USER MOD reduce.3.24.130724 H: found=0, std=0, add=408, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 407 hydrogens (6 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 NoAdj-H: A 7 TPO H2 : A 7 TPO N : A 6 ARG C :(H bumps) USER MOD Set 1.1: B 36 SER OG : rot -108:sc= 1.19 USER MOD Set 1.2: B 38 SER OG : rot 91:sc= 2.15 USER MOD Set 2.1: B 21 ASN : amide:sc= -0.313 X(o=-0.72,f=-0.56) USER MOD Set 2.2: B 24 THR OG1 : rot 180:sc= -0.408 USER MOD Single : A 1 LYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -149:sc= 1.04 (180deg=0.447) USER MOD Single : A 11 SER OG : rot -71:sc= 1.17 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : B 1 LYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 MET CE :methyl 161:sc= -0.239 (180deg=-1.15) USER MOD Single : B 11 SER OG : rot -26:sc= 1.25 USER MOD Single : B 13 SER OG : rot 37:sc= 0.0604 USER MOD Single : B 14 SER OG : rot -26:sc= 0.861 USER MOD Single : B 18 TYR OH : rot -30:sc= 1.27 USER MOD Single : B 19 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 25 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : B 27 SER OG : rot 93:sc= 1.1 USER MOD Single : B 28 GLN : amide:sc= -0.0463 X(o=-0.046,f=0) USER MOD Single : B 33 SER OG : rot 153:sc= 1.23 USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : B 37 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 -48.254 -2.524 62.779 1.00 0.00 N ATOM 2 CA LYS A 1 -48.922 -2.716 61.457 1.00 0.00 C ATOM 3 C LYS A 1 -48.477 -1.576 60.476 1.00 0.00 C ATOM 4 O LYS A 1 -48.706 -0.407 60.788 1.00 0.00 O ATOM 5 CB LYS A 1 -50.473 -2.740 61.630 1.00 0.00 C ATOM 6 CG LYS A 1 -51.124 -3.983 62.304 1.00 0.00 C ATOM 7 CD LYS A 1 -52.673 -3.899 62.288 1.00 0.00 C ATOM 8 CE LYS A 1 -53.368 -5.133 62.906 1.00 0.00 C ATOM 9 NZ LYS A 1 -54.854 -4.977 62.833 1.00 0.00 N ATOM 0 H1 LYS A 1 -48.549 -3.280 63.430 1.00 0.00 H new ATOM 0 H2 LYS A 1 -47.222 -2.557 62.655 1.00 0.00 H new ATOM 0 H3 LYS A 1 -48.525 -1.601 63.174 1.00 0.00 H new ATOM 0 HA LYS A 1 -48.622 -3.675 61.034 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -50.756 -1.862 62.210 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -50.919 -2.627 60.642 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -50.803 -4.887 61.787 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -50.775 -4.064 63.333 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -52.985 -3.007 62.831 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -53.011 -3.780 61.259 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -53.063 -6.035 62.376 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -53.058 -5.253 63.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -55.312 -5.812 63.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -55.140 -4.126 63.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -55.145 -4.884 61.839 1.00 0.00 H new ATOM 25 N VAL A 2 -47.835 -1.891 59.337 1.00 0.00 N ATOM 26 CA VAL A 2 -47.351 -0.861 58.356 1.00 0.00 C ATOM 27 C VAL A 2 -47.372 -1.441 56.895 1.00 0.00 C ATOM 28 O VAL A 2 -47.006 -2.599 56.671 1.00 0.00 O ATOM 29 CB VAL A 2 -45.958 -0.272 58.794 1.00 0.00 C ATOM 30 CG1 VAL A 2 -44.762 -1.253 58.728 1.00 0.00 C ATOM 31 CG2 VAL A 2 -45.570 1.006 58.017 1.00 0.00 C ATOM 0 H VAL A 2 -47.631 -2.851 59.058 1.00 0.00 H new ATOM 0 HA VAL A 2 -48.036 -0.013 58.354 1.00 0.00 H new ATOM 0 HB VAL A 2 -46.135 -0.042 59.845 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -43.855 -0.743 59.051 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -44.953 -2.104 59.383 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -44.636 -1.604 57.704 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -44.601 1.363 58.365 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -45.513 0.781 56.952 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -46.322 1.777 58.186 1.00 0.00 H new ATOM 41 N SER A 3 -47.771 -0.629 55.899 1.00 0.00 N ATOM 42 CA SER A 3 -47.600 -0.988 54.458 1.00 0.00 C ATOM 43 C SER A 3 -46.211 -0.505 53.919 1.00 0.00 C ATOM 44 O SER A 3 -46.051 0.652 53.517 1.00 0.00 O ATOM 45 CB SER A 3 -48.786 -0.388 53.666 1.00 0.00 C ATOM 46 OG SER A 3 -50.040 -0.933 54.084 1.00 0.00 O ATOM 0 H SER A 3 -48.213 0.277 56.053 1.00 0.00 H new ATOM 0 HA SER A 3 -47.607 -2.071 54.333 1.00 0.00 H new ATOM 0 HB2 SER A 3 -48.799 0.694 53.797 1.00 0.00 H new ATOM 0 HB3 SER A 3 -48.645 -0.578 52.602 1.00 0.00 H new ATOM 0 HG SER A 3 -50.763 -0.528 53.562 1.00 0.00 H new ATOM 52 N VAL A 4 -45.200 -1.389 53.942 1.00 0.00 N ATOM 53 CA VAL A 4 -43.775 -1.016 53.650 1.00 0.00 C ATOM 54 C VAL A 4 -43.472 -0.818 52.115 1.00 0.00 C ATOM 55 O VAL A 4 -43.017 -1.725 51.411 1.00 0.00 O ATOM 56 CB VAL A 4 -42.828 -1.990 54.439 1.00 0.00 C ATOM 57 CG1 VAL A 4 -42.856 -3.479 54.014 1.00 0.00 C ATOM 58 CG2 VAL A 4 -41.357 -1.519 54.440 1.00 0.00 C ATOM 0 H VAL A 4 -45.328 -2.377 54.160 1.00 0.00 H new ATOM 0 HA VAL A 4 -43.567 -0.013 54.023 1.00 0.00 H new ATOM 0 HB VAL A 4 -43.256 -1.943 55.440 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -42.161 -4.047 54.632 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -43.863 -3.875 54.143 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -42.564 -3.564 52.967 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -40.748 -2.229 54.999 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -40.994 -1.458 53.414 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -41.290 -0.537 54.907 1.00 0.00 H new ATOM 68 N VAL A 5 -43.744 0.404 51.609 1.00 0.00 N ATOM 69 CA VAL A 5 -43.786 0.729 50.142 1.00 0.00 C ATOM 70 C VAL A 5 -45.061 0.083 49.482 1.00 0.00 C ATOM 71 O VAL A 5 -45.246 -1.138 49.498 1.00 0.00 O ATOM 72 CB VAL A 5 -42.468 0.471 49.324 1.00 0.00 C ATOM 73 CG1 VAL A 5 -42.466 1.062 47.894 1.00 0.00 C ATOM 74 CG2 VAL A 5 -41.165 0.976 49.995 1.00 0.00 C ATOM 0 H VAL A 5 -43.944 1.209 52.202 1.00 0.00 H new ATOM 0 HA VAL A 5 -43.863 1.815 50.092 1.00 0.00 H new ATOM 0 HB VAL A 5 -42.473 -0.618 49.288 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -41.518 0.834 47.407 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -43.283 0.626 47.319 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -42.596 2.143 47.947 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -40.314 0.751 49.352 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -41.229 2.053 50.148 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -41.035 0.480 50.957 1.00 0.00 H new ATOM 84 N ARG A 6 -45.948 0.912 48.919 1.00 0.00 N ATOM 85 CA ARG A 6 -47.272 0.459 48.403 1.00 0.00 C ATOM 86 C ARG A 6 -47.680 1.182 47.076 1.00 0.00 C ATOM 87 O ARG A 6 -47.750 2.413 46.993 1.00 0.00 O ATOM 88 CB ARG A 6 -48.353 0.674 49.513 1.00 0.00 C ATOM 89 CG ARG A 6 -49.573 -0.279 49.394 1.00 0.00 C ATOM 90 CD ARG A 6 -50.761 0.025 50.333 1.00 0.00 C ATOM 91 NE ARG A 6 -51.728 0.987 49.714 1.00 0.00 N ATOM 92 CZ ARG A 6 -52.972 1.187 50.115 1.00 0.00 C ATOM 93 NH1 ARG A 6 -53.453 0.702 51.223 1.00 0.00 N ATOM 94 NH2 ARG A 6 -53.751 1.896 49.372 1.00 0.00 N ATOM 0 H ARG A 6 -45.782 1.912 48.803 1.00 0.00 H new ATOM 0 HA ARG A 6 -47.197 -0.601 48.159 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -47.890 0.535 50.490 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -48.704 1.705 49.470 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -49.932 -0.251 48.365 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -49.234 -1.297 49.586 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -51.278 -0.903 50.577 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -50.387 0.438 51.270 1.00 0.00 H new ATOM 0 HE ARG A 6 -51.400 1.533 48.917 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -52.861 0.136 51.831 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -54.421 0.888 51.483 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -53.403 2.288 48.497 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -54.715 2.065 49.659 1.00 0.00 H new HETATM 108 N TPO A 7 -48.093 0.394 46.078 1.00 0.00 N HETATM 109 CA TPO A 7 -49.338 0.639 45.279 1.00 0.00 C HETATM 110 CB TPO A 7 -49.902 -0.772 44.888 1.00 0.00 C HETATM 111 CG2 TPO A 7 -51.296 -0.808 44.250 1.00 0.00 C HETATM 112 OG1 TPO A 7 -49.962 -1.675 46.018 1.00 0.00 O HETATM 113 P TPO A 7 -48.913 -2.877 46.197 1.00 0.00 P HETATM 114 O1P TPO A 7 -47.473 -2.344 46.231 1.00 0.00 O HETATM 115 O2P TPO A 7 -49.128 -3.582 47.551 1.00 0.00 O HETATM 116 O3P TPO A 7 -49.056 -3.945 45.019 1.00 0.00 O HETATM 117 C TPO A 7 -50.442 1.635 45.864 1.00 0.00 C HETATM 118 O TPO A 7 -51.058 1.319 46.890 1.00 0.00 O HETATM 0 HG23 TPO A 7 -52.023 -0.382 44.941 1.00 0.00 H new HETATM 0 HG22 TPO A 7 -51.289 -0.228 43.327 1.00 0.00 H new HETATM 0 HG21 TPO A 7 -51.568 -1.840 44.028 1.00 0.00 H new HETATM 0 HB TPO A 7 -49.177 -1.081 44.135 1.00 0.00 H new HETATM 0 HA TPO A 7 -49.043 1.227 44.410 1.00 0.00 H new HETATM 0 H TPO A 7 -47.783 -0.561 46.260 1.00 0.00 H new ATOM 125 N PRO A 8 -50.738 2.827 45.259 1.00 0.00 N ATOM 126 CA PRO A 8 -51.686 3.820 45.835 1.00 0.00 C ATOM 127 C PRO A 8 -53.198 3.414 46.008 1.00 0.00 C ATOM 128 O PRO A 8 -53.681 3.643 47.122 1.00 0.00 O ATOM 129 CB PRO A 8 -51.425 5.095 45.007 1.00 0.00 C ATOM 130 CG PRO A 8 -50.671 4.663 43.751 1.00 0.00 C ATOM 131 CD PRO A 8 -49.978 3.353 44.122 1.00 0.00 C ATOM 0 HA PRO A 8 -51.485 3.948 46.899 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -52.363 5.584 44.745 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -50.840 5.814 45.580 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -51.353 4.522 42.913 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -49.946 5.419 43.449 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -49.984 2.653 43.286 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -48.935 3.521 44.389 1.00 0.00 H new ATOM 139 N PRO A 9 -53.984 2.819 45.056 1.00 0.00 N ATOM 140 CA PRO A 9 -55.395 2.405 45.319 1.00 0.00 C ATOM 141 C PRO A 9 -55.577 1.248 46.364 1.00 0.00 C ATOM 142 O PRO A 9 -56.149 1.471 47.436 1.00 0.00 O ATOM 143 CB PRO A 9 -55.920 2.138 43.889 1.00 0.00 C ATOM 144 CG PRO A 9 -54.688 1.781 43.049 1.00 0.00 C ATOM 145 CD PRO A 9 -53.559 2.604 43.660 1.00 0.00 C ATOM 0 HA PRO A 9 -55.981 3.162 45.840 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -56.645 1.324 43.885 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -56.425 3.017 43.488 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -54.471 0.714 43.095 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -54.838 2.030 41.999 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -52.608 2.074 43.610 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -53.425 3.549 43.134 1.00 0.00 H new ATOM 153 N LYS A 10 -55.073 0.035 46.088 1.00 0.00 N ATOM 154 CA LYS A 10 -55.089 -1.101 47.052 1.00 0.00 C ATOM 155 C LYS A 10 -53.948 -2.130 46.768 1.00 0.00 C ATOM 156 O LYS A 10 -53.711 -2.507 45.616 1.00 0.00 O ATOM 157 CB LYS A 10 -56.490 -1.792 47.104 1.00 0.00 C ATOM 158 CG LYS A 10 -56.986 -2.474 45.799 1.00 0.00 C ATOM 159 CD LYS A 10 -58.245 -3.363 45.950 1.00 0.00 C ATOM 160 CE LYS A 10 -58.097 -4.675 46.754 1.00 0.00 C ATOM 161 NZ LYS A 10 -57.088 -5.587 46.140 1.00 0.00 N ATOM 0 H LYS A 10 -54.641 -0.196 45.194 1.00 0.00 H new ATOM 0 HA LYS A 10 -54.896 -0.681 48.039 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -56.468 -2.544 47.893 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -57.227 -1.044 47.397 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -57.196 -1.699 45.062 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -56.177 -3.085 45.398 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -59.025 -2.765 46.422 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -58.599 -3.618 44.951 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -57.803 -4.443 47.778 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -59.061 -5.181 46.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -57.355 -6.575 46.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -57.052 -5.424 45.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -56.152 -5.398 46.553 1.00 0.00 H new ATOM 175 N SER A 11 -53.348 -2.694 47.832 1.00 0.00 N ATOM 176 CA SER A 11 -52.482 -3.909 47.723 1.00 0.00 C ATOM 177 C SER A 11 -53.188 -5.153 47.052 1.00 0.00 C ATOM 178 O SER A 11 -54.418 -5.287 47.142 1.00 0.00 O ATOM 179 CB SER A 11 -51.905 -4.181 49.135 1.00 0.00 C ATOM 180 OG SER A 11 -50.795 -3.317 49.396 1.00 0.00 O ATOM 0 H SER A 11 -53.440 -2.336 48.783 1.00 0.00 H new ATOM 0 HA SER A 11 -51.667 -3.721 47.025 1.00 0.00 H new ATOM 0 HB2 SER A 11 -52.679 -4.026 49.887 1.00 0.00 H new ATOM 0 HB3 SER A 11 -51.590 -5.222 49.212 1.00 0.00 H new ATOM 0 HG SER A 11 -50.028 -3.596 48.853 1.00 0.00 H new ATOM 186 N PRO A 12 -52.456 -5.977 46.249 1.00 0.00 N ATOM 187 CA PRO A 12 -52.984 -6.729 45.074 1.00 0.00 C ATOM 188 C PRO A 12 -54.446 -6.600 44.543 1.00 0.00 C ATOM 189 O PRO A 12 -55.276 -7.508 44.626 1.00 0.00 O ATOM 190 CB PRO A 12 -52.435 -8.128 45.380 1.00 0.00 C ATOM 191 CG PRO A 12 -51.022 -7.831 45.906 1.00 0.00 C ATOM 192 CD PRO A 12 -51.126 -6.492 46.648 1.00 0.00 C ATOM 0 HA PRO A 12 -52.661 -6.261 44.144 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -53.042 -8.647 46.122 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -52.412 -8.757 44.490 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -50.678 -8.622 46.573 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -50.305 -7.770 45.088 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -51.055 -6.625 47.728 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -50.328 -5.809 46.357 1.00 0.00 H new ATOM 200 N SER A 13 -54.749 -5.434 43.957 1.00 0.00 N ATOM 201 CA SER A 13 -55.385 -5.411 42.618 1.00 0.00 C ATOM 202 C SER A 13 -54.305 -5.543 41.508 1.00 0.00 C ATOM 203 O SER A 13 -53.127 -5.155 41.689 1.00 0.00 O ATOM 204 CB SER A 13 -56.178 -4.105 42.434 1.00 0.00 C ATOM 205 OG SER A 13 -56.823 -4.118 41.161 1.00 0.00 O ATOM 206 OXT SER A 13 -54.627 -6.110 40.447 1.00 0.00 O ATOM 0 H SER A 13 -54.574 -4.517 44.367 1.00 0.00 H new ATOM 0 HA SER A 13 -56.071 -6.254 42.540 1.00 0.00 H new ATOM 0 HB2 SER A 13 -56.918 -4.001 43.228 1.00 0.00 H new ATOM 0 HB3 SER A 13 -55.509 -3.247 42.507 1.00 0.00 H new ATOM 0 HG SER A 13 -57.330 -3.288 41.043 1.00 0.00 H new TER 212 SER A 13 ATOM 213 N LYS B 1 -32.436 10.655 32.411 1.00 0.00 N ATOM 214 CA LYS B 1 -33.298 9.581 32.989 1.00 0.00 C ATOM 215 C LYS B 1 -34.061 10.076 34.264 1.00 0.00 C ATOM 216 O LYS B 1 -33.419 10.140 35.310 1.00 0.00 O ATOM 217 CB LYS B 1 -32.461 8.282 33.249 1.00 0.00 C ATOM 218 CG LYS B 1 -31.219 8.333 34.204 1.00 0.00 C ATOM 219 CD LYS B 1 -31.188 7.303 35.366 1.00 0.00 C ATOM 220 CE LYS B 1 -32.090 7.655 36.572 1.00 0.00 C ATOM 221 NZ LYS B 1 -31.841 6.727 37.718 1.00 0.00 N ATOM 0 H1 LYS B 1 -31.946 10.291 31.569 1.00 0.00 H new ATOM 0 H2 LYS B 1 -33.027 11.468 32.144 1.00 0.00 H new ATOM 0 H3 LYS B 1 -31.734 10.954 33.117 1.00 0.00 H new ATOM 0 HA LYS B 1 -34.066 9.327 32.259 1.00 0.00 H new ATOM 0 HB2 LYS B 1 -33.143 7.529 33.643 1.00 0.00 H new ATOM 0 HB3 LYS B 1 -32.112 7.921 32.281 1.00 0.00 H new ATOM 0 HG2 LYS B 1 -30.321 8.193 33.602 1.00 0.00 H new ATOM 0 HG3 LYS B 1 -31.162 9.333 34.634 1.00 0.00 H new ATOM 0 HD2 LYS B 1 -31.489 6.330 34.978 1.00 0.00 H new ATOM 0 HD3 LYS B 1 -30.161 7.203 35.716 1.00 0.00 H new ATOM 0 HE2 LYS B 1 -31.901 8.682 36.884 1.00 0.00 H new ATOM 0 HE3 LYS B 1 -33.137 7.599 36.276 1.00 0.00 H new ATOM 0 HZ1 LYS B 1 -32.459 6.985 38.514 1.00 0.00 H new ATOM 0 HZ2 LYS B 1 -32.044 5.750 37.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 1 -30.847 6.800 38.014 1.00 0.00 H new ATOM 237 N LEU B 2 -35.370 10.415 34.180 1.00 0.00 N ATOM 238 CA LEU B 2 -36.232 10.820 35.352 1.00 0.00 C ATOM 239 C LEU B 2 -35.706 11.900 36.396 1.00 0.00 C ATOM 240 O LEU B 2 -34.558 12.341 36.269 1.00 0.00 O ATOM 241 CB LEU B 2 -36.866 9.528 35.968 1.00 0.00 C ATOM 242 CG LEU B 2 -35.936 8.714 36.900 1.00 0.00 C ATOM 243 CD1 LEU B 2 -36.279 9.000 38.350 1.00 0.00 C ATOM 244 CD2 LEU B 2 -36.023 7.203 36.634 1.00 0.00 C ATOM 0 H LEU B 2 -35.876 10.420 33.295 1.00 0.00 H new ATOM 0 HA LEU B 2 -37.002 11.464 34.928 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -37.757 9.812 36.529 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -37.194 8.881 35.155 1.00 0.00 H new ATOM 0 HG LEU B 2 -34.913 9.025 36.691 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -35.621 8.424 39.000 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -36.149 10.063 38.552 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -37.315 8.719 38.541 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -35.353 6.675 37.312 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -37.046 6.863 36.797 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -35.732 6.998 35.604 1.00 0.00 H new ATOM 256 N PRO B 3 -36.479 12.366 37.428 1.00 0.00 N ATOM 257 CA PRO B 3 -35.979 13.394 38.388 1.00 0.00 C ATOM 258 C PRO B 3 -35.005 13.027 39.586 1.00 0.00 C ATOM 259 O PRO B 3 -34.944 11.867 40.030 1.00 0.00 O ATOM 260 CB PRO B 3 -37.284 14.103 38.801 1.00 0.00 C ATOM 261 CG PRO B 3 -38.311 13.765 37.738 1.00 0.00 C ATOM 262 CD PRO B 3 -37.958 12.321 37.419 1.00 0.00 C ATOM 0 HA PRO B 3 -35.227 14.003 37.885 1.00 0.00 H new ATOM 0 HB2 PRO B 3 -37.616 13.765 39.783 1.00 0.00 H new ATOM 0 HB3 PRO B 3 -37.136 15.181 38.869 1.00 0.00 H new ATOM 0 HG2 PRO B 3 -39.331 13.865 38.108 1.00 0.00 H new ATOM 0 HG3 PRO B 3 -38.224 14.411 36.864 1.00 0.00 H new ATOM 0 HD2 PRO B 3 -38.351 11.629 38.164 1.00 0.00 H new ATOM 0 HD3 PRO B 3 -38.352 12.007 36.453 1.00 0.00 H new ATOM 270 N PRO B 4 -34.222 14.000 40.156 1.00 0.00 N ATOM 271 CA PRO B 4 -33.250 13.729 41.247 1.00 0.00 C ATOM 272 C PRO B 4 -33.927 13.569 42.647 1.00 0.00 C ATOM 273 O PRO B 4 -34.726 14.402 43.087 1.00 0.00 O ATOM 274 CB PRO B 4 -32.314 14.948 41.128 1.00 0.00 C ATOM 275 CG PRO B 4 -33.209 16.096 40.657 1.00 0.00 C ATOM 276 CD PRO B 4 -34.255 15.426 39.765 1.00 0.00 C ATOM 0 HA PRO B 4 -32.726 12.778 41.155 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -31.846 15.180 42.085 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -31.509 14.759 40.417 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -33.675 16.607 41.499 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -32.638 16.844 40.106 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -35.244 15.857 39.922 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -34.015 15.553 38.709 1.00 0.00 H new ATOM 284 N GLY B 5 -33.624 12.455 43.319 1.00 0.00 N ATOM 285 CA GLY B 5 -34.441 11.975 44.469 1.00 0.00 C ATOM 286 C GLY B 5 -35.519 10.905 44.198 1.00 0.00 C ATOM 287 O GLY B 5 -36.438 10.814 45.013 1.00 0.00 O ATOM 0 H GLY B 5 -32.825 11.861 43.098 1.00 0.00 H new ATOM 0 HA2 GLY B 5 -33.758 11.578 45.220 1.00 0.00 H new ATOM 0 HA3 GLY B 5 -34.934 12.840 44.912 1.00 0.00 H new ATOM 291 N TRP B 6 -35.426 10.086 43.137 1.00 0.00 N ATOM 292 CA TRP B 6 -36.418 9.034 42.852 1.00 0.00 C ATOM 293 C TRP B 6 -35.874 7.580 42.825 1.00 0.00 C ATOM 294 O TRP B 6 -34.681 7.318 42.627 1.00 0.00 O ATOM 295 CB TRP B 6 -36.847 9.421 41.417 1.00 0.00 C ATOM 296 CG TRP B 6 -38.076 10.285 41.329 1.00 0.00 C ATOM 297 CD1 TRP B 6 -38.082 11.669 41.168 1.00 0.00 C ATOM 298 CD2 TRP B 6 -39.382 9.890 41.395 1.00 0.00 C ATOM 299 NE1 TRP B 6 -39.393 12.178 41.130 1.00 0.00 N ATOM 300 CE2 TRP B 6 -40.179 11.052 41.285 1.00 0.00 C ATOM 301 CE3 TRP B 6 -39.972 8.606 41.535 1.00 0.00 C ATOM 302 CZ2 TRP B 6 -41.579 10.943 41.275 1.00 0.00 C ATOM 303 CZ3 TRP B 6 -41.359 8.560 41.696 1.00 0.00 C ATOM 304 CH2 TRP B 6 -42.158 9.698 41.528 1.00 0.00 C ATOM 0 H TRP B 6 -34.667 10.133 42.457 1.00 0.00 H new ATOM 0 HA TRP B 6 -37.186 9.006 43.625 1.00 0.00 H new ATOM 0 HB2 TRP B 6 -36.020 9.943 40.935 1.00 0.00 H new ATOM 0 HB3 TRP B 6 -37.022 8.508 40.848 1.00 0.00 H new ATOM 0 HD1 TRP B 6 -37.192 12.275 41.083 1.00 0.00 H new ATOM 0 HE1 TRP B 6 -39.692 13.146 41.015 1.00 0.00 H new ATOM 0 HE3 TRP B 6 -39.376 7.706 41.518 1.00 0.00 H new ATOM 0 HZ2 TRP B 6 -42.196 11.806 41.075 1.00 0.00 H new ATOM 0 HZ3 TRP B 6 -41.827 7.622 41.957 1.00 0.00 H new ATOM 0 HH2 TRP B 6 -43.232 9.612 41.595 1.00 0.00 H new ATOM 315 N GLU B 7 -36.836 6.644 42.790 1.00 0.00 N ATOM 316 CA GLU B 7 -36.669 5.333 42.177 1.00 0.00 C ATOM 317 C GLU B 7 -37.873 4.901 41.277 1.00 0.00 C ATOM 318 O GLU B 7 -39.017 5.345 41.369 1.00 0.00 O ATOM 319 CB GLU B 7 -36.486 4.267 43.305 1.00 0.00 C ATOM 320 CG GLU B 7 -35.283 4.329 44.275 1.00 0.00 C ATOM 321 CD GLU B 7 -35.487 3.384 45.439 1.00 0.00 C ATOM 322 OE1 GLU B 7 -36.133 3.790 46.425 1.00 0.00 O ATOM 323 OE2 GLU B 7 -35.066 2.213 45.373 1.00 0.00 O ATOM 0 H GLU B 7 -37.761 6.787 43.195 1.00 0.00 H new ATOM 0 HA GLU B 7 -35.794 5.400 41.530 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -37.389 4.290 43.915 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -36.454 3.292 42.820 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -34.367 4.068 43.744 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -35.159 5.347 44.644 1.00 0.00 H new ATOM 330 N LYS B 8 -37.580 3.874 40.482 1.00 0.00 N ATOM 331 CA LYS B 8 -38.573 2.802 40.178 1.00 0.00 C ATOM 332 C LYS B 8 -38.580 1.727 41.327 1.00 0.00 C ATOM 333 O LYS B 8 -37.513 1.172 41.618 1.00 0.00 O ATOM 334 CB LYS B 8 -38.314 2.257 38.739 1.00 0.00 C ATOM 335 CG LYS B 8 -37.085 1.337 38.517 1.00 0.00 C ATOM 336 CD LYS B 8 -37.371 -0.160 38.822 1.00 0.00 C ATOM 337 CE LYS B 8 -36.193 -0.945 39.434 1.00 0.00 C ATOM 338 NZ LYS B 8 -35.036 -1.036 38.497 1.00 0.00 N ATOM 0 H LYS B 8 -36.674 3.746 40.031 1.00 0.00 H new ATOM 0 HA LYS B 8 -39.592 3.189 40.164 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -39.202 1.709 38.425 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -38.215 3.113 38.071 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -36.751 1.432 37.484 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -36.266 1.679 39.149 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -38.219 -0.219 39.504 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -37.672 -0.651 37.897 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -35.875 -0.460 40.357 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -36.525 -1.949 39.699 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -34.266 -1.571 38.947 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -35.332 -1.521 37.626 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -34.702 -0.079 38.264 1.00 0.00 H new ATOM 352 N ARG B 9 -39.713 1.407 41.994 1.00 0.00 N ATOM 353 CA ARG B 9 -39.687 0.490 43.173 1.00 0.00 C ATOM 354 C ARG B 9 -40.612 -0.713 42.942 1.00 0.00 C ATOM 355 O ARG B 9 -41.823 -0.571 43.028 1.00 0.00 O ATOM 356 CB ARG B 9 -40.006 1.234 44.494 1.00 0.00 C ATOM 357 CG ARG B 9 -38.756 1.527 45.360 1.00 0.00 C ATOM 358 CD ARG B 9 -39.068 1.399 46.859 1.00 0.00 C ATOM 359 NE ARG B 9 -37.955 1.966 47.652 1.00 0.00 N ATOM 360 CZ ARG B 9 -36.975 1.282 48.219 1.00 0.00 C ATOM 361 NH1 ARG B 9 -37.099 0.055 48.628 1.00 0.00 N ATOM 362 NH2 ARG B 9 -35.842 1.876 48.373 1.00 0.00 N ATOM 0 H ARG B 9 -40.639 1.757 41.749 1.00 0.00 H new ATOM 0 HA ARG B 9 -38.672 0.108 43.280 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -40.504 2.175 44.260 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -40.709 0.638 45.076 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -37.957 0.836 45.093 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -38.392 2.532 45.147 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -39.996 1.921 47.093 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -39.217 0.351 47.121 1.00 0.00 H new ATOM 0 HE ARG B 9 -37.942 2.979 47.773 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -37.989 -0.432 48.519 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -36.307 -0.422 49.058 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -35.725 2.840 48.062 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -35.062 1.382 48.806 1.00 0.00 H new ATOM 376 N MET B 10 -40.054 -1.871 42.605 1.00 0.00 N ATOM 377 CA MET B 10 -40.779 -2.909 41.860 1.00 0.00 C ATOM 378 C MET B 10 -41.162 -4.137 42.719 1.00 0.00 C ATOM 379 O MET B 10 -40.256 -4.877 43.115 1.00 0.00 O ATOM 380 CB MET B 10 -39.837 -3.256 40.671 1.00 0.00 C ATOM 381 CG MET B 10 -40.624 -3.728 39.454 1.00 0.00 C ATOM 382 SD MET B 10 -41.310 -5.379 39.681 1.00 0.00 S ATOM 383 CE MET B 10 -43.047 -4.983 39.480 1.00 0.00 C ATOM 0 H MET B 10 -39.093 -2.121 42.836 1.00 0.00 H new ATOM 0 HA MET B 10 -41.752 -2.554 41.519 1.00 0.00 H new ATOM 0 HB2 MET B 10 -39.246 -2.379 40.406 1.00 0.00 H new ATOM 0 HB3 MET B 10 -39.136 -4.033 40.976 1.00 0.00 H new ATOM 0 HG2 MET B 10 -41.433 -3.026 39.252 1.00 0.00 H new ATOM 0 HG3 MET B 10 -39.973 -3.724 38.580 1.00 0.00 H new ATOM 0 HE1 MET B 10 -43.603 -5.892 39.251 1.00 0.00 H new ATOM 0 HE2 MET B 10 -43.430 -4.546 40.402 1.00 0.00 H new ATOM 0 HE3 MET B 10 -43.166 -4.270 38.664 1.00 0.00 H new ATOM 393 N SER B 11 -42.468 -4.419 42.946 1.00 0.00 N ATOM 394 CA SER B 11 -42.890 -5.726 43.557 1.00 0.00 C ATOM 395 C SER B 11 -42.497 -5.990 45.054 1.00 0.00 C ATOM 396 O SER B 11 -41.333 -5.891 45.444 1.00 0.00 O ATOM 397 CB SER B 11 -42.553 -6.947 42.658 1.00 0.00 C ATOM 398 OG SER B 11 -41.176 -7.314 42.730 1.00 0.00 O ATOM 0 H SER B 11 -43.237 -3.786 42.726 1.00 0.00 H new ATOM 0 HA SER B 11 -43.972 -5.603 43.603 1.00 0.00 H new ATOM 0 HB2 SER B 11 -43.168 -7.796 42.957 1.00 0.00 H new ATOM 0 HB3 SER B 11 -42.811 -6.715 41.624 1.00 0.00 H new ATOM 0 HG SER B 11 -40.641 -6.529 42.971 1.00 0.00 H new ATOM 404 N ARG B 12 -43.460 -6.423 45.882 1.00 0.00 N ATOM 405 CA ARG B 12 -43.157 -7.108 47.180 1.00 0.00 C ATOM 406 C ARG B 12 -44.073 -8.376 47.273 1.00 0.00 C ATOM 407 O ARG B 12 -43.587 -9.496 47.111 1.00 0.00 O ATOM 408 CB ARG B 12 -43.156 -6.188 48.452 1.00 0.00 C ATOM 409 CG ARG B 12 -42.571 -4.740 48.330 1.00 0.00 C ATOM 410 CD ARG B 12 -43.559 -3.547 48.207 1.00 0.00 C ATOM 411 NE ARG B 12 -44.775 -3.840 47.386 1.00 0.00 N ATOM 412 CZ ARG B 12 -45.930 -4.235 47.888 1.00 0.00 C ATOM 413 NH1 ARG B 12 -46.383 -3.866 49.047 1.00 0.00 N ATOM 414 NH2 ARG B 12 -46.690 -4.954 47.140 1.00 0.00 N ATOM 0 H ARG B 12 -44.456 -6.319 45.690 1.00 0.00 H new ATOM 0 HA ARG B 12 -42.112 -7.419 47.175 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -44.186 -6.101 48.798 1.00 0.00 H new ATOM 0 HB3 ARG B 12 -42.600 -6.705 49.234 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -41.944 -4.562 49.203 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -41.917 -4.719 47.458 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -43.873 -3.245 49.206 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -43.034 -2.699 47.768 1.00 0.00 H new ATOM 0 HE ARG B 12 -44.707 -3.727 46.375 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -45.836 -3.232 49.630 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -47.286 -4.210 49.375 1.00 0.00 H new ATOM 0 HH21 ARG B 12 -46.392 -5.199 46.196 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -47.591 -5.279 47.491 1.00 0.00 H new ATOM 428 N SER B 13 -45.404 -8.216 47.432 1.00 0.00 N ATOM 429 CA SER B 13 -46.384 -9.322 47.239 1.00 0.00 C ATOM 430 C SER B 13 -46.981 -9.357 45.785 1.00 0.00 C ATOM 431 O SER B 13 -47.755 -8.484 45.372 1.00 0.00 O ATOM 432 CB SER B 13 -47.455 -9.243 48.356 1.00 0.00 C ATOM 433 OG SER B 13 -48.222 -8.034 48.345 1.00 0.00 O ATOM 0 H SER B 13 -45.833 -7.329 47.695 1.00 0.00 H new ATOM 0 HA SER B 13 -45.871 -10.279 47.331 1.00 0.00 H new ATOM 0 HB2 SER B 13 -48.132 -10.091 48.256 1.00 0.00 H new ATOM 0 HB3 SER B 13 -46.963 -9.340 49.324 1.00 0.00 H new ATOM 0 HG SER B 13 -48.379 -7.755 47.419 1.00 0.00 H new ATOM 439 N SER B 14 -46.622 -10.395 45.004 1.00 0.00 N ATOM 440 CA SER B 14 -47.247 -10.733 43.678 1.00 0.00 C ATOM 441 C SER B 14 -47.122 -9.726 42.471 1.00 0.00 C ATOM 442 O SER B 14 -48.066 -9.544 41.695 1.00 0.00 O ATOM 443 CB SER B 14 -48.687 -11.273 43.902 1.00 0.00 C ATOM 444 OG SER B 14 -49.602 -10.215 44.194 1.00 0.00 O ATOM 0 H SER B 14 -45.879 -11.042 45.267 1.00 0.00 H new ATOM 0 HA SER B 14 -46.594 -11.513 43.285 1.00 0.00 H new ATOM 0 HB2 SER B 14 -49.019 -11.808 43.012 1.00 0.00 H new ATOM 0 HB3 SER B 14 -48.684 -11.990 44.723 1.00 0.00 H new ATOM 0 HG SER B 14 -49.118 -9.467 44.603 1.00 0.00 H new ATOM 450 N GLY B 15 -45.955 -9.089 42.274 1.00 0.00 N ATOM 451 CA GLY B 15 -45.709 -8.197 41.099 1.00 0.00 C ATOM 452 C GLY B 15 -46.298 -6.769 41.159 1.00 0.00 C ATOM 453 O GLY B 15 -46.720 -6.244 40.131 1.00 0.00 O ATOM 0 H GLY B 15 -45.159 -9.167 42.907 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -44.631 -8.112 40.959 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -46.107 -8.690 40.212 1.00 0.00 H new ATOM 457 N ARG B 16 -46.376 -6.157 42.354 1.00 0.00 N ATOM 458 CA ARG B 16 -47.089 -4.872 42.570 1.00 0.00 C ATOM 459 C ARG B 16 -46.103 -3.747 43.031 1.00 0.00 C ATOM 460 O ARG B 16 -45.375 -3.906 44.010 1.00 0.00 O ATOM 461 CB ARG B 16 -48.288 -5.079 43.550 1.00 0.00 C ATOM 462 CG ARG B 16 -49.667 -5.398 42.908 1.00 0.00 C ATOM 463 CD ARG B 16 -49.724 -6.718 42.121 1.00 0.00 C ATOM 464 NE ARG B 16 -51.112 -6.982 41.654 1.00 0.00 N ATOM 465 CZ ARG B 16 -51.563 -8.124 41.160 1.00 0.00 C ATOM 466 NH1 ARG B 16 -50.859 -9.215 41.086 1.00 0.00 N ATOM 467 NH2 ARG B 16 -52.776 -8.162 40.723 1.00 0.00 N ATOM 0 H ARG B 16 -45.949 -6.534 43.200 1.00 0.00 H new ATOM 0 HA ARG B 16 -47.507 -4.532 41.623 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -48.034 -5.891 44.232 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -48.394 -4.177 44.153 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -50.420 -5.428 43.696 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -49.938 -4.581 42.239 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -49.049 -6.669 41.267 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -49.383 -7.540 42.751 1.00 0.00 H new ATOM 0 HE ARG B 16 -51.777 -6.212 41.721 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -49.896 -9.224 41.421 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -51.270 -10.062 40.693 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -53.359 -7.326 40.764 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -53.152 -9.028 40.336 1.00 0.00 H new ATOM 481 N VAL B 17 -46.124 -2.630 42.299 1.00 0.00 N ATOM 482 CA VAL B 17 -45.272 -1.409 42.509 1.00 0.00 C ATOM 483 C VAL B 17 -44.182 -1.172 41.397 1.00 0.00 C ATOM 484 O VAL B 17 -43.781 -2.130 40.742 1.00 0.00 O ATOM 485 CB VAL B 17 -45.131 -0.859 43.987 1.00 0.00 C ATOM 486 CG1 VAL B 17 -44.002 -1.396 44.896 1.00 0.00 C ATOM 487 CG2 VAL B 17 -45.100 0.679 44.094 1.00 0.00 C ATOM 0 H VAL B 17 -46.755 -2.526 41.504 1.00 0.00 H new ATOM 0 HA VAL B 17 -45.871 -0.532 42.264 1.00 0.00 H new ATOM 0 HB VAL B 17 -46.058 -1.283 44.374 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -44.057 -0.910 45.870 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -44.117 -2.473 45.021 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -43.035 -1.185 44.439 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -45.002 0.969 45.140 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -44.252 1.066 43.529 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -46.024 1.091 43.689 1.00 0.00 H new ATOM 497 N TYR B 18 -43.806 0.095 41.075 1.00 0.00 N ATOM 498 CA TYR B 18 -42.754 0.478 40.100 1.00 0.00 C ATOM 499 C TYR B 18 -42.361 2.012 40.093 1.00 0.00 C ATOM 500 O TYR B 18 -41.558 2.387 39.241 1.00 0.00 O ATOM 501 CB TYR B 18 -42.879 -0.164 38.685 1.00 0.00 C ATOM 502 CG TYR B 18 -44.219 0.080 37.998 1.00 0.00 C ATOM 503 CD1 TYR B 18 -44.512 1.362 37.542 1.00 0.00 C ATOM 504 CD2 TYR B 18 -45.246 -0.852 38.156 1.00 0.00 C ATOM 505 CE1 TYR B 18 -45.830 1.748 37.356 1.00 0.00 C ATOM 506 CE2 TYR B 18 -46.565 -0.469 37.964 1.00 0.00 C ATOM 507 CZ TYR B 18 -46.862 0.826 37.539 1.00 0.00 C ATOM 508 OH TYR B 18 -48.167 1.232 37.469 1.00 0.00 O ATOM 0 H TYR B 18 -44.246 0.908 41.506 1.00 0.00 H new ATOM 0 HA TYR B 18 -41.872 -0.009 40.516 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -42.083 0.226 38.051 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -42.719 -1.239 38.772 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -43.712 2.056 37.333 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -45.014 -1.871 38.428 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -46.059 2.764 37.069 1.00 0.00 H new ATOM 0 HE2 TYR B 18 -47.363 -1.174 38.144 1.00 0.00 H new ATOM 0 HH TYR B 18 -48.235 2.165 37.761 1.00 0.00 H new ATOM 518 N TYR B 19 -42.756 2.866 41.067 1.00 0.00 N ATOM 519 CA TYR B 19 -42.174 4.231 41.295 1.00 0.00 C ATOM 520 C TYR B 19 -42.203 4.639 42.821 1.00 0.00 C ATOM 521 O TYR B 19 -43.181 4.430 43.539 1.00 0.00 O ATOM 522 CB TYR B 19 -42.821 5.324 40.400 1.00 0.00 C ATOM 523 CG TYR B 19 -42.546 5.316 38.890 1.00 0.00 C ATOM 524 CD1 TYR B 19 -41.401 5.934 38.372 1.00 0.00 C ATOM 525 CD2 TYR B 19 -43.480 4.763 38.013 1.00 0.00 C ATOM 526 CE1 TYR B 19 -41.200 5.998 36.993 1.00 0.00 C ATOM 527 CE2 TYR B 19 -43.275 4.819 36.636 1.00 0.00 C ATOM 528 CZ TYR B 19 -42.138 5.440 36.128 1.00 0.00 C ATOM 529 OH TYR B 19 -41.940 5.485 34.775 1.00 0.00 O ATOM 0 H TYR B 19 -43.496 2.634 41.730 1.00 0.00 H new ATOM 0 HA TYR B 19 -41.129 4.164 40.993 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -43.901 5.263 40.537 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -42.505 6.293 40.786 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -40.671 6.363 39.043 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -44.368 4.288 38.404 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -40.318 6.480 36.597 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -43.998 4.381 35.964 1.00 0.00 H new ATOM 0 HH TYR B 19 -42.690 5.049 34.320 1.00 0.00 H new ATOM 539 N PHE B 20 -41.122 5.244 43.333 1.00 0.00 N ATOM 540 CA PHE B 20 -41.048 5.804 44.722 1.00 0.00 C ATOM 541 C PHE B 20 -40.215 7.125 44.745 1.00 0.00 C ATOM 542 O PHE B 20 -39.122 7.187 44.190 1.00 0.00 O ATOM 543 CB PHE B 20 -40.434 4.705 45.633 1.00 0.00 C ATOM 544 CG PHE B 20 -40.080 5.063 47.089 1.00 0.00 C ATOM 545 CD1 PHE B 20 -41.039 5.020 48.086 1.00 0.00 C ATOM 546 CD2 PHE B 20 -38.774 5.390 47.421 1.00 0.00 C ATOM 547 CE1 PHE B 20 -40.705 5.300 49.406 1.00 0.00 C ATOM 548 CE2 PHE B 20 -38.423 5.643 48.741 1.00 0.00 C ATOM 549 CZ PHE B 20 -39.375 5.612 49.789 1.00 0.00 C ATOM 0 H PHE B 20 -40.259 5.368 42.804 1.00 0.00 H new ATOM 0 HA PHE B 20 -42.040 6.069 45.089 1.00 0.00 H new ATOM 0 HB2 PHE B 20 -41.133 3.869 45.659 1.00 0.00 H new ATOM 0 HB3 PHE B 20 -39.525 4.346 45.151 1.00 0.00 H new ATOM 0 HD1 PHE B 20 -42.058 4.766 47.836 1.00 0.00 H new ATOM 0 HD2 PHE B 20 -38.023 5.448 46.647 1.00 0.00 H new ATOM 0 HE1 PHE B 20 -41.478 5.280 50.160 1.00 0.00 H new ATOM 0 HE2 PHE B 20 -37.393 5.870 48.975 1.00 0.00 H new ATOM 0 HZ PHE B 20 -39.106 5.813 50.815 1.00 0.00 H new ATOM 559 N ASN B 21 -40.678 8.171 45.438 1.00 0.00 N ATOM 560 CA ASN B 21 -39.852 9.382 45.698 1.00 0.00 C ATOM 561 C ASN B 21 -39.055 9.227 47.042 1.00 0.00 C ATOM 562 O ASN B 21 -39.659 9.096 48.107 1.00 0.00 O ATOM 563 CB ASN B 21 -40.840 10.581 45.696 1.00 0.00 C ATOM 564 CG ASN B 21 -40.343 12.023 45.620 1.00 0.00 C ATOM 565 OD1 ASN B 21 -41.114 12.943 45.387 1.00 0.00 O ATOM 566 ND2 ASN B 21 -39.115 12.313 45.934 1.00 0.00 N ATOM 0 H ASN B 21 -41.617 8.215 45.833 1.00 0.00 H new ATOM 0 HA ASN B 21 -39.088 9.539 44.937 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -41.516 10.434 44.853 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -41.439 10.500 46.603 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -38.817 13.287 45.981 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -38.450 11.566 46.134 1.00 0.00 H new ATOM 573 N HIS B 22 -37.713 9.287 47.008 1.00 0.00 N ATOM 574 CA HIS B 22 -36.844 9.098 48.210 1.00 0.00 C ATOM 575 C HIS B 22 -36.743 10.298 49.215 1.00 0.00 C ATOM 576 O HIS B 22 -36.750 10.122 50.433 1.00 0.00 O ATOM 577 CB HIS B 22 -35.430 8.720 47.658 1.00 0.00 C ATOM 578 CG HIS B 22 -34.777 7.585 48.419 1.00 0.00 C ATOM 579 ND1 HIS B 22 -34.260 7.660 49.692 1.00 0.00 N ATOM 580 CD2 HIS B 22 -34.802 6.265 47.980 1.00 0.00 C ATOM 581 CE1 HIS B 22 -34.034 6.329 49.928 1.00 0.00 C ATOM 582 NE2 HIS B 22 -34.325 5.401 48.960 1.00 0.00 N ATOM 0 H HIS B 22 -37.188 9.467 46.152 1.00 0.00 H new ATOM 0 HA HIS B 22 -37.305 8.324 48.824 1.00 0.00 H new ATOM 0 HB2 HIS B 22 -35.520 8.441 46.608 1.00 0.00 H new ATOM 0 HB3 HIS B 22 -34.784 9.597 47.701 1.00 0.00 H new ATOM 0 HD2 HIS B 22 -35.147 5.952 47.006 1.00 0.00 H new ATOM 0 HE1 HIS B 22 -33.627 6.010 50.876 1.00 0.00 H new ATOM 0 HE2 HIS B 22 -34.223 4.386 48.959 1.00 0.00 H new ATOM 590 N ILE B 23 -36.589 11.510 48.672 1.00 0.00 N ATOM 591 CA ILE B 23 -36.446 12.791 49.441 1.00 0.00 C ATOM 592 C ILE B 23 -37.747 13.307 50.153 1.00 0.00 C ATOM 593 O ILE B 23 -37.669 13.845 51.258 1.00 0.00 O ATOM 594 CB ILE B 23 -35.771 13.879 48.520 1.00 0.00 C ATOM 595 CG1 ILE B 23 -36.532 14.119 47.176 1.00 0.00 C ATOM 596 CG2 ILE B 23 -34.267 13.569 48.293 1.00 0.00 C ATOM 597 CD1 ILE B 23 -35.986 15.172 46.211 1.00 0.00 C ATOM 0 H ILE B 23 -36.557 11.651 47.662 1.00 0.00 H new ATOM 0 HA ILE B 23 -35.794 12.574 50.287 1.00 0.00 H new ATOM 0 HB ILE B 23 -35.840 14.823 49.061 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -36.573 13.169 46.643 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -37.559 14.392 47.420 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -33.830 14.337 47.654 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -33.749 13.557 49.252 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -34.165 12.596 47.813 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -36.622 15.220 45.327 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -35.974 16.145 46.703 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -34.972 14.903 45.914 1.00 0.00 H new ATOM 609 N THR B 24 -38.931 13.127 49.546 1.00 0.00 N ATOM 610 CA THR B 24 -40.239 13.167 50.282 1.00 0.00 C ATOM 611 C THR B 24 -40.499 11.938 51.216 1.00 0.00 C ATOM 612 O THR B 24 -40.899 12.075 52.372 1.00 0.00 O ATOM 613 CB THR B 24 -41.413 13.266 49.251 1.00 0.00 C ATOM 614 OG1 THR B 24 -41.475 12.152 48.376 1.00 0.00 O ATOM 615 CG2 THR B 24 -41.361 14.466 48.329 1.00 0.00 C ATOM 0 H THR B 24 -39.026 12.951 48.546 1.00 0.00 H new ATOM 0 HA THR B 24 -40.187 14.043 50.928 1.00 0.00 H new ATOM 0 HB THR B 24 -42.277 13.332 49.913 1.00 0.00 H new ATOM 0 HG1 THR B 24 -42.225 12.265 47.756 1.00 0.00 H new ATOM 0 HG21 THR B 24 -42.216 14.443 47.654 1.00 0.00 H new ATOM 0 HG22 THR B 24 -41.390 15.381 48.921 1.00 0.00 H new ATOM 0 HG23 THR B 24 -40.439 14.439 47.748 1.00 0.00 H new ATOM 623 N ASN B 25 -40.322 10.759 50.609 1.00 0.00 N ATOM 624 CA ASN B 25 -40.806 9.430 51.103 1.00 0.00 C ATOM 625 C ASN B 25 -42.303 9.159 50.706 1.00 0.00 C ATOM 626 O ASN B 25 -43.189 9.046 51.557 1.00 0.00 O ATOM 627 CB ASN B 25 -40.411 9.132 52.582 1.00 0.00 C ATOM 628 CG ASN B 25 -40.483 7.672 53.038 1.00 0.00 C ATOM 629 OD1 ASN B 25 -40.960 6.763 52.371 1.00 0.00 O ATOM 630 ND2 ASN B 25 -40.011 7.391 54.223 1.00 0.00 N ATOM 0 H ASN B 25 -39.820 10.683 49.724 1.00 0.00 H new ATOM 0 HA ASN B 25 -40.253 8.660 50.565 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -39.392 9.486 52.739 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -41.058 9.722 53.231 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -40.045 6.433 54.572 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -39.608 8.129 54.800 1.00 0.00 H new ATOM 637 N ALA B 26 -42.567 9.046 49.390 1.00 0.00 N ATOM 638 CA ALA B 26 -43.913 8.733 48.848 1.00 0.00 C ATOM 639 C ALA B 26 -43.861 7.535 47.844 1.00 0.00 C ATOM 640 O ALA B 26 -43.209 7.611 46.796 1.00 0.00 O ATOM 641 CB ALA B 26 -44.440 10.028 48.197 1.00 0.00 C ATOM 0 H ALA B 26 -41.856 9.168 48.669 1.00 0.00 H new ATOM 0 HA ALA B 26 -44.590 8.411 49.639 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -45.432 9.849 47.782 1.00 0.00 H new ATOM 0 HB2 ALA B 26 -44.498 10.815 48.948 1.00 0.00 H new ATOM 0 HB3 ALA B 26 -43.763 10.336 47.400 1.00 0.00 H new ATOM 647 N SER B 27 -44.566 6.431 48.146 1.00 0.00 N ATOM 648 CA SER B 27 -44.749 5.304 47.190 1.00 0.00 C ATOM 649 C SER B 27 -45.959 5.500 46.232 1.00 0.00 C ATOM 650 O SER B 27 -47.089 5.759 46.661 1.00 0.00 O ATOM 651 CB SER B 27 -44.867 3.978 47.969 1.00 0.00 C ATOM 652 OG SER B 27 -46.046 3.912 48.778 1.00 0.00 O ATOM 0 H SER B 27 -45.023 6.287 49.046 1.00 0.00 H new ATOM 0 HA SER B 27 -43.867 5.276 46.550 1.00 0.00 H new ATOM 0 HB2 SER B 27 -44.869 3.147 47.264 1.00 0.00 H new ATOM 0 HB3 SER B 27 -43.989 3.856 48.604 1.00 0.00 H new ATOM 0 HG SER B 27 -46.764 3.476 48.274 1.00 0.00 H new ATOM 658 N GLN B 28 -45.703 5.356 44.927 1.00 0.00 N ATOM 659 CA GLN B 28 -46.764 5.411 43.892 1.00 0.00 C ATOM 660 C GLN B 28 -46.573 4.303 42.800 1.00 0.00 C ATOM 661 O GLN B 28 -45.609 3.534 42.784 1.00 0.00 O ATOM 662 CB GLN B 28 -46.925 6.869 43.381 1.00 0.00 C ATOM 663 CG GLN B 28 -45.857 7.390 42.390 1.00 0.00 C ATOM 664 CD GLN B 28 -46.114 8.841 41.982 1.00 0.00 C ATOM 665 OE1 GLN B 28 -45.656 9.792 42.604 1.00 0.00 O ATOM 666 NE2 GLN B 28 -46.902 9.046 40.958 1.00 0.00 N ATOM 0 H GLN B 28 -44.767 5.199 44.552 1.00 0.00 H new ATOM 0 HA GLN B 28 -47.731 5.154 44.324 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -47.901 6.954 42.903 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -46.936 7.532 44.246 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -44.870 7.311 42.846 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -45.849 6.759 41.501 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -47.283 8.254 40.441 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -47.136 9.998 40.677 1.00 0.00 H new ATOM 675 N TRP B 29 -47.498 4.228 41.839 1.00 0.00 N ATOM 676 CA TRP B 29 -47.259 3.473 40.575 1.00 0.00 C ATOM 677 C TRP B 29 -47.560 4.295 39.270 1.00 0.00 C ATOM 678 O TRP B 29 -48.158 3.807 38.310 1.00 0.00 O ATOM 679 CB TRP B 29 -47.826 2.040 40.763 1.00 0.00 C ATOM 680 CG TRP B 29 -49.309 1.680 40.603 1.00 0.00 C ATOM 681 CD1 TRP B 29 -50.440 2.522 40.646 1.00 0.00 C ATOM 682 CD2 TRP B 29 -49.813 0.388 40.576 1.00 0.00 C ATOM 683 NE1 TRP B 29 -51.637 1.784 40.680 1.00 0.00 N ATOM 684 CE2 TRP B 29 -51.225 0.466 40.608 1.00 0.00 C ATOM 685 CE3 TRP B 29 -49.164 -0.875 40.605 1.00 0.00 C ATOM 686 CZ2 TRP B 29 -52.002 -0.716 40.669 1.00 0.00 C ATOM 687 CZ3 TRP B 29 -49.949 -2.028 40.643 1.00 0.00 C ATOM 688 CH2 TRP B 29 -51.348 -1.951 40.680 1.00 0.00 C ATOM 0 H TRP B 29 -48.415 4.671 41.897 1.00 0.00 H new ATOM 0 HA TRP B 29 -46.200 3.316 40.371 1.00 0.00 H new ATOM 0 HB2 TRP B 29 -47.280 1.402 40.067 1.00 0.00 H new ATOM 0 HB3 TRP B 29 -47.543 1.730 41.769 1.00 0.00 H new ATOM 0 HD1 TRP B 29 -50.393 3.601 40.652 1.00 0.00 H new ATOM 0 HE1 TRP B 29 -52.591 2.140 40.743 1.00 0.00 H new ATOM 0 HE3 TRP B 29 -48.086 -0.942 40.598 1.00 0.00 H new ATOM 0 HZ2 TRP B 29 -53.080 -0.664 40.706 1.00 0.00 H new ATOM 0 HZ3 TRP B 29 -49.470 -2.996 40.644 1.00 0.00 H new ATOM 0 HH2 TRP B 29 -51.930 -2.860 40.718 1.00 0.00 H new ATOM 699 N GLU B 30 -47.042 5.538 39.243 1.00 0.00 N ATOM 700 CA GLU B 30 -46.944 6.410 38.053 1.00 0.00 C ATOM 701 C GLU B 30 -45.658 7.310 38.163 1.00 0.00 C ATOM 702 O GLU B 30 -45.033 7.538 39.203 1.00 0.00 O ATOM 703 CB GLU B 30 -48.286 7.195 37.913 1.00 0.00 C ATOM 704 CG GLU B 30 -48.404 8.363 36.887 1.00 0.00 C ATOM 705 CD GLU B 30 -48.026 8.226 35.413 1.00 0.00 C ATOM 706 OE1 GLU B 30 -47.465 7.201 34.970 1.00 0.00 O ATOM 707 OE2 GLU B 30 -48.198 9.227 34.689 1.00 0.00 O ATOM 0 H GLU B 30 -46.665 5.981 40.081 1.00 0.00 H new ATOM 0 HA GLU B 30 -46.817 5.841 37.132 1.00 0.00 H new ATOM 0 HB2 GLU B 30 -49.062 6.469 37.668 1.00 0.00 H new ATOM 0 HB3 GLU B 30 -48.528 7.601 38.895 1.00 0.00 H new ATOM 0 HG2 GLU B 30 -49.444 8.688 36.909 1.00 0.00 H new ATOM 0 HG3 GLU B 30 -47.805 9.183 37.284 1.00 0.00 H new ATOM 714 N ARG B 31 -45.275 7.799 37.001 1.00 0.00 N ATOM 715 CA ARG B 31 -44.218 8.818 36.779 1.00 0.00 C ATOM 716 C ARG B 31 -44.493 10.244 37.374 1.00 0.00 C ATOM 717 O ARG B 31 -45.660 10.645 37.444 1.00 0.00 O ATOM 718 CB ARG B 31 -44.192 8.749 35.225 1.00 0.00 C ATOM 719 CG ARG B 31 -43.271 9.594 34.318 1.00 0.00 C ATOM 720 CD ARG B 31 -43.388 9.171 32.821 1.00 0.00 C ATOM 721 NE ARG B 31 -44.761 9.345 32.233 1.00 0.00 N ATOM 722 CZ ARG B 31 -45.775 8.482 32.341 1.00 0.00 C ATOM 723 NH1 ARG B 31 -45.648 7.256 32.748 1.00 0.00 N ATOM 724 NH2 ARG B 31 -46.969 8.901 32.096 1.00 0.00 N ATOM 0 H ARG B 31 -45.703 7.493 36.127 1.00 0.00 H new ATOM 0 HA ARG B 31 -43.274 8.625 37.289 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -43.986 7.708 34.975 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -45.210 8.960 34.898 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -43.529 10.648 34.419 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -42.238 9.485 34.647 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -42.678 9.754 32.235 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -43.096 8.125 32.727 1.00 0.00 H new ATOM 0 HE ARG B 31 -44.934 10.200 31.704 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -44.729 6.898 33.009 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -46.467 6.651 32.806 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -47.123 9.873 31.826 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -47.760 8.261 32.172 1.00 0.00 H new ATOM 738 N PRO B 32 -43.475 11.110 37.680 1.00 0.00 N ATOM 739 CA PRO B 32 -43.670 12.593 37.707 1.00 0.00 C ATOM 740 C PRO B 32 -43.906 13.189 36.271 1.00 0.00 C ATOM 741 O PRO B 32 -43.120 13.969 35.728 1.00 0.00 O ATOM 742 CB PRO B 32 -42.368 13.098 38.367 1.00 0.00 C ATOM 743 CG PRO B 32 -41.352 12.037 37.985 1.00 0.00 C ATOM 744 CD PRO B 32 -42.069 10.703 37.811 1.00 0.00 C ATOM 0 HA PRO B 32 -44.562 12.902 38.253 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -42.083 14.082 37.994 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -42.472 13.185 39.449 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -40.846 12.316 37.061 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -40.586 11.955 38.756 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -41.718 10.166 36.929 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -41.915 10.045 38.667 1.00 0.00 H new ATOM 752 N SER B 33 -45.037 12.805 35.673 1.00 0.00 N ATOM 753 CA SER B 33 -45.497 13.313 34.344 1.00 0.00 C ATOM 754 C SER B 33 -45.606 14.863 34.093 1.00 0.00 C ATOM 755 O SER B 33 -45.697 15.280 32.935 1.00 0.00 O ATOM 756 CB SER B 33 -46.855 12.627 34.068 1.00 0.00 C ATOM 757 OG SER B 33 -46.699 11.225 33.825 1.00 0.00 O ATOM 0 H SER B 33 -45.676 12.127 36.088 1.00 0.00 H new ATOM 0 HA SER B 33 -44.693 13.060 33.652 1.00 0.00 H new ATOM 0 HB2 SER B 33 -47.519 12.777 34.920 1.00 0.00 H new ATOM 0 HB3 SER B 33 -47.331 13.095 33.206 1.00 0.00 H new ATOM 0 HG SER B 33 -47.519 10.755 34.085 1.00 0.00 H new ATOM 763 N GLY B 34 -45.549 15.705 35.137 1.00 0.00 N ATOM 764 CA GLY B 34 -45.451 17.186 34.970 1.00 0.00 C ATOM 765 C GLY B 34 -44.020 17.761 35.021 1.00 0.00 C ATOM 766 O GLY B 34 -43.729 18.625 35.850 1.00 0.00 O ATOM 0 H GLY B 34 -45.568 15.398 36.109 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -45.901 17.458 34.015 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -46.045 17.663 35.749 1.00 0.00 H new ATOM 770 N ASN B 35 -43.138 17.285 34.132 1.00 0.00 N ATOM 771 CA ASN B 35 -41.686 17.617 34.170 1.00 0.00 C ATOM 772 C ASN B 35 -41.181 17.987 32.735 1.00 0.00 C ATOM 773 O ASN B 35 -40.857 17.105 31.932 1.00 0.00 O ATOM 774 CB ASN B 35 -40.958 16.399 34.814 1.00 0.00 C ATOM 775 CG ASN B 35 -39.497 16.618 35.202 1.00 0.00 C ATOM 776 OD1 ASN B 35 -39.151 16.791 36.363 1.00 0.00 O ATOM 777 ND2 ASN B 35 -38.584 16.591 34.266 1.00 0.00 N ATOM 0 H ASN B 35 -43.397 16.662 33.367 1.00 0.00 H new ATOM 0 HA ASN B 35 -41.474 18.498 34.776 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -41.509 16.102 35.706 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -41.006 15.563 34.117 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -37.601 16.713 34.509 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -38.855 16.448 33.293 1.00 0.00 H new ATOM 784 N SER B 36 -41.078 19.288 32.424 1.00 0.00 N ATOM 785 CA SER B 36 -40.538 19.767 31.120 1.00 0.00 C ATOM 786 C SER B 36 -38.970 19.760 31.022 1.00 0.00 C ATOM 787 O SER B 36 -38.248 19.747 32.024 1.00 0.00 O ATOM 788 CB SER B 36 -41.145 21.172 30.896 1.00 0.00 C ATOM 789 OG SER B 36 -40.817 21.672 29.598 1.00 0.00 O ATOM 0 H SER B 36 -41.360 20.039 33.054 1.00 0.00 H new ATOM 0 HA SER B 36 -40.827 19.076 30.328 1.00 0.00 H new ATOM 0 HB2 SER B 36 -42.228 21.126 31.009 1.00 0.00 H new ATOM 0 HB3 SER B 36 -40.774 21.858 31.658 1.00 0.00 H new ATOM 0 HG SER B 36 -40.162 22.396 29.682 1.00 0.00 H new ATOM 795 N SER B 37 -38.428 19.801 29.790 1.00 0.00 N ATOM 796 CA SER B 37 -36.959 20.025 29.563 1.00 0.00 C ATOM 797 C SER B 37 -36.551 21.537 29.419 1.00 0.00 C ATOM 798 O SER B 37 -36.072 22.038 28.398 1.00 0.00 O ATOM 799 CB SER B 37 -36.565 19.219 28.325 1.00 0.00 C ATOM 800 OG SER B 37 -36.778 17.816 28.496 1.00 0.00 O ATOM 0 H SER B 37 -38.968 19.685 28.933 1.00 0.00 H new ATOM 0 HA SER B 37 -36.417 19.689 30.447 1.00 0.00 H new ATOM 0 HB2 SER B 37 -37.141 19.569 27.469 1.00 0.00 H new ATOM 0 HB3 SER B 37 -35.514 19.399 28.097 1.00 0.00 H new ATOM 0 HG SER B 37 -36.514 17.343 27.679 1.00 0.00 H new ATOM 806 N SER B 38 -36.803 22.237 30.513 1.00 0.00 N ATOM 807 CA SER B 38 -36.891 23.731 30.570 1.00 0.00 C ATOM 808 C SER B 38 -37.003 24.334 32.012 1.00 0.00 C ATOM 809 O SER B 38 -36.423 25.388 32.286 1.00 0.00 O ATOM 810 CB SER B 38 -38.055 24.283 29.688 1.00 0.00 C ATOM 811 OG SER B 38 -39.347 23.796 30.079 1.00 0.00 O ATOM 0 H SER B 38 -36.959 21.795 31.419 1.00 0.00 H new ATOM 0 HA SER B 38 -35.932 24.059 30.169 1.00 0.00 H new ATOM 0 HB2 SER B 38 -38.055 25.372 29.739 1.00 0.00 H new ATOM 0 HB3 SER B 38 -37.873 24.013 28.648 1.00 0.00 H new ATOM 0 HG SER B 38 -39.741 24.406 30.736 1.00 0.00 H new ATOM 817 N GLY B 39 -37.820 23.735 32.894 1.00 0.00 N ATOM 818 CA GLY B 39 -38.768 24.520 33.718 1.00 0.00 C ATOM 819 C GLY B 39 -40.173 24.318 33.139 1.00 0.00 C ATOM 820 O GLY B 39 -40.966 23.546 33.718 1.00 0.00 O ATOM 821 OXT GLY B 39 -40.469 24.886 32.063 1.00 0.00 O ATOM 0 H GLY B 39 -37.848 22.728 33.057 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -38.733 24.192 34.757 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -38.499 25.576 33.707 1.00 0.00 H new TER 825 GLY B 39