USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 1090 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 47 CYS SG : rot -96:sc= 1.19 USER MOD Set 1.2: A 49 THR OG1 : rot 150:sc= 1.07 USER MOD Single : A 5 LYS NZ :NH3+ -105:sc= 0.523 (180deg=-0.0187) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.532 K(o=-0.53,f=-1.1) USER MOD Single : A 28 TYR OH : rot 130:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 166:sc= -5.27! (180deg=-5.55!) USER MOD Single : A 45 HIS : no HD1:sc= -0.0238 K(o=-0.024,f=-0.83) USER MOD Single : A 48 GLN : amide:sc= -0.401 K(o=-0.4,f=-3.1!) USER MOD Single : A 54 HIS : no HD1:sc= -4.75! C(o=-4.7!,f=-12!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -1.16 K(o=-1.2,f=-2.6!) USER MOD Single : A 74 THR OG1 : rot -160:sc= 0.0707 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0.00631 USER MOD Single : A 102 TYR OH : rot 109:sc= 0.13 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.102 USER MOD Single : A 127 GLN : amide:sc= -5.36! C(o=-5.4!,f=-7.1!) USER MOD Single : A 129 GLN : amide:sc= -0.0893 K(o=-0.089,f=-5.8!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot -41:sc= 1.05 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 10.831 -4.004 6.615 1.00 0.00 N ATOM 19 CA VAL A 2 10.132 -3.432 5.477 1.00 0.00 C ATOM 20 C VAL A 2 10.642 -4.085 4.190 1.00 0.00 C ATOM 21 O VAL A 2 11.836 -4.347 4.054 1.00 0.00 O ATOM 22 CB VAL A 2 10.288 -1.910 5.477 1.00 0.00 C ATOM 23 CG1 VAL A 2 9.340 -1.262 4.466 1.00 0.00 C ATOM 24 CG2 VAL A 2 10.070 -1.337 6.879 1.00 0.00 C ATOM 0 HA VAL A 2 9.063 -3.635 5.544 1.00 0.00 H new ATOM 0 HB VAL A 2 11.309 -1.677 5.175 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.471 -0.180 4.486 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.563 -1.636 3.467 1.00 0.00 H new ATOM 0 HG13 VAL A 2 8.310 -1.508 4.724 1.00 0.00 H new ATOM 0 HG21 VAL A 2 10.187 -0.254 6.851 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.065 -1.585 7.221 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.803 -1.763 7.564 1.00 0.00 H new ATOM 34 N PRO A 3 9.687 -4.336 3.255 1.00 0.00 N ATOM 35 CA PRO A 3 10.027 -4.953 1.985 1.00 0.00 C ATOM 36 C PRO A 3 10.721 -3.953 1.058 1.00 0.00 C ATOM 37 O PRO A 3 10.741 -2.755 1.335 1.00 0.00 O ATOM 38 CB PRO A 3 8.707 -5.462 1.429 1.00 0.00 C ATOM 39 CG PRO A 3 7.621 -4.707 2.177 1.00 0.00 C ATOM 40 CD PRO A 3 8.263 -4.040 3.382 1.00 0.00 C ATOM 0 HA PRO A 3 10.740 -5.770 2.092 1.00 0.00 H new ATOM 0 HB2 PRO A 3 8.640 -5.282 0.356 1.00 0.00 H new ATOM 0 HB3 PRO A 3 8.609 -6.537 1.578 1.00 0.00 H new ATOM 0 HG2 PRO A 3 7.159 -3.962 1.529 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.831 -5.388 2.493 1.00 0.00 H new ATOM 0 HD2 PRO A 3 8.081 -2.965 3.384 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.858 -4.433 4.315 1.00 0.00 H new ATOM 48 N PRO A 4 11.289 -4.497 -0.052 1.00 0.00 N ATOM 49 CA PRO A 4 11.982 -3.665 -1.022 1.00 0.00 C ATOM 50 C PRO A 4 10.989 -2.874 -1.875 1.00 0.00 C ATOM 51 O PRO A 4 11.153 -1.670 -2.068 1.00 0.00 O ATOM 52 CB PRO A 4 12.826 -4.632 -1.836 1.00 0.00 C ATOM 53 CG PRO A 4 12.226 -6.009 -1.602 1.00 0.00 C ATOM 54 CD PRO A 4 11.286 -5.912 -0.412 1.00 0.00 C ATOM 0 HA PRO A 4 12.609 -2.906 -0.554 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.806 -4.372 -2.894 1.00 0.00 H new ATOM 0 HB3 PRO A 4 13.869 -4.602 -1.520 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.687 -6.346 -2.488 1.00 0.00 H new ATOM 0 HG3 PRO A 4 13.011 -6.740 -1.409 1.00 0.00 H new ATOM 0 HD2 PRO A 4 10.283 -6.253 -0.670 1.00 0.00 H new ATOM 0 HD3 PRO A 4 11.630 -6.532 0.416 1.00 0.00 H new ATOM 62 N LYS A 5 9.981 -3.582 -2.363 1.00 0.00 N ATOM 63 CA LYS A 5 8.962 -2.961 -3.191 1.00 0.00 C ATOM 64 C LYS A 5 8.625 -1.579 -2.627 1.00 0.00 C ATOM 65 O LYS A 5 8.546 -0.603 -3.371 1.00 0.00 O ATOM 66 CB LYS A 5 7.748 -3.882 -3.328 1.00 0.00 C ATOM 67 CG LYS A 5 7.659 -4.464 -4.740 1.00 0.00 C ATOM 68 CD LYS A 5 7.102 -3.434 -5.724 1.00 0.00 C ATOM 69 CE LYS A 5 5.587 -3.587 -5.880 1.00 0.00 C ATOM 70 NZ LYS A 5 5.057 -2.568 -6.814 1.00 0.00 N ATOM 0 H LYS A 5 9.848 -4.580 -2.201 1.00 0.00 H new ATOM 0 HA LYS A 5 9.334 -2.810 -4.204 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.817 -4.691 -2.601 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.838 -3.326 -3.102 1.00 0.00 H new ATOM 0 HG2 LYS A 5 8.647 -4.787 -5.067 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.021 -5.348 -4.733 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.335 -2.428 -5.374 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.585 -3.554 -6.694 1.00 0.00 H new ATOM 0 HE2 LYS A 5 5.352 -4.585 -6.250 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.103 -3.485 -4.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 4.564 -1.827 -6.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 5.843 -2.144 -7.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 4.391 -3.016 -7.476 1.00 0.00 H new ATOM 84 N LEU A 6 8.435 -1.541 -1.316 1.00 0.00 N ATOM 85 CA LEU A 6 8.108 -0.295 -0.643 1.00 0.00 C ATOM 86 C LEU A 6 9.382 0.534 -0.467 1.00 0.00 C ATOM 87 O LEU A 6 9.460 1.665 -0.943 1.00 0.00 O ATOM 88 CB LEU A 6 7.368 -0.572 0.668 1.00 0.00 C ATOM 89 CG LEU A 6 6.908 0.659 1.451 1.00 0.00 C ATOM 90 CD1 LEU A 6 5.620 1.235 0.859 1.00 0.00 C ATOM 91 CD2 LEU A 6 6.760 0.338 2.940 1.00 0.00 C ATOM 0 H LEU A 6 8.501 -2.353 -0.702 1.00 0.00 H new ATOM 0 HA LEU A 6 7.423 0.297 -1.250 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.494 -1.185 0.446 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.018 -1.165 1.311 1.00 0.00 H new ATOM 0 HG LEU A 6 7.676 1.427 1.362 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.314 2.109 1.434 1.00 0.00 H new ATOM 0 HD12 LEU A 6 5.794 1.525 -0.177 1.00 0.00 H new ATOM 0 HD13 LEU A 6 4.833 0.482 0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 6 6.432 1.230 3.474 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.023 -0.454 3.070 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.720 0.009 3.338 1.00 0.00 H new ATOM 103 N LYS A 7 10.347 -0.062 0.217 1.00 0.00 N ATOM 104 CA LYS A 7 11.613 0.608 0.462 1.00 0.00 C ATOM 105 C LYS A 7 12.049 1.345 -0.806 1.00 0.00 C ATOM 106 O LYS A 7 12.669 2.404 -0.731 1.00 0.00 O ATOM 107 CB LYS A 7 12.653 -0.386 0.984 1.00 0.00 C ATOM 108 CG LYS A 7 13.839 0.343 1.618 1.00 0.00 C ATOM 109 CD LYS A 7 13.942 0.027 3.111 1.00 0.00 C ATOM 110 CE LYS A 7 15.131 0.753 3.745 1.00 0.00 C ATOM 111 NZ LYS A 7 15.542 0.079 4.997 1.00 0.00 N ATOM 0 H LYS A 7 10.278 -1.001 0.609 1.00 0.00 H new ATOM 0 HA LYS A 7 11.502 1.358 1.245 1.00 0.00 H new ATOM 0 HB2 LYS A 7 12.193 -1.047 1.719 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.003 -1.015 0.165 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.761 0.050 1.116 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.727 1.418 1.477 1.00 0.00 H new ATOM 0 HD2 LYS A 7 13.021 0.323 3.613 1.00 0.00 H new ATOM 0 HD3 LYS A 7 14.051 -1.048 3.252 1.00 0.00 H new ATOM 0 HE2 LYS A 7 15.967 0.775 3.045 1.00 0.00 H new ATOM 0 HE3 LYS A 7 14.863 1.789 3.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 16.350 0.584 5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.748 0.081 5.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 15.817 -0.902 4.789 1.00 0.00 H new ATOM 125 N GLN A 8 11.708 0.754 -1.942 1.00 0.00 N ATOM 126 CA GLN A 8 12.056 1.341 -3.225 1.00 0.00 C ATOM 127 C GLN A 8 11.276 2.639 -3.444 1.00 0.00 C ATOM 128 O GLN A 8 11.855 3.659 -3.816 1.00 0.00 O ATOM 129 CB GLN A 8 11.806 0.353 -4.366 1.00 0.00 C ATOM 130 CG GLN A 8 13.027 0.253 -5.283 1.00 0.00 C ATOM 131 CD GLN A 8 12.669 0.643 -6.718 1.00 0.00 C ATOM 132 OE1 GLN A 8 12.551 1.808 -7.061 1.00 0.00 O ATOM 133 NE2 GLN A 8 12.502 -0.393 -7.535 1.00 0.00 N ATOM 0 H GLN A 8 11.194 -0.125 -2.001 1.00 0.00 H new ATOM 0 HA GLN A 8 13.120 1.576 -3.218 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.573 -0.630 -3.956 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.938 0.671 -4.944 1.00 0.00 H new ATOM 0 HG2 GLN A 8 13.819 0.904 -4.912 1.00 0.00 H new ATOM 0 HG3 GLN A 8 13.417 -0.765 -5.266 1.00 0.00 H new ATOM 0 HE21 GLN A 8 12.616 -1.344 -7.183 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.260 -0.237 -8.514 1.00 0.00 H new ATOM 142 N ALA A 9 9.976 2.559 -3.204 1.00 0.00 N ATOM 143 CA ALA A 9 9.112 3.715 -3.370 1.00 0.00 C ATOM 144 C ALA A 9 9.517 4.798 -2.368 1.00 0.00 C ATOM 145 O ALA A 9 9.733 5.948 -2.746 1.00 0.00 O ATOM 146 CB ALA A 9 7.651 3.288 -3.208 1.00 0.00 C ATOM 0 H ALA A 9 9.500 1.711 -2.896 1.00 0.00 H new ATOM 0 HA ALA A 9 9.221 4.134 -4.370 1.00 0.00 H new ATOM 0 HB1 ALA A 9 7.003 4.155 -3.332 1.00 0.00 H new ATOM 0 HB2 ALA A 9 7.405 2.540 -3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.504 2.865 -2.214 1.00 0.00 H new ATOM 152 N LEU A 10 9.608 4.391 -1.110 1.00 0.00 N ATOM 153 CA LEU A 10 9.983 5.312 -0.051 1.00 0.00 C ATOM 154 C LEU A 10 11.304 5.993 -0.418 1.00 0.00 C ATOM 155 O LEU A 10 11.353 7.210 -0.587 1.00 0.00 O ATOM 156 CB LEU A 10 10.016 4.593 1.298 1.00 0.00 C ATOM 157 CG LEU A 10 8.656 4.302 1.937 1.00 0.00 C ATOM 158 CD1 LEU A 10 8.820 3.536 3.251 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.851 5.589 2.121 1.00 0.00 C ATOM 0 H LEU A 10 9.428 3.436 -0.801 1.00 0.00 H new ATOM 0 HA LEU A 10 9.236 6.099 0.052 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.545 3.648 1.171 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.601 5.195 1.994 1.00 0.00 H new ATOM 0 HG LEU A 10 8.090 3.662 1.260 1.00 0.00 H new ATOM 0 HD11 LEU A 10 7.839 3.342 3.684 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.326 2.589 3.060 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.413 4.130 3.947 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.889 5.354 2.577 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.401 6.273 2.767 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.688 6.058 1.151 1.00 0.00 H new ATOM 171 N GLU A 11 12.342 5.177 -0.529 1.00 0.00 N ATOM 172 CA GLU A 11 13.659 5.685 -0.872 1.00 0.00 C ATOM 173 C GLU A 11 13.581 6.559 -2.125 1.00 0.00 C ATOM 174 O GLU A 11 14.106 7.671 -2.145 1.00 0.00 O ATOM 175 CB GLU A 11 14.656 4.540 -1.064 1.00 0.00 C ATOM 176 CG GLU A 11 15.109 3.977 0.285 1.00 0.00 C ATOM 177 CD GLU A 11 16.434 3.224 0.147 1.00 0.00 C ATOM 178 OE1 GLU A 11 16.521 2.394 -0.784 1.00 0.00 O ATOM 179 OE2 GLU A 11 17.330 3.495 0.975 1.00 0.00 O ATOM 0 H GLU A 11 12.297 4.168 -0.387 1.00 0.00 H new ATOM 0 HA GLU A 11 14.016 6.299 -0.045 1.00 0.00 H new ATOM 0 HB2 GLU A 11 14.197 3.749 -1.657 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.521 4.896 -1.623 1.00 0.00 H new ATOM 0 HG2 GLU A 11 15.221 4.789 1.003 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.345 3.307 0.679 1.00 0.00 H new ATOM 186 N LEU A 12 12.922 6.023 -3.142 1.00 0.00 N ATOM 187 CA LEU A 12 12.768 6.740 -4.396 1.00 0.00 C ATOM 188 C LEU A 12 12.171 8.122 -4.119 1.00 0.00 C ATOM 189 O LEU A 12 12.844 9.138 -4.287 1.00 0.00 O ATOM 190 CB LEU A 12 11.958 5.909 -5.393 1.00 0.00 C ATOM 191 CG LEU A 12 11.407 6.664 -6.604 1.00 0.00 C ATOM 192 CD1 LEU A 12 10.250 7.581 -6.199 1.00 0.00 C ATOM 193 CD2 LEU A 12 12.518 7.429 -7.326 1.00 0.00 C ATOM 0 H LEU A 12 12.488 5.100 -3.123 1.00 0.00 H new ATOM 0 HA LEU A 12 13.739 6.900 -4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.587 5.095 -5.753 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.122 5.455 -4.862 1.00 0.00 H new ATOM 0 HG LEU A 12 11.008 5.934 -7.308 1.00 0.00 H new ATOM 0 HD11 LEU A 12 9.877 8.106 -7.078 1.00 0.00 H new ATOM 0 HD12 LEU A 12 9.448 6.984 -5.765 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.601 8.307 -5.465 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.099 7.957 -8.183 1.00 0.00 H new ATOM 0 HD22 LEU A 12 12.969 8.148 -6.642 1.00 0.00 H new ATOM 0 HD23 LEU A 12 13.279 6.728 -7.669 1.00 0.00 H new ATOM 205 N PHE A 13 10.914 8.114 -3.700 1.00 0.00 N ATOM 206 CA PHE A 13 10.219 9.354 -3.398 1.00 0.00 C ATOM 207 C PHE A 13 11.141 10.338 -2.674 1.00 0.00 C ATOM 208 O PHE A 13 11.405 11.429 -3.175 1.00 0.00 O ATOM 209 CB PHE A 13 9.049 8.998 -2.478 1.00 0.00 C ATOM 210 CG PHE A 13 8.099 10.164 -2.200 1.00 0.00 C ATOM 211 CD1 PHE A 13 7.472 10.791 -3.231 1.00 0.00 C ATOM 212 CD2 PHE A 13 7.882 10.575 -0.921 1.00 0.00 C ATOM 213 CE1 PHE A 13 6.590 11.874 -2.973 1.00 0.00 C ATOM 214 CE2 PHE A 13 7.000 11.657 -0.663 1.00 0.00 C ATOM 215 CZ PHE A 13 6.372 12.284 -1.694 1.00 0.00 C ATOM 0 H PHE A 13 10.359 7.269 -3.563 1.00 0.00 H new ATOM 0 HA PHE A 13 9.882 9.826 -4.321 1.00 0.00 H new ATOM 0 HB2 PHE A 13 8.484 8.181 -2.926 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.444 8.631 -1.531 1.00 0.00 H new ATOM 0 HD1 PHE A 13 7.645 10.465 -4.246 1.00 0.00 H new ATOM 0 HD2 PHE A 13 8.381 10.078 -0.102 1.00 0.00 H new ATOM 0 HE1 PHE A 13 6.092 12.372 -3.792 1.00 0.00 H new ATOM 0 HE2 PHE A 13 6.828 11.983 0.352 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.701 13.107 -1.497 1.00 0.00 H new ATOM 225 N LYS A 14 11.605 9.915 -1.507 1.00 0.00 N ATOM 226 CA LYS A 14 12.492 10.745 -0.710 1.00 0.00 C ATOM 227 C LYS A 14 13.582 11.330 -1.610 1.00 0.00 C ATOM 228 O LYS A 14 14.041 12.450 -1.388 1.00 0.00 O ATOM 229 CB LYS A 14 13.037 9.955 0.482 1.00 0.00 C ATOM 230 CG LYS A 14 14.125 10.746 1.212 1.00 0.00 C ATOM 231 CD LYS A 14 14.814 9.881 2.270 1.00 0.00 C ATOM 232 CE LYS A 14 15.064 10.679 3.551 1.00 0.00 C ATOM 233 NZ LYS A 14 16.506 10.684 3.885 1.00 0.00 N ATOM 0 H LYS A 14 11.383 9.009 -1.095 1.00 0.00 H new ATOM 0 HA LYS A 14 11.946 11.586 -0.283 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.225 9.724 1.172 1.00 0.00 H new ATOM 0 HB3 LYS A 14 13.443 9.004 0.138 1.00 0.00 H new ATOM 0 HG2 LYS A 14 14.862 11.105 0.494 1.00 0.00 H new ATOM 0 HG3 LYS A 14 13.686 11.625 1.685 1.00 0.00 H new ATOM 0 HD2 LYS A 14 14.196 9.012 2.493 1.00 0.00 H new ATOM 0 HD3 LYS A 14 15.760 9.507 1.879 1.00 0.00 H new ATOM 0 HE2 LYS A 14 14.710 11.702 3.424 1.00 0.00 H new ATOM 0 HE3 LYS A 14 14.496 10.245 4.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 16.658 11.230 4.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 16.833 9.707 4.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 17.041 11.119 3.106 1.00 0.00 H new ATOM 247 N SER A 15 13.965 10.547 -2.607 1.00 0.00 N ATOM 248 CA SER A 15 14.993 10.973 -3.542 1.00 0.00 C ATOM 249 C SER A 15 14.404 11.959 -4.553 1.00 0.00 C ATOM 250 O SER A 15 15.059 12.927 -4.936 1.00 0.00 O ATOM 251 CB SER A 15 15.611 9.775 -4.266 1.00 0.00 C ATOM 252 OG SER A 15 16.871 10.096 -4.849 1.00 0.00 O ATOM 0 H SER A 15 13.582 9.619 -2.788 1.00 0.00 H new ATOM 0 HA SER A 15 15.784 11.469 -2.979 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.736 8.951 -3.563 1.00 0.00 H new ATOM 0 HB3 SER A 15 14.929 9.430 -5.043 1.00 0.00 H new ATOM 0 HG SER A 15 17.234 9.305 -5.300 1.00 0.00 H new ATOM 258 N LEU A 16 13.174 11.677 -4.958 1.00 0.00 N ATOM 259 CA LEU A 16 12.489 12.527 -5.918 1.00 0.00 C ATOM 260 C LEU A 16 12.468 13.965 -5.396 1.00 0.00 C ATOM 261 O LEU A 16 12.536 14.192 -4.189 1.00 0.00 O ATOM 262 CB LEU A 16 11.101 11.967 -6.234 1.00 0.00 C ATOM 263 CG LEU A 16 11.049 10.854 -7.283 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.609 10.402 -7.532 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.747 11.285 -8.574 1.00 0.00 C ATOM 0 H LEU A 16 12.634 10.872 -4.639 1.00 0.00 H new ATOM 0 HA LEU A 16 13.026 12.540 -6.867 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.665 11.588 -5.310 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.468 12.788 -6.572 1.00 0.00 H new ATOM 0 HG LEU A 16 11.593 9.993 -6.895 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.601 9.611 -8.281 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.180 10.027 -6.603 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.019 11.246 -7.889 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.696 10.476 -9.303 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.253 12.169 -8.977 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.791 11.518 -8.363 1.00 0.00 H new ATOM 277 N PRO A 17 12.371 14.923 -6.356 1.00 0.00 N ATOM 278 CA PRO A 17 12.340 16.333 -6.005 1.00 0.00 C ATOM 279 C PRO A 17 10.978 16.724 -5.427 1.00 0.00 C ATOM 280 O PRO A 17 9.939 16.353 -5.970 1.00 0.00 O ATOM 281 CB PRO A 17 12.671 17.066 -7.295 1.00 0.00 C ATOM 282 CG PRO A 17 12.418 16.072 -8.416 1.00 0.00 C ATOM 283 CD PRO A 17 12.288 14.691 -7.795 1.00 0.00 C ATOM 0 HA PRO A 17 13.055 16.588 -5.223 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.048 17.953 -7.411 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.708 17.402 -7.298 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.510 16.333 -8.960 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.237 16.091 -9.135 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.342 14.222 -8.067 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.083 14.027 -8.136 1.00 0.00 H new ATOM 291 N LYS A 18 11.028 17.470 -4.333 1.00 0.00 N ATOM 292 CA LYS A 18 9.811 17.916 -3.675 1.00 0.00 C ATOM 293 C LYS A 18 8.743 18.205 -4.731 1.00 0.00 C ATOM 294 O LYS A 18 7.748 17.487 -4.826 1.00 0.00 O ATOM 295 CB LYS A 18 10.104 19.103 -2.755 1.00 0.00 C ATOM 296 CG LYS A 18 8.830 19.579 -2.054 1.00 0.00 C ATOM 297 CD LYS A 18 9.131 20.043 -0.627 1.00 0.00 C ATOM 298 CE LYS A 18 7.904 20.703 0.005 1.00 0.00 C ATOM 299 NZ LYS A 18 8.162 22.138 0.262 1.00 0.00 N ATOM 0 H LYS A 18 11.892 17.777 -3.886 1.00 0.00 H new ATOM 0 HA LYS A 18 9.417 17.132 -3.029 1.00 0.00 H new ATOM 0 HB2 LYS A 18 10.848 18.817 -2.011 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.532 19.921 -3.335 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.383 20.397 -2.620 1.00 0.00 H new ATOM 0 HG3 LYS A 18 8.099 18.770 -2.031 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.443 19.192 -0.022 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.962 20.748 -0.638 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.044 20.595 -0.656 1.00 0.00 H new ATOM 0 HE3 LYS A 18 7.653 20.200 0.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.319 22.571 0.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.969 22.235 0.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 8.379 22.618 -0.635 1.00 0.00 H new ATOM 313 N GLU A 19 8.984 19.258 -5.499 1.00 0.00 N ATOM 314 CA GLU A 19 8.054 19.650 -6.544 1.00 0.00 C ATOM 315 C GLU A 19 7.412 18.414 -7.175 1.00 0.00 C ATOM 316 O GLU A 19 6.193 18.352 -7.326 1.00 0.00 O ATOM 317 CB GLU A 19 8.751 20.508 -7.603 1.00 0.00 C ATOM 318 CG GLU A 19 9.701 19.663 -8.454 1.00 0.00 C ATOM 319 CD GLU A 19 10.556 20.548 -9.363 1.00 0.00 C ATOM 320 OE1 GLU A 19 10.098 20.807 -10.497 1.00 0.00 O ATOM 321 OE2 GLU A 19 11.649 20.944 -8.904 1.00 0.00 O ATOM 0 H GLU A 19 9.810 19.851 -5.418 1.00 0.00 H new ATOM 0 HA GLU A 19 7.266 20.254 -6.095 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.005 20.979 -8.243 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.307 21.310 -7.118 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.346 19.071 -7.806 1.00 0.00 H new ATOM 0 HG3 GLU A 19 9.127 18.961 -9.059 1.00 0.00 H new ATOM 328 N LEU A 20 8.261 17.459 -7.527 1.00 0.00 N ATOM 329 CA LEU A 20 7.791 16.228 -8.138 1.00 0.00 C ATOM 330 C LEU A 20 7.028 15.406 -7.098 1.00 0.00 C ATOM 331 O LEU A 20 5.898 14.986 -7.340 1.00 0.00 O ATOM 332 CB LEU A 20 8.954 15.473 -8.785 1.00 0.00 C ATOM 333 CG LEU A 20 9.422 15.999 -10.144 1.00 0.00 C ATOM 334 CD1 LEU A 20 10.431 15.044 -10.784 1.00 0.00 C ATOM 335 CD2 LEU A 20 8.231 16.276 -11.064 1.00 0.00 C ATOM 0 H LEU A 20 9.272 17.514 -7.400 1.00 0.00 H new ATOM 0 HA LEU A 20 7.093 16.447 -8.946 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.801 15.493 -8.099 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.663 14.429 -8.902 1.00 0.00 H new ATOM 0 HG LEU A 20 9.934 16.948 -9.985 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.747 15.442 -11.748 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.298 14.941 -10.132 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.967 14.068 -10.928 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.591 16.649 -12.023 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.670 15.355 -11.220 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.583 17.022 -10.605 1.00 0.00 H new ATOM 347 N ARG A 21 7.677 15.200 -5.961 1.00 0.00 N ATOM 348 CA ARG A 21 7.073 14.436 -4.882 1.00 0.00 C ATOM 349 C ARG A 21 5.611 14.846 -4.695 1.00 0.00 C ATOM 350 O ARG A 21 4.764 14.010 -4.383 1.00 0.00 O ATOM 351 CB ARG A 21 7.828 14.647 -3.568 1.00 0.00 C ATOM 352 CG ARG A 21 9.250 14.089 -3.657 1.00 0.00 C ATOM 353 CD ARG A 21 9.967 14.199 -2.309 1.00 0.00 C ATOM 354 NE ARG A 21 11.025 15.231 -2.382 1.00 0.00 N ATOM 355 CZ ARG A 21 11.724 15.666 -1.324 1.00 0.00 C ATOM 356 NH1 ARG A 21 11.481 15.161 -0.107 1.00 0.00 N ATOM 357 NH2 ARG A 21 12.666 16.606 -1.484 1.00 0.00 N ATOM 0 H ARG A 21 8.615 15.549 -5.764 1.00 0.00 H new ATOM 0 HA ARG A 21 7.126 13.381 -5.152 1.00 0.00 H new ATOM 0 HB2 ARG A 21 7.865 15.711 -3.332 1.00 0.00 H new ATOM 0 HB3 ARG A 21 7.292 14.159 -2.754 1.00 0.00 H new ATOM 0 HG2 ARG A 21 9.216 13.046 -3.971 1.00 0.00 H new ATOM 0 HG3 ARG A 21 9.811 14.633 -4.417 1.00 0.00 H new ATOM 0 HD2 ARG A 21 9.252 14.454 -1.527 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.404 13.237 -2.040 1.00 0.00 H new ATOM 0 HE ARG A 21 11.236 15.637 -3.294 1.00 0.00 H new ATOM 0 HH11 ARG A 21 10.764 14.446 0.014 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.013 15.492 0.698 1.00 0.00 H new ATOM 0 HH21 ARG A 21 12.851 16.990 -2.411 1.00 0.00 H new ATOM 0 HH22 ARG A 21 13.198 16.937 -0.679 1.00 0.00 H new ATOM 371 N SER A 22 5.360 16.131 -4.893 1.00 0.00 N ATOM 372 CA SER A 22 4.015 16.662 -4.750 1.00 0.00 C ATOM 373 C SER A 22 3.074 15.976 -5.741 1.00 0.00 C ATOM 374 O SER A 22 2.017 15.478 -5.356 1.00 0.00 O ATOM 375 CB SER A 22 3.996 18.177 -4.960 1.00 0.00 C ATOM 376 OG SER A 22 2.751 18.754 -4.575 1.00 0.00 O ATOM 0 H SER A 22 6.065 16.821 -5.151 1.00 0.00 H new ATOM 0 HA SER A 22 3.673 16.459 -3.735 1.00 0.00 H new ATOM 0 HB2 SER A 22 4.801 18.633 -4.383 1.00 0.00 H new ATOM 0 HB3 SER A 22 4.190 18.400 -6.009 1.00 0.00 H new ATOM 0 HG SER A 22 2.780 19.722 -4.723 1.00 0.00 H new ATOM 382 N GLN A 23 3.491 15.973 -6.999 1.00 0.00 N ATOM 383 CA GLN A 23 2.697 15.356 -8.048 1.00 0.00 C ATOM 384 C GLN A 23 2.695 13.835 -7.887 1.00 0.00 C ATOM 385 O GLN A 23 1.698 13.177 -8.182 1.00 0.00 O ATOM 386 CB GLN A 23 3.210 15.760 -9.432 1.00 0.00 C ATOM 387 CG GLN A 23 4.171 14.708 -9.990 1.00 0.00 C ATOM 388 CD GLN A 23 4.723 15.136 -11.351 1.00 0.00 C ATOM 389 OE1 GLN A 23 4.413 16.195 -11.870 1.00 0.00 O ATOM 390 NE2 GLN A 23 5.555 14.255 -11.898 1.00 0.00 N ATOM 0 H GLN A 23 4.368 16.388 -7.315 1.00 0.00 H new ATOM 0 HA GLN A 23 1.671 15.712 -7.958 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.368 15.886 -10.113 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.716 16.723 -9.369 1.00 0.00 H new ATOM 0 HG2 GLN A 23 4.994 14.555 -9.292 1.00 0.00 H new ATOM 0 HG3 GLN A 23 3.654 13.753 -10.087 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.772 13.387 -11.409 1.00 0.00 H new ATOM 0 HE22 GLN A 23 5.976 14.448 -12.807 1.00 0.00 H new ATOM 399 N VAL A 24 3.822 13.319 -7.420 1.00 0.00 N ATOM 400 CA VAL A 24 3.962 11.887 -7.216 1.00 0.00 C ATOM 401 C VAL A 24 2.842 11.395 -6.298 1.00 0.00 C ATOM 402 O VAL A 24 1.944 10.678 -6.738 1.00 0.00 O ATOM 403 CB VAL A 24 5.359 11.569 -6.679 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.465 10.101 -6.260 1.00 0.00 C ATOM 405 CG2 VAL A 24 6.436 11.926 -7.705 1.00 0.00 C ATOM 0 H VAL A 24 4.647 13.867 -7.177 1.00 0.00 H new ATOM 0 HA VAL A 24 3.864 11.355 -8.162 1.00 0.00 H new ATOM 0 HB VAL A 24 5.524 12.183 -5.793 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.468 9.902 -5.882 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.735 9.892 -5.478 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.268 9.462 -7.121 1.00 0.00 H new ATOM 0 HG21 VAL A 24 7.419 11.690 -7.298 1.00 0.00 H new ATOM 0 HG22 VAL A 24 6.274 11.352 -8.617 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.384 12.991 -7.932 1.00 0.00 H new ATOM 415 N LEU A 25 2.931 11.800 -5.040 1.00 0.00 N ATOM 416 CA LEU A 25 1.936 11.409 -4.056 1.00 0.00 C ATOM 417 C LEU A 25 0.543 11.496 -4.683 1.00 0.00 C ATOM 418 O LEU A 25 -0.298 10.627 -4.458 1.00 0.00 O ATOM 419 CB LEU A 25 2.089 12.239 -2.780 1.00 0.00 C ATOM 420 CG LEU A 25 3.407 12.069 -2.023 1.00 0.00 C ATOM 421 CD1 LEU A 25 3.422 12.917 -0.750 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.685 10.593 -1.731 1.00 0.00 C ATOM 0 H LEU A 25 3.677 12.395 -4.679 1.00 0.00 H new ATOM 0 HA LEU A 25 2.086 10.372 -3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.975 13.292 -3.039 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.271 11.986 -2.106 1.00 0.00 H new ATOM 0 HG LEU A 25 4.215 12.430 -2.660 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.370 12.777 -0.231 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.303 13.968 -1.012 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.603 12.610 -0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.628 10.500 -1.192 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.878 10.184 -1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.748 10.042 -2.669 1.00 0.00 H new ATOM 434 N LEU A 26 0.343 12.552 -5.457 1.00 0.00 N ATOM 435 CA LEU A 26 -0.934 12.764 -6.118 1.00 0.00 C ATOM 436 C LEU A 26 -1.209 11.599 -7.072 1.00 0.00 C ATOM 437 O LEU A 26 -2.267 10.976 -7.008 1.00 0.00 O ATOM 438 CB LEU A 26 -0.965 14.135 -6.797 1.00 0.00 C ATOM 439 CG LEU A 26 -1.419 15.306 -5.923 1.00 0.00 C ATOM 440 CD1 LEU A 26 -1.182 16.642 -6.630 1.00 0.00 C ATOM 441 CD2 LEU A 26 -2.878 15.135 -5.494 1.00 0.00 C ATOM 0 H LEU A 26 1.043 13.270 -5.642 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.743 12.777 -5.388 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.034 14.355 -7.174 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.626 14.075 -7.662 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.815 15.311 -5.016 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.513 17.458 -5.987 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.119 16.757 -6.844 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.744 16.664 -7.564 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.176 15.980 -4.874 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.514 15.091 -6.378 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.984 14.212 -4.924 1.00 0.00 H new ATOM 453 N GLU A 27 -0.237 11.340 -7.934 1.00 0.00 N ATOM 454 CA GLU A 27 -0.361 10.262 -8.900 1.00 0.00 C ATOM 455 C GLU A 27 -0.793 8.971 -8.201 1.00 0.00 C ATOM 456 O GLU A 27 -1.823 8.391 -8.543 1.00 0.00 O ATOM 457 CB GLU A 27 0.948 10.059 -9.666 1.00 0.00 C ATOM 458 CG GLU A 27 1.379 11.349 -10.366 1.00 0.00 C ATOM 459 CD GLU A 27 1.622 11.108 -11.858 1.00 0.00 C ATOM 460 OE1 GLU A 27 2.626 10.431 -12.168 1.00 0.00 O ATOM 461 OE2 GLU A 27 0.797 11.606 -12.654 1.00 0.00 O ATOM 0 H GLU A 27 0.640 11.858 -7.984 1.00 0.00 H new ATOM 0 HA GLU A 27 -1.129 10.535 -9.624 1.00 0.00 H new ATOM 0 HB2 GLU A 27 1.729 9.736 -8.978 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.823 9.265 -10.403 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.610 12.111 -10.237 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.288 11.732 -9.903 1.00 0.00 H new ATOM 468 N TYR A 28 0.014 8.560 -7.235 1.00 0.00 N ATOM 469 CA TYR A 28 -0.272 7.348 -6.486 1.00 0.00 C ATOM 470 C TYR A 28 -1.779 7.169 -6.289 1.00 0.00 C ATOM 471 O TYR A 28 -2.343 6.150 -6.685 1.00 0.00 O ATOM 472 CB TYR A 28 0.391 7.532 -5.119 1.00 0.00 C ATOM 473 CG TYR A 28 1.851 7.078 -5.070 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.675 7.283 -6.158 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.345 6.462 -3.937 1.00 0.00 C ATOM 476 CE1 TYR A 28 4.049 6.856 -6.111 1.00 0.00 C ATOM 477 CE2 TYR A 28 3.719 6.035 -3.891 1.00 0.00 C ATOM 478 CZ TYR A 28 4.504 6.253 -4.980 1.00 0.00 C ATOM 479 OH TYR A 28 5.802 5.850 -4.937 1.00 0.00 O ATOM 0 H TYR A 28 0.866 9.044 -6.953 1.00 0.00 H new ATOM 0 HA TYR A 28 0.099 6.471 -7.016 1.00 0.00 H new ATOM 0 HB2 TYR A 28 0.339 8.584 -4.840 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.177 6.976 -4.373 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.289 7.764 -7.045 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.701 6.301 -3.086 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.704 7.011 -6.955 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.118 5.552 -3.011 1.00 0.00 H new ATOM 0 HH TYR A 28 6.220 6.180 -4.115 1.00 0.00 H new ATOM 489 N ALA A 29 -2.387 8.174 -5.676 1.00 0.00 N ATOM 490 CA ALA A 29 -3.817 8.140 -5.422 1.00 0.00 C ATOM 491 C ALA A 29 -4.554 7.804 -6.720 1.00 0.00 C ATOM 492 O ALA A 29 -5.457 6.970 -6.727 1.00 0.00 O ATOM 493 CB ALA A 29 -4.262 9.478 -4.828 1.00 0.00 C ATOM 0 H ALA A 29 -1.915 9.017 -5.348 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.059 7.364 -4.696 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.335 9.453 -4.637 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.731 9.655 -3.893 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.037 10.281 -5.530 1.00 0.00 H new ATOM 499 N ALA A 30 -4.140 8.472 -7.787 1.00 0.00 N ATOM 500 CA ALA A 30 -4.750 8.255 -9.088 1.00 0.00 C ATOM 501 C ALA A 30 -4.521 6.804 -9.518 1.00 0.00 C ATOM 502 O ALA A 30 -5.299 6.253 -10.296 1.00 0.00 O ATOM 503 CB ALA A 30 -4.179 9.257 -10.093 1.00 0.00 C ATOM 0 H ALA A 30 -3.390 9.163 -7.777 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.826 8.419 -9.039 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -4.636 9.094 -11.069 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.393 10.272 -9.757 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.100 9.120 -10.171 1.00 0.00 H new ATOM 509 N LYS A 31 -3.451 6.226 -8.992 1.00 0.00 N ATOM 510 CA LYS A 31 -3.110 4.851 -9.312 1.00 0.00 C ATOM 511 C LYS A 31 -3.983 3.907 -8.481 1.00 0.00 C ATOM 512 O LYS A 31 -4.346 2.826 -8.941 1.00 0.00 O ATOM 513 CB LYS A 31 -1.609 4.615 -9.134 1.00 0.00 C ATOM 514 CG LYS A 31 -0.853 4.893 -10.435 1.00 0.00 C ATOM 515 CD LYS A 31 -0.340 6.334 -10.474 1.00 0.00 C ATOM 516 CE LYS A 31 1.180 6.380 -10.304 1.00 0.00 C ATOM 517 NZ LYS A 31 1.535 6.655 -8.893 1.00 0.00 N ATOM 0 H LYS A 31 -2.809 6.685 -8.346 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.320 4.641 -10.361 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -1.227 5.260 -8.342 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.434 3.586 -8.820 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.015 4.202 -10.527 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.509 4.714 -11.287 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.618 6.797 -11.421 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.816 6.915 -9.684 1.00 0.00 H new ATOM 0 HE2 LYS A 31 1.616 5.431 -10.617 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.601 7.152 -10.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.544 6.451 -8.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.348 7.655 -8.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 0.963 6.052 -8.267 1.00 0.00 H new ATOM 531 N VAL A 32 -4.294 4.352 -7.272 1.00 0.00 N ATOM 532 CA VAL A 32 -5.117 3.561 -6.374 1.00 0.00 C ATOM 533 C VAL A 32 -6.400 3.145 -7.097 1.00 0.00 C ATOM 534 O VAL A 32 -7.283 3.970 -7.325 1.00 0.00 O ATOM 535 CB VAL A 32 -5.384 4.341 -5.085 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.396 3.610 -4.201 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.083 4.606 -4.325 1.00 0.00 C ATOM 0 H VAL A 32 -3.991 5.250 -6.894 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.596 2.648 -6.084 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.814 5.304 -5.360 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.568 4.186 -3.292 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.336 3.496 -4.741 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.007 2.626 -3.939 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.301 5.162 -3.413 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.612 3.657 -4.068 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.408 5.188 -4.952 1.00 0.00 H new ATOM 547 N PRO A 33 -6.463 1.832 -7.446 1.00 0.00 N ATOM 548 CA PRO A 33 -7.623 1.297 -8.139 1.00 0.00 C ATOM 549 C PRO A 33 -8.806 1.135 -7.183 1.00 0.00 C ATOM 550 O PRO A 33 -8.627 1.110 -5.966 1.00 0.00 O ATOM 551 CB PRO A 33 -7.153 -0.022 -8.732 1.00 0.00 C ATOM 552 CG PRO A 33 -5.896 -0.399 -7.965 1.00 0.00 C ATOM 553 CD PRO A 33 -5.436 0.826 -7.192 1.00 0.00 C ATOM 0 HA PRO A 33 -7.990 1.962 -8.921 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.919 -0.791 -8.630 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -6.945 0.081 -9.797 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -6.098 -1.226 -7.284 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -5.117 -0.733 -8.650 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.347 0.612 -6.127 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -4.457 1.165 -7.532 1.00 0.00 H new ATOM 561 N PRO A 34 -10.021 1.025 -7.785 1.00 0.00 N ATOM 562 CA PRO A 34 -11.233 0.866 -7.000 1.00 0.00 C ATOM 563 C PRO A 34 -11.343 -0.554 -6.442 1.00 0.00 C ATOM 564 O PRO A 34 -10.800 -1.495 -7.019 1.00 0.00 O ATOM 565 CB PRO A 34 -12.366 1.220 -7.950 1.00 0.00 C ATOM 566 CG PRO A 34 -11.784 1.114 -9.350 1.00 0.00 C ATOM 567 CD PRO A 34 -10.271 1.050 -9.223 1.00 0.00 C ATOM 0 HA PRO A 34 -11.252 1.510 -6.121 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -13.208 0.539 -7.824 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -12.738 2.226 -7.757 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -12.163 0.225 -9.854 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -12.080 1.973 -9.952 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -9.870 0.161 -9.710 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.797 1.912 -9.692 1.00 0.00 H new ATOM 575 N PRO A 35 -12.067 -0.668 -5.297 1.00 0.00 N ATOM 576 CA PRO A 35 -12.255 -1.957 -4.654 1.00 0.00 C ATOM 577 C PRO A 35 -13.269 -2.809 -5.421 1.00 0.00 C ATOM 578 O PRO A 35 -14.258 -2.290 -5.936 1.00 0.00 O ATOM 579 CB PRO A 35 -12.703 -1.631 -3.239 1.00 0.00 C ATOM 580 CG PRO A 35 -13.196 -0.193 -3.279 1.00 0.00 C ATOM 581 CD PRO A 35 -12.724 0.425 -4.585 1.00 0.00 C ATOM 0 HA PRO A 35 -11.345 -2.556 -4.640 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.495 -2.306 -2.915 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.880 -1.742 -2.533 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.283 -0.160 -3.212 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -12.807 0.368 -2.429 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -13.560 0.825 -5.159 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.036 1.251 -4.406 1.00 0.00 H new ATOM 589 N PRO A 36 -12.981 -4.137 -5.473 1.00 0.00 N ATOM 590 CA PRO A 36 -13.857 -5.066 -6.168 1.00 0.00 C ATOM 591 C PRO A 36 -15.124 -5.337 -5.355 1.00 0.00 C ATOM 592 O PRO A 36 -15.171 -5.056 -4.159 1.00 0.00 O ATOM 593 CB PRO A 36 -13.014 -6.311 -6.388 1.00 0.00 C ATOM 594 CG PRO A 36 -11.858 -6.211 -5.406 1.00 0.00 C ATOM 595 CD PRO A 36 -11.819 -4.788 -4.875 1.00 0.00 C ATOM 0 HA PRO A 36 -14.219 -4.673 -7.118 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -13.598 -7.214 -6.213 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -12.651 -6.360 -7.415 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -11.989 -6.920 -4.589 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -10.917 -6.461 -5.897 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -11.872 -4.770 -3.786 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -10.894 -4.285 -5.158 1.00 0.00 H new ATOM 603 N PRO A 37 -16.147 -5.896 -6.055 1.00 0.00 N ATOM 604 CA PRO A 37 -17.412 -6.209 -5.411 1.00 0.00 C ATOM 605 C PRO A 37 -17.286 -7.455 -4.533 1.00 0.00 C ATOM 606 O PRO A 37 -16.699 -8.454 -4.947 1.00 0.00 O ATOM 607 CB PRO A 37 -18.401 -6.383 -6.552 1.00 0.00 C ATOM 608 CG PRO A 37 -17.564 -6.620 -7.798 1.00 0.00 C ATOM 609 CD PRO A 37 -16.128 -6.243 -7.473 1.00 0.00 C ATOM 0 HA PRO A 37 -17.744 -5.425 -4.730 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -19.069 -7.224 -6.365 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -19.027 -5.498 -6.665 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -17.624 -7.664 -8.106 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -17.937 -6.021 -8.628 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -15.447 -7.071 -7.669 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -15.792 -5.404 -8.082 1.00 0.00 H new ATOM 617 N GLY A 38 -17.847 -7.357 -3.337 1.00 0.00 N ATOM 618 CA GLY A 38 -17.806 -8.464 -2.397 1.00 0.00 C ATOM 619 C GLY A 38 -16.773 -8.210 -1.297 1.00 0.00 C ATOM 620 O GLY A 38 -16.887 -8.751 -0.197 1.00 0.00 O ATOM 0 H GLY A 38 -18.333 -6.527 -2.997 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -18.791 -8.604 -1.951 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -17.561 -9.386 -2.925 1.00 0.00 H new ATOM 624 N VAL A 39 -15.790 -7.387 -1.630 1.00 0.00 N ATOM 625 CA VAL A 39 -14.739 -7.055 -0.684 1.00 0.00 C ATOM 626 C VAL A 39 -15.324 -6.203 0.444 1.00 0.00 C ATOM 627 O VAL A 39 -16.010 -5.215 0.188 1.00 0.00 O ATOM 628 CB VAL A 39 -13.578 -6.371 -1.410 1.00 0.00 C ATOM 629 CG1 VAL A 39 -12.573 -5.792 -0.412 1.00 0.00 C ATOM 630 CG2 VAL A 39 -12.894 -7.335 -2.381 1.00 0.00 C ATOM 0 H VAL A 39 -15.699 -6.940 -2.542 1.00 0.00 H new ATOM 0 HA VAL A 39 -14.334 -7.960 -0.231 1.00 0.00 H new ATOM 0 HB VAL A 39 -13.987 -5.545 -1.992 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -11.758 -5.312 -0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -13.071 -5.057 0.221 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -12.173 -6.594 0.209 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.073 -6.824 -2.883 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -12.505 -8.191 -1.830 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -13.616 -7.678 -3.122 1.00 0.00 H new ATOM 640 N GLU A 40 -15.031 -6.617 1.668 1.00 0.00 N ATOM 641 CA GLU A 40 -15.520 -5.905 2.836 1.00 0.00 C ATOM 642 C GLU A 40 -14.417 -5.016 3.416 1.00 0.00 C ATOM 643 O GLU A 40 -13.389 -5.515 3.870 1.00 0.00 O ATOM 644 CB GLU A 40 -16.051 -6.878 3.890 1.00 0.00 C ATOM 645 CG GLU A 40 -17.182 -6.244 4.703 1.00 0.00 C ATOM 646 CD GLU A 40 -17.021 -6.545 6.194 1.00 0.00 C ATOM 647 OE1 GLU A 40 -15.984 -6.122 6.750 1.00 0.00 O ATOM 648 OE2 GLU A 40 -17.939 -7.190 6.745 1.00 0.00 O ATOM 0 H GLU A 40 -14.461 -7.437 1.876 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.349 -5.268 2.528 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -16.412 -7.784 3.404 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.241 -7.175 4.557 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -17.188 -5.166 4.545 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -18.142 -6.623 4.354 1.00 0.00 H new ATOM 655 N LEU A 41 -14.669 -3.716 3.381 1.00 0.00 N ATOM 656 CA LEU A 41 -13.711 -2.754 3.897 1.00 0.00 C ATOM 657 C LEU A 41 -14.224 -2.190 5.223 1.00 0.00 C ATOM 658 O LEU A 41 -15.428 -2.012 5.401 1.00 0.00 O ATOM 659 CB LEU A 41 -13.410 -1.682 2.848 1.00 0.00 C ATOM 660 CG LEU A 41 -12.923 -2.190 1.490 1.00 0.00 C ATOM 661 CD1 LEU A 41 -13.878 -1.767 0.372 1.00 0.00 C ATOM 662 CD2 LEU A 41 -11.487 -1.739 1.218 1.00 0.00 C ATOM 0 H LEU A 41 -15.523 -3.306 3.003 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.758 -3.240 4.105 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.313 -1.093 2.690 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.656 -1.007 3.253 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.918 -3.280 1.515 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -13.509 -2.141 -0.583 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -14.869 -2.179 0.564 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -13.938 -0.679 0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.166 -2.114 0.246 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.441 -0.650 1.220 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.829 -2.131 1.994 1.00 0.00 H new ATOM 674 N GLU A 42 -13.286 -1.924 6.120 1.00 0.00 N ATOM 675 CA GLU A 42 -13.629 -1.384 7.425 1.00 0.00 C ATOM 676 C GLU A 42 -13.209 0.084 7.518 1.00 0.00 C ATOM 677 O GLU A 42 -12.112 0.448 7.098 1.00 0.00 O ATOM 678 CB GLU A 42 -12.991 -2.209 8.545 1.00 0.00 C ATOM 679 CG GLU A 42 -13.992 -2.469 9.672 1.00 0.00 C ATOM 680 CD GLU A 42 -13.990 -1.319 10.682 1.00 0.00 C ATOM 681 OE1 GLU A 42 -12.876 -0.895 11.058 1.00 0.00 O ATOM 682 OE2 GLU A 42 -15.103 -0.890 11.056 1.00 0.00 O ATOM 0 H GLU A 42 -12.288 -2.072 5.969 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.711 -1.441 7.548 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.634 -3.158 8.145 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.122 -1.683 8.940 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -14.992 -2.590 9.255 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.742 -3.402 10.177 1.00 0.00 H new ATOM 689 N ARG A 43 -14.105 0.888 8.072 1.00 0.00 N ATOM 690 CA ARG A 43 -13.841 2.309 8.226 1.00 0.00 C ATOM 691 C ARG A 43 -12.709 2.533 9.231 1.00 0.00 C ATOM 692 O ARG A 43 -12.570 1.778 10.193 1.00 0.00 O ATOM 693 CB ARG A 43 -15.090 3.053 8.702 1.00 0.00 C ATOM 694 CG ARG A 43 -14.766 4.509 9.040 1.00 0.00 C ATOM 695 CD ARG A 43 -15.958 5.420 8.740 1.00 0.00 C ATOM 696 NE ARG A 43 -17.142 4.975 9.509 1.00 0.00 N ATOM 697 CZ ARG A 43 -18.298 5.649 9.566 1.00 0.00 C ATOM 698 NH1 ARG A 43 -18.434 6.804 8.900 1.00 0.00 N ATOM 699 NH2 ARG A 43 -19.319 5.169 10.289 1.00 0.00 N ATOM 0 H ARG A 43 -15.014 0.583 8.420 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.549 2.699 7.251 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.856 3.018 7.927 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.502 2.555 9.580 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -14.498 4.590 10.093 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -13.900 4.836 8.464 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.713 6.450 8.998 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -16.180 5.403 7.673 1.00 0.00 H new ATOM 0 HE ARG A 43 -17.073 4.100 10.028 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -17.657 7.170 8.350 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -19.314 7.317 8.943 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -19.216 4.290 10.796 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -20.199 5.683 10.332 1.00 0.00 H new ATOM 713 N VAL A 44 -11.930 3.573 8.974 1.00 0.00 N ATOM 714 CA VAL A 44 -10.815 3.906 9.845 1.00 0.00 C ATOM 715 C VAL A 44 -11.198 5.097 10.724 1.00 0.00 C ATOM 716 O VAL A 44 -10.995 6.248 10.340 1.00 0.00 O ATOM 717 CB VAL A 44 -9.557 4.158 9.011 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.423 4.706 9.880 1.00 0.00 C ATOM 719 CG2 VAL A 44 -9.122 2.888 8.277 1.00 0.00 C ATOM 0 H VAL A 44 -12.048 4.196 8.175 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.587 3.072 10.509 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.798 4.912 8.261 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.541 4.876 9.262 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.735 5.646 10.334 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.184 3.986 10.663 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.226 3.095 7.692 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.908 2.103 9.003 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.921 2.560 7.613 1.00 0.00 H new ATOM 729 N HIS A 45 -11.745 4.781 11.889 1.00 0.00 N ATOM 730 CA HIS A 45 -12.158 5.811 12.826 1.00 0.00 C ATOM 731 C HIS A 45 -10.987 6.758 13.097 1.00 0.00 C ATOM 732 O HIS A 45 -11.162 7.975 13.128 1.00 0.00 O ATOM 733 CB HIS A 45 -12.724 5.188 14.104 1.00 0.00 C ATOM 734 CG HIS A 45 -14.228 5.047 14.104 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.959 4.809 12.953 1.00 0.00 N ATOM 736 CD2 HIS A 45 -15.129 5.112 15.126 1.00 0.00 C ATOM 737 CE1 HIS A 45 -16.241 4.737 13.280 1.00 0.00 C ATOM 738 NE2 HIS A 45 -16.344 4.925 14.627 1.00 0.00 N ATOM 0 H HIS A 45 -11.912 3.826 12.205 1.00 0.00 H new ATOM 0 HA HIS A 45 -12.964 6.401 12.391 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -12.277 4.204 14.245 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -12.426 5.799 14.956 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -14.893 5.286 16.165 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -17.061 4.560 12.599 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -17.212 4.922 15.162 1.00 0.00 H new ATOM 746 N GLU A 46 -9.818 6.163 13.287 1.00 0.00 N ATOM 747 CA GLU A 46 -8.619 6.938 13.554 1.00 0.00 C ATOM 748 C GLU A 46 -8.550 8.149 12.621 1.00 0.00 C ATOM 749 O GLU A 46 -8.004 9.189 12.986 1.00 0.00 O ATOM 750 CB GLU A 46 -7.365 6.072 13.421 1.00 0.00 C ATOM 751 CG GLU A 46 -6.366 6.378 14.538 1.00 0.00 C ATOM 752 CD GLU A 46 -5.928 5.096 15.250 1.00 0.00 C ATOM 753 OE1 GLU A 46 -6.809 4.235 15.460 1.00 0.00 O ATOM 754 OE2 GLU A 46 -4.722 5.007 15.567 1.00 0.00 O ATOM 0 H GLU A 46 -9.676 5.153 13.261 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.665 7.298 14.582 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.641 5.018 13.454 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.898 6.249 12.452 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.494 6.883 14.122 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.818 7.061 15.257 1.00 0.00 H new ATOM 761 N CYS A 47 -9.112 7.973 11.434 1.00 0.00 N ATOM 762 CA CYS A 47 -9.121 9.038 10.445 1.00 0.00 C ATOM 763 C CYS A 47 -10.483 9.733 10.500 1.00 0.00 C ATOM 764 O CYS A 47 -11.521 9.074 10.485 1.00 0.00 O ATOM 765 CB CYS A 47 -8.805 8.512 9.044 1.00 0.00 C ATOM 766 SG CYS A 47 -8.660 9.908 7.869 1.00 0.00 S ATOM 0 H CYS A 47 -9.564 7.109 11.135 1.00 0.00 H new ATOM 0 HA CYS A 47 -8.337 9.759 10.676 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -7.876 7.943 9.061 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.590 7.831 8.717 1.00 0.00 H new ATOM 0 HG CYS A 47 -9.794 10.079 7.256 1.00 0.00 H new ATOM 772 N GLN A 48 -10.435 11.056 10.563 1.00 0.00 N ATOM 773 CA GLN A 48 -11.652 11.847 10.621 1.00 0.00 C ATOM 774 C GLN A 48 -12.580 11.479 9.462 1.00 0.00 C ATOM 775 O GLN A 48 -13.776 11.272 9.661 1.00 0.00 O ATOM 776 CB GLN A 48 -11.334 13.343 10.614 1.00 0.00 C ATOM 777 CG GLN A 48 -10.212 13.670 11.602 1.00 0.00 C ATOM 778 CD GLN A 48 -10.662 14.727 12.613 1.00 0.00 C ATOM 779 OE1 GLN A 48 -11.766 15.242 12.561 1.00 0.00 O ATOM 780 NE2 GLN A 48 -9.747 15.019 13.533 1.00 0.00 N ATOM 0 H GLN A 48 -9.572 11.600 10.575 1.00 0.00 H new ATOM 0 HA GLN A 48 -12.164 11.622 11.557 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -11.041 13.651 9.610 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -12.228 13.910 10.873 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.910 12.764 12.128 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.338 14.030 11.059 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.841 14.550 13.519 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -9.951 15.712 14.253 1.00 0.00 H new ATOM 789 N THR A 49 -11.993 11.407 8.276 1.00 0.00 N ATOM 790 CA THR A 49 -12.753 11.067 7.085 1.00 0.00 C ATOM 791 C THR A 49 -13.118 9.581 7.091 1.00 0.00 C ATOM 792 O THR A 49 -12.464 8.780 7.757 1.00 0.00 O ATOM 793 CB THR A 49 -11.930 11.485 5.864 1.00 0.00 C ATOM 794 OG1 THR A 49 -10.739 10.710 5.966 1.00 0.00 O ATOM 795 CG2 THR A 49 -11.442 12.932 5.955 1.00 0.00 C ATOM 0 H THR A 49 -11.001 11.578 8.115 1.00 0.00 H new ATOM 0 HA THR A 49 -13.702 11.603 7.055 1.00 0.00 H new ATOM 0 HB THR A 49 -12.529 11.360 4.962 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.388 10.530 5.069 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.864 13.178 5.064 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.299 13.601 6.027 1.00 0.00 H new ATOM 0 HG23 THR A 49 -10.815 13.050 6.839 1.00 0.00 H new ATOM 803 N PRO A 50 -14.189 9.249 6.322 1.00 0.00 N ATOM 804 CA PRO A 50 -14.649 7.874 6.232 1.00 0.00 C ATOM 805 C PRO A 50 -13.716 7.039 5.354 1.00 0.00 C ATOM 806 O PRO A 50 -14.105 6.596 4.274 1.00 0.00 O ATOM 807 CB PRO A 50 -16.061 7.967 5.678 1.00 0.00 C ATOM 808 CG PRO A 50 -16.170 9.344 5.043 1.00 0.00 C ATOM 809 CD PRO A 50 -14.987 10.171 5.519 1.00 0.00 C ATOM 0 HA PRO A 50 -14.646 7.366 7.196 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -16.245 7.183 4.944 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -16.800 7.842 6.469 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -16.168 9.264 3.956 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -17.108 9.822 5.326 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -14.414 10.562 4.679 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -15.314 11.028 6.108 1.00 0.00 H new ATOM 817 N PHE A 51 -12.501 6.850 5.849 1.00 0.00 N ATOM 818 CA PHE A 51 -11.509 6.077 5.122 1.00 0.00 C ATOM 819 C PHE A 51 -11.613 4.590 5.467 1.00 0.00 C ATOM 820 O PHE A 51 -11.450 4.204 6.623 1.00 0.00 O ATOM 821 CB PHE A 51 -10.135 6.593 5.553 1.00 0.00 C ATOM 822 CG PHE A 51 -8.963 5.913 4.843 1.00 0.00 C ATOM 823 CD1 PHE A 51 -9.040 5.638 3.514 1.00 0.00 C ATOM 824 CD2 PHE A 51 -7.844 5.583 5.542 1.00 0.00 C ATOM 825 CE1 PHE A 51 -7.952 5.007 2.855 1.00 0.00 C ATOM 826 CE2 PHE A 51 -6.756 4.951 4.883 1.00 0.00 C ATOM 827 CZ PHE A 51 -6.833 4.677 3.553 1.00 0.00 C ATOM 0 H PHE A 51 -12.182 7.219 6.745 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.666 6.186 4.049 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -10.086 7.666 5.366 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.026 6.452 6.628 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.929 5.900 2.959 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.783 5.801 6.598 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.013 4.789 1.799 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.868 4.688 5.438 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.005 4.197 3.052 1.00 0.00 H new ATOM 837 N PHE A 52 -11.882 3.795 4.441 1.00 0.00 N ATOM 838 CA PHE A 52 -12.010 2.359 4.621 1.00 0.00 C ATOM 839 C PHE A 52 -10.730 1.637 4.196 1.00 0.00 C ATOM 840 O PHE A 52 -9.863 2.229 3.554 1.00 0.00 O ATOM 841 CB PHE A 52 -13.163 1.897 3.728 1.00 0.00 C ATOM 842 CG PHE A 52 -14.445 2.715 3.893 1.00 0.00 C ATOM 843 CD1 PHE A 52 -15.171 2.618 5.038 1.00 0.00 C ATOM 844 CD2 PHE A 52 -14.858 3.541 2.894 1.00 0.00 C ATOM 845 CE1 PHE A 52 -16.361 3.378 5.191 1.00 0.00 C ATOM 846 CE2 PHE A 52 -16.047 4.301 3.047 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.774 4.204 4.192 1.00 0.00 C ATOM 0 H PHE A 52 -12.015 4.118 3.483 1.00 0.00 H new ATOM 0 HA PHE A 52 -12.192 2.131 5.671 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -12.845 1.946 2.687 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.381 0.851 3.946 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -14.843 1.963 5.832 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -14.281 3.618 1.984 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -16.938 3.300 6.101 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -16.374 4.957 2.254 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.679 4.782 4.308 1.00 0.00 H new ATOM 857 N VAL A 53 -10.651 0.369 4.571 1.00 0.00 N ATOM 858 CA VAL A 53 -9.491 -0.440 4.236 1.00 0.00 C ATOM 859 C VAL A 53 -9.859 -1.921 4.345 1.00 0.00 C ATOM 860 O VAL A 53 -10.932 -2.263 4.839 1.00 0.00 O ATOM 861 CB VAL A 53 -8.308 -0.051 5.125 1.00 0.00 C ATOM 862 CG1 VAL A 53 -8.159 -1.025 6.296 1.00 0.00 C ATOM 863 CG2 VAL A 53 -7.015 0.030 4.311 1.00 0.00 C ATOM 0 H VAL A 53 -11.371 -0.118 5.104 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.182 -0.257 3.207 1.00 0.00 H new ATOM 0 HB VAL A 53 -8.508 0.939 5.536 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.311 -0.726 6.912 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.068 -1.012 6.898 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.992 -2.032 5.913 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.189 0.308 4.966 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -6.808 -0.940 3.859 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.125 0.780 3.527 1.00 0.00 H new ATOM 873 N HIS A 54 -8.948 -2.760 3.874 1.00 0.00 N ATOM 874 CA HIS A 54 -9.163 -4.197 3.912 1.00 0.00 C ATOM 875 C HIS A 54 -7.840 -4.921 3.653 1.00 0.00 C ATOM 876 O HIS A 54 -6.924 -4.354 3.060 1.00 0.00 O ATOM 877 CB HIS A 54 -10.265 -4.607 2.934 1.00 0.00 C ATOM 878 CG HIS A 54 -10.560 -6.088 2.927 1.00 0.00 C ATOM 879 ND1 HIS A 54 -10.857 -6.799 4.076 1.00 0.00 N ATOM 880 CD2 HIS A 54 -10.601 -6.984 1.899 1.00 0.00 C ATOM 881 CE1 HIS A 54 -11.065 -8.064 3.744 1.00 0.00 C ATOM 882 NE2 HIS A 54 -10.905 -8.177 2.394 1.00 0.00 N ATOM 0 H HIS A 54 -8.059 -2.472 3.464 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.509 -4.491 4.903 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.178 -4.066 3.184 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -9.977 -4.299 1.929 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -10.417 -6.760 0.859 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -11.317 -8.865 4.423 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -11.003 -9.037 1.854 1.00 0.00 H new ATOM 890 N ALA A 55 -7.783 -6.163 4.111 1.00 0.00 N ATOM 891 CA ALA A 55 -6.588 -6.971 3.936 1.00 0.00 C ATOM 892 C ALA A 55 -6.989 -8.438 3.773 1.00 0.00 C ATOM 893 O ALA A 55 -7.771 -8.963 4.563 1.00 0.00 O ATOM 894 CB ALA A 55 -5.646 -6.752 5.122 1.00 0.00 C ATOM 0 H ALA A 55 -8.545 -6.629 4.603 1.00 0.00 H new ATOM 0 HA ALA A 55 -6.052 -6.674 3.035 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.749 -7.358 4.991 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.368 -5.699 5.176 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.149 -7.042 6.044 1.00 0.00 H new ATOM 900 N ASP A 56 -6.434 -9.059 2.742 1.00 0.00 N ATOM 901 CA ASP A 56 -6.723 -10.455 2.465 1.00 0.00 C ATOM 902 C ASP A 56 -5.497 -11.108 1.824 1.00 0.00 C ATOM 903 O ASP A 56 -4.619 -10.418 1.310 1.00 0.00 O ATOM 904 CB ASP A 56 -7.895 -10.592 1.491 1.00 0.00 C ATOM 905 CG ASP A 56 -9.280 -10.421 2.117 1.00 0.00 C ATOM 906 OD1 ASP A 56 -9.335 -10.354 3.364 1.00 0.00 O ATOM 907 OD2 ASP A 56 -10.254 -10.362 1.335 1.00 0.00 O ATOM 0 H ASP A 56 -5.785 -8.620 2.088 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.978 -10.940 3.407 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.777 -9.853 0.699 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.844 -11.574 1.021 1.00 0.00 H new ATOM 912 N VAL A 57 -5.477 -12.432 1.875 1.00 0.00 N ATOM 913 CA VAL A 57 -4.373 -13.186 1.306 1.00 0.00 C ATOM 914 C VAL A 57 -4.910 -14.136 0.233 1.00 0.00 C ATOM 915 O VAL A 57 -5.527 -15.152 0.550 1.00 0.00 O ATOM 916 CB VAL A 57 -3.606 -13.909 2.415 1.00 0.00 C ATOM 917 CG1 VAL A 57 -2.465 -14.747 1.836 1.00 0.00 C ATOM 918 CG2 VAL A 57 -3.085 -12.918 3.457 1.00 0.00 C ATOM 0 H VAL A 57 -6.208 -13.002 2.302 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.662 -12.516 0.822 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.299 -14.586 2.914 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.936 -15.250 2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.871 -15.491 1.150 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -1.773 -14.098 1.299 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -2.544 -13.458 4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.415 -12.204 2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -3.924 -12.385 3.903 1.00 0.00 H new ATOM 928 N GLU A 58 -4.655 -13.772 -1.015 1.00 0.00 N ATOM 929 CA GLU A 58 -5.104 -14.580 -2.137 1.00 0.00 C ATOM 930 C GLU A 58 -3.970 -15.480 -2.631 1.00 0.00 C ATOM 931 O GLU A 58 -3.066 -15.020 -3.327 1.00 0.00 O ATOM 932 CB GLU A 58 -5.637 -13.698 -3.268 1.00 0.00 C ATOM 933 CG GLU A 58 -6.541 -14.499 -4.208 1.00 0.00 C ATOM 934 CD GLU A 58 -7.879 -13.787 -4.420 1.00 0.00 C ATOM 935 OE1 GLU A 58 -7.850 -12.692 -5.023 1.00 0.00 O ATOM 936 OE2 GLU A 58 -8.900 -14.354 -3.974 1.00 0.00 O ATOM 0 H GLU A 58 -4.143 -12.929 -1.274 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.923 -15.215 -1.798 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.194 -12.860 -2.849 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -4.803 -13.278 -3.830 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.043 -14.637 -5.167 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.715 -15.492 -3.793 1.00 0.00 H new ATOM 943 N GLY A 59 -4.056 -16.747 -2.252 1.00 0.00 N ATOM 944 CA GLY A 59 -3.048 -17.716 -2.649 1.00 0.00 C ATOM 945 C GLY A 59 -1.795 -17.590 -1.780 1.00 0.00 C ATOM 946 O GLY A 59 -1.586 -18.385 -0.865 1.00 0.00 O ATOM 0 H GLY A 59 -4.807 -17.125 -1.675 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.454 -18.724 -2.564 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.786 -17.565 -3.696 1.00 0.00 H new ATOM 950 N GLY A 60 -0.993 -16.584 -2.097 1.00 0.00 N ATOM 951 CA GLY A 60 0.235 -16.343 -1.358 1.00 0.00 C ATOM 952 C GLY A 60 0.626 -14.865 -1.411 1.00 0.00 C ATOM 953 O GLY A 60 1.785 -14.518 -1.186 1.00 0.00 O ATOM 0 H GLY A 60 -1.170 -15.926 -2.856 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.106 -16.652 -0.321 1.00 0.00 H new ATOM 0 HA3 GLY A 60 1.039 -16.951 -1.774 1.00 0.00 H new ATOM 957 N LYS A 61 -0.362 -14.035 -1.710 1.00 0.00 N ATOM 958 CA LYS A 61 -0.135 -12.602 -1.796 1.00 0.00 C ATOM 959 C LYS A 61 -1.221 -11.870 -1.004 1.00 0.00 C ATOM 960 O LYS A 61 -2.341 -12.361 -0.880 1.00 0.00 O ATOM 961 CB LYS A 61 -0.038 -12.161 -3.258 1.00 0.00 C ATOM 962 CG LYS A 61 1.190 -12.775 -3.935 1.00 0.00 C ATOM 963 CD LYS A 61 1.164 -12.528 -5.444 1.00 0.00 C ATOM 964 CE LYS A 61 1.572 -13.787 -6.213 1.00 0.00 C ATOM 965 NZ LYS A 61 2.160 -13.426 -7.522 1.00 0.00 N ATOM 0 H LYS A 61 -1.322 -14.327 -1.896 1.00 0.00 H new ATOM 0 HA LYS A 61 0.822 -12.340 -1.344 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -0.940 -12.460 -3.792 1.00 0.00 H new ATOM 0 HB3 LYS A 61 0.019 -11.074 -3.311 1.00 0.00 H new ATOM 0 HG2 LYS A 61 2.097 -12.347 -3.508 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.220 -13.847 -3.739 1.00 0.00 H new ATOM 0 HD2 LYS A 61 0.164 -12.220 -5.748 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.840 -11.710 -5.694 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.293 -14.359 -5.629 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.702 -14.427 -6.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.431 -14.291 -8.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 1.461 -12.899 -8.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.002 -12.834 -7.373 1.00 0.00 H new ATOM 979 N VAL A 62 -0.850 -10.707 -0.489 1.00 0.00 N ATOM 980 CA VAL A 62 -1.778 -9.902 0.287 1.00 0.00 C ATOM 981 C VAL A 62 -2.484 -8.910 -0.639 1.00 0.00 C ATOM 982 O VAL A 62 -1.834 -8.097 -1.294 1.00 0.00 O ATOM 983 CB VAL A 62 -1.041 -9.222 1.443 1.00 0.00 C ATOM 984 CG1 VAL A 62 0.239 -9.981 1.800 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.736 -7.759 1.113 1.00 0.00 C ATOM 0 H VAL A 62 0.081 -10.303 -0.594 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.547 -10.531 0.735 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.696 -9.240 2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.743 -9.477 2.624 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.013 -10.999 2.097 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.899 -10.009 0.933 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.212 -7.299 1.951 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.110 -7.710 0.222 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.669 -7.225 0.931 1.00 0.00 H new ATOM 995 N ARG A 63 -3.805 -9.009 -0.663 1.00 0.00 N ATOM 996 CA ARG A 63 -4.606 -8.130 -1.498 1.00 0.00 C ATOM 997 C ARG A 63 -5.061 -6.908 -0.698 1.00 0.00 C ATOM 998 O ARG A 63 -5.986 -6.998 0.108 1.00 0.00 O ATOM 999 CB ARG A 63 -5.834 -8.859 -2.045 1.00 0.00 C ATOM 1000 CG ARG A 63 -5.450 -9.795 -3.194 1.00 0.00 C ATOM 1001 CD ARG A 63 -5.097 -9.001 -4.453 1.00 0.00 C ATOM 1002 NE ARG A 63 -5.634 -9.686 -5.650 1.00 0.00 N ATOM 1003 CZ ARG A 63 -5.247 -9.418 -6.905 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -4.320 -8.478 -7.135 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -5.789 -10.090 -7.931 1.00 0.00 N ATOM 0 H ARG A 63 -4.341 -9.684 -0.118 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.985 -7.810 -2.335 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.307 -9.432 -1.247 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.568 -8.132 -2.393 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -4.601 -10.411 -2.898 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.276 -10.473 -3.407 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.508 -7.994 -4.385 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.015 -8.899 -4.537 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.342 -10.407 -5.511 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.908 -7.966 -6.355 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -4.026 -8.275 -8.090 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.495 -10.805 -7.756 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.495 -9.886 -8.886 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.390 -5.793 -0.949 1.00 0.00 N ATOM 1020 CA LEU A 64 -4.715 -4.554 -0.262 1.00 0.00 C ATOM 1021 C LEU A 64 -5.833 -3.834 -1.019 1.00 0.00 C ATOM 1022 O LEU A 64 -5.905 -3.908 -2.245 1.00 0.00 O ATOM 1023 CB LEU A 64 -3.457 -3.704 -0.069 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.494 -4.172 1.024 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -1.193 -3.367 0.988 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -3.160 -4.124 2.400 1.00 0.00 C ATOM 0 H LEU A 64 -3.623 -5.722 -1.618 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.090 -4.761 0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.915 -3.672 -1.014 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.763 -2.683 0.157 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.235 -5.213 0.829 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.526 -3.719 1.775 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.712 -3.497 0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.414 -2.311 1.145 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.453 -4.462 3.158 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.467 -3.102 2.620 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.035 -4.774 2.404 1.00 0.00 H new ATOM 1038 N TYR A 65 -6.678 -3.155 -0.257 1.00 0.00 N ATOM 1039 CA TYR A 65 -7.789 -2.423 -0.840 1.00 0.00 C ATOM 1040 C TYR A 65 -8.114 -1.174 -0.018 1.00 0.00 C ATOM 1041 O TYR A 65 -7.888 -1.146 1.191 1.00 0.00 O ATOM 1042 CB TYR A 65 -8.988 -3.373 -0.797 1.00 0.00 C ATOM 1043 CG TYR A 65 -8.842 -4.600 -1.699 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -8.841 -4.453 -3.071 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -8.711 -5.855 -1.139 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -8.703 -5.608 -3.919 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -8.573 -7.011 -1.988 1.00 0.00 C ATOM 1048 CZ TYR A 65 -8.576 -6.830 -3.336 1.00 0.00 C ATOM 1049 OH TYR A 65 -8.446 -7.921 -4.137 1.00 0.00 O ATOM 0 H TYR A 65 -6.615 -3.097 0.759 1.00 0.00 H new ATOM 0 HA TYR A 65 -7.547 -2.100 -1.853 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.138 -3.706 0.230 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -9.884 -2.825 -1.089 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -8.944 -3.471 -3.509 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.712 -5.970 -0.065 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -8.700 -5.506 -4.994 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.470 -7.999 -1.564 1.00 0.00 H new ATOM 0 HH TYR A 65 -8.363 -8.725 -3.583 1.00 0.00 H new ATOM 1059 N PHE A 66 -8.638 -0.171 -0.707 1.00 0.00 N ATOM 1060 CA PHE A 66 -8.996 1.078 -0.056 1.00 0.00 C ATOM 1061 C PHE A 66 -10.127 1.783 -0.807 1.00 0.00 C ATOM 1062 O PHE A 66 -10.256 1.637 -2.022 1.00 0.00 O ATOM 1063 CB PHE A 66 -7.752 1.967 -0.081 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.515 1.326 0.553 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -5.682 0.562 -0.204 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -6.250 1.520 1.872 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -4.535 -0.033 0.384 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -5.102 0.924 2.460 1.00 0.00 C ATOM 1069 CZ PHE A 66 -4.269 0.161 1.704 1.00 0.00 C ATOM 0 H PHE A 66 -8.823 -0.198 -1.710 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.337 0.883 0.961 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.524 2.227 -1.115 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -7.973 2.898 0.440 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -5.893 0.408 -1.252 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -6.912 2.127 2.473 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -3.874 -0.640 -0.217 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -4.891 1.077 3.508 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.396 -0.291 2.151 1.00 0.00 H new ATOM 1079 N HIS A 67 -10.919 2.532 -0.053 1.00 0.00 N ATOM 1080 CA HIS A 67 -12.035 3.259 -0.632 1.00 0.00 C ATOM 1081 C HIS A 67 -12.067 4.682 -0.070 1.00 0.00 C ATOM 1082 O HIS A 67 -12.332 4.878 1.116 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.348 2.505 -0.413 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.562 3.211 -0.968 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -14.905 4.504 -0.612 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -15.508 2.792 -1.856 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -16.010 4.837 -1.262 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.383 3.775 -2.032 1.00 0.00 N ATOM 0 H HIS A 67 -10.809 2.651 0.954 1.00 0.00 H new ATOM 0 HA HIS A 67 -11.904 3.334 -1.711 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.271 1.520 -0.874 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.490 2.346 0.656 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.540 1.825 -2.335 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.525 5.784 -1.194 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -17.199 3.741 -2.642 1.00 0.00 H new ATOM 1096 N VAL A 68 -11.795 5.637 -0.946 1.00 0.00 N ATOM 1097 CA VAL A 68 -11.790 7.036 -0.552 1.00 0.00 C ATOM 1098 C VAL A 68 -12.943 7.761 -1.247 1.00 0.00 C ATOM 1099 O VAL A 68 -12.919 7.953 -2.462 1.00 0.00 O ATOM 1100 CB VAL A 68 -10.425 7.658 -0.851 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -10.188 8.901 0.011 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -9.302 6.637 -0.660 1.00 0.00 C ATOM 0 H VAL A 68 -11.576 5.470 -1.928 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.947 7.131 0.522 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.421 7.968 -1.896 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.211 9.324 -0.221 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.962 9.640 -0.196 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.223 8.625 1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.343 7.106 -0.879 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.305 6.281 0.370 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.457 5.795 -1.335 1.00 0.00 H new ATOM 1112 N PRO A 69 -13.952 8.156 -0.425 1.00 0.00 N ATOM 1113 CA PRO A 69 -15.113 8.857 -0.948 1.00 0.00 C ATOM 1114 C PRO A 69 -14.771 10.310 -1.283 1.00 0.00 C ATOM 1115 O PRO A 69 -14.747 10.692 -2.452 1.00 0.00 O ATOM 1116 CB PRO A 69 -16.170 8.730 0.136 1.00 0.00 C ATOM 1117 CG PRO A 69 -15.421 8.371 1.409 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.015 7.947 1.018 1.00 0.00 C ATOM 0 HA PRO A 69 -15.472 8.435 -1.887 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -16.720 9.663 0.257 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -16.899 7.961 -0.118 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -15.388 9.225 2.086 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -15.930 7.565 1.937 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -13.263 8.542 1.537 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -13.830 6.904 1.275 1.00 0.00 H new ATOM 1126 N ASP A 70 -14.515 11.081 -0.236 1.00 0.00 N ATOM 1127 CA ASP A 70 -14.176 12.483 -0.405 1.00 0.00 C ATOM 1128 C ASP A 70 -13.183 12.628 -1.560 1.00 0.00 C ATOM 1129 O ASP A 70 -13.134 13.668 -2.215 1.00 0.00 O ATOM 1130 CB ASP A 70 -13.519 13.047 0.857 1.00 0.00 C ATOM 1131 CG ASP A 70 -14.401 13.989 1.679 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -15.186 14.728 1.047 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -14.270 13.948 2.922 1.00 0.00 O ATOM 0 H ASP A 70 -14.536 10.761 0.732 1.00 0.00 H new ATOM 0 HA ASP A 70 -15.097 13.030 -0.608 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -13.212 12.215 1.491 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.613 13.580 0.569 1.00 0.00 H new ATOM 1138 N GLU A 71 -12.415 11.570 -1.773 1.00 0.00 N ATOM 1139 CA GLU A 71 -11.425 11.566 -2.837 1.00 0.00 C ATOM 1140 C GLU A 71 -10.267 12.504 -2.489 1.00 0.00 C ATOM 1141 O GLU A 71 -9.707 13.157 -3.368 1.00 0.00 O ATOM 1142 CB GLU A 71 -12.058 11.951 -4.176 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.181 10.733 -5.095 1.00 0.00 C ATOM 1144 CD GLU A 71 -12.379 11.162 -6.550 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -13.506 11.601 -6.864 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -11.398 11.041 -7.315 1.00 0.00 O ATOM 0 H GLU A 71 -12.458 10.709 -1.227 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.031 10.555 -2.936 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.044 12.383 -4.005 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.454 12.717 -4.661 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.285 10.118 -5.012 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.021 10.116 -4.776 1.00 0.00 H new ATOM 1153 N ALA A 72 -9.943 12.540 -1.205 1.00 0.00 N ATOM 1154 CA ALA A 72 -8.862 13.386 -0.730 1.00 0.00 C ATOM 1155 C ALA A 72 -7.538 12.896 -1.320 1.00 0.00 C ATOM 1156 O ALA A 72 -7.237 11.704 -1.272 1.00 0.00 O ATOM 1157 CB ALA A 72 -8.852 13.391 0.800 1.00 0.00 C ATOM 0 H ALA A 72 -10.410 11.997 -0.479 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.008 14.415 -1.059 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.041 14.026 1.156 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.803 13.776 1.169 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.705 12.375 1.166 1.00 0.00 H new ATOM 1163 N PRO A 73 -6.764 13.864 -1.878 1.00 0.00 N ATOM 1164 CA PRO A 73 -5.480 13.543 -2.477 1.00 0.00 C ATOM 1165 C PRO A 73 -4.426 13.271 -1.402 1.00 0.00 C ATOM 1166 O PRO A 73 -3.304 12.874 -1.714 1.00 0.00 O ATOM 1167 CB PRO A 73 -5.142 14.740 -3.351 1.00 0.00 C ATOM 1168 CG PRO A 73 -6.016 15.880 -2.852 1.00 0.00 C ATOM 1169 CD PRO A 73 -7.089 15.285 -1.954 1.00 0.00 C ATOM 0 HA PRO A 73 -5.510 12.630 -3.071 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.085 14.995 -3.273 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.341 14.526 -4.401 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.418 16.607 -2.302 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.470 16.409 -3.690 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.079 15.747 -0.967 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -8.084 15.442 -2.369 1.00 0.00 H new ATOM 1177 N THR A 74 -4.824 13.496 -0.159 1.00 0.00 N ATOM 1178 CA THR A 74 -3.927 13.281 0.965 1.00 0.00 C ATOM 1179 C THR A 74 -4.152 11.893 1.567 1.00 0.00 C ATOM 1180 O THR A 74 -3.195 11.198 1.908 1.00 0.00 O ATOM 1181 CB THR A 74 -4.140 14.419 1.964 1.00 0.00 C ATOM 1182 OG1 THR A 74 -5.557 14.513 2.087 1.00 0.00 O ATOM 1183 CG2 THR A 74 -3.724 15.779 1.401 1.00 0.00 C ATOM 0 H THR A 74 -5.755 13.825 0.095 1.00 0.00 H new ATOM 0 HA THR A 74 -2.884 13.299 0.649 1.00 0.00 H new ATOM 0 HB THR A 74 -3.574 14.214 2.873 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.797 15.393 2.445 1.00 0.00 H new ATOM 0 HG21 THR A 74 -3.896 16.551 2.151 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.666 15.756 1.139 1.00 0.00 H new ATOM 0 HG23 THR A 74 -4.313 16.000 0.511 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.421 11.530 1.680 1.00 0.00 N ATOM 1192 CA VAL A 75 -5.783 10.237 2.236 1.00 0.00 C ATOM 1193 C VAL A 75 -5.544 9.150 1.186 1.00 0.00 C ATOM 1194 O VAL A 75 -5.037 8.076 1.503 1.00 0.00 O ATOM 1195 CB VAL A 75 -7.226 10.271 2.743 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.729 8.861 3.060 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -7.357 11.187 3.961 1.00 0.00 C ATOM 0 H VAL A 75 -6.212 12.109 1.396 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.156 10.002 3.096 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.851 10.679 1.949 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.757 8.913 3.418 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.690 8.249 2.159 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.099 8.414 3.829 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.392 11.193 4.302 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.714 10.822 4.762 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.058 12.199 3.689 1.00 0.00 H new ATOM 1207 N LYS A 76 -5.921 9.467 -0.044 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.754 8.532 -1.143 1.00 0.00 C ATOM 1209 C LYS A 76 -4.262 8.333 -1.416 1.00 0.00 C ATOM 1210 O LYS A 76 -3.813 7.212 -1.647 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.547 8.995 -2.367 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.132 7.802 -3.125 1.00 0.00 C ATOM 1213 CD LYS A 76 -8.013 8.268 -4.286 1.00 0.00 C ATOM 1214 CE LYS A 76 -8.123 7.185 -5.360 1.00 0.00 C ATOM 1215 NZ LYS A 76 -9.541 6.942 -5.708 1.00 0.00 N ATOM 0 H LYS A 76 -6.342 10.359 -0.304 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.163 7.557 -0.878 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.351 9.661 -2.053 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.898 9.569 -3.029 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.324 7.177 -3.505 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.718 7.186 -2.443 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.007 8.519 -3.915 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.596 9.176 -4.722 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.571 7.489 -6.249 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -7.667 6.262 -5.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.598 6.204 -6.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.058 6.631 -4.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.965 7.820 -6.069 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.534 9.440 -1.381 1.00 0.00 N ATOM 1230 CA ALA A 77 -2.102 9.402 -1.622 1.00 0.00 C ATOM 1231 C ALA A 77 -1.508 8.163 -0.948 1.00 0.00 C ATOM 1232 O ALA A 77 -1.029 7.255 -1.624 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.465 10.700 -1.120 1.00 0.00 C ATOM 0 H ALA A 77 -3.910 10.369 -1.189 1.00 0.00 H new ATOM 0 HA ALA A 77 -1.895 9.328 -2.690 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.390 10.672 -1.301 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.900 11.547 -1.650 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.650 10.807 -0.051 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.561 8.167 0.376 1.00 0.00 N ATOM 1240 CA PHE A 78 -1.034 7.054 1.148 1.00 0.00 C ATOM 1241 C PHE A 78 -1.588 5.722 0.639 1.00 0.00 C ATOM 1242 O PHE A 78 -0.827 4.806 0.330 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.486 7.261 2.595 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.477 6.774 3.637 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.831 7.134 3.538 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -0.888 5.982 4.664 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.767 6.682 4.505 1.00 0.00 C ATOM 1248 CE2 PHE A 78 0.048 5.530 5.631 1.00 0.00 C ATOM 1249 CZ PHE A 78 1.356 5.890 5.531 1.00 0.00 C ATOM 0 H PHE A 78 -1.960 8.922 0.933 1.00 0.00 H new ATOM 0 HA PHE A 78 0.052 7.022 1.061 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.677 8.322 2.757 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.431 6.740 2.748 1.00 0.00 H new ATOM 0 HD1 PHE A 78 1.158 7.764 2.724 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.927 5.697 4.744 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.806 6.967 4.426 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.278 4.901 6.446 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.068 5.547 6.267 1.00 0.00 H new ATOM 1259 N ALA A 79 -2.909 5.656 0.566 1.00 0.00 N ATOM 1260 CA ALA A 79 -3.574 4.451 0.099 1.00 0.00 C ATOM 1261 C ALA A 79 -2.795 3.869 -1.082 1.00 0.00 C ATOM 1262 O ALA A 79 -2.739 2.652 -1.253 1.00 0.00 O ATOM 1263 CB ALA A 79 -5.025 4.776 -0.263 1.00 0.00 C ATOM 0 H ALA A 79 -3.537 6.418 0.822 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.595 3.696 0.884 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.524 3.872 -0.613 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.543 5.158 0.617 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.044 5.529 -1.051 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.213 4.765 -1.865 1.00 0.00 N ATOM 1270 CA GLY A 80 -1.440 4.356 -3.025 1.00 0.00 C ATOM 1271 C GLY A 80 -0.045 3.881 -2.614 1.00 0.00 C ATOM 1272 O GLY A 80 0.437 2.861 -3.104 1.00 0.00 O ATOM 0 H GLY A 80 -2.261 5.773 -1.719 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.961 3.555 -3.550 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.354 5.190 -3.722 1.00 0.00 H new ATOM 1276 N LEU A 81 0.564 4.643 -1.718 1.00 0.00 N ATOM 1277 CA LEU A 81 1.894 4.313 -1.235 1.00 0.00 C ATOM 1278 C LEU A 81 1.854 2.957 -0.527 1.00 0.00 C ATOM 1279 O LEU A 81 2.844 2.228 -0.516 1.00 0.00 O ATOM 1280 CB LEU A 81 2.445 5.445 -0.365 1.00 0.00 C ATOM 1281 CG LEU A 81 3.121 5.020 0.940 1.00 0.00 C ATOM 1282 CD1 LEU A 81 2.095 4.479 1.938 1.00 0.00 C ATOM 1283 CD2 LEU A 81 4.245 4.017 0.674 1.00 0.00 C ATOM 0 H LEU A 81 0.161 5.488 -1.314 1.00 0.00 H new ATOM 0 HA LEU A 81 2.588 4.217 -2.070 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.164 6.013 -0.955 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.626 6.122 -0.123 1.00 0.00 H new ATOM 0 HG LEU A 81 3.576 5.902 1.392 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.602 4.184 2.857 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.361 5.253 2.161 1.00 0.00 H new ATOM 0 HD13 LEU A 81 1.590 3.614 1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.709 3.731 1.618 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.835 3.131 0.189 1.00 0.00 H new ATOM 0 HD23 LEU A 81 4.993 4.473 0.025 1.00 0.00 H new ATOM 1295 N LEU A 82 0.697 2.660 0.048 1.00 0.00 N ATOM 1296 CA LEU A 82 0.514 1.405 0.756 1.00 0.00 C ATOM 1297 C LEU A 82 0.576 0.247 -0.242 1.00 0.00 C ATOM 1298 O LEU A 82 1.497 -0.566 -0.198 1.00 0.00 O ATOM 1299 CB LEU A 82 -0.775 1.438 1.581 1.00 0.00 C ATOM 1300 CG LEU A 82 -0.882 2.563 2.612 1.00 0.00 C ATOM 1301 CD1 LEU A 82 -2.258 2.563 3.282 1.00 0.00 C ATOM 1302 CD2 LEU A 82 0.253 2.479 3.635 1.00 0.00 C ATOM 0 H LEU A 82 -0.122 3.267 0.038 1.00 0.00 H new ATOM 0 HA LEU A 82 1.320 1.251 1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.619 1.518 0.896 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.875 0.485 2.101 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.777 3.515 2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.308 3.372 4.011 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.031 2.707 2.527 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.417 1.610 3.787 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.153 3.290 4.356 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.204 1.522 4.155 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.211 2.565 3.123 1.00 0.00 H new ATOM 1314 N ARG A 83 -0.417 0.209 -1.118 1.00 0.00 N ATOM 1315 CA ARG A 83 -0.488 -0.835 -2.125 1.00 0.00 C ATOM 1316 C ARG A 83 0.748 -0.787 -3.027 1.00 0.00 C ATOM 1317 O ARG A 83 1.074 -1.769 -3.692 1.00 0.00 O ATOM 1318 CB ARG A 83 -1.744 -0.688 -2.985 1.00 0.00 C ATOM 1319 CG ARG A 83 -1.458 0.143 -4.238 1.00 0.00 C ATOM 1320 CD ARG A 83 -2.750 0.711 -4.826 1.00 0.00 C ATOM 1321 NE ARG A 83 -2.533 1.108 -6.235 1.00 0.00 N ATOM 1322 CZ ARG A 83 -2.267 0.246 -7.226 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -2.184 -1.066 -6.968 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -2.084 0.696 -8.475 1.00 0.00 N ATOM 0 H ARG A 83 -1.180 0.885 -1.151 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.528 -1.793 -1.606 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.109 -1.674 -3.274 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.534 -0.214 -2.403 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -0.778 0.958 -3.991 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.957 -0.476 -4.982 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.544 -0.033 -4.767 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.077 1.572 -4.243 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.589 2.100 -6.466 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -2.323 -1.409 -6.017 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -1.982 -1.722 -7.722 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -2.147 1.695 -8.672 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -1.882 0.040 -9.229 1.00 0.00 H new ATOM 1338 N GLU A 84 1.401 0.365 -3.021 1.00 0.00 N ATOM 1339 CA GLU A 84 2.593 0.555 -3.830 1.00 0.00 C ATOM 1340 C GLU A 84 3.618 -0.541 -3.529 1.00 0.00 C ATOM 1341 O GLU A 84 4.032 -1.272 -4.428 1.00 0.00 O ATOM 1342 CB GLU A 84 3.193 1.944 -3.605 1.00 0.00 C ATOM 1343 CG GLU A 84 2.870 2.877 -4.773 1.00 0.00 C ATOM 1344 CD GLU A 84 3.299 2.258 -6.105 1.00 0.00 C ATOM 1345 OE1 GLU A 84 4.518 2.292 -6.379 1.00 0.00 O ATOM 1346 OE2 GLU A 84 2.399 1.764 -6.818 1.00 0.00 O ATOM 0 H GLU A 84 1.127 1.177 -2.468 1.00 0.00 H new ATOM 0 HA GLU A 84 2.311 0.484 -4.881 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.803 2.367 -2.679 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.274 1.863 -3.488 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.800 3.084 -4.792 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.377 3.831 -4.632 1.00 0.00 H new ATOM 1353 N GLY A 85 3.997 -0.620 -2.262 1.00 0.00 N ATOM 1354 CA GLY A 85 4.966 -1.615 -1.832 1.00 0.00 C ATOM 1355 C GLY A 85 4.371 -2.533 -0.763 1.00 0.00 C ATOM 1356 O GLY A 85 4.960 -2.716 0.301 1.00 0.00 O ATOM 0 H GLY A 85 3.651 -0.012 -1.520 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.288 -2.208 -2.688 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.852 -1.118 -1.437 1.00 0.00 H new ATOM 1360 N LEU A 86 3.211 -3.087 -1.084 1.00 0.00 N ATOM 1361 CA LEU A 86 2.530 -3.982 -0.164 1.00 0.00 C ATOM 1362 C LEU A 86 1.610 -4.915 -0.954 1.00 0.00 C ATOM 1363 O LEU A 86 1.593 -6.122 -0.719 1.00 0.00 O ATOM 1364 CB LEU A 86 1.809 -3.185 0.925 1.00 0.00 C ATOM 1365 CG LEU A 86 2.687 -2.264 1.774 1.00 0.00 C ATOM 1366 CD1 LEU A 86 1.832 -1.362 2.667 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.706 -3.070 2.581 1.00 0.00 C ATOM 0 H LEU A 86 2.726 -2.933 -1.968 1.00 0.00 H new ATOM 0 HA LEU A 86 3.251 -4.611 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.034 -2.581 0.453 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.306 -3.888 1.589 1.00 0.00 H new ATOM 0 HG LEU A 86 3.249 -1.614 1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.480 -0.717 3.260 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.180 -0.748 2.046 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.226 -1.977 3.332 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.318 -2.392 3.176 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.182 -3.761 3.242 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.345 -3.633 1.901 1.00 0.00 H new ATOM 1379 N GLU A 87 0.867 -4.320 -1.876 1.00 0.00 N ATOM 1380 CA GLU A 87 -0.054 -5.082 -2.702 1.00 0.00 C ATOM 1381 C GLU A 87 0.712 -6.102 -3.547 1.00 0.00 C ATOM 1382 O GLU A 87 1.542 -5.729 -4.376 1.00 0.00 O ATOM 1383 CB GLU A 87 -0.892 -4.157 -3.586 1.00 0.00 C ATOM 1384 CG GLU A 87 -1.765 -4.963 -4.551 1.00 0.00 C ATOM 1385 CD GLU A 87 -1.105 -5.071 -5.927 1.00 0.00 C ATOM 1386 OE1 GLU A 87 -0.851 -4.000 -6.520 1.00 0.00 O ATOM 1387 OE2 GLU A 87 -0.869 -6.221 -6.355 1.00 0.00 O ATOM 0 H GLU A 87 0.884 -3.319 -2.069 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.738 -5.621 -2.047 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.523 -3.524 -2.961 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.236 -3.495 -4.150 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.935 -5.961 -4.146 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.741 -4.487 -4.648 1.00 0.00 H new ATOM 1394 N GLY A 88 0.407 -7.369 -3.309 1.00 0.00 N ATOM 1395 CA GLY A 88 1.056 -8.445 -4.038 1.00 0.00 C ATOM 1396 C GLY A 88 2.167 -9.083 -3.201 1.00 0.00 C ATOM 1397 O GLY A 88 2.594 -10.202 -3.480 1.00 0.00 O ATOM 0 H GLY A 88 -0.281 -7.675 -2.621 1.00 0.00 H new ATOM 0 HA2 GLY A 88 0.320 -9.202 -4.308 1.00 0.00 H new ATOM 0 HA3 GLY A 88 1.473 -8.059 -4.968 1.00 0.00 H new ATOM 1401 N GLU A 89 2.602 -8.344 -2.191 1.00 0.00 N ATOM 1402 CA GLU A 89 3.654 -8.823 -1.311 1.00 0.00 C ATOM 1403 C GLU A 89 3.121 -9.933 -0.403 1.00 0.00 C ATOM 1404 O GLU A 89 1.997 -10.399 -0.580 1.00 0.00 O ATOM 1405 CB GLU A 89 4.245 -7.677 -0.488 1.00 0.00 C ATOM 1406 CG GLU A 89 4.959 -6.667 -1.389 1.00 0.00 C ATOM 1407 CD GLU A 89 5.915 -7.372 -2.353 1.00 0.00 C ATOM 1408 OE1 GLU A 89 7.015 -7.745 -1.891 1.00 0.00 O ATOM 1409 OE2 GLU A 89 5.524 -7.523 -3.531 1.00 0.00 O ATOM 0 H GLU A 89 2.245 -7.416 -1.963 1.00 0.00 H new ATOM 0 HA GLU A 89 4.455 -9.235 -1.925 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.452 -7.177 0.068 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.946 -8.075 0.245 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.223 -6.095 -1.954 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.513 -5.956 -0.776 1.00 0.00 H new ATOM 1416 N SER A 90 3.954 -10.323 0.551 1.00 0.00 N ATOM 1417 CA SER A 90 3.581 -11.369 1.488 1.00 0.00 C ATOM 1418 C SER A 90 3.012 -10.749 2.766 1.00 0.00 C ATOM 1419 O SER A 90 3.282 -9.588 3.070 1.00 0.00 O ATOM 1420 CB SER A 90 4.777 -12.264 1.819 1.00 0.00 C ATOM 1421 OG SER A 90 5.958 -11.506 2.066 1.00 0.00 O ATOM 0 H SER A 90 4.886 -9.933 0.695 1.00 0.00 H new ATOM 0 HA SER A 90 2.816 -11.989 1.021 1.00 0.00 H new ATOM 0 HB2 SER A 90 4.545 -12.870 2.695 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.954 -12.953 0.993 1.00 0.00 H new ATOM 0 HG SER A 90 6.698 -12.113 2.275 1.00 0.00 H new ATOM 1427 N PRO A 91 2.215 -11.571 3.499 1.00 0.00 N ATOM 1428 CA PRO A 91 1.607 -11.116 4.737 1.00 0.00 C ATOM 1429 C PRO A 91 2.638 -11.053 5.865 1.00 0.00 C ATOM 1430 O PRO A 91 2.422 -10.381 6.873 1.00 0.00 O ATOM 1431 CB PRO A 91 0.486 -12.105 5.012 1.00 0.00 C ATOM 1432 CG PRO A 91 0.802 -13.335 4.177 1.00 0.00 C ATOM 1433 CD PRO A 91 1.874 -12.952 3.170 1.00 0.00 C ATOM 0 HA PRO A 91 1.216 -10.101 4.664 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.436 -12.355 6.072 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.482 -11.685 4.738 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.149 -14.149 4.813 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -0.093 -13.689 3.666 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.744 -13.604 3.250 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.505 -13.036 2.148 1.00 0.00 H new ATOM 1441 N GLU A 92 3.738 -11.762 5.658 1.00 0.00 N ATOM 1442 CA GLU A 92 4.804 -11.796 6.645 1.00 0.00 C ATOM 1443 C GLU A 92 5.582 -10.479 6.631 1.00 0.00 C ATOM 1444 O GLU A 92 6.017 -9.999 7.677 1.00 0.00 O ATOM 1445 CB GLU A 92 5.736 -12.986 6.405 1.00 0.00 C ATOM 1446 CG GLU A 92 4.937 -14.270 6.173 1.00 0.00 C ATOM 1447 CD GLU A 92 5.252 -15.313 7.247 1.00 0.00 C ATOM 1448 OE1 GLU A 92 6.434 -15.713 7.321 1.00 0.00 O ATOM 1449 OE2 GLU A 92 4.304 -15.688 7.970 1.00 0.00 O ATOM 0 H GLU A 92 3.914 -12.318 4.821 1.00 0.00 H new ATOM 0 HA GLU A 92 4.356 -11.921 7.631 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.370 -12.787 5.541 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.396 -13.114 7.263 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.870 -14.045 6.181 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.170 -14.675 5.188 1.00 0.00 H new ATOM 1456 N ALA A 93 5.734 -9.931 5.434 1.00 0.00 N ATOM 1457 CA ALA A 93 6.452 -8.678 5.270 1.00 0.00 C ATOM 1458 C ALA A 93 5.500 -7.511 5.539 1.00 0.00 C ATOM 1459 O ALA A 93 5.901 -6.496 6.106 1.00 0.00 O ATOM 1460 CB ALA A 93 7.065 -8.620 3.870 1.00 0.00 C ATOM 0 H ALA A 93 5.372 -10.332 4.569 1.00 0.00 H new ATOM 0 HA ALA A 93 7.270 -8.608 5.987 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.603 -7.680 3.747 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.755 -9.453 3.740 1.00 0.00 H new ATOM 0 HB3 ALA A 93 6.274 -8.685 3.123 1.00 0.00 H new ATOM 1466 N VAL A 94 4.257 -7.694 5.119 1.00 0.00 N ATOM 1467 CA VAL A 94 3.244 -6.668 5.307 1.00 0.00 C ATOM 1468 C VAL A 94 2.961 -6.506 6.802 1.00 0.00 C ATOM 1469 O VAL A 94 2.408 -5.492 7.226 1.00 0.00 O ATOM 1470 CB VAL A 94 1.994 -7.013 4.495 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.837 -6.075 4.847 1.00 0.00 C ATOM 1472 CG2 VAL A 94 2.289 -6.982 2.995 1.00 0.00 C ATOM 0 H VAL A 94 3.928 -8.537 4.649 1.00 0.00 H new ATOM 0 HA VAL A 94 3.600 -5.706 4.938 1.00 0.00 H new ATOM 0 HB VAL A 94 1.694 -8.028 4.755 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -0.040 -6.341 4.256 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.602 -6.169 5.907 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.123 -5.046 4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 94 1.384 -7.231 2.441 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.626 -5.985 2.711 1.00 0.00 H new ATOM 0 HG23 VAL A 94 3.068 -7.708 2.762 1.00 0.00 H new ATOM 1482 N LEU A 95 3.353 -7.519 7.560 1.00 0.00 N ATOM 1483 CA LEU A 95 3.148 -7.501 8.998 1.00 0.00 C ATOM 1484 C LEU A 95 4.404 -6.956 9.681 1.00 0.00 C ATOM 1485 O LEU A 95 4.311 -6.197 10.645 1.00 0.00 O ATOM 1486 CB LEU A 95 2.729 -8.886 9.497 1.00 0.00 C ATOM 1487 CG LEU A 95 1.222 -9.145 9.568 1.00 0.00 C ATOM 1488 CD1 LEU A 95 0.930 -10.636 9.745 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.571 -8.299 10.664 1.00 0.00 C ATOM 0 H LEU A 95 3.812 -8.358 7.205 1.00 0.00 H new ATOM 0 HA LEU A 95 2.327 -6.832 9.257 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.176 -9.636 8.845 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.151 -9.035 10.491 1.00 0.00 H new ATOM 0 HG LEU A 95 0.778 -8.840 8.620 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.148 -10.793 9.793 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.340 -11.190 8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.389 -10.990 10.668 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.499 -8.502 10.693 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.014 -8.549 11.628 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.734 -7.242 10.453 1.00 0.00 H new ATOM 1501 N GLU A 96 5.549 -7.364 9.155 1.00 0.00 N ATOM 1502 CA GLU A 96 6.822 -6.926 9.702 1.00 0.00 C ATOM 1503 C GLU A 96 6.974 -5.412 9.546 1.00 0.00 C ATOM 1504 O GLU A 96 7.887 -4.814 10.114 1.00 0.00 O ATOM 1505 CB GLU A 96 7.987 -7.665 9.039 1.00 0.00 C ATOM 1506 CG GLU A 96 8.104 -9.094 9.572 1.00 0.00 C ATOM 1507 CD GLU A 96 9.327 -9.243 10.479 1.00 0.00 C ATOM 1508 OE1 GLU A 96 9.169 -8.985 11.692 1.00 0.00 O ATOM 1509 OE2 GLU A 96 10.393 -9.611 9.939 1.00 0.00 O ATOM 0 H GLU A 96 5.622 -7.993 8.356 1.00 0.00 H new ATOM 0 HA GLU A 96 6.840 -7.166 10.765 1.00 0.00 H new ATOM 0 HB2 GLU A 96 7.841 -7.687 7.959 1.00 0.00 H new ATOM 0 HB3 GLU A 96 8.916 -7.127 9.224 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.202 -9.354 10.126 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.178 -9.792 8.738 1.00 0.00 H new ATOM 1516 N VAL A 97 6.065 -4.835 8.774 1.00 0.00 N ATOM 1517 CA VAL A 97 6.086 -3.401 8.537 1.00 0.00 C ATOM 1518 C VAL A 97 5.513 -2.678 9.757 1.00 0.00 C ATOM 1519 O VAL A 97 4.418 -3.000 10.216 1.00 0.00 O ATOM 1520 CB VAL A 97 5.340 -3.074 7.242 1.00 0.00 C ATOM 1521 CG1 VAL A 97 5.018 -1.581 7.157 1.00 0.00 C ATOM 1522 CG2 VAL A 97 6.135 -3.535 6.019 1.00 0.00 C ATOM 0 H VAL A 97 5.309 -5.334 8.305 1.00 0.00 H new ATOM 0 HA VAL A 97 7.110 -3.051 8.404 1.00 0.00 H new ATOM 0 HB VAL A 97 4.397 -3.620 7.252 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.488 -1.376 6.227 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.392 -1.295 8.002 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.944 -1.007 7.181 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.582 -3.290 5.112 1.00 0.00 H new ATOM 0 HG22 VAL A 97 7.101 -3.031 6.002 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.289 -4.613 6.070 1.00 0.00 H new ATOM 1532 N PRO A 98 6.298 -1.688 10.260 1.00 0.00 N ATOM 1533 CA PRO A 98 5.879 -0.917 11.418 1.00 0.00 C ATOM 1534 C PRO A 98 4.791 0.091 11.041 1.00 0.00 C ATOM 1535 O PRO A 98 4.533 0.319 9.861 1.00 0.00 O ATOM 1536 CB PRO A 98 7.149 -0.256 11.931 1.00 0.00 C ATOM 1537 CG PRO A 98 8.139 -0.306 10.778 1.00 0.00 C ATOM 1538 CD PRO A 98 7.600 -1.279 9.742 1.00 0.00 C ATOM 0 HA PRO A 98 5.426 -1.535 12.193 1.00 0.00 H new ATOM 0 HB2 PRO A 98 6.958 0.772 12.237 1.00 0.00 H new ATOM 0 HB3 PRO A 98 7.538 -0.781 12.803 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.267 0.685 10.341 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.119 -0.628 11.130 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.506 -0.805 8.765 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.264 -2.135 9.619 1.00 0.00 H new ATOM 1546 N PRO A 99 4.166 0.682 12.095 1.00 0.00 N ATOM 1547 CA PRO A 99 3.112 1.660 11.886 1.00 0.00 C ATOM 1548 C PRO A 99 3.691 3.002 11.431 1.00 0.00 C ATOM 1549 O PRO A 99 2.945 3.931 11.124 1.00 0.00 O ATOM 1550 CB PRO A 99 2.387 1.747 13.219 1.00 0.00 C ATOM 1551 CG PRO A 99 3.342 1.169 14.251 1.00 0.00 C ATOM 1552 CD PRO A 99 4.446 0.437 13.506 1.00 0.00 C ATOM 0 HA PRO A 99 2.424 1.373 11.091 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.132 2.779 13.458 1.00 0.00 H new ATOM 0 HB3 PRO A 99 1.453 1.185 13.193 1.00 0.00 H new ATOM 0 HG2 PRO A 99 3.761 1.962 14.870 1.00 0.00 H new ATOM 0 HG3 PRO A 99 2.815 0.487 14.919 1.00 0.00 H new ATOM 0 HD2 PRO A 99 5.430 0.814 13.786 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.437 -0.629 13.732 1.00 0.00 H new ATOM 1560 N GLY A 100 5.014 3.060 11.403 1.00 0.00 N ATOM 1561 CA GLY A 100 5.701 4.272 10.991 1.00 0.00 C ATOM 1562 C GLY A 100 6.875 3.949 10.064 1.00 0.00 C ATOM 1563 O GLY A 100 8.009 4.343 10.333 1.00 0.00 O ATOM 0 H GLY A 100 5.629 2.287 11.659 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.002 4.935 10.481 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.063 4.806 11.870 1.00 0.00 H new ATOM 1567 N PHE A 101 6.562 3.235 8.992 1.00 0.00 N ATOM 1568 CA PHE A 101 7.577 2.855 8.025 1.00 0.00 C ATOM 1569 C PHE A 101 7.882 4.008 7.067 1.00 0.00 C ATOM 1570 O PHE A 101 8.887 3.983 6.358 1.00 0.00 O ATOM 1571 CB PHE A 101 7.014 1.678 7.225 1.00 0.00 C ATOM 1572 CG PHE A 101 5.710 1.994 6.489 1.00 0.00 C ATOM 1573 CD1 PHE A 101 5.712 2.867 5.447 1.00 0.00 C ATOM 1574 CD2 PHE A 101 4.550 1.401 6.877 1.00 0.00 C ATOM 1575 CE1 PHE A 101 4.502 3.160 4.764 1.00 0.00 C ATOM 1576 CE2 PHE A 101 3.340 1.693 6.194 1.00 0.00 C ATOM 1577 CZ PHE A 101 3.341 2.567 5.152 1.00 0.00 C ATOM 0 H PHE A 101 5.620 2.910 8.772 1.00 0.00 H new ATOM 0 HA PHE A 101 8.501 2.593 8.540 1.00 0.00 H new ATOM 0 HB2 PHE A 101 7.760 1.355 6.499 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.844 0.840 7.901 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.634 3.338 5.139 1.00 0.00 H new ATOM 0 HD2 PHE A 101 4.549 0.708 7.705 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.504 3.854 3.936 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.419 1.221 6.502 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.421 2.790 4.633 1.00 0.00 H new ATOM 1587 N TYR A 102 6.995 4.993 7.076 1.00 0.00 N ATOM 1588 CA TYR A 102 7.156 6.154 6.217 1.00 0.00 C ATOM 1589 C TYR A 102 7.980 7.239 6.911 1.00 0.00 C ATOM 1590 O TYR A 102 8.472 8.161 6.262 1.00 0.00 O ATOM 1591 CB TYR A 102 5.745 6.687 5.961 1.00 0.00 C ATOM 1592 CG TYR A 102 4.994 7.095 7.230 1.00 0.00 C ATOM 1593 CD1 TYR A 102 5.119 8.377 7.724 1.00 0.00 C ATOM 1594 CD2 TYR A 102 4.190 6.180 7.880 1.00 0.00 C ATOM 1595 CE1 TYR A 102 4.412 8.761 8.918 1.00 0.00 C ATOM 1596 CE2 TYR A 102 3.483 6.564 9.074 1.00 0.00 C ATOM 1597 CZ TYR A 102 3.629 7.835 9.534 1.00 0.00 C ATOM 1598 OH TYR A 102 2.961 8.198 10.662 1.00 0.00 O ATOM 0 H TYR A 102 6.162 5.011 7.665 1.00 0.00 H new ATOM 0 HA TYR A 102 7.674 5.882 5.297 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.808 7.548 5.296 1.00 0.00 H new ATOM 0 HB3 TYR A 102 5.168 5.923 5.440 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.747 9.093 7.215 1.00 0.00 H new ATOM 0 HD2 TYR A 102 4.091 5.177 7.493 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.501 9.761 9.315 1.00 0.00 H new ATOM 0 HE2 TYR A 102 2.851 5.858 9.593 1.00 0.00 H new ATOM 0 HH TYR A 102 2.002 8.261 10.469 1.00 0.00 H new ATOM 1608 N ARG A 103 8.106 7.095 8.222 1.00 0.00 N ATOM 1609 CA ARG A 103 8.863 8.052 9.012 1.00 0.00 C ATOM 1610 C ARG A 103 10.265 8.231 8.427 1.00 0.00 C ATOM 1611 O ARG A 103 10.983 7.255 8.214 1.00 0.00 O ATOM 1612 CB ARG A 103 8.979 7.595 10.467 1.00 0.00 C ATOM 1613 CG ARG A 103 7.611 7.592 11.152 1.00 0.00 C ATOM 1614 CD ARG A 103 7.712 8.134 12.580 1.00 0.00 C ATOM 1615 NE ARG A 103 6.620 9.101 12.832 1.00 0.00 N ATOM 1616 CZ ARG A 103 6.528 9.859 13.933 1.00 0.00 C ATOM 1617 NH1 ARG A 103 7.461 9.766 14.891 1.00 0.00 N ATOM 1618 NH2 ARG A 103 5.502 10.709 14.077 1.00 0.00 N ATOM 0 H ARG A 103 7.696 6.330 8.758 1.00 0.00 H new ATOM 0 HA ARG A 103 8.330 9.002 8.983 1.00 0.00 H new ATOM 0 HB2 ARG A 103 9.410 6.595 10.504 1.00 0.00 H new ATOM 0 HB3 ARG A 103 9.658 8.255 11.006 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.911 8.199 10.577 1.00 0.00 H new ATOM 0 HG3 ARG A 103 7.212 6.578 11.171 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.654 7.313 13.295 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.678 8.617 12.727 1.00 0.00 H new ATOM 0 HE ARG A 103 5.892 9.196 12.124 1.00 0.00 H new ATOM 0 HH11 ARG A 103 8.241 9.118 14.782 1.00 0.00 H new ATOM 0 HH12 ARG A 103 7.391 10.343 15.729 1.00 0.00 H new ATOM 0 HH21 ARG A 103 4.791 10.779 13.349 1.00 0.00 H new ATOM 0 HH22 ARG A 103 5.432 11.286 14.915 1.00 0.00 H new ATOM 1632 N GLY A 104 10.614 9.486 8.183 1.00 0.00 N ATOM 1633 CA GLY A 104 11.918 9.806 7.627 1.00 0.00 C ATOM 1634 C GLY A 104 12.003 9.391 6.157 1.00 0.00 C ATOM 1635 O GLY A 104 12.614 8.375 5.830 1.00 0.00 O ATOM 0 H GLY A 104 10.016 10.293 8.360 1.00 0.00 H new ATOM 0 HA2 GLY A 104 12.104 10.876 7.718 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.695 9.298 8.198 1.00 0.00 H new ATOM 1639 N TYR A 105 11.383 10.200 5.310 1.00 0.00 N ATOM 1640 CA TYR A 105 11.381 9.930 3.883 1.00 0.00 C ATOM 1641 C TYR A 105 10.883 11.143 3.096 1.00 0.00 C ATOM 1642 O TYR A 105 11.521 11.568 2.133 1.00 0.00 O ATOM 1643 CB TYR A 105 10.408 8.767 3.674 1.00 0.00 C ATOM 1644 CG TYR A 105 11.066 7.387 3.733 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.100 7.079 2.872 1.00 0.00 C ATOM 1646 CD2 TYR A 105 10.625 6.451 4.646 1.00 0.00 C ATOM 1647 CE1 TYR A 105 12.719 5.780 2.927 1.00 0.00 C ATOM 1648 CE2 TYR A 105 11.244 5.152 4.701 1.00 0.00 C ATOM 1649 CZ TYR A 105 12.260 4.880 3.839 1.00 0.00 C ATOM 1650 OH TYR A 105 12.845 3.653 3.890 1.00 0.00 O ATOM 0 H TYR A 105 10.879 11.043 5.585 1.00 0.00 H new ATOM 0 HA TYR A 105 12.388 9.700 3.535 1.00 0.00 H new ATOM 0 HB2 TYR A 105 9.628 8.819 4.433 1.00 0.00 H new ATOM 0 HB3 TYR A 105 9.920 8.884 2.706 1.00 0.00 H new ATOM 0 HD1 TYR A 105 12.445 7.812 2.157 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.816 6.693 5.319 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.529 5.526 2.260 1.00 0.00 H new ATOM 0 HE2 TYR A 105 10.909 4.410 5.411 1.00 0.00 H new ATOM 0 HH TYR A 105 12.417 3.115 4.588 1.00 0.00 H new ATOM 1660 N GLY A 106 9.748 11.668 3.534 1.00 0.00 N ATOM 1661 CA GLY A 106 9.157 12.824 2.882 1.00 0.00 C ATOM 1662 C GLY A 106 7.709 13.026 3.332 1.00 0.00 C ATOM 1663 O GLY A 106 7.337 14.113 3.771 1.00 0.00 O ATOM 0 H GLY A 106 9.222 11.314 4.333 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.741 13.715 3.113 1.00 0.00 H new ATOM 0 HA3 GLY A 106 9.191 12.693 1.800 1.00 0.00 H new ATOM 1667 N LEU A 107 6.930 11.961 3.206 1.00 0.00 N ATOM 1668 CA LEU A 107 5.530 12.008 3.594 1.00 0.00 C ATOM 1669 C LEU A 107 5.418 12.555 5.018 1.00 0.00 C ATOM 1670 O LEU A 107 4.605 13.439 5.285 1.00 0.00 O ATOM 1671 CB LEU A 107 4.877 10.637 3.408 1.00 0.00 C ATOM 1672 CG LEU A 107 5.373 9.813 2.218 1.00 0.00 C ATOM 1673 CD1 LEU A 107 6.336 8.715 2.674 1.00 0.00 C ATOM 1674 CD2 LEU A 107 4.199 9.249 1.415 1.00 0.00 C ATOM 0 H LEU A 107 7.242 11.061 2.841 1.00 0.00 H new ATOM 0 HA LEU A 107 4.977 12.689 2.947 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.033 10.056 4.317 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.802 10.780 3.302 1.00 0.00 H new ATOM 0 HG LEU A 107 5.930 10.473 1.554 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.673 8.144 1.809 1.00 0.00 H new ATOM 0 HD12 LEU A 107 7.196 9.167 3.168 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.826 8.050 3.371 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.579 8.667 0.575 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.594 8.608 2.056 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.587 10.069 1.041 1.00 0.00 H new ATOM 1686 N GLU A 108 6.246 12.007 5.895 1.00 0.00 N ATOM 1687 CA GLU A 108 6.250 12.430 7.286 1.00 0.00 C ATOM 1688 C GLU A 108 6.161 13.954 7.377 1.00 0.00 C ATOM 1689 O GLU A 108 5.555 14.490 8.304 1.00 0.00 O ATOM 1690 CB GLU A 108 7.490 11.907 8.014 1.00 0.00 C ATOM 1691 CG GLU A 108 7.217 11.740 9.510 1.00 0.00 C ATOM 1692 CD GLU A 108 8.494 11.944 10.327 1.00 0.00 C ATOM 1693 OE1 GLU A 108 9.481 11.239 10.023 1.00 0.00 O ATOM 1694 OE2 GLU A 108 8.456 12.801 11.236 1.00 0.00 O ATOM 0 H GLU A 108 6.919 11.274 5.670 1.00 0.00 H new ATOM 0 HA GLU A 108 5.375 12.005 7.778 1.00 0.00 H new ATOM 0 HB2 GLU A 108 7.791 10.951 7.586 1.00 0.00 H new ATOM 0 HB3 GLU A 108 8.321 12.597 7.867 1.00 0.00 H new ATOM 0 HG2 GLU A 108 6.460 12.457 9.827 1.00 0.00 H new ATOM 0 HG3 GLU A 108 6.814 10.745 9.701 1.00 0.00 H new ATOM 1701 N GLU A 109 6.775 14.610 6.404 1.00 0.00 N ATOM 1702 CA GLU A 109 6.773 16.063 6.363 1.00 0.00 C ATOM 1703 C GLU A 109 5.495 16.573 5.694 1.00 0.00 C ATOM 1704 O GLU A 109 4.718 17.304 6.307 1.00 0.00 O ATOM 1705 CB GLU A 109 8.016 16.593 5.646 1.00 0.00 C ATOM 1706 CG GLU A 109 9.011 17.190 6.644 1.00 0.00 C ATOM 1707 CD GLU A 109 10.314 17.588 5.947 1.00 0.00 C ATOM 1708 OE1 GLU A 109 10.301 18.645 5.281 1.00 0.00 O ATOM 1709 OE2 GLU A 109 11.294 16.825 6.097 1.00 0.00 O ATOM 0 H GLU A 109 7.278 14.162 5.637 1.00 0.00 H new ATOM 0 HA GLU A 109 6.798 16.436 7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 109 8.492 15.785 5.091 1.00 0.00 H new ATOM 0 HB3 GLU A 109 7.725 17.351 4.919 1.00 0.00 H new ATOM 0 HG2 GLU A 109 8.570 18.063 7.125 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.222 16.466 7.431 1.00 0.00 H new ATOM 1716 N PHE A 110 5.317 16.169 4.444 1.00 0.00 N ATOM 1717 CA PHE A 110 4.147 16.576 3.685 1.00 0.00 C ATOM 1718 C PHE A 110 2.888 16.531 4.553 1.00 0.00 C ATOM 1719 O PHE A 110 2.313 17.570 4.874 1.00 0.00 O ATOM 1720 CB PHE A 110 3.994 15.583 2.532 1.00 0.00 C ATOM 1721 CG PHE A 110 4.896 15.878 1.332 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.898 17.118 0.772 1.00 0.00 C ATOM 1723 CD2 PHE A 110 5.695 14.901 0.826 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.736 17.392 -0.341 1.00 0.00 C ATOM 1725 CE2 PHE A 110 6.532 15.175 -0.288 1.00 0.00 C ATOM 1726 CZ PHE A 110 6.535 16.415 -0.848 1.00 0.00 C ATOM 0 H PHE A 110 5.964 15.564 3.938 1.00 0.00 H new ATOM 0 HA PHE A 110 4.272 17.598 3.327 1.00 0.00 H new ATOM 0 HB2 PHE A 110 4.211 14.580 2.899 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.955 15.583 2.201 1.00 0.00 H new ATOM 0 HD1 PHE A 110 4.263 17.893 1.174 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.693 13.917 1.271 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.739 18.376 -0.785 1.00 0.00 H new ATOM 0 HE2 PHE A 110 7.166 14.399 -0.691 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.172 16.623 -1.695 1.00 0.00 H new ATOM 1736 N PHE A 111 2.495 15.316 4.908 1.00 0.00 N ATOM 1737 CA PHE A 111 1.315 15.122 5.732 1.00 0.00 C ATOM 1738 C PHE A 111 1.550 15.629 7.156 1.00 0.00 C ATOM 1739 O PHE A 111 2.649 15.494 7.693 1.00 0.00 O ATOM 1740 CB PHE A 111 1.044 13.616 5.777 1.00 0.00 C ATOM 1741 CG PHE A 111 0.785 12.989 4.406 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.418 13.162 3.796 1.00 0.00 C ATOM 1743 CD2 PHE A 111 1.757 12.258 3.798 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.659 12.580 2.523 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.517 11.676 2.525 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.314 11.849 1.915 1.00 0.00 C ATOM 0 H PHE A 111 2.974 14.456 4.640 1.00 0.00 H new ATOM 0 HA PHE A 111 0.474 15.675 5.313 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.897 13.117 6.238 1.00 0.00 H new ATOM 0 HB3 PHE A 111 0.182 13.431 6.418 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -1.190 13.742 4.280 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.712 12.120 4.283 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.614 12.718 2.038 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.289 11.096 2.042 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.131 11.406 0.947 1.00 0.00 H new ATOM 1756 N THR A 112 0.501 16.201 7.727 1.00 0.00 N ATOM 1757 CA THR A 112 0.580 16.729 9.078 1.00 0.00 C ATOM 1758 C THR A 112 0.822 15.598 10.080 1.00 0.00 C ATOM 1759 O THR A 112 0.585 14.431 9.772 1.00 0.00 O ATOM 1760 CB THR A 112 -0.701 17.519 9.353 1.00 0.00 C ATOM 1761 OG1 THR A 112 -1.737 16.695 8.826 1.00 0.00 O ATOM 1762 CG2 THR A 112 -0.787 18.802 8.523 1.00 0.00 C ATOM 0 H THR A 112 -0.409 16.311 7.279 1.00 0.00 H new ATOM 0 HA THR A 112 1.427 17.406 9.188 1.00 0.00 H new ATOM 0 HB THR A 112 -0.753 17.768 10.413 1.00 0.00 H new ATOM 0 HG1 THR A 112 -2.604 17.131 8.964 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.715 19.325 8.756 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.061 19.445 8.758 1.00 0.00 H new ATOM 0 HG23 THR A 112 -0.769 18.551 7.462 1.00 0.00 H new ATOM 1770 N PRO A 113 1.303 15.994 11.289 1.00 0.00 N ATOM 1771 CA PRO A 113 1.580 15.026 12.337 1.00 0.00 C ATOM 1772 C PRO A 113 0.284 14.526 12.978 1.00 0.00 C ATOM 1773 O PRO A 113 0.305 13.604 13.792 1.00 0.00 O ATOM 1774 CB PRO A 113 2.484 15.756 13.317 1.00 0.00 C ATOM 1775 CG PRO A 113 2.304 17.237 13.027 1.00 0.00 C ATOM 1776 CD PRO A 113 1.595 17.367 11.688 1.00 0.00 C ATOM 0 HA PRO A 113 2.066 14.126 11.961 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.212 15.524 14.347 1.00 0.00 H new ATOM 0 HB3 PRO A 113 3.524 15.456 13.187 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.721 17.712 13.816 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.270 17.741 12.998 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.682 17.956 11.779 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.225 17.868 10.953 1.00 0.00 H new ATOM 1784 N LEU A 114 -0.814 15.157 12.586 1.00 0.00 N ATOM 1785 CA LEU A 114 -2.117 14.787 13.112 1.00 0.00 C ATOM 1786 C LEU A 114 -2.723 13.688 12.237 1.00 0.00 C ATOM 1787 O LEU A 114 -2.915 12.562 12.692 1.00 0.00 O ATOM 1788 CB LEU A 114 -3.008 16.023 13.253 1.00 0.00 C ATOM 1789 CG LEU A 114 -3.999 16.006 14.418 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -5.213 15.133 14.094 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -3.312 15.574 15.716 1.00 0.00 C ATOM 0 H LEU A 114 -0.828 15.921 11.911 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.020 14.376 14.117 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.367 16.898 13.360 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -3.569 16.150 12.327 1.00 0.00 H new ATOM 0 HG LEU A 114 -4.365 17.022 14.569 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -5.901 15.139 14.939 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -5.718 15.526 13.212 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -4.885 14.112 13.900 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -4.039 15.570 16.528 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -2.900 14.572 15.594 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -2.508 16.271 15.952 1.00 0.00 H new ATOM 1803 N ARG A 115 -3.007 14.054 10.996 1.00 0.00 N ATOM 1804 CA ARG A 115 -3.587 13.114 10.052 1.00 0.00 C ATOM 1805 C ARG A 115 -2.747 11.836 9.992 1.00 0.00 C ATOM 1806 O ARG A 115 -3.290 10.734 9.930 1.00 0.00 O ATOM 1807 CB ARG A 115 -3.677 13.723 8.652 1.00 0.00 C ATOM 1808 CG ARG A 115 -4.863 14.684 8.547 1.00 0.00 C ATOM 1809 CD ARG A 115 -5.106 15.099 7.094 1.00 0.00 C ATOM 1810 NE ARG A 115 -5.385 16.550 7.023 1.00 0.00 N ATOM 1811 CZ ARG A 115 -5.842 17.174 5.928 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -6.073 16.477 4.807 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -6.068 18.495 5.955 1.00 0.00 N ATOM 0 H ARG A 115 -2.846 14.989 10.622 1.00 0.00 H new ATOM 0 HA ARG A 115 -4.593 12.876 10.397 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -2.753 14.254 8.422 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -3.781 12.929 7.912 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.758 14.208 8.947 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -4.674 15.569 9.155 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.233 14.858 6.487 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -5.945 14.538 6.682 1.00 0.00 H new ATOM 0 HE ARG A 115 -5.219 17.110 7.859 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -5.901 15.472 4.787 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -6.421 16.952 3.974 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -5.892 19.025 6.809 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -6.416 18.970 5.122 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.436 12.026 10.013 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.516 10.903 9.962 1.00 0.00 C ATOM 1829 C LEU A 116 -0.999 9.809 10.916 1.00 0.00 C ATOM 1830 O LEU A 116 -0.958 8.626 10.582 1.00 0.00 O ATOM 1831 CB LEU A 116 0.915 11.370 10.236 1.00 0.00 C ATOM 1832 CG LEU A 116 1.729 11.792 9.011 1.00 0.00 C ATOM 1833 CD1 LEU A 116 2.928 12.651 9.419 1.00 0.00 C ATOM 1834 CD2 LEU A 116 2.150 10.575 8.185 1.00 0.00 C ATOM 0 H LEU A 116 -0.989 12.941 10.065 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.500 10.470 8.962 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.875 12.211 10.928 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.448 10.565 10.742 1.00 0.00 H new ATOM 0 HG LEU A 116 1.093 12.408 8.375 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.490 12.937 8.530 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.576 13.547 9.930 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.573 12.081 10.088 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.727 10.904 7.321 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.761 9.913 8.798 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.263 10.040 7.847 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.447 10.244 12.085 1.00 0.00 N ATOM 1847 CA ARG A 117 -1.938 9.316 13.090 1.00 0.00 C ATOM 1848 C ARG A 117 -3.007 8.400 12.490 1.00 0.00 C ATOM 1849 O ARG A 117 -3.017 7.198 12.751 1.00 0.00 O ATOM 1850 CB ARG A 117 -2.530 10.064 14.287 1.00 0.00 C ATOM 1851 CG ARG A 117 -1.433 10.761 15.095 1.00 0.00 C ATOM 1852 CD ARG A 117 -1.724 10.682 16.595 1.00 0.00 C ATOM 1853 NE ARG A 117 -0.479 10.903 17.364 1.00 0.00 N ATOM 1854 CZ ARG A 117 0.148 12.083 17.455 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -0.349 13.157 16.825 1.00 0.00 N ATOM 1856 NH2 ARG A 117 1.273 12.191 18.175 1.00 0.00 N ATOM 0 H ARG A 117 -1.480 11.226 12.358 1.00 0.00 H new ATOM 0 HA ARG A 117 -1.093 8.718 13.431 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.254 10.801 13.938 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.069 9.365 14.926 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -0.470 10.297 14.883 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -1.359 11.805 14.790 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -2.468 11.430 16.869 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -2.145 9.707 16.841 1.00 0.00 H new ATOM 0 HE ARG A 117 -0.073 10.107 17.856 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -1.205 13.076 16.276 1.00 0.00 H new ATOM 0 HH12 ARG A 117 0.129 14.056 16.895 1.00 0.00 H new ATOM 0 HH21 ARG A 117 1.652 11.374 18.654 1.00 0.00 H new ATOM 0 HH22 ARG A 117 1.750 13.090 18.244 1.00 0.00 H new ATOM 1870 N GLY A 118 -3.881 9.004 11.698 1.00 0.00 N ATOM 1871 CA GLY A 118 -4.951 8.257 11.059 1.00 0.00 C ATOM 1872 C GLY A 118 -4.398 7.312 9.990 1.00 0.00 C ATOM 1873 O GLY A 118 -4.990 6.270 9.713 1.00 0.00 O ATOM 0 H GLY A 118 -3.870 10.001 11.484 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -5.497 7.684 11.808 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.662 8.948 10.606 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.271 7.710 9.420 1.00 0.00 N ATOM 1878 CA LEU A 119 -2.632 6.911 8.388 1.00 0.00 C ATOM 1879 C LEU A 119 -2.138 5.598 8.998 1.00 0.00 C ATOM 1880 O LEU A 119 -2.460 4.519 8.501 1.00 0.00 O ATOM 1881 CB LEU A 119 -1.533 7.716 7.691 1.00 0.00 C ATOM 1882 CG LEU A 119 -2.008 8.782 6.702 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -0.820 9.486 6.041 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -2.966 8.185 5.669 1.00 0.00 C ATOM 0 H LEU A 119 -2.784 8.575 9.653 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.349 6.652 7.609 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.926 8.202 8.455 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -0.882 7.021 7.161 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.563 9.538 7.257 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.186 10.239 5.343 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.210 9.967 6.806 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.217 8.755 5.503 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.288 8.964 4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.458 7.396 5.114 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.836 7.768 6.177 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.366 5.732 10.066 1.00 0.00 N ATOM 1897 CA GLU A 120 -0.826 4.569 10.749 1.00 0.00 C ATOM 1898 C GLU A 120 -1.945 3.579 11.080 1.00 0.00 C ATOM 1899 O GLU A 120 -1.810 2.381 10.839 1.00 0.00 O ATOM 1900 CB GLU A 120 -0.065 4.979 12.012 1.00 0.00 C ATOM 1901 CG GLU A 120 0.930 6.101 11.713 1.00 0.00 C ATOM 1902 CD GLU A 120 0.707 7.295 12.643 1.00 0.00 C ATOM 1903 OE1 GLU A 120 0.406 7.041 13.829 1.00 0.00 O ATOM 1904 OE2 GLU A 120 0.844 8.434 12.147 1.00 0.00 O ATOM 0 H GLU A 120 -1.102 6.628 10.475 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.119 4.077 10.082 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.770 5.308 12.775 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.465 4.117 12.418 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.948 5.730 11.830 1.00 0.00 H new ATOM 0 HG3 GLU A 120 0.824 6.419 10.676 1.00 0.00 H new ATOM 1911 N ALA A 121 -3.024 4.118 11.628 1.00 0.00 N ATOM 1912 CA ALA A 121 -4.166 3.298 11.994 1.00 0.00 C ATOM 1913 C ALA A 121 -4.496 2.346 10.842 1.00 0.00 C ATOM 1914 O ALA A 121 -4.910 1.210 11.070 1.00 0.00 O ATOM 1915 CB ALA A 121 -5.347 4.200 12.361 1.00 0.00 C ATOM 0 H ALA A 121 -3.131 5.113 11.827 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.936 2.690 12.869 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -6.204 3.584 12.635 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.072 4.835 13.203 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.608 4.824 11.506 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.300 2.845 9.630 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.571 2.053 8.443 1.00 0.00 C ATOM 1923 C ALA A 122 -3.755 0.760 8.500 1.00 0.00 C ATOM 1924 O ALA A 122 -4.305 -0.315 8.735 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.262 2.883 7.195 1.00 0.00 C ATOM 0 H ALA A 122 -3.957 3.788 9.445 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.624 1.776 8.398 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.465 2.289 6.304 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.888 3.775 7.187 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.212 3.177 7.204 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.457 0.906 8.281 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.560 -0.237 8.305 1.00 0.00 C ATOM 1933 C LEU A 123 -1.928 -1.144 9.481 1.00 0.00 C ATOM 1934 O LEU A 123 -2.146 -2.341 9.301 1.00 0.00 O ATOM 1935 CB LEU A 123 -0.102 0.226 8.318 1.00 0.00 C ATOM 1936 CG LEU A 123 0.953 -0.882 8.339 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.333 -1.250 9.774 1.00 0.00 C ATOM 1938 CD2 LEU A 123 0.485 -2.100 7.539 1.00 0.00 C ATOM 0 H LEU A 123 -2.004 1.799 8.086 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.674 -0.830 7.397 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.069 0.847 7.439 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.049 0.861 9.191 1.00 0.00 H new ATOM 0 HG LEU A 123 1.854 -0.505 7.854 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.084 -2.040 9.760 1.00 0.00 H new ATOM 0 HD12 LEU A 123 1.737 -0.373 10.280 1.00 0.00 H new ATOM 0 HD13 LEU A 123 0.448 -1.600 10.306 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.253 -2.873 7.570 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -0.437 -2.487 7.972 1.00 0.00 H new ATOM 0 HD23 LEU A 123 0.305 -1.808 6.504 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.987 -0.538 10.658 1.00 0.00 N ATOM 1951 CA LEU A 124 -2.325 -1.276 11.863 1.00 0.00 C ATOM 1952 C LEU A 124 -3.486 -2.227 11.565 1.00 0.00 C ATOM 1953 O LEU A 124 -3.388 -3.428 11.809 1.00 0.00 O ATOM 1954 CB LEU A 124 -2.599 -0.315 13.021 1.00 0.00 C ATOM 1955 CG LEU A 124 -1.402 0.501 13.512 1.00 0.00 C ATOM 1956 CD1 LEU A 124 -1.853 1.848 14.082 1.00 0.00 C ATOM 1957 CD2 LEU A 124 -0.570 -0.297 14.518 1.00 0.00 C ATOM 0 H LEU A 124 -1.806 0.455 10.803 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.483 -1.890 12.182 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -3.384 0.377 12.715 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.990 -0.891 13.860 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.759 0.712 12.657 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.983 2.408 14.424 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -2.369 2.416 13.308 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.529 1.680 14.921 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.275 0.306 14.851 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.189 -0.559 15.376 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.202 -1.207 14.045 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.560 -1.652 11.042 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.739 -2.433 10.708 1.00 0.00 C ATOM 1971 C ARG A 125 -5.350 -3.644 9.856 1.00 0.00 C ATOM 1972 O ARG A 125 -5.395 -4.779 10.328 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.761 -1.589 9.945 1.00 0.00 C ATOM 1974 CG ARG A 125 -7.571 -0.711 10.902 1.00 0.00 C ATOM 1975 CD ARG A 125 -8.109 0.529 10.186 1.00 0.00 C ATOM 1976 NE ARG A 125 -8.302 1.630 11.156 1.00 0.00 N ATOM 1977 CZ ARG A 125 -9.285 1.667 12.065 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -10.171 0.663 12.135 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -9.382 2.706 12.906 1.00 0.00 N ATOM 0 H ARG A 125 -4.638 -0.655 10.842 1.00 0.00 H new ATOM 0 HA ARG A 125 -6.188 -2.770 11.642 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.248 -0.962 9.216 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.433 -2.241 9.387 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -8.400 -1.286 11.314 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.945 -0.408 11.741 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -7.414 0.839 9.406 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.054 0.295 9.696 1.00 0.00 H new ATOM 0 HE ARG A 125 -7.645 2.410 11.131 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -10.096 -0.129 11.496 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -10.920 0.691 12.827 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -8.707 3.469 12.854 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -10.131 2.734 13.598 1.00 0.00 H new ATOM 1993 N LEU A 126 -4.978 -3.360 8.617 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.582 -4.411 7.695 1.00 0.00 C ATOM 1995 C LEU A 126 -3.784 -5.474 8.453 1.00 0.00 C ATOM 1996 O LEU A 126 -4.215 -6.621 8.557 1.00 0.00 O ATOM 1997 CB LEU A 126 -3.836 -3.820 6.497 1.00 0.00 C ATOM 1998 CG LEU A 126 -4.565 -2.713 5.732 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -6.073 -2.970 5.703 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -4.229 -1.336 6.307 1.00 0.00 C ATOM 0 H LEU A 126 -4.942 -2.417 8.230 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.461 -4.906 7.281 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.882 -3.425 6.847 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.610 -4.627 5.801 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.216 -2.724 4.699 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.568 -2.169 5.154 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -6.270 -3.923 5.212 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -6.456 -3.001 6.723 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -4.760 -0.568 5.745 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.532 -1.295 7.353 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -3.155 -1.163 6.233 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.635 -5.054 8.963 1.00 0.00 N ATOM 2013 CA GLN A 127 -1.774 -5.956 9.708 1.00 0.00 C ATOM 2014 C GLN A 127 -2.611 -6.869 10.606 1.00 0.00 C ATOM 2015 O GLN A 127 -2.347 -8.067 10.697 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.742 -5.177 10.527 1.00 0.00 C ATOM 2017 CG GLN A 127 0.197 -4.385 9.615 1.00 0.00 C ATOM 2018 CD GLN A 127 1.560 -4.178 10.278 1.00 0.00 C ATOM 2019 OE1 GLN A 127 1.668 -3.720 11.404 1.00 0.00 O ATOM 2020 NE2 GLN A 127 2.591 -4.539 9.520 1.00 0.00 N ATOM 0 H GLN A 127 -2.281 -4.102 8.875 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.231 -6.578 8.997 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -1.252 -4.497 11.209 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -0.163 -5.867 11.140 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.325 -4.914 8.671 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -0.248 -3.418 9.381 1.00 0.00 H new ATOM 0 HE21 GLN A 127 2.430 -4.916 8.586 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.543 -4.439 9.873 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.603 -6.268 11.246 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.480 -7.012 12.134 1.00 0.00 C ATOM 2031 C ALA A 128 -5.331 -7.980 11.310 1.00 0.00 C ATOM 2032 O ALA A 128 -5.512 -9.134 11.694 1.00 0.00 O ATOM 2033 CB ALA A 128 -5.331 -6.035 12.947 1.00 0.00 C ATOM 0 H ALA A 128 -3.819 -5.274 11.167 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.898 -7.604 12.841 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.989 -6.593 13.613 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.680 -5.389 13.537 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -5.931 -5.426 12.271 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.829 -7.474 10.191 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.657 -8.280 9.309 1.00 0.00 C ATOM 2041 C GLN A 129 -5.828 -9.404 8.685 1.00 0.00 C ATOM 2042 O GLN A 129 -6.174 -10.578 8.810 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.310 -7.416 8.229 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.200 -6.338 8.853 1.00 0.00 C ATOM 2045 CD GLN A 129 -8.645 -5.319 7.803 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -7.963 -5.058 6.825 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.824 -4.758 8.058 1.00 0.00 N ATOM 0 H GLN A 129 -5.675 -6.516 9.875 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.455 -8.728 9.901 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.539 -6.947 7.618 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.904 -8.044 7.566 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.075 -6.802 9.308 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.658 -5.830 9.651 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.344 -5.022 8.895 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.208 -4.064 7.416 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.750 -9.006 8.026 1.00 0.00 N ATOM 2057 CA VAL A 130 -3.869 -9.965 7.381 1.00 0.00 C ATOM 2058 C VAL A 130 -3.644 -11.154 8.318 1.00 0.00 C ATOM 2059 O VAL A 130 -3.769 -12.306 7.906 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.567 -9.280 6.961 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -1.608 -10.279 6.310 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -2.845 -8.099 6.030 1.00 0.00 C ATOM 0 H VAL A 130 -4.466 -8.032 7.925 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.326 -10.351 6.470 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.087 -8.892 7.859 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.690 -9.767 6.021 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -1.373 -11.072 7.019 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -2.077 -10.710 5.426 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.903 -7.630 5.746 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.358 -8.453 5.136 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.473 -7.371 6.543 1.00 0.00 H new ATOM 2072 N ARG A 131 -3.317 -10.833 9.561 1.00 0.00 N ATOM 2073 CA ARG A 131 -3.074 -11.860 10.560 1.00 0.00 C ATOM 2074 C ARG A 131 -4.109 -12.980 10.433 1.00 0.00 C ATOM 2075 O ARG A 131 -3.754 -14.157 10.408 1.00 0.00 O ATOM 2076 CB ARG A 131 -3.133 -11.278 11.974 1.00 0.00 C ATOM 2077 CG ARG A 131 -1.727 -11.062 12.537 1.00 0.00 C ATOM 2078 CD ARG A 131 -1.732 -9.988 13.627 1.00 0.00 C ATOM 2079 NE ARG A 131 -0.402 -9.914 14.271 1.00 0.00 N ATOM 2080 CZ ARG A 131 0.044 -10.794 15.177 1.00 0.00 C ATOM 2081 NH1 ARG A 131 -0.731 -11.821 15.552 1.00 0.00 N ATOM 2082 NH2 ARG A 131 1.266 -10.648 15.709 1.00 0.00 N ATOM 0 H ARG A 131 -3.215 -9.876 9.899 1.00 0.00 H new ATOM 0 HA ARG A 131 -2.076 -12.262 10.386 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -3.672 -10.331 11.959 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -3.690 -11.951 12.625 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -1.347 -11.998 12.946 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -1.051 -10.767 11.734 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -1.990 -9.021 13.195 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -2.494 -10.218 14.372 1.00 0.00 H new ATOM 0 HE ARG A 131 0.214 -9.145 14.009 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -1.661 -11.933 15.147 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -0.391 -12.491 16.242 1.00 0.00 H new ATOM 0 HH21 ARG A 131 1.856 -9.867 15.424 1.00 0.00 H new ATOM 0 HH22 ARG A 131 1.605 -11.318 16.399 1.00 0.00 H new ATOM 2096 N LYS A 132 -5.367 -12.573 10.356 1.00 0.00 N ATOM 2097 CA LYS A 132 -6.456 -13.527 10.232 1.00 0.00 C ATOM 2098 C LYS A 132 -6.330 -14.267 8.899 1.00 0.00 C ATOM 2099 O LYS A 132 -6.581 -15.469 8.826 1.00 0.00 O ATOM 2100 CB LYS A 132 -7.804 -12.830 10.424 1.00 0.00 C ATOM 2101 CG LYS A 132 -8.803 -13.264 9.349 1.00 0.00 C ATOM 2102 CD LYS A 132 -8.658 -12.409 8.088 1.00 0.00 C ATOM 2103 CE LYS A 132 -8.969 -13.226 6.833 1.00 0.00 C ATOM 2104 NZ LYS A 132 -10.431 -13.317 6.623 1.00 0.00 N ATOM 0 H LYS A 132 -5.657 -11.595 10.377 1.00 0.00 H new ATOM 0 HA LYS A 132 -6.397 -14.277 11.020 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -8.202 -13.065 11.411 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -7.668 -11.749 10.384 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -8.643 -14.313 9.101 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -9.819 -13.179 9.736 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -9.331 -11.553 8.145 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -7.644 -12.014 8.027 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -8.499 -12.763 5.965 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -8.546 -14.226 6.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -10.625 -13.875 5.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -10.872 -13.779 7.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -10.826 -12.361 6.510 1.00 0.00 H new ATOM 2118 N ALA A 133 -5.942 -13.518 7.877 1.00 0.00 N ATOM 2119 CA ALA A 133 -5.780 -14.088 6.550 1.00 0.00 C ATOM 2120 C ALA A 133 -4.591 -15.051 6.555 1.00 0.00 C ATOM 2121 O ALA A 133 -4.575 -16.027 5.807 1.00 0.00 O ATOM 2122 CB ALA A 133 -5.615 -12.962 5.527 1.00 0.00 C ATOM 0 H ALA A 133 -5.735 -12.521 7.941 1.00 0.00 H new ATOM 0 HA ALA A 133 -6.665 -14.658 6.267 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -5.493 -13.390 4.532 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -6.499 -12.324 5.542 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -4.735 -12.369 5.777 1.00 0.00 H new ATOM 2128 N LEU A 134 -3.624 -14.742 7.406 1.00 0.00 N ATOM 2129 CA LEU A 134 -2.433 -15.567 7.518 1.00 0.00 C ATOM 2130 C LEU A 134 -2.720 -16.745 8.452 1.00 0.00 C ATOM 2131 O LEU A 134 -2.457 -17.895 8.106 1.00 0.00 O ATOM 2132 CB LEU A 134 -1.233 -14.721 7.947 1.00 0.00 C ATOM 2133 CG LEU A 134 -0.864 -14.783 9.430 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -0.394 -16.185 9.820 1.00 0.00 C ATOM 2135 CD2 LEU A 134 0.171 -13.713 9.782 1.00 0.00 C ATOM 0 H LEU A 134 -3.641 -13.931 8.025 1.00 0.00 H new ATOM 0 HA LEU A 134 -2.167 -15.986 6.547 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -0.367 -15.034 7.364 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -1.435 -13.682 7.686 1.00 0.00 H new ATOM 0 HG LEU A 134 -1.759 -14.570 10.014 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.138 -16.201 10.879 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.192 -16.903 9.628 1.00 0.00 H new ATOM 0 HD13 LEU A 134 0.483 -16.452 9.231 1.00 0.00 H new ATOM 0 HD21 LEU A 134 0.416 -13.779 10.842 1.00 0.00 H new ATOM 0 HD22 LEU A 134 1.073 -13.871 9.191 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -0.238 -12.726 9.565 1.00 0.00 H new ATOM 2147 N THR A 135 -3.257 -16.416 9.618 1.00 0.00 N ATOM 2148 CA THR A 135 -3.583 -17.432 10.605 1.00 0.00 C ATOM 2149 C THR A 135 -4.984 -17.991 10.352 1.00 0.00 C ATOM 2150 O THR A 135 -5.603 -18.555 11.253 1.00 0.00 O ATOM 2151 CB THR A 135 -3.417 -16.813 11.994 1.00 0.00 C ATOM 2152 OG1 THR A 135 -3.613 -17.906 12.887 1.00 0.00 O ATOM 2153 CG2 THR A 135 -4.546 -15.841 12.340 1.00 0.00 C ATOM 0 H THR A 135 -3.474 -15.461 9.901 1.00 0.00 H new ATOM 0 HA THR A 135 -2.909 -18.285 10.532 1.00 0.00 H new ATOM 0 HB THR A 135 -2.461 -16.292 12.048 1.00 0.00 H new ATOM 0 HG1 THR A 135 -4.356 -18.460 12.568 1.00 0.00 H new ATOM 0 HG21 THR A 135 -4.380 -15.430 13.336 1.00 0.00 H new ATOM 0 HG22 THR A 135 -4.564 -15.030 11.611 1.00 0.00 H new ATOM 0 HG23 THR A 135 -5.499 -16.369 12.320 1.00 0.00 H new ATOM 2161 N SER A 136 -5.444 -17.814 9.122 1.00 0.00 N ATOM 2162 CA SER A 136 -6.762 -18.294 8.740 1.00 0.00 C ATOM 2163 C SER A 136 -7.837 -17.586 9.567 1.00 0.00 C ATOM 2164 O SER A 136 -8.917 -18.132 9.785 1.00 0.00 O ATOM 2165 CB SER A 136 -6.869 -19.810 8.917 1.00 0.00 C ATOM 2166 OG SER A 136 -6.227 -20.517 7.859 1.00 0.00 O ATOM 0 H SER A 136 -4.928 -17.345 8.377 1.00 0.00 H new ATOM 0 HA SER A 136 -6.916 -18.067 7.685 1.00 0.00 H new ATOM 0 HB2 SER A 136 -6.421 -20.097 9.869 1.00 0.00 H new ATOM 0 HB3 SER A 136 -7.920 -20.097 8.960 1.00 0.00 H new ATOM 0 HG SER A 136 -6.316 -21.481 8.009 1.00 0.00 H new