USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 ASN : amide:sc= -0.0242 K(o=-0.036,f=-3!) USER MOD Set 1.2: A 37 GLN : amide:sc= -0.0123 K(o=-0.036,f=-1.5!) USER MOD Set 2.1: A 30 GLN : amide:sc= -2.77! C(o=-3.2!,f=-4.1!) USER MOD Set 2.2: A 31 GLN : amide:sc= -0.429 K(o=-3.2,f=-4.4) USER MOD Set 3.1: A 17 THR OG1 : rot -179:sc= 0.322 USER MOD Set 3.2: A 20 SER OG : rot -114:sc= 0.451 USER MOD Single : A 4 SER OG : rot 180:sc= -0.011 USER MOD Single : A 5 ASN : amide:sc= -0.398 K(o=-0.4,f=-1.6!) USER MOD Single : A 8 LYS NZ :NH3+ -167:sc= -1.36! (180deg=-1.95!) USER MOD Single : A 15 SER OG : rot -4:sc= 1.12 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 MET CE :methyl 167:sc= -0.767 (180deg=-1.48!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 33 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= -0.441 USER MOD Single : A 53 SER OG : rot -44:sc= 0.827 USER MOD Single : A 54 LYS NZ :NH3+ -156:sc= -0.926 (180deg=-2.25!) USER MOD Single : A 59 ASN : amide:sc= -0.286 K(o=-0.29,f=-3.2!) USER MOD Single : B 4 SER OG : rot 12:sc= -1.2! USER MOD Single : B 5 ASN :FLIP amide:sc= -0.0592 F(o=-1.6,f=-0.059) USER MOD Single : B 8 LYS NZ :NH3+ 136:sc= -0.0538 (180deg=-0.647) USER MOD Single : B 15 SER OG : rot -13:sc= 0.414 USER MOD Single : B 17 THR OG1 : rot 180:sc= -0.531 USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 25 MET CE :methyl 138:sc= -1.7 (180deg=-6.29!) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 30 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 31 GLN : amide:sc= -0.0187 K(o=-0.019,f=-1.5!) USER MOD Single : B 33 CYS SG : rot 180:sc= 0 USER MOD Single : B 34 ASN : amide:sc= -2.2 K(o=-2.2,f=-7.8!) USER MOD Single : B 37 GLN : amide:sc=-0.00105 K(o=-0.001,f=-0.5) USER MOD Single : B 38 SER OG : rot 180:sc= 0 USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ -162:sc= -0.0219 (180deg=-0.455) USER MOD Single : B 47 TYR OH : rot 150:sc= 0 USER MOD Single : B 53 SER OG : rot 180:sc= 0 USER MOD Single : B 54 LYS NZ :NH3+ -115:sc= -4.1! (180deg=-6.13!) USER MOD Single : B 59 ASN : amide:sc= -0.943! C(o=-0.94!,f=-12!) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 8.686 14.772 7.224 1.00 0.00 N ATOM 21 CA GLU A 2 8.905 13.314 7.002 1.00 0.00 C ATOM 22 C GLU A 2 7.710 12.712 6.262 1.00 0.00 C ATOM 23 O GLU A 2 6.746 13.385 5.968 1.00 0.00 O ATOM 24 CB GLU A 2 9.086 12.619 8.355 1.00 0.00 C ATOM 25 CG GLU A 2 10.428 13.034 8.964 1.00 0.00 C ATOM 26 CD GLU A 2 11.571 12.452 8.128 1.00 0.00 C ATOM 27 OE1 GLU A 2 11.730 11.242 8.140 1.00 0.00 O ATOM 28 OE2 GLU A 2 12.250 13.223 7.471 1.00 0.00 O ATOM 0 HA GLU A 2 9.800 13.170 6.397 1.00 0.00 H new ATOM 0 HB2 GLU A 2 8.271 12.888 9.026 1.00 0.00 H new ATOM 0 HB3 GLU A 2 9.051 11.537 8.228 1.00 0.00 H new ATOM 0 HG2 GLU A 2 10.504 14.121 8.996 1.00 0.00 H new ATOM 0 HG3 GLU A 2 10.498 12.679 9.992 1.00 0.00 H new ATOM 35 N LEU A 3 7.773 11.445 5.953 1.00 0.00 N ATOM 36 CA LEU A 3 6.652 10.793 5.221 1.00 0.00 C ATOM 37 C LEU A 3 5.373 10.843 6.065 1.00 0.00 C ATOM 38 O LEU A 3 4.307 11.145 5.570 1.00 0.00 O ATOM 39 CB LEU A 3 7.022 9.329 4.947 1.00 0.00 C ATOM 40 CG LEU A 3 5.911 8.627 4.147 1.00 0.00 C ATOM 41 CD1 LEU A 3 5.766 9.270 2.758 1.00 0.00 C ATOM 42 CD2 LEU A 3 6.272 7.145 3.995 1.00 0.00 C ATOM 0 H LEU A 3 8.557 10.832 6.178 1.00 0.00 H new ATOM 0 HA LEU A 3 6.478 11.319 4.282 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.960 9.283 4.393 1.00 0.00 H new ATOM 0 HB3 LEU A 3 7.183 8.807 5.890 1.00 0.00 H new ATOM 0 HG LEU A 3 4.964 8.728 4.677 1.00 0.00 H new ATOM 0 HD11 LEU A 3 4.976 8.763 2.203 1.00 0.00 H new ATOM 0 HD12 LEU A 3 5.512 10.324 2.870 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.707 9.179 2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 3 5.491 6.637 3.429 1.00 0.00 H new ATOM 0 HD22 LEU A 3 7.221 7.054 3.466 1.00 0.00 H new ATOM 0 HD23 LEU A 3 6.361 6.689 4.981 1.00 0.00 H new ATOM 54 N SER A 4 5.469 10.542 7.329 1.00 0.00 N ATOM 55 CA SER A 4 4.257 10.560 8.196 1.00 0.00 C ATOM 56 C SER A 4 3.766 11.994 8.399 1.00 0.00 C ATOM 57 O SER A 4 2.580 12.256 8.415 1.00 0.00 O ATOM 58 CB SER A 4 4.612 9.948 9.548 1.00 0.00 C ATOM 59 OG SER A 4 5.666 10.694 10.140 1.00 0.00 O ATOM 0 H SER A 4 6.336 10.284 7.801 1.00 0.00 H new ATOM 0 HA SER A 4 3.464 9.986 7.718 1.00 0.00 H new ATOM 0 HB2 SER A 4 3.739 9.949 10.201 1.00 0.00 H new ATOM 0 HB3 SER A 4 4.914 8.908 9.421 1.00 0.00 H new ATOM 0 HG SER A 4 5.895 10.304 11.009 1.00 0.00 H new ATOM 65 N ASN A 5 4.666 12.921 8.560 1.00 0.00 N ATOM 66 CA ASN A 5 4.254 14.337 8.771 1.00 0.00 C ATOM 67 C ASN A 5 3.535 14.863 7.526 1.00 0.00 C ATOM 68 O ASN A 5 2.530 15.540 7.620 1.00 0.00 O ATOM 69 CB ASN A 5 5.505 15.177 9.031 1.00 0.00 C ATOM 70 CG ASN A 5 5.123 16.651 9.174 1.00 0.00 C ATOM 71 OD1 ASN A 5 4.806 17.305 8.200 1.00 0.00 O ATOM 72 ND2 ASN A 5 5.141 17.205 10.354 1.00 0.00 N ATOM 0 H ASN A 5 5.673 12.760 8.555 1.00 0.00 H new ATOM 0 HA ASN A 5 3.576 14.399 9.622 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.003 14.832 9.937 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.213 15.054 8.211 1.00 0.00 H new ATOM 0 HD21 ASN A 5 4.889 18.188 10.460 1.00 0.00 H new ATOM 0 HD22 ASN A 5 5.407 16.656 11.171 1.00 0.00 H new ATOM 79 N GLU A 6 4.037 14.556 6.366 1.00 0.00 N ATOM 80 CA GLU A 6 3.386 15.036 5.117 1.00 0.00 C ATOM 81 C GLU A 6 2.044 14.316 4.938 1.00 0.00 C ATOM 82 O GLU A 6 1.064 14.900 4.504 1.00 0.00 O ATOM 83 CB GLU A 6 4.309 14.733 3.934 1.00 0.00 C ATOM 84 CG GLU A 6 5.568 15.600 4.044 1.00 0.00 C ATOM 85 CD GLU A 6 6.596 15.161 2.997 1.00 0.00 C ATOM 86 OE1 GLU A 6 6.208 14.973 1.857 1.00 0.00 O ATOM 87 OE2 GLU A 6 7.754 15.030 3.353 1.00 0.00 O ATOM 0 H GLU A 6 4.874 13.990 6.227 1.00 0.00 H new ATOM 0 HA GLU A 6 3.207 16.110 5.171 1.00 0.00 H new ATOM 0 HB2 GLU A 6 4.579 13.677 3.929 1.00 0.00 H new ATOM 0 HB3 GLU A 6 3.795 14.935 2.995 1.00 0.00 H new ATOM 0 HG2 GLU A 6 5.312 16.649 3.897 1.00 0.00 H new ATOM 0 HG3 GLU A 6 5.994 15.513 5.044 1.00 0.00 H new ATOM 94 N LEU A 7 1.994 13.054 5.277 1.00 0.00 N ATOM 95 CA LEU A 7 0.728 12.280 5.138 1.00 0.00 C ATOM 96 C LEU A 7 -0.344 12.899 6.035 1.00 0.00 C ATOM 97 O LEU A 7 -1.490 13.022 5.659 1.00 0.00 O ATOM 98 CB LEU A 7 0.971 10.827 5.561 1.00 0.00 C ATOM 99 CG LEU A 7 -0.295 9.985 5.334 1.00 0.00 C ATOM 100 CD1 LEU A 7 -0.639 9.929 3.832 1.00 0.00 C ATOM 101 CD2 LEU A 7 -0.053 8.566 5.865 1.00 0.00 C ATOM 0 H LEU A 7 2.783 12.524 5.647 1.00 0.00 H new ATOM 0 HA LEU A 7 0.395 12.306 4.100 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.801 10.409 4.991 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.256 10.790 6.612 1.00 0.00 H new ATOM 0 HG LEU A 7 -1.131 10.441 5.864 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.538 9.329 3.687 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -0.813 10.939 3.461 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.190 9.479 3.285 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -0.946 7.962 5.708 1.00 0.00 H new ATOM 0 HD22 LEU A 7 0.787 8.117 5.334 1.00 0.00 H new ATOM 0 HD23 LEU A 7 0.173 8.610 6.930 1.00 0.00 H new ATOM 113 N LYS A 8 0.012 13.280 7.225 1.00 0.00 N ATOM 114 CA LYS A 8 -0.989 13.894 8.131 1.00 0.00 C ATOM 115 C LYS A 8 -1.393 15.274 7.606 1.00 0.00 C ATOM 116 O LYS A 8 -2.543 15.638 7.632 1.00 0.00 O ATOM 117 CB LYS A 8 -0.397 14.037 9.530 1.00 0.00 C ATOM 118 CG LYS A 8 -0.239 12.650 10.161 1.00 0.00 C ATOM 119 CD LYS A 8 0.161 12.790 11.637 1.00 0.00 C ATOM 120 CE LYS A 8 1.629 13.215 11.759 1.00 0.00 C ATOM 121 NZ LYS A 8 2.487 12.296 10.958 1.00 0.00 N ATOM 0 H LYS A 8 0.953 13.193 7.609 1.00 0.00 H new ATOM 0 HA LYS A 8 -1.870 13.253 8.172 1.00 0.00 H new ATOM 0 HB2 LYS A 8 0.570 14.537 9.478 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -1.044 14.658 10.149 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.174 12.095 10.080 1.00 0.00 H new ATOM 0 HG3 LYS A 8 0.518 12.080 9.622 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -0.478 13.526 12.125 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.007 11.842 12.153 1.00 0.00 H new ATOM 0 HE2 LYS A 8 1.751 14.240 11.408 1.00 0.00 H new ATOM 0 HE3 LYS A 8 1.937 13.197 12.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 3.485 12.443 11.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 2.221 11.311 11.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.355 12.492 9.945 1.00 0.00 H new ATOM 135 N VAL A 9 -0.450 16.050 7.144 1.00 0.00 N ATOM 136 CA VAL A 9 -0.780 17.413 6.634 1.00 0.00 C ATOM 137 C VAL A 9 -1.970 17.352 5.670 1.00 0.00 C ATOM 138 O VAL A 9 -3.017 17.909 5.930 1.00 0.00 O ATOM 139 CB VAL A 9 0.443 17.982 5.897 1.00 0.00 C ATOM 140 CG1 VAL A 9 0.033 19.193 5.045 1.00 0.00 C ATOM 141 CG2 VAL A 9 1.509 18.409 6.915 1.00 0.00 C ATOM 0 H VAL A 9 0.537 15.798 7.097 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.044 18.053 7.476 1.00 0.00 H new ATOM 0 HB VAL A 9 0.851 17.210 5.245 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.908 19.587 4.528 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.714 18.886 4.313 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -0.386 19.966 5.689 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.374 18.812 6.388 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.097 19.173 7.574 1.00 0.00 H new ATOM 0 HG23 VAL A 9 1.814 17.546 7.506 1.00 0.00 H new ATOM 151 N GLU A 10 -1.810 16.694 4.556 1.00 0.00 N ATOM 152 CA GLU A 10 -2.920 16.615 3.567 1.00 0.00 C ATOM 153 C GLU A 10 -4.172 16.055 4.237 1.00 0.00 C ATOM 154 O GLU A 10 -5.261 16.563 4.059 1.00 0.00 O ATOM 155 CB GLU A 10 -2.489 15.701 2.402 1.00 0.00 C ATOM 156 CG GLU A 10 -1.499 14.627 2.916 1.00 0.00 C ATOM 157 CD GLU A 10 -1.733 13.298 2.205 1.00 0.00 C ATOM 158 OE1 GLU A 10 -2.740 12.678 2.496 1.00 0.00 O ATOM 159 OE2 GLU A 10 -0.901 12.917 1.402 1.00 0.00 O ATOM 0 H GLU A 10 -0.955 16.206 4.287 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.145 17.611 3.185 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.363 15.222 1.961 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.021 16.294 1.616 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.474 14.959 2.749 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -1.621 14.497 3.991 1.00 0.00 H new ATOM 166 N ARG A 11 -4.028 15.024 5.005 1.00 0.00 N ATOM 167 CA ARG A 11 -5.207 14.440 5.687 1.00 0.00 C ATOM 168 C ARG A 11 -5.845 15.507 6.595 1.00 0.00 C ATOM 169 O ARG A 11 -7.056 15.661 6.639 1.00 0.00 O ATOM 170 CB ARG A 11 -4.728 13.236 6.508 1.00 0.00 C ATOM 171 CG ARG A 11 -5.920 12.559 7.246 1.00 0.00 C ATOM 172 CD ARG A 11 -5.607 12.362 8.748 1.00 0.00 C ATOM 173 NE ARG A 11 -6.879 12.314 9.526 1.00 0.00 N ATOM 174 CZ ARG A 11 -7.641 13.376 9.614 1.00 0.00 C ATOM 175 NH1 ARG A 11 -7.322 14.475 8.985 1.00 0.00 N ATOM 176 NH2 ARG A 11 -8.727 13.338 10.337 1.00 0.00 N ATOM 0 H ARG A 11 -3.141 14.556 5.192 1.00 0.00 H new ATOM 0 HA ARG A 11 -5.958 14.113 4.967 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.243 12.513 5.852 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -3.982 13.559 7.234 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -6.815 13.171 7.135 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -6.135 11.594 6.787 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -5.045 11.439 8.894 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -4.980 13.177 9.108 1.00 0.00 H new ATOM 0 HE ARG A 11 -7.157 11.450 9.992 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -6.474 14.511 8.420 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -7.921 15.297 9.059 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -8.981 12.483 10.832 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -9.322 14.163 10.407 1.00 0.00 H new ATOM 190 N ILE A 12 -5.029 16.245 7.305 1.00 0.00 N ATOM 191 CA ILE A 12 -5.543 17.322 8.202 1.00 0.00 C ATOM 192 C ILE A 12 -6.157 18.451 7.364 1.00 0.00 C ATOM 193 O ILE A 12 -7.203 18.974 7.686 1.00 0.00 O ATOM 194 CB ILE A 12 -4.380 17.877 9.037 1.00 0.00 C ATOM 195 CG1 ILE A 12 -3.918 16.819 10.046 1.00 0.00 C ATOM 196 CG2 ILE A 12 -4.830 19.136 9.787 1.00 0.00 C ATOM 197 CD1 ILE A 12 -2.542 17.205 10.597 1.00 0.00 C ATOM 0 H ILE A 12 -4.014 16.144 7.300 1.00 0.00 H new ATOM 0 HA ILE A 12 -6.309 16.912 8.860 1.00 0.00 H new ATOM 0 HB ILE A 12 -3.554 18.131 8.372 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.638 16.739 10.860 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.868 15.841 9.567 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -4.000 19.524 10.377 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -5.150 19.892 9.070 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -5.661 18.888 10.448 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.213 16.453 11.314 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.825 17.263 9.778 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.607 18.174 11.091 1.00 0.00 H new ATOM 209 N ARG A 13 -5.502 18.836 6.298 1.00 0.00 N ATOM 210 CA ARG A 13 -6.034 19.939 5.446 1.00 0.00 C ATOM 211 C ARG A 13 -7.462 19.610 5.014 1.00 0.00 C ATOM 212 O ARG A 13 -8.338 20.449 5.047 1.00 0.00 O ATOM 213 CB ARG A 13 -5.153 20.098 4.197 1.00 0.00 C ATOM 214 CG ARG A 13 -3.831 20.786 4.562 1.00 0.00 C ATOM 215 CD ARG A 13 -3.050 21.106 3.280 1.00 0.00 C ATOM 216 NE ARG A 13 -2.919 19.867 2.464 1.00 0.00 N ATOM 217 CZ ARG A 13 -2.128 19.831 1.423 1.00 0.00 C ATOM 218 NH1 ARG A 13 -1.437 20.884 1.085 1.00 0.00 N ATOM 219 NH2 ARG A 13 -2.033 18.735 0.718 1.00 0.00 N ATOM 0 H ARG A 13 -4.620 18.432 5.982 1.00 0.00 H new ATOM 0 HA ARG A 13 -6.029 20.867 6.018 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -4.953 19.121 3.758 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -5.680 20.684 3.444 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.027 21.702 5.119 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.239 20.139 5.210 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -3.565 21.879 2.709 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -2.064 21.498 3.529 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.453 19.036 2.720 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -1.512 21.741 1.633 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -0.822 20.851 0.272 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -2.575 17.911 0.980 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -1.417 18.703 -0.095 1.00 0.00 H new ATOM 233 N LEU A 14 -7.705 18.395 4.615 1.00 0.00 N ATOM 234 CA LEU A 14 -9.077 18.009 4.188 1.00 0.00 C ATOM 235 C LEU A 14 -9.860 17.550 5.419 1.00 0.00 C ATOM 236 O LEU A 14 -11.019 17.197 5.327 1.00 0.00 O ATOM 237 CB LEU A 14 -8.980 16.865 3.177 1.00 0.00 C ATOM 238 CG LEU A 14 -8.153 17.314 1.962 1.00 0.00 C ATOM 239 CD1 LEU A 14 -8.008 16.141 0.986 1.00 0.00 C ATOM 240 CD2 LEU A 14 -8.841 18.498 1.256 1.00 0.00 C ATOM 0 H LEU A 14 -7.010 17.650 4.566 1.00 0.00 H new ATOM 0 HA LEU A 14 -9.585 18.855 3.726 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.517 15.995 3.642 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.978 16.563 2.858 1.00 0.00 H new ATOM 0 HG LEU A 14 -7.167 17.634 2.299 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.422 16.456 0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -7.504 15.313 1.484 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.995 15.818 0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.245 18.806 0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -9.832 18.195 0.919 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.934 19.332 1.951 1.00 0.00 H new ATOM 252 N SER A 15 -9.222 17.556 6.569 1.00 0.00 N ATOM 253 CA SER A 15 -9.888 17.121 7.836 1.00 0.00 C ATOM 254 C SER A 15 -10.840 15.957 7.560 1.00 0.00 C ATOM 255 O SER A 15 -12.042 16.083 7.676 1.00 0.00 O ATOM 256 CB SER A 15 -10.653 18.297 8.450 1.00 0.00 C ATOM 257 OG SER A 15 -9.774 19.409 8.571 1.00 0.00 O ATOM 0 H SER A 15 -8.252 17.850 6.681 1.00 0.00 H new ATOM 0 HA SER A 15 -9.127 16.787 8.541 1.00 0.00 H new ATOM 0 HB2 SER A 15 -11.507 18.558 7.825 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.047 18.020 9.428 1.00 0.00 H new ATOM 0 HG SER A 15 -8.872 19.144 8.295 1.00 0.00 H new ATOM 263 N LEU A 16 -10.305 14.827 7.186 1.00 0.00 N ATOM 264 CA LEU A 16 -11.177 13.652 6.890 1.00 0.00 C ATOM 265 C LEU A 16 -11.555 12.955 8.195 1.00 0.00 C ATOM 266 O LEU A 16 -10.723 12.708 9.044 1.00 0.00 O ATOM 267 CB LEU A 16 -10.419 12.683 5.982 1.00 0.00 C ATOM 268 CG LEU A 16 -9.997 13.410 4.699 1.00 0.00 C ATOM 269 CD1 LEU A 16 -9.176 12.457 3.827 1.00 0.00 C ATOM 270 CD2 LEU A 16 -11.239 13.881 3.921 1.00 0.00 C ATOM 0 H LEU A 16 -9.304 14.665 7.072 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.086 13.983 6.388 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.541 12.295 6.498 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -11.049 11.828 5.738 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.396 14.281 4.962 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.874 12.969 2.914 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.289 12.136 4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.780 11.586 3.572 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.926 14.396 3.013 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.852 13.019 3.657 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.820 14.563 4.542 1.00 0.00 H new ATOM 282 N THR A 17 -12.812 12.648 8.368 1.00 0.00 N ATOM 283 CA THR A 17 -13.253 11.984 9.630 1.00 0.00 C ATOM 284 C THR A 17 -12.971 10.481 9.566 1.00 0.00 C ATOM 285 O THR A 17 -13.031 9.867 8.522 1.00 0.00 O ATOM 286 CB THR A 17 -14.755 12.218 9.822 1.00 0.00 C ATOM 287 OG1 THR A 17 -15.424 12.029 8.584 1.00 0.00 O ATOM 288 CG2 THR A 17 -14.994 13.646 10.315 1.00 0.00 C ATOM 0 H THR A 17 -13.553 12.828 7.691 1.00 0.00 H new ATOM 0 HA THR A 17 -12.702 12.407 10.469 1.00 0.00 H new ATOM 0 HB THR A 17 -15.140 11.512 10.558 1.00 0.00 H new ATOM 0 HG1 THR A 17 -16.383 12.192 8.702 1.00 0.00 H new ATOM 0 HG21 THR A 17 -16.063 13.810 10.451 1.00 0.00 H new ATOM 0 HG22 THR A 17 -14.481 13.794 11.265 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.609 14.354 9.581 1.00 0.00 H new ATOM 296 N ALA A 18 -12.668 9.892 10.691 1.00 0.00 N ATOM 297 CA ALA A 18 -12.384 8.434 10.729 1.00 0.00 C ATOM 298 C ALA A 18 -13.641 7.651 10.355 1.00 0.00 C ATOM 299 O ALA A 18 -13.580 6.659 9.657 1.00 0.00 O ATOM 300 CB ALA A 18 -11.946 8.053 12.145 1.00 0.00 C ATOM 0 H ALA A 18 -12.605 10.366 11.592 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.593 8.195 10.018 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -11.735 6.984 12.185 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -11.048 8.611 12.411 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.743 8.292 12.849 1.00 0.00 H new ATOM 306 N LYS A 19 -14.776 8.085 10.814 1.00 0.00 N ATOM 307 CA LYS A 19 -16.027 7.367 10.489 1.00 0.00 C ATOM 308 C LYS A 19 -16.292 7.440 8.985 1.00 0.00 C ATOM 309 O LYS A 19 -16.624 6.457 8.355 1.00 0.00 O ATOM 310 CB LYS A 19 -17.178 8.032 11.240 1.00 0.00 C ATOM 311 CG LYS A 19 -17.011 7.796 12.743 1.00 0.00 C ATOM 312 CD LYS A 19 -18.236 8.333 13.494 1.00 0.00 C ATOM 313 CE LYS A 19 -18.260 9.865 13.455 1.00 0.00 C ATOM 314 NZ LYS A 19 -19.205 10.366 14.494 1.00 0.00 N ATOM 0 H LYS A 19 -14.889 8.910 11.403 1.00 0.00 H new ATOM 0 HA LYS A 19 -15.939 6.321 10.783 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -17.195 9.101 11.029 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -18.131 7.625 10.901 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -16.890 6.731 12.942 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -16.108 8.292 13.100 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -19.147 7.938 13.045 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -18.215 7.990 14.528 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -17.260 10.261 13.634 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -18.568 10.211 12.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -19.226 11.406 14.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -20.158 9.997 14.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -18.891 10.045 15.432 1.00 0.00 H new ATOM 328 N SER A 20 -16.151 8.600 8.404 1.00 0.00 N ATOM 329 CA SER A 20 -16.399 8.734 6.944 1.00 0.00 C ATOM 330 C SER A 20 -15.368 7.917 6.165 1.00 0.00 C ATOM 331 O SER A 20 -15.701 7.189 5.252 1.00 0.00 O ATOM 332 CB SER A 20 -16.272 10.203 6.546 1.00 0.00 C ATOM 333 OG SER A 20 -14.935 10.629 6.766 1.00 0.00 O ATOM 0 H SER A 20 -15.875 9.460 8.879 1.00 0.00 H new ATOM 0 HA SER A 20 -17.400 8.369 6.715 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.541 10.333 5.498 1.00 0.00 H new ATOM 0 HB3 SER A 20 -16.962 10.812 7.130 1.00 0.00 H new ATOM 0 HG SER A 20 -14.919 11.301 7.479 1.00 0.00 H new ATOM 339 N VAL A 21 -14.117 8.037 6.516 1.00 0.00 N ATOM 340 CA VAL A 21 -13.063 7.275 5.794 1.00 0.00 C ATOM 341 C VAL A 21 -13.225 5.778 6.059 1.00 0.00 C ATOM 342 O VAL A 21 -13.187 4.972 5.154 1.00 0.00 O ATOM 343 CB VAL A 21 -11.688 7.725 6.289 1.00 0.00 C ATOM 344 CG1 VAL A 21 -10.604 6.900 5.598 1.00 0.00 C ATOM 345 CG2 VAL A 21 -11.483 9.208 5.967 1.00 0.00 C ATOM 0 H VAL A 21 -13.780 8.631 7.273 1.00 0.00 H new ATOM 0 HA VAL A 21 -13.155 7.463 4.724 1.00 0.00 H new ATOM 0 HB VAL A 21 -11.627 7.578 7.367 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.623 7.220 5.950 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -10.746 5.845 5.830 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.668 7.046 4.520 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.502 9.525 6.321 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.546 9.358 4.889 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.255 9.798 6.461 1.00 0.00 H new ATOM 355 N ALA A 22 -13.402 5.404 7.295 1.00 0.00 N ATOM 356 CA ALA A 22 -13.558 3.961 7.623 1.00 0.00 C ATOM 357 C ALA A 22 -14.844 3.417 7.001 1.00 0.00 C ATOM 358 O ALA A 22 -14.878 2.316 6.490 1.00 0.00 O ATOM 359 CB ALA A 22 -13.623 3.799 9.143 1.00 0.00 C ATOM 0 H ALA A 22 -13.445 6.037 8.093 1.00 0.00 H new ATOM 0 HA ALA A 22 -12.708 3.407 7.224 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.737 2.744 9.392 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.704 4.180 9.589 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.474 4.358 9.532 1.00 0.00 H new ATOM 365 N GLU A 23 -15.904 4.176 7.046 1.00 0.00 N ATOM 366 CA GLU A 23 -17.189 3.700 6.465 1.00 0.00 C ATOM 367 C GLU A 23 -17.075 3.606 4.939 1.00 0.00 C ATOM 368 O GLU A 23 -17.477 2.631 4.339 1.00 0.00 O ATOM 369 CB GLU A 23 -18.296 4.693 6.821 1.00 0.00 C ATOM 370 CG GLU A 23 -19.656 4.140 6.378 1.00 0.00 C ATOM 371 CD GLU A 23 -20.729 5.210 6.581 1.00 0.00 C ATOM 372 OE1 GLU A 23 -21.180 5.367 7.702 1.00 0.00 O ATOM 373 OE2 GLU A 23 -21.077 5.859 5.608 1.00 0.00 O ATOM 0 H GLU A 23 -15.935 5.107 7.461 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.421 2.715 6.869 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.301 4.876 7.896 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -18.107 5.651 6.336 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.616 3.843 5.330 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.903 3.248 6.953 1.00 0.00 H new ATOM 380 N GLU A 24 -16.546 4.620 4.311 1.00 0.00 N ATOM 381 CA GLU A 24 -16.421 4.600 2.825 1.00 0.00 C ATOM 382 C GLU A 24 -15.408 3.539 2.400 1.00 0.00 C ATOM 383 O GLU A 24 -15.668 2.730 1.532 1.00 0.00 O ATOM 384 CB GLU A 24 -15.944 5.976 2.352 1.00 0.00 C ATOM 385 CG GLU A 24 -17.023 7.027 2.649 1.00 0.00 C ATOM 386 CD GLU A 24 -18.145 6.928 1.613 1.00 0.00 C ATOM 387 OE1 GLU A 24 -17.949 7.416 0.512 1.00 0.00 O ATOM 388 OE2 GLU A 24 -19.171 6.349 1.930 1.00 0.00 O ATOM 0 H GLU A 24 -16.194 5.464 4.763 1.00 0.00 H new ATOM 0 HA GLU A 24 -17.388 4.364 2.381 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -15.015 6.242 2.855 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -15.732 5.951 1.283 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -17.426 6.874 3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -16.586 8.025 2.630 1.00 0.00 H new ATOM 395 N MET A 25 -14.254 3.533 3.006 1.00 0.00 N ATOM 396 CA MET A 25 -13.225 2.525 2.640 1.00 0.00 C ATOM 397 C MET A 25 -13.701 1.139 3.069 1.00 0.00 C ATOM 398 O MET A 25 -13.483 0.159 2.388 1.00 0.00 O ATOM 399 CB MET A 25 -11.913 2.858 3.349 1.00 0.00 C ATOM 400 CG MET A 25 -11.298 4.114 2.731 1.00 0.00 C ATOM 401 SD MET A 25 -9.807 4.567 3.652 1.00 0.00 S ATOM 402 CE MET A 25 -8.840 3.088 3.271 1.00 0.00 C ATOM 0 H MET A 25 -13.980 4.185 3.741 1.00 0.00 H new ATOM 0 HA MET A 25 -13.067 2.538 1.562 1.00 0.00 H new ATOM 0 HB2 MET A 25 -12.093 3.015 4.413 1.00 0.00 H new ATOM 0 HB3 MET A 25 -11.219 2.022 3.263 1.00 0.00 H new ATOM 0 HG2 MET A 25 -11.052 3.935 1.684 1.00 0.00 H new ATOM 0 HG3 MET A 25 -12.016 4.933 2.754 1.00 0.00 H new ATOM 0 HE1 MET A 25 -7.799 3.253 3.547 1.00 0.00 H new ATOM 0 HE2 MET A 25 -9.234 2.241 3.832 1.00 0.00 H new ATOM 0 HE3 MET A 25 -8.903 2.877 2.204 1.00 0.00 H new ATOM 412 N GLY A 26 -14.340 1.049 4.206 1.00 0.00 N ATOM 413 CA GLY A 26 -14.824 -0.274 4.694 1.00 0.00 C ATOM 414 C GLY A 26 -13.735 -0.929 5.547 1.00 0.00 C ATOM 415 O GLY A 26 -13.462 -2.104 5.414 1.00 0.00 O ATOM 0 H GLY A 26 -14.548 1.838 4.819 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -15.734 -0.147 5.280 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -15.076 -0.916 3.850 1.00 0.00 H new ATOM 419 N ILE A 27 -13.108 -0.172 6.421 1.00 0.00 N ATOM 420 CA ILE A 27 -12.025 -0.736 7.293 1.00 0.00 C ATOM 421 C ILE A 27 -12.317 -0.427 8.760 1.00 0.00 C ATOM 422 O ILE A 27 -13.104 0.440 9.082 1.00 0.00 O ATOM 423 CB ILE A 27 -10.676 -0.128 6.902 1.00 0.00 C ATOM 424 CG1 ILE A 27 -10.737 1.405 6.997 1.00 0.00 C ATOM 425 CG2 ILE A 27 -10.336 -0.536 5.470 1.00 0.00 C ATOM 426 CD1 ILE A 27 -9.323 1.987 6.879 1.00 0.00 C ATOM 0 H ILE A 27 -13.302 0.819 6.568 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.990 -1.817 7.156 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.908 -0.494 7.584 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -11.372 1.803 6.205 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -11.185 1.703 7.945 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.376 -0.105 5.187 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.279 -1.623 5.405 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.110 -0.172 4.794 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -9.370 3.074 6.947 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -8.702 1.600 7.686 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -8.891 1.702 5.920 1.00 0.00 H new ATOM 438 N SER A 28 -11.684 -1.135 9.651 1.00 0.00 N ATOM 439 CA SER A 28 -11.912 -0.900 11.100 1.00 0.00 C ATOM 440 C SER A 28 -11.219 0.393 11.537 1.00 0.00 C ATOM 441 O SER A 28 -10.207 0.787 10.995 1.00 0.00 O ATOM 442 CB SER A 28 -11.340 -2.076 11.887 1.00 0.00 C ATOM 443 OG SER A 28 -11.390 -1.778 13.274 1.00 0.00 O ATOM 0 H SER A 28 -11.013 -1.872 9.434 1.00 0.00 H new ATOM 0 HA SER A 28 -12.981 -0.808 11.290 1.00 0.00 H new ATOM 0 HB2 SER A 28 -11.910 -2.981 11.677 1.00 0.00 H new ATOM 0 HB3 SER A 28 -10.312 -2.268 11.581 1.00 0.00 H new ATOM 0 HG SER A 28 -11.025 -2.531 13.784 1.00 0.00 H new ATOM 449 N ARG A 29 -11.758 1.043 12.530 1.00 0.00 N ATOM 450 CA ARG A 29 -11.144 2.301 13.037 1.00 0.00 C ATOM 451 C ARG A 29 -9.749 1.986 13.595 1.00 0.00 C ATOM 452 O ARG A 29 -8.828 2.767 13.465 1.00 0.00 O ATOM 453 CB ARG A 29 -12.049 2.877 14.145 1.00 0.00 C ATOM 454 CG ARG A 29 -13.077 3.846 13.542 1.00 0.00 C ATOM 455 CD ARG A 29 -13.990 3.101 12.562 1.00 0.00 C ATOM 456 NE ARG A 29 -14.726 2.023 13.284 1.00 0.00 N ATOM 457 CZ ARG A 29 -15.789 1.484 12.748 1.00 0.00 C ATOM 458 NH1 ARG A 29 -16.215 1.892 11.583 1.00 0.00 N ATOM 459 NH2 ARG A 29 -16.426 0.533 13.377 1.00 0.00 N ATOM 0 H ARG A 29 -12.606 0.753 13.017 1.00 0.00 H new ATOM 0 HA ARG A 29 -11.046 3.033 12.235 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -12.563 2.067 14.663 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -11.442 3.395 14.887 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -13.673 4.297 14.336 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -12.564 4.659 13.028 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -14.696 3.796 12.107 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -13.399 2.672 11.753 1.00 0.00 H new ATOM 0 HE ARG A 29 -14.399 1.706 14.197 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -15.718 2.633 11.089 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -17.045 1.470 11.167 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -16.094 0.211 14.286 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -17.256 0.112 12.959 1.00 0.00 H new ATOM 473 N GLN A 30 -9.587 0.845 14.208 1.00 0.00 N ATOM 474 CA GLN A 30 -8.255 0.478 14.767 1.00 0.00 C ATOM 475 C GLN A 30 -7.220 0.489 13.643 1.00 0.00 C ATOM 476 O GLN A 30 -6.111 0.957 13.809 1.00 0.00 O ATOM 477 CB GLN A 30 -8.338 -0.928 15.373 1.00 0.00 C ATOM 478 CG GLN A 30 -7.134 -1.178 16.286 1.00 0.00 C ATOM 479 CD GLN A 30 -5.869 -1.322 15.436 1.00 0.00 C ATOM 480 OE1 GLN A 30 -4.953 -0.532 15.552 1.00 0.00 O ATOM 481 NE2 GLN A 30 -5.780 -2.304 14.583 1.00 0.00 N ATOM 0 H GLN A 30 -10.321 0.150 14.346 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.964 1.192 15.537 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.263 -1.034 15.940 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -8.363 -1.674 14.579 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -7.020 -0.353 16.989 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -7.293 -2.081 16.876 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -6.549 -2.967 14.486 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -4.941 -2.410 14.013 1.00 0.00 H new ATOM 490 N GLN A 31 -7.579 -0.012 12.495 1.00 0.00 N ATOM 491 CA GLN A 31 -6.627 -0.022 11.354 1.00 0.00 C ATOM 492 C GLN A 31 -6.310 1.417 10.954 1.00 0.00 C ATOM 493 O GLN A 31 -5.187 1.754 10.638 1.00 0.00 O ATOM 494 CB GLN A 31 -7.269 -0.743 10.165 1.00 0.00 C ATOM 495 CG GLN A 31 -7.426 -2.231 10.486 1.00 0.00 C ATOM 496 CD GLN A 31 -6.047 -2.886 10.566 1.00 0.00 C ATOM 497 OE1 GLN A 31 -5.415 -2.877 11.605 1.00 0.00 O ATOM 498 NE2 GLN A 31 -5.551 -3.460 9.504 1.00 0.00 N ATOM 0 H GLN A 31 -8.495 -0.416 12.298 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.711 -0.536 11.645 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.242 -0.304 9.944 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -6.653 -0.616 9.275 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -7.955 -2.356 11.431 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -8.027 -2.718 9.718 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -6.082 -3.467 8.633 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -4.632 -3.902 9.545 1.00 0.00 H new ATOM 507 N LEU A 32 -7.299 2.269 10.963 1.00 0.00 N ATOM 508 CA LEU A 32 -7.066 3.686 10.580 1.00 0.00 C ATOM 509 C LEU A 32 -6.088 4.339 11.559 1.00 0.00 C ATOM 510 O LEU A 32 -5.167 5.025 11.163 1.00 0.00 O ATOM 511 CB LEU A 32 -8.400 4.436 10.636 1.00 0.00 C ATOM 512 CG LEU A 32 -8.199 5.912 10.269 1.00 0.00 C ATOM 513 CD1 LEU A 32 -7.669 6.034 8.834 1.00 0.00 C ATOM 514 CD2 LEU A 32 -9.539 6.641 10.387 1.00 0.00 C ATOM 0 H LEU A 32 -8.260 2.042 11.220 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.647 3.726 9.574 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -9.111 3.977 9.949 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.827 4.358 11.636 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.473 6.358 10.948 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.531 7.086 8.585 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.715 5.513 8.753 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.385 5.589 8.143 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.406 7.691 10.128 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.261 6.188 9.707 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.906 6.564 11.410 1.00 0.00 H new ATOM 526 N CYS A 33 -6.286 4.139 12.831 1.00 0.00 N ATOM 527 CA CYS A 33 -5.380 4.756 13.835 1.00 0.00 C ATOM 528 C CYS A 33 -3.960 4.225 13.640 1.00 0.00 C ATOM 529 O CYS A 33 -2.993 4.944 13.787 1.00 0.00 O ATOM 530 CB CYS A 33 -5.889 4.415 15.245 1.00 0.00 C ATOM 531 SG CYS A 33 -5.541 5.789 16.375 1.00 0.00 S ATOM 0 H CYS A 33 -7.040 3.572 13.219 1.00 0.00 H new ATOM 0 HA CYS A 33 -5.367 5.839 13.709 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -6.961 4.218 15.217 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -5.408 3.506 15.605 1.00 0.00 H new ATOM 0 HG CYS A 33 -5.976 5.494 17.564 1.00 0.00 H new ATOM 537 N ASN A 34 -3.830 2.973 13.306 1.00 0.00 N ATOM 538 CA ASN A 34 -2.480 2.394 13.100 1.00 0.00 C ATOM 539 C ASN A 34 -1.795 3.101 11.929 1.00 0.00 C ATOM 540 O ASN A 34 -0.633 3.443 11.992 1.00 0.00 O ATOM 541 CB ASN A 34 -2.631 0.905 12.782 1.00 0.00 C ATOM 542 CG ASN A 34 -1.265 0.224 12.829 1.00 0.00 C ATOM 543 OD1 ASN A 34 -0.380 0.657 13.540 1.00 0.00 O ATOM 544 ND2 ASN A 34 -1.055 -0.833 12.094 1.00 0.00 N ATOM 0 H ASN A 34 -4.605 2.325 13.167 1.00 0.00 H new ATOM 0 HA ASN A 34 -1.876 2.524 13.998 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -3.305 0.437 13.499 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -3.077 0.778 11.796 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.147 -1.297 12.116 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -1.799 -1.195 11.498 1.00 0.00 H new ATOM 551 N ILE A 35 -2.515 3.333 10.864 1.00 0.00 N ATOM 552 CA ILE A 35 -1.920 4.027 9.689 1.00 0.00 C ATOM 553 C ILE A 35 -1.552 5.463 10.076 1.00 0.00 C ATOM 554 O ILE A 35 -0.510 5.967 9.714 1.00 0.00 O ATOM 555 CB ILE A 35 -2.935 4.055 8.541 1.00 0.00 C ATOM 556 CG1 ILE A 35 -3.175 2.628 8.034 1.00 0.00 C ATOM 557 CG2 ILE A 35 -2.388 4.918 7.398 1.00 0.00 C ATOM 558 CD1 ILE A 35 -4.356 2.614 7.055 1.00 0.00 C ATOM 0 H ILE A 35 -3.495 3.070 10.759 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.025 3.494 9.370 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.875 4.476 8.898 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.278 2.252 7.541 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.379 1.964 8.874 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.109 4.939 6.581 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.218 5.933 7.758 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.448 4.497 7.042 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.521 1.597 6.699 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.253 2.971 7.561 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.134 3.264 6.208 1.00 0.00 H new ATOM 570 N GLU A 36 -2.418 6.126 10.794 1.00 0.00 N ATOM 571 CA GLU A 36 -2.145 7.534 11.191 1.00 0.00 C ATOM 572 C GLU A 36 -0.815 7.625 11.945 1.00 0.00 C ATOM 573 O GLU A 36 -0.070 8.570 11.784 1.00 0.00 O ATOM 574 CB GLU A 36 -3.280 8.034 12.087 1.00 0.00 C ATOM 575 CG GLU A 36 -3.047 9.504 12.436 1.00 0.00 C ATOM 576 CD GLU A 36 -4.249 10.038 13.218 1.00 0.00 C ATOM 577 OE1 GLU A 36 -5.088 9.237 13.598 1.00 0.00 O ATOM 578 OE2 GLU A 36 -4.310 11.239 13.424 1.00 0.00 O ATOM 0 H GLU A 36 -3.307 5.749 11.123 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.082 8.152 10.295 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.237 7.918 11.578 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.328 7.437 12.997 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.138 9.609 13.029 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.903 10.087 11.526 1.00 0.00 H new ATOM 585 N GLN A 37 -0.508 6.655 12.765 1.00 0.00 N ATOM 586 CA GLN A 37 0.780 6.692 13.522 1.00 0.00 C ATOM 587 C GLN A 37 1.840 5.889 12.761 1.00 0.00 C ATOM 588 O GLN A 37 2.987 5.832 13.156 1.00 0.00 O ATOM 589 CB GLN A 37 0.565 6.079 14.911 1.00 0.00 C ATOM 590 CG GLN A 37 0.151 4.611 14.774 1.00 0.00 C ATOM 591 CD GLN A 37 -0.181 4.045 16.156 1.00 0.00 C ATOM 592 OE1 GLN A 37 -0.356 4.786 17.103 1.00 0.00 O ATOM 593 NE2 GLN A 37 -0.277 2.753 16.312 1.00 0.00 N ATOM 0 H GLN A 37 -1.092 5.838 12.944 1.00 0.00 H new ATOM 0 HA GLN A 37 1.117 7.723 13.628 1.00 0.00 H new ATOM 0 HB2 GLN A 37 1.481 6.154 15.497 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -0.204 6.634 15.448 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -0.714 4.526 14.117 1.00 0.00 H new ATOM 0 HG3 GLN A 37 0.956 4.036 14.317 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -0.130 2.131 15.517 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.499 2.365 17.229 1.00 0.00 H new ATOM 602 N SER A 38 1.464 5.263 11.677 1.00 0.00 N ATOM 603 CA SER A 38 2.447 4.459 10.897 1.00 0.00 C ATOM 604 C SER A 38 3.414 5.383 10.160 1.00 0.00 C ATOM 605 O SER A 38 3.068 6.472 9.752 1.00 0.00 O ATOM 606 CB SER A 38 1.712 3.586 9.883 1.00 0.00 C ATOM 607 OG SER A 38 2.657 2.791 9.181 1.00 0.00 O ATOM 0 H SER A 38 0.517 5.275 11.299 1.00 0.00 H new ATOM 0 HA SER A 38 3.008 3.827 11.585 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.988 2.949 10.391 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.153 4.210 9.185 1.00 0.00 H new ATOM 0 HG SER A 38 2.190 2.227 8.530 1.00 0.00 H new ATOM 613 N GLU A 39 4.630 4.944 9.992 1.00 0.00 N ATOM 614 CA GLU A 39 5.656 5.768 9.288 1.00 0.00 C ATOM 615 C GLU A 39 6.539 4.856 8.438 1.00 0.00 C ATOM 616 O GLU A 39 7.705 5.124 8.234 1.00 0.00 O ATOM 617 CB GLU A 39 6.516 6.512 10.321 1.00 0.00 C ATOM 618 CG GLU A 39 7.013 5.543 11.418 1.00 0.00 C ATOM 619 CD GLU A 39 7.266 6.316 12.717 1.00 0.00 C ATOM 620 OE1 GLU A 39 6.321 6.887 13.235 1.00 0.00 O ATOM 621 OE2 GLU A 39 8.399 6.320 13.171 1.00 0.00 O ATOM 0 H GLU A 39 4.963 4.036 10.317 1.00 0.00 H new ATOM 0 HA GLU A 39 5.163 6.496 8.644 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.369 6.976 9.825 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.935 7.315 10.774 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.273 4.761 11.588 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.929 5.050 11.093 1.00 0.00 H new ATOM 628 N THR A 40 5.993 3.775 7.940 1.00 0.00 N ATOM 629 CA THR A 40 6.794 2.838 7.095 1.00 0.00 C ATOM 630 C THR A 40 5.937 2.369 5.919 1.00 0.00 C ATOM 631 O THR A 40 5.011 1.599 6.075 1.00 0.00 O ATOM 632 CB THR A 40 7.228 1.634 7.940 1.00 0.00 C ATOM 633 OG1 THR A 40 7.495 0.527 7.088 1.00 0.00 O ATOM 634 CG2 THR A 40 6.121 1.266 8.928 1.00 0.00 C ATOM 0 H THR A 40 5.021 3.500 8.084 1.00 0.00 H new ATOM 0 HA THR A 40 7.681 3.345 6.716 1.00 0.00 H new ATOM 0 HB THR A 40 8.130 1.892 8.495 1.00 0.00 H new ATOM 0 HG1 THR A 40 7.774 -0.242 7.628 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.436 0.410 9.525 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.923 2.113 9.585 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.214 1.012 8.380 1.00 0.00 H new ATOM 642 N ALA A 41 6.240 2.838 4.741 1.00 0.00 N ATOM 643 CA ALA A 41 5.448 2.434 3.548 1.00 0.00 C ATOM 644 C ALA A 41 5.758 0.969 3.201 1.00 0.00 C ATOM 645 O ALA A 41 6.841 0.487 3.465 1.00 0.00 O ATOM 646 CB ALA A 41 5.830 3.332 2.368 1.00 0.00 C ATOM 0 H ALA A 41 7.005 3.486 4.553 1.00 0.00 H new ATOM 0 HA ALA A 41 4.383 2.537 3.759 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.254 3.043 1.489 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.615 4.371 2.617 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.894 3.222 2.157 1.00 0.00 H new ATOM 652 N PRO A 42 4.818 0.259 2.615 1.00 0.00 N ATOM 653 CA PRO A 42 5.019 -1.175 2.236 1.00 0.00 C ATOM 654 C PRO A 42 5.997 -1.354 1.062 1.00 0.00 C ATOM 655 O PRO A 42 6.183 -0.470 0.250 1.00 0.00 O ATOM 656 CB PRO A 42 3.605 -1.658 1.865 1.00 0.00 C ATOM 657 CG PRO A 42 2.867 -0.424 1.447 1.00 0.00 C ATOM 658 CD PRO A 42 3.466 0.734 2.252 1.00 0.00 C ATOM 0 HA PRO A 42 5.470 -1.746 3.048 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.638 -2.390 1.058 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.118 -2.140 2.713 1.00 0.00 H new ATOM 0 HG2 PRO A 42 2.977 -0.250 0.377 1.00 0.00 H new ATOM 0 HG3 PRO A 42 1.800 -0.524 1.646 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.510 1.649 1.662 1.00 0.00 H new ATOM 0 HD3 PRO A 42 2.870 0.954 3.137 1.00 0.00 H new ATOM 666 N VAL A 43 6.612 -2.502 0.976 1.00 0.00 N ATOM 667 CA VAL A 43 7.575 -2.775 -0.128 1.00 0.00 C ATOM 668 C VAL A 43 6.844 -2.694 -1.470 1.00 0.00 C ATOM 669 O VAL A 43 7.445 -2.495 -2.506 1.00 0.00 O ATOM 670 CB VAL A 43 8.169 -4.174 0.057 1.00 0.00 C ATOM 671 CG1 VAL A 43 7.078 -5.227 -0.112 1.00 0.00 C ATOM 672 CG2 VAL A 43 9.261 -4.414 -0.982 1.00 0.00 C ATOM 0 H VAL A 43 6.486 -3.272 1.633 1.00 0.00 H new ATOM 0 HA VAL A 43 8.377 -2.037 -0.111 1.00 0.00 H new ATOM 0 HB VAL A 43 8.594 -4.247 1.058 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.507 -6.220 0.021 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.298 -5.066 0.633 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.648 -5.148 -1.110 1.00 0.00 H new ATOM 0 HG21 VAL A 43 9.680 -5.411 -0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 43 8.836 -4.333 -1.982 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.048 -3.670 -0.861 1.00 0.00 H new ATOM 682 N VAL A 44 5.550 -2.847 -1.455 1.00 0.00 N ATOM 683 CA VAL A 44 4.769 -2.784 -2.720 1.00 0.00 C ATOM 684 C VAL A 44 4.982 -1.421 -3.382 1.00 0.00 C ATOM 685 O VAL A 44 5.194 -1.327 -4.573 1.00 0.00 O ATOM 686 CB VAL A 44 3.285 -2.966 -2.393 1.00 0.00 C ATOM 687 CG1 VAL A 44 2.448 -2.750 -3.655 1.00 0.00 C ATOM 688 CG2 VAL A 44 3.051 -4.381 -1.858 1.00 0.00 C ATOM 0 H VAL A 44 4.997 -3.014 -0.615 1.00 0.00 H new ATOM 0 HA VAL A 44 5.098 -3.570 -3.400 1.00 0.00 H new ATOM 0 HB VAL A 44 2.989 -2.238 -1.638 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.392 -2.880 -3.418 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.613 -1.741 -4.033 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.742 -3.474 -4.415 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.994 -4.512 -1.625 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.349 -5.109 -2.612 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.643 -4.531 -0.955 1.00 0.00 H new ATOM 698 N VAL A 45 4.937 -0.365 -2.617 1.00 0.00 N ATOM 699 CA VAL A 45 5.145 0.988 -3.201 1.00 0.00 C ATOM 700 C VAL A 45 6.546 1.063 -3.813 1.00 0.00 C ATOM 701 O VAL A 45 6.726 1.539 -4.913 1.00 0.00 O ATOM 702 CB VAL A 45 5.008 2.036 -2.093 1.00 0.00 C ATOM 703 CG1 VAL A 45 5.423 3.410 -2.626 1.00 0.00 C ATOM 704 CG2 VAL A 45 3.552 2.089 -1.619 1.00 0.00 C ATOM 0 H VAL A 45 4.765 -0.382 -1.612 1.00 0.00 H new ATOM 0 HA VAL A 45 4.403 1.178 -3.976 1.00 0.00 H new ATOM 0 HB VAL A 45 5.654 1.765 -1.258 1.00 0.00 H new ATOM 0 HG11 VAL A 45 5.324 4.153 -1.834 1.00 0.00 H new ATOM 0 HG12 VAL A 45 6.460 3.373 -2.961 1.00 0.00 H new ATOM 0 HG13 VAL A 45 4.781 3.685 -3.463 1.00 0.00 H new ATOM 0 HG21 VAL A 45 3.453 2.835 -0.830 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.907 2.358 -2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 45 3.259 1.112 -1.234 1.00 0.00 H new ATOM 714 N LYS A 46 7.536 0.585 -3.111 1.00 0.00 N ATOM 715 CA LYS A 46 8.920 0.619 -3.655 1.00 0.00 C ATOM 716 C LYS A 46 8.979 -0.235 -4.920 1.00 0.00 C ATOM 717 O LYS A 46 9.596 0.129 -5.900 1.00 0.00 O ATOM 718 CB LYS A 46 9.888 0.062 -2.613 1.00 0.00 C ATOM 719 CG LYS A 46 9.983 1.034 -1.434 1.00 0.00 C ATOM 720 CD LYS A 46 10.933 0.464 -0.380 1.00 0.00 C ATOM 721 CE LYS A 46 11.057 1.447 0.783 1.00 0.00 C ATOM 722 NZ LYS A 46 11.982 0.887 1.809 1.00 0.00 N ATOM 0 H LYS A 46 7.445 0.172 -2.183 1.00 0.00 H new ATOM 0 HA LYS A 46 9.200 1.645 -3.893 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.545 -0.913 -2.267 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.872 -0.085 -3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.343 2.004 -1.777 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.996 1.195 -1.001 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.560 -0.495 -0.021 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.913 0.280 -0.820 1.00 0.00 H new ATOM 0 HE2 LYS A 46 11.432 2.406 0.425 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.077 1.632 1.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 12.067 1.555 2.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.606 -0.018 2.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 12.919 0.732 1.384 1.00 0.00 H new ATOM 736 N TYR A 47 8.330 -1.365 -4.911 1.00 0.00 N ATOM 737 CA TYR A 47 8.339 -2.229 -6.116 1.00 0.00 C ATOM 738 C TYR A 47 7.724 -1.421 -7.263 1.00 0.00 C ATOM 739 O TYR A 47 8.243 -1.372 -8.361 1.00 0.00 O ATOM 740 CB TYR A 47 7.498 -3.482 -5.839 1.00 0.00 C ATOM 741 CG TYR A 47 7.823 -4.553 -6.852 1.00 0.00 C ATOM 742 CD1 TYR A 47 7.151 -4.593 -8.077 1.00 0.00 C ATOM 743 CD2 TYR A 47 8.806 -5.508 -6.561 1.00 0.00 C ATOM 744 CE1 TYR A 47 7.460 -5.587 -9.012 1.00 0.00 C ATOM 745 CE2 TYR A 47 9.116 -6.501 -7.496 1.00 0.00 C ATOM 746 CZ TYR A 47 8.443 -6.542 -8.722 1.00 0.00 C ATOM 747 OH TYR A 47 8.752 -7.518 -9.647 1.00 0.00 O ATOM 0 H TYR A 47 7.795 -1.725 -4.121 1.00 0.00 H new ATOM 0 HA TYR A 47 9.351 -2.540 -6.375 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.697 -3.849 -4.832 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.437 -3.236 -5.885 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.393 -3.857 -8.302 1.00 0.00 H new ATOM 0 HD2 TYR A 47 9.325 -5.477 -5.614 1.00 0.00 H new ATOM 0 HE1 TYR A 47 6.940 -5.618 -9.958 1.00 0.00 H new ATOM 0 HE2 TYR A 47 9.875 -7.236 -7.272 1.00 0.00 H new ATOM 0 HH TYR A 47 9.455 -8.098 -9.288 1.00 0.00 H new ATOM 757 N ILE A 48 6.626 -0.770 -6.990 1.00 0.00 N ATOM 758 CA ILE A 48 5.957 0.068 -8.021 1.00 0.00 C ATOM 759 C ILE A 48 6.868 1.242 -8.403 1.00 0.00 C ATOM 760 O ILE A 48 7.008 1.579 -9.560 1.00 0.00 O ATOM 761 CB ILE A 48 4.643 0.605 -7.446 1.00 0.00 C ATOM 762 CG1 ILE A 48 3.664 -0.558 -7.251 1.00 0.00 C ATOM 763 CG2 ILE A 48 4.037 1.633 -8.404 1.00 0.00 C ATOM 764 CD1 ILE A 48 2.469 -0.085 -6.420 1.00 0.00 C ATOM 0 H ILE A 48 6.159 -0.785 -6.083 1.00 0.00 H new ATOM 0 HA ILE A 48 5.756 -0.531 -8.909 1.00 0.00 H new ATOM 0 HB ILE A 48 4.837 1.085 -6.487 1.00 0.00 H new ATOM 0 HG12 ILE A 48 3.324 -0.928 -8.219 1.00 0.00 H new ATOM 0 HG13 ILE A 48 4.163 -1.388 -6.750 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.103 2.011 -7.989 1.00 0.00 H new ATOM 0 HG22 ILE A 48 4.734 2.460 -8.539 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.842 1.162 -9.367 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.772 -0.912 -6.281 1.00 0.00 H new ATOM 0 HD12 ILE A 48 2.817 0.264 -5.448 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.965 0.731 -6.939 1.00 0.00 H new ATOM 776 N ALA A 49 7.482 1.867 -7.435 1.00 0.00 N ATOM 777 CA ALA A 49 8.374 3.020 -7.738 1.00 0.00 C ATOM 778 C ALA A 49 9.464 2.572 -8.706 1.00 0.00 C ATOM 779 O ALA A 49 9.851 3.297 -9.600 1.00 0.00 O ATOM 780 CB ALA A 49 9.025 3.509 -6.442 1.00 0.00 C ATOM 0 H ALA A 49 7.404 1.628 -6.447 1.00 0.00 H new ATOM 0 HA ALA A 49 7.792 3.826 -8.185 1.00 0.00 H new ATOM 0 HB1 ALA A 49 9.679 4.353 -6.659 1.00 0.00 H new ATOM 0 HB2 ALA A 49 8.251 3.821 -5.741 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.609 2.701 -6.001 1.00 0.00 H new ATOM 786 N PHE A 50 9.955 1.381 -8.535 1.00 0.00 N ATOM 787 CA PHE A 50 11.016 0.875 -9.440 1.00 0.00 C ATOM 788 C PHE A 50 10.466 0.813 -10.869 1.00 0.00 C ATOM 789 O PHE A 50 11.090 1.265 -11.808 1.00 0.00 O ATOM 790 CB PHE A 50 11.420 -0.528 -8.972 1.00 0.00 C ATOM 791 CG PHE A 50 12.783 -0.886 -9.514 1.00 0.00 C ATOM 792 CD1 PHE A 50 13.928 -0.539 -8.788 1.00 0.00 C ATOM 793 CD2 PHE A 50 12.903 -1.568 -10.727 1.00 0.00 C ATOM 794 CE1 PHE A 50 15.195 -0.872 -9.277 1.00 0.00 C ATOM 795 CE2 PHE A 50 14.173 -1.904 -11.218 1.00 0.00 C ATOM 796 CZ PHE A 50 15.318 -1.554 -10.493 1.00 0.00 C ATOM 0 H PHE A 50 9.665 0.733 -7.803 1.00 0.00 H new ATOM 0 HA PHE A 50 11.885 1.533 -9.422 1.00 0.00 H new ATOM 0 HB2 PHE A 50 11.432 -0.567 -7.883 1.00 0.00 H new ATOM 0 HB3 PHE A 50 10.684 -1.258 -9.309 1.00 0.00 H new ATOM 0 HD1 PHE A 50 13.833 -0.014 -7.849 1.00 0.00 H new ATOM 0 HD2 PHE A 50 12.019 -1.836 -11.286 1.00 0.00 H new ATOM 0 HE1 PHE A 50 16.078 -0.603 -8.717 1.00 0.00 H new ATOM 0 HE2 PHE A 50 14.267 -2.433 -12.155 1.00 0.00 H new ATOM 0 HZ PHE A 50 16.296 -1.810 -10.872 1.00 0.00 H new ATOM 806 N LEU A 51 9.293 0.260 -11.033 1.00 0.00 N ATOM 807 CA LEU A 51 8.685 0.169 -12.389 1.00 0.00 C ATOM 808 C LEU A 51 8.375 1.575 -12.908 1.00 0.00 C ATOM 809 O LEU A 51 8.577 1.880 -14.069 1.00 0.00 O ATOM 810 CB LEU A 51 7.394 -0.653 -12.310 1.00 0.00 C ATOM 811 CG LEU A 51 7.729 -2.121 -11.993 1.00 0.00 C ATOM 812 CD1 LEU A 51 6.429 -2.896 -11.746 1.00 0.00 C ATOM 813 CD2 LEU A 51 8.506 -2.763 -13.163 1.00 0.00 C ATOM 0 H LEU A 51 8.729 -0.134 -10.280 1.00 0.00 H new ATOM 0 HA LEU A 51 9.382 -0.317 -13.072 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.739 -0.245 -11.540 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.853 -0.590 -13.254 1.00 0.00 H new ATOM 0 HG LEU A 51 8.354 -2.158 -11.101 1.00 0.00 H new ATOM 0 HD11 LEU A 51 6.663 -3.937 -11.521 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.896 -2.454 -10.904 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.803 -2.849 -12.637 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.735 -3.801 -12.922 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.898 -2.726 -14.067 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.434 -2.216 -13.327 1.00 0.00 H new ATOM 825 N ARG A 52 7.888 2.437 -12.059 1.00 0.00 N ATOM 826 CA ARG A 52 7.576 3.819 -12.503 1.00 0.00 C ATOM 827 C ARG A 52 8.863 4.531 -12.918 1.00 0.00 C ATOM 828 O ARG A 52 8.876 5.308 -13.850 1.00 0.00 O ATOM 829 CB ARG A 52 6.914 4.600 -11.364 1.00 0.00 C ATOM 830 CG ARG A 52 5.474 4.109 -11.141 1.00 0.00 C ATOM 831 CD ARG A 52 4.720 5.154 -10.315 1.00 0.00 C ATOM 832 NE ARG A 52 4.724 6.455 -11.071 1.00 0.00 N ATOM 833 CZ ARG A 52 4.983 7.599 -10.472 1.00 0.00 C ATOM 834 NH1 ARG A 52 5.260 7.649 -9.195 1.00 0.00 N ATOM 835 NH2 ARG A 52 4.971 8.705 -11.168 1.00 0.00 N ATOM 0 H ARG A 52 7.693 2.241 -11.077 1.00 0.00 H new ATOM 0 HA ARG A 52 6.894 3.769 -13.352 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.492 4.479 -10.448 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.909 5.664 -11.599 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.976 3.953 -12.098 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.478 3.150 -10.623 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.697 4.826 -10.132 1.00 0.00 H new ATOM 0 HD3 ARG A 52 5.193 5.280 -9.341 1.00 0.00 H new ATOM 0 HE ARG A 52 4.521 6.451 -12.071 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.278 6.791 -8.643 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.458 8.546 -8.751 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.762 8.677 -12.166 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.170 9.596 -10.713 1.00 0.00 H new ATOM 849 N SER A 53 9.943 4.280 -12.235 1.00 0.00 N ATOM 850 CA SER A 53 11.218 4.953 -12.597 1.00 0.00 C ATOM 851 C SER A 53 11.589 4.595 -14.038 1.00 0.00 C ATOM 852 O SER A 53 12.324 5.306 -14.693 1.00 0.00 O ATOM 853 CB SER A 53 12.320 4.489 -11.648 1.00 0.00 C ATOM 854 OG SER A 53 12.572 3.108 -11.865 1.00 0.00 O ATOM 0 H SER A 53 9.998 3.639 -11.443 1.00 0.00 H new ATOM 0 HA SER A 53 11.102 6.034 -12.514 1.00 0.00 H new ATOM 0 HB2 SER A 53 13.228 5.068 -11.816 1.00 0.00 H new ATOM 0 HB3 SER A 53 12.021 4.658 -10.614 1.00 0.00 H new ATOM 0 HG SER A 53 11.721 2.628 -11.941 1.00 0.00 H new ATOM 860 N LYS A 54 11.073 3.506 -14.546 1.00 0.00 N ATOM 861 CA LYS A 54 11.376 3.116 -15.952 1.00 0.00 C ATOM 862 C LYS A 54 10.341 3.756 -16.882 1.00 0.00 C ATOM 863 O LYS A 54 10.354 3.545 -18.078 1.00 0.00 O ATOM 864 CB LYS A 54 11.320 1.592 -16.076 1.00 0.00 C ATOM 865 CG LYS A 54 12.532 0.974 -15.377 1.00 0.00 C ATOM 866 CD LYS A 54 12.453 -0.550 -15.473 1.00 0.00 C ATOM 867 CE LYS A 54 13.686 -1.165 -14.813 1.00 0.00 C ATOM 868 NZ LYS A 54 13.603 -2.651 -14.885 1.00 0.00 N ATOM 0 H LYS A 54 10.453 2.869 -14.045 1.00 0.00 H new ATOM 0 HA LYS A 54 12.372 3.460 -16.230 1.00 0.00 H new ATOM 0 HB2 LYS A 54 10.399 1.215 -15.631 1.00 0.00 H new ATOM 0 HB3 LYS A 54 11.307 1.303 -17.127 1.00 0.00 H new ATOM 0 HG2 LYS A 54 13.453 1.331 -15.839 1.00 0.00 H new ATOM 0 HG3 LYS A 54 12.559 1.282 -14.332 1.00 0.00 H new ATOM 0 HD2 LYS A 54 11.548 -0.910 -14.984 1.00 0.00 H new ATOM 0 HD3 LYS A 54 12.395 -0.857 -16.517 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.590 -0.817 -15.312 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.752 -0.844 -13.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 14.178 -3.068 -14.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.613 -2.949 -14.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.960 -2.974 -15.807 1.00 0.00 H new ATOM 882 N GLY A 55 9.450 4.546 -16.339 1.00 0.00 N ATOM 883 CA GLY A 55 8.418 5.213 -17.183 1.00 0.00 C ATOM 884 C GLY A 55 7.273 4.244 -17.488 1.00 0.00 C ATOM 885 O GLY A 55 6.565 4.404 -18.460 1.00 0.00 O ATOM 0 H GLY A 55 9.394 4.757 -15.343 1.00 0.00 H new ATOM 0 HA2 GLY A 55 8.031 6.093 -16.669 1.00 0.00 H new ATOM 0 HA3 GLY A 55 8.868 5.559 -18.113 1.00 0.00 H new ATOM 889 N VAL A 56 7.086 3.239 -16.677 1.00 0.00 N ATOM 890 CA VAL A 56 5.986 2.268 -16.948 1.00 0.00 C ATOM 891 C VAL A 56 4.628 2.946 -16.743 1.00 0.00 C ATOM 892 O VAL A 56 4.394 3.606 -15.752 1.00 0.00 O ATOM 893 CB VAL A 56 6.133 1.075 -16.003 1.00 0.00 C ATOM 894 CG1 VAL A 56 4.971 0.096 -16.208 1.00 0.00 C ATOM 895 CG2 VAL A 56 7.454 0.369 -16.307 1.00 0.00 C ATOM 0 H VAL A 56 7.642 3.048 -15.844 1.00 0.00 H new ATOM 0 HA VAL A 56 6.045 1.922 -17.980 1.00 0.00 H new ATOM 0 HB VAL A 56 6.122 1.423 -14.970 1.00 0.00 H new ATOM 0 HG11 VAL A 56 5.084 -0.750 -15.531 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.028 0.602 -16.001 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.973 -0.261 -17.238 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.572 -0.485 -15.640 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.453 0.024 -17.341 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.281 1.064 -16.157 1.00 0.00 H new ATOM 905 N ASP A 57 3.735 2.790 -17.683 1.00 0.00 N ATOM 906 CA ASP A 57 2.391 3.427 -17.564 1.00 0.00 C ATOM 907 C ASP A 57 1.531 2.640 -16.569 1.00 0.00 C ATOM 908 O ASP A 57 0.431 2.222 -16.868 1.00 0.00 O ATOM 909 CB ASP A 57 1.727 3.449 -18.957 1.00 0.00 C ATOM 910 CG ASP A 57 2.110 4.738 -19.694 1.00 0.00 C ATOM 911 OD1 ASP A 57 1.752 5.799 -19.209 1.00 0.00 O ATOM 912 OD2 ASP A 57 2.750 4.643 -20.728 1.00 0.00 O ATOM 0 H ASP A 57 3.879 2.245 -18.533 1.00 0.00 H new ATOM 0 HA ASP A 57 2.491 4.448 -17.197 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.044 2.581 -19.535 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.644 3.386 -18.855 1.00 0.00 H new ATOM 917 N LEU A 58 2.028 2.446 -15.381 1.00 0.00 N ATOM 918 CA LEU A 58 1.246 1.705 -14.355 1.00 0.00 C ATOM 919 C LEU A 58 0.184 2.631 -13.767 1.00 0.00 C ATOM 920 O LEU A 58 -0.826 2.192 -13.256 1.00 0.00 O ATOM 921 CB LEU A 58 2.191 1.234 -13.242 1.00 0.00 C ATOM 922 CG LEU A 58 1.510 0.145 -12.390 1.00 0.00 C ATOM 923 CD1 LEU A 58 1.695 -1.231 -13.043 1.00 0.00 C ATOM 924 CD2 LEU A 58 2.135 0.126 -10.991 1.00 0.00 C ATOM 0 H LEU A 58 2.946 2.770 -15.075 1.00 0.00 H new ATOM 0 HA LEU A 58 0.763 0.841 -14.811 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.111 0.843 -13.677 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.470 2.078 -12.611 1.00 0.00 H new ATOM 0 HG LEU A 58 0.445 0.367 -12.318 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.210 -1.992 -12.432 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.248 -1.225 -14.037 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.759 -1.455 -13.124 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.654 -0.644 -10.388 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.201 -0.089 -11.071 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.996 1.098 -10.517 1.00 0.00 H new ATOM 936 N ASN A 59 0.408 3.912 -13.834 1.00 0.00 N ATOM 937 CA ASN A 59 -0.585 4.869 -13.275 1.00 0.00 C ATOM 938 C ASN A 59 -1.897 4.727 -14.048 1.00 0.00 C ATOM 939 O ASN A 59 -2.973 4.847 -13.498 1.00 0.00 O ATOM 940 CB ASN A 59 -0.049 6.308 -13.403 1.00 0.00 C ATOM 941 CG ASN A 59 1.478 6.301 -13.304 1.00 0.00 C ATOM 942 OD1 ASN A 59 2.031 6.104 -12.240 1.00 0.00 O ATOM 943 ND2 ASN A 59 2.189 6.507 -14.381 1.00 0.00 N ATOM 0 H ASN A 59 1.235 4.338 -14.251 1.00 0.00 H new ATOM 0 HA ASN A 59 -0.757 4.653 -12.221 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.359 6.738 -14.355 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.471 6.935 -12.617 1.00 0.00 H new ATOM 0 HD21 ASN A 59 3.208 6.502 -14.328 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.725 6.672 -15.274 1.00 0.00 H new ATOM 950 N ALA A 60 -1.811 4.470 -15.323 1.00 0.00 N ATOM 951 CA ALA A 60 -3.044 4.315 -16.141 1.00 0.00 C ATOM 952 C ALA A 60 -3.879 3.156 -15.594 1.00 0.00 C ATOM 953 O ALA A 60 -5.077 3.268 -15.417 1.00 0.00 O ATOM 954 CB ALA A 60 -2.644 4.007 -17.585 1.00 0.00 C ATOM 0 H ALA A 60 -0.936 4.360 -15.835 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.629 5.234 -16.102 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.541 3.891 -18.194 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.041 4.826 -17.978 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.065 3.084 -17.613 1.00 0.00 H new ATOM 960 N LEU A 61 -3.255 2.046 -15.321 1.00 0.00 N ATOM 961 CA LEU A 61 -4.005 0.881 -14.786 1.00 0.00 C ATOM 962 C LEU A 61 -4.599 1.239 -13.425 1.00 0.00 C ATOM 963 O LEU A 61 -5.725 0.909 -13.130 1.00 0.00 O ATOM 964 CB LEU A 61 -3.046 -0.303 -14.629 1.00 0.00 C ATOM 965 CG LEU A 61 -2.610 -0.813 -16.012 1.00 0.00 C ATOM 966 CD1 LEU A 61 -1.414 -1.756 -15.840 1.00 0.00 C ATOM 967 CD2 LEU A 61 -3.766 -1.563 -16.705 1.00 0.00 C ATOM 0 H LEU A 61 -2.254 1.896 -15.446 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.809 0.615 -15.472 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.172 0.000 -14.052 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.533 -1.105 -14.073 1.00 0.00 H new ATOM 0 HG LEU A 61 -2.331 0.038 -16.634 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.097 -2.123 -16.816 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -0.591 -1.218 -15.370 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.702 -2.598 -15.211 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.437 -1.916 -17.682 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.065 -2.414 -16.094 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.614 -0.889 -16.829 1.00 0.00 H new ATOM 979 N PHE A 62 -3.848 1.915 -12.602 1.00 0.00 N ATOM 980 CA PHE A 62 -4.356 2.301 -11.254 1.00 0.00 C ATOM 981 C PHE A 62 -5.594 3.198 -11.394 1.00 0.00 C ATOM 982 O PHE A 62 -6.551 3.062 -10.662 1.00 0.00 O ATOM 983 CB PHE A 62 -3.230 3.066 -10.510 1.00 0.00 C ATOM 984 CG PHE A 62 -2.620 2.197 -9.429 1.00 0.00 C ATOM 985 CD1 PHE A 62 -1.923 1.037 -9.779 1.00 0.00 C ATOM 986 CD2 PHE A 62 -2.755 2.553 -8.080 1.00 0.00 C ATOM 987 CE1 PHE A 62 -1.359 0.231 -8.784 1.00 0.00 C ATOM 988 CE2 PHE A 62 -2.192 1.748 -7.085 1.00 0.00 C ATOM 989 CZ PHE A 62 -1.493 0.587 -7.436 1.00 0.00 C ATOM 0 H PHE A 62 -2.896 2.220 -12.806 1.00 0.00 H new ATOM 0 HA PHE A 62 -4.639 1.410 -10.693 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -2.459 3.369 -11.219 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -3.633 3.977 -10.068 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.820 0.763 -10.818 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.294 3.449 -7.809 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.821 -0.665 -9.055 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.296 2.022 -6.046 1.00 0.00 H new ATOM 0 HZ PHE A 62 -1.057 -0.034 -6.667 1.00 0.00 H new ATOM 999 N ASP A 63 -5.574 4.119 -12.311 1.00 0.00 N ATOM 1000 CA ASP A 63 -6.736 5.032 -12.474 1.00 0.00 C ATOM 1001 C ASP A 63 -7.989 4.239 -12.864 1.00 0.00 C ATOM 1002 O ASP A 63 -9.080 4.551 -12.429 1.00 0.00 O ATOM 1003 CB ASP A 63 -6.402 6.070 -13.546 1.00 0.00 C ATOM 1004 CG ASP A 63 -5.359 7.047 -12.990 1.00 0.00 C ATOM 1005 OD1 ASP A 63 -5.316 7.216 -11.782 1.00 0.00 O ATOM 1006 OD2 ASP A 63 -4.623 7.605 -13.784 1.00 0.00 O ATOM 0 H ASP A 63 -4.801 4.280 -12.957 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.940 5.537 -11.530 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.018 5.578 -14.439 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -7.302 6.609 -13.841 1.00 0.00 H new ATOM 1011 N ARG A 64 -7.856 3.217 -13.668 1.00 0.00 N ATOM 1012 CA ARG A 64 -9.061 2.419 -14.053 1.00 0.00 C ATOM 1013 C ARG A 64 -9.691 1.793 -12.803 1.00 0.00 C ATOM 1014 O ARG A 64 -10.889 1.615 -12.725 1.00 0.00 O ATOM 1015 CB ARG A 64 -8.678 1.296 -15.028 1.00 0.00 C ATOM 1016 CG ARG A 64 -8.341 1.879 -16.406 1.00 0.00 C ATOM 1017 CD ARG A 64 -8.201 0.741 -17.430 1.00 0.00 C ATOM 1018 NE ARG A 64 -7.369 1.207 -18.575 1.00 0.00 N ATOM 1019 CZ ARG A 64 -7.324 0.510 -19.679 1.00 0.00 C ATOM 1020 NH1 ARG A 64 -8.026 -0.586 -19.792 1.00 0.00 N ATOM 1021 NH2 ARG A 64 -6.575 0.912 -20.670 1.00 0.00 N ATOM 0 H ARG A 64 -6.974 2.901 -14.072 1.00 0.00 H new ATOM 0 HA ARG A 64 -9.773 3.088 -14.536 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -7.822 0.744 -14.640 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -9.501 0.586 -15.117 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -9.123 2.570 -16.720 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -7.414 2.450 -16.353 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.741 -0.130 -16.962 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.185 0.431 -17.783 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.834 2.072 -18.497 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.611 -0.899 -19.017 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.989 -1.128 -20.655 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.027 1.768 -20.581 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -6.538 0.370 -21.533 1.00 0.00 H new ATOM 1035 N ILE A 65 -8.889 1.441 -11.836 1.00 0.00 N ATOM 1036 CA ILE A 65 -9.428 0.809 -10.598 1.00 0.00 C ATOM 1037 C ILE A 65 -10.365 1.776 -9.867 1.00 0.00 C ATOM 1038 O ILE A 65 -11.402 1.379 -9.375 1.00 0.00 O ATOM 1039 CB ILE A 65 -8.261 0.440 -9.677 1.00 0.00 C ATOM 1040 CG1 ILE A 65 -7.231 -0.387 -10.456 1.00 0.00 C ATOM 1041 CG2 ILE A 65 -8.765 -0.363 -8.477 1.00 0.00 C ATOM 1042 CD1 ILE A 65 -7.893 -1.605 -11.115 1.00 0.00 C ATOM 0 H ILE A 65 -7.877 1.565 -11.850 1.00 0.00 H new ATOM 0 HA ILE A 65 -9.990 -0.085 -10.870 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.794 1.356 -9.316 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -6.762 0.234 -11.219 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.440 -0.718 -9.783 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.925 -0.618 -7.831 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.485 0.233 -7.917 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -9.245 -1.277 -8.827 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.142 -2.176 -11.662 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -8.340 -2.236 -10.347 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -8.667 -1.269 -11.805 1.00 0.00 H new ATOM 1282 N GLU B 2 -7.606 -9.170 -11.818 1.00 0.00 N ATOM 1283 CA GLU B 2 -6.623 -9.230 -10.694 1.00 0.00 C ATOM 1284 C GLU B 2 -5.451 -8.283 -10.970 1.00 0.00 C ATOM 1285 O GLU B 2 -4.945 -8.204 -12.070 1.00 0.00 O ATOM 1286 CB GLU B 2 -6.115 -10.668 -10.516 1.00 0.00 C ATOM 1287 CG GLU B 2 -7.309 -11.642 -10.529 1.00 0.00 C ATOM 1288 CD GLU B 2 -6.975 -12.900 -9.719 1.00 0.00 C ATOM 1289 OE1 GLU B 2 -5.808 -13.244 -9.645 1.00 0.00 O ATOM 1290 OE2 GLU B 2 -7.897 -13.495 -9.187 1.00 0.00 O ATOM 0 HA GLU B 2 -7.117 -8.917 -9.774 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -5.418 -10.920 -11.315 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -5.569 -10.758 -9.577 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -8.190 -11.155 -10.111 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.553 -11.916 -11.555 1.00 0.00 H new ATOM 1297 N LEU B 3 -5.025 -7.557 -9.968 1.00 0.00 N ATOM 1298 CA LEU B 3 -3.895 -6.602 -10.153 1.00 0.00 C ATOM 1299 C LEU B 3 -2.624 -7.369 -10.513 1.00 0.00 C ATOM 1300 O LEU B 3 -1.871 -6.973 -11.377 1.00 0.00 O ATOM 1301 CB LEU B 3 -3.663 -5.836 -8.841 1.00 0.00 C ATOM 1302 CG LEU B 3 -2.545 -4.793 -9.019 1.00 0.00 C ATOM 1303 CD1 LEU B 3 -2.980 -3.707 -10.017 1.00 0.00 C ATOM 1304 CD2 LEU B 3 -2.241 -4.152 -7.660 1.00 0.00 C ATOM 0 H LEU B 3 -5.414 -7.586 -9.026 1.00 0.00 H new ATOM 0 HA LEU B 3 -4.138 -5.906 -10.955 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -4.584 -5.342 -8.533 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -3.395 -6.534 -8.048 1.00 0.00 H new ATOM 0 HG LEU B 3 -1.653 -5.284 -9.407 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -2.179 -2.977 -10.132 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -3.195 -4.165 -10.982 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -3.875 -3.208 -9.645 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -1.450 -3.411 -7.776 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -3.139 -3.667 -7.278 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -1.918 -4.921 -6.959 1.00 0.00 H new ATOM 1316 N SER B 4 -2.376 -8.456 -9.848 1.00 0.00 N ATOM 1317 CA SER B 4 -1.147 -9.240 -10.128 1.00 0.00 C ATOM 1318 C SER B 4 -1.077 -9.625 -11.606 1.00 0.00 C ATOM 1319 O SER B 4 -0.019 -9.650 -12.192 1.00 0.00 O ATOM 1320 CB SER B 4 -1.173 -10.514 -9.284 1.00 0.00 C ATOM 1321 OG SER B 4 -1.169 -10.162 -7.903 1.00 0.00 O ATOM 0 H SER B 4 -2.976 -8.839 -9.117 1.00 0.00 H new ATOM 0 HA SER B 4 -0.276 -8.633 -9.882 1.00 0.00 H new ATOM 0 HB2 SER B 4 -2.060 -11.102 -9.519 1.00 0.00 H new ATOM 0 HB3 SER B 4 -0.308 -11.136 -9.516 1.00 0.00 H new ATOM 0 HG SER B 4 -1.345 -9.203 -7.809 1.00 0.00 H new ATOM 1327 N ASN B 5 -2.184 -9.945 -12.210 1.00 0.00 N ATOM 1328 CA ASN B 5 -2.158 -10.360 -13.643 1.00 0.00 C ATOM 1329 C ASN B 5 -1.603 -9.235 -14.533 1.00 0.00 C ATOM 1330 O ASN B 5 -0.777 -9.467 -15.393 1.00 0.00 O ATOM 1331 CB ASN B 5 -3.592 -10.688 -14.076 1.00 0.00 C ATOM 1332 CG ASN B 5 -3.592 -11.645 -15.273 1.00 0.00 C ATOM 1333 OD1 ASN B 5 -2.463 -11.986 -15.832 1.00 0.00 O flip ATOM 1334 ND2 ASN B 5 -4.639 -12.084 -15.706 1.00 0.00 N flip ATOM 0 H ASN B 5 -3.107 -9.938 -11.776 1.00 0.00 H new ATOM 0 HA ASN B 5 -1.511 -11.230 -13.752 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -4.134 -11.138 -13.244 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -4.117 -9.769 -14.339 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -5.522 -11.819 -15.270 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -4.635 -12.718 -16.505 1.00 0.00 H new ATOM 1341 N GLU B 6 -2.052 -8.024 -14.342 1.00 0.00 N ATOM 1342 CA GLU B 6 -1.553 -6.900 -15.186 1.00 0.00 C ATOM 1343 C GLU B 6 -0.092 -6.609 -14.847 1.00 0.00 C ATOM 1344 O GLU B 6 0.752 -6.497 -15.717 1.00 0.00 O ATOM 1345 CB GLU B 6 -2.404 -5.656 -14.903 1.00 0.00 C ATOM 1346 CG GLU B 6 -3.753 -5.772 -15.623 1.00 0.00 C ATOM 1347 CD GLU B 6 -4.393 -7.132 -15.325 1.00 0.00 C ATOM 1348 OE1 GLU B 6 -4.989 -7.265 -14.270 1.00 0.00 O ATOM 1349 OE2 GLU B 6 -4.271 -8.015 -16.158 1.00 0.00 O ATOM 0 H GLU B 6 -2.743 -7.764 -13.638 1.00 0.00 H new ATOM 0 HA GLU B 6 -1.625 -7.169 -16.240 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -2.563 -5.550 -13.830 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -1.879 -4.761 -15.238 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -4.417 -4.970 -15.300 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -3.612 -5.655 -16.698 1.00 0.00 H new ATOM 1356 N LEU B 7 0.215 -6.496 -13.586 1.00 0.00 N ATOM 1357 CA LEU B 7 1.618 -6.223 -13.191 1.00 0.00 C ATOM 1358 C LEU B 7 2.501 -7.385 -13.637 1.00 0.00 C ATOM 1359 O LEU B 7 3.573 -7.183 -14.152 1.00 0.00 O ATOM 1360 CB LEU B 7 1.693 -6.072 -11.659 1.00 0.00 C ATOM 1361 CG LEU B 7 1.427 -4.620 -11.253 1.00 0.00 C ATOM 1362 CD1 LEU B 7 0.029 -4.198 -11.708 1.00 0.00 C ATOM 1363 CD2 LEU B 7 1.529 -4.506 -9.731 1.00 0.00 C ATOM 0 H LEU B 7 -0.446 -6.581 -12.814 1.00 0.00 H new ATOM 0 HA LEU B 7 1.964 -5.304 -13.663 1.00 0.00 H new ATOM 0 HB2 LEU B 7 0.962 -6.728 -11.186 1.00 0.00 H new ATOM 0 HB3 LEU B 7 2.676 -6.381 -11.304 1.00 0.00 H new ATOM 0 HG LEU B 7 2.162 -3.968 -11.725 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -0.152 -3.164 -11.415 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -0.043 -4.286 -12.792 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -0.716 -4.843 -11.241 1.00 0.00 H new ATOM 0 HD21 LEU B 7 1.341 -3.475 -9.430 1.00 0.00 H new ATOM 0 HD22 LEU B 7 0.791 -5.160 -9.267 1.00 0.00 H new ATOM 0 HD23 LEU B 7 2.528 -4.801 -9.410 1.00 0.00 H new ATOM 1375 N LYS B 8 2.051 -8.595 -13.454 1.00 0.00 N ATOM 1376 CA LYS B 8 2.869 -9.773 -13.861 1.00 0.00 C ATOM 1377 C LYS B 8 3.256 -9.660 -15.335 1.00 0.00 C ATOM 1378 O LYS B 8 4.377 -9.936 -15.710 1.00 0.00 O ATOM 1379 CB LYS B 8 2.047 -11.047 -13.645 1.00 0.00 C ATOM 1380 CG LYS B 8 2.892 -12.274 -13.973 1.00 0.00 C ATOM 1381 CD LYS B 8 2.073 -13.538 -13.706 1.00 0.00 C ATOM 1382 CE LYS B 8 2.921 -14.768 -14.024 1.00 0.00 C ATOM 1383 NZ LYS B 8 4.099 -14.803 -13.112 1.00 0.00 N ATOM 0 H LYS B 8 1.147 -8.820 -13.038 1.00 0.00 H new ATOM 0 HA LYS B 8 3.778 -9.808 -13.260 1.00 0.00 H new ATOM 0 HB2 LYS B 8 1.703 -11.097 -12.612 1.00 0.00 H new ATOM 0 HB3 LYS B 8 1.158 -11.028 -14.276 1.00 0.00 H new ATOM 0 HG2 LYS B 8 3.207 -12.245 -15.016 1.00 0.00 H new ATOM 0 HG3 LYS B 8 3.798 -12.279 -13.367 1.00 0.00 H new ATOM 0 HD2 LYS B 8 1.752 -13.563 -12.665 1.00 0.00 H new ATOM 0 HD3 LYS B 8 1.171 -13.536 -14.318 1.00 0.00 H new ATOM 0 HE2 LYS B 8 2.327 -15.674 -13.905 1.00 0.00 H new ATOM 0 HE3 LYS B 8 3.251 -14.738 -15.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 4.234 -15.771 -12.756 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 4.949 -14.503 -13.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 3.937 -14.159 -12.311 1.00 0.00 H new ATOM 1397 N VAL B 9 2.347 -9.257 -16.171 1.00 0.00 N ATOM 1398 CA VAL B 9 2.675 -9.130 -17.614 1.00 0.00 C ATOM 1399 C VAL B 9 3.808 -8.115 -17.799 1.00 0.00 C ATOM 1400 O VAL B 9 4.772 -8.374 -18.490 1.00 0.00 O ATOM 1401 CB VAL B 9 1.426 -8.647 -18.360 1.00 0.00 C ATOM 1402 CG1 VAL B 9 1.788 -8.306 -19.807 1.00 0.00 C ATOM 1403 CG2 VAL B 9 0.353 -9.745 -18.341 1.00 0.00 C ATOM 0 H VAL B 9 1.390 -9.010 -15.918 1.00 0.00 H new ATOM 0 HA VAL B 9 2.995 -10.095 -18.008 1.00 0.00 H new ATOM 0 HB VAL B 9 1.037 -7.756 -17.867 1.00 0.00 H new ATOM 0 HG11 VAL B 9 0.897 -7.963 -20.334 1.00 0.00 H new ATOM 0 HG12 VAL B 9 2.542 -7.519 -19.818 1.00 0.00 H new ATOM 0 HG13 VAL B 9 2.183 -9.193 -20.302 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -0.533 -9.397 -18.872 1.00 0.00 H new ATOM 0 HG22 VAL B 9 0.740 -10.640 -18.828 1.00 0.00 H new ATOM 0 HG23 VAL B 9 0.089 -9.978 -17.309 1.00 0.00 H new ATOM 1413 N GLU B 10 3.715 -6.966 -17.185 1.00 0.00 N ATOM 1414 CA GLU B 10 4.799 -5.964 -17.331 1.00 0.00 C ATOM 1415 C GLU B 10 6.030 -6.430 -16.547 1.00 0.00 C ATOM 1416 O GLU B 10 7.154 -6.157 -16.915 1.00 0.00 O ATOM 1417 CB GLU B 10 4.290 -4.619 -16.811 1.00 0.00 C ATOM 1418 CG GLU B 10 3.335 -4.014 -17.850 1.00 0.00 C ATOM 1419 CD GLU B 10 2.515 -2.890 -17.215 1.00 0.00 C ATOM 1420 OE1 GLU B 10 1.994 -3.106 -16.133 1.00 0.00 O ATOM 1421 OE2 GLU B 10 2.418 -1.839 -17.823 1.00 0.00 O ATOM 0 H GLU B 10 2.936 -6.682 -16.591 1.00 0.00 H new ATOM 0 HA GLU B 10 5.085 -5.854 -18.377 1.00 0.00 H new ATOM 0 HB2 GLU B 10 3.776 -4.753 -15.859 1.00 0.00 H new ATOM 0 HB3 GLU B 10 5.126 -3.944 -16.629 1.00 0.00 H new ATOM 0 HG2 GLU B 10 3.903 -3.628 -18.696 1.00 0.00 H new ATOM 0 HG3 GLU B 10 2.670 -4.786 -18.238 1.00 0.00 H new ATOM 1428 N ARG B 11 5.816 -7.146 -15.476 1.00 0.00 N ATOM 1429 CA ARG B 11 6.953 -7.658 -14.658 1.00 0.00 C ATOM 1430 C ARG B 11 7.802 -8.589 -15.541 1.00 0.00 C ATOM 1431 O ARG B 11 9.016 -8.611 -15.456 1.00 0.00 O ATOM 1432 CB ARG B 11 6.377 -8.417 -13.433 1.00 0.00 C ATOM 1433 CG ARG B 11 7.264 -8.268 -12.178 1.00 0.00 C ATOM 1434 CD ARG B 11 8.405 -9.285 -12.200 1.00 0.00 C ATOM 1435 NE ARG B 11 7.831 -10.670 -12.272 1.00 0.00 N ATOM 1436 CZ ARG B 11 7.941 -11.402 -13.359 1.00 0.00 C ATOM 1437 NH1 ARG B 11 8.559 -10.948 -14.417 1.00 0.00 N ATOM 1438 NH2 ARG B 11 7.413 -12.594 -13.390 1.00 0.00 N ATOM 0 H ARG B 11 4.891 -7.401 -15.129 1.00 0.00 H new ATOM 0 HA ARG B 11 7.583 -6.845 -14.297 1.00 0.00 H new ATOM 0 HB2 ARG B 11 5.377 -8.043 -13.214 1.00 0.00 H new ATOM 0 HB3 ARG B 11 6.275 -9.474 -13.679 1.00 0.00 H new ATOM 0 HG2 ARG B 11 7.671 -7.258 -12.132 1.00 0.00 H new ATOM 0 HG3 ARG B 11 6.661 -8.410 -11.281 1.00 0.00 H new ATOM 0 HD2 ARG B 11 9.054 -9.103 -13.056 1.00 0.00 H new ATOM 0 HD3 ARG B 11 9.020 -9.179 -11.306 1.00 0.00 H new ATOM 0 HE ARG B 11 7.345 -11.052 -11.460 1.00 0.00 H new ATOM 0 HH11 ARG B 11 8.965 -10.012 -14.408 1.00 0.00 H new ATOM 0 HH12 ARG B 11 8.635 -11.529 -15.252 1.00 0.00 H new ATOM 0 HH21 ARG B 11 6.918 -12.954 -12.574 1.00 0.00 H new ATOM 0 HH22 ARG B 11 7.495 -13.166 -14.230 1.00 0.00 H new ATOM 1452 N ILE B 12 7.163 -9.354 -16.391 1.00 0.00 N ATOM 1453 CA ILE B 12 7.907 -10.285 -17.293 1.00 0.00 C ATOM 1454 C ILE B 12 8.361 -9.537 -18.552 1.00 0.00 C ATOM 1455 O ILE B 12 9.474 -9.695 -19.010 1.00 0.00 O ATOM 1456 CB ILE B 12 6.976 -11.431 -17.688 1.00 0.00 C ATOM 1457 CG1 ILE B 12 6.630 -12.261 -16.446 1.00 0.00 C ATOM 1458 CG2 ILE B 12 7.669 -12.321 -18.719 1.00 0.00 C ATOM 1459 CD1 ILE B 12 5.416 -13.142 -16.747 1.00 0.00 C ATOM 0 H ILE B 12 6.149 -9.373 -16.499 1.00 0.00 H new ATOM 0 HA ILE B 12 8.784 -10.676 -16.778 1.00 0.00 H new ATOM 0 HB ILE B 12 6.062 -11.022 -18.118 1.00 0.00 H new ATOM 0 HG12 ILE B 12 7.480 -12.880 -16.160 1.00 0.00 H new ATOM 0 HG13 ILE B 12 6.416 -11.603 -15.603 1.00 0.00 H new ATOM 0 HG21 ILE B 12 7.004 -13.138 -19.000 1.00 0.00 H new ATOM 0 HG22 ILE B 12 7.913 -11.732 -19.603 1.00 0.00 H new ATOM 0 HG23 ILE B 12 8.584 -12.729 -18.291 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.168 -13.733 -15.865 1.00 0.00 H new ATOM 0 HD12 ILE B 12 4.567 -12.513 -17.013 1.00 0.00 H new ATOM 0 HD13 ILE B 12 5.647 -13.809 -17.578 1.00 0.00 H new ATOM 1471 N ARG B 13 7.511 -8.717 -19.112 1.00 0.00 N ATOM 1472 CA ARG B 13 7.900 -7.962 -20.334 1.00 0.00 C ATOM 1473 C ARG B 13 9.123 -7.105 -20.010 1.00 0.00 C ATOM 1474 O ARG B 13 10.052 -7.006 -20.783 1.00 0.00 O ATOM 1475 CB ARG B 13 6.750 -7.043 -20.756 1.00 0.00 C ATOM 1476 CG ARG B 13 7.058 -6.427 -22.123 1.00 0.00 C ATOM 1477 CD ARG B 13 6.001 -5.370 -22.465 1.00 0.00 C ATOM 1478 NE ARG B 13 4.676 -6.026 -22.657 1.00 0.00 N ATOM 1479 CZ ARG B 13 3.632 -5.308 -22.984 1.00 0.00 C ATOM 1480 NH1 ARG B 13 3.753 -4.021 -23.176 1.00 0.00 N ATOM 1481 NH2 ARG B 13 2.466 -5.880 -23.125 1.00 0.00 N ATOM 0 H ARG B 13 6.565 -8.539 -18.774 1.00 0.00 H new ATOM 0 HA ARG B 13 8.126 -8.659 -21.141 1.00 0.00 H new ATOM 0 HB2 ARG B 13 5.819 -7.607 -20.802 1.00 0.00 H new ATOM 0 HB3 ARG B 13 6.610 -6.256 -20.015 1.00 0.00 H new ATOM 0 HG2 ARG B 13 8.049 -5.974 -22.113 1.00 0.00 H new ATOM 0 HG3 ARG B 13 7.070 -7.203 -22.888 1.00 0.00 H new ATOM 0 HD2 ARG B 13 5.939 -4.632 -21.665 1.00 0.00 H new ATOM 0 HD3 ARG B 13 6.287 -4.836 -23.371 1.00 0.00 H new ATOM 0 HE ARG B 13 4.583 -7.034 -22.533 1.00 0.00 H new ATOM 0 HH11 ARG B 13 4.663 -3.573 -23.071 1.00 0.00 H new ATOM 0 HH12 ARG B 13 2.937 -3.464 -23.431 1.00 0.00 H new ATOM 0 HH21 ARG B 13 2.370 -6.885 -22.980 1.00 0.00 H new ATOM 0 HH22 ARG B 13 1.651 -5.321 -23.380 1.00 0.00 H new ATOM 1495 N LEU B 14 9.120 -6.488 -18.864 1.00 0.00 N ATOM 1496 CA LEU B 14 10.265 -5.633 -18.465 1.00 0.00 C ATOM 1497 C LEU B 14 11.369 -6.528 -17.894 1.00 0.00 C ATOM 1498 O LEU B 14 12.441 -6.069 -17.549 1.00 0.00 O ATOM 1499 CB LEU B 14 9.782 -4.649 -17.400 1.00 0.00 C ATOM 1500 CG LEU B 14 8.671 -3.758 -17.981 1.00 0.00 C ATOM 1501 CD1 LEU B 14 8.044 -2.929 -16.855 1.00 0.00 C ATOM 1502 CD2 LEU B 14 9.244 -2.815 -19.056 1.00 0.00 C ATOM 0 H LEU B 14 8.364 -6.541 -18.181 1.00 0.00 H new ATOM 0 HA LEU B 14 10.657 -5.081 -19.320 1.00 0.00 H new ATOM 0 HB2 LEU B 14 9.409 -5.192 -16.532 1.00 0.00 H new ATOM 0 HB3 LEU B 14 10.613 -4.033 -17.057 1.00 0.00 H new ATOM 0 HG LEU B 14 7.913 -4.393 -18.440 1.00 0.00 H new ATOM 0 HD11 LEU B 14 7.256 -2.297 -17.264 1.00 0.00 H new ATOM 0 HD12 LEU B 14 7.620 -3.596 -16.104 1.00 0.00 H new ATOM 0 HD13 LEU B 14 8.809 -2.304 -16.394 1.00 0.00 H new ATOM 0 HD21 LEU B 14 8.445 -2.192 -19.457 1.00 0.00 H new ATOM 0 HD22 LEU B 14 10.011 -2.180 -18.612 1.00 0.00 H new ATOM 0 HD23 LEU B 14 9.682 -3.405 -19.861 1.00 0.00 H new ATOM 1514 N SER B 15 11.104 -7.806 -17.806 1.00 0.00 N ATOM 1515 CA SER B 15 12.112 -8.772 -17.273 1.00 0.00 C ATOM 1516 C SER B 15 12.838 -8.181 -16.065 1.00 0.00 C ATOM 1517 O SER B 15 13.921 -7.649 -16.180 1.00 0.00 O ATOM 1518 CB SER B 15 13.121 -9.105 -18.369 1.00 0.00 C ATOM 1519 OG SER B 15 12.417 -9.509 -19.537 1.00 0.00 O ATOM 0 H SER B 15 10.218 -8.228 -18.085 1.00 0.00 H new ATOM 0 HA SER B 15 11.598 -9.680 -16.956 1.00 0.00 H new ATOM 0 HB2 SER B 15 13.743 -8.236 -18.585 1.00 0.00 H new ATOM 0 HB3 SER B 15 13.789 -9.900 -18.038 1.00 0.00 H new ATOM 0 HG SER B 15 11.481 -9.687 -19.309 1.00 0.00 H new ATOM 1525 N LEU B 16 12.243 -8.276 -14.906 1.00 0.00 N ATOM 1526 CA LEU B 16 12.888 -7.727 -13.674 1.00 0.00 C ATOM 1527 C LEU B 16 13.640 -8.839 -12.945 1.00 0.00 C ATOM 1528 O LEU B 16 13.166 -9.948 -12.807 1.00 0.00 O ATOM 1529 CB LEU B 16 11.801 -7.137 -12.760 1.00 0.00 C ATOM 1530 CG LEU B 16 11.556 -5.661 -13.112 1.00 0.00 C ATOM 1531 CD1 LEU B 16 12.776 -4.802 -12.719 1.00 0.00 C ATOM 1532 CD2 LEU B 16 11.282 -5.531 -14.618 1.00 0.00 C ATOM 0 H LEU B 16 11.333 -8.712 -14.757 1.00 0.00 H new ATOM 0 HA LEU B 16 13.598 -6.945 -13.946 1.00 0.00 H new ATOM 0 HB2 LEU B 16 10.876 -7.703 -12.870 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.106 -7.224 -11.717 1.00 0.00 H new ATOM 0 HG LEU B 16 10.690 -5.303 -12.555 1.00 0.00 H new ATOM 0 HD11 LEU B 16 12.585 -3.760 -12.975 1.00 0.00 H new ATOM 0 HD12 LEU B 16 12.950 -4.886 -11.646 1.00 0.00 H new ATOM 0 HD13 LEU B 16 13.656 -5.153 -13.257 1.00 0.00 H new ATOM 0 HD21 LEU B 16 11.108 -4.484 -14.867 1.00 0.00 H new ATOM 0 HD22 LEU B 16 12.142 -5.899 -15.177 1.00 0.00 H new ATOM 0 HD23 LEU B 16 10.401 -6.117 -14.879 1.00 0.00 H new ATOM 1544 N THR B 17 14.820 -8.535 -12.477 1.00 0.00 N ATOM 1545 CA THR B 17 15.636 -9.552 -11.754 1.00 0.00 C ATOM 1546 C THR B 17 15.399 -9.419 -10.252 1.00 0.00 C ATOM 1547 O THR B 17 15.588 -8.372 -9.667 1.00 0.00 O ATOM 1548 CB THR B 17 17.114 -9.311 -12.075 1.00 0.00 C ATOM 1549 OG1 THR B 17 17.371 -7.914 -12.067 1.00 0.00 O ATOM 1550 CG2 THR B 17 17.439 -9.877 -13.456 1.00 0.00 C ATOM 0 H THR B 17 15.257 -7.618 -12.565 1.00 0.00 H new ATOM 0 HA THR B 17 15.352 -10.556 -12.068 1.00 0.00 H new ATOM 0 HB THR B 17 17.734 -9.805 -11.327 1.00 0.00 H new ATOM 0 HG1 THR B 17 18.316 -7.754 -12.270 1.00 0.00 H new ATOM 0 HG21 THR B 17 18.491 -9.704 -13.682 1.00 0.00 H new ATOM 0 HG22 THR B 17 17.237 -10.948 -13.467 1.00 0.00 H new ATOM 0 HG23 THR B 17 16.821 -9.383 -14.206 1.00 0.00 H new ATOM 1558 N ALA B 18 14.984 -10.483 -9.629 1.00 0.00 N ATOM 1559 CA ALA B 18 14.722 -10.451 -8.169 1.00 0.00 C ATOM 1560 C ALA B 18 16.027 -10.238 -7.406 1.00 0.00 C ATOM 1561 O ALA B 18 16.063 -9.569 -6.394 1.00 0.00 O ATOM 1562 CB ALA B 18 14.099 -11.781 -7.748 1.00 0.00 C ATOM 0 H ALA B 18 14.814 -11.384 -10.076 1.00 0.00 H new ATOM 0 HA ALA B 18 14.042 -9.630 -7.941 1.00 0.00 H new ATOM 0 HB1 ALA B 18 13.903 -11.768 -6.676 1.00 0.00 H new ATOM 0 HB2 ALA B 18 13.163 -11.931 -8.287 1.00 0.00 H new ATOM 0 HB3 ALA B 18 14.786 -12.595 -7.981 1.00 0.00 H new ATOM 1568 N LYS B 19 17.096 -10.814 -7.872 1.00 0.00 N ATOM 1569 CA LYS B 19 18.393 -10.663 -7.170 1.00 0.00 C ATOM 1570 C LYS B 19 18.840 -9.201 -7.183 1.00 0.00 C ATOM 1571 O LYS B 19 19.250 -8.659 -6.175 1.00 0.00 O ATOM 1572 CB LYS B 19 19.432 -11.510 -7.899 1.00 0.00 C ATOM 1573 CG LYS B 19 19.099 -12.995 -7.720 1.00 0.00 C ATOM 1574 CD LYS B 19 20.184 -13.858 -8.379 1.00 0.00 C ATOM 1575 CE LYS B 19 20.075 -13.788 -9.908 1.00 0.00 C ATOM 1576 NZ LYS B 19 20.895 -14.880 -10.507 1.00 0.00 N ATOM 0 H LYS B 19 17.125 -11.387 -8.715 1.00 0.00 H new ATOM 0 HA LYS B 19 18.287 -10.986 -6.134 1.00 0.00 H new ATOM 0 HB2 LYS B 19 19.446 -11.255 -8.959 1.00 0.00 H new ATOM 0 HB3 LYS B 19 20.427 -11.300 -7.507 1.00 0.00 H new ATOM 0 HG2 LYS B 19 19.026 -13.235 -6.659 1.00 0.00 H new ATOM 0 HG3 LYS B 19 18.128 -13.215 -8.164 1.00 0.00 H new ATOM 0 HD2 LYS B 19 21.170 -13.516 -8.063 1.00 0.00 H new ATOM 0 HD3 LYS B 19 20.084 -14.892 -8.049 1.00 0.00 H new ATOM 0 HE2 LYS B 19 19.034 -13.888 -10.216 1.00 0.00 H new ATOM 0 HE3 LYS B 19 20.422 -12.818 -10.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 20.825 -14.838 -11.544 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 21.888 -14.764 -10.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 20.544 -15.800 -10.174 1.00 0.00 H new ATOM 1590 N SER B 20 18.771 -8.557 -8.315 1.00 0.00 N ATOM 1591 CA SER B 20 19.199 -7.134 -8.388 1.00 0.00 C ATOM 1592 C SER B 20 18.252 -6.260 -7.564 1.00 0.00 C ATOM 1593 O SER B 20 18.677 -5.422 -6.796 1.00 0.00 O ATOM 1594 CB SER B 20 19.163 -6.676 -9.844 1.00 0.00 C ATOM 1595 OG SER B 20 19.637 -5.339 -9.928 1.00 0.00 O ATOM 0 H SER B 20 18.437 -8.956 -9.192 1.00 0.00 H new ATOM 0 HA SER B 20 20.210 -7.042 -7.991 1.00 0.00 H new ATOM 0 HB2 SER B 20 19.780 -7.332 -10.459 1.00 0.00 H new ATOM 0 HB3 SER B 20 18.146 -6.739 -10.232 1.00 0.00 H new ATOM 0 HG SER B 20 19.616 -5.043 -10.862 1.00 0.00 H new ATOM 1601 N VAL B 21 16.971 -6.452 -7.723 1.00 0.00 N ATOM 1602 CA VAL B 21 15.994 -5.634 -6.957 1.00 0.00 C ATOM 1603 C VAL B 21 16.098 -5.969 -5.469 1.00 0.00 C ATOM 1604 O VAL B 21 16.121 -5.096 -4.630 1.00 0.00 O ATOM 1605 CB VAL B 21 14.578 -5.942 -7.451 1.00 0.00 C ATOM 1606 CG1 VAL B 21 13.558 -5.208 -6.578 1.00 0.00 C ATOM 1607 CG2 VAL B 21 14.429 -5.481 -8.903 1.00 0.00 C ATOM 0 H VAL B 21 16.560 -7.142 -8.352 1.00 0.00 H new ATOM 0 HA VAL B 21 16.212 -4.576 -7.105 1.00 0.00 H new ATOM 0 HB VAL B 21 14.402 -7.016 -7.390 1.00 0.00 H new ATOM 0 HG11 VAL B 21 12.551 -5.429 -6.932 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.660 -5.538 -5.544 1.00 0.00 H new ATOM 0 HG13 VAL B 21 13.736 -4.134 -6.636 1.00 0.00 H new ATOM 0 HG21 VAL B 21 13.420 -5.701 -9.253 1.00 0.00 H new ATOM 0 HG22 VAL B 21 14.608 -4.408 -8.964 1.00 0.00 H new ATOM 0 HG23 VAL B 21 15.152 -6.006 -9.527 1.00 0.00 H new ATOM 1617 N ALA B 22 16.157 -7.231 -5.143 1.00 0.00 N ATOM 1618 CA ALA B 22 16.250 -7.637 -3.713 1.00 0.00 C ATOM 1619 C ALA B 22 17.555 -7.129 -3.101 1.00 0.00 C ATOM 1620 O ALA B 22 17.583 -6.667 -1.977 1.00 0.00 O ATOM 1621 CB ALA B 22 16.221 -9.163 -3.626 1.00 0.00 C ATOM 0 H ALA B 22 16.145 -8.002 -5.810 1.00 0.00 H new ATOM 0 HA ALA B 22 15.410 -7.209 -3.166 1.00 0.00 H new ATOM 0 HB1 ALA B 22 16.289 -9.469 -2.582 1.00 0.00 H new ATOM 0 HB2 ALA B 22 15.290 -9.534 -4.053 1.00 0.00 H new ATOM 0 HB3 ALA B 22 17.064 -9.575 -4.180 1.00 0.00 H new ATOM 1627 N GLU B 23 18.636 -7.217 -3.821 1.00 0.00 N ATOM 1628 CA GLU B 23 19.937 -6.749 -3.272 1.00 0.00 C ATOM 1629 C GLU B 23 19.879 -5.240 -3.025 1.00 0.00 C ATOM 1630 O GLU B 23 20.222 -4.761 -1.963 1.00 0.00 O ATOM 1631 CB GLU B 23 21.042 -7.055 -4.286 1.00 0.00 C ATOM 1632 CG GLU B 23 22.422 -6.847 -3.644 1.00 0.00 C ATOM 1633 CD GLU B 23 22.808 -8.077 -2.817 1.00 0.00 C ATOM 1634 OE1 GLU B 23 22.158 -8.325 -1.814 1.00 0.00 O ATOM 1635 OE2 GLU B 23 23.750 -8.749 -3.201 1.00 0.00 O ATOM 0 H GLU B 23 18.675 -7.594 -4.768 1.00 0.00 H new ATOM 0 HA GLU B 23 20.143 -7.259 -2.331 1.00 0.00 H new ATOM 0 HB2 GLU B 23 20.948 -8.082 -4.639 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.936 -6.408 -5.157 1.00 0.00 H new ATOM 0 HG2 GLU B 23 23.169 -6.670 -4.418 1.00 0.00 H new ATOM 0 HG3 GLU B 23 22.406 -5.962 -3.008 1.00 0.00 H new ATOM 1642 N GLU B 24 19.441 -4.490 -3.996 1.00 0.00 N ATOM 1643 CA GLU B 24 19.353 -3.015 -3.823 1.00 0.00 C ATOM 1644 C GLU B 24 18.268 -2.687 -2.794 1.00 0.00 C ATOM 1645 O GLU B 24 18.437 -1.831 -1.950 1.00 0.00 O ATOM 1646 CB GLU B 24 19.003 -2.389 -5.176 1.00 0.00 C ATOM 1647 CG GLU B 24 20.202 -2.516 -6.121 1.00 0.00 C ATOM 1648 CD GLU B 24 19.769 -2.165 -7.545 1.00 0.00 C ATOM 1649 OE1 GLU B 24 18.575 -2.050 -7.765 1.00 0.00 O ATOM 1650 OE2 GLU B 24 20.635 -2.045 -8.395 1.00 0.00 O ATOM 0 H GLU B 24 19.139 -4.837 -4.906 1.00 0.00 H new ATOM 0 HA GLU B 24 20.303 -2.616 -3.468 1.00 0.00 H new ATOM 0 HB2 GLU B 24 18.133 -2.887 -5.605 1.00 0.00 H new ATOM 0 HB3 GLU B 24 18.738 -1.340 -5.046 1.00 0.00 H new ATOM 0 HG2 GLU B 24 21.004 -1.852 -5.799 1.00 0.00 H new ATOM 0 HG3 GLU B 24 20.597 -3.531 -6.090 1.00 0.00 H new ATOM 1657 N MET B 25 17.157 -3.370 -2.858 1.00 0.00 N ATOM 1658 CA MET B 25 16.054 -3.117 -1.888 1.00 0.00 C ATOM 1659 C MET B 25 16.504 -3.528 -0.484 1.00 0.00 C ATOM 1660 O MET B 25 16.195 -2.875 0.491 1.00 0.00 O ATOM 1661 CB MET B 25 14.832 -3.940 -2.296 1.00 0.00 C ATOM 1662 CG MET B 25 14.172 -3.297 -3.520 1.00 0.00 C ATOM 1663 SD MET B 25 13.347 -1.761 -3.032 1.00 0.00 S ATOM 1664 CE MET B 25 11.801 -2.495 -2.431 1.00 0.00 C ATOM 0 H MET B 25 16.965 -4.098 -3.546 1.00 0.00 H new ATOM 0 HA MET B 25 15.799 -2.057 -1.888 1.00 0.00 H new ATOM 0 HB2 MET B 25 15.129 -4.964 -2.525 1.00 0.00 H new ATOM 0 HB3 MET B 25 14.122 -3.991 -1.471 1.00 0.00 H new ATOM 0 HG2 MET B 25 14.922 -3.091 -4.284 1.00 0.00 H new ATOM 0 HG3 MET B 25 13.450 -3.985 -3.959 1.00 0.00 H new ATOM 0 HE1 MET B 25 11.499 -2.001 -1.507 1.00 0.00 H new ATOM 0 HE2 MET B 25 11.022 -2.368 -3.182 1.00 0.00 H new ATOM 0 HE3 MET B 25 11.952 -3.558 -2.242 1.00 0.00 H new ATOM 1674 N GLY B 26 17.222 -4.616 -0.370 1.00 0.00 N ATOM 1675 CA GLY B 26 17.680 -5.077 0.974 1.00 0.00 C ATOM 1676 C GLY B 26 16.621 -5.992 1.596 1.00 0.00 C ATOM 1677 O GLY B 26 16.450 -6.018 2.797 1.00 0.00 O ATOM 0 H GLY B 26 17.511 -5.205 -1.151 1.00 0.00 H new ATOM 0 HA2 GLY B 26 18.626 -5.610 0.883 1.00 0.00 H new ATOM 0 HA3 GLY B 26 17.858 -4.219 1.622 1.00 0.00 H new ATOM 1681 N ILE B 27 15.907 -6.745 0.786 1.00 0.00 N ATOM 1682 CA ILE B 27 14.849 -7.670 1.322 1.00 0.00 C ATOM 1683 C ILE B 27 15.075 -9.086 0.797 1.00 0.00 C ATOM 1684 O ILE B 27 15.840 -9.313 -0.118 1.00 0.00 O ATOM 1685 CB ILE B 27 13.468 -7.185 0.890 1.00 0.00 C ATOM 1686 CG1 ILE B 27 13.410 -7.080 -0.633 1.00 0.00 C ATOM 1687 CG2 ILE B 27 13.174 -5.820 1.511 1.00 0.00 C ATOM 1688 CD1 ILE B 27 12.046 -6.531 -1.043 1.00 0.00 C ATOM 0 H ILE B 27 16.012 -6.759 -0.228 1.00 0.00 H new ATOM 0 HA ILE B 27 14.908 -7.676 2.410 1.00 0.00 H new ATOM 0 HB ILE B 27 12.719 -7.900 1.231 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.203 -6.426 -0.996 1.00 0.00 H new ATOM 0 HG13 ILE B 27 13.573 -8.059 -1.084 1.00 0.00 H new ATOM 0 HG21 ILE B 27 12.186 -5.482 1.197 1.00 0.00 H new ATOM 0 HG22 ILE B 27 13.201 -5.901 2.598 1.00 0.00 H new ATOM 0 HG23 ILE B 27 13.925 -5.101 1.182 1.00 0.00 H new ATOM 0 HD11 ILE B 27 11.997 -6.453 -2.129 1.00 0.00 H new ATOM 0 HD12 ILE B 27 11.263 -7.203 -0.691 1.00 0.00 H new ATOM 0 HD13 ILE B 27 11.903 -5.545 -0.602 1.00 0.00 H new ATOM 1700 N SER B 28 14.420 -10.045 1.390 1.00 0.00 N ATOM 1701 CA SER B 28 14.591 -11.459 0.960 1.00 0.00 C ATOM 1702 C SER B 28 13.874 -11.708 -0.372 1.00 0.00 C ATOM 1703 O SER B 28 12.904 -11.059 -0.703 1.00 0.00 O ATOM 1704 CB SER B 28 14.008 -12.377 2.037 1.00 0.00 C ATOM 1705 OG SER B 28 14.920 -12.462 3.124 1.00 0.00 O ATOM 0 H SER B 28 13.767 -9.907 2.162 1.00 0.00 H new ATOM 0 HA SER B 28 15.652 -11.666 0.824 1.00 0.00 H new ATOM 0 HB2 SER B 28 13.049 -11.990 2.381 1.00 0.00 H new ATOM 0 HB3 SER B 28 13.822 -13.369 1.625 1.00 0.00 H new ATOM 0 HG SER B 28 14.550 -13.048 3.817 1.00 0.00 H new ATOM 1711 N ARG B 29 14.346 -12.665 -1.124 1.00 0.00 N ATOM 1712 CA ARG B 29 13.709 -12.998 -2.429 1.00 0.00 C ATOM 1713 C ARG B 29 12.278 -13.494 -2.195 1.00 0.00 C ATOM 1714 O ARG B 29 11.385 -13.228 -2.973 1.00 0.00 O ATOM 1715 CB ARG B 29 14.529 -14.091 -3.124 1.00 0.00 C ATOM 1716 CG ARG B 29 15.828 -13.487 -3.666 1.00 0.00 C ATOM 1717 CD ARG B 29 16.672 -14.579 -4.329 1.00 0.00 C ATOM 1718 NE ARG B 29 17.233 -15.488 -3.287 1.00 0.00 N ATOM 1719 CZ ARG B 29 18.194 -15.069 -2.506 1.00 0.00 C ATOM 1720 NH1 ARG B 29 18.647 -13.850 -2.622 1.00 0.00 N ATOM 1721 NH2 ARG B 29 18.704 -15.870 -1.610 1.00 0.00 N ATOM 0 H ARG B 29 15.156 -13.237 -0.886 1.00 0.00 H new ATOM 0 HA ARG B 29 13.678 -12.109 -3.058 1.00 0.00 H new ATOM 0 HB2 ARG B 29 14.754 -14.894 -2.422 1.00 0.00 H new ATOM 0 HB3 ARG B 29 13.953 -14.531 -3.938 1.00 0.00 H new ATOM 0 HG2 ARG B 29 15.601 -12.702 -4.387 1.00 0.00 H new ATOM 0 HG3 ARG B 29 16.390 -13.023 -2.855 1.00 0.00 H new ATOM 0 HD2 ARG B 29 16.061 -15.148 -5.030 1.00 0.00 H new ATOM 0 HD3 ARG B 29 17.480 -14.128 -4.904 1.00 0.00 H new ATOM 0 HE ARG B 29 16.867 -16.435 -3.184 1.00 0.00 H new ATOM 0 HH11 ARG B 29 18.251 -13.223 -3.323 1.00 0.00 H new ATOM 0 HH12 ARG B 29 19.397 -13.524 -2.012 1.00 0.00 H new ATOM 0 HH21 ARG B 29 18.353 -16.823 -1.519 1.00 0.00 H new ATOM 0 HH22 ARG B 29 19.454 -15.543 -1.001 1.00 0.00 H new ATOM 1735 N GLN B 30 12.054 -14.215 -1.131 1.00 0.00 N ATOM 1736 CA GLN B 30 10.684 -14.729 -0.851 1.00 0.00 C ATOM 1737 C GLN B 30 9.718 -13.553 -0.685 1.00 0.00 C ATOM 1738 O GLN B 30 8.607 -13.579 -1.177 1.00 0.00 O ATOM 1739 CB GLN B 30 10.710 -15.549 0.439 1.00 0.00 C ATOM 1740 CG GLN B 30 9.342 -16.191 0.670 1.00 0.00 C ATOM 1741 CD GLN B 30 9.370 -17.001 1.965 1.00 0.00 C ATOM 1742 OE1 GLN B 30 10.428 -17.286 2.493 1.00 0.00 O ATOM 1743 NE2 GLN B 30 8.247 -17.386 2.502 1.00 0.00 N ATOM 0 H GLN B 30 12.762 -14.471 -0.443 1.00 0.00 H new ATOM 0 HA GLN B 30 10.353 -15.355 -1.680 1.00 0.00 H new ATOM 0 HB2 GLN B 30 11.478 -16.320 0.376 1.00 0.00 H new ATOM 0 HB3 GLN B 30 10.969 -14.909 1.283 1.00 0.00 H new ATOM 0 HG2 GLN B 30 8.572 -15.421 0.727 1.00 0.00 H new ATOM 0 HG3 GLN B 30 9.085 -16.837 -0.170 1.00 0.00 H new ATOM 0 HE21 GLN B 30 7.361 -17.146 2.058 1.00 0.00 H new ATOM 0 HE22 GLN B 30 8.254 -17.927 3.367 1.00 0.00 H new ATOM 1752 N GLN B 31 10.132 -12.521 -0.002 1.00 0.00 N ATOM 1753 CA GLN B 31 9.236 -11.347 0.185 1.00 0.00 C ATOM 1754 C GLN B 31 8.952 -10.717 -1.177 1.00 0.00 C ATOM 1755 O GLN B 31 7.840 -10.332 -1.476 1.00 0.00 O ATOM 1756 CB GLN B 31 9.930 -10.318 1.082 1.00 0.00 C ATOM 1757 CG GLN B 31 8.971 -9.162 1.369 1.00 0.00 C ATOM 1758 CD GLN B 31 9.615 -8.199 2.367 1.00 0.00 C ATOM 1759 OE1 GLN B 31 10.559 -8.552 3.046 1.00 0.00 O ATOM 1760 NE2 GLN B 31 9.141 -6.990 2.484 1.00 0.00 N ATOM 0 H GLN B 31 11.051 -12.441 0.434 1.00 0.00 H new ATOM 0 HA GLN B 31 8.302 -11.665 0.649 1.00 0.00 H new ATOM 0 HB2 GLN B 31 10.242 -10.786 2.016 1.00 0.00 H new ATOM 0 HB3 GLN B 31 10.831 -9.945 0.595 1.00 0.00 H new ATOM 0 HG2 GLN B 31 8.731 -8.637 0.444 1.00 0.00 H new ATOM 0 HG3 GLN B 31 8.033 -9.545 1.771 1.00 0.00 H new ATOM 0 HE21 GLN B 31 8.349 -6.695 1.913 1.00 0.00 H new ATOM 0 HE22 GLN B 31 9.563 -6.339 3.146 1.00 0.00 H new ATOM 1769 N LEU B 32 9.952 -10.620 -2.005 1.00 0.00 N ATOM 1770 CA LEU B 32 9.754 -10.025 -3.352 1.00 0.00 C ATOM 1771 C LEU B 32 8.772 -10.887 -4.148 1.00 0.00 C ATOM 1772 O LEU B 32 7.906 -10.389 -4.837 1.00 0.00 O ATOM 1773 CB LEU B 32 11.103 -9.978 -4.082 1.00 0.00 C ATOM 1774 CG LEU B 32 11.044 -8.956 -5.236 1.00 0.00 C ATOM 1775 CD1 LEU B 32 11.402 -7.559 -4.718 1.00 0.00 C ATOM 1776 CD2 LEU B 32 12.045 -9.355 -6.323 1.00 0.00 C ATOM 0 H LEU B 32 10.903 -10.929 -1.805 1.00 0.00 H new ATOM 0 HA LEU B 32 9.353 -9.016 -3.255 1.00 0.00 H new ATOM 0 HB2 LEU B 32 11.894 -9.705 -3.384 1.00 0.00 H new ATOM 0 HB3 LEU B 32 11.349 -10.966 -4.472 1.00 0.00 H new ATOM 0 HG LEU B 32 10.034 -8.943 -5.646 1.00 0.00 H new ATOM 0 HD11 LEU B 32 11.358 -6.844 -5.540 1.00 0.00 H new ATOM 0 HD12 LEU B 32 10.694 -7.266 -3.943 1.00 0.00 H new ATOM 0 HD13 LEU B 32 12.410 -7.572 -4.302 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.003 -8.633 -7.139 1.00 0.00 H new ATOM 0 HD22 LEU B 32 13.051 -9.371 -5.903 1.00 0.00 H new ATOM 0 HD23 LEU B 32 11.795 -10.346 -6.702 1.00 0.00 H new ATOM 1788 N CYS B 33 8.910 -12.181 -4.058 1.00 0.00 N ATOM 1789 CA CYS B 33 7.999 -13.088 -4.805 1.00 0.00 C ATOM 1790 C CYS B 33 6.552 -12.820 -4.382 1.00 0.00 C ATOM 1791 O CYS B 33 5.640 -12.878 -5.183 1.00 0.00 O ATOM 1792 CB CYS B 33 8.383 -14.547 -4.498 1.00 0.00 C ATOM 1793 SG CYS B 33 8.095 -15.578 -5.960 1.00 0.00 S ATOM 0 H CYS B 33 9.620 -12.650 -3.495 1.00 0.00 H new ATOM 0 HA CYS B 33 8.090 -12.910 -5.877 1.00 0.00 H new ATOM 0 HB2 CYS B 33 9.431 -14.603 -4.203 1.00 0.00 H new ATOM 0 HB3 CYS B 33 7.796 -14.918 -3.658 1.00 0.00 H new ATOM 0 HG CYS B 33 8.423 -16.808 -5.695 1.00 0.00 H new ATOM 1799 N ASN B 34 6.343 -12.518 -3.133 1.00 0.00 N ATOM 1800 CA ASN B 34 4.966 -12.239 -2.648 1.00 0.00 C ATOM 1801 C ASN B 34 4.416 -11.022 -3.389 1.00 0.00 C ATOM 1802 O ASN B 34 3.256 -10.968 -3.747 1.00 0.00 O ATOM 1803 CB ASN B 34 5.008 -11.919 -1.154 1.00 0.00 C ATOM 1804 CG ASN B 34 5.699 -13.049 -0.394 1.00 0.00 C ATOM 1805 OD1 ASN B 34 6.227 -13.969 -0.991 1.00 0.00 O ATOM 1806 ND2 ASN B 34 5.715 -13.018 0.909 1.00 0.00 N ATOM 0 H ASN B 34 7.072 -12.452 -2.423 1.00 0.00 H new ATOM 0 HA ASN B 34 4.334 -13.110 -2.825 1.00 0.00 H new ATOM 0 HB2 ASN B 34 5.540 -10.982 -0.990 1.00 0.00 H new ATOM 0 HB3 ASN B 34 3.995 -11.782 -0.775 1.00 0.00 H new ATOM 0 HD21 ASN B 34 6.171 -13.766 1.431 1.00 0.00 H new ATOM 0 HD22 ASN B 34 5.272 -12.246 1.406 1.00 0.00 H new ATOM 1813 N ILE B 35 5.246 -10.044 -3.615 1.00 0.00 N ATOM 1814 CA ILE B 35 4.788 -8.821 -4.323 1.00 0.00 C ATOM 1815 C ILE B 35 4.303 -9.195 -5.724 1.00 0.00 C ATOM 1816 O ILE B 35 3.284 -8.723 -6.184 1.00 0.00 O ATOM 1817 CB ILE B 35 5.957 -7.845 -4.445 1.00 0.00 C ATOM 1818 CG1 ILE B 35 6.544 -7.573 -3.056 1.00 0.00 C ATOM 1819 CG2 ILE B 35 5.468 -6.535 -5.066 1.00 0.00 C ATOM 1820 CD1 ILE B 35 7.783 -6.681 -3.189 1.00 0.00 C ATOM 0 H ILE B 35 6.228 -10.041 -3.338 1.00 0.00 H new ATOM 0 HA ILE B 35 3.974 -8.359 -3.764 1.00 0.00 H new ATOM 0 HB ILE B 35 6.728 -8.279 -5.082 1.00 0.00 H new ATOM 0 HG12 ILE B 35 5.800 -7.088 -2.424 1.00 0.00 H new ATOM 0 HG13 ILE B 35 6.810 -8.513 -2.572 1.00 0.00 H new ATOM 0 HG21 ILE B 35 6.303 -5.839 -5.153 1.00 0.00 H new ATOM 0 HG22 ILE B 35 5.056 -6.733 -6.056 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.696 -6.098 -4.433 1.00 0.00 H new ATOM 0 HD11 ILE B 35 8.200 -6.488 -2.201 1.00 0.00 H new ATOM 0 HD12 ILE B 35 8.528 -7.183 -3.806 1.00 0.00 H new ATOM 0 HD13 ILE B 35 7.503 -5.737 -3.656 1.00 0.00 H new ATOM 1832 N GLU B 36 5.033 -10.029 -6.407 1.00 0.00 N ATOM 1833 CA GLU B 36 4.629 -10.426 -7.782 1.00 0.00 C ATOM 1834 C GLU B 36 3.232 -11.053 -7.753 1.00 0.00 C ATOM 1835 O GLU B 36 2.405 -10.774 -8.596 1.00 0.00 O ATOM 1836 CB GLU B 36 5.623 -11.457 -8.316 1.00 0.00 C ATOM 1837 CG GLU B 36 5.363 -11.702 -9.804 1.00 0.00 C ATOM 1838 CD GLU B 36 6.166 -12.918 -10.266 1.00 0.00 C ATOM 1839 OE1 GLU B 36 7.383 -12.843 -10.252 1.00 0.00 O ATOM 1840 OE2 GLU B 36 5.546 -13.907 -10.626 1.00 0.00 O ATOM 0 H GLU B 36 5.896 -10.455 -6.070 1.00 0.00 H new ATOM 0 HA GLU B 36 4.618 -9.545 -8.423 1.00 0.00 H new ATOM 0 HB2 GLU B 36 6.643 -11.103 -8.169 1.00 0.00 H new ATOM 0 HB3 GLU B 36 5.526 -12.391 -7.762 1.00 0.00 H new ATOM 0 HG2 GLU B 36 4.300 -11.868 -9.976 1.00 0.00 H new ATOM 0 HG3 GLU B 36 5.647 -10.823 -10.384 1.00 0.00 H new ATOM 1847 N GLN B 37 2.962 -11.901 -6.794 1.00 0.00 N ATOM 1848 CA GLN B 37 1.616 -12.547 -6.716 1.00 0.00 C ATOM 1849 C GLN B 37 0.743 -11.781 -5.723 1.00 0.00 C ATOM 1850 O GLN B 37 -0.045 -12.356 -4.999 1.00 0.00 O ATOM 1851 CB GLN B 37 1.775 -14.003 -6.258 1.00 0.00 C ATOM 1852 CG GLN B 37 2.449 -14.050 -4.885 1.00 0.00 C ATOM 1853 CD GLN B 37 2.655 -15.509 -4.472 1.00 0.00 C ATOM 1854 OE1 GLN B 37 3.074 -16.325 -5.271 1.00 0.00 O ATOM 1855 NE2 GLN B 37 2.376 -15.877 -3.252 1.00 0.00 N ATOM 0 H GLN B 37 3.616 -12.175 -6.061 1.00 0.00 H new ATOM 0 HA GLN B 37 1.142 -12.530 -7.697 1.00 0.00 H new ATOM 0 HB2 GLN B 37 0.799 -14.486 -6.210 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.370 -14.558 -6.983 1.00 0.00 H new ATOM 0 HG2 GLN B 37 3.407 -13.531 -4.920 1.00 0.00 H new ATOM 0 HG3 GLN B 37 1.834 -13.535 -4.147 1.00 0.00 H new ATOM 0 HE21 GLN B 37 2.025 -15.194 -2.581 1.00 0.00 H new ATOM 0 HE22 GLN B 37 2.509 -16.848 -2.969 1.00 0.00 H new ATOM 1864 N SER B 38 0.879 -10.482 -5.684 1.00 0.00 N ATOM 1865 CA SER B 38 0.057 -9.674 -4.738 1.00 0.00 C ATOM 1866 C SER B 38 -1.315 -9.400 -5.351 1.00 0.00 C ATOM 1867 O SER B 38 -1.480 -8.511 -6.161 1.00 0.00 O ATOM 1868 CB SER B 38 0.759 -8.348 -4.461 1.00 0.00 C ATOM 1869 OG SER B 38 -0.061 -7.549 -3.619 1.00 0.00 O ATOM 0 H SER B 38 1.523 -9.947 -6.266 1.00 0.00 H new ATOM 0 HA SER B 38 -0.066 -10.226 -3.807 1.00 0.00 H new ATOM 0 HB2 SER B 38 1.723 -8.526 -3.985 1.00 0.00 H new ATOM 0 HB3 SER B 38 0.957 -7.826 -5.397 1.00 0.00 H new ATOM 0 HG SER B 38 0.388 -6.697 -3.438 1.00 0.00 H new ATOM 1875 N GLU B 39 -2.302 -10.156 -4.955 1.00 0.00 N ATOM 1876 CA GLU B 39 -3.684 -9.958 -5.487 1.00 0.00 C ATOM 1877 C GLU B 39 -4.516 -9.216 -4.445 1.00 0.00 C ATOM 1878 O GLU B 39 -5.612 -8.768 -4.717 1.00 0.00 O ATOM 1879 CB GLU B 39 -4.299 -11.329 -5.772 1.00 0.00 C ATOM 1880 CG GLU B 39 -3.614 -11.942 -6.996 1.00 0.00 C ATOM 1881 CD GLU B 39 -4.022 -13.408 -7.138 1.00 0.00 C ATOM 1882 OE1 GLU B 39 -4.795 -13.870 -6.314 1.00 0.00 O ATOM 1883 OE2 GLU B 39 -3.550 -14.048 -8.062 1.00 0.00 O ATOM 0 H GLU B 39 -2.210 -10.912 -4.277 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.660 -9.373 -6.406 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -4.178 -11.982 -4.908 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -5.370 -11.231 -5.950 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -3.891 -11.389 -7.894 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.531 -11.864 -6.895 1.00 0.00 H new ATOM 1890 N THR B 40 -3.994 -9.079 -3.250 1.00 0.00 N ATOM 1891 CA THR B 40 -4.730 -8.357 -2.163 1.00 0.00 C ATOM 1892 C THR B 40 -3.834 -7.247 -1.612 1.00 0.00 C ATOM 1893 O THR B 40 -3.023 -7.465 -0.736 1.00 0.00 O ATOM 1894 CB THR B 40 -5.077 -9.343 -1.044 1.00 0.00 C ATOM 1895 OG1 THR B 40 -5.951 -10.342 -1.551 1.00 0.00 O ATOM 1896 CG2 THR B 40 -5.765 -8.597 0.099 1.00 0.00 C ATOM 0 H THR B 40 -3.080 -9.440 -2.978 1.00 0.00 H new ATOM 0 HA THR B 40 -5.649 -7.925 -2.558 1.00 0.00 H new ATOM 0 HB THR B 40 -4.164 -9.810 -0.674 1.00 0.00 H new ATOM 0 HG1 THR B 40 -6.173 -10.975 -0.837 1.00 0.00 H new ATOM 0 HG21 THR B 40 -6.012 -9.299 0.895 1.00 0.00 H new ATOM 0 HG22 THR B 40 -5.096 -7.829 0.487 1.00 0.00 H new ATOM 0 HG23 THR B 40 -6.679 -8.130 -0.269 1.00 0.00 H new ATOM 1904 N ALA B 41 -3.970 -6.058 -2.131 1.00 0.00 N ATOM 1905 CA ALA B 41 -3.121 -4.930 -1.653 1.00 0.00 C ATOM 1906 C ALA B 41 -3.596 -4.474 -0.261 1.00 0.00 C ATOM 1907 O ALA B 41 -4.746 -4.642 0.090 1.00 0.00 O ATOM 1908 CB ALA B 41 -3.236 -3.770 -2.652 1.00 0.00 C ATOM 0 H ALA B 41 -4.634 -5.818 -2.867 1.00 0.00 H new ATOM 0 HA ALA B 41 -2.082 -5.252 -1.579 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.619 -2.937 -2.315 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.895 -4.100 -3.633 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -4.275 -3.449 -2.718 1.00 0.00 H new ATOM 1914 N PRO B 42 -2.712 -3.895 0.526 1.00 0.00 N ATOM 1915 CA PRO B 42 -3.052 -3.402 1.900 1.00 0.00 C ATOM 1916 C PRO B 42 -3.957 -2.156 1.887 1.00 0.00 C ATOM 1917 O PRO B 42 -4.079 -1.469 0.893 1.00 0.00 O ATOM 1918 CB PRO B 42 -1.681 -3.084 2.520 1.00 0.00 C ATOM 1919 CG PRO B 42 -0.788 -2.785 1.357 1.00 0.00 C ATOM 1920 CD PRO B 42 -1.291 -3.653 0.199 1.00 0.00 C ATOM 0 HA PRO B 42 -3.623 -4.141 2.462 1.00 0.00 H new ATOM 0 HB2 PRO B 42 -1.743 -2.233 3.199 1.00 0.00 H new ATOM 0 HB3 PRO B 42 -1.305 -3.927 3.099 1.00 0.00 H new ATOM 0 HG2 PRO B 42 -0.828 -1.727 1.097 1.00 0.00 H new ATOM 0 HG3 PRO B 42 0.251 -3.016 1.594 1.00 0.00 H new ATOM 0 HD2 PRO B 42 -1.183 -3.143 -0.758 1.00 0.00 H new ATOM 0 HD3 PRO B 42 -0.733 -4.587 0.128 1.00 0.00 H new ATOM 1928 N VAL B 43 -4.590 -1.870 2.998 1.00 0.00 N ATOM 1929 CA VAL B 43 -5.490 -0.682 3.083 1.00 0.00 C ATOM 1930 C VAL B 43 -4.699 0.593 2.773 1.00 0.00 C ATOM 1931 O VAL B 43 -5.262 1.623 2.460 1.00 0.00 O ATOM 1932 CB VAL B 43 -6.076 -0.590 4.497 1.00 0.00 C ATOM 1933 CG1 VAL B 43 -7.123 -1.688 4.692 1.00 0.00 C ATOM 1934 CG2 VAL B 43 -4.958 -0.775 5.524 1.00 0.00 C ATOM 0 H VAL B 43 -4.520 -2.415 3.857 1.00 0.00 H new ATOM 0 HA VAL B 43 -6.297 -0.787 2.358 1.00 0.00 H new ATOM 0 HB VAL B 43 -6.542 0.386 4.631 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -7.538 -1.621 5.698 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -7.922 -1.563 3.961 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -6.656 -2.664 4.557 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -5.373 -0.710 6.530 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -4.495 -1.752 5.385 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -4.208 0.005 5.390 1.00 0.00 H new ATOM 1944 N VAL B 44 -3.399 0.534 2.857 1.00 0.00 N ATOM 1945 CA VAL B 44 -2.573 1.739 2.568 1.00 0.00 C ATOM 1946 C VAL B 44 -2.777 2.168 1.111 1.00 0.00 C ATOM 1947 O VAL B 44 -2.916 3.337 0.813 1.00 0.00 O ATOM 1948 CB VAL B 44 -1.099 1.407 2.798 1.00 0.00 C ATOM 1949 CG1 VAL B 44 -0.232 2.597 2.381 1.00 0.00 C ATOM 1950 CG2 VAL B 44 -0.873 1.105 4.282 1.00 0.00 C ATOM 0 H VAL B 44 -2.871 -0.300 3.114 1.00 0.00 H new ATOM 0 HA VAL B 44 -2.874 2.552 3.228 1.00 0.00 H new ATOM 0 HB VAL B 44 -0.826 0.536 2.202 1.00 0.00 H new ATOM 0 HG11 VAL B 44 0.818 2.357 2.546 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -0.393 2.812 1.325 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -0.503 3.470 2.975 1.00 0.00 H new ATOM 0 HG21 VAL B 44 0.178 0.868 4.449 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -1.147 1.976 4.877 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -1.488 0.255 4.578 1.00 0.00 H new ATOM 1960 N VAL B 45 -2.798 1.232 0.201 1.00 0.00 N ATOM 1961 CA VAL B 45 -2.991 1.584 -1.233 1.00 0.00 C ATOM 1962 C VAL B 45 -4.338 2.281 -1.406 1.00 0.00 C ATOM 1963 O VAL B 45 -4.448 3.282 -2.086 1.00 0.00 O ATOM 1964 CB VAL B 45 -2.970 0.306 -2.075 1.00 0.00 C ATOM 1965 CG1 VAL B 45 -3.305 0.643 -3.529 1.00 0.00 C ATOM 1966 CG2 VAL B 45 -1.578 -0.324 -2.002 1.00 0.00 C ATOM 0 H VAL B 45 -2.689 0.236 0.391 1.00 0.00 H new ATOM 0 HA VAL B 45 -2.191 2.249 -1.557 1.00 0.00 H new ATOM 0 HB VAL B 45 -3.709 -0.396 -1.690 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -3.289 -0.268 -4.127 1.00 0.00 H new ATOM 0 HG12 VAL B 45 -4.297 1.093 -3.579 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -2.568 1.345 -3.919 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -1.559 -1.235 -2.601 1.00 0.00 H new ATOM 0 HG22 VAL B 45 -0.840 0.379 -2.388 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -1.342 -0.566 -0.966 1.00 0.00 H new ATOM 1976 N LYS B 46 -5.363 1.770 -0.787 1.00 0.00 N ATOM 1977 CA LYS B 46 -6.697 2.411 -0.907 1.00 0.00 C ATOM 1978 C LYS B 46 -6.609 3.836 -0.361 1.00 0.00 C ATOM 1979 O LYS B 46 -7.192 4.755 -0.898 1.00 0.00 O ATOM 1980 CB LYS B 46 -7.718 1.620 -0.089 1.00 0.00 C ATOM 1981 CG LYS B 46 -7.937 0.250 -0.735 1.00 0.00 C ATOM 1982 CD LYS B 46 -8.925 -0.556 0.108 1.00 0.00 C ATOM 1983 CE LYS B 46 -9.085 -1.952 -0.492 1.00 0.00 C ATOM 1984 NZ LYS B 46 -9.664 -1.843 -1.862 1.00 0.00 N ATOM 0 H LYS B 46 -5.333 0.935 -0.202 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.006 2.429 -1.952 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.364 1.499 0.935 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.661 2.165 -0.038 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -8.320 0.370 -1.748 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -6.989 -0.283 -0.814 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -8.568 -0.629 1.135 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -9.890 -0.050 0.141 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -8.118 -2.454 -0.533 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -9.733 -2.559 0.141 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -10.053 -2.764 -2.149 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -10.422 -1.131 -1.863 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.921 -1.558 -2.531 1.00 0.00 H new ATOM 1998 N TYR B 47 -5.885 4.021 0.707 1.00 0.00 N ATOM 1999 CA TYR B 47 -5.758 5.377 1.301 1.00 0.00 C ATOM 2000 C TYR B 47 -5.161 6.333 0.262 1.00 0.00 C ATOM 2001 O TYR B 47 -5.648 7.428 0.059 1.00 0.00 O ATOM 2002 CB TYR B 47 -4.829 5.286 2.531 1.00 0.00 C ATOM 2003 CG TYR B 47 -5.292 6.242 3.601 1.00 0.00 C ATOM 2004 CD1 TYR B 47 -4.837 7.565 3.621 1.00 0.00 C ATOM 2005 CD2 TYR B 47 -6.189 5.796 4.572 1.00 0.00 C ATOM 2006 CE1 TYR B 47 -5.285 8.441 4.618 1.00 0.00 C ATOM 2007 CE2 TYR B 47 -6.634 6.666 5.563 1.00 0.00 C ATOM 2008 CZ TYR B 47 -6.186 7.989 5.588 1.00 0.00 C ATOM 2009 OH TYR B 47 -6.633 8.847 6.573 1.00 0.00 O ATOM 0 H TYR B 47 -5.374 3.286 1.195 1.00 0.00 H new ATOM 0 HA TYR B 47 -6.735 5.752 1.604 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -4.825 4.267 2.919 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -3.805 5.520 2.241 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -4.142 7.910 2.870 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -6.539 4.774 4.555 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -4.936 9.463 4.638 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -7.327 6.318 6.314 1.00 0.00 H new ATOM 0 HH TYR B 47 -7.537 8.588 6.847 1.00 0.00 H new ATOM 2019 N ILE B 48 -4.109 5.927 -0.391 1.00 0.00 N ATOM 2020 CA ILE B 48 -3.473 6.804 -1.410 1.00 0.00 C ATOM 2021 C ILE B 48 -4.452 7.045 -2.561 1.00 0.00 C ATOM 2022 O ILE B 48 -4.610 8.150 -3.039 1.00 0.00 O ATOM 2023 CB ILE B 48 -2.226 6.104 -1.953 1.00 0.00 C ATOM 2024 CG1 ILE B 48 -1.180 5.981 -0.842 1.00 0.00 C ATOM 2025 CG2 ILE B 48 -1.641 6.927 -3.102 1.00 0.00 C ATOM 2026 CD1 ILE B 48 -0.079 5.011 -1.283 1.00 0.00 C ATOM 0 H ILE B 48 -3.660 5.020 -0.261 1.00 0.00 H new ATOM 0 HA ILE B 48 -3.203 7.758 -0.957 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.498 5.111 -2.311 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -0.751 6.959 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -1.648 5.624 0.075 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -0.752 6.430 -3.490 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -2.381 7.020 -3.897 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -1.372 7.919 -2.739 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.666 4.923 -0.493 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.515 4.032 -1.482 1.00 0.00 H new ATOM 0 HD13 ILE B 48 0.396 5.387 -2.189 1.00 0.00 H new ATOM 2038 N ALA B 49 -5.109 6.011 -3.009 1.00 0.00 N ATOM 2039 CA ALA B 49 -6.077 6.161 -4.127 1.00 0.00 C ATOM 2040 C ALA B 49 -7.243 7.043 -3.685 1.00 0.00 C ATOM 2041 O ALA B 49 -7.754 7.841 -4.445 1.00 0.00 O ATOM 2042 CB ALA B 49 -6.606 4.781 -4.516 1.00 0.00 C ATOM 0 H ALA B 49 -5.015 5.063 -2.645 1.00 0.00 H new ATOM 0 HA ALA B 49 -5.580 6.623 -4.980 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -7.317 4.882 -5.336 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -5.776 4.149 -4.831 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -7.103 4.327 -3.659 1.00 0.00 H new ATOM 2048 N PHE B 50 -7.672 6.900 -2.464 1.00 0.00 N ATOM 2049 CA PHE B 50 -8.808 7.720 -1.969 1.00 0.00 C ATOM 2050 C PHE B 50 -8.408 9.199 -2.012 1.00 0.00 C ATOM 2051 O PHE B 50 -9.149 10.040 -2.479 1.00 0.00 O ATOM 2052 CB PHE B 50 -9.133 7.294 -0.526 1.00 0.00 C ATOM 2053 CG PHE B 50 -10.585 7.581 -0.210 1.00 0.00 C ATOM 2054 CD1 PHE B 50 -11.589 6.897 -0.904 1.00 0.00 C ATOM 2055 CD2 PHE B 50 -10.928 8.512 0.780 1.00 0.00 C ATOM 2056 CE1 PHE B 50 -12.935 7.141 -0.615 1.00 0.00 C ATOM 2057 CE2 PHE B 50 -12.277 8.756 1.070 1.00 0.00 C ATOM 2058 CZ PHE B 50 -13.280 8.070 0.373 1.00 0.00 C ATOM 0 H PHE B 50 -7.282 6.247 -1.785 1.00 0.00 H new ATOM 0 HA PHE B 50 -9.690 7.572 -2.593 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -8.929 6.231 -0.398 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -8.489 7.828 0.172 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -11.323 6.178 -1.665 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -10.155 9.040 1.318 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -13.708 6.613 -1.154 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -12.544 9.474 1.832 1.00 0.00 H new ATOM 0 HZ PHE B 50 -14.319 8.258 0.598 1.00 0.00 H new ATOM 2068 N LEU B 51 -7.235 9.516 -1.531 1.00 0.00 N ATOM 2069 CA LEU B 51 -6.775 10.929 -1.549 1.00 0.00 C ATOM 2070 C LEU B 51 -6.647 11.405 -2.994 1.00 0.00 C ATOM 2071 O LEU B 51 -7.044 12.500 -3.336 1.00 0.00 O ATOM 2072 CB LEU B 51 -5.409 11.024 -0.865 1.00 0.00 C ATOM 2073 CG LEU B 51 -5.557 10.780 0.647 1.00 0.00 C ATOM 2074 CD1 LEU B 51 -4.161 10.642 1.278 1.00 0.00 C ATOM 2075 CD2 LEU B 51 -6.325 11.948 1.306 1.00 0.00 C ATOM 0 H LEU B 51 -6.575 8.852 -1.126 1.00 0.00 H new ATOM 0 HA LEU B 51 -7.496 11.553 -1.022 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -4.727 10.291 -1.295 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -4.973 12.007 -1.042 1.00 0.00 H new ATOM 0 HG LEU B 51 -6.121 9.862 0.810 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -4.262 10.469 2.349 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -3.637 9.802 0.822 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -3.594 11.557 1.110 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -6.422 11.762 2.376 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -5.779 12.878 1.148 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -7.316 12.029 0.860 1.00 0.00 H new ATOM 2087 N ARG B 52 -6.101 10.586 -3.845 1.00 0.00 N ATOM 2088 CA ARG B 52 -5.954 10.982 -5.267 1.00 0.00 C ATOM 2089 C ARG B 52 -7.340 11.158 -5.890 1.00 0.00 C ATOM 2090 O ARG B 52 -7.577 12.072 -6.653 1.00 0.00 O ATOM 2091 CB ARG B 52 -5.167 9.902 -6.018 1.00 0.00 C ATOM 2092 CG ARG B 52 -5.128 10.213 -7.523 1.00 0.00 C ATOM 2093 CD ARG B 52 -4.611 11.638 -7.765 1.00 0.00 C ATOM 2094 NE ARG B 52 -4.236 11.807 -9.197 1.00 0.00 N ATOM 2095 CZ ARG B 52 -5.159 11.791 -10.122 1.00 0.00 C ATOM 2096 NH1 ARG B 52 -6.411 11.609 -9.801 1.00 0.00 N ATOM 2097 NH2 ARG B 52 -4.828 11.977 -11.370 1.00 0.00 N ATOM 0 H ARG B 52 -5.749 9.657 -3.615 1.00 0.00 H new ATOM 0 HA ARG B 52 -5.412 11.925 -5.335 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -4.152 9.845 -5.626 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -5.627 8.928 -5.854 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -4.485 9.495 -8.032 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -6.126 10.105 -7.949 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -5.378 12.363 -7.493 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -3.748 11.834 -7.129 1.00 0.00 H new ATOM 0 HE ARG B 52 -3.258 11.935 -9.456 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -6.673 11.478 -8.824 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -7.127 11.597 -10.527 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -3.852 12.134 -11.621 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -5.545 11.965 -12.095 1.00 0.00 H new ATOM 2111 N SER B 53 -8.254 10.286 -5.568 1.00 0.00 N ATOM 2112 CA SER B 53 -9.625 10.390 -6.135 1.00 0.00 C ATOM 2113 C SER B 53 -10.253 11.718 -5.712 1.00 0.00 C ATOM 2114 O SER B 53 -11.207 12.180 -6.305 1.00 0.00 O ATOM 2115 CB SER B 53 -10.473 9.232 -5.613 1.00 0.00 C ATOM 2116 OG SER B 53 -11.760 9.279 -6.212 1.00 0.00 O ATOM 0 H SER B 53 -8.108 9.502 -4.933 1.00 0.00 H new ATOM 0 HA SER B 53 -9.577 10.346 -7.223 1.00 0.00 H new ATOM 0 HB2 SER B 53 -9.989 8.282 -5.840 1.00 0.00 H new ATOM 0 HB3 SER B 53 -10.563 9.293 -4.528 1.00 0.00 H new ATOM 0 HG SER B 53 -12.304 8.535 -5.878 1.00 0.00 H new ATOM 2122 N LYS B 54 -9.719 12.339 -4.697 1.00 0.00 N ATOM 2123 CA LYS B 54 -10.270 13.644 -4.238 1.00 0.00 C ATOM 2124 C LYS B 54 -9.538 14.775 -4.963 1.00 0.00 C ATOM 2125 O LYS B 54 -9.782 15.940 -4.721 1.00 0.00 O ATOM 2126 CB LYS B 54 -10.060 13.772 -2.728 1.00 0.00 C ATOM 2127 CG LYS B 54 -10.976 12.786 -1.999 1.00 0.00 C ATOM 2128 CD LYS B 54 -10.736 12.884 -0.492 1.00 0.00 C ATOM 2129 CE LYS B 54 -11.654 11.902 0.232 1.00 0.00 C ATOM 2130 NZ LYS B 54 -11.390 11.959 1.697 1.00 0.00 N ATOM 0 H LYS B 54 -8.920 11.996 -4.163 1.00 0.00 H new ATOM 0 HA LYS B 54 -11.336 13.702 -4.459 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -9.019 13.571 -2.477 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -10.275 14.791 -2.405 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -12.019 13.006 -2.227 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -10.782 11.770 -2.343 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -9.694 12.661 -0.263 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -10.928 13.900 -0.147 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -12.697 12.147 0.030 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -11.487 10.891 -0.139 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -11.005 11.047 2.016 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -10.703 12.714 1.897 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -12.277 12.156 2.202 1.00 0.00 H new ATOM 2144 N GLY B 55 -8.643 14.438 -5.858 1.00 0.00 N ATOM 2145 CA GLY B 55 -7.889 15.485 -6.615 1.00 0.00 C ATOM 2146 C GLY B 55 -6.564 15.788 -5.910 1.00 0.00 C ATOM 2147 O GLY B 55 -5.806 16.631 -6.344 1.00 0.00 O ATOM 0 H GLY B 55 -8.401 13.477 -6.098 1.00 0.00 H new ATOM 0 HA2 GLY B 55 -7.699 15.144 -7.633 1.00 0.00 H new ATOM 0 HA3 GLY B 55 -8.487 16.393 -6.689 1.00 0.00 H new ATOM 2151 N VAL B 56 -6.276 15.112 -4.831 1.00 0.00 N ATOM 2152 CA VAL B 56 -4.998 15.375 -4.106 1.00 0.00 C ATOM 2153 C VAL B 56 -3.821 15.022 -5.018 1.00 0.00 C ATOM 2154 O VAL B 56 -3.839 14.027 -5.713 1.00 0.00 O ATOM 2155 CB VAL B 56 -4.947 14.535 -2.821 1.00 0.00 C ATOM 2156 CG1 VAL B 56 -3.706 14.908 -1.991 1.00 0.00 C ATOM 2157 CG2 VAL B 56 -6.203 14.805 -1.989 1.00 0.00 C ATOM 0 H VAL B 56 -6.868 14.390 -4.420 1.00 0.00 H new ATOM 0 HA VAL B 56 -4.939 16.429 -3.835 1.00 0.00 H new ATOM 0 HB VAL B 56 -4.895 13.480 -3.090 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -3.681 14.306 -1.083 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -2.806 14.719 -2.577 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -3.750 15.964 -1.725 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -6.170 14.210 -1.076 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -6.248 15.863 -1.731 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.087 14.534 -2.566 1.00 0.00 H new ATOM 2167 N ASP B 57 -2.809 15.848 -5.036 1.00 0.00 N ATOM 2168 CA ASP B 57 -1.636 15.582 -5.921 1.00 0.00 C ATOM 2169 C ASP B 57 -0.651 14.617 -5.246 1.00 0.00 C ATOM 2170 O ASP B 57 0.267 15.012 -4.559 1.00 0.00 O ATOM 2171 CB ASP B 57 -0.941 16.909 -6.251 1.00 0.00 C ATOM 2172 CG ASP B 57 -0.262 17.480 -5.002 1.00 0.00 C ATOM 2173 OD1 ASP B 57 -0.948 17.675 -4.014 1.00 0.00 O ATOM 2174 OD2 ASP B 57 0.936 17.712 -5.060 1.00 0.00 O ATOM 0 H ASP B 57 -2.743 16.697 -4.475 1.00 0.00 H new ATOM 0 HA ASP B 57 -1.984 15.115 -6.842 1.00 0.00 H new ATOM 0 HB2 ASP B 57 -0.201 16.754 -7.036 1.00 0.00 H new ATOM 0 HB3 ASP B 57 -1.669 17.623 -6.635 1.00 0.00 H new ATOM 2179 N LEU B 58 -0.831 13.343 -5.460 1.00 0.00 N ATOM 2180 CA LEU B 58 0.093 12.338 -4.862 1.00 0.00 C ATOM 2181 C LEU B 58 1.286 12.161 -5.800 1.00 0.00 C ATOM 2182 O LEU B 58 2.294 11.585 -5.441 1.00 0.00 O ATOM 2183 CB LEU B 58 -0.655 11.005 -4.704 1.00 0.00 C ATOM 2184 CG LEU B 58 -1.469 10.995 -3.395 1.00 0.00 C ATOM 2185 CD1 LEU B 58 -0.539 10.879 -2.171 1.00 0.00 C ATOM 2186 CD2 LEU B 58 -2.300 12.279 -3.296 1.00 0.00 C ATOM 0 H LEU B 58 -1.583 12.952 -6.027 1.00 0.00 H new ATOM 0 HA LEU B 58 0.442 12.669 -3.884 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.320 10.851 -5.554 1.00 0.00 H new ATOM 0 HB3 LEU B 58 0.057 10.180 -4.703 1.00 0.00 H new ATOM 0 HG LEU B 58 -2.132 10.130 -3.406 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -1.136 10.874 -1.259 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.033 9.953 -2.235 1.00 0.00 H new ATOM 0 HD13 LEU B 58 0.145 11.728 -2.152 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -2.875 12.270 -2.370 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -1.636 13.143 -3.303 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -2.981 12.338 -4.145 1.00 0.00 H new ATOM 2198 N ASN B 59 1.181 12.658 -6.999 1.00 0.00 N ATOM 2199 CA ASN B 59 2.310 12.524 -7.956 1.00 0.00 C ATOM 2200 C ASN B 59 3.494 13.364 -7.474 1.00 0.00 C ATOM 2201 O ASN B 59 4.611 12.896 -7.409 1.00 0.00 O ATOM 2202 CB ASN B 59 1.867 13.013 -9.338 1.00 0.00 C ATOM 2203 CG ASN B 59 1.209 14.386 -9.211 1.00 0.00 C ATOM 2204 OD1 ASN B 59 0.535 14.663 -8.239 1.00 0.00 O ATOM 2205 ND2 ASN B 59 1.378 15.268 -10.159 1.00 0.00 N ATOM 0 H ASN B 59 0.363 13.151 -7.357 1.00 0.00 H new ATOM 0 HA ASN B 59 2.610 11.478 -8.018 1.00 0.00 H new ATOM 0 HB2 ASN B 59 2.726 13.071 -10.007 1.00 0.00 H new ATOM 0 HB3 ASN B 59 1.167 12.303 -9.779 1.00 0.00 H new ATOM 0 HD21 ASN B 59 0.944 16.188 -10.083 1.00 0.00 H new ATOM 0 HD22 ASN B 59 1.944 15.037 -10.976 1.00 0.00 H new ATOM 2212 N ALA B 60 3.255 14.600 -7.129 1.00 0.00 N ATOM 2213 CA ALA B 60 4.361 15.471 -6.648 1.00 0.00 C ATOM 2214 C ALA B 60 4.907 14.946 -5.319 1.00 0.00 C ATOM 2215 O ALA B 60 6.099 14.960 -5.075 1.00 0.00 O ATOM 2216 CB ALA B 60 3.825 16.887 -6.442 1.00 0.00 C ATOM 0 H ALA B 60 2.337 15.044 -7.160 1.00 0.00 H new ATOM 0 HA ALA B 60 5.162 15.473 -7.387 1.00 0.00 H new ATOM 0 HB1 ALA B 60 4.629 17.533 -6.089 1.00 0.00 H new ATOM 0 HB2 ALA B 60 3.439 17.271 -7.386 1.00 0.00 H new ATOM 0 HB3 ALA B 60 3.024 16.869 -5.703 1.00 0.00 H new ATOM 2222 N LEU B 61 4.045 14.485 -4.457 1.00 0.00 N ATOM 2223 CA LEU B 61 4.519 13.971 -3.147 1.00 0.00 C ATOM 2224 C LEU B 61 5.458 12.787 -3.372 1.00 0.00 C ATOM 2225 O LEU B 61 6.527 12.728 -2.812 1.00 0.00 O ATOM 2226 CB LEU B 61 3.306 13.516 -2.324 1.00 0.00 C ATOM 2227 CG LEU B 61 3.759 12.883 -0.999 1.00 0.00 C ATOM 2228 CD1 LEU B 61 4.635 13.867 -0.211 1.00 0.00 C ATOM 2229 CD2 LEU B 61 2.520 12.520 -0.172 1.00 0.00 C ATOM 0 H LEU B 61 3.037 14.443 -4.604 1.00 0.00 H new ATOM 0 HA LEU B 61 5.055 14.756 -2.613 1.00 0.00 H new ATOM 0 HB2 LEU B 61 2.656 14.367 -2.123 1.00 0.00 H new ATOM 0 HB3 LEU B 61 2.721 12.796 -2.896 1.00 0.00 H new ATOM 0 HG LEU B 61 4.343 11.987 -1.208 1.00 0.00 H new ATOM 0 HD11 LEU B 61 4.949 13.405 0.725 1.00 0.00 H new ATOM 0 HD12 LEU B 61 5.514 14.124 -0.801 1.00 0.00 H new ATOM 0 HD13 LEU B 61 4.065 14.771 0.003 1.00 0.00 H new ATOM 0 HD21 LEU B 61 2.831 12.070 0.771 1.00 0.00 H new ATOM 0 HD22 LEU B 61 1.940 13.421 0.030 1.00 0.00 H new ATOM 0 HD23 LEU B 61 1.907 11.811 -0.728 1.00 0.00 H new ATOM 2241 N PHE B 62 5.065 11.860 -4.200 1.00 0.00 N ATOM 2242 CA PHE B 62 5.921 10.669 -4.484 1.00 0.00 C ATOM 2243 C PHE B 62 7.233 11.109 -5.138 1.00 0.00 C ATOM 2244 O PHE B 62 8.281 10.548 -4.890 1.00 0.00 O ATOM 2245 CB PHE B 62 5.165 9.736 -5.452 1.00 0.00 C ATOM 2246 CG PHE B 62 4.347 8.711 -4.691 1.00 0.00 C ATOM 2247 CD1 PHE B 62 3.445 9.119 -3.699 1.00 0.00 C ATOM 2248 CD2 PHE B 62 4.489 7.348 -4.987 1.00 0.00 C ATOM 2249 CE1 PHE B 62 2.688 8.164 -3.007 1.00 0.00 C ATOM 2250 CE2 PHE B 62 3.733 6.399 -4.298 1.00 0.00 C ATOM 2251 CZ PHE B 62 2.833 6.805 -3.308 1.00 0.00 C ATOM 0 H PHE B 62 4.176 11.875 -4.700 1.00 0.00 H new ATOM 0 HA PHE B 62 6.143 10.151 -3.551 1.00 0.00 H new ATOM 0 HB2 PHE B 62 4.510 10.325 -6.094 1.00 0.00 H new ATOM 0 HB3 PHE B 62 5.876 9.228 -6.103 1.00 0.00 H new ATOM 0 HD1 PHE B 62 3.333 10.168 -3.468 1.00 0.00 H new ATOM 0 HD2 PHE B 62 5.185 7.032 -5.750 1.00 0.00 H new ATOM 0 HE1 PHE B 62 1.993 8.477 -2.242 1.00 0.00 H new ATOM 0 HE2 PHE B 62 3.843 5.350 -4.530 1.00 0.00 H new ATOM 0 HZ PHE B 62 2.249 6.069 -2.775 1.00 0.00 H new ATOM 2261 N ASP B 63 7.175 12.081 -5.995 1.00 0.00 N ATOM 2262 CA ASP B 63 8.407 12.532 -6.688 1.00 0.00 C ATOM 2263 C ASP B 63 9.464 12.915 -5.653 1.00 0.00 C ATOM 2264 O ASP B 63 10.634 12.640 -5.816 1.00 0.00 O ATOM 2265 CB ASP B 63 8.073 13.740 -7.561 1.00 0.00 C ATOM 2266 CG ASP B 63 6.935 13.375 -8.517 1.00 0.00 C ATOM 2267 OD1 ASP B 63 6.694 12.192 -8.695 1.00 0.00 O ATOM 2268 OD2 ASP B 63 6.319 14.284 -9.046 1.00 0.00 O ATOM 0 H ASP B 63 6.325 12.585 -6.247 1.00 0.00 H new ATOM 0 HA ASP B 63 8.797 11.728 -7.312 1.00 0.00 H new ATOM 0 HB2 ASP B 63 7.782 14.585 -6.937 1.00 0.00 H new ATOM 0 HB3 ASP B 63 8.953 14.049 -8.126 1.00 0.00 H new ATOM 2273 N ARG B 64 9.066 13.556 -4.596 1.00 0.00 N ATOM 2274 CA ARG B 64 10.051 13.954 -3.555 1.00 0.00 C ATOM 2275 C ARG B 64 10.594 12.726 -2.807 1.00 0.00 C ATOM 2276 O ARG B 64 11.746 12.692 -2.423 1.00 0.00 O ATOM 2277 CB ARG B 64 9.385 14.923 -2.569 1.00 0.00 C ATOM 2278 CG ARG B 64 9.176 16.291 -3.243 1.00 0.00 C ATOM 2279 CD ARG B 64 10.533 16.938 -3.591 1.00 0.00 C ATOM 2280 NE ARG B 64 10.888 16.604 -5.006 1.00 0.00 N ATOM 2281 CZ ARG B 64 10.503 17.374 -5.990 1.00 0.00 C ATOM 2282 NH1 ARG B 64 9.812 18.457 -5.752 1.00 0.00 N ATOM 2283 NH2 ARG B 64 10.808 17.053 -7.219 1.00 0.00 N ATOM 0 H ARG B 64 8.100 13.823 -4.406 1.00 0.00 H new ATOM 0 HA ARG B 64 10.893 14.447 -4.041 1.00 0.00 H new ATOM 0 HB2 ARG B 64 8.428 14.520 -2.239 1.00 0.00 H new ATOM 0 HB3 ARG B 64 10.006 15.036 -1.680 1.00 0.00 H new ATOM 0 HG2 ARG B 64 8.582 16.169 -4.149 1.00 0.00 H new ATOM 0 HG3 ARG B 64 8.614 16.947 -2.579 1.00 0.00 H new ATOM 0 HD2 ARG B 64 10.478 18.019 -3.463 1.00 0.00 H new ATOM 0 HD3 ARG B 64 11.307 16.576 -2.914 1.00 0.00 H new ATOM 0 HE ARG B 64 11.436 15.767 -5.205 1.00 0.00 H new ATOM 0 HH11 ARG B 64 9.569 18.707 -4.793 1.00 0.00 H new ATOM 0 HH12 ARG B 64 9.515 19.053 -6.525 1.00 0.00 H new ATOM 0 HH21 ARG B 64 11.344 16.206 -7.407 1.00 0.00 H new ATOM 0 HH22 ARG B 64 10.510 17.650 -7.991 1.00 0.00 H new ATOM 2297 N ILE B 65 9.782 11.732 -2.573 1.00 0.00 N ATOM 2298 CA ILE B 65 10.264 10.533 -1.825 1.00 0.00 C ATOM 2299 C ILE B 65 11.381 9.822 -2.599 1.00 0.00 C ATOM 2300 O ILE B 65 12.391 9.452 -2.037 1.00 0.00 O ATOM 2301 CB ILE B 65 9.099 9.557 -1.642 1.00 0.00 C ATOM 2302 CG1 ILE B 65 7.897 10.286 -1.033 1.00 0.00 C ATOM 2303 CG2 ILE B 65 9.517 8.405 -0.727 1.00 0.00 C ATOM 2304 CD1 ILE B 65 8.291 11.009 0.259 1.00 0.00 C ATOM 0 H ILE B 65 8.806 11.697 -2.867 1.00 0.00 H new ATOM 0 HA ILE B 65 10.651 10.858 -0.859 1.00 0.00 H new ATOM 0 HB ILE B 65 8.821 9.156 -2.617 1.00 0.00 H new ATOM 0 HG12 ILE B 65 7.502 11.005 -1.750 1.00 0.00 H new ATOM 0 HG13 ILE B 65 7.100 9.571 -0.826 1.00 0.00 H new ATOM 0 HG21 ILE B 65 8.681 7.717 -0.604 1.00 0.00 H new ATOM 0 HG22 ILE B 65 10.360 7.876 -1.171 1.00 0.00 H new ATOM 0 HG23 ILE B 65 9.808 8.800 0.246 1.00 0.00 H new ATOM 0 HD11 ILE B 65 7.420 11.518 0.671 1.00 0.00 H new ATOM 0 HD12 ILE B 65 8.663 10.284 0.983 1.00 0.00 H new ATOM 0 HD13 ILE B 65 9.071 11.740 0.044 1.00 0.00 H new