1.00 0.00 H new ATOM 0 HH2 TRP B 57 41.344 -6.361 -9.615 1.00 0.00 H new ATOM 1918 N VAL B 58 35.368 -5.468 -9.607 1.00 0.00 N ATOM 1919 CA VAL B 58 35.678 -4.668 -8.390 1.00 0.00 C ATOM 1920 C VAL B 58 34.455 -3.846 -7.984 1.00 0.00 C ATOM 1921 O VAL B 58 34.344 -3.402 -6.860 1.00 0.00 O ATOM 1922 CB VAL B 58 36.852 -3.727 -8.637 1.00 0.00 C ATOM 1923 CG1 VAL B 58 36.451 -2.656 -9.649 1.00 0.00 C ATOM 1924 CG2 VAL B 58 37.218 -3.062 -7.312 1.00 0.00 C ATOM 0 H VAL B 58 35.823 -5.166 -10.468 1.00 0.00 H new ATOM 0 HA VAL B 58 35.945 -5.360 -7.591 1.00 0.00 H new ATOM 0 HB VAL B 58 37.702 -4.284 -9.031 1.00 0.00 H new ATOM 0 HG11 VAL B 58 37.293 -1.986 -9.822 1.00 0.00 H new ATOM 0 HG12 VAL B 58 36.166 -3.131 -10.588 1.00 0.00 H new ATOM 0 HG13 VAL B 58 35.607 -2.086 -9.260 1.00 0.00 H new ATOM 0 HG21 VAL B 58 38.057 -2.383 -7.465 1.00 0.00 H new ATOM 0 HG22 VAL B 58 36.362 -2.501 -6.937 1.00 0.00 H new ATOM 0 HG23 VAL B 58 37.497 -3.826 -6.586 1.00 0.00 H new ATOM 1934 N GLN B 59 33.528 -3.646 -8.880 1.00 0.00 N ATOM 1935 CA GLN B 59 32.310 -2.867 -8.523 1.00 0.00 C ATOM 1936 C GLN B 59 31.483 -3.702 -7.554 1.00 0.00 C ATOM 1937 O GLN B 59 30.970 -3.216 -6.566 1.00 0.00 O ATOM 1938 CB GLN B 59 31.492 -2.590 -9.781 1.00 0.00 C ATOM 1939 CG GLN B 59 31.888 -1.232 -10.363 1.00 0.00 C ATOM 1940 CD GLN B 59 31.680 -0.145 -9.305 1.00 0.00 C ATOM 1941 OE1 GLN B 59 30.917 -0.321 -8.377 1.00 0.00 O ATOM 1942 NE2 GLN B 59 32.332 0.982 -9.409 1.00 0.00 N ATOM 0 H GLN B 59 33.561 -3.987 -9.841 1.00 0.00 H new ATOM 0 HA GLN B 59 32.589 -1.917 -8.066 1.00 0.00 H new ATOM 0 HB2 GLN B 59 31.661 -3.376 -10.517 1.00 0.00 H new ATOM 0 HB3 GLN B 59 30.428 -2.599 -9.544 1.00 0.00 H new ATOM 0 HG2 GLN B 59 32.930 -1.250 -10.681 1.00 0.00 H new ATOM 0 HG3 GLN B 59 31.289 -1.014 -11.247 1.00 0.00 H new ATOM 0 HE21 GLN B 59 32.973 1.130 -10.188 1.00 0.00 H new ATOM 0 HE22 GLN B 59 32.200 1.714 -8.711 1.00 0.00 H new ATOM 1951 N LYS B 60 31.367 -4.969 -7.832 1.00 0.00 N ATOM 1952 CA LYS B 60 30.594 -5.869 -6.937 1.00 0.00 C ATOM 1953 C LYS B 60 31.373 -6.043 -5.635 1.00 0.00 C ATOM 1954 O LYS B 60 30.813 -6.049 -4.557 1.00 0.00 O ATOM 1955 CB LYS B 60 30.419 -7.234 -7.626 1.00 0.00 C ATOM 1956 CG LYS B 60 30.153 -8.336 -6.589 1.00 0.00 C ATOM 1957 CD LYS B 60 28.962 -9.181 -7.043 1.00 0.00 C ATOM 1958 CE LYS B 60 28.650 -10.243 -5.986 1.00 0.00 C ATOM 1959 NZ LYS B 60 27.184 -10.513 -5.967 1.00 0.00 N ATOM 0 H LYS B 60 31.778 -5.422 -8.648 1.00 0.00 H new ATOM 0 HA LYS B 60 29.612 -5.446 -6.726 1.00 0.00 H new ATOM 0 HB2 LYS B 60 29.591 -7.186 -8.334 1.00 0.00 H new ATOM 0 HB3 LYS B 60 31.314 -7.475 -8.199 1.00 0.00 H new ATOM 0 HG2 LYS B 60 31.036 -8.964 -6.474 1.00 0.00 H new ATOM 0 HG3 LYS B 60 29.948 -7.893 -5.615 1.00 0.00 H new ATOM 0 HD2 LYS B 60 28.091 -8.544 -7.201 1.00 0.00 H new ATOM 0 HD3 LYS B 60 29.185 -9.658 -7.997 1.00 0.00 H new ATOM 0 HE2 LYS B 60 29.196 -11.160 -6.205 1.00 0.00 H new ATOM 0 HE3 LYS B 60 28.980 -9.902 -5.005 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 26.973 -11.235 -5.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 26.673 -9.637 -5.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 26.882 -10.856 -6.901 1.00 0.00 H new ATOM 1973 N TYR B 61 32.659 -6.225 -5.735 1.00 0.00 N ATOM 1974 CA TYR B 61 33.479 -6.447 -4.510 1.00 0.00 C ATOM 1975 C TYR B 61 33.613 -5.145 -3.717 1.00 0.00 C ATOM 1976 O TYR B 61 33.896 -5.156 -2.535 1.00 0.00 O ATOM 1977 CB TYR B 61 34.863 -6.986 -4.901 1.00 0.00 C ATOM 1978 CG TYR B 61 34.743 -7.981 -6.024 1.00 0.00 C ATOM 1979 CD1 TYR B 61 33.507 -8.544 -6.363 1.00 0.00 C ATOM 1980 CD2 TYR B 61 35.885 -8.332 -6.735 1.00 0.00 C ATOM 1981 CE1 TYR B 61 33.417 -9.445 -7.414 1.00 0.00 C ATOM 1982 CE2 TYR B 61 35.797 -9.237 -7.785 1.00 0.00 C ATOM 1983 CZ TYR B 61 34.563 -9.796 -8.132 1.00 0.00 C ATOM 1984 OH TYR B 61 34.479 -10.695 -9.176 1.00 0.00 O ATOM 0 H TYR B 61 33.179 -6.230 -6.612 1.00 0.00 H new ATOM 0 HA TYR B 61 32.982 -7.182 -3.877 1.00 0.00 H new ATOM 0 HB2 TYR B 61 35.508 -6.162 -5.205 1.00 0.00 H new ATOM 0 HB3 TYR B 61 35.333 -7.458 -4.038 1.00 0.00 H new ATOM 0 HD1 TYR B 61 32.622 -8.276 -5.805 1.00 0.00 H new ATOM 0 HD2 TYR B 61 36.840 -7.901 -6.471 1.00 0.00 H new ATOM 0 HE1 TYR B 61 32.462 -9.875 -7.677 1.00 0.00 H new ATOM 0 HE2 TYR B 61 36.685 -9.510 -8.336 1.00 0.00 H new ATOM 0 HH TYR B 61 35.359 -10.790 -9.598 1.00 0.00 H new ATOM 1994 N VAL B 62 33.403 -4.026 -4.349 1.00 0.00 N ATOM 1995 CA VAL B 62 33.505 -2.727 -3.624 1.00 0.00 C ATOM 1996 C VAL B 62 32.103 -2.206 -3.291 1.00 0.00 C ATOM 1997 O VAL B 62 31.945 -1.261 -2.543 1.00 0.00 O ATOM 1998 CB VAL B 62 34.223 -1.704 -4.505 1.00 0.00 C ATOM 1999 CG1 VAL B 62 34.322 -0.373 -3.759 1.00 0.00 C ATOM 2000 CG2 VAL B 62 35.628 -2.209 -4.832 1.00 0.00 C ATOM 0 H VAL B 62 33.165 -3.953 -5.338 1.00 0.00 H new ATOM 0 HA VAL B 62 34.066 -2.877 -2.702 1.00 0.00 H new ATOM 0 HB VAL B 62 33.663 -1.564 -5.430 1.00 0.00 H new ATOM 0 HG11 VAL B 62 34.834 0.358 -4.385 1.00 0.00 H new ATOM 0 HG12 VAL B 62 33.321 -0.012 -3.524 1.00 0.00 H new ATOM 0 HG13 VAL B 62 34.882 -0.515 -2.835 1.00 0.00 H new ATOM 0 HG21 VAL B 62 36.140 -1.480 -5.460 1.00 0.00 H new ATOM 0 HG22 VAL B 62 36.189 -2.349 -3.908 1.00 0.00 H new ATOM 0 HG23 VAL B 62 35.559 -3.159 -5.362 1.00 0.00 H new ATOM 2010 N SER B 63 31.085 -2.801 -3.852 1.00 0.00 N ATOM 2011 CA SER B 63 29.698 -2.320 -3.579 1.00 0.00 C ATOM 2012 C SER B 63 29.139 -2.989 -2.319 1.00 0.00 C ATOM 2013 O SER B 63 28.334 -2.417 -1.611 1.00 0.00 O ATOM 2014 CB SER B 63 28.799 -2.661 -4.768 1.00 0.00 C ATOM 2015 OG SER B 63 27.444 -2.688 -4.339 1.00 0.00 O ATOM 0 H SER B 63 31.152 -3.597 -4.486 1.00 0.00 H new ATOM 0 HA SER B 63 29.724 -1.241 -3.427 1.00 0.00 H new ATOM 0 HB2 SER B 63 28.927 -1.923 -5.559 1.00 0.00 H new ATOM 0 HB3 SER B 63 29.080 -3.628 -5.186 1.00 0.00 H new ATOM 0 HG SER B 63 26.865 -2.905 -5.099 1.00 0.00 H new