USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 967 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 107 HIS : no HD1:sc= -2.34! K(o=-5.2!,f=-0.094) USER MOD Set 1.2: A 111 ASN : amide:sc= -2.81! K(o=-5.2!,f=-0.05) USER MOD Set 2.1: A 51 MET CE :methyl 168:sc= 0 (180deg=-0.11) USER MOD Set 2.2: A 71 MET CE :methyl 162:sc= -0.365 (180deg=-0.818) USER MOD Set 3.1: A 60 ASN : amide:sc= 0.0634 K(o=0.15,f=-4.2!) USER MOD Set 3.2: A 62 THR OG1 : rot -12:sc= 0.0873 USER MOD Set 4.1: A 5 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 8 GLN : amide:sc= 0 X(o=0,f=0.074) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -168:sc= 0.283 (180deg=0.209) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -63:sc= 0.512 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 59:sc= 0.235 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 42 ASN : amide:sc= 0.00578 X(o=0.0058,f=-0.31) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.134 USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -165:sc=-0.00183 (180deg=-0.508) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 K(o=0,f=0.59) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.199 USER MOD Single : A 109 MET CE :methyl 174:sc= 0 (180deg=-0.0567) USER MOD Single : A 110 THR OG1 : rot 83:sc= 1.06 USER MOD Single : A 115 LYS NZ :NH3+ 158:sc= -0.125 (180deg=-0.552) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.239 USER MOD Single : A 124 MET CE :methyl -179:sc= 0 (180deg=-0.00366) USER MOD Single : A 135 GLN : amide:sc= 0.11 X(o=0.11,f=-0.16) USER MOD Single : A 137 ASN : amide:sc= -0.0664 K(o=-0.066,f=-8.6!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.273 USER MOD Single : A 143 GLN : amide:sc= 0.323 X(o=0.32,f=-0.14) USER MOD Single : A 144 MET CE :methyl -158:sc=-0.00128 (180deg=-0.93) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -13.162 16.809 1.804 1.00 0.00 N ATOM 59 CA THR A 5 -13.998 17.899 1.405 1.00 0.00 C ATOM 60 C THR A 5 -15.270 17.344 0.863 1.00 0.00 C ATOM 61 O THR A 5 -15.352 16.139 0.632 1.00 0.00 O ATOM 62 CB THR A 5 -13.392 18.811 0.380 1.00 0.00 C ATOM 63 OG1 THR A 5 -13.281 18.273 -0.930 1.00 0.00 O ATOM 64 CG2 THR A 5 -12.002 19.264 0.857 1.00 0.00 C ATOM 0 HA THR A 5 -14.154 18.509 2.295 1.00 0.00 H new ATOM 0 HB THR A 5 -14.088 19.645 0.294 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.877 18.940 -1.524 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.560 19.927 0.113 1.00 0.00 H new ATOM 0 HG22 THR A 5 -12.097 19.794 1.805 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.362 18.392 0.992 1.00 0.00 H new ATOM 72 N GLU A 6 -16.299 18.199 0.724 1.00 0.00 N ATOM 73 CA GLU A 6 -17.581 17.786 0.244 1.00 0.00 C ATOM 74 C GLU A 6 -17.578 17.272 -1.155 1.00 0.00 C ATOM 75 O GLU A 6 -18.242 16.296 -1.498 1.00 0.00 O ATOM 76 CB GLU A 6 -18.658 18.847 0.525 1.00 0.00 C ATOM 77 CG GLU A 6 -20.072 18.262 0.512 1.00 0.00 C ATOM 78 CD GLU A 6 -21.123 19.363 0.508 1.00 0.00 C ATOM 79 OE1 GLU A 6 -21.530 19.864 -0.574 1.00 0.00 O ATOM 80 OE2 GLU A 6 -21.586 19.737 1.618 1.00 0.00 O ATOM 0 H GLU A 6 -16.240 19.192 0.948 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.856 16.907 0.827 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -18.467 19.306 1.495 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -18.588 19.638 -0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -20.199 17.631 -0.368 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -20.213 17.624 1.385 1.00 0.00 H new ATOM 87 N GLU A 7 -16.723 17.840 -2.024 1.00 0.00 N ATOM 88 CA GLU A 7 -16.468 17.382 -3.355 1.00 0.00 C ATOM 89 C GLU A 7 -15.875 16.024 -3.518 1.00 0.00 C ATOM 90 O GLU A 7 -16.302 15.232 -4.356 1.00 0.00 O ATOM 91 CB GLU A 7 -15.654 18.454 -4.099 1.00 0.00 C ATOM 92 CG GLU A 7 -15.718 18.280 -5.617 1.00 0.00 C ATOM 93 CD GLU A 7 -14.900 19.388 -6.266 1.00 0.00 C ATOM 94 OE1 GLU A 7 -15.455 20.487 -6.534 1.00 0.00 O ATOM 95 OE2 GLU A 7 -13.692 19.139 -6.524 1.00 0.00 O ATOM 0 H GLU A 7 -16.178 18.668 -1.783 1.00 0.00 H new ATOM 0 HA GLU A 7 -17.454 17.242 -3.799 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -16.029 19.442 -3.832 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.615 18.409 -3.774 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.327 17.304 -5.903 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -16.752 18.322 -5.960 1.00 0.00 H new ATOM 102 N GLN A 8 -14.888 15.705 -2.662 1.00 0.00 N ATOM 103 CA GLN A 8 -14.320 14.399 -2.536 1.00 0.00 C ATOM 104 C GLN A 8 -15.243 13.395 -1.936 1.00 0.00 C ATOM 105 O GLN A 8 -15.304 12.281 -2.455 1.00 0.00 O ATOM 106 CB GLN A 8 -13.072 14.660 -1.676 1.00 0.00 C ATOM 107 CG GLN A 8 -11.960 15.452 -2.367 1.00 0.00 C ATOM 108 CD GLN A 8 -10.768 15.777 -1.478 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.873 16.082 -0.291 1.00 0.00 O ATOM 110 NE2 GLN A 8 -9.592 15.859 -2.156 1.00 0.00 N ATOM 0 H GLN A 8 -14.468 16.387 -2.030 1.00 0.00 H new ATOM 0 HA GLN A 8 -14.093 13.947 -3.501 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.375 15.198 -0.778 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.666 13.702 -1.352 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.610 14.885 -3.229 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.378 16.384 -2.747 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.551 15.595 -3.140 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.750 16.184 -1.680 1.00 0.00 H new ATOM 119 N ILE A 9 -15.998 13.800 -0.900 1.00 0.00 N ATOM 120 CA ILE A 9 -17.052 13.023 -0.324 1.00 0.00 C ATOM 121 C ILE A 9 -18.063 12.629 -1.345 1.00 0.00 C ATOM 122 O ILE A 9 -18.413 11.466 -1.538 1.00 0.00 O ATOM 123 CB ILE A 9 -17.798 13.529 0.875 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.728 13.683 1.969 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.892 12.557 1.346 1.00 0.00 C ATOM 126 CD1 ILE A 9 -17.199 14.291 3.290 1.00 0.00 C ATOM 0 H ILE A 9 -15.870 14.704 -0.445 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.461 12.194 0.065 1.00 0.00 H new ATOM 0 HB ILE A 9 -18.314 14.460 0.641 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -16.305 12.700 2.175 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.921 14.301 1.575 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.399 12.974 2.216 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.614 12.405 0.543 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.440 11.602 1.613 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.360 14.350 3.983 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -17.592 15.292 3.110 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.981 13.666 3.720 1.00 0.00 H new ATOM 138 N ALA A 10 -18.597 13.575 -2.139 1.00 0.00 N ATOM 139 CA ALA A 10 -19.578 13.377 -3.161 1.00 0.00 C ATOM 140 C ALA A 10 -19.112 12.704 -4.405 1.00 0.00 C ATOM 141 O ALA A 10 -19.917 12.155 -5.156 1.00 0.00 O ATOM 142 CB ALA A 10 -20.267 14.730 -3.407 1.00 0.00 C ATOM 0 H ALA A 10 -18.320 14.553 -2.059 1.00 0.00 H new ATOM 0 HA ALA A 10 -20.294 12.641 -2.796 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -21.024 14.617 -4.183 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -20.740 15.070 -2.486 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.526 15.463 -3.727 1.00 0.00 H new ATOM 148 N GLU A 11 -17.793 12.559 -4.624 1.00 0.00 N ATOM 149 CA GLU A 11 -17.215 11.577 -5.488 1.00 0.00 C ATOM 150 C GLU A 11 -17.234 10.169 -5.002 1.00 0.00 C ATOM 151 O GLU A 11 -17.717 9.204 -5.592 1.00 0.00 O ATOM 152 CB GLU A 11 -15.753 11.942 -5.796 1.00 0.00 C ATOM 153 CG GLU A 11 -15.182 11.405 -7.110 1.00 0.00 C ATOM 154 CD GLU A 11 -13.967 12.187 -7.588 1.00 0.00 C ATOM 155 OE1 GLU A 11 -14.127 13.428 -7.734 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.845 11.617 -7.640 1.00 0.00 O ATOM 0 H GLU A 11 -17.096 13.155 -4.177 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.858 11.603 -6.368 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -15.666 13.029 -5.804 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -15.130 11.579 -4.979 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.907 10.358 -6.980 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -15.955 11.439 -7.878 1.00 0.00 H new ATOM 163 N PHE A 12 -16.820 9.993 -3.734 1.00 0.00 N ATOM 164 CA PHE A 12 -16.871 8.709 -3.108 1.00 0.00 C ATOM 165 C PHE A 12 -18.308 8.356 -2.930 1.00 0.00 C ATOM 166 O PHE A 12 -18.608 7.179 -2.731 1.00 0.00 O ATOM 167 CB PHE A 12 -16.017 8.817 -1.834 1.00 0.00 C ATOM 168 CG PHE A 12 -14.556 9.107 -1.890 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.868 9.399 -3.044 1.00 0.00 C ATOM 170 CD2 PHE A 12 -13.941 9.287 -0.673 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.519 9.650 -2.958 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.640 9.728 -0.615 1.00 0.00 C ATOM 173 CZ PHE A 12 -11.885 9.860 -1.756 1.00 0.00 C ATOM 0 H PHE A 12 -16.451 10.738 -3.144 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.450 7.884 -3.683 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.469 9.593 -1.216 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.131 7.875 -1.297 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.376 9.430 -3.997 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.481 9.081 0.239 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.937 9.683 -3.867 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.204 9.975 0.342 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.837 10.118 -1.710 1.00 0.00 H new ATOM 183 N LYS A 13 -19.282 9.284 -2.956 1.00 0.00 N ATOM 184 CA LYS A 13 -20.665 8.983 -3.155 1.00 0.00 C ATOM 185 C LYS A 13 -21.015 8.255 -4.407 1.00 0.00 C ATOM 186 O LYS A 13 -21.578 7.165 -4.323 1.00 0.00 O ATOM 187 CB LYS A 13 -21.682 10.120 -2.955 1.00 0.00 C ATOM 188 CG LYS A 13 -23.164 9.750 -2.856 1.00 0.00 C ATOM 189 CD LYS A 13 -23.550 8.909 -1.638 1.00 0.00 C ATOM 190 CE LYS A 13 -24.902 8.194 -1.628 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.993 9.192 -1.564 1.00 0.00 N ATOM 0 H LYS A 13 -19.099 10.280 -2.834 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.771 8.302 -2.311 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.410 10.655 -2.045 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.567 10.820 -3.783 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.750 10.669 -2.843 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.446 9.205 -3.757 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.777 8.153 -1.502 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.516 9.560 -0.765 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -25.008 7.582 -2.524 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.962 7.520 -0.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.911 8.703 -1.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.896 9.758 -0.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.940 9.818 -2.393 1.00 0.00 H new ATOM 205 N GLU A 14 -20.617 8.811 -5.565 1.00 0.00 N ATOM 206 CA GLU A 14 -20.804 8.256 -6.870 1.00 0.00 C ATOM 207 C GLU A 14 -20.153 6.929 -7.061 1.00 0.00 C ATOM 208 O GLU A 14 -20.670 6.068 -7.772 1.00 0.00 O ATOM 209 CB GLU A 14 -20.292 9.236 -7.939 1.00 0.00 C ATOM 210 CG GLU A 14 -20.935 10.622 -7.860 1.00 0.00 C ATOM 211 CD GLU A 14 -21.114 11.194 -9.258 1.00 0.00 C ATOM 212 OE1 GLU A 14 -20.081 11.380 -9.955 1.00 0.00 O ATOM 213 OE2 GLU A 14 -22.269 11.279 -9.754 1.00 0.00 O ATOM 0 H GLU A 14 -20.132 9.708 -5.591 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.877 8.095 -6.976 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.212 9.340 -7.837 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.480 8.814 -8.926 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -21.901 10.556 -7.359 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.311 11.288 -7.263 1.00 0.00 H new ATOM 220 N ALA A 15 -19.039 6.607 -6.381 1.00 0.00 N ATOM 221 CA ALA A 15 -18.397 5.332 -6.477 1.00 0.00 C ATOM 222 C ALA A 15 -19.121 4.362 -5.609 1.00 0.00 C ATOM 223 O ALA A 15 -19.234 3.182 -5.939 1.00 0.00 O ATOM 224 CB ALA A 15 -16.938 5.478 -6.012 1.00 0.00 C ATOM 0 H ALA A 15 -18.570 7.252 -5.745 1.00 0.00 H new ATOM 0 HA ALA A 15 -18.412 4.970 -7.505 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.436 4.513 -6.080 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.424 6.200 -6.647 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.918 5.825 -4.979 1.00 0.00 H new ATOM 230 N PHE A 16 -19.726 4.737 -4.467 1.00 0.00 N ATOM 231 CA PHE A 16 -20.656 3.939 -3.731 1.00 0.00 C ATOM 232 C PHE A 16 -21.843 3.454 -4.491 1.00 0.00 C ATOM 233 O PHE A 16 -22.150 2.264 -4.549 1.00 0.00 O ATOM 234 CB PHE A 16 -21.017 4.658 -2.420 1.00 0.00 C ATOM 235 CG PHE A 16 -21.542 3.788 -1.330 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.840 3.361 -1.488 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.743 3.165 -0.400 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.385 2.505 -0.560 1.00 0.00 C ATOM 239 CE2 PHE A 16 -21.281 2.327 0.548 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.618 2.015 0.471 1.00 0.00 C ATOM 0 H PHE A 16 -19.557 5.645 -4.035 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.147 3.003 -3.500 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.129 5.173 -2.053 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.762 5.423 -2.640 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.425 3.695 -2.332 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.677 3.337 -0.415 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.422 2.216 -0.641 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.666 1.922 1.338 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.067 1.383 1.223 1.00 0.00 H new ATOM 250 N SER A 17 -22.489 4.374 -5.229 1.00 0.00 N ATOM 251 CA SER A 17 -23.609 4.058 -6.060 1.00 0.00 C ATOM 252 C SER A 17 -23.218 3.133 -7.162 1.00 0.00 C ATOM 253 O SER A 17 -23.978 2.303 -7.656 1.00 0.00 O ATOM 254 CB SER A 17 -24.187 5.261 -6.825 1.00 0.00 C ATOM 255 OG SER A 17 -24.664 6.246 -5.921 1.00 0.00 O ATOM 0 H SER A 17 -22.227 5.360 -5.249 1.00 0.00 H new ATOM 0 HA SER A 17 -24.330 3.646 -5.354 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.420 5.692 -7.469 1.00 0.00 H new ATOM 0 HB3 SER A 17 -24.999 4.931 -7.473 1.00 0.00 H new ATOM 0 HG SER A 17 -25.026 7.004 -6.425 1.00 0.00 H new ATOM 261 N LEU A 18 -21.981 3.248 -7.678 1.00 0.00 N ATOM 262 CA LEU A 18 -21.471 2.360 -8.676 1.00 0.00 C ATOM 263 C LEU A 18 -21.241 0.950 -8.252 1.00 0.00 C ATOM 264 O LEU A 18 -21.427 0.006 -9.017 1.00 0.00 O ATOM 265 CB LEU A 18 -20.196 2.946 -9.305 1.00 0.00 C ATOM 266 CG LEU A 18 -20.216 3.127 -10.832 1.00 0.00 C ATOM 267 CD1 LEU A 18 -20.036 1.778 -11.547 1.00 0.00 C ATOM 268 CD2 LEU A 18 -21.505 3.776 -11.363 1.00 0.00 C ATOM 0 H LEU A 18 -21.321 3.973 -7.396 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.273 2.288 -9.410 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.002 3.916 -8.847 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.358 2.299 -9.047 1.00 0.00 H new ATOM 0 HG LEU A 18 -19.385 3.799 -11.046 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.054 1.933 -12.626 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -19.081 1.338 -11.259 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -20.845 1.105 -11.264 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -21.445 3.871 -12.447 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -22.361 3.154 -11.100 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -21.625 4.764 -10.919 1.00 0.00 H new ATOM 280 N PHE A 19 -20.805 0.697 -7.005 1.00 0.00 N ATOM 281 CA PHE A 19 -20.685 -0.624 -6.470 1.00 0.00 C ATOM 282 C PHE A 19 -21.942 -1.316 -6.070 1.00 0.00 C ATOM 283 O PHE A 19 -22.180 -2.510 -6.244 1.00 0.00 O ATOM 284 CB PHE A 19 -19.755 -0.645 -5.245 1.00 0.00 C ATOM 285 CG PHE A 19 -18.379 -0.225 -5.635 1.00 0.00 C ATOM 286 CD1 PHE A 19 -17.635 -0.841 -6.613 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.831 0.773 -4.864 1.00 0.00 C ATOM 288 CE1 PHE A 19 -16.362 -0.400 -6.886 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.528 1.123 -5.129 1.00 0.00 C ATOM 290 CZ PHE A 19 -15.746 0.545 -6.101 1.00 0.00 C ATOM 0 H PHE A 19 -20.529 1.430 -6.352 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.286 -1.174 -7.323 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.142 0.022 -4.474 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.729 -1.647 -4.816 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.050 -1.670 -7.166 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.399 1.260 -4.085 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -15.834 -0.805 -7.737 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.088 1.907 -4.531 1.00 0.00 H new ATOM 0 HZ PHE A 19 -14.710 0.817 -6.239 1.00 0.00 H new ATOM 300 N ASP A 20 -22.916 -0.526 -5.583 1.00 0.00 N ATOM 301 CA ASP A 20 -24.264 -0.902 -5.292 1.00 0.00 C ATOM 302 C ASP A 20 -25.033 -1.489 -6.425 1.00 0.00 C ATOM 303 O ASP A 20 -25.303 -0.842 -7.435 1.00 0.00 O ATOM 304 CB ASP A 20 -25.068 0.183 -4.556 1.00 0.00 C ATOM 305 CG ASP A 20 -26.081 -0.447 -3.612 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.786 -1.417 -4.001 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.083 -0.047 -2.417 1.00 0.00 O ATOM 0 H ASP A 20 -22.744 0.458 -5.376 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.126 -1.728 -4.594 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.391 0.826 -3.994 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.582 0.816 -5.280 1.00 0.00 H new ATOM 312 N LYS A 21 -25.352 -2.783 -6.242 1.00 0.00 N ATOM 313 CA LYS A 21 -26.036 -3.483 -7.284 1.00 0.00 C ATOM 314 C LYS A 21 -27.460 -3.052 -7.374 1.00 0.00 C ATOM 315 O LYS A 21 -27.921 -2.595 -8.419 1.00 0.00 O ATOM 316 CB LYS A 21 -25.887 -4.954 -6.859 1.00 0.00 C ATOM 317 CG LYS A 21 -26.804 -5.970 -7.543 1.00 0.00 C ATOM 318 CD LYS A 21 -26.411 -7.367 -7.060 1.00 0.00 C ATOM 319 CE LYS A 21 -27.380 -8.501 -7.403 1.00 0.00 C ATOM 320 NZ LYS A 21 -28.661 -8.238 -6.711 1.00 0.00 N ATOM 0 H LYS A 21 -25.146 -3.328 -5.405 1.00 0.00 H new ATOM 0 HA LYS A 21 -25.635 -3.296 -8.280 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.855 -5.255 -7.037 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.056 -5.015 -5.784 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.847 -5.764 -7.302 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.707 -5.901 -8.626 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -25.435 -7.612 -7.480 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -26.293 -7.334 -5.977 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -27.534 -8.557 -8.481 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -26.969 -9.461 -7.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -29.262 -9.085 -6.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -28.476 -8.002 -5.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -29.147 -7.442 -7.171 1.00 0.00 H new ATOM 334 N ASP A 22 -28.292 -3.250 -6.337 1.00 0.00 N ATOM 335 CA ASP A 22 -29.685 -3.008 -6.554 1.00 0.00 C ATOM 336 C ASP A 22 -30.028 -1.563 -6.435 1.00 0.00 C ATOM 337 O ASP A 22 -30.907 -1.043 -7.121 1.00 0.00 O ATOM 338 CB ASP A 22 -30.534 -3.786 -5.534 1.00 0.00 C ATOM 339 CG ASP A 22 -30.090 -5.239 -5.441 1.00 0.00 C ATOM 340 OD1 ASP A 22 -30.420 -5.946 -6.430 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.465 -5.699 -4.448 1.00 0.00 O ATOM 0 H ASP A 22 -28.025 -3.559 -5.402 1.00 0.00 H new ATOM 0 HA ASP A 22 -29.902 -3.342 -7.568 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -30.452 -3.315 -4.554 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -31.584 -3.742 -5.822 1.00 0.00 H new ATOM 346 N GLY A 23 -29.146 -0.914 -5.653 1.00 0.00 N ATOM 347 CA GLY A 23 -29.188 0.512 -5.563 1.00 0.00 C ATOM 348 C GLY A 23 -29.794 0.983 -4.285 1.00 0.00 C ATOM 349 O GLY A 23 -30.420 2.037 -4.190 1.00 0.00 O ATOM 0 H GLY A 23 -28.420 -1.364 -5.095 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.177 0.909 -5.650 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -29.760 0.910 -6.401 1.00 0.00 H new ATOM 353 N ASP A 24 -29.591 0.212 -3.203 1.00 0.00 N ATOM 354 CA ASP A 24 -30.167 0.421 -1.911 1.00 0.00 C ATOM 355 C ASP A 24 -29.436 1.413 -1.074 1.00 0.00 C ATOM 356 O ASP A 24 -29.989 2.464 -0.754 1.00 0.00 O ATOM 357 CB ASP A 24 -30.299 -0.923 -1.175 1.00 0.00 C ATOM 358 CG ASP A 24 -29.100 -1.842 -1.364 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.122 -1.755 -0.574 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.071 -2.718 -2.269 1.00 0.00 O ATOM 0 H ASP A 24 -28.986 -0.609 -3.233 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.153 0.853 -2.078 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -30.436 -0.733 -0.111 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.196 -1.433 -1.526 1.00 0.00 H new ATOM 365 N GLY A 25 -28.167 1.146 -0.716 1.00 0.00 N ATOM 366 CA GLY A 25 -27.493 1.901 0.295 1.00 0.00 C ATOM 367 C GLY A 25 -26.392 1.201 1.014 1.00 0.00 C ATOM 368 O GLY A 25 -25.576 1.874 1.642 1.00 0.00 O ATOM 0 H GLY A 25 -27.605 0.402 -1.130 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.084 2.801 -0.165 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.230 2.225 1.030 1.00 0.00 H new ATOM 372 N THR A 26 -26.182 -0.126 0.940 1.00 0.00 N ATOM 373 CA THR A 26 -25.057 -0.771 1.542 1.00 0.00 C ATOM 374 C THR A 26 -24.304 -1.582 0.545 1.00 0.00 C ATOM 375 O THR A 26 -24.849 -2.003 -0.474 1.00 0.00 O ATOM 376 CB THR A 26 -25.413 -1.535 2.783 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.467 -2.458 2.549 1.00 0.00 O ATOM 378 CG2 THR A 26 -25.884 -0.444 3.759 1.00 0.00 C ATOM 0 H THR A 26 -26.809 -0.765 0.451 1.00 0.00 H new ATOM 0 HA THR A 26 -24.382 0.013 1.885 1.00 0.00 H new ATOM 0 HB THR A 26 -24.574 -2.124 3.153 1.00 0.00 H new ATOM 0 HG1 THR A 26 -26.671 -2.939 3.378 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.170 -0.902 4.706 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.075 0.266 3.929 1.00 0.00 H new ATOM 0 HG23 THR A 26 -26.742 0.078 3.335 1.00 0.00 H new ATOM 386 N ILE A 27 -23.071 -1.979 0.908 1.00 0.00 N ATOM 387 CA ILE A 27 -22.341 -3.006 0.231 1.00 0.00 C ATOM 388 C ILE A 27 -22.366 -4.304 0.963 1.00 0.00 C ATOM 389 O ILE A 27 -21.900 -4.376 2.099 1.00 0.00 O ATOM 390 CB ILE A 27 -21.029 -2.542 -0.328 1.00 0.00 C ATOM 391 CG1 ILE A 27 -20.954 -1.046 -0.676 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.802 -3.433 -1.561 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.614 -0.601 -1.260 1.00 0.00 C ATOM 0 H ILE A 27 -22.567 -1.573 1.696 1.00 0.00 H new ATOM 0 HA ILE A 27 -22.879 -3.248 -0.685 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.248 -2.639 0.426 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.744 -0.811 -1.390 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.155 -0.465 0.224 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.859 -3.163 -2.037 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.767 -4.478 -1.253 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.619 -3.291 -2.268 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.648 0.467 -1.476 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.820 -0.800 -0.541 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.417 -1.152 -2.180 1.00 0.00 H new ATOM 405 N THR A 28 -22.801 -5.389 0.296 1.00 0.00 N ATOM 406 CA THR A 28 -22.749 -6.693 0.880 1.00 0.00 C ATOM 407 C THR A 28 -21.590 -7.501 0.404 1.00 0.00 C ATOM 408 O THR A 28 -20.921 -7.091 -0.542 1.00 0.00 O ATOM 409 CB THR A 28 -23.932 -7.500 0.432 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.194 -7.423 -0.961 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.179 -6.907 1.110 1.00 0.00 C ATOM 0 H THR A 28 -23.188 -5.363 -0.647 1.00 0.00 H new ATOM 0 HA THR A 28 -22.699 -6.517 1.955 1.00 0.00 H new ATOM 0 HB THR A 28 -23.713 -8.536 0.689 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.413 -6.499 -1.202 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.061 -7.471 0.806 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.067 -6.965 2.193 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.294 -5.865 0.812 1.00 0.00 H new ATOM 419 N THR A 29 -21.301 -8.664 1.015 1.00 0.00 N ATOM 420 CA THR A 29 -20.440 -9.727 0.597 1.00 0.00 C ATOM 421 C THR A 29 -20.399 -10.019 -0.863 1.00 0.00 C ATOM 422 O THR A 29 -19.374 -9.914 -1.534 1.00 0.00 O ATOM 423 CB THR A 29 -20.656 -11.048 1.273 1.00 0.00 C ATOM 424 OG1 THR A 29 -22.001 -11.309 1.646 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.868 -11.021 2.594 1.00 0.00 C ATOM 0 H THR A 29 -21.727 -8.882 1.916 1.00 0.00 H new ATOM 0 HA THR A 29 -19.493 -9.287 0.910 1.00 0.00 H new ATOM 0 HB THR A 29 -20.346 -11.810 0.558 1.00 0.00 H new ATOM 0 HG1 THR A 29 -22.056 -12.187 2.077 1.00 0.00 H new ATOM 0 HG21 THR A 29 -20.001 -11.968 3.116 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.810 -10.868 2.383 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.234 -10.207 3.220 1.00 0.00 H new ATOM 433 N LYS A 30 -21.549 -10.314 -1.496 1.00 0.00 N ATOM 434 CA LYS A 30 -21.753 -10.505 -2.899 1.00 0.00 C ATOM 435 C LYS A 30 -21.363 -9.406 -3.827 1.00 0.00 C ATOM 436 O LYS A 30 -20.841 -9.626 -4.918 1.00 0.00 O ATOM 437 CB LYS A 30 -23.141 -11.030 -3.301 1.00 0.00 C ATOM 438 CG LYS A 30 -24.339 -10.082 -3.216 1.00 0.00 C ATOM 439 CD LYS A 30 -25.703 -10.742 -3.426 1.00 0.00 C ATOM 440 CE LYS A 30 -26.006 -11.774 -2.338 1.00 0.00 C ATOM 441 NZ LYS A 30 -27.214 -12.489 -2.806 1.00 0.00 N ATOM 0 H LYS A 30 -22.417 -10.429 -0.973 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.012 -11.292 -3.043 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.074 -11.387 -4.329 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.360 -11.896 -2.677 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -24.332 -9.599 -2.239 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -24.214 -9.296 -3.961 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -26.480 -9.978 -3.429 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.727 -11.225 -4.403 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.170 -12.460 -2.203 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -26.182 -11.292 -1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -27.481 -13.213 -2.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -27.996 -11.813 -2.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -27.016 -12.945 -3.720 1.00 0.00 H new ATOM 455 N GLU A 31 -21.632 -8.161 -3.395 1.00 0.00 N ATOM 456 CA GLU A 31 -21.335 -7.001 -4.177 1.00 0.00 C ATOM 457 C GLU A 31 -19.880 -6.691 -4.090 1.00 0.00 C ATOM 458 O GLU A 31 -19.242 -6.463 -5.116 1.00 0.00 O ATOM 459 CB GLU A 31 -22.171 -5.787 -3.740 1.00 0.00 C ATOM 460 CG GLU A 31 -23.689 -5.800 -3.933 1.00 0.00 C ATOM 461 CD GLU A 31 -24.426 -4.701 -3.180 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.445 -4.766 -1.922 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.168 -3.946 -3.862 1.00 0.00 O ATOM 0 H GLU A 31 -22.061 -7.957 -2.492 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.597 -7.218 -5.213 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -21.979 -5.625 -2.679 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.783 -4.917 -4.270 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.909 -5.706 -4.996 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.076 -6.767 -3.612 1.00 0.00 H new ATOM 470 N LEU A 32 -19.262 -6.664 -2.896 1.00 0.00 N ATOM 471 CA LEU A 32 -17.835 -6.597 -2.826 1.00 0.00 C ATOM 472 C LEU A 32 -17.129 -7.655 -3.602 1.00 0.00 C ATOM 473 O LEU A 32 -16.092 -7.367 -4.197 1.00 0.00 O ATOM 474 CB LEU A 32 -17.454 -6.385 -1.351 1.00 0.00 C ATOM 475 CG LEU A 32 -16.016 -5.966 -1.001 1.00 0.00 C ATOM 476 CD1 LEU A 32 -15.474 -4.777 -1.812 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.959 -5.636 0.500 1.00 0.00 C ATOM 0 H LEU A 32 -19.739 -6.688 -1.995 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.450 -5.734 -3.369 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.125 -5.628 -0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.663 -7.314 -0.821 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.374 -6.808 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.455 -4.555 -1.495 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.478 -5.028 -2.873 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.105 -3.904 -1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.946 -5.336 0.768 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.649 -4.821 0.720 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.242 -6.516 1.077 1.00 0.00 H new ATOM 489 N GLY A 33 -17.628 -8.899 -3.721 1.00 0.00 N ATOM 490 CA GLY A 33 -16.994 -9.912 -4.506 1.00 0.00 C ATOM 491 C GLY A 33 -17.128 -9.664 -5.969 1.00 0.00 C ATOM 492 O GLY A 33 -16.120 -9.831 -6.654 1.00 0.00 O ATOM 0 H GLY A 33 -18.487 -9.206 -3.264 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.937 -9.962 -4.244 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.429 -10.881 -4.263 1.00 0.00 H new ATOM 496 N THR A 34 -18.260 -9.112 -6.440 1.00 0.00 N ATOM 497 CA THR A 34 -18.373 -8.631 -7.781 1.00 0.00 C ATOM 498 C THR A 34 -17.272 -7.749 -8.260 1.00 0.00 C ATOM 499 O THR A 34 -16.811 -7.937 -9.385 1.00 0.00 O ATOM 500 CB THR A 34 -19.647 -7.936 -8.164 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.760 -8.783 -7.916 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.763 -7.599 -9.660 1.00 0.00 C ATOM 0 H THR A 34 -19.107 -8.998 -5.883 1.00 0.00 H new ATOM 0 HA THR A 34 -18.331 -9.604 -8.271 1.00 0.00 H new ATOM 0 HB THR A 34 -19.636 -7.021 -7.572 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.780 -9.028 -6.967 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.713 -7.099 -9.848 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.943 -6.941 -9.949 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.715 -8.518 -10.245 1.00 0.00 H new ATOM 510 N VAL A 35 -16.837 -6.787 -7.427 1.00 0.00 N ATOM 511 CA VAL A 35 -15.732 -5.980 -7.844 1.00 0.00 C ATOM 512 C VAL A 35 -14.535 -6.799 -8.187 1.00 0.00 C ATOM 513 O VAL A 35 -13.914 -6.707 -9.245 1.00 0.00 O ATOM 514 CB VAL A 35 -15.359 -5.054 -6.724 1.00 0.00 C ATOM 515 CG1 VAL A 35 -14.089 -4.289 -7.134 1.00 0.00 C ATOM 516 CG2 VAL A 35 -16.514 -4.055 -6.549 1.00 0.00 C ATOM 0 H VAL A 35 -17.227 -6.573 -6.509 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.040 -5.433 -8.735 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.179 -5.600 -5.798 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -13.799 -3.609 -6.333 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -13.281 -4.997 -7.318 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.285 -3.718 -8.042 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -16.278 -3.363 -5.740 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -16.655 -3.497 -7.474 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.429 -4.596 -6.308 1.00 0.00 H new ATOM 526 N MET A 36 -14.164 -7.687 -7.247 1.00 0.00 N ATOM 527 CA MET A 36 -13.042 -8.572 -7.272 1.00 0.00 C ATOM 528 C MET A 36 -13.152 -9.532 -8.405 1.00 0.00 C ATOM 529 O MET A 36 -12.127 -9.873 -8.993 1.00 0.00 O ATOM 530 CB MET A 36 -12.875 -9.336 -5.947 1.00 0.00 C ATOM 531 CG MET A 36 -12.702 -8.454 -4.709 1.00 0.00 C ATOM 532 SD MET A 36 -11.837 -9.288 -3.344 1.00 0.00 S ATOM 533 CE MET A 36 -12.019 -7.976 -2.101 1.00 0.00 C ATOM 0 H MET A 36 -14.704 -7.793 -6.388 1.00 0.00 H new ATOM 0 HA MET A 36 -12.155 -7.955 -7.411 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.746 -9.974 -5.801 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.009 -9.993 -6.030 1.00 0.00 H new ATOM 0 HG2 MET A 36 -12.149 -7.557 -4.986 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.683 -8.129 -4.363 1.00 0.00 H new ATOM 0 HE1 MET A 36 -11.548 -8.290 -1.169 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.540 -7.065 -2.461 1.00 0.00 H new ATOM 0 HE3 MET A 36 -13.078 -7.785 -1.926 1.00 0.00 H new ATOM 543 N ARG A 37 -14.331 -10.079 -8.754 1.00 0.00 N ATOM 544 CA ARG A 37 -14.669 -10.995 -9.799 1.00 0.00 C ATOM 545 C ARG A 37 -14.610 -10.405 -11.167 1.00 0.00 C ATOM 546 O ARG A 37 -13.945 -10.972 -12.033 1.00 0.00 O ATOM 547 CB ARG A 37 -16.071 -11.602 -9.622 1.00 0.00 C ATOM 548 CG ARG A 37 -16.282 -12.508 -8.408 1.00 0.00 C ATOM 549 CD ARG A 37 -15.522 -13.828 -8.258 1.00 0.00 C ATOM 550 NE ARG A 37 -15.534 -14.531 -9.572 1.00 0.00 N ATOM 551 CZ ARG A 37 -14.567 -15.456 -9.840 1.00 0.00 C ATOM 552 NH1 ARG A 37 -13.952 -16.258 -8.923 1.00 0.00 N ATOM 553 NH2 ARG A 37 -14.399 -15.880 -11.127 1.00 0.00 N ATOM 0 H ARG A 37 -15.166 -9.839 -8.220 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.904 -11.767 -9.713 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -16.790 -10.785 -9.565 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -16.309 -12.174 -10.519 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -16.059 -11.911 -7.524 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -17.345 -12.748 -8.371 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -14.497 -13.641 -7.938 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -15.987 -14.448 -7.492 1.00 0.00 H new ATOM 0 HE ARG A 37 -16.256 -14.323 -10.262 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -14.207 -16.194 -7.937 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -13.238 -16.921 -9.223 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.991 -15.506 -11.869 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -13.681 -16.571 -11.347 1.00 0.00 H new ATOM 567 N SER A 38 -15.008 -9.132 -11.334 1.00 0.00 N ATOM 568 CA SER A 38 -14.758 -8.389 -12.531 1.00 0.00 C ATOM 569 C SER A 38 -13.382 -7.821 -12.594 1.00 0.00 C ATOM 570 O SER A 38 -13.010 -7.302 -13.645 1.00 0.00 O ATOM 571 CB SER A 38 -15.846 -7.324 -12.746 1.00 0.00 C ATOM 572 OG SER A 38 -17.125 -7.942 -12.765 1.00 0.00 O ATOM 0 H SER A 38 -15.515 -8.606 -10.622 1.00 0.00 H new ATOM 0 HA SER A 38 -14.810 -9.093 -13.362 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.803 -6.580 -11.950 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.672 -6.797 -13.684 1.00 0.00 H new ATOM 0 HG SER A 38 -17.816 -7.260 -12.900 1.00 0.00 H new ATOM 578 N LEU A 39 -12.575 -7.913 -11.523 1.00 0.00 N ATOM 579 CA LEU A 39 -11.163 -7.684 -11.502 1.00 0.00 C ATOM 580 C LEU A 39 -10.456 -8.956 -11.822 1.00 0.00 C ATOM 581 O LEU A 39 -9.265 -8.925 -12.126 1.00 0.00 O ATOM 582 CB LEU A 39 -10.780 -6.902 -10.234 1.00 0.00 C ATOM 583 CG LEU A 39 -9.332 -6.464 -9.958 1.00 0.00 C ATOM 584 CD1 LEU A 39 -9.000 -5.170 -10.719 1.00 0.00 C ATOM 585 CD2 LEU A 39 -9.173 -6.312 -8.436 1.00 0.00 C ATOM 0 H LEU A 39 -12.937 -8.166 -10.604 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.814 -7.015 -12.289 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -11.390 -5.999 -10.225 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -11.094 -7.507 -9.384 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.623 -7.211 -10.317 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.971 -4.878 -10.509 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.119 -5.337 -11.790 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.675 -4.376 -10.398 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.154 -6.001 -8.206 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.873 -5.561 -8.070 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -9.379 -7.266 -7.952 1.00 0.00 H new ATOM 597 N GLY A 40 -11.098 -10.133 -11.723 1.00 0.00 N ATOM 598 CA GLY A 40 -10.546 -11.406 -12.067 1.00 0.00 C ATOM 599 C GLY A 40 -10.239 -12.363 -10.967 1.00 0.00 C ATOM 600 O GLY A 40 -9.804 -13.484 -11.231 1.00 0.00 O ATOM 0 H GLY A 40 -12.057 -10.199 -11.383 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -11.240 -11.896 -12.750 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.624 -11.230 -12.621 1.00 0.00 H new ATOM 604 N GLN A 41 -10.599 -11.952 -9.739 1.00 0.00 N ATOM 605 CA GLN A 41 -10.208 -12.636 -8.545 1.00 0.00 C ATOM 606 C GLN A 41 -11.141 -13.669 -8.012 1.00 0.00 C ATOM 607 O GLN A 41 -12.321 -13.760 -8.345 1.00 0.00 O ATOM 608 CB GLN A 41 -9.651 -11.702 -7.457 1.00 0.00 C ATOM 609 CG GLN A 41 -8.676 -10.681 -8.046 1.00 0.00 C ATOM 610 CD GLN A 41 -8.142 -9.769 -6.951 1.00 0.00 C ATOM 611 OE1 GLN A 41 -8.598 -9.562 -5.827 1.00 0.00 O ATOM 612 NE2 GLN A 41 -7.067 -9.025 -7.326 1.00 0.00 N ATOM 0 H GLN A 41 -11.174 -11.127 -9.571 1.00 0.00 H new ATOM 0 HA GLN A 41 -9.376 -13.243 -8.901 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.473 -11.181 -6.966 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.145 -12.292 -6.693 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.849 -11.197 -8.534 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.178 -10.088 -8.810 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.651 -9.158 -8.248 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -6.677 -8.334 -6.685 1.00 0.00 H new ATOM 621 N ASN A 42 -10.597 -14.477 -7.084 1.00 0.00 N ATOM 622 CA ASN A 42 -11.199 -15.642 -6.515 1.00 0.00 C ATOM 623 C ASN A 42 -11.218 -15.611 -5.026 1.00 0.00 C ATOM 624 O ASN A 42 -10.476 -16.392 -4.432 1.00 0.00 O ATOM 625 CB ASN A 42 -10.347 -16.879 -6.848 1.00 0.00 C ATOM 626 CG ASN A 42 -10.356 -17.391 -8.282 1.00 0.00 C ATOM 627 OD1 ASN A 42 -11.268 -18.107 -8.692 1.00 0.00 O ATOM 628 ND2 ASN A 42 -9.262 -17.076 -9.025 1.00 0.00 N ATOM 0 H ASN A 42 -9.667 -14.301 -6.704 1.00 0.00 H new ATOM 0 HA ASN A 42 -12.210 -15.675 -6.920 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -9.314 -16.655 -6.581 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.674 -17.693 -6.201 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -9.168 -17.439 -9.974 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -8.535 -16.477 -8.634 1.00 0.00 H new ATOM 635 N PRO A 43 -12.089 -14.931 -4.342 1.00 0.00 N ATOM 636 CA PRO A 43 -12.066 -14.958 -2.909 1.00 0.00 C ATOM 637 C PRO A 43 -13.030 -15.937 -2.334 1.00 0.00 C ATOM 638 O PRO A 43 -13.891 -16.478 -3.028 1.00 0.00 O ATOM 639 CB PRO A 43 -12.609 -13.582 -2.532 1.00 0.00 C ATOM 640 CG PRO A 43 -13.602 -13.261 -3.661 1.00 0.00 C ATOM 641 CD PRO A 43 -12.804 -13.777 -4.868 1.00 0.00 C ATOM 0 HA PRO A 43 -11.069 -15.215 -2.550 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.100 -13.598 -1.559 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.813 -12.839 -2.475 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.554 -13.777 -3.539 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -13.824 -12.196 -3.732 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -13.460 -14.055 -5.693 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -12.118 -13.020 -5.248 1.00 0.00 H new ATOM 649 N THR A 44 -12.986 -15.997 -0.991 1.00 0.00 N ATOM 650 CA THR A 44 -13.910 -16.672 -0.134 1.00 0.00 C ATOM 651 C THR A 44 -14.806 -15.693 0.543 1.00 0.00 C ATOM 652 O THR A 44 -14.417 -14.534 0.678 1.00 0.00 O ATOM 653 CB THR A 44 -13.256 -17.539 0.901 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.243 -16.833 1.602 1.00 0.00 O ATOM 655 CG2 THR A 44 -12.643 -18.788 0.245 1.00 0.00 C ATOM 0 H THR A 44 -12.244 -15.536 -0.464 1.00 0.00 H new ATOM 0 HA THR A 44 -14.485 -17.331 -0.785 1.00 0.00 H new ATOM 0 HB THR A 44 -14.027 -17.839 1.611 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.836 -17.423 2.271 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.172 -19.407 1.009 1.00 0.00 H new ATOM 0 HG22 THR A 44 -13.427 -19.359 -0.253 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.895 -18.484 -0.487 1.00 0.00 H new ATOM 663 N GLU A 45 -15.983 -16.134 1.022 1.00 0.00 N ATOM 664 CA GLU A 45 -16.823 -15.372 1.893 1.00 0.00 C ATOM 665 C GLU A 45 -16.123 -14.899 3.120 1.00 0.00 C ATOM 666 O GLU A 45 -16.167 -13.695 3.370 1.00 0.00 O ATOM 667 CB GLU A 45 -18.063 -16.187 2.297 1.00 0.00 C ATOM 668 CG GLU A 45 -18.813 -16.771 1.099 1.00 0.00 C ATOM 669 CD GLU A 45 -20.163 -17.269 1.596 1.00 0.00 C ATOM 670 OE1 GLU A 45 -20.222 -18.192 2.451 1.00 0.00 O ATOM 671 OE2 GLU A 45 -21.198 -16.662 1.213 1.00 0.00 O ATOM 0 H GLU A 45 -16.363 -17.053 0.795 1.00 0.00 H new ATOM 0 HA GLU A 45 -17.120 -14.489 1.328 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.758 -16.998 2.958 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.740 -15.550 2.866 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -18.946 -16.015 0.325 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -18.245 -17.587 0.653 1.00 0.00 H new ATOM 678 N ALA A 46 -15.391 -15.745 3.866 1.00 0.00 N ATOM 679 CA ALA A 46 -14.607 -15.431 5.020 1.00 0.00 C ATOM 680 C ALA A 46 -13.609 -14.351 4.779 1.00 0.00 C ATOM 681 O ALA A 46 -13.691 -13.440 5.602 1.00 0.00 O ATOM 682 CB ALA A 46 -13.880 -16.718 5.445 1.00 0.00 C ATOM 0 H ALA A 46 -15.345 -16.738 3.639 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.274 -15.059 5.797 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.270 -16.517 6.325 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -14.613 -17.489 5.680 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.241 -17.061 4.631 1.00 0.00 H new ATOM 688 N GLU A 47 -12.785 -14.345 3.716 1.00 0.00 N ATOM 689 CA GLU A 47 -11.899 -13.247 3.485 1.00 0.00 C ATOM 690 C GLU A 47 -12.556 -11.948 3.170 1.00 0.00 C ATOM 691 O GLU A 47 -12.200 -10.908 3.723 1.00 0.00 O ATOM 692 CB GLU A 47 -10.761 -13.570 2.503 1.00 0.00 C ATOM 693 CG GLU A 47 -11.159 -13.741 1.035 1.00 0.00 C ATOM 694 CD GLU A 47 -9.918 -14.125 0.241 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.916 -13.371 0.113 1.00 0.00 O ATOM 696 OE2 GLU A 47 -9.840 -15.256 -0.308 1.00 0.00 O ATOM 0 H GLU A 47 -12.732 -15.092 3.023 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.443 -13.096 4.464 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.019 -12.774 2.566 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.273 -14.487 2.834 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.925 -14.511 0.937 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.586 -12.816 0.648 1.00 0.00 H new ATOM 703 N LEU A 48 -13.674 -11.965 2.422 1.00 0.00 N ATOM 704 CA LEU A 48 -14.435 -10.790 2.133 1.00 0.00 C ATOM 705 C LEU A 48 -15.004 -10.225 3.389 1.00 0.00 C ATOM 706 O LEU A 48 -14.945 -9.061 3.783 1.00 0.00 O ATOM 707 CB LEU A 48 -15.600 -11.256 1.244 1.00 0.00 C ATOM 708 CG LEU A 48 -15.267 -11.161 -0.254 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.417 -11.893 -0.967 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.157 -9.685 -0.673 1.00 0.00 C ATOM 0 H LEU A 48 -14.058 -12.815 2.009 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.816 -10.030 1.657 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.854 -12.286 1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.481 -10.651 1.457 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.309 -11.614 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -16.251 -11.869 -2.044 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -16.454 -12.929 -0.629 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -17.361 -11.401 -0.734 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -14.921 -9.625 -1.735 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -16.105 -9.181 -0.483 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.367 -9.201 -0.098 1.00 0.00 H new ATOM 722 N GLN A 49 -15.627 -11.153 4.137 1.00 0.00 N ATOM 723 CA GLN A 49 -16.134 -10.766 5.418 1.00 0.00 C ATOM 724 C GLN A 49 -15.249 -10.199 6.474 1.00 0.00 C ATOM 725 O GLN A 49 -15.582 -9.218 7.137 1.00 0.00 O ATOM 726 CB GLN A 49 -16.974 -11.921 5.987 1.00 0.00 C ATOM 727 CG GLN A 49 -17.673 -11.712 7.332 1.00 0.00 C ATOM 728 CD GLN A 49 -18.771 -12.747 7.529 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.753 -13.754 6.822 1.00 0.00 O ATOM 730 NE2 GLN A 49 -19.792 -12.451 8.377 1.00 0.00 N ATOM 0 H GLN A 49 -15.776 -12.127 3.873 1.00 0.00 H new ATOM 0 HA GLN A 49 -16.697 -9.868 5.161 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.737 -12.172 5.250 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.324 -12.791 6.081 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -16.947 -11.785 8.141 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.098 -10.709 7.375 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.757 -11.602 8.941 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.593 -13.078 8.449 1.00 0.00 H new ATOM 739 N ASP A 50 -13.951 -10.546 6.402 1.00 0.00 N ATOM 740 CA ASP A 50 -12.950 -9.955 7.235 1.00 0.00 C ATOM 741 C ASP A 50 -12.642 -8.522 6.970 1.00 0.00 C ATOM 742 O ASP A 50 -12.604 -7.679 7.865 1.00 0.00 O ATOM 743 CB ASP A 50 -11.627 -10.714 7.034 1.00 0.00 C ATOM 744 CG ASP A 50 -11.654 -11.945 7.927 1.00 0.00 C ATOM 745 OD1 ASP A 50 -12.535 -12.172 8.799 1.00 0.00 O ATOM 746 OD2 ASP A 50 -10.612 -12.641 7.790 1.00 0.00 O ATOM 0 H ASP A 50 -13.591 -11.248 5.755 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.364 -10.018 8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.508 -11.003 5.990 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -10.779 -10.077 7.288 1.00 0.00 H new ATOM 751 N MET A 51 -12.538 -8.124 5.689 1.00 0.00 N ATOM 752 CA MET A 51 -12.334 -6.756 5.329 1.00 0.00 C ATOM 753 C MET A 51 -13.443 -5.859 5.760 1.00 0.00 C ATOM 754 O MET A 51 -13.214 -4.870 6.455 1.00 0.00 O ATOM 755 CB MET A 51 -12.143 -6.750 3.803 1.00 0.00 C ATOM 756 CG MET A 51 -11.855 -5.403 3.137 1.00 0.00 C ATOM 757 SD MET A 51 -11.260 -5.605 1.431 1.00 0.00 S ATOM 758 CE MET A 51 -10.844 -3.865 1.118 1.00 0.00 C ATOM 0 H MET A 51 -12.596 -8.760 4.894 1.00 0.00 H new ATOM 0 HA MET A 51 -11.462 -6.354 5.845 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.323 -7.427 3.563 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.043 -7.165 3.349 1.00 0.00 H new ATOM 0 HG2 MET A 51 -12.761 -4.797 3.136 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.110 -4.862 3.720 1.00 0.00 H new ATOM 0 HE1 MET A 51 -10.261 -3.790 0.200 1.00 0.00 H new ATOM 0 HE2 MET A 51 -11.761 -3.285 1.015 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.260 -3.475 1.951 1.00 0.00 H new ATOM 768 N ILE A 52 -14.693 -6.238 5.439 1.00 0.00 N ATOM 769 CA ILE A 52 -15.875 -5.683 6.021 1.00 0.00 C ATOM 770 C ILE A 52 -15.860 -5.465 7.495 1.00 0.00 C ATOM 771 O ILE A 52 -16.027 -4.338 7.958 1.00 0.00 O ATOM 772 CB ILE A 52 -17.088 -6.492 5.666 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.198 -6.774 4.159 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.359 -5.737 6.089 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.193 -7.862 3.756 1.00 0.00 C ATOM 0 H ILE A 52 -14.888 -6.960 4.746 1.00 0.00 H new ATOM 0 HA ILE A 52 -15.911 -4.687 5.580 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.987 -7.442 6.192 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.477 -5.849 3.655 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.212 -7.054 3.788 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.237 -6.328 5.829 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.341 -5.568 7.166 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.402 -4.778 5.572 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.188 -7.976 2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -17.909 -8.806 4.222 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.193 -7.581 4.086 1.00 0.00 H new ATOM 787 N ASN A 53 -15.672 -6.519 8.308 1.00 0.00 N ATOM 788 CA ASN A 53 -15.666 -6.501 9.738 1.00 0.00 C ATOM 789 C ASN A 53 -14.614 -5.637 10.345 1.00 0.00 C ATOM 790 O ASN A 53 -14.791 -5.063 11.419 1.00 0.00 O ATOM 791 CB ASN A 53 -15.421 -7.935 10.236 1.00 0.00 C ATOM 792 CG ASN A 53 -16.671 -8.775 10.014 1.00 0.00 C ATOM 793 OD1 ASN A 53 -17.777 -8.349 9.684 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.468 -10.094 10.273 1.00 0.00 N ATOM 0 H ASN A 53 -15.512 -7.455 7.936 1.00 0.00 H new ATOM 0 HA ASN A 53 -16.630 -6.092 10.039 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.576 -8.375 9.706 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.162 -7.923 11.295 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.242 -10.754 10.195 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.542 -10.424 10.545 1.00 0.00 H new ATOM 801 N GLU A 54 -13.444 -5.354 9.745 1.00 0.00 N ATOM 802 CA GLU A 54 -12.566 -4.337 10.236 1.00 0.00 C ATOM 803 C GLU A 54 -13.074 -2.941 10.351 1.00 0.00 C ATOM 804 O GLU A 54 -12.932 -2.184 11.310 1.00 0.00 O ATOM 805 CB GLU A 54 -11.313 -4.250 9.348 1.00 0.00 C ATOM 806 CG GLU A 54 -10.080 -3.658 10.033 1.00 0.00 C ATOM 807 CD GLU A 54 -8.783 -4.049 9.339 1.00 0.00 C ATOM 808 OE1 GLU A 54 -8.481 -3.577 8.210 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.100 -4.982 9.839 1.00 0.00 O ATOM 0 H GLU A 54 -13.104 -5.834 8.912 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.396 -4.679 11.257 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.068 -5.250 8.991 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.548 -3.647 8.471 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.165 -2.571 10.051 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.049 -3.993 11.070 1.00 0.00 H new ATOM 816 N VAL A 55 -13.769 -2.531 9.275 1.00 0.00 N ATOM 817 CA VAL A 55 -14.345 -1.233 9.107 1.00 0.00 C ATOM 818 C VAL A 55 -15.759 -1.080 9.551 1.00 0.00 C ATOM 819 O VAL A 55 -16.277 0.035 9.504 1.00 0.00 O ATOM 820 CB VAL A 55 -14.035 -0.698 7.740 1.00 0.00 C ATOM 821 CG1 VAL A 55 -12.522 -0.670 7.467 1.00 0.00 C ATOM 822 CG2 VAL A 55 -14.865 -1.505 6.726 1.00 0.00 C ATOM 0 H VAL A 55 -13.938 -3.142 8.476 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.851 -0.581 9.828 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.324 0.349 7.649 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.340 -0.276 6.467 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.031 -0.033 8.203 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.121 -1.681 7.537 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.663 -1.141 5.719 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.595 -2.559 6.792 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -15.926 -1.388 6.948 1.00 0.00 H new ATOM 832 N ASP A 56 -16.434 -2.174 9.946 1.00 0.00 N ATOM 833 CA ASP A 56 -17.786 -2.227 10.409 1.00 0.00 C ATOM 834 C ASP A 56 -17.832 -1.731 11.813 1.00 0.00 C ATOM 835 O ASP A 56 -17.641 -2.463 12.783 1.00 0.00 O ATOM 836 CB ASP A 56 -18.398 -3.637 10.357 1.00 0.00 C ATOM 837 CG ASP A 56 -19.915 -3.661 10.482 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.514 -2.570 10.287 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.480 -4.760 10.726 1.00 0.00 O ATOM 0 H ASP A 56 -15.997 -3.096 9.941 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.377 -1.602 9.740 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.114 -4.110 9.417 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -17.969 -4.238 11.159 1.00 0.00 H new ATOM 844 N ALA A 57 -18.058 -0.411 11.932 1.00 0.00 N ATOM 845 CA ALA A 57 -18.025 0.278 13.185 1.00 0.00 C ATOM 846 C ALA A 57 -19.342 0.287 13.880 1.00 0.00 C ATOM 847 O ALA A 57 -19.469 0.419 15.097 1.00 0.00 O ATOM 848 CB ALA A 57 -17.510 1.714 12.995 1.00 0.00 C ATOM 0 H ALA A 57 -18.269 0.193 11.138 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.337 -0.273 13.826 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.491 2.224 13.958 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.503 1.687 12.579 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.170 2.250 12.313 1.00 0.00 H new ATOM 854 N ASP A 58 -20.429 0.068 13.120 1.00 0.00 N ATOM 855 CA ASP A 58 -21.772 -0.045 13.600 1.00 0.00 C ATOM 856 C ASP A 58 -22.137 -1.424 14.030 1.00 0.00 C ATOM 857 O ASP A 58 -22.864 -1.541 15.015 1.00 0.00 O ATOM 858 CB ASP A 58 -22.860 0.616 12.737 1.00 0.00 C ATOM 859 CG ASP A 58 -22.917 0.145 11.290 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.029 -1.077 11.005 1.00 0.00 O ATOM 861 OD2 ASP A 58 -22.817 0.967 10.341 1.00 0.00 O ATOM 0 H ASP A 58 -20.366 -0.037 12.107 1.00 0.00 H new ATOM 0 HA ASP A 58 -21.752 0.571 14.499 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.829 0.433 13.200 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.702 1.694 12.745 1.00 0.00 H new ATOM 866 N GLY A 59 -21.584 -2.451 13.361 1.00 0.00 N ATOM 867 CA GLY A 59 -21.800 -3.851 13.559 1.00 0.00 C ATOM 868 C GLY A 59 -22.954 -4.447 12.829 1.00 0.00 C ATOM 869 O GLY A 59 -23.673 -5.253 13.418 1.00 0.00 O ATOM 0 H GLY A 59 -20.919 -2.281 12.606 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -20.896 -4.383 13.263 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.940 -4.029 14.625 1.00 0.00 H new ATOM 873 N ASN A 60 -23.261 -4.020 11.591 1.00 0.00 N ATOM 874 CA ASN A 60 -24.380 -4.580 10.898 1.00 0.00 C ATOM 875 C ASN A 60 -23.913 -5.609 9.927 1.00 0.00 C ATOM 876 O ASN A 60 -24.730 -6.347 9.378 1.00 0.00 O ATOM 877 CB ASN A 60 -25.234 -3.518 10.185 1.00 0.00 C ATOM 878 CG ASN A 60 -24.474 -2.704 9.148 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.315 -2.879 8.777 1.00 0.00 O ATOM 880 ND2 ASN A 60 -25.310 -1.795 8.577 1.00 0.00 N ATOM 0 H ASN A 60 -22.748 -3.303 11.079 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.022 -5.045 11.647 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.076 -4.011 9.699 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -25.649 -2.840 10.931 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -24.983 -1.218 7.802 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -26.263 -1.690 8.924 1.00 0.00 H new ATOM 887 N GLY A 61 -22.618 -5.827 9.635 1.00 0.00 N ATOM 888 CA GLY A 61 -22.136 -6.859 8.772 1.00 0.00 C ATOM 889 C GLY A 61 -21.828 -6.362 7.402 1.00 0.00 C ATOM 890 O GLY A 61 -21.212 -7.036 6.577 1.00 0.00 O ATOM 0 H GLY A 61 -21.869 -5.253 10.022 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.238 -7.300 9.205 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.881 -7.652 8.708 1.00 0.00 H new ATOM 894 N THR A 62 -22.130 -5.091 7.082 1.00 0.00 N ATOM 895 CA THR A 62 -22.010 -4.652 5.726 1.00 0.00 C ATOM 896 C THR A 62 -21.307 -3.338 5.730 1.00 0.00 C ATOM 897 O THR A 62 -21.179 -2.675 6.758 1.00 0.00 O ATOM 898 CB THR A 62 -23.349 -4.344 5.125 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.043 -3.352 5.866 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.154 -5.651 5.222 1.00 0.00 C ATOM 0 H THR A 62 -22.449 -4.383 7.743 1.00 0.00 H new ATOM 0 HA THR A 62 -21.500 -5.439 5.171 1.00 0.00 H new ATOM 0 HB THR A 62 -23.226 -3.976 4.106 1.00 0.00 H new ATOM 0 HG1 THR A 62 -23.594 -3.211 6.725 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.147 -5.499 4.800 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.640 -6.437 4.668 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.246 -5.945 6.268 1.00 0.00 H new ATOM 908 N ILE A 63 -20.769 -2.938 4.564 1.00 0.00 N ATOM 909 CA ILE A 63 -20.125 -1.664 4.479 1.00 0.00 C ATOM 910 C ILE A 63 -21.120 -0.647 4.038 1.00 0.00 C ATOM 911 O ILE A 63 -21.609 -0.633 2.909 1.00 0.00 O ATOM 912 CB ILE A 63 -18.862 -1.586 3.673 1.00 0.00 C ATOM 913 CG1 ILE A 63 -17.862 -2.734 3.892 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.230 -0.189 3.782 1.00 0.00 C ATOM 915 CD1 ILE A 63 -16.784 -2.869 2.817 1.00 0.00 C ATOM 0 H ILE A 63 -20.778 -3.480 3.700 1.00 0.00 H new ATOM 0 HA ILE A 63 -19.765 -1.461 5.487 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.165 -1.738 2.637 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -17.375 -2.592 4.857 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -18.415 -3.671 3.949 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.316 -0.156 3.190 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -18.931 0.558 3.409 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -17.995 0.023 4.825 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.129 -3.705 3.061 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.255 -3.047 1.850 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.198 -1.951 2.772 1.00 0.00 H new ATOM 927 N ASP A 64 -21.423 0.297 4.946 1.00 0.00 N ATOM 928 CA ASP A 64 -22.203 1.477 4.734 1.00 0.00 C ATOM 929 C ASP A 64 -21.475 2.682 4.248 1.00 0.00 C ATOM 930 O ASP A 64 -20.247 2.623 4.220 1.00 0.00 O ATOM 931 CB ASP A 64 -22.930 1.965 5.999 1.00 0.00 C ATOM 932 CG ASP A 64 -23.686 0.808 6.637 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.029 -0.058 7.274 1.00 0.00 O ATOM 934 OD2 ASP A 64 -24.934 0.957 6.735 1.00 0.00 O ATOM 0 H ASP A 64 -21.094 0.228 5.909 1.00 0.00 H new ATOM 0 HA ASP A 64 -22.879 1.115 3.959 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.211 2.376 6.707 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -23.622 2.768 5.745 1.00 0.00 H new ATOM 939 N PHE A 65 -22.119 3.770 3.789 1.00 0.00 N ATOM 940 CA PHE A 65 -21.439 4.896 3.230 1.00 0.00 C ATOM 941 C PHE A 65 -20.495 5.630 4.120 1.00 0.00 C ATOM 942 O PHE A 65 -19.362 5.665 3.643 1.00 0.00 O ATOM 943 CB PHE A 65 -22.535 5.733 2.549 1.00 0.00 C ATOM 944 CG PHE A 65 -22.060 6.993 1.910 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.092 6.975 0.934 1.00 0.00 C ATOM 946 CD2 PHE A 65 -22.514 8.222 2.326 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.439 8.120 0.544 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.994 9.406 1.858 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.930 9.324 0.991 1.00 0.00 C ATOM 0 H PHE A 65 -23.134 3.869 3.807 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.698 4.564 2.502 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.021 5.119 1.790 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.294 5.983 3.291 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.838 6.038 0.462 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -23.313 8.259 3.051 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.568 8.075 -0.093 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -22.404 10.359 2.158 1.00 0.00 H new ATOM 0 HZ PHE A 65 -20.464 10.236 0.649 1.00 0.00 H new ATOM 959 N PRO A 66 -20.750 6.065 5.318 1.00 0.00 N ATOM 960 CA PRO A 66 -19.681 6.621 6.095 1.00 0.00 C ATOM 961 C PRO A 66 -18.477 5.808 6.426 1.00 0.00 C ATOM 962 O PRO A 66 -17.443 6.414 6.704 1.00 0.00 O ATOM 963 CB PRO A 66 -20.321 7.126 7.386 1.00 0.00 C ATOM 964 CG PRO A 66 -21.467 6.114 7.541 1.00 0.00 C ATOM 965 CD PRO A 66 -21.978 6.000 6.095 1.00 0.00 C ATOM 0 HA PRO A 66 -19.237 7.371 5.441 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -19.630 7.103 8.229 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.681 8.151 7.297 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.118 5.157 7.929 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.240 6.471 8.222 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.515 5.066 5.927 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.661 6.810 5.842 1.00 0.00 H new ATOM 973 N GLU A 67 -18.527 4.465 6.385 1.00 0.00 N ATOM 974 CA GLU A 67 -17.431 3.547 6.408 1.00 0.00 C ATOM 975 C GLU A 67 -16.646 3.413 5.148 1.00 0.00 C ATOM 976 O GLU A 67 -15.470 3.066 5.249 1.00 0.00 O ATOM 977 CB GLU A 67 -17.938 2.173 6.877 1.00 0.00 C ATOM 978 CG GLU A 67 -18.651 2.099 8.228 1.00 0.00 C ATOM 979 CD GLU A 67 -19.560 0.889 8.390 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.077 0.199 7.472 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.930 0.623 9.565 1.00 0.00 O ATOM 0 H GLU A 67 -19.421 3.978 6.331 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.714 3.976 7.108 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.620 1.790 6.117 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.085 1.495 6.911 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.903 2.086 9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.243 3.004 8.364 1.00 0.00 H new ATOM 988 N PHE A 68 -17.242 3.658 3.968 1.00 0.00 N ATOM 989 CA PHE A 68 -16.526 3.529 2.736 1.00 0.00 C ATOM 990 C PHE A 68 -15.716 4.767 2.559 1.00 0.00 C ATOM 991 O PHE A 68 -14.667 4.808 1.917 1.00 0.00 O ATOM 992 CB PHE A 68 -17.470 3.377 1.531 1.00 0.00 C ATOM 993 CG PHE A 68 -16.695 2.771 0.412 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.199 1.493 0.511 1.00 0.00 C ATOM 995 CD2 PHE A 68 -16.399 3.559 -0.676 1.00 0.00 C ATOM 996 CE1 PHE A 68 -15.387 0.955 -0.460 1.00 0.00 C ATOM 997 CE2 PHE A 68 -15.536 3.059 -1.622 1.00 0.00 C ATOM 998 CZ PHE A 68 -15.075 1.767 -1.524 1.00 0.00 C ATOM 0 H PHE A 68 -18.216 3.944 3.866 1.00 0.00 H new ATOM 0 HA PHE A 68 -15.905 2.634 2.781 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.321 2.747 1.791 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -17.870 4.347 1.236 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.454 0.896 1.374 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -16.832 4.542 -0.784 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.013 -0.056 -0.390 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.219 3.683 -2.445 1.00 0.00 H new ATOM 0 HZ PHE A 68 -14.446 1.377 -2.310 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.207 5.913 3.064 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.410 7.079 3.283 1.00 0.00 C ATOM 1010 C LEU A 69 -14.220 6.841 4.147 1.00 0.00 C ATOM 1011 O LEU A 69 -13.149 7.285 3.737 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.210 8.223 3.930 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.422 8.762 3.152 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.244 9.854 3.859 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -17.015 9.330 1.782 1.00 0.00 C ATOM 0 H LEU A 69 -17.185 6.031 3.327 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.080 7.353 2.281 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.559 7.882 4.905 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.527 9.054 4.109 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.052 7.877 3.061 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.072 10.158 3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.636 9.464 4.798 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.607 10.715 4.062 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.900 9.700 1.264 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.308 10.148 1.923 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.548 8.545 1.187 1.00 0.00 H new ATOM 1027 N THR A 70 -14.353 6.128 5.280 1.00 0.00 N ATOM 1028 CA THR A 70 -13.261 5.667 6.079 1.00 0.00 C ATOM 1029 C THR A 70 -12.291 4.788 5.366 1.00 0.00 C ATOM 1030 O THR A 70 -11.085 5.022 5.422 1.00 0.00 O ATOM 1031 CB THR A 70 -13.794 4.984 7.304 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.373 5.982 8.131 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.668 4.351 8.139 1.00 0.00 C ATOM 0 H THR A 70 -15.263 5.861 5.655 1.00 0.00 H new ATOM 0 HA THR A 70 -12.687 6.553 6.350 1.00 0.00 H new ATOM 0 HB THR A 70 -14.495 4.213 6.985 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.733 5.566 8.942 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.095 3.866 9.017 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.140 3.611 7.537 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.970 5.126 8.456 1.00 0.00 H new ATOM 1041 N MET A 71 -12.720 3.798 4.562 1.00 0.00 N ATOM 1042 CA MET A 71 -11.902 2.969 3.732 1.00 0.00 C ATOM 1043 C MET A 71 -11.157 3.808 2.752 1.00 0.00 C ATOM 1044 O MET A 71 -9.966 3.605 2.522 1.00 0.00 O ATOM 1045 CB MET A 71 -12.687 1.888 2.969 1.00 0.00 C ATOM 1046 CG MET A 71 -11.857 0.677 2.538 1.00 0.00 C ATOM 1047 SD MET A 71 -12.872 -0.764 2.093 1.00 0.00 S ATOM 1048 CE MET A 71 -12.662 -1.666 3.655 1.00 0.00 C ATOM 0 H MET A 71 -13.709 3.561 4.488 1.00 0.00 H new ATOM 0 HA MET A 71 -11.218 2.452 4.405 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.508 1.543 3.598 1.00 0.00 H new ATOM 0 HB3 MET A 71 -13.132 2.340 2.083 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.237 0.954 1.685 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.181 0.401 3.347 1.00 0.00 H new ATOM 0 HE1 MET A 71 -13.440 -2.424 3.745 1.00 0.00 H new ATOM 0 HE2 MET A 71 -11.684 -2.146 3.669 1.00 0.00 H new ATOM 0 HE3 MET A 71 -12.736 -0.970 4.490 1.00 0.00 H new ATOM 1058 N MET A 72 -11.793 4.801 2.105 1.00 0.00 N ATOM 1059 CA MET A 72 -11.217 5.613 1.079 1.00 0.00 C ATOM 1060 C MET A 72 -10.351 6.702 1.612 1.00 0.00 C ATOM 1061 O MET A 72 -9.369 7.028 0.947 1.00 0.00 O ATOM 1062 CB MET A 72 -12.276 6.316 0.214 1.00 0.00 C ATOM 1063 CG MET A 72 -12.946 5.383 -0.797 1.00 0.00 C ATOM 1064 SD MET A 72 -11.844 4.288 -1.742 1.00 0.00 S ATOM 1065 CE MET A 72 -10.912 5.651 -2.496 1.00 0.00 C ATOM 0 H MET A 72 -12.761 5.050 2.309 1.00 0.00 H new ATOM 0 HA MET A 72 -10.633 4.904 0.492 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.039 6.746 0.863 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.809 7.144 -0.320 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.668 4.764 -0.264 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.509 5.993 -1.503 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.331 5.273 -3.337 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.605 6.415 -2.848 1.00 0.00 H new ATOM 0 HE3 MET A 72 -10.239 6.085 -1.756 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.536 7.189 2.852 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.678 8.207 3.373 1.00 0.00 C ATOM 1077 C ALA A 73 -8.308 7.738 3.727 1.00 0.00 C ATOM 1078 O ALA A 73 -7.321 8.471 3.759 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.367 8.938 4.538 1.00 0.00 C ATOM 0 H ALA A 73 -11.272 6.882 3.488 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.512 8.916 2.562 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.703 9.711 4.926 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.290 9.397 4.184 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.596 8.225 5.330 1.00 0.00 H new ATOM 1234 N GLU A 83 3.034 1.080 3.919 1.00 0.00 N ATOM 1235 CA GLU A 83 4.166 1.794 3.414 1.00 0.00 C ATOM 1236 C GLU A 83 5.446 1.242 3.940 1.00 0.00 C ATOM 1237 O GLU A 83 6.502 1.312 3.312 1.00 0.00 O ATOM 1238 CB GLU A 83 4.151 3.247 3.915 1.00 0.00 C ATOM 1239 CG GLU A 83 3.180 4.131 3.129 1.00 0.00 C ATOM 1240 CD GLU A 83 3.895 4.730 1.926 1.00 0.00 C ATOM 1241 OE1 GLU A 83 5.015 5.293 2.055 1.00 0.00 O ATOM 1242 OE2 GLU A 83 3.387 4.706 0.773 1.00 0.00 O ATOM 0 HA GLU A 83 4.105 1.714 2.329 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.876 3.261 4.970 1.00 0.00 H new ATOM 0 HB3 GLU A 83 5.156 3.663 3.842 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.323 3.544 2.800 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.796 4.925 3.769 1.00 0.00 H new ATOM 1249 N GLU A 84 5.394 0.437 5.016 1.00 0.00 N ATOM 1250 CA GLU A 84 6.433 -0.475 5.382 1.00 0.00 C ATOM 1251 C GLU A 84 6.594 -1.564 4.379 1.00 0.00 C ATOM 1252 O GLU A 84 7.704 -1.632 3.853 1.00 0.00 O ATOM 1253 CB GLU A 84 6.165 -1.094 6.764 1.00 0.00 C ATOM 1254 CG GLU A 84 7.356 -1.688 7.518 1.00 0.00 C ATOM 1255 CD GLU A 84 6.895 -2.444 8.757 1.00 0.00 C ATOM 1256 OE1 GLU A 84 6.345 -1.851 9.723 1.00 0.00 O ATOM 1257 OE2 GLU A 84 7.015 -3.698 8.741 1.00 0.00 O ATOM 0 H GLU A 84 4.599 0.420 5.655 1.00 0.00 H new ATOM 0 HA GLU A 84 7.356 0.103 5.418 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.717 -0.326 7.395 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.420 -1.880 6.641 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.908 -2.361 6.861 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.042 -0.892 7.808 1.00 0.00 H new ATOM 1264 N ILE A 85 5.549 -2.334 4.026 1.00 0.00 N ATOM 1265 CA ILE A 85 5.615 -3.248 2.928 1.00 0.00 C ATOM 1266 C ILE A 85 5.867 -2.726 1.555 1.00 0.00 C ATOM 1267 O ILE A 85 6.423 -3.427 0.711 1.00 0.00 O ATOM 1268 CB ILE A 85 4.544 -4.298 2.914 1.00 0.00 C ATOM 1269 CG1 ILE A 85 3.155 -3.855 2.425 1.00 0.00 C ATOM 1270 CG2 ILE A 85 4.528 -4.788 4.372 1.00 0.00 C ATOM 1271 CD1 ILE A 85 2.011 -4.762 2.873 1.00 0.00 C ATOM 0 H ILE A 85 4.649 -2.323 4.507 1.00 0.00 H new ATOM 0 HA ILE A 85 6.565 -3.713 3.190 1.00 0.00 H new ATOM 0 HB ILE A 85 4.774 -5.069 2.178 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.962 -2.844 2.783 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.163 -3.812 1.336 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.774 -5.567 4.486 1.00 0.00 H new ATOM 0 HG22 ILE A 85 5.507 -5.190 4.632 1.00 0.00 H new ATOM 0 HG23 ILE A 85 4.291 -3.955 5.033 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.068 -4.377 2.485 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.176 -5.770 2.493 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.972 -4.787 3.962 1.00 0.00 H new ATOM 1283 N ARG A 86 5.530 -1.453 1.283 1.00 0.00 N ATOM 1284 CA ARG A 86 5.770 -0.864 0.002 1.00 0.00 C ATOM 1285 C ARG A 86 7.233 -0.629 -0.159 1.00 0.00 C ATOM 1286 O ARG A 86 7.774 -1.097 -1.159 1.00 0.00 O ATOM 1287 CB ARG A 86 5.002 0.464 -0.101 1.00 0.00 C ATOM 1288 CG ARG A 86 5.125 1.109 -1.483 1.00 0.00 C ATOM 1289 CD ARG A 86 4.421 2.452 -1.279 1.00 0.00 C ATOM 1290 NE ARG A 86 4.036 2.945 -2.632 1.00 0.00 N ATOM 1291 CZ ARG A 86 3.269 4.053 -2.849 1.00 0.00 C ATOM 1292 NH1 ARG A 86 2.832 4.901 -1.873 1.00 0.00 N ATOM 1293 NH2 ARG A 86 2.920 4.408 -4.120 1.00 0.00 N ATOM 0 H ARG A 86 5.088 -0.827 1.956 1.00 0.00 H new ATOM 0 HA ARG A 86 5.426 -1.532 -0.788 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.949 0.289 0.122 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.377 1.156 0.653 1.00 0.00 H new ATOM 0 HG2 ARG A 86 6.166 1.236 -1.781 1.00 0.00 H new ATOM 0 HG3 ARG A 86 4.643 0.510 -2.256 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.542 2.336 -0.645 1.00 0.00 H new ATOM 0 HD3 ARG A 86 5.081 3.163 -0.782 1.00 0.00 H new ATOM 0 HE ARG A 86 4.365 2.423 -3.444 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.077 4.726 -0.898 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.261 5.710 -2.118 1.00 0.00 H new ATOM 0 HH21 ARG A 86 3.232 3.845 -4.911 1.00 0.00 H new ATOM 0 HH22 ARG A 86 2.347 5.237 -4.279 1.00 0.00 H new ATOM 1307 N GLU A 87 7.965 -0.070 0.822 1.00 0.00 N ATOM 1308 CA GLU A 87 9.375 0.096 0.657 1.00 0.00 C ATOM 1309 C GLU A 87 10.154 -1.167 0.793 1.00 0.00 C ATOM 1310 O GLU A 87 11.145 -1.442 0.118 1.00 0.00 O ATOM 1311 CB GLU A 87 9.920 1.095 1.691 1.00 0.00 C ATOM 1312 CG GLU A 87 11.396 1.478 1.564 1.00 0.00 C ATOM 1313 CD GLU A 87 11.653 2.346 0.341 1.00 0.00 C ATOM 1314 OE1 GLU A 87 10.965 3.364 0.062 1.00 0.00 O ATOM 1315 OE2 GLU A 87 12.614 1.995 -0.395 1.00 0.00 O ATOM 0 H GLU A 87 7.590 0.261 1.711 1.00 0.00 H new ATOM 0 HA GLU A 87 9.502 0.460 -0.363 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.325 2.006 1.630 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.761 0.677 2.685 1.00 0.00 H new ATOM 0 HG2 GLU A 87 11.711 2.012 2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 87 12.002 0.574 1.502 1.00 0.00 H new ATOM 1322 N ALA A 88 9.606 -2.096 1.597 1.00 0.00 N ATOM 1323 CA ALA A 88 10.079 -3.432 1.790 1.00 0.00 C ATOM 1324 C ALA A 88 10.084 -4.329 0.600 1.00 0.00 C ATOM 1325 O ALA A 88 10.984 -5.141 0.390 1.00 0.00 O ATOM 1326 CB ALA A 88 9.311 -4.154 2.910 1.00 0.00 C ATOM 0 H ALA A 88 8.773 -1.898 2.151 1.00 0.00 H new ATOM 0 HA ALA A 88 11.123 -3.259 2.049 1.00 0.00 H new ATOM 0 HB1 ALA A 88 9.701 -5.165 3.025 1.00 0.00 H new ATOM 0 HB2 ALA A 88 9.435 -3.609 3.846 1.00 0.00 H new ATOM 0 HB3 ALA A 88 8.252 -4.200 2.654 1.00 0.00 H new ATOM 1332 N PHE A 89 9.179 -4.129 -0.373 1.00 0.00 N ATOM 1333 CA PHE A 89 9.127 -4.792 -1.639 1.00 0.00 C ATOM 1334 C PHE A 89 10.388 -4.626 -2.416 1.00 0.00 C ATOM 1335 O PHE A 89 10.915 -5.579 -2.988 1.00 0.00 O ATOM 1336 CB PHE A 89 7.860 -4.211 -2.289 1.00 0.00 C ATOM 1337 CG PHE A 89 7.658 -4.839 -3.625 1.00 0.00 C ATOM 1338 CD1 PHE A 89 7.281 -6.161 -3.653 1.00 0.00 C ATOM 1339 CD2 PHE A 89 7.584 -4.068 -4.761 1.00 0.00 C ATOM 1340 CE1 PHE A 89 6.821 -6.763 -4.800 1.00 0.00 C ATOM 1341 CE2 PHE A 89 7.266 -4.690 -5.945 1.00 0.00 C ATOM 1342 CZ PHE A 89 6.903 -6.016 -5.952 1.00 0.00 C ATOM 0 H PHE A 89 8.425 -3.451 -0.265 1.00 0.00 H new ATOM 0 HA PHE A 89 9.060 -5.878 -1.572 1.00 0.00 H new ATOM 0 HB2 PHE A 89 6.994 -4.396 -1.653 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.954 -3.130 -2.393 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.348 -6.744 -2.746 1.00 0.00 H new ATOM 0 HD2 PHE A 89 7.770 -3.005 -4.724 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.418 -7.765 -4.797 1.00 0.00 H new ATOM 0 HE2 PHE A 89 7.301 -4.136 -6.871 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.674 -6.488 -6.896 1.00 0.00 H new ATOM 1352 N ARG A 90 10.851 -3.369 -2.540 1.00 0.00 N ATOM 1353 CA ARG A 90 11.990 -3.003 -3.323 1.00 0.00 C ATOM 1354 C ARG A 90 13.245 -3.311 -2.583 1.00 0.00 C ATOM 1355 O ARG A 90 14.355 -3.380 -3.108 1.00 0.00 O ATOM 1356 CB ARG A 90 11.852 -1.564 -3.849 1.00 0.00 C ATOM 1357 CG ARG A 90 13.058 -1.130 -4.684 1.00 0.00 C ATOM 1358 CD ARG A 90 12.823 0.261 -5.276 1.00 0.00 C ATOM 1359 NE ARG A 90 12.857 1.264 -4.175 1.00 0.00 N ATOM 1360 CZ ARG A 90 12.048 2.345 -3.974 1.00 0.00 C ATOM 1361 NH1 ARG A 90 11.201 2.706 -4.983 1.00 0.00 N ATOM 1362 NH2 ARG A 90 12.064 3.051 -2.806 1.00 0.00 N ATOM 0 H ARG A 90 10.413 -2.574 -2.075 1.00 0.00 H new ATOM 0 HA ARG A 90 12.046 -3.611 -4.226 1.00 0.00 H new ATOM 0 HB2 ARG A 90 10.948 -1.486 -4.453 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.732 -0.882 -3.007 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.954 -1.122 -4.063 1.00 0.00 H new ATOM 0 HG3 ARG A 90 13.232 -1.849 -5.485 1.00 0.00 H new ATOM 0 HD2 ARG A 90 13.588 0.489 -6.018 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.862 0.296 -5.788 1.00 0.00 H new ATOM 0 HE ARG A 90 13.585 1.124 -3.475 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.187 2.173 -5.852 1.00 0.00 H new ATOM 0 HH12 ARG A 90 10.582 3.509 -4.867 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.693 2.775 -2.052 1.00 0.00 H new ATOM 0 HH22 ARG A 90 11.447 3.854 -2.687 1.00 0.00 H new ATOM 1376 N VAL A 91 13.179 -3.514 -1.255 1.00 0.00 N ATOM 1377 CA VAL A 91 14.178 -3.992 -0.350 1.00 0.00 C ATOM 1378 C VAL A 91 14.401 -5.440 -0.618 1.00 0.00 C ATOM 1379 O VAL A 91 15.550 -5.875 -0.681 1.00 0.00 O ATOM 1380 CB VAL A 91 13.978 -3.730 1.114 1.00 0.00 C ATOM 1381 CG1 VAL A 91 14.925 -4.572 1.986 1.00 0.00 C ATOM 1382 CG2 VAL A 91 14.186 -2.228 1.371 1.00 0.00 C ATOM 0 H VAL A 91 12.311 -3.316 -0.756 1.00 0.00 H new ATOM 0 HA VAL A 91 15.062 -3.391 -0.561 1.00 0.00 H new ATOM 0 HB VAL A 91 12.965 -4.022 1.391 1.00 0.00 H new ATOM 0 HG11 VAL A 91 14.745 -4.350 3.038 1.00 0.00 H new ATOM 0 HG12 VAL A 91 14.743 -5.631 1.803 1.00 0.00 H new ATOM 0 HG13 VAL A 91 15.959 -4.333 1.736 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.045 -2.017 2.431 1.00 0.00 H new ATOM 0 HG22 VAL A 91 15.197 -1.945 1.076 1.00 0.00 H new ATOM 0 HG23 VAL A 91 13.464 -1.656 0.788 1.00 0.00 H new ATOM 1392 N PHE A 92 13.337 -6.251 -0.754 1.00 0.00 N ATOM 1393 CA PHE A 92 13.293 -7.677 -0.855 1.00 0.00 C ATOM 1394 C PHE A 92 13.770 -8.089 -2.206 1.00 0.00 C ATOM 1395 O PHE A 92 14.296 -9.188 -2.371 1.00 0.00 O ATOM 1396 CB PHE A 92 11.850 -8.208 -0.823 1.00 0.00 C ATOM 1397 CG PHE A 92 11.406 -8.482 0.573 1.00 0.00 C ATOM 1398 CD1 PHE A 92 11.823 -7.729 1.645 1.00 0.00 C ATOM 1399 CD2 PHE A 92 10.510 -9.498 0.809 1.00 0.00 C ATOM 1400 CE1 PHE A 92 11.489 -8.089 2.930 1.00 0.00 C ATOM 1401 CE2 PHE A 92 10.138 -9.800 2.098 1.00 0.00 C ATOM 1402 CZ PHE A 92 10.683 -9.171 3.192 1.00 0.00 C ATOM 0 H PHE A 92 12.397 -5.856 -0.798 1.00 0.00 H new ATOM 0 HA PHE A 92 13.890 -8.059 -0.027 1.00 0.00 H new ATOM 0 HB2 PHE A 92 11.182 -7.480 -1.283 1.00 0.00 H new ATOM 0 HB3 PHE A 92 11.783 -9.121 -1.414 1.00 0.00 H new ATOM 0 HD1 PHE A 92 12.420 -6.845 1.476 1.00 0.00 H new ATOM 0 HD2 PHE A 92 10.099 -10.058 -0.017 1.00 0.00 H new ATOM 0 HE1 PHE A 92 11.870 -7.506 3.755 1.00 0.00 H new ATOM 0 HE2 PHE A 92 9.388 -10.561 2.257 1.00 0.00 H new ATOM 0 HZ PHE A 92 10.489 -9.508 4.200 1.00 0.00 H new ATOM 1412 N ASP A 93 13.524 -7.307 -3.272 1.00 0.00 N ATOM 1413 CA ASP A 93 14.218 -7.573 -4.494 1.00 0.00 C ATOM 1414 C ASP A 93 15.580 -6.977 -4.408 1.00 0.00 C ATOM 1415 O ASP A 93 15.643 -5.849 -3.921 1.00 0.00 O ATOM 1416 CB ASP A 93 13.487 -7.044 -5.740 1.00 0.00 C ATOM 1417 CG ASP A 93 13.911 -7.773 -7.007 1.00 0.00 C ATOM 1418 OD1 ASP A 93 14.593 -8.827 -6.898 1.00 0.00 O ATOM 1419 OD2 ASP A 93 13.505 -7.369 -8.129 1.00 0.00 O ATOM 0 H ASP A 93 12.873 -6.522 -3.293 1.00 0.00 H new ATOM 0 HA ASP A 93 14.271 -8.655 -4.613 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.411 -7.154 -5.602 1.00 0.00 H new ATOM 0 HB3 ASP A 93 13.687 -5.978 -5.852 1.00 0.00 H new ATOM 1424 N LYS A 94 16.700 -7.614 -4.795 1.00 0.00 N ATOM 1425 CA LYS A 94 18.029 -7.128 -4.589 1.00 0.00 C ATOM 1426 C LYS A 94 18.334 -6.195 -5.709 1.00 0.00 C ATOM 1427 O LYS A 94 18.672 -5.033 -5.487 1.00 0.00 O ATOM 1428 CB LYS A 94 19.116 -8.212 -4.492 1.00 0.00 C ATOM 1429 CG LYS A 94 20.510 -7.617 -4.282 1.00 0.00 C ATOM 1430 CD LYS A 94 21.585 -8.639 -3.908 1.00 0.00 C ATOM 1431 CE LYS A 94 21.331 -9.306 -2.555 1.00 0.00 C ATOM 1432 NZ LYS A 94 22.249 -10.446 -2.340 1.00 0.00 N ATOM 0 H LYS A 94 16.677 -8.513 -5.276 1.00 0.00 H new ATOM 0 HA LYS A 94 18.050 -6.639 -3.615 1.00 0.00 H new ATOM 0 HB2 LYS A 94 18.882 -8.885 -3.667 1.00 0.00 H new ATOM 0 HB3 LYS A 94 19.112 -8.810 -5.403 1.00 0.00 H new ATOM 0 HG2 LYS A 94 20.814 -7.106 -5.195 1.00 0.00 H new ATOM 0 HG3 LYS A 94 20.455 -6.862 -3.497 1.00 0.00 H new ATOM 0 HD2 LYS A 94 21.634 -9.406 -4.681 1.00 0.00 H new ATOM 0 HD3 LYS A 94 22.556 -8.145 -3.887 1.00 0.00 H new ATOM 0 HE2 LYS A 94 21.461 -8.576 -1.756 1.00 0.00 H new ATOM 0 HE3 LYS A 94 20.299 -9.653 -2.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 22.054 -10.879 -1.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 22.107 -11.152 -3.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 23.233 -10.109 -2.364 1.00 0.00 H new ATOM 1446 N ASP A 95 18.210 -6.676 -6.959 1.00 0.00 N ATOM 1447 CA ASP A 95 18.467 -5.966 -8.173 1.00 0.00 C ATOM 1448 C ASP A 95 17.525 -4.837 -8.415 1.00 0.00 C ATOM 1449 O ASP A 95 17.908 -3.668 -8.415 1.00 0.00 O ATOM 1450 CB ASP A 95 18.459 -7.132 -9.175 1.00 0.00 C ATOM 1451 CG ASP A 95 17.224 -8.020 -9.235 1.00 0.00 C ATOM 1452 OD1 ASP A 95 16.191 -7.559 -9.790 1.00 0.00 O ATOM 1453 OD2 ASP A 95 17.264 -9.167 -8.714 1.00 0.00 O ATOM 0 H ASP A 95 17.907 -7.634 -7.132 1.00 0.00 H new ATOM 0 HA ASP A 95 19.397 -5.400 -8.213 1.00 0.00 H new ATOM 0 HB2 ASP A 95 18.619 -6.717 -10.170 1.00 0.00 H new ATOM 0 HB3 ASP A 95 19.316 -7.768 -8.953 1.00 0.00 H new ATOM 1458 N GLY A 96 16.236 -5.159 -8.628 1.00 0.00 N ATOM 1459 CA GLY A 96 15.187 -4.187 -8.665 1.00 0.00 C ATOM 1460 C GLY A 96 14.628 -3.979 -10.031 1.00 0.00 C ATOM 1461 O GLY A 96 14.768 -2.907 -10.616 1.00 0.00 O ATOM 0 H GLY A 96 15.916 -6.116 -8.778 1.00 0.00 H new ATOM 0 HA2 GLY A 96 14.386 -4.500 -7.995 1.00 0.00 H new ATOM 0 HA3 GLY A 96 15.566 -3.238 -8.286 1.00 0.00 H new ATOM 1465 N ASN A 97 13.894 -4.995 -10.520 1.00 0.00 N ATOM 1466 CA ASN A 97 13.364 -4.945 -11.847 1.00 0.00 C ATOM 1467 C ASN A 97 11.947 -4.495 -11.937 1.00 0.00 C ATOM 1468 O ASN A 97 11.607 -3.953 -12.987 1.00 0.00 O ATOM 1469 CB ASN A 97 13.624 -6.257 -12.607 1.00 0.00 C ATOM 1470 CG ASN A 97 13.050 -7.540 -12.022 1.00 0.00 C ATOM 1471 OD1 ASN A 97 13.591 -8.066 -11.051 1.00 0.00 O ATOM 1472 ND2 ASN A 97 11.904 -8.006 -12.588 1.00 0.00 N ATOM 0 H ASN A 97 13.669 -5.844 -10.002 1.00 0.00 H new ATOM 0 HA ASN A 97 13.920 -4.154 -12.351 1.00 0.00 H new ATOM 0 HB2 ASN A 97 13.230 -6.143 -13.617 1.00 0.00 H new ATOM 0 HB3 ASN A 97 14.703 -6.383 -12.698 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.447 -8.835 -12.207 1.00 0.00 H new ATOM 0 HD22 ASN A 97 11.501 -7.527 -13.393 1.00 0.00 H new ATOM 1479 N GLY A 98 11.080 -4.653 -10.920 1.00 0.00 N ATOM 1480 CA GLY A 98 9.716 -4.230 -10.857 1.00 0.00 C ATOM 1481 C GLY A 98 8.827 -5.253 -10.238 1.00 0.00 C ATOM 1482 O GLY A 98 7.769 -4.927 -9.701 1.00 0.00 O ATOM 0 H GLY A 98 11.365 -5.123 -10.060 1.00 0.00 H new ATOM 0 HA2 GLY A 98 9.653 -3.305 -10.285 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.362 -4.007 -11.863 1.00 0.00 H new ATOM 1486 N TYR A 99 9.280 -6.518 -10.280 1.00 0.00 N ATOM 1487 CA TYR A 99 8.668 -7.637 -9.633 1.00 0.00 C ATOM 1488 C TYR A 99 9.703 -8.384 -8.865 1.00 0.00 C ATOM 1489 O TYR A 99 10.907 -8.283 -9.093 1.00 0.00 O ATOM 1490 CB TYR A 99 8.199 -8.657 -10.684 1.00 0.00 C ATOM 1491 CG TYR A 99 7.408 -7.987 -11.755 1.00 0.00 C ATOM 1492 CD1 TYR A 99 6.208 -7.438 -11.368 1.00 0.00 C ATOM 1493 CD2 TYR A 99 7.880 -7.820 -13.035 1.00 0.00 C ATOM 1494 CE1 TYR A 99 5.392 -6.937 -12.354 1.00 0.00 C ATOM 1495 CE2 TYR A 99 7.076 -7.208 -13.967 1.00 0.00 C ATOM 1496 CZ TYR A 99 5.826 -6.735 -13.643 1.00 0.00 C ATOM 1497 OH TYR A 99 5.042 -6.050 -14.595 1.00 0.00 O ATOM 0 H TYR A 99 10.122 -6.774 -10.795 1.00 0.00 H new ATOM 0 HA TYR A 99 7.854 -7.257 -9.016 1.00 0.00 H new ATOM 0 HB2 TYR A 99 9.062 -9.158 -11.122 1.00 0.00 H new ATOM 0 HB3 TYR A 99 7.593 -9.427 -10.206 1.00 0.00 H new ATOM 0 HD1 TYR A 99 5.918 -7.402 -10.328 1.00 0.00 H new ATOM 0 HD2 TYR A 99 8.868 -8.164 -13.304 1.00 0.00 H new ATOM 0 HE1 TYR A 99 4.370 -6.692 -12.107 1.00 0.00 H new ATOM 0 HE2 TYR A 99 7.435 -7.096 -14.979 1.00 0.00 H new ATOM 0 HH TYR A 99 5.524 -6.010 -15.447 1.00 0.00 H new ATOM 1507 N ILE A 100 9.220 -9.195 -7.907 1.00 0.00 N ATOM 1508 CA ILE A 100 10.087 -10.201 -7.376 1.00 0.00 C ATOM 1509 C ILE A 100 9.850 -11.540 -7.987 1.00 0.00 C ATOM 1510 O ILE A 100 8.709 -11.777 -8.382 1.00 0.00 O ATOM 1511 CB ILE A 100 9.943 -10.305 -5.887 1.00 0.00 C ATOM 1512 CG1 ILE A 100 9.350 -9.038 -5.248 1.00 0.00 C ATOM 1513 CG2 ILE A 100 11.369 -10.505 -5.346 1.00 0.00 C ATOM 1514 CD1 ILE A 100 9.466 -9.198 -3.732 1.00 0.00 C ATOM 0 H ILE A 100 8.279 -9.161 -7.516 1.00 0.00 H new ATOM 0 HA ILE A 100 11.101 -9.890 -7.626 1.00 0.00 H new ATOM 0 HB ILE A 100 9.262 -11.121 -5.646 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.887 -8.151 -5.583 1.00 0.00 H new ATOM 0 HG13 ILE A 100 8.308 -8.910 -5.543 1.00 0.00 H new ATOM 0 HG21 ILE A 100 11.338 -10.589 -4.260 1.00 0.00 H new ATOM 0 HG22 ILE A 100 11.794 -11.416 -5.768 1.00 0.00 H new ATOM 0 HG23 ILE A 100 11.987 -9.652 -5.626 1.00 0.00 H new ATOM 0 HD11 ILE A 100 9.055 -8.316 -3.241 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.912 -10.082 -3.416 1.00 0.00 H new ATOM 0 HD13 ILE A 100 10.515 -9.310 -3.457 1.00 0.00 H new ATOM 1526 N SER A 101 10.833 -12.456 -8.028 1.00 0.00 N ATOM 1527 CA SER A 101 10.545 -13.827 -8.315 1.00 0.00 C ATOM 1528 C SER A 101 10.204 -14.417 -6.990 1.00 0.00 C ATOM 1529 O SER A 101 10.782 -14.090 -5.954 1.00 0.00 O ATOM 1530 CB SER A 101 11.687 -14.645 -8.942 1.00 0.00 C ATOM 1531 OG SER A 101 11.348 -16.020 -9.049 1.00 0.00 O ATOM 0 H SER A 101 11.819 -12.251 -7.864 1.00 0.00 H new ATOM 0 HA SER A 101 9.757 -13.861 -9.067 1.00 0.00 H new ATOM 0 HB2 SER A 101 11.919 -14.249 -9.931 1.00 0.00 H new ATOM 0 HB3 SER A 101 12.587 -14.538 -8.337 1.00 0.00 H new ATOM 0 HG SER A 101 12.094 -16.510 -9.453 1.00 0.00 H new ATOM 1537 N ALA A 102 9.261 -15.376 -6.998 1.00 0.00 N ATOM 1538 CA ALA A 102 8.953 -16.082 -5.793 1.00 0.00 C ATOM 1539 C ALA A 102 10.038 -16.970 -5.290 1.00 0.00 C ATOM 1540 O ALA A 102 10.098 -17.374 -4.130 1.00 0.00 O ATOM 1541 CB ALA A 102 7.722 -16.925 -6.167 1.00 0.00 C ATOM 0 H ALA A 102 8.723 -15.658 -7.817 1.00 0.00 H new ATOM 0 HA ALA A 102 8.797 -15.374 -4.979 1.00 0.00 H new ATOM 0 HB1 ALA A 102 7.405 -17.509 -5.303 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.911 -16.267 -6.478 1.00 0.00 H new ATOM 0 HB3 ALA A 102 7.977 -17.598 -6.986 1.00 0.00 H new ATOM 1547 N ALA A 103 11.110 -17.105 -6.091 1.00 0.00 N ATOM 1548 CA ALA A 103 12.372 -17.651 -5.698 1.00 0.00 C ATOM 1549 C ALA A 103 13.198 -16.697 -4.905 1.00 0.00 C ATOM 1550 O ALA A 103 13.796 -17.005 -3.875 1.00 0.00 O ATOM 1551 CB ALA A 103 13.086 -18.213 -6.939 1.00 0.00 C ATOM 0 H ALA A 103 11.094 -16.816 -7.069 1.00 0.00 H new ATOM 0 HA ALA A 103 12.201 -18.476 -5.007 1.00 0.00 H new ATOM 0 HB1 ALA A 103 14.049 -18.631 -6.646 1.00 0.00 H new ATOM 0 HB2 ALA A 103 12.473 -18.994 -7.389 1.00 0.00 H new ATOM 0 HB3 ALA A 103 13.242 -17.413 -7.662 1.00 0.00 H new ATOM 1557 N GLU A 104 13.283 -15.430 -5.349 1.00 0.00 N ATOM 1558 CA GLU A 104 14.032 -14.489 -4.575 1.00 0.00 C ATOM 1559 C GLU A 104 13.343 -14.089 -3.316 1.00 0.00 C ATOM 1560 O GLU A 104 14.026 -13.924 -2.307 1.00 0.00 O ATOM 1561 CB GLU A 104 14.204 -13.219 -5.424 1.00 0.00 C ATOM 1562 CG GLU A 104 14.798 -13.436 -6.817 1.00 0.00 C ATOM 1563 CD GLU A 104 14.686 -12.168 -7.651 1.00 0.00 C ATOM 1564 OE1 GLU A 104 13.595 -11.568 -7.841 1.00 0.00 O ATOM 1565 OE2 GLU A 104 15.717 -11.551 -8.031 1.00 0.00 O ATOM 0 H GLU A 104 12.856 -15.069 -6.202 1.00 0.00 H new ATOM 0 HA GLU A 104 14.977 -14.961 -4.306 1.00 0.00 H new ATOM 0 HB2 GLU A 104 13.231 -12.741 -5.533 1.00 0.00 H new ATOM 0 HB3 GLU A 104 14.842 -12.522 -4.880 1.00 0.00 H new ATOM 0 HG2 GLU A 104 15.844 -13.729 -6.730 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.278 -14.253 -7.317 1.00 0.00 H new ATOM 1572 N LEU A 105 12.012 -13.899 -3.339 1.00 0.00 N ATOM 1573 CA LEU A 105 11.161 -13.603 -2.228 1.00 0.00 C ATOM 1574 C LEU A 105 11.335 -14.614 -1.148 1.00 0.00 C ATOM 1575 O LEU A 105 11.496 -14.168 -0.013 1.00 0.00 O ATOM 1576 CB LEU A 105 9.710 -13.423 -2.705 1.00 0.00 C ATOM 1577 CG LEU A 105 8.580 -13.664 -1.690 1.00 0.00 C ATOM 1578 CD1 LEU A 105 7.471 -12.633 -1.961 1.00 0.00 C ATOM 1579 CD2 LEU A 105 8.014 -15.092 -1.623 1.00 0.00 C ATOM 0 H LEU A 105 11.487 -13.958 -4.212 1.00 0.00 H new ATOM 0 HA LEU A 105 11.448 -12.652 -1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 105 9.607 -12.406 -3.084 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.550 -14.095 -3.548 1.00 0.00 H new ATOM 0 HG LEU A 105 9.022 -13.537 -0.702 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.655 -12.782 -1.254 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.873 -11.627 -1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 105 7.097 -12.759 -2.977 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.225 -15.136 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.605 -15.367 -2.595 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.810 -15.787 -1.354 1.00 0.00 H new ATOM 1591 N ARG A 106 11.432 -15.938 -1.367 1.00 0.00 N ATOM 1592 CA ARG A 106 11.535 -16.911 -0.325 1.00 0.00 C ATOM 1593 C ARG A 106 12.924 -16.997 0.209 1.00 0.00 C ATOM 1594 O ARG A 106 13.056 -17.501 1.324 1.00 0.00 O ATOM 1595 CB ARG A 106 10.941 -18.291 -0.655 1.00 0.00 C ATOM 1596 CG ARG A 106 11.720 -19.058 -1.725 1.00 0.00 C ATOM 1597 CD ARG A 106 10.965 -20.191 -2.422 1.00 0.00 C ATOM 1598 NE ARG A 106 10.794 -21.240 -1.378 1.00 0.00 N ATOM 1599 CZ ARG A 106 9.722 -22.085 -1.373 1.00 0.00 C ATOM 1600 NH1 ARG A 106 8.812 -22.187 -2.386 1.00 0.00 N ATOM 1601 NH2 ARG A 106 9.538 -22.922 -0.310 1.00 0.00 N ATOM 0 H ARG A 106 11.439 -16.345 -2.302 1.00 0.00 H new ATOM 0 HA ARG A 106 10.891 -16.538 0.471 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.908 -18.889 0.256 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.912 -18.163 -0.990 1.00 0.00 H new ATOM 0 HG2 ARG A 106 12.051 -18.349 -2.483 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.616 -19.474 -1.265 1.00 0.00 H new ATOM 0 HD2 ARG A 106 10.001 -19.849 -2.800 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.525 -20.572 -3.276 1.00 0.00 H new ATOM 0 HE ARG A 106 11.498 -21.329 -0.646 1.00 0.00 H new ATOM 0 HH11 ARG A 106 8.909 -21.607 -3.219 1.00 0.00 H new ATOM 0 HH12 ARG A 106 8.035 -22.844 -2.309 1.00 0.00 H new ATOM 0 HH21 ARG A 106 10.198 -22.911 0.468 1.00 0.00 H new ATOM 0 HH22 ARG A 106 8.741 -23.558 -0.294 1.00 0.00 H new ATOM 1615 N HIS A 107 13.937 -16.435 -0.474 1.00 0.00 N ATOM 1616 CA HIS A 107 15.205 -16.206 0.146 1.00 0.00 C ATOM 1617 C HIS A 107 15.210 -15.163 1.210 1.00 0.00 C ATOM 1618 O HIS A 107 15.913 -15.128 2.218 1.00 0.00 O ATOM 1619 CB HIS A 107 16.285 -15.896 -0.903 1.00 0.00 C ATOM 1620 CG HIS A 107 17.712 -16.240 -0.592 1.00 0.00 C ATOM 1621 ND1 HIS A 107 18.149 -17.477 -0.165 1.00 0.00 N ATOM 1622 CD2 HIS A 107 18.846 -15.504 -0.739 1.00 0.00 C ATOM 1623 CE1 HIS A 107 19.505 -17.442 -0.070 1.00 0.00 C ATOM 1624 NE2 HIS A 107 19.961 -16.258 -0.436 1.00 0.00 N ATOM 0 H HIS A 107 13.879 -16.141 -1.449 1.00 0.00 H new ATOM 0 HA HIS A 107 15.433 -17.143 0.654 1.00 0.00 H new ATOM 0 HB2 HIS A 107 16.012 -16.416 -1.821 1.00 0.00 H new ATOM 0 HB3 HIS A 107 16.242 -14.828 -1.116 1.00 0.00 H new ATOM 0 HD2 HIS A 107 18.870 -14.470 -1.050 1.00 0.00 H new ATOM 0 HE1 HIS A 107 20.122 -18.266 0.258 1.00 0.00 H new ATOM 0 HE2 HIS A 107 20.936 -15.962 -0.485 1.00 0.00 H new ATOM 1632 N VAL A 108 14.419 -14.101 0.971 1.00 0.00 N ATOM 1633 CA VAL A 108 14.319 -13.053 1.938 1.00 0.00 C ATOM 1634 C VAL A 108 13.625 -13.500 3.179 1.00 0.00 C ATOM 1635 O VAL A 108 13.915 -13.125 4.314 1.00 0.00 O ATOM 1636 CB VAL A 108 13.739 -11.811 1.329 1.00 0.00 C ATOM 1637 CG1 VAL A 108 14.195 -10.717 2.309 1.00 0.00 C ATOM 1638 CG2 VAL A 108 14.258 -11.433 -0.068 1.00 0.00 C ATOM 0 H VAL A 108 13.860 -13.969 0.128 1.00 0.00 H new ATOM 0 HA VAL A 108 15.326 -12.789 2.260 1.00 0.00 H new ATOM 0 HB VAL A 108 12.667 -11.947 1.188 1.00 0.00 H new ATOM 0 HG11 VAL A 108 13.829 -9.748 1.969 1.00 0.00 H new ATOM 0 HG12 VAL A 108 13.796 -10.928 3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 108 15.284 -10.698 2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 108 13.767 -10.520 -0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 108 15.335 -11.271 -0.024 1.00 0.00 H new ATOM 0 HG23 VAL A 108 14.040 -12.240 -0.768 1.00 0.00 H new ATOM 1648 N MET A 109 12.604 -14.359 3.012 1.00 0.00 N ATOM 1649 CA MET A 109 11.841 -14.861 4.112 1.00 0.00 C ATOM 1650 C MET A 109 12.537 -15.876 4.952 1.00 0.00 C ATOM 1651 O MET A 109 12.137 -16.242 6.056 1.00 0.00 O ATOM 1652 CB MET A 109 10.477 -15.380 3.627 1.00 0.00 C ATOM 1653 CG MET A 109 9.669 -14.265 2.960 1.00 0.00 C ATOM 1654 SD MET A 109 8.072 -14.875 2.341 1.00 0.00 S ATOM 1655 CE MET A 109 7.563 -13.162 2.018 1.00 0.00 C ATOM 0 H MET A 109 12.304 -14.710 2.102 1.00 0.00 H new ATOM 0 HA MET A 109 11.696 -14.009 4.777 1.00 0.00 H new ATOM 0 HB2 MET A 109 10.625 -16.198 2.922 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.917 -15.784 4.470 1.00 0.00 H new ATOM 0 HG2 MET A 109 9.499 -13.460 3.675 1.00 0.00 H new ATOM 0 HG3 MET A 109 10.243 -13.843 2.135 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.602 -13.159 1.505 1.00 0.00 H new ATOM 0 HE2 MET A 109 7.472 -12.625 2.962 1.00 0.00 H new ATOM 0 HE3 MET A 109 8.310 -12.672 1.393 1.00 0.00 H new ATOM 1665 N THR A 110 13.652 -16.446 4.460 1.00 0.00 N ATOM 1666 CA THR A 110 14.495 -17.383 5.135 1.00 0.00 C ATOM 1667 C THR A 110 15.582 -16.620 5.813 1.00 0.00 C ATOM 1668 O THR A 110 15.820 -16.819 7.003 1.00 0.00 O ATOM 1669 CB THR A 110 15.059 -18.381 4.168 1.00 0.00 C ATOM 1670 OG1 THR A 110 13.988 -19.022 3.490 1.00 0.00 O ATOM 1671 CG2 THR A 110 16.022 -19.319 4.915 1.00 0.00 C ATOM 0 H THR A 110 13.988 -16.235 3.520 1.00 0.00 H new ATOM 0 HA THR A 110 13.920 -17.942 5.873 1.00 0.00 H new ATOM 0 HB THR A 110 15.659 -17.910 3.390 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.690 -18.461 2.744 1.00 0.00 H new ATOM 0 HG21 THR A 110 16.435 -20.047 4.217 1.00 0.00 H new ATOM 0 HG22 THR A 110 16.832 -18.735 5.353 1.00 0.00 H new ATOM 0 HG23 THR A 110 15.482 -19.840 5.706 1.00 0.00 H new ATOM 1679 N ASN A 111 16.329 -15.708 5.166 1.00 0.00 N ATOM 1680 CA ASN A 111 17.529 -15.207 5.761 1.00 0.00 C ATOM 1681 C ASN A 111 17.437 -13.993 6.620 1.00 0.00 C ATOM 1682 O ASN A 111 18.462 -13.492 7.080 1.00 0.00 O ATOM 1683 CB ASN A 111 18.519 -14.885 4.629 1.00 0.00 C ATOM 1684 CG ASN A 111 18.708 -16.046 3.664 1.00 0.00 C ATOM 1685 OD1 ASN A 111 18.747 -17.244 3.942 1.00 0.00 O ATOM 1686 ND2 ASN A 111 19.057 -15.635 2.415 1.00 0.00 N ATOM 0 H ASN A 111 16.108 -15.323 4.248 1.00 0.00 H new ATOM 0 HA ASN A 111 17.833 -16.003 6.441 1.00 0.00 H new ATOM 0 HB2 ASN A 111 18.163 -14.014 4.078 1.00 0.00 H new ATOM 0 HB3 ASN A 111 19.483 -14.617 5.061 1.00 0.00 H new ATOM 0 HD21 ASN A 111 19.349 -16.318 1.716 1.00 0.00 H new ATOM 0 HD22 ASN A 111 19.027 -14.644 2.177 1.00 0.00 H new ATOM 1693 N LEU A 112 16.220 -13.473 6.864 1.00 0.00 N ATOM 1694 CA LEU A 112 16.043 -12.229 7.547 1.00 0.00 C ATOM 1695 C LEU A 112 15.850 -12.381 9.016 1.00 0.00 C ATOM 1696 O LEU A 112 16.655 -11.885 9.803 1.00 0.00 O ATOM 1697 CB LEU A 112 14.958 -11.282 7.007 1.00 0.00 C ATOM 1698 CG LEU A 112 15.039 -9.844 7.546 1.00 0.00 C ATOM 1699 CD1 LEU A 112 16.337 -9.186 7.048 1.00 0.00 C ATOM 1700 CD2 LEU A 112 13.846 -9.019 7.032 1.00 0.00 C ATOM 0 H LEU A 112 15.348 -13.922 6.584 1.00 0.00 H new ATOM 0 HA LEU A 112 16.999 -11.750 7.335 1.00 0.00 H new ATOM 0 HB2 LEU A 112 15.028 -11.253 5.920 1.00 0.00 H new ATOM 0 HB3 LEU A 112 13.979 -11.694 7.253 1.00 0.00 H new ATOM 0 HG LEU A 112 15.022 -9.875 8.635 1.00 0.00 H new ATOM 0 HD11 LEU A 112 16.397 -8.166 7.429 1.00 0.00 H new ATOM 0 HD12 LEU A 112 17.194 -9.757 7.404 1.00 0.00 H new ATOM 0 HD13 LEU A 112 16.341 -9.167 5.958 1.00 0.00 H new ATOM 0 HD21 LEU A 112 13.913 -8.002 7.419 1.00 0.00 H new ATOM 0 HD22 LEU A 112 13.863 -8.994 5.942 1.00 0.00 H new ATOM 0 HD23 LEU A 112 12.916 -9.475 7.370 1.00 0.00 H new ATOM 1712 N GLY A 113 14.787 -13.023 9.531 1.00 0.00 N ATOM 1713 CA GLY A 113 14.440 -12.916 10.914 1.00 0.00 C ATOM 1714 C GLY A 113 13.454 -13.960 11.310 1.00 0.00 C ATOM 1715 O GLY A 113 13.923 -14.896 11.956 1.00 0.00 O ATOM 0 H GLY A 113 14.164 -13.620 8.986 1.00 0.00 H new ATOM 0 HA2 GLY A 113 15.338 -13.012 11.524 1.00 0.00 H new ATOM 0 HA3 GLY A 113 14.024 -11.928 11.111 1.00 0.00 H new ATOM 1719 N GLU A 114 12.151 -13.851 10.991 1.00 0.00 N ATOM 1720 CA GLU A 114 11.135 -14.766 11.408 1.00 0.00 C ATOM 1721 C GLU A 114 11.035 -16.000 10.580 1.00 0.00 C ATOM 1722 O GLU A 114 11.111 -15.845 9.362 1.00 0.00 O ATOM 1723 CB GLU A 114 9.715 -14.174 11.424 1.00 0.00 C ATOM 1724 CG GLU A 114 9.658 -12.783 12.060 1.00 0.00 C ATOM 1725 CD GLU A 114 8.247 -12.218 11.982 1.00 0.00 C ATOM 1726 OE1 GLU A 114 7.676 -12.110 10.864 1.00 0.00 O ATOM 1727 OE2 GLU A 114 7.624 -11.794 12.991 1.00 0.00 O ATOM 0 H GLU A 114 11.790 -13.090 10.416 1.00 0.00 H new ATOM 0 HA GLU A 114 11.472 -15.003 12.417 1.00 0.00 H new ATOM 0 HB2 GLU A 114 9.339 -14.117 10.403 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.053 -14.845 11.970 1.00 0.00 H new ATOM 0 HG2 GLU A 114 9.976 -12.839 13.101 1.00 0.00 H new ATOM 0 HG3 GLU A 114 10.352 -12.115 11.550 1.00 0.00 H new ATOM 1734 N LYS A 115 10.900 -17.233 11.100 1.00 0.00 N ATOM 1735 CA LYS A 115 10.981 -18.419 10.304 1.00 0.00 C ATOM 1736 C LYS A 115 9.624 -18.878 9.893 1.00 0.00 C ATOM 1737 O LYS A 115 8.742 -19.002 10.741 1.00 0.00 O ATOM 1738 CB LYS A 115 11.641 -19.521 11.150 1.00 0.00 C ATOM 1739 CG LYS A 115 12.009 -20.697 10.243 1.00 0.00 C ATOM 1740 CD LYS A 115 12.937 -21.655 10.991 1.00 0.00 C ATOM 1741 CE LYS A 115 12.178 -22.475 12.037 1.00 0.00 C ATOM 1742 NZ LYS A 115 11.088 -23.274 11.435 1.00 0.00 N ATOM 0 H LYS A 115 10.732 -17.410 12.090 1.00 0.00 H new ATOM 0 HA LYS A 115 11.562 -18.208 9.406 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.532 -19.133 11.643 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.960 -19.850 11.935 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.107 -21.221 9.928 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.498 -20.333 9.340 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.417 -22.327 10.279 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.730 -21.088 11.478 1.00 0.00 H new ATOM 0 HE2 LYS A 115 12.873 -23.140 12.550 1.00 0.00 H new ATOM 0 HE3 LYS A 115 11.763 -21.805 12.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.851 -24.067 12.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.249 -22.673 11.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.397 -23.644 10.513 1.00 0.00 H new ATOM 1756 N LEU A 116 9.614 -19.312 8.620 1.00 0.00 N ATOM 1757 CA LEU A 116 8.572 -19.996 7.920 1.00 0.00 C ATOM 1758 C LEU A 116 9.186 -21.274 7.462 1.00 0.00 C ATOM 1759 O LEU A 116 10.396 -21.479 7.384 1.00 0.00 O ATOM 1760 CB LEU A 116 8.085 -19.244 6.670 1.00 0.00 C ATOM 1761 CG LEU A 116 7.601 -17.828 7.025 1.00 0.00 C ATOM 1762 CD1 LEU A 116 8.584 -16.732 6.580 1.00 0.00 C ATOM 1763 CD2 LEU A 116 6.233 -17.563 6.373 1.00 0.00 C ATOM 0 H LEU A 116 10.425 -19.166 8.019 1.00 0.00 H new ATOM 0 HA LEU A 116 7.711 -20.111 8.579 1.00 0.00 H new ATOM 0 HB2 LEU A 116 8.893 -19.183 5.942 1.00 0.00 H new ATOM 0 HB3 LEU A 116 7.274 -19.801 6.200 1.00 0.00 H new ATOM 0 HG LEU A 116 7.527 -17.787 8.112 1.00 0.00 H new ATOM 0 HD11 LEU A 116 8.189 -15.755 6.857 1.00 0.00 H new ATOM 0 HD12 LEU A 116 9.546 -16.886 7.068 1.00 0.00 H new ATOM 0 HD13 LEU A 116 8.714 -16.777 5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.897 -16.558 6.629 1.00 0.00 H new ATOM 0 HD22 LEU A 116 6.323 -17.651 5.290 1.00 0.00 H new ATOM 0 HD23 LEU A 116 5.509 -18.292 6.737 1.00 0.00 H new ATOM 1775 N THR A 117 8.348 -22.291 7.189 1.00 0.00 N ATOM 1776 CA THR A 117 8.832 -23.498 6.594 1.00 0.00 C ATOM 1777 C THR A 117 8.824 -23.271 5.122 1.00 0.00 C ATOM 1778 O THR A 117 8.352 -22.235 4.657 1.00 0.00 O ATOM 1779 CB THR A 117 8.139 -24.759 7.018 1.00 0.00 C ATOM 1780 OG1 THR A 117 6.832 -24.894 6.480 1.00 0.00 O ATOM 1781 CG2 THR A 117 8.032 -24.851 8.549 1.00 0.00 C ATOM 0 H THR A 117 7.346 -22.279 7.378 1.00 0.00 H new ATOM 0 HA THR A 117 9.841 -23.693 6.957 1.00 0.00 H new ATOM 0 HB THR A 117 8.759 -25.565 6.625 1.00 0.00 H new ATOM 0 HG1 THR A 117 6.435 -25.734 6.791 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.525 -25.776 8.823 1.00 0.00 H new ATOM 0 HG22 THR A 117 9.031 -24.842 8.985 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.464 -24.000 8.926 1.00 0.00 H new ATOM 1789 N ASP A 118 9.308 -24.259 4.348 1.00 0.00 N ATOM 1790 CA ASP A 118 9.181 -24.250 2.924 1.00 0.00 C ATOM 1791 C ASP A 118 7.737 -24.381 2.581 1.00 0.00 C ATOM 1792 O ASP A 118 7.189 -23.543 1.866 1.00 0.00 O ATOM 1793 CB ASP A 118 10.023 -25.332 2.226 1.00 0.00 C ATOM 1794 CG ASP A 118 11.419 -24.817 1.906 1.00 0.00 C ATOM 1795 OD1 ASP A 118 11.556 -23.759 1.236 1.00 0.00 O ATOM 1796 OD2 ASP A 118 12.388 -25.494 2.344 1.00 0.00 O ATOM 0 H ASP A 118 9.795 -25.076 4.716 1.00 0.00 H new ATOM 0 HA ASP A 118 9.576 -23.304 2.554 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.094 -26.211 2.866 1.00 0.00 H new ATOM 0 HB3 ASP A 118 9.528 -25.646 1.307 1.00 0.00 H new ATOM 1801 N GLU A 119 7.030 -25.419 3.061 1.00 0.00 N ATOM 1802 CA GLU A 119 5.654 -25.717 2.811 1.00 0.00 C ATOM 1803 C GLU A 119 4.814 -24.509 3.039 1.00 0.00 C ATOM 1804 O GLU A 119 3.954 -24.200 2.216 1.00 0.00 O ATOM 1805 CB GLU A 119 5.087 -26.943 3.546 1.00 0.00 C ATOM 1806 CG GLU A 119 5.747 -28.287 3.228 1.00 0.00 C ATOM 1807 CD GLU A 119 5.261 -29.451 4.080 1.00 0.00 C ATOM 1808 OE1 GLU A 119 5.780 -29.665 5.208 1.00 0.00 O ATOM 1809 OE2 GLU A 119 4.240 -30.076 3.689 1.00 0.00 O ATOM 0 H GLU A 119 7.460 -26.109 3.677 1.00 0.00 H new ATOM 0 HA GLU A 119 5.616 -26.007 1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 119 5.168 -26.767 4.619 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.025 -27.020 3.315 1.00 0.00 H new ATOM 0 HG2 GLU A 119 5.571 -28.524 2.179 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.825 -28.186 3.355 1.00 0.00 H new ATOM 1816 N GLU A 120 5.006 -23.811 4.173 1.00 0.00 N ATOM 1817 CA GLU A 120 4.315 -22.605 4.508 1.00 0.00 C ATOM 1818 C GLU A 120 4.315 -21.556 3.450 1.00 0.00 C ATOM 1819 O GLU A 120 3.341 -20.923 3.046 1.00 0.00 O ATOM 1820 CB GLU A 120 4.889 -22.087 5.838 1.00 0.00 C ATOM 1821 CG GLU A 120 4.139 -21.066 6.696 1.00 0.00 C ATOM 1822 CD GLU A 120 4.631 -21.086 8.136 1.00 0.00 C ATOM 1823 OE1 GLU A 120 5.602 -21.787 8.527 1.00 0.00 O ATOM 1824 OE2 GLU A 120 3.901 -20.400 8.899 1.00 0.00 O ATOM 0 H GLU A 120 5.673 -24.101 4.888 1.00 0.00 H new ATOM 0 HA GLU A 120 3.257 -22.849 4.607 1.00 0.00 H new ATOM 0 HB2 GLU A 120 5.064 -22.960 6.467 1.00 0.00 H new ATOM 0 HB3 GLU A 120 5.864 -21.655 5.614 1.00 0.00 H new ATOM 0 HG2 GLU A 120 4.272 -20.068 6.278 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.071 -21.282 6.671 1.00 0.00 H new ATOM 1831 N VAL A 121 5.514 -21.408 2.857 1.00 0.00 N ATOM 1832 CA VAL A 121 5.799 -20.535 1.761 1.00 0.00 C ATOM 1833 C VAL A 121 5.236 -20.921 0.437 1.00 0.00 C ATOM 1834 O VAL A 121 4.587 -20.161 -0.281 1.00 0.00 O ATOM 1835 CB VAL A 121 7.262 -20.211 1.821 1.00 0.00 C ATOM 1836 CG1 VAL A 121 7.691 -19.410 0.580 1.00 0.00 C ATOM 1837 CG2 VAL A 121 7.504 -19.359 3.078 1.00 0.00 C ATOM 0 H VAL A 121 6.334 -21.931 3.163 1.00 0.00 H new ATOM 0 HA VAL A 121 5.235 -19.610 1.878 1.00 0.00 H new ATOM 0 HB VAL A 121 7.841 -21.134 1.853 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.756 -19.185 0.642 1.00 0.00 H new ATOM 0 HG12 VAL A 121 7.496 -19.997 -0.317 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.125 -18.479 0.534 1.00 0.00 H new ATOM 0 HG21 VAL A 121 8.562 -19.107 3.149 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.916 -18.443 3.015 1.00 0.00 H new ATOM 0 HG23 VAL A 121 7.205 -19.922 3.962 1.00 0.00 H new ATOM 1847 N ASP A 122 5.406 -22.209 0.091 1.00 0.00 N ATOM 1848 CA ASP A 122 4.871 -22.786 -1.104 1.00 0.00 C ATOM 1849 C ASP A 122 3.386 -22.684 -1.040 1.00 0.00 C ATOM 1850 O ASP A 122 2.799 -22.371 -2.075 1.00 0.00 O ATOM 1851 CB ASP A 122 5.250 -24.273 -1.200 1.00 0.00 C ATOM 1852 CG ASP A 122 6.626 -24.322 -1.849 1.00 0.00 C ATOM 1853 OD1 ASP A 122 6.691 -23.974 -3.059 1.00 0.00 O ATOM 1854 OD2 ASP A 122 7.585 -24.701 -1.126 1.00 0.00 O ATOM 0 H ASP A 122 5.933 -22.871 0.661 1.00 0.00 H new ATOM 0 HA ASP A 122 5.271 -22.260 -1.971 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.269 -24.734 -0.212 1.00 0.00 H new ATOM 0 HB3 ASP A 122 4.520 -24.823 -1.794 1.00 0.00 H new ATOM 1859 N GLU A 123 2.748 -22.858 0.131 1.00 0.00 N ATOM 1860 CA GLU A 123 1.359 -22.649 0.400 1.00 0.00 C ATOM 1861 C GLU A 123 0.882 -21.246 0.241 1.00 0.00 C ATOM 1862 O GLU A 123 -0.083 -20.987 -0.476 1.00 0.00 O ATOM 1863 CB GLU A 123 1.076 -23.203 1.807 1.00 0.00 C ATOM 1864 CG GLU A 123 -0.340 -23.071 2.370 1.00 0.00 C ATOM 1865 CD GLU A 123 -0.639 -24.013 3.527 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -0.946 -25.181 3.167 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -0.647 -23.632 4.728 1.00 0.00 O ATOM 0 H GLU A 123 3.250 -23.173 0.961 1.00 0.00 H new ATOM 0 HA GLU A 123 0.787 -23.182 -0.359 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.335 -24.262 1.805 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.756 -22.710 2.501 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.493 -22.044 2.703 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.056 -23.257 1.570 1.00 0.00 H new ATOM 1874 N MET A 124 1.624 -20.272 0.798 1.00 0.00 N ATOM 1875 CA MET A 124 1.429 -18.861 0.669 1.00 0.00 C ATOM 1876 C MET A 124 1.404 -18.331 -0.723 1.00 0.00 C ATOM 1877 O MET A 124 0.527 -17.595 -1.173 1.00 0.00 O ATOM 1878 CB MET A 124 2.549 -18.211 1.499 1.00 0.00 C ATOM 1879 CG MET A 124 2.625 -16.686 1.411 1.00 0.00 C ATOM 1880 SD MET A 124 4.027 -16.036 2.369 1.00 0.00 S ATOM 1881 CE MET A 124 3.153 -15.965 3.960 1.00 0.00 C ATOM 0 H MET A 124 2.427 -20.492 1.387 1.00 0.00 H new ATOM 0 HA MET A 124 0.430 -18.616 1.028 1.00 0.00 H new ATOM 0 HB2 MET A 124 2.415 -18.492 2.544 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.505 -18.625 1.177 1.00 0.00 H new ATOM 0 HG2 MET A 124 2.724 -16.385 0.368 1.00 0.00 H new ATOM 0 HG3 MET A 124 1.696 -16.252 1.782 1.00 0.00 H new ATOM 0 HE1 MET A 124 3.821 -15.569 4.725 1.00 0.00 H new ATOM 0 HE2 MET A 124 2.282 -15.316 3.868 1.00 0.00 H new ATOM 0 HE3 MET A 124 2.831 -16.967 4.243 1.00 0.00 H new ATOM 1891 N ILE A 125 2.418 -18.748 -1.503 1.00 0.00 N ATOM 1892 CA ILE A 125 2.663 -18.356 -2.856 1.00 0.00 C ATOM 1893 C ILE A 125 1.641 -18.903 -3.792 1.00 0.00 C ATOM 1894 O ILE A 125 1.080 -18.226 -4.652 1.00 0.00 O ATOM 1895 CB ILE A 125 4.063 -18.714 -3.258 1.00 0.00 C ATOM 1896 CG1 ILE A 125 5.123 -17.965 -2.434 1.00 0.00 C ATOM 1897 CG2 ILE A 125 4.380 -18.557 -4.754 1.00 0.00 C ATOM 1898 CD1 ILE A 125 6.490 -18.648 -2.409 1.00 0.00 C ATOM 0 H ILE A 125 3.117 -19.408 -1.161 1.00 0.00 H new ATOM 0 HA ILE A 125 2.569 -17.272 -2.918 1.00 0.00 H new ATOM 0 HB ILE A 125 4.112 -19.781 -3.040 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.238 -16.959 -2.838 1.00 0.00 H new ATOM 0 HG13 ILE A 125 4.763 -17.858 -1.411 1.00 0.00 H new ATOM 0 HG21 ILE A 125 5.416 -18.841 -4.938 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.719 -19.199 -5.335 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.230 -17.519 -5.051 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.181 -18.057 -1.807 1.00 0.00 H new ATOM 0 HD12 ILE A 125 6.392 -19.643 -1.976 1.00 0.00 H new ATOM 0 HD13 ILE A 125 6.874 -18.731 -3.426 1.00 0.00 H new ATOM 1910 N ARG A 126 1.217 -20.171 -3.647 1.00 0.00 N ATOM 1911 CA ARG A 126 0.171 -20.846 -4.350 1.00 0.00 C ATOM 1912 C ARG A 126 -1.132 -20.140 -4.199 1.00 0.00 C ATOM 1913 O ARG A 126 -1.828 -19.781 -5.147 1.00 0.00 O ATOM 1914 CB ARG A 126 0.019 -22.298 -3.867 1.00 0.00 C ATOM 1915 CG ARG A 126 -0.912 -23.071 -4.804 1.00 0.00 C ATOM 1916 CD ARG A 126 -1.172 -24.510 -4.356 1.00 0.00 C ATOM 1917 NE ARG A 126 -1.841 -24.451 -3.026 1.00 0.00 N ATOM 1918 CZ ARG A 126 -1.845 -25.458 -2.104 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -1.325 -26.676 -2.435 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -2.252 -25.265 -0.816 1.00 0.00 N ATOM 0 H ARG A 126 1.657 -20.787 -2.963 1.00 0.00 H new ATOM 0 HA ARG A 126 0.452 -20.848 -5.403 1.00 0.00 H new ATOM 0 HB2 ARG A 126 0.995 -22.782 -3.832 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -0.380 -22.312 -2.853 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -1.863 -22.543 -4.874 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -0.479 -23.083 -5.804 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -1.801 -25.029 -5.079 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -0.237 -25.066 -4.290 1.00 0.00 H new ATOM 0 HE ARG A 126 -2.334 -23.591 -2.786 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.937 -26.829 -3.366 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -1.324 -27.433 -1.751 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -2.567 -24.343 -0.514 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -2.241 -26.042 -0.156 1.00 0.00 H new ATOM 1934 N GLU A 127 -1.414 -19.774 -2.936 1.00 0.00 N ATOM 1935 CA GLU A 127 -2.619 -19.113 -2.540 1.00 0.00 C ATOM 1936 C GLU A 127 -2.720 -17.679 -2.930 1.00 0.00 C ATOM 1937 O GLU A 127 -3.772 -17.199 -3.351 1.00 0.00 O ATOM 1938 CB GLU A 127 -2.909 -19.341 -1.047 1.00 0.00 C ATOM 1939 CG GLU A 127 -4.217 -18.801 -0.465 1.00 0.00 C ATOM 1940 CD GLU A 127 -5.434 -19.616 -0.878 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -5.344 -20.872 -0.935 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -6.476 -18.998 -1.225 1.00 0.00 O ATOM 0 H GLU A 127 -0.776 -19.946 -2.159 1.00 0.00 H new ATOM 0 HA GLU A 127 -3.409 -19.588 -3.122 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -2.884 -20.415 -0.865 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -2.088 -18.903 -0.479 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -4.147 -18.789 0.623 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -4.352 -17.768 -0.787 1.00 0.00 H new ATOM 1949 N ALA A 128 -1.607 -16.930 -2.835 1.00 0.00 N ATOM 1950 CA ALA A 128 -1.551 -15.518 -3.054 1.00 0.00 C ATOM 1951 C ALA A 128 -0.785 -15.044 -4.240 1.00 0.00 C ATOM 1952 O ALA A 128 -0.269 -13.928 -4.214 1.00 0.00 O ATOM 1953 CB ALA A 128 -0.986 -14.934 -1.749 1.00 0.00 C ATOM 0 H ALA A 128 -0.700 -17.330 -2.593 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.556 -15.173 -3.299 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.912 -13.850 -1.837 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.648 -15.186 -0.921 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.004 -15.351 -1.562 1.00 0.00 H new ATOM 1959 N ASP A 129 -0.826 -15.744 -5.388 1.00 0.00 N ATOM 1960 CA ASP A 129 -0.489 -15.234 -6.681 1.00 0.00 C ATOM 1961 C ASP A 129 -1.732 -15.128 -7.495 1.00 0.00 C ATOM 1962 O ASP A 129 -2.632 -15.962 -7.402 1.00 0.00 O ATOM 1963 CB ASP A 129 0.558 -16.015 -7.495 1.00 0.00 C ATOM 1964 CG ASP A 129 1.209 -15.277 -8.656 1.00 0.00 C ATOM 1965 OD1 ASP A 129 0.623 -14.987 -9.733 1.00 0.00 O ATOM 1966 OD2 ASP A 129 2.344 -14.748 -8.513 1.00 0.00 O ATOM 0 H ASP A 129 -1.111 -16.723 -5.414 1.00 0.00 H new ATOM 0 HA ASP A 129 -0.017 -14.274 -6.474 1.00 0.00 H new ATOM 0 HB2 ASP A 129 1.345 -16.341 -6.814 1.00 0.00 H new ATOM 0 HB3 ASP A 129 0.083 -16.914 -7.887 1.00 0.00 H new ATOM 1971 N ILE A 130 -1.872 -14.068 -8.311 1.00 0.00 N ATOM 1972 CA ILE A 130 -3.000 -13.924 -9.177 1.00 0.00 C ATOM 1973 C ILE A 130 -2.841 -14.796 -10.375 1.00 0.00 C ATOM 1974 O ILE A 130 -3.538 -15.802 -10.498 1.00 0.00 O ATOM 1975 CB ILE A 130 -3.155 -12.465 -9.490 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -3.674 -11.793 -8.207 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -4.038 -12.142 -10.707 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -5.157 -12.065 -7.961 1.00 0.00 C ATOM 0 H ILE A 130 -1.198 -13.305 -8.371 1.00 0.00 H new ATOM 0 HA ILE A 130 -3.923 -14.258 -8.703 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.184 -12.074 -9.792 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -3.096 -12.151 -7.355 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -3.512 -10.717 -8.273 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -4.085 -11.062 -10.846 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -3.613 -12.605 -11.598 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -5.043 -12.530 -10.541 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -5.471 -11.568 -7.043 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.741 -11.683 -8.799 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.319 -13.139 -7.865 1.00 0.00 H new ATOM 1990 N ASP A 131 -1.836 -14.584 -11.243 1.00 0.00 N ATOM 1991 CA ASP A 131 -1.468 -15.361 -12.386 1.00 0.00 C ATOM 1992 C ASP A 131 -1.279 -16.809 -12.091 1.00 0.00 C ATOM 1993 O ASP A 131 -1.632 -17.753 -12.797 1.00 0.00 O ATOM 1994 CB ASP A 131 -0.174 -14.813 -13.011 1.00 0.00 C ATOM 1995 CG ASP A 131 -0.201 -13.292 -13.073 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -0.704 -12.711 -14.071 1.00 0.00 O ATOM 1997 OD2 ASP A 131 0.382 -12.639 -12.167 1.00 0.00 O ATOM 0 H ASP A 131 -1.217 -13.782 -11.129 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.304 -15.276 -13.081 1.00 0.00 H new ATOM 0 HB2 ASP A 131 0.685 -15.142 -12.426 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -0.050 -15.220 -14.015 1.00 0.00 H new ATOM 2002 N GLY A 132 -0.545 -17.081 -10.998 1.00 0.00 N ATOM 2003 CA GLY A 132 0.058 -18.358 -10.771 1.00 0.00 C ATOM 2004 C GLY A 132 1.351 -18.591 -11.475 1.00 0.00 C ATOM 2005 O GLY A 132 1.770 -19.743 -11.580 1.00 0.00 O ATOM 0 H GLY A 132 -0.367 -16.402 -10.258 1.00 0.00 H new ATOM 0 HA2 GLY A 132 0.221 -18.478 -9.700 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -0.646 -19.132 -11.076 1.00 0.00 H new ATOM 2009 N ASP A 133 2.006 -17.506 -11.925 1.00 0.00 N ATOM 2010 CA ASP A 133 3.178 -17.405 -12.739 1.00 0.00 C ATOM 2011 C ASP A 133 4.443 -17.483 -11.955 1.00 0.00 C ATOM 2012 O ASP A 133 5.456 -18.011 -12.410 1.00 0.00 O ATOM 2013 CB ASP A 133 3.067 -16.136 -13.601 1.00 0.00 C ATOM 2014 CG ASP A 133 3.169 -14.746 -12.990 1.00 0.00 C ATOM 2015 OD1 ASP A 133 3.184 -14.517 -11.751 1.00 0.00 O ATOM 2016 OD2 ASP A 133 3.230 -13.839 -13.863 1.00 0.00 O ATOM 0 H ASP A 133 1.663 -16.577 -11.682 1.00 0.00 H new ATOM 0 HA ASP A 133 3.231 -18.271 -13.399 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.842 -16.204 -14.365 1.00 0.00 H new ATOM 0 HB3 ASP A 133 2.107 -16.186 -14.115 1.00 0.00 H new ATOM 2021 N GLY A 134 4.430 -16.949 -10.721 1.00 0.00 N ATOM 2022 CA GLY A 134 5.522 -17.138 -9.817 1.00 0.00 C ATOM 2023 C GLY A 134 6.450 -15.972 -9.802 1.00 0.00 C ATOM 2024 O GLY A 134 7.539 -15.997 -9.229 1.00 0.00 O ATOM 0 H GLY A 134 3.664 -16.387 -10.349 1.00 0.00 H new ATOM 0 HA2 GLY A 134 5.134 -17.304 -8.812 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.073 -18.035 -10.099 1.00 0.00 H new ATOM 2028 N GLN A 135 6.125 -14.870 -10.500 1.00 0.00 N ATOM 2029 CA GLN A 135 6.672 -13.595 -10.153 1.00 0.00 C ATOM 2030 C GLN A 135 5.622 -12.879 -9.375 1.00 0.00 C ATOM 2031 O GLN A 135 4.441 -12.831 -9.715 1.00 0.00 O ATOM 2032 CB GLN A 135 7.250 -12.802 -11.338 1.00 0.00 C ATOM 2033 CG GLN A 135 6.432 -12.712 -12.627 1.00 0.00 C ATOM 2034 CD GLN A 135 7.000 -11.553 -13.432 1.00 0.00 C ATOM 2035 OE1 GLN A 135 8.218 -11.400 -13.511 1.00 0.00 O ATOM 2036 NE2 GLN A 135 6.151 -10.589 -13.879 1.00 0.00 N ATOM 0 H GLN A 135 5.489 -14.860 -11.298 1.00 0.00 H new ATOM 0 HA GLN A 135 7.563 -13.726 -9.539 1.00 0.00 H new ATOM 0 HB2 GLN A 135 7.440 -11.785 -10.995 1.00 0.00 H new ATOM 0 HB3 GLN A 135 8.216 -13.239 -11.589 1.00 0.00 H new ATOM 0 HG2 GLN A 135 6.497 -13.642 -13.191 1.00 0.00 H new ATOM 0 HG3 GLN A 135 5.378 -12.547 -12.404 1.00 0.00 H new ATOM 0 HE21 GLN A 135 5.143 -10.725 -13.809 1.00 0.00 H new ATOM 0 HE22 GLN A 135 6.523 -9.730 -14.284 1.00 0.00 H new ATOM 2045 N VAL A 136 6.016 -12.143 -8.320 1.00 0.00 N ATOM 2046 CA VAL A 136 5.153 -11.403 -7.454 1.00 0.00 C ATOM 2047 C VAL A 136 5.151 -9.957 -7.815 1.00 0.00 C ATOM 2048 O VAL A 136 6.237 -9.381 -7.851 1.00 0.00 O ATOM 2049 CB VAL A 136 5.252 -11.882 -6.036 1.00 0.00 C ATOM 2050 CG1 VAL A 136 6.411 -11.133 -5.358 1.00 0.00 C ATOM 2051 CG2 VAL A 136 3.954 -11.590 -5.265 1.00 0.00 C ATOM 0 H VAL A 136 6.998 -12.061 -8.057 1.00 0.00 H new ATOM 0 HA VAL A 136 4.095 -11.614 -7.608 1.00 0.00 H new ATOM 0 HB VAL A 136 5.421 -12.959 -6.033 1.00 0.00 H new ATOM 0 HG11 VAL A 136 6.503 -11.465 -4.324 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.339 -11.341 -5.890 1.00 0.00 H new ATOM 0 HG13 VAL A 136 6.213 -10.061 -5.379 1.00 0.00 H new ATOM 0 HG21 VAL A 136 4.052 -11.947 -4.240 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.768 -10.516 -5.259 1.00 0.00 H new ATOM 0 HG23 VAL A 136 3.121 -12.100 -5.749 1.00 0.00 H new ATOM 2061 N ASN A 137 4.007 -9.318 -8.116 1.00 0.00 N ATOM 2062 CA ASN A 137 3.923 -7.893 -8.033 1.00 0.00 C ATOM 2063 C ASN A 137 3.567 -7.341 -6.696 1.00 0.00 C ATOM 2064 O ASN A 137 3.443 -8.051 -5.698 1.00 0.00 O ATOM 2065 CB ASN A 137 3.102 -7.297 -9.189 1.00 0.00 C ATOM 2066 CG ASN A 137 1.593 -7.444 -9.056 1.00 0.00 C ATOM 2067 OD1 ASN A 137 1.036 -7.207 -7.985 1.00 0.00 O ATOM 2068 ND2 ASN A 137 0.869 -7.771 -10.160 1.00 0.00 N ATOM 0 H ASN A 137 3.149 -9.782 -8.414 1.00 0.00 H new ATOM 0 HA ASN A 137 4.950 -7.550 -8.159 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.341 -6.237 -9.275 1.00 0.00 H new ATOM 0 HB3 ASN A 137 3.416 -7.771 -10.119 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -0.148 -7.822 -10.106 1.00 0.00 H new ATOM 0 HD22 ASN A 137 1.343 -7.965 -11.042 1.00 0.00 H new ATOM 2075 N TYR A 138 3.434 -6.004 -6.634 1.00 0.00 N ATOM 2076 CA TYR A 138 3.230 -5.415 -5.347 1.00 0.00 C ATOM 2077 C TYR A 138 1.892 -5.683 -4.750 1.00 0.00 C ATOM 2078 O TYR A 138 1.718 -5.914 -3.554 1.00 0.00 O ATOM 2079 CB TYR A 138 3.606 -3.927 -5.453 1.00 0.00 C ATOM 2080 CG TYR A 138 3.441 -3.292 -4.116 1.00 0.00 C ATOM 2081 CD1 TYR A 138 4.209 -3.813 -3.100 1.00 0.00 C ATOM 2082 CD2 TYR A 138 2.459 -2.351 -3.917 1.00 0.00 C ATOM 2083 CE1 TYR A 138 3.817 -3.452 -1.832 1.00 0.00 C ATOM 2084 CE2 TYR A 138 2.149 -1.919 -2.650 1.00 0.00 C ATOM 2085 CZ TYR A 138 2.837 -2.511 -1.617 1.00 0.00 C ATOM 2086 OH TYR A 138 2.552 -2.153 -0.283 1.00 0.00 O ATOM 0 H TYR A 138 3.465 -5.361 -7.425 1.00 0.00 H new ATOM 0 HA TYR A 138 3.884 -5.896 -4.620 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.635 -3.822 -5.796 1.00 0.00 H new ATOM 0 HB3 TYR A 138 2.973 -3.429 -6.188 1.00 0.00 H new ATOM 0 HD1 TYR A 138 5.056 -4.457 -3.284 1.00 0.00 H new ATOM 0 HD2 TYR A 138 1.926 -1.947 -4.765 1.00 0.00 H new ATOM 0 HE1 TYR A 138 4.291 -3.920 -0.982 1.00 0.00 H new ATOM 0 HE2 TYR A 138 1.405 -1.156 -2.475 1.00 0.00 H new ATOM 0 HH TYR A 138 1.841 -1.478 -0.270 1.00 0.00 H new ATOM 2096 N GLU A 139 0.834 -5.684 -5.581 1.00 0.00 N ATOM 2097 CA GLU A 139 -0.526 -5.871 -5.178 1.00 0.00 C ATOM 2098 C GLU A 139 -0.726 -7.277 -4.729 1.00 0.00 C ATOM 2099 O GLU A 139 -1.413 -7.521 -3.739 1.00 0.00 O ATOM 2100 CB GLU A 139 -1.499 -5.503 -6.311 1.00 0.00 C ATOM 2101 CG GLU A 139 -2.854 -5.179 -5.678 1.00 0.00 C ATOM 2102 CD GLU A 139 -3.721 -4.424 -6.675 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -3.302 -3.363 -7.212 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -4.839 -4.904 -7.004 1.00 0.00 O ATOM 0 H GLU A 139 0.933 -5.547 -6.587 1.00 0.00 H new ATOM 0 HA GLU A 139 -0.740 -5.203 -4.344 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -1.125 -4.647 -6.872 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -1.594 -6.329 -7.016 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.352 -6.099 -5.372 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.712 -4.580 -4.779 1.00 0.00 H new ATOM 2111 N GLU A 140 -0.105 -8.260 -5.405 1.00 0.00 N ATOM 2112 CA GLU A 140 0.047 -9.557 -4.822 1.00 0.00 C ATOM 2113 C GLU A 140 0.799 -9.692 -3.543 1.00 0.00 C ATOM 2114 O GLU A 140 0.371 -10.350 -2.596 1.00 0.00 O ATOM 2115 CB GLU A 140 0.600 -10.599 -5.809 1.00 0.00 C ATOM 2116 CG GLU A 140 0.007 -10.557 -7.218 1.00 0.00 C ATOM 2117 CD GLU A 140 0.685 -11.495 -8.207 1.00 0.00 C ATOM 2118 OE1 GLU A 140 1.941 -11.529 -8.302 1.00 0.00 O ATOM 2119 OE2 GLU A 140 0.032 -12.233 -8.993 1.00 0.00 O ATOM 0 H GLU A 140 0.287 -8.160 -6.341 1.00 0.00 H new ATOM 0 HA GLU A 140 -0.994 -9.748 -4.560 1.00 0.00 H new ATOM 0 HB2 GLU A 140 1.679 -10.464 -5.885 1.00 0.00 H new ATOM 0 HB3 GLU A 140 0.431 -11.592 -5.393 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -1.052 -10.809 -7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 140 0.072 -9.537 -7.598 1.00 0.00 H new ATOM 2126 N PHE A 141 2.005 -9.095 -3.531 1.00 0.00 N ATOM 2127 CA PHE A 141 2.874 -9.074 -2.395 1.00 0.00 C ATOM 2128 C PHE A 141 2.227 -8.555 -1.157 1.00 0.00 C ATOM 2129 O PHE A 141 2.340 -9.101 -0.060 1.00 0.00 O ATOM 2130 CB PHE A 141 4.204 -8.363 -2.695 1.00 0.00 C ATOM 2131 CG PHE A 141 5.228 -8.414 -1.614 1.00 0.00 C ATOM 2132 CD1 PHE A 141 5.957 -9.525 -1.260 1.00 0.00 C ATOM 2133 CD2 PHE A 141 5.564 -7.242 -0.977 1.00 0.00 C ATOM 2134 CE1 PHE A 141 6.843 -9.472 -0.210 1.00 0.00 C ATOM 2135 CE2 PHE A 141 6.540 -7.129 -0.015 1.00 0.00 C ATOM 2136 CZ PHE A 141 7.095 -8.296 0.456 1.00 0.00 C ATOM 0 H PHE A 141 2.389 -8.609 -4.342 1.00 0.00 H new ATOM 0 HA PHE A 141 3.106 -10.119 -2.187 1.00 0.00 H new ATOM 0 HB2 PHE A 141 4.633 -8.802 -3.596 1.00 0.00 H new ATOM 0 HB3 PHE A 141 3.992 -7.318 -2.919 1.00 0.00 H new ATOM 0 HD1 PHE A 141 5.833 -10.446 -1.811 1.00 0.00 H new ATOM 0 HD2 PHE A 141 5.024 -6.348 -1.252 1.00 0.00 H new ATOM 0 HE1 PHE A 141 7.352 -10.373 0.098 1.00 0.00 H new ATOM 0 HE2 PHE A 141 6.857 -6.165 0.355 1.00 0.00 H new ATOM 0 HZ PHE A 141 7.720 -8.289 1.337 1.00 0.00 H new ATOM 2146 N VAL A 142 1.345 -7.548 -1.283 1.00 0.00 N ATOM 2147 CA VAL A 142 0.454 -7.085 -0.266 1.00 0.00 C ATOM 2148 C VAL A 142 -0.375 -8.161 0.346 1.00 0.00 C ATOM 2149 O VAL A 142 -0.298 -8.320 1.564 1.00 0.00 O ATOM 2150 CB VAL A 142 -0.430 -6.007 -0.821 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -1.712 -5.754 -0.010 1.00 0.00 C ATOM 2152 CG2 VAL A 142 0.418 -4.727 -0.914 1.00 0.00 C ATOM 0 H VAL A 142 1.249 -7.024 -2.153 1.00 0.00 H new ATOM 0 HA VAL A 142 1.079 -6.693 0.536 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.788 -6.332 -1.798 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -2.291 -4.960 -0.482 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.308 -6.666 0.023 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -1.448 -5.456 1.005 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -0.190 -3.916 -1.315 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.777 -4.455 0.079 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.269 -4.901 -1.572 1.00 0.00 H new ATOM 2162 N GLN A 143 -1.115 -8.966 -0.437 1.00 0.00 N ATOM 2163 CA GLN A 143 -1.884 -10.080 0.023 1.00 0.00 C ATOM 2164 C GLN A 143 -1.131 -11.033 0.887 1.00 0.00 C ATOM 2165 O GLN A 143 -1.591 -11.386 1.972 1.00 0.00 O ATOM 2166 CB GLN A 143 -2.703 -10.834 -1.038 1.00 0.00 C ATOM 2167 CG GLN A 143 -3.740 -11.847 -0.548 1.00 0.00 C ATOM 2168 CD GLN A 143 -4.752 -11.167 0.363 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -5.792 -10.637 -0.022 1.00 0.00 O ATOM 2170 NE2 GLN A 143 -4.445 -11.141 1.688 1.00 0.00 N ATOM 0 H GLN A 143 -1.180 -8.832 -1.446 1.00 0.00 H new ATOM 0 HA GLN A 143 -2.621 -9.574 0.647 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.219 -10.095 -1.651 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -2.005 -11.358 -1.691 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -4.251 -12.296 -1.400 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -3.243 -12.656 -0.012 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -3.585 -11.577 2.021 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -5.075 -10.685 2.349 1.00 0.00 H new ATOM 2179 N MET A 144 0.065 -11.485 0.470 1.00 0.00 N ATOM 2180 CA MET A 144 1.029 -12.207 1.241 1.00 0.00 C ATOM 2181 C MET A 144 1.463 -11.644 2.550 1.00 0.00 C ATOM 2182 O MET A 144 1.644 -12.431 3.478 1.00 0.00 O ATOM 2183 CB MET A 144 2.334 -12.541 0.498 1.00 0.00 C ATOM 2184 CG MET A 144 2.218 -13.604 -0.596 1.00 0.00 C ATOM 2185 SD MET A 144 3.772 -13.712 -1.534 1.00 0.00 S ATOM 2186 CE MET A 144 2.844 -14.357 -2.956 1.00 0.00 C ATOM 0 H MET A 144 0.383 -11.332 -0.487 1.00 0.00 H new ATOM 0 HA MET A 144 0.414 -13.087 1.430 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.721 -11.625 0.051 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.071 -12.875 1.228 1.00 0.00 H new ATOM 0 HG2 MET A 144 1.986 -14.571 -0.150 1.00 0.00 H new ATOM 0 HG3 MET A 144 1.396 -13.357 -1.268 1.00 0.00 H new ATOM 0 HE1 MET A 144 3.519 -14.906 -3.612 1.00 0.00 H new ATOM 0 HE2 MET A 144 2.057 -15.025 -2.605 1.00 0.00 H new ATOM 0 HE3 MET A 144 2.398 -13.528 -3.506 1.00 0.00 H new ATOM 2196 N MET A 145 1.869 -10.364 2.612 1.00 0.00 N ATOM 2197 CA MET A 145 2.414 -9.816 3.816 1.00 0.00 C ATOM 2198 C MET A 145 1.328 -9.418 4.755 1.00 0.00 C ATOM 2199 O MET A 145 1.667 -9.433 5.938 1.00 0.00 O ATOM 2200 CB MET A 145 3.253 -8.570 3.483 1.00 0.00 C ATOM 2201 CG MET A 145 4.490 -8.870 2.633 1.00 0.00 C ATOM 2202 SD MET A 145 5.874 -9.703 3.467 1.00 0.00 S ATOM 2203 CE MET A 145 6.644 -8.257 4.251 1.00 0.00 C ATOM 0 H MET A 145 1.821 -9.709 1.831 1.00 0.00 H new ATOM 0 HA MET A 145 3.035 -10.579 4.286 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.626 -7.851 2.955 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.568 -8.096 4.413 1.00 0.00 H new ATOM 0 HG2 MET A 145 4.181 -9.487 1.789 1.00 0.00 H new ATOM 0 HG3 MET A 145 4.857 -7.929 2.223 1.00 0.00 H new ATOM 0 HE1 MET A 145 7.521 -8.573 4.815 1.00 0.00 H new ATOM 0 HE2 MET A 145 6.944 -7.544 3.483 1.00 0.00 H new ATOM 0 HE3 MET A 145 5.929 -7.785 4.926 1.00 0.00 H new