USER MOD reduce.3.24.130724 H: found=0, std=0, add=1134, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1129 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 137 GLN : amide:sc= -0.0626 X(o=-2.7,f=-2.6) USER MOD Set 1.2: A 140 ASN : amide:sc= -2.6 X(o=-2.7,f=-2.9) USER MOD Set 2.1: A 81 ASN : amide:sc= 1.04 K(o=3.3,f=-4) USER MOD Set 2.2: A 86 LYS NZ :NH3+ 176:sc= 2.22 (180deg=0.997) USER MOD Single : A 1 GLY N :NH3+ -176:sc= 0.33 (180deg=0.327) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0405 K(o=-0.041,f=-1.9!) USER MOD Single : A 13 LYS NZ :NH3+ -149:sc= 1.1 (180deg=-0.551!) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 170:sc= 0.418 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.383 K(o=-0.38,f=-5.3!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 51:sc= 0.502 USER MOD Single : A 37 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.226) USER MOD Single : A 42 THR OG1 : rot -73:sc= 0.874 USER MOD Single : A 44 GLN : amide:sc= -0.945 X(o=-0.95,f=-0.72!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -174:sc= 0.664 (180deg=0.635) USER MOD Single : A 60 THR OG1 : rot 180:sc=-0.00772 USER MOD Single : A 62 LYS NZ :NH3+ -166:sc=-0.00117 (180deg=-0.113) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -9:sc= 0.445 USER MOD Single : A 77 HIS :FLIP no HD1:sc= -0.0317 F(o=-0.55,f=-0.032) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= -0.112 X(o=-0.11,f=-0.0015) USER MOD Single : A 92 TYR OH : rot 168:sc= 1.27 USER MOD Single : A 95 SER OG : rot 67:sc= 1.18 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 150:sc= 1.34 (180deg=0.908) USER MOD Single : A 111 TYR OH : rot 180:sc= 0.191 USER MOD Single : A 113 THR OG1 : rot 170:sc= 1.29 USER MOD Single : A 115 CYS SG : rot 180:sc= -0.226 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0.0347 K(o=0.035,f=-2.9!) USER MOD Single : A 120 TYR OH : rot 180:sc= -1.49! USER MOD Single : A 121 ASN : amide:sc= 1.28 K(o=1.3,f=-6.8!) USER MOD Single : A 127 ASN : amide:sc= -0.138 K(o=-0.14,f=-3!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.577 10.408 -8.749 1.00 2.53 N ATOM 2 CA GLY A 1 27.239 10.012 -10.122 1.00 2.54 C ATOM 3 C GLY A 1 26.104 9.001 -10.154 1.00 42.32 C ATOM 4 O GLY A 1 25.097 9.260 -10.815 1.00 63.44 O ATOM 0 H1 GLY A 1 28.308 11.148 -8.771 1.00 2.53 H new ATOM 0 H2 GLY A 1 26.727 10.775 -8.274 1.00 2.53 H new ATOM 0 H3 GLY A 1 27.936 9.582 -8.228 1.00 2.53 H new ATOM 0 HA2 GLY A 1 26.956 10.895 -10.696 1.00 2.54 H new ATOM 0 HA3 GLY A 1 28.119 9.586 -10.605 1.00 2.54 H new ATOM 8 N ALA A 2 26.236 7.864 -9.464 1.00 64.21 N ATOM 9 CA ALA A 2 25.169 6.909 -9.193 1.00 14.30 C ATOM 10 C ALA A 2 25.080 6.810 -7.675 1.00 0.54 C ATOM 11 O ALA A 2 25.893 6.111 -7.069 1.00 62.21 O ATOM 12 CB ALA A 2 25.454 5.551 -9.842 1.00 53.12 C ATOM 0 H ALA A 2 27.129 7.576 -9.064 1.00 64.21 H new ATOM 0 HA ALA A 2 24.221 7.236 -9.619 1.00 14.30 H new ATOM 0 HB1 ALA A 2 24.638 4.863 -9.620 1.00 53.12 H new ATOM 0 HB2 ALA A 2 25.540 5.675 -10.922 1.00 53.12 H new ATOM 0 HB3 ALA A 2 26.386 5.148 -9.447 1.00 53.12 H new ATOM 18 N GLU A 3 24.200 7.596 -7.055 1.00 4.41 N ATOM 19 CA GLU A 3 24.130 7.743 -5.599 1.00 3.12 C ATOM 20 C GLU A 3 22.682 7.586 -5.165 1.00 2.43 C ATOM 21 O GLU A 3 22.072 8.468 -4.544 1.00 11.34 O ATOM 22 CB GLU A 3 24.718 9.082 -5.133 1.00 20.00 C ATOM 23 CG GLU A 3 26.194 9.300 -5.465 1.00 31.13 C ATOM 24 CD GLU A 3 26.507 10.783 -5.323 1.00 11.44 C ATOM 25 OE1 GLU A 3 26.603 11.275 -4.177 1.00 21.11 O ATOM 26 OE2 GLU A 3 26.594 11.453 -6.378 1.00 54.44 O ATOM 0 H GLU A 3 23.508 8.155 -7.554 1.00 4.41 H new ATOM 0 HA GLU A 3 24.735 6.967 -5.130 1.00 3.12 H new ATOM 0 HB2 GLU A 3 24.139 9.889 -5.581 1.00 20.00 H new ATOM 0 HB3 GLU A 3 24.590 9.160 -4.053 1.00 20.00 H new ATOM 0 HG2 GLU A 3 26.823 8.714 -4.795 1.00 31.13 H new ATOM 0 HG3 GLU A 3 26.408 8.963 -6.479 1.00 31.13 H new ATOM 33 N GLU A 4 22.122 6.450 -5.552 1.00 61.41 N ATOM 34 CA GLU A 4 20.729 6.131 -5.324 1.00 61.14 C ATOM 35 C GLU A 4 20.529 5.667 -3.888 1.00 75.02 C ATOM 36 O GLU A 4 21.488 5.486 -3.129 1.00 13.13 O ATOM 37 CB GLU A 4 20.232 5.058 -6.300 1.00 14.12 C ATOM 38 CG GLU A 4 20.698 5.253 -7.739 1.00 74.05 C ATOM 39 CD GLU A 4 21.946 4.434 -8.094 1.00 22.32 C ATOM 40 OE1 GLU A 4 22.837 4.229 -7.232 1.00 14.33 O ATOM 41 OE2 GLU A 4 22.000 3.930 -9.243 1.00 21.13 O ATOM 0 H GLU A 4 22.634 5.715 -6.040 1.00 61.41 H new ATOM 0 HA GLU A 4 20.145 7.035 -5.496 1.00 61.14 H new ATOM 0 HB2 GLU A 4 20.569 4.082 -5.951 1.00 14.12 H new ATOM 0 HB3 GLU A 4 19.142 5.044 -6.282 1.00 14.12 H new ATOM 0 HG2 GLU A 4 19.888 4.978 -8.415 1.00 74.05 H new ATOM 0 HG3 GLU A 4 20.907 6.310 -7.905 1.00 74.05 H new ATOM 48 N GLU A 5 19.281 5.424 -3.509 1.00 72.34 N ATOM 49 CA GLU A 5 18.985 4.688 -2.300 1.00 43.52 C ATOM 50 C GLU A 5 19.264 3.193 -2.541 1.00 24.02 C ATOM 51 O GLU A 5 19.647 2.763 -3.636 1.00 51.24 O ATOM 52 CB GLU A 5 17.524 4.929 -1.913 1.00 21.24 C ATOM 53 CG GLU A 5 17.325 5.100 -0.403 1.00 43.34 C ATOM 54 CD GLU A 5 17.023 6.539 0.014 1.00 53.25 C ATOM 55 OE1 GLU A 5 17.772 7.472 -0.333 1.00 44.23 O ATOM 56 OE2 GLU A 5 16.025 6.732 0.748 1.00 12.41 O ATOM 0 H GLU A 5 18.458 5.730 -4.028 1.00 72.34 H new ATOM 0 HA GLU A 5 19.617 5.026 -1.478 1.00 43.52 H new ATOM 0 HB2 GLU A 5 17.160 5.820 -2.425 1.00 21.24 H new ATOM 0 HB3 GLU A 5 16.919 4.092 -2.261 1.00 21.24 H new ATOM 0 HG2 GLU A 5 16.507 4.457 -0.077 1.00 43.34 H new ATOM 0 HG3 GLU A 5 18.223 4.761 0.114 1.00 43.34 H new ATOM 63 N ASP A 6 19.004 2.362 -1.535 1.00 53.32 N ATOM 64 CA ASP A 6 19.199 0.919 -1.606 1.00 54.22 C ATOM 65 C ASP A 6 17.926 0.193 -1.175 1.00 74.45 C ATOM 66 O ASP A 6 17.181 0.710 -0.348 1.00 64.02 O ATOM 67 CB ASP A 6 20.396 0.523 -0.740 1.00 62.31 C ATOM 68 CG ASP A 6 20.500 -0.990 -0.694 1.00 13.43 C ATOM 69 OD1 ASP A 6 20.927 -1.566 -1.718 1.00 24.04 O ATOM 70 OD2 ASP A 6 20.047 -1.589 0.302 1.00 14.23 O ATOM 0 H ASP A 6 18.646 2.679 -0.634 1.00 53.32 H new ATOM 0 HA ASP A 6 19.411 0.626 -2.634 1.00 54.22 H new ATOM 0 HB2 ASP A 6 21.312 0.950 -1.148 1.00 62.31 H new ATOM 0 HB3 ASP A 6 20.279 0.922 0.268 1.00 62.31 H new ATOM 75 N PHE A 7 17.679 -0.992 -1.734 1.00 63.22 N ATOM 76 CA PHE A 7 16.550 -1.883 -1.471 1.00 22.40 C ATOM 77 C PHE A 7 16.254 -2.061 0.021 1.00 32.24 C ATOM 78 O PHE A 7 15.092 -2.117 0.413 1.00 32.33 O ATOM 79 CB PHE A 7 16.781 -3.252 -2.141 1.00 34.44 C ATOM 80 CG PHE A 7 17.683 -4.233 -1.397 1.00 31.43 C ATOM 81 CD1 PHE A 7 17.181 -4.974 -0.305 1.00 11.24 C ATOM 82 CD2 PHE A 7 19.026 -4.409 -1.780 1.00 55.35 C ATOM 83 CE1 PHE A 7 18.009 -5.838 0.425 1.00 21.13 C ATOM 84 CE2 PHE A 7 19.851 -5.293 -1.060 1.00 11.31 C ATOM 85 CZ PHE A 7 19.352 -5.988 0.055 1.00 75.04 C ATOM 0 H PHE A 7 18.310 -1.382 -2.434 1.00 63.22 H new ATOM 0 HA PHE A 7 15.671 -1.407 -1.905 1.00 22.40 H new ATOM 0 HB2 PHE A 7 15.811 -3.727 -2.290 1.00 34.44 H new ATOM 0 HB3 PHE A 7 17.207 -3.080 -3.130 1.00 34.44 H new ATOM 0 HD1 PHE A 7 16.142 -4.873 -0.028 1.00 11.24 H new ATOM 0 HD2 PHE A 7 19.423 -3.866 -2.625 1.00 55.35 H new ATOM 0 HE1 PHE A 7 17.614 -6.385 1.268 1.00 21.13 H new ATOM 0 HE2 PHE A 7 20.876 -5.439 -1.367 1.00 11.31 H new ATOM 0 HZ PHE A 7 20.002 -6.636 0.625 1.00 75.04 H new ATOM 95 N LYS A 8 17.285 -2.174 0.861 1.00 73.41 N ATOM 96 CA LYS A 8 17.141 -2.288 2.304 1.00 40.53 C ATOM 97 C LYS A 8 16.936 -0.889 2.848 1.00 13.40 C ATOM 98 O LYS A 8 15.955 -0.618 3.531 1.00 43.31 O ATOM 99 CB LYS A 8 18.400 -2.957 2.859 1.00 20.41 C ATOM 100 CG LYS A 8 18.533 -2.899 4.387 1.00 24.40 C ATOM 101 CD LYS A 8 19.934 -3.389 4.766 1.00 31.03 C ATOM 102 CE LYS A 8 20.951 -2.264 4.507 1.00 40.35 C ATOM 103 NZ LYS A 8 22.287 -2.765 4.131 1.00 35.14 N ATOM 0 H LYS A 8 18.256 -2.189 0.548 1.00 73.41 H new ATOM 0 HA LYS A 8 16.288 -2.900 2.597 1.00 40.53 H new ATOM 0 HB2 LYS A 8 18.409 -4.001 2.546 1.00 20.41 H new ATOM 0 HB3 LYS A 8 19.274 -2.483 2.413 1.00 20.41 H new ATOM 0 HG2 LYS A 8 18.377 -1.881 4.743 1.00 24.40 H new ATOM 0 HG3 LYS A 8 17.772 -3.521 4.858 1.00 24.40 H new ATOM 0 HD2 LYS A 8 19.958 -3.683 5.815 1.00 31.03 H new ATOM 0 HD3 LYS A 8 20.194 -4.272 4.182 1.00 31.03 H new ATOM 0 HE2 LYS A 8 20.575 -1.619 3.713 1.00 40.35 H new ATOM 0 HE3 LYS A 8 21.039 -1.649 5.403 1.00 40.35 H new ATOM 0 HZ1 LYS A 8 22.927 -1.961 3.970 1.00 35.14 H new ATOM 0 HZ2 LYS A 8 22.663 -3.359 4.897 1.00 35.14 H new ATOM 0 HZ3 LYS A 8 22.214 -3.329 3.260 1.00 35.14 H new ATOM 117 N THR A 9 17.877 0.007 2.582 1.00 12.24 N ATOM 118 CA THR A 9 17.959 1.291 3.256 1.00 52.44 C ATOM 119 C THR A 9 16.771 2.212 2.943 1.00 43.23 C ATOM 120 O THR A 9 16.437 3.067 3.765 1.00 0.30 O ATOM 121 CB THR A 9 19.317 1.891 2.889 1.00 61.22 C ATOM 122 OG1 THR A 9 20.310 0.955 3.268 1.00 20.42 O ATOM 123 CG2 THR A 9 19.591 3.241 3.547 1.00 71.41 C ATOM 0 H THR A 9 18.609 -0.140 1.887 1.00 12.24 H new ATOM 0 HA THR A 9 17.890 1.162 4.336 1.00 52.44 H new ATOM 0 HB THR A 9 19.325 2.084 1.816 1.00 61.22 H new ATOM 0 HG1 THR A 9 21.196 1.309 3.044 1.00 20.42 H new ATOM 0 HG21 THR A 9 20.572 3.603 3.240 1.00 71.41 H new ATOM 0 HG22 THR A 9 18.828 3.956 3.241 1.00 71.41 H new ATOM 0 HG23 THR A 9 19.569 3.129 4.631 1.00 71.41 H new ATOM 131 N PHE A 10 16.100 2.056 1.796 1.00 53.53 N ATOM 132 CA PHE A 10 14.906 2.839 1.502 1.00 0.54 C ATOM 133 C PHE A 10 13.838 2.315 2.481 1.00 53.55 C ATOM 134 O PHE A 10 13.174 3.100 3.159 1.00 44.21 O ATOM 135 CB PHE A 10 14.452 2.719 0.021 1.00 11.23 C ATOM 136 CG PHE A 10 13.336 1.732 -0.252 1.00 32.34 C ATOM 137 CD1 PHE A 10 12.008 2.125 0.009 1.00 33.00 C ATOM 138 CD2 PHE A 10 13.606 0.414 -0.648 1.00 12.54 C ATOM 139 CE1 PHE A 10 10.965 1.190 -0.067 1.00 60.13 C ATOM 140 CE2 PHE A 10 12.561 -0.521 -0.731 1.00 52.34 C ATOM 141 CZ PHE A 10 11.243 -0.139 -0.431 1.00 54.43 C ATOM 0 H PHE A 10 16.366 1.398 1.064 1.00 53.53 H new ATOM 0 HA PHE A 10 15.092 3.905 1.632 1.00 0.54 H new ATOM 0 HB2 PHE A 10 14.132 3.703 -0.321 1.00 11.23 H new ATOM 0 HB3 PHE A 10 15.315 2.437 -0.582 1.00 11.23 H new ATOM 0 HD1 PHE A 10 11.792 3.151 0.269 1.00 33.00 H new ATOM 0 HD2 PHE A 10 14.616 0.118 -0.889 1.00 12.54 H new ATOM 0 HE1 PHE A 10 9.951 1.490 0.154 1.00 60.13 H new ATOM 0 HE2 PHE A 10 12.772 -1.538 -1.027 1.00 52.34 H new ATOM 0 HZ PHE A 10 10.445 -0.865 -0.480 1.00 54.43 H new ATOM 151 N LEU A 11 13.714 0.983 2.578 1.00 42.14 N ATOM 152 CA LEU A 11 12.767 0.237 3.388 1.00 23.33 C ATOM 153 C LEU A 11 12.928 0.613 4.857 1.00 12.44 C ATOM 154 O LEU A 11 11.939 0.949 5.495 1.00 54.55 O ATOM 155 CB LEU A 11 12.967 -1.280 3.169 1.00 54.51 C ATOM 156 CG LEU A 11 11.681 -2.051 2.831 1.00 62.12 C ATOM 157 CD1 LEU A 11 12.015 -3.529 2.595 1.00 1.12 C ATOM 158 CD2 LEU A 11 10.617 -1.951 3.924 1.00 53.45 C ATOM 0 H LEU A 11 14.324 0.361 2.048 1.00 42.14 H new ATOM 0 HA LEU A 11 11.751 0.490 3.086 1.00 23.33 H new ATOM 0 HB2 LEU A 11 13.686 -1.426 2.362 1.00 54.51 H new ATOM 0 HB3 LEU A 11 13.407 -1.709 4.069 1.00 54.51 H new ATOM 0 HG LEU A 11 11.268 -1.594 1.932 1.00 62.12 H new ATOM 0 HD11 LEU A 11 11.102 -4.075 2.355 1.00 1.12 H new ATOM 0 HD12 LEU A 11 12.718 -3.615 1.766 1.00 1.12 H new ATOM 0 HD13 LEU A 11 12.463 -3.949 3.496 1.00 1.12 H new ATOM 0 HD21 LEU A 11 9.734 -2.516 3.625 1.00 53.45 H new ATOM 0 HD22 LEU A 11 11.012 -2.359 4.854 1.00 53.45 H new ATOM 0 HD23 LEU A 11 10.345 -0.906 4.073 1.00 53.45 H new ATOM 170 N GLN A 12 14.168 0.666 5.363 1.00 13.43 N ATOM 171 CA GLN A 12 14.485 1.027 6.747 1.00 21.13 C ATOM 172 C GLN A 12 13.786 2.320 7.176 1.00 74.02 C ATOM 173 O GLN A 12 13.320 2.409 8.311 1.00 34.33 O ATOM 174 CB GLN A 12 16.004 1.189 6.942 1.00 2.42 C ATOM 175 CG GLN A 12 16.793 -0.123 6.861 1.00 44.15 C ATOM 176 CD GLN A 12 18.274 0.080 7.192 1.00 75.35 C ATOM 177 OE1 GLN A 12 18.991 0.870 6.572 1.00 52.11 O ATOM 178 NE2 GLN A 12 18.786 -0.644 8.167 1.00 51.35 N ATOM 0 H GLN A 12 14.996 0.454 4.806 1.00 13.43 H new ATOM 0 HA GLN A 12 14.121 0.211 7.371 1.00 21.13 H new ATOM 0 HB2 GLN A 12 16.385 1.876 6.186 1.00 2.42 H new ATOM 0 HB3 GLN A 12 16.187 1.650 7.912 1.00 2.42 H new ATOM 0 HG2 GLN A 12 16.363 -0.848 7.551 1.00 44.15 H new ATOM 0 HG3 GLN A 12 16.699 -0.542 5.859 1.00 44.15 H new ATOM 0 HE21 GLN A 12 18.195 -1.298 8.681 1.00 51.35 H new ATOM 0 HE22 GLN A 12 19.773 -0.551 8.408 1.00 51.35 H new ATOM 187 N LYS A 13 13.727 3.317 6.286 1.00 23.01 N ATOM 188 CA LYS A 13 13.032 4.572 6.509 1.00 40.15 C ATOM 189 C LYS A 13 11.535 4.388 6.269 1.00 75.34 C ATOM 190 O LYS A 13 10.718 4.880 7.042 1.00 51.41 O ATOM 191 CB LYS A 13 13.592 5.590 5.520 1.00 14.20 C ATOM 192 CG LYS A 13 15.118 5.771 5.611 1.00 53.11 C ATOM 193 CD LYS A 13 15.559 6.387 4.293 1.00 34.12 C ATOM 194 CE LYS A 13 17.064 6.605 4.191 1.00 64.21 C ATOM 195 NZ LYS A 13 17.375 7.471 3.037 1.00 74.01 N ATOM 0 H LYS A 13 14.175 3.264 5.371 1.00 23.01 H new ATOM 0 HA LYS A 13 13.176 4.912 7.535 1.00 40.15 H new ATOM 0 HB2 LYS A 13 13.332 5.280 4.508 1.00 14.20 H new ATOM 0 HB3 LYS A 13 13.111 6.553 5.692 1.00 14.20 H new ATOM 0 HG2 LYS A 13 15.383 6.416 6.449 1.00 53.11 H new ATOM 0 HG3 LYS A 13 15.613 4.814 5.777 1.00 53.11 H new ATOM 0 HD2 LYS A 13 15.238 5.742 3.475 1.00 34.12 H new ATOM 0 HD3 LYS A 13 15.053 7.343 4.162 1.00 34.12 H new ATOM 0 HE2 LYS A 13 17.436 7.061 5.108 1.00 64.21 H new ATOM 0 HE3 LYS A 13 17.571 5.646 4.083 1.00 64.21 H new ATOM 0 HZ1 LYS A 13 18.306 7.214 2.651 1.00 74.01 H new ATOM 0 HZ2 LYS A 13 16.649 7.345 2.303 1.00 74.01 H new ATOM 0 HZ3 LYS A 13 17.389 8.465 3.343 1.00 74.01 H new ATOM 209 N PHE A 14 11.171 3.709 5.178 1.00 44.35 N ATOM 210 CA PHE A 14 9.806 3.517 4.711 1.00 51.31 C ATOM 211 C PHE A 14 8.902 2.895 5.772 1.00 15.43 C ATOM 212 O PHE A 14 7.735 3.270 5.833 1.00 32.10 O ATOM 213 CB PHE A 14 9.825 2.670 3.436 1.00 73.35 C ATOM 214 CG PHE A 14 8.517 2.636 2.677 1.00 1.51 C ATOM 215 CD1 PHE A 14 8.079 3.771 1.964 1.00 62.23 C ATOM 216 CD2 PHE A 14 7.752 1.456 2.658 1.00 14.14 C ATOM 217 CE1 PHE A 14 6.890 3.710 1.214 1.00 4.40 C ATOM 218 CE2 PHE A 14 6.556 1.407 1.928 1.00 43.45 C ATOM 219 CZ PHE A 14 6.125 2.530 1.202 1.00 14.23 C ATOM 0 H PHE A 14 11.857 3.259 4.571 1.00 44.35 H new ATOM 0 HA PHE A 14 9.382 4.498 4.494 1.00 51.31 H new ATOM 0 HB2 PHE A 14 10.603 3.052 2.775 1.00 73.35 H new ATOM 0 HB3 PHE A 14 10.103 1.649 3.699 1.00 73.35 H new ATOM 0 HD1 PHE A 14 8.654 4.684 1.993 1.00 62.23 H new ATOM 0 HD2 PHE A 14 8.086 0.587 3.206 1.00 14.14 H new ATOM 0 HE1 PHE A 14 6.565 4.570 0.647 1.00 4.40 H new ATOM 0 HE2 PHE A 14 5.964 0.503 1.924 1.00 43.45 H new ATOM 0 HZ PHE A 14 5.207 2.487 0.635 1.00 14.23 H new ATOM 229 N THR A 15 9.429 2.000 6.608 1.00 14.50 N ATOM 230 CA THR A 15 8.705 1.325 7.680 1.00 4.10 C ATOM 231 C THR A 15 9.128 1.860 9.059 1.00 3.23 C ATOM 232 O THR A 15 9.057 1.158 10.067 1.00 11.11 O ATOM 233 CB THR A 15 8.854 -0.194 7.493 1.00 71.03 C ATOM 234 OG1 THR A 15 10.166 -0.591 7.141 1.00 0.13 O ATOM 235 CG2 THR A 15 7.950 -0.657 6.348 1.00 40.11 C ATOM 0 H THR A 15 10.407 1.717 6.553 1.00 14.50 H new ATOM 0 HA THR A 15 7.638 1.543 7.631 1.00 4.10 H new ATOM 0 HB THR A 15 8.591 -0.638 8.453 1.00 71.03 H new ATOM 0 HG1 THR A 15 10.197 -1.565 7.038 1.00 0.13 H new ATOM 0 HG21 THR A 15 8.055 -1.734 6.214 1.00 40.11 H new ATOM 0 HG22 THR A 15 6.913 -0.420 6.585 1.00 40.11 H new ATOM 0 HG23 THR A 15 8.238 -0.148 5.428 1.00 40.11 H new ATOM 243 N SER A 16 9.580 3.118 9.122 1.00 54.41 N ATOM 244 CA SER A 16 9.879 3.796 10.376 1.00 41.31 C ATOM 245 C SER A 16 9.503 5.278 10.332 1.00 34.30 C ATOM 246 O SER A 16 9.773 5.987 11.302 1.00 40.52 O ATOM 247 CB SER A 16 11.357 3.512 10.729 1.00 11.10 C ATOM 248 OG SER A 16 11.601 3.494 12.129 1.00 20.42 O ATOM 0 H SER A 16 9.748 3.692 8.296 1.00 54.41 H new ATOM 0 HA SER A 16 9.261 3.405 11.185 1.00 41.31 H new ATOM 0 HB2 SER A 16 11.648 2.552 10.303 1.00 11.10 H new ATOM 0 HB3 SER A 16 11.988 4.271 10.266 1.00 11.10 H new ATOM 0 HG SER A 16 12.549 3.309 12.293 1.00 20.42 H new ATOM 254 N SER A 17 8.877 5.761 9.253 1.00 54.43 N ATOM 255 CA SER A 17 8.611 7.175 9.101 1.00 75.44 C ATOM 256 C SER A 17 7.396 7.416 8.209 1.00 64.43 C ATOM 257 O SER A 17 7.433 7.132 7.007 1.00 52.52 O ATOM 258 CB SER A 17 9.874 7.835 8.546 1.00 21.22 C ATOM 259 OG SER A 17 9.670 9.181 8.154 1.00 4.54 O ATOM 0 H SER A 17 8.549 5.184 8.478 1.00 54.43 H new ATOM 0 HA SER A 17 8.366 7.619 10.066 1.00 75.44 H new ATOM 0 HB2 SER A 17 10.659 7.798 9.302 1.00 21.22 H new ATOM 0 HB3 SER A 17 10.229 7.263 7.689 1.00 21.22 H new ATOM 0 HG SER A 17 10.535 9.600 7.961 1.00 4.54 H new ATOM 265 N ALA A 18 6.340 7.985 8.793 1.00 54.12 N ATOM 266 CA ALA A 18 5.144 8.428 8.091 1.00 41.32 C ATOM 267 C ALA A 18 5.504 9.469 7.032 1.00 22.45 C ATOM 268 O ALA A 18 5.143 9.317 5.865 1.00 24.15 O ATOM 269 CB ALA A 18 4.154 9.025 9.093 1.00 0.53 C ATOM 0 H ALA A 18 6.297 8.153 9.798 1.00 54.12 H new ATOM 0 HA ALA A 18 4.686 7.572 7.595 1.00 41.32 H new ATOM 0 HB1 ALA A 18 3.259 9.356 8.567 1.00 0.53 H new ATOM 0 HB2 ALA A 18 3.883 8.270 9.830 1.00 0.53 H new ATOM 0 HB3 ALA A 18 4.614 9.875 9.597 1.00 0.53 H new ATOM 275 N SER A 19 6.221 10.528 7.418 1.00 1.35 N ATOM 276 CA SER A 19 6.556 11.605 6.495 1.00 31.44 C ATOM 277 C SER A 19 7.452 11.120 5.358 1.00 72.30 C ATOM 278 O SER A 19 7.239 11.526 4.216 1.00 74.04 O ATOM 279 CB SER A 19 7.181 12.768 7.261 1.00 23.04 C ATOM 280 OG SER A 19 6.144 13.417 7.973 1.00 51.53 O ATOM 0 H SER A 19 6.579 10.658 8.364 1.00 1.35 H new ATOM 0 HA SER A 19 5.637 11.958 6.027 1.00 31.44 H new ATOM 0 HB2 SER A 19 7.948 12.407 7.946 1.00 23.04 H new ATOM 0 HB3 SER A 19 7.667 13.462 6.575 1.00 23.04 H new ATOM 0 HG SER A 19 6.516 14.170 8.478 1.00 51.53 H new ATOM 286 N PHE A 20 8.409 10.225 5.621 1.00 23.41 N ATOM 287 CA PHE A 20 9.205 9.634 4.556 1.00 72.35 C ATOM 288 C PHE A 20 8.311 8.834 3.611 1.00 51.20 C ATOM 289 O PHE A 20 8.383 9.070 2.405 1.00 12.44 O ATOM 290 CB PHE A 20 10.322 8.765 5.125 1.00 44.32 C ATOM 291 CG PHE A 20 11.187 8.119 4.066 1.00 12.51 C ATOM 292 CD1 PHE A 20 12.329 8.773 3.575 1.00 20.33 C ATOM 293 CD2 PHE A 20 10.844 6.849 3.577 1.00 54.24 C ATOM 294 CE1 PHE A 20 13.132 8.140 2.613 1.00 63.44 C ATOM 295 CE2 PHE A 20 11.656 6.205 2.631 1.00 11.10 C ATOM 296 CZ PHE A 20 12.809 6.849 2.152 1.00 4.20 C ATOM 0 H PHE A 20 8.646 9.899 6.558 1.00 23.41 H new ATOM 0 HA PHE A 20 9.673 10.438 3.988 1.00 72.35 H new ATOM 0 HB2 PHE A 20 10.951 9.375 5.773 1.00 44.32 H new ATOM 0 HB3 PHE A 20 9.883 7.986 5.748 1.00 44.32 H new ATOM 0 HD1 PHE A 20 12.588 9.758 3.936 1.00 20.33 H new ATOM 0 HD2 PHE A 20 9.947 6.363 3.932 1.00 54.24 H new ATOM 0 HE1 PHE A 20 14.003 8.646 2.224 1.00 63.44 H new ATOM 0 HE2 PHE A 20 11.396 5.220 2.273 1.00 11.10 H new ATOM 0 HZ PHE A 20 13.446 6.356 1.433 1.00 4.20 H new ATOM 306 N GLN A 21 7.472 7.930 4.139 1.00 14.53 N ATOM 307 CA GLN A 21 6.504 7.161 3.368 1.00 20.45 C ATOM 308 C GLN A 21 5.702 8.091 2.455 1.00 53.50 C ATOM 309 O GLN A 21 5.750 7.925 1.239 1.00 41.11 O ATOM 310 CB GLN A 21 5.626 6.298 4.291 1.00 63.42 C ATOM 311 CG GLN A 21 4.628 5.478 3.453 1.00 64.00 C ATOM 312 CD GLN A 21 4.212 4.164 4.097 1.00 60.40 C ATOM 313 OE1 GLN A 21 3.019 3.903 4.201 1.00 61.33 O ATOM 314 NE2 GLN A 21 5.152 3.320 4.481 1.00 53.31 N ATOM 0 H GLN A 21 7.453 7.714 5.136 1.00 14.53 H new ATOM 0 HA GLN A 21 7.029 6.460 2.719 1.00 20.45 H new ATOM 0 HB2 GLN A 21 6.252 5.630 4.882 1.00 63.42 H new ATOM 0 HB3 GLN A 21 5.087 6.934 4.993 1.00 63.42 H new ATOM 0 HG2 GLN A 21 3.738 6.081 3.274 1.00 64.00 H new ATOM 0 HG3 GLN A 21 5.072 5.269 2.480 1.00 64.00 H new ATOM 0 HE21 GLN A 21 6.135 3.571 4.379 1.00 53.31 H new ATOM 0 HE22 GLN A 21 4.895 2.417 4.879 1.00 53.31 H new ATOM 323 N TYR A 22 5.017 9.099 3.001 1.00 3.53 N ATOM 324 CA TYR A 22 4.238 10.055 2.217 1.00 0.53 C ATOM 325 C TYR A 22 5.074 10.726 1.125 1.00 2.41 C ATOM 326 O TYR A 22 4.646 10.805 -0.028 1.00 35.11 O ATOM 327 CB TYR A 22 3.612 11.113 3.134 1.00 75.12 C ATOM 328 CG TYR A 22 2.383 10.658 3.891 1.00 23.33 C ATOM 329 CD1 TYR A 22 1.273 10.175 3.176 1.00 31.25 C ATOM 330 CD2 TYR A 22 2.314 10.770 5.293 1.00 60.11 C ATOM 331 CE1 TYR A 22 0.095 9.831 3.854 1.00 51.24 C ATOM 332 CE2 TYR A 22 1.134 10.426 5.976 1.00 41.42 C ATOM 333 CZ TYR A 22 0.003 9.986 5.255 1.00 40.11 C ATOM 334 OH TYR A 22 -1.158 9.683 5.892 1.00 14.25 O ATOM 0 H TYR A 22 4.988 9.274 4.005 1.00 3.53 H new ATOM 0 HA TYR A 22 3.446 9.495 1.720 1.00 0.53 H new ATOM 0 HB2 TYR A 22 4.363 11.439 3.853 1.00 75.12 H new ATOM 0 HB3 TYR A 22 3.348 11.983 2.533 1.00 75.12 H new ATOM 0 HD1 TYR A 22 1.328 10.069 2.103 1.00 31.25 H new ATOM 0 HD2 TYR A 22 3.172 11.122 5.847 1.00 60.11 H new ATOM 0 HE1 TYR A 22 -0.748 9.445 3.301 1.00 51.24 H new ATOM 0 HE2 TYR A 22 1.093 10.498 7.053 1.00 41.42 H new ATOM 0 HH TYR A 22 -1.055 9.843 6.853 1.00 14.25 H new ATOM 344 N SER A 23 6.280 11.184 1.452 1.00 23.15 N ATOM 345 CA SER A 23 7.177 11.857 0.519 1.00 43.12 C ATOM 346 C SER A 23 7.691 10.919 -0.594 1.00 23.25 C ATOM 347 O SER A 23 8.259 11.383 -1.587 1.00 40.40 O ATOM 348 CB SER A 23 8.316 12.450 1.359 1.00 55.51 C ATOM 349 OG SER A 23 8.975 13.532 0.730 1.00 71.12 O ATOM 0 H SER A 23 6.668 11.095 2.391 1.00 23.15 H new ATOM 0 HA SER A 23 6.647 12.643 -0.018 1.00 43.12 H new ATOM 0 HB2 SER A 23 7.915 12.785 2.316 1.00 55.51 H new ATOM 0 HB3 SER A 23 9.043 11.667 1.575 1.00 55.51 H new ATOM 0 HG SER A 23 9.687 13.866 1.315 1.00 71.12 H new ATOM 355 N ARG A 24 7.497 9.603 -0.453 1.00 1.33 N ATOM 356 CA ARG A 24 7.883 8.548 -1.378 1.00 31.02 C ATOM 357 C ARG A 24 6.671 8.070 -2.182 1.00 12.42 C ATOM 358 O ARG A 24 6.780 7.015 -2.782 1.00 22.41 O ATOM 359 CB ARG A 24 8.526 7.389 -0.564 1.00 71.21 C ATOM 360 CG ARG A 24 10.061 7.334 -0.497 1.00 14.43 C ATOM 361 CD ARG A 24 10.781 8.642 -0.153 1.00 41.53 C ATOM 362 NE ARG A 24 11.053 9.482 -1.336 1.00 74.43 N ATOM 363 CZ ARG A 24 11.325 10.794 -1.278 1.00 33.03 C ATOM 364 NH1 ARG A 24 11.456 11.411 -0.105 1.00 53.44 N ATOM 365 NH2 ARG A 24 11.479 11.520 -2.375 1.00 55.43 N ATOM 0 H ARG A 24 7.032 9.227 0.373 1.00 1.33 H new ATOM 0 HA ARG A 24 8.612 8.924 -2.096 1.00 31.02 H new ATOM 0 HB2 ARG A 24 8.147 7.444 0.456 1.00 71.21 H new ATOM 0 HB3 ARG A 24 8.174 6.447 -0.985 1.00 71.21 H new ATOM 0 HG2 ARG A 24 10.343 6.585 0.243 1.00 14.43 H new ATOM 0 HG3 ARG A 24 10.432 6.985 -1.461 1.00 14.43 H new ATOM 0 HD2 ARG A 24 10.176 9.208 0.555 1.00 41.53 H new ATOM 0 HD3 ARG A 24 11.722 8.411 0.346 1.00 41.53 H new ATOM 0 HE ARG A 24 11.033 9.037 -2.254 1.00 74.43 H new ATOM 0 HH11 ARG A 24 11.349 10.885 0.763 1.00 53.44 H new ATOM 0 HH12 ARG A 24 11.663 12.409 -0.074 1.00 53.44 H new ATOM 0 HH21 ARG A 24 11.391 11.083 -3.292 1.00 55.43 H new ATOM 0 HH22 ARG A 24 11.685 12.516 -2.302 1.00 55.43 H new ATOM 379 N ILE A 25 5.519 8.750 -2.205 1.00 34.02 N ATOM 380 CA ILE A 25 4.334 8.299 -2.951 1.00 4.22 C ATOM 381 C ILE A 25 3.887 9.467 -3.843 1.00 40.24 C ATOM 382 O ILE A 25 3.830 10.602 -3.373 1.00 3.21 O ATOM 383 CB ILE A 25 3.242 7.799 -1.977 1.00 23.15 C ATOM 384 CG1 ILE A 25 3.744 6.697 -1.014 1.00 33.12 C ATOM 385 CG2 ILE A 25 2.048 7.214 -2.751 1.00 61.03 C ATOM 386 CD1 ILE A 25 2.928 6.633 0.271 1.00 54.31 C ATOM 0 H ILE A 25 5.380 9.629 -1.707 1.00 34.02 H new ATOM 0 HA ILE A 25 4.554 7.444 -3.590 1.00 4.22 H new ATOM 0 HB ILE A 25 2.952 8.674 -1.396 1.00 23.15 H new ATOM 0 HG12 ILE A 25 3.701 5.731 -1.517 1.00 33.12 H new ATOM 0 HG13 ILE A 25 4.790 6.882 -0.768 1.00 33.12 H new ATOM 0 HG21 ILE A 25 1.292 6.868 -2.046 1.00 61.03 H new ATOM 0 HG22 ILE A 25 1.620 7.982 -3.395 1.00 61.03 H new ATOM 0 HG23 ILE A 25 2.385 6.376 -3.361 1.00 61.03 H new ATOM 0 HD11 ILE A 25 3.321 5.844 0.912 1.00 54.31 H new ATOM 0 HD12 ILE A 25 2.992 7.589 0.791 1.00 54.31 H new ATOM 0 HD13 ILE A 25 1.886 6.420 0.030 1.00 54.31 H new ATOM 398 N LYS A 26 3.621 9.228 -5.139 1.00 12.45 N ATOM 399 CA LYS A 26 3.119 10.266 -6.049 1.00 35.14 C ATOM 400 C LYS A 26 1.682 10.592 -5.625 1.00 54.40 C ATOM 401 O LYS A 26 1.046 9.800 -4.922 1.00 1.14 O ATOM 402 CB LYS A 26 3.166 9.786 -7.529 1.00 20.02 C ATOM 403 CG LYS A 26 4.250 10.457 -8.403 1.00 54.32 C ATOM 404 CD LYS A 26 5.660 9.909 -8.148 1.00 31.33 C ATOM 405 CE LYS A 26 6.788 10.781 -8.712 1.00 61.33 C ATOM 406 NZ LYS A 26 6.993 10.698 -10.176 1.00 11.41 N ATOM 0 H LYS A 26 3.747 8.317 -5.580 1.00 12.45 H new ATOM 0 HA LYS A 26 3.746 11.156 -5.988 1.00 35.14 H new ATOM 0 HB2 LYS A 26 3.329 8.708 -7.540 1.00 20.02 H new ATOM 0 HB3 LYS A 26 2.192 9.966 -7.984 1.00 20.02 H new ATOM 0 HG2 LYS A 26 3.998 10.317 -9.454 1.00 54.32 H new ATOM 0 HG3 LYS A 26 4.245 11.531 -8.215 1.00 54.32 H new ATOM 0 HD2 LYS A 26 5.805 9.798 -7.073 1.00 31.33 H new ATOM 0 HD3 LYS A 26 5.734 8.913 -8.584 1.00 31.33 H new ATOM 0 HE2 LYS A 26 6.585 11.819 -8.450 1.00 61.33 H new ATOM 0 HE3 LYS A 26 7.719 10.504 -8.217 1.00 61.33 H new ATOM 0 HZ1 LYS A 26 7.776 11.324 -10.453 1.00 11.41 H new ATOM 0 HZ2 LYS A 26 7.223 9.718 -10.439 1.00 11.41 H new ATOM 0 HZ3 LYS A 26 6.124 10.993 -10.665 1.00 11.41 H new ATOM 420 N PHE A 27 1.112 11.698 -6.101 1.00 43.31 N ATOM 421 CA PHE A 27 -0.327 11.808 -6.197 1.00 61.14 C ATOM 422 C PHE A 27 -0.703 12.500 -7.511 1.00 3.15 C ATOM 423 O PHE A 27 -0.083 13.509 -7.854 1.00 23.21 O ATOM 424 CB PHE A 27 -0.942 12.483 -4.968 1.00 42.54 C ATOM 425 CG PHE A 27 -0.469 13.875 -4.588 1.00 20.45 C ATOM 426 CD1 PHE A 27 0.747 14.041 -3.898 1.00 3.14 C ATOM 427 CD2 PHE A 27 -1.289 14.994 -4.832 1.00 75.03 C ATOM 428 CE1 PHE A 27 1.147 15.316 -3.464 1.00 1.32 C ATOM 429 CE2 PHE A 27 -0.913 16.260 -4.350 1.00 20.02 C ATOM 430 CZ PHE A 27 0.305 16.424 -3.667 1.00 71.12 C ATOM 0 H PHE A 27 1.626 12.519 -6.421 1.00 43.31 H new ATOM 0 HA PHE A 27 -0.754 10.805 -6.211 1.00 61.14 H new ATOM 0 HB2 PHE A 27 -2.020 12.531 -5.122 1.00 42.54 H new ATOM 0 HB3 PHE A 27 -0.771 11.830 -4.112 1.00 42.54 H new ATOM 0 HD1 PHE A 27 1.375 13.185 -3.701 1.00 3.14 H new ATOM 0 HD2 PHE A 27 -2.207 14.879 -5.390 1.00 75.03 H new ATOM 0 HE1 PHE A 27 2.101 15.445 -2.975 1.00 1.32 H new ATOM 0 HE2 PHE A 27 -1.562 17.109 -4.505 1.00 20.02 H new ATOM 0 HZ PHE A 27 0.593 17.398 -3.299 1.00 71.12 H new ATOM 440 N PRO A 28 -1.725 12.002 -8.227 1.00 13.21 N ATOM 441 CA PRO A 28 -2.438 10.764 -7.938 1.00 71.04 C ATOM 442 C PRO A 28 -1.614 9.526 -8.314 1.00 13.14 C ATOM 443 O PRO A 28 -0.593 9.632 -8.998 1.00 75.21 O ATOM 444 CB PRO A 28 -3.703 10.833 -8.777 1.00 53.52 C ATOM 445 CG PRO A 28 -3.245 11.596 -10.013 1.00 75.42 C ATOM 446 CD PRO A 28 -2.247 12.602 -9.444 1.00 20.33 C ATOM 0 HA PRO A 28 -2.646 10.670 -6.872 1.00 71.04 H new ATOM 0 HB2 PRO A 28 -4.076 9.840 -9.029 1.00 53.52 H new ATOM 0 HB3 PRO A 28 -4.507 11.353 -8.255 1.00 53.52 H new ATOM 0 HG2 PRO A 28 -2.780 10.936 -10.746 1.00 75.42 H new ATOM 0 HG3 PRO A 28 -4.077 12.091 -10.513 1.00 75.42 H new ATOM 0 HD2 PRO A 28 -1.446 12.802 -10.155 1.00 20.33 H new ATOM 0 HD3 PRO A 28 -2.731 13.555 -9.233 1.00 20.33 H new ATOM 454 N LEU A 29 -2.070 8.353 -7.876 1.00 22.23 N ATOM 455 CA LEU A 29 -1.509 7.068 -8.296 1.00 24.32 C ATOM 456 C LEU A 29 -2.164 6.636 -9.601 1.00 4.53 C ATOM 457 O LEU A 29 -3.213 7.166 -9.976 1.00 43.54 O ATOM 458 CB LEU A 29 -1.747 5.999 -7.220 1.00 35.42 C ATOM 459 CG LEU A 29 -0.985 6.309 -5.924 1.00 71.14 C ATOM 460 CD1 LEU A 29 -1.586 5.517 -4.771 1.00 54.20 C ATOM 461 CD2 LEU A 29 0.498 5.964 -6.054 1.00 54.24 C ATOM 0 H LEU A 29 -2.843 8.266 -7.216 1.00 22.23 H new ATOM 0 HA LEU A 29 -0.435 7.181 -8.441 1.00 24.32 H new ATOM 0 HB2 LEU A 29 -2.814 5.931 -7.006 1.00 35.42 H new ATOM 0 HB3 LEU A 29 -1.435 5.026 -7.600 1.00 35.42 H new ATOM 0 HG LEU A 29 -1.074 7.378 -5.730 1.00 71.14 H new ATOM 0 HD11 LEU A 29 -1.042 5.740 -3.853 1.00 54.20 H new ATOM 0 HD12 LEU A 29 -2.634 5.792 -4.648 1.00 54.20 H new ATOM 0 HD13 LEU A 29 -1.514 4.451 -4.985 1.00 54.20 H new ATOM 0 HD21 LEU A 29 1.009 6.195 -5.119 1.00 54.24 H new ATOM 0 HD22 LEU A 29 0.607 4.902 -6.273 1.00 54.24 H new ATOM 0 HD23 LEU A 29 0.938 6.548 -6.862 1.00 54.24 H new ATOM 473 N LYS A 30 -1.573 5.641 -10.265 1.00 62.10 N ATOM 474 CA LYS A 30 -2.126 5.101 -11.514 1.00 33.23 C ATOM 475 C LYS A 30 -3.380 4.250 -11.280 1.00 1.45 C ATOM 476 O LYS A 30 -4.112 3.987 -12.232 1.00 4.24 O ATOM 477 CB LYS A 30 -1.093 4.266 -12.267 1.00 33.05 C ATOM 478 CG LYS A 30 0.216 4.975 -12.622 1.00 62.03 C ATOM 479 CD LYS A 30 1.140 3.979 -13.332 1.00 33.03 C ATOM 480 CE LYS A 30 2.583 4.481 -13.414 1.00 44.51 C ATOM 481 NZ LYS A 30 3.412 3.523 -14.166 1.00 2.31 N ATOM 0 H LYS A 30 -0.710 5.190 -9.960 1.00 62.10 H new ATOM 0 HA LYS A 30 -2.403 5.967 -12.115 1.00 33.23 H new ATOM 0 HB2 LYS A 30 -0.856 3.389 -11.665 1.00 33.05 H new ATOM 0 HB3 LYS A 30 -1.549 3.906 -13.189 1.00 33.05 H new ATOM 0 HG2 LYS A 30 0.019 5.832 -13.266 1.00 62.03 H new ATOM 0 HG3 LYS A 30 0.695 5.357 -11.721 1.00 62.03 H new ATOM 0 HD2 LYS A 30 1.119 3.026 -12.803 1.00 33.03 H new ATOM 0 HD3 LYS A 30 0.765 3.793 -14.338 1.00 33.03 H new ATOM 0 HE2 LYS A 30 2.610 5.456 -13.900 1.00 44.51 H new ATOM 0 HE3 LYS A 30 2.987 4.614 -12.411 1.00 44.51 H new ATOM 0 HZ1 LYS A 30 4.390 3.874 -14.215 1.00 2.31 H new ATOM 0 HZ2 LYS A 30 3.399 2.601 -13.685 1.00 2.31 H new ATOM 0 HZ3 LYS A 30 3.033 3.417 -15.129 1.00 2.31 H new ATOM 495 N SER A 31 -3.635 3.842 -10.042 1.00 0.35 N ATOM 496 CA SER A 31 -4.596 2.842 -9.617 1.00 51.41 C ATOM 497 C SER A 31 -5.882 3.490 -9.086 1.00 62.34 C ATOM 498 O SER A 31 -5.936 3.808 -7.898 1.00 74.12 O ATOM 499 CB SER A 31 -3.909 1.972 -8.558 1.00 53.30 C ATOM 500 OG SER A 31 -3.196 2.749 -7.601 1.00 55.43 O ATOM 0 H SER A 31 -3.131 4.237 -9.248 1.00 0.35 H new ATOM 0 HA SER A 31 -4.905 2.225 -10.461 1.00 51.41 H new ATOM 0 HB2 SER A 31 -4.658 1.367 -8.047 1.00 53.30 H new ATOM 0 HB3 SER A 31 -3.222 1.282 -9.048 1.00 53.30 H new ATOM 0 HG SER A 31 -3.782 3.451 -7.247 1.00 55.43 H new ATOM 506 N PRO A 32 -6.895 3.822 -9.904 1.00 71.11 N ATOM 507 CA PRO A 32 -8.136 4.308 -9.344 1.00 32.41 C ATOM 508 C PRO A 32 -8.814 3.192 -8.559 1.00 24.11 C ATOM 509 O PRO A 32 -8.970 2.062 -9.021 1.00 44.23 O ATOM 510 CB PRO A 32 -8.987 4.763 -10.515 1.00 74.41 C ATOM 511 CG PRO A 32 -8.502 3.893 -11.674 1.00 20.14 C ATOM 512 CD PRO A 32 -7.074 3.497 -11.304 1.00 41.24 C ATOM 0 HA PRO A 32 -7.978 5.135 -8.652 1.00 32.41 H new ATOM 0 HB2 PRO A 32 -10.049 4.615 -10.320 1.00 74.41 H new ATOM 0 HB3 PRO A 32 -8.847 5.823 -10.724 1.00 74.41 H new ATOM 0 HG2 PRO A 32 -9.135 3.014 -11.799 1.00 20.14 H new ATOM 0 HG3 PRO A 32 -8.528 4.441 -12.616 1.00 20.14 H new ATOM 0 HD2 PRO A 32 -6.911 2.433 -11.477 1.00 41.24 H new ATOM 0 HD3 PRO A 32 -6.353 4.034 -11.920 1.00 41.24 H new ATOM 520 N ILE A 33 -9.284 3.562 -7.378 1.00 64.12 N ATOM 521 CA ILE A 33 -10.275 2.802 -6.630 1.00 64.13 C ATOM 522 C ILE A 33 -11.525 2.788 -7.517 1.00 75.41 C ATOM 523 O ILE A 33 -11.853 3.829 -8.111 1.00 44.02 O ATOM 524 CB ILE A 33 -10.545 3.499 -5.276 1.00 44.21 C ATOM 525 CG1 ILE A 33 -9.261 3.712 -4.441 1.00 54.32 C ATOM 526 CG2 ILE A 33 -11.519 2.693 -4.424 1.00 41.34 C ATOM 527 CD1 ILE A 33 -9.402 4.712 -3.288 1.00 52.40 C ATOM 0 H ILE A 33 -8.983 4.413 -6.904 1.00 64.12 H new ATOM 0 HA ILE A 33 -9.949 1.787 -6.401 1.00 64.13 H new ATOM 0 HB ILE A 33 -10.967 4.470 -5.534 1.00 44.21 H new ATOM 0 HG12 ILE A 33 -8.946 2.751 -4.034 1.00 54.32 H new ATOM 0 HG13 ILE A 33 -8.466 4.053 -5.104 1.00 54.32 H new ATOM 0 HG21 ILE A 33 -11.689 3.209 -3.479 1.00 41.34 H new ATOM 0 HG22 ILE A 33 -12.465 2.587 -4.955 1.00 41.34 H new ATOM 0 HG23 ILE A 33 -11.101 1.706 -4.229 1.00 41.34 H new ATOM 0 HD11 ILE A 33 -8.452 4.795 -2.760 1.00 52.40 H new ATOM 0 HD12 ILE A 33 -9.684 5.687 -3.685 1.00 52.40 H new ATOM 0 HD13 ILE A 33 -10.171 4.365 -2.598 1.00 52.40 H new ATOM 539 N ALA A 34 -12.260 1.674 -7.583 1.00 34.34 N ATOM 540 CA ALA A 34 -13.439 1.534 -8.435 1.00 14.02 C ATOM 541 C ALA A 34 -14.499 0.672 -7.759 1.00 52.20 C ATOM 542 O ALA A 34 -14.320 -0.542 -7.716 1.00 4.13 O ATOM 543 CB ALA A 34 -13.028 0.911 -9.768 1.00 11.11 C ATOM 0 H ALA A 34 -12.049 0.837 -7.040 1.00 34.34 H new ATOM 0 HA ALA A 34 -13.867 2.521 -8.608 1.00 14.02 H new ATOM 0 HB1 ALA A 34 -13.905 0.805 -10.406 1.00 11.11 H new ATOM 0 HB2 ALA A 34 -12.297 1.553 -10.260 1.00 11.11 H new ATOM 0 HB3 ALA A 34 -12.588 -0.070 -9.591 1.00 11.11 H new ATOM 549 N LEU A 35 -15.571 1.254 -7.208 1.00 11.02 N ATOM 550 CA LEU A 35 -16.522 0.520 -6.358 1.00 15.32 C ATOM 551 C LEU A 35 -17.889 0.490 -7.010 1.00 2.04 C ATOM 552 O LEU A 35 -18.223 1.396 -7.771 1.00 32.33 O ATOM 553 CB LEU A 35 -16.689 1.143 -4.964 1.00 23.51 C ATOM 554 CG LEU A 35 -15.408 1.445 -4.179 1.00 75.24 C ATOM 555 CD1 LEU A 35 -14.330 0.360 -4.263 1.00 54.02 C ATOM 556 CD2 LEU A 35 -14.906 2.843 -4.491 1.00 73.11 C ATOM 0 H LEU A 35 -15.804 2.239 -7.336 1.00 11.02 H new ATOM 0 HA LEU A 35 -16.109 -0.482 -6.244 1.00 15.32 H new ATOM 0 HB2 LEU A 35 -17.247 2.073 -5.073 1.00 23.51 H new ATOM 0 HB3 LEU A 35 -17.303 0.472 -4.364 1.00 23.51 H new ATOM 0 HG LEU A 35 -15.679 1.424 -3.124 1.00 75.24 H new ATOM 0 HD11 LEU A 35 -13.462 0.663 -3.677 1.00 54.02 H new ATOM 0 HD12 LEU A 35 -14.725 -0.577 -3.869 1.00 54.02 H new ATOM 0 HD13 LEU A 35 -14.034 0.221 -5.303 1.00 54.02 H new ATOM 0 HD21 LEU A 35 -13.996 3.038 -3.924 1.00 73.11 H new ATOM 0 HD22 LEU A 35 -14.693 2.924 -5.557 1.00 73.11 H new ATOM 0 HD23 LEU A 35 -15.668 3.573 -4.217 1.00 73.11 H new ATOM 568 N LEU A 36 -18.683 -0.517 -6.663 1.00 43.43 N ATOM 569 CA LEU A 36 -20.027 -0.677 -7.197 1.00 32.42 C ATOM 570 C LEU A 36 -20.953 0.306 -6.493 1.00 14.43 C ATOM 571 O LEU A 36 -20.769 0.629 -5.316 1.00 23.22 O ATOM 572 CB LEU A 36 -20.506 -2.122 -7.010 1.00 74.34 C ATOM 573 CG LEU A 36 -19.934 -3.120 -8.039 1.00 75.30 C ATOM 574 CD1 LEU A 36 -18.425 -3.038 -8.301 1.00 43.03 C ATOM 575 CD2 LEU A 36 -20.268 -4.525 -7.536 1.00 21.34 C ATOM 0 H LEU A 36 -18.411 -1.245 -6.003 1.00 43.43 H new ATOM 0 HA LEU A 36 -20.031 -0.467 -8.267 1.00 32.42 H new ATOM 0 HB2 LEU A 36 -20.234 -2.455 -6.008 1.00 74.34 H new ATOM 0 HB3 LEU A 36 -21.594 -2.142 -7.068 1.00 74.34 H new ATOM 0 HG LEU A 36 -20.392 -2.867 -8.995 1.00 75.30 H new ATOM 0 HD11 LEU A 36 -18.143 -3.787 -9.041 1.00 43.03 H new ATOM 0 HD12 LEU A 36 -18.174 -2.046 -8.676 1.00 43.03 H new ATOM 0 HD13 LEU A 36 -17.884 -3.223 -7.373 1.00 43.03 H new ATOM 0 HD21 LEU A 36 -19.880 -5.264 -8.237 1.00 21.34 H new ATOM 0 HD22 LEU A 36 -19.813 -4.679 -6.558 1.00 21.34 H new ATOM 0 HD23 LEU A 36 -21.349 -4.635 -7.455 1.00 21.34 H new ATOM 587 N LYS A 37 -21.968 0.786 -7.210 1.00 4.02 N ATOM 588 CA LYS A 37 -22.816 1.898 -6.781 1.00 51.01 C ATOM 589 C LYS A 37 -24.020 1.392 -5.980 1.00 41.31 C ATOM 590 O LYS A 37 -25.105 1.956 -6.112 1.00 35.15 O ATOM 591 CB LYS A 37 -23.231 2.709 -8.023 1.00 1.42 C ATOM 592 CG LYS A 37 -22.022 3.250 -8.806 1.00 12.43 C ATOM 593 CD LYS A 37 -22.398 3.809 -10.180 1.00 4.03 C ATOM 594 CE LYS A 37 -22.708 5.306 -10.177 1.00 75.12 C ATOM 595 NZ LYS A 37 -24.033 5.634 -9.617 1.00 33.15 N ATOM 0 H LYS A 37 -22.229 0.407 -8.120 1.00 4.02 H new ATOM 0 HA LYS A 37 -22.262 2.554 -6.110 1.00 51.01 H new ATOM 0 HB2 LYS A 37 -23.832 2.080 -8.679 1.00 1.42 H new ATOM 0 HB3 LYS A 37 -23.862 3.542 -7.714 1.00 1.42 H new ATOM 0 HG2 LYS A 37 -21.539 4.033 -8.222 1.00 12.43 H new ATOM 0 HG3 LYS A 37 -21.292 2.451 -8.933 1.00 12.43 H new ATOM 0 HD2 LYS A 37 -21.580 3.619 -10.875 1.00 4.03 H new ATOM 0 HD3 LYS A 37 -23.267 3.269 -10.556 1.00 4.03 H new ATOM 0 HE2 LYS A 37 -21.941 5.826 -9.603 1.00 75.12 H new ATOM 0 HE3 LYS A 37 -22.651 5.682 -11.198 1.00 75.12 H new ATOM 0 HZ1 LYS A 37 -24.278 6.616 -9.857 1.00 33.15 H new ATOM 0 HZ2 LYS A 37 -24.747 4.992 -10.016 1.00 33.15 H new ATOM 0 HZ3 LYS A 37 -24.009 5.526 -8.583 1.00 33.15 H new ATOM 609 N ASP A 38 -23.841 0.313 -5.207 1.00 73.22 N ATOM 610 CA ASP A 38 -24.928 -0.479 -4.608 1.00 52.23 C ATOM 611 C ASP A 38 -26.017 -0.771 -5.652 1.00 71.31 C ATOM 612 O ASP A 38 -27.219 -0.656 -5.409 1.00 75.42 O ATOM 613 CB ASP A 38 -25.437 0.198 -3.324 1.00 23.34 C ATOM 614 CG ASP A 38 -26.441 -0.641 -2.524 1.00 41.11 C ATOM 615 OD1 ASP A 38 -26.566 -1.875 -2.727 1.00 14.24 O ATOM 616 OD2 ASP A 38 -27.086 -0.049 -1.627 1.00 41.33 O ATOM 0 H ASP A 38 -22.914 -0.044 -4.974 1.00 73.22 H new ATOM 0 HA ASP A 38 -24.555 -1.455 -4.297 1.00 52.23 H new ATOM 0 HB2 ASP A 38 -24.584 0.428 -2.686 1.00 23.34 H new ATOM 0 HB3 ASP A 38 -25.903 1.147 -3.588 1.00 23.34 H new ATOM 621 N ASP A 39 -25.573 -1.115 -6.864 1.00 34.13 N ATOM 622 CA ASP A 39 -26.402 -1.266 -8.049 1.00 33.41 C ATOM 623 C ASP A 39 -25.715 -2.295 -8.949 1.00 31.41 C ATOM 624 O ASP A 39 -25.447 -2.048 -10.124 1.00 14.03 O ATOM 625 CB ASP A 39 -26.621 0.102 -8.695 1.00 54.33 C ATOM 626 CG ASP A 39 -27.571 0.080 -9.892 1.00 72.50 C ATOM 627 OD1 ASP A 39 -28.432 -0.820 -9.993 1.00 21.32 O ATOM 628 OD2 ASP A 39 -27.507 1.031 -10.708 1.00 3.22 O ATOM 0 H ASP A 39 -24.587 -1.302 -7.047 1.00 34.13 H new ATOM 0 HA ASP A 39 -27.402 -1.638 -7.825 1.00 33.41 H new ATOM 0 HB2 ASP A 39 -27.014 0.788 -7.945 1.00 54.33 H new ATOM 0 HB3 ASP A 39 -25.658 0.499 -9.016 1.00 54.33 H new ATOM 633 N GLY A 40 -25.342 -3.425 -8.342 1.00 52.34 N ATOM 634 CA GLY A 40 -24.801 -4.645 -8.918 1.00 64.14 C ATOM 635 C GLY A 40 -23.678 -4.434 -9.919 1.00 0.22 C ATOM 636 O GLY A 40 -22.522 -4.360 -9.517 1.00 0.15 O ATOM 0 H GLY A 40 -25.423 -3.509 -7.329 1.00 52.34 H new ATOM 0 HA2 GLY A 40 -24.435 -5.280 -8.111 1.00 64.14 H new ATOM 0 HA3 GLY A 40 -25.609 -5.188 -9.409 1.00 64.14 H new ATOM 640 N GLU A 41 -23.990 -4.390 -11.209 1.00 11.35 N ATOM 641 CA GLU A 41 -23.015 -4.321 -12.290 1.00 72.42 C ATOM 642 C GLU A 41 -22.734 -2.863 -12.651 1.00 0.24 C ATOM 643 O GLU A 41 -22.920 -2.423 -13.789 1.00 74.52 O ATOM 644 CB GLU A 41 -23.495 -5.133 -13.493 1.00 51.31 C ATOM 645 CG GLU A 41 -23.557 -6.637 -13.195 1.00 0.23 C ATOM 646 CD GLU A 41 -23.589 -7.444 -14.491 1.00 61.54 C ATOM 647 OE1 GLU A 41 -22.540 -7.505 -15.175 1.00 72.43 O ATOM 648 OE2 GLU A 41 -24.641 -8.028 -14.833 1.00 4.11 O ATOM 0 H GLU A 41 -24.955 -4.402 -11.540 1.00 11.35 H new ATOM 0 HA GLU A 41 -22.075 -4.763 -11.959 1.00 72.42 H new ATOM 0 HB2 GLU A 41 -24.483 -4.784 -13.793 1.00 51.31 H new ATOM 0 HB3 GLU A 41 -22.826 -4.959 -14.336 1.00 51.31 H new ATOM 0 HG2 GLU A 41 -22.693 -6.931 -12.599 1.00 0.23 H new ATOM 0 HG3 GLU A 41 -24.444 -6.859 -12.601 1.00 0.23 H new ATOM 655 N THR A 42 -22.288 -2.105 -11.654 1.00 13.31 N ATOM 656 CA THR A 42 -21.985 -0.690 -11.800 1.00 33.54 C ATOM 657 C THR A 42 -20.491 -0.406 -11.718 1.00 1.43 C ATOM 658 O THR A 42 -19.842 -0.621 -10.695 1.00 63.23 O ATOM 659 CB THR A 42 -22.802 0.165 -10.827 1.00 0.44 C ATOM 660 OG1 THR A 42 -23.195 -0.526 -9.653 1.00 23.32 O ATOM 661 CG2 THR A 42 -24.036 0.684 -11.561 1.00 63.14 C ATOM 0 H THR A 42 -22.126 -2.462 -10.713 1.00 13.31 H new ATOM 0 HA THR A 42 -22.290 -0.400 -12.805 1.00 33.54 H new ATOM 0 HB THR A 42 -22.163 0.982 -10.493 1.00 0.44 H new ATOM 0 HG1 THR A 42 -23.904 -1.166 -9.872 1.00 23.32 H new ATOM 0 HG21 THR A 42 -24.632 1.296 -10.884 1.00 63.14 H new ATOM 0 HG22 THR A 42 -23.725 1.286 -12.415 1.00 63.14 H new ATOM 0 HG23 THR A 42 -24.634 -0.159 -11.909 1.00 63.14 H new ATOM 669 N GLU A 43 -19.964 0.121 -12.816 1.00 51.24 N ATOM 670 CA GLU A 43 -18.650 0.730 -12.895 1.00 11.31 C ATOM 671 C GLU A 43 -18.731 2.153 -12.362 1.00 74.42 C ATOM 672 O GLU A 43 -19.740 2.847 -12.530 1.00 24.43 O ATOM 673 CB GLU A 43 -18.173 0.758 -14.351 1.00 51.44 C ATOM 674 CG GLU A 43 -17.550 -0.583 -14.726 1.00 43.22 C ATOM 675 CD GLU A 43 -17.634 -0.831 -16.231 1.00 74.23 C ATOM 676 OE1 GLU A 43 -16.811 -0.266 -16.990 1.00 54.13 O ATOM 677 OE2 GLU A 43 -18.507 -1.601 -16.689 1.00 22.23 O ATOM 0 H GLU A 43 -20.461 0.135 -13.706 1.00 51.24 H new ATOM 0 HA GLU A 43 -17.944 0.149 -12.301 1.00 11.31 H new ATOM 0 HB2 GLU A 43 -19.012 0.975 -15.012 1.00 51.44 H new ATOM 0 HB3 GLU A 43 -17.444 1.557 -14.487 1.00 51.44 H new ATOM 0 HG2 GLU A 43 -16.507 -0.603 -14.409 1.00 43.22 H new ATOM 0 HG3 GLU A 43 -18.061 -1.385 -14.194 1.00 43.22 H new ATOM 684 N GLN A 44 -17.641 2.578 -11.731 1.00 42.34 N ATOM 685 CA GLN A 44 -17.453 3.885 -11.111 1.00 22.14 C ATOM 686 C GLN A 44 -15.961 3.989 -10.746 1.00 32.13 C ATOM 687 O GLN A 44 -15.369 2.969 -10.399 1.00 41.00 O ATOM 688 CB GLN A 44 -18.333 3.901 -9.850 1.00 63.52 C ATOM 689 CG GLN A 44 -18.630 5.248 -9.197 1.00 32.12 C ATOM 690 CD GLN A 44 -17.426 5.879 -8.533 1.00 35.32 C ATOM 691 OE1 GLN A 44 -17.053 7.015 -8.801 1.00 64.54 O ATOM 692 NE2 GLN A 44 -16.806 5.132 -7.643 1.00 61.21 N ATOM 0 H GLN A 44 -16.817 1.985 -11.633 1.00 42.34 H new ATOM 0 HA GLN A 44 -17.727 4.720 -11.756 1.00 22.14 H new ATOM 0 HB2 GLN A 44 -19.286 3.436 -10.103 1.00 63.52 H new ATOM 0 HB3 GLN A 44 -17.856 3.266 -9.103 1.00 63.52 H new ATOM 0 HG2 GLN A 44 -19.017 5.931 -9.953 1.00 32.12 H new ATOM 0 HG3 GLN A 44 -19.417 5.116 -8.454 1.00 32.12 H new ATOM 0 HE21 GLN A 44 -17.143 4.190 -7.444 1.00 61.21 H new ATOM 0 HE22 GLN A 44 -15.989 5.495 -7.153 1.00 61.21 H new ATOM 701 N THR A 45 -15.330 5.168 -10.749 1.00 42.21 N ATOM 702 CA THR A 45 -13.897 5.317 -10.436 1.00 33.54 C ATOM 703 C THR A 45 -13.629 6.610 -9.669 1.00 63.41 C ATOM 704 O THR A 45 -14.333 7.599 -9.866 1.00 74.43 O ATOM 705 CB THR A 45 -13.049 5.296 -11.723 1.00 14.45 C ATOM 706 OG1 THR A 45 -13.483 6.257 -12.668 1.00 35.11 O ATOM 707 CG2 THR A 45 -13.021 3.922 -12.377 1.00 52.40 C ATOM 0 H THR A 45 -15.795 6.049 -10.968 1.00 42.21 H new ATOM 0 HA THR A 45 -13.613 4.473 -9.808 1.00 33.54 H new ATOM 0 HB THR A 45 -12.037 5.550 -11.407 1.00 14.45 H new ATOM 0 HG1 THR A 45 -12.917 6.210 -13.466 1.00 35.11 H new ATOM 0 HG21 THR A 45 -12.411 3.961 -13.279 1.00 52.40 H new ATOM 0 HG22 THR A 45 -12.596 3.197 -11.683 1.00 52.40 H new ATOM 0 HG23 THR A 45 -14.036 3.623 -12.638 1.00 52.40 H new ATOM 715 N PHE A 46 -12.614 6.611 -8.796 1.00 40.23 N ATOM 716 CA PHE A 46 -12.250 7.762 -7.957 1.00 53.41 C ATOM 717 C PHE A 46 -10.806 8.198 -8.225 1.00 11.15 C ATOM 718 O PHE A 46 -10.004 7.381 -8.693 1.00 4.41 O ATOM 719 CB PHE A 46 -12.446 7.426 -6.459 1.00 31.32 C ATOM 720 CG PHE A 46 -13.720 7.969 -5.838 1.00 32.35 C ATOM 721 CD1 PHE A 46 -14.947 7.848 -6.512 1.00 54.10 C ATOM 722 CD2 PHE A 46 -13.685 8.611 -4.584 1.00 44.13 C ATOM 723 CE1 PHE A 46 -16.116 8.419 -5.986 1.00 35.52 C ATOM 724 CE2 PHE A 46 -14.858 9.169 -4.048 1.00 44.04 C ATOM 725 CZ PHE A 46 -16.066 9.090 -4.757 1.00 75.11 C ATOM 0 H PHE A 46 -12.013 5.800 -8.650 1.00 40.23 H new ATOM 0 HA PHE A 46 -12.909 8.591 -8.215 1.00 53.41 H new ATOM 0 HB2 PHE A 46 -12.436 6.342 -6.342 1.00 31.32 H new ATOM 0 HB3 PHE A 46 -11.594 7.815 -5.901 1.00 31.32 H new ATOM 0 HD1 PHE A 46 -14.991 7.309 -7.447 1.00 54.10 H new ATOM 0 HD2 PHE A 46 -12.757 8.674 -4.035 1.00 44.13 H new ATOM 0 HE1 PHE A 46 -17.049 8.342 -6.525 1.00 35.52 H new ATOM 0 HE2 PHE A 46 -14.829 9.660 -3.087 1.00 44.04 H new ATOM 0 HZ PHE A 46 -16.958 9.547 -4.355 1.00 75.11 H new ATOM 735 N PRO A 47 -10.432 9.437 -7.866 1.00 31.15 N ATOM 736 CA PRO A 47 -9.045 9.882 -7.832 1.00 15.03 C ATOM 737 C PRO A 47 -8.314 9.287 -6.622 1.00 61.21 C ATOM 738 O PRO A 47 -8.689 9.560 -5.472 1.00 44.13 O ATOM 739 CB PRO A 47 -9.120 11.410 -7.766 1.00 60.32 C ATOM 740 CG PRO A 47 -10.445 11.678 -7.050 1.00 64.20 C ATOM 741 CD PRO A 47 -11.333 10.528 -7.511 1.00 41.43 C ATOM 0 HA PRO A 47 -8.480 9.554 -8.704 1.00 15.03 H new ATOM 0 HB2 PRO A 47 -8.277 11.829 -7.217 1.00 60.32 H new ATOM 0 HB3 PRO A 47 -9.105 11.855 -8.761 1.00 60.32 H new ATOM 0 HG2 PRO A 47 -10.323 11.682 -5.967 1.00 64.20 H new ATOM 0 HG3 PRO A 47 -10.864 12.645 -7.328 1.00 64.20 H new ATOM 0 HD2 PRO A 47 -12.019 10.225 -6.720 1.00 41.43 H new ATOM 0 HD3 PRO A 47 -11.942 10.824 -8.365 1.00 41.43 H new ATOM 749 N PHE A 48 -7.275 8.471 -6.854 1.00 75.51 N ATOM 750 CA PHE A 48 -6.455 7.987 -5.750 1.00 31.25 C ATOM 751 C PHE A 48 -5.448 9.079 -5.406 1.00 72.30 C ATOM 752 O PHE A 48 -4.601 9.400 -6.239 1.00 40.44 O ATOM 753 CB PHE A 48 -5.750 6.653 -6.022 1.00 40.23 C ATOM 754 CG PHE A 48 -5.479 5.888 -4.728 1.00 60.20 C ATOM 755 CD1 PHE A 48 -4.855 6.494 -3.615 1.00 71.12 C ATOM 756 CD2 PHE A 48 -5.944 4.570 -4.594 1.00 1.43 C ATOM 757 CE1 PHE A 48 -4.802 5.840 -2.374 1.00 73.41 C ATOM 758 CE2 PHE A 48 -5.882 3.904 -3.358 1.00 0.31 C ATOM 759 CZ PHE A 48 -5.345 4.554 -2.236 1.00 75.34 C ATOM 0 H PHE A 48 -6.992 8.142 -7.777 1.00 75.51 H new ATOM 0 HA PHE A 48 -7.116 7.776 -4.910 1.00 31.25 H new ATOM 0 HB2 PHE A 48 -6.365 6.044 -6.684 1.00 40.23 H new ATOM 0 HB3 PHE A 48 -4.809 6.837 -6.541 1.00 40.23 H new ATOM 0 HD1 PHE A 48 -4.413 7.474 -3.720 1.00 71.12 H new ATOM 0 HD2 PHE A 48 -6.355 4.061 -5.453 1.00 1.43 H new ATOM 0 HE1 PHE A 48 -4.343 6.327 -1.526 1.00 73.41 H new ATOM 0 HE2 PHE A 48 -6.248 2.892 -3.272 1.00 0.31 H new ATOM 0 HZ PHE A 48 -5.350 4.067 -1.272 1.00 75.34 H new ATOM 769 N THR A 49 -5.517 9.651 -4.205 1.00 32.51 N ATOM 770 CA THR A 49 -4.606 10.709 -3.765 1.00 53.03 C ATOM 771 C THR A 49 -3.999 10.385 -2.391 1.00 43.22 C ATOM 772 O THR A 49 -4.225 9.307 -1.844 1.00 13.35 O ATOM 773 CB THR A 49 -5.339 12.059 -3.804 1.00 14.31 C ATOM 774 OG1 THR A 49 -6.443 12.046 -2.922 1.00 0.11 O ATOM 775 CG2 THR A 49 -5.820 12.445 -5.208 1.00 41.11 C ATOM 0 H THR A 49 -6.211 9.392 -3.504 1.00 32.51 H new ATOM 0 HA THR A 49 -3.759 10.775 -4.448 1.00 53.03 H new ATOM 0 HB THR A 49 -4.611 12.808 -3.491 1.00 14.31 H new ATOM 0 HG1 THR A 49 -6.899 12.913 -2.956 1.00 0.11 H new ATOM 0 HG21 THR A 49 -6.329 13.408 -5.166 1.00 41.11 H new ATOM 0 HG22 THR A 49 -4.964 12.516 -5.879 1.00 41.11 H new ATOM 0 HG23 THR A 49 -6.509 11.686 -5.578 1.00 41.11 H new ATOM 783 N ARG A 50 -3.215 11.304 -1.810 1.00 1.13 N ATOM 784 CA ARG A 50 -2.621 11.115 -0.481 1.00 14.44 C ATOM 785 C ARG A 50 -3.683 11.040 0.620 1.00 24.32 C ATOM 786 O ARG A 50 -3.428 10.528 1.707 1.00 42.43 O ATOM 787 CB ARG A 50 -1.691 12.301 -0.175 1.00 21.21 C ATOM 788 CG ARG A 50 -0.721 12.014 0.977 1.00 24.11 C ATOM 789 CD ARG A 50 -0.660 13.189 1.949 1.00 42.43 C ATOM 790 NE ARG A 50 -1.749 13.164 2.947 1.00 2.45 N ATOM 791 CZ ARG A 50 -1.975 14.099 3.884 1.00 54.20 C ATOM 792 NH1 ARG A 50 -1.252 15.216 3.930 1.00 23.11 N ATOM 793 NH2 ARG A 50 -2.901 13.903 4.805 1.00 20.23 N ATOM 0 H ARG A 50 -2.976 12.195 -2.246 1.00 1.13 H new ATOM 0 HA ARG A 50 -2.074 10.172 -0.495 1.00 14.44 H new ATOM 0 HB2 ARG A 50 -1.121 12.550 -1.070 1.00 21.21 H new ATOM 0 HB3 ARG A 50 -2.294 13.175 0.073 1.00 21.21 H new ATOM 0 HG2 ARG A 50 -1.037 11.115 1.507 1.00 24.11 H new ATOM 0 HG3 ARG A 50 0.274 11.816 0.578 1.00 24.11 H new ATOM 0 HD2 ARG A 50 0.300 13.178 2.465 1.00 42.43 H new ATOM 0 HD3 ARG A 50 -0.709 14.122 1.388 1.00 42.43 H new ATOM 0 HE ARG A 50 -2.385 12.367 2.922 1.00 2.45 H new ATOM 0 HH11 ARG A 50 -0.512 15.373 3.246 1.00 23.11 H new ATOM 0 HH12 ARG A 50 -1.438 15.915 4.649 1.00 23.11 H new ATOM 0 HH21 ARG A 50 -3.446 13.041 4.805 1.00 20.23 H new ATOM 0 HH22 ARG A 50 -3.072 14.614 5.516 1.00 20.23 H new ATOM 807 N GLU A 51 -4.866 11.581 0.363 1.00 53.33 N ATOM 808 CA GLU A 51 -5.915 11.892 1.329 1.00 21.21 C ATOM 809 C GLU A 51 -6.864 10.701 1.467 1.00 13.02 C ATOM 810 O GLU A 51 -8.084 10.853 1.515 1.00 24.13 O ATOM 811 CB GLU A 51 -6.562 13.198 0.828 1.00 13.22 C ATOM 812 CG GLU A 51 -7.419 13.958 1.846 1.00 60.10 C ATOM 813 CD GLU A 51 -7.648 15.387 1.349 1.00 62.13 C ATOM 814 OE1 GLU A 51 -6.766 16.257 1.574 1.00 71.41 O ATOM 815 OE2 GLU A 51 -8.666 15.664 0.679 1.00 13.23 O ATOM 0 H GLU A 51 -5.138 11.831 -0.588 1.00 53.33 H new ATOM 0 HA GLU A 51 -5.551 12.056 2.343 1.00 21.21 H new ATOM 0 HB2 GLU A 51 -5.770 13.862 0.482 1.00 13.22 H new ATOM 0 HB3 GLU A 51 -7.183 12.964 -0.037 1.00 13.22 H new ATOM 0 HG2 GLU A 51 -8.374 13.452 1.984 1.00 60.10 H new ATOM 0 HG3 GLU A 51 -6.923 13.974 2.816 1.00 60.10 H new ATOM 822 N LYS A 52 -6.277 9.506 1.439 1.00 22.45 N ATOM 823 CA LYS A 52 -6.871 8.174 1.451 1.00 54.12 C ATOM 824 C LYS A 52 -5.724 7.149 1.435 1.00 15.44 C ATOM 825 O LYS A 52 -5.791 6.138 0.741 1.00 63.13 O ATOM 826 CB LYS A 52 -7.904 8.001 0.312 1.00 43.41 C ATOM 827 CG LYS A 52 -7.408 8.520 -1.041 1.00 53.31 C ATOM 828 CD LYS A 52 -8.199 7.962 -2.221 1.00 74.53 C ATOM 829 CE LYS A 52 -9.673 8.367 -2.378 1.00 62.22 C ATOM 830 NZ LYS A 52 -9.855 9.785 -2.769 1.00 31.51 N ATOM 0 H LYS A 52 -5.260 9.443 1.403 1.00 22.45 H new ATOM 0 HA LYS A 52 -7.454 8.012 2.358 1.00 54.12 H new ATOM 0 HB2 LYS A 52 -8.157 6.945 0.218 1.00 43.41 H new ATOM 0 HB3 LYS A 52 -8.821 8.525 0.580 1.00 43.41 H new ATOM 0 HG2 LYS A 52 -7.470 9.608 -1.051 1.00 53.31 H new ATOM 0 HG3 LYS A 52 -6.356 8.260 -1.160 1.00 53.31 H new ATOM 0 HD2 LYS A 52 -7.678 8.250 -3.134 1.00 74.53 H new ATOM 0 HD3 LYS A 52 -8.160 6.874 -2.161 1.00 74.53 H new ATOM 0 HE2 LYS A 52 -10.140 7.728 -3.128 1.00 62.22 H new ATOM 0 HE3 LYS A 52 -10.194 8.187 -1.437 1.00 62.22 H new ATOM 0 HZ1 LYS A 52 -10.868 10.021 -2.759 1.00 31.51 H new ATOM 0 HZ2 LYS A 52 -9.350 10.398 -2.097 1.00 31.51 H new ATOM 0 HZ3 LYS A 52 -9.475 9.933 -3.726 1.00 31.51 H new ATOM 844 N TRP A 53 -4.618 7.458 2.125 1.00 32.35 N ATOM 845 CA TRP A 53 -3.472 6.562 2.289 1.00 35.22 C ATOM 846 C TRP A 53 -3.303 6.209 3.771 1.00 43.10 C ATOM 847 O TRP A 53 -3.767 6.955 4.631 1.00 34.15 O ATOM 848 CB TRP A 53 -2.219 7.250 1.719 1.00 55.14 C ATOM 849 CG TRP A 53 -0.951 6.455 1.842 1.00 12.13 C ATOM 850 CD1 TRP A 53 -0.129 6.444 2.918 1.00 23.12 C ATOM 851 CD2 TRP A 53 -0.456 5.399 0.973 1.00 55.52 C ATOM 852 NE1 TRP A 53 0.808 5.429 2.792 1.00 74.12 N ATOM 853 CE2 TRP A 53 0.613 4.719 1.631 1.00 62.34 C ATOM 854 CE3 TRP A 53 -0.879 4.909 -0.276 1.00 13.44 C ATOM 855 CZ2 TRP A 53 1.200 3.567 1.091 1.00 60.12 C ATOM 856 CZ3 TRP A 53 -0.271 3.780 -0.837 1.00 53.30 C ATOM 857 CH2 TRP A 53 0.758 3.103 -0.161 1.00 74.11 C ATOM 0 H TRP A 53 -4.495 8.356 2.593 1.00 32.35 H new ATOM 0 HA TRP A 53 -3.631 5.631 1.745 1.00 35.22 H new ATOM 0 HB2 TRP A 53 -2.391 7.472 0.666 1.00 55.14 H new ATOM 0 HB3 TRP A 53 -2.083 8.205 2.227 1.00 55.14 H new ATOM 0 HD1 TRP A 53 -0.194 7.126 3.753 1.00 23.12 H new ATOM 0 HE1 TRP A 53 1.544 5.235 3.471 1.00 74.12 H new ATOM 0 HE3 TRP A 53 -1.678 5.407 -0.805 1.00 13.44 H new ATOM 0 HZ2 TRP A 53 1.978 3.044 1.627 1.00 60.12 H new ATOM 0 HZ3 TRP A 53 -0.597 3.424 -1.803 1.00 53.30 H new ATOM 0 HH2 TRP A 53 1.209 2.227 -0.603 1.00 74.11 H new ATOM 868 N ALA A 54 -2.574 5.123 4.066 1.00 34.24 N ATOM 869 CA ALA A 54 -2.263 4.644 5.412 1.00 73.12 C ATOM 870 C ALA A 54 -0.922 3.952 5.477 1.00 74.02 C ATOM 871 O ALA A 54 -0.397 3.459 4.476 1.00 33.43 O ATOM 872 CB ALA A 54 -3.309 3.596 5.801 1.00 22.44 C ATOM 0 H ALA A 54 -2.170 4.532 3.339 1.00 34.24 H new ATOM 0 HA ALA A 54 -2.254 5.510 6.074 1.00 73.12 H new ATOM 0 HB1 ALA A 54 -3.096 3.224 6.803 1.00 22.44 H new ATOM 0 HB2 ALA A 54 -4.301 4.048 5.785 1.00 22.44 H new ATOM 0 HB3 ALA A 54 -3.276 2.768 5.092 1.00 22.44 H new ATOM 878 N LEU A 55 -0.389 3.952 6.688 1.00 41.50 N ATOM 879 CA LEU A 55 1.010 3.791 6.959 1.00 22.14 C ATOM 880 C LEU A 55 1.331 2.354 7.368 1.00 71.04 C ATOM 881 O LEU A 55 0.517 1.700 8.021 1.00 54.51 O ATOM 882 CB LEU A 55 1.382 4.826 8.024 1.00 41.12 C ATOM 883 CG LEU A 55 0.946 6.278 7.707 1.00 24.01 C ATOM 884 CD1 LEU A 55 0.865 6.694 6.239 1.00 62.33 C ATOM 885 CD2 LEU A 55 -0.196 6.802 8.559 1.00 74.44 C ATOM 0 H LEU A 55 -0.949 4.069 7.533 1.00 41.50 H new ATOM 0 HA LEU A 55 1.612 3.966 6.067 1.00 22.14 H new ATOM 0 HB2 LEU A 55 0.934 4.527 8.972 1.00 41.12 H new ATOM 0 HB3 LEU A 55 2.463 4.809 8.163 1.00 41.12 H new ATOM 0 HG LEU A 55 1.832 6.820 8.037 1.00 24.01 H new ATOM 0 HD11 LEU A 55 0.547 7.735 6.173 1.00 62.33 H new ATOM 0 HD12 LEU A 55 1.845 6.583 5.775 1.00 62.33 H new ATOM 0 HD13 LEU A 55 0.145 6.061 5.721 1.00 62.33 H new ATOM 0 HD21 LEU A 55 -0.430 7.825 8.264 1.00 74.44 H new ATOM 0 HD22 LEU A 55 -1.075 6.173 8.416 1.00 74.44 H new ATOM 0 HD23 LEU A 55 0.096 6.785 9.609 1.00 74.44 H new ATOM 897 N LEU A 56 2.487 1.869 6.907 1.00 12.11 N ATOM 898 CA LEU A 56 2.877 0.460 6.921 1.00 11.54 C ATOM 899 C LEU A 56 4.110 0.241 7.808 1.00 35.11 C ATOM 900 O LEU A 56 4.896 1.171 8.006 1.00 61.03 O ATOM 901 CB LEU A 56 3.168 0.020 5.477 1.00 1.33 C ATOM 902 CG LEU A 56 1.959 0.088 4.520 1.00 44.21 C ATOM 903 CD1 LEU A 56 2.444 -0.051 3.080 1.00 60.21 C ATOM 904 CD2 LEU A 56 0.960 -1.037 4.813 1.00 3.21 C ATOM 0 H LEU A 56 3.202 2.471 6.499 1.00 12.11 H new ATOM 0 HA LEU A 56 2.065 -0.138 7.336 1.00 11.54 H new ATOM 0 HB2 LEU A 56 3.966 0.645 5.076 1.00 1.33 H new ATOM 0 HB3 LEU A 56 3.543 -1.003 5.493 1.00 1.33 H new ATOM 0 HG LEU A 56 1.463 1.047 4.666 1.00 44.21 H new ATOM 0 HD11 LEU A 56 1.591 -0.003 2.403 1.00 60.21 H new ATOM 0 HD12 LEU A 56 3.136 0.759 2.850 1.00 60.21 H new ATOM 0 HD13 LEU A 56 2.951 -1.008 2.958 1.00 60.21 H new ATOM 0 HD21 LEU A 56 0.118 -0.965 4.124 1.00 3.21 H new ATOM 0 HD22 LEU A 56 1.451 -2.002 4.686 1.00 3.21 H new ATOM 0 HD23 LEU A 56 0.599 -0.945 5.837 1.00 3.21 H new ATOM 916 N ASP A 57 4.330 -0.998 8.278 1.00 52.54 N ATOM 917 CA ASP A 57 5.307 -1.330 9.330 1.00 31.44 C ATOM 918 C ASP A 57 6.353 -2.333 8.853 1.00 24.04 C ATOM 919 O ASP A 57 6.197 -2.992 7.819 1.00 11.31 O ATOM 920 CB ASP A 57 4.616 -1.950 10.552 1.00 22.43 C ATOM 921 CG ASP A 57 3.676 -0.982 11.242 1.00 71.12 C ATOM 922 OD1 ASP A 57 4.154 -0.237 12.125 1.00 3.40 O ATOM 923 OD2 ASP A 57 2.456 -1.039 10.966 1.00 21.43 O ATOM 0 H ASP A 57 3.824 -1.813 7.931 1.00 52.54 H new ATOM 0 HA ASP A 57 5.789 -0.387 9.590 1.00 31.44 H new ATOM 0 HB2 ASP A 57 4.058 -2.833 10.240 1.00 22.43 H new ATOM 0 HB3 ASP A 57 5.372 -2.285 11.262 1.00 22.43 H new ATOM 928 N GLU A 58 7.424 -2.487 9.638 1.00 13.31 N ATOM 929 CA GLU A 58 8.550 -3.341 9.288 1.00 33.42 C ATOM 930 C GLU A 58 8.152 -4.810 9.197 1.00 3.44 C ATOM 931 O GLU A 58 8.752 -5.556 8.419 1.00 1.23 O ATOM 932 CB GLU A 58 9.637 -3.244 10.344 1.00 52.34 C ATOM 933 CG GLU A 58 10.263 -1.870 10.542 1.00 74.24 C ATOM 934 CD GLU A 58 11.651 -2.030 11.155 1.00 51.21 C ATOM 935 OE1 GLU A 58 11.788 -2.513 12.300 1.00 1.10 O ATOM 936 OE2 GLU A 58 12.660 -1.843 10.436 1.00 3.34 O ATOM 0 H GLU A 58 7.529 -2.018 10.538 1.00 13.31 H new ATOM 0 HA GLU A 58 8.903 -2.994 8.317 1.00 33.42 H new ATOM 0 HB2 GLU A 58 9.219 -3.570 11.296 1.00 52.34 H new ATOM 0 HB3 GLU A 58 10.429 -3.947 10.086 1.00 52.34 H new ATOM 0 HG2 GLU A 58 10.333 -1.349 9.587 1.00 74.24 H new ATOM 0 HG3 GLU A 58 9.634 -1.262 11.192 1.00 74.24 H new ATOM 943 N GLU A 59 7.209 -5.228 10.040 1.00 10.22 N ATOM 944 CA GLU A 59 6.684 -6.589 10.028 1.00 3.33 C ATOM 945 C GLU A 59 5.608 -6.789 8.959 1.00 11.53 C ATOM 946 O GLU A 59 5.310 -7.935 8.624 1.00 44.35 O ATOM 947 CB GLU A 59 6.146 -6.981 11.413 1.00 50.54 C ATOM 948 CG GLU A 59 7.275 -7.212 12.430 1.00 2.54 C ATOM 949 CD GLU A 59 7.105 -8.537 13.171 1.00 52.23 C ATOM 950 OE1 GLU A 59 6.363 -8.591 14.172 1.00 41.45 O ATOM 951 OE2 GLU A 59 7.697 -9.556 12.732 1.00 22.30 O ATOM 0 H GLU A 59 6.788 -4.630 10.751 1.00 10.22 H new ATOM 0 HA GLU A 59 7.516 -7.246 9.775 1.00 3.33 H new ATOM 0 HB2 GLU A 59 5.484 -6.196 11.779 1.00 50.54 H new ATOM 0 HB3 GLU A 59 5.547 -7.888 11.325 1.00 50.54 H new ATOM 0 HG2 GLU A 59 8.236 -7.203 11.915 1.00 2.54 H new ATOM 0 HG3 GLU A 59 7.291 -6.393 13.149 1.00 2.54 H new ATOM 958 N THR A 60 5.047 -5.717 8.393 1.00 1.13 N ATOM 959 CA THR A 60 4.133 -5.815 7.264 1.00 5.13 C ATOM 960 C THR A 60 4.929 -6.154 6.001 1.00 31.14 C ATOM 961 O THR A 60 4.553 -7.063 5.256 1.00 65.45 O ATOM 962 CB THR A 60 3.366 -4.493 7.105 1.00 55.51 C ATOM 963 OG1 THR A 60 2.864 -4.047 8.350 1.00 20.40 O ATOM 964 CG2 THR A 60 2.208 -4.631 6.118 1.00 11.42 C ATOM 0 H THR A 60 5.216 -4.762 8.707 1.00 1.13 H new ATOM 0 HA THR A 60 3.405 -6.608 7.436 1.00 5.13 H new ATOM 0 HB THR A 60 4.073 -3.761 6.716 1.00 55.51 H new ATOM 0 HG1 THR A 60 2.381 -3.203 8.225 1.00 20.40 H new ATOM 0 HG21 THR A 60 1.688 -3.677 6.031 1.00 11.42 H new ATOM 0 HG22 THR A 60 2.595 -4.924 5.142 1.00 11.42 H new ATOM 0 HG23 THR A 60 1.513 -5.391 6.476 1.00 11.42 H new ATOM 972 N LEU A 61 6.038 -5.442 5.767 1.00 25.00 N ATOM 973 CA LEU A 61 6.873 -5.554 4.573 1.00 64.05 C ATOM 974 C LEU A 61 7.838 -6.743 4.679 1.00 63.13 C ATOM 975 O LEU A 61 8.999 -6.669 4.266 1.00 32.41 O ATOM 976 CB LEU A 61 7.606 -4.217 4.311 1.00 11.24 C ATOM 977 CG LEU A 61 6.839 -3.163 3.489 1.00 55.53 C ATOM 978 CD1 LEU A 61 6.482 -3.704 2.095 1.00 73.04 C ATOM 979 CD2 LEU A 61 5.607 -2.603 4.209 1.00 42.54 C ATOM 0 H LEU A 61 6.388 -4.749 6.429 1.00 25.00 H new ATOM 0 HA LEU A 61 6.235 -5.754 3.712 1.00 64.05 H new ATOM 0 HB2 LEU A 61 7.866 -3.776 5.273 1.00 11.24 H new ATOM 0 HB3 LEU A 61 8.542 -4.436 3.797 1.00 11.24 H new ATOM 0 HG LEU A 61 7.517 -2.318 3.368 1.00 55.53 H new ATOM 0 HD11 LEU A 61 5.941 -2.940 1.536 1.00 73.04 H new ATOM 0 HD12 LEU A 61 7.396 -3.966 1.561 1.00 73.04 H new ATOM 0 HD13 LEU A 61 5.855 -4.590 2.198 1.00 73.04 H new ATOM 0 HD21 LEU A 61 5.116 -1.867 3.572 1.00 42.54 H new ATOM 0 HD22 LEU A 61 4.913 -3.415 4.427 1.00 42.54 H new ATOM 0 HD23 LEU A 61 5.915 -2.129 5.141 1.00 42.54 H new ATOM 991 N LYS A 62 7.390 -7.848 5.265 1.00 4.40 N ATOM 992 CA LYS A 62 8.203 -9.018 5.508 1.00 73.22 C ATOM 993 C LYS A 62 8.102 -9.977 4.332 1.00 5.32 C ATOM 994 O LYS A 62 7.116 -10.001 3.600 1.00 2.41 O ATOM 995 CB LYS A 62 7.734 -9.673 6.810 1.00 21.41 C ATOM 996 CG LYS A 62 8.749 -9.411 7.928 1.00 25.03 C ATOM 997 CD LYS A 62 8.315 -10.094 9.232 1.00 61.44 C ATOM 998 CE LYS A 62 9.463 -10.160 10.245 1.00 65.04 C ATOM 999 NZ LYS A 62 10.513 -11.121 9.843 1.00 11.33 N ATOM 0 H LYS A 62 6.428 -7.950 5.589 1.00 4.40 H new ATOM 0 HA LYS A 62 9.252 -8.739 5.610 1.00 73.22 H new ATOM 0 HB2 LYS A 62 6.759 -9.278 7.094 1.00 21.41 H new ATOM 0 HB3 LYS A 62 7.613 -10.746 6.663 1.00 21.41 H new ATOM 0 HG2 LYS A 62 9.730 -9.780 7.628 1.00 25.03 H new ATOM 0 HG3 LYS A 62 8.848 -8.338 8.090 1.00 25.03 H new ATOM 0 HD2 LYS A 62 7.477 -9.550 9.667 1.00 61.44 H new ATOM 0 HD3 LYS A 62 7.962 -11.102 9.015 1.00 61.44 H new ATOM 0 HE2 LYS A 62 9.904 -9.169 10.356 1.00 65.04 H new ATOM 0 HE3 LYS A 62 9.068 -10.444 11.220 1.00 65.04 H new ATOM 0 HZ1 LYS A 62 11.139 -11.309 10.652 1.00 11.33 H new ATOM 0 HZ2 LYS A 62 10.070 -12.010 9.534 1.00 11.33 H new ATOM 0 HZ3 LYS A 62 11.069 -10.721 9.061 1.00 11.33 H new ATOM 1013 N GLU A 63 9.112 -10.826 4.214 1.00 25.11 N ATOM 1014 CA GLU A 63 9.233 -11.828 3.171 1.00 65.45 C ATOM 1015 C GLU A 63 9.089 -13.177 3.869 1.00 45.24 C ATOM 1016 O GLU A 63 10.017 -13.613 4.562 1.00 74.05 O ATOM 1017 CB GLU A 63 10.585 -11.700 2.448 1.00 32.31 C ATOM 1018 CG GLU A 63 10.841 -10.318 1.839 1.00 23.41 C ATOM 1019 CD GLU A 63 12.309 -10.144 1.415 1.00 31.21 C ATOM 1020 OE1 GLU A 63 12.810 -10.954 0.599 1.00 70.21 O ATOM 1021 OE2 GLU A 63 12.977 -9.194 1.881 1.00 14.24 O ATOM 0 H GLU A 63 9.896 -10.835 4.866 1.00 25.11 H new ATOM 0 HA GLU A 63 8.470 -11.708 2.402 1.00 65.45 H new ATOM 0 HB2 GLU A 63 11.385 -11.928 3.153 1.00 32.31 H new ATOM 0 HB3 GLU A 63 10.634 -12.448 1.657 1.00 32.31 H new ATOM 0 HG2 GLU A 63 10.193 -10.176 0.974 1.00 23.41 H new ATOM 0 HG3 GLU A 63 10.578 -9.547 2.563 1.00 23.41 H new ATOM 1028 N GLY A 64 7.924 -13.810 3.754 1.00 25.44 N ATOM 1029 CA GLY A 64 7.609 -15.020 4.502 1.00 70.45 C ATOM 1030 C GLY A 64 6.209 -15.554 4.204 1.00 4.24 C ATOM 1031 O GLY A 64 5.605 -15.227 3.179 1.00 74.03 O ATOM 0 H GLY A 64 7.173 -13.497 3.139 1.00 25.44 H new ATOM 0 HA2 GLY A 64 8.344 -15.789 4.265 1.00 70.45 H new ATOM 0 HA3 GLY A 64 7.695 -14.814 5.569 1.00 70.45 H new ATOM 1035 N ARG A 65 5.722 -16.447 5.068 1.00 34.00 N ATOM 1036 CA ARG A 65 4.377 -17.020 5.073 1.00 50.44 C ATOM 1037 C ARG A 65 3.875 -17.018 6.513 1.00 10.12 C ATOM 1038 O ARG A 65 4.557 -17.537 7.398 1.00 24.33 O ATOM 1039 CB ARG A 65 4.430 -18.457 4.550 1.00 72.14 C ATOM 1040 CG ARG A 65 4.968 -18.489 3.118 1.00 50.55 C ATOM 1041 CD ARG A 65 4.959 -19.885 2.501 1.00 43.34 C ATOM 1042 NE ARG A 65 5.698 -20.847 3.334 1.00 73.01 N ATOM 1043 CZ ARG A 65 7.021 -21.029 3.351 1.00 64.31 C ATOM 1044 NH1 ARG A 65 7.791 -20.541 2.384 1.00 53.31 N ATOM 1045 NH2 ARG A 65 7.580 -21.696 4.354 1.00 44.11 N ATOM 0 H ARG A 65 6.293 -16.811 5.830 1.00 34.00 H new ATOM 0 HA ARG A 65 3.711 -16.439 4.435 1.00 50.44 H new ATOM 0 HB2 ARG A 65 5.066 -19.062 5.197 1.00 72.14 H new ATOM 0 HB3 ARG A 65 3.433 -18.898 4.580 1.00 72.14 H new ATOM 0 HG2 ARG A 65 4.370 -17.821 2.498 1.00 50.55 H new ATOM 0 HG3 ARG A 65 5.987 -18.103 3.111 1.00 50.55 H new ATOM 0 HD2 ARG A 65 3.930 -20.223 2.378 1.00 43.34 H new ATOM 0 HD3 ARG A 65 5.403 -19.847 1.506 1.00 43.34 H new ATOM 0 HE ARG A 65 5.145 -21.433 3.960 1.00 73.01 H new ATOM 0 HH11 ARG A 65 7.373 -20.019 1.614 1.00 53.31 H new ATOM 0 HH12 ARG A 65 8.800 -20.689 2.412 1.00 53.31 H new ATOM 0 HH21 ARG A 65 6.999 -22.066 5.106 1.00 44.11 H new ATOM 0 HH22 ARG A 65 8.590 -21.838 4.372 1.00 44.11 H new ATOM 1059 N THR A 66 2.687 -16.487 6.745 1.00 31.42 N ATOM 1060 CA THR A 66 1.907 -16.608 7.978 1.00 52.31 C ATOM 1061 C THR A 66 0.882 -17.741 7.769 1.00 44.33 C ATOM 1062 O THR A 66 0.771 -18.254 6.652 1.00 74.15 O ATOM 1063 CB THR A 66 1.334 -15.202 8.288 1.00 22.04 C ATOM 1064 OG1 THR A 66 2.422 -14.327 8.584 1.00 73.04 O ATOM 1065 CG2 THR A 66 0.321 -15.119 9.428 1.00 50.22 C ATOM 0 H THR A 66 2.208 -15.926 6.041 1.00 31.42 H new ATOM 0 HA THR A 66 2.477 -16.898 8.861 1.00 52.31 H new ATOM 0 HB THR A 66 0.778 -14.918 7.394 1.00 22.04 H new ATOM 0 HG1 THR A 66 2.077 -13.431 8.781 1.00 73.04 H new ATOM 0 HG21 THR A 66 -0.007 -14.087 9.549 1.00 50.22 H new ATOM 0 HG22 THR A 66 -0.539 -15.748 9.197 1.00 50.22 H new ATOM 0 HG23 THR A 66 0.785 -15.463 10.352 1.00 50.22 H new ATOM 1073 N THR A 67 0.173 -18.194 8.800 1.00 54.21 N ATOM 1074 CA THR A 67 -1.010 -19.038 8.723 1.00 62.03 C ATOM 1075 C THR A 67 -2.054 -18.479 9.706 1.00 21.31 C ATOM 1076 O THR A 67 -1.748 -17.542 10.449 1.00 23.23 O ATOM 1077 CB THR A 67 -0.658 -20.509 9.033 1.00 74.42 C ATOM 1078 OG1 THR A 67 0.721 -20.780 9.245 1.00 4.44 O ATOM 1079 CG2 THR A 67 -1.084 -21.413 7.885 1.00 23.11 C ATOM 0 H THR A 67 0.425 -17.968 9.762 1.00 54.21 H new ATOM 0 HA THR A 67 -1.420 -19.027 7.713 1.00 62.03 H new ATOM 0 HB THR A 67 -1.192 -20.703 9.963 1.00 74.42 H new ATOM 0 HG1 THR A 67 0.841 -21.734 9.435 1.00 4.44 H new ATOM 0 HG21 THR A 67 -0.828 -22.446 8.121 1.00 23.11 H new ATOM 0 HG22 THR A 67 -2.161 -21.331 7.737 1.00 23.11 H new ATOM 0 HG23 THR A 67 -0.569 -21.111 6.973 1.00 23.11 H new ATOM 1087 N GLU A 68 -3.273 -19.026 9.736 1.00 24.12 N ATOM 1088 CA GLU A 68 -4.334 -18.549 10.621 1.00 45.34 C ATOM 1089 C GLU A 68 -5.104 -19.693 11.272 1.00 43.31 C ATOM 1090 O GLU A 68 -5.100 -20.826 10.789 1.00 12.24 O ATOM 1091 CB GLU A 68 -5.310 -17.662 9.830 1.00 24.43 C ATOM 1092 CG GLU A 68 -4.691 -16.300 9.518 1.00 25.31 C ATOM 1093 CD GLU A 68 -5.766 -15.225 9.405 1.00 25.12 C ATOM 1094 OE1 GLU A 68 -6.229 -14.743 10.471 1.00 34.33 O ATOM 1095 OE2 GLU A 68 -6.118 -14.846 8.269 1.00 61.25 O ATOM 0 H GLU A 68 -3.550 -19.811 9.147 1.00 24.12 H new ATOM 0 HA GLU A 68 -3.859 -17.975 11.417 1.00 45.34 H new ATOM 0 HB2 GLU A 68 -5.586 -18.160 8.901 1.00 24.43 H new ATOM 0 HB3 GLU A 68 -6.227 -17.525 10.403 1.00 24.43 H new ATOM 0 HG2 GLU A 68 -3.983 -16.030 10.301 1.00 25.31 H new ATOM 0 HG3 GLU A 68 -4.129 -16.357 8.586 1.00 25.31 H new ATOM 1102 N GLU A 69 -5.852 -19.363 12.323 1.00 12.40 N ATOM 1103 CA GLU A 69 -6.792 -20.273 12.977 1.00 61.11 C ATOM 1104 C GLU A 69 -8.098 -20.402 12.173 1.00 12.23 C ATOM 1105 O GLU A 69 -8.974 -21.215 12.475 1.00 11.01 O ATOM 1106 CB GLU A 69 -7.078 -19.755 14.400 1.00 51.44 C ATOM 1107 CG GLU A 69 -7.300 -20.878 15.420 1.00 31.11 C ATOM 1108 CD GLU A 69 -5.967 -21.501 15.837 1.00 33.40 C ATOM 1109 OE1 GLU A 69 -5.343 -20.990 16.793 1.00 23.43 O ATOM 1110 OE2 GLU A 69 -5.529 -22.482 15.192 1.00 12.20 O ATOM 0 H GLU A 69 -5.822 -18.438 12.752 1.00 12.40 H new ATOM 0 HA GLU A 69 -6.347 -21.267 13.029 1.00 61.11 H new ATOM 0 HB2 GLU A 69 -6.244 -19.135 14.728 1.00 51.44 H new ATOM 0 HB3 GLU A 69 -7.960 -19.115 14.376 1.00 51.44 H new ATOM 0 HG2 GLU A 69 -7.813 -20.483 16.297 1.00 31.11 H new ATOM 0 HG3 GLU A 69 -7.946 -21.643 14.991 1.00 31.11 H new ATOM 1117 N GLU A 70 -8.257 -19.580 11.139 1.00 74.14 N ATOM 1118 CA GLU A 70 -9.524 -19.306 10.485 1.00 65.24 C ATOM 1119 C GLU A 70 -9.434 -19.129 8.966 1.00 63.51 C ATOM 1120 O GLU A 70 -10.462 -18.885 8.333 1.00 23.10 O ATOM 1121 CB GLU A 70 -10.192 -18.107 11.180 1.00 73.32 C ATOM 1122 CG GLU A 70 -9.557 -16.749 10.862 1.00 73.35 C ATOM 1123 CD GLU A 70 -10.228 -15.643 11.680 1.00 32.14 C ATOM 1124 OE1 GLU A 70 -11.404 -15.314 11.389 1.00 50.42 O ATOM 1125 OE2 GLU A 70 -9.586 -15.144 12.633 1.00 21.51 O ATOM 0 H GLU A 70 -7.477 -19.071 10.722 1.00 74.14 H new ATOM 0 HA GLU A 70 -10.148 -20.193 10.597 1.00 65.24 H new ATOM 0 HB2 GLU A 70 -11.243 -18.078 10.894 1.00 73.32 H new ATOM 0 HB3 GLU A 70 -10.160 -18.265 12.258 1.00 73.32 H new ATOM 0 HG2 GLU A 70 -8.490 -16.778 11.084 1.00 73.35 H new ATOM 0 HG3 GLU A 70 -9.656 -16.534 9.798 1.00 73.35 H new ATOM 1132 N GLY A 71 -8.247 -19.279 8.376 1.00 43.05 N ATOM 1133 CA GLY A 71 -8.038 -19.098 6.948 1.00 62.25 C ATOM 1134 C GLY A 71 -7.019 -20.106 6.438 1.00 33.53 C ATOM 1135 O GLY A 71 -7.256 -21.315 6.483 1.00 54.24 O ATOM 0 H GLY A 71 -7.400 -19.532 8.885 1.00 43.05 H new ATOM 0 HA2 GLY A 71 -8.981 -19.221 6.416 1.00 62.25 H new ATOM 0 HA3 GLY A 71 -7.690 -18.084 6.749 1.00 62.25 H new ATOM 1139 N GLY A 72 -5.875 -19.616 5.979 1.00 63.31 N ATOM 1140 CA GLY A 72 -4.874 -20.402 5.292 1.00 25.33 C ATOM 1141 C GLY A 72 -3.511 -19.747 5.424 1.00 44.22 C ATOM 1142 O GLY A 72 -3.329 -18.758 6.136 1.00 53.05 O ATOM 0 H GLY A 72 -5.616 -18.634 6.080 1.00 63.31 H new ATOM 0 HA2 GLY A 72 -4.843 -21.409 5.708 1.00 25.33 H new ATOM 0 HA3 GLY A 72 -5.138 -20.500 4.239 1.00 25.33 H new ATOM 1146 N THR A 73 -2.540 -20.309 4.721 1.00 41.43 N ATOM 1147 CA THR A 73 -1.188 -19.788 4.618 1.00 14.34 C ATOM 1148 C THR A 73 -1.236 -18.436 3.895 1.00 62.01 C ATOM 1149 O THR A 73 -1.596 -18.412 2.722 1.00 4.43 O ATOM 1150 CB THR A 73 -0.323 -20.828 3.884 1.00 3.53 C ATOM 1151 OG1 THR A 73 -0.455 -22.103 4.482 1.00 70.24 O ATOM 1152 CG2 THR A 73 1.162 -20.468 3.849 1.00 41.25 C ATOM 0 H THR A 73 -2.677 -21.169 4.189 1.00 41.43 H new ATOM 0 HA THR A 73 -0.741 -19.617 5.598 1.00 14.34 H new ATOM 0 HB THR A 73 -0.693 -20.840 2.859 1.00 3.53 H new ATOM 0 HG1 THR A 73 0.101 -22.750 4.000 1.00 70.24 H new ATOM 0 HG21 THR A 73 1.712 -21.244 3.317 1.00 41.25 H new ATOM 0 HG22 THR A 73 1.293 -19.514 3.337 1.00 41.25 H new ATOM 0 HG23 THR A 73 1.541 -20.388 4.868 1.00 41.25 H new ATOM 1160 N TYR A 74 -0.894 -17.329 4.565 1.00 23.31 N ATOM 1161 CA TYR A 74 -0.834 -15.988 3.986 1.00 42.51 C ATOM 1162 C TYR A 74 0.606 -15.637 3.626 1.00 45.52 C ATOM 1163 O TYR A 74 1.436 -15.357 4.498 1.00 2.12 O ATOM 1164 CB TYR A 74 -1.420 -14.938 4.934 1.00 12.54 C ATOM 1165 CG TYR A 74 -1.469 -13.533 4.345 1.00 71.31 C ATOM 1166 CD1 TYR A 74 -2.000 -13.313 3.059 1.00 51.22 C ATOM 1167 CD2 TYR A 74 -1.004 -12.435 5.088 1.00 2.43 C ATOM 1168 CE1 TYR A 74 -2.110 -12.015 2.530 1.00 30.32 C ATOM 1169 CE2 TYR A 74 -1.108 -11.133 4.565 1.00 12.34 C ATOM 1170 CZ TYR A 74 -1.684 -10.912 3.296 1.00 63.35 C ATOM 1171 OH TYR A 74 -1.794 -9.652 2.793 1.00 52.42 O ATOM 0 H TYR A 74 -0.645 -17.346 5.554 1.00 23.31 H new ATOM 0 HA TYR A 74 -1.439 -15.986 3.080 1.00 42.51 H new ATOM 0 HB2 TYR A 74 -2.429 -15.239 5.215 1.00 12.54 H new ATOM 0 HB3 TYR A 74 -0.827 -14.917 5.849 1.00 12.54 H new ATOM 0 HD1 TYR A 74 -2.328 -14.156 2.469 1.00 51.22 H new ATOM 0 HD2 TYR A 74 -0.566 -12.591 6.063 1.00 2.43 H new ATOM 0 HE1 TYR A 74 -2.519 -11.864 1.542 1.00 30.32 H new ATOM 0 HE2 TYR A 74 -0.744 -10.295 5.140 1.00 12.34 H new ATOM 0 HH TYR A 74 -1.456 -9.007 3.449 1.00 52.42 H new ATOM 1181 N ILE A 75 0.938 -15.696 2.345 1.00 21.41 N ATOM 1182 CA ILE A 75 2.255 -15.394 1.815 1.00 34.23 C ATOM 1183 C ILE A 75 2.414 -13.869 1.756 1.00 72.45 C ATOM 1184 O ILE A 75 1.442 -13.123 1.620 1.00 74.14 O ATOM 1185 CB ILE A 75 2.401 -16.088 0.438 1.00 50.54 C ATOM 1186 CG1 ILE A 75 2.184 -17.622 0.543 1.00 31.30 C ATOM 1187 CG2 ILE A 75 3.796 -15.870 -0.159 1.00 61.23 C ATOM 1188 CD1 ILE A 75 0.766 -18.072 0.211 1.00 41.44 C ATOM 0 H ILE A 75 0.272 -15.966 1.621 1.00 21.41 H new ATOM 0 HA ILE A 75 3.055 -15.775 2.449 1.00 34.23 H new ATOM 0 HB ILE A 75 1.640 -15.640 -0.201 1.00 50.54 H new ATOM 0 HG12 ILE A 75 2.880 -18.124 -0.129 1.00 31.30 H new ATOM 0 HG13 ILE A 75 2.429 -17.945 1.555 1.00 31.30 H new ATOM 0 HG21 ILE A 75 3.861 -16.371 -1.125 1.00 61.23 H new ATOM 0 HG22 ILE A 75 3.972 -14.803 -0.292 1.00 61.23 H new ATOM 0 HG23 ILE A 75 4.548 -16.281 0.514 1.00 61.23 H new ATOM 0 HD11 ILE A 75 0.696 -19.155 0.307 1.00 41.44 H new ATOM 0 HD12 ILE A 75 0.064 -17.600 0.899 1.00 41.44 H new ATOM 0 HD13 ILE A 75 0.522 -17.782 -0.811 1.00 41.44 H new ATOM 1200 N SER A 76 3.647 -13.383 1.871 1.00 21.24 N ATOM 1201 CA SER A 76 4.034 -12.048 1.443 1.00 13.41 C ATOM 1202 C SER A 76 5.477 -12.119 0.973 1.00 51.22 C ATOM 1203 O SER A 76 6.303 -12.740 1.650 1.00 50.12 O ATOM 1204 CB SER A 76 3.916 -11.049 2.597 1.00 42.23 C ATOM 1205 OG SER A 76 2.638 -11.116 3.208 1.00 1.20 O ATOM 0 H SER A 76 4.417 -13.918 2.272 1.00 21.24 H new ATOM 0 HA SER A 76 3.376 -11.710 0.642 1.00 13.41 H new ATOM 0 HB2 SER A 76 4.687 -11.255 3.339 1.00 42.23 H new ATOM 0 HB3 SER A 76 4.092 -10.039 2.226 1.00 42.23 H new ATOM 0 HG SER A 76 2.046 -11.680 2.667 1.00 1.20 H new ATOM 1211 N HIS A 77 5.795 -11.517 -0.171 1.00 33.03 N ATOM 1212 CA HIS A 77 7.162 -11.425 -0.658 1.00 53.41 C ATOM 1213 C HIS A 77 7.253 -10.431 -1.813 1.00 73.12 C ATOM 1214 O HIS A 77 6.252 -9.981 -2.375 1.00 11.42 O ATOM 1215 CB HIS A 77 7.702 -12.816 -1.066 1.00 74.03 C ATOM 1216 CG HIS A 77 6.788 -13.693 -1.897 1.00 65.32 C ATOM 1217 ND1 HIS A 77 5.968 -13.312 -2.926 1.00 22.14 N flip ATOM 1218 CD2 HIS A 77 6.662 -15.057 -1.760 1.00 21.03 C flip ATOM 1219 CE1 HIS A 77 5.381 -14.464 -3.459 1.00 50.13 C flip ATOM 1220 NE2 HIS A 77 5.819 -15.491 -2.712 1.00 65.32 N flip ATOM 0 H HIS A 77 5.108 -11.080 -0.785 1.00 33.03 H new ATOM 0 HA HIS A 77 7.791 -11.057 0.153 1.00 53.41 H new ATOM 0 HB2 HIS A 77 8.628 -12.670 -1.622 1.00 74.03 H new ATOM 0 HB3 HIS A 77 7.958 -13.360 -0.157 1.00 74.03 H new ATOM 0 HD2 HIS A 77 7.154 -15.670 -1.019 1.00 21.03 H new ATOM 0 HE1 HIS A 77 4.709 -14.517 -4.303 1.00 50.13 H new ATOM 0 HE2 HIS A 77 5.549 -16.465 -2.849 1.00 65.32 H new ATOM 1228 N PHE A 78 8.485 -10.117 -2.203 1.00 33.31 N ATOM 1229 CA PHE A 78 8.745 -9.523 -3.505 1.00 41.22 C ATOM 1230 C PHE A 78 8.503 -10.606 -4.561 1.00 73.32 C ATOM 1231 O PHE A 78 8.788 -11.784 -4.318 1.00 11.40 O ATOM 1232 CB PHE A 78 10.192 -9.016 -3.569 1.00 2.33 C ATOM 1233 CG PHE A 78 10.536 -7.970 -2.521 1.00 72.14 C ATOM 1234 CD1 PHE A 78 10.773 -8.354 -1.189 1.00 21.14 C ATOM 1235 CD2 PHE A 78 10.677 -6.618 -2.878 1.00 43.11 C ATOM 1236 CE1 PHE A 78 11.076 -7.392 -0.210 1.00 24.44 C ATOM 1237 CE2 PHE A 78 11.052 -5.669 -1.911 1.00 21.40 C ATOM 1238 CZ PHE A 78 11.222 -6.048 -0.572 1.00 35.01 C ATOM 0 H PHE A 78 9.318 -10.265 -1.633 1.00 33.31 H new ATOM 0 HA PHE A 78 8.088 -8.672 -3.683 1.00 41.22 H new ATOM 0 HB2 PHE A 78 10.867 -9.864 -3.454 1.00 2.33 H new ATOM 0 HB3 PHE A 78 10.374 -8.596 -4.558 1.00 2.33 H new ATOM 0 HD1 PHE A 78 10.722 -9.398 -0.916 1.00 21.14 H new ATOM 0 HD2 PHE A 78 10.497 -6.308 -3.897 1.00 43.11 H new ATOM 0 HE1 PHE A 78 11.196 -7.690 0.821 1.00 24.44 H new ATOM 0 HE2 PHE A 78 11.210 -4.641 -2.202 1.00 21.40 H new ATOM 0 HZ PHE A 78 11.464 -5.307 0.176 1.00 35.01 H new ATOM 1248 N THR A 79 8.028 -10.220 -5.741 1.00 24.31 N ATOM 1249 CA THR A 79 7.778 -11.109 -6.878 1.00 1.43 C ATOM 1250 C THR A 79 8.734 -10.813 -8.043 1.00 21.21 C ATOM 1251 O THR A 79 8.582 -11.358 -9.137 1.00 45.12 O ATOM 1252 CB THR A 79 6.295 -10.975 -7.279 1.00 62.02 C ATOM 1253 OG1 THR A 79 5.868 -9.623 -7.209 1.00 73.12 O ATOM 1254 CG2 THR A 79 5.410 -11.787 -6.331 1.00 74.45 C ATOM 0 H THR A 79 7.798 -9.247 -5.942 1.00 24.31 H new ATOM 0 HA THR A 79 7.975 -12.143 -6.595 1.00 1.43 H new ATOM 0 HB THR A 79 6.204 -11.343 -8.301 1.00 62.02 H new ATOM 0 HG1 THR A 79 4.925 -9.564 -7.469 1.00 73.12 H new ATOM 0 HG21 THR A 79 4.366 -11.682 -6.628 1.00 74.45 H new ATOM 0 HG22 THR A 79 5.696 -12.838 -6.377 1.00 74.45 H new ATOM 0 HG23 THR A 79 5.536 -11.421 -5.312 1.00 74.45 H new ATOM 1262 N VAL A 80 9.706 -9.925 -7.839 1.00 62.43 N ATOM 1263 CA VAL A 80 10.607 -9.420 -8.862 1.00 51.54 C ATOM 1264 C VAL A 80 11.911 -9.012 -8.178 1.00 74.04 C ATOM 1265 O VAL A 80 11.918 -8.676 -6.985 1.00 53.54 O ATOM 1266 CB VAL A 80 9.909 -8.245 -9.602 1.00 33.43 C ATOM 1267 CG1 VAL A 80 9.339 -7.211 -8.628 1.00 60.32 C ATOM 1268 CG2 VAL A 80 10.800 -7.544 -10.634 1.00 63.02 C ATOM 0 H VAL A 80 9.891 -9.525 -6.919 1.00 62.43 H new ATOM 0 HA VAL A 80 10.847 -10.172 -9.614 1.00 51.54 H new ATOM 0 HB VAL A 80 9.091 -8.714 -10.149 1.00 33.43 H new ATOM 0 HG11 VAL A 80 8.861 -6.408 -9.189 1.00 60.32 H new ATOM 0 HG12 VAL A 80 8.604 -7.688 -7.979 1.00 60.32 H new ATOM 0 HG13 VAL A 80 10.146 -6.799 -8.021 1.00 60.32 H new ATOM 0 HG21 VAL A 80 10.242 -6.736 -11.108 1.00 63.02 H new ATOM 0 HG22 VAL A 80 11.680 -7.135 -10.137 1.00 63.02 H new ATOM 0 HG23 VAL A 80 11.113 -8.262 -11.392 1.00 63.02 H new ATOM 1278 N ASN A 81 12.996 -8.968 -8.954 1.00 24.22 N ATOM 1279 CA ASN A 81 14.194 -8.238 -8.591 1.00 32.12 C ATOM 1280 C ASN A 81 14.814 -7.596 -9.827 1.00 12.50 C ATOM 1281 O ASN A 81 15.537 -8.251 -10.575 1.00 21.11 O ATOM 1282 CB ASN A 81 15.210 -9.137 -7.888 1.00 24.30 C ATOM 1283 CG ASN A 81 16.349 -8.252 -7.398 1.00 60.33 C ATOM 1284 OD1 ASN A 81 16.137 -7.237 -6.736 1.00 71.34 O ATOM 1285 ND2 ASN A 81 17.579 -8.564 -7.736 1.00 54.15 N ATOM 0 H ASN A 81 13.060 -9.443 -9.854 1.00 24.22 H new ATOM 0 HA ASN A 81 13.908 -7.455 -7.889 1.00 32.12 H new ATOM 0 HB2 ASN A 81 14.745 -9.660 -7.052 1.00 24.30 H new ATOM 0 HB3 ASN A 81 15.584 -9.899 -8.572 1.00 24.30 H new ATOM 0 HD21 ASN A 81 18.354 -7.966 -7.450 1.00 54.15 H new ATOM 0 HD22 ASN A 81 17.759 -9.405 -8.285 1.00 54.15 H new ATOM 1292 N GLU A 82 14.541 -6.313 -10.032 1.00 43.44 N ATOM 1293 CA GLU A 82 15.343 -5.426 -10.865 1.00 44.55 C ATOM 1294 C GLU A 82 15.961 -4.405 -9.902 1.00 44.14 C ATOM 1295 O GLU A 82 15.427 -4.187 -8.807 1.00 20.33 O ATOM 1296 CB GLU A 82 14.451 -4.771 -11.937 1.00 21.24 C ATOM 1297 CG GLU A 82 14.110 -5.712 -13.101 1.00 51.23 C ATOM 1298 CD GLU A 82 15.315 -6.064 -13.987 1.00 74.31 C ATOM 1299 OE1 GLU A 82 16.106 -5.157 -14.332 1.00 3.50 O ATOM 1300 OE2 GLU A 82 15.443 -7.229 -14.425 1.00 74.11 O ATOM 0 H GLU A 82 13.735 -5.849 -9.613 1.00 43.44 H new ATOM 0 HA GLU A 82 16.129 -5.948 -11.410 1.00 44.55 H new ATOM 0 HB2 GLU A 82 13.526 -4.430 -11.471 1.00 21.24 H new ATOM 0 HB3 GLU A 82 14.955 -3.888 -12.329 1.00 21.24 H new ATOM 0 HG2 GLU A 82 13.685 -6.632 -12.700 1.00 51.23 H new ATOM 0 HG3 GLU A 82 13.341 -5.248 -13.718 1.00 51.23 H new ATOM 1307 N PRO A 83 17.081 -3.761 -10.262 1.00 73.31 N ATOM 1308 CA PRO A 83 17.816 -2.902 -9.339 1.00 20.03 C ATOM 1309 C PRO A 83 17.021 -1.640 -8.991 1.00 60.22 C ATOM 1310 O PRO A 83 17.178 -1.096 -7.898 1.00 75.44 O ATOM 1311 CB PRO A 83 19.117 -2.558 -10.066 1.00 61.31 C ATOM 1312 CG PRO A 83 18.726 -2.648 -11.539 1.00 75.45 C ATOM 1313 CD PRO A 83 17.742 -3.812 -11.555 1.00 51.11 C ATOM 0 HA PRO A 83 18.002 -3.400 -8.387 1.00 20.03 H new ATOM 0 HB2 PRO A 83 19.474 -1.562 -9.804 1.00 61.31 H new ATOM 0 HB3 PRO A 83 19.915 -3.258 -9.817 1.00 61.31 H new ATOM 0 HG2 PRO A 83 18.267 -1.725 -11.893 1.00 75.45 H new ATOM 0 HG3 PRO A 83 19.590 -2.839 -12.176 1.00 75.45 H new ATOM 0 HD2 PRO A 83 17.025 -3.712 -12.370 1.00 51.11 H new ATOM 0 HD3 PRO A 83 18.256 -4.762 -11.698 1.00 51.11 H new ATOM 1321 N ALA A 84 16.148 -1.209 -9.903 1.00 35.43 N ATOM 1322 CA ALA A 84 15.446 0.061 -9.876 1.00 13.33 C ATOM 1323 C ALA A 84 13.923 -0.118 -9.912 1.00 74.33 C ATOM 1324 O ALA A 84 13.206 0.874 -10.012 1.00 64.15 O ATOM 1325 CB ALA A 84 15.950 0.887 -11.069 1.00 32.43 C ATOM 0 H ALA A 84 15.904 -1.770 -10.719 1.00 35.43 H new ATOM 0 HA ALA A 84 15.653 0.580 -8.940 1.00 13.33 H new ATOM 0 HB1 ALA A 84 15.444 1.852 -11.083 1.00 32.43 H new ATOM 0 HB2 ALA A 84 17.025 1.042 -10.976 1.00 32.43 H new ATOM 0 HB3 ALA A 84 15.739 0.353 -11.996 1.00 32.43 H new ATOM 1331 N HIS A 85 13.408 -1.354 -9.869 1.00 24.40 N ATOM 1332 CA HIS A 85 11.977 -1.607 -9.919 1.00 74.44 C ATOM 1333 C HIS A 85 11.685 -2.880 -9.117 1.00 40.12 C ATOM 1334 O HIS A 85 12.241 -3.931 -9.445 1.00 54.23 O ATOM 1335 CB HIS A 85 11.562 -1.721 -11.400 1.00 1.42 C ATOM 1336 CG HIS A 85 10.086 -1.608 -11.677 1.00 75.34 C ATOM 1337 ND1 HIS A 85 9.491 -1.694 -12.918 1.00 61.12 N ATOM 1338 CD2 HIS A 85 9.087 -1.411 -10.763 1.00 3.10 C ATOM 1339 CE1 HIS A 85 8.168 -1.560 -12.747 1.00 31.03 C ATOM 1340 NE2 HIS A 85 7.873 -1.419 -11.449 1.00 74.34 N ATOM 0 H HIS A 85 13.976 -2.198 -9.799 1.00 24.40 H new ATOM 0 HA HIS A 85 11.397 -0.799 -9.474 1.00 74.44 H new ATOM 0 HB2 HIS A 85 12.079 -0.944 -11.964 1.00 1.42 H new ATOM 0 HB3 HIS A 85 11.912 -2.679 -11.783 1.00 1.42 H new ATOM 0 HD2 HIS A 85 9.216 -1.274 -9.700 1.00 3.10 H new ATOM 0 HE1 HIS A 85 7.441 -1.565 -13.546 1.00 31.03 H new ATOM 0 HE2 HIS A 85 6.942 -1.334 -11.041 1.00 74.34 H new ATOM 1348 N LYS A 86 10.859 -2.824 -8.064 1.00 23.33 N ATOM 1349 CA LYS A 86 10.423 -4.030 -7.353 1.00 32.20 C ATOM 1350 C LYS A 86 8.990 -3.861 -6.848 1.00 32.02 C ATOM 1351 O LYS A 86 8.581 -2.762 -6.504 1.00 43.23 O ATOM 1352 CB LYS A 86 11.324 -4.358 -6.144 1.00 15.11 C ATOM 1353 CG LYS A 86 12.845 -4.317 -6.359 1.00 31.04 C ATOM 1354 CD LYS A 86 13.583 -4.838 -5.114 1.00 34.31 C ATOM 1355 CE LYS A 86 14.993 -4.256 -4.959 1.00 55.53 C ATOM 1356 NZ LYS A 86 15.891 -4.525 -6.097 1.00 20.04 N ATOM 0 H LYS A 86 10.480 -1.956 -7.687 1.00 23.33 H new ATOM 0 HA LYS A 86 10.487 -4.850 -8.069 1.00 32.20 H new ATOM 0 HB2 LYS A 86 11.079 -3.660 -5.343 1.00 15.11 H new ATOM 0 HB3 LYS A 86 11.061 -5.355 -5.790 1.00 15.11 H new ATOM 0 HG2 LYS A 86 13.111 -4.922 -7.226 1.00 31.04 H new ATOM 0 HG3 LYS A 86 13.160 -3.296 -6.574 1.00 31.04 H new ATOM 0 HD2 LYS A 86 12.998 -4.598 -4.226 1.00 34.31 H new ATOM 0 HD3 LYS A 86 13.649 -5.925 -5.167 1.00 34.31 H new ATOM 0 HE2 LYS A 86 14.915 -3.178 -4.821 1.00 55.53 H new ATOM 0 HE3 LYS A 86 15.443 -4.662 -4.053 1.00 55.53 H new ATOM 0 HZ1 LYS A 86 16.799 -4.042 -5.944 1.00 20.04 H new ATOM 0 HZ2 LYS A 86 16.053 -5.549 -6.177 1.00 20.04 H new ATOM 0 HZ3 LYS A 86 15.455 -4.174 -6.974 1.00 20.04 H new ATOM 1370 N GLU A 87 8.270 -4.965 -6.689 1.00 61.21 N ATOM 1371 CA GLU A 87 6.889 -5.030 -6.210 1.00 44.22 C ATOM 1372 C GLU A 87 6.883 -5.473 -4.734 1.00 61.25 C ATOM 1373 O GLU A 87 7.940 -5.806 -4.186 1.00 55.42 O ATOM 1374 CB GLU A 87 6.169 -6.096 -7.046 1.00 24.14 C ATOM 1375 CG GLU A 87 5.991 -5.725 -8.519 1.00 32.11 C ATOM 1376 CD GLU A 87 4.794 -4.821 -8.809 1.00 64.11 C ATOM 1377 OE1 GLU A 87 3.737 -4.933 -8.145 1.00 72.03 O ATOM 1378 OE2 GLU A 87 4.925 -4.015 -9.760 1.00 24.24 O ATOM 0 H GLU A 87 8.650 -5.888 -6.901 1.00 61.21 H new ATOM 0 HA GLU A 87 6.402 -4.059 -6.299 1.00 44.22 H new ATOM 0 HB2 GLU A 87 6.728 -7.029 -6.983 1.00 24.14 H new ATOM 0 HB3 GLU A 87 5.188 -6.282 -6.609 1.00 24.14 H new ATOM 0 HG2 GLU A 87 6.897 -5.228 -8.867 1.00 32.11 H new ATOM 0 HG3 GLU A 87 5.887 -6.641 -9.100 1.00 32.11 H new ATOM 1385 N PHE A 88 5.717 -5.558 -4.089 1.00 22.34 N ATOM 1386 CA PHE A 88 5.491 -6.292 -2.846 1.00 63.02 C ATOM 1387 C PHE A 88 4.070 -6.863 -2.879 1.00 24.03 C ATOM 1388 O PHE A 88 3.095 -6.123 -2.743 1.00 54.22 O ATOM 1389 CB PHE A 88 5.715 -5.402 -1.616 1.00 62.03 C ATOM 1390 CG PHE A 88 5.645 -6.170 -0.311 1.00 33.20 C ATOM 1391 CD1 PHE A 88 4.399 -6.420 0.298 1.00 11.52 C ATOM 1392 CD2 PHE A 88 6.827 -6.638 0.295 1.00 11.33 C ATOM 1393 CE1 PHE A 88 4.335 -7.146 1.500 1.00 54.52 C ATOM 1394 CE2 PHE A 88 6.766 -7.331 1.516 1.00 32.03 C ATOM 1395 CZ PHE A 88 5.517 -7.605 2.103 1.00 41.13 C ATOM 0 H PHE A 88 4.874 -5.099 -4.433 1.00 22.34 H new ATOM 0 HA PHE A 88 6.211 -7.106 -2.765 1.00 63.02 H new ATOM 0 HB2 PHE A 88 6.689 -4.919 -1.696 1.00 62.03 H new ATOM 0 HB3 PHE A 88 4.966 -4.610 -1.606 1.00 62.03 H new ATOM 0 HD1 PHE A 88 3.492 -6.053 -0.159 1.00 11.52 H new ATOM 0 HD2 PHE A 88 7.782 -6.464 -0.179 1.00 11.33 H new ATOM 0 HE1 PHE A 88 3.379 -7.350 1.959 1.00 54.52 H new ATOM 0 HE2 PHE A 88 7.675 -7.652 2.002 1.00 32.03 H new ATOM 0 HZ PHE A 88 5.467 -8.171 3.022 1.00 41.13 H new ATOM 1405 N GLU A 89 3.953 -8.173 -3.087 1.00 11.32 N ATOM 1406 CA GLU A 89 2.683 -8.891 -3.148 1.00 44.52 C ATOM 1407 C GLU A 89 2.422 -9.563 -1.796 1.00 32.11 C ATOM 1408 O GLU A 89 3.362 -9.863 -1.046 1.00 12.13 O ATOM 1409 CB GLU A 89 2.763 -9.929 -4.282 1.00 51.15 C ATOM 1410 CG GLU A 89 1.486 -9.897 -5.129 1.00 45.13 C ATOM 1411 CD GLU A 89 1.339 -11.169 -5.963 1.00 45.12 C ATOM 1412 OE1 GLU A 89 0.995 -12.222 -5.377 1.00 51.51 O ATOM 1413 OE2 GLU A 89 1.603 -11.139 -7.188 1.00 45.44 O ATOM 0 H GLU A 89 4.761 -8.780 -3.221 1.00 11.32 H new ATOM 0 HA GLU A 89 1.858 -8.209 -3.354 1.00 44.52 H new ATOM 0 HB2 GLU A 89 3.629 -9.723 -4.911 1.00 51.15 H new ATOM 0 HB3 GLU A 89 2.903 -10.925 -3.862 1.00 51.15 H new ATOM 0 HG2 GLU A 89 0.619 -9.784 -4.478 1.00 45.13 H new ATOM 0 HG3 GLU A 89 1.506 -9.029 -5.787 1.00 45.13 H new ATOM 1420 N ALA A 90 1.148 -9.827 -1.492 1.00 23.44 N ATOM 1421 CA ALA A 90 0.744 -10.702 -0.404 1.00 30.40 C ATOM 1422 C ALA A 90 -0.644 -11.271 -0.690 1.00 44.24 C ATOM 1423 O ALA A 90 -1.564 -10.517 -1.029 1.00 5.52 O ATOM 1424 CB ALA A 90 0.724 -9.926 0.912 1.00 32.34 C ATOM 0 H ALA A 90 0.362 -9.430 -2.006 1.00 23.44 H new ATOM 0 HA ALA A 90 1.459 -11.521 -0.321 1.00 30.40 H new ATOM 0 HB1 ALA A 90 0.420 -10.590 1.721 1.00 32.34 H new ATOM 0 HB2 ALA A 90 1.720 -9.534 1.119 1.00 32.34 H new ATOM 0 HB3 ALA A 90 0.018 -9.099 0.836 1.00 32.34 H new ATOM 1430 N GLY A 91 -0.808 -12.579 -0.505 1.00 33.34 N ATOM 1431 CA GLY A 91 -2.033 -13.316 -0.773 1.00 54.11 C ATOM 1432 C GLY A 91 -1.998 -14.684 -0.120 1.00 33.34 C ATOM 1433 O GLY A 91 -0.936 -15.145 0.306 1.00 4.43 O ATOM 0 H GLY A 91 -0.060 -13.174 -0.150 1.00 33.34 H new ATOM 0 HA2 GLY A 91 -2.889 -12.753 -0.401 1.00 54.11 H new ATOM 0 HA3 GLY A 91 -2.167 -13.426 -1.849 1.00 54.11 H new ATOM 1437 N TYR A 92 -3.161 -15.322 0.007 1.00 54.14 N ATOM 1438 CA TYR A 92 -3.239 -16.640 0.617 1.00 53.13 C ATOM 1439 C TYR A 92 -2.871 -17.717 -0.412 1.00 4.40 C ATOM 1440 O TYR A 92 -2.878 -17.493 -1.628 1.00 4.34 O ATOM 1441 CB TYR A 92 -4.611 -16.861 1.288 1.00 11.33 C ATOM 1442 CG TYR A 92 -4.803 -16.097 2.594 1.00 23.11 C ATOM 1443 CD1 TYR A 92 -4.915 -14.696 2.583 1.00 31.44 C ATOM 1444 CD2 TYR A 92 -4.851 -16.772 3.831 1.00 50.43 C ATOM 1445 CE1 TYR A 92 -5.022 -13.967 3.775 1.00 33.22 C ATOM 1446 CE2 TYR A 92 -4.971 -16.052 5.038 1.00 1.23 C ATOM 1447 CZ TYR A 92 -5.035 -14.638 5.012 1.00 12.04 C ATOM 1448 OH TYR A 92 -5.017 -13.903 6.156 1.00 12.11 O ATOM 0 H TYR A 92 -4.056 -14.946 -0.304 1.00 54.14 H new ATOM 0 HA TYR A 92 -2.508 -16.715 1.422 1.00 53.13 H new ATOM 0 HB2 TYR A 92 -5.395 -16.567 0.590 1.00 11.33 H new ATOM 0 HB3 TYR A 92 -4.740 -17.926 1.482 1.00 11.33 H new ATOM 0 HD1 TYR A 92 -4.919 -14.172 1.639 1.00 31.44 H new ATOM 0 HD2 TYR A 92 -4.795 -17.850 3.855 1.00 50.43 H new ATOM 0 HE1 TYR A 92 -5.095 -12.890 3.744 1.00 33.22 H new ATOM 0 HE2 TYR A 92 -5.014 -16.578 5.980 1.00 1.23 H new ATOM 0 HH TYR A 92 -5.229 -14.480 6.919 1.00 12.11 H new ATOM 1458 N ASP A 93 -2.524 -18.898 0.087 1.00 21.43 N ATOM 1459 CA ASP A 93 -2.129 -20.052 -0.712 1.00 12.44 C ATOM 1460 C ASP A 93 -3.299 -20.484 -1.583 1.00 4.32 C ATOM 1461 O ASP A 93 -4.446 -20.483 -1.122 1.00 72.24 O ATOM 1462 CB ASP A 93 -1.686 -21.182 0.223 1.00 74.43 C ATOM 1463 CG ASP A 93 -1.061 -22.372 -0.499 1.00 5.20 C ATOM 1464 OD1 ASP A 93 -0.310 -22.147 -1.474 1.00 33.10 O ATOM 1465 OD2 ASP A 93 -1.139 -23.504 0.038 1.00 12.43 O ATOM 0 H ASP A 93 -2.509 -19.084 1.090 1.00 21.43 H new ATOM 0 HA ASP A 93 -1.294 -19.796 -1.364 1.00 12.44 H new ATOM 0 HB2 ASP A 93 -0.967 -20.786 0.940 1.00 74.43 H new ATOM 0 HB3 ASP A 93 -2.548 -21.527 0.793 1.00 74.43 H new ATOM 1470 N GLU A 94 -3.031 -20.808 -2.850 1.00 13.20 N ATOM 1471 CA GLU A 94 -4.052 -21.146 -3.846 1.00 63.33 C ATOM 1472 C GLU A 94 -5.125 -20.047 -3.988 1.00 25.33 C ATOM 1473 O GLU A 94 -6.227 -20.315 -4.464 1.00 64.11 O ATOM 1474 CB GLU A 94 -4.627 -22.539 -3.529 1.00 30.20 C ATOM 1475 CG GLU A 94 -3.764 -23.684 -4.054 1.00 11.30 C ATOM 1476 CD GLU A 94 -3.980 -23.865 -5.553 1.00 34.10 C ATOM 1477 OE1 GLU A 94 -5.050 -24.400 -5.930 1.00 41.21 O ATOM 1478 OE2 GLU A 94 -3.053 -23.495 -6.312 1.00 1.53 O ATOM 0 H GLU A 94 -2.081 -20.844 -3.220 1.00 13.20 H new ATOM 0 HA GLU A 94 -3.589 -21.194 -4.832 1.00 63.33 H new ATOM 0 HB2 GLU A 94 -4.737 -22.642 -2.449 1.00 30.20 H new ATOM 0 HB3 GLU A 94 -5.625 -22.619 -3.960 1.00 30.20 H new ATOM 0 HG2 GLU A 94 -2.713 -23.478 -3.853 1.00 11.30 H new ATOM 0 HG3 GLU A 94 -4.013 -24.606 -3.530 1.00 11.30 H new ATOM 1485 N SER A 95 -4.851 -18.825 -3.526 1.00 71.14 N ATOM 1486 CA SER A 95 -5.787 -17.729 -3.487 1.00 23.22 C ATOM 1487 C SER A 95 -5.201 -16.521 -4.217 1.00 4.12 C ATOM 1488 O SER A 95 -4.013 -16.491 -4.561 1.00 41.35 O ATOM 1489 CB SER A 95 -6.066 -17.395 -2.024 1.00 3.04 C ATOM 1490 OG SER A 95 -6.348 -18.535 -1.223 1.00 12.42 O ATOM 0 H SER A 95 -3.933 -18.575 -3.158 1.00 71.14 H new ATOM 0 HA SER A 95 -6.718 -18.002 -3.984 1.00 23.22 H new ATOM 0 HB2 SER A 95 -5.204 -16.874 -1.608 1.00 3.04 H new ATOM 0 HB3 SER A 95 -6.910 -16.707 -1.972 1.00 3.04 H new ATOM 0 HG SER A 95 -5.544 -19.091 -1.151 1.00 12.42 H new ATOM 1496 N GLU A 96 -6.039 -15.523 -4.453 1.00 10.30 N ATOM 1497 CA GLU A 96 -5.681 -14.220 -5.004 1.00 54.14 C ATOM 1498 C GLU A 96 -4.966 -13.362 -3.945 1.00 5.20 C ATOM 1499 O GLU A 96 -5.087 -13.662 -2.756 1.00 64.42 O ATOM 1500 CB GLU A 96 -6.970 -13.572 -5.533 1.00 30.30 C ATOM 1501 CG GLU A 96 -7.982 -13.303 -4.407 1.00 22.51 C ATOM 1502 CD GLU A 96 -9.436 -13.508 -4.835 1.00 44.14 C ATOM 1503 OE1 GLU A 96 -9.769 -14.612 -5.330 1.00 24.22 O ATOM 1504 OE2 GLU A 96 -10.276 -12.601 -4.631 1.00 72.54 O ATOM 0 H GLU A 96 -7.037 -15.601 -4.257 1.00 10.30 H new ATOM 0 HA GLU A 96 -4.974 -14.318 -5.827 1.00 54.14 H new ATOM 0 HB2 GLU A 96 -6.726 -12.635 -6.033 1.00 30.30 H new ATOM 0 HB3 GLU A 96 -7.423 -14.223 -6.280 1.00 30.30 H new ATOM 0 HG2 GLU A 96 -7.762 -13.961 -3.566 1.00 22.51 H new ATOM 0 HG3 GLU A 96 -7.856 -12.280 -4.052 1.00 22.51 H new ATOM 1511 N PRO A 97 -4.218 -12.306 -4.309 1.00 22.04 N ATOM 1512 CA PRO A 97 -3.660 -11.386 -3.324 1.00 53.54 C ATOM 1513 C PRO A 97 -4.707 -10.446 -2.718 1.00 22.42 C ATOM 1514 O PRO A 97 -5.781 -10.239 -3.285 1.00 33.44 O ATOM 1515 CB PRO A 97 -2.574 -10.591 -4.040 1.00 50.15 C ATOM 1516 CG PRO A 97 -2.968 -10.675 -5.516 1.00 33.40 C ATOM 1517 CD PRO A 97 -3.725 -11.999 -5.641 1.00 74.11 C ATOM 0 HA PRO A 97 -3.263 -11.953 -2.482 1.00 53.54 H new ATOM 0 HB2 PRO A 97 -2.541 -9.558 -3.694 1.00 50.15 H new ATOM 0 HB3 PRO A 97 -1.586 -11.017 -3.865 1.00 50.15 H new ATOM 0 HG2 PRO A 97 -3.594 -9.832 -5.807 1.00 33.40 H new ATOM 0 HG3 PRO A 97 -2.090 -10.658 -6.162 1.00 33.40 H new ATOM 0 HD2 PRO A 97 -4.547 -11.913 -6.351 1.00 74.11 H new ATOM 0 HD3 PRO A 97 -3.070 -12.790 -6.006 1.00 74.11 H new ATOM 1525 N SER A 98 -4.331 -9.808 -1.605 1.00 63.23 N ATOM 1526 CA SER A 98 -4.968 -8.604 -1.076 1.00 62.35 C ATOM 1527 C SER A 98 -4.104 -7.386 -1.403 1.00 74.55 C ATOM 1528 O SER A 98 -4.583 -6.410 -1.983 1.00 75.44 O ATOM 1529 CB SER A 98 -5.147 -8.709 0.445 1.00 53.44 C ATOM 1530 OG SER A 98 -6.247 -9.530 0.770 1.00 10.45 O ATOM 0 H SER A 98 -3.550 -10.128 -1.032 1.00 63.23 H new ATOM 0 HA SER A 98 -5.950 -8.498 -1.537 1.00 62.35 H new ATOM 0 HB2 SER A 98 -4.241 -9.115 0.894 1.00 53.44 H new ATOM 0 HB3 SER A 98 -5.294 -7.715 0.867 1.00 53.44 H new ATOM 0 HG SER A 98 -6.339 -9.583 1.744 1.00 10.45 H new ATOM 1536 N LEU A 99 -2.815 -7.423 -1.063 1.00 64.42 N ATOM 1537 CA LEU A 99 -1.970 -6.231 -0.969 1.00 71.23 C ATOM 1538 C LEU A 99 -0.993 -6.219 -2.145 1.00 43.12 C ATOM 1539 O LEU A 99 -0.412 -7.261 -2.462 1.00 44.52 O ATOM 1540 CB LEU A 99 -1.280 -6.280 0.404 1.00 75.31 C ATOM 1541 CG LEU A 99 -0.368 -5.106 0.802 1.00 21.44 C ATOM 1542 CD1 LEU A 99 -1.100 -3.764 0.849 1.00 54.52 C ATOM 1543 CD2 LEU A 99 0.175 -5.397 2.207 1.00 2.10 C ATOM 0 H LEU A 99 -2.323 -8.289 -0.843 1.00 64.42 H new ATOM 0 HA LEU A 99 -2.536 -5.302 -1.035 1.00 71.23 H new ATOM 0 HB2 LEU A 99 -2.056 -6.371 1.164 1.00 75.31 H new ATOM 0 HB3 LEU A 99 -0.685 -7.192 0.445 1.00 75.31 H new ATOM 0 HG LEU A 99 0.416 -5.024 0.050 1.00 21.44 H new ATOM 0 HD11 LEU A 99 -0.401 -2.978 1.136 1.00 54.52 H new ATOM 0 HD12 LEU A 99 -1.514 -3.541 -0.134 1.00 54.52 H new ATOM 0 HD13 LEU A 99 -1.908 -3.815 1.579 1.00 54.52 H new ATOM 0 HD21 LEU A 99 0.827 -4.582 2.521 1.00 2.10 H new ATOM 0 HD22 LEU A 99 -0.656 -5.487 2.907 1.00 2.10 H new ATOM 0 HD23 LEU A 99 0.740 -6.329 2.193 1.00 2.10 H new ATOM 1555 N ARG A 100 -0.849 -5.078 -2.828 1.00 53.23 N ATOM 1556 CA ARG A 100 0.072 -4.897 -3.957 1.00 21.01 C ATOM 1557 C ARG A 100 0.706 -3.514 -3.824 1.00 3.14 C ATOM 1558 O ARG A 100 -0.019 -2.538 -3.593 1.00 23.21 O ATOM 1559 CB ARG A 100 -0.669 -5.059 -5.309 1.00 60.33 C ATOM 1560 CG ARG A 100 0.203 -5.762 -6.368 1.00 33.24 C ATOM 1561 CD ARG A 100 -0.582 -6.358 -7.544 1.00 34.40 C ATOM 1562 NE ARG A 100 -1.179 -5.294 -8.344 1.00 54.22 N ATOM 1563 CZ ARG A 100 -1.604 -5.354 -9.604 1.00 40.32 C ATOM 1564 NH1 ARG A 100 -1.713 -6.507 -10.261 1.00 43.34 N ATOM 1565 NH2 ARG A 100 -1.934 -4.211 -10.188 1.00 71.33 N ATOM 0 H ARG A 100 -1.381 -4.236 -2.607 1.00 53.23 H new ATOM 0 HA ARG A 100 0.850 -5.661 -3.939 1.00 21.01 H new ATOM 0 HB2 ARG A 100 -1.583 -5.632 -5.154 1.00 60.33 H new ATOM 0 HB3 ARG A 100 -0.967 -4.078 -5.679 1.00 60.33 H new ATOM 0 HG2 ARG A 100 0.928 -5.047 -6.757 1.00 33.24 H new ATOM 0 HG3 ARG A 100 0.769 -6.558 -5.884 1.00 33.24 H new ATOM 0 HD2 ARG A 100 0.081 -6.961 -8.165 1.00 34.40 H new ATOM 0 HD3 ARG A 100 -1.361 -7.023 -7.171 1.00 34.40 H new ATOM 0 HE ARG A 100 -1.284 -4.392 -7.880 1.00 54.22 H new ATOM 0 HH11 ARG A 100 -1.467 -7.382 -9.799 1.00 43.34 H new ATOM 0 HH12 ARG A 100 -2.042 -6.515 -11.226 1.00 43.34 H new ATOM 0 HH21 ARG A 100 -1.857 -3.334 -9.673 1.00 71.33 H new ATOM 0 HH22 ARG A 100 -2.265 -4.208 -11.153 1.00 71.33 H new ATOM 1579 N VAL A 101 2.030 -3.403 -3.923 1.00 41.12 N ATOM 1580 CA VAL A 101 2.750 -2.141 -3.782 1.00 64.23 C ATOM 1581 C VAL A 101 3.888 -2.109 -4.807 1.00 63.02 C ATOM 1582 O VAL A 101 4.768 -2.966 -4.802 1.00 13.34 O ATOM 1583 CB VAL A 101 3.243 -1.936 -2.329 1.00 1.24 C ATOM 1584 CG1 VAL A 101 3.758 -0.499 -2.175 1.00 2.10 C ATOM 1585 CG2 VAL A 101 2.165 -2.179 -1.267 1.00 73.21 C ATOM 0 H VAL A 101 2.640 -4.200 -4.106 1.00 41.12 H new ATOM 0 HA VAL A 101 2.082 -1.304 -3.985 1.00 64.23 H new ATOM 0 HB VAL A 101 4.028 -2.674 -2.163 1.00 1.24 H new ATOM 0 HG11 VAL A 101 4.108 -0.345 -1.154 1.00 2.10 H new ATOM 0 HG12 VAL A 101 4.581 -0.331 -2.870 1.00 2.10 H new ATOM 0 HG13 VAL A 101 2.952 0.202 -2.392 1.00 2.10 H new ATOM 0 HG21 VAL A 101 2.588 -2.016 -0.276 1.00 73.21 H new ATOM 0 HG22 VAL A 101 1.336 -1.490 -1.426 1.00 73.21 H new ATOM 0 HG23 VAL A 101 1.804 -3.205 -1.343 1.00 73.21 H new ATOM 1595 N VAL A 102 3.877 -1.120 -5.696 1.00 53.45 N ATOM 1596 CA VAL A 102 4.799 -0.993 -6.827 1.00 11.24 C ATOM 1597 C VAL A 102 5.846 0.046 -6.451 1.00 60.42 C ATOM 1598 O VAL A 102 5.482 1.127 -5.985 1.00 1.13 O ATOM 1599 CB VAL A 102 3.979 -0.507 -8.034 1.00 2.34 C ATOM 1600 CG1 VAL A 102 4.793 -0.272 -9.310 1.00 63.44 C ATOM 1601 CG2 VAL A 102 2.949 -1.587 -8.327 1.00 21.03 C ATOM 0 H VAL A 102 3.203 -0.356 -5.649 1.00 53.45 H new ATOM 0 HA VAL A 102 5.290 -1.936 -7.069 1.00 11.24 H new ATOM 0 HB VAL A 102 3.550 0.459 -7.767 1.00 2.34 H new ATOM 0 HG11 VAL A 102 4.131 0.069 -10.106 1.00 63.44 H new ATOM 0 HG12 VAL A 102 5.554 0.485 -9.122 1.00 63.44 H new ATOM 0 HG13 VAL A 102 5.274 -1.203 -9.611 1.00 63.44 H new ATOM 0 HG21 VAL A 102 2.340 -1.287 -9.180 1.00 21.03 H new ATOM 0 HG22 VAL A 102 3.458 -2.523 -8.556 1.00 21.03 H new ATOM 0 HG23 VAL A 102 2.310 -1.726 -7.455 1.00 21.03 H new ATOM 1611 N PHE A 103 7.126 -0.247 -6.663 1.00 41.24 N ATOM 1612 CA PHE A 103 8.233 0.616 -6.235 1.00 62.31 C ATOM 1613 C PHE A 103 9.156 0.886 -7.417 1.00 22.41 C ATOM 1614 O PHE A 103 9.860 -0.016 -7.868 1.00 72.05 O ATOM 1615 CB PHE A 103 9.041 0.029 -5.057 1.00 62.34 C ATOM 1616 CG PHE A 103 8.283 -0.323 -3.789 1.00 14.32 C ATOM 1617 CD1 PHE A 103 7.389 -1.409 -3.780 1.00 11.52 C ATOM 1618 CD2 PHE A 103 8.547 0.357 -2.582 1.00 51.32 C ATOM 1619 CE1 PHE A 103 6.774 -1.814 -2.588 1.00 54.35 C ATOM 1620 CE2 PHE A 103 7.885 -0.017 -1.400 1.00 43.13 C ATOM 1621 CZ PHE A 103 7.011 -1.112 -1.400 1.00 43.11 C ATOM 0 H PHE A 103 7.431 -1.096 -7.140 1.00 41.24 H new ATOM 0 HA PHE A 103 7.792 1.546 -5.877 1.00 62.31 H new ATOM 0 HB2 PHE A 103 9.542 -0.872 -5.410 1.00 62.34 H new ATOM 0 HB3 PHE A 103 9.820 0.745 -4.795 1.00 62.34 H new ATOM 0 HD1 PHE A 103 7.175 -1.935 -4.699 1.00 11.52 H new ATOM 0 HD2 PHE A 103 9.260 1.168 -2.566 1.00 51.32 H new ATOM 0 HE1 PHE A 103 6.115 -2.670 -2.586 1.00 54.35 H new ATOM 0 HE2 PHE A 103 8.050 0.541 -0.490 1.00 43.13 H new ATOM 0 HZ PHE A 103 6.521 -1.414 -0.486 1.00 43.11 H new ATOM 1631 N GLU A 104 9.185 2.125 -7.905 1.00 14.42 N ATOM 1632 CA GLU A 104 10.056 2.564 -8.991 1.00 22.44 C ATOM 1633 C GLU A 104 11.142 3.455 -8.394 1.00 33.03 C ATOM 1634 O GLU A 104 10.912 4.143 -7.396 1.00 60.33 O ATOM 1635 CB GLU A 104 9.234 3.320 -10.053 1.00 35.44 C ATOM 1636 CG GLU A 104 8.237 2.371 -10.731 1.00 15.33 C ATOM 1637 CD GLU A 104 7.387 3.024 -11.824 1.00 11.44 C ATOM 1638 OE1 GLU A 104 6.553 3.915 -11.539 1.00 64.01 O ATOM 1639 OE2 GLU A 104 7.506 2.626 -13.003 1.00 52.54 O ATOM 0 H GLU A 104 8.587 2.870 -7.546 1.00 14.42 H new ATOM 0 HA GLU A 104 10.519 1.709 -9.484 1.00 22.44 H new ATOM 0 HB2 GLU A 104 8.699 4.148 -9.587 1.00 35.44 H new ATOM 0 HB3 GLU A 104 9.901 3.751 -10.799 1.00 35.44 H new ATOM 0 HG2 GLU A 104 8.787 1.536 -11.165 1.00 15.33 H new ATOM 0 HG3 GLU A 104 7.574 1.956 -9.971 1.00 15.33 H new ATOM 1646 N LEU A 105 12.321 3.450 -9.007 1.00 73.12 N ATOM 1647 CA LEU A 105 13.486 4.236 -8.605 1.00 55.32 C ATOM 1648 C LEU A 105 13.745 5.312 -9.663 1.00 12.30 C ATOM 1649 O LEU A 105 14.281 5.027 -10.739 1.00 35.02 O ATOM 1650 CB LEU A 105 14.695 3.309 -8.414 1.00 55.52 C ATOM 1651 CG LEU A 105 15.990 4.026 -7.992 1.00 2.32 C ATOM 1652 CD1 LEU A 105 16.090 4.244 -6.486 1.00 1.32 C ATOM 1653 CD2 LEU A 105 17.205 3.209 -8.437 1.00 3.54 C ATOM 0 H LEU A 105 12.500 2.876 -9.831 1.00 73.12 H new ATOM 0 HA LEU A 105 13.305 4.733 -7.652 1.00 55.32 H new ATOM 0 HB2 LEU A 105 14.447 2.561 -7.661 1.00 55.52 H new ATOM 0 HB3 LEU A 105 14.878 2.775 -9.346 1.00 55.52 H new ATOM 0 HG LEU A 105 15.969 5.003 -8.474 1.00 2.32 H new ATOM 0 HD11 LEU A 105 17.025 4.754 -6.253 1.00 1.32 H new ATOM 0 HD12 LEU A 105 15.251 4.854 -6.150 1.00 1.32 H new ATOM 0 HD13 LEU A 105 16.065 3.281 -5.977 1.00 1.32 H new ATOM 0 HD21 LEU A 105 18.118 3.722 -8.135 1.00 3.54 H new ATOM 0 HD22 LEU A 105 17.171 2.224 -7.972 1.00 3.54 H new ATOM 0 HD23 LEU A 105 17.192 3.099 -9.521 1.00 3.54 H new ATOM 1665 N THR A 106 13.402 6.559 -9.350 1.00 75.01 N ATOM 1666 CA THR A 106 13.550 7.709 -10.229 1.00 33.00 C ATOM 1667 C THR A 106 14.499 8.708 -9.566 1.00 12.53 C ATOM 1668 O THR A 106 14.344 9.022 -8.387 1.00 35.20 O ATOM 1669 CB THR A 106 12.175 8.347 -10.492 1.00 15.13 C ATOM 1670 OG1 THR A 106 11.163 7.383 -10.748 1.00 4.21 O ATOM 1671 CG2 THR A 106 12.235 9.313 -11.674 1.00 40.41 C ATOM 0 H THR A 106 12.999 6.802 -8.445 1.00 75.01 H new ATOM 0 HA THR A 106 13.965 7.402 -11.189 1.00 33.00 H new ATOM 0 HB THR A 106 11.918 8.884 -9.579 1.00 15.13 H new ATOM 0 HG1 THR A 106 10.310 7.839 -10.907 1.00 4.21 H new ATOM 0 HG21 THR A 106 11.250 9.749 -11.838 1.00 40.41 H new ATOM 0 HG22 THR A 106 12.952 10.106 -11.460 1.00 40.41 H new ATOM 0 HG23 THR A 106 12.546 8.774 -12.569 1.00 40.41 H new ATOM 1679 N ASP A 107 15.454 9.252 -10.322 1.00 15.20 N ATOM 1680 CA ASP A 107 16.370 10.311 -9.873 1.00 62.15 C ATOM 1681 C ASP A 107 17.151 9.865 -8.623 1.00 22.23 C ATOM 1682 O ASP A 107 17.452 10.665 -7.736 1.00 34.11 O ATOM 1683 CB ASP A 107 15.598 11.639 -9.705 1.00 52.32 C ATOM 1684 CG ASP A 107 16.256 12.835 -10.394 1.00 60.31 C ATOM 1685 OD1 ASP A 107 15.921 13.077 -11.582 1.00 62.23 O ATOM 1686 OD2 ASP A 107 17.003 13.590 -9.741 1.00 34.01 O ATOM 0 H ASP A 107 15.619 8.964 -11.287 1.00 15.20 H new ATOM 0 HA ASP A 107 17.130 10.497 -10.632 1.00 62.15 H new ATOM 0 HB2 ASP A 107 14.591 11.514 -10.102 1.00 52.32 H new ATOM 0 HB3 ASP A 107 15.497 11.856 -8.642 1.00 52.32 H new ATOM 1691 N GLY A 108 17.430 8.558 -8.513 1.00 62.15 N ATOM 1692 CA GLY A 108 18.131 7.950 -7.395 1.00 14.22 C ATOM 1693 C GLY A 108 17.258 7.716 -6.160 1.00 75.25 C ATOM 1694 O GLY A 108 17.781 7.283 -5.134 1.00 31.00 O ATOM 0 H GLY A 108 17.161 7.882 -9.228 1.00 62.15 H new ATOM 0 HA2 GLY A 108 18.548 6.996 -7.718 1.00 14.22 H new ATOM 0 HA3 GLY A 108 18.971 8.587 -7.117 1.00 14.22 H new ATOM 1698 N LYS A 109 15.945 7.964 -6.206 1.00 53.22 N ATOM 1699 CA LYS A 109 15.070 7.835 -5.041 1.00 54.53 C ATOM 1700 C LYS A 109 13.895 6.945 -5.394 1.00 14.53 C ATOM 1701 O LYS A 109 13.434 6.936 -6.531 1.00 74.04 O ATOM 1702 CB LYS A 109 14.617 9.235 -4.585 1.00 62.35 C ATOM 1703 CG LYS A 109 15.790 10.146 -4.184 1.00 44.22 C ATOM 1704 CD LYS A 109 16.453 9.688 -2.880 1.00 43.34 C ATOM 1705 CE LYS A 109 17.885 10.206 -2.786 1.00 34.12 C ATOM 1706 NZ LYS A 109 18.502 9.861 -1.486 1.00 74.22 N ATOM 0 H LYS A 109 15.461 8.260 -7.054 1.00 53.22 H new ATOM 0 HA LYS A 109 15.603 7.371 -4.211 1.00 54.53 H new ATOM 0 HB2 LYS A 109 14.055 9.709 -5.390 1.00 62.35 H new ATOM 0 HB3 LYS A 109 13.938 9.133 -3.739 1.00 62.35 H new ATOM 0 HG2 LYS A 109 16.531 10.156 -4.983 1.00 44.22 H new ATOM 0 HG3 LYS A 109 15.432 11.169 -4.069 1.00 44.22 H new ATOM 0 HD2 LYS A 109 15.876 10.047 -2.028 1.00 43.34 H new ATOM 0 HD3 LYS A 109 16.452 8.599 -2.830 1.00 43.34 H new ATOM 0 HE2 LYS A 109 18.480 9.783 -3.596 1.00 34.12 H new ATOM 0 HE3 LYS A 109 17.891 11.288 -2.917 1.00 34.12 H new ATOM 0 HZ1 LYS A 109 19.528 9.747 -1.608 1.00 74.22 H new ATOM 0 HZ2 LYS A 109 18.317 10.622 -0.801 1.00 74.22 H new ATOM 0 HZ3 LYS A 109 18.094 8.971 -1.133 1.00 74.22 H new ATOM 1720 N TRP A 110 13.442 6.158 -4.421 1.00 14.50 N ATOM 1721 CA TRP A 110 12.289 5.297 -4.617 1.00 62.04 C ATOM 1722 C TRP A 110 11.020 6.134 -4.511 1.00 73.43 C ATOM 1723 O TRP A 110 10.980 7.129 -3.774 1.00 12.24 O ATOM 1724 CB TRP A 110 12.321 4.132 -3.627 1.00 22.31 C ATOM 1725 CG TRP A 110 13.447 3.172 -3.866 1.00 31.03 C ATOM 1726 CD1 TRP A 110 14.695 3.296 -3.371 1.00 40.24 C ATOM 1727 CD2 TRP A 110 13.491 2.011 -4.752 1.00 55.44 C ATOM 1728 NE1 TRP A 110 15.485 2.257 -3.820 1.00 34.22 N ATOM 1729 CE2 TRP A 110 14.797 1.442 -4.691 1.00 72.41 C ATOM 1730 CE3 TRP A 110 12.584 1.424 -5.658 1.00 31.43 C ATOM 1731 CZ2 TRP A 110 15.177 0.338 -5.470 1.00 41.32 C ATOM 1732 CZ3 TRP A 110 12.955 0.323 -6.452 1.00 60.24 C ATOM 1733 CH2 TRP A 110 14.245 -0.227 -6.354 1.00 15.10 C ATOM 0 H TRP A 110 13.858 6.102 -3.492 1.00 14.50 H new ATOM 0 HA TRP A 110 12.310 4.853 -5.612 1.00 62.04 H new ATOM 0 HB2 TRP A 110 12.401 4.528 -2.615 1.00 22.31 H new ATOM 0 HB3 TRP A 110 11.376 3.592 -3.684 1.00 22.31 H new ATOM 0 HD1 TRP A 110 15.027 4.091 -2.720 1.00 40.24 H new ATOM 0 HE1 TRP A 110 16.455 2.111 -3.542 1.00 34.22 H new ATOM 0 HE3 TRP A 110 11.586 1.827 -5.744 1.00 31.43 H new ATOM 0 HZ2 TRP A 110 16.173 -0.071 -5.390 1.00 41.32 H new ATOM 0 HZ3 TRP A 110 12.242 -0.103 -7.143 1.00 60.24 H new ATOM 0 HH2 TRP A 110 14.518 -1.081 -6.957 1.00 15.10 H new ATOM 1744 N TYR A 111 10.010 5.699 -5.253 1.00 71.31 N ATOM 1745 CA TYR A 111 8.724 6.321 -5.464 1.00 55.31 C ATOM 1746 C TYR A 111 7.697 5.205 -5.620 1.00 15.41 C ATOM 1747 O TYR A 111 7.884 4.297 -6.431 1.00 75.43 O ATOM 1748 CB TYR A 111 8.826 7.202 -6.718 1.00 44.43 C ATOM 1749 CG TYR A 111 9.551 8.497 -6.416 1.00 0.11 C ATOM 1750 CD1 TYR A 111 9.048 9.394 -5.452 1.00 63.01 C ATOM 1751 CD2 TYR A 111 10.797 8.747 -7.006 1.00 12.12 C ATOM 1752 CE1 TYR A 111 9.784 10.521 -5.065 1.00 60.20 C ATOM 1753 CE2 TYR A 111 11.534 9.881 -6.642 1.00 14.20 C ATOM 1754 CZ TYR A 111 11.034 10.765 -5.664 1.00 2.52 C ATOM 1755 OH TYR A 111 11.767 11.819 -5.228 1.00 31.44 O ATOM 0 H TYR A 111 10.085 4.821 -5.766 1.00 71.31 H new ATOM 0 HA TYR A 111 8.419 6.955 -4.632 1.00 55.31 H new ATOM 0 HB2 TYR A 111 9.353 6.661 -7.504 1.00 44.43 H new ATOM 0 HB3 TYR A 111 7.827 7.420 -7.095 1.00 44.43 H new ATOM 0 HD1 TYR A 111 8.082 9.210 -5.006 1.00 63.01 H new ATOM 0 HD2 TYR A 111 11.190 8.063 -7.744 1.00 12.12 H new ATOM 0 HE1 TYR A 111 9.397 11.195 -4.315 1.00 60.20 H new ATOM 0 HE2 TYR A 111 12.487 10.079 -7.111 1.00 14.20 H new ATOM 0 HH TYR A 111 12.607 11.864 -5.731 1.00 31.44 H new ATOM 1765 N VAL A 112 6.659 5.170 -4.783 1.00 62.21 N ATOM 1766 CA VAL A 112 5.544 4.252 -4.931 1.00 20.44 C ATOM 1767 C VAL A 112 4.572 4.919 -5.910 1.00 51.42 C ATOM 1768 O VAL A 112 4.267 6.112 -5.753 1.00 23.22 O ATOM 1769 CB VAL A 112 4.897 3.959 -3.563 1.00 73.41 C ATOM 1770 CG1 VAL A 112 4.038 2.696 -3.642 1.00 62.32 C ATOM 1771 CG2 VAL A 112 5.894 3.704 -2.415 1.00 11.51 C ATOM 0 H VAL A 112 6.574 5.788 -3.976 1.00 62.21 H new ATOM 0 HA VAL A 112 5.860 3.283 -5.318 1.00 20.44 H new ATOM 0 HB VAL A 112 4.328 4.862 -3.344 1.00 73.41 H new ATOM 0 HG11 VAL A 112 3.587 2.501 -2.669 1.00 62.32 H new ATOM 0 HG12 VAL A 112 3.252 2.836 -4.384 1.00 62.32 H new ATOM 0 HG13 VAL A 112 4.661 1.849 -3.929 1.00 62.32 H new ATOM 0 HG21 VAL A 112 5.346 3.507 -1.494 1.00 11.51 H new ATOM 0 HG22 VAL A 112 6.516 2.843 -2.658 1.00 11.51 H new ATOM 0 HG23 VAL A 112 6.526 4.582 -2.281 1.00 11.51 H new ATOM 1781 N THR A 113 4.151 4.213 -6.959 1.00 15.35 N ATOM 1782 CA THR A 113 3.479 4.833 -8.104 1.00 53.40 C ATOM 1783 C THR A 113 2.122 4.195 -8.428 1.00 2.55 C ATOM 1784 O THR A 113 1.336 4.772 -9.186 1.00 11.21 O ATOM 1785 CB THR A 113 4.445 4.814 -9.300 1.00 62.14 C ATOM 1786 OG1 THR A 113 4.876 3.502 -9.575 1.00 35.12 O ATOM 1787 CG2 THR A 113 5.697 5.664 -9.036 1.00 15.53 C ATOM 0 H THR A 113 4.264 3.203 -7.041 1.00 15.35 H new ATOM 0 HA THR A 113 3.234 5.865 -7.852 1.00 53.40 H new ATOM 0 HB THR A 113 3.893 5.224 -10.145 1.00 62.14 H new ATOM 0 HG1 THR A 113 5.354 3.487 -10.431 1.00 35.12 H new ATOM 0 HG21 THR A 113 6.354 5.624 -9.905 1.00 15.53 H new ATOM 0 HG22 THR A 113 5.403 6.697 -8.851 1.00 15.53 H new ATOM 0 HG23 THR A 113 6.224 5.275 -8.165 1.00 15.53 H new ATOM 1795 N ASP A 114 1.808 3.061 -7.802 1.00 51.52 N ATOM 1796 CA ASP A 114 0.549 2.335 -7.925 1.00 23.44 C ATOM 1797 C ASP A 114 0.252 1.708 -6.560 1.00 43.31 C ATOM 1798 O ASP A 114 1.172 1.578 -5.740 1.00 32.42 O ATOM 1799 CB ASP A 114 0.705 1.255 -8.998 1.00 72.41 C ATOM 1800 CG ASP A 114 -0.643 0.773 -9.516 1.00 4.15 C ATOM 1801 OD1 ASP A 114 -1.238 1.489 -10.346 1.00 21.31 O ATOM 1802 OD2 ASP A 114 -1.106 -0.316 -9.115 1.00 41.50 O ATOM 0 H ASP A 114 2.459 2.603 -7.164 1.00 51.52 H new ATOM 0 HA ASP A 114 -0.271 2.991 -8.217 1.00 23.44 H new ATOM 0 HB2 ASP A 114 1.293 1.649 -9.827 1.00 72.41 H new ATOM 0 HB3 ASP A 114 1.259 0.411 -8.587 1.00 72.41 H new ATOM 1807 N CYS A 115 -0.999 1.346 -6.280 1.00 4.51 N ATOM 1808 CA CYS A 115 -1.407 0.747 -5.013 1.00 42.13 C ATOM 1809 C CYS A 115 -2.507 -0.279 -5.217 1.00 54.30 C ATOM 1810 O CYS A 115 -3.345 -0.166 -6.114 1.00 62.44 O ATOM 1811 CB CYS A 115 -1.842 1.874 -4.050 1.00 74.01 C ATOM 1812 SG CYS A 115 -2.801 1.431 -2.568 1.00 4.55 S ATOM 0 H CYS A 115 -1.769 1.463 -6.939 1.00 4.51 H new ATOM 0 HA CYS A 115 -0.566 0.210 -4.574 1.00 42.13 H new ATOM 0 HB2 CYS A 115 -0.942 2.393 -3.719 1.00 74.01 H new ATOM 0 HB3 CYS A 115 -2.430 2.591 -4.623 1.00 74.01 H new ATOM 0 HG CYS A 115 -3.069 2.506 -1.887 1.00 4.55 H new ATOM 1818 N TYR A 116 -2.564 -1.217 -4.282 1.00 32.42 N ATOM 1819 CA TYR A 116 -3.720 -2.023 -3.975 1.00 13.44 C ATOM 1820 C TYR A 116 -3.679 -2.182 -2.456 1.00 43.40 C ATOM 1821 O TYR A 116 -2.821 -2.909 -1.951 1.00 41.40 O ATOM 1822 CB TYR A 116 -3.599 -3.351 -4.732 1.00 21.31 C ATOM 1823 CG TYR A 116 -4.904 -4.011 -5.096 1.00 43.00 C ATOM 1824 CD1 TYR A 116 -5.830 -4.379 -4.105 1.00 34.32 C ATOM 1825 CD2 TYR A 116 -5.155 -4.311 -6.444 1.00 54.04 C ATOM 1826 CE1 TYR A 116 -7.026 -5.023 -4.466 1.00 23.41 C ATOM 1827 CE2 TYR A 116 -6.354 -4.945 -6.812 1.00 44.44 C ATOM 1828 CZ TYR A 116 -7.293 -5.311 -5.823 1.00 31.35 C ATOM 1829 OH TYR A 116 -8.460 -5.921 -6.161 1.00 51.32 O ATOM 0 H TYR A 116 -1.762 -1.441 -3.693 1.00 32.42 H new ATOM 0 HA TYR A 116 -4.674 -1.591 -4.277 1.00 13.44 H new ATOM 0 HB2 TYR A 116 -3.032 -3.178 -5.647 1.00 21.31 H new ATOM 0 HB3 TYR A 116 -3.018 -4.044 -4.124 1.00 21.31 H new ATOM 0 HD1 TYR A 116 -5.623 -4.167 -3.066 1.00 34.32 H new ATOM 0 HD2 TYR A 116 -4.426 -4.054 -7.199 1.00 54.04 H new ATOM 0 HE1 TYR A 116 -7.742 -5.298 -3.705 1.00 23.41 H new ATOM 0 HE2 TYR A 116 -6.557 -5.152 -7.852 1.00 44.44 H new ATOM 0 HH TYR A 116 -8.493 -6.049 -7.132 1.00 51.32 H new ATOM 1839 N ASN A 117 -4.519 -1.460 -1.705 1.00 21.24 N ATOM 1840 CA ASN A 117 -4.707 -1.714 -0.270 1.00 42.43 C ATOM 1841 C ASN A 117 -6.163 -2.081 -0.036 1.00 62.24 C ATOM 1842 O ASN A 117 -7.050 -1.602 -0.750 1.00 11.42 O ATOM 1843 CB ASN A 117 -4.334 -0.529 0.646 1.00 40.33 C ATOM 1844 CG ASN A 117 -4.100 -0.994 2.085 1.00 14.23 C ATOM 1845 OD1 ASN A 117 -3.922 -2.175 2.374 1.00 31.35 O ATOM 1846 ND2 ASN A 117 -4.091 -0.075 3.024 1.00 0.14 N ATOM 0 H ASN A 117 -5.082 -0.691 -2.069 1.00 21.24 H new ATOM 0 HA ASN A 117 -4.026 -2.523 -0.005 1.00 42.43 H new ATOM 0 HB2 ASN A 117 -3.435 -0.042 0.268 1.00 40.33 H new ATOM 0 HB3 ASN A 117 -5.131 0.214 0.626 1.00 40.33 H new ATOM 0 HD21 ASN A 117 -3.936 -0.341 3.996 1.00 0.14 H new ATOM 0 HD22 ASN A 117 -4.239 0.904 2.781 1.00 0.14 H new ATOM 1853 N ASP A 118 -6.414 -2.913 0.966 1.00 3.04 N ATOM 1854 CA ASP A 118 -7.697 -3.590 1.133 1.00 35.21 C ATOM 1855 C ASP A 118 -8.771 -2.685 1.753 1.00 73.51 C ATOM 1856 O ASP A 118 -9.950 -3.029 1.713 1.00 13.15 O ATOM 1857 CB ASP A 118 -7.478 -4.871 1.946 1.00 3.12 C ATOM 1858 CG ASP A 118 -8.565 -5.917 1.693 1.00 31.44 C ATOM 1859 OD1 ASP A 118 -8.771 -6.284 0.510 1.00 1.25 O ATOM 1860 OD2 ASP A 118 -9.127 -6.433 2.681 1.00 32.33 O ATOM 0 H ASP A 118 -5.732 -3.139 1.690 1.00 3.04 H new ATOM 0 HA ASP A 118 -8.084 -3.851 0.148 1.00 35.21 H new ATOM 0 HB2 ASP A 118 -6.505 -5.295 1.696 1.00 3.12 H new ATOM 0 HB3 ASP A 118 -7.455 -4.625 3.008 1.00 3.12 H new ATOM 1865 N TRP A 119 -8.390 -1.503 2.266 1.00 52.24 N ATOM 1866 CA TRP A 119 -9.276 -0.457 2.804 1.00 12.44 C ATOM 1867 C TRP A 119 -10.314 0.076 1.815 1.00 64.34 C ATOM 1868 O TRP A 119 -11.218 0.788 2.229 1.00 13.04 O ATOM 1869 CB TRP A 119 -8.434 0.757 3.237 1.00 74.11 C ATOM 1870 CG TRP A 119 -7.974 0.799 4.653 1.00 55.31 C ATOM 1871 CD1 TRP A 119 -6.697 0.980 5.034 1.00 42.22 C ATOM 1872 CD2 TRP A 119 -8.769 0.860 5.877 1.00 41.03 C ATOM 1873 NE1 TRP A 119 -6.634 1.143 6.402 1.00 75.10 N ATOM 1874 CE2 TRP A 119 -7.888 1.096 6.972 1.00 1.43 C ATOM 1875 CE3 TRP A 119 -10.146 0.805 6.171 1.00 34.52 C ATOM 1876 CZ2 TRP A 119 -8.350 1.271 8.285 1.00 3.41 C ATOM 1877 CZ3 TRP A 119 -10.619 0.981 7.487 1.00 63.30 C ATOM 1878 CH2 TRP A 119 -9.726 1.219 8.547 1.00 4.12 C ATOM 0 H TRP A 119 -7.406 -1.238 2.319 1.00 52.24 H new ATOM 0 HA TRP A 119 -9.805 -0.938 3.627 1.00 12.44 H new ATOM 0 HB2 TRP A 119 -7.554 0.804 2.595 1.00 74.11 H new ATOM 0 HB3 TRP A 119 -9.017 1.658 3.045 1.00 74.11 H new ATOM 0 HD1 TRP A 119 -5.847 0.995 4.368 1.00 42.22 H new ATOM 0 HE1 TRP A 119 -5.769 1.281 6.925 1.00 75.10 H new ATOM 0 HE3 TRP A 119 -10.852 0.625 5.374 1.00 34.52 H new ATOM 0 HZ2 TRP A 119 -7.650 1.445 9.089 1.00 3.41 H new ATOM 0 HZ3 TRP A 119 -11.680 0.933 7.684 1.00 63.30 H new ATOM 0 HH2 TRP A 119 -10.096 1.360 9.552 1.00 4.12 H new ATOM 1889 N TYR A 120 -10.136 -0.169 0.518 1.00 55.40 N ATOM 1890 CA TYR A 120 -11.005 0.357 -0.534 1.00 74.50 C ATOM 1891 C TYR A 120 -11.239 -0.763 -1.557 1.00 13.44 C ATOM 1892 O TYR A 120 -10.648 -0.766 -2.648 1.00 55.44 O ATOM 1893 CB TYR A 120 -10.350 1.605 -1.154 1.00 64.44 C ATOM 1894 CG TYR A 120 -9.875 2.677 -0.189 1.00 41.13 C ATOM 1895 CD1 TYR A 120 -10.793 3.553 0.433 1.00 44.44 C ATOM 1896 CD2 TYR A 120 -8.494 2.807 0.062 1.00 55.24 C ATOM 1897 CE1 TYR A 120 -10.326 4.544 1.331 1.00 72.24 C ATOM 1898 CE2 TYR A 120 -8.029 3.788 0.951 1.00 72.12 C ATOM 1899 CZ TYR A 120 -8.943 4.639 1.607 1.00 0.24 C ATOM 1900 OH TYR A 120 -8.481 5.554 2.502 1.00 3.21 O ATOM 0 H TYR A 120 -9.374 -0.746 0.163 1.00 55.40 H new ATOM 0 HA TYR A 120 -11.974 0.669 -0.143 1.00 74.50 H new ATOM 0 HB2 TYR A 120 -9.496 1.281 -1.749 1.00 64.44 H new ATOM 0 HB3 TYR A 120 -11.064 2.058 -1.841 1.00 64.44 H new ATOM 0 HD1 TYR A 120 -11.849 3.467 0.224 1.00 44.44 H new ATOM 0 HD2 TYR A 120 -7.792 2.150 -0.431 1.00 55.24 H new ATOM 0 HE1 TYR A 120 -11.022 5.222 1.802 1.00 72.24 H new ATOM 0 HE2 TYR A 120 -6.970 3.892 1.133 1.00 72.12 H new ATOM 0 HH TYR A 120 -7.506 5.481 2.571 1.00 3.21 H new ATOM 1910 N ASN A 121 -12.032 -1.767 -1.182 1.00 12.01 N ATOM 1911 CA ASN A 121 -12.327 -2.966 -1.976 1.00 31.25 C ATOM 1912 C ASN A 121 -13.823 -3.047 -2.312 1.00 51.20 C ATOM 1913 O ASN A 121 -14.570 -2.109 -2.033 1.00 55.00 O ATOM 1914 CB ASN A 121 -11.772 -4.236 -1.296 1.00 33.24 C ATOM 1915 CG ASN A 121 -12.665 -4.810 -0.199 1.00 24.35 C ATOM 1916 OD1 ASN A 121 -13.670 -5.444 -0.487 1.00 52.13 O ATOM 1917 ND2 ASN A 121 -12.333 -4.604 1.063 1.00 34.33 N ATOM 0 H ASN A 121 -12.507 -1.770 -0.280 1.00 12.01 H new ATOM 0 HA ASN A 121 -11.808 -2.892 -2.932 1.00 31.25 H new ATOM 0 HB2 ASN A 121 -11.616 -5.001 -2.057 1.00 33.24 H new ATOM 0 HB3 ASN A 121 -10.796 -4.007 -0.869 1.00 33.24 H new ATOM 0 HD21 ASN A 121 -12.918 -4.976 1.811 1.00 34.33 H new ATOM 0 HD22 ASN A 121 -11.492 -4.073 1.289 1.00 34.33 H new ATOM 1924 N PHE A 122 -14.245 -4.137 -2.963 1.00 44.12 N ATOM 1925 CA PHE A 122 -15.610 -4.370 -3.438 1.00 44.13 C ATOM 1926 C PHE A 122 -16.681 -4.166 -2.369 1.00 12.05 C ATOM 1927 O PHE A 122 -17.797 -3.771 -2.702 1.00 63.11 O ATOM 1928 CB PHE A 122 -15.720 -5.795 -4.017 1.00 23.34 C ATOM 1929 CG PHE A 122 -15.769 -5.855 -5.530 1.00 3.42 C ATOM 1930 CD1 PHE A 122 -14.674 -5.398 -6.278 1.00 12.01 C ATOM 1931 CD2 PHE A 122 -16.909 -6.338 -6.196 1.00 33.55 C ATOM 1932 CE1 PHE A 122 -14.738 -5.360 -7.682 1.00 32.33 C ATOM 1933 CE2 PHE A 122 -16.963 -6.335 -7.599 1.00 51.22 C ATOM 1934 CZ PHE A 122 -15.883 -5.833 -8.344 1.00 60.42 C ATOM 0 H PHE A 122 -13.618 -4.911 -3.181 1.00 44.12 H new ATOM 0 HA PHE A 122 -15.799 -3.622 -4.208 1.00 44.13 H new ATOM 0 HB2 PHE A 122 -14.869 -6.381 -3.670 1.00 23.34 H new ATOM 0 HB3 PHE A 122 -16.617 -6.268 -3.618 1.00 23.34 H new ATOM 0 HD1 PHE A 122 -13.776 -5.073 -5.773 1.00 12.01 H new ATOM 0 HD2 PHE A 122 -17.746 -6.713 -5.626 1.00 33.55 H new ATOM 0 HE1 PHE A 122 -13.908 -4.968 -8.251 1.00 32.33 H new ATOM 0 HE2 PHE A 122 -17.836 -6.719 -8.106 1.00 51.22 H new ATOM 0 HZ PHE A 122 -15.933 -5.811 -9.423 1.00 60.42 H new ATOM 1944 N ASP A 123 -16.351 -4.406 -1.103 1.00 14.12 N ATOM 1945 CA ASP A 123 -17.238 -4.298 0.054 1.00 31.13 C ATOM 1946 C ASP A 123 -17.812 -2.887 0.248 1.00 43.10 C ATOM 1947 O ASP A 123 -18.820 -2.724 0.931 1.00 0.01 O ATOM 1948 CB ASP A 123 -16.407 -4.693 1.284 1.00 4.13 C ATOM 1949 CG ASP A 123 -17.182 -5.231 2.487 1.00 0.41 C ATOM 1950 OD1 ASP A 123 -18.317 -4.815 2.774 1.00 41.03 O ATOM 1951 OD2 ASP A 123 -16.594 -6.119 3.156 1.00 12.11 O ATOM 0 H ASP A 123 -15.409 -4.696 -0.842 1.00 14.12 H new ATOM 0 HA ASP A 123 -18.098 -4.951 -0.097 1.00 31.13 H new ATOM 0 HB2 ASP A 123 -15.684 -5.449 0.978 1.00 4.13 H new ATOM 0 HB3 ASP A 123 -15.839 -3.820 1.607 1.00 4.13 H new ATOM 1956 N LEU A 124 -17.188 -1.855 -0.334 1.00 12.13 N ATOM 1957 CA LEU A 124 -17.206 -0.508 0.230 1.00 13.21 C ATOM 1958 C LEU A 124 -17.893 0.480 -0.717 1.00 41.12 C ATOM 1959 O LEU A 124 -17.205 1.095 -1.528 1.00 4.05 O ATOM 1960 CB LEU A 124 -15.762 -0.144 0.611 1.00 54.02 C ATOM 1961 CG LEU A 124 -15.491 1.304 1.060 1.00 31.33 C ATOM 1962 CD1 LEU A 124 -16.627 1.952 1.868 1.00 62.52 C ATOM 1963 CD2 LEU A 124 -14.243 1.307 1.916 1.00 32.42 C ATOM 0 H LEU A 124 -16.661 -1.934 -1.204 1.00 12.13 H new ATOM 0 HA LEU A 124 -17.809 -0.460 1.137 1.00 13.21 H new ATOM 0 HB2 LEU A 124 -15.448 -0.810 1.414 1.00 54.02 H new ATOM 0 HB3 LEU A 124 -15.124 -0.356 -0.247 1.00 54.02 H new ATOM 0 HG LEU A 124 -15.388 1.893 0.149 1.00 31.33 H new ATOM 0 HD11 LEU A 124 -16.346 2.969 2.140 1.00 62.52 H new ATOM 0 HD12 LEU A 124 -17.535 1.975 1.265 1.00 62.52 H new ATOM 0 HD13 LEU A 124 -16.807 1.371 2.773 1.00 62.52 H new ATOM 0 HD21 LEU A 124 -14.031 2.324 2.246 1.00 32.42 H new ATOM 0 HD22 LEU A 124 -14.397 0.668 2.785 1.00 32.42 H new ATOM 0 HD23 LEU A 124 -13.401 0.932 1.334 1.00 32.42 H new ATOM 1975 N PRO A 125 -19.227 0.637 -0.688 1.00 24.31 N ATOM 1976 CA PRO A 125 -19.933 1.503 -1.622 1.00 74.41 C ATOM 1977 C PRO A 125 -19.540 2.969 -1.439 1.00 1.21 C ATOM 1978 O PRO A 125 -19.153 3.419 -0.357 1.00 71.32 O ATOM 1979 CB PRO A 125 -21.415 1.290 -1.328 1.00 73.31 C ATOM 1980 CG PRO A 125 -21.403 0.996 0.171 1.00 1.44 C ATOM 1981 CD PRO A 125 -20.145 0.146 0.326 1.00 60.52 C ATOM 0 HA PRO A 125 -19.685 1.260 -2.655 1.00 74.41 H new ATOM 0 HB2 PRO A 125 -22.009 2.172 -1.566 1.00 73.31 H new ATOM 0 HB3 PRO A 125 -21.830 0.462 -1.903 1.00 73.31 H new ATOM 0 HG2 PRO A 125 -21.352 1.909 0.764 1.00 1.44 H new ATOM 0 HG3 PRO A 125 -22.298 0.460 0.487 1.00 1.44 H new ATOM 0 HD2 PRO A 125 -19.721 0.249 1.325 1.00 60.52 H new ATOM 0 HD3 PRO A 125 -20.364 -0.912 0.180 1.00 60.52 H new ATOM 1989 N ILE A 126 -19.701 3.739 -2.516 1.00 0.45 N ATOM 1990 CA ILE A 126 -19.226 5.115 -2.598 1.00 23.42 C ATOM 1991 C ILE A 126 -19.861 5.992 -1.513 1.00 3.05 C ATOM 1992 O ILE A 126 -19.199 6.890 -0.986 1.00 40.24 O ATOM 1993 CB ILE A 126 -19.468 5.710 -4.006 1.00 52.32 C ATOM 1994 CG1 ILE A 126 -19.007 4.808 -5.171 1.00 41.04 C ATOM 1995 CG2 ILE A 126 -18.706 7.040 -4.145 1.00 63.23 C ATOM 1996 CD1 ILE A 126 -20.087 3.885 -5.723 1.00 43.10 C ATOM 0 H ILE A 126 -20.170 3.419 -3.363 1.00 0.45 H new ATOM 0 HA ILE A 126 -18.150 5.100 -2.423 1.00 23.42 H new ATOM 0 HB ILE A 126 -20.549 5.829 -4.080 1.00 52.32 H new ATOM 0 HG12 ILE A 126 -18.639 5.440 -5.979 1.00 41.04 H new ATOM 0 HG13 ILE A 126 -18.167 4.201 -4.833 1.00 41.04 H new ATOM 0 HG21 ILE A 126 -18.879 7.456 -5.138 1.00 63.23 H new ATOM 0 HG22 ILE A 126 -19.060 7.743 -3.390 1.00 63.23 H new ATOM 0 HG23 ILE A 126 -17.639 6.864 -4.006 1.00 63.23 H new ATOM 0 HD11 ILE A 126 -19.675 3.289 -6.537 1.00 43.10 H new ATOM 0 HD12 ILE A 126 -20.440 3.224 -4.932 1.00 43.10 H new ATOM 0 HD13 ILE A 126 -20.920 4.481 -6.095 1.00 43.10 H new ATOM 2008 N ASN A 127 -21.119 5.727 -1.154 1.00 53.00 N ATOM 2009 CA ASN A 127 -21.834 6.560 -0.195 1.00 33.31 C ATOM 2010 C ASN A 127 -21.187 6.512 1.189 1.00 4.33 C ATOM 2011 O ASN A 127 -21.243 7.526 1.892 1.00 23.34 O ATOM 2012 CB ASN A 127 -23.325 6.195 -0.123 1.00 35.12 C ATOM 2013 CG ASN A 127 -23.597 4.807 0.433 1.00 74.10 C ATOM 2014 OD1 ASN A 127 -23.142 3.833 -0.153 1.00 55.23 O ATOM 2015 ND2 ASN A 127 -24.355 4.673 1.506 1.00 32.24 N ATOM 0 H ASN A 127 -21.660 4.941 -1.515 1.00 53.00 H new ATOM 0 HA ASN A 127 -21.765 7.587 -0.555 1.00 33.31 H new ATOM 0 HB2 ASN A 127 -23.839 6.930 0.497 1.00 35.12 H new ATOM 0 HB3 ASN A 127 -23.754 6.265 -1.123 1.00 35.12 H new ATOM 0 HD21 ASN A 127 -24.573 3.743 1.864 1.00 32.24 H new ATOM 0 HD22 ASN A 127 -24.723 5.500 1.977 1.00 32.24 H new ATOM 2022 N GLU A 128 -20.546 5.396 1.554 1.00 22.14 N ATOM 2023 CA GLU A 128 -19.914 5.200 2.864 1.00 1.05 C ATOM 2024 C GLU A 128 -18.390 5.352 2.779 1.00 54.10 C ATOM 2025 O GLU A 128 -17.710 5.405 3.799 1.00 41.14 O ATOM 2026 CB GLU A 128 -20.263 3.819 3.447 1.00 55.03 C ATOM 2027 CG GLU A 128 -21.761 3.498 3.555 1.00 63.23 C ATOM 2028 CD GLU A 128 -22.553 4.423 4.489 1.00 1.05 C ATOM 2029 OE1 GLU A 128 -22.659 5.642 4.228 1.00 4.23 O ATOM 2030 OE2 GLU A 128 -23.154 3.931 5.470 1.00 33.12 O ATOM 0 H GLU A 128 -20.450 4.590 0.937 1.00 22.14 H new ATOM 0 HA GLU A 128 -20.305 5.973 3.526 1.00 1.05 H new ATOM 0 HB2 GLU A 128 -19.791 3.055 2.829 1.00 55.03 H new ATOM 0 HB3 GLU A 128 -19.822 3.743 4.441 1.00 55.03 H new ATOM 0 HG2 GLU A 128 -22.201 3.547 2.559 1.00 63.23 H new ATOM 0 HG3 GLU A 128 -21.874 2.471 3.903 1.00 63.23 H new ATOM 2037 N LEU A 129 -17.834 5.486 1.572 1.00 23.14 N ATOM 2038 CA LEU A 129 -16.407 5.680 1.316 1.00 1.15 C ATOM 2039 C LEU A 129 -15.834 6.783 2.194 1.00 43.33 C ATOM 2040 O LEU A 129 -14.788 6.622 2.819 1.00 63.40 O ATOM 2041 CB LEU A 129 -16.243 5.977 -0.174 1.00 64.31 C ATOM 2042 CG LEU A 129 -14.796 5.784 -0.649 1.00 1.25 C ATOM 2043 CD1 LEU A 129 -14.804 5.458 -2.142 1.00 35.34 C ATOM 2044 CD2 LEU A 129 -13.958 7.034 -0.467 1.00 3.23 C ATOM 0 H LEU A 129 -18.387 5.461 0.715 1.00 23.14 H new ATOM 0 HA LEU A 129 -15.845 4.781 1.571 1.00 1.15 H new ATOM 0 HB2 LEU A 129 -16.902 5.325 -0.747 1.00 64.31 H new ATOM 0 HB3 LEU A 129 -16.556 7.002 -0.375 1.00 64.31 H new ATOM 0 HG LEU A 129 -14.365 4.980 -0.052 1.00 1.25 H new ATOM 0 HD11 LEU A 129 -13.780 5.319 -2.490 1.00 35.34 H new ATOM 0 HD12 LEU A 129 -15.372 4.543 -2.312 1.00 35.34 H new ATOM 0 HD13 LEU A 129 -15.265 6.279 -2.691 1.00 35.34 H new ATOM 0 HD21 LEU A 129 -12.943 6.846 -0.818 1.00 3.23 H new ATOM 0 HD22 LEU A 129 -14.395 7.851 -1.041 1.00 3.23 H new ATOM 0 HD23 LEU A 129 -13.933 7.305 0.589 1.00 3.23 H new ATOM 2056 N GLU A 130 -16.551 7.898 2.242 1.00 32.41 N ATOM 2057 CA GLU A 130 -16.228 9.100 3.000 1.00 35.54 C ATOM 2058 C GLU A 130 -16.104 8.847 4.500 1.00 51.01 C ATOM 2059 O GLU A 130 -15.483 9.647 5.194 1.00 21.11 O ATOM 2060 CB GLU A 130 -17.351 10.110 2.747 1.00 1.35 C ATOM 2061 CG GLU A 130 -17.239 10.690 1.338 1.00 34.43 C ATOM 2062 CD GLU A 130 -16.380 11.946 1.324 1.00 33.54 C ATOM 2063 OE1 GLU A 130 -15.157 11.850 1.569 1.00 74.13 O ATOM 2064 OE2 GLU A 130 -16.901 13.034 1.001 1.00 72.52 O ATOM 0 H GLU A 130 -17.424 7.993 1.723 1.00 32.41 H new ATOM 0 HA GLU A 130 -15.257 9.468 2.669 1.00 35.54 H new ATOM 0 HB2 GLU A 130 -18.319 9.625 2.872 1.00 1.35 H new ATOM 0 HB3 GLU A 130 -17.299 10.913 3.483 1.00 1.35 H new ATOM 0 HG2 GLU A 130 -16.809 9.945 0.669 1.00 34.43 H new ATOM 0 HG3 GLU A 130 -18.234 10.923 0.958 1.00 34.43 H new ATOM 2071 N GLU A 131 -16.694 7.771 5.009 1.00 13.23 N ATOM 2072 CA GLU A 131 -16.606 7.356 6.397 1.00 32.53 C ATOM 2073 C GLU A 131 -15.378 6.462 6.596 1.00 52.10 C ATOM 2074 O GLU A 131 -14.712 6.552 7.623 1.00 73.51 O ATOM 2075 CB GLU A 131 -17.923 6.640 6.736 1.00 31.21 C ATOM 2076 CG GLU A 131 -18.198 6.489 8.230 1.00 71.34 C ATOM 2077 CD GLU A 131 -19.633 6.006 8.438 1.00 2.45 C ATOM 2078 OE1 GLU A 131 -20.550 6.865 8.454 1.00 42.10 O ATOM 2079 OE2 GLU A 131 -19.842 4.782 8.568 1.00 75.53 O ATOM 0 H GLU A 131 -17.266 7.144 4.443 1.00 13.23 H new ATOM 0 HA GLU A 131 -16.477 8.204 7.070 1.00 32.53 H new ATOM 0 HB2 GLU A 131 -18.747 7.190 6.282 1.00 31.21 H new ATOM 0 HB3 GLU A 131 -17.911 5.650 6.280 1.00 31.21 H new ATOM 0 HG2 GLU A 131 -17.497 5.780 8.670 1.00 71.34 H new ATOM 0 HG3 GLU A 131 -18.047 7.442 8.737 1.00 71.34 H new ATOM 2086 N THR A 132 -15.019 5.651 5.601 1.00 73.34 N ATOM 2087 CA THR A 132 -13.845 4.798 5.675 1.00 35.12 C ATOM 2088 C THR A 132 -12.563 5.608 5.497 1.00 3.21 C ATOM 2089 O THR A 132 -11.615 5.349 6.232 1.00 61.34 O ATOM 2090 CB THR A 132 -13.995 3.617 4.708 1.00 72.44 C ATOM 2091 OG1 THR A 132 -15.022 2.759 5.185 1.00 54.30 O ATOM 2092 CG2 THR A 132 -12.685 2.837 4.546 1.00 11.21 C ATOM 0 H THR A 132 -15.536 5.571 4.725 1.00 73.34 H new ATOM 0 HA THR A 132 -13.762 4.364 6.671 1.00 35.12 H new ATOM 0 HB THR A 132 -14.257 4.008 3.725 1.00 72.44 H new ATOM 0 HG1 THR A 132 -15.126 2.002 4.572 1.00 54.30 H new ATOM 0 HG21 THR A 132 -12.837 2.010 3.853 1.00 11.21 H new ATOM 0 HG22 THR A 132 -11.913 3.500 4.156 1.00 11.21 H new ATOM 0 HG23 THR A 132 -12.372 2.446 5.514 1.00 11.21 H new ATOM 2100 N ILE A 133 -12.497 6.628 4.627 1.00 53.33 N ATOM 2101 CA ILE A 133 -11.332 7.522 4.610 1.00 62.33 C ATOM 2102 C ILE A 133 -11.059 8.072 6.027 1.00 44.14 C ATOM 2103 O ILE A 133 -9.894 8.145 6.437 1.00 20.45 O ATOM 2104 CB ILE A 133 -11.480 8.663 3.576 1.00 42.13 C ATOM 2105 CG1 ILE A 133 -11.738 8.173 2.134 1.00 61.24 C ATOM 2106 CG2 ILE A 133 -10.151 9.432 3.516 1.00 11.15 C ATOM 2107 CD1 ILE A 133 -12.120 9.310 1.165 1.00 31.33 C ATOM 0 H ILE A 133 -13.219 6.850 3.942 1.00 53.33 H new ATOM 0 HA ILE A 133 -10.470 6.935 4.294 1.00 62.33 H new ATOM 0 HB ILE A 133 -12.332 9.259 3.903 1.00 42.13 H new ATOM 0 HG12 ILE A 133 -10.844 7.672 1.762 1.00 61.24 H new ATOM 0 HG13 ILE A 133 -12.537 7.431 2.147 1.00 61.24 H new ATOM 0 HG21 ILE A 133 -10.232 10.243 2.792 1.00 11.15 H new ATOM 0 HG22 ILE A 133 -9.925 9.845 4.499 1.00 11.15 H new ATOM 0 HG23 ILE A 133 -9.352 8.755 3.214 1.00 11.15 H new ATOM 0 HD11 ILE A 133 -12.288 8.899 0.170 1.00 31.33 H new ATOM 0 HD12 ILE A 133 -13.031 9.796 1.515 1.00 31.33 H new ATOM 0 HD13 ILE A 133 -11.312 10.040 1.124 1.00 31.33 H new ATOM 2119 N GLN A 134 -12.107 8.413 6.781 1.00 75.43 N ATOM 2120 CA GLN A 134 -11.971 8.942 8.132 1.00 31.13 C ATOM 2121 C GLN A 134 -11.431 7.877 9.096 1.00 11.14 C ATOM 2122 O GLN A 134 -10.654 8.214 9.993 1.00 2.32 O ATOM 2123 CB GLN A 134 -13.328 9.476 8.612 1.00 15.31 C ATOM 2124 CG GLN A 134 -13.879 10.626 7.753 1.00 3.12 C ATOM 2125 CD GLN A 134 -13.530 11.984 8.346 1.00 72.13 C ATOM 2126 OE1 GLN A 134 -12.493 12.569 8.030 1.00 33.55 O ATOM 2127 NE2 GLN A 134 -14.395 12.487 9.213 1.00 33.11 N ATOM 0 H GLN A 134 -13.074 8.328 6.467 1.00 75.43 H new ATOM 0 HA GLN A 134 -11.250 9.759 8.116 1.00 31.13 H new ATOM 0 HB2 GLN A 134 -14.049 8.659 8.615 1.00 15.31 H new ATOM 0 HB3 GLN A 134 -13.230 9.819 9.642 1.00 15.31 H new ATOM 0 HG2 GLN A 134 -13.474 10.554 6.744 1.00 3.12 H new ATOM 0 HG3 GLN A 134 -14.962 10.532 7.669 1.00 3.12 H new ATOM 0 HE21 GLN A 134 -15.242 11.969 9.447 1.00 33.11 H new ATOM 0 HE22 GLN A 134 -14.214 13.392 9.647 1.00 33.11 H new ATOM 2136 N ALA A 135 -11.811 6.607 8.911 1.00 31.11 N ATOM 2137 CA ALA A 135 -11.283 5.489 9.694 1.00 42.44 C ATOM 2138 C ALA A 135 -9.810 5.230 9.368 1.00 21.33 C ATOM 2139 O ALA A 135 -9.024 4.943 10.270 1.00 61.10 O ATOM 2140 CB ALA A 135 -12.097 4.220 9.436 1.00 64.33 C ATOM 0 H ALA A 135 -12.497 6.327 8.210 1.00 31.11 H new ATOM 0 HA ALA A 135 -11.363 5.759 10.747 1.00 42.44 H new ATOM 0 HB1 ALA A 135 -11.689 3.400 10.027 1.00 64.33 H new ATOM 0 HB2 ALA A 135 -13.136 4.390 9.719 1.00 64.33 H new ATOM 0 HB3 ALA A 135 -12.047 3.965 8.378 1.00 64.33 H new ATOM 2146 N VAL A 136 -9.407 5.379 8.104 1.00 40.32 N ATOM 2147 CA VAL A 136 -8.007 5.240 7.717 1.00 54.04 C ATOM 2148 C VAL A 136 -7.166 6.236 8.540 1.00 55.13 C ATOM 2149 O VAL A 136 -6.180 5.825 9.163 1.00 33.34 O ATOM 2150 CB VAL A 136 -7.877 5.380 6.181 1.00 75.21 C ATOM 2151 CG1 VAL A 136 -6.442 5.220 5.666 1.00 4.13 C ATOM 2152 CG2 VAL A 136 -8.759 4.353 5.430 1.00 20.45 C ATOM 0 H VAL A 136 -10.035 5.597 7.331 1.00 40.32 H new ATOM 0 HA VAL A 136 -7.614 4.250 7.947 1.00 54.04 H new ATOM 0 HB VAL A 136 -8.212 6.397 5.978 1.00 75.21 H new ATOM 0 HG11 VAL A 136 -6.430 5.331 4.582 1.00 4.13 H new ATOM 0 HG12 VAL A 136 -5.807 5.983 6.116 1.00 4.13 H new ATOM 0 HG13 VAL A 136 -6.067 4.232 5.934 1.00 4.13 H new ATOM 0 HG21 VAL A 136 -8.638 4.486 4.355 1.00 20.45 H new ATOM 0 HG22 VAL A 136 -8.457 3.343 5.707 1.00 20.45 H new ATOM 0 HG23 VAL A 136 -9.804 4.506 5.699 1.00 20.45 H new ATOM 2162 N GLN A 137 -7.596 7.505 8.636 1.00 0.22 N ATOM 2163 CA GLN A 137 -6.884 8.508 9.423 1.00 74.43 C ATOM 2164 C GLN A 137 -6.859 8.203 10.933 1.00 51.40 C ATOM 2165 O GLN A 137 -5.960 8.707 11.614 1.00 20.25 O ATOM 2166 CB GLN A 137 -7.472 9.917 9.209 1.00 61.53 C ATOM 2167 CG GLN A 137 -7.385 10.503 7.793 1.00 1.45 C ATOM 2168 CD GLN A 137 -5.952 10.592 7.266 1.00 13.15 C ATOM 2169 OE1 GLN A 137 -5.083 11.245 7.840 1.00 60.14 O ATOM 2170 NE2 GLN A 137 -5.682 9.999 6.114 1.00 20.34 N ATOM 0 H GLN A 137 -8.436 7.855 8.175 1.00 0.22 H new ATOM 0 HA GLN A 137 -5.857 8.473 9.059 1.00 74.43 H new ATOM 0 HB2 GLN A 137 -8.522 9.894 9.502 1.00 61.53 H new ATOM 0 HB3 GLN A 137 -6.967 10.602 9.890 1.00 61.53 H new ATOM 0 HG2 GLN A 137 -7.977 9.888 7.115 1.00 1.45 H new ATOM 0 HG3 GLN A 137 -7.829 11.499 7.791 1.00 1.45 H new ATOM 0 HE21 GLN A 137 -6.403 9.457 5.638 1.00 20.34 H new ATOM 0 HE22 GLN A 137 -4.753 10.084 5.702 1.00 20.34 H new ATOM 2179 N GLU A 138 -7.804 7.431 11.486 1.00 61.41 N ATOM 2180 CA GLU A 138 -7.814 7.106 12.916 1.00 15.35 C ATOM 2181 C GLU A 138 -6.555 6.331 13.289 1.00 13.12 C ATOM 2182 O GLU A 138 -5.887 6.660 14.269 1.00 54.04 O ATOM 2183 CB GLU A 138 -9.062 6.296 13.291 1.00 32.11 C ATOM 2184 CG GLU A 138 -10.170 7.205 13.817 1.00 3.24 C ATOM 2185 CD GLU A 138 -11.383 6.448 14.368 1.00 52.00 C ATOM 2186 OE1 GLU A 138 -11.345 5.218 14.620 1.00 40.40 O ATOM 2187 OE2 GLU A 138 -12.355 7.149 14.720 1.00 74.43 O ATOM 0 H GLU A 138 -8.575 7.019 10.960 1.00 61.41 H new ATOM 0 HA GLU A 138 -7.836 8.042 13.474 1.00 15.35 H new ATOM 0 HB2 GLU A 138 -9.420 5.749 12.419 1.00 32.11 H new ATOM 0 HB3 GLU A 138 -8.805 5.556 14.048 1.00 32.11 H new ATOM 0 HG2 GLU A 138 -9.763 7.841 14.603 1.00 3.24 H new ATOM 0 HG3 GLU A 138 -10.499 7.863 13.013 1.00 3.24 H new ATOM 2194 N GLU A 139 -6.207 5.330 12.486 1.00 44.00 N ATOM 2195 CA GLU A 139 -4.952 4.607 12.656 1.00 43.13 C ATOM 2196 C GLU A 139 -3.751 5.524 12.395 1.00 55.11 C ATOM 2197 O GLU A 139 -2.719 5.423 13.072 1.00 73.20 O ATOM 2198 CB GLU A 139 -4.867 3.421 11.696 1.00 61.11 C ATOM 2199 CG GLU A 139 -6.092 2.503 11.726 1.00 20.15 C ATOM 2200 CD GLU A 139 -5.755 1.166 11.077 1.00 64.42 C ATOM 2201 OE1 GLU A 139 -5.254 1.185 9.929 1.00 61.41 O ATOM 2202 OE2 GLU A 139 -5.947 0.111 11.722 1.00 55.02 O ATOM 0 H GLU A 139 -6.779 5.001 11.709 1.00 44.00 H new ATOM 0 HA GLU A 139 -4.928 4.250 13.685 1.00 43.13 H new ATOM 0 HB2 GLU A 139 -4.733 3.797 10.682 1.00 61.11 H new ATOM 0 HB3 GLU A 139 -3.981 2.834 11.938 1.00 61.11 H new ATOM 0 HG2 GLU A 139 -6.415 2.346 12.755 1.00 20.15 H new ATOM 0 HG3 GLU A 139 -6.923 2.973 11.200 1.00 20.15 H new ATOM 2209 N ASN A 140 -3.877 6.407 11.394 1.00 60.30 N ATOM 2210 CA ASN A 140 -2.749 7.203 10.914 1.00 71.41 C ATOM 2211 C ASN A 140 -2.145 8.059 12.020 1.00 24.11 C ATOM 2212 O ASN A 140 -0.923 8.086 12.147 1.00 42.34 O ATOM 2213 CB ASN A 140 -3.102 8.128 9.739 1.00 24.13 C ATOM 2214 CG ASN A 140 -3.508 7.486 8.419 1.00 20.35 C ATOM 2215 OD1 ASN A 140 -3.895 8.196 7.504 1.00 34.11 O ATOM 2216 ND2 ASN A 140 -3.424 6.186 8.237 1.00 4.11 N ATOM 0 H ASN A 140 -4.753 6.585 10.903 1.00 60.30 H new ATOM 0 HA ASN A 140 -2.027 6.464 10.568 1.00 71.41 H new ATOM 0 HB2 ASN A 140 -3.917 8.777 10.059 1.00 24.13 H new ATOM 0 HB3 ASN A 140 -2.241 8.768 9.548 1.00 24.13 H new ATOM 0 HD21 ASN A 140 -3.681 5.779 7.338 1.00 4.11 H new ATOM 0 HD22 ASN A 140 -3.102 5.585 8.995 1.00 4.11 H new ATOM 2223 N LYS A 141 -2.970 8.737 12.825 1.00 11.01 N ATOM 2224 CA LYS A 141 -2.483 9.617 13.893 1.00 31.53 C ATOM 2225 C LYS A 141 -1.612 8.850 14.890 1.00 34.25 C ATOM 2226 O LYS A 141 -0.567 9.348 15.293 1.00 13.35 O ATOM 2227 CB LYS A 141 -3.645 10.336 14.604 1.00 54.34 C ATOM 2228 CG LYS A 141 -4.786 9.380 14.985 1.00 74.13 C ATOM 2229 CD LYS A 141 -5.619 9.804 16.194 1.00 3.22 C ATOM 2230 CE LYS A 141 -5.937 8.550 17.018 1.00 41.11 C ATOM 2231 NZ LYS A 141 -6.532 8.865 18.327 1.00 11.44 N ATOM 0 H LYS A 141 -3.987 8.692 12.756 1.00 11.01 H new ATOM 0 HA LYS A 141 -1.860 10.381 13.429 1.00 31.53 H new ATOM 0 HB2 LYS A 141 -3.269 10.824 15.503 1.00 54.34 H new ATOM 0 HB3 LYS A 141 -4.034 11.120 13.954 1.00 54.34 H new ATOM 0 HG2 LYS A 141 -5.450 9.273 14.127 1.00 74.13 H new ATOM 0 HG3 LYS A 141 -4.362 8.396 15.184 1.00 74.13 H new ATOM 0 HD2 LYS A 141 -5.072 10.528 16.798 1.00 3.22 H new ATOM 0 HD3 LYS A 141 -6.539 10.290 15.870 1.00 3.22 H new ATOM 0 HE2 LYS A 141 -6.622 7.915 16.456 1.00 41.11 H new ATOM 0 HE3 LYS A 141 -5.022 7.977 17.168 1.00 41.11 H new ATOM 0 HZ1 LYS A 141 -6.727 7.982 18.841 1.00 11.44 H new ATOM 0 HZ2 LYS A 141 -5.870 9.448 18.878 1.00 11.44 H new ATOM 0 HZ3 LYS A 141 -7.420 9.388 18.188 1.00 11.44 H new ATOM 2245 N ALA A 142 -2.034 7.649 15.294 1.00 15.42 N ATOM 2246 CA ALA A 142 -1.307 6.842 16.256 1.00 61.42 C ATOM 2247 C ALA A 142 0.015 6.380 15.649 1.00 60.22 C ATOM 2248 O ALA A 142 1.018 6.331 16.360 1.00 34.22 O ATOM 2249 CB ALA A 142 -2.169 5.654 16.689 1.00 74.12 C ATOM 0 H ALA A 142 -2.893 7.215 14.957 1.00 15.42 H new ATOM 0 HA ALA A 142 -1.081 7.437 17.141 1.00 61.42 H new ATOM 0 HB1 ALA A 142 -1.620 5.050 17.411 1.00 74.12 H new ATOM 0 HB2 ALA A 142 -3.089 6.019 17.146 1.00 74.12 H new ATOM 0 HB3 ALA A 142 -2.413 5.045 15.818 1.00 74.12 H new ATOM 2255 N PHE A 143 0.017 6.059 14.350 1.00 12.52 N ATOM 2256 CA PHE A 143 1.219 5.693 13.629 1.00 20.35 C ATOM 2257 C PHE A 143 2.204 6.867 13.617 1.00 43.34 C ATOM 2258 O PHE A 143 3.317 6.734 14.116 1.00 3.54 O ATOM 2259 CB PHE A 143 0.871 5.196 12.218 1.00 43.14 C ATOM 2260 CG PHE A 143 2.093 4.730 11.451 1.00 75.20 C ATOM 2261 CD1 PHE A 143 2.905 5.658 10.770 1.00 54.20 C ATOM 2262 CD2 PHE A 143 2.449 3.370 11.454 1.00 72.31 C ATOM 2263 CE1 PHE A 143 4.122 5.245 10.197 1.00 11.12 C ATOM 2264 CE2 PHE A 143 3.645 2.955 10.849 1.00 61.01 C ATOM 2265 CZ PHE A 143 4.510 3.896 10.272 1.00 54.21 C ATOM 0 H PHE A 143 -0.826 6.049 13.775 1.00 12.52 H new ATOM 0 HA PHE A 143 1.711 4.865 14.140 1.00 20.35 H new ATOM 0 HB2 PHE A 143 0.157 4.376 12.291 1.00 43.14 H new ATOM 0 HB3 PHE A 143 0.382 5.997 11.664 1.00 43.14 H new ATOM 0 HD1 PHE A 143 2.593 6.689 10.688 1.00 54.20 H new ATOM 0 HD2 PHE A 143 1.801 2.644 11.922 1.00 72.31 H new ATOM 0 HE1 PHE A 143 4.757 5.964 9.700 1.00 11.12 H new ATOM 0 HE2 PHE A 143 3.901 1.906 10.828 1.00 61.01 H new ATOM 0 HZ PHE A 143 5.470 3.586 9.887 1.00 54.21 H new ATOM 2275 N GLU A 144 1.838 8.016 13.040 1.00 21.05 N ATOM 2276 CA GLU A 144 2.771 9.138 12.873 1.00 3.35 C ATOM 2277 C GLU A 144 3.188 9.784 14.201 1.00 33.35 C ATOM 2278 O GLU A 144 4.274 10.360 14.268 1.00 14.11 O ATOM 2279 CB GLU A 144 2.258 10.199 11.890 1.00 71.40 C ATOM 2280 CG GLU A 144 0.837 10.681 12.188 1.00 53.34 C ATOM 2281 CD GLU A 144 0.601 12.201 12.252 1.00 53.34 C ATOM 2282 OE1 GLU A 144 1.532 13.033 12.141 1.00 72.01 O ATOM 2283 OE2 GLU A 144 -0.593 12.576 12.338 1.00 12.52 O ATOM 0 H GLU A 144 0.901 8.195 12.680 1.00 21.05 H new ATOM 0 HA GLU A 144 3.666 8.691 12.439 1.00 3.35 H new ATOM 0 HB2 GLU A 144 2.933 11.055 11.908 1.00 71.40 H new ATOM 0 HB3 GLU A 144 2.289 9.790 10.880 1.00 71.40 H new ATOM 0 HG2 GLU A 144 0.175 10.270 11.426 1.00 53.34 H new ATOM 0 HG3 GLU A 144 0.529 10.252 13.142 1.00 53.34 H new ATOM 2290 N GLU A 145 2.396 9.637 15.272 1.00 14.51 N ATOM 2291 CA GLU A 145 2.824 10.036 16.609 1.00 40.23 C ATOM 2292 C GLU A 145 4.111 9.279 16.956 1.00 31.11 C ATOM 2293 O GLU A 145 5.021 9.853 17.555 1.00 35.41 O ATOM 2294 CB GLU A 145 1.710 9.784 17.645 1.00 12.52 C ATOM 2295 CG GLU A 145 2.096 10.201 19.084 1.00 3.35 C ATOM 2296 CD GLU A 145 1.213 9.619 20.198 1.00 22.25 C ATOM 2297 OE1 GLU A 145 0.135 9.041 19.919 1.00 2.33 O ATOM 2298 OE2 GLU A 145 1.619 9.708 21.382 1.00 44.32 O ATOM 0 H GLU A 145 1.456 9.244 15.233 1.00 14.51 H new ATOM 0 HA GLU A 145 3.027 11.107 16.630 1.00 40.23 H new ATOM 0 HB2 GLU A 145 0.816 10.331 17.345 1.00 12.52 H new ATOM 0 HB3 GLU A 145 1.453 8.725 17.639 1.00 12.52 H new ATOM 0 HG2 GLU A 145 3.128 9.900 19.267 1.00 3.35 H new ATOM 0 HG3 GLU A 145 2.065 11.289 19.150 1.00 3.35 H new ATOM 2305 N LEU A 146 4.217 8.007 16.567 1.00 13.32 N ATOM 2306 CA LEU A 146 5.270 7.108 17.025 1.00 71.40 C ATOM 2307 C LEU A 146 6.303 6.750 15.959 1.00 64.04 C ATOM 2308 O LEU A 146 7.354 6.207 16.318 1.00 42.54 O ATOM 2309 CB LEU A 146 4.642 5.839 17.635 1.00 72.13 C ATOM 2310 CG LEU A 146 4.197 5.902 19.113 1.00 42.12 C ATOM 2311 CD1 LEU A 146 5.096 6.779 19.993 1.00 44.53 C ATOM 2312 CD2 LEU A 146 2.751 6.361 19.269 1.00 53.32 C ATOM 0 H LEU A 146 3.564 7.570 15.917 1.00 13.32 H new ATOM 0 HA LEU A 146 5.829 7.652 17.786 1.00 71.40 H new ATOM 0 HB2 LEU A 146 3.773 5.571 17.034 1.00 72.13 H new ATOM 0 HB3 LEU A 146 5.362 5.026 17.535 1.00 72.13 H new ATOM 0 HG LEU A 146 4.288 4.873 19.460 1.00 42.12 H new ATOM 0 HD11 LEU A 146 4.720 6.774 21.016 1.00 44.53 H new ATOM 0 HD12 LEU A 146 6.113 6.388 19.978 1.00 44.53 H new ATOM 0 HD13 LEU A 146 5.094 7.800 19.611 1.00 44.53 H new ATOM 0 HD21 LEU A 146 2.490 6.388 20.327 1.00 53.32 H new ATOM 0 HD22 LEU A 146 2.638 7.357 18.842 1.00 53.32 H new ATOM 0 HD23 LEU A 146 2.091 5.666 18.750 1.00 53.32 H new ATOM 2324 N HIS A 147 6.066 7.085 14.696 1.00 51.41 N ATOM 2325 CA HIS A 147 6.898 6.700 13.557 1.00 71.24 C ATOM 2326 C HIS A 147 7.162 7.931 12.671 1.00 34.11 C ATOM 2327 O HIS A 147 6.503 8.103 11.642 1.00 52.24 O ATOM 2328 CB HIS A 147 6.239 5.535 12.810 1.00 74.23 C ATOM 2329 CG HIS A 147 6.133 4.277 13.639 1.00 43.52 C ATOM 2330 ND1 HIS A 147 7.141 3.368 13.881 1.00 41.53 N ATOM 2331 CD2 HIS A 147 5.023 3.852 14.319 1.00 61.43 C ATOM 2332 CE1 HIS A 147 6.647 2.410 14.677 1.00 41.25 C ATOM 2333 NE2 HIS A 147 5.365 2.669 14.985 1.00 61.45 N ATOM 0 H HIS A 147 5.262 7.652 14.425 1.00 51.41 H new ATOM 0 HA HIS A 147 7.872 6.343 13.891 1.00 71.24 H new ATOM 0 HB2 HIS A 147 5.241 5.836 12.490 1.00 74.23 H new ATOM 0 HB3 HIS A 147 6.812 5.320 11.908 1.00 74.23 H new ATOM 0 HD2 HIS A 147 4.060 4.340 14.338 1.00 61.43 H new ATOM 0 HE1 HIS A 147 7.202 1.550 15.023 1.00 41.25 H new ATOM 0 HE2 HIS A 147 4.759 2.112 15.587 1.00 61.45 H new ATOM 2341 N PRO A 148 8.095 8.809 13.081 1.00 14.33 N ATOM 2342 CA PRO A 148 8.341 10.103 12.457 1.00 35.41 C ATOM 2343 C PRO A 148 9.075 9.971 11.131 1.00 72.10 C ATOM 2344 O PRO A 148 10.252 9.561 11.112 1.00 22.12 O ATOM 2345 CB PRO A 148 9.166 10.893 13.477 1.00 53.13 C ATOM 2346 CG PRO A 148 9.880 9.822 14.299 1.00 51.25 C ATOM 2347 CD PRO A 148 8.862 8.691 14.311 1.00 60.14 C ATOM 0 HA PRO A 148 7.406 10.606 12.213 1.00 35.41 H new ATOM 0 HB2 PRO A 148 9.877 11.556 12.985 1.00 53.13 H new ATOM 0 HB3 PRO A 148 8.530 11.517 14.105 1.00 53.13 H new ATOM 0 HG2 PRO A 148 10.821 9.517 13.841 1.00 51.25 H new ATOM 0 HG3 PRO A 148 10.113 10.170 15.305 1.00 51.25 H new ATOM 0 HD2 PRO A 148 9.359 7.723 14.366 1.00 60.14 H new ATOM 0 HD3 PRO A 148 8.211 8.765 15.182 1.00 60.14 H new TER 2355 PRO A 148