USER MOD reduce.3.24.130724 H: found=0, std=0, add=934, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 932 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 51 MET CE :methyl 176:sc= -3.47! (180deg=-3.24!) USER MOD Set 1.2: A 88 SER OG : rot 180:sc= -0.175 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 15:sc= 0.0635 USER MOD Single : A 6 SER OG : rot 180:sc= -0.183 USER MOD Single : A 11 THR OG1 : rot -93:sc= 0.173 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.0101 K(o=-0.01,f=-0.7) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 HIS : no HD1:sc= -0.335 X(o=-0.33,f=0.059) USER MOD Single : A 33 LYS NZ :NH3+ -136:sc= 0.282 (180deg=0.0137) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN :FLIP amide:sc= 0.6 F(o=0,f=0.6) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.921 K(o=-0.92,f=-12!) USER MOD Single : A 46 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0467) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= -1.05 USER MOD Single : A 59 ASN :FLIP amide:sc= -0.102 F(o=-0.64,f=-0.1) USER MOD Single : A 70 MET CE :methyl -164:sc= -1.99 (180deg=-2.13) USER MOD Single : A 80 ASN :FLIP amide:sc= -1.37 F(o=-2.1,f=-1.4) USER MOD Single : A 81 ASN : amide:sc= -0.0238 X(o=-0.024,f=-0.024) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -0.987 X(o=-0.99,f=-0.92) USER MOD Single : A 90 GLN : amide:sc= -3.42! C(o=-3.4!,f=-3.5!) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 93 SER OG : rot -50:sc= 0.49 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -15:sc= 0.901 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.144) USER MOD Single : A 110 ASN : amide:sc= -1.56 K(o=-1.6,f=-10!) USER MOD Single : A 115 ASN : amide:sc= -0.63 X(o=-0.63,f=-0.46) USER MOD Single : A 116 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 117 MET CE :methyl -127:sc= -5.06! (180deg=-11.7!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.182 -30.834 15.570 1.00 0.00 N ATOM 2 CA GLY A 1 7.940 -30.153 15.252 1.00 0.00 C ATOM 3 C GLY A 1 7.880 -28.756 15.837 1.00 0.00 C ATOM 4 O GLY A 1 8.724 -27.913 15.535 1.00 0.00 O ATOM 0 H1 GLY A 1 9.175 -31.785 15.148 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.983 -30.292 15.188 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.279 -30.914 16.602 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.827 -30.096 14.169 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.101 -30.738 15.629 1.00 0.00 H new ATOM 8 N SER A 2 6.878 -28.510 16.674 1.00 0.00 N ATOM 9 CA SER A 2 6.707 -27.203 17.298 1.00 0.00 C ATOM 10 C SER A 2 5.876 -27.314 18.573 1.00 0.00 C ATOM 11 O SER A 2 5.089 -28.246 18.735 1.00 0.00 O ATOM 12 CB SER A 2 6.037 -26.232 16.323 1.00 0.00 C ATOM 13 OG SER A 2 6.385 -24.891 16.618 1.00 0.00 O ATOM 0 H SER A 2 6.172 -29.198 16.936 1.00 0.00 H new ATOM 0 HA SER A 2 7.694 -26.821 17.560 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.336 -26.472 15.303 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.955 -26.350 16.374 1.00 0.00 H new ATOM 0 HG SER A 2 5.946 -24.291 15.980 1.00 0.00 H new ATOM 19 N SER A 3 6.059 -26.356 19.476 1.00 0.00 N ATOM 20 CA SER A 3 5.331 -26.347 20.739 1.00 0.00 C ATOM 21 C SER A 3 3.964 -25.689 20.574 1.00 0.00 C ATOM 22 O SER A 3 3.556 -24.864 21.390 1.00 0.00 O ATOM 23 CB SER A 3 6.137 -25.611 21.812 1.00 0.00 C ATOM 24 OG SER A 3 7.456 -26.121 21.898 1.00 0.00 O ATOM 0 H SER A 3 6.705 -25.576 19.356 1.00 0.00 H new ATOM 0 HA SER A 3 5.182 -27.381 21.051 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.170 -24.546 21.580 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.641 -25.712 22.777 1.00 0.00 H new ATOM 0 HG SER A 3 7.951 -25.633 22.589 1.00 0.00 H new ATOM 30 N GLY A 4 3.260 -26.062 19.509 1.00 0.00 N ATOM 31 CA GLY A 4 1.947 -25.500 19.254 1.00 0.00 C ATOM 32 C GLY A 4 2.004 -24.024 18.913 1.00 0.00 C ATOM 33 O GLY A 4 2.517 -23.219 19.690 1.00 0.00 O ATOM 0 H GLY A 4 3.576 -26.743 18.819 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.477 -26.041 18.433 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.317 -25.643 20.132 1.00 0.00 H new ATOM 37 N SER A 5 1.478 -23.667 17.745 1.00 0.00 N ATOM 38 CA SER A 5 1.477 -22.278 17.300 1.00 0.00 C ATOM 39 C SER A 5 0.198 -21.955 16.534 1.00 0.00 C ATOM 40 O SER A 5 -0.572 -22.849 16.184 1.00 0.00 O ATOM 41 CB SER A 5 2.696 -22.002 16.418 1.00 0.00 C ATOM 42 OG SER A 5 3.856 -21.787 17.204 1.00 0.00 O ATOM 0 H SER A 5 1.047 -24.320 17.090 1.00 0.00 H new ATOM 0 HA SER A 5 1.524 -21.639 18.182 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.860 -22.844 15.745 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.508 -21.128 15.795 1.00 0.00 H new ATOM 0 HG SER A 5 3.688 -22.084 18.123 1.00 0.00 H new ATOM 48 N SER A 6 -0.022 -20.669 16.278 1.00 0.00 N ATOM 49 CA SER A 6 -1.209 -20.225 15.557 1.00 0.00 C ATOM 50 C SER A 6 -0.824 -19.488 14.278 1.00 0.00 C ATOM 51 O SER A 6 -1.197 -19.893 13.178 1.00 0.00 O ATOM 52 CB SER A 6 -2.062 -19.318 16.446 1.00 0.00 C ATOM 53 OG SER A 6 -1.323 -18.189 16.879 1.00 0.00 O ATOM 0 H SER A 6 0.606 -19.916 16.559 1.00 0.00 H new ATOM 0 HA SER A 6 -1.790 -21.106 15.286 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.944 -18.990 15.896 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.415 -19.879 17.311 1.00 0.00 H new ATOM 0 HG SER A 6 -1.890 -17.624 17.444 1.00 0.00 H new ATOM 59 N GLY A 7 -0.075 -18.401 14.432 1.00 0.00 N ATOM 60 CA GLY A 7 0.349 -17.623 13.282 1.00 0.00 C ATOM 61 C GLY A 7 0.453 -16.142 13.591 1.00 0.00 C ATOM 62 O GLY A 7 -0.354 -15.344 13.114 1.00 0.00 O ATOM 0 H GLY A 7 0.246 -18.045 15.332 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.316 -17.988 12.937 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.358 -17.772 12.466 1.00 0.00 H new ATOM 66 N ASP A 8 1.447 -15.774 14.391 1.00 0.00 N ATOM 67 CA ASP A 8 1.653 -14.380 14.763 1.00 0.00 C ATOM 68 C ASP A 8 2.687 -13.722 13.855 1.00 0.00 C ATOM 69 O ASP A 8 3.390 -12.799 14.265 1.00 0.00 O ATOM 70 CB ASP A 8 2.100 -14.279 16.222 1.00 0.00 C ATOM 71 CG ASP A 8 2.880 -15.499 16.674 1.00 0.00 C ATOM 72 OD1 ASP A 8 3.880 -15.842 16.009 1.00 0.00 O ATOM 73 OD2 ASP A 8 2.490 -16.110 17.691 1.00 0.00 O ATOM 0 H ASP A 8 2.123 -16.422 14.795 1.00 0.00 H new ATOM 0 HA ASP A 8 0.705 -13.855 14.645 1.00 0.00 H new ATOM 0 HB2 ASP A 8 2.717 -13.389 16.349 1.00 0.00 H new ATOM 0 HB3 ASP A 8 1.225 -14.154 16.859 1.00 0.00 H new ATOM 78 N ALA A 9 2.774 -14.205 12.620 1.00 0.00 N ATOM 79 CA ALA A 9 3.722 -13.663 11.653 1.00 0.00 C ATOM 80 C ALA A 9 3.208 -12.359 11.052 1.00 0.00 C ATOM 81 O ALA A 9 3.904 -11.706 10.275 1.00 0.00 O ATOM 82 CB ALA A 9 3.996 -14.681 10.556 1.00 0.00 C ATOM 0 H ALA A 9 2.200 -14.970 12.265 1.00 0.00 H new ATOM 0 HA ALA A 9 4.654 -13.449 12.175 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.705 -14.264 9.841 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.415 -15.586 10.996 1.00 0.00 H new ATOM 0 HB3 ALA A 9 3.065 -14.924 10.044 1.00 0.00 H new ATOM 88 N PHE A 10 1.986 -11.986 11.417 1.00 0.00 N ATOM 89 CA PHE A 10 1.378 -10.761 10.912 1.00 0.00 C ATOM 90 C PHE A 10 1.444 -9.650 11.957 1.00 0.00 C ATOM 91 O PHE A 10 0.637 -8.720 11.944 1.00 0.00 O ATOM 92 CB PHE A 10 -0.077 -11.015 10.512 1.00 0.00 C ATOM 93 CG PHE A 10 -0.221 -11.863 9.281 1.00 0.00 C ATOM 94 CD1 PHE A 10 -0.275 -13.244 9.378 1.00 0.00 C ATOM 95 CD2 PHE A 10 -0.303 -11.279 8.027 1.00 0.00 C ATOM 96 CE1 PHE A 10 -0.408 -14.028 8.247 1.00 0.00 C ATOM 97 CE2 PHE A 10 -0.436 -12.057 6.893 1.00 0.00 C ATOM 98 CZ PHE A 10 -0.488 -13.433 7.003 1.00 0.00 C ATOM 0 H PHE A 10 1.397 -12.515 12.061 1.00 0.00 H new ATOM 0 HA PHE A 10 1.938 -10.443 10.033 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.594 -11.500 11.340 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -0.572 -10.058 10.344 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -0.212 -13.714 10.349 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -0.262 -10.204 7.935 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -0.449 -15.104 8.336 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.499 -11.590 5.921 1.00 0.00 H new ATOM 0 HZ PHE A 10 -0.591 -14.043 6.118 1.00 0.00 H new ATOM 108 N THR A 11 2.411 -9.755 12.863 1.00 0.00 N ATOM 109 CA THR A 11 2.583 -8.763 13.916 1.00 0.00 C ATOM 110 C THR A 11 3.520 -7.645 13.472 1.00 0.00 C ATOM 111 O THR A 11 4.483 -7.884 12.743 1.00 0.00 O ATOM 112 CB THR A 11 3.137 -9.400 15.204 1.00 0.00 C ATOM 113 OG1 THR A 11 4.435 -9.953 14.958 1.00 0.00 O ATOM 114 CG2 THR A 11 2.205 -10.489 15.713 1.00 0.00 C ATOM 0 H THR A 11 3.087 -10.518 12.888 1.00 0.00 H new ATOM 0 HA THR A 11 1.597 -8.347 14.121 1.00 0.00 H new ATOM 0 HB THR A 11 3.212 -8.623 15.964 1.00 0.00 H new ATOM 0 HG1 THR A 11 4.347 -10.897 14.710 1.00 0.00 H new ATOM 0 HG21 THR A 11 2.617 -10.924 16.623 1.00 0.00 H new ATOM 0 HG22 THR A 11 1.226 -10.060 15.927 1.00 0.00 H new ATOM 0 HG23 THR A 11 2.103 -11.265 14.954 1.00 0.00 H new ATOM 122 N ASP A 12 3.231 -6.427 13.914 1.00 0.00 N ATOM 123 CA ASP A 12 4.050 -5.272 13.563 1.00 0.00 C ATOM 124 C ASP A 12 5.532 -5.632 13.579 1.00 0.00 C ATOM 125 O ASP A 12 6.223 -5.501 12.568 1.00 0.00 O ATOM 126 CB ASP A 12 3.783 -4.117 14.530 1.00 0.00 C ATOM 127 CG ASP A 12 3.393 -4.599 15.913 1.00 0.00 C ATOM 128 OD1 ASP A 12 2.220 -4.987 16.099 1.00 0.00 O ATOM 129 OD2 ASP A 12 4.261 -4.590 16.811 1.00 0.00 O ATOM 0 H ASP A 12 2.436 -6.213 14.516 1.00 0.00 H new ATOM 0 HA ASP A 12 3.781 -4.960 12.554 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.675 -3.495 14.603 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.988 -3.488 14.130 1.00 0.00 H new ATOM 134 N GLN A 13 6.014 -6.084 14.732 1.00 0.00 N ATOM 135 CA GLN A 13 7.415 -6.461 14.879 1.00 0.00 C ATOM 136 C GLN A 13 7.865 -7.346 13.721 1.00 0.00 C ATOM 137 O GLN A 13 8.997 -7.240 13.248 1.00 0.00 O ATOM 138 CB GLN A 13 7.633 -7.188 16.207 1.00 0.00 C ATOM 139 CG GLN A 13 9.097 -7.330 16.590 1.00 0.00 C ATOM 140 CD GLN A 13 9.315 -8.337 17.702 1.00 0.00 C ATOM 141 OE1 GLN A 13 9.164 -8.018 18.882 1.00 0.00 O ATOM 142 NE2 GLN A 13 9.671 -9.561 17.331 1.00 0.00 N ATOM 0 H GLN A 13 5.455 -6.198 15.578 1.00 0.00 H new ATOM 0 HA GLN A 13 8.013 -5.550 14.870 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.110 -6.649 16.997 1.00 0.00 H new ATOM 0 HB3 GLN A 13 7.184 -8.179 16.147 1.00 0.00 H new ATOM 0 HG2 GLN A 13 9.670 -7.633 15.714 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.482 -6.360 16.903 1.00 0.00 H new ATOM 0 HE21 GLN A 13 9.785 -9.781 16.342 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.831 -10.281 18.035 1.00 0.00 H new ATOM 151 N LYS A 14 6.972 -8.219 13.269 1.00 0.00 N ATOM 152 CA LYS A 14 7.275 -9.123 12.166 1.00 0.00 C ATOM 153 C LYS A 14 7.210 -8.391 10.829 1.00 0.00 C ATOM 154 O LYS A 14 8.019 -8.640 9.935 1.00 0.00 O ATOM 155 CB LYS A 14 6.299 -10.302 12.162 1.00 0.00 C ATOM 156 CG LYS A 14 6.618 -11.359 13.205 1.00 0.00 C ATOM 157 CD LYS A 14 7.848 -12.165 12.825 1.00 0.00 C ATOM 158 CE LYS A 14 7.502 -13.287 11.858 1.00 0.00 C ATOM 159 NZ LYS A 14 8.710 -14.051 11.439 1.00 0.00 N ATOM 0 H LYS A 14 6.031 -8.320 13.650 1.00 0.00 H new ATOM 0 HA LYS A 14 8.288 -9.499 12.306 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.290 -9.928 12.333 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.305 -10.764 11.175 1.00 0.00 H new ATOM 0 HG2 LYS A 14 6.780 -10.881 14.171 1.00 0.00 H new ATOM 0 HG3 LYS A 14 5.765 -12.028 13.319 1.00 0.00 H new ATOM 0 HD2 LYS A 14 8.589 -11.507 12.371 1.00 0.00 H new ATOM 0 HD3 LYS A 14 8.301 -12.584 13.723 1.00 0.00 H new ATOM 0 HE2 LYS A 14 6.789 -13.964 12.328 1.00 0.00 H new ATOM 0 HE3 LYS A 14 7.013 -12.870 10.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 8.432 -14.806 10.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 9.380 -13.410 10.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.163 -14.471 12.276 1.00 0.00 H new ATOM 173 N ILE A 15 6.245 -7.487 10.701 1.00 0.00 N ATOM 174 CA ILE A 15 6.077 -6.718 9.475 1.00 0.00 C ATOM 175 C ILE A 15 7.290 -5.832 9.211 1.00 0.00 C ATOM 176 O ILE A 15 7.843 -5.829 8.111 1.00 0.00 O ATOM 177 CB ILE A 15 4.815 -5.837 9.530 1.00 0.00 C ATOM 178 CG1 ILE A 15 3.565 -6.709 9.670 1.00 0.00 C ATOM 179 CG2 ILE A 15 4.723 -4.964 8.288 1.00 0.00 C ATOM 180 CD1 ILE A 15 2.298 -5.915 9.900 1.00 0.00 C ATOM 0 H ILE A 15 5.567 -7.269 11.432 1.00 0.00 H new ATOM 0 HA ILE A 15 5.972 -7.438 8.664 1.00 0.00 H new ATOM 0 HB ILE A 15 4.881 -5.186 10.402 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.449 -7.311 8.769 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.706 -7.402 10.500 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.826 -4.347 8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.602 -4.322 8.229 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.676 -5.596 7.401 1.00 0.00 H new ATOM 0 HD11 ILE A 15 1.452 -6.597 9.990 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.394 -5.334 10.817 1.00 0.00 H new ATOM 0 HD13 ILE A 15 2.133 -5.241 9.059 1.00 0.00 H new ATOM 192 N ARG A 16 7.700 -5.081 10.229 1.00 0.00 N ATOM 193 CA ARG A 16 8.848 -4.191 10.108 1.00 0.00 C ATOM 194 C ARG A 16 10.130 -4.986 9.878 1.00 0.00 C ATOM 195 O ARG A 16 10.996 -4.575 9.106 1.00 0.00 O ATOM 196 CB ARG A 16 8.987 -3.330 11.365 1.00 0.00 C ATOM 197 CG ARG A 16 9.455 -4.106 12.586 1.00 0.00 C ATOM 198 CD ARG A 16 9.161 -3.350 13.872 1.00 0.00 C ATOM 199 NE ARG A 16 10.116 -3.675 14.928 1.00 0.00 N ATOM 200 CZ ARG A 16 11.377 -3.256 14.933 1.00 0.00 C ATOM 201 NH1 ARG A 16 11.832 -2.500 13.944 1.00 0.00 N ATOM 202 NH2 ARG A 16 12.185 -3.594 15.930 1.00 0.00 N ATOM 0 H ARG A 16 7.254 -5.072 11.146 1.00 0.00 H new ATOM 0 HA ARG A 16 8.684 -3.542 9.248 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.692 -2.523 11.166 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.025 -2.867 11.586 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.961 -5.077 12.613 1.00 0.00 H new ATOM 0 HG3 ARG A 16 10.526 -4.295 12.510 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.188 -2.278 13.677 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.152 -3.588 14.210 1.00 0.00 H new ATOM 0 HE ARG A 16 9.798 -4.255 15.704 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.214 -2.238 13.176 1.00 0.00 H new ATOM 0 HH12 ARG A 16 12.800 -2.180 13.951 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.838 -4.176 16.693 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.153 -3.272 15.934 1.00 0.00 H new ATOM 216 N GLN A 17 10.244 -6.124 10.555 1.00 0.00 N ATOM 217 CA GLN A 17 11.421 -6.975 10.425 1.00 0.00 C ATOM 218 C GLN A 17 11.383 -7.761 9.118 1.00 0.00 C ATOM 219 O GLN A 17 12.425 -8.100 8.556 1.00 0.00 O ATOM 220 CB GLN A 17 11.514 -7.938 11.610 1.00 0.00 C ATOM 221 CG GLN A 17 12.306 -7.383 12.783 1.00 0.00 C ATOM 222 CD GLN A 17 12.908 -8.473 13.648 1.00 0.00 C ATOM 223 OE1 GLN A 17 12.472 -9.624 13.610 1.00 0.00 O ATOM 224 NE2 GLN A 17 13.918 -8.116 14.433 1.00 0.00 N ATOM 0 H GLN A 17 9.536 -6.478 11.199 1.00 0.00 H new ATOM 0 HA GLN A 17 12.302 -6.334 10.417 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.507 -8.185 11.946 1.00 0.00 H new ATOM 0 HB3 GLN A 17 11.976 -8.867 11.277 1.00 0.00 H new ATOM 0 HG2 GLN A 17 13.103 -6.741 12.407 1.00 0.00 H new ATOM 0 HG3 GLN A 17 11.654 -6.758 13.394 1.00 0.00 H new ATOM 0 HE21 GLN A 17 14.247 -7.151 14.433 1.00 0.00 H new ATOM 0 HE22 GLN A 17 14.364 -8.807 15.036 1.00 0.00 H new ATOM 233 N ARG A 18 10.177 -8.046 8.640 1.00 0.00 N ATOM 234 CA ARG A 18 10.003 -8.794 7.400 1.00 0.00 C ATOM 235 C ARG A 18 10.367 -7.935 6.193 1.00 0.00 C ATOM 236 O ARG A 18 10.981 -8.415 5.239 1.00 0.00 O ATOM 237 CB ARG A 18 8.560 -9.285 7.274 1.00 0.00 C ATOM 238 CG ARG A 18 8.230 -9.859 5.905 1.00 0.00 C ATOM 239 CD ARG A 18 7.019 -10.777 5.963 1.00 0.00 C ATOM 240 NE ARG A 18 7.324 -12.046 6.618 1.00 0.00 N ATOM 241 CZ ARG A 18 6.582 -13.139 6.484 1.00 0.00 C ATOM 242 NH1 ARG A 18 5.497 -13.119 5.722 1.00 0.00 N ATOM 243 NH2 ARG A 18 6.926 -14.257 7.111 1.00 0.00 N ATOM 0 H ARG A 18 9.305 -7.771 9.092 1.00 0.00 H new ATOM 0 HA ARG A 18 10.671 -9.655 7.427 1.00 0.00 H new ATOM 0 HB2 ARG A 18 8.377 -10.047 8.032 1.00 0.00 H new ATOM 0 HB3 ARG A 18 7.883 -8.457 7.484 1.00 0.00 H new ATOM 0 HG2 ARG A 18 8.038 -9.046 5.205 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.089 -10.412 5.524 1.00 0.00 H new ATOM 0 HD2 ARG A 18 6.211 -10.278 6.498 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.661 -10.968 4.952 1.00 0.00 H new ATOM 0 HE ARG A 18 8.152 -12.096 7.211 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.230 -12.262 5.237 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.929 -13.960 5.621 1.00 0.00 H new ATOM 0 HH21 ARG A 18 7.761 -14.277 7.696 1.00 0.00 H new ATOM 0 HH22 ARG A 18 6.355 -15.096 7.007 1.00 0.00 H new ATOM 257 N TYR A 19 9.985 -6.664 6.240 1.00 0.00 N ATOM 258 CA TYR A 19 10.268 -5.739 5.149 1.00 0.00 C ATOM 259 C TYR A 19 11.406 -4.792 5.519 1.00 0.00 C ATOM 260 O TYR A 19 11.630 -3.783 4.852 1.00 0.00 O ATOM 261 CB TYR A 19 9.016 -4.935 4.796 1.00 0.00 C ATOM 262 CG TYR A 19 7.881 -5.784 4.267 1.00 0.00 C ATOM 263 CD1 TYR A 19 7.951 -6.367 3.008 1.00 0.00 C ATOM 264 CD2 TYR A 19 6.739 -6.003 5.028 1.00 0.00 C ATOM 265 CE1 TYR A 19 6.917 -7.142 2.522 1.00 0.00 C ATOM 266 CE2 TYR A 19 5.700 -6.777 4.550 1.00 0.00 C ATOM 267 CZ TYR A 19 5.794 -7.344 3.296 1.00 0.00 C ATOM 268 OH TYR A 19 4.761 -8.117 2.815 1.00 0.00 O ATOM 0 H TYR A 19 9.478 -6.250 7.022 1.00 0.00 H new ATOM 0 HA TYR A 19 10.573 -6.324 4.281 1.00 0.00 H new ATOM 0 HB2 TYR A 19 8.676 -4.400 5.683 1.00 0.00 H new ATOM 0 HB3 TYR A 19 9.275 -4.184 4.050 1.00 0.00 H new ATOM 0 HD1 TYR A 19 8.829 -6.211 2.399 1.00 0.00 H new ATOM 0 HD2 TYR A 19 6.663 -5.560 6.010 1.00 0.00 H new ATOM 0 HE1 TYR A 19 6.987 -7.588 1.541 1.00 0.00 H new ATOM 0 HE2 TYR A 19 4.819 -6.937 5.154 1.00 0.00 H new ATOM 0 HH TYR A 19 4.046 -8.160 3.484 1.00 0.00 H new ATOM 278 N ALA A 20 12.122 -5.127 6.588 1.00 0.00 N ATOM 279 CA ALA A 20 13.239 -4.310 7.046 1.00 0.00 C ATOM 280 C ALA A 20 14.354 -4.273 6.007 1.00 0.00 C ATOM 281 O ALA A 20 15.129 -3.317 5.949 1.00 0.00 O ATOM 282 CB ALA A 20 13.767 -4.835 8.373 1.00 0.00 C ATOM 0 H ALA A 20 11.948 -5.958 7.153 1.00 0.00 H new ATOM 0 HA ALA A 20 12.878 -3.291 7.189 1.00 0.00 H new ATOM 0 HB1 ALA A 20 14.601 -4.216 8.703 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.973 -4.803 9.119 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.106 -5.863 8.248 1.00 0.00 H new ATOM 288 N ASP A 21 14.431 -5.317 5.190 1.00 0.00 N ATOM 289 CA ASP A 21 15.452 -5.404 4.153 1.00 0.00 C ATOM 290 C ASP A 21 15.229 -4.342 3.081 1.00 0.00 C ATOM 291 O ASP A 21 16.176 -3.875 2.447 1.00 0.00 O ATOM 292 CB ASP A 21 15.449 -6.796 3.519 1.00 0.00 C ATOM 293 CG ASP A 21 14.336 -6.967 2.504 1.00 0.00 C ATOM 294 OD1 ASP A 21 13.177 -7.168 2.924 1.00 0.00 O ATOM 295 OD2 ASP A 21 14.624 -6.901 1.291 1.00 0.00 O ATOM 0 H ASP A 21 13.798 -6.116 5.226 1.00 0.00 H new ATOM 0 HA ASP A 21 16.422 -5.228 4.617 1.00 0.00 H new ATOM 0 HB2 ASP A 21 16.409 -6.974 3.035 1.00 0.00 H new ATOM 0 HB3 ASP A 21 15.343 -7.548 4.301 1.00 0.00 H new ATOM 300 N LEU A 22 13.971 -3.966 2.881 1.00 0.00 N ATOM 301 CA LEU A 22 13.622 -2.960 1.884 1.00 0.00 C ATOM 302 C LEU A 22 14.440 -1.688 2.084 1.00 0.00 C ATOM 303 O LEU A 22 14.870 -1.365 3.192 1.00 0.00 O ATOM 304 CB LEU A 22 12.129 -2.635 1.959 1.00 0.00 C ATOM 305 CG LEU A 22 11.176 -3.819 1.790 1.00 0.00 C ATOM 306 CD1 LEU A 22 9.753 -3.331 1.568 1.00 0.00 C ATOM 307 CD2 LEU A 22 11.624 -4.704 0.636 1.00 0.00 C ATOM 0 H LEU A 22 13.175 -4.343 3.396 1.00 0.00 H new ATOM 0 HA LEU A 22 13.851 -3.367 0.899 1.00 0.00 H new ATOM 0 HB2 LEU A 22 11.927 -2.166 2.922 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.899 -1.897 1.191 1.00 0.00 H new ATOM 0 HG LEU A 22 11.197 -4.411 2.705 1.00 0.00 H new ATOM 0 HD11 LEU A 22 9.089 -4.187 1.450 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.433 -2.739 2.426 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.715 -2.716 0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.934 -5.541 0.531 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.633 -4.123 -0.286 1.00 0.00 H new ATOM 0 HD23 LEU A 22 12.626 -5.083 0.836 1.00 0.00 H new ATOM 319 N PRO A 23 14.661 -0.947 0.988 1.00 0.00 N ATOM 320 CA PRO A 23 15.427 0.302 1.018 1.00 0.00 C ATOM 321 C PRO A 23 14.685 1.420 1.743 1.00 0.00 C ATOM 322 O PRO A 23 15.244 2.086 2.613 1.00 0.00 O ATOM 323 CB PRO A 23 15.599 0.648 -0.463 1.00 0.00 C ATOM 324 CG PRO A 23 14.451 -0.015 -1.143 1.00 0.00 C ATOM 325 CD PRO A 23 14.179 -1.272 -0.365 1.00 0.00 C ATOM 0 HA PRO A 23 16.368 0.190 1.556 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.584 1.726 -0.622 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.551 0.282 -0.847 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.576 0.634 -1.154 1.00 0.00 H new ATOM 0 HG3 PRO A 23 14.691 -0.243 -2.181 1.00 0.00 H new ATOM 0 HD2 PRO A 23 13.118 -1.522 -0.364 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.708 -2.127 -0.785 1.00 0.00 H new ATOM 333 N GLY A 24 13.422 1.619 1.379 1.00 0.00 N ATOM 334 CA GLY A 24 12.624 2.657 2.006 1.00 0.00 C ATOM 335 C GLY A 24 12.275 2.330 3.445 1.00 0.00 C ATOM 336 O GLY A 24 12.626 1.264 3.948 1.00 0.00 O ATOM 0 H GLY A 24 12.937 1.080 0.661 1.00 0.00 H new ATOM 0 HA2 GLY A 24 13.169 3.600 1.973 1.00 0.00 H new ATOM 0 HA3 GLY A 24 11.706 2.799 1.436 1.00 0.00 H new ATOM 340 N GLU A 25 11.584 3.252 4.108 1.00 0.00 N ATOM 341 CA GLU A 25 11.190 3.057 5.499 1.00 0.00 C ATOM 342 C GLU A 25 9.721 2.655 5.597 1.00 0.00 C ATOM 343 O GLU A 25 8.849 3.302 5.015 1.00 0.00 O ATOM 344 CB GLU A 25 11.437 4.333 6.306 1.00 0.00 C ATOM 345 CG GLU A 25 11.690 4.081 7.782 1.00 0.00 C ATOM 346 CD GLU A 25 10.414 3.809 8.555 1.00 0.00 C ATOM 347 OE1 GLU A 25 9.746 4.783 8.960 1.00 0.00 O ATOM 348 OE2 GLU A 25 10.084 2.621 8.755 1.00 0.00 O ATOM 0 H GLU A 25 11.286 4.140 3.705 1.00 0.00 H new ATOM 0 HA GLU A 25 11.797 2.252 5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 25 12.293 4.859 5.884 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.575 4.992 6.201 1.00 0.00 H new ATOM 0 HG2 GLU A 25 12.364 3.232 7.891 1.00 0.00 H new ATOM 0 HG3 GLU A 25 12.194 4.946 8.213 1.00 0.00 H new ATOM 355 N LEU A 26 9.455 1.585 6.337 1.00 0.00 N ATOM 356 CA LEU A 26 8.092 1.095 6.512 1.00 0.00 C ATOM 357 C LEU A 26 7.217 2.149 7.182 1.00 0.00 C ATOM 358 O LEU A 26 7.573 2.693 8.228 1.00 0.00 O ATOM 359 CB LEU A 26 8.093 -0.188 7.344 1.00 0.00 C ATOM 360 CG LEU A 26 6.846 -1.065 7.228 1.00 0.00 C ATOM 361 CD1 LEU A 26 6.883 -1.878 5.943 1.00 0.00 C ATOM 362 CD2 LEU A 26 6.723 -1.980 8.437 1.00 0.00 C ATOM 0 H LEU A 26 10.165 1.040 6.826 1.00 0.00 H new ATOM 0 HA LEU A 26 7.680 0.880 5.526 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.959 -0.783 7.056 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.226 0.082 8.392 1.00 0.00 H new ATOM 0 HG LEU A 26 5.971 -0.416 7.198 1.00 0.00 H new ATOM 0 HD11 LEU A 26 5.988 -2.496 5.878 1.00 0.00 H new ATOM 0 HD12 LEU A 26 6.922 -1.204 5.087 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.766 -2.517 5.942 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.830 -2.597 8.337 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.602 -2.622 8.499 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.649 -1.378 9.343 1.00 0.00 H new ATOM 374 N HIS A 27 6.069 2.432 6.574 1.00 0.00 N ATOM 375 CA HIS A 27 5.141 3.419 7.114 1.00 0.00 C ATOM 376 C HIS A 27 3.738 2.833 7.241 1.00 0.00 C ATOM 377 O HIS A 27 2.988 2.778 6.266 1.00 0.00 O ATOM 378 CB HIS A 27 5.110 4.661 6.223 1.00 0.00 C ATOM 379 CG HIS A 27 6.150 5.678 6.577 1.00 0.00 C ATOM 380 ND1 HIS A 27 5.853 6.997 6.847 1.00 0.00 N ATOM 381 CD2 HIS A 27 7.493 5.563 6.704 1.00 0.00 C ATOM 382 CE1 HIS A 27 6.967 7.650 7.125 1.00 0.00 C ATOM 383 NE2 HIS A 27 7.977 6.802 7.045 1.00 0.00 N ATOM 0 H HIS A 27 5.759 1.992 5.707 1.00 0.00 H new ATOM 0 HA HIS A 27 5.488 3.703 8.108 1.00 0.00 H new ATOM 0 HB2 HIS A 27 5.249 4.357 5.185 1.00 0.00 H new ATOM 0 HB3 HIS A 27 4.125 5.122 6.291 1.00 0.00 H new ATOM 0 HD2 HIS A 27 8.075 4.664 6.563 1.00 0.00 H new ATOM 0 HE1 HIS A 27 7.040 8.698 7.375 1.00 0.00 H new ATOM 0 HE2 HIS A 27 8.957 7.031 7.210 1.00 0.00 H new ATOM 392 N ILE A 28 3.391 2.397 8.447 1.00 0.00 N ATOM 393 CA ILE A 28 2.078 1.816 8.700 1.00 0.00 C ATOM 394 C ILE A 28 1.106 2.864 9.231 1.00 0.00 C ATOM 395 O ILE A 28 1.247 3.341 10.357 1.00 0.00 O ATOM 396 CB ILE A 28 2.162 0.653 9.706 1.00 0.00 C ATOM 397 CG1 ILE A 28 3.080 -0.448 9.171 1.00 0.00 C ATOM 398 CG2 ILE A 28 0.774 0.099 9.992 1.00 0.00 C ATOM 399 CD1 ILE A 28 3.455 -1.480 10.211 1.00 0.00 C ATOM 0 H ILE A 28 4.000 2.435 9.264 1.00 0.00 H new ATOM 0 HA ILE A 28 1.712 1.435 7.746 1.00 0.00 H new ATOM 0 HB ILE A 28 2.582 1.029 10.639 1.00 0.00 H new ATOM 0 HG12 ILE A 28 2.587 -0.947 8.337 1.00 0.00 H new ATOM 0 HG13 ILE A 28 3.989 0.007 8.778 1.00 0.00 H new ATOM 0 HG21 ILE A 28 0.850 -0.722 10.705 1.00 0.00 H new ATOM 0 HG22 ILE A 28 0.147 0.886 10.411 1.00 0.00 H new ATOM 0 HG23 ILE A 28 0.329 -0.264 9.066 1.00 0.00 H new ATOM 0 HD11 ILE A 28 4.107 -2.229 9.762 1.00 0.00 H new ATOM 0 HD12 ILE A 28 3.976 -0.993 11.035 1.00 0.00 H new ATOM 0 HD13 ILE A 28 2.553 -1.962 10.587 1.00 0.00 H new ATOM 411 N ILE A 29 0.120 3.216 8.413 1.00 0.00 N ATOM 412 CA ILE A 29 -0.877 4.206 8.802 1.00 0.00 C ATOM 413 C ILE A 29 -2.289 3.644 8.671 1.00 0.00 C ATOM 414 O ILE A 29 -2.561 2.820 7.799 1.00 0.00 O ATOM 415 CB ILE A 29 -0.764 5.484 7.951 1.00 0.00 C ATOM 416 CG1 ILE A 29 -1.154 5.193 6.500 1.00 0.00 C ATOM 417 CG2 ILE A 29 0.648 6.045 8.023 1.00 0.00 C ATOM 418 CD1 ILE A 29 -1.394 6.440 5.678 1.00 0.00 C ATOM 0 H ILE A 29 -0.010 2.831 7.477 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.683 4.456 9.845 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.451 6.230 8.350 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.365 4.605 6.031 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.056 4.582 6.490 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.712 6.948 7.416 1.00 0.00 H new ATOM 0 HG22 ILE A 29 0.892 6.285 9.058 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.353 5.304 7.646 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.666 6.158 4.661 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.203 7.019 6.123 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.486 7.042 5.657 1.00 0.00 H new ATOM 430 N GLU A 30 -3.184 4.099 9.542 1.00 0.00 N ATOM 431 CA GLU A 30 -4.569 3.642 9.522 1.00 0.00 C ATOM 432 C GLU A 30 -5.465 4.653 8.813 1.00 0.00 C ATOM 433 O GLU A 30 -5.526 5.822 9.196 1.00 0.00 O ATOM 434 CB GLU A 30 -5.073 3.409 10.948 1.00 0.00 C ATOM 435 CG GLU A 30 -4.837 1.995 11.454 1.00 0.00 C ATOM 436 CD GLU A 30 -4.642 1.938 12.957 1.00 0.00 C ATOM 437 OE1 GLU A 30 -3.565 2.355 13.432 1.00 0.00 O ATOM 438 OE2 GLU A 30 -5.567 1.477 13.657 1.00 0.00 O ATOM 0 H GLU A 30 -2.975 4.783 10.270 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.607 2.701 8.973 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.580 4.113 11.618 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -6.140 3.626 10.987 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.685 1.368 11.177 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.958 1.579 10.961 1.00 0.00 H new ATOM 445 N LEU A 31 -6.160 4.195 7.778 1.00 0.00 N ATOM 446 CA LEU A 31 -7.053 5.059 7.013 1.00 0.00 C ATOM 447 C LEU A 31 -8.464 4.481 6.970 1.00 0.00 C ATOM 448 O LEU A 31 -8.649 3.289 6.727 1.00 0.00 O ATOM 449 CB LEU A 31 -6.522 5.244 5.591 1.00 0.00 C ATOM 450 CG LEU A 31 -5.075 5.724 5.472 1.00 0.00 C ATOM 451 CD1 LEU A 31 -4.670 5.840 4.010 1.00 0.00 C ATOM 452 CD2 LEU A 31 -4.895 7.057 6.184 1.00 0.00 C ATOM 0 H LEU A 31 -6.123 3.230 7.449 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.092 6.029 7.508 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.613 4.294 5.064 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.164 5.958 5.075 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.428 4.989 5.950 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.637 6.183 3.945 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.760 4.866 3.529 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -5.322 6.554 3.507 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.859 7.383 6.089 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.553 7.801 5.735 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.144 6.943 7.239 1.00 0.00 H new ATOM 464 N GLU A 32 -9.455 5.335 7.206 1.00 0.00 N ATOM 465 CA GLU A 32 -10.850 4.908 7.193 1.00 0.00 C ATOM 466 C GLU A 32 -11.484 5.165 5.829 1.00 0.00 C ATOM 467 O GLU A 32 -11.557 6.305 5.370 1.00 0.00 O ATOM 468 CB GLU A 32 -11.640 5.638 8.281 1.00 0.00 C ATOM 469 CG GLU A 32 -12.801 4.830 8.835 1.00 0.00 C ATOM 470 CD GLU A 32 -13.899 5.704 9.409 1.00 0.00 C ATOM 471 OE1 GLU A 32 -14.539 6.440 8.628 1.00 0.00 O ATOM 472 OE2 GLU A 32 -14.119 5.653 10.637 1.00 0.00 O ATOM 0 H GLU A 32 -9.318 6.325 7.408 1.00 0.00 H new ATOM 0 HA GLU A 32 -10.878 3.837 7.392 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -10.965 5.896 9.097 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.021 6.575 7.875 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -13.215 4.206 8.043 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.434 4.158 9.611 1.00 0.00 H new ATOM 479 N LYS A 33 -11.942 4.096 5.185 1.00 0.00 N ATOM 480 CA LYS A 33 -12.571 4.204 3.874 1.00 0.00 C ATOM 481 C LYS A 33 -13.541 5.380 3.831 1.00 0.00 C ATOM 482 O LYS A 33 -14.534 5.405 4.559 1.00 0.00 O ATOM 483 CB LYS A 33 -13.310 2.908 3.532 1.00 0.00 C ATOM 484 CG LYS A 33 -12.384 1.752 3.191 1.00 0.00 C ATOM 485 CD LYS A 33 -13.030 0.793 2.206 1.00 0.00 C ATOM 486 CE LYS A 33 -13.830 -0.285 2.921 1.00 0.00 C ATOM 487 NZ LYS A 33 -14.982 -0.756 2.103 1.00 0.00 N ATOM 0 H LYS A 33 -11.889 3.145 5.550 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.787 4.375 3.136 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.937 2.623 4.377 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -13.975 3.091 2.688 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -11.457 2.140 2.768 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.119 1.216 4.102 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -13.684 1.347 1.533 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.260 0.328 1.591 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.179 -1.128 3.150 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.195 0.104 3.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -15.826 -0.836 2.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.166 -0.076 1.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -14.760 -1.686 1.693 1.00 0.00 H new ATOM 501 N ASP A 34 -13.248 6.351 2.973 1.00 0.00 N ATOM 502 CA ASP A 34 -14.096 7.529 2.833 1.00 0.00 C ATOM 503 C ASP A 34 -15.352 7.203 2.031 1.00 0.00 C ATOM 504 O ASP A 34 -15.496 6.100 1.502 1.00 0.00 O ATOM 505 CB ASP A 34 -13.324 8.662 2.156 1.00 0.00 C ATOM 506 CG ASP A 34 -13.465 8.638 0.647 1.00 0.00 C ATOM 507 OD1 ASP A 34 -12.923 7.708 0.015 1.00 0.00 O ATOM 508 OD2 ASP A 34 -14.117 9.551 0.097 1.00 0.00 O ATOM 0 H ASP A 34 -12.430 6.346 2.364 1.00 0.00 H new ATOM 0 HA ASP A 34 -14.397 7.850 3.830 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.681 9.619 2.536 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.269 8.588 2.421 1.00 0.00 H new ATOM 513 N LYS A 35 -16.261 8.169 1.944 1.00 0.00 N ATOM 514 CA LYS A 35 -17.505 7.985 1.207 1.00 0.00 C ATOM 515 C LYS A 35 -17.288 7.099 -0.015 1.00 0.00 C ATOM 516 O LYS A 35 -18.147 6.293 -0.370 1.00 0.00 O ATOM 517 CB LYS A 35 -18.069 9.340 0.773 1.00 0.00 C ATOM 518 CG LYS A 35 -17.098 10.168 -0.051 1.00 0.00 C ATOM 519 CD LYS A 35 -17.677 11.530 -0.394 1.00 0.00 C ATOM 520 CE LYS A 35 -16.607 12.475 -0.919 1.00 0.00 C ATOM 521 NZ LYS A 35 -16.170 12.108 -2.294 1.00 0.00 N ATOM 0 H LYS A 35 -16.159 9.088 2.375 1.00 0.00 H new ATOM 0 HA LYS A 35 -18.220 7.494 1.867 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.977 9.177 0.193 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -18.354 9.906 1.660 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.168 10.296 0.502 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -16.852 9.635 -0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -18.461 11.415 -1.142 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.143 11.962 0.492 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -16.992 13.495 -0.920 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -15.748 12.459 -0.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -15.440 12.776 -2.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -15.779 11.144 -2.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -16.985 12.148 -2.939 1.00 0.00 H new ATOM 535 N ASN A 36 -16.133 7.253 -0.655 1.00 0.00 N ATOM 536 CA ASN A 36 -15.802 6.465 -1.837 1.00 0.00 C ATOM 537 C ASN A 36 -14.795 5.371 -1.497 1.00 0.00 C ATOM 538 O ASN A 36 -14.695 4.365 -2.199 1.00 0.00 O ATOM 539 CB ASN A 36 -15.240 7.368 -2.937 1.00 0.00 C ATOM 540 CG ASN A 36 -15.549 6.847 -4.327 1.00 0.00 C ATOM 541 OD1 ASN A 36 -15.865 7.755 -5.242 1.00 0.00 O flip ATOM 542 ND2 ASN A 36 -15.505 5.641 -4.574 1.00 0.00 N flip ATOM 0 H ASN A 36 -15.411 7.916 -0.375 1.00 0.00 H new ATOM 0 HA ASN A 36 -16.717 5.993 -2.196 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -15.654 8.370 -2.827 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -14.160 7.454 -2.816 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -15.257 4.979 -3.839 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -15.716 5.305 -5.514 1.00 0.00 H new ATOM 549 N GLY A 37 -14.050 5.575 -0.415 1.00 0.00 N ATOM 550 CA GLY A 37 -13.060 4.598 0.000 1.00 0.00 C ATOM 551 C GLY A 37 -11.643 5.046 -0.297 1.00 0.00 C ATOM 552 O GLY A 37 -11.431 6.083 -0.927 1.00 0.00 O ATOM 0 H GLY A 37 -14.114 6.400 0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -13.163 4.413 1.069 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -13.253 3.652 -0.507 1.00 0.00 H new ATOM 556 N LEU A 38 -10.669 4.266 0.160 1.00 0.00 N ATOM 557 CA LEU A 38 -9.264 4.590 -0.058 1.00 0.00 C ATOM 558 C LEU A 38 -8.978 4.803 -1.541 1.00 0.00 C ATOM 559 O LEU A 38 -9.051 3.869 -2.338 1.00 0.00 O ATOM 560 CB LEU A 38 -8.372 3.474 0.490 1.00 0.00 C ATOM 561 CG LEU A 38 -8.757 2.921 1.863 1.00 0.00 C ATOM 562 CD1 LEU A 38 -7.779 1.839 2.295 1.00 0.00 C ATOM 563 CD2 LEU A 38 -8.808 4.039 2.893 1.00 0.00 C ATOM 0 H LEU A 38 -10.827 3.405 0.684 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.044 5.516 0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.373 2.651 -0.225 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -7.349 3.847 0.544 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.750 2.477 1.790 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.068 1.457 3.274 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.793 1.026 1.570 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -6.774 2.258 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -9.084 3.627 3.864 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.829 4.513 2.964 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -9.548 4.780 2.590 1.00 0.00 H new ATOM 575 N GLY A 39 -8.649 6.040 -1.903 1.00 0.00 N ATOM 576 CA GLY A 39 -8.355 6.353 -3.289 1.00 0.00 C ATOM 577 C GLY A 39 -6.866 6.460 -3.556 1.00 0.00 C ATOM 578 O GLY A 39 -6.205 7.378 -3.068 1.00 0.00 O ATOM 0 H GLY A 39 -8.581 6.830 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.782 5.582 -3.931 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.837 7.293 -3.556 1.00 0.00 H new ATOM 582 N LEU A 40 -6.337 5.520 -4.331 1.00 0.00 N ATOM 583 CA LEU A 40 -4.916 5.511 -4.660 1.00 0.00 C ATOM 584 C LEU A 40 -4.682 4.924 -6.048 1.00 0.00 C ATOM 585 O LEU A 40 -5.274 3.907 -6.411 1.00 0.00 O ATOM 586 CB LEU A 40 -4.135 4.710 -3.617 1.00 0.00 C ATOM 587 CG LEU A 40 -4.259 5.190 -2.171 1.00 0.00 C ATOM 588 CD1 LEU A 40 -4.052 4.034 -1.205 1.00 0.00 C ATOM 589 CD2 LEU A 40 -3.263 6.306 -1.892 1.00 0.00 C ATOM 0 H LEU A 40 -6.870 4.754 -4.743 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.562 6.542 -4.657 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.465 3.672 -3.664 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.081 4.722 -3.894 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.265 5.583 -2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.144 4.395 -0.181 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.805 3.267 -1.389 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.059 3.610 -1.353 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.366 6.635 -0.858 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.250 5.939 -2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.459 7.144 -2.561 1.00 0.00 H new ATOM 601 N SER A 41 -3.814 5.570 -6.820 1.00 0.00 N ATOM 602 CA SER A 41 -3.503 5.112 -8.170 1.00 0.00 C ATOM 603 C SER A 41 -2.366 4.096 -8.150 1.00 0.00 C ATOM 604 O SER A 41 -1.200 4.454 -7.976 1.00 0.00 O ATOM 605 CB SER A 41 -3.127 6.299 -9.059 1.00 0.00 C ATOM 606 OG SER A 41 -4.231 7.169 -9.243 1.00 0.00 O ATOM 0 H SER A 41 -3.314 6.412 -6.534 1.00 0.00 H new ATOM 0 HA SER A 41 -4.391 4.629 -8.578 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.299 6.847 -8.608 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.780 5.937 -10.027 1.00 0.00 H new ATOM 0 HG SER A 41 -3.964 7.920 -9.813 1.00 0.00 H new ATOM 612 N LEU A 42 -2.712 2.826 -8.331 1.00 0.00 N ATOM 613 CA LEU A 42 -1.721 1.756 -8.334 1.00 0.00 C ATOM 614 C LEU A 42 -1.230 1.473 -9.750 1.00 0.00 C ATOM 615 O LEU A 42 -1.959 1.670 -10.722 1.00 0.00 O ATOM 616 CB LEU A 42 -2.313 0.484 -7.724 1.00 0.00 C ATOM 617 CG LEU A 42 -3.029 0.653 -6.384 1.00 0.00 C ATOM 618 CD1 LEU A 42 -3.720 -0.641 -5.981 1.00 0.00 C ATOM 619 CD2 LEU A 42 -2.047 1.092 -5.307 1.00 0.00 C ATOM 0 H LEU A 42 -3.671 2.512 -8.478 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.872 2.079 -7.732 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.017 0.056 -8.438 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.509 -0.241 -7.595 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.788 1.427 -6.494 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.224 -0.502 -5.025 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.452 -0.914 -6.741 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.979 -1.435 -5.888 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.574 1.208 -4.360 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.266 0.340 -5.198 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.597 2.044 -5.591 1.00 0.00 H new ATOM 631 N ALA A 43 0.011 1.010 -9.859 1.00 0.00 N ATOM 632 CA ALA A 43 0.598 0.696 -11.155 1.00 0.00 C ATOM 633 C ALA A 43 1.720 -0.328 -11.017 1.00 0.00 C ATOM 634 O ALA A 43 2.764 -0.045 -10.431 1.00 0.00 O ATOM 635 CB ALA A 43 1.117 1.962 -11.820 1.00 0.00 C ATOM 0 H ALA A 43 0.629 0.844 -9.065 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.180 0.261 -11.782 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.553 1.712 -12.787 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.294 2.662 -11.963 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.877 2.420 -11.187 1.00 0.00 H new ATOM 641 N GLY A 44 1.496 -1.522 -11.559 1.00 0.00 N ATOM 642 CA GLY A 44 2.496 -2.570 -11.484 1.00 0.00 C ATOM 643 C GLY A 44 3.887 -2.070 -11.821 1.00 0.00 C ATOM 644 O GLY A 44 4.053 -1.214 -12.689 1.00 0.00 O ATOM 0 H GLY A 44 0.640 -1.781 -12.049 1.00 0.00 H new ATOM 0 HA2 GLY A 44 2.499 -2.994 -10.480 1.00 0.00 H new ATOM 0 HA3 GLY A 44 2.227 -3.374 -12.168 1.00 0.00 H new ATOM 648 N ASN A 45 4.889 -2.604 -11.130 1.00 0.00 N ATOM 649 CA ASN A 45 6.273 -2.204 -11.359 1.00 0.00 C ATOM 650 C ASN A 45 6.610 -2.238 -12.846 1.00 0.00 C ATOM 651 O ASN A 45 6.228 -3.166 -13.560 1.00 0.00 O ATOM 652 CB ASN A 45 7.224 -3.121 -10.588 1.00 0.00 C ATOM 653 CG ASN A 45 8.682 -2.790 -10.844 1.00 0.00 C ATOM 654 OD1 ASN A 45 9.118 -2.708 -11.993 1.00 0.00 O ATOM 655 ND2 ASN A 45 9.442 -2.597 -9.773 1.00 0.00 N ATOM 0 H ASN A 45 4.769 -3.314 -10.408 1.00 0.00 H new ATOM 0 HA ASN A 45 6.394 -1.182 -11.001 1.00 0.00 H new ATOM 0 HB2 ASN A 45 7.018 -3.039 -9.521 1.00 0.00 H new ATOM 0 HB3 ASN A 45 7.034 -4.157 -10.871 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.430 -2.370 -9.883 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.038 -2.675 -8.840 1.00 0.00 H new ATOM 662 N LYS A 46 7.329 -1.220 -13.308 1.00 0.00 N ATOM 663 CA LYS A 46 7.720 -1.133 -14.710 1.00 0.00 C ATOM 664 C LYS A 46 8.015 -2.516 -15.280 1.00 0.00 C ATOM 665 O LYS A 46 7.476 -2.898 -16.318 1.00 0.00 O ATOM 666 CB LYS A 46 8.949 -0.234 -14.862 1.00 0.00 C ATOM 667 CG LYS A 46 8.669 1.232 -14.582 1.00 0.00 C ATOM 668 CD LYS A 46 9.950 2.049 -14.549 1.00 0.00 C ATOM 669 CE LYS A 46 9.659 3.541 -14.497 1.00 0.00 C ATOM 670 NZ LYS A 46 9.188 4.060 -15.811 1.00 0.00 N ATOM 0 H LYS A 46 7.653 -0.443 -12.731 1.00 0.00 H new ATOM 0 HA LYS A 46 6.889 -0.700 -15.267 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.729 -0.582 -14.185 1.00 0.00 H new ATOM 0 HB3 LYS A 46 9.339 -0.334 -15.875 1.00 0.00 H new ATOM 0 HG2 LYS A 46 8.003 1.629 -15.348 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.150 1.328 -13.628 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.543 1.763 -13.680 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.549 1.825 -15.432 1.00 0.00 H new ATOM 0 HE2 LYS A 46 8.903 3.737 -13.737 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.560 4.076 -14.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 9.114 5.097 -15.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 9.865 3.791 -16.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.255 3.655 -16.030 1.00 0.00 H new ATOM 684 N ASP A 47 8.873 -3.263 -14.593 1.00 0.00 N ATOM 685 CA ASP A 47 9.237 -4.606 -15.030 1.00 0.00 C ATOM 686 C ASP A 47 8.181 -5.621 -14.604 1.00 0.00 C ATOM 687 O ASP A 47 8.055 -5.943 -13.423 1.00 0.00 O ATOM 688 CB ASP A 47 10.600 -4.999 -14.457 1.00 0.00 C ATOM 689 CG ASP A 47 11.744 -4.267 -15.131 1.00 0.00 C ATOM 690 OD1 ASP A 47 11.608 -3.050 -15.375 1.00 0.00 O ATOM 691 OD2 ASP A 47 12.776 -4.911 -15.413 1.00 0.00 O ATOM 0 H ASP A 47 9.329 -2.961 -13.732 1.00 0.00 H new ATOM 0 HA ASP A 47 9.295 -4.604 -16.118 1.00 0.00 H new ATOM 0 HB2 ASP A 47 10.616 -4.787 -13.388 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.743 -6.074 -14.571 1.00 0.00 H new ATOM 696 N ARG A 48 7.424 -6.122 -15.575 1.00 0.00 N ATOM 697 CA ARG A 48 6.377 -7.098 -15.301 1.00 0.00 C ATOM 698 C ARG A 48 6.893 -8.207 -14.389 1.00 0.00 C ATOM 699 O ARG A 48 6.328 -8.464 -13.326 1.00 0.00 O ATOM 700 CB ARG A 48 5.856 -7.700 -16.608 1.00 0.00 C ATOM 701 CG ARG A 48 6.958 -8.167 -17.545 1.00 0.00 C ATOM 702 CD ARG A 48 6.476 -8.223 -18.987 1.00 0.00 C ATOM 703 NE ARG A 48 7.568 -8.028 -19.937 1.00 0.00 N ATOM 704 CZ ARG A 48 7.447 -8.221 -21.245 1.00 0.00 C ATOM 705 NH1 ARG A 48 6.288 -8.612 -21.757 1.00 0.00 N ATOM 706 NH2 ARG A 48 8.487 -8.022 -22.045 1.00 0.00 N ATOM 0 H ARG A 48 7.517 -5.868 -16.558 1.00 0.00 H new ATOM 0 HA ARG A 48 5.560 -6.584 -14.794 1.00 0.00 H new ATOM 0 HB2 ARG A 48 5.206 -8.544 -16.376 1.00 0.00 H new ATOM 0 HB3 ARG A 48 5.244 -6.958 -17.121 1.00 0.00 H new ATOM 0 HG2 ARG A 48 7.811 -7.492 -17.471 1.00 0.00 H new ATOM 0 HG3 ARG A 48 7.305 -9.153 -17.237 1.00 0.00 H new ATOM 0 HD2 ARG A 48 6.001 -9.186 -19.173 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.717 -7.457 -19.145 1.00 0.00 H new ATOM 0 HE ARG A 48 8.473 -7.727 -19.576 1.00 0.00 H new ATOM 0 HH11 ARG A 48 5.486 -8.765 -21.146 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.198 -8.759 -22.762 1.00 0.00 H new ATOM 0 HH21 ARG A 48 9.380 -7.721 -21.655 1.00 0.00 H new ATOM 0 HH22 ARG A 48 8.393 -8.170 -23.050 1.00 0.00 H new ATOM 720 N SER A 49 7.970 -8.862 -14.812 1.00 0.00 N ATOM 721 CA SER A 49 8.560 -9.946 -14.036 1.00 0.00 C ATOM 722 C SER A 49 8.556 -9.612 -12.547 1.00 0.00 C ATOM 723 O SER A 49 8.355 -10.487 -11.704 1.00 0.00 O ATOM 724 CB SER A 49 9.990 -10.218 -14.506 1.00 0.00 C ATOM 725 OG SER A 49 10.000 -11.048 -15.654 1.00 0.00 O ATOM 0 H SER A 49 8.452 -8.660 -15.688 1.00 0.00 H new ATOM 0 HA SER A 49 7.958 -10.841 -14.191 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.488 -9.275 -14.731 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.555 -10.694 -13.705 1.00 0.00 H new ATOM 0 HG SER A 49 10.925 -11.206 -15.936 1.00 0.00 H new ATOM 731 N ARG A 50 8.780 -8.341 -12.232 1.00 0.00 N ATOM 732 CA ARG A 50 8.804 -7.891 -10.845 1.00 0.00 C ATOM 733 C ARG A 50 7.413 -7.461 -10.389 1.00 0.00 C ATOM 734 O ARG A 50 6.991 -6.330 -10.632 1.00 0.00 O ATOM 735 CB ARG A 50 9.787 -6.731 -10.680 1.00 0.00 C ATOM 736 CG ARG A 50 11.223 -7.177 -10.454 1.00 0.00 C ATOM 737 CD ARG A 50 11.998 -6.161 -9.630 1.00 0.00 C ATOM 738 NE ARG A 50 13.290 -6.683 -9.193 1.00 0.00 N ATOM 739 CZ ARG A 50 14.095 -6.042 -8.352 1.00 0.00 C ATOM 740 NH1 ARG A 50 13.742 -4.863 -7.860 1.00 0.00 N ATOM 741 NH2 ARG A 50 15.255 -6.582 -8.001 1.00 0.00 N ATOM 0 H ARG A 50 8.947 -7.605 -12.918 1.00 0.00 H new ATOM 0 HA ARG A 50 9.130 -8.726 -10.224 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.746 -6.102 -11.569 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.470 -6.114 -9.839 1.00 0.00 H new ATOM 0 HG2 ARG A 50 11.230 -8.141 -9.945 1.00 0.00 H new ATOM 0 HG3 ARG A 50 11.716 -7.320 -11.415 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.153 -5.258 -10.220 1.00 0.00 H new ATOM 0 HD3 ARG A 50 11.409 -5.875 -8.759 1.00 0.00 H new ATOM 0 HE ARG A 50 13.591 -7.589 -9.553 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.850 -4.445 -8.127 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.362 -4.373 -7.215 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.529 -7.490 -8.377 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.872 -6.089 -7.355 1.00 0.00 H new ATOM 755 N MET A 51 6.705 -8.370 -9.727 1.00 0.00 N ATOM 756 CA MET A 51 5.362 -8.085 -9.237 1.00 0.00 C ATOM 757 C MET A 51 5.413 -7.206 -7.991 1.00 0.00 C ATOM 758 O MET A 51 6.082 -7.538 -7.013 1.00 0.00 O ATOM 759 CB MET A 51 4.621 -9.387 -8.926 1.00 0.00 C ATOM 760 CG MET A 51 3.822 -9.927 -10.101 1.00 0.00 C ATOM 761 SD MET A 51 2.584 -8.759 -10.694 1.00 0.00 S ATOM 762 CE MET A 51 1.073 -9.626 -10.276 1.00 0.00 C ATOM 0 H MET A 51 7.039 -9.311 -9.518 1.00 0.00 H new ATOM 0 HA MET A 51 4.825 -7.548 -10.018 1.00 0.00 H new ATOM 0 HB2 MET A 51 5.343 -10.140 -8.611 1.00 0.00 H new ATOM 0 HB3 MET A 51 3.948 -9.220 -8.085 1.00 0.00 H new ATOM 0 HG2 MET A 51 4.503 -10.174 -10.916 1.00 0.00 H new ATOM 0 HG3 MET A 51 3.330 -10.854 -9.805 1.00 0.00 H new ATOM 0 HE1 MET A 51 0.215 -8.998 -10.516 1.00 0.00 H new ATOM 0 HE2 MET A 51 1.016 -10.553 -10.847 1.00 0.00 H new ATOM 0 HE3 MET A 51 1.068 -9.855 -9.210 1.00 0.00 H new ATOM 772 N SER A 52 4.703 -6.083 -8.034 1.00 0.00 N ATOM 773 CA SER A 52 4.671 -5.154 -6.911 1.00 0.00 C ATOM 774 C SER A 52 3.672 -4.030 -7.163 1.00 0.00 C ATOM 775 O SER A 52 3.502 -3.578 -8.296 1.00 0.00 O ATOM 776 CB SER A 52 6.064 -4.569 -6.667 1.00 0.00 C ATOM 777 OG SER A 52 6.812 -4.514 -7.869 1.00 0.00 O ATOM 0 H SER A 52 4.142 -5.795 -8.835 1.00 0.00 H new ATOM 0 HA SER A 52 4.355 -5.704 -6.025 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.973 -3.568 -6.246 1.00 0.00 H new ATOM 0 HB3 SER A 52 6.593 -5.177 -5.933 1.00 0.00 H new ATOM 0 HG SER A 52 7.697 -4.135 -7.686 1.00 0.00 H new ATOM 783 N ILE A 53 3.012 -3.583 -6.099 1.00 0.00 N ATOM 784 CA ILE A 53 2.030 -2.511 -6.205 1.00 0.00 C ATOM 785 C ILE A 53 2.551 -1.225 -5.572 1.00 0.00 C ATOM 786 O ILE A 53 2.858 -1.186 -4.381 1.00 0.00 O ATOM 787 CB ILE A 53 0.700 -2.899 -5.532 1.00 0.00 C ATOM 788 CG1 ILE A 53 0.175 -4.215 -6.110 1.00 0.00 C ATOM 789 CG2 ILE A 53 -0.326 -1.790 -5.710 1.00 0.00 C ATOM 790 CD1 ILE A 53 -0.732 -4.971 -5.165 1.00 0.00 C ATOM 0 H ILE A 53 3.140 -3.947 -5.155 1.00 0.00 H new ATOM 0 HA ILE A 53 1.855 -2.345 -7.268 1.00 0.00 H new ATOM 0 HB ILE A 53 0.876 -3.037 -4.465 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.367 -4.007 -7.032 1.00 0.00 H new ATOM 0 HG13 ILE A 53 1.021 -4.850 -6.374 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.261 -2.079 -5.229 1.00 0.00 H new ATOM 0 HG22 ILE A 53 0.048 -0.872 -5.256 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.501 -1.623 -6.773 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.066 -5.893 -5.641 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.187 -5.211 -4.252 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -1.597 -4.355 -4.920 1.00 0.00 H new ATOM 802 N PHE A 54 2.645 -0.172 -6.378 1.00 0.00 N ATOM 803 CA PHE A 54 3.128 1.117 -5.898 1.00 0.00 C ATOM 804 C PHE A 54 2.018 2.164 -5.943 1.00 0.00 C ATOM 805 O PHE A 54 0.898 1.880 -6.367 1.00 0.00 O ATOM 806 CB PHE A 54 4.319 1.584 -6.736 1.00 0.00 C ATOM 807 CG PHE A 54 5.549 0.741 -6.552 1.00 0.00 C ATOM 808 CD1 PHE A 54 6.308 0.841 -5.398 1.00 0.00 C ATOM 809 CD2 PHE A 54 5.946 -0.152 -7.535 1.00 0.00 C ATOM 810 CE1 PHE A 54 7.439 0.067 -5.225 1.00 0.00 C ATOM 811 CE2 PHE A 54 7.076 -0.929 -7.368 1.00 0.00 C ATOM 812 CZ PHE A 54 7.824 -0.819 -6.213 1.00 0.00 C ATOM 0 H PHE A 54 2.393 -0.187 -7.366 1.00 0.00 H new ATOM 0 HA PHE A 54 3.447 0.995 -4.863 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.037 1.577 -7.789 1.00 0.00 H new ATOM 0 HB3 PHE A 54 4.553 2.616 -6.476 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.012 1.533 -4.623 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.366 -0.241 -8.441 1.00 0.00 H new ATOM 0 HE1 PHE A 54 8.021 0.154 -4.319 1.00 0.00 H new ATOM 0 HE2 PHE A 54 7.374 -1.622 -8.141 1.00 0.00 H new ATOM 0 HZ PHE A 54 8.709 -1.424 -6.082 1.00 0.00 H new ATOM 822 N VAL A 55 2.338 3.376 -5.501 1.00 0.00 N ATOM 823 CA VAL A 55 1.370 4.466 -5.491 1.00 0.00 C ATOM 824 C VAL A 55 1.847 5.632 -6.349 1.00 0.00 C ATOM 825 O VAL A 55 2.609 6.484 -5.891 1.00 0.00 O ATOM 826 CB VAL A 55 1.108 4.971 -4.059 1.00 0.00 C ATOM 827 CG1 VAL A 55 0.154 6.155 -4.077 1.00 0.00 C ATOM 828 CG2 VAL A 55 0.561 3.848 -3.191 1.00 0.00 C ATOM 0 H VAL A 55 3.260 3.628 -5.145 1.00 0.00 H new ATOM 0 HA VAL A 55 0.443 4.069 -5.904 1.00 0.00 H new ATOM 0 HB VAL A 55 2.053 5.304 -3.630 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.019 6.498 -3.057 1.00 0.00 H new ATOM 0 HG12 VAL A 55 0.590 6.964 -4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -0.793 5.852 -4.524 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.382 4.222 -2.183 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.375 3.483 -3.615 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.284 3.033 -3.152 1.00 0.00 H new ATOM 838 N VAL A 56 1.392 5.665 -7.598 1.00 0.00 N ATOM 839 CA VAL A 56 1.771 6.728 -8.522 1.00 0.00 C ATOM 840 C VAL A 56 0.740 7.851 -8.519 1.00 0.00 C ATOM 841 O VAL A 56 0.697 8.670 -9.436 1.00 0.00 O ATOM 842 CB VAL A 56 1.928 6.194 -9.958 1.00 0.00 C ATOM 843 CG1 VAL A 56 2.804 4.950 -9.972 1.00 0.00 C ATOM 844 CG2 VAL A 56 0.566 5.905 -10.571 1.00 0.00 C ATOM 0 H VAL A 56 0.761 4.968 -7.993 1.00 0.00 H new ATOM 0 HA VAL A 56 2.730 7.118 -8.181 1.00 0.00 H new ATOM 0 HB VAL A 56 2.416 6.960 -10.561 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.904 4.587 -10.995 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.790 5.195 -9.576 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.347 4.176 -9.355 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.696 5.529 -11.586 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.048 5.158 -9.970 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -0.023 6.822 -10.597 1.00 0.00 H new ATOM 854 N GLY A 57 -0.090 7.883 -7.481 1.00 0.00 N ATOM 855 CA GLY A 57 -1.110 8.910 -7.378 1.00 0.00 C ATOM 856 C GLY A 57 -1.958 8.762 -6.130 1.00 0.00 C ATOM 857 O GLY A 57 -2.224 7.646 -5.682 1.00 0.00 O ATOM 0 H GLY A 57 -0.074 7.216 -6.710 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.635 9.891 -7.376 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.753 8.869 -8.257 1.00 0.00 H new ATOM 861 N ILE A 58 -2.382 9.888 -5.568 1.00 0.00 N ATOM 862 CA ILE A 58 -3.204 9.878 -4.364 1.00 0.00 C ATOM 863 C ILE A 58 -4.375 10.847 -4.490 1.00 0.00 C ATOM 864 O ILE A 58 -4.231 12.045 -4.251 1.00 0.00 O ATOM 865 CB ILE A 58 -2.380 10.246 -3.116 1.00 0.00 C ATOM 866 CG1 ILE A 58 -1.274 9.214 -2.885 1.00 0.00 C ATOM 867 CG2 ILE A 58 -3.283 10.345 -1.895 1.00 0.00 C ATOM 868 CD1 ILE A 58 -0.290 9.613 -1.808 1.00 0.00 C ATOM 0 H ILE A 58 -2.170 10.819 -5.927 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.585 8.863 -4.251 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.915 11.218 -3.280 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.728 8.261 -2.615 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.734 9.057 -3.819 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.686 10.606 -1.021 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -4.037 11.114 -2.062 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.773 9.386 -1.726 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.465 8.835 -1.699 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.192 10.550 -2.085 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.817 9.742 -0.863 1.00 0.00 H new ATOM 880 N ASN A 59 -5.535 10.319 -4.865 1.00 0.00 N ATOM 881 CA ASN A 59 -6.733 11.137 -5.022 1.00 0.00 C ATOM 882 C ASN A 59 -6.815 12.195 -3.926 1.00 0.00 C ATOM 883 O ASN A 59 -6.766 11.895 -2.733 1.00 0.00 O ATOM 884 CB ASN A 59 -7.984 10.257 -4.992 1.00 0.00 C ATOM 885 CG ASN A 59 -9.119 10.838 -5.812 1.00 0.00 C ATOM 886 OD1 ASN A 59 -8.835 11.164 -7.068 1.00 0.00 O flip ATOM 887 ND2 ASN A 59 -10.238 10.992 -5.323 1.00 0.00 N flip ATOM 0 H ASN A 59 -5.672 9.328 -5.066 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.675 11.642 -5.986 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -7.736 9.265 -5.371 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -8.312 10.132 -3.960 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.412 10.728 -4.353 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.992 11.384 -5.887 1.00 0.00 H new ATOM 894 N PRO A 60 -6.944 13.465 -4.339 1.00 0.00 N ATOM 895 CA PRO A 60 -7.038 14.594 -3.409 1.00 0.00 C ATOM 896 C PRO A 60 -8.356 14.606 -2.642 1.00 0.00 C ATOM 897 O PRO A 60 -8.479 15.269 -1.613 1.00 0.00 O ATOM 898 CB PRO A 60 -6.940 15.817 -4.324 1.00 0.00 C ATOM 899 CG PRO A 60 -7.425 15.338 -5.649 1.00 0.00 C ATOM 900 CD PRO A 60 -7.009 13.896 -5.745 1.00 0.00 C ATOM 0 HA PRO A 60 -6.264 14.555 -2.642 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -7.551 16.640 -3.952 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -5.915 16.184 -4.386 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.508 15.438 -5.728 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -6.991 15.924 -6.459 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.729 13.307 -6.313 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -6.046 13.788 -6.243 1.00 0.00 H new ATOM 908 N GLU A 61 -9.338 13.868 -3.151 1.00 0.00 N ATOM 909 CA GLU A 61 -10.647 13.796 -2.513 1.00 0.00 C ATOM 910 C GLU A 61 -10.746 12.568 -1.612 1.00 0.00 C ATOM 911 O GLU A 61 -11.654 12.461 -0.789 1.00 0.00 O ATOM 912 CB GLU A 61 -11.753 13.756 -3.571 1.00 0.00 C ATOM 913 CG GLU A 61 -11.617 14.833 -4.634 1.00 0.00 C ATOM 914 CD GLU A 61 -12.866 14.975 -5.482 1.00 0.00 C ATOM 915 OE1 GLU A 61 -13.083 14.122 -6.368 1.00 0.00 O ATOM 916 OE2 GLU A 61 -13.627 15.941 -5.259 1.00 0.00 O ATOM 0 H GLU A 61 -9.252 13.312 -4.002 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.773 14.688 -1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -11.748 12.779 -4.053 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -12.719 13.863 -3.079 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.398 15.787 -4.154 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -10.770 14.598 -5.278 1.00 0.00 H new ATOM 923 N GLY A 62 -9.804 11.644 -1.775 1.00 0.00 N ATOM 924 CA GLY A 62 -9.803 10.436 -0.971 1.00 0.00 C ATOM 925 C GLY A 62 -9.269 10.672 0.428 1.00 0.00 C ATOM 926 O GLY A 62 -8.781 11.754 0.755 1.00 0.00 O ATOM 0 H GLY A 62 -9.042 11.711 -2.449 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -10.818 10.044 -0.908 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -9.198 9.675 -1.464 1.00 0.00 H new ATOM 930 N PRO A 63 -9.360 9.642 1.282 1.00 0.00 N ATOM 931 CA PRO A 63 -8.889 9.718 2.668 1.00 0.00 C ATOM 932 C PRO A 63 -7.368 9.786 2.760 1.00 0.00 C ATOM 933 O PRO A 63 -6.820 10.480 3.616 1.00 0.00 O ATOM 934 CB PRO A 63 -9.405 8.418 3.290 1.00 0.00 C ATOM 935 CG PRO A 63 -9.544 7.478 2.143 1.00 0.00 C ATOM 936 CD PRO A 63 -9.931 8.323 0.960 1.00 0.00 C ATOM 0 HA PRO A 63 -9.245 10.617 3.171 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -8.709 8.033 4.036 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -10.359 8.572 3.794 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -8.609 6.949 1.956 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -10.302 6.722 2.347 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -9.523 7.925 0.031 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -11.013 8.372 0.838 1.00 0.00 H new ATOM 944 N ALA A 64 -6.693 9.063 1.873 1.00 0.00 N ATOM 945 CA ALA A 64 -5.236 9.043 1.854 1.00 0.00 C ATOM 946 C ALA A 64 -4.670 10.452 1.710 1.00 0.00 C ATOM 947 O ALA A 64 -3.615 10.766 2.259 1.00 0.00 O ATOM 948 CB ALA A 64 -4.735 8.154 0.725 1.00 0.00 C ATOM 0 H ALA A 64 -7.132 8.483 1.158 1.00 0.00 H new ATOM 0 HA ALA A 64 -4.890 8.635 2.804 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.645 8.148 0.723 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.103 7.138 0.871 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.098 8.538 -0.229 1.00 0.00 H new ATOM 954 N ALA A 65 -5.379 11.297 0.969 1.00 0.00 N ATOM 955 CA ALA A 65 -4.948 12.673 0.755 1.00 0.00 C ATOM 956 C ALA A 65 -5.146 13.512 2.012 1.00 0.00 C ATOM 957 O ALA A 65 -4.325 14.371 2.333 1.00 0.00 O ATOM 958 CB ALA A 65 -5.703 13.286 -0.416 1.00 0.00 C ATOM 0 H ALA A 65 -6.255 11.053 0.507 1.00 0.00 H new ATOM 0 HA ALA A 65 -3.883 12.662 0.521 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.371 14.314 -0.565 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -5.507 12.707 -1.318 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -6.772 13.277 -0.204 1.00 0.00 H new ATOM 964 N ALA A 66 -6.241 13.258 2.721 1.00 0.00 N ATOM 965 CA ALA A 66 -6.546 13.990 3.945 1.00 0.00 C ATOM 966 C ALA A 66 -5.518 13.694 5.031 1.00 0.00 C ATOM 967 O ALA A 66 -5.152 14.576 5.810 1.00 0.00 O ATOM 968 CB ALA A 66 -7.945 13.645 4.432 1.00 0.00 C ATOM 0 H ALA A 66 -6.932 12.551 2.469 1.00 0.00 H new ATOM 0 HA ALA A 66 -6.504 15.056 3.722 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -8.159 14.199 5.346 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -8.673 13.913 3.667 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.007 12.575 4.633 1.00 0.00 H new ATOM 974 N ASP A 67 -5.056 12.450 5.079 1.00 0.00 N ATOM 975 CA ASP A 67 -4.069 12.038 6.071 1.00 0.00 C ATOM 976 C ASP A 67 -2.735 12.740 5.835 1.00 0.00 C ATOM 977 O ASP A 67 -2.164 13.333 6.749 1.00 0.00 O ATOM 978 CB ASP A 67 -3.875 10.522 6.030 1.00 0.00 C ATOM 979 CG ASP A 67 -3.446 9.956 7.370 1.00 0.00 C ATOM 980 OD1 ASP A 67 -4.080 10.301 8.390 1.00 0.00 O ATOM 981 OD2 ASP A 67 -2.478 9.168 7.398 1.00 0.00 O ATOM 0 H ASP A 67 -5.349 11.709 4.443 1.00 0.00 H new ATOM 0 HA ASP A 67 -4.440 12.323 7.056 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -4.806 10.048 5.720 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.126 10.275 5.278 1.00 0.00 H new ATOM 986 N GLY A 68 -2.244 12.668 4.601 1.00 0.00 N ATOM 987 CA GLY A 68 -0.981 13.300 4.267 1.00 0.00 C ATOM 988 C GLY A 68 0.198 12.364 4.438 1.00 0.00 C ATOM 989 O GLY A 68 1.263 12.584 3.861 1.00 0.00 O ATOM 0 H GLY A 68 -2.698 12.183 3.827 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.016 13.651 3.236 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.839 14.177 4.898 1.00 0.00 H new ATOM 993 N ARG A 69 0.010 11.317 5.235 1.00 0.00 N ATOM 994 CA ARG A 69 1.069 10.345 5.483 1.00 0.00 C ATOM 995 C ARG A 69 1.475 9.642 4.191 1.00 0.00 C ATOM 996 O ARG A 69 2.658 9.568 3.858 1.00 0.00 O ATOM 997 CB ARG A 69 0.611 9.313 6.515 1.00 0.00 C ATOM 998 CG ARG A 69 0.054 9.930 7.788 1.00 0.00 C ATOM 999 CD ARG A 69 1.128 10.684 8.557 1.00 0.00 C ATOM 1000 NE ARG A 69 0.590 11.859 9.239 1.00 0.00 N ATOM 1001 CZ ARG A 69 1.220 12.490 10.223 1.00 0.00 C ATOM 1002 NH1 ARG A 69 2.404 12.063 10.638 1.00 0.00 N ATOM 1003 NH2 ARG A 69 0.665 13.552 10.793 1.00 0.00 N ATOM 0 H ARG A 69 -0.865 11.120 5.720 1.00 0.00 H new ATOM 0 HA ARG A 69 1.935 10.880 5.873 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.152 8.676 6.066 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.453 8.670 6.771 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.761 10.609 7.538 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.366 9.147 8.420 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.585 10.018 9.289 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.916 10.993 7.870 1.00 0.00 H new ATOM 0 HE ARG A 69 -0.319 12.214 8.943 1.00 0.00 H new ATOM 0 HH11 ARG A 69 2.834 11.248 10.201 1.00 0.00 H new ATOM 0 HH12 ARG A 69 2.885 12.550 11.394 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -0.246 13.884 10.475 1.00 0.00 H new ATOM 0 HH22 ARG A 69 1.149 14.037 11.549 1.00 0.00 H new ATOM 1017 N MET A 70 0.486 9.128 3.467 1.00 0.00 N ATOM 1018 CA MET A 70 0.741 8.432 2.211 1.00 0.00 C ATOM 1019 C MET A 70 1.238 9.401 1.143 1.00 0.00 C ATOM 1020 O MET A 70 0.803 10.551 1.085 1.00 0.00 O ATOM 1021 CB MET A 70 -0.528 7.728 1.727 1.00 0.00 C ATOM 1022 CG MET A 70 -0.740 6.359 2.353 1.00 0.00 C ATOM 1023 SD MET A 70 -1.620 5.225 1.262 1.00 0.00 S ATOM 1024 CE MET A 70 -0.253 4.451 0.402 1.00 0.00 C ATOM 0 H MET A 70 -0.499 9.180 3.728 1.00 0.00 H new ATOM 0 HA MET A 70 1.516 7.687 2.389 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.390 8.357 1.949 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.483 7.620 0.643 1.00 0.00 H new ATOM 0 HG2 MET A 70 0.227 5.929 2.613 1.00 0.00 H new ATOM 0 HG3 MET A 70 -1.299 6.471 3.282 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.624 3.944 -0.489 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.472 5.212 0.112 1.00 0.00 H new ATOM 0 HE3 MET A 70 0.226 3.725 1.059 1.00 0.00 H new ATOM 1034 N ARG A 71 2.150 8.929 0.300 1.00 0.00 N ATOM 1035 CA ARG A 71 2.707 9.755 -0.765 1.00 0.00 C ATOM 1036 C ARG A 71 2.935 8.931 -2.029 1.00 0.00 C ATOM 1037 O ARG A 71 2.676 7.728 -2.052 1.00 0.00 O ATOM 1038 CB ARG A 71 4.023 10.389 -0.312 1.00 0.00 C ATOM 1039 CG ARG A 71 3.894 11.227 0.950 1.00 0.00 C ATOM 1040 CD ARG A 71 3.584 12.680 0.624 1.00 0.00 C ATOM 1041 NE ARG A 71 3.023 13.390 1.770 1.00 0.00 N ATOM 1042 CZ ARG A 71 3.087 14.708 1.922 1.00 0.00 C ATOM 1043 NH1 ARG A 71 3.685 15.455 1.005 1.00 0.00 N ATOM 1044 NH2 ARG A 71 2.553 15.281 2.993 1.00 0.00 N ATOM 0 H ARG A 71 2.519 7.979 0.334 1.00 0.00 H new ATOM 0 HA ARG A 71 1.990 10.545 -0.991 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.756 9.601 -0.141 1.00 0.00 H new ATOM 0 HB3 ARG A 71 4.410 11.015 -1.116 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.105 10.818 1.581 1.00 0.00 H new ATOM 0 HG3 ARG A 71 4.820 11.171 1.522 1.00 0.00 H new ATOM 0 HD2 ARG A 71 4.496 13.181 0.298 1.00 0.00 H new ATOM 0 HD3 ARG A 71 2.882 12.723 -0.208 1.00 0.00 H new ATOM 0 HE ARG A 71 2.556 12.844 2.494 1.00 0.00 H new ATOM 0 HH11 ARG A 71 4.097 15.018 0.181 1.00 0.00 H new ATOM 0 HH12 ARG A 71 3.733 16.467 1.124 1.00 0.00 H new ATOM 0 HH21 ARG A 71 2.093 14.709 3.701 1.00 0.00 H new ATOM 0 HH22 ARG A 71 2.603 16.293 3.108 1.00 0.00 H new ATOM 1058 N ILE A 72 3.420 9.588 -3.077 1.00 0.00 N ATOM 1059 CA ILE A 72 3.683 8.917 -4.344 1.00 0.00 C ATOM 1060 C ILE A 72 4.979 8.115 -4.282 1.00 0.00 C ATOM 1061 O ILE A 72 6.047 8.662 -4.013 1.00 0.00 O ATOM 1062 CB ILE A 72 3.769 9.922 -5.507 1.00 0.00 C ATOM 1063 CG1 ILE A 72 2.634 10.945 -5.411 1.00 0.00 C ATOM 1064 CG2 ILE A 72 3.722 9.194 -6.842 1.00 0.00 C ATOM 1065 CD1 ILE A 72 1.276 10.320 -5.180 1.00 0.00 C ATOM 0 H ILE A 72 3.639 10.584 -3.074 1.00 0.00 H new ATOM 0 HA ILE A 72 2.847 8.240 -4.522 1.00 0.00 H new ATOM 0 HB ILE A 72 4.718 10.453 -5.439 1.00 0.00 H new ATOM 0 HG12 ILE A 72 2.849 11.639 -4.598 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.604 11.530 -6.330 1.00 0.00 H new ATOM 0 HG21 ILE A 72 3.784 9.919 -7.654 1.00 0.00 H new ATOM 0 HG22 ILE A 72 4.561 8.502 -6.909 1.00 0.00 H new ATOM 0 HG23 ILE A 72 2.787 8.639 -6.921 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.520 11.103 -5.122 1.00 0.00 H new ATOM 0 HD12 ILE A 72 1.040 9.648 -6.005 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.288 9.758 -4.246 1.00 0.00 H new ATOM 1077 N GLY A 73 4.876 6.814 -4.536 1.00 0.00 N ATOM 1078 CA GLY A 73 6.048 5.958 -4.507 1.00 0.00 C ATOM 1079 C GLY A 73 5.885 4.785 -3.561 1.00 0.00 C ATOM 1080 O GLY A 73 6.511 3.741 -3.742 1.00 0.00 O ATOM 0 H GLY A 73 4.003 6.338 -4.761 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.247 5.586 -5.512 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.916 6.545 -4.207 1.00 0.00 H new ATOM 1084 N ASP A 74 5.043 4.957 -2.547 1.00 0.00 N ATOM 1085 CA ASP A 74 4.801 3.904 -1.568 1.00 0.00 C ATOM 1086 C ASP A 74 4.516 2.574 -2.259 1.00 0.00 C ATOM 1087 O ASP A 74 4.066 2.544 -3.404 1.00 0.00 O ATOM 1088 CB ASP A 74 3.629 4.283 -0.660 1.00 0.00 C ATOM 1089 CG ASP A 74 3.911 5.526 0.161 1.00 0.00 C ATOM 1090 OD1 ASP A 74 5.100 5.817 0.407 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.942 6.207 0.556 1.00 0.00 O ATOM 0 H ASP A 74 4.517 5.815 -2.382 1.00 0.00 H new ATOM 0 HA ASP A 74 5.700 3.792 -0.961 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.740 4.447 -1.269 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.408 3.451 0.009 1.00 0.00 H new ATOM 1096 N GLU A 75 4.782 1.478 -1.555 1.00 0.00 N ATOM 1097 CA GLU A 75 4.556 0.146 -2.103 1.00 0.00 C ATOM 1098 C GLU A 75 3.719 -0.700 -1.148 1.00 0.00 C ATOM 1099 O GLU A 75 4.246 -1.311 -0.217 1.00 0.00 O ATOM 1100 CB GLU A 75 5.890 -0.549 -2.381 1.00 0.00 C ATOM 1101 CG GLU A 75 5.740 -1.958 -2.930 1.00 0.00 C ATOM 1102 CD GLU A 75 7.075 -2.612 -3.228 1.00 0.00 C ATOM 1103 OE1 GLU A 75 8.054 -1.877 -3.475 1.00 0.00 O ATOM 1104 OE2 GLU A 75 7.141 -3.859 -3.216 1.00 0.00 O ATOM 0 H GLU A 75 5.154 1.486 -0.605 1.00 0.00 H new ATOM 0 HA GLU A 75 4.009 0.255 -3.040 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.461 0.050 -3.091 1.00 0.00 H new ATOM 0 HB3 GLU A 75 6.469 -0.587 -1.458 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.193 -2.568 -2.211 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.143 -1.927 -3.841 1.00 0.00 H new ATOM 1111 N LEU A 76 2.412 -0.730 -1.384 1.00 0.00 N ATOM 1112 CA LEU A 76 1.500 -1.501 -0.545 1.00 0.00 C ATOM 1113 C LEU A 76 1.982 -2.940 -0.396 1.00 0.00 C ATOM 1114 O LEU A 76 2.003 -3.703 -1.363 1.00 0.00 O ATOM 1115 CB LEU A 76 0.091 -1.482 -1.139 1.00 0.00 C ATOM 1116 CG LEU A 76 -0.595 -0.117 -1.196 1.00 0.00 C ATOM 1117 CD1 LEU A 76 -1.817 -0.170 -2.100 1.00 0.00 C ATOM 1118 CD2 LEU A 76 -0.984 0.344 0.201 1.00 0.00 C ATOM 0 H LEU A 76 1.960 -0.230 -2.149 1.00 0.00 H new ATOM 0 HA LEU A 76 1.478 -1.041 0.443 1.00 0.00 H new ATOM 0 HB2 LEU A 76 0.140 -1.884 -2.151 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.536 -2.157 -0.557 1.00 0.00 H new ATOM 0 HG LEU A 76 0.109 0.604 -1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.292 0.811 -2.128 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.512 -0.454 -3.107 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.524 -0.904 -1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.471 1.317 0.141 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.670 -0.378 0.645 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.090 0.423 0.820 1.00 0.00 H new ATOM 1130 N LEU A 77 2.368 -3.306 0.821 1.00 0.00 N ATOM 1131 CA LEU A 77 2.848 -4.656 1.098 1.00 0.00 C ATOM 1132 C LEU A 77 1.718 -5.540 1.616 1.00 0.00 C ATOM 1133 O LEU A 77 1.558 -6.679 1.179 1.00 0.00 O ATOM 1134 CB LEU A 77 3.987 -4.614 2.118 1.00 0.00 C ATOM 1135 CG LEU A 77 5.173 -3.717 1.764 1.00 0.00 C ATOM 1136 CD1 LEU A 77 5.933 -3.315 3.018 1.00 0.00 C ATOM 1137 CD2 LEU A 77 6.097 -4.419 0.780 1.00 0.00 C ATOM 0 H LEU A 77 2.358 -2.687 1.632 1.00 0.00 H new ATOM 0 HA LEU A 77 3.219 -5.082 0.166 1.00 0.00 H new ATOM 0 HB2 LEU A 77 3.580 -4.284 3.074 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.356 -5.629 2.263 1.00 0.00 H new ATOM 0 HG LEU A 77 4.791 -2.812 1.291 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.773 -2.677 2.745 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.267 -2.771 3.688 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.304 -4.208 3.521 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.936 -3.766 0.539 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.471 -5.340 1.226 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.547 -4.654 -0.131 1.00 0.00 H new ATOM 1149 N GLU A 78 0.935 -5.006 2.549 1.00 0.00 N ATOM 1150 CA GLU A 78 -0.181 -5.747 3.125 1.00 0.00 C ATOM 1151 C GLU A 78 -1.378 -4.831 3.362 1.00 0.00 C ATOM 1152 O GLU A 78 -1.225 -3.617 3.503 1.00 0.00 O ATOM 1153 CB GLU A 78 0.240 -6.405 4.441 1.00 0.00 C ATOM 1154 CG GLU A 78 1.533 -7.196 4.339 1.00 0.00 C ATOM 1155 CD GLU A 78 1.763 -8.096 5.539 1.00 0.00 C ATOM 1156 OE1 GLU A 78 0.770 -8.612 6.092 1.00 0.00 O ATOM 1157 OE2 GLU A 78 2.936 -8.283 5.923 1.00 0.00 O ATOM 0 H GLU A 78 1.053 -4.064 2.922 1.00 0.00 H new ATOM 0 HA GLU A 78 -0.473 -6.522 2.417 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.355 -5.634 5.203 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.557 -7.069 4.777 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.513 -7.802 3.433 1.00 0.00 H new ATOM 0 HG3 GLU A 78 2.370 -6.505 4.242 1.00 0.00 H new ATOM 1164 N ILE A 79 -2.567 -5.420 3.404 1.00 0.00 N ATOM 1165 CA ILE A 79 -3.790 -4.658 3.624 1.00 0.00 C ATOM 1166 C ILE A 79 -4.864 -5.519 4.279 1.00 0.00 C ATOM 1167 O ILE A 79 -5.024 -6.692 3.944 1.00 0.00 O ATOM 1168 CB ILE A 79 -4.341 -4.085 2.305 1.00 0.00 C ATOM 1169 CG1 ILE A 79 -3.356 -3.077 1.710 1.00 0.00 C ATOM 1170 CG2 ILE A 79 -5.697 -3.435 2.536 1.00 0.00 C ATOM 1171 CD1 ILE A 79 -3.762 -2.568 0.345 1.00 0.00 C ATOM 0 H ILE A 79 -2.710 -6.423 3.289 1.00 0.00 H new ATOM 0 HA ILE A 79 -3.533 -3.834 4.289 1.00 0.00 H new ATOM 0 HB ILE A 79 -4.467 -4.903 1.596 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.260 -2.231 2.390 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.373 -3.542 1.638 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.074 -3.035 1.595 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.396 -4.178 2.920 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.594 -2.626 3.259 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.018 -1.858 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.831 -3.405 -0.350 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.731 -2.074 0.414 1.00 0.00 H new ATOM 1183 N ASN A 80 -5.600 -4.928 5.215 1.00 0.00 N ATOM 1184 CA ASN A 80 -6.661 -5.641 5.917 1.00 0.00 C ATOM 1185 C ASN A 80 -6.255 -7.084 6.195 1.00 0.00 C ATOM 1186 O ASN A 80 -7.063 -8.003 6.067 1.00 0.00 O ATOM 1187 CB ASN A 80 -7.953 -5.612 5.097 1.00 0.00 C ATOM 1188 CG ASN A 80 -9.137 -6.168 5.864 1.00 0.00 C ATOM 1189 OD1 ASN A 80 -9.602 -5.420 6.858 1.00 0.00 O flip ATOM 1190 ND2 ASN A 80 -9.628 -7.257 5.565 1.00 0.00 N flip ATOM 0 H ASN A 80 -5.481 -3.957 5.505 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.832 -5.140 6.870 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.167 -4.586 4.797 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -7.813 -6.188 4.183 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -9.238 -7.798 4.793 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -10.425 -7.618 6.089 1.00 0.00 H new ATOM 1197 N ASN A 81 -4.996 -7.276 6.578 1.00 0.00 N ATOM 1198 CA ASN A 81 -4.482 -8.608 6.875 1.00 0.00 C ATOM 1199 C ASN A 81 -4.399 -9.454 5.608 1.00 0.00 C ATOM 1200 O ASN A 81 -4.744 -10.635 5.615 1.00 0.00 O ATOM 1201 CB ASN A 81 -5.372 -9.302 7.908 1.00 0.00 C ATOM 1202 CG ASN A 81 -5.645 -8.428 9.116 1.00 0.00 C ATOM 1203 OD1 ASN A 81 -4.742 -8.132 9.899 1.00 0.00 O ATOM 1204 ND2 ASN A 81 -6.896 -8.011 9.274 1.00 0.00 N ATOM 0 H ASN A 81 -4.314 -6.526 6.690 1.00 0.00 H new ATOM 0 HA ASN A 81 -3.478 -8.500 7.285 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -6.318 -9.578 7.442 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -4.894 -10.227 8.232 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -7.140 -7.421 10.069 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -7.613 -8.281 8.600 1.00 0.00 H new ATOM 1211 N GLN A 82 -3.939 -8.841 4.522 1.00 0.00 N ATOM 1212 CA GLN A 82 -3.811 -9.538 3.248 1.00 0.00 C ATOM 1213 C GLN A 82 -2.586 -9.050 2.481 1.00 0.00 C ATOM 1214 O GLN A 82 -2.532 -7.899 2.045 1.00 0.00 O ATOM 1215 CB GLN A 82 -5.070 -9.336 2.403 1.00 0.00 C ATOM 1216 CG GLN A 82 -6.245 -10.191 2.849 1.00 0.00 C ATOM 1217 CD GLN A 82 -6.276 -11.542 2.164 1.00 0.00 C ATOM 1218 OE1 GLN A 82 -5.853 -12.549 2.732 1.00 0.00 O ATOM 1219 NE2 GLN A 82 -6.779 -11.572 0.935 1.00 0.00 N ATOM 0 H GLN A 82 -3.649 -7.863 4.499 1.00 0.00 H new ATOM 0 HA GLN A 82 -3.688 -10.601 3.455 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -5.360 -8.286 2.443 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -4.840 -9.564 1.362 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -6.195 -10.336 3.928 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -7.175 -9.661 2.641 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -7.119 -10.713 0.502 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.826 -12.454 0.424 1.00 0.00 H new ATOM 1228 N ILE A 83 -1.605 -9.931 2.321 1.00 0.00 N ATOM 1229 CA ILE A 83 -0.381 -9.589 1.606 1.00 0.00 C ATOM 1230 C ILE A 83 -0.642 -9.438 0.111 1.00 0.00 C ATOM 1231 O ILE A 83 -1.190 -10.337 -0.529 1.00 0.00 O ATOM 1232 CB ILE A 83 0.712 -10.653 1.820 1.00 0.00 C ATOM 1233 CG1 ILE A 83 1.046 -10.780 3.308 1.00 0.00 C ATOM 1234 CG2 ILE A 83 1.957 -10.302 1.020 1.00 0.00 C ATOM 1235 CD1 ILE A 83 2.174 -11.747 3.593 1.00 0.00 C ATOM 0 H ILE A 83 -1.633 -10.887 2.676 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.035 -8.638 2.010 1.00 0.00 H new ATOM 0 HB ILE A 83 0.337 -11.614 1.468 1.00 0.00 H new ATOM 0 HG12 ILE A 83 1.313 -9.798 3.697 1.00 0.00 H new ATOM 0 HG13 ILE A 83 0.155 -11.105 3.846 1.00 0.00 H new ATOM 0 HG21 ILE A 83 2.720 -11.063 1.182 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.708 -10.258 -0.040 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.337 -9.333 1.344 1.00 0.00 H new ATOM 0 HD11 ILE A 83 2.357 -11.787 4.667 1.00 0.00 H new ATOM 0 HD12 ILE A 83 1.902 -12.740 3.234 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.078 -11.412 3.084 1.00 0.00 H new ATOM 1247 N LEU A 84 -0.244 -8.297 -0.441 1.00 0.00 N ATOM 1248 CA LEU A 84 -0.432 -8.028 -1.862 1.00 0.00 C ATOM 1249 C LEU A 84 0.823 -8.380 -2.654 1.00 0.00 C ATOM 1250 O LEU A 84 0.756 -8.659 -3.852 1.00 0.00 O ATOM 1251 CB LEU A 84 -0.790 -6.557 -2.080 1.00 0.00 C ATOM 1252 CG LEU A 84 -1.774 -5.950 -1.078 1.00 0.00 C ATOM 1253 CD1 LEU A 84 -1.805 -4.436 -1.212 1.00 0.00 C ATOM 1254 CD2 LEU A 84 -3.165 -6.534 -1.277 1.00 0.00 C ATOM 0 H LEU A 84 0.211 -7.543 0.074 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.251 -8.652 -2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 84 0.130 -5.972 -2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.209 -6.450 -3.081 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.438 -6.198 -0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.510 -4.021 -0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.811 -4.033 -1.019 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.116 -4.166 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.852 -6.091 -0.556 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.510 -6.316 -2.288 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.131 -7.613 -1.130 1.00 0.00 H new ATOM 1266 N TYR A 85 1.966 -8.368 -1.977 1.00 0.00 N ATOM 1267 CA TYR A 85 3.237 -8.686 -2.618 1.00 0.00 C ATOM 1268 C TYR A 85 3.111 -9.932 -3.489 1.00 0.00 C ATOM 1269 O TYR A 85 3.052 -11.053 -2.985 1.00 0.00 O ATOM 1270 CB TYR A 85 4.325 -8.896 -1.563 1.00 0.00 C ATOM 1271 CG TYR A 85 5.702 -9.114 -2.149 1.00 0.00 C ATOM 1272 CD1 TYR A 85 6.036 -10.318 -2.756 1.00 0.00 C ATOM 1273 CD2 TYR A 85 6.668 -8.117 -2.094 1.00 0.00 C ATOM 1274 CE1 TYR A 85 7.293 -10.522 -3.292 1.00 0.00 C ATOM 1275 CE2 TYR A 85 7.927 -8.312 -2.628 1.00 0.00 C ATOM 1276 CZ TYR A 85 8.235 -9.516 -3.226 1.00 0.00 C ATOM 1277 OH TYR A 85 9.488 -9.715 -3.758 1.00 0.00 O ATOM 0 H TYR A 85 2.039 -8.142 -0.985 1.00 0.00 H new ATOM 0 HA TYR A 85 3.514 -7.846 -3.255 1.00 0.00 H new ATOM 0 HB2 TYR A 85 4.353 -8.028 -0.904 1.00 0.00 H new ATOM 0 HB3 TYR A 85 4.061 -9.756 -0.947 1.00 0.00 H new ATOM 0 HD1 TYR A 85 5.301 -11.108 -2.810 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.431 -7.173 -1.626 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.537 -11.464 -3.760 1.00 0.00 H new ATOM 0 HE2 TYR A 85 8.666 -7.526 -2.577 1.00 0.00 H new ATOM 0 HH TYR A 85 10.030 -8.909 -3.629 1.00 0.00 H new ATOM 1287 N GLY A 86 3.071 -9.726 -4.802 1.00 0.00 N ATOM 1288 CA GLY A 86 2.953 -10.841 -5.724 1.00 0.00 C ATOM 1289 C GLY A 86 1.691 -10.770 -6.561 1.00 0.00 C ATOM 1290 O GLY A 86 1.704 -11.105 -7.745 1.00 0.00 O ATOM 0 H GLY A 86 3.118 -8.808 -5.243 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.822 -10.858 -6.382 1.00 0.00 H new ATOM 0 HA3 GLY A 86 2.961 -11.775 -5.162 1.00 0.00 H new ATOM 1294 N ARG A 87 0.598 -10.335 -5.943 1.00 0.00 N ATOM 1295 CA ARG A 87 -0.679 -10.225 -6.638 1.00 0.00 C ATOM 1296 C ARG A 87 -0.712 -8.981 -7.521 1.00 0.00 C ATOM 1297 O ARG A 87 0.228 -8.187 -7.527 1.00 0.00 O ATOM 1298 CB ARG A 87 -1.830 -10.179 -5.631 1.00 0.00 C ATOM 1299 CG ARG A 87 -1.979 -11.455 -4.818 1.00 0.00 C ATOM 1300 CD ARG A 87 -2.600 -11.179 -3.457 1.00 0.00 C ATOM 1301 NE ARG A 87 -2.453 -12.313 -2.549 1.00 0.00 N ATOM 1302 CZ ARG A 87 -3.190 -13.416 -2.625 1.00 0.00 C ATOM 1303 NH1 ARG A 87 -4.120 -13.532 -3.563 1.00 0.00 N ATOM 1304 NH2 ARG A 87 -2.997 -14.405 -1.762 1.00 0.00 N ATOM 0 H ARG A 87 0.571 -10.053 -4.963 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.795 -11.104 -7.273 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -1.674 -9.341 -4.951 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -2.761 -9.987 -6.165 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.599 -12.166 -5.365 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -1.002 -11.920 -4.686 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -2.132 -10.299 -3.017 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -3.658 -10.949 -3.581 1.00 0.00 H new ATOM 0 HE ARG A 87 -1.746 -12.255 -1.816 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -4.271 -12.774 -4.228 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -4.685 -14.380 -3.619 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -2.282 -14.319 -1.039 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -3.563 -15.251 -1.821 1.00 0.00 H new ATOM 1318 N SER A 88 -1.801 -8.818 -8.265 1.00 0.00 N ATOM 1319 CA SER A 88 -1.955 -7.674 -9.156 1.00 0.00 C ATOM 1320 C SER A 88 -2.651 -6.519 -8.441 1.00 0.00 C ATOM 1321 O SER A 88 -3.508 -6.731 -7.582 1.00 0.00 O ATOM 1322 CB SER A 88 -2.751 -8.072 -10.400 1.00 0.00 C ATOM 1323 OG SER A 88 -2.146 -9.168 -11.064 1.00 0.00 O ATOM 0 H SER A 88 -2.590 -9.464 -8.268 1.00 0.00 H new ATOM 0 HA SER A 88 -0.961 -7.345 -9.460 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.770 -8.333 -10.115 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.818 -7.223 -11.080 1.00 0.00 H new ATOM 0 HG SER A 88 -2.675 -9.404 -11.855 1.00 0.00 H new ATOM 1329 N HIS A 89 -2.275 -5.296 -8.801 1.00 0.00 N ATOM 1330 CA HIS A 89 -2.863 -4.106 -8.195 1.00 0.00 C ATOM 1331 C HIS A 89 -4.386 -4.181 -8.219 1.00 0.00 C ATOM 1332 O HIS A 89 -5.051 -3.773 -7.267 1.00 0.00 O ATOM 1333 CB HIS A 89 -2.390 -2.850 -8.926 1.00 0.00 C ATOM 1334 CG HIS A 89 -2.746 -2.833 -10.381 1.00 0.00 C ATOM 1335 ND1 HIS A 89 -3.921 -2.295 -10.862 1.00 0.00 N ATOM 1336 CD2 HIS A 89 -2.074 -3.292 -11.462 1.00 0.00 C ATOM 1337 CE1 HIS A 89 -3.957 -2.425 -12.177 1.00 0.00 C ATOM 1338 NE2 HIS A 89 -2.847 -3.027 -12.566 1.00 0.00 N ATOM 0 H HIS A 89 -1.566 -5.103 -9.509 1.00 0.00 H new ATOM 0 HA HIS A 89 -2.536 -4.057 -7.156 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -2.824 -1.974 -8.444 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -1.308 -2.766 -8.824 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -1.109 -3.777 -11.458 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -4.757 -2.095 -12.823 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -2.604 -3.257 -13.529 1.00 0.00 H new ATOM 1347 N GLN A 90 -4.932 -4.703 -9.313 1.00 0.00 N ATOM 1348 CA GLN A 90 -6.377 -4.829 -9.460 1.00 0.00 C ATOM 1349 C GLN A 90 -6.989 -5.523 -8.247 1.00 0.00 C ATOM 1350 O GLN A 90 -8.040 -5.117 -7.753 1.00 0.00 O ATOM 1351 CB GLN A 90 -6.715 -5.607 -10.733 1.00 0.00 C ATOM 1352 CG GLN A 90 -6.731 -4.746 -11.985 1.00 0.00 C ATOM 1353 CD GLN A 90 -7.796 -3.668 -11.939 1.00 0.00 C ATOM 1354 OE1 GLN A 90 -7.576 -2.585 -11.395 1.00 0.00 O ATOM 1355 NE2 GLN A 90 -8.958 -3.958 -12.512 1.00 0.00 N ATOM 0 H GLN A 90 -4.395 -5.045 -10.110 1.00 0.00 H new ATOM 0 HA GLN A 90 -6.799 -3.827 -9.533 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.988 -6.409 -10.863 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -7.691 -6.078 -10.613 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -5.754 -4.281 -12.114 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -6.899 -5.380 -12.855 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -9.097 -4.868 -12.951 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -9.712 -3.271 -12.513 1.00 0.00 H new ATOM 1364 N ASN A 91 -6.325 -6.572 -7.775 1.00 0.00 N ATOM 1365 CA ASN A 91 -6.805 -7.324 -6.620 1.00 0.00 C ATOM 1366 C ASN A 91 -6.786 -6.460 -5.363 1.00 0.00 C ATOM 1367 O ASN A 91 -7.754 -6.430 -4.604 1.00 0.00 O ATOM 1368 CB ASN A 91 -5.948 -8.573 -6.407 1.00 0.00 C ATOM 1369 CG ASN A 91 -6.387 -9.732 -7.282 1.00 0.00 C ATOM 1370 OD1 ASN A 91 -6.380 -9.634 -8.510 1.00 0.00 O ATOM 1371 ND2 ASN A 91 -6.772 -10.836 -6.653 1.00 0.00 N ATOM 0 H ASN A 91 -5.453 -6.921 -8.173 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.834 -7.627 -6.816 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -4.906 -8.336 -6.619 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.000 -8.872 -5.360 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.078 -11.648 -7.189 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.761 -10.872 -5.634 1.00 0.00 H new ATOM 1378 N ALA A 92 -5.677 -5.759 -5.150 1.00 0.00 N ATOM 1379 CA ALA A 92 -5.533 -4.893 -3.986 1.00 0.00 C ATOM 1380 C ALA A 92 -6.838 -4.167 -3.677 1.00 0.00 C ATOM 1381 O ALA A 92 -7.442 -4.378 -2.625 1.00 0.00 O ATOM 1382 CB ALA A 92 -4.410 -3.890 -4.211 1.00 0.00 C ATOM 0 H ALA A 92 -4.866 -5.774 -5.768 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.283 -5.517 -3.128 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -4.313 -3.250 -3.334 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -3.474 -4.423 -4.376 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -4.638 -3.278 -5.084 1.00 0.00 H new ATOM 1388 N SER A 93 -7.267 -3.312 -4.599 1.00 0.00 N ATOM 1389 CA SER A 93 -8.499 -2.551 -4.422 1.00 0.00 C ATOM 1390 C SER A 93 -9.649 -3.468 -4.017 1.00 0.00 C ATOM 1391 O SER A 93 -10.493 -3.099 -3.201 1.00 0.00 O ATOM 1392 CB SER A 93 -8.854 -1.808 -5.711 1.00 0.00 C ATOM 1393 OG SER A 93 -9.259 -2.711 -6.726 1.00 0.00 O ATOM 0 H SER A 93 -6.780 -3.128 -5.476 1.00 0.00 H new ATOM 0 HA SER A 93 -8.338 -1.825 -3.625 1.00 0.00 H new ATOM 0 HB2 SER A 93 -9.654 -1.094 -5.514 1.00 0.00 H new ATOM 0 HB3 SER A 93 -7.992 -1.235 -6.053 1.00 0.00 H new ATOM 0 HG SER A 93 -8.602 -3.434 -6.801 1.00 0.00 H new ATOM 1399 N ALA A 94 -9.675 -4.665 -4.593 1.00 0.00 N ATOM 1400 CA ALA A 94 -10.720 -5.636 -4.292 1.00 0.00 C ATOM 1401 C ALA A 94 -10.740 -5.976 -2.805 1.00 0.00 C ATOM 1402 O ALA A 94 -11.805 -6.052 -2.191 1.00 0.00 O ATOM 1403 CB ALA A 94 -10.525 -6.896 -5.121 1.00 0.00 C ATOM 0 H ALA A 94 -8.984 -4.986 -5.271 1.00 0.00 H new ATOM 0 HA ALA A 94 -11.681 -5.191 -4.550 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -11.313 -7.612 -4.886 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -10.568 -6.645 -6.181 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -9.554 -7.336 -4.892 1.00 0.00 H new ATOM 1409 N ILE A 95 -9.558 -6.181 -2.234 1.00 0.00 N ATOM 1410 CA ILE A 95 -9.441 -6.513 -0.820 1.00 0.00 C ATOM 1411 C ILE A 95 -9.955 -5.375 0.057 1.00 0.00 C ATOM 1412 O ILE A 95 -10.638 -5.607 1.055 1.00 0.00 O ATOM 1413 CB ILE A 95 -7.984 -6.826 -0.433 1.00 0.00 C ATOM 1414 CG1 ILE A 95 -7.450 -7.991 -1.270 1.00 0.00 C ATOM 1415 CG2 ILE A 95 -7.885 -7.144 1.051 1.00 0.00 C ATOM 1416 CD1 ILE A 95 -5.945 -8.135 -1.214 1.00 0.00 C ATOM 0 H ILE A 95 -8.668 -6.123 -2.729 1.00 0.00 H new ATOM 0 HA ILE A 95 -10.051 -7.401 -0.654 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.373 -5.946 -0.637 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -7.909 -8.917 -0.923 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -7.755 -7.853 -2.307 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.849 -7.363 1.308 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.229 -6.287 1.630 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.506 -8.010 1.280 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.637 -8.980 -1.830 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -5.478 -7.224 -1.588 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.634 -8.305 -0.183 1.00 0.00 H new ATOM 1428 N ILE A 96 -9.622 -4.147 -0.324 1.00 0.00 N ATOM 1429 CA ILE A 96 -10.052 -2.973 0.425 1.00 0.00 C ATOM 1430 C ILE A 96 -11.568 -2.814 0.376 1.00 0.00 C ATOM 1431 O ILE A 96 -12.213 -2.579 1.398 1.00 0.00 O ATOM 1432 CB ILE A 96 -9.395 -1.689 -0.114 1.00 0.00 C ATOM 1433 CG1 ILE A 96 -7.897 -1.687 0.196 1.00 0.00 C ATOM 1434 CG2 ILE A 96 -10.066 -0.460 0.481 1.00 0.00 C ATOM 1435 CD1 ILE A 96 -7.113 -0.679 -0.614 1.00 0.00 C ATOM 0 H ILE A 96 -9.056 -3.939 -1.147 1.00 0.00 H new ATOM 0 HA ILE A 96 -9.738 -3.126 1.458 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.523 -1.661 -1.196 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.754 -1.479 1.256 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.494 -2.683 0.010 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.590 0.439 0.090 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.123 -0.457 0.214 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.967 -0.481 1.566 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.059 -0.734 -0.341 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.225 -0.899 -1.676 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -7.489 0.324 -0.410 1.00 0.00 H new ATOM 1447 N LYS A 97 -12.133 -2.945 -0.820 1.00 0.00 N ATOM 1448 CA LYS A 97 -13.574 -2.820 -1.004 1.00 0.00 C ATOM 1449 C LYS A 97 -14.326 -3.742 -0.050 1.00 0.00 C ATOM 1450 O LYS A 97 -15.328 -3.349 0.550 1.00 0.00 O ATOM 1451 CB LYS A 97 -13.954 -3.145 -2.450 1.00 0.00 C ATOM 1452 CG LYS A 97 -15.184 -2.399 -2.938 1.00 0.00 C ATOM 1453 CD LYS A 97 -15.345 -2.514 -4.444 1.00 0.00 C ATOM 1454 CE LYS A 97 -14.351 -1.630 -5.180 1.00 0.00 C ATOM 1455 NZ LYS A 97 -14.862 -1.211 -6.514 1.00 0.00 N ATOM 0 H LYS A 97 -11.614 -3.138 -1.677 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.856 -1.790 -0.783 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.113 -2.906 -3.100 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -14.131 -4.217 -2.538 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -16.071 -2.797 -2.445 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.108 -1.348 -2.659 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -15.205 -3.551 -4.748 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -16.360 -2.234 -4.725 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -14.137 -0.746 -4.579 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -13.410 -2.167 -5.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -14.155 -0.610 -6.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -15.042 -2.053 -7.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -15.746 -0.677 -6.395 1.00 0.00 H new ATOM 1469 N THR A 98 -13.838 -4.971 0.087 1.00 0.00 N ATOM 1470 CA THR A 98 -14.464 -5.949 0.968 1.00 0.00 C ATOM 1471 C THR A 98 -14.140 -5.658 2.430 1.00 0.00 C ATOM 1472 O THR A 98 -14.906 -6.009 3.326 1.00 0.00 O ATOM 1473 CB THR A 98 -14.012 -7.381 0.629 1.00 0.00 C ATOM 1474 OG1 THR A 98 -12.596 -7.503 0.805 1.00 0.00 O ATOM 1475 CG2 THR A 98 -14.383 -7.741 -0.802 1.00 0.00 C ATOM 0 H THR A 98 -13.010 -5.313 -0.401 1.00 0.00 H new ATOM 0 HA THR A 98 -15.540 -5.870 0.814 1.00 0.00 H new ATOM 0 HB THR A 98 -14.522 -8.068 1.304 1.00 0.00 H new ATOM 0 HG1 THR A 98 -12.197 -6.611 0.872 1.00 0.00 H new ATOM 0 HG21 THR A 98 -14.054 -8.757 -1.019 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.464 -7.676 -0.925 1.00 0.00 H new ATOM 0 HG23 THR A 98 -13.897 -7.048 -1.489 1.00 0.00 H new ATOM 1483 N ALA A 99 -13.001 -5.015 2.662 1.00 0.00 N ATOM 1484 CA ALA A 99 -12.578 -4.675 4.015 1.00 0.00 C ATOM 1485 C ALA A 99 -13.521 -3.657 4.646 1.00 0.00 C ATOM 1486 O ALA A 99 -14.205 -2.899 3.958 1.00 0.00 O ATOM 1487 CB ALA A 99 -11.153 -4.142 4.004 1.00 0.00 C ATOM 0 H ALA A 99 -12.354 -4.719 1.931 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.610 -5.583 4.618 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -10.850 -3.892 5.021 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.483 -4.902 3.602 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -11.103 -3.249 3.381 1.00 0.00 H new ATOM 1493 N PRO A 100 -13.561 -3.637 5.986 1.00 0.00 N ATOM 1494 CA PRO A 100 -14.418 -2.716 6.739 1.00 0.00 C ATOM 1495 C PRO A 100 -13.946 -1.270 6.635 1.00 0.00 C ATOM 1496 O PRO A 100 -12.911 -0.987 6.032 1.00 0.00 O ATOM 1497 CB PRO A 100 -14.295 -3.216 8.181 1.00 0.00 C ATOM 1498 CG PRO A 100 -12.976 -3.906 8.231 1.00 0.00 C ATOM 1499 CD PRO A 100 -12.773 -4.513 6.870 1.00 0.00 C ATOM 0 HA PRO A 100 -15.440 -2.709 6.361 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -14.337 -2.390 8.891 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -15.108 -3.897 8.435 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -12.177 -3.203 8.468 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -12.966 -4.673 9.006 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.720 -4.526 6.589 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.126 -5.544 6.833 1.00 0.00 H new ATOM 1507 N SER A 101 -14.712 -0.358 7.226 1.00 0.00 N ATOM 1508 CA SER A 101 -14.374 1.060 7.196 1.00 0.00 C ATOM 1509 C SER A 101 -12.906 1.276 7.553 1.00 0.00 C ATOM 1510 O SER A 101 -12.139 1.832 6.766 1.00 0.00 O ATOM 1511 CB SER A 101 -15.266 1.839 8.164 1.00 0.00 C ATOM 1512 OG SER A 101 -16.612 1.849 7.722 1.00 0.00 O ATOM 0 H SER A 101 -15.571 -0.576 7.731 1.00 0.00 H new ATOM 0 HA SER A 101 -14.542 1.427 6.183 1.00 0.00 H new ATOM 0 HB2 SER A 101 -15.209 1.391 9.156 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.902 2.862 8.255 1.00 0.00 H new ATOM 0 HG SER A 101 -17.162 2.352 8.359 1.00 0.00 H new ATOM 1518 N LYS A 102 -12.523 0.833 8.745 1.00 0.00 N ATOM 1519 CA LYS A 102 -11.147 0.975 9.208 1.00 0.00 C ATOM 1520 C LYS A 102 -10.263 -0.128 8.635 1.00 0.00 C ATOM 1521 O LYS A 102 -10.472 -1.310 8.909 1.00 0.00 O ATOM 1522 CB LYS A 102 -11.097 0.941 10.737 1.00 0.00 C ATOM 1523 CG LYS A 102 -9.793 1.464 11.314 1.00 0.00 C ATOM 1524 CD LYS A 102 -9.991 2.042 12.706 1.00 0.00 C ATOM 1525 CE LYS A 102 -10.356 3.517 12.651 1.00 0.00 C ATOM 1526 NZ LYS A 102 -10.654 4.066 14.003 1.00 0.00 N ATOM 0 H LYS A 102 -13.146 0.372 9.409 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.769 1.936 8.859 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -11.923 1.532 11.133 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -11.249 -0.084 11.075 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -9.062 0.656 11.355 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.384 2.230 10.656 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -10.777 1.491 13.221 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -9.078 1.914 13.288 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.535 4.078 12.204 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -11.223 3.653 12.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -10.898 5.074 13.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -11.454 3.548 14.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -9.818 3.960 14.613 1.00 0.00 H new ATOM 1540 N VAL A 103 -9.274 0.266 7.839 1.00 0.00 N ATOM 1541 CA VAL A 103 -8.356 -0.689 7.230 1.00 0.00 C ATOM 1542 C VAL A 103 -6.906 -0.322 7.523 1.00 0.00 C ATOM 1543 O VAL A 103 -6.565 0.855 7.647 1.00 0.00 O ATOM 1544 CB VAL A 103 -8.557 -0.765 5.705 1.00 0.00 C ATOM 1545 CG1 VAL A 103 -7.732 -1.898 5.113 1.00 0.00 C ATOM 1546 CG2 VAL A 103 -10.031 -0.937 5.369 1.00 0.00 C ATOM 0 H VAL A 103 -9.088 1.240 7.601 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.576 -1.663 7.667 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.214 0.171 5.265 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.887 -1.936 4.035 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.676 -1.727 5.322 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.041 -2.844 5.558 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -10.154 -0.989 4.287 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.402 -1.857 5.821 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.594 -0.089 5.758 1.00 0.00 H new ATOM 1556 N LYS A 104 -6.055 -1.336 7.633 1.00 0.00 N ATOM 1557 CA LYS A 104 -4.640 -1.122 7.910 1.00 0.00 C ATOM 1558 C LYS A 104 -3.810 -1.259 6.638 1.00 0.00 C ATOM 1559 O LYS A 104 -3.843 -2.294 5.972 1.00 0.00 O ATOM 1560 CB LYS A 104 -4.149 -2.118 8.963 1.00 0.00 C ATOM 1561 CG LYS A 104 -2.704 -1.901 9.377 1.00 0.00 C ATOM 1562 CD LYS A 104 -2.253 -2.939 10.391 1.00 0.00 C ATOM 1563 CE LYS A 104 -0.741 -3.104 10.386 1.00 0.00 C ATOM 1564 NZ LYS A 104 -0.295 -4.162 11.334 1.00 0.00 N ATOM 0 H LYS A 104 -6.321 -2.316 7.534 1.00 0.00 H new ATOM 0 HA LYS A 104 -4.519 -0.109 8.294 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.786 -2.045 9.845 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -4.259 -3.130 8.573 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.062 -1.947 8.498 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -2.592 -0.903 9.802 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -2.584 -2.644 11.387 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -2.725 -3.896 10.168 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.406 -3.354 9.379 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -0.272 -2.157 10.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.737 -4.108 11.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -0.759 -4.022 12.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -0.551 -5.097 10.956 1.00 0.00 H new ATOM 1578 N LEU A 105 -3.065 -0.210 6.307 1.00 0.00 N ATOM 1579 CA LEU A 105 -2.224 -0.214 5.115 1.00 0.00 C ATOM 1580 C LEU A 105 -0.746 -0.213 5.491 1.00 0.00 C ATOM 1581 O LEU A 105 -0.266 0.699 6.164 1.00 0.00 O ATOM 1582 CB LEU A 105 -2.540 1.000 4.240 1.00 0.00 C ATOM 1583 CG LEU A 105 -3.993 1.140 3.786 1.00 0.00 C ATOM 1584 CD1 LEU A 105 -4.318 2.594 3.478 1.00 0.00 C ATOM 1585 CD2 LEU A 105 -4.259 0.263 2.571 1.00 0.00 C ATOM 0 H LEU A 105 -3.026 0.654 6.847 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.436 -1.124 4.554 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.264 1.900 4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.906 0.959 3.354 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.641 0.808 4.597 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -5.356 2.674 3.156 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -4.167 3.198 4.373 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.663 2.953 2.684 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -5.298 0.375 2.262 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -3.603 0.564 1.754 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.067 -0.779 2.826 1.00 0.00 H new ATOM 1597 N VAL A 106 -0.028 -1.241 5.051 1.00 0.00 N ATOM 1598 CA VAL A 106 1.397 -1.358 5.338 1.00 0.00 C ATOM 1599 C VAL A 106 2.230 -1.172 4.075 1.00 0.00 C ATOM 1600 O VAL A 106 2.374 -2.095 3.273 1.00 0.00 O ATOM 1601 CB VAL A 106 1.733 -2.724 5.966 1.00 0.00 C ATOM 1602 CG1 VAL A 106 3.234 -2.862 6.172 1.00 0.00 C ATOM 1603 CG2 VAL A 106 0.987 -2.905 7.279 1.00 0.00 C ATOM 0 H VAL A 106 -0.410 -2.005 4.494 1.00 0.00 H new ATOM 0 HA VAL A 106 1.642 -0.569 6.050 1.00 0.00 H new ATOM 0 HB VAL A 106 1.411 -3.508 5.281 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.453 -3.833 6.616 1.00 0.00 H new ATOM 0 HG12 VAL A 106 3.742 -2.780 5.211 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.584 -2.072 6.836 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.236 -3.875 7.708 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.276 -2.116 7.973 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.087 -2.854 7.098 1.00 0.00 H new ATOM 1613 N PHE A 107 2.776 0.027 3.904 1.00 0.00 N ATOM 1614 CA PHE A 107 3.594 0.335 2.737 1.00 0.00 C ATOM 1615 C PHE A 107 4.974 0.832 3.156 1.00 0.00 C ATOM 1616 O PHE A 107 5.256 0.985 4.346 1.00 0.00 O ATOM 1617 CB PHE A 107 2.904 1.386 1.866 1.00 0.00 C ATOM 1618 CG PHE A 107 2.856 2.749 2.496 1.00 0.00 C ATOM 1619 CD1 PHE A 107 3.958 3.587 2.450 1.00 0.00 C ATOM 1620 CD2 PHE A 107 1.708 3.191 3.133 1.00 0.00 C ATOM 1621 CE1 PHE A 107 3.916 4.841 3.029 1.00 0.00 C ATOM 1622 CE2 PHE A 107 1.660 4.445 3.714 1.00 0.00 C ATOM 1623 CZ PHE A 107 2.766 5.271 3.661 1.00 0.00 C ATOM 0 H PHE A 107 2.667 0.801 4.559 1.00 0.00 H new ATOM 0 HA PHE A 107 3.717 -0.581 2.159 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.425 1.454 0.911 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.887 1.058 1.651 1.00 0.00 H new ATOM 0 HD1 PHE A 107 4.860 3.257 1.956 1.00 0.00 H new ATOM 0 HD2 PHE A 107 0.841 2.549 3.176 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.782 5.485 2.987 1.00 0.00 H new ATOM 0 HE2 PHE A 107 0.759 4.778 4.208 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.731 6.251 4.113 1.00 0.00 H new ATOM 1633 N ILE A 108 5.831 1.083 2.172 1.00 0.00 N ATOM 1634 CA ILE A 108 7.181 1.564 2.439 1.00 0.00 C ATOM 1635 C ILE A 108 7.432 2.904 1.755 1.00 0.00 C ATOM 1636 O ILE A 108 7.250 3.039 0.545 1.00 0.00 O ATOM 1637 CB ILE A 108 8.242 0.552 1.966 1.00 0.00 C ATOM 1638 CG1 ILE A 108 9.647 1.072 2.278 1.00 0.00 C ATOM 1639 CG2 ILE A 108 8.090 0.281 0.477 1.00 0.00 C ATOM 1640 CD1 ILE A 108 10.662 -0.028 2.503 1.00 0.00 C ATOM 0 H ILE A 108 5.614 0.961 1.183 1.00 0.00 H new ATOM 0 HA ILE A 108 7.265 1.689 3.519 1.00 0.00 H new ATOM 0 HB ILE A 108 8.094 -0.385 2.502 1.00 0.00 H new ATOM 0 HG12 ILE A 108 9.983 1.703 1.455 1.00 0.00 H new ATOM 0 HG13 ILE A 108 9.604 1.703 3.166 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.847 -0.436 0.159 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.098 -0.127 0.281 1.00 0.00 H new ATOM 0 HG23 ILE A 108 8.216 1.211 -0.077 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.635 0.413 2.719 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.349 -0.646 3.345 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.734 -0.645 1.607 1.00 0.00 H new ATOM 1652 N ARG A 109 7.854 3.891 2.538 1.00 0.00 N ATOM 1653 CA ARG A 109 8.131 5.221 2.009 1.00 0.00 C ATOM 1654 C ARG A 109 9.502 5.265 1.340 1.00 0.00 C ATOM 1655 O ARG A 109 10.501 5.607 1.972 1.00 0.00 O ATOM 1656 CB ARG A 109 8.064 6.263 3.127 1.00 0.00 C ATOM 1657 CG ARG A 109 8.074 7.697 2.625 1.00 0.00 C ATOM 1658 CD ARG A 109 7.656 8.672 3.714 1.00 0.00 C ATOM 1659 NE ARG A 109 7.123 9.914 3.161 1.00 0.00 N ATOM 1660 CZ ARG A 109 7.882 10.941 2.795 1.00 0.00 C ATOM 1661 NH1 ARG A 109 9.200 10.873 2.922 1.00 0.00 N ATOM 1662 NH2 ARG A 109 7.323 12.038 2.300 1.00 0.00 N ATOM 0 H ARG A 109 8.012 3.795 3.541 1.00 0.00 H new ATOM 0 HA ARG A 109 7.373 5.452 1.261 1.00 0.00 H new ATOM 0 HB2 ARG A 109 7.159 6.098 3.712 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.909 6.117 3.800 1.00 0.00 H new ATOM 0 HG2 ARG A 109 9.073 7.952 2.270 1.00 0.00 H new ATOM 0 HG3 ARG A 109 7.400 7.790 1.774 1.00 0.00 H new ATOM 0 HD2 ARG A 109 6.903 8.205 4.349 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.513 8.896 4.349 1.00 0.00 H new ATOM 0 HE ARG A 109 6.113 9.998 3.050 1.00 0.00 H new ATOM 0 HH11 ARG A 109 9.633 10.031 3.301 1.00 0.00 H new ATOM 0 HH12 ARG A 109 9.781 11.663 2.640 1.00 0.00 H new ATOM 0 HH21 ARG A 109 6.309 12.093 2.200 1.00 0.00 H new ATOM 0 HH22 ARG A 109 7.907 12.826 2.019 1.00 0.00 H new ATOM 1676 N ASN A 110 9.542 4.914 0.059 1.00 0.00 N ATOM 1677 CA ASN A 110 10.790 4.913 -0.695 1.00 0.00 C ATOM 1678 C ASN A 110 10.744 5.935 -1.826 1.00 0.00 C ATOM 1679 O ASN A 110 9.958 5.803 -2.763 1.00 0.00 O ATOM 1680 CB ASN A 110 11.065 3.519 -1.264 1.00 0.00 C ATOM 1681 CG ASN A 110 12.393 3.443 -1.992 1.00 0.00 C ATOM 1682 OD1 ASN A 110 13.155 4.409 -2.018 1.00 0.00 O ATOM 1683 ND2 ASN A 110 12.676 2.290 -2.588 1.00 0.00 N ATOM 0 H ASN A 110 8.724 4.627 -0.479 1.00 0.00 H new ATOM 0 HA ASN A 110 11.596 5.187 -0.014 1.00 0.00 H new ATOM 0 HB2 ASN A 110 11.056 2.790 -0.453 1.00 0.00 H new ATOM 0 HB3 ASN A 110 10.262 3.244 -1.948 1.00 0.00 H new ATOM 0 HD21 ASN A 110 13.555 2.179 -3.093 1.00 0.00 H new ATOM 0 HD22 ASN A 110 12.014 1.515 -2.540 1.00 0.00 H new ATOM 1690 N GLU A 111 11.592 6.954 -1.731 1.00 0.00 N ATOM 1691 CA GLU A 111 11.648 7.999 -2.746 1.00 0.00 C ATOM 1692 C GLU A 111 12.121 7.435 -4.082 1.00 0.00 C ATOM 1693 O GLU A 111 11.788 7.962 -5.144 1.00 0.00 O ATOM 1694 CB GLU A 111 12.579 9.128 -2.298 1.00 0.00 C ATOM 1695 CG GLU A 111 14.049 8.743 -2.306 1.00 0.00 C ATOM 1696 CD GLU A 111 14.699 8.950 -3.660 1.00 0.00 C ATOM 1697 OE1 GLU A 111 14.247 9.844 -4.406 1.00 0.00 O ATOM 1698 OE2 GLU A 111 15.660 8.217 -3.975 1.00 0.00 O ATOM 0 H GLU A 111 12.250 7.078 -0.961 1.00 0.00 H new ATOM 0 HA GLU A 111 10.642 8.398 -2.875 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.434 9.988 -2.951 1.00 0.00 H new ATOM 0 HB3 GLU A 111 12.299 9.441 -1.292 1.00 0.00 H new ATOM 0 HG2 GLU A 111 14.579 9.333 -1.559 1.00 0.00 H new ATOM 0 HG3 GLU A 111 14.148 7.697 -2.016 1.00 0.00 H new ATOM 1705 N ASP A 112 12.899 6.360 -4.022 1.00 0.00 N ATOM 1706 CA ASP A 112 13.418 5.723 -5.226 1.00 0.00 C ATOM 1707 C ASP A 112 12.306 5.004 -5.983 1.00 0.00 C ATOM 1708 O ASP A 112 12.363 4.864 -7.204 1.00 0.00 O ATOM 1709 CB ASP A 112 14.530 4.736 -4.868 1.00 0.00 C ATOM 1710 CG ASP A 112 15.871 5.417 -4.677 1.00 0.00 C ATOM 1711 OD1 ASP A 112 16.380 6.006 -5.653 1.00 0.00 O ATOM 1712 OD2 ASP A 112 16.411 5.361 -3.553 1.00 0.00 O ATOM 0 H ASP A 112 13.184 5.911 -3.152 1.00 0.00 H new ATOM 0 HA ASP A 112 13.827 6.501 -5.871 1.00 0.00 H new ATOM 0 HB2 ASP A 112 14.261 4.207 -3.954 1.00 0.00 H new ATOM 0 HB3 ASP A 112 14.615 3.988 -5.656 1.00 0.00 H new ATOM 1717 N ALA A 113 11.296 4.549 -5.249 1.00 0.00 N ATOM 1718 CA ALA A 113 10.171 3.845 -5.850 1.00 0.00 C ATOM 1719 C ALA A 113 9.571 4.649 -7.000 1.00 0.00 C ATOM 1720 O ALA A 113 9.146 4.086 -8.009 1.00 0.00 O ATOM 1721 CB ALA A 113 9.110 3.551 -4.800 1.00 0.00 C ATOM 0 H ALA A 113 11.234 4.656 -4.236 1.00 0.00 H new ATOM 0 HA ALA A 113 10.539 2.901 -6.253 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.275 3.025 -5.263 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.539 2.930 -4.013 1.00 0.00 H new ATOM 0 HB3 ALA A 113 8.755 4.487 -4.370 1.00 0.00 H new ATOM 1727 N VAL A 114 9.540 5.968 -6.840 1.00 0.00 N ATOM 1728 CA VAL A 114 8.993 6.849 -7.865 1.00 0.00 C ATOM 1729 C VAL A 114 9.453 6.427 -9.255 1.00 0.00 C ATOM 1730 O VAL A 114 8.683 6.467 -10.214 1.00 0.00 O ATOM 1731 CB VAL A 114 9.404 8.314 -7.623 1.00 0.00 C ATOM 1732 CG1 VAL A 114 8.824 8.822 -6.312 1.00 0.00 C ATOM 1733 CG2 VAL A 114 10.919 8.450 -7.634 1.00 0.00 C ATOM 0 H VAL A 114 9.887 6.450 -6.011 1.00 0.00 H new ATOM 0 HA VAL A 114 7.908 6.769 -7.805 1.00 0.00 H new ATOM 0 HB VAL A 114 9.001 8.925 -8.431 1.00 0.00 H new ATOM 0 HG11 VAL A 114 9.125 9.858 -6.158 1.00 0.00 H new ATOM 0 HG12 VAL A 114 7.736 8.762 -6.348 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.194 8.211 -5.489 1.00 0.00 H new ATOM 0 HG21 VAL A 114 11.192 9.491 -7.462 1.00 0.00 H new ATOM 0 HG22 VAL A 114 11.346 7.828 -6.847 1.00 0.00 H new ATOM 0 HG23 VAL A 114 11.306 8.129 -8.601 1.00 0.00 H new ATOM 1743 N ASN A 115 10.715 6.021 -9.358 1.00 0.00 N ATOM 1744 CA ASN A 115 11.278 5.591 -10.632 1.00 0.00 C ATOM 1745 C ASN A 115 10.932 4.132 -10.915 1.00 0.00 C ATOM 1746 O ASN A 115 10.574 3.775 -12.037 1.00 0.00 O ATOM 1747 CB ASN A 115 12.797 5.775 -10.630 1.00 0.00 C ATOM 1748 CG ASN A 115 13.210 7.163 -10.179 1.00 0.00 C ATOM 1749 OD1 ASN A 115 13.096 8.131 -10.930 1.00 0.00 O ATOM 1750 ND2 ASN A 115 13.694 7.264 -8.946 1.00 0.00 N ATOM 0 H ASN A 115 11.366 5.981 -8.574 1.00 0.00 H new ATOM 0 HA ASN A 115 10.845 6.208 -11.419 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.249 5.033 -9.973 1.00 0.00 H new ATOM 0 HB3 ASN A 115 13.184 5.591 -11.632 1.00 0.00 H new ATOM 0 HD21 ASN A 115 13.989 8.172 -8.587 1.00 0.00 H new ATOM 0 HD22 ASN A 115 13.770 6.434 -8.358 1.00 0.00 H new ATOM 1757 N GLN A 116 11.042 3.294 -9.889 1.00 0.00 N ATOM 1758 CA GLN A 116 10.741 1.874 -10.028 1.00 0.00 C ATOM 1759 C GLN A 116 9.312 1.666 -10.518 1.00 0.00 C ATOM 1760 O GLN A 116 9.089 1.127 -11.602 1.00 0.00 O ATOM 1761 CB GLN A 116 10.944 1.155 -8.693 1.00 0.00 C ATOM 1762 CG GLN A 116 12.362 1.260 -8.155 1.00 0.00 C ATOM 1763 CD GLN A 116 12.562 0.467 -6.879 1.00 0.00 C ATOM 1764 OE1 GLN A 116 11.770 -0.418 -6.553 1.00 0.00 O ATOM 1765 NE2 GLN A 116 13.625 0.781 -6.147 1.00 0.00 N ATOM 0 H GLN A 116 11.337 3.573 -8.953 1.00 0.00 H new ATOM 0 HA GLN A 116 11.424 1.454 -10.767 1.00 0.00 H new ATOM 0 HB2 GLN A 116 10.254 1.569 -7.958 1.00 0.00 H new ATOM 0 HB3 GLN A 116 10.687 0.103 -8.814 1.00 0.00 H new ATOM 0 HG2 GLN A 116 13.061 0.905 -8.912 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.599 2.307 -7.968 1.00 0.00 H new ATOM 0 HE21 GLN A 116 14.255 1.521 -6.455 1.00 0.00 H new ATOM 0 HE22 GLN A 116 13.811 0.282 -5.277 1.00 0.00 H new ATOM 1774 N MET A 117 8.346 2.097 -9.713 1.00 0.00 N ATOM 1775 CA MET A 117 6.938 1.958 -10.066 1.00 0.00 C ATOM 1776 C MET A 117 6.684 2.446 -11.488 1.00 0.00 C ATOM 1777 O MET A 117 7.294 3.415 -11.940 1.00 0.00 O ATOM 1778 CB MET A 117 6.064 2.739 -9.082 1.00 0.00 C ATOM 1779 CG MET A 117 6.206 4.247 -9.208 1.00 0.00 C ATOM 1780 SD MET A 117 5.315 5.138 -7.919 1.00 0.00 S ATOM 1781 CE MET A 117 5.581 6.833 -8.433 1.00 0.00 C ATOM 0 H MET A 117 8.513 2.545 -8.812 1.00 0.00 H new ATOM 0 HA MET A 117 6.678 0.901 -10.012 1.00 0.00 H new ATOM 0 HB2 MET A 117 5.021 2.466 -9.240 1.00 0.00 H new ATOM 0 HB3 MET A 117 6.321 2.442 -8.065 1.00 0.00 H new ATOM 0 HG2 MET A 117 7.262 4.514 -9.165 1.00 0.00 H new ATOM 0 HG3 MET A 117 5.837 4.563 -10.184 1.00 0.00 H new ATOM 0 HE1 MET A 117 5.990 7.406 -7.601 1.00 0.00 H new ATOM 0 HE2 MET A 117 6.282 6.854 -9.268 1.00 0.00 H new ATOM 0 HE3 MET A 117 4.633 7.272 -8.744 1.00 0.00 H new ATOM 1791 N ALA A 118 5.780 1.769 -12.189 1.00 0.00 N ATOM 1792 CA ALA A 118 5.444 2.136 -13.559 1.00 0.00 C ATOM 1793 C ALA A 118 4.323 3.169 -13.592 1.00 0.00 C ATOM 1794 O ALA A 118 3.146 2.826 -13.476 1.00 0.00 O ATOM 1795 CB ALA A 118 5.050 0.900 -14.355 1.00 0.00 C ATOM 0 H ALA A 118 5.267 0.963 -11.830 1.00 0.00 H new ATOM 0 HA ALA A 118 6.327 2.583 -14.016 1.00 0.00 H new ATOM 0 HB1 ALA A 118 4.802 1.189 -15.376 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.882 0.196 -14.369 1.00 0.00 H new ATOM 0 HB3 ALA A 118 4.184 0.429 -13.890 1.00 0.00 H new ATOM 1801 N SER A 119 4.695 4.435 -13.751 1.00 0.00 N ATOM 1802 CA SER A 119 3.720 5.519 -13.795 1.00 0.00 C ATOM 1803 C SER A 119 2.606 5.207 -14.789 1.00 0.00 C ATOM 1804 O SER A 119 2.745 4.329 -15.640 1.00 0.00 O ATOM 1805 CB SER A 119 4.405 6.833 -14.174 1.00 0.00 C ATOM 1806 OG SER A 119 3.591 7.946 -13.843 1.00 0.00 O ATOM 0 H SER A 119 5.665 4.736 -13.852 1.00 0.00 H new ATOM 0 HA SER A 119 3.280 5.620 -12.803 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.361 6.911 -13.657 1.00 0.00 H new ATOM 0 HB3 SER A 119 4.619 6.840 -15.243 1.00 0.00 H new ATOM 0 HG SER A 119 4.051 8.774 -14.093 1.00 0.00 H new ATOM 1812 N GLY A 120 1.498 5.934 -14.674 1.00 0.00 N ATOM 1813 CA GLY A 120 0.375 5.721 -15.568 1.00 0.00 C ATOM 1814 C GLY A 120 -0.468 4.527 -15.166 1.00 0.00 C ATOM 1815 O GLY A 120 -0.244 3.403 -15.615 1.00 0.00 O ATOM 0 H GLY A 120 1.359 6.666 -13.978 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.249 6.614 -15.581 1.00 0.00 H new ATOM 0 HA3 GLY A 120 0.745 5.575 -16.583 1.00 0.00 H new ATOM 1819 N PRO A 121 -1.463 4.766 -14.299 1.00 0.00 N ATOM 1820 CA PRO A 121 -2.361 3.713 -13.816 1.00 0.00 C ATOM 1821 C PRO A 121 -3.301 3.209 -14.905 1.00 0.00 C ATOM 1822 O PRO A 121 -4.132 3.958 -15.418 1.00 0.00 O ATOM 1823 CB PRO A 121 -3.154 4.406 -12.705 1.00 0.00 C ATOM 1824 CG PRO A 121 -3.116 5.853 -13.057 1.00 0.00 C ATOM 1825 CD PRO A 121 -1.787 6.082 -13.723 1.00 0.00 C ATOM 0 HA PRO A 121 -1.813 2.832 -13.482 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.178 4.036 -12.660 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -2.707 4.225 -11.728 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.937 6.114 -13.725 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.219 6.474 -12.167 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.850 6.852 -14.491 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.030 6.405 -13.009 1.00 0.00 H new ATOM 1833 N SER A 122 -3.164 1.933 -15.255 1.00 0.00 N ATOM 1834 CA SER A 122 -3.999 1.329 -16.286 1.00 0.00 C ATOM 1835 C SER A 122 -5.355 0.923 -15.718 1.00 0.00 C ATOM 1836 O SER A 122 -5.478 0.618 -14.532 1.00 0.00 O ATOM 1837 CB SER A 122 -3.299 0.110 -16.889 1.00 0.00 C ATOM 1838 OG SER A 122 -3.064 -0.882 -15.904 1.00 0.00 O ATOM 0 H SER A 122 -2.482 1.298 -14.839 1.00 0.00 H new ATOM 0 HA SER A 122 -4.160 2.070 -17.069 1.00 0.00 H new ATOM 0 HB2 SER A 122 -3.911 -0.306 -17.690 1.00 0.00 H new ATOM 0 HB3 SER A 122 -2.353 0.414 -17.336 1.00 0.00 H new ATOM 0 HG SER A 122 -2.617 -1.651 -16.315 1.00 0.00 H new ATOM 1844 N SER A 123 -6.372 0.921 -16.575 1.00 0.00 N ATOM 1845 CA SER A 123 -7.721 0.556 -16.159 1.00 0.00 C ATOM 1846 C SER A 123 -8.021 -0.899 -16.505 1.00 0.00 C ATOM 1847 O SER A 123 -8.641 -1.190 -17.527 1.00 0.00 O ATOM 1848 CB SER A 123 -8.749 1.473 -16.825 1.00 0.00 C ATOM 1849 OG SER A 123 -8.649 2.797 -16.328 1.00 0.00 O ATOM 0 H SER A 123 -6.287 1.168 -17.561 1.00 0.00 H new ATOM 0 HA SER A 123 -7.786 0.675 -15.077 1.00 0.00 H new ATOM 0 HB2 SER A 123 -8.595 1.474 -17.904 1.00 0.00 H new ATOM 0 HB3 SER A 123 -9.753 1.089 -16.646 1.00 0.00 H new ATOM 0 HG SER A 123 -9.315 3.364 -16.770 1.00 0.00 H new ATOM 1855 N GLY A 124 -7.576 -1.810 -15.645 1.00 0.00 N ATOM 1856 CA GLY A 124 -7.806 -3.224 -15.876 1.00 0.00 C ATOM 1857 C GLY A 124 -7.212 -4.094 -14.786 1.00 0.00 C ATOM 1858 O GLY A 124 -5.995 -4.265 -14.713 1.00 0.00 O ATOM 0 H GLY A 124 -7.060 -1.594 -14.792 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -8.878 -3.409 -15.940 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -7.376 -3.507 -16.837 1.00 0.00 H new TER 1862 GLY A 124