USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 804 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: B 30 LYS NZ :NH3+ -136:sc= -1.09 (180deg=-3.01!) USER MOD Set 2.2: B 31 TYR OH : rot 157:sc= -0.728 USER MOD Set 3.1: B 1 MET CE :methyl 166:sc= -0.322 (180deg=-0.74) USER MOD Set 3.2: B 85 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 98 C O2' : rot -91:sc= 1.15 USER MOD Set 4.2: B 80 LYS NZ :NH3+ 179:sc= 0.102 (180deg=0.101) USER MOD Single : A 96 A O2' : rot -24:sc= 0.35 USER MOD Single : A 96 A O5' : rot -34:sc= 0.00647 USER MOD Single : A 97 U O2' : rot 15:sc= 0.283 USER MOD Single : A 99 A O2' : rot -40:sc= 1.23 USER MOD Single : A 100 A O2' : rot 180:sc= 0 USER MOD Single : A 101 A O2' : rot 150:sc= 0.786 USER MOD Single : A 101 A O3' : rot 133:sc= 0.177 USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 156:sc= 1.47 (180deg=0.823) USER MOD Single : B 16 ASN : amide:sc= -3.16! X(o=-3.2!,f=-3.1) USER MOD Single : B 17 THR OG1 : rot 79:sc= 1.31 USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0414) USER MOD Single : B 40 MET CE :methyl -130:sc= -0.205 (180deg=-2.56!) USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.0549 USER MOD Single : B 47 LYS NZ :NH3+ -164:sc=-0.00452 (180deg=-0.237) USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 58 SER OG : rot 180:sc= -0.0776 USER MOD Single : B 63 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0851) USER MOD Single : B 69 MET CE :methyl -141:sc= -1.47 (180deg=-3.17!) USER MOD Single : B 70 ASN : amide:sc= 0.262 K(o=0.26,f=-3.8!) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 SER OG : rot 180:sc= -0.0106 USER MOD Single : B 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 GLN : amide:sc= 0.142 K(o=0.14,f=-0.81) USER MOD Single : B 86 LYS NZ :NH3+ 166:sc= 1.73 (180deg=1.46) USER MOD Single : B 88 SER OG : rot -29:sc= 0.196 USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET B 1 0.243 5.430 -0.853 1.00 0.00 N ATOM 2 CA MET B 1 0.738 4.412 -1.801 1.00 0.00 C ATOM 3 C MET B 1 -0.394 3.468 -2.197 1.00 0.00 C ATOM 4 O MET B 1 -0.784 2.577 -1.444 1.00 0.00 O ATOM 5 CB MET B 1 1.931 3.656 -1.199 1.00 0.00 C ATOM 6 CG MET B 1 2.635 2.777 -2.236 1.00 0.00 C ATOM 7 SD MET B 1 1.711 1.312 -2.763 1.00 0.00 S ATOM 8 CE MET B 1 2.889 0.635 -3.958 1.00 0.00 C ATOM 0 H1 MET B 1 1.022 6.067 -0.590 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.518 5.980 -1.300 1.00 0.00 H new ATOM 0 H3 MET B 1 -0.124 4.961 -0.000 1.00 0.00 H new ATOM 0 HA MET B 1 1.089 4.905 -2.707 1.00 0.00 H new ATOM 0 HB2 MET B 1 2.643 4.371 -0.787 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.587 3.036 -0.371 1.00 0.00 H new ATOM 0 HG2 MET B 1 2.853 3.384 -3.115 1.00 0.00 H new ATOM 0 HG3 MET B 1 3.592 2.455 -1.825 1.00 0.00 H new ATOM 0 HE1 MET B 1 2.610 -0.390 -4.203 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.877 1.241 -4.864 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.890 0.646 -3.528 1.00 0.00 H new ATOM 20 N VAL B 2 -0.908 3.690 -3.405 1.00 0.00 N ATOM 21 CA VAL B 2 -1.888 2.861 -4.092 1.00 0.00 C ATOM 22 C VAL B 2 -1.505 2.845 -5.574 1.00 0.00 C ATOM 23 O VAL B 2 -2.261 2.453 -6.458 1.00 0.00 O ATOM 24 CB VAL B 2 -3.286 3.441 -3.836 1.00 0.00 C ATOM 25 CG1 VAL B 2 -3.350 4.923 -4.215 1.00 0.00 C ATOM 26 CG2 VAL B 2 -4.346 2.707 -4.645 1.00 0.00 C ATOM 0 H VAL B 2 -0.634 4.501 -3.960 1.00 0.00 H new ATOM 0 HA VAL B 2 -1.902 1.833 -3.730 1.00 0.00 H new ATOM 0 HB VAL B 2 -3.480 3.319 -2.770 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -4.353 5.305 -4.022 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -2.628 5.482 -3.620 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -3.115 5.038 -5.273 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -5.325 3.142 -4.441 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -4.122 2.800 -5.708 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -4.352 1.653 -4.366 1.00 0.00 H new ATOM 36 N GLU B 3 -0.285 3.298 -5.835 1.00 0.00 N ATOM 37 CA GLU B 3 0.180 3.609 -7.164 1.00 0.00 C ATOM 38 C GLU B 3 0.610 2.388 -7.957 1.00 0.00 C ATOM 39 O GLU B 3 1.240 1.466 -7.447 1.00 0.00 O ATOM 40 CB GLU B 3 1.306 4.631 -7.044 1.00 0.00 C ATOM 41 CG GLU B 3 0.759 5.947 -6.497 1.00 0.00 C ATOM 42 CD GLU B 3 1.859 7.001 -6.431 1.00 0.00 C ATOM 43 OE1 GLU B 3 2.217 7.527 -7.509 1.00 0.00 O ATOM 44 OE2 GLU B 3 2.334 7.270 -5.307 1.00 0.00 O ATOM 0 H GLU B 3 0.415 3.459 -5.110 1.00 0.00 H new ATOM 0 HA GLU B 3 -0.652 4.025 -7.733 1.00 0.00 H new ATOM 0 HB2 GLU B 3 2.086 4.250 -6.385 1.00 0.00 H new ATOM 0 HB3 GLU B 3 1.765 4.795 -8.019 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -0.053 6.301 -7.132 1.00 0.00 H new ATOM 0 HG3 GLU B 3 0.341 5.788 -5.503 1.00 0.00 H new ATOM 51 N ALA B 4 0.241 2.426 -9.235 1.00 0.00 N ATOM 52 CA ALA B 4 0.575 1.416 -10.209 1.00 0.00 C ATOM 53 C ALA B 4 1.115 2.149 -11.431 1.00 0.00 C ATOM 54 O ALA B 4 0.390 2.877 -12.106 1.00 0.00 O ATOM 55 CB ALA B 4 -0.677 0.595 -10.497 1.00 0.00 C ATOM 0 H ALA B 4 -0.315 3.188 -9.623 1.00 0.00 H new ATOM 0 HA ALA B 4 1.336 0.716 -9.865 1.00 0.00 H new ATOM 0 HB1 ALA B 4 -0.446 -0.176 -11.232 1.00 0.00 H new ATOM 0 HB2 ALA B 4 -1.024 0.126 -9.576 1.00 0.00 H new ATOM 0 HB3 ALA B 4 -1.458 1.247 -10.888 1.00 0.00 H new ATOM 61 N ASP B 5 2.404 1.942 -11.691 1.00 0.00 N ATOM 62 CA ASP B 5 3.165 2.645 -12.712 1.00 0.00 C ATOM 63 C ASP B 5 2.827 2.199 -14.137 1.00 0.00 C ATOM 64 O ASP B 5 3.695 1.709 -14.861 1.00 0.00 O ATOM 65 CB ASP B 5 4.653 2.500 -12.389 1.00 0.00 C ATOM 66 CG ASP B 5 5.553 3.271 -13.353 1.00 0.00 C ATOM 67 OD1 ASP B 5 5.085 4.295 -13.898 1.00 0.00 O ATOM 68 OD2 ASP B 5 6.709 2.826 -13.536 1.00 0.00 O ATOM 0 H ASP B 5 2.962 1.258 -11.179 1.00 0.00 H new ATOM 0 HA ASP B 5 2.888 3.699 -12.691 1.00 0.00 H new ATOM 0 HB2 ASP B 5 4.834 2.851 -11.373 1.00 0.00 H new ATOM 0 HB3 ASP B 5 4.923 1.444 -12.415 1.00 0.00 H new ATOM 73 N ARG B 6 1.557 2.380 -14.523 1.00 0.00 N ATOM 74 CA ARG B 6 1.023 2.160 -15.864 1.00 0.00 C ATOM 75 C ARG B 6 1.164 0.721 -16.374 1.00 0.00 C ATOM 76 O ARG B 6 2.051 -0.017 -15.947 1.00 0.00 O ATOM 77 CB ARG B 6 1.668 3.165 -16.822 1.00 0.00 C ATOM 78 CG ARG B 6 1.318 4.604 -16.435 1.00 0.00 C ATOM 79 CD ARG B 6 2.327 5.577 -17.038 1.00 0.00 C ATOM 80 NE ARG B 6 3.641 5.410 -16.402 1.00 0.00 N ATOM 81 CZ ARG B 6 4.766 5.999 -16.806 1.00 0.00 C ATOM 82 NH1 ARG B 6 4.778 6.817 -17.854 1.00 0.00 N ATOM 83 NH2 ARG B 6 5.894 5.764 -16.143 1.00 0.00 N ATOM 0 H ARG B 6 0.841 2.701 -13.871 1.00 0.00 H new ATOM 0 HA ARG B 6 -0.054 2.321 -15.815 1.00 0.00 H new ATOM 0 HB2 ARG B 6 2.750 3.037 -16.813 1.00 0.00 H new ATOM 0 HB3 ARG B 6 1.332 2.968 -17.840 1.00 0.00 H new ATOM 0 HG2 ARG B 6 0.315 4.848 -16.784 1.00 0.00 H new ATOM 0 HG3 ARG B 6 1.311 4.704 -15.350 1.00 0.00 H new ATOM 0 HD2 ARG B 6 2.411 5.406 -18.111 1.00 0.00 H new ATOM 0 HD3 ARG B 6 1.979 6.601 -16.905 1.00 0.00 H new ATOM 0 HE ARG B 6 3.696 4.796 -15.589 1.00 0.00 H new ATOM 0 HH11 ARG B 6 3.915 7.004 -18.365 1.00 0.00 H new ATOM 0 HH12 ARG B 6 5.650 7.258 -18.147 1.00 0.00 H new ATOM 0 HH21 ARG B 6 5.891 5.140 -15.336 1.00 0.00 H new ATOM 0 HH22 ARG B 6 6.763 6.208 -16.441 1.00 0.00 H new ATOM 97 N PRO B 7 0.287 0.308 -17.298 1.00 0.00 N ATOM 98 CA PRO B 7 0.341 -0.996 -17.933 1.00 0.00 C ATOM 99 C PRO B 7 1.697 -1.282 -18.573 1.00 0.00 C ATOM 100 O PRO B 7 2.372 -0.367 -19.042 1.00 0.00 O ATOM 101 CB PRO B 7 -0.720 -0.938 -19.031 1.00 0.00 C ATOM 102 CG PRO B 7 -1.741 0.056 -18.505 1.00 0.00 C ATOM 103 CD PRO B 7 -0.847 1.070 -17.797 1.00 0.00 C ATOM 0 HA PRO B 7 0.176 -1.783 -17.197 1.00 0.00 H new ATOM 0 HB2 PRO B 7 -0.295 -0.609 -19.979 1.00 0.00 H new ATOM 0 HB3 PRO B 7 -1.168 -1.916 -19.205 1.00 0.00 H new ATOM 0 HG2 PRO B 7 -2.321 0.511 -19.308 1.00 0.00 H new ATOM 0 HG3 PRO B 7 -2.452 -0.410 -17.823 1.00 0.00 H new ATOM 0 HD2 PRO B 7 -0.522 1.853 -18.483 1.00 0.00 H new ATOM 0 HD3 PRO B 7 -1.379 1.561 -16.982 1.00 0.00 H new ATOM 111 N GLY B 8 2.092 -2.558 -18.595 1.00 0.00 N ATOM 112 CA GLY B 8 3.251 -3.005 -19.348 1.00 0.00 C ATOM 113 C GLY B 8 4.409 -3.364 -18.436 1.00 0.00 C ATOM 114 O GLY B 8 5.314 -4.071 -18.867 1.00 0.00 O ATOM 0 H GLY B 8 1.613 -3.304 -18.090 1.00 0.00 H new ATOM 0 HA2 GLY B 8 2.981 -3.872 -19.951 1.00 0.00 H new ATOM 0 HA3 GLY B 8 3.561 -2.220 -20.038 1.00 0.00 H new ATOM 118 N LYS B 9 4.391 -2.894 -17.184 1.00 0.00 N ATOM 119 CA LYS B 9 5.447 -3.230 -16.250 1.00 0.00 C ATOM 120 C LYS B 9 4.966 -4.353 -15.348 1.00 0.00 C ATOM 121 O LYS B 9 3.891 -4.269 -14.758 1.00 0.00 O ATOM 122 CB LYS B 9 5.901 -2.011 -15.448 1.00 0.00 C ATOM 123 CG LYS B 9 7.054 -2.441 -14.535 1.00 0.00 C ATOM 124 CD LYS B 9 7.560 -1.295 -13.666 1.00 0.00 C ATOM 125 CE LYS B 9 8.267 -0.247 -14.524 1.00 0.00 C ATOM 126 NZ LYS B 9 8.726 0.891 -13.705 1.00 0.00 N ATOM 0 H LYS B 9 3.662 -2.288 -16.807 1.00 0.00 H new ATOM 0 HA LYS B 9 6.322 -3.569 -16.805 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.224 -1.214 -16.118 1.00 0.00 H new ATOM 0 HB3 LYS B 9 5.075 -1.616 -14.857 1.00 0.00 H new ATOM 0 HG2 LYS B 9 6.723 -3.260 -13.896 1.00 0.00 H new ATOM 0 HG3 LYS B 9 7.874 -2.822 -15.144 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.725 -0.837 -13.135 1.00 0.00 H new ATOM 0 HD3 LYS B 9 8.246 -1.679 -12.911 1.00 0.00 H new ATOM 0 HE2 LYS B 9 9.119 -0.702 -15.030 1.00 0.00 H new ATOM 0 HE3 LYS B 9 7.589 0.110 -15.299 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 9.519 1.365 -14.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 7.944 1.565 -13.579 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 9.039 0.546 -12.775 1.00 0.00 H new ATOM 140 N LEU B 10 5.768 -5.409 -15.240 1.00 0.00 N ATOM 141 CA LEU B 10 5.405 -6.576 -14.458 1.00 0.00 C ATOM 142 C LEU B 10 6.309 -6.705 -13.242 1.00 0.00 C ATOM 143 O LEU B 10 7.461 -6.277 -13.266 1.00 0.00 O ATOM 144 CB LEU B 10 5.515 -7.816 -15.339 1.00 0.00 C ATOM 145 CG LEU B 10 4.508 -7.867 -16.488 1.00 0.00 C ATOM 146 CD1 LEU B 10 4.747 -9.177 -17.238 1.00 0.00 C ATOM 147 CD2 LEU B 10 3.061 -7.859 -16.001 1.00 0.00 C ATOM 0 H LEU B 10 6.681 -5.475 -15.691 1.00 0.00 H new ATOM 0 HA LEU B 10 4.380 -6.471 -14.103 1.00 0.00 H new ATOM 0 HB2 LEU B 10 6.522 -7.864 -15.753 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.383 -8.701 -14.717 1.00 0.00 H new ATOM 0 HG LEU B 10 4.651 -6.985 -17.113 1.00 0.00 H new ATOM 0 HD11 LEU B 10 4.046 -9.253 -18.069 1.00 0.00 H new ATOM 0 HD12 LEU B 10 5.767 -9.196 -17.621 1.00 0.00 H new ATOM 0 HD13 LEU B 10 4.598 -10.017 -16.560 1.00 0.00 H new ATOM 0 HD21 LEU B 10 2.388 -7.896 -16.858 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.886 -8.727 -15.365 1.00 0.00 H new ATOM 0 HD23 LEU B 10 2.874 -6.948 -15.432 1.00 0.00 H new ATOM 159 N PHE B 11 5.773 -7.304 -12.180 1.00 0.00 N ATOM 160 CA PHE B 11 6.518 -7.664 -10.992 1.00 0.00 C ATOM 161 C PHE B 11 6.737 -9.169 -11.028 1.00 0.00 C ATOM 162 O PHE B 11 5.786 -9.929 -11.203 1.00 0.00 O ATOM 163 CB PHE B 11 5.738 -7.263 -9.741 1.00 0.00 C ATOM 164 CG PHE B 11 6.338 -7.837 -8.484 1.00 0.00 C ATOM 165 CD1 PHE B 11 7.492 -7.262 -7.939 1.00 0.00 C ATOM 166 CD2 PHE B 11 5.751 -8.950 -7.865 1.00 0.00 C ATOM 167 CE1 PHE B 11 8.062 -7.792 -6.777 1.00 0.00 C ATOM 168 CE2 PHE B 11 6.323 -9.485 -6.701 1.00 0.00 C ATOM 169 CZ PHE B 11 7.480 -8.905 -6.162 1.00 0.00 C ATOM 0 H PHE B 11 4.786 -7.555 -12.128 1.00 0.00 H new ATOM 0 HA PHE B 11 7.476 -7.144 -10.964 1.00 0.00 H new ATOM 0 HB2 PHE B 11 5.712 -6.176 -9.665 1.00 0.00 H new ATOM 0 HB3 PHE B 11 4.706 -7.601 -9.835 1.00 0.00 H new ATOM 0 HD1 PHE B 11 7.944 -6.406 -8.418 1.00 0.00 H new ATOM 0 HD2 PHE B 11 4.860 -9.395 -8.284 1.00 0.00 H new ATOM 0 HE1 PHE B 11 8.949 -7.343 -6.356 1.00 0.00 H new ATOM 0 HE2 PHE B 11 5.873 -10.342 -6.221 1.00 0.00 H new ATOM 0 HZ PHE B 11 7.923 -9.319 -5.269 1.00 0.00 H new ATOM 179 N ILE B 12 7.989 -9.593 -10.863 1.00 0.00 N ATOM 180 CA ILE B 12 8.364 -10.987 -10.996 1.00 0.00 C ATOM 181 C ILE B 12 8.957 -11.476 -9.676 1.00 0.00 C ATOM 182 O ILE B 12 10.176 -11.571 -9.545 1.00 0.00 O ATOM 183 CB ILE B 12 9.360 -11.151 -12.154 1.00 0.00 C ATOM 184 CG1 ILE B 12 9.077 -10.304 -13.403 1.00 0.00 C ATOM 185 CG2 ILE B 12 9.389 -12.625 -12.543 1.00 0.00 C ATOM 186 CD1 ILE B 12 7.717 -10.535 -14.061 1.00 0.00 C ATOM 0 H ILE B 12 8.767 -8.975 -10.633 1.00 0.00 H new ATOM 0 HA ILE B 12 7.486 -11.591 -11.224 1.00 0.00 H new ATOM 0 HB ILE B 12 10.318 -10.788 -11.783 1.00 0.00 H new ATOM 0 HG12 ILE B 12 9.156 -9.251 -13.132 1.00 0.00 H new ATOM 0 HG13 ILE B 12 9.856 -10.503 -14.139 1.00 0.00 H new ATOM 0 HG21 ILE B 12 10.090 -12.771 -13.365 1.00 0.00 H new ATOM 0 HG22 ILE B 12 9.705 -13.221 -11.687 1.00 0.00 H new ATOM 0 HG23 ILE B 12 8.393 -12.938 -12.856 1.00 0.00 H new ATOM 0 HD11 ILE B 12 7.620 -9.888 -14.933 1.00 0.00 H new ATOM 0 HD12 ILE B 12 7.635 -11.577 -14.372 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.925 -10.306 -13.349 1.00 0.00 H new ATOM 198 N GLY B 13 8.110 -11.791 -8.689 1.00 0.00 N ATOM 199 CA GLY B 13 8.605 -12.208 -7.379 1.00 0.00 C ATOM 200 C GLY B 13 8.702 -13.728 -7.263 1.00 0.00 C ATOM 201 O GLY B 13 7.891 -14.440 -7.842 1.00 0.00 O ATOM 0 H GLY B 13 7.094 -11.765 -8.773 1.00 0.00 H new ATOM 0 HA2 GLY B 13 9.587 -11.767 -7.205 1.00 0.00 H new ATOM 0 HA3 GLY B 13 7.942 -11.826 -6.602 1.00 0.00 H new ATOM 205 N GLY B 14 9.690 -14.232 -6.517 1.00 0.00 N ATOM 206 CA GLY B 14 9.812 -15.654 -6.210 1.00 0.00 C ATOM 207 C GLY B 14 10.861 -16.333 -7.089 1.00 0.00 C ATOM 208 O GLY B 14 10.962 -17.559 -7.106 1.00 0.00 O ATOM 0 H GLY B 14 10.429 -13.660 -6.109 1.00 0.00 H new ATOM 0 HA2 GLY B 14 10.080 -15.778 -5.161 1.00 0.00 H new ATOM 0 HA3 GLY B 14 8.847 -16.141 -6.352 1.00 0.00 H new ATOM 212 N LEU B 15 11.641 -15.535 -7.822 1.00 0.00 N ATOM 213 CA LEU B 15 12.651 -16.026 -8.743 1.00 0.00 C ATOM 214 C LEU B 15 13.785 -16.753 -8.020 1.00 0.00 C ATOM 215 O LEU B 15 13.941 -16.644 -6.806 1.00 0.00 O ATOM 216 CB LEU B 15 13.238 -14.846 -9.509 1.00 0.00 C ATOM 217 CG LEU B 15 12.219 -14.131 -10.391 1.00 0.00 C ATOM 218 CD1 LEU B 15 12.758 -12.760 -10.775 1.00 0.00 C ATOM 219 CD2 LEU B 15 12.042 -14.940 -11.666 1.00 0.00 C ATOM 0 H LEU B 15 11.583 -14.517 -7.787 1.00 0.00 H new ATOM 0 HA LEU B 15 12.170 -16.735 -9.417 1.00 0.00 H new ATOM 0 HB2 LEU B 15 13.657 -14.133 -8.799 1.00 0.00 H new ATOM 0 HB3 LEU B 15 14.062 -15.199 -10.130 1.00 0.00 H new ATOM 0 HG LEU B 15 11.275 -14.027 -9.856 1.00 0.00 H new ATOM 0 HD11 LEU B 15 12.032 -12.247 -11.405 1.00 0.00 H new ATOM 0 HD12 LEU B 15 12.935 -12.173 -9.874 1.00 0.00 H new ATOM 0 HD13 LEU B 15 13.694 -12.877 -11.321 1.00 0.00 H new ATOM 0 HD21 LEU B 15 11.316 -14.446 -12.312 1.00 0.00 H new ATOM 0 HD22 LEU B 15 12.998 -15.016 -12.185 1.00 0.00 H new ATOM 0 HD23 LEU B 15 11.685 -15.939 -11.416 1.00 0.00 H new ATOM 231 N ASN B 16 14.581 -17.497 -8.793 1.00 0.00 N ATOM 232 CA ASN B 16 15.735 -18.217 -8.300 1.00 0.00 C ATOM 233 C ASN B 16 16.908 -17.263 -8.069 1.00 0.00 C ATOM 234 O ASN B 16 16.919 -16.148 -8.587 1.00 0.00 O ATOM 235 CB ASN B 16 16.071 -19.277 -9.343 1.00 0.00 C ATOM 236 CG ASN B 16 17.018 -20.348 -8.851 1.00 0.00 C ATOM 237 OD1 ASN B 16 17.266 -20.497 -7.658 1.00 0.00 O ATOM 238 ND2 ASN B 16 17.550 -21.102 -9.799 1.00 0.00 N ATOM 0 H ASN B 16 14.430 -17.611 -9.795 1.00 0.00 H new ATOM 0 HA ASN B 16 15.526 -18.686 -7.338 1.00 0.00 H new ATOM 0 HB2 ASN B 16 15.147 -19.749 -9.676 1.00 0.00 H new ATOM 0 HB3 ASN B 16 16.511 -18.789 -10.213 1.00 0.00 H new ATOM 0 HD21 ASN B 16 18.200 -21.849 -9.552 1.00 0.00 H new ATOM 0 HD22 ASN B 16 17.311 -20.937 -10.777 1.00 0.00 H new ATOM 245 N THR B 17 17.900 -17.699 -7.292 1.00 0.00 N ATOM 246 CA THR B 17 19.104 -16.909 -7.047 1.00 0.00 C ATOM 247 C THR B 17 20.037 -16.964 -8.253 1.00 0.00 C ATOM 248 O THR B 17 21.095 -16.337 -8.253 1.00 0.00 O ATOM 249 CB THR B 17 19.822 -17.427 -5.798 1.00 0.00 C ATOM 250 OG1 THR B 17 20.204 -18.775 -5.962 1.00 0.00 O ATOM 251 CG2 THR B 17 18.893 -17.365 -4.590 1.00 0.00 C ATOM 0 H THR B 17 17.891 -18.603 -6.819 1.00 0.00 H new ATOM 0 HA THR B 17 18.813 -15.871 -6.886 1.00 0.00 H new ATOM 0 HB THR B 17 20.700 -16.800 -5.646 1.00 0.00 H new ATOM 0 HG1 THR B 17 21.019 -18.820 -6.504 1.00 0.00 H new ATOM 0 HG21 THR B 17 19.416 -17.736 -3.709 1.00 0.00 H new ATOM 0 HG22 THR B 17 18.584 -16.333 -4.421 1.00 0.00 H new ATOM 0 HG23 THR B 17 18.013 -17.981 -4.776 1.00 0.00 H new ATOM 259 N GLU B 18 19.631 -17.718 -9.276 1.00 0.00 N ATOM 260 CA GLU B 18 20.448 -18.037 -10.436 1.00 0.00 C ATOM 261 C GLU B 18 19.932 -17.315 -11.678 1.00 0.00 C ATOM 262 O GLU B 18 20.539 -17.391 -12.745 1.00 0.00 O ATOM 263 CB GLU B 18 20.402 -19.553 -10.649 1.00 0.00 C ATOM 264 CG GLU B 18 20.501 -20.322 -9.327 1.00 0.00 C ATOM 265 CD GLU B 18 21.871 -20.142 -8.677 1.00 0.00 C ATOM 266 OE1 GLU B 18 22.792 -20.898 -9.062 1.00 0.00 O ATOM 267 OE2 GLU B 18 21.995 -19.254 -7.804 1.00 0.00 O ATOM 0 H GLU B 18 18.700 -18.132 -9.317 1.00 0.00 H new ATOM 0 HA GLU B 18 21.473 -17.709 -10.265 1.00 0.00 H new ATOM 0 HB2 GLU B 18 19.474 -19.820 -11.155 1.00 0.00 H new ATOM 0 HB3 GLU B 18 21.220 -19.852 -11.304 1.00 0.00 H new ATOM 0 HG2 GLU B 18 19.725 -19.976 -8.644 1.00 0.00 H new ATOM 0 HG3 GLU B 18 20.318 -21.382 -9.506 1.00 0.00 H new ATOM 274 N THR B 19 18.804 -16.613 -11.537 1.00 0.00 N ATOM 275 CA THR B 19 18.165 -15.911 -12.641 1.00 0.00 C ATOM 276 C THR B 19 18.828 -14.553 -12.851 1.00 0.00 C ATOM 277 O THR B 19 19.241 -13.897 -11.897 1.00 0.00 O ATOM 278 CB THR B 19 16.669 -15.744 -12.355 1.00 0.00 C ATOM 279 OG1 THR B 19 16.089 -17.002 -12.083 1.00 0.00 O ATOM 280 CG2 THR B 19 15.940 -15.121 -13.544 1.00 0.00 C ATOM 0 H THR B 19 18.311 -16.519 -10.649 1.00 0.00 H new ATOM 0 HA THR B 19 18.281 -16.495 -13.554 1.00 0.00 H new ATOM 0 HB THR B 19 16.571 -15.083 -11.494 1.00 0.00 H new ATOM 0 HG1 THR B 19 15.133 -16.889 -11.899 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.881 -15.017 -13.308 1.00 0.00 H new ATOM 0 HG22 THR B 19 16.363 -14.139 -13.756 1.00 0.00 H new ATOM 0 HG23 THR B 19 16.055 -15.762 -14.418 1.00 0.00 H new ATOM 288 N ASN B 20 18.923 -14.136 -14.114 1.00 0.00 N ATOM 289 CA ASN B 20 19.470 -12.837 -14.468 1.00 0.00 C ATOM 290 C ASN B 20 18.604 -12.199 -15.544 1.00 0.00 C ATOM 291 O ASN B 20 17.512 -12.672 -15.850 1.00 0.00 O ATOM 292 CB ASN B 20 20.914 -12.942 -14.962 1.00 0.00 C ATOM 293 CG ASN B 20 21.597 -14.242 -14.582 1.00 0.00 C ATOM 294 OD1 ASN B 20 22.147 -14.377 -13.493 1.00 0.00 O ATOM 295 ND2 ASN B 20 21.559 -15.205 -15.494 1.00 0.00 N ATOM 0 H ASN B 20 18.622 -14.692 -14.915 1.00 0.00 H new ATOM 0 HA ASN B 20 19.472 -12.218 -13.571 1.00 0.00 H new ATOM 0 HB2 ASN B 20 20.925 -12.840 -16.047 1.00 0.00 H new ATOM 0 HB3 ASN B 20 21.488 -12.109 -14.557 1.00 0.00 H new ATOM 0 HD21 ASN B 20 21.999 -16.105 -15.304 1.00 0.00 H new ATOM 0 HD22 ASN B 20 21.089 -15.045 -16.385 1.00 0.00 H new ATOM 302 N GLU B 21 19.109 -11.115 -16.117 1.00 0.00 N ATOM 303 CA GLU B 21 18.377 -10.305 -17.070 1.00 0.00 C ATOM 304 C GLU B 21 18.205 -11.051 -18.384 1.00 0.00 C ATOM 305 O GLU B 21 17.177 -10.925 -19.045 1.00 0.00 O ATOM 306 CB GLU B 21 19.126 -8.993 -17.290 1.00 0.00 C ATOM 307 CG GLU B 21 19.421 -8.312 -15.954 1.00 0.00 C ATOM 308 CD GLU B 21 20.781 -8.724 -15.391 1.00 0.00 C ATOM 309 OE1 GLU B 21 21.788 -8.145 -15.852 1.00 0.00 O ATOM 310 OE2 GLU B 21 20.802 -9.609 -14.509 1.00 0.00 O ATOM 0 H GLU B 21 20.051 -10.773 -15.928 1.00 0.00 H new ATOM 0 HA GLU B 21 17.384 -10.091 -16.675 1.00 0.00 H new ATOM 0 HB2 GLU B 21 20.059 -9.185 -17.820 1.00 0.00 H new ATOM 0 HB3 GLU B 21 18.532 -8.330 -17.919 1.00 0.00 H new ATOM 0 HG2 GLU B 21 19.395 -7.230 -16.085 1.00 0.00 H new ATOM 0 HG3 GLU B 21 18.640 -8.565 -15.237 1.00 0.00 H new ATOM 317 N LYS B 22 19.212 -11.838 -18.772 1.00 0.00 N ATOM 318 CA LYS B 22 19.181 -12.573 -20.026 1.00 0.00 C ATOM 319 C LYS B 22 18.068 -13.619 -19.993 1.00 0.00 C ATOM 320 O LYS B 22 17.492 -13.955 -21.026 1.00 0.00 O ATOM 321 CB LYS B 22 20.556 -13.222 -20.230 1.00 0.00 C ATOM 322 CG LYS B 22 20.974 -13.381 -21.696 1.00 0.00 C ATOM 323 CD LYS B 22 20.012 -14.239 -22.521 1.00 0.00 C ATOM 324 CE LYS B 22 20.632 -14.594 -23.877 1.00 0.00 C ATOM 325 NZ LYS B 22 20.873 -13.391 -24.695 1.00 0.00 N ATOM 0 H LYS B 22 20.062 -11.979 -18.226 1.00 0.00 H new ATOM 0 HA LYS B 22 18.971 -11.904 -20.861 1.00 0.00 H new ATOM 0 HB2 LYS B 22 21.306 -12.623 -19.715 1.00 0.00 H new ATOM 0 HB3 LYS B 22 20.553 -14.204 -19.758 1.00 0.00 H new ATOM 0 HG2 LYS B 22 21.049 -12.394 -22.152 1.00 0.00 H new ATOM 0 HG3 LYS B 22 21.968 -13.826 -21.735 1.00 0.00 H new ATOM 0 HD2 LYS B 22 19.771 -15.151 -21.975 1.00 0.00 H new ATOM 0 HD3 LYS B 22 19.076 -13.702 -22.673 1.00 0.00 H new ATOM 0 HE2 LYS B 22 21.572 -15.123 -23.721 1.00 0.00 H new ATOM 0 HE3 LYS B 22 19.970 -15.273 -24.414 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 21.181 -13.675 -25.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 19.995 -12.837 -24.765 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 21.613 -12.811 -24.250 1.00 0.00 H new ATOM 339 N ALA B 23 17.749 -14.142 -18.804 1.00 0.00 N ATOM 340 CA ALA B 23 16.824 -15.257 -18.699 1.00 0.00 C ATOM 341 C ALA B 23 15.416 -14.702 -18.569 1.00 0.00 C ATOM 342 O ALA B 23 14.430 -15.380 -18.839 1.00 0.00 O ATOM 343 CB ALA B 23 17.199 -16.104 -17.483 1.00 0.00 C ATOM 0 H ALA B 23 18.118 -13.809 -17.913 1.00 0.00 H new ATOM 0 HA ALA B 23 16.873 -15.891 -19.584 1.00 0.00 H new ATOM 0 HB1 ALA B 23 16.509 -16.943 -17.397 1.00 0.00 H new ATOM 0 HB2 ALA B 23 18.215 -16.480 -17.601 1.00 0.00 H new ATOM 0 HB3 ALA B 23 17.141 -15.493 -16.582 1.00 0.00 H new ATOM 349 N LEU B 24 15.340 -13.442 -18.144 1.00 0.00 N ATOM 350 CA LEU B 24 14.105 -12.746 -17.898 1.00 0.00 C ATOM 351 C LEU B 24 13.622 -12.105 -19.189 1.00 0.00 C ATOM 352 O LEU B 24 12.423 -11.931 -19.390 1.00 0.00 O ATOM 353 CB LEU B 24 14.428 -11.702 -16.832 1.00 0.00 C ATOM 354 CG LEU B 24 14.137 -12.239 -15.436 1.00 0.00 C ATOM 355 CD1 LEU B 24 14.653 -11.265 -14.384 1.00 0.00 C ATOM 356 CD2 LEU B 24 12.634 -12.408 -15.251 1.00 0.00 C ATOM 0 H LEU B 24 16.166 -12.873 -17.960 1.00 0.00 H new ATOM 0 HA LEU B 24 13.307 -13.406 -17.557 1.00 0.00 H new ATOM 0 HB2 LEU B 24 15.477 -11.416 -16.904 1.00 0.00 H new ATOM 0 HB3 LEU B 24 13.839 -10.802 -17.009 1.00 0.00 H new ATOM 0 HG LEU B 24 14.636 -13.201 -15.322 1.00 0.00 H new ATOM 0 HD11 LEU B 24 14.440 -11.657 -13.390 1.00 0.00 H new ATOM 0 HD12 LEU B 24 15.729 -11.139 -14.502 1.00 0.00 H new ATOM 0 HD13 LEU B 24 14.159 -10.301 -14.507 1.00 0.00 H new ATOM 0 HD21 LEU B 24 12.431 -12.792 -14.251 1.00 0.00 H new ATOM 0 HD22 LEU B 24 12.141 -11.444 -15.376 1.00 0.00 H new ATOM 0 HD23 LEU B 24 12.253 -13.109 -15.993 1.00 0.00 H new ATOM 368 N GLU B 25 14.553 -11.755 -20.073 1.00 0.00 N ATOM 369 CA GLU B 25 14.172 -11.263 -21.384 1.00 0.00 C ATOM 370 C GLU B 25 13.822 -12.424 -22.298 1.00 0.00 C ATOM 371 O GLU B 25 13.059 -12.277 -23.251 1.00 0.00 O ATOM 372 CB GLU B 25 15.329 -10.489 -22.010 1.00 0.00 C ATOM 373 CG GLU B 25 15.535 -9.200 -21.241 1.00 0.00 C ATOM 374 CD GLU B 25 16.568 -8.299 -21.911 1.00 0.00 C ATOM 375 OE1 GLU B 25 17.777 -8.548 -21.707 1.00 0.00 O ATOM 376 OE2 GLU B 25 16.147 -7.363 -22.627 1.00 0.00 O ATOM 0 H GLU B 25 15.558 -11.803 -19.906 1.00 0.00 H new ATOM 0 HA GLU B 25 13.307 -10.610 -21.265 1.00 0.00 H new ATOM 0 HB2 GLU B 25 16.239 -11.089 -21.989 1.00 0.00 H new ATOM 0 HB3 GLU B 25 15.114 -10.273 -23.057 1.00 0.00 H new ATOM 0 HG2 GLU B 25 14.587 -8.669 -21.161 1.00 0.00 H new ATOM 0 HG3 GLU B 25 15.858 -9.430 -20.226 1.00 0.00 H new ATOM 383 N ALA B 26 14.394 -13.587 -21.994 1.00 0.00 N ATOM 384 CA ALA B 26 14.220 -14.794 -22.779 1.00 0.00 C ATOM 385 C ALA B 26 12.924 -15.516 -22.425 1.00 0.00 C ATOM 386 O ALA B 26 12.409 -16.292 -23.227 1.00 0.00 O ATOM 387 CB ALA B 26 15.414 -15.696 -22.483 1.00 0.00 C ATOM 0 H ALA B 26 14.999 -13.713 -21.183 1.00 0.00 H new ATOM 0 HA ALA B 26 14.162 -14.540 -23.837 1.00 0.00 H new ATOM 0 HB1 ALA B 26 15.323 -16.619 -23.055 1.00 0.00 H new ATOM 0 HB2 ALA B 26 16.335 -15.184 -22.763 1.00 0.00 H new ATOM 0 HB3 ALA B 26 15.438 -15.930 -21.419 1.00 0.00 H new ATOM 393 N VAL B 27 12.396 -15.260 -21.227 1.00 0.00 N ATOM 394 CA VAL B 27 11.212 -15.948 -20.730 1.00 0.00 C ATOM 395 C VAL B 27 9.962 -15.089 -20.798 1.00 0.00 C ATOM 396 O VAL B 27 8.855 -15.599 -20.945 1.00 0.00 O ATOM 397 CB VAL B 27 11.517 -16.359 -19.304 1.00 0.00 C ATOM 398 CG1 VAL B 27 11.430 -15.184 -18.354 1.00 0.00 C ATOM 399 CG2 VAL B 27 10.584 -17.456 -18.814 1.00 0.00 C ATOM 0 H VAL B 27 12.778 -14.572 -20.579 1.00 0.00 H new ATOM 0 HA VAL B 27 10.997 -16.813 -21.357 1.00 0.00 H new ATOM 0 HB VAL B 27 12.538 -16.741 -19.314 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.655 -15.518 -17.341 1.00 0.00 H new ATOM 0 HG12 VAL B 27 12.149 -14.421 -18.653 1.00 0.00 H new ATOM 0 HG13 VAL B 27 10.424 -14.766 -18.383 1.00 0.00 H new ATOM 0 HG21 VAL B 27 10.839 -17.719 -17.787 1.00 0.00 H new ATOM 0 HG22 VAL B 27 9.554 -17.102 -18.852 1.00 0.00 H new ATOM 0 HG23 VAL B 27 10.689 -18.335 -19.451 1.00 0.00 H new ATOM 409 N PHE B 28 10.138 -13.774 -20.692 1.00 0.00 N ATOM 410 CA PHE B 28 9.028 -12.849 -20.855 1.00 0.00 C ATOM 411 C PHE B 28 9.007 -12.248 -22.254 1.00 0.00 C ATOM 412 O PHE B 28 8.035 -11.596 -22.631 1.00 0.00 O ATOM 413 CB PHE B 28 9.061 -11.781 -19.770 1.00 0.00 C ATOM 414 CG PHE B 28 8.764 -12.320 -18.394 1.00 0.00 C ATOM 415 CD1 PHE B 28 7.444 -12.624 -18.033 1.00 0.00 C ATOM 416 CD2 PHE B 28 9.802 -12.533 -17.481 1.00 0.00 C ATOM 417 CE1 PHE B 28 7.160 -13.147 -16.765 1.00 0.00 C ATOM 418 CE2 PHE B 28 9.522 -13.072 -16.218 1.00 0.00 C ATOM 419 CZ PHE B 28 8.203 -13.371 -15.858 1.00 0.00 C ATOM 0 H PHE B 28 11.035 -13.330 -20.495 1.00 0.00 H new ATOM 0 HA PHE B 28 8.097 -13.404 -20.741 1.00 0.00 H new ATOM 0 HB2 PHE B 28 10.044 -11.310 -19.764 1.00 0.00 H new ATOM 0 HB3 PHE B 28 8.336 -11.004 -20.013 1.00 0.00 H new ATOM 0 HD1 PHE B 28 6.642 -12.454 -18.736 1.00 0.00 H new ATOM 0 HD2 PHE B 28 10.818 -12.282 -17.749 1.00 0.00 H new ATOM 0 HE1 PHE B 28 6.142 -13.376 -16.488 1.00 0.00 H new ATOM 0 HE2 PHE B 28 10.326 -13.257 -15.521 1.00 0.00 H new ATOM 0 HZ PHE B 28 7.989 -13.775 -14.879 1.00 0.00 H new ATOM 429 N GLY B 29 10.071 -12.460 -23.032 1.00 0.00 N ATOM 430 CA GLY B 29 10.109 -11.975 -24.408 1.00 0.00 C ATOM 431 C GLY B 29 9.278 -12.865 -25.326 1.00 0.00 C ATOM 432 O GLY B 29 9.101 -12.561 -26.504 1.00 0.00 O ATOM 0 H GLY B 29 10.909 -12.960 -22.734 1.00 0.00 H new ATOM 0 HA2 GLY B 29 9.732 -10.953 -24.447 1.00 0.00 H new ATOM 0 HA3 GLY B 29 11.141 -11.947 -24.759 1.00 0.00 H new ATOM 436 N LYS B 30 8.771 -13.971 -24.774 1.00 0.00 N ATOM 437 CA LYS B 30 7.961 -14.951 -25.474 1.00 0.00 C ATOM 438 C LYS B 30 6.536 -14.452 -25.658 1.00 0.00 C ATOM 439 O LYS B 30 5.817 -14.900 -26.548 1.00 0.00 O ATOM 440 CB LYS B 30 7.930 -16.214 -24.610 1.00 0.00 C ATOM 441 CG LYS B 30 9.335 -16.782 -24.444 1.00 0.00 C ATOM 442 CD LYS B 30 9.456 -17.798 -23.303 1.00 0.00 C ATOM 443 CE LYS B 30 8.467 -18.962 -23.357 1.00 0.00 C ATOM 444 NZ LYS B 30 7.087 -18.557 -23.019 1.00 0.00 N ATOM 0 H LYS B 30 8.923 -14.210 -23.794 1.00 0.00 H new ATOM 0 HA LYS B 30 8.386 -15.141 -26.460 1.00 0.00 H new ATOM 0 HB2 LYS B 30 7.507 -15.983 -23.632 1.00 0.00 H new ATOM 0 HB3 LYS B 30 7.282 -16.960 -25.069 1.00 0.00 H new ATOM 0 HG2 LYS B 30 9.638 -17.258 -25.377 1.00 0.00 H new ATOM 0 HG3 LYS B 30 10.030 -15.962 -24.264 1.00 0.00 H new ATOM 0 HD2 LYS B 30 10.468 -18.202 -23.305 1.00 0.00 H new ATOM 0 HD3 LYS B 30 9.324 -17.274 -22.356 1.00 0.00 H new ATOM 0 HE2 LYS B 30 8.479 -19.397 -24.357 1.00 0.00 H new ATOM 0 HE3 LYS B 30 8.792 -19.741 -22.667 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 6.666 -19.259 -22.378 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 7.102 -17.628 -22.552 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 6.520 -18.498 -23.889 1.00 0.00 H new ATOM 458 N TYR B 31 6.149 -13.517 -24.793 1.00 0.00 N ATOM 459 CA TYR B 31 4.801 -12.984 -24.741 1.00 0.00 C ATOM 460 C TYR B 31 4.687 -11.615 -25.408 1.00 0.00 C ATOM 461 O TYR B 31 3.585 -11.210 -25.770 1.00 0.00 O ATOM 462 CB TYR B 31 4.403 -12.914 -23.272 1.00 0.00 C ATOM 463 CG TYR B 31 4.495 -14.252 -22.572 1.00 0.00 C ATOM 464 CD1 TYR B 31 3.558 -15.251 -22.865 1.00 0.00 C ATOM 465 CD2 TYR B 31 5.520 -14.494 -21.643 1.00 0.00 C ATOM 466 CE1 TYR B 31 3.656 -16.502 -22.247 1.00 0.00 C ATOM 467 CE2 TYR B 31 5.624 -15.747 -21.016 1.00 0.00 C ATOM 468 CZ TYR B 31 4.703 -16.766 -21.341 1.00 0.00 C ATOM 469 OH TYR B 31 4.818 -18.007 -20.790 1.00 0.00 O ATOM 0 H TYR B 31 6.776 -13.106 -24.101 1.00 0.00 H new ATOM 0 HA TYR B 31 4.128 -13.636 -25.298 1.00 0.00 H new ATOM 0 HB2 TYR B 31 5.046 -12.197 -22.761 1.00 0.00 H new ATOM 0 HB3 TYR B 31 3.383 -12.539 -23.195 1.00 0.00 H new ATOM 0 HD1 TYR B 31 2.761 -15.056 -23.567 1.00 0.00 H new ATOM 0 HD2 TYR B 31 6.230 -13.715 -21.410 1.00 0.00 H new ATOM 0 HE1 TYR B 31 2.927 -17.268 -22.465 1.00 0.00 H new ATOM 0 HE2 TYR B 31 6.403 -15.929 -20.291 1.00 0.00 H new ATOM 0 HH TYR B 31 5.743 -18.152 -20.499 1.00 0.00 H new ATOM 479 N GLY B 32 5.806 -10.903 -25.576 1.00 0.00 N ATOM 480 CA GLY B 32 5.805 -9.582 -26.180 1.00 0.00 C ATOM 481 C GLY B 32 7.200 -9.013 -26.313 1.00 0.00 C ATOM 482 O GLY B 32 8.146 -9.509 -25.703 1.00 0.00 O ATOM 0 H GLY B 32 6.730 -11.231 -25.296 1.00 0.00 H new ATOM 0 HA2 GLY B 32 5.341 -9.635 -27.165 1.00 0.00 H new ATOM 0 HA3 GLY B 32 5.196 -8.909 -25.576 1.00 0.00 H new ATOM 486 N ARG B 33 7.320 -7.960 -27.120 1.00 0.00 N ATOM 487 CA ARG B 33 8.586 -7.296 -27.305 1.00 0.00 C ATOM 488 C ARG B 33 8.892 -6.486 -26.062 1.00 0.00 C ATOM 489 O ARG B 33 8.168 -5.557 -25.717 1.00 0.00 O ATOM 490 CB ARG B 33 8.509 -6.430 -28.561 1.00 0.00 C ATOM 491 CG ARG B 33 9.902 -6.309 -29.161 1.00 0.00 C ATOM 492 CD ARG B 33 9.837 -5.516 -30.463 1.00 0.00 C ATOM 493 NE ARG B 33 11.140 -5.490 -31.134 1.00 0.00 N ATOM 494 CZ ARG B 33 12.071 -4.544 -30.965 1.00 0.00 C ATOM 495 NH1 ARG B 33 11.864 -3.512 -30.151 1.00 0.00 N ATOM 496 NH2 ARG B 33 13.224 -4.628 -31.620 1.00 0.00 N ATOM 0 H ARG B 33 6.549 -7.557 -27.652 1.00 0.00 H new ATOM 0 HA ARG B 33 9.397 -8.011 -27.446 1.00 0.00 H new ATOM 0 HB2 ARG B 33 7.824 -6.874 -29.284 1.00 0.00 H new ATOM 0 HB3 ARG B 33 8.117 -5.443 -28.315 1.00 0.00 H new ATOM 0 HG2 ARG B 33 10.570 -5.814 -28.456 1.00 0.00 H new ATOM 0 HG3 ARG B 33 10.315 -7.300 -29.349 1.00 0.00 H new ATOM 0 HD2 ARG B 33 9.093 -5.959 -31.125 1.00 0.00 H new ATOM 0 HD3 ARG B 33 9.512 -4.497 -30.255 1.00 0.00 H new ATOM 0 HE ARG B 33 11.353 -6.251 -31.779 1.00 0.00 H new ATOM 0 HH11 ARG B 33 10.983 -3.432 -29.643 1.00 0.00 H new ATOM 0 HH12 ARG B 33 12.586 -2.801 -30.035 1.00 0.00 H new ATOM 0 HH21 ARG B 33 13.397 -5.412 -32.249 1.00 0.00 H new ATOM 0 HH22 ARG B 33 13.936 -3.909 -31.494 1.00 0.00 H new ATOM 510 N ILE B 34 9.975 -6.859 -25.395 1.00 0.00 N ATOM 511 CA ILE B 34 10.443 -6.176 -24.200 1.00 0.00 C ATOM 512 C ILE B 34 11.117 -4.855 -24.571 1.00 0.00 C ATOM 513 O ILE B 34 11.854 -4.783 -25.556 1.00 0.00 O ATOM 514 CB ILE B 34 11.371 -7.115 -23.423 1.00 0.00 C ATOM 515 CG1 ILE B 34 10.522 -8.287 -22.912 1.00 0.00 C ATOM 516 CG2 ILE B 34 12.059 -6.384 -22.271 1.00 0.00 C ATOM 517 CD1 ILE B 34 11.309 -9.238 -22.009 1.00 0.00 C ATOM 0 H ILE B 34 10.557 -7.650 -25.671 1.00 0.00 H new ATOM 0 HA ILE B 34 9.603 -5.922 -23.554 1.00 0.00 H new ATOM 0 HB ILE B 34 12.165 -7.482 -24.073 1.00 0.00 H new ATOM 0 HG12 ILE B 34 9.665 -7.897 -22.363 1.00 0.00 H new ATOM 0 HG13 ILE B 34 10.129 -8.843 -23.763 1.00 0.00 H new ATOM 0 HG21 ILE B 34 12.711 -7.076 -21.738 1.00 0.00 H new ATOM 0 HG22 ILE B 34 12.651 -5.559 -22.666 1.00 0.00 H new ATOM 0 HG23 ILE B 34 11.306 -5.995 -21.586 1.00 0.00 H new ATOM 0 HD11 ILE B 34 10.658 -10.047 -21.678 1.00 0.00 H new ATOM 0 HD12 ILE B 34 12.151 -9.653 -22.563 1.00 0.00 H new ATOM 0 HD13 ILE B 34 11.680 -8.692 -21.141 1.00 0.00 H new ATOM 529 N VAL B 35 10.860 -3.817 -23.771 1.00 0.00 N ATOM 530 CA VAL B 35 11.484 -2.511 -23.945 1.00 0.00 C ATOM 531 C VAL B 35 12.502 -2.263 -22.835 1.00 0.00 C ATOM 532 O VAL B 35 13.426 -1.471 -23.008 1.00 0.00 O ATOM 533 CB VAL B 35 10.439 -1.380 -23.962 1.00 0.00 C ATOM 534 CG1 VAL B 35 10.558 -0.610 -25.272 1.00 0.00 C ATOM 535 CG2 VAL B 35 8.993 -1.855 -23.817 1.00 0.00 C ATOM 0 H VAL B 35 10.212 -3.863 -22.985 1.00 0.00 H new ATOM 0 HA VAL B 35 11.992 -2.512 -24.910 1.00 0.00 H new ATOM 0 HB VAL B 35 10.657 -0.758 -23.094 1.00 0.00 H new ATOM 0 HG11 VAL B 35 9.821 0.193 -25.291 1.00 0.00 H new ATOM 0 HG12 VAL B 35 11.559 -0.186 -25.355 1.00 0.00 H new ATOM 0 HG13 VAL B 35 10.380 -1.286 -26.109 1.00 0.00 H new ATOM 0 HG21 VAL B 35 8.324 -0.995 -23.839 1.00 0.00 H new ATOM 0 HG22 VAL B 35 8.747 -2.528 -24.639 1.00 0.00 H new ATOM 0 HG23 VAL B 35 8.876 -2.381 -22.870 1.00 0.00 H new ATOM 545 N GLU B 36 12.334 -2.941 -21.698 1.00 0.00 N ATOM 546 CA GLU B 36 13.236 -2.820 -20.561 1.00 0.00 C ATOM 547 C GLU B 36 13.076 -4.031 -19.650 1.00 0.00 C ATOM 548 O GLU B 36 11.988 -4.600 -19.562 1.00 0.00 O ATOM 549 CB GLU B 36 12.904 -1.530 -19.802 1.00 0.00 C ATOM 550 CG GLU B 36 13.791 -1.351 -18.573 1.00 0.00 C ATOM 551 CD GLU B 36 13.565 0.019 -17.935 1.00 0.00 C ATOM 552 OE1 GLU B 36 12.669 0.111 -17.063 1.00 0.00 O ATOM 553 OE2 GLU B 36 14.287 0.967 -18.322 1.00 0.00 O ATOM 0 H GLU B 36 11.564 -3.591 -21.544 1.00 0.00 H new ATOM 0 HA GLU B 36 14.270 -2.780 -20.904 1.00 0.00 H new ATOM 0 HB2 GLU B 36 13.027 -0.675 -20.467 1.00 0.00 H new ATOM 0 HB3 GLU B 36 11.858 -1.547 -19.496 1.00 0.00 H new ATOM 0 HG2 GLU B 36 13.576 -2.135 -17.847 1.00 0.00 H new ATOM 0 HG3 GLU B 36 14.838 -1.457 -18.856 1.00 0.00 H new ATOM 560 N VAL B 37 14.150 -4.426 -18.965 1.00 0.00 N ATOM 561 CA VAL B 37 14.078 -5.469 -17.950 1.00 0.00 C ATOM 562 C VAL B 37 14.885 -5.059 -16.732 1.00 0.00 C ATOM 563 O VAL B 37 15.936 -4.431 -16.843 1.00 0.00 O ATOM 564 CB VAL B 37 14.532 -6.831 -18.501 1.00 0.00 C ATOM 565 CG1 VAL B 37 15.243 -7.698 -17.461 1.00 0.00 C ATOM 566 CG2 VAL B 37 13.297 -7.608 -18.951 1.00 0.00 C ATOM 0 H VAL B 37 15.083 -4.035 -19.098 1.00 0.00 H new ATOM 0 HA VAL B 37 13.037 -5.588 -17.650 1.00 0.00 H new ATOM 0 HB VAL B 37 15.229 -6.624 -19.313 1.00 0.00 H new ATOM 0 HG11 VAL B 37 15.537 -8.644 -17.916 1.00 0.00 H new ATOM 0 HG12 VAL B 37 16.130 -7.178 -17.099 1.00 0.00 H new ATOM 0 HG13 VAL B 37 14.570 -7.890 -16.626 1.00 0.00 H new ATOM 0 HG21 VAL B 37 13.601 -8.578 -19.345 1.00 0.00 H new ATOM 0 HG22 VAL B 37 12.630 -7.754 -18.102 1.00 0.00 H new ATOM 0 HG23 VAL B 37 12.777 -7.047 -19.728 1.00 0.00 H new ATOM 576 N LEU B 38 14.361 -5.431 -15.565 1.00 0.00 N ATOM 577 CA LEU B 38 15.020 -5.233 -14.282 1.00 0.00 C ATOM 578 C LEU B 38 15.278 -6.594 -13.677 1.00 0.00 C ATOM 579 O LEU B 38 14.574 -7.559 -13.965 1.00 0.00 O ATOM 580 CB LEU B 38 14.106 -4.435 -13.372 1.00 0.00 C ATOM 581 CG LEU B 38 14.436 -2.940 -13.353 1.00 0.00 C ATOM 582 CD1 LEU B 38 13.374 -2.204 -12.553 1.00 0.00 C ATOM 583 CD2 LEU B 38 15.786 -2.657 -12.701 1.00 0.00 C ATOM 0 H LEU B 38 13.451 -5.886 -15.487 1.00 0.00 H new ATOM 0 HA LEU B 38 15.958 -4.692 -14.408 1.00 0.00 H new ATOM 0 HB2 LEU B 38 13.074 -4.569 -13.695 1.00 0.00 H new ATOM 0 HB3 LEU B 38 14.177 -4.830 -12.358 1.00 0.00 H new ATOM 0 HG LEU B 38 14.468 -2.603 -14.389 1.00 0.00 H new ATOM 0 HD11 LEU B 38 13.604 -1.139 -12.536 1.00 0.00 H new ATOM 0 HD12 LEU B 38 12.399 -2.357 -13.015 1.00 0.00 H new ATOM 0 HD13 LEU B 38 13.356 -2.587 -11.533 1.00 0.00 H new ATOM 0 HD21 LEU B 38 15.977 -1.584 -12.711 1.00 0.00 H new ATOM 0 HD22 LEU B 38 15.775 -3.014 -11.671 1.00 0.00 H new ATOM 0 HD23 LEU B 38 16.572 -3.170 -13.255 1.00 0.00 H new ATOM 595 N LEU B 39 16.293 -6.662 -12.826 1.00 0.00 N ATOM 596 CA LEU B 39 16.575 -7.846 -12.059 1.00 0.00 C ATOM 597 C LEU B 39 17.258 -7.368 -10.794 1.00 0.00 C ATOM 598 O LEU B 39 18.321 -6.750 -10.858 1.00 0.00 O ATOM 599 CB LEU B 39 17.447 -8.763 -12.918 1.00 0.00 C ATOM 600 CG LEU B 39 17.930 -10.064 -12.278 1.00 0.00 C ATOM 601 CD1 LEU B 39 19.200 -9.841 -11.466 1.00 0.00 C ATOM 602 CD2 LEU B 39 16.877 -10.745 -11.413 1.00 0.00 C ATOM 0 H LEU B 39 16.939 -5.891 -12.655 1.00 0.00 H new ATOM 0 HA LEU B 39 15.693 -8.422 -11.781 1.00 0.00 H new ATOM 0 HB2 LEU B 39 16.887 -9.016 -13.818 1.00 0.00 H new ATOM 0 HB3 LEU B 39 18.323 -8.197 -13.236 1.00 0.00 H new ATOM 0 HG LEU B 39 18.142 -10.736 -13.110 1.00 0.00 H new ATOM 0 HD11 LEU B 39 19.519 -10.784 -11.023 1.00 0.00 H new ATOM 0 HD12 LEU B 39 19.987 -9.462 -12.118 1.00 0.00 H new ATOM 0 HD13 LEU B 39 19.004 -9.117 -10.675 1.00 0.00 H new ATOM 0 HD21 LEU B 39 17.290 -11.662 -10.991 1.00 0.00 H new ATOM 0 HD22 LEU B 39 16.581 -10.075 -10.605 1.00 0.00 H new ATOM 0 HD23 LEU B 39 16.006 -10.986 -12.022 1.00 0.00 H new ATOM 614 N MET B 40 16.655 -7.646 -9.641 1.00 0.00 N ATOM 615 CA MET B 40 17.132 -7.052 -8.408 1.00 0.00 C ATOM 616 C MET B 40 18.102 -7.995 -7.721 1.00 0.00 C ATOM 617 O MET B 40 17.849 -9.196 -7.652 1.00 0.00 O ATOM 618 CB MET B 40 15.965 -6.656 -7.497 1.00 0.00 C ATOM 619 CG MET B 40 14.797 -5.980 -8.222 1.00 0.00 C ATOM 620 SD MET B 40 15.188 -5.002 -9.701 1.00 0.00 S ATOM 621 CE MET B 40 16.329 -3.768 -9.028 1.00 0.00 C ATOM 0 H MET B 40 15.852 -8.267 -9.540 1.00 0.00 H new ATOM 0 HA MET B 40 17.669 -6.133 -8.642 1.00 0.00 H new ATOM 0 HB2 MET B 40 15.595 -7.548 -6.992 1.00 0.00 H new ATOM 0 HB3 MET B 40 16.336 -5.983 -6.724 1.00 0.00 H new ATOM 0 HG2 MET B 40 14.085 -6.754 -8.508 1.00 0.00 H new ATOM 0 HG3 MET B 40 14.291 -5.328 -7.511 1.00 0.00 H new ATOM 0 HE1 MET B 40 16.012 -2.772 -9.337 1.00 0.00 H new ATOM 0 HE2 MET B 40 16.329 -3.827 -7.940 1.00 0.00 H new ATOM 0 HE3 MET B 40 17.335 -3.960 -9.402 1.00 0.00 H new ATOM 631 N LYS B 41 19.210 -7.453 -7.206 1.00 0.00 N ATOM 632 CA LYS B 41 20.185 -8.233 -6.459 1.00 0.00 C ATOM 633 C LYS B 41 20.812 -7.412 -5.342 1.00 0.00 C ATOM 634 O LYS B 41 20.883 -6.186 -5.411 1.00 0.00 O ATOM 635 CB LYS B 41 21.256 -8.853 -7.368 1.00 0.00 C ATOM 636 CG LYS B 41 21.380 -8.174 -8.732 1.00 0.00 C ATOM 637 CD LYS B 41 22.524 -8.806 -9.521 1.00 0.00 C ATOM 638 CE LYS B 41 22.633 -8.146 -10.896 1.00 0.00 C ATOM 639 NZ LYS B 41 23.711 -8.760 -11.693 1.00 0.00 N ATOM 0 H LYS B 41 19.450 -6.466 -7.298 1.00 0.00 H new ATOM 0 HA LYS B 41 19.643 -9.061 -6.002 1.00 0.00 H new ATOM 0 HB2 LYS B 41 22.220 -8.807 -6.861 1.00 0.00 H new ATOM 0 HB3 LYS B 41 21.025 -9.908 -7.518 1.00 0.00 H new ATOM 0 HG2 LYS B 41 20.446 -8.274 -9.285 1.00 0.00 H new ATOM 0 HG3 LYS B 41 21.561 -7.107 -8.602 1.00 0.00 H new ATOM 0 HD2 LYS B 41 23.461 -8.690 -8.977 1.00 0.00 H new ATOM 0 HD3 LYS B 41 22.352 -9.876 -9.634 1.00 0.00 H new ATOM 0 HE2 LYS B 41 21.685 -8.242 -11.425 1.00 0.00 H new ATOM 0 HE3 LYS B 41 22.826 -7.080 -10.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 23.764 -8.295 -12.621 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 24.618 -8.647 -11.196 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 23.512 -9.772 -11.824 1.00 0.00 H new ATOM 653 N ASP B 42 21.271 -8.118 -4.308 1.00 0.00 N ATOM 654 CA ASP B 42 21.922 -7.544 -3.144 1.00 0.00 C ATOM 655 C ASP B 42 23.171 -6.756 -3.538 1.00 0.00 C ATOM 656 O ASP B 42 23.793 -7.040 -4.560 1.00 0.00 O ATOM 657 CB ASP B 42 22.261 -8.686 -2.189 1.00 0.00 C ATOM 658 CG ASP B 42 22.661 -8.160 -0.816 1.00 0.00 C ATOM 659 OD1 ASP B 42 23.869 -7.901 -0.631 1.00 0.00 O ATOM 660 OD2 ASP B 42 21.755 -8.022 0.035 1.00 0.00 O ATOM 0 H ASP B 42 21.195 -9.134 -4.262 1.00 0.00 H new ATOM 0 HA ASP B 42 21.255 -6.835 -2.654 1.00 0.00 H new ATOM 0 HB2 ASP B 42 21.401 -9.348 -2.091 1.00 0.00 H new ATOM 0 HB3 ASP B 42 23.075 -9.281 -2.604 1.00 0.00 H new ATOM 665 N ARG B 43 23.537 -5.761 -2.724 1.00 0.00 N ATOM 666 CA ARG B 43 24.635 -4.854 -3.035 1.00 0.00 C ATOM 667 C ARG B 43 25.954 -5.283 -2.392 1.00 0.00 C ATOM 668 O ARG B 43 26.970 -4.614 -2.574 1.00 0.00 O ATOM 669 CB ARG B 43 24.232 -3.434 -2.650 1.00 0.00 C ATOM 670 CG ARG B 43 24.106 -3.259 -1.135 1.00 0.00 C ATOM 671 CD ARG B 43 23.388 -1.949 -0.832 1.00 0.00 C ATOM 672 NE ARG B 43 24.110 -0.796 -1.386 1.00 0.00 N ATOM 673 CZ ARG B 43 23.537 0.213 -2.052 1.00 0.00 C ATOM 674 NH1 ARG B 43 22.220 0.251 -2.245 1.00 0.00 N ATOM 675 NH2 ARG B 43 24.288 1.199 -2.532 1.00 0.00 N ATOM 0 H ARG B 43 23.079 -5.566 -1.834 1.00 0.00 H new ATOM 0 HA ARG B 43 24.822 -4.888 -4.108 1.00 0.00 H new ATOM 0 HB2 ARG B 43 24.971 -2.731 -3.035 1.00 0.00 H new ATOM 0 HB3 ARG B 43 23.281 -3.187 -3.123 1.00 0.00 H new ATOM 0 HG2 ARG B 43 23.555 -4.096 -0.706 1.00 0.00 H new ATOM 0 HG3 ARG B 43 25.094 -3.259 -0.675 1.00 0.00 H new ATOM 0 HD2 ARG B 43 22.380 -1.981 -1.246 1.00 0.00 H new ATOM 0 HD3 ARG B 43 23.285 -1.831 0.247 1.00 0.00 H new ATOM 0 HE ARG B 43 25.121 -0.762 -1.253 1.00 0.00 H new ATOM 0 HH11 ARG B 43 21.630 -0.498 -1.882 1.00 0.00 H new ATOM 0 HH12 ARG B 43 21.802 1.029 -2.755 1.00 0.00 H new ATOM 0 HH21 ARG B 43 25.298 1.185 -2.392 1.00 0.00 H new ATOM 0 HH22 ARG B 43 23.854 1.970 -3.040 1.00 0.00 H new ATOM 689 N GLU B 44 25.941 -6.390 -1.651 1.00 0.00 N ATOM 690 CA GLU B 44 27.131 -6.926 -0.998 1.00 0.00 C ATOM 691 C GLU B 44 27.413 -8.370 -1.416 1.00 0.00 C ATOM 692 O GLU B 44 28.506 -8.877 -1.164 1.00 0.00 O ATOM 693 CB GLU B 44 26.959 -6.846 0.518 1.00 0.00 C ATOM 694 CG GLU B 44 26.828 -5.398 0.993 1.00 0.00 C ATOM 695 CD GLU B 44 26.732 -5.330 2.517 1.00 0.00 C ATOM 696 OE1 GLU B 44 27.803 -5.328 3.162 1.00 0.00 O ATOM 697 OE2 GLU B 44 25.591 -5.280 3.025 1.00 0.00 O ATOM 0 H GLU B 44 25.099 -6.942 -1.487 1.00 0.00 H new ATOM 0 HA GLU B 44 27.985 -6.324 -1.310 1.00 0.00 H new ATOM 0 HB2 GLU B 44 26.074 -7.409 0.815 1.00 0.00 H new ATOM 0 HB3 GLU B 44 27.813 -7.314 1.007 1.00 0.00 H new ATOM 0 HG2 GLU B 44 27.687 -4.820 0.653 1.00 0.00 H new ATOM 0 HG3 GLU B 44 25.942 -4.944 0.548 1.00 0.00 H new ATOM 704 N THR B 45 26.447 -9.045 -2.050 1.00 0.00 N ATOM 705 CA THR B 45 26.628 -10.414 -2.529 1.00 0.00 C ATOM 706 C THR B 45 26.259 -10.538 -3.995 1.00 0.00 C ATOM 707 O THR B 45 26.590 -11.540 -4.628 1.00 0.00 O ATOM 708 CB THR B 45 25.774 -11.394 -1.728 1.00 0.00 C ATOM 709 OG1 THR B 45 24.422 -11.251 -2.089 1.00 0.00 O ATOM 710 CG2 THR B 45 25.905 -11.123 -0.240 1.00 0.00 C ATOM 0 H THR B 45 25.524 -8.657 -2.243 1.00 0.00 H new ATOM 0 HA THR B 45 27.683 -10.657 -2.399 1.00 0.00 H new ATOM 0 HB THR B 45 26.120 -12.404 -1.946 1.00 0.00 H new ATOM 0 HG1 THR B 45 23.877 -11.883 -1.574 1.00 0.00 H new ATOM 0 HG21 THR B 45 25.289 -11.831 0.314 1.00 0.00 H new ATOM 0 HG22 THR B 45 26.947 -11.235 0.060 1.00 0.00 H new ATOM 0 HG23 THR B 45 25.573 -10.107 -0.025 1.00 0.00 H new ATOM 718 N ASN B 46 25.575 -9.527 -4.537 1.00 0.00 N ATOM 719 CA ASN B 46 25.173 -9.519 -5.931 1.00 0.00 C ATOM 720 C ASN B 46 24.222 -10.675 -6.263 1.00 0.00 C ATOM 721 O ASN B 46 23.961 -10.946 -7.433 1.00 0.00 O ATOM 722 CB ASN B 46 26.437 -9.486 -6.788 1.00 0.00 C ATOM 723 CG ASN B 46 26.211 -8.758 -8.105 1.00 0.00 C ATOM 724 OD1 ASN B 46 26.124 -9.375 -9.161 1.00 0.00 O ATOM 725 ND2 ASN B 46 26.113 -7.432 -8.052 1.00 0.00 N ATOM 0 H ASN B 46 25.289 -8.697 -4.017 1.00 0.00 H new ATOM 0 HA ASN B 46 24.587 -8.627 -6.153 1.00 0.00 H new ATOM 0 HB2 ASN B 46 27.238 -8.995 -6.235 1.00 0.00 H new ATOM 0 HB3 ASN B 46 26.766 -10.506 -6.989 1.00 0.00 H new ATOM 0 HD21 ASN B 46 25.961 -6.897 -8.907 1.00 0.00 H new ATOM 0 HD22 ASN B 46 26.190 -6.950 -7.156 1.00 0.00 H new ATOM 732 N LYS B 47 23.700 -11.354 -5.237 1.00 0.00 N ATOM 733 CA LYS B 47 22.726 -12.424 -5.400 1.00 0.00 C ATOM 734 C LYS B 47 21.355 -11.813 -5.594 1.00 0.00 C ATOM 735 O LYS B 47 21.022 -10.810 -4.967 1.00 0.00 O ATOM 736 CB LYS B 47 22.717 -13.325 -4.167 1.00 0.00 C ATOM 737 CG LYS B 47 24.014 -14.124 -4.105 1.00 0.00 C ATOM 738 CD LYS B 47 23.927 -15.414 -4.919 1.00 0.00 C ATOM 739 CE LYS B 47 25.254 -16.163 -4.807 1.00 0.00 C ATOM 740 NZ LYS B 47 26.339 -15.449 -5.510 1.00 0.00 N ATOM 0 H LYS B 47 23.947 -11.171 -4.264 1.00 0.00 H new ATOM 0 HA LYS B 47 22.993 -13.026 -6.269 1.00 0.00 H new ATOM 0 HB2 LYS B 47 22.606 -12.723 -3.265 1.00 0.00 H new ATOM 0 HB3 LYS B 47 21.863 -14.002 -4.205 1.00 0.00 H new ATOM 0 HG2 LYS B 47 24.835 -13.513 -4.480 1.00 0.00 H new ATOM 0 HG3 LYS B 47 24.243 -14.364 -3.067 1.00 0.00 H new ATOM 0 HD2 LYS B 47 23.111 -16.037 -4.552 1.00 0.00 H new ATOM 0 HD3 LYS B 47 23.710 -15.187 -5.963 1.00 0.00 H new ATOM 0 HE2 LYS B 47 25.517 -16.284 -3.756 1.00 0.00 H new ATOM 0 HE3 LYS B 47 25.145 -17.164 -5.225 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 27.144 -16.093 -5.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 25.995 -15.117 -6.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 26.644 -14.634 -4.941 1.00 0.00 H new ATOM 754 N SER B 48 20.558 -12.429 -6.463 1.00 0.00 N ATOM 755 CA SER B 48 19.210 -11.965 -6.739 1.00 0.00 C ATOM 756 C SER B 48 18.409 -11.812 -5.446 1.00 0.00 C ATOM 757 O SER B 48 18.483 -12.656 -4.556 1.00 0.00 O ATOM 758 CB SER B 48 18.513 -12.938 -7.692 1.00 0.00 C ATOM 759 OG SER B 48 19.310 -13.124 -8.842 1.00 0.00 O ATOM 0 H SER B 48 20.830 -13.258 -6.991 1.00 0.00 H new ATOM 0 HA SER B 48 19.269 -10.985 -7.212 1.00 0.00 H new ATOM 0 HB2 SER B 48 18.345 -13.893 -7.195 1.00 0.00 H new ATOM 0 HB3 SER B 48 17.534 -12.549 -7.974 1.00 0.00 H new ATOM 0 HG SER B 48 18.864 -13.748 -9.452 1.00 0.00 H new ATOM 765 N ARG B 49 17.644 -10.721 -5.354 1.00 0.00 N ATOM 766 CA ARG B 49 16.783 -10.428 -4.215 1.00 0.00 C ATOM 767 C ARG B 49 15.603 -11.396 -4.191 1.00 0.00 C ATOM 768 O ARG B 49 14.854 -11.444 -3.217 1.00 0.00 O ATOM 769 CB ARG B 49 16.230 -9.010 -4.360 1.00 0.00 C ATOM 770 CG ARG B 49 17.286 -7.905 -4.379 1.00 0.00 C ATOM 771 CD ARG B 49 17.749 -7.480 -2.993 1.00 0.00 C ATOM 772 NE ARG B 49 16.703 -6.742 -2.275 1.00 0.00 N ATOM 773 CZ ARG B 49 16.474 -5.438 -2.447 1.00 0.00 C ATOM 774 NH1 ARG B 49 17.202 -4.735 -3.309 1.00 0.00 N ATOM 775 NH2 ARG B 49 15.516 -4.832 -1.757 1.00 0.00 N ATOM 0 H ARG B 49 17.608 -10.008 -6.082 1.00 0.00 H new ATOM 0 HA ARG B 49 17.363 -10.526 -3.297 1.00 0.00 H new ATOM 0 HB2 ARG B 49 15.651 -8.954 -5.282 1.00 0.00 H new ATOM 0 HB3 ARG B 49 15.540 -8.819 -3.538 1.00 0.00 H new ATOM 0 HG2 ARG B 49 18.148 -8.248 -4.952 1.00 0.00 H new ATOM 0 HG3 ARG B 49 16.882 -7.037 -4.900 1.00 0.00 H new ATOM 0 HD2 ARG B 49 18.033 -8.361 -2.418 1.00 0.00 H new ATOM 0 HD3 ARG B 49 18.639 -6.857 -3.082 1.00 0.00 H new ATOM 0 HE ARG B 49 16.121 -7.252 -1.610 1.00 0.00 H new ATOM 0 HH11 ARG B 49 17.941 -5.192 -3.844 1.00 0.00 H new ATOM 0 HH12 ARG B 49 17.022 -3.739 -3.436 1.00 0.00 H new ATOM 0 HH21 ARG B 49 14.952 -5.363 -1.093 1.00 0.00 H new ATOM 0 HH22 ARG B 49 15.344 -3.836 -1.891 1.00 0.00 H new ATOM 789 N GLY B 50 15.443 -12.163 -5.273 1.00 0.00 N ATOM 790 CA GLY B 50 14.335 -13.089 -5.443 1.00 0.00 C ATOM 791 C GLY B 50 13.170 -12.435 -6.182 1.00 0.00 C ATOM 792 O GLY B 50 12.144 -13.082 -6.374 1.00 0.00 O ATOM 0 H GLY B 50 16.090 -12.154 -6.061 1.00 0.00 H new ATOM 0 HA2 GLY B 50 14.673 -13.965 -5.996 1.00 0.00 H new ATOM 0 HA3 GLY B 50 13.998 -13.439 -4.467 1.00 0.00 H new ATOM 796 N PHE B 51 13.303 -11.169 -6.596 1.00 0.00 N ATOM 797 CA PHE B 51 12.259 -10.498 -7.357 1.00 0.00 C ATOM 798 C PHE B 51 12.869 -9.626 -8.449 1.00 0.00 C ATOM 799 O PHE B 51 14.038 -9.240 -8.371 1.00 0.00 O ATOM 800 CB PHE B 51 11.337 -9.704 -6.424 1.00 0.00 C ATOM 801 CG PHE B 51 11.931 -8.447 -5.830 1.00 0.00 C ATOM 802 CD1 PHE B 51 12.802 -8.523 -4.731 1.00 0.00 C ATOM 803 CD2 PHE B 51 11.596 -7.198 -6.369 1.00 0.00 C ATOM 804 CE1 PHE B 51 13.338 -7.349 -4.177 1.00 0.00 C ATOM 805 CE2 PHE B 51 12.116 -6.029 -5.802 1.00 0.00 C ATOM 806 CZ PHE B 51 12.995 -6.106 -4.719 1.00 0.00 C ATOM 0 H PHE B 51 14.126 -10.594 -6.413 1.00 0.00 H new ATOM 0 HA PHE B 51 11.643 -11.249 -7.852 1.00 0.00 H new ATOM 0 HB2 PHE B 51 10.437 -9.433 -6.977 1.00 0.00 H new ATOM 0 HB3 PHE B 51 11.026 -10.357 -5.609 1.00 0.00 H new ATOM 0 HD1 PHE B 51 13.060 -9.484 -4.312 1.00 0.00 H new ATOM 0 HD2 PHE B 51 10.936 -7.137 -7.222 1.00 0.00 H new ATOM 0 HE1 PHE B 51 14.013 -7.406 -3.336 1.00 0.00 H new ATOM 0 HE2 PHE B 51 11.837 -5.066 -6.202 1.00 0.00 H new ATOM 0 HZ PHE B 51 13.411 -5.202 -4.299 1.00 0.00 H new ATOM 816 N ALA B 52 12.071 -9.308 -9.473 1.00 0.00 N ATOM 817 CA ALA B 52 12.525 -8.549 -10.625 1.00 0.00 C ATOM 818 C ALA B 52 11.350 -7.835 -11.292 1.00 0.00 C ATOM 819 O ALA B 52 10.217 -7.930 -10.825 1.00 0.00 O ATOM 820 CB ALA B 52 13.173 -9.528 -11.604 1.00 0.00 C ATOM 0 H ALA B 52 11.088 -9.575 -9.519 1.00 0.00 H new ATOM 0 HA ALA B 52 13.243 -7.789 -10.315 1.00 0.00 H new ATOM 0 HB1 ALA B 52 13.525 -8.986 -12.482 1.00 0.00 H new ATOM 0 HB2 ALA B 52 14.016 -10.022 -11.121 1.00 0.00 H new ATOM 0 HB3 ALA B 52 12.441 -10.276 -11.909 1.00 0.00 H new ATOM 826 N PHE B 53 11.621 -7.120 -12.389 1.00 0.00 N ATOM 827 CA PHE B 53 10.599 -6.407 -13.138 1.00 0.00 C ATOM 828 C PHE B 53 10.883 -6.487 -14.637 1.00 0.00 C ATOM 829 O PHE B 53 12.001 -6.798 -15.046 1.00 0.00 O ATOM 830 CB PHE B 53 10.522 -4.943 -12.692 1.00 0.00 C ATOM 831 CG PHE B 53 10.247 -4.748 -11.224 1.00 0.00 C ATOM 832 CD1 PHE B 53 11.299 -4.879 -10.309 1.00 0.00 C ATOM 833 CD2 PHE B 53 8.958 -4.436 -10.780 1.00 0.00 C ATOM 834 CE1 PHE B 53 11.055 -4.722 -8.939 1.00 0.00 C ATOM 835 CE2 PHE B 53 8.714 -4.276 -9.411 1.00 0.00 C ATOM 836 CZ PHE B 53 9.761 -4.432 -8.490 1.00 0.00 C ATOM 0 H PHE B 53 12.559 -7.024 -12.777 1.00 0.00 H new ATOM 0 HA PHE B 53 9.638 -6.880 -12.937 1.00 0.00 H new ATOM 0 HB2 PHE B 53 11.463 -4.451 -12.940 1.00 0.00 H new ATOM 0 HB3 PHE B 53 9.740 -4.443 -13.264 1.00 0.00 H new ATOM 0 HD1 PHE B 53 12.296 -5.101 -10.659 1.00 0.00 H new ATOM 0 HD2 PHE B 53 8.154 -4.319 -11.491 1.00 0.00 H new ATOM 0 HE1 PHE B 53 11.863 -4.824 -8.230 1.00 0.00 H new ATOM 0 HE2 PHE B 53 7.721 -4.033 -9.064 1.00 0.00 H new ATOM 0 HZ PHE B 53 9.568 -4.328 -7.432 1.00 0.00 H new ATOM 846 N VAL B 54 9.872 -6.205 -15.460 1.00 0.00 N ATOM 847 CA VAL B 54 10.025 -6.195 -16.907 1.00 0.00 C ATOM 848 C VAL B 54 9.006 -5.253 -17.526 1.00 0.00 C ATOM 849 O VAL B 54 7.879 -5.171 -17.044 1.00 0.00 O ATOM 850 CB VAL B 54 9.867 -7.612 -17.474 1.00 0.00 C ATOM 851 CG1 VAL B 54 8.620 -8.303 -17.001 1.00 0.00 C ATOM 852 CG2 VAL B 54 9.885 -7.630 -19.001 1.00 0.00 C ATOM 0 H VAL B 54 8.930 -5.979 -15.140 1.00 0.00 H new ATOM 0 HA VAL B 54 11.026 -5.841 -17.155 1.00 0.00 H new ATOM 0 HB VAL B 54 10.731 -8.157 -17.093 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.568 -9.300 -17.438 1.00 0.00 H new ATOM 0 HG12 VAL B 54 8.639 -8.384 -15.914 1.00 0.00 H new ATOM 0 HG13 VAL B 54 7.747 -7.727 -17.307 1.00 0.00 H new ATOM 0 HG21 VAL B 54 9.770 -8.655 -19.354 1.00 0.00 H new ATOM 0 HG22 VAL B 54 9.065 -7.021 -19.382 1.00 0.00 H new ATOM 0 HG23 VAL B 54 10.833 -7.227 -19.358 1.00 0.00 H new ATOM 862 N THR B 55 9.397 -4.550 -18.590 1.00 0.00 N ATOM 863 CA THR B 55 8.498 -3.657 -19.307 1.00 0.00 C ATOM 864 C THR B 55 8.282 -4.155 -20.729 1.00 0.00 C ATOM 865 O THR B 55 9.235 -4.314 -21.489 1.00 0.00 O ATOM 866 CB THR B 55 9.028 -2.223 -19.309 1.00 0.00 C ATOM 867 OG1 THR B 55 9.284 -1.807 -17.985 1.00 0.00 O ATOM 868 CG2 THR B 55 7.985 -1.293 -19.927 1.00 0.00 C ATOM 0 H THR B 55 10.341 -4.586 -18.974 1.00 0.00 H new ATOM 0 HA THR B 55 7.538 -3.654 -18.790 1.00 0.00 H new ATOM 0 HB THR B 55 9.949 -2.185 -19.890 1.00 0.00 H new ATOM 0 HG1 THR B 55 9.625 -0.888 -17.991 1.00 0.00 H new ATOM 0 HG21 THR B 55 8.364 -0.271 -19.928 1.00 0.00 H new ATOM 0 HG22 THR B 55 7.781 -1.605 -20.951 1.00 0.00 H new ATOM 0 HG23 THR B 55 7.066 -1.339 -19.343 1.00 0.00 H new ATOM 876 N PHE B 56 7.018 -4.395 -21.075 1.00 0.00 N ATOM 877 CA PHE B 56 6.614 -4.813 -22.409 1.00 0.00 C ATOM 878 C PHE B 56 6.261 -3.623 -23.299 1.00 0.00 C ATOM 879 O PHE B 56 5.912 -2.551 -22.805 1.00 0.00 O ATOM 880 CB PHE B 56 5.396 -5.723 -22.282 1.00 0.00 C ATOM 881 CG PHE B 56 5.700 -7.095 -21.727 1.00 0.00 C ATOM 882 CD1 PHE B 56 6.204 -7.266 -20.428 1.00 0.00 C ATOM 883 CD2 PHE B 56 5.469 -8.208 -22.543 1.00 0.00 C ATOM 884 CE1 PHE B 56 6.471 -8.553 -19.950 1.00 0.00 C ATOM 885 CE2 PHE B 56 5.721 -9.489 -22.055 1.00 0.00 C ATOM 886 CZ PHE B 56 6.202 -9.669 -20.753 1.00 0.00 C ATOM 0 H PHE B 56 6.238 -4.302 -20.425 1.00 0.00 H new ATOM 0 HA PHE B 56 7.450 -5.336 -22.873 1.00 0.00 H new ATOM 0 HB2 PHE B 56 4.661 -5.239 -21.639 1.00 0.00 H new ATOM 0 HB3 PHE B 56 4.937 -5.835 -23.264 1.00 0.00 H new ATOM 0 HD1 PHE B 56 6.385 -6.406 -19.800 1.00 0.00 H new ATOM 0 HD2 PHE B 56 5.097 -8.075 -23.548 1.00 0.00 H new ATOM 0 HE1 PHE B 56 6.885 -8.687 -18.961 1.00 0.00 H new ATOM 0 HE2 PHE B 56 5.544 -10.348 -22.685 1.00 0.00 H new ATOM 0 HZ PHE B 56 6.365 -10.665 -20.369 1.00 0.00 H new ATOM 896 N GLU B 57 6.348 -3.815 -24.619 1.00 0.00 N ATOM 897 CA GLU B 57 5.923 -2.820 -25.582 1.00 0.00 C ATOM 898 C GLU B 57 4.398 -2.765 -25.679 1.00 0.00 C ATOM 899 O GLU B 57 3.856 -1.740 -26.095 1.00 0.00 O ATOM 900 CB GLU B 57 6.516 -3.161 -26.946 1.00 0.00 C ATOM 901 CG GLU B 57 7.942 -2.625 -27.082 1.00 0.00 C ATOM 902 CD GLU B 57 8.445 -2.657 -28.521 1.00 0.00 C ATOM 903 OE1 GLU B 57 7.609 -2.571 -29.449 1.00 0.00 O ATOM 904 OE2 GLU B 57 9.680 -2.770 -28.684 1.00 0.00 O ATOM 0 H GLU B 57 6.716 -4.668 -25.040 1.00 0.00 H new ATOM 0 HA GLU B 57 6.276 -1.842 -25.255 1.00 0.00 H new ATOM 0 HB2 GLU B 57 6.517 -4.242 -27.084 1.00 0.00 H new ATOM 0 HB3 GLU B 57 5.890 -2.739 -27.733 1.00 0.00 H new ATOM 0 HG2 GLU B 57 7.978 -1.601 -26.711 1.00 0.00 H new ATOM 0 HG3 GLU B 57 8.610 -3.215 -26.454 1.00 0.00 H new ATOM 911 N SER B 58 3.703 -3.844 -25.303 1.00 0.00 N ATOM 912 CA SER B 58 2.249 -3.844 -25.266 1.00 0.00 C ATOM 913 C SER B 58 1.780 -4.146 -23.854 1.00 0.00 C ATOM 914 O SER B 58 2.366 -4.988 -23.174 1.00 0.00 O ATOM 915 CB SER B 58 1.715 -4.868 -26.262 1.00 0.00 C ATOM 916 OG SER B 58 0.317 -5.013 -26.114 1.00 0.00 O ATOM 0 H SER B 58 4.131 -4.726 -25.021 1.00 0.00 H new ATOM 0 HA SER B 58 1.865 -2.864 -25.549 1.00 0.00 H new ATOM 0 HB2 SER B 58 1.949 -4.553 -27.279 1.00 0.00 H new ATOM 0 HB3 SER B 58 2.206 -5.828 -26.105 1.00 0.00 H new ATOM 0 HG SER B 58 -0.014 -5.672 -26.760 1.00 0.00 H new ATOM 922 N PRO B 59 0.719 -3.468 -23.399 1.00 0.00 N ATOM 923 CA PRO B 59 0.206 -3.639 -22.057 1.00 0.00 C ATOM 924 C PRO B 59 -0.515 -4.971 -21.937 1.00 0.00 C ATOM 925 O PRO B 59 -0.808 -5.390 -20.824 1.00 0.00 O ATOM 926 CB PRO B 59 -0.782 -2.494 -21.872 1.00 0.00 C ATOM 927 CG PRO B 59 -1.332 -2.313 -23.278 1.00 0.00 C ATOM 928 CD PRO B 59 -0.077 -2.494 -24.127 1.00 0.00 C ATOM 0 HA PRO B 59 0.998 -3.632 -21.308 1.00 0.00 H new ATOM 0 HB2 PRO B 59 -1.566 -2.744 -21.157 1.00 0.00 H new ATOM 0 HB3 PRO B 59 -0.294 -1.590 -21.506 1.00 0.00 H new ATOM 0 HG2 PRO B 59 -2.097 -3.052 -23.516 1.00 0.00 H new ATOM 0 HG3 PRO B 59 -1.783 -1.330 -23.418 1.00 0.00 H new ATOM 0 HD2 PRO B 59 -0.323 -2.851 -25.127 1.00 0.00 H new ATOM 0 HD3 PRO B 59 0.460 -1.553 -24.247 1.00 0.00 H new ATOM 936 N ALA B 60 -0.804 -5.636 -23.061 1.00 0.00 N ATOM 937 CA ALA B 60 -1.570 -6.870 -23.062 1.00 0.00 C ATOM 938 C ALA B 60 -0.676 -8.057 -23.388 1.00 0.00 C ATOM 939 O ALA B 60 -1.058 -9.203 -23.157 1.00 0.00 O ATOM 940 CB ALA B 60 -2.741 -6.737 -24.030 1.00 0.00 C ATOM 0 H ALA B 60 -0.511 -5.329 -23.988 1.00 0.00 H new ATOM 0 HA ALA B 60 -1.977 -7.054 -22.068 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -3.318 -7.662 -24.033 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -3.380 -5.912 -23.716 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -2.363 -6.542 -25.034 1.00 0.00 H new ATOM 946 N ASP B 61 0.519 -7.794 -23.921 1.00 0.00 N ATOM 947 CA ASP B 61 1.524 -8.830 -24.046 1.00 0.00 C ATOM 948 C ASP B 61 2.030 -9.151 -22.642 1.00 0.00 C ATOM 949 O ASP B 61 2.453 -10.273 -22.366 1.00 0.00 O ATOM 950 CB ASP B 61 2.668 -8.328 -24.918 1.00 0.00 C ATOM 951 CG ASP B 61 2.322 -8.275 -26.408 1.00 0.00 C ATOM 952 OD1 ASP B 61 1.188 -8.664 -26.769 1.00 0.00 O ATOM 953 OD2 ASP B 61 3.204 -7.840 -27.183 1.00 0.00 O ATOM 0 H ASP B 61 0.805 -6.878 -24.268 1.00 0.00 H new ATOM 0 HA ASP B 61 1.108 -9.724 -24.511 1.00 0.00 H new ATOM 0 HB2 ASP B 61 2.958 -7.332 -24.585 1.00 0.00 H new ATOM 0 HB3 ASP B 61 3.533 -8.976 -24.777 1.00 0.00 H new ATOM 958 N ALA B 62 1.983 -8.149 -21.758 1.00 0.00 N ATOM 959 CA ALA B 62 2.326 -8.321 -20.362 1.00 0.00 C ATOM 960 C ALA B 62 1.187 -9.022 -19.627 1.00 0.00 C ATOM 961 O ALA B 62 1.442 -9.775 -18.690 1.00 0.00 O ATOM 962 CB ALA B 62 2.602 -6.955 -19.747 1.00 0.00 C ATOM 0 H ALA B 62 1.704 -7.198 -22.001 1.00 0.00 H new ATOM 0 HA ALA B 62 3.219 -8.940 -20.274 1.00 0.00 H new ATOM 0 HB1 ALA B 62 2.861 -7.075 -18.695 1.00 0.00 H new ATOM 0 HB2 ALA B 62 3.430 -6.480 -20.273 1.00 0.00 H new ATOM 0 HB3 ALA B 62 1.712 -6.331 -19.832 1.00 0.00 H new ATOM 968 N LYS B 63 -0.066 -8.787 -20.038 1.00 0.00 N ATOM 969 CA LYS B 63 -1.199 -9.491 -19.457 1.00 0.00 C ATOM 970 C LYS B 63 -1.122 -10.957 -19.846 1.00 0.00 C ATOM 971 O LYS B 63 -1.425 -11.825 -19.038 1.00 0.00 O ATOM 972 CB LYS B 63 -2.521 -8.924 -19.984 1.00 0.00 C ATOM 973 CG LYS B 63 -2.794 -7.524 -19.436 1.00 0.00 C ATOM 974 CD LYS B 63 -4.024 -6.899 -20.096 1.00 0.00 C ATOM 975 CE LYS B 63 -5.279 -7.735 -19.835 1.00 0.00 C ATOM 976 NZ LYS B 63 -5.652 -7.714 -18.404 1.00 0.00 N ATOM 0 H LYS B 63 -0.312 -8.117 -20.767 1.00 0.00 H new ATOM 0 HA LYS B 63 -1.163 -9.370 -18.374 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -2.494 -8.890 -21.073 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -3.339 -9.589 -19.707 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -2.944 -7.576 -18.358 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -1.925 -6.889 -19.606 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -4.171 -5.889 -19.714 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -3.859 -6.812 -21.170 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -6.105 -7.351 -20.434 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -5.106 -8.763 -20.153 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -6.591 -8.144 -18.284 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -4.952 -8.253 -17.855 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -5.675 -6.731 -18.066 1.00 0.00 H new ATOM 990 N ASP B 64 -0.717 -11.238 -21.082 1.00 0.00 N ATOM 991 CA ASP B 64 -0.669 -12.601 -21.574 1.00 0.00 C ATOM 992 C ASP B 64 0.419 -13.388 -20.856 1.00 0.00 C ATOM 993 O ASP B 64 0.265 -14.585 -20.625 1.00 0.00 O ATOM 994 CB ASP B 64 -0.386 -12.559 -23.070 1.00 0.00 C ATOM 995 CG ASP B 64 -0.604 -13.918 -23.724 1.00 0.00 C ATOM 996 OD1 ASP B 64 -1.762 -14.397 -23.696 1.00 0.00 O ATOM 997 OD2 ASP B 64 0.385 -14.473 -24.252 1.00 0.00 O ATOM 0 H ASP B 64 -0.418 -10.535 -21.758 1.00 0.00 H new ATOM 0 HA ASP B 64 -1.622 -13.096 -21.386 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -1.033 -11.820 -23.542 1.00 0.00 H new ATOM 0 HB3 ASP B 64 0.641 -12.236 -23.237 1.00 0.00 H new ATOM 1002 N ALA B 65 1.515 -12.711 -20.498 1.00 0.00 N ATOM 1003 CA ALA B 65 2.567 -13.335 -19.716 1.00 0.00 C ATOM 1004 C ALA B 65 2.113 -13.479 -18.268 1.00 0.00 C ATOM 1005 O ALA B 65 2.311 -14.520 -17.652 1.00 0.00 O ATOM 1006 CB ALA B 65 3.831 -12.479 -19.787 1.00 0.00 C ATOM 0 H ALA B 65 1.689 -11.735 -20.740 1.00 0.00 H new ATOM 0 HA ALA B 65 2.783 -14.324 -20.119 1.00 0.00 H new ATOM 0 HB1 ALA B 65 4.621 -12.947 -19.200 1.00 0.00 H new ATOM 0 HB2 ALA B 65 4.153 -12.391 -20.825 1.00 0.00 H new ATOM 0 HB3 ALA B 65 3.621 -11.487 -19.387 1.00 0.00 H new ATOM 1012 N ALA B 66 1.498 -12.432 -17.717 1.00 0.00 N ATOM 1013 CA ALA B 66 1.062 -12.433 -16.333 1.00 0.00 C ATOM 1014 C ALA B 66 -0.129 -13.375 -16.136 1.00 0.00 C ATOM 1015 O ALA B 66 -0.541 -13.628 -15.006 1.00 0.00 O ATOM 1016 CB ALA B 66 0.732 -10.989 -15.939 1.00 0.00 C ATOM 0 H ALA B 66 1.292 -11.568 -18.219 1.00 0.00 H new ATOM 0 HA ALA B 66 1.854 -12.807 -15.684 1.00 0.00 H new ATOM 0 HB1 ALA B 66 0.401 -10.962 -14.901 1.00 0.00 H new ATOM 0 HB2 ALA B 66 1.621 -10.369 -16.053 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -0.061 -10.608 -16.583 1.00 0.00 H new ATOM 1022 N ARG B 67 -0.680 -13.891 -17.239 1.00 0.00 N ATOM 1023 CA ARG B 67 -1.739 -14.891 -17.234 1.00 0.00 C ATOM 1024 C ARG B 67 -1.223 -16.285 -17.601 1.00 0.00 C ATOM 1025 O ARG B 67 -2.026 -17.205 -17.730 1.00 0.00 O ATOM 1026 CB ARG B 67 -2.831 -14.451 -18.211 1.00 0.00 C ATOM 1027 CG ARG B 67 -3.579 -13.238 -17.661 1.00 0.00 C ATOM 1028 CD ARG B 67 -4.474 -12.606 -18.727 1.00 0.00 C ATOM 1029 NE ARG B 67 -5.507 -13.547 -19.182 1.00 0.00 N ATOM 1030 CZ ARG B 67 -6.101 -13.504 -20.377 1.00 0.00 C ATOM 1031 NH1 ARG B 67 -5.784 -12.565 -21.267 1.00 0.00 N ATOM 1032 NH2 ARG B 67 -7.023 -14.408 -20.690 1.00 0.00 N ATOM 0 H ARG B 67 -0.392 -13.616 -18.178 1.00 0.00 H new ATOM 0 HA ARG B 67 -2.141 -14.964 -16.223 1.00 0.00 H new ATOM 0 HB2 ARG B 67 -2.387 -14.206 -19.176 1.00 0.00 H new ATOM 0 HB3 ARG B 67 -3.529 -15.271 -18.380 1.00 0.00 H new ATOM 0 HG2 ARG B 67 -4.185 -13.539 -16.806 1.00 0.00 H new ATOM 0 HG3 ARG B 67 -2.863 -12.500 -17.300 1.00 0.00 H new ATOM 0 HD2 ARG B 67 -4.947 -11.710 -18.324 1.00 0.00 H new ATOM 0 HD3 ARG B 67 -3.866 -12.291 -19.575 1.00 0.00 H new ATOM 0 HE ARG B 67 -5.791 -14.286 -18.539 1.00 0.00 H new ATOM 0 HH11 ARG B 67 -5.078 -11.865 -21.040 1.00 0.00 H new ATOM 0 HH12 ARG B 67 -6.247 -12.546 -22.176 1.00 0.00 H new ATOM 0 HH21 ARG B 67 -7.276 -15.133 -20.018 1.00 0.00 H new ATOM 0 HH22 ARG B 67 -7.478 -14.377 -21.602 1.00 0.00 H new ATOM 1046 N ASP B 68 0.091 -16.463 -17.769 1.00 0.00 N ATOM 1047 CA ASP B 68 0.652 -17.725 -18.208 1.00 0.00 C ATOM 1048 C ASP B 68 1.754 -18.145 -17.257 1.00 0.00 C ATOM 1049 O ASP B 68 1.766 -19.258 -16.740 1.00 0.00 O ATOM 1050 CB ASP B 68 1.298 -17.482 -19.568 1.00 0.00 C ATOM 1051 CG ASP B 68 0.446 -18.021 -20.717 1.00 0.00 C ATOM 1052 OD1 ASP B 68 -0.738 -17.629 -20.802 1.00 0.00 O ATOM 1053 OD2 ASP B 68 0.988 -18.831 -21.503 1.00 0.00 O ATOM 0 H ASP B 68 0.785 -15.734 -17.603 1.00 0.00 H new ATOM 0 HA ASP B 68 -0.124 -18.490 -18.248 1.00 0.00 H new ATOM 0 HB2 ASP B 68 1.457 -16.413 -19.707 1.00 0.00 H new ATOM 0 HB3 ASP B 68 2.279 -17.956 -19.592 1.00 0.00 H new ATOM 1058 N MET B 69 2.672 -17.208 -17.047 1.00 0.00 N ATOM 1059 CA MET B 69 3.866 -17.370 -16.251 1.00 0.00 C ATOM 1060 C MET B 69 3.609 -17.160 -14.763 1.00 0.00 C ATOM 1061 O MET B 69 4.478 -17.453 -13.941 1.00 0.00 O ATOM 1062 CB MET B 69 4.850 -16.333 -16.777 1.00 0.00 C ATOM 1063 CG MET B 69 5.775 -16.917 -17.838 1.00 0.00 C ATOM 1064 SD MET B 69 6.779 -18.332 -17.327 1.00 0.00 S ATOM 1065 CE MET B 69 7.607 -17.546 -15.930 1.00 0.00 C ATOM 0 H MET B 69 2.593 -16.274 -17.449 1.00 0.00 H new ATOM 0 HA MET B 69 4.248 -18.387 -16.338 1.00 0.00 H new ATOM 0 HB2 MET B 69 4.300 -15.491 -17.198 1.00 0.00 H new ATOM 0 HB3 MET B 69 5.445 -15.944 -15.950 1.00 0.00 H new ATOM 0 HG2 MET B 69 5.170 -17.217 -18.693 1.00 0.00 H new ATOM 0 HG3 MET B 69 6.444 -16.128 -18.182 1.00 0.00 H new ATOM 0 HE1 MET B 69 8.648 -17.868 -15.895 1.00 0.00 H new ATOM 0 HE2 MET B 69 7.566 -16.463 -16.045 1.00 0.00 H new ATOM 0 HE3 MET B 69 7.108 -17.831 -15.004 1.00 0.00 H new ATOM 1075 N ASN B 70 2.428 -16.657 -14.396 1.00 0.00 N ATOM 1076 CA ASN B 70 2.102 -16.444 -12.999 1.00 0.00 C ATOM 1077 C ASN B 70 1.826 -17.789 -12.332 1.00 0.00 C ATOM 1078 O ASN B 70 1.011 -18.572 -12.816 1.00 0.00 O ATOM 1079 CB ASN B 70 0.904 -15.495 -12.903 1.00 0.00 C ATOM 1080 CG ASN B 70 0.565 -15.137 -11.463 1.00 0.00 C ATOM 1081 OD1 ASN B 70 1.375 -15.324 -10.559 1.00 0.00 O ATOM 1082 ND2 ASN B 70 -0.638 -14.620 -11.240 1.00 0.00 N ATOM 0 H ASN B 70 1.690 -16.393 -15.049 1.00 0.00 H new ATOM 0 HA ASN B 70 2.938 -15.982 -12.474 1.00 0.00 H new ATOM 0 HB2 ASN B 70 1.120 -14.584 -13.461 1.00 0.00 H new ATOM 0 HB3 ASN B 70 0.037 -15.959 -13.374 1.00 0.00 H new ATOM 0 HD21 ASN B 70 -0.915 -14.364 -10.292 1.00 0.00 H new ATOM 0 HD22 ASN B 70 -1.284 -14.479 -12.016 1.00 0.00 H new ATOM 1089 N GLY B 71 2.513 -18.052 -11.218 1.00 0.00 N ATOM 1090 CA GLY B 71 2.350 -19.288 -10.463 1.00 0.00 C ATOM 1091 C GLY B 71 3.237 -20.411 -10.998 1.00 0.00 C ATOM 1092 O GLY B 71 3.322 -21.470 -10.378 1.00 0.00 O ATOM 0 H GLY B 71 3.198 -17.411 -10.817 1.00 0.00 H new ATOM 0 HA2 GLY B 71 2.589 -19.106 -9.415 1.00 0.00 H new ATOM 0 HA3 GLY B 71 1.307 -19.601 -10.502 1.00 0.00 H new ATOM 1096 N LYS B 72 3.899 -20.191 -12.139 1.00 0.00 N ATOM 1097 CA LYS B 72 4.848 -21.112 -12.718 1.00 0.00 C ATOM 1098 C LYS B 72 6.204 -20.933 -12.064 1.00 0.00 C ATOM 1099 O LYS B 72 6.303 -20.434 -10.949 1.00 0.00 O ATOM 1100 CB LYS B 72 4.939 -20.813 -14.206 1.00 0.00 C ATOM 1101 CG LYS B 72 3.579 -20.767 -14.903 1.00 0.00 C ATOM 1102 CD LYS B 72 2.814 -22.082 -14.728 1.00 0.00 C ATOM 1103 CE LYS B 72 1.489 -22.006 -15.479 1.00 0.00 C ATOM 1104 NZ LYS B 72 0.721 -23.255 -15.336 1.00 0.00 N ATOM 0 H LYS B 72 3.777 -19.341 -12.690 1.00 0.00 H new ATOM 0 HA LYS B 72 4.527 -22.142 -12.560 1.00 0.00 H new ATOM 0 HB2 LYS B 72 5.443 -19.857 -14.346 1.00 0.00 H new ATOM 0 HB3 LYS B 72 5.558 -21.572 -14.684 1.00 0.00 H new ATOM 0 HG2 LYS B 72 2.989 -19.945 -14.498 1.00 0.00 H new ATOM 0 HG3 LYS B 72 3.720 -20.565 -15.965 1.00 0.00 H new ATOM 0 HD2 LYS B 72 3.410 -22.914 -15.104 1.00 0.00 H new ATOM 0 HD3 LYS B 72 2.634 -22.272 -13.670 1.00 0.00 H new ATOM 0 HE2 LYS B 72 0.901 -21.170 -15.100 1.00 0.00 H new ATOM 0 HE3 LYS B 72 1.677 -21.811 -16.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 -0.175 -23.173 -15.857 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 1.274 -24.048 -15.720 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 0.522 -23.427 -14.330 1.00 0.00 H new ATOM 1118 N SER B 73 7.250 -21.348 -12.777 1.00 0.00 N ATOM 1119 CA SER B 73 8.613 -21.348 -12.280 1.00 0.00 C ATOM 1120 C SER B 73 9.567 -20.781 -13.316 1.00 0.00 C ATOM 1121 O SER B 73 9.307 -20.851 -14.517 1.00 0.00 O ATOM 1122 CB SER B 73 8.943 -22.785 -11.926 1.00 0.00 C ATOM 1123 OG SER B 73 10.215 -22.887 -11.332 1.00 0.00 O ATOM 0 H SER B 73 7.166 -21.698 -13.731 1.00 0.00 H new ATOM 0 HA SER B 73 8.717 -20.711 -11.402 1.00 0.00 H new ATOM 0 HB2 SER B 73 8.188 -23.176 -11.244 1.00 0.00 H new ATOM 0 HB3 SER B 73 8.909 -23.400 -12.825 1.00 0.00 H new ATOM 0 HG SER B 73 10.400 -23.824 -11.113 1.00 0.00 H new ATOM 1129 N LEU B 74 10.679 -20.216 -12.836 1.00 0.00 N ATOM 1130 CA LEU B 74 11.625 -19.564 -13.728 1.00 0.00 C ATOM 1131 C LEU B 74 12.803 -20.474 -14.029 1.00 0.00 C ATOM 1132 O LEU B 74 12.976 -20.942 -15.153 1.00 0.00 O ATOM 1133 CB LEU B 74 12.109 -18.243 -13.121 1.00 0.00 C ATOM 1134 CG LEU B 74 12.527 -17.210 -14.169 1.00 0.00 C ATOM 1135 CD1 LEU B 74 13.586 -17.715 -15.147 1.00 0.00 C ATOM 1136 CD2 LEU B 74 11.296 -16.763 -14.943 1.00 0.00 C ATOM 0 H LEU B 74 10.938 -20.200 -11.850 1.00 0.00 H new ATOM 0 HA LEU B 74 11.114 -19.350 -14.667 1.00 0.00 H new ATOM 0 HB2 LEU B 74 11.315 -17.823 -12.504 1.00 0.00 H new ATOM 0 HB3 LEU B 74 12.953 -18.443 -12.461 1.00 0.00 H new ATOM 0 HG LEU B 74 12.981 -16.380 -13.628 1.00 0.00 H new ATOM 0 HD11 LEU B 74 13.830 -16.926 -15.859 1.00 0.00 H new ATOM 0 HD12 LEU B 74 14.484 -17.998 -14.597 1.00 0.00 H new ATOM 0 HD13 LEU B 74 13.201 -18.582 -15.684 1.00 0.00 H new ATOM 0 HD21 LEU B 74 11.585 -16.026 -15.692 1.00 0.00 H new ATOM 0 HD22 LEU B 74 10.844 -17.624 -15.436 1.00 0.00 H new ATOM 0 HD23 LEU B 74 10.576 -16.318 -14.256 1.00 0.00 H new ATOM 1148 N ASP B 75 13.608 -20.710 -12.996 1.00 0.00 N ATOM 1149 CA ASP B 75 14.828 -21.488 -13.096 1.00 0.00 C ATOM 1150 C ASP B 75 14.744 -22.727 -12.229 1.00 0.00 C ATOM 1151 O ASP B 75 15.719 -23.455 -12.060 1.00 0.00 O ATOM 1152 CB ASP B 75 15.998 -20.608 -12.677 1.00 0.00 C ATOM 1153 CG ASP B 75 17.320 -21.144 -13.223 1.00 0.00 C ATOM 1154 OD1 ASP B 75 17.466 -21.143 -14.465 1.00 0.00 O ATOM 1155 OD2 ASP B 75 18.170 -21.547 -12.401 1.00 0.00 O ATOM 0 H ASP B 75 13.424 -20.359 -12.056 1.00 0.00 H new ATOM 0 HA ASP B 75 14.972 -21.820 -14.124 1.00 0.00 H new ATOM 0 HB2 ASP B 75 15.839 -19.592 -13.038 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.046 -20.557 -11.589 1.00 0.00 H new ATOM 1160 N GLY B 76 13.555 -22.951 -11.676 1.00 0.00 N ATOM 1161 CA GLY B 76 13.326 -24.056 -10.774 1.00 0.00 C ATOM 1162 C GLY B 76 12.591 -23.588 -9.526 1.00 0.00 C ATOM 1163 O GLY B 76 12.179 -24.402 -8.702 1.00 0.00 O ATOM 0 H GLY B 76 12.733 -22.371 -11.844 1.00 0.00 H new ATOM 0 HA2 GLY B 76 12.744 -24.828 -11.277 1.00 0.00 H new ATOM 0 HA3 GLY B 76 14.278 -24.507 -10.494 1.00 0.00 H new ATOM 1167 N LYS B 77 12.430 -22.267 -9.395 1.00 0.00 N ATOM 1168 CA LYS B 77 11.769 -21.639 -8.268 1.00 0.00 C ATOM 1169 C LYS B 77 10.483 -20.990 -8.750 1.00 0.00 C ATOM 1170 O LYS B 77 10.480 -20.290 -9.763 1.00 0.00 O ATOM 1171 CB LYS B 77 12.708 -20.630 -7.601 1.00 0.00 C ATOM 1172 CG LYS B 77 14.055 -21.279 -7.266 1.00 0.00 C ATOM 1173 CD LYS B 77 13.916 -22.500 -6.354 1.00 0.00 C ATOM 1174 CE LYS B 77 15.223 -23.288 -6.382 1.00 0.00 C ATOM 1175 NZ LYS B 77 15.176 -24.430 -5.449 1.00 0.00 N ATOM 0 H LYS B 77 12.766 -21.599 -10.089 1.00 0.00 H new ATOM 0 HA LYS B 77 11.515 -22.385 -7.515 1.00 0.00 H new ATOM 0 HB2 LYS B 77 12.864 -19.779 -8.264 1.00 0.00 H new ATOM 0 HB3 LYS B 77 12.248 -20.245 -6.691 1.00 0.00 H new ATOM 0 HG2 LYS B 77 14.549 -21.577 -8.191 1.00 0.00 H new ATOM 0 HG3 LYS B 77 14.698 -20.543 -6.784 1.00 0.00 H new ATOM 0 HD2 LYS B 77 13.687 -22.186 -5.336 1.00 0.00 H new ATOM 0 HD3 LYS B 77 13.090 -23.128 -6.688 1.00 0.00 H new ATOM 0 HE2 LYS B 77 15.412 -23.648 -7.393 1.00 0.00 H new ATOM 0 HE3 LYS B 77 16.052 -22.632 -6.117 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 16.077 -24.948 -5.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 15.019 -24.082 -4.482 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 14.399 -25.066 -5.718 1.00 0.00 H new ATOM 1189 N ALA B 78 9.394 -21.228 -8.023 1.00 0.00 N ATOM 1190 CA ALA B 78 8.085 -20.777 -8.448 1.00 0.00 C ATOM 1191 C ALA B 78 7.904 -19.281 -8.197 1.00 0.00 C ATOM 1192 O ALA B 78 8.272 -18.773 -7.140 1.00 0.00 O ATOM 1193 CB ALA B 78 7.006 -21.607 -7.762 1.00 0.00 C ATOM 0 H ALA B 78 9.399 -21.732 -7.136 1.00 0.00 H new ATOM 0 HA ALA B 78 7.993 -20.923 -9.524 1.00 0.00 H new ATOM 0 HB1 ALA B 78 6.023 -21.264 -8.085 1.00 0.00 H new ATOM 0 HB2 ALA B 78 7.130 -22.657 -8.029 1.00 0.00 H new ATOM 0 HB3 ALA B 78 7.093 -21.495 -6.681 1.00 0.00 H new ATOM 1199 N ILE B 79 7.328 -18.588 -9.183 1.00 0.00 N ATOM 1200 CA ILE B 79 7.210 -17.139 -9.161 1.00 0.00 C ATOM 1201 C ILE B 79 5.769 -16.640 -9.123 1.00 0.00 C ATOM 1202 O ILE B 79 4.811 -17.407 -9.198 1.00 0.00 O ATOM 1203 CB ILE B 79 7.917 -16.536 -10.381 1.00 0.00 C ATOM 1204 CG1 ILE B 79 7.116 -16.798 -11.665 1.00 0.00 C ATOM 1205 CG2 ILE B 79 9.333 -17.090 -10.515 1.00 0.00 C ATOM 1206 CD1 ILE B 79 7.734 -16.051 -12.841 1.00 0.00 C ATOM 0 H ILE B 79 6.932 -19.022 -10.017 1.00 0.00 H new ATOM 0 HA ILE B 79 7.684 -16.813 -8.235 1.00 0.00 H new ATOM 0 HB ILE B 79 7.981 -15.458 -10.232 1.00 0.00 H new ATOM 0 HG12 ILE B 79 7.095 -17.867 -11.876 1.00 0.00 H new ATOM 0 HG13 ILE B 79 6.082 -16.480 -11.527 1.00 0.00 H new ATOM 0 HG21 ILE B 79 9.815 -16.648 -11.387 1.00 0.00 H new ATOM 0 HG22 ILE B 79 9.906 -16.845 -9.621 1.00 0.00 H new ATOM 0 HG23 ILE B 79 9.290 -18.173 -10.633 1.00 0.00 H new ATOM 0 HD11 ILE B 79 7.154 -16.248 -13.743 1.00 0.00 H new ATOM 0 HD12 ILE B 79 7.731 -14.981 -12.634 1.00 0.00 H new ATOM 0 HD13 ILE B 79 8.760 -16.389 -12.988 1.00 0.00 H new ATOM 1218 N LYS B 80 5.658 -15.316 -9.011 1.00 0.00 N ATOM 1219 CA LYS B 80 4.433 -14.554 -9.137 1.00 0.00 C ATOM 1220 C LYS B 80 4.631 -13.564 -10.275 1.00 0.00 C ATOM 1221 O LYS B 80 5.713 -12.995 -10.400 1.00 0.00 O ATOM 1222 CB LYS B 80 4.170 -13.802 -7.829 1.00 0.00 C ATOM 1223 CG LYS B 80 2.770 -13.179 -7.844 1.00 0.00 C ATOM 1224 CD LYS B 80 2.511 -12.366 -6.573 1.00 0.00 C ATOM 1225 CE LYS B 80 3.367 -11.102 -6.538 1.00 0.00 C ATOM 1226 NZ LYS B 80 3.227 -10.407 -5.243 1.00 0.00 N ATOM 0 H LYS B 80 6.466 -14.724 -8.820 1.00 0.00 H new ATOM 0 HA LYS B 80 3.583 -15.205 -9.341 1.00 0.00 H new ATOM 0 HB2 LYS B 80 4.262 -14.485 -6.984 1.00 0.00 H new ATOM 0 HB3 LYS B 80 4.920 -13.023 -7.693 1.00 0.00 H new ATOM 0 HG2 LYS B 80 2.665 -12.536 -8.718 1.00 0.00 H new ATOM 0 HG3 LYS B 80 2.020 -13.965 -7.935 1.00 0.00 H new ATOM 0 HD2 LYS B 80 1.457 -12.095 -6.521 1.00 0.00 H new ATOM 0 HD3 LYS B 80 2.727 -12.978 -5.697 1.00 0.00 H new ATOM 0 HE2 LYS B 80 4.412 -11.361 -6.705 1.00 0.00 H new ATOM 0 HE3 LYS B 80 3.071 -10.435 -7.347 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 3.831 -9.560 -5.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 2.235 -10.126 -5.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 3.516 -11.044 -4.474 1.00 0.00 H new ATOM 1240 N VAL B 81 3.603 -13.351 -11.098 1.00 0.00 N ATOM 1241 CA VAL B 81 3.678 -12.370 -12.170 1.00 0.00 C ATOM 1242 C VAL B 81 2.409 -11.540 -12.156 1.00 0.00 C ATOM 1243 O VAL B 81 1.304 -12.077 -12.214 1.00 0.00 O ATOM 1244 CB VAL B 81 3.906 -13.048 -13.522 1.00 0.00 C ATOM 1245 CG1 VAL B 81 4.068 -11.987 -14.609 1.00 0.00 C ATOM 1246 CG2 VAL B 81 5.173 -13.899 -13.491 1.00 0.00 C ATOM 0 H VAL B 81 2.713 -13.846 -11.039 1.00 0.00 H new ATOM 0 HA VAL B 81 4.532 -11.712 -12.011 1.00 0.00 H new ATOM 0 HB VAL B 81 3.045 -13.683 -13.733 1.00 0.00 H new ATOM 0 HG11 VAL B 81 4.230 -12.473 -15.571 1.00 0.00 H new ATOM 0 HG12 VAL B 81 3.166 -11.376 -14.659 1.00 0.00 H new ATOM 0 HG13 VAL B 81 4.923 -11.353 -14.374 1.00 0.00 H new ATOM 0 HG21 VAL B 81 5.317 -14.373 -14.462 1.00 0.00 H new ATOM 0 HG22 VAL B 81 6.031 -13.266 -13.265 1.00 0.00 H new ATOM 0 HG23 VAL B 81 5.077 -14.667 -12.724 1.00 0.00 H new ATOM 1256 N GLU B 82 2.574 -10.220 -12.076 1.00 0.00 N ATOM 1257 CA GLU B 82 1.454 -9.300 -11.953 1.00 0.00 C ATOM 1258 C GLU B 82 1.911 -7.912 -12.394 1.00 0.00 C ATOM 1259 O GLU B 82 3.109 -7.660 -12.460 1.00 0.00 O ATOM 1260 CB GLU B 82 1.008 -9.287 -10.482 1.00 0.00 C ATOM 1261 CG GLU B 82 -0.242 -8.440 -10.234 1.00 0.00 C ATOM 1262 CD GLU B 82 -1.411 -8.891 -11.107 1.00 0.00 C ATOM 1263 OE1 GLU B 82 -2.155 -9.791 -10.658 1.00 0.00 O ATOM 1264 OE2 GLU B 82 -1.551 -8.329 -12.216 1.00 0.00 O ATOM 0 H GLU B 82 3.486 -9.764 -12.095 1.00 0.00 H new ATOM 0 HA GLU B 82 0.617 -9.607 -12.580 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.815 -10.310 -10.160 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.823 -8.907 -9.866 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -0.525 -8.507 -9.184 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -0.018 -7.393 -10.437 1.00 0.00 H new ATOM 1271 N GLN B 83 0.986 -6.998 -12.697 1.00 0.00 N ATOM 1272 CA GLN B 83 1.359 -5.625 -12.979 1.00 0.00 C ATOM 1273 C GLN B 83 2.044 -5.060 -11.732 1.00 0.00 C ATOM 1274 O GLN B 83 1.554 -5.233 -10.617 1.00 0.00 O ATOM 1275 CB GLN B 83 0.104 -4.836 -13.359 1.00 0.00 C ATOM 1276 CG GLN B 83 0.288 -3.319 -13.279 1.00 0.00 C ATOM 1277 CD GLN B 83 1.289 -2.760 -14.279 1.00 0.00 C ATOM 1278 OE1 GLN B 83 1.310 -3.144 -15.446 1.00 0.00 O ATOM 1279 NE2 GLN B 83 2.126 -1.841 -13.807 1.00 0.00 N ATOM 0 H GLN B 83 -0.015 -7.188 -12.751 1.00 0.00 H new ATOM 0 HA GLN B 83 2.053 -5.557 -13.817 1.00 0.00 H new ATOM 0 HB2 GLN B 83 -0.191 -5.105 -14.373 1.00 0.00 H new ATOM 0 HB3 GLN B 83 -0.713 -5.130 -12.701 1.00 0.00 H new ATOM 0 HG2 GLN B 83 -0.677 -2.838 -13.440 1.00 0.00 H new ATOM 0 HG3 GLN B 83 0.611 -3.056 -12.272 1.00 0.00 H new ATOM 0 HE21 GLN B 83 2.070 -1.554 -12.830 1.00 0.00 H new ATOM 0 HE22 GLN B 83 2.824 -1.423 -14.422 1.00 0.00 H new ATOM 1288 N ALA B 84 3.181 -4.387 -11.923 1.00 0.00 N ATOM 1289 CA ALA B 84 3.990 -3.914 -10.813 1.00 0.00 C ATOM 1290 C ALA B 84 3.433 -2.636 -10.195 1.00 0.00 C ATOM 1291 O ALA B 84 2.680 -1.898 -10.832 1.00 0.00 O ATOM 1292 CB ALA B 84 5.417 -3.682 -11.298 1.00 0.00 C ATOM 0 H ALA B 84 3.558 -4.160 -12.843 1.00 0.00 H new ATOM 0 HA ALA B 84 3.974 -4.678 -10.035 1.00 0.00 H new ATOM 0 HB1 ALA B 84 6.030 -3.327 -10.469 1.00 0.00 H new ATOM 0 HB2 ALA B 84 5.828 -4.617 -11.679 1.00 0.00 H new ATOM 0 HB3 ALA B 84 5.414 -2.936 -12.093 1.00 0.00 H new ATOM 1298 N THR B 85 3.821 -2.389 -8.942 1.00 0.00 N ATOM 1299 CA THR B 85 3.542 -1.136 -8.259 1.00 0.00 C ATOM 1300 C THR B 85 4.855 -0.444 -7.931 1.00 0.00 C ATOM 1301 O THR B 85 5.918 -1.060 -7.952 1.00 0.00 O ATOM 1302 CB THR B 85 2.738 -1.342 -6.982 1.00 0.00 C ATOM 1303 OG1 THR B 85 3.359 -2.303 -6.154 1.00 0.00 O ATOM 1304 CG2 THR B 85 1.322 -1.815 -7.311 1.00 0.00 C ATOM 0 H THR B 85 4.340 -3.060 -8.375 1.00 0.00 H new ATOM 0 HA THR B 85 2.940 -0.518 -8.926 1.00 0.00 H new ATOM 0 HB THR B 85 2.692 -0.387 -6.459 1.00 0.00 H new ATOM 0 HG1 THR B 85 2.830 -2.422 -5.338 1.00 0.00 H new ATOM 0 HG21 THR B 85 0.762 -1.957 -6.387 1.00 0.00 H new ATOM 0 HG22 THR B 85 0.822 -1.067 -7.927 1.00 0.00 H new ATOM 0 HG23 THR B 85 1.371 -2.759 -7.854 1.00 0.00 H new ATOM 1312 N LYS B 86 4.765 0.851 -7.626 1.00 0.00 N ATOM 1313 CA LYS B 86 5.930 1.676 -7.358 1.00 0.00 C ATOM 1314 C LYS B 86 6.690 1.184 -6.126 1.00 0.00 C ATOM 1315 O LYS B 86 6.086 0.582 -5.235 1.00 0.00 O ATOM 1316 CB LYS B 86 5.459 3.119 -7.183 1.00 0.00 C ATOM 1317 CG LYS B 86 4.883 3.614 -8.508 1.00 0.00 C ATOM 1318 CD LYS B 86 4.608 5.112 -8.464 1.00 0.00 C ATOM 1319 CE LYS B 86 3.884 5.515 -9.746 1.00 0.00 C ATOM 1320 NZ LYS B 86 3.687 6.977 -9.802 1.00 0.00 N ATOM 0 H LYS B 86 3.879 1.352 -7.559 1.00 0.00 H new ATOM 0 HA LYS B 86 6.627 1.614 -8.194 1.00 0.00 H new ATOM 0 HB2 LYS B 86 4.704 3.177 -6.399 1.00 0.00 H new ATOM 0 HB3 LYS B 86 6.290 3.752 -6.873 1.00 0.00 H new ATOM 0 HG2 LYS B 86 5.581 3.393 -9.316 1.00 0.00 H new ATOM 0 HG3 LYS B 86 3.960 3.078 -8.729 1.00 0.00 H new ATOM 0 HD2 LYS B 86 4.000 5.359 -7.593 1.00 0.00 H new ATOM 0 HD3 LYS B 86 5.542 5.665 -8.368 1.00 0.00 H new ATOM 0 HE2 LYS B 86 4.460 5.188 -10.612 1.00 0.00 H new ATOM 0 HE3 LYS B 86 2.919 5.012 -9.797 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 3.415 7.254 -10.767 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 2.935 7.252 -9.138 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 4.572 7.457 -9.541 1.00 0.00 H new ATOM 1334 N PRO B 87 8.005 1.433 -6.064 1.00 0.00 N ATOM 1335 CA PRO B 87 8.851 1.007 -4.961 1.00 0.00 C ATOM 1336 C PRO B 87 8.439 1.719 -3.675 1.00 0.00 C ATOM 1337 O PRO B 87 7.831 2.790 -3.711 1.00 0.00 O ATOM 1338 CB PRO B 87 10.281 1.348 -5.378 1.00 0.00 C ATOM 1339 CG PRO B 87 10.097 2.502 -6.361 1.00 0.00 C ATOM 1340 CD PRO B 87 8.784 2.151 -7.055 1.00 0.00 C ATOM 0 HA PRO B 87 8.760 -0.060 -4.756 1.00 0.00 H new ATOM 0 HB2 PRO B 87 10.890 1.642 -4.523 1.00 0.00 H new ATOM 0 HB3 PRO B 87 10.777 0.497 -5.845 1.00 0.00 H new ATOM 0 HG2 PRO B 87 10.040 3.463 -5.850 1.00 0.00 H new ATOM 0 HG3 PRO B 87 10.924 2.566 -7.069 1.00 0.00 H new ATOM 0 HD2 PRO B 87 8.264 3.049 -7.389 1.00 0.00 H new ATOM 0 HD3 PRO B 87 8.958 1.537 -7.938 1.00 0.00 H new ATOM 1348 N SER B 88 8.774 1.120 -2.532 1.00 0.00 N ATOM 1349 CA SER B 88 8.327 1.585 -1.232 1.00 0.00 C ATOM 1350 C SER B 88 9.161 2.752 -0.709 1.00 0.00 C ATOM 1351 O SER B 88 8.788 3.374 0.283 1.00 0.00 O ATOM 1352 CB SER B 88 8.357 0.395 -0.266 1.00 0.00 C ATOM 1353 OG SER B 88 7.730 0.737 0.950 1.00 0.00 O ATOM 0 H SER B 88 9.368 0.292 -2.489 1.00 0.00 H new ATOM 0 HA SER B 88 7.312 1.971 -1.321 1.00 0.00 H new ATOM 0 HB2 SER B 88 7.852 -0.460 -0.716 1.00 0.00 H new ATOM 0 HB3 SER B 88 9.388 0.095 -0.080 1.00 0.00 H new ATOM 0 HG SER B 88 7.825 1.700 1.108 1.00 0.00 H new ATOM 1359 N PHE B 89 10.286 3.062 -1.362 1.00 0.00 N ATOM 1360 CA PHE B 89 11.109 4.205 -0.994 1.00 0.00 C ATOM 1361 C PHE B 89 10.795 5.416 -1.869 1.00 0.00 C ATOM 1362 O PHE B 89 11.590 6.350 -1.950 1.00 0.00 O ATOM 1363 CB PHE B 89 12.592 3.845 -1.012 1.00 0.00 C ATOM 1364 CG PHE B 89 13.133 3.374 -2.341 1.00 0.00 C ATOM 1365 CD1 PHE B 89 13.001 2.031 -2.714 1.00 0.00 C ATOM 1366 CD2 PHE B 89 13.780 4.279 -3.195 1.00 0.00 C ATOM 1367 CE1 PHE B 89 13.541 1.588 -3.926 1.00 0.00 C ATOM 1368 CE2 PHE B 89 14.319 3.833 -4.410 1.00 0.00 C ATOM 1369 CZ PHE B 89 14.200 2.485 -4.775 1.00 0.00 C ATOM 0 H PHE B 89 10.645 2.528 -2.154 1.00 0.00 H new ATOM 0 HA PHE B 89 10.864 4.484 0.031 1.00 0.00 H new ATOM 0 HB2 PHE B 89 13.163 4.718 -0.696 1.00 0.00 H new ATOM 0 HB3 PHE B 89 12.767 3.065 -0.272 1.00 0.00 H new ATOM 0 HD1 PHE B 89 12.483 1.338 -2.067 1.00 0.00 H new ATOM 0 HD2 PHE B 89 13.863 5.319 -2.917 1.00 0.00 H new ATOM 0 HE1 PHE B 89 13.449 0.550 -4.208 1.00 0.00 H new ATOM 0 HE2 PHE B 89 14.825 4.527 -5.064 1.00 0.00 H new ATOM 0 HZ PHE B 89 14.616 2.139 -5.710 1.00 0.00 H new ATOM 1379 N GLU B 90 9.634 5.403 -2.528 1.00 0.00 N ATOM 1380 CA GLU B 90 9.264 6.441 -3.471 1.00 0.00 C ATOM 1381 C GLU B 90 7.766 6.727 -3.412 1.00 0.00 C ATOM 1382 O GLU B 90 6.991 5.924 -2.889 1.00 0.00 O ATOM 1383 CB GLU B 90 9.689 5.973 -4.860 1.00 0.00 C ATOM 1384 CG GLU B 90 9.841 7.153 -5.818 1.00 0.00 C ATOM 1385 CD GLU B 90 10.311 6.677 -7.193 1.00 0.00 C ATOM 1386 OE1 GLU B 90 9.455 6.175 -7.955 1.00 0.00 O ATOM 1387 OE2 GLU B 90 11.522 6.819 -7.471 1.00 0.00 O ATOM 0 H GLU B 90 8.931 4.672 -2.418 1.00 0.00 H new ATOM 0 HA GLU B 90 9.766 7.376 -3.223 1.00 0.00 H new ATOM 0 HB2 GLU B 90 10.633 5.433 -4.791 1.00 0.00 H new ATOM 0 HB3 GLU B 90 8.950 5.275 -5.253 1.00 0.00 H new ATOM 0 HG2 GLU B 90 8.889 7.674 -5.914 1.00 0.00 H new ATOM 0 HG3 GLU B 90 10.556 7.868 -5.411 1.00 0.00 H new ATOM 1394 N SER B 91 7.360 7.878 -3.952 1.00 0.00 N ATOM 1395 CA SER B 91 5.969 8.299 -3.952 1.00 0.00 C ATOM 1396 C SER B 91 5.705 9.232 -5.123 1.00 0.00 C ATOM 1397 O SER B 91 6.588 9.994 -5.517 1.00 0.00 O ATOM 1398 CB SER B 91 5.684 9.037 -2.651 1.00 0.00 C ATOM 1399 OG SER B 91 4.291 9.169 -2.457 1.00 0.00 O ATOM 0 H SER B 91 7.992 8.541 -4.401 1.00 0.00 H new ATOM 0 HA SER B 91 5.324 7.425 -4.043 1.00 0.00 H new ATOM 0 HB2 SER B 91 6.125 8.496 -1.814 1.00 0.00 H new ATOM 0 HB3 SER B 91 6.150 10.022 -2.674 1.00 0.00 H new ATOM 0 HG SER B 91 4.121 9.644 -1.617 1.00 0.00 H new ATOM 1405 N GLY B 92 4.494 9.180 -5.678 1.00 0.00 N ATOM 1406 CA GLY B 92 4.103 10.067 -6.761 1.00 0.00 C ATOM 1407 C GLY B 92 5.045 9.924 -7.952 1.00 0.00 C ATOM 1408 O GLY B 92 5.393 8.811 -8.349 1.00 0.00 O ATOM 0 H GLY B 92 3.766 8.526 -5.389 1.00 0.00 H new ATOM 0 HA2 GLY B 92 3.083 9.841 -7.071 1.00 0.00 H new ATOM 0 HA3 GLY B 92 4.108 11.099 -6.410 1.00 0.00 H new ATOM 1412 N ARG B 93 5.449 11.072 -8.503 1.00 0.00 N ATOM 1413 CA ARG B 93 6.309 11.193 -9.676 1.00 0.00 C ATOM 1414 C ARG B 93 5.778 10.486 -10.919 1.00 0.00 C ATOM 1415 O ARG B 93 4.860 9.667 -10.865 1.00 0.00 O ATOM 1416 CB ARG B 93 7.739 10.763 -9.333 1.00 0.00 C ATOM 1417 CG ARG B 93 8.434 11.801 -8.450 1.00 0.00 C ATOM 1418 CD ARG B 93 8.652 13.107 -9.222 1.00 0.00 C ATOM 1419 NE ARG B 93 9.400 14.077 -8.413 1.00 0.00 N ATOM 1420 CZ ARG B 93 9.780 15.281 -8.851 1.00 0.00 C ATOM 1421 NH1 ARG B 93 9.490 15.678 -10.087 1.00 0.00 N ATOM 1422 NH2 ARG B 93 10.456 16.097 -8.047 1.00 0.00 N ATOM 0 H ARG B 93 5.172 11.978 -8.126 1.00 0.00 H new ATOM 0 HA ARG B 93 6.314 12.249 -9.947 1.00 0.00 H new ATOM 0 HB2 ARG B 93 7.719 9.801 -8.821 1.00 0.00 H new ATOM 0 HB3 ARG B 93 8.309 10.623 -10.251 1.00 0.00 H new ATOM 0 HG2 ARG B 93 7.831 11.993 -7.562 1.00 0.00 H new ATOM 0 HG3 ARG B 93 9.392 11.411 -8.106 1.00 0.00 H new ATOM 0 HD2 ARG B 93 9.195 12.902 -10.145 1.00 0.00 H new ATOM 0 HD3 ARG B 93 7.689 13.531 -9.506 1.00 0.00 H new ATOM 0 HE ARG B 93 9.645 13.816 -7.458 1.00 0.00 H new ATOM 0 HH11 ARG B 93 8.972 15.061 -10.712 1.00 0.00 H new ATOM 0 HH12 ARG B 93 9.786 16.599 -10.409 1.00 0.00 H new ATOM 0 HH21 ARG B 93 10.684 15.804 -7.097 1.00 0.00 H new ATOM 0 HH22 ARG B 93 10.746 17.016 -8.380 1.00 0.00 H new ATOM 1436 N ARG B 94 6.386 10.835 -12.054 1.00 0.00 N ATOM 1437 CA ARG B 94 5.990 10.386 -13.379 1.00 0.00 C ATOM 1438 C ARG B 94 7.225 10.214 -14.258 1.00 0.00 C ATOM 1439 O ARG B 94 8.289 10.750 -13.947 1.00 0.00 O ATOM 1440 CB ARG B 94 5.051 11.429 -13.985 1.00 0.00 C ATOM 1441 CG ARG B 94 3.676 11.395 -13.313 1.00 0.00 C ATOM 1442 CD ARG B 94 2.746 12.397 -13.991 1.00 0.00 C ATOM 1443 NE ARG B 94 1.418 12.396 -13.367 1.00 0.00 N ATOM 1444 CZ ARG B 94 0.412 13.188 -13.748 1.00 0.00 C ATOM 1445 NH1 ARG B 94 0.566 14.052 -14.745 1.00 0.00 N ATOM 1446 NH2 ARG B 94 -0.762 13.118 -13.129 1.00 0.00 N ATOM 0 H ARG B 94 7.193 11.458 -12.071 1.00 0.00 H new ATOM 0 HA ARG B 94 5.479 9.426 -13.312 1.00 0.00 H new ATOM 0 HB2 ARG B 94 5.487 12.422 -13.876 1.00 0.00 H new ATOM 0 HB3 ARG B 94 4.941 11.245 -15.054 1.00 0.00 H new ATOM 0 HG2 ARG B 94 3.254 10.392 -13.377 1.00 0.00 H new ATOM 0 HG3 ARG B 94 3.772 11.633 -12.254 1.00 0.00 H new ATOM 0 HD2 ARG B 94 3.178 13.396 -13.931 1.00 0.00 H new ATOM 0 HD3 ARG B 94 2.653 12.153 -15.049 1.00 0.00 H new ATOM 0 HE ARG B 94 1.253 11.751 -12.595 1.00 0.00 H new ATOM 0 HH11 ARG B 94 1.461 14.117 -15.230 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -0.211 14.651 -15.026 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -0.896 12.459 -12.362 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -1.529 13.723 -13.421 1.00 0.00 H new ATOM 1460 N GLY B 95 7.081 9.471 -15.358 1.00 0.00 N ATOM 1461 CA GLY B 95 8.168 9.229 -16.294 1.00 0.00 C ATOM 1462 C GLY B 95 7.780 8.147 -17.294 1.00 0.00 C ATOM 1463 O GLY B 95 7.046 8.481 -18.249 1.00 0.00 O ATOM 1464 OXT GLY B 95 8.220 6.994 -17.091 1.00 0.00 O ATOM 0 H GLY B 95 6.204 9.022 -15.620 1.00 0.00 H new ATOM 0 HA2 GLY B 95 8.412 10.150 -16.823 1.00 0.00 H new ATOM 0 HA3 GLY B 95 9.063 8.926 -15.751 1.00 0.00 H new TER 1468 GLY B 95 ATOM 1469 O5' A A 96 8.488 -11.448 3.045 1.00 0.00 O ATOM 1470 C5' A A 96 7.211 -11.557 3.643 1.00 0.00 C ATOM 1471 C4' A A 96 7.071 -12.913 4.342 1.00 0.00 C ATOM 1472 O4' A A 96 8.065 -13.032 5.356 1.00 0.00 O ATOM 1473 C3' A A 96 5.711 -12.978 5.042 1.00 0.00 C ATOM 1474 O3' A A 96 4.865 -14.022 4.605 1.00 0.00 O ATOM 1475 C2' A A 96 6.077 -13.255 6.496 1.00 0.00 C ATOM 1476 O2' A A 96 6.103 -14.643 6.766 1.00 0.00 O ATOM 1477 C1' A A 96 7.493 -12.717 6.615 1.00 0.00 C ATOM 1478 N9 A A 96 7.530 -11.258 6.887 1.00 0.00 N ATOM 1479 C8 A A 96 8.320 -10.313 6.286 1.00 0.00 C ATOM 1480 N7 A A 96 8.155 -9.102 6.743 1.00 0.00 N ATOM 1481 C5 A A 96 7.172 -9.252 7.719 1.00 0.00 C ATOM 1482 C6 A A 96 6.528 -8.344 8.582 1.00 0.00 C ATOM 1483 N6 A A 96 6.789 -7.033 8.611 1.00 0.00 N ATOM 1484 N1 A A 96 5.596 -8.811 9.423 1.00 0.00 N ATOM 1485 C2 A A 96 5.326 -10.107 9.419 1.00 0.00 C ATOM 1486 N3 A A 96 5.857 -11.065 8.670 1.00 0.00 N ATOM 1487 C4 A A 96 6.785 -10.563 7.816 1.00 0.00 C ATOM 0 H5' A A 96 6.435 -11.448 2.885 1.00 0.00 H new ATOM 0 H5'' A A 96 7.068 -10.751 4.363 1.00 0.00 H new ATOM 0 H4' A A 96 7.175 -13.704 3.599 1.00 0.00 H new ATOM 0 H3' A A 96 5.157 -12.060 4.846 1.00 0.00 H new ATOM 0 H2' A A 96 5.362 -12.806 7.185 1.00 0.00 H new ATOM 0 HO2' A A 96 5.535 -15.113 6.120 1.00 0.00 H new ATOM 0 HO5' A A 96 9.148 -11.918 3.596 1.00 0.00 H new ATOM 0 H1' A A 96 8.034 -13.153 7.455 1.00 0.00 H new ATOM 0 H8 A A 96 9.021 -10.551 5.499 1.00 0.00 H new ATOM 0 H61 A A 96 6.287 -6.427 9.260 1.00 0.00 H new ATOM 0 H62 A A 96 7.490 -6.639 7.984 1.00 0.00 H new ATOM 0 H2 A A 96 4.571 -10.428 10.121 1.00 0.00 H new ATOM 1500 P U A 97 4.087 -13.901 3.202 1.00 0.00 P ATOM 1501 OP1 U A 97 3.047 -14.954 3.157 1.00 0.00 O ATOM 1502 OP2 U A 97 5.087 -13.812 2.115 1.00 0.00 O ATOM 1503 O5' U A 97 3.361 -12.470 3.343 1.00 0.00 O ATOM 1504 C5' U A 97 2.396 -12.240 4.347 1.00 0.00 C ATOM 1505 C4' U A 97 1.963 -10.770 4.309 1.00 0.00 C ATOM 1506 O4' U A 97 0.868 -10.525 5.175 1.00 0.00 O ATOM 1507 C3' U A 97 3.093 -9.817 4.712 1.00 0.00 C ATOM 1508 O3' U A 97 3.230 -8.786 3.750 1.00 0.00 O ATOM 1509 C2' U A 97 2.641 -9.257 6.064 1.00 0.00 C ATOM 1510 O2' U A 97 2.299 -7.888 5.978 1.00 0.00 O ATOM 1511 C1' U A 97 1.374 -10.040 6.403 1.00 0.00 C ATOM 1512 N1 U A 97 1.601 -11.149 7.359 1.00 0.00 N ATOM 1513 C2 U A 97 0.516 -11.537 8.138 1.00 0.00 C ATOM 1514 O2 U A 97 -0.597 -11.023 8.019 1.00 0.00 O ATOM 1515 N3 U A 97 0.746 -12.540 9.063 1.00 0.00 N ATOM 1516 C4 U A 97 1.950 -13.188 9.275 1.00 0.00 C ATOM 1517 O4 U A 97 2.047 -14.058 10.136 1.00 0.00 O ATOM 1518 C5 U A 97 3.014 -12.743 8.407 1.00 0.00 C ATOM 1519 C6 U A 97 2.817 -11.765 7.492 1.00 0.00 C ATOM 0 H5' U A 97 2.808 -12.484 5.326 1.00 0.00 H new ATOM 0 H5'' U A 97 1.534 -12.889 4.194 1.00 0.00 H new ATOM 0 H4' U A 97 1.678 -10.581 3.274 1.00 0.00 H new ATOM 0 H3' U A 97 4.065 -10.306 4.774 1.00 0.00 H new ATOM 0 H2' U A 97 3.436 -9.349 6.803 1.00 0.00 H new ATOM 0 HO2' U A 97 2.198 -7.635 5.037 1.00 0.00 H new ATOM 0 H1' U A 97 0.665 -9.383 6.908 1.00 0.00 H new ATOM 0 H3 U A 97 -0.044 -12.828 9.641 1.00 0.00 H new ATOM 0 H5 U A 97 3.989 -13.200 8.489 1.00 0.00 H new ATOM 0 H6 U A 97 3.635 -11.464 6.854 1.00 0.00 H new ATOM 1530 P C A 98 4.557 -7.874 3.706 1.00 0.00 P ATOM 1531 OP1 C A 98 5.144 -7.839 5.066 1.00 0.00 O ATOM 1532 OP2 C A 98 4.225 -6.605 3.015 1.00 0.00 O ATOM 1533 O5' C A 98 5.539 -8.725 2.753 1.00 0.00 O ATOM 1534 C5' C A 98 5.569 -8.497 1.358 1.00 0.00 C ATOM 1535 C4' C A 98 6.530 -9.473 0.679 1.00 0.00 C ATOM 1536 O4' C A 98 5.948 -10.763 0.539 1.00 0.00 O ATOM 1537 C3' C A 98 6.828 -8.999 -0.743 1.00 0.00 C ATOM 1538 O3' C A 98 8.024 -9.586 -1.214 1.00 0.00 O ATOM 1539 C2' C A 98 5.619 -9.565 -1.472 1.00 0.00 C ATOM 1540 O2' C A 98 5.857 -9.713 -2.858 1.00 0.00 O ATOM 1541 C1' C A 98 5.416 -10.902 -0.771 1.00 0.00 C ATOM 1542 N1 C A 98 3.978 -11.239 -0.731 1.00 0.00 N ATOM 1543 C2 C A 98 3.432 -11.947 -1.794 1.00 0.00 C ATOM 1544 O2 C A 98 4.130 -12.302 -2.744 1.00 0.00 O ATOM 1545 N3 C A 98 2.105 -12.244 -1.767 1.00 0.00 N ATOM 1546 C4 C A 98 1.348 -11.860 -0.738 1.00 0.00 C ATOM 1547 N4 C A 98 0.056 -12.172 -0.757 1.00 0.00 N ATOM 1548 C5 C A 98 1.890 -11.131 0.367 1.00 0.00 C ATOM 1549 C6 C A 98 3.209 -10.850 0.326 1.00 0.00 C ATOM 0 H5' C A 98 5.880 -7.472 1.157 1.00 0.00 H new ATOM 0 H5'' C A 98 4.568 -8.614 0.942 1.00 0.00 H new ATOM 0 H4' C A 98 7.425 -9.517 1.300 1.00 0.00 H new ATOM 0 H3' C A 98 6.968 -7.924 -0.858 1.00 0.00 H new ATOM 0 H2' C A 98 4.742 -8.920 -1.429 1.00 0.00 H new ATOM 0 HO2' C A 98 5.588 -8.895 -3.325 1.00 0.00 H new ATOM 0 H1' C A 98 5.920 -11.711 -1.300 1.00 0.00 H new ATOM 0 H41 C A 98 -0.548 -11.892 0.016 1.00 0.00 H new ATOM 0 H42 C A 98 -0.332 -12.692 -1.545 1.00 0.00 H new ATOM 0 H5 C A 98 1.272 -10.820 1.196 1.00 0.00 H new ATOM 0 H6 C A 98 3.663 -10.309 1.143 1.00 0.00 H new ATOM 1561 P A A 99 9.468 -8.995 -0.806 1.00 0.00 P ATOM 1562 OP1 A A 99 10.470 -10.071 -0.987 1.00 0.00 O ATOM 1563 OP2 A A 99 9.356 -8.317 0.504 1.00 0.00 O ATOM 1564 O5' A A 99 9.741 -7.874 -1.933 1.00 0.00 O ATOM 1565 C5' A A 99 9.285 -6.543 -1.782 1.00 0.00 C ATOM 1566 C4' A A 99 9.642 -5.746 -3.037 1.00 0.00 C ATOM 1567 O4' A A 99 8.737 -6.083 -4.075 1.00 0.00 O ATOM 1568 C3' A A 99 9.538 -4.232 -2.803 1.00 0.00 C ATOM 1569 O3' A A 99 10.681 -3.612 -3.357 1.00 0.00 O ATOM 1570 C2' A A 99 8.271 -3.860 -3.569 1.00 0.00 C ATOM 1571 O2' A A 99 8.280 -2.541 -4.075 1.00 0.00 O ATOM 1572 C1' A A 99 8.328 -4.881 -4.691 1.00 0.00 C ATOM 1573 N9 A A 99 7.028 -4.981 -5.379 1.00 0.00 N ATOM 1574 C8 A A 99 6.675 -4.340 -6.529 1.00 0.00 C ATOM 1575 N7 A A 99 5.474 -4.617 -6.961 1.00 0.00 N ATOM 1576 C5 A A 99 4.988 -5.502 -6.000 1.00 0.00 C ATOM 1577 C6 A A 99 3.766 -6.185 -5.847 1.00 0.00 C ATOM 1578 N6 A A 99 2.753 -6.095 -6.714 1.00 0.00 N ATOM 1579 N1 A A 99 3.600 -6.970 -4.777 1.00 0.00 N ATOM 1580 C2 A A 99 4.585 -7.070 -3.897 1.00 0.00 C ATOM 1581 N3 A A 99 5.778 -6.491 -3.914 1.00 0.00 N ATOM 1582 C4 A A 99 5.921 -5.713 -5.015 1.00 0.00 C ATOM 0 H5' A A 99 9.742 -6.086 -0.904 1.00 0.00 H new ATOM 0 H5'' A A 99 8.207 -6.531 -1.623 1.00 0.00 H new ATOM 0 H4' A A 99 10.670 -5.994 -3.301 1.00 0.00 H new ATOM 0 H3' A A 99 9.492 -3.928 -1.757 1.00 0.00 H new ATOM 0 H2' A A 99 7.370 -3.878 -2.955 1.00 0.00 H new ATOM 0 HO2' A A 99 8.681 -1.940 -3.414 1.00 0.00 H new ATOM 0 H1' A A 99 9.028 -4.606 -5.480 1.00 0.00 H new ATOM 0 H8 A A 99 7.336 -3.657 -7.042 1.00 0.00 H new ATOM 0 H61 A A 99 1.892 -6.615 -6.548 1.00 0.00 H new ATOM 0 H62 A A 99 2.841 -5.506 -7.542 1.00 0.00 H new ATOM 0 H2 A A 99 4.390 -7.711 -3.050 1.00 0.00 H new ATOM 1594 P A A 100 11.228 -2.209 -2.792 1.00 0.00 P ATOM 1595 OP1 A A 100 11.883 -2.450 -1.485 1.00 0.00 O ATOM 1596 OP2 A A 100 10.145 -1.207 -2.897 1.00 0.00 O ATOM 1597 O5' A A 100 12.360 -1.852 -3.873 1.00 0.00 O ATOM 1598 C5' A A 100 13.557 -2.597 -3.887 1.00 0.00 C ATOM 1599 C4' A A 100 14.133 -2.721 -5.302 1.00 0.00 C ATOM 1600 O4' A A 100 13.126 -3.070 -6.243 1.00 0.00 O ATOM 1601 C3' A A 100 14.704 -1.378 -5.723 1.00 0.00 C ATOM 1602 O3' A A 100 15.830 -1.573 -6.546 1.00 0.00 O ATOM 1603 C2' A A 100 13.549 -0.777 -6.502 1.00 0.00 C ATOM 1604 O2' A A 100 13.970 0.219 -7.415 1.00 0.00 O ATOM 1605 C1' A A 100 12.991 -2.016 -7.183 1.00 0.00 C ATOM 1606 N9 A A 100 11.584 -1.764 -7.548 1.00 0.00 N ATOM 1607 C8 A A 100 10.470 -1.831 -6.754 1.00 0.00 C ATOM 1608 N7 A A 100 9.359 -1.527 -7.370 1.00 0.00 N ATOM 1609 C5 A A 100 9.774 -1.228 -8.669 1.00 0.00 C ATOM 1610 C6 A A 100 9.100 -0.813 -9.836 1.00 0.00 C ATOM 1611 N6 A A 100 7.782 -0.626 -9.907 1.00 0.00 N ATOM 1612 N1 A A 100 9.814 -0.587 -10.946 1.00 0.00 N ATOM 1613 C2 A A 100 11.124 -0.769 -10.905 1.00 0.00 C ATOM 1614 N3 A A 100 11.882 -1.152 -9.888 1.00 0.00 N ATOM 1615 C4 A A 100 11.130 -1.375 -8.784 1.00 0.00 C ATOM 0 H5' A A 100 13.371 -3.592 -3.482 1.00 0.00 H new ATOM 0 H5'' A A 100 14.290 -2.120 -3.237 1.00 0.00 H new ATOM 0 H4' A A 100 14.897 -3.498 -5.285 1.00 0.00 H new ATOM 0 H3' A A 100 15.043 -0.749 -4.900 1.00 0.00 H new ATOM 0 H2' A A 100 12.821 -0.243 -5.892 1.00 0.00 H new ATOM 0 HO2' A A 100 13.192 0.574 -7.893 1.00 0.00 H new ATOM 0 H1' A A 100 13.515 -2.275 -8.103 1.00 0.00 H new ATOM 0 H8 A A 100 10.507 -2.110 -5.711 1.00 0.00 H new ATOM 0 H61 A A 100 7.356 -0.324 -10.783 1.00 0.00 H new ATOM 0 H62 A A 100 7.199 -0.784 -9.085 1.00 0.00 H new ATOM 0 H2 A A 100 11.649 -0.579 -11.830 1.00 0.00 H new ATOM 1627 P A A 101 17.298 -1.708 -5.898 1.00 0.00 P ATOM 1628 OP1 A A 101 18.213 -2.269 -6.918 1.00 0.00 O ATOM 1629 OP2 A A 101 17.171 -2.365 -4.577 1.00 0.00 O ATOM 1630 O5' A A 101 17.693 -0.173 -5.657 1.00 0.00 O ATOM 1631 C5' A A 101 17.599 0.750 -6.716 1.00 0.00 C ATOM 1632 C4' A A 101 18.235 2.096 -6.362 1.00 0.00 C ATOM 1633 O4' A A 101 17.598 2.685 -5.238 1.00 0.00 O ATOM 1634 C3' A A 101 19.716 1.940 -6.015 1.00 0.00 C ATOM 1635 O3' A A 101 20.411 3.125 -6.350 1.00 0.00 O ATOM 1636 C2' A A 101 19.667 1.747 -4.506 1.00 0.00 C ATOM 1637 O2' A A 101 20.855 2.196 -3.881 1.00 0.00 O ATOM 1638 C1' A A 101 18.446 2.574 -4.105 1.00 0.00 C ATOM 1639 N9 A A 101 17.731 1.958 -2.968 1.00 0.00 N ATOM 1640 C8 A A 101 17.590 0.631 -2.650 1.00 0.00 C ATOM 1641 N7 A A 101 16.903 0.414 -1.561 1.00 0.00 N ATOM 1642 C5 A A 101 16.569 1.693 -1.122 1.00 0.00 C ATOM 1643 C6 A A 101 15.850 2.178 -0.012 1.00 0.00 C ATOM 1644 N6 A A 101 15.287 1.388 0.907 1.00 0.00 N ATOM 1645 N1 A A 101 15.718 3.502 0.138 1.00 0.00 N ATOM 1646 C2 A A 101 16.268 4.306 -0.764 1.00 0.00 C ATOM 1647 N3 A A 101 16.961 3.988 -1.850 1.00 0.00 N ATOM 1648 C4 A A 101 17.072 2.642 -1.971 1.00 0.00 C ATOM 0 H5' A A 101 16.551 0.901 -6.973 1.00 0.00 H new ATOM 0 H5'' A A 101 18.088 0.339 -7.599 1.00 0.00 H new ATOM 0 H4' A A 101 18.118 2.729 -7.241 1.00 0.00 H new ATOM 0 H3' A A 101 20.223 1.130 -6.540 1.00 0.00 H new ATOM 0 H2' A A 101 19.590 0.703 -4.201 1.00 0.00 H new ATOM 0 HO2' A A 101 20.650 2.511 -2.976 1.00 0.00 H new ATOM 0 HO3' A A 101 20.992 3.385 -5.605 1.00 0.00 H new ATOM 0 H1' A A 101 18.764 3.564 -3.778 1.00 0.00 H new ATOM 0 H8 A A 101 18.010 -0.164 -3.248 1.00 0.00 H new ATOM 0 H61 A A 101 14.778 1.799 1.690 1.00 0.00 H new ATOM 0 H62 A A 101 15.366 0.374 0.826 1.00 0.00 H new ATOM 0 H2 A A 101 16.133 5.363 -0.590 1.00 0.00 H new TER 1661 A A 101