USER MOD reduce.3.24.130724 H: found=0, std=0, add=408, rem=0, adj=21 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: A 1 LYS N :NH3+ 146:sc= 1.25 (180deg=0) USER MOD Set 1.2: B 25 ASN : amide:sc= 1.97 K(o=3.2,f=-4.5!) USER MOD Set 2.1: B 1 LYS NZ :NH3+ -172:sc= 1.95 (180deg=0.729) USER MOD Set 2.2: B 35 ASN : amide:sc= 1.01 K(o=3,f=-3.3) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 44:sc= 0.825 USER MOD Single : A 10 LYS NZ :NH3+ -149:sc= 1.15 (180deg=-0.659!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 25:sc= 1.48 USER MOD Single : B 1 LYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 LYS NZ :NH3+ -178:sc= 1.23 (180deg=1.18) USER MOD Single : B 10 MET CE :methyl 148:sc= -0.225 (180deg=-1.23) USER MOD Single : B 11 SER OG : rot 175:sc= 0.00173 USER MOD Single : B 13 SER OG : rot -93:sc= 1.22 USER MOD Single : B 14 SER OG : rot 3:sc= 1.09 USER MOD Single : B 18 TYR OH : rot -23:sc= 1.05 USER MOD Single : B 19 TYR OH : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= -0.0907 X(o=-0.091,f=0) USER MOD Single : B 22 HIS : no HE2:sc= 0.0785 K(o=0.078,f=-1.1) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 27 SER OG : rot 81:sc= 1.63 USER MOD Single : B 28 GLN :FLIP amide:sc= -0.0334 F(o=-1.2,f=-0.033) USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 36 SER OG : rot 44:sc= 0.411 USER MOD Single : B 37 SER OG : rot -3:sc= 0.825 USER MOD Single : B 38 SER OG : rot 28:sc= 0.743 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 -43.863 9.583 57.684 1.00 0.00 N ATOM 2 CA LYS A 1 -43.757 8.099 57.742 1.00 0.00 C ATOM 3 C LYS A 1 -44.838 7.389 56.852 1.00 0.00 C ATOM 4 O LYS A 1 -46.016 7.740 56.950 1.00 0.00 O ATOM 5 CB LYS A 1 -43.746 7.614 59.228 1.00 0.00 C ATOM 6 CG LYS A 1 -45.045 7.711 60.089 1.00 0.00 C ATOM 7 CD LYS A 1 -44.851 7.085 61.496 1.00 0.00 C ATOM 8 CE LYS A 1 -46.131 6.881 62.343 1.00 0.00 C ATOM 9 NZ LYS A 1 -46.601 8.141 62.996 1.00 0.00 N ATOM 0 H1 LYS A 1 -43.604 9.986 58.607 1.00 0.00 H new ATOM 0 H2 LYS A 1 -43.219 9.949 56.954 1.00 0.00 H new ATOM 0 H3 LYS A 1 -44.840 9.852 57.450 1.00 0.00 H new ATOM 0 HA LYS A 1 -42.803 7.802 57.305 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -43.435 6.569 59.226 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -42.970 8.176 59.747 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -45.335 8.757 60.193 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -45.861 7.203 59.575 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -44.364 6.117 61.375 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -44.166 7.718 62.060 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -46.924 6.490 61.706 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -45.938 6.130 63.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -47.460 7.946 63.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -45.858 8.503 63.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -46.813 8.852 62.267 1.00 0.00 H new ATOM 25 N VAL A 2 -44.458 6.397 56.028 1.00 0.00 N ATOM 26 CA VAL A 2 -45.435 5.530 55.279 1.00 0.00 C ATOM 27 C VAL A 2 -45.942 4.354 56.199 1.00 0.00 C ATOM 28 O VAL A 2 -45.260 3.932 57.142 1.00 0.00 O ATOM 29 CB VAL A 2 -44.760 5.051 53.934 1.00 0.00 C ATOM 30 CG1 VAL A 2 -45.585 4.055 53.080 1.00 0.00 C ATOM 31 CG2 VAL A 2 -44.426 6.212 52.967 1.00 0.00 C ATOM 0 H VAL A 2 -43.481 6.161 55.852 1.00 0.00 H new ATOM 0 HA VAL A 2 -46.329 6.091 55.007 1.00 0.00 H new ATOM 0 HB VAL A 2 -43.869 4.559 54.323 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -45.025 3.795 52.182 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -45.779 3.153 53.660 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -46.532 4.515 52.797 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -43.965 5.812 52.064 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -45.342 6.741 52.703 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -43.736 6.902 53.452 1.00 0.00 H new ATOM 41 N SER A 3 -47.135 3.801 55.916 1.00 0.00 N ATOM 42 CA SER A 3 -47.581 2.499 56.498 1.00 0.00 C ATOM 43 C SER A 3 -46.846 1.257 55.868 1.00 0.00 C ATOM 44 O SER A 3 -47.376 0.579 54.980 1.00 0.00 O ATOM 45 CB SER A 3 -49.124 2.437 56.348 1.00 0.00 C ATOM 46 OG SER A 3 -49.515 2.237 54.986 1.00 0.00 O ATOM 0 H SER A 3 -47.816 4.228 55.288 1.00 0.00 H new ATOM 0 HA SER A 3 -47.308 2.448 57.552 1.00 0.00 H new ATOM 0 HB2 SER A 3 -49.517 1.627 56.962 1.00 0.00 H new ATOM 0 HB3 SER A 3 -49.564 3.362 56.721 1.00 0.00 H new ATOM 0 HG SER A 3 -48.950 1.546 54.581 1.00 0.00 H new ATOM 52 N VAL A 4 -45.593 1.014 56.299 1.00 0.00 N ATOM 53 CA VAL A 4 -44.673 0.007 55.671 1.00 0.00 C ATOM 54 C VAL A 4 -44.242 0.468 54.231 1.00 0.00 C ATOM 55 O VAL A 4 -43.570 1.487 54.047 1.00 0.00 O ATOM 56 CB VAL A 4 -45.085 -1.495 55.970 1.00 0.00 C ATOM 57 CG1 VAL A 4 -44.003 -2.528 55.562 1.00 0.00 C ATOM 58 CG2 VAL A 4 -45.402 -1.797 57.457 1.00 0.00 C ATOM 0 H VAL A 4 -45.177 1.503 57.092 1.00 0.00 H new ATOM 0 HA VAL A 4 -43.705 -0.020 56.171 1.00 0.00 H new ATOM 0 HB VAL A 4 -45.985 -1.598 55.363 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -44.353 -3.533 55.796 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -43.811 -2.450 54.492 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -43.083 -2.328 56.111 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -45.674 -2.847 57.565 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -44.524 -1.585 58.067 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -46.232 -1.172 57.786 1.00 0.00 H new ATOM 68 N VAL A 5 -44.649 -0.301 53.233 1.00 0.00 N ATOM 69 CA VAL A 5 -44.586 0.070 51.787 1.00 0.00 C ATOM 70 C VAL A 5 -45.964 -0.348 51.156 1.00 0.00 C ATOM 71 O VAL A 5 -46.440 -1.477 51.320 1.00 0.00 O ATOM 72 CB VAL A 5 -43.354 -0.563 51.041 1.00 0.00 C ATOM 73 CG1 VAL A 5 -43.193 -0.050 49.591 1.00 0.00 C ATOM 74 CG2 VAL A 5 -41.980 -0.331 51.718 1.00 0.00 C ATOM 0 H VAL A 5 -45.046 -1.228 53.387 1.00 0.00 H new ATOM 0 HA VAL A 5 -44.427 1.143 51.679 1.00 0.00 H new ATOM 0 HB VAL A 5 -43.603 -1.624 51.073 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -42.326 -0.524 49.131 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -44.087 -0.294 49.017 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -43.053 1.031 49.601 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -41.198 -0.806 51.126 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -41.784 0.739 51.786 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -41.990 -0.762 52.719 1.00 0.00 H new ATOM 84 N ARG A 6 -46.625 0.567 50.436 1.00 0.00 N ATOM 85 CA ARG A 6 -48.091 0.483 50.160 1.00 0.00 C ATOM 86 C ARG A 6 -48.426 0.919 48.684 1.00 0.00 C ATOM 87 O ARG A 6 -48.117 2.042 48.281 1.00 0.00 O ATOM 88 CB ARG A 6 -48.753 1.358 51.280 1.00 0.00 C ATOM 89 CG ARG A 6 -50.274 1.193 51.504 1.00 0.00 C ATOM 90 CD ARG A 6 -51.135 1.968 50.486 1.00 0.00 C ATOM 91 NE ARG A 6 -52.510 1.424 50.333 1.00 0.00 N ATOM 92 CZ ARG A 6 -52.804 0.351 49.590 1.00 0.00 C ATOM 93 NH1 ARG A 6 -51.979 -0.637 49.374 1.00 0.00 N ATOM 94 NH2 ARG A 6 -53.969 0.282 49.034 1.00 0.00 N ATOM 0 H ARG A 6 -46.176 1.386 50.025 1.00 0.00 H new ATOM 0 HA ARG A 6 -48.485 -0.532 50.203 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -48.248 1.140 52.221 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -48.558 2.405 51.049 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -50.528 0.134 51.451 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -50.523 1.531 52.510 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -51.198 3.011 50.796 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -50.637 1.953 49.516 1.00 0.00 H new ATOM 0 HE ARG A 6 -53.272 1.895 50.822 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -51.045 -0.620 49.783 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -52.269 -1.426 48.796 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -54.643 1.036 49.166 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -54.215 -0.527 48.463 1.00 0.00 H new HETATM 108 N TPO A 7 -49.111 0.067 47.896 1.00 0.00 N HETATM 109 CA TPO A 7 -49.490 0.360 46.473 1.00 0.00 C HETATM 110 CB TPO A 7 -49.440 -0.967 45.650 1.00 0.00 C HETATM 111 CG2 TPO A 7 -49.781 -0.839 44.164 1.00 0.00 C HETATM 112 OG1 TPO A 7 -50.302 -2.001 46.166 1.00 0.00 O HETATM 113 P TPO A 7 -49.746 -3.150 47.143 1.00 0.00 P HETATM 114 O1P TPO A 7 -48.344 -3.566 46.704 1.00 0.00 O HETATM 115 O2P TPO A 7 -49.637 -2.604 48.577 1.00 0.00 O HETATM 116 O3P TPO A 7 -50.740 -4.404 47.100 1.00 0.00 O HETATM 117 C TPO A 7 -50.856 1.151 46.346 1.00 0.00 C HETATM 118 O TPO A 7 -51.893 0.563 46.666 1.00 0.00 O HETATM 0 HG23 TPO A 7 -50.793 -0.450 44.055 1.00 0.00 H new HETATM 0 HG22 TPO A 7 -49.077 -0.157 43.687 1.00 0.00 H new HETATM 0 HG21 TPO A 7 -49.715 -1.818 43.690 1.00 0.00 H new HETATM 0 HB TPO A 7 -48.388 -1.233 45.757 1.00 0.00 H new HETATM 0 HA TPO A 7 -48.761 1.047 46.043 1.00 0.00 H new HETATM 0 H TPO A 7 -48.876 -0.885 48.175 1.00 0.00 H new ATOM 125 N PRO A 8 -50.924 2.451 45.910 1.00 0.00 N ATOM 126 CA PRO A 8 -52.091 3.347 46.181 1.00 0.00 C ATOM 127 C PRO A 8 -53.515 2.923 45.629 1.00 0.00 C ATOM 128 O PRO A 8 -54.249 2.346 46.445 1.00 0.00 O ATOM 129 CB PRO A 8 -51.507 4.753 45.879 1.00 0.00 C ATOM 130 CG PRO A 8 -50.254 4.553 45.033 1.00 0.00 C ATOM 131 CD PRO A 8 -49.730 3.206 45.502 1.00 0.00 C ATOM 0 HA PRO A 8 -52.456 3.291 47.206 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -52.235 5.365 45.348 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -51.266 5.276 46.805 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -50.484 4.547 43.968 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -49.526 5.348 45.197 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -49.193 2.693 44.705 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -49.034 3.321 46.333 1.00 0.00 H new ATOM 139 N PRO A 9 -53.986 3.106 44.354 1.00 0.00 N ATOM 140 CA PRO A 9 -55.220 2.429 43.853 1.00 0.00 C ATOM 141 C PRO A 9 -55.012 0.906 43.537 1.00 0.00 C ATOM 142 O PRO A 9 -53.896 0.464 43.243 1.00 0.00 O ATOM 143 CB PRO A 9 -55.533 3.281 42.608 1.00 0.00 C ATOM 144 CG PRO A 9 -54.165 3.699 42.063 1.00 0.00 C ATOM 145 CD PRO A 9 -53.309 3.905 43.314 1.00 0.00 C ATOM 0 HA PRO A 9 -56.033 2.391 44.578 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -56.095 2.710 41.869 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -56.138 4.150 42.866 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -53.743 2.931 41.414 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -54.234 4.613 41.473 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -52.285 3.566 43.156 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -53.257 4.958 43.592 1.00 0.00 H new ATOM 153 N LYS A 10 -56.078 0.087 43.598 1.00 0.00 N ATOM 154 CA LYS A 10 -55.947 -1.395 43.472 1.00 0.00 C ATOM 155 C LYS A 10 -56.796 -2.019 42.311 1.00 0.00 C ATOM 156 O LYS A 10 -57.947 -2.422 42.494 1.00 0.00 O ATOM 157 CB LYS A 10 -56.190 -2.011 44.879 1.00 0.00 C ATOM 158 CG LYS A 10 -55.747 -3.484 45.081 1.00 0.00 C ATOM 159 CD LYS A 10 -54.216 -3.722 45.017 1.00 0.00 C ATOM 160 CE LYS A 10 -53.722 -4.215 43.643 1.00 0.00 C ATOM 161 NZ LYS A 10 -52.233 -4.359 43.666 1.00 0.00 N ATOM 0 H LYS A 10 -57.035 0.412 43.732 1.00 0.00 H new ATOM 0 HA LYS A 10 -54.937 -1.650 43.152 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -55.671 -1.396 45.614 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -57.255 -1.943 45.101 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -56.113 -3.828 46.048 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -56.227 -4.100 44.321 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -53.702 -2.793 45.266 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -53.939 -4.453 45.776 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -54.186 -5.171 43.400 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -54.017 -3.511 42.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -51.851 -4.171 42.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -51.829 -3.680 44.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -51.982 -5.326 43.954 1.00 0.00 H new ATOM 175 N SER A 11 -56.180 -2.162 41.127 1.00 0.00 N ATOM 176 CA SER A 11 -56.644 -3.117 40.068 1.00 0.00 C ATOM 177 C SER A 11 -56.204 -4.619 40.322 1.00 0.00 C ATOM 178 O SER A 11 -55.417 -4.848 41.247 1.00 0.00 O ATOM 179 CB SER A 11 -56.065 -2.538 38.748 1.00 0.00 C ATOM 180 OG SER A 11 -56.733 -1.330 38.380 1.00 0.00 O ATOM 0 H SER A 11 -55.351 -1.630 40.863 1.00 0.00 H new ATOM 0 HA SER A 11 -57.732 -3.188 40.049 1.00 0.00 H new ATOM 0 HB2 SER A 11 -54.999 -2.346 38.868 1.00 0.00 H new ATOM 0 HB3 SER A 11 -56.168 -3.272 37.949 1.00 0.00 H new ATOM 0 HG SER A 11 -56.349 -0.985 37.547 1.00 0.00 H new ATOM 186 N PRO A 12 -56.635 -5.683 39.570 1.00 0.00 N ATOM 187 CA PRO A 12 -56.114 -7.078 39.769 1.00 0.00 C ATOM 188 C PRO A 12 -54.636 -7.308 39.279 1.00 0.00 C ATOM 189 O PRO A 12 -54.368 -7.805 38.179 1.00 0.00 O ATOM 190 CB PRO A 12 -57.191 -7.910 39.041 1.00 0.00 C ATOM 191 CG PRO A 12 -57.756 -6.984 37.962 1.00 0.00 C ATOM 192 CD PRO A 12 -57.766 -5.605 38.621 1.00 0.00 C ATOM 0 HA PRO A 12 -55.993 -7.356 40.816 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -56.762 -8.810 38.601 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -57.971 -8.233 39.730 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -57.137 -6.993 37.065 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -58.758 -7.289 37.660 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -57.626 -4.808 37.891 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -58.709 -5.408 39.132 1.00 0.00 H new ATOM 200 N SER A 13 -53.679 -6.865 40.110 1.00 0.00 N ATOM 201 CA SER A 13 -52.268 -6.601 39.731 1.00 0.00 C ATOM 202 C SER A 13 -51.585 -5.967 40.984 1.00 0.00 C ATOM 203 O SER A 13 -51.451 -4.725 41.085 1.00 0.00 O ATOM 204 CB SER A 13 -52.147 -5.701 38.468 1.00 0.00 C ATOM 205 OG SER A 13 -52.308 -6.472 37.275 1.00 0.00 O ATOM 206 OXT SER A 13 -51.206 -6.705 41.921 1.00 0.00 O ATOM 0 H SER A 13 -53.864 -6.673 41.095 1.00 0.00 H new ATOM 0 HA SER A 13 -51.768 -7.528 39.449 1.00 0.00 H new ATOM 0 HB2 SER A 13 -52.902 -4.915 38.503 1.00 0.00 H new ATOM 0 HB3 SER A 13 -51.175 -5.209 38.459 1.00 0.00 H new ATOM 0 HG SER A 13 -52.828 -7.278 37.474 1.00 0.00 H new TER 212 SER A 13 ATOM 213 N LYS B 1 -33.484 7.948 33.250 1.00 0.00 N ATOM 214 CA LYS B 1 -34.020 9.315 33.519 1.00 0.00 C ATOM 215 C LYS B 1 -34.980 9.283 34.758 1.00 0.00 C ATOM 216 O LYS B 1 -36.174 9.019 34.595 1.00 0.00 O ATOM 217 CB LYS B 1 -34.662 9.847 32.198 1.00 0.00 C ATOM 218 CG LYS B 1 -35.334 11.251 32.261 1.00 0.00 C ATOM 219 CD LYS B 1 -35.777 11.755 30.863 1.00 0.00 C ATOM 220 CE LYS B 1 -36.588 13.073 30.859 1.00 0.00 C ATOM 221 NZ LYS B 1 -38.028 12.825 31.181 1.00 0.00 N ATOM 0 H1 LYS B 1 -32.849 7.980 32.427 1.00 0.00 H new ATOM 0 H2 LYS B 1 -32.957 7.612 34.081 1.00 0.00 H new ATOM 0 H3 LYS B 1 -34.272 7.298 33.054 1.00 0.00 H new ATOM 0 HA LYS B 1 -33.235 10.019 33.797 1.00 0.00 H new ATOM 0 HB2 LYS B 1 -33.888 9.875 31.431 1.00 0.00 H new ATOM 0 HB3 LYS B 1 -35.411 9.126 31.870 1.00 0.00 H new ATOM 0 HG2 LYS B 1 -36.201 11.207 32.920 1.00 0.00 H new ATOM 0 HG3 LYS B 1 -34.637 11.966 32.698 1.00 0.00 H new ATOM 0 HD2 LYS B 1 -34.888 11.893 30.247 1.00 0.00 H new ATOM 0 HD3 LYS B 1 -36.376 10.978 30.388 1.00 0.00 H new ATOM 0 HE2 LYS B 1 -36.164 13.766 31.586 1.00 0.00 H new ATOM 0 HE3 LYS B 1 -36.508 13.549 29.882 1.00 0.00 H new ATOM 0 HZ1 LYS B 1 -38.571 13.700 31.039 1.00 0.00 H new ATOM 0 HZ2 LYS B 1 -38.400 12.081 30.557 1.00 0.00 H new ATOM 0 HZ3 LYS B 1 -38.115 12.521 32.172 1.00 0.00 H new ATOM 237 N LEU B 2 -34.464 9.525 35.980 1.00 0.00 N ATOM 238 CA LEU B 2 -35.310 9.637 37.208 1.00 0.00 C ATOM 239 C LEU B 2 -34.736 10.658 38.280 1.00 0.00 C ATOM 240 O LEU B 2 -33.559 11.025 38.176 1.00 0.00 O ATOM 241 CB LEU B 2 -35.639 8.219 37.778 1.00 0.00 C ATOM 242 CG LEU B 2 -34.558 7.551 38.672 1.00 0.00 C ATOM 243 CD1 LEU B 2 -34.845 7.840 40.152 1.00 0.00 C ATOM 244 CD2 LEU B 2 -34.510 6.029 38.466 1.00 0.00 C ATOM 0 H LEU B 2 -33.466 9.648 36.153 1.00 0.00 H new ATOM 0 HA LEU B 2 -36.260 10.086 36.918 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -36.560 8.292 38.357 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -35.842 7.555 36.938 1.00 0.00 H new ATOM 0 HG LEU B 2 -33.595 7.972 38.384 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -34.081 7.367 40.770 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -34.833 8.917 40.321 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -35.824 7.442 40.417 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -33.742 5.599 39.109 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -35.478 5.597 38.719 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -34.276 5.810 37.424 1.00 0.00 H new ATOM 256 N PRO B 3 -35.501 11.125 39.316 1.00 0.00 N ATOM 257 CA PRO B 3 -35.029 12.164 40.273 1.00 0.00 C ATOM 258 C PRO B 3 -34.109 11.806 41.515 1.00 0.00 C ATOM 259 O PRO B 3 -34.099 10.661 41.992 1.00 0.00 O ATOM 260 CB PRO B 3 -36.357 12.842 40.672 1.00 0.00 C ATOM 261 CG PRO B 3 -37.431 12.353 39.723 1.00 0.00 C ATOM 262 CD PRO B 3 -36.957 10.951 39.384 1.00 0.00 C ATOM 0 HA PRO B 3 -34.277 12.773 39.771 1.00 0.00 H new ATOM 0 HB2 PRO B 3 -36.617 12.596 41.702 1.00 0.00 H new ATOM 0 HB3 PRO B 3 -36.264 13.927 40.617 1.00 0.00 H new ATOM 0 HG2 PRO B 3 -38.415 12.346 40.192 1.00 0.00 H new ATOM 0 HG3 PRO B 3 -37.505 12.982 38.836 1.00 0.00 H new ATOM 0 HD2 PRO B 3 -37.246 10.228 40.147 1.00 0.00 H new ATOM 0 HD3 PRO B 3 -37.370 10.599 38.439 1.00 0.00 H new ATOM 270 N PRO B 4 -33.350 12.781 42.111 1.00 0.00 N ATOM 271 CA PRO B 4 -32.390 12.510 43.213 1.00 0.00 C ATOM 272 C PRO B 4 -33.090 12.404 44.608 1.00 0.00 C ATOM 273 O PRO B 4 -33.675 13.363 45.122 1.00 0.00 O ATOM 274 CB PRO B 4 -31.426 13.704 43.063 1.00 0.00 C ATOM 275 CG PRO B 4 -32.290 14.864 42.562 1.00 0.00 C ATOM 276 CD PRO B 4 -33.376 14.202 41.712 1.00 0.00 C ATOM 0 HA PRO B 4 -31.883 11.547 43.156 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -30.953 13.949 44.014 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -30.626 13.477 42.358 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -32.723 15.423 43.392 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -31.703 15.570 41.974 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -34.353 14.648 41.900 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -33.172 14.318 40.648 1.00 0.00 H new ATOM 284 N GLY B 5 -33.059 11.200 45.185 1.00 0.00 N ATOM 285 CA GLY B 5 -33.961 10.827 46.314 1.00 0.00 C ATOM 286 C GLY B 5 -35.069 9.783 46.040 1.00 0.00 C ATOM 287 O GLY B 5 -36.045 9.752 46.791 1.00 0.00 O ATOM 0 H GLY B 5 -32.423 10.455 44.899 1.00 0.00 H new ATOM 0 HA2 GLY B 5 -33.341 10.451 47.127 1.00 0.00 H new ATOM 0 HA3 GLY B 5 -34.441 11.737 46.674 1.00 0.00 H new ATOM 291 N TRP B 6 -34.919 8.908 45.037 1.00 0.00 N ATOM 292 CA TRP B 6 -35.868 7.819 44.748 1.00 0.00 C ATOM 293 C TRP B 6 -35.279 6.397 44.932 1.00 0.00 C ATOM 294 O TRP B 6 -34.064 6.192 44.847 1.00 0.00 O ATOM 295 CB TRP B 6 -36.157 8.084 43.247 1.00 0.00 C ATOM 296 CG TRP B 6 -37.363 8.974 43.038 1.00 0.00 C ATOM 297 CD1 TRP B 6 -37.337 10.367 42.887 1.00 0.00 C ATOM 298 CD2 TRP B 6 -38.682 8.611 43.058 1.00 0.00 C ATOM 299 NE1 TRP B 6 -38.632 10.902 42.825 1.00 0.00 N ATOM 300 CE2 TRP B 6 -39.446 9.794 42.936 1.00 0.00 C ATOM 301 CE3 TRP B 6 -39.308 7.338 43.131 1.00 0.00 C ATOM 302 CZ2 TRP B 6 -40.839 9.717 42.796 1.00 0.00 C ATOM 303 CZ3 TRP B 6 -40.708 7.318 43.141 1.00 0.00 C ATOM 304 CH2 TRP B 6 -41.466 8.481 42.959 1.00 0.00 C ATOM 0 H TRP B 6 -34.127 8.935 44.395 1.00 0.00 H new ATOM 0 HA TRP B 6 -36.728 7.826 45.418 1.00 0.00 H new ATOM 0 HB2 TRP B 6 -35.284 8.547 42.788 1.00 0.00 H new ATOM 0 HB3 TRP B 6 -36.318 7.134 42.738 1.00 0.00 H new ATOM 0 HD1 TRP B 6 -36.433 10.955 42.826 1.00 0.00 H new ATOM 0 HE1 TRP B 6 -38.907 11.879 42.722 1.00 0.00 H new ATOM 0 HE3 TRP B 6 -38.730 6.427 43.177 1.00 0.00 H new ATOM 0 HZ2 TRP B 6 -41.417 10.600 42.566 1.00 0.00 H new ATOM 0 HZ3 TRP B 6 -41.218 6.378 43.294 1.00 0.00 H new ATOM 0 HH2 TRP B 6 -42.544 8.421 42.945 1.00 0.00 H new ATOM 315 N GLU B 7 -36.163 5.383 45.040 1.00 0.00 N ATOM 316 CA GLU B 7 -35.831 4.024 44.582 1.00 0.00 C ATOM 317 C GLU B 7 -37.082 3.278 43.987 1.00 0.00 C ATOM 318 O GLU B 7 -37.964 3.879 43.364 1.00 0.00 O ATOM 319 CB GLU B 7 -35.028 3.333 45.747 1.00 0.00 C ATOM 320 CG GLU B 7 -34.090 2.150 45.378 1.00 0.00 C ATOM 321 CD GLU B 7 -34.485 0.792 45.913 1.00 0.00 C ATOM 322 OE1 GLU B 7 -34.438 0.575 47.140 1.00 0.00 O ATOM 323 OE2 GLU B 7 -34.850 -0.077 45.104 1.00 0.00 O ATOM 0 H GLU B 7 -37.098 5.480 45.435 1.00 0.00 H new ATOM 0 HA GLU B 7 -35.172 4.011 43.714 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -34.426 4.097 46.238 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -35.748 2.973 46.482 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -34.031 2.086 44.291 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -33.088 2.382 45.739 1.00 0.00 H new ATOM 330 N LYS B 8 -37.107 1.946 44.088 1.00 0.00 N ATOM 331 CA LYS B 8 -37.956 1.054 43.242 1.00 0.00 C ATOM 332 C LYS B 8 -38.430 -0.213 44.029 1.00 0.00 C ATOM 333 O LYS B 8 -37.603 -0.978 44.537 1.00 0.00 O ATOM 334 CB LYS B 8 -37.275 0.819 41.854 1.00 0.00 C ATOM 335 CG LYS B 8 -35.907 0.104 41.798 1.00 0.00 C ATOM 336 CD LYS B 8 -36.037 -1.434 41.710 1.00 0.00 C ATOM 337 CE LYS B 8 -34.710 -2.172 41.993 1.00 0.00 C ATOM 338 NZ LYS B 8 -34.513 -2.165 43.483 1.00 0.00 N ATOM 0 H LYS B 8 -36.537 1.435 44.763 1.00 0.00 H new ATOM 0 HA LYS B 8 -38.899 1.542 42.998 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -37.970 0.246 41.240 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -37.156 1.792 41.378 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -35.348 0.467 40.935 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -35.329 0.365 42.685 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -36.791 -1.770 42.421 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -36.392 -1.706 40.716 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -34.748 -3.193 41.614 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -33.879 -1.677 41.492 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -33.610 -2.625 43.716 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -34.501 -1.184 43.827 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -35.292 -2.682 43.939 1.00 0.00 H new ATOM 352 N ARG B 9 -39.755 -0.420 44.226 1.00 0.00 N ATOM 353 CA ARG B 9 -40.255 -1.323 45.317 1.00 0.00 C ATOM 354 C ARG B 9 -41.412 -2.233 44.860 1.00 0.00 C ATOM 355 O ARG B 9 -42.490 -1.758 44.525 1.00 0.00 O ATOM 356 CB ARG B 9 -40.621 -0.557 46.615 1.00 0.00 C ATOM 357 CG ARG B 9 -39.404 0.151 47.237 1.00 0.00 C ATOM 358 CD ARG B 9 -39.443 0.326 48.771 1.00 0.00 C ATOM 359 NE ARG B 9 -38.311 1.159 49.295 1.00 0.00 N ATOM 360 CZ ARG B 9 -37.019 0.918 49.026 1.00 0.00 C ATOM 361 NH1 ARG B 9 -36.552 -0.245 48.677 1.00 0.00 N ATOM 362 NH2 ARG B 9 -36.167 1.880 49.054 1.00 0.00 N ATOM 0 H ARG B 9 -40.489 0.010 43.664 1.00 0.00 H new ATOM 0 HA ARG B 9 -39.413 -1.973 45.557 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -41.394 0.179 46.394 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -41.043 -1.254 47.339 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -38.507 -0.411 46.977 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -39.307 1.136 46.780 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -40.389 0.788 49.054 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -39.414 -0.656 49.244 1.00 0.00 H new ATOM 0 HE ARG B 9 -38.537 1.955 49.891 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -37.181 -1.043 48.594 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -35.556 -0.359 48.487 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -36.473 2.826 49.281 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -35.185 1.697 48.850 1.00 0.00 H new ATOM 376 N MET B 10 -41.157 -3.539 44.826 1.00 0.00 N ATOM 377 CA MET B 10 -41.482 -4.357 43.636 1.00 0.00 C ATOM 378 C MET B 10 -42.477 -5.536 43.887 1.00 0.00 C ATOM 379 O MET B 10 -42.143 -6.442 44.654 1.00 0.00 O ATOM 380 CB MET B 10 -40.089 -4.824 43.108 1.00 0.00 C ATOM 381 CG MET B 10 -40.022 -4.934 41.582 1.00 0.00 C ATOM 382 SD MET B 10 -40.872 -6.399 40.981 1.00 0.00 S ATOM 383 CE MET B 10 -42.088 -5.598 39.938 1.00 0.00 C ATOM 0 H MET B 10 -40.732 -4.059 45.594 1.00 0.00 H new ATOM 0 HA MET B 10 -42.038 -3.771 42.904 1.00 0.00 H new ATOM 0 HB2 MET B 10 -39.326 -4.123 43.448 1.00 0.00 H new ATOM 0 HB3 MET B 10 -39.849 -5.793 43.545 1.00 0.00 H new ATOM 0 HG2 MET B 10 -40.467 -4.046 41.134 1.00 0.00 H new ATOM 0 HG3 MET B 10 -38.980 -4.963 41.265 1.00 0.00 H new ATOM 0 HE1 MET B 10 -42.318 -6.240 39.088 1.00 0.00 H new ATOM 0 HE2 MET B 10 -42.997 -5.417 40.512 1.00 0.00 H new ATOM 0 HE3 MET B 10 -41.691 -4.649 39.579 1.00 0.00 H new ATOM 393 N SER B 11 -43.647 -5.588 43.202 1.00 0.00 N ATOM 394 CA SER B 11 -44.473 -6.846 43.119 1.00 0.00 C ATOM 395 C SER B 11 -45.232 -7.339 44.406 1.00 0.00 C ATOM 396 O SER B 11 -44.661 -7.480 45.488 1.00 0.00 O ATOM 397 CB SER B 11 -43.739 -8.009 42.414 1.00 0.00 C ATOM 398 OG SER B 11 -44.664 -9.003 41.966 1.00 0.00 O ATOM 0 H SER B 11 -44.046 -4.793 42.702 1.00 0.00 H new ATOM 0 HA SER B 11 -45.291 -6.496 42.489 1.00 0.00 H new ATOM 0 HB2 SER B 11 -43.173 -7.625 41.565 1.00 0.00 H new ATOM 0 HB3 SER B 11 -43.020 -8.459 43.099 1.00 0.00 H new ATOM 0 HG SER B 11 -44.186 -9.687 41.453 1.00 0.00 H new ATOM 404 N ARG B 12 -46.528 -7.684 44.271 1.00 0.00 N ATOM 405 CA ARG B 12 -47.226 -8.610 45.223 1.00 0.00 C ATOM 406 C ARG B 12 -47.888 -9.834 44.492 1.00 0.00 C ATOM 407 O ARG B 12 -47.616 -10.980 44.848 1.00 0.00 O ATOM 408 CB ARG B 12 -48.254 -7.848 46.111 1.00 0.00 C ATOM 409 CG ARG B 12 -47.803 -6.527 46.771 1.00 0.00 C ATOM 410 CD ARG B 12 -46.818 -6.620 47.957 1.00 0.00 C ATOM 411 NE ARG B 12 -46.297 -5.249 48.239 1.00 0.00 N ATOM 412 CZ ARG B 12 -46.840 -4.359 49.052 1.00 0.00 C ATOM 413 NH1 ARG B 12 -47.886 -4.570 49.790 1.00 0.00 N ATOM 414 NH2 ARG B 12 -46.344 -3.172 49.032 1.00 0.00 N ATOM 0 H ARG B 12 -47.123 -7.342 43.517 1.00 0.00 H new ATOM 0 HA ARG B 12 -46.459 -9.018 45.882 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -49.130 -7.633 45.499 1.00 0.00 H new ATOM 0 HB3 ARG B 12 -48.577 -8.524 46.903 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -47.344 -5.906 46.001 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -48.694 -6.002 47.115 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -47.319 -7.025 48.836 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -45.998 -7.297 47.718 1.00 0.00 H new ATOM 0 HE ARG B 12 -45.441 -4.973 47.759 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -48.351 -5.478 49.768 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -48.243 -3.828 50.392 1.00 0.00 H new ATOM 0 HH21 ARG B 12 -45.567 -2.954 48.408 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -46.728 -2.449 49.640 1.00 0.00 H new ATOM 428 N SER B 13 -48.774 -9.596 43.505 1.00 0.00 N ATOM 429 CA SER B 13 -49.457 -10.671 42.723 1.00 0.00 C ATOM 430 C SER B 13 -48.609 -11.432 41.643 1.00 0.00 C ATOM 431 O SER B 13 -48.738 -12.649 41.491 1.00 0.00 O ATOM 432 CB SER B 13 -50.716 -10.011 42.100 1.00 0.00 C ATOM 433 OG SER B 13 -50.384 -8.973 41.167 1.00 0.00 O ATOM 0 H SER B 13 -49.044 -8.655 43.219 1.00 0.00 H new ATOM 0 HA SER B 13 -49.685 -11.480 43.417 1.00 0.00 H new ATOM 0 HB2 SER B 13 -51.310 -10.773 41.596 1.00 0.00 H new ATOM 0 HB3 SER B 13 -51.337 -9.597 42.895 1.00 0.00 H new ATOM 0 HG SER B 13 -50.377 -8.108 41.628 1.00 0.00 H new ATOM 439 N SER B 14 -47.794 -10.719 40.847 1.00 0.00 N ATOM 440 CA SER B 14 -46.949 -11.308 39.761 1.00 0.00 C ATOM 441 C SER B 14 -45.745 -10.385 39.375 1.00 0.00 C ATOM 442 O SER B 14 -44.593 -10.819 39.410 1.00 0.00 O ATOM 443 CB SER B 14 -47.811 -11.679 38.523 1.00 0.00 C ATOM 444 OG SER B 14 -48.679 -12.778 38.804 1.00 0.00 O ATOM 0 H SER B 14 -47.693 -9.707 40.929 1.00 0.00 H new ATOM 0 HA SER B 14 -46.516 -12.228 40.154 1.00 0.00 H new ATOM 0 HB2 SER B 14 -48.402 -10.816 38.217 1.00 0.00 H new ATOM 0 HB3 SER B 14 -47.160 -11.932 37.687 1.00 0.00 H new ATOM 0 HG SER B 14 -48.577 -13.044 39.742 1.00 0.00 H new ATOM 450 N GLY B 15 -45.994 -9.112 39.019 1.00 0.00 N ATOM 451 CA GLY B 15 -44.909 -8.120 38.774 1.00 0.00 C ATOM 452 C GLY B 15 -45.428 -6.672 38.707 1.00 0.00 C ATOM 453 O GLY B 15 -45.423 -6.073 37.629 1.00 0.00 O ATOM 0 H GLY B 15 -46.934 -8.737 38.892 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -44.166 -8.198 39.567 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -44.404 -8.364 37.839 1.00 0.00 H new ATOM 457 N ARG B 16 -45.966 -6.155 39.824 1.00 0.00 N ATOM 458 CA ARG B 16 -46.609 -4.804 39.883 1.00 0.00 C ATOM 459 C ARG B 16 -46.476 -4.136 41.288 1.00 0.00 C ATOM 460 O ARG B 16 -46.501 -4.780 42.330 1.00 0.00 O ATOM 461 CB ARG B 16 -48.107 -4.810 39.465 1.00 0.00 C ATOM 462 CG ARG B 16 -48.421 -5.116 37.979 1.00 0.00 C ATOM 463 CD ARG B 16 -48.736 -6.606 37.770 1.00 0.00 C ATOM 464 NE ARG B 16 -49.366 -6.857 36.442 1.00 0.00 N ATOM 465 CZ ARG B 16 -48.718 -7.084 35.311 1.00 0.00 C ATOM 466 NH1 ARG B 16 -47.418 -7.052 35.207 1.00 0.00 N ATOM 467 NH2 ARG B 16 -49.421 -7.342 34.257 1.00 0.00 N ATOM 0 H ARG B 16 -45.975 -6.649 40.716 1.00 0.00 H new ATOM 0 HA ARG B 16 -46.055 -4.214 39.153 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -48.627 -5.545 40.079 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -48.530 -3.835 39.707 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -49.269 -4.514 37.653 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -47.571 -4.831 37.359 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -47.817 -7.187 37.852 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -49.403 -6.951 38.560 1.00 0.00 H new ATOM 0 HE ARG B 16 -50.385 -6.853 36.402 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -46.846 -6.843 36.025 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -46.974 -7.236 34.307 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -50.439 -7.365 34.316 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -48.958 -7.522 33.366 1.00 0.00 H new ATOM 481 N VAL B 17 -46.363 -2.810 41.307 1.00 0.00 N ATOM 482 CA VAL B 17 -45.517 -2.068 42.298 1.00 0.00 C ATOM 483 C VAL B 17 -44.008 -2.075 41.921 1.00 0.00 C ATOM 484 O VAL B 17 -43.508 -3.095 41.454 1.00 0.00 O ATOM 485 CB VAL B 17 -45.971 -2.015 43.800 1.00 0.00 C ATOM 486 CG1 VAL B 17 -45.497 -3.129 44.758 1.00 0.00 C ATOM 487 CG2 VAL B 17 -45.689 -0.659 44.492 1.00 0.00 C ATOM 0 H VAL B 17 -46.846 -2.201 40.646 1.00 0.00 H new ATOM 0 HA VAL B 17 -45.781 -1.017 42.178 1.00 0.00 H new ATOM 0 HB VAL B 17 -47.038 -2.180 43.648 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -45.897 -2.946 45.755 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -45.851 -4.095 44.397 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -44.408 -3.134 44.799 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -46.030 -0.700 45.526 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -44.618 -0.456 44.471 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -46.219 0.135 43.966 1.00 0.00 H new ATOM 497 N TYR B 18 -43.340 -0.899 41.928 1.00 0.00 N ATOM 498 CA TYR B 18 -42.011 -0.670 41.318 1.00 0.00 C ATOM 499 C TYR B 18 -41.368 0.758 41.546 1.00 0.00 C ATOM 500 O TYR B 18 -40.251 0.957 41.082 1.00 0.00 O ATOM 501 CB TYR B 18 -41.928 -1.166 39.836 1.00 0.00 C ATOM 502 CG TYR B 18 -43.121 -0.837 38.914 1.00 0.00 C ATOM 503 CD1 TYR B 18 -43.425 0.502 38.705 1.00 0.00 C ATOM 504 CD2 TYR B 18 -44.065 -1.814 38.581 1.00 0.00 C ATOM 505 CE1 TYR B 18 -44.680 0.883 38.256 1.00 0.00 C ATOM 506 CE2 TYR B 18 -45.331 -1.436 38.136 1.00 0.00 C ATOM 507 CZ TYR B 18 -45.640 -0.086 37.976 1.00 0.00 C ATOM 508 OH TYR B 18 -46.916 0.287 37.648 1.00 0.00 O ATOM 0 H TYR B 18 -43.720 -0.062 42.369 1.00 0.00 H new ATOM 0 HA TYR B 18 -41.355 -1.314 41.903 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -41.029 -0.743 39.388 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -41.799 -2.248 39.849 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -42.675 1.255 38.895 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -43.813 -2.861 38.669 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -44.913 1.929 38.124 1.00 0.00 H new ATOM 0 HE2 TYR B 18 -46.073 -2.189 37.915 1.00 0.00 H new ATOM 0 HH TYR B 18 -47.093 1.187 37.994 1.00 0.00 H new ATOM 518 N TYR B 19 -41.938 1.698 42.322 1.00 0.00 N ATOM 519 CA TYR B 19 -41.332 3.053 42.606 1.00 0.00 C ATOM 520 C TYR B 19 -41.600 3.546 44.082 1.00 0.00 C ATOM 521 O TYR B 19 -42.671 3.352 44.663 1.00 0.00 O ATOM 522 CB TYR B 19 -41.725 4.091 41.508 1.00 0.00 C ATOM 523 CG TYR B 19 -40.872 4.073 40.221 1.00 0.00 C ATOM 524 CD1 TYR B 19 -39.550 4.541 40.201 1.00 0.00 C ATOM 525 CD2 TYR B 19 -41.398 3.496 39.067 1.00 0.00 C ATOM 526 CE1 TYR B 19 -38.740 4.317 39.089 1.00 0.00 C ATOM 527 CE2 TYR B 19 -40.581 3.236 37.967 1.00 0.00 C ATOM 528 CZ TYR B 19 -39.249 3.642 37.984 1.00 0.00 C ATOM 529 OH TYR B 19 -38.450 3.418 36.897 1.00 0.00 O ATOM 0 H TYR B 19 -42.838 1.558 42.782 1.00 0.00 H new ATOM 0 HA TYR B 19 -40.249 2.947 42.549 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -42.766 3.922 41.232 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -41.669 5.089 41.943 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -39.157 5.078 41.052 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -42.448 3.248 39.024 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -37.718 4.667 39.085 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -40.980 2.722 37.105 1.00 0.00 H new ATOM 0 HH TYR B 19 -38.957 2.934 36.212 1.00 0.00 H new ATOM 539 N PHE B 20 -40.594 4.189 44.699 1.00 0.00 N ATOM 540 CA PHE B 20 -40.683 4.779 46.077 1.00 0.00 C ATOM 541 C PHE B 20 -39.874 6.119 46.205 1.00 0.00 C ATOM 542 O PHE B 20 -38.667 6.129 45.969 1.00 0.00 O ATOM 543 CB PHE B 20 -40.170 3.710 47.090 1.00 0.00 C ATOM 544 CG PHE B 20 -40.157 4.123 48.577 1.00 0.00 C ATOM 545 CD1 PHE B 20 -41.289 3.964 49.356 1.00 0.00 C ATOM 546 CD2 PHE B 20 -39.037 4.734 49.124 1.00 0.00 C ATOM 547 CE1 PHE B 20 -41.322 4.436 50.664 1.00 0.00 C ATOM 548 CE2 PHE B 20 -39.057 5.206 50.431 1.00 0.00 C ATOM 549 CZ PHE B 20 -40.196 5.057 51.263 1.00 0.00 C ATOM 0 H PHE B 20 -39.681 4.324 44.265 1.00 0.00 H new ATOM 0 HA PHE B 20 -41.720 5.037 46.291 1.00 0.00 H new ATOM 0 HB2 PHE B 20 -40.789 2.819 46.989 1.00 0.00 H new ATOM 0 HB3 PHE B 20 -39.156 3.428 46.805 1.00 0.00 H new ATOM 0 HD1 PHE B 20 -42.156 3.468 48.944 1.00 0.00 H new ATOM 0 HD2 PHE B 20 -38.142 4.844 48.529 1.00 0.00 H new ATOM 0 HE1 PHE B 20 -42.230 4.327 51.239 1.00 0.00 H new ATOM 0 HE2 PHE B 20 -38.181 5.700 50.824 1.00 0.00 H new ATOM 0 HZ PHE B 20 -40.205 5.395 52.289 1.00 0.00 H new ATOM 559 N ASN B 21 -40.481 7.230 46.657 1.00 0.00 N ATOM 560 CA ASN B 21 -39.732 8.487 46.967 1.00 0.00 C ATOM 561 C ASN B 21 -39.225 8.494 48.454 1.00 0.00 C ATOM 562 O ASN B 21 -40.022 8.357 49.383 1.00 0.00 O ATOM 563 CB ASN B 21 -40.647 9.707 46.653 1.00 0.00 C ATOM 564 CG ASN B 21 -40.000 11.061 46.321 1.00 0.00 C ATOM 565 OD1 ASN B 21 -40.502 11.818 45.502 1.00 0.00 O ATOM 566 ND2 ASN B 21 -38.905 11.463 46.917 1.00 0.00 N ATOM 0 H ASN B 21 -41.486 7.296 46.820 1.00 0.00 H new ATOM 0 HA ASN B 21 -38.841 8.548 46.342 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -41.284 9.432 45.812 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -41.301 9.857 47.512 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -38.506 12.374 46.691 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -38.451 10.865 47.607 1.00 0.00 H new ATOM 573 N HIS B 22 -37.917 8.699 48.684 1.00 0.00 N ATOM 574 CA HIS B 22 -37.334 8.830 50.059 1.00 0.00 C ATOM 575 C HIS B 22 -37.548 10.213 50.762 1.00 0.00 C ATOM 576 O HIS B 22 -37.977 10.238 51.915 1.00 0.00 O ATOM 577 CB HIS B 22 -35.820 8.467 50.006 1.00 0.00 C ATOM 578 CG HIS B 22 -35.510 6.979 49.968 1.00 0.00 C ATOM 579 ND1 HIS B 22 -35.125 6.264 51.081 1.00 0.00 N ATOM 580 CD2 HIS B 22 -35.539 6.140 48.845 1.00 0.00 C ATOM 581 CE1 HIS B 22 -34.928 5.034 50.522 1.00 0.00 C ATOM 582 NE2 HIS B 22 -35.182 4.844 49.189 1.00 0.00 N ATOM 0 H HIS B 22 -37.226 8.780 47.938 1.00 0.00 H new ATOM 0 HA HIS B 22 -37.889 8.130 50.684 1.00 0.00 H new ATOM 0 HB2 HIS B 22 -35.382 8.935 49.125 1.00 0.00 H new ATOM 0 HB3 HIS B 22 -35.328 8.902 50.876 1.00 0.00 H new ATOM 0 HD1 HIS B 22 -35.018 6.568 52.049 1.00 0.00 H new ATOM 0 HD2 HIS B 22 -35.803 6.459 47.848 1.00 0.00 H new ATOM 0 HE1 HIS B 22 -34.573 4.214 51.128 1.00 0.00 H new ATOM 590 N ILE B 23 -37.227 11.346 50.107 1.00 0.00 N ATOM 591 CA ILE B 23 -37.303 12.714 50.735 1.00 0.00 C ATOM 592 C ILE B 23 -38.768 13.166 51.099 1.00 0.00 C ATOM 593 O ILE B 23 -39.013 13.633 52.212 1.00 0.00 O ATOM 594 CB ILE B 23 -36.512 13.769 49.870 1.00 0.00 C ATOM 595 CG1 ILE B 23 -35.076 13.361 49.411 1.00 0.00 C ATOM 596 CG2 ILE B 23 -36.433 15.168 50.537 1.00 0.00 C ATOM 597 CD1 ILE B 23 -34.083 12.952 50.517 1.00 0.00 C ATOM 0 H ILE B 23 -36.909 11.358 49.138 1.00 0.00 H new ATOM 0 HA ILE B 23 -36.805 12.651 51.703 1.00 0.00 H new ATOM 0 HB ILE B 23 -37.128 13.807 48.971 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -35.166 12.530 48.711 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -34.645 14.197 48.860 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -35.876 15.848 49.892 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -37.440 15.556 50.690 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -35.927 15.085 51.499 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -33.125 12.692 50.068 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -33.946 13.783 51.209 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -34.475 12.091 51.058 1.00 0.00 H new ATOM 609 N THR B 24 -39.736 12.996 50.185 1.00 0.00 N ATOM 610 CA THR B 24 -41.194 13.015 50.520 1.00 0.00 C ATOM 611 C THR B 24 -41.694 11.887 51.503 1.00 0.00 C ATOM 612 O THR B 24 -42.541 12.160 52.353 1.00 0.00 O ATOM 613 CB THR B 24 -41.955 12.987 49.152 1.00 0.00 C ATOM 614 OG1 THR B 24 -41.686 14.162 48.394 1.00 0.00 O ATOM 615 CG2 THR B 24 -43.482 12.902 49.244 1.00 0.00 C ATOM 0 H THR B 24 -39.546 12.841 49.195 1.00 0.00 H new ATOM 0 HA THR B 24 -41.402 13.918 51.095 1.00 0.00 H new ATOM 0 HB THR B 24 -41.582 12.074 48.687 1.00 0.00 H new ATOM 0 HG1 THR B 24 -42.171 14.121 47.543 1.00 0.00 H new ATOM 0 HG21 THR B 24 -43.907 12.889 48.240 1.00 0.00 H new ATOM 0 HG22 THR B 24 -43.765 11.990 49.770 1.00 0.00 H new ATOM 0 HG23 THR B 24 -43.862 13.767 49.788 1.00 0.00 H new ATOM 623 N ASN B 25 -41.250 10.633 51.308 1.00 0.00 N ATOM 624 CA ASN B 25 -41.852 9.398 51.887 1.00 0.00 C ATOM 625 C ASN B 25 -43.178 8.975 51.159 1.00 0.00 C ATOM 626 O ASN B 25 -44.282 9.168 51.672 1.00 0.00 O ATOM 627 CB ASN B 25 -41.745 9.244 53.441 1.00 0.00 C ATOM 628 CG ASN B 25 -42.623 10.006 54.444 1.00 0.00 C ATOM 629 OD1 ASN B 25 -42.202 10.330 55.549 1.00 0.00 O ATOM 630 ND2 ASN B 25 -43.889 10.229 54.220 1.00 0.00 N ATOM 0 H ASN B 25 -40.436 10.434 50.726 1.00 0.00 H new ATOM 0 HA ASN B 25 -41.186 8.573 51.635 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -41.892 8.185 53.652 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -40.713 9.481 53.699 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -44.469 10.651 54.945 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -44.299 9.981 53.319 1.00 0.00 H new ATOM 637 N ALA B 26 -43.068 8.411 49.945 1.00 0.00 N ATOM 638 CA ALA B 26 -44.242 8.036 49.113 1.00 0.00 C ATOM 639 C ALA B 26 -43.999 6.690 48.367 1.00 0.00 C ATOM 640 O ALA B 26 -43.211 6.618 47.419 1.00 0.00 O ATOM 641 CB ALA B 26 -44.536 9.200 48.143 1.00 0.00 C ATOM 0 H ALA B 26 -42.171 8.200 49.507 1.00 0.00 H new ATOM 0 HA ALA B 26 -45.114 7.872 49.746 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -45.395 8.947 47.521 1.00 0.00 H new ATOM 0 HB2 ALA B 26 -44.754 10.103 48.714 1.00 0.00 H new ATOM 0 HB3 ALA B 26 -43.667 9.373 47.508 1.00 0.00 H new ATOM 647 N SER B 27 -44.702 5.626 48.776 1.00 0.00 N ATOM 648 CA SER B 27 -44.796 4.371 47.983 1.00 0.00 C ATOM 649 C SER B 27 -45.871 4.445 46.862 1.00 0.00 C ATOM 650 O SER B 27 -47.037 4.775 47.104 1.00 0.00 O ATOM 651 CB SER B 27 -45.077 3.206 48.949 1.00 0.00 C ATOM 652 OG SER B 27 -46.285 3.391 49.693 1.00 0.00 O ATOM 0 H SER B 27 -45.220 5.599 49.654 1.00 0.00 H new ATOM 0 HA SER B 27 -43.848 4.214 47.469 1.00 0.00 H new ATOM 0 HB2 SER B 27 -45.141 2.276 48.383 1.00 0.00 H new ATOM 0 HB3 SER B 27 -44.241 3.101 49.640 1.00 0.00 H new ATOM 0 HG SER B 27 -47.052 3.126 49.143 1.00 0.00 H new ATOM 658 N GLN B 28 -45.454 4.148 45.625 1.00 0.00 N ATOM 659 CA GLN B 28 -46.355 4.215 44.445 1.00 0.00 C ATOM 660 C GLN B 28 -46.069 3.149 43.336 1.00 0.00 C ATOM 661 O GLN B 28 -45.045 2.464 43.292 1.00 0.00 O ATOM 662 CB GLN B 28 -46.481 5.682 43.933 1.00 0.00 C ATOM 663 CG GLN B 28 -45.323 6.188 43.042 1.00 0.00 C ATOM 664 CD GLN B 28 -45.575 7.580 42.452 1.00 0.00 C ATOM 665 OE1 GLN B 28 -46.173 7.587 41.287 1.00 0.00 O flip ATOM 666 NE2 GLN B 28 -45.285 8.619 43.031 1.00 0.00 N flip ATOM 0 H GLN B 28 -44.501 3.858 45.405 1.00 0.00 H new ATOM 0 HA GLN B 28 -47.346 3.915 44.785 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -47.411 5.772 43.372 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -46.564 6.342 44.797 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -44.405 6.211 43.630 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -45.163 5.480 42.229 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -44.819 8.585 43.938 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -45.509 9.519 42.607 1.00 0.00 H new ATOM 675 N TRP B 29 -47.008 3.086 42.386 1.00 0.00 N ATOM 676 CA TRP B 29 -46.800 2.366 41.087 1.00 0.00 C ATOM 677 C TRP B 29 -46.822 3.257 39.792 1.00 0.00 C ATOM 678 O TRP B 29 -47.305 2.850 38.732 1.00 0.00 O ATOM 679 CB TRP B 29 -47.654 1.071 41.076 1.00 0.00 C ATOM 680 CG TRP B 29 -49.189 1.093 40.971 1.00 0.00 C ATOM 681 CD1 TRP B 29 -50.068 1.826 41.799 1.00 0.00 C ATOM 682 CD2 TRP B 29 -49.985 0.134 40.358 1.00 0.00 C ATOM 683 NE1 TRP B 29 -51.384 1.337 41.736 1.00 0.00 N ATOM 684 CE2 TRP B 29 -51.310 0.292 40.839 1.00 0.00 C ATOM 685 CE3 TRP B 29 -49.656 -0.973 39.528 1.00 0.00 C ATOM 686 CZ2 TRP B 29 -52.301 -0.664 40.523 1.00 0.00 C ATOM 687 CZ3 TRP B 29 -50.663 -1.883 39.201 1.00 0.00 C ATOM 688 CH2 TRP B 29 -51.962 -1.738 39.700 1.00 0.00 C ATOM 0 H TRP B 29 -47.927 3.520 42.475 1.00 0.00 H new ATOM 0 HA TRP B 29 -45.758 2.052 41.035 1.00 0.00 H new ATOM 0 HB2 TRP B 29 -47.293 0.467 40.244 1.00 0.00 H new ATOM 0 HB3 TRP B 29 -47.412 0.530 41.991 1.00 0.00 H new ATOM 0 HD1 TRP B 29 -49.764 2.664 42.409 1.00 0.00 H new ATOM 0 HE1 TRP B 29 -52.205 1.677 42.238 1.00 0.00 H new ATOM 0 HE3 TRP B 29 -48.650 -1.107 39.159 1.00 0.00 H new ATOM 0 HZ2 TRP B 29 -53.304 -0.565 40.912 1.00 0.00 H new ATOM 0 HZ3 TRP B 29 -50.435 -2.715 38.551 1.00 0.00 H new ATOM 0 HH2 TRP B 29 -52.714 -2.469 39.444 1.00 0.00 H new ATOM 699 N GLU B 30 -46.155 4.421 39.870 1.00 0.00 N ATOM 700 CA GLU B 30 -45.729 5.238 38.706 1.00 0.00 C ATOM 701 C GLU B 30 -44.302 5.812 38.936 1.00 0.00 C ATOM 702 O GLU B 30 -43.810 5.969 40.059 1.00 0.00 O ATOM 703 CB GLU B 30 -46.754 6.395 38.460 1.00 0.00 C ATOM 704 CG GLU B 30 -47.234 6.581 37.019 1.00 0.00 C ATOM 705 CD GLU B 30 -46.279 7.151 35.978 1.00 0.00 C ATOM 706 OE1 GLU B 30 -45.298 6.486 35.587 1.00 0.00 O ATOM 707 OE2 GLU B 30 -46.509 8.282 35.517 1.00 0.00 O ATOM 0 H GLU B 30 -45.888 4.835 40.763 1.00 0.00 H new ATOM 0 HA GLU B 30 -45.701 4.601 37.822 1.00 0.00 H new ATOM 0 HB2 GLU B 30 -47.625 6.220 39.091 1.00 0.00 H new ATOM 0 HB3 GLU B 30 -46.302 7.329 38.793 1.00 0.00 H new ATOM 0 HG2 GLU B 30 -47.568 5.608 36.658 1.00 0.00 H new ATOM 0 HG3 GLU B 30 -48.110 7.229 37.048 1.00 0.00 H new ATOM 714 N ARG B 31 -43.666 6.187 37.830 1.00 0.00 N ATOM 715 CA ARG B 31 -42.446 7.012 37.849 1.00 0.00 C ATOM 716 C ARG B 31 -42.762 8.559 37.785 1.00 0.00 C ATOM 717 O ARG B 31 -43.641 8.967 37.022 1.00 0.00 O ATOM 718 CB ARG B 31 -41.466 6.385 36.809 1.00 0.00 C ATOM 719 CG ARG B 31 -40.729 7.279 35.785 1.00 0.00 C ATOM 720 CD ARG B 31 -41.328 7.271 34.361 1.00 0.00 C ATOM 721 NE ARG B 31 -42.762 7.700 34.350 1.00 0.00 N ATOM 722 CZ ARG B 31 -43.385 8.350 33.381 1.00 0.00 C ATOM 723 NH1 ARG B 31 -42.806 8.744 32.284 1.00 0.00 N ATOM 724 NH2 ARG B 31 -44.637 8.616 33.529 1.00 0.00 N ATOM 0 H ARG B 31 -43.976 5.932 36.892 1.00 0.00 H new ATOM 0 HA ARG B 31 -41.916 6.989 38.801 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -40.704 5.844 37.371 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -42.030 5.644 36.242 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -40.726 8.304 36.156 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -39.689 6.958 35.727 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -40.747 7.934 33.720 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -41.247 6.269 33.940 1.00 0.00 H new ATOM 0 HE ARG B 31 -43.316 7.467 35.174 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -41.815 8.555 32.134 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -43.343 9.242 31.574 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -45.123 8.326 34.378 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -45.142 9.116 32.797 1.00 0.00 H new ATOM 738 N PRO B 32 -42.021 9.467 38.492 1.00 0.00 N ATOM 739 CA PRO B 32 -42.230 10.958 38.411 1.00 0.00 C ATOM 740 C PRO B 32 -42.061 11.685 37.016 1.00 0.00 C ATOM 741 O PRO B 32 -42.212 12.907 36.941 1.00 0.00 O ATOM 742 CB PRO B 32 -41.161 11.497 39.409 1.00 0.00 C ATOM 743 CG PRO B 32 -40.173 10.359 39.528 1.00 0.00 C ATOM 744 CD PRO B 32 -40.927 9.065 39.380 1.00 0.00 C ATOM 0 HA PRO B 32 -43.279 11.165 38.622 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -40.685 12.403 39.034 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -41.603 11.745 40.374 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -39.404 10.441 38.760 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -39.666 10.395 40.492 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -40.311 8.279 38.943 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -41.291 8.690 40.337 1.00 0.00 H new ATOM 752 N SER B 33 -41.694 10.962 35.938 1.00 0.00 N ATOM 753 CA SER B 33 -41.446 11.515 34.570 1.00 0.00 C ATOM 754 C SER B 33 -40.129 12.348 34.384 1.00 0.00 C ATOM 755 O SER B 33 -39.240 11.951 33.618 1.00 0.00 O ATOM 756 CB SER B 33 -42.722 12.152 33.957 1.00 0.00 C ATOM 757 OG SER B 33 -42.590 12.322 32.543 1.00 0.00 O ATOM 0 H SER B 33 -41.556 9.952 35.985 1.00 0.00 H new ATOM 0 HA SER B 33 -41.219 10.642 33.958 1.00 0.00 H new ATOM 0 HB2 SER B 33 -43.585 11.521 34.171 1.00 0.00 H new ATOM 0 HB3 SER B 33 -42.910 13.118 34.426 1.00 0.00 H new ATOM 0 HG SER B 33 -43.409 12.723 32.184 1.00 0.00 H new ATOM 763 N GLY B 34 -40.007 13.505 35.054 1.00 0.00 N ATOM 764 CA GLY B 34 -38.817 14.401 34.952 1.00 0.00 C ATOM 765 C GLY B 34 -38.777 15.376 33.751 1.00 0.00 C ATOM 766 O GLY B 34 -37.859 15.306 32.932 1.00 0.00 O ATOM 0 H GLY B 34 -40.726 13.857 35.686 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -38.755 14.988 35.868 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -37.924 13.777 34.912 1.00 0.00 H new ATOM 770 N ASN B 35 -39.756 16.284 33.665 1.00 0.00 N ATOM 771 CA ASN B 35 -39.806 17.358 32.630 1.00 0.00 C ATOM 772 C ASN B 35 -40.348 18.674 33.279 1.00 0.00 C ATOM 773 O ASN B 35 -41.512 18.738 33.686 1.00 0.00 O ATOM 774 CB ASN B 35 -40.706 16.922 31.434 1.00 0.00 C ATOM 775 CG ASN B 35 -40.022 16.038 30.391 1.00 0.00 C ATOM 776 OD1 ASN B 35 -39.871 14.832 30.546 1.00 0.00 O ATOM 777 ND2 ASN B 35 -39.584 16.593 29.291 1.00 0.00 N ATOM 0 H ASN B 35 -40.547 16.306 34.309 1.00 0.00 H new ATOM 0 HA ASN B 35 -38.802 17.536 32.245 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -41.571 16.389 31.827 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -41.082 17.817 30.938 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -39.126 16.023 28.580 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -39.701 17.596 29.144 1.00 0.00 H new ATOM 784 N SER B 36 -39.532 19.739 33.340 1.00 0.00 N ATOM 785 CA SER B 36 -39.973 21.066 33.867 1.00 0.00 C ATOM 786 C SER B 36 -40.711 21.952 32.811 1.00 0.00 C ATOM 787 O SER B 36 -40.153 22.892 32.235 1.00 0.00 O ATOM 788 CB SER B 36 -38.733 21.748 34.498 1.00 0.00 C ATOM 789 OG SER B 36 -37.766 22.122 33.512 1.00 0.00 O ATOM 0 H SER B 36 -38.559 19.719 33.033 1.00 0.00 H new ATOM 0 HA SER B 36 -40.738 20.920 34.629 1.00 0.00 H new ATOM 0 HB2 SER B 36 -39.048 22.633 35.050 1.00 0.00 H new ATOM 0 HB3 SER B 36 -38.273 21.070 35.217 1.00 0.00 H new ATOM 0 HG SER B 36 -38.220 22.539 32.750 1.00 0.00 H new ATOM 795 N SER B 37 -41.992 21.648 32.571 1.00 0.00 N ATOM 796 CA SER B 37 -42.937 22.556 31.873 1.00 0.00 C ATOM 797 C SER B 37 -44.382 22.248 32.372 1.00 0.00 C ATOM 798 O SER B 37 -44.937 21.164 32.172 1.00 0.00 O ATOM 799 CB SER B 37 -42.862 22.426 30.343 1.00 0.00 C ATOM 800 OG SER B 37 -41.544 22.661 29.841 1.00 0.00 O ATOM 0 H SER B 37 -42.413 20.763 32.853 1.00 0.00 H new ATOM 0 HA SER B 37 -42.659 23.583 32.109 1.00 0.00 H new ATOM 0 HB2 SER B 37 -43.187 21.428 30.049 1.00 0.00 H new ATOM 0 HB3 SER B 37 -43.554 23.134 29.886 1.00 0.00 H new ATOM 0 HG SER B 37 -40.952 22.909 30.581 1.00 0.00 H new ATOM 806 N SER B 38 -44.960 23.238 33.039 1.00 0.00 N ATOM 807 CA SER B 38 -46.351 23.189 33.568 1.00 0.00 C ATOM 808 C SER B 38 -46.959 24.626 33.560 1.00 0.00 C ATOM 809 O SER B 38 -46.636 25.442 34.434 1.00 0.00 O ATOM 810 CB SER B 38 -46.363 22.545 34.982 1.00 0.00 C ATOM 811 OG SER B 38 -45.697 23.362 35.951 1.00 0.00 O ATOM 0 H SER B 38 -44.484 24.118 33.240 1.00 0.00 H new ATOM 0 HA SER B 38 -46.974 22.563 32.930 1.00 0.00 H new ATOM 0 HB2 SER B 38 -47.394 22.379 35.295 1.00 0.00 H new ATOM 0 HB3 SER B 38 -45.881 21.568 34.939 1.00 0.00 H new ATOM 0 HG SER B 38 -45.764 24.303 35.686 1.00 0.00 H new ATOM 817 N GLY B 39 -47.802 24.936 32.570 1.00 0.00 N ATOM 818 CA GLY B 39 -48.420 26.275 32.432 1.00 0.00 C ATOM 819 C GLY B 39 -49.609 26.244 31.473 1.00 0.00 C ATOM 820 O GLY B 39 -49.392 26.171 30.243 1.00 0.00 O ATOM 821 OXT GLY B 39 -50.766 26.302 31.943 1.00 0.00 O ATOM 0 H GLY B 39 -48.079 24.277 31.842 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -48.748 26.628 33.409 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -47.677 26.985 32.069 1.00 0.00 H new TER 825 GLY B 39