USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 984 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 118 CYS SG : rot -21:sc= 0.723 USER MOD Set 1.2: A 119 GLN : amide:sc= -0.257 K(o=0.47,f=-0.44) USER MOD Set 2.1: A 105 LYS NZ :NH3+ -120:sc= 0.0502 (180deg=0) USER MOD Set 2.2: A 108 THR OG1 : rot 69:sc= -0.251 USER MOD Set 3.1: A 98 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 111 LYS NZ :NH3+ 158:sc= -0.0803 (180deg=-0.414) USER MOD Set 4.1: A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 42 LYS NZ :NH3+ -167:sc= -1.11 (180deg=-0.224) USER MOD Set 5.2: A 77 GLN : amide:sc= -0.26 K(o=-1.4,f=-6!) USER MOD Set 6.1: A 37 TYR OH : rot 180:sc=-0.00441 USER MOD Set 6.2: A 53 CYS SG : rot 174:sc= -2.49 USER MOD Set 7.1: A 39 SER OG : rot 144:sc= 0.632 USER MOD Set 7.2: A 48 SER OG : rot -107:sc= 1.25 USER MOD Set 7.3: A 75 TYR OH : rot 180:sc= 0.266 USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.0754 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 28:sc= 0.0119 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 31:sc= 0.0938 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 HIS :FLIP no HE2:sc= -3.62! C(o=-4.6!,f=-3.6!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -77:sc= 0.937 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 CYS SG : rot 180:sc= -1.36 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.0595 X(o=-0.06,f=-0.054) USER MOD Single : A 68 THR OG1 : rot -53:sc= 0.259 USER MOD Single : A 71 CYS SG : rot 156:sc= 0.283 USER MOD Single : A 76 CYS SG : rot 180:sc= -1.17 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.29) USER MOD Single : A 89 ASN : amide:sc= -3.79! C(o=-3.8!,f=-4.6!) USER MOD Single : A 93 GLN : amide:sc= 0.815 K(o=0.81,f=-0.88) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -21:sc= 0.586 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.595 K(o=-0.59,f=-1.7) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 CYS SG : rot 146:sc= 0.0985 USER MOD Single : A 120 SER OG : rot 180:sc= 0.0482 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 155:sc= -0.28 (180deg=-1.28!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.031 12.264 16.023 1.00 0.00 N ATOM 2 CA GLY A 1 11.048 13.600 15.456 1.00 0.00 C ATOM 3 C GLY A 1 9.711 13.996 14.863 1.00 0.00 C ATOM 4 O GLY A 1 8.790 13.182 14.792 1.00 0.00 O ATOM 0 H1 GLY A 1 11.310 12.308 17.024 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.073 11.867 15.948 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.698 11.658 15.504 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.325 14.316 16.230 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.815 13.653 14.683 1.00 0.00 H new ATOM 8 N SER A 2 9.602 15.250 14.437 1.00 0.00 N ATOM 9 CA SER A 2 8.365 15.754 13.852 1.00 0.00 C ATOM 10 C SER A 2 8.490 15.872 12.336 1.00 0.00 C ATOM 11 O SER A 2 9.581 16.079 11.807 1.00 0.00 O ATOM 12 CB SER A 2 8.009 17.115 14.453 1.00 0.00 C ATOM 13 OG SER A 2 7.581 16.983 15.797 1.00 0.00 O ATOM 0 H SER A 2 10.355 15.936 14.486 1.00 0.00 H new ATOM 0 HA SER A 2 7.569 15.045 14.080 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.876 17.774 14.407 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.222 17.582 13.862 1.00 0.00 H new ATOM 0 HG SER A 2 7.361 17.867 16.159 1.00 0.00 H new ATOM 19 N GLU A 3 7.363 15.738 11.643 1.00 0.00 N ATOM 20 CA GLU A 3 7.346 15.828 10.188 1.00 0.00 C ATOM 21 C GLU A 3 7.733 17.230 9.725 1.00 0.00 C ATOM 22 O GLU A 3 7.885 18.143 10.536 1.00 0.00 O ATOM 23 CB GLU A 3 5.961 15.466 9.648 1.00 0.00 C ATOM 24 CG GLU A 3 5.704 13.969 9.587 1.00 0.00 C ATOM 25 CD GLU A 3 5.420 13.369 10.950 1.00 0.00 C ATOM 26 OE1 GLU A 3 4.447 13.808 11.600 1.00 0.00 O ATOM 27 OE2 GLU A 3 6.170 12.463 11.368 1.00 0.00 O ATOM 0 H GLU A 3 6.451 15.567 12.066 1.00 0.00 H new ATOM 0 HA GLU A 3 8.077 15.120 9.798 1.00 0.00 H new ATOM 0 HB2 GLU A 3 5.202 15.931 10.277 1.00 0.00 H new ATOM 0 HB3 GLU A 3 5.848 15.887 8.649 1.00 0.00 H new ATOM 0 HG2 GLU A 3 4.859 13.776 8.926 1.00 0.00 H new ATOM 0 HG3 GLU A 3 6.570 13.473 9.149 1.00 0.00 H new ATOM 34 N GLY A 4 7.892 17.392 8.415 1.00 0.00 N ATOM 35 CA GLY A 4 8.261 18.683 7.866 1.00 0.00 C ATOM 36 C GLY A 4 7.820 18.848 6.425 1.00 0.00 C ATOM 37 O GLY A 4 8.634 18.758 5.507 1.00 0.00 O ATOM 0 H GLY A 4 7.772 16.651 7.724 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.816 19.472 8.472 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.342 18.805 7.928 1.00 0.00 H new ATOM 41 N ALA A 5 6.529 19.090 6.227 1.00 0.00 N ATOM 42 CA ALA A 5 5.982 19.268 4.888 1.00 0.00 C ATOM 43 C ALA A 5 5.947 17.946 4.128 1.00 0.00 C ATOM 44 O ALA A 5 6.479 17.840 3.024 1.00 0.00 O ATOM 45 CB ALA A 5 6.794 20.299 4.119 1.00 0.00 C ATOM 0 H ALA A 5 5.842 19.167 6.977 1.00 0.00 H new ATOM 0 HA ALA A 5 4.958 19.628 4.986 1.00 0.00 H new ATOM 0 HB1 ALA A 5 6.374 20.422 3.121 1.00 0.00 H new ATOM 0 HB2 ALA A 5 6.763 21.253 4.646 1.00 0.00 H new ATOM 0 HB3 ALA A 5 7.828 19.962 4.039 1.00 0.00 H new ATOM 51 N ALA A 6 5.319 16.940 4.728 1.00 0.00 N ATOM 52 CA ALA A 6 5.214 15.626 4.108 1.00 0.00 C ATOM 53 C ALA A 6 4.336 14.695 4.937 1.00 0.00 C ATOM 54 O ALA A 6 4.486 14.605 6.156 1.00 0.00 O ATOM 55 CB ALA A 6 6.597 15.020 3.919 1.00 0.00 C ATOM 0 H ALA A 6 4.875 17.011 5.644 1.00 0.00 H new ATOM 0 HA ALA A 6 4.746 15.749 3.131 1.00 0.00 H new ATOM 0 HB1 ALA A 6 6.504 14.038 3.455 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.194 15.669 3.278 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.085 14.918 4.888 1.00 0.00 H new ATOM 61 N THR A 7 3.417 14.005 4.269 1.00 0.00 N ATOM 62 CA THR A 7 2.513 13.083 4.945 1.00 0.00 C ATOM 63 C THR A 7 3.092 11.673 4.983 1.00 0.00 C ATOM 64 O THR A 7 3.617 11.181 3.985 1.00 0.00 O ATOM 65 CB THR A 7 1.135 13.041 4.257 1.00 0.00 C ATOM 66 OG1 THR A 7 1.260 12.478 2.946 1.00 0.00 O ATOM 67 CG2 THR A 7 0.536 14.436 4.160 1.00 0.00 C ATOM 0 H THR A 7 3.279 14.067 3.260 1.00 0.00 H new ATOM 0 HA THR A 7 2.391 13.451 5.964 1.00 0.00 H new ATOM 0 HB THR A 7 0.472 12.419 4.858 1.00 0.00 H new ATOM 0 HG1 THR A 7 2.026 11.867 2.924 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.437 14.381 3.671 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.416 14.851 5.161 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.199 15.077 3.579 1.00 0.00 H new ATOM 75 N MET A 8 2.993 11.029 6.141 1.00 0.00 N ATOM 76 CA MET A 8 3.506 9.674 6.307 1.00 0.00 C ATOM 77 C MET A 8 2.463 8.642 5.890 1.00 0.00 C ATOM 78 O MET A 8 1.287 8.967 5.726 1.00 0.00 O ATOM 79 CB MET A 8 3.922 9.438 7.761 1.00 0.00 C ATOM 80 CG MET A 8 5.116 10.272 8.195 1.00 0.00 C ATOM 81 SD MET A 8 6.550 10.040 7.126 1.00 0.00 S ATOM 82 CE MET A 8 7.884 10.202 8.310 1.00 0.00 C ATOM 0 H MET A 8 2.563 11.423 6.978 1.00 0.00 H new ATOM 0 HA MET A 8 4.379 9.562 5.664 1.00 0.00 H new ATOM 0 HB2 MET A 8 3.077 9.661 8.413 1.00 0.00 H new ATOM 0 HB3 MET A 8 4.158 8.383 7.896 1.00 0.00 H new ATOM 0 HG2 MET A 8 4.837 11.326 8.198 1.00 0.00 H new ATOM 0 HG3 MET A 8 5.384 10.010 9.219 1.00 0.00 H new ATOM 0 HE1 MET A 8 8.840 10.082 7.800 1.00 0.00 H new ATOM 0 HE2 MET A 8 7.841 11.187 8.774 1.00 0.00 H new ATOM 0 HE3 MET A 8 7.784 9.435 9.078 1.00 0.00 H new ATOM 92 N ALA A 9 2.901 7.399 5.721 1.00 0.00 N ATOM 93 CA ALA A 9 2.004 6.320 5.325 1.00 0.00 C ATOM 94 C ALA A 9 1.703 5.398 6.501 1.00 0.00 C ATOM 95 O ALA A 9 2.428 5.386 7.497 1.00 0.00 O ATOM 96 CB ALA A 9 2.606 5.530 4.173 1.00 0.00 C ATOM 0 H ALA A 9 3.872 7.114 5.852 1.00 0.00 H new ATOM 0 HA ALA A 9 1.065 6.764 4.995 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.926 4.728 3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.764 6.192 3.321 1.00 0.00 H new ATOM 0 HB3 ALA A 9 3.560 5.104 4.483 1.00 0.00 H new ATOM 102 N THR A 10 0.627 4.625 6.381 1.00 0.00 N ATOM 103 CA THR A 10 0.229 3.701 7.435 1.00 0.00 C ATOM 104 C THR A 10 -0.181 2.351 6.856 1.00 0.00 C ATOM 105 O THR A 10 -1.018 2.279 5.956 1.00 0.00 O ATOM 106 CB THR A 10 -0.939 4.266 8.266 1.00 0.00 C ATOM 107 OG1 THR A 10 -2.008 4.665 7.401 1.00 0.00 O ATOM 108 CG2 THR A 10 -0.484 5.454 9.100 1.00 0.00 C ATOM 0 H THR A 10 0.016 4.621 5.564 1.00 0.00 H new ATOM 0 HA THR A 10 1.095 3.568 8.083 1.00 0.00 H new ATOM 0 HB THR A 10 -1.290 3.483 8.938 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.013 4.096 6.603 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.325 5.836 9.678 1.00 0.00 H new ATOM 0 HG22 THR A 10 0.309 5.140 9.778 1.00 0.00 H new ATOM 0 HG23 THR A 10 -0.110 6.238 8.442 1.00 0.00 H new ATOM 116 N PHE A 11 0.413 1.284 7.379 1.00 0.00 N ATOM 117 CA PHE A 11 0.109 -0.065 6.914 1.00 0.00 C ATOM 118 C PHE A 11 -0.569 -0.879 8.012 1.00 0.00 C ATOM 119 O PHE A 11 -0.336 -0.654 9.199 1.00 0.00 O ATOM 120 CB PHE A 11 1.388 -0.769 6.457 1.00 0.00 C ATOM 121 CG PHE A 11 2.114 -1.474 7.568 1.00 0.00 C ATOM 122 CD1 PHE A 11 3.017 -0.791 8.366 1.00 0.00 C ATOM 123 CD2 PHE A 11 1.892 -2.819 7.814 1.00 0.00 C ATOM 124 CE1 PHE A 11 3.687 -1.437 9.387 1.00 0.00 C ATOM 125 CE2 PHE A 11 2.558 -3.471 8.835 1.00 0.00 C ATOM 126 CZ PHE A 11 3.456 -2.778 9.623 1.00 0.00 C ATOM 0 H PHE A 11 1.107 1.327 8.125 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.576 0.014 6.070 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.138 -1.492 5.681 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.056 -0.035 6.006 1.00 0.00 H new ATOM 0 HD1 PHE A 11 3.199 0.259 8.188 1.00 0.00 H new ATOM 0 HD2 PHE A 11 1.190 -3.365 7.201 1.00 0.00 H new ATOM 0 HE1 PHE A 11 4.391 -0.894 10.000 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.376 -4.520 9.016 1.00 0.00 H new ATOM 0 HZ PHE A 11 3.977 -3.284 10.422 1.00 0.00 H new ATOM 136 N GLU A 12 -1.410 -1.825 7.605 1.00 0.00 N ATOM 137 CA GLU A 12 -2.124 -2.671 8.553 1.00 0.00 C ATOM 138 C GLU A 12 -2.006 -4.142 8.165 1.00 0.00 C ATOM 139 O GLU A 12 -2.189 -4.504 7.003 1.00 0.00 O ATOM 140 CB GLU A 12 -3.598 -2.267 8.623 1.00 0.00 C ATOM 141 CG GLU A 12 -4.442 -3.191 9.485 1.00 0.00 C ATOM 142 CD GLU A 12 -4.062 -3.131 10.951 1.00 0.00 C ATOM 143 OE1 GLU A 12 -4.630 -2.288 11.677 1.00 0.00 O ATOM 144 OE2 GLU A 12 -3.196 -3.925 11.373 1.00 0.00 O ATOM 0 H GLU A 12 -1.613 -2.024 6.625 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.671 -2.534 9.535 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.670 -1.252 9.015 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.009 -2.249 7.614 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.493 -2.925 9.375 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.334 -4.215 9.127 1.00 0.00 H new ATOM 151 N GLU A 13 -1.700 -4.985 9.147 1.00 0.00 N ATOM 152 CA GLU A 13 -1.557 -6.416 8.908 1.00 0.00 C ATOM 153 C GLU A 13 -2.875 -7.144 9.153 1.00 0.00 C ATOM 154 O GLU A 13 -3.447 -7.066 10.241 1.00 0.00 O ATOM 155 CB GLU A 13 -0.465 -6.999 9.807 1.00 0.00 C ATOM 156 CG GLU A 13 0.250 -8.195 9.200 1.00 0.00 C ATOM 157 CD GLU A 13 1.231 -7.798 8.114 1.00 0.00 C ATOM 158 OE1 GLU A 13 1.201 -6.626 7.685 1.00 0.00 O ATOM 159 OE2 GLU A 13 2.029 -8.661 7.693 1.00 0.00 O ATOM 0 H GLU A 13 -1.547 -4.701 10.115 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.273 -6.557 7.865 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.267 -6.222 10.026 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.909 -7.296 10.757 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.781 -8.733 9.985 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.487 -8.882 8.785 1.00 0.00 H new ATOM 166 N VAL A 14 -3.353 -7.851 8.134 1.00 0.00 N ATOM 167 CA VAL A 14 -4.604 -8.593 8.238 1.00 0.00 C ATOM 168 C VAL A 14 -4.414 -10.050 7.832 1.00 0.00 C ATOM 169 O VAL A 14 -4.079 -10.346 6.685 1.00 0.00 O ATOM 170 CB VAL A 14 -5.703 -7.966 7.360 1.00 0.00 C ATOM 171 CG1 VAL A 14 -6.990 -8.771 7.459 1.00 0.00 C ATOM 172 CG2 VAL A 14 -5.940 -6.516 7.758 1.00 0.00 C ATOM 0 H VAL A 14 -2.893 -7.926 7.227 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.913 -8.547 9.282 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.370 -7.985 6.322 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.755 -8.313 6.832 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.808 -9.791 7.122 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.331 -8.786 8.494 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.720 -6.088 7.127 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.252 -6.471 8.801 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -5.018 -5.948 7.630 1.00 0.00 H new ATOM 182 N SER A 15 -4.630 -10.956 8.780 1.00 0.00 N ATOM 183 CA SER A 15 -4.479 -12.383 8.522 1.00 0.00 C ATOM 184 C SER A 15 -5.804 -12.999 8.083 1.00 0.00 C ATOM 185 O SER A 15 -6.835 -12.808 8.728 1.00 0.00 O ATOM 186 CB SER A 15 -3.962 -13.097 9.772 1.00 0.00 C ATOM 187 OG SER A 15 -4.136 -14.499 9.667 1.00 0.00 O ATOM 0 H SER A 15 -4.910 -10.727 9.734 1.00 0.00 H new ATOM 0 HA SER A 15 -3.756 -12.506 7.716 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.906 -12.868 9.915 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.490 -12.727 10.651 1.00 0.00 H new ATOM 0 HG SER A 15 -3.796 -14.932 10.478 1.00 0.00 H new ATOM 193 N VAL A 16 -5.769 -13.739 6.979 1.00 0.00 N ATOM 194 CA VAL A 16 -6.966 -14.384 6.452 1.00 0.00 C ATOM 195 C VAL A 16 -6.624 -15.706 5.774 1.00 0.00 C ATOM 196 O VAL A 16 -5.527 -15.877 5.240 1.00 0.00 O ATOM 197 CB VAL A 16 -7.696 -13.476 5.445 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.240 -12.237 6.139 1.00 0.00 C ATOM 199 CG2 VAL A 16 -6.767 -13.093 4.303 1.00 0.00 C ATOM 0 H VAL A 16 -4.924 -13.907 6.432 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.623 -14.574 7.301 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.538 -14.028 5.028 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.752 -11.608 5.411 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.941 -12.535 6.919 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.417 -11.679 6.585 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.299 -12.451 3.601 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -5.904 -12.559 4.700 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.432 -13.994 3.789 1.00 0.00 H new ATOM 209 N LEU A 17 -7.570 -16.638 5.798 1.00 0.00 N ATOM 210 CA LEU A 17 -7.370 -17.947 5.184 1.00 0.00 C ATOM 211 C LEU A 17 -8.520 -18.288 4.243 1.00 0.00 C ATOM 212 O LEU A 17 -9.653 -18.493 4.678 1.00 0.00 O ATOM 213 CB LEU A 17 -7.242 -19.024 6.263 1.00 0.00 C ATOM 214 CG LEU A 17 -6.412 -20.252 5.890 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.139 -21.106 7.119 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.119 -21.068 4.817 1.00 0.00 C ATOM 0 H LEU A 17 -8.483 -16.512 6.236 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.448 -17.912 4.603 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -6.803 -18.570 7.151 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.243 -19.357 6.537 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.457 -19.913 5.490 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.547 -21.976 6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.590 -20.519 7.855 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.084 -21.436 7.550 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.514 -21.938 4.564 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.089 -21.397 5.190 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.261 -20.454 3.928 1.00 0.00 H new ATOM 228 N GLY A 18 -8.221 -18.350 2.949 1.00 0.00 N ATOM 229 CA GLY A 18 -9.240 -18.669 1.966 1.00 0.00 C ATOM 230 C GLY A 18 -9.757 -17.438 1.247 1.00 0.00 C ATOM 231 O GLY A 18 -9.536 -16.312 1.691 1.00 0.00 O ATOM 0 H GLY A 18 -7.291 -18.185 2.564 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.830 -19.367 1.236 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.071 -19.174 2.459 1.00 0.00 H new ATOM 235 N PHE A 19 -10.447 -17.653 0.131 1.00 0.00 N ATOM 236 CA PHE A 19 -10.995 -16.553 -0.653 1.00 0.00 C ATOM 237 C PHE A 19 -12.146 -15.878 0.087 1.00 0.00 C ATOM 238 O PHE A 19 -12.327 -14.664 -0.003 1.00 0.00 O ATOM 239 CB PHE A 19 -11.476 -17.059 -2.014 1.00 0.00 C ATOM 240 CG PHE A 19 -11.779 -15.958 -2.990 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.919 -15.183 -2.847 1.00 0.00 C ATOM 242 CD2 PHE A 19 -10.925 -15.697 -4.049 1.00 0.00 C ATOM 243 CE1 PHE A 19 -13.201 -14.170 -3.744 1.00 0.00 C ATOM 244 CE2 PHE A 19 -11.201 -14.685 -4.948 1.00 0.00 C ATOM 245 CZ PHE A 19 -12.341 -13.919 -4.795 1.00 0.00 C ATOM 0 H PHE A 19 -10.640 -18.579 -0.250 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.204 -15.819 -0.805 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.714 -17.712 -2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.371 -17.664 -1.872 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.594 -15.373 -2.026 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -10.032 -16.292 -4.173 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -14.094 -13.575 -3.623 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.527 -14.493 -5.769 1.00 0.00 H new ATOM 0 HZ PHE A 19 -12.559 -13.126 -5.495 1.00 0.00 H new ATOM 255 N GLU A 20 -12.920 -16.674 0.817 1.00 0.00 N ATOM 256 CA GLU A 20 -14.054 -16.154 1.572 1.00 0.00 C ATOM 257 C GLU A 20 -13.611 -15.052 2.530 1.00 0.00 C ATOM 258 O GLU A 20 -14.087 -13.920 2.453 1.00 0.00 O ATOM 259 CB GLU A 20 -14.736 -17.280 2.352 1.00 0.00 C ATOM 260 CG GLU A 20 -15.631 -18.159 1.494 1.00 0.00 C ATOM 261 CD GLU A 20 -14.858 -18.925 0.438 1.00 0.00 C ATOM 262 OE1 GLU A 20 -14.007 -19.757 0.813 1.00 0.00 O ATOM 263 OE2 GLU A 20 -15.106 -18.691 -0.763 1.00 0.00 O ATOM 0 H GLU A 20 -12.783 -17.681 0.902 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.766 -15.731 0.863 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -13.972 -17.901 2.820 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.330 -16.846 3.156 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -16.162 -18.864 2.133 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.385 -17.539 1.009 1.00 0.00 H new ATOM 270 N GLU A 21 -12.697 -15.394 3.433 1.00 0.00 N ATOM 271 CA GLU A 21 -12.191 -14.435 4.408 1.00 0.00 C ATOM 272 C GLU A 21 -11.460 -13.289 3.714 1.00 0.00 C ATOM 273 O GLU A 21 -11.564 -12.133 4.125 1.00 0.00 O ATOM 274 CB GLU A 21 -11.253 -15.127 5.399 1.00 0.00 C ATOM 275 CG GLU A 21 -11.956 -16.118 6.312 1.00 0.00 C ATOM 276 CD GLU A 21 -12.595 -15.450 7.515 1.00 0.00 C ATOM 277 OE1 GLU A 21 -11.848 -14.920 8.364 1.00 0.00 O ATOM 278 OE2 GLU A 21 -13.840 -15.459 7.607 1.00 0.00 O ATOM 0 H GLU A 21 -12.292 -16.327 3.509 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.042 -14.025 4.951 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.472 -15.647 4.844 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.760 -14.370 6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -12.722 -16.648 5.746 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.239 -16.864 6.654 1.00 0.00 H new ATOM 285 N PHE A 22 -10.721 -13.619 2.660 1.00 0.00 N ATOM 286 CA PHE A 22 -9.970 -12.619 1.910 1.00 0.00 C ATOM 287 C PHE A 22 -10.889 -11.502 1.423 1.00 0.00 C ATOM 288 O PHE A 22 -10.670 -10.328 1.722 1.00 0.00 O ATOM 289 CB PHE A 22 -9.263 -13.269 0.719 1.00 0.00 C ATOM 290 CG PHE A 22 -8.761 -12.279 -0.293 1.00 0.00 C ATOM 291 CD1 PHE A 22 -8.200 -11.078 0.112 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.849 -12.549 -1.649 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.738 -10.165 -0.818 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.388 -11.641 -2.583 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.831 -10.447 -2.167 1.00 0.00 C ATOM 0 H PHE A 22 -10.626 -14.571 2.306 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.223 -12.187 2.575 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.424 -13.861 1.084 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.951 -13.959 0.230 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -8.123 -10.853 1.165 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.283 -13.481 -1.980 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.305 -9.232 -0.490 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.463 -11.864 -3.637 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.469 -9.736 -2.895 1.00 0.00 H new ATOM 305 N ASP A 23 -11.918 -11.877 0.670 1.00 0.00 N ATOM 306 CA ASP A 23 -12.871 -10.908 0.141 1.00 0.00 C ATOM 307 C ASP A 23 -13.436 -10.036 1.258 1.00 0.00 C ATOM 308 O ASP A 23 -13.525 -8.815 1.123 1.00 0.00 O ATOM 309 CB ASP A 23 -14.008 -11.625 -0.587 1.00 0.00 C ATOM 310 CG ASP A 23 -14.808 -10.691 -1.474 1.00 0.00 C ATOM 311 OD1 ASP A 23 -14.209 -9.752 -2.040 1.00 0.00 O ATOM 312 OD2 ASP A 23 -16.032 -10.900 -1.603 1.00 0.00 O ATOM 0 H ASP A 23 -12.113 -12.844 0.413 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.345 -10.266 -0.566 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.596 -12.432 -1.193 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.672 -12.083 0.145 1.00 0.00 H new ATOM 317 N LYS A 24 -13.817 -10.670 2.361 1.00 0.00 N ATOM 318 CA LYS A 24 -14.373 -9.953 3.503 1.00 0.00 C ATOM 319 C LYS A 24 -13.426 -8.851 3.967 1.00 0.00 C ATOM 320 O LYS A 24 -13.861 -7.757 4.327 1.00 0.00 O ATOM 321 CB LYS A 24 -14.649 -10.922 4.655 1.00 0.00 C ATOM 322 CG LYS A 24 -15.697 -10.422 5.633 1.00 0.00 C ATOM 323 CD LYS A 24 -17.104 -10.620 5.092 1.00 0.00 C ATOM 324 CE LYS A 24 -17.618 -12.023 5.376 1.00 0.00 C ATOM 325 NZ LYS A 24 -18.933 -12.274 4.725 1.00 0.00 N ATOM 0 H LYS A 24 -13.751 -11.680 2.489 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.311 -9.494 3.190 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -14.974 -11.878 4.244 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.720 -11.106 5.194 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.593 -10.950 6.581 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.530 -9.364 5.837 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.774 -9.888 5.542 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.110 -10.440 4.017 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -16.892 -12.754 5.022 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.713 -12.164 6.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.249 -13.241 4.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -19.633 -11.592 5.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.837 -12.165 3.695 1.00 0.00 H new ATOM 339 N ALA A 25 -12.131 -9.146 3.955 1.00 0.00 N ATOM 340 CA ALA A 25 -11.123 -8.179 4.372 1.00 0.00 C ATOM 341 C ALA A 25 -11.067 -6.996 3.411 1.00 0.00 C ATOM 342 O ALA A 25 -11.056 -5.840 3.833 1.00 0.00 O ATOM 343 CB ALA A 25 -9.759 -8.847 4.470 1.00 0.00 C ATOM 0 H ALA A 25 -11.755 -10.047 3.661 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.402 -7.802 5.356 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.016 -8.113 4.782 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -9.801 -9.655 5.201 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.482 -9.252 3.497 1.00 0.00 H new ATOM 349 N VAL A 26 -11.032 -7.293 2.115 1.00 0.00 N ATOM 350 CA VAL A 26 -10.977 -6.254 1.094 1.00 0.00 C ATOM 351 C VAL A 26 -12.161 -5.300 1.217 1.00 0.00 C ATOM 352 O VAL A 26 -11.987 -4.084 1.302 1.00 0.00 O ATOM 353 CB VAL A 26 -10.964 -6.859 -0.322 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.939 -5.759 -1.373 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.778 -7.796 -0.490 1.00 0.00 C ATOM 0 H VAL A 26 -11.041 -8.245 1.748 1.00 0.00 H new ATOM 0 HA VAL A 26 -10.051 -5.702 1.253 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.877 -7.438 -0.459 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -10.930 -6.206 -2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -11.824 -5.132 -1.265 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -10.045 -5.150 -1.241 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.785 -8.214 -1.496 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.852 -7.243 -0.333 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.846 -8.603 0.239 1.00 0.00 H new ATOM 365 N LYS A 27 -13.366 -5.860 1.226 1.00 0.00 N ATOM 366 CA LYS A 27 -14.580 -5.061 1.340 1.00 0.00 C ATOM 367 C LYS A 27 -14.516 -4.145 2.558 1.00 0.00 C ATOM 368 O LYS A 27 -15.115 -3.070 2.569 1.00 0.00 O ATOM 369 CB LYS A 27 -15.807 -5.971 1.436 1.00 0.00 C ATOM 370 CG LYS A 27 -16.264 -6.519 0.096 1.00 0.00 C ATOM 371 CD LYS A 27 -17.492 -7.403 0.244 1.00 0.00 C ATOM 372 CE LYS A 27 -17.108 -8.844 0.545 1.00 0.00 C ATOM 373 NZ LYS A 27 -18.278 -9.760 0.454 1.00 0.00 N ATOM 0 H LYS A 27 -13.528 -6.865 1.156 1.00 0.00 H new ATOM 0 HA LYS A 27 -14.663 -4.442 0.446 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.580 -6.804 2.101 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.627 -5.415 1.890 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -16.489 -5.693 -0.578 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -15.455 -7.091 -0.359 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -18.124 -7.019 1.045 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -18.081 -7.366 -0.672 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -16.338 -9.168 -0.155 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -16.677 -8.904 1.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -17.975 -10.732 0.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -19.003 -9.466 1.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -18.674 -9.723 -0.507 1.00 0.00 H new ATOM 387 N GLU A 28 -13.785 -4.578 3.580 1.00 0.00 N ATOM 388 CA GLU A 28 -13.644 -3.795 4.803 1.00 0.00 C ATOM 389 C GLU A 28 -12.657 -2.648 4.603 1.00 0.00 C ATOM 390 O GLU A 28 -12.784 -1.590 5.222 1.00 0.00 O ATOM 391 CB GLU A 28 -13.178 -4.687 5.955 1.00 0.00 C ATOM 392 CG GLU A 28 -14.318 -5.340 6.719 1.00 0.00 C ATOM 393 CD GLU A 28 -15.125 -4.342 7.526 1.00 0.00 C ATOM 394 OE1 GLU A 28 -14.607 -3.851 8.551 1.00 0.00 O ATOM 395 OE2 GLU A 28 -16.275 -4.052 7.134 1.00 0.00 O ATOM 0 H GLU A 28 -13.282 -5.465 3.586 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.619 -3.375 5.050 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.524 -5.465 5.560 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -12.583 -4.091 6.647 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -14.976 -5.850 6.016 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -13.914 -6.100 7.387 1.00 0.00 H new ATOM 402 N HIS A 29 -11.675 -2.864 3.734 1.00 0.00 N ATOM 403 CA HIS A 29 -10.666 -1.849 3.452 1.00 0.00 C ATOM 404 C HIS A 29 -10.780 -1.356 2.012 1.00 0.00 C ATOM 405 O HIS A 29 -9.773 -1.083 1.359 1.00 0.00 O ATOM 406 CB HIS A 29 -9.265 -2.408 3.703 1.00 0.00 C ATOM 407 CG HIS A 29 -9.174 -3.267 4.926 1.00 0.00 C ATOM 408 ND1 HIS A 29 -9.017 -4.605 5.059 1.00 0.00 N flip ATOM 409 CD2 HIS A 29 -9.245 -2.762 6.207 1.00 0.00 C flip ATOM 410 CE1 HIS A 29 -8.996 -4.881 6.404 1.00 0.00 C flip ATOM 411 NE2 HIS A 29 -9.135 -3.752 7.075 1.00 0.00 N flip ATOM 0 H HIS A 29 -11.556 -3.733 3.213 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.837 -1.006 4.121 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.954 -2.991 2.836 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.564 -1.579 3.798 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -8.930 -5.282 4.301 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -9.371 -1.720 6.461 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -8.884 -5.862 6.842 1.00 0.00 H new ATOM 420 N GLU A 30 -12.012 -1.246 1.524 1.00 0.00 N ATOM 421 CA GLU A 30 -12.255 -0.788 0.162 1.00 0.00 C ATOM 422 C GLU A 30 -12.267 0.737 0.094 1.00 0.00 C ATOM 423 O GLU A 30 -12.993 1.328 -0.705 1.00 0.00 O ATOM 424 CB GLU A 30 -13.583 -1.342 -0.357 1.00 0.00 C ATOM 425 CG GLU A 30 -14.802 -0.720 0.304 1.00 0.00 C ATOM 426 CD GLU A 30 -16.101 -1.357 -0.150 1.00 0.00 C ATOM 427 OE1 GLU A 30 -16.219 -1.674 -1.352 1.00 0.00 O ATOM 428 OE2 GLU A 30 -17.000 -1.539 0.697 1.00 0.00 O ATOM 0 H GLU A 30 -12.856 -1.468 2.052 1.00 0.00 H new ATOM 0 HA GLU A 30 -11.445 -1.156 -0.467 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -13.640 -1.177 -1.433 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -13.604 -2.420 -0.198 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.713 -0.817 1.386 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -14.827 0.347 0.081 1.00 0.00 H new ATOM 435 N SER A 31 -11.457 1.367 0.940 1.00 0.00 N ATOM 436 CA SER A 31 -11.377 2.822 0.980 1.00 0.00 C ATOM 437 C SER A 31 -9.958 3.296 0.684 1.00 0.00 C ATOM 438 O SER A 31 -9.752 4.393 0.164 1.00 0.00 O ATOM 439 CB SER A 31 -11.825 3.341 2.348 1.00 0.00 C ATOM 440 OG SER A 31 -12.894 2.565 2.863 1.00 0.00 O ATOM 0 H SER A 31 -10.848 0.892 1.606 1.00 0.00 H new ATOM 0 HA SER A 31 -12.042 3.219 0.213 1.00 0.00 H new ATOM 0 HB2 SER A 31 -10.986 3.316 3.043 1.00 0.00 H new ATOM 0 HB3 SER A 31 -12.136 4.382 2.261 1.00 0.00 H new ATOM 0 HG SER A 31 -13.161 2.916 3.738 1.00 0.00 H new ATOM 446 N LYS A 32 -8.980 2.462 1.020 1.00 0.00 N ATOM 447 CA LYS A 32 -7.579 2.792 0.790 1.00 0.00 C ATOM 448 C LYS A 32 -6.873 1.673 0.031 1.00 0.00 C ATOM 449 O LYS A 32 -7.463 0.629 -0.248 1.00 0.00 O ATOM 450 CB LYS A 32 -6.868 3.048 2.121 1.00 0.00 C ATOM 451 CG LYS A 32 -7.712 3.817 3.123 1.00 0.00 C ATOM 452 CD LYS A 32 -7.395 3.406 4.551 1.00 0.00 C ATOM 453 CE LYS A 32 -7.660 1.925 4.776 1.00 0.00 C ATOM 454 NZ LYS A 32 -7.853 1.610 6.219 1.00 0.00 N ATOM 0 H LYS A 32 -9.132 1.551 1.453 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.540 3.698 0.185 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.580 2.092 2.559 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.949 3.602 1.932 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.536 4.886 3.004 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -8.769 3.643 2.919 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -6.351 3.628 4.771 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.998 3.994 5.243 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.546 1.625 4.217 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.825 1.343 4.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.031 0.592 6.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.998 1.872 6.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.665 2.146 6.586 1.00 0.00 H new ATOM 468 N THR A 33 -5.604 1.895 -0.298 1.00 0.00 N ATOM 469 CA THR A 33 -4.818 0.906 -1.024 1.00 0.00 C ATOM 470 C THR A 33 -4.834 -0.441 -0.309 1.00 0.00 C ATOM 471 O THR A 33 -4.718 -0.505 0.915 1.00 0.00 O ATOM 472 CB THR A 33 -3.358 1.365 -1.196 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.315 2.604 -1.913 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.545 0.316 -1.939 1.00 0.00 C ATOM 0 H THR A 33 -5.099 2.752 -0.073 1.00 0.00 H new ATOM 0 HA THR A 33 -5.276 0.798 -2.007 1.00 0.00 H new ATOM 0 HB THR A 33 -2.925 1.503 -0.205 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.383 2.890 -2.017 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.517 0.662 -2.048 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.555 -0.618 -1.377 1.00 0.00 H new ATOM 0 HG23 THR A 33 -2.979 0.150 -2.925 1.00 0.00 H new ATOM 482 N ILE A 34 -4.978 -1.513 -1.080 1.00 0.00 N ATOM 483 CA ILE A 34 -5.008 -2.858 -0.520 1.00 0.00 C ATOM 484 C ILE A 34 -3.901 -3.725 -1.111 1.00 0.00 C ATOM 485 O ILE A 34 -3.670 -3.714 -2.320 1.00 0.00 O ATOM 486 CB ILE A 34 -6.366 -3.541 -0.766 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.475 -2.808 -0.008 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.308 -5.003 -0.347 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.862 -3.325 -0.317 1.00 0.00 C ATOM 0 H ILE A 34 -5.076 -1.476 -2.095 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.852 -2.755 0.554 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.590 -3.497 -1.832 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.293 -2.898 1.063 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.429 -1.746 -0.251 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.275 -5.472 -0.527 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.542 -5.518 -0.927 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.065 -5.068 0.714 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.597 -2.759 0.255 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -9.064 -3.210 -1.382 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.926 -4.379 -0.048 1.00 0.00 H new ATOM 501 N PHE A 35 -3.222 -4.476 -0.251 1.00 0.00 N ATOM 502 CA PHE A 35 -2.139 -5.350 -0.688 1.00 0.00 C ATOM 503 C PHE A 35 -2.382 -6.786 -0.233 1.00 0.00 C ATOM 504 O PHE A 35 -2.265 -7.101 0.950 1.00 0.00 O ATOM 505 CB PHE A 35 -0.800 -4.850 -0.143 1.00 0.00 C ATOM 506 CG PHE A 35 -0.217 -3.714 -0.934 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.439 -3.951 -2.132 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.325 -2.409 -0.481 1.00 0.00 C ATOM 509 CE1 PHE A 35 0.977 -2.908 -2.861 1.00 0.00 C ATOM 510 CE2 PHE A 35 0.210 -1.362 -1.207 1.00 0.00 C ATOM 511 CZ PHE A 35 0.861 -1.611 -2.399 1.00 0.00 C ATOM 0 H PHE A 35 -3.402 -4.497 0.753 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.109 -5.333 -1.777 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.934 -4.531 0.891 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.090 -5.677 -0.132 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.531 -4.962 -2.500 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.833 -2.208 0.450 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.488 -3.106 -3.792 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.119 -0.350 -0.842 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.278 -0.794 -2.969 1.00 0.00 H new ATOM 521 N ALA A 36 -2.722 -7.651 -1.183 1.00 0.00 N ATOM 522 CA ALA A 36 -2.981 -9.054 -0.881 1.00 0.00 C ATOM 523 C ALA A 36 -1.741 -9.906 -1.130 1.00 0.00 C ATOM 524 O ALA A 36 -1.161 -9.872 -2.216 1.00 0.00 O ATOM 525 CB ALA A 36 -4.151 -9.565 -1.709 1.00 0.00 C ATOM 0 H ALA A 36 -2.825 -7.405 -2.168 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.237 -9.132 0.176 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.333 -10.614 -1.473 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.042 -8.981 -1.479 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.917 -9.467 -2.769 1.00 0.00 H new ATOM 531 N TYR A 37 -1.341 -10.669 -0.119 1.00 0.00 N ATOM 532 CA TYR A 37 -0.168 -11.528 -0.228 1.00 0.00 C ATOM 533 C TYR A 37 -0.572 -12.999 -0.266 1.00 0.00 C ATOM 534 O TYR A 37 -0.675 -13.654 0.771 1.00 0.00 O ATOM 535 CB TYR A 37 0.783 -11.279 0.943 1.00 0.00 C ATOM 536 CG TYR A 37 2.029 -12.136 0.905 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.914 -12.061 -0.163 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.320 -13.021 1.936 1.00 0.00 C ATOM 539 CE1 TYR A 37 4.053 -12.842 -0.203 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.457 -13.805 1.905 1.00 0.00 C ATOM 541 CZ TYR A 37 4.320 -13.712 0.833 1.00 0.00 C ATOM 542 OH TYR A 37 5.453 -14.492 0.798 1.00 0.00 O ATOM 0 H TYR A 37 -1.812 -10.710 0.785 1.00 0.00 H new ATOM 0 HA TYR A 37 0.343 -11.286 -1.160 1.00 0.00 H new ATOM 0 HB2 TYR A 37 1.075 -10.229 0.946 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.253 -11.465 1.877 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.708 -11.381 -0.976 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.646 -13.097 2.776 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.731 -12.771 -1.041 1.00 0.00 H new ATOM 0 HE2 TYR A 37 3.669 -14.487 2.715 1.00 0.00 H new ATOM 0 HH TYR A 37 5.492 -15.048 1.604 1.00 0.00 H new ATOM 552 N PHE A 38 -0.799 -13.513 -1.471 1.00 0.00 N ATOM 553 CA PHE A 38 -1.192 -14.906 -1.646 1.00 0.00 C ATOM 554 C PHE A 38 0.003 -15.836 -1.457 1.00 0.00 C ATOM 555 O PHE A 38 1.015 -15.713 -2.148 1.00 0.00 O ATOM 556 CB PHE A 38 -1.801 -15.115 -3.034 1.00 0.00 C ATOM 557 CG PHE A 38 -2.780 -14.047 -3.426 1.00 0.00 C ATOM 558 CD1 PHE A 38 -3.959 -13.875 -2.718 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.523 -13.214 -4.503 1.00 0.00 C ATOM 560 CE1 PHE A 38 -4.863 -12.892 -3.076 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.422 -12.229 -4.866 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.594 -12.069 -4.152 1.00 0.00 C ATOM 0 H PHE A 38 -0.717 -12.985 -2.340 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.939 -15.145 -0.889 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.000 -15.151 -3.772 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.302 -16.083 -3.060 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.174 -14.517 -1.876 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.609 -13.336 -5.066 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.778 -12.768 -2.515 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.209 -11.585 -5.707 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.299 -11.301 -4.435 1.00 0.00 H new ATOM 572 N SER A 39 -0.121 -16.766 -0.516 1.00 0.00 N ATOM 573 CA SER A 39 0.949 -17.715 -0.232 1.00 0.00 C ATOM 574 C SER A 39 0.398 -18.973 0.432 1.00 0.00 C ATOM 575 O SER A 39 -0.744 -18.998 0.887 1.00 0.00 O ATOM 576 CB SER A 39 2.005 -17.070 0.667 1.00 0.00 C ATOM 577 OG SER A 39 1.417 -16.523 1.834 1.00 0.00 O ATOM 0 H SER A 39 -0.952 -16.883 0.063 1.00 0.00 H new ATOM 0 HA SER A 39 1.411 -17.998 -1.178 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.752 -17.813 0.947 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.526 -16.286 0.117 1.00 0.00 H new ATOM 0 HG SER A 39 2.021 -16.650 2.595 1.00 0.00 H new ATOM 583 N GLY A 40 1.221 -20.016 0.484 1.00 0.00 N ATOM 584 CA GLY A 40 0.800 -21.263 1.095 1.00 0.00 C ATOM 585 C GLY A 40 0.383 -21.089 2.542 1.00 0.00 C ATOM 586 O GLY A 40 0.754 -20.110 3.188 1.00 0.00 O ATOM 0 H GLY A 40 2.171 -20.019 0.114 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.033 -21.679 0.528 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.615 -21.984 1.039 1.00 0.00 H new ATOM 590 N SER A 41 -0.392 -22.041 3.051 1.00 0.00 N ATOM 591 CA SER A 41 -0.865 -21.986 4.430 1.00 0.00 C ATOM 592 C SER A 41 0.276 -22.255 5.406 1.00 0.00 C ATOM 593 O SER A 41 1.257 -22.918 5.066 1.00 0.00 O ATOM 594 CB SER A 41 -1.988 -23.002 4.647 1.00 0.00 C ATOM 595 OG SER A 41 -1.567 -24.309 4.299 1.00 0.00 O ATOM 0 H SER A 41 -0.706 -22.860 2.530 1.00 0.00 H new ATOM 0 HA SER A 41 -1.251 -20.984 4.617 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.303 -22.984 5.690 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.855 -22.724 4.048 1.00 0.00 H new ATOM 0 HG SER A 41 -1.560 -24.402 3.323 1.00 0.00 H new ATOM 601 N LYS A 42 0.141 -21.737 6.622 1.00 0.00 N ATOM 602 CA LYS A 42 1.158 -21.921 7.650 1.00 0.00 C ATOM 603 C LYS A 42 1.206 -23.373 8.114 1.00 0.00 C ATOM 604 O LYS A 42 0.251 -24.127 7.926 1.00 0.00 O ATOM 605 CB LYS A 42 0.879 -21.003 8.843 1.00 0.00 C ATOM 606 CG LYS A 42 0.866 -19.527 8.484 1.00 0.00 C ATOM 607 CD LYS A 42 0.102 -18.710 9.512 1.00 0.00 C ATOM 608 CE LYS A 42 0.010 -17.247 9.105 1.00 0.00 C ATOM 609 NZ LYS A 42 -0.804 -17.065 7.871 1.00 0.00 N ATOM 0 H LYS A 42 -0.664 -21.186 6.920 1.00 0.00 H new ATOM 0 HA LYS A 42 2.125 -21.663 7.219 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.083 -21.271 9.280 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.636 -21.176 9.608 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.890 -19.160 8.414 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.412 -19.394 7.502 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.901 -19.119 9.631 1.00 0.00 H new ATOM 0 HD3 LYS A 42 0.595 -18.789 10.481 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.430 -16.671 9.919 1.00 0.00 H new ATOM 0 HE3 LYS A 42 1.012 -16.852 8.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.665 -16.103 7.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.507 -17.757 7.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -1.810 -17.208 8.094 1.00 0.00 H new ATOM 623 N ASP A 43 2.323 -23.759 8.722 1.00 0.00 N ATOM 624 CA ASP A 43 2.495 -25.120 9.215 1.00 0.00 C ATOM 625 C ASP A 43 2.156 -25.207 10.700 1.00 0.00 C ATOM 626 O ASP A 43 1.751 -24.220 11.315 1.00 0.00 O ATOM 627 CB ASP A 43 3.929 -25.595 8.977 1.00 0.00 C ATOM 628 CG ASP A 43 4.169 -26.015 7.540 1.00 0.00 C ATOM 629 OD1 ASP A 43 3.568 -25.400 6.635 1.00 0.00 O ATOM 630 OD2 ASP A 43 4.958 -26.958 7.322 1.00 0.00 O ATOM 0 H ASP A 43 3.123 -23.148 8.885 1.00 0.00 H new ATOM 0 HA ASP A 43 1.811 -25.768 8.666 1.00 0.00 H new ATOM 0 HB2 ASP A 43 4.622 -24.795 9.239 1.00 0.00 H new ATOM 0 HB3 ASP A 43 4.145 -26.434 9.639 1.00 0.00 H new ATOM 635 N THR A 44 2.324 -26.396 11.271 1.00 0.00 N ATOM 636 CA THR A 44 2.035 -26.612 12.683 1.00 0.00 C ATOM 637 C THR A 44 2.900 -25.719 13.565 1.00 0.00 C ATOM 638 O THR A 44 2.653 -25.591 14.764 1.00 0.00 O ATOM 639 CB THR A 44 2.260 -28.083 13.083 1.00 0.00 C ATOM 640 OG1 THR A 44 3.643 -28.424 12.935 1.00 0.00 O ATOM 641 CG2 THR A 44 1.409 -29.012 12.231 1.00 0.00 C ATOM 0 H THR A 44 2.659 -27.223 10.777 1.00 0.00 H new ATOM 0 HA THR A 44 0.986 -26.358 12.833 1.00 0.00 H new ATOM 0 HB THR A 44 1.966 -28.202 14.126 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.779 -29.360 13.193 1.00 0.00 H new ATOM 0 HG21 THR A 44 1.585 -30.045 12.532 1.00 0.00 H new ATOM 0 HG22 THR A 44 0.355 -28.769 12.368 1.00 0.00 H new ATOM 0 HG23 THR A 44 1.676 -28.889 11.181 1.00 0.00 H new ATOM 649 N GLU A 45 3.912 -25.103 12.963 1.00 0.00 N ATOM 650 CA GLU A 45 4.814 -24.222 13.696 1.00 0.00 C ATOM 651 C GLU A 45 4.494 -22.757 13.409 1.00 0.00 C ATOM 652 O GLU A 45 5.025 -21.857 14.058 1.00 0.00 O ATOM 653 CB GLU A 45 6.268 -24.520 13.326 1.00 0.00 C ATOM 654 CG GLU A 45 7.252 -24.237 14.448 1.00 0.00 C ATOM 655 CD GLU A 45 6.973 -25.059 15.691 1.00 0.00 C ATOM 656 OE1 GLU A 45 7.081 -26.301 15.616 1.00 0.00 O ATOM 657 OE2 GLU A 45 6.646 -24.462 16.737 1.00 0.00 O ATOM 0 H GLU A 45 4.128 -25.197 11.971 1.00 0.00 H new ATOM 0 HA GLU A 45 4.674 -24.406 14.761 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.353 -25.567 13.035 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.542 -23.924 12.455 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.264 -24.444 14.100 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.213 -23.178 14.701 1.00 0.00 H new ATOM 664 N GLY A 46 3.623 -22.528 12.432 1.00 0.00 N ATOM 665 CA GLY A 46 3.248 -21.172 12.075 1.00 0.00 C ATOM 666 C GLY A 46 4.052 -20.637 10.907 1.00 0.00 C ATOM 667 O GLY A 46 4.269 -19.430 10.794 1.00 0.00 O ATOM 0 H GLY A 46 3.170 -23.257 11.881 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.187 -21.146 11.825 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.388 -20.520 12.938 1.00 0.00 H new ATOM 671 N LYS A 47 4.496 -21.536 10.035 1.00 0.00 N ATOM 672 CA LYS A 47 5.282 -21.148 8.869 1.00 0.00 C ATOM 673 C LYS A 47 4.778 -21.856 7.615 1.00 0.00 C ATOM 674 O LYS A 47 4.442 -23.039 7.651 1.00 0.00 O ATOM 675 CB LYS A 47 6.760 -21.474 9.093 1.00 0.00 C ATOM 676 CG LYS A 47 7.040 -22.960 9.237 1.00 0.00 C ATOM 677 CD LYS A 47 8.484 -23.291 8.900 1.00 0.00 C ATOM 678 CE LYS A 47 8.632 -24.730 8.431 1.00 0.00 C ATOM 679 NZ LYS A 47 9.825 -24.910 7.559 1.00 0.00 N ATOM 0 H LYS A 47 4.325 -22.538 10.113 1.00 0.00 H new ATOM 0 HA LYS A 47 5.172 -20.073 8.728 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.340 -21.083 8.257 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.105 -20.959 9.990 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.822 -23.275 10.258 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.375 -23.522 8.581 1.00 0.00 H new ATOM 0 HD2 LYS A 47 8.841 -22.616 8.123 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.110 -23.127 9.777 1.00 0.00 H new ATOM 0 HE2 LYS A 47 8.713 -25.387 9.297 1.00 0.00 H new ATOM 0 HE3 LYS A 47 7.736 -25.028 7.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.890 -25.904 7.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 9.737 -24.302 6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 10.683 -24.650 8.086 1.00 0.00 H new ATOM 693 N SER A 48 4.731 -21.123 6.507 1.00 0.00 N ATOM 694 CA SER A 48 4.266 -21.680 5.242 1.00 0.00 C ATOM 695 C SER A 48 5.192 -22.797 4.767 1.00 0.00 C ATOM 696 O SER A 48 6.415 -22.656 4.793 1.00 0.00 O ATOM 697 CB SER A 48 4.183 -20.585 4.177 1.00 0.00 C ATOM 698 OG SER A 48 3.016 -19.798 4.345 1.00 0.00 O ATOM 0 H SER A 48 5.009 -20.143 6.460 1.00 0.00 H new ATOM 0 HA SER A 48 3.272 -22.098 5.402 1.00 0.00 H new ATOM 0 HB2 SER A 48 5.066 -19.949 4.235 1.00 0.00 H new ATOM 0 HB3 SER A 48 4.181 -21.037 3.185 1.00 0.00 H new ATOM 0 HG SER A 48 2.374 -20.010 3.636 1.00 0.00 H new ATOM 704 N TRP A 49 4.600 -23.904 4.335 1.00 0.00 N ATOM 705 CA TRP A 49 5.370 -25.045 3.855 1.00 0.00 C ATOM 706 C TRP A 49 6.459 -24.597 2.886 1.00 0.00 C ATOM 707 O TRP A 49 7.614 -25.011 3.001 1.00 0.00 O ATOM 708 CB TRP A 49 4.449 -26.058 3.173 1.00 0.00 C ATOM 709 CG TRP A 49 3.454 -25.427 2.246 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.248 -24.884 2.586 1.00 0.00 C ATOM 711 CD2 TRP A 49 3.580 -25.275 0.828 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.616 -24.405 1.464 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.413 -24.631 0.373 1.00 0.00 C ATOM 714 CE3 TRP A 49 4.566 -25.618 -0.101 1.00 0.00 C ATOM 715 CZ2 TRP A 49 2.207 -24.326 -0.970 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.360 -25.315 -1.433 1.00 0.00 C ATOM 717 CH2 TRP A 49 3.189 -24.674 -1.858 1.00 0.00 C ATOM 0 H TRP A 49 3.589 -24.036 4.307 1.00 0.00 H new ATOM 0 HA TRP A 49 5.846 -25.518 4.714 1.00 0.00 H new ATOM 0 HB2 TRP A 49 5.055 -26.770 2.613 1.00 0.00 H new ATOM 0 HB3 TRP A 49 3.915 -26.624 3.936 1.00 0.00 H new ATOM 0 HD1 TRP A 49 1.850 -24.838 3.589 1.00 0.00 H new ATOM 0 HE1 TRP A 49 0.701 -23.954 1.446 1.00 0.00 H new ATOM 0 HE3 TRP A 49 5.473 -26.111 0.217 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 1.305 -23.832 -1.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 5.115 -25.577 -2.160 1.00 0.00 H new ATOM 0 HH2 TRP A 49 3.059 -24.450 -2.906 1.00 0.00 H new ATOM 728 N CYS A 50 6.086 -23.751 1.933 1.00 0.00 N ATOM 729 CA CYS A 50 7.032 -23.248 0.943 1.00 0.00 C ATOM 730 C CYS A 50 8.211 -22.557 1.621 1.00 0.00 C ATOM 731 O CYS A 50 8.048 -21.753 2.539 1.00 0.00 O ATOM 732 CB CYS A 50 6.336 -22.277 -0.011 1.00 0.00 C ATOM 733 SG CYS A 50 7.324 -21.826 -1.457 1.00 0.00 S ATOM 0 H CYS A 50 5.135 -23.399 1.824 1.00 0.00 H new ATOM 0 HA CYS A 50 7.410 -24.097 0.373 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.401 -22.724 -0.348 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.077 -21.370 0.536 1.00 0.00 H new ATOM 0 HG CYS A 50 6.649 -21.004 -2.204 1.00 0.00 H new ATOM 739 N PRO A 51 9.429 -22.877 1.159 1.00 0.00 N ATOM 740 CA PRO A 51 10.660 -22.299 1.707 1.00 0.00 C ATOM 741 C PRO A 51 10.811 -20.822 1.362 1.00 0.00 C ATOM 742 O PRO A 51 11.106 -19.999 2.229 1.00 0.00 O ATOM 743 CB PRO A 51 11.766 -23.120 1.038 1.00 0.00 C ATOM 744 CG PRO A 51 11.157 -23.613 -0.229 1.00 0.00 C ATOM 745 CD PRO A 51 9.699 -23.828 0.067 1.00 0.00 C ATOM 0 HA PRO A 51 10.679 -22.340 2.796 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.648 -22.511 0.842 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.084 -23.947 1.673 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.289 -22.889 -1.033 1.00 0.00 H new ATOM 0 HG3 PRO A 51 11.630 -24.540 -0.554 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.078 -23.625 -0.805 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.498 -24.856 0.370 1.00 0.00 H new ATOM 753 N ASP A 52 10.605 -20.492 0.092 1.00 0.00 N ATOM 754 CA ASP A 52 10.717 -19.112 -0.367 1.00 0.00 C ATOM 755 C ASP A 52 9.828 -18.190 0.462 1.00 0.00 C ATOM 756 O ASP A 52 10.278 -17.153 0.950 1.00 0.00 O ATOM 757 CB ASP A 52 10.337 -19.012 -1.846 1.00 0.00 C ATOM 758 CG ASP A 52 11.457 -19.464 -2.763 1.00 0.00 C ATOM 759 OD1 ASP A 52 12.634 -19.212 -2.430 1.00 0.00 O ATOM 760 OD2 ASP A 52 11.156 -20.069 -3.812 1.00 0.00 O ATOM 0 H ASP A 52 10.360 -21.161 -0.638 1.00 0.00 H new ATOM 0 HA ASP A 52 11.753 -18.797 -0.243 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.451 -19.619 -2.032 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.072 -17.981 -2.081 1.00 0.00 H new ATOM 765 N CYS A 53 8.566 -18.575 0.617 1.00 0.00 N ATOM 766 CA CYS A 53 7.614 -17.781 1.386 1.00 0.00 C ATOM 767 C CYS A 53 8.189 -17.415 2.750 1.00 0.00 C ATOM 768 O CYS A 53 8.087 -16.270 3.191 1.00 0.00 O ATOM 769 CB CYS A 53 6.303 -18.549 1.560 1.00 0.00 C ATOM 770 SG CYS A 53 5.178 -18.419 0.150 1.00 0.00 S ATOM 0 H CYS A 53 8.178 -19.431 0.221 1.00 0.00 H new ATOM 0 HA CYS A 53 7.417 -16.860 0.837 1.00 0.00 H new ATOM 0 HB2 CYS A 53 6.531 -19.601 1.733 1.00 0.00 H new ATOM 0 HB3 CYS A 53 5.795 -18.182 2.452 1.00 0.00 H new ATOM 0 HG CYS A 53 4.158 -19.203 0.335 1.00 0.00 H new ATOM 776 N VAL A 54 8.791 -18.395 3.416 1.00 0.00 N ATOM 777 CA VAL A 54 9.381 -18.176 4.731 1.00 0.00 C ATOM 778 C VAL A 54 10.543 -17.192 4.655 1.00 0.00 C ATOM 779 O VAL A 54 10.885 -16.543 5.642 1.00 0.00 O ATOM 780 CB VAL A 54 9.880 -19.496 5.349 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.550 -19.238 6.690 1.00 0.00 C ATOM 782 CG2 VAL A 54 8.731 -20.481 5.498 1.00 0.00 C ATOM 0 H VAL A 54 8.883 -19.349 3.066 1.00 0.00 H new ATOM 0 HA VAL A 54 8.597 -17.760 5.364 1.00 0.00 H new ATOM 0 HB VAL A 54 10.620 -19.934 4.679 1.00 0.00 H new ATOM 0 HG11 VAL A 54 10.896 -20.182 7.111 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.400 -18.570 6.550 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.835 -18.777 7.371 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.101 -21.408 5.936 1.00 0.00 H new ATOM 0 HG22 VAL A 54 7.967 -20.053 6.147 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.301 -20.689 4.518 1.00 0.00 H new ATOM 792 N GLU A 55 11.147 -17.088 3.475 1.00 0.00 N ATOM 793 CA GLU A 55 12.272 -16.183 3.270 1.00 0.00 C ATOM 794 C GLU A 55 11.809 -14.874 2.638 1.00 0.00 C ATOM 795 O GLU A 55 12.559 -13.900 2.580 1.00 0.00 O ATOM 796 CB GLU A 55 13.332 -16.843 2.386 1.00 0.00 C ATOM 797 CG GLU A 55 14.613 -16.034 2.265 1.00 0.00 C ATOM 798 CD GLU A 55 15.633 -16.690 1.354 1.00 0.00 C ATOM 799 OE1 GLU A 55 15.223 -17.459 0.460 1.00 0.00 O ATOM 800 OE2 GLU A 55 16.841 -16.434 1.537 1.00 0.00 O ATOM 0 H GLU A 55 10.876 -17.619 2.647 1.00 0.00 H new ATOM 0 HA GLU A 55 12.709 -15.961 4.244 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.570 -17.826 2.791 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.916 -17.001 1.391 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.376 -15.041 1.884 1.00 0.00 H new ATOM 0 HG3 GLU A 55 15.049 -15.900 3.255 1.00 0.00 H new ATOM 807 N ALA A 56 10.568 -14.860 2.163 1.00 0.00 N ATOM 808 CA ALA A 56 10.003 -13.671 1.536 1.00 0.00 C ATOM 809 C ALA A 56 9.094 -12.919 2.502 1.00 0.00 C ATOM 810 O ALA A 56 8.859 -11.722 2.342 1.00 0.00 O ATOM 811 CB ALA A 56 9.238 -14.051 0.277 1.00 0.00 C ATOM 0 H ALA A 56 9.935 -15.659 2.200 1.00 0.00 H new ATOM 0 HA ALA A 56 10.825 -13.010 1.263 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.822 -13.154 -0.181 1.00 0.00 H new ATOM 0 HB2 ALA A 56 9.914 -14.537 -0.427 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.430 -14.735 0.535 1.00 0.00 H new ATOM 817 N GLU A 57 8.587 -13.630 3.504 1.00 0.00 N ATOM 818 CA GLU A 57 7.702 -13.029 4.495 1.00 0.00 C ATOM 819 C GLU A 57 8.360 -11.815 5.146 1.00 0.00 C ATOM 820 O GLU A 57 7.792 -10.724 5.199 1.00 0.00 O ATOM 821 CB GLU A 57 7.327 -14.055 5.567 1.00 0.00 C ATOM 822 CG GLU A 57 5.891 -13.935 6.048 1.00 0.00 C ATOM 823 CD GLU A 57 5.558 -14.927 7.145 1.00 0.00 C ATOM 824 OE1 GLU A 57 5.845 -16.129 6.966 1.00 0.00 O ATOM 825 OE2 GLU A 57 5.011 -14.501 8.184 1.00 0.00 O ATOM 0 H GLU A 57 8.774 -14.622 3.651 1.00 0.00 H new ATOM 0 HA GLU A 57 6.797 -12.701 3.984 1.00 0.00 H new ATOM 0 HB2 GLU A 57 7.486 -15.058 5.170 1.00 0.00 H new ATOM 0 HB3 GLU A 57 7.997 -13.940 6.419 1.00 0.00 H new ATOM 0 HG2 GLU A 57 5.718 -12.923 6.414 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.216 -14.090 5.206 1.00 0.00 H new ATOM 832 N PRO A 58 9.585 -12.009 5.656 1.00 0.00 N ATOM 833 CA PRO A 58 10.347 -10.943 6.313 1.00 0.00 C ATOM 834 C PRO A 58 10.817 -9.876 5.330 1.00 0.00 C ATOM 835 O PRO A 58 11.207 -8.779 5.728 1.00 0.00 O ATOM 836 CB PRO A 58 11.545 -11.682 6.914 1.00 0.00 C ATOM 837 CG PRO A 58 11.708 -12.895 6.064 1.00 0.00 C ATOM 838 CD PRO A 58 10.322 -13.284 5.629 1.00 0.00 C ATOM 0 HA PRO A 58 9.747 -10.407 7.048 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.442 -11.063 6.896 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.363 -11.950 7.955 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.343 -12.686 5.203 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.183 -13.702 6.622 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.323 -13.726 4.633 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.880 -14.018 6.303 1.00 0.00 H new ATOM 846 N VAL A 59 10.778 -10.206 4.042 1.00 0.00 N ATOM 847 CA VAL A 59 11.199 -9.275 3.002 1.00 0.00 C ATOM 848 C VAL A 59 10.046 -8.377 2.568 1.00 0.00 C ATOM 849 O VAL A 59 10.256 -7.237 2.154 1.00 0.00 O ATOM 850 CB VAL A 59 11.746 -10.020 1.770 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.418 -9.048 0.812 1.00 0.00 C ATOM 852 CG2 VAL A 59 12.712 -11.115 2.196 1.00 0.00 C ATOM 0 H VAL A 59 10.459 -11.111 3.695 1.00 0.00 H new ATOM 0 HA VAL A 59 11.992 -8.662 3.429 1.00 0.00 H new ATOM 0 HB VAL A 59 10.910 -10.486 1.249 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.798 -9.593 -0.052 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.694 -8.303 0.482 1.00 0.00 H new ATOM 0 HG13 VAL A 59 13.244 -8.550 1.319 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.089 -11.631 1.313 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.546 -10.673 2.741 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.194 -11.827 2.839 1.00 0.00 H new ATOM 862 N ILE A 60 8.828 -8.899 2.667 1.00 0.00 N ATOM 863 CA ILE A 60 7.640 -8.144 2.287 1.00 0.00 C ATOM 864 C ILE A 60 7.108 -7.329 3.461 1.00 0.00 C ATOM 865 O ILE A 60 6.842 -6.134 3.331 1.00 0.00 O ATOM 866 CB ILE A 60 6.524 -9.071 1.772 1.00 0.00 C ATOM 867 CG1 ILE A 60 6.999 -9.838 0.536 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.272 -8.268 1.454 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.881 -10.528 -0.214 1.00 0.00 C ATOM 0 H ILE A 60 8.638 -9.842 3.007 1.00 0.00 H new ATOM 0 HA ILE A 60 7.938 -7.469 1.485 1.00 0.00 H new ATOM 0 HB ILE A 60 6.281 -9.791 2.553 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.505 -9.147 -0.138 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.735 -10.582 0.841 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.492 -8.938 1.091 1.00 0.00 H new ATOM 0 HG22 ILE A 60 4.925 -7.762 2.355 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.500 -7.527 0.687 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.291 -11.051 -1.078 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.389 -11.244 0.444 1.00 0.00 H new ATOM 0 HD13 ILE A 60 5.156 -9.786 -0.550 1.00 0.00 H new ATOM 881 N ARG A 61 6.955 -7.984 4.607 1.00 0.00 N ATOM 882 CA ARG A 61 6.454 -7.321 5.805 1.00 0.00 C ATOM 883 C ARG A 61 7.344 -6.142 6.186 1.00 0.00 C ATOM 884 O ARG A 61 6.891 -5.190 6.821 1.00 0.00 O ATOM 885 CB ARG A 61 6.377 -8.312 6.968 1.00 0.00 C ATOM 886 CG ARG A 61 5.297 -7.976 7.984 1.00 0.00 C ATOM 887 CD ARG A 61 4.883 -9.202 8.783 1.00 0.00 C ATOM 888 NE ARG A 61 4.442 -8.854 10.131 1.00 0.00 N ATOM 889 CZ ARG A 61 5.270 -8.491 11.104 1.00 0.00 C ATOM 890 NH1 ARG A 61 6.575 -8.430 10.880 1.00 0.00 N ATOM 891 NH2 ARG A 61 4.793 -8.189 12.305 1.00 0.00 N ATOM 0 H ARG A 61 7.171 -8.973 4.731 1.00 0.00 H new ATOM 0 HA ARG A 61 5.454 -6.945 5.590 1.00 0.00 H new ATOM 0 HB2 ARG A 61 6.193 -9.311 6.572 1.00 0.00 H new ATOM 0 HB3 ARG A 61 7.342 -8.342 7.473 1.00 0.00 H new ATOM 0 HG2 ARG A 61 5.661 -7.204 8.662 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.428 -7.565 7.470 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.079 -9.720 8.261 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.722 -9.895 8.844 1.00 0.00 H new ATOM 0 HE ARG A 61 3.444 -8.892 10.336 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.946 -8.662 9.959 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.209 -8.151 11.629 1.00 0.00 H new ATOM 0 HH21 ARG A 61 3.789 -8.236 12.482 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.430 -7.910 13.051 1.00 0.00 H new ATOM 905 N GLU A 62 8.613 -6.214 5.795 1.00 0.00 N ATOM 906 CA GLU A 62 9.566 -5.152 6.097 1.00 0.00 C ATOM 907 C GLU A 62 9.419 -3.993 5.116 1.00 0.00 C ATOM 908 O GLU A 62 9.408 -2.828 5.511 1.00 0.00 O ATOM 909 CB GLU A 62 10.997 -5.694 6.052 1.00 0.00 C ATOM 910 CG GLU A 62 11.340 -6.604 7.220 1.00 0.00 C ATOM 911 CD GLU A 62 11.431 -5.855 8.535 1.00 0.00 C ATOM 912 OE1 GLU A 62 12.363 -5.038 8.689 1.00 0.00 O ATOM 913 OE2 GLU A 62 10.572 -6.087 9.411 1.00 0.00 O ATOM 0 H GLU A 62 9.004 -6.996 5.269 1.00 0.00 H new ATOM 0 HA GLU A 62 9.355 -4.784 7.101 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.140 -6.242 5.121 1.00 0.00 H new ATOM 0 HB3 GLU A 62 11.694 -4.856 6.038 1.00 0.00 H new ATOM 0 HG2 GLU A 62 10.584 -7.384 7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.290 -7.100 7.022 1.00 0.00 H new ATOM 920 N GLY A 63 9.306 -4.322 3.832 1.00 0.00 N ATOM 921 CA GLY A 63 9.161 -3.298 2.814 1.00 0.00 C ATOM 922 C GLY A 63 7.901 -2.475 2.994 1.00 0.00 C ATOM 923 O GLY A 63 7.886 -1.278 2.706 1.00 0.00 O ATOM 0 H GLY A 63 9.312 -5.279 3.479 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.029 -2.639 2.840 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.147 -3.767 1.830 1.00 0.00 H new ATOM 927 N LEU A 64 6.840 -3.118 3.469 1.00 0.00 N ATOM 928 CA LEU A 64 5.567 -2.438 3.686 1.00 0.00 C ATOM 929 C LEU A 64 5.770 -1.136 4.454 1.00 0.00 C ATOM 930 O LEU A 64 4.962 -0.212 4.356 1.00 0.00 O ATOM 931 CB LEU A 64 4.603 -3.348 4.448 1.00 0.00 C ATOM 932 CG LEU A 64 3.772 -4.308 3.596 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.284 -5.480 4.434 1.00 0.00 C ATOM 934 CD2 LEU A 64 2.598 -3.578 2.961 1.00 0.00 C ATOM 0 H LEU A 64 6.836 -4.109 3.711 1.00 0.00 H new ATOM 0 HA LEU A 64 5.139 -2.201 2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.178 -3.935 5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.921 -2.721 5.023 1.00 0.00 H new ATOM 0 HG LEU A 64 4.406 -4.697 2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.694 -6.152 3.811 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.140 -6.019 4.840 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.667 -5.110 5.253 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.018 -4.277 2.358 1.00 0.00 H new ATOM 0 HD22 LEU A 64 1.964 -3.160 3.743 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.970 -2.774 2.326 1.00 0.00 H new ATOM 946 N LYS A 65 6.855 -1.068 5.218 1.00 0.00 N ATOM 947 CA LYS A 65 7.167 0.122 6.001 1.00 0.00 C ATOM 948 C LYS A 65 7.610 1.268 5.097 1.00 0.00 C ATOM 949 O LYS A 65 7.261 2.426 5.330 1.00 0.00 O ATOM 950 CB LYS A 65 8.264 -0.188 7.022 1.00 0.00 C ATOM 951 CG LYS A 65 7.729 -0.644 8.369 1.00 0.00 C ATOM 952 CD LYS A 65 7.592 0.519 9.337 1.00 0.00 C ATOM 953 CE LYS A 65 6.326 1.320 9.070 1.00 0.00 C ATOM 954 NZ LYS A 65 6.194 2.475 10.000 1.00 0.00 N ATOM 0 H LYS A 65 7.534 -1.824 5.312 1.00 0.00 H new ATOM 0 HA LYS A 65 6.263 0.427 6.528 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.916 -0.962 6.618 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.877 0.702 7.166 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.759 -1.122 8.233 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.397 -1.394 8.792 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.577 0.143 10.360 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.461 1.171 9.250 1.00 0.00 H new ATOM 0 HE2 LYS A 65 6.335 1.681 8.042 1.00 0.00 H new ATOM 0 HE3 LYS A 65 5.457 0.670 9.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 5.319 2.995 9.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.160 2.129 10.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.011 3.109 9.885 1.00 0.00 H new ATOM 968 N HIS A 66 8.378 0.938 4.063 1.00 0.00 N ATOM 969 CA HIS A 66 8.866 1.940 3.122 1.00 0.00 C ATOM 970 C HIS A 66 7.708 2.580 2.362 1.00 0.00 C ATOM 971 O HIS A 66 7.832 3.690 1.842 1.00 0.00 O ATOM 972 CB HIS A 66 9.851 1.309 2.138 1.00 0.00 C ATOM 973 CG HIS A 66 11.128 0.856 2.776 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.337 1.484 2.569 1.00 0.00 N ATOM 975 CD2 HIS A 66 11.379 -0.170 3.622 1.00 0.00 C ATOM 976 CE1 HIS A 66 13.278 0.864 3.258 1.00 0.00 C ATOM 977 NE2 HIS A 66 12.722 -0.144 3.907 1.00 0.00 N ATOM 0 H HIS A 66 8.676 -0.015 3.856 1.00 0.00 H new ATOM 0 HA HIS A 66 9.379 2.717 3.689 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.373 0.456 1.655 1.00 0.00 H new ATOM 0 HB3 HIS A 66 10.082 2.031 1.355 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.657 -0.878 4.002 1.00 0.00 H new ATOM 0 HE1 HIS A 66 14.323 1.135 3.286 1.00 0.00 H new ATOM 0 HE2 HIS A 66 13.211 -0.797 4.520 1.00 0.00 H new ATOM 986 N VAL A 67 6.584 1.874 2.301 1.00 0.00 N ATOM 987 CA VAL A 67 5.404 2.374 1.604 1.00 0.00 C ATOM 988 C VAL A 67 5.144 3.837 1.944 1.00 0.00 C ATOM 989 O VAL A 67 5.364 4.272 3.075 1.00 0.00 O ATOM 990 CB VAL A 67 4.153 1.546 1.954 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.581 1.984 3.293 1.00 0.00 C ATOM 992 CG2 VAL A 67 3.110 1.667 0.854 1.00 0.00 C ATOM 0 H VAL A 67 6.465 0.954 2.725 1.00 0.00 H new ATOM 0 HA VAL A 67 5.604 2.283 0.536 1.00 0.00 H new ATOM 0 HB VAL A 67 4.442 0.498 2.035 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.698 1.388 3.524 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.329 1.841 4.073 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.305 3.037 3.244 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.233 1.076 1.118 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.822 2.712 0.739 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.526 1.300 -0.084 1.00 0.00 H new ATOM 1002 N THR A 68 4.673 4.593 0.958 1.00 0.00 N ATOM 1003 CA THR A 68 4.383 6.008 1.152 1.00 0.00 C ATOM 1004 C THR A 68 2.914 6.311 0.878 1.00 0.00 C ATOM 1005 O THR A 68 2.570 7.401 0.423 1.00 0.00 O ATOM 1006 CB THR A 68 5.255 6.891 0.239 1.00 0.00 C ATOM 1007 OG1 THR A 68 5.231 8.246 0.701 1.00 0.00 O ATOM 1008 CG2 THR A 68 4.766 6.831 -1.200 1.00 0.00 C ATOM 0 H THR A 68 4.484 4.249 0.017 1.00 0.00 H new ATOM 0 HA THR A 68 4.611 6.237 2.193 1.00 0.00 H new ATOM 0 HB THR A 68 6.277 6.514 0.274 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.302 8.546 0.788 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.397 7.462 -1.825 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.813 5.803 -1.558 1.00 0.00 H new ATOM 0 HG23 THR A 68 3.736 7.185 -1.249 1.00 0.00 H new ATOM 1016 N GLU A 69 2.052 5.339 1.160 1.00 0.00 N ATOM 1017 CA GLU A 69 0.619 5.503 0.943 1.00 0.00 C ATOM 1018 C GLU A 69 -0.180 4.617 1.895 1.00 0.00 C ATOM 1019 O GLU A 69 0.087 3.422 2.019 1.00 0.00 O ATOM 1020 CB GLU A 69 0.258 5.169 -0.506 1.00 0.00 C ATOM 1021 CG GLU A 69 0.603 3.744 -0.906 1.00 0.00 C ATOM 1022 CD GLU A 69 0.596 3.542 -2.409 1.00 0.00 C ATOM 1023 OE1 GLU A 69 -0.014 4.372 -3.115 1.00 0.00 O ATOM 1024 OE2 GLU A 69 1.201 2.556 -2.878 1.00 0.00 O ATOM 0 H GLU A 69 2.320 4.431 1.539 1.00 0.00 H new ATOM 0 HA GLU A 69 0.364 6.544 1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.810 5.330 -0.652 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.778 5.860 -1.170 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.587 3.489 -0.513 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.110 3.059 -0.448 1.00 0.00 H new ATOM 1031 N ASP A 70 -1.160 5.213 2.565 1.00 0.00 N ATOM 1032 CA ASP A 70 -1.999 4.479 3.506 1.00 0.00 C ATOM 1033 C ASP A 70 -2.639 3.268 2.833 1.00 0.00 C ATOM 1034 O ASP A 70 -3.606 3.402 2.082 1.00 0.00 O ATOM 1035 CB ASP A 70 -3.084 5.394 4.075 1.00 0.00 C ATOM 1036 CG ASP A 70 -3.723 6.266 3.012 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -3.168 7.345 2.718 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -4.779 5.869 2.475 1.00 0.00 O ATOM 0 H ASP A 70 -1.393 6.202 2.474 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.367 4.127 4.321 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.853 4.787 4.553 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.651 6.028 4.849 1.00 0.00 H new ATOM 1043 N CYS A 71 -2.092 2.089 3.107 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.608 0.854 2.527 1.00 0.00 C ATOM 1045 C CYS A 71 -2.922 -0.168 3.615 1.00 0.00 C ATOM 1046 O CYS A 71 -2.592 0.032 4.784 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.599 0.270 1.537 1.00 0.00 C ATOM 1048 SG CYS A 71 -0.113 -0.408 2.313 1.00 0.00 S ATOM 0 H CYS A 71 -1.292 1.962 3.727 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.531 1.089 1.997 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.086 -0.516 0.960 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.305 1.048 0.832 1.00 0.00 H new ATOM 0 HG CYS A 71 0.422 -1.293 1.526 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.564 -1.264 3.222 1.00 0.00 N ATOM 1055 CA VAL A 72 -3.923 -2.318 4.164 1.00 0.00 C ATOM 1056 C VAL A 72 -3.423 -3.676 3.686 1.00 0.00 C ATOM 1057 O VAL A 72 -3.951 -4.243 2.729 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.448 -2.389 4.372 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -5.793 -3.406 5.448 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -6.001 -1.017 4.726 1.00 0.00 C ATOM 0 H VAL A 72 -3.846 -1.445 2.259 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.445 -2.071 5.112 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.910 -2.712 3.439 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.874 -3.442 5.581 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.431 -4.390 5.148 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.321 -3.116 6.387 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.079 -1.085 4.869 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.534 -0.663 5.645 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.786 -0.318 3.917 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.401 -4.194 4.359 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.828 -5.487 4.002 1.00 0.00 C ATOM 1072 C PHE A 73 -2.769 -6.624 4.388 1.00 0.00 C ATOM 1073 O PHE A 73 -3.415 -6.581 5.435 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.474 -5.676 4.690 1.00 0.00 C ATOM 1075 CG PHE A 73 0.238 -6.932 4.278 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.792 -7.047 3.013 1.00 0.00 C ATOM 1077 CD2 PHE A 73 0.353 -7.999 5.156 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.447 -8.203 2.632 1.00 0.00 C ATOM 1079 CE2 PHE A 73 1.008 -9.157 4.779 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.556 -9.259 3.516 1.00 0.00 C ATOM 0 H PHE A 73 -1.953 -3.739 5.154 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.685 -5.507 2.922 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.161 -4.818 4.467 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.623 -5.690 5.770 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.711 -6.225 2.317 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -0.074 -7.925 6.145 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.874 -8.281 1.643 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.091 -9.981 5.472 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.069 -10.162 3.220 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.842 -7.639 3.533 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.704 -8.788 3.784 1.00 0.00 C ATOM 1092 C ILE A 74 -2.997 -10.093 3.431 1.00 0.00 C ATOM 1093 O ILE A 74 -2.776 -10.393 2.258 1.00 0.00 O ATOM 1094 CB ILE A 74 -5.015 -8.694 2.982 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.720 -7.367 3.270 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -5.925 -9.867 3.315 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -6.892 -7.094 2.354 1.00 0.00 C ATOM 0 H ILE A 74 -2.315 -7.689 2.661 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.938 -8.781 4.849 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.777 -8.734 1.919 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -6.069 -7.367 4.303 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -4.999 -6.554 3.177 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.848 -9.786 2.740 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.422 -10.801 3.064 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.159 -9.855 4.380 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.343 -6.137 2.616 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.546 -7.061 1.321 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.632 -7.886 2.464 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.647 -10.865 4.454 1.00 0.00 N ATOM 1110 CA TYR A 75 -1.965 -12.137 4.252 1.00 0.00 C ATOM 1111 C TYR A 75 -2.966 -13.251 3.958 1.00 0.00 C ATOM 1112 O TYR A 75 -3.442 -13.929 4.869 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.134 -12.496 5.485 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.125 -13.594 5.237 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.526 -14.919 5.116 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.230 -13.307 5.124 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.392 -15.926 4.890 1.00 0.00 C ATOM 1118 CE2 TYR A 75 2.155 -14.308 4.896 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.732 -15.615 4.780 1.00 0.00 C ATOM 1120 OH TYR A 75 2.650 -16.615 4.555 1.00 0.00 O ATOM 0 H TYR A 75 -2.824 -10.632 5.431 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.302 -12.032 3.393 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.611 -11.605 5.832 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.804 -12.805 6.287 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.574 -15.166 5.200 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.566 -12.285 5.216 1.00 0.00 H new ATOM 0 HE1 TYR A 75 0.063 -16.951 4.800 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.204 -14.068 4.809 1.00 0.00 H new ATOM 0 HH TYR A 75 3.549 -16.228 4.502 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.278 -13.434 2.680 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.222 -14.465 2.264 1.00 0.00 C ATOM 1132 C CYS A 76 -3.500 -15.775 1.966 1.00 0.00 C ATOM 1133 O CYS A 76 -2.553 -15.807 1.181 1.00 0.00 O ATOM 1134 CB CYS A 76 -5.001 -14.005 1.030 1.00 0.00 C ATOM 1135 SG CYS A 76 -6.249 -15.185 0.463 1.00 0.00 S ATOM 0 H CYS A 76 -2.891 -12.882 1.914 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.921 -14.635 3.083 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.489 -13.056 1.254 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.298 -13.818 0.218 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.855 -14.706 -0.583 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.954 -16.852 2.598 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.349 -18.164 2.402 1.00 0.00 C ATOM 1143 C GLN A 77 -4.105 -18.959 1.342 1.00 0.00 C ATOM 1144 O GLN A 77 -5.276 -19.294 1.520 1.00 0.00 O ATOM 1145 CB GLN A 77 -3.327 -18.941 3.720 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.354 -18.377 4.743 1.00 0.00 C ATOM 1147 CD GLN A 77 -2.688 -18.799 6.160 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -2.128 -19.764 6.681 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -3.605 -18.076 6.793 1.00 0.00 N ATOM 0 H GLN A 77 -4.738 -16.842 3.250 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.325 -18.017 2.058 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.330 -18.943 4.147 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -3.065 -19.979 3.516 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.344 -18.706 4.498 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.358 -17.289 4.681 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -4.044 -17.284 6.323 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.870 -18.313 7.749 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.427 -19.257 0.238 1.00 0.00 N ATOM 1159 CA VAL A 78 -4.034 -20.013 -0.851 1.00 0.00 C ATOM 1160 C VAL A 78 -4.591 -21.342 -0.353 1.00 0.00 C ATOM 1161 O VAL A 78 -5.692 -21.744 -0.727 1.00 0.00 O ATOM 1162 CB VAL A 78 -3.020 -20.284 -1.979 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.548 -18.978 -2.597 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -1.843 -21.092 -1.454 1.00 0.00 C ATOM 0 H VAL A 78 -2.457 -18.986 0.074 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.849 -19.405 -1.243 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.514 -20.868 -2.756 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.832 -19.189 -3.392 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.402 -18.442 -3.011 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.071 -18.365 -1.832 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -1.137 -21.274 -2.264 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.347 -20.537 -0.658 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.201 -22.045 -1.063 1.00 0.00 H new ATOM 1174 N GLY A 79 -3.823 -22.020 0.494 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.257 -23.297 1.029 1.00 0.00 C ATOM 1176 C GLY A 79 -3.097 -24.227 1.324 1.00 0.00 C ATOM 1177 O GLY A 79 -2.002 -23.776 1.663 1.00 0.00 O ATOM 0 H GLY A 79 -2.908 -21.708 0.819 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.826 -23.130 1.944 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.930 -23.775 0.318 1.00 0.00 H new ATOM 1181 N ASP A 80 -3.336 -25.527 1.198 1.00 0.00 N ATOM 1182 CA ASP A 80 -2.302 -26.523 1.454 1.00 0.00 C ATOM 1183 C ASP A 80 -1.321 -26.600 0.288 1.00 0.00 C ATOM 1184 O ASP A 80 -1.561 -26.034 -0.778 1.00 0.00 O ATOM 1185 CB ASP A 80 -2.934 -27.895 1.696 1.00 0.00 C ATOM 1186 CG ASP A 80 -4.155 -27.820 2.592 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -4.064 -27.190 3.666 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -5.201 -28.392 2.219 1.00 0.00 O ATOM 0 H ASP A 80 -4.237 -25.916 0.920 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.755 -26.221 2.347 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.215 -28.336 0.740 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.196 -28.557 2.148 1.00 0.00 H new ATOM 1193 N LYS A 81 -0.213 -27.304 0.499 1.00 0.00 N ATOM 1194 CA LYS A 81 0.805 -27.456 -0.533 1.00 0.00 C ATOM 1195 C LYS A 81 0.212 -28.070 -1.797 1.00 0.00 C ATOM 1196 O LYS A 81 0.260 -27.488 -2.880 1.00 0.00 O ATOM 1197 CB LYS A 81 1.954 -28.327 -0.020 1.00 0.00 C ATOM 1198 CG LYS A 81 2.619 -29.157 -1.105 1.00 0.00 C ATOM 1199 CD LYS A 81 3.922 -29.769 -0.618 1.00 0.00 C ATOM 1200 CE LYS A 81 4.908 -29.961 -1.760 1.00 0.00 C ATOM 1201 NZ LYS A 81 4.630 -31.205 -2.530 1.00 0.00 N ATOM 0 H LYS A 81 0.002 -27.778 1.376 1.00 0.00 H new ATOM 0 HA LYS A 81 1.189 -26.466 -0.778 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.703 -27.688 0.447 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.576 -28.993 0.755 1.00 0.00 H new ATOM 0 HG2 LYS A 81 1.942 -29.948 -1.426 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.813 -28.531 -1.976 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.365 -29.126 0.143 1.00 0.00 H new ATOM 0 HD3 LYS A 81 3.720 -30.730 -0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.861 -29.102 -2.429 1.00 0.00 H new ATOM 0 HE3 LYS A 81 5.922 -29.999 -1.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 5.324 -31.299 -3.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 4.700 -32.028 -1.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 3.672 -31.158 -2.932 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.363 -29.274 -1.657 1.00 0.00 N ATOM 1216 CA PRO A 82 -0.978 -29.992 -2.777 1.00 0.00 C ATOM 1217 C PRO A 82 -2.263 -29.326 -3.257 1.00 0.00 C ATOM 1218 O PRO A 82 -2.822 -29.703 -4.287 1.00 0.00 O ATOM 1219 CB PRO A 82 -1.280 -31.374 -2.189 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.410 -31.142 -0.723 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.457 -30.026 -0.394 1.00 0.00 C ATOM 0 HA PRO A 82 -0.327 -30.018 -3.651 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.197 -31.790 -2.607 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.480 -32.081 -2.408 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.433 -30.872 -0.460 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.164 -32.043 -0.162 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.833 -29.403 0.418 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.515 -30.407 -0.080 1.00 0.00 H new ATOM 1229 N TYR A 83 -2.727 -28.334 -2.504 1.00 0.00 N ATOM 1230 CA TYR A 83 -3.947 -27.617 -2.852 1.00 0.00 C ATOM 1231 C TYR A 83 -3.652 -26.480 -3.827 1.00 0.00 C ATOM 1232 O TYR A 83 -4.445 -26.196 -4.724 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.615 -27.062 -1.593 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.724 -26.075 -1.879 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -5.438 -24.766 -2.247 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -7.058 -26.452 -1.783 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -6.448 -23.861 -2.509 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -8.074 -25.554 -2.045 1.00 0.00 C ATOM 1239 CZ TYR A 83 -7.764 -24.260 -2.407 1.00 0.00 C ATOM 1240 OH TYR A 83 -8.773 -23.361 -2.668 1.00 0.00 O ATOM 0 H TYR A 83 -2.276 -28.009 -1.649 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.625 -28.320 -3.335 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.019 -27.891 -1.011 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.859 -26.577 -0.975 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.408 -24.451 -2.330 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.304 -27.464 -1.499 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.208 -22.847 -2.792 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -9.106 -25.864 -1.967 1.00 0.00 H new ATOM 0 HH TYR A 83 -9.641 -23.801 -2.552 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.506 -25.835 -3.642 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.104 -24.730 -4.505 1.00 0.00 C ATOM 1252 C TRP A 84 -2.057 -25.168 -5.965 1.00 0.00 C ATOM 1253 O TRP A 84 -2.632 -24.518 -6.838 1.00 0.00 O ATOM 1254 CB TRP A 84 -0.738 -24.192 -4.077 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.086 -23.330 -5.116 1.00 0.00 C ATOM 1256 CD1 TRP A 84 1.175 -23.468 -5.622 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.663 -22.196 -5.772 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.416 -22.488 -6.554 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.304 -21.696 -6.666 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -1.903 -21.556 -5.695 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 0.069 -20.585 -7.472 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.135 -20.455 -6.496 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -1.154 -19.979 -7.376 1.00 0.00 C ATOM 0 H TRP A 84 -1.839 -26.058 -2.903 1.00 0.00 H new ATOM 0 HA TRP A 84 -2.846 -23.937 -4.407 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -0.854 -23.617 -3.159 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.081 -25.031 -3.847 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.879 -24.234 -5.332 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.283 -22.369 -7.078 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -2.666 -21.916 -5.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.825 -20.215 -8.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.089 -19.952 -6.443 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.367 -19.117 -7.991 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.368 -26.274 -6.224 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.247 -26.801 -7.578 1.00 0.00 C ATOM 1276 C LYS A 85 -2.598 -26.795 -8.287 1.00 0.00 C ATOM 1277 O LYS A 85 -2.683 -26.498 -9.479 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.682 -28.223 -7.546 1.00 0.00 C ATOM 1279 CG LYS A 85 0.834 -28.273 -7.472 1.00 0.00 C ATOM 1280 CD LYS A 85 1.337 -29.698 -7.313 1.00 0.00 C ATOM 1281 CE LYS A 85 1.309 -30.140 -5.857 1.00 0.00 C ATOM 1282 NZ LYS A 85 2.324 -31.193 -5.578 1.00 0.00 N ATOM 0 H LYS A 85 -0.884 -26.823 -5.513 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.563 -26.158 -8.131 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.097 -28.751 -6.687 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -1.012 -28.756 -8.438 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.258 -27.835 -8.376 1.00 0.00 H new ATOM 0 HG3 LYS A 85 1.179 -27.669 -6.633 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.722 -30.371 -7.911 1.00 0.00 H new ATOM 0 HD3 LYS A 85 2.355 -29.771 -7.697 1.00 0.00 H new ATOM 0 HE2 LYS A 85 1.491 -29.280 -5.213 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.317 -30.518 -5.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 2.273 -31.467 -4.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 2.135 -32.024 -6.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 3.273 -30.824 -5.788 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.651 -27.123 -7.547 1.00 0.00 N ATOM 1297 CA ASP A 86 -4.998 -27.153 -8.104 1.00 0.00 C ATOM 1298 C ASP A 86 -5.218 -25.983 -9.058 1.00 0.00 C ATOM 1299 O ASP A 86 -5.460 -24.849 -8.644 1.00 0.00 O ATOM 1300 CB ASP A 86 -6.038 -27.115 -6.983 1.00 0.00 C ATOM 1301 CG ASP A 86 -5.724 -28.094 -5.869 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -4.720 -28.826 -5.989 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.484 -28.129 -4.878 1.00 0.00 O ATOM 0 H ASP A 86 -3.598 -27.372 -6.559 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.112 -28.081 -8.664 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.089 -26.106 -6.573 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.021 -27.342 -7.396 1.00 0.00 H new ATOM 1308 N PRO A 87 -5.130 -26.262 -10.367 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.315 -25.246 -11.407 1.00 0.00 C ATOM 1310 C PRO A 87 -6.762 -24.773 -11.505 1.00 0.00 C ATOM 1311 O PRO A 87 -7.072 -23.843 -12.248 1.00 0.00 O ATOM 1312 CB PRO A 87 -4.902 -25.972 -12.690 1.00 0.00 C ATOM 1313 CG PRO A 87 -5.129 -27.415 -12.399 1.00 0.00 C ATOM 1314 CD PRO A 87 -4.844 -27.591 -10.933 1.00 0.00 C ATOM 0 HA PRO A 87 -4.735 -24.346 -11.205 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.497 -25.641 -13.541 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.858 -25.777 -12.936 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.153 -27.704 -12.635 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.473 -28.043 -13.002 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.476 -28.361 -10.490 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -3.810 -27.888 -10.758 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.643 -25.420 -10.749 1.00 0.00 N ATOM 1323 CA ASN A 88 -9.057 -25.065 -10.751 1.00 0.00 C ATOM 1324 C ASN A 88 -9.420 -24.269 -9.500 1.00 0.00 C ATOM 1325 O ASN A 88 -10.575 -24.255 -9.075 1.00 0.00 O ATOM 1326 CB ASN A 88 -9.921 -26.325 -10.835 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.373 -27.459 -9.990 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -9.442 -27.422 -8.762 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -8.825 -28.475 -10.647 1.00 0.00 N ATOM 0 H ASN A 88 -7.403 -26.192 -10.128 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.248 -24.442 -11.625 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -10.934 -26.090 -10.509 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -9.987 -26.649 -11.874 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.440 -29.267 -10.132 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -8.789 -28.463 -11.666 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.426 -23.608 -8.917 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.640 -22.810 -7.715 1.00 0.00 C ATOM 1338 C ASN A 89 -9.058 -21.387 -8.074 1.00 0.00 C ATOM 1339 O ASN A 89 -8.536 -20.795 -9.019 1.00 0.00 O ATOM 1340 CB ASN A 89 -7.369 -22.780 -6.864 1.00 0.00 C ATOM 1341 CG ASN A 89 -7.296 -23.943 -5.894 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -8.301 -24.597 -5.613 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -6.102 -24.207 -5.376 1.00 0.00 N ATOM 0 H ASN A 89 -7.464 -23.609 -9.257 1.00 0.00 H new ATOM 0 HA ASN A 89 -9.443 -23.272 -7.141 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.497 -22.800 -7.517 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.329 -21.843 -6.308 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -5.991 -24.978 -4.717 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.296 -23.639 -5.637 1.00 0.00 H new ATOM 1350 N ASP A 90 -10.003 -20.845 -7.314 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.491 -19.491 -7.551 1.00 0.00 C ATOM 1352 C ASP A 90 -9.332 -18.504 -7.643 1.00 0.00 C ATOM 1353 O ASP A 90 -9.474 -17.412 -8.194 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.449 -19.069 -6.436 1.00 0.00 C ATOM 1355 CG ASP A 90 -12.836 -19.657 -6.610 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -13.597 -19.140 -7.454 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -13.160 -20.634 -5.903 1.00 0.00 O ATOM 0 H ASP A 90 -10.446 -21.322 -6.529 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.026 -19.485 -8.501 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -11.043 -19.382 -5.474 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.519 -17.981 -6.413 1.00 0.00 H new ATOM 1362 N PHE A 91 -8.184 -18.895 -7.098 1.00 0.00 N ATOM 1363 CA PHE A 91 -7.000 -18.044 -7.117 1.00 0.00 C ATOM 1364 C PHE A 91 -6.449 -17.909 -8.533 1.00 0.00 C ATOM 1365 O PHE A 91 -6.134 -16.808 -8.986 1.00 0.00 O ATOM 1366 CB PHE A 91 -5.923 -18.612 -6.190 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.299 -18.569 -4.737 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -6.352 -17.364 -4.056 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.601 -19.735 -4.052 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.697 -17.322 -2.718 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -6.947 -19.700 -2.714 1.00 0.00 C ATOM 1372 CZ PHE A 91 -6.996 -18.491 -2.047 1.00 0.00 C ATOM 0 H PHE A 91 -8.049 -19.795 -6.638 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.289 -17.054 -6.763 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.718 -19.644 -6.474 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.999 -18.053 -6.335 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.121 -16.446 -4.577 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.566 -20.682 -4.569 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.733 -16.376 -2.198 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.179 -20.616 -2.191 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.268 -18.460 -1.002 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.335 -19.037 -9.227 1.00 0.00 N ATOM 1383 CA ARG A 92 -5.821 -19.046 -10.591 1.00 0.00 C ATOM 1384 C ARG A 92 -6.942 -18.798 -11.597 1.00 0.00 C ATOM 1385 O ARG A 92 -6.694 -18.661 -12.794 1.00 0.00 O ATOM 1386 CB ARG A 92 -5.137 -20.381 -10.892 1.00 0.00 C ATOM 1387 CG ARG A 92 -4.020 -20.725 -9.921 1.00 0.00 C ATOM 1388 CD ARG A 92 -3.766 -22.224 -9.872 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.454 -22.539 -9.315 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.328 -22.503 -10.019 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.355 -22.166 -11.301 1.00 0.00 N ATOM 1392 NH2 ARG A 92 -0.172 -22.803 -9.441 1.00 0.00 N ATOM 0 H ARG A 92 -6.592 -19.956 -8.867 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.090 -18.242 -10.682 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -5.883 -21.175 -10.870 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.732 -20.352 -11.903 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.107 -20.210 -10.218 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.279 -20.366 -8.925 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.539 -22.703 -9.271 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.842 -22.637 -10.878 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.399 -22.801 -8.331 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.242 -21.934 -11.749 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.489 -22.139 -11.840 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.147 -23.062 -8.455 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.692 -22.775 -9.983 1.00 0.00 H new ATOM 1406 N GLN A 93 -8.173 -18.743 -11.100 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.332 -18.513 -11.956 1.00 0.00 C ATOM 1408 C GLN A 93 -9.869 -17.097 -11.775 1.00 0.00 C ATOM 1409 O GLN A 93 -9.901 -16.309 -12.720 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.430 -19.532 -11.647 1.00 0.00 C ATOM 1411 CG GLN A 93 -9.948 -20.973 -11.673 1.00 0.00 C ATOM 1412 CD GLN A 93 -9.952 -21.566 -13.068 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -10.886 -21.356 -13.841 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -8.904 -22.311 -13.398 1.00 0.00 N ATOM 0 H GLN A 93 -8.394 -18.854 -10.111 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.017 -18.632 -12.993 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -10.849 -19.315 -10.664 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.237 -19.415 -12.370 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -8.938 -21.022 -11.265 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.583 -21.576 -11.024 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.151 -22.459 -12.726 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -8.851 -22.735 -14.324 1.00 0.00 H new ATOM 1423 N LYS A 94 -10.292 -16.782 -10.556 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.828 -15.461 -10.249 1.00 0.00 C ATOM 1425 C LYS A 94 -9.712 -14.423 -10.182 1.00 0.00 C ATOM 1426 O LYS A 94 -9.757 -13.403 -10.871 1.00 0.00 O ATOM 1427 CB LYS A 94 -11.590 -15.492 -8.923 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.652 -16.576 -8.857 1.00 0.00 C ATOM 1429 CD LYS A 94 -14.005 -16.062 -9.319 1.00 0.00 C ATOM 1430 CE LYS A 94 -14.215 -16.302 -10.806 1.00 0.00 C ATOM 1431 NZ LYS A 94 -15.495 -15.714 -11.288 1.00 0.00 N ATOM 0 H LYS A 94 -10.274 -17.424 -9.764 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.514 -15.181 -11.048 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.880 -15.640 -8.109 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -12.062 -14.523 -8.762 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -12.351 -17.419 -9.478 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.732 -16.946 -7.835 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -14.795 -16.557 -8.754 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.082 -14.996 -9.107 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.384 -15.870 -11.364 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.210 -17.374 -11.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -15.601 -15.899 -12.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -16.290 -16.144 -10.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -15.490 -14.687 -11.122 1.00 0.00 H new ATOM 1445 N LEU A 95 -8.712 -14.689 -9.349 1.00 0.00 N ATOM 1446 CA LEU A 95 -7.583 -13.779 -9.194 1.00 0.00 C ATOM 1447 C LEU A 95 -6.577 -13.960 -10.326 1.00 0.00 C ATOM 1448 O LEU A 95 -5.794 -13.058 -10.625 1.00 0.00 O ATOM 1449 CB LEU A 95 -6.898 -14.010 -7.846 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.689 -13.584 -6.609 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -6.989 -14.047 -5.341 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -7.881 -12.074 -6.593 1.00 0.00 C ATOM 0 H LEU A 95 -8.660 -15.528 -8.771 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.964 -12.758 -9.231 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.666 -15.071 -7.756 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -5.948 -13.475 -7.847 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.671 -14.055 -6.650 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.567 -13.734 -4.471 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.904 -15.134 -5.349 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.994 -13.605 -5.293 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.446 -11.788 -5.706 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.908 -11.584 -6.577 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.427 -11.767 -7.485 1.00 0.00 H new ATOM 1464 N LYS A 96 -6.605 -15.131 -10.954 1.00 0.00 N ATOM 1465 CA LYS A 96 -5.699 -15.430 -12.056 1.00 0.00 C ATOM 1466 C LYS A 96 -4.244 -15.325 -11.608 1.00 0.00 C ATOM 1467 O LYS A 96 -3.407 -14.763 -12.315 1.00 0.00 O ATOM 1468 CB LYS A 96 -5.953 -14.477 -13.226 1.00 0.00 C ATOM 1469 CG LYS A 96 -7.370 -14.547 -13.770 1.00 0.00 C ATOM 1470 CD LYS A 96 -7.562 -15.756 -14.671 1.00 0.00 C ATOM 1471 CE LYS A 96 -7.034 -15.496 -16.073 1.00 0.00 C ATOM 1472 NZ LYS A 96 -7.345 -16.620 -17.000 1.00 0.00 N ATOM 0 H LYS A 96 -7.246 -15.889 -10.718 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.888 -16.453 -12.381 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.746 -13.456 -12.904 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -5.253 -14.706 -14.029 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.077 -14.593 -12.942 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.592 -13.637 -14.328 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -7.049 -16.616 -14.242 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -8.621 -16.009 -14.721 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -7.470 -14.575 -16.460 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -5.955 -15.346 -16.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -6.969 -16.405 -17.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -6.908 -17.494 -16.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -8.376 -16.747 -17.058 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.951 -15.870 -10.432 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.597 -15.840 -9.893 1.00 0.00 C ATOM 1488 C ILE A 97 -1.624 -16.573 -10.809 1.00 0.00 C ATOM 1489 O ILE A 97 -2.027 -17.403 -11.625 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.537 -16.469 -8.488 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.468 -15.723 -7.531 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -1.109 -16.456 -7.964 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -3.118 -14.261 -7.364 1.00 0.00 C ATOM 0 H ILE A 97 -4.633 -16.337 -9.835 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.307 -14.791 -9.825 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.870 -17.505 -8.555 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.492 -15.804 -7.896 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.438 -16.209 -6.556 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.082 -16.903 -6.970 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.469 -17.027 -8.637 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.751 -15.428 -7.909 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.820 -13.796 -6.672 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.106 -14.172 -6.969 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.176 -13.760 -8.331 1.00 0.00 H new ATOM 1505 N THR A 98 -0.339 -16.264 -10.667 1.00 0.00 N ATOM 1506 CA THR A 98 0.693 -16.894 -11.481 1.00 0.00 C ATOM 1507 C THR A 98 1.487 -17.912 -10.671 1.00 0.00 C ATOM 1508 O THR A 98 1.393 -19.116 -10.905 1.00 0.00 O ATOM 1509 CB THR A 98 1.664 -15.850 -12.065 1.00 0.00 C ATOM 1510 OG1 THR A 98 0.939 -14.884 -12.835 1.00 0.00 O ATOM 1511 CG2 THR A 98 2.715 -16.517 -12.938 1.00 0.00 C ATOM 0 H THR A 98 0.012 -15.581 -9.996 1.00 0.00 H new ATOM 0 HA THR A 98 0.183 -17.403 -12.299 1.00 0.00 H new ATOM 0 HB THR A 98 2.167 -15.351 -11.237 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.563 -14.223 -13.201 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.389 -15.760 -13.339 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.284 -17.230 -12.342 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.227 -17.040 -13.760 1.00 0.00 H new ATOM 1519 N ALA A 99 2.270 -17.420 -9.716 1.00 0.00 N ATOM 1520 CA ALA A 99 3.079 -18.288 -8.868 1.00 0.00 C ATOM 1521 C ALA A 99 3.245 -17.693 -7.474 1.00 0.00 C ATOM 1522 O ALA A 99 3.731 -16.573 -7.320 1.00 0.00 O ATOM 1523 CB ALA A 99 4.438 -18.531 -9.507 1.00 0.00 C ATOM 0 H ALA A 99 2.361 -16.425 -9.510 1.00 0.00 H new ATOM 0 HA ALA A 99 2.562 -19.242 -8.767 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.032 -19.180 -8.864 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.303 -19.007 -10.478 1.00 0.00 H new ATOM 0 HB3 ALA A 99 4.954 -17.580 -9.638 1.00 0.00 H new ATOM 1529 N VAL A 100 2.838 -18.451 -6.460 1.00 0.00 N ATOM 1530 CA VAL A 100 2.943 -17.999 -5.078 1.00 0.00 C ATOM 1531 C VAL A 100 4.362 -18.173 -4.549 1.00 0.00 C ATOM 1532 O VAL A 100 5.094 -19.077 -4.951 1.00 0.00 O ATOM 1533 CB VAL A 100 1.968 -18.763 -4.162 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.554 -18.703 -4.719 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.420 -20.205 -3.988 1.00 0.00 C ATOM 0 H VAL A 100 2.433 -19.381 -6.570 1.00 0.00 H new ATOM 0 HA VAL A 100 2.683 -16.940 -5.071 1.00 0.00 H new ATOM 0 HB VAL A 100 1.968 -18.285 -3.182 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.121 -19.248 -4.059 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.234 -17.663 -4.787 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.534 -19.155 -5.711 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.720 -20.730 -3.338 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.451 -20.697 -4.960 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.414 -20.223 -3.541 1.00 0.00 H new ATOM 1545 N PRO A 101 4.762 -17.287 -3.624 1.00 0.00 N ATOM 1546 CA PRO A 101 3.899 -16.206 -3.139 1.00 0.00 C ATOM 1547 C PRO A 101 3.656 -15.138 -4.199 1.00 0.00 C ATOM 1548 O PRO A 101 4.571 -14.750 -4.927 1.00 0.00 O ATOM 1549 CB PRO A 101 4.688 -15.623 -1.964 1.00 0.00 C ATOM 1550 CG PRO A 101 6.110 -15.953 -2.262 1.00 0.00 C ATOM 1551 CD PRO A 101 6.087 -17.272 -2.983 1.00 0.00 C ATOM 0 HA PRO A 101 2.907 -16.567 -2.867 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.540 -14.546 -1.883 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.370 -16.060 -1.018 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.569 -15.180 -2.878 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.695 -16.020 -1.345 1.00 0.00 H new ATOM 0 HD2 PRO A 101 6.889 -17.343 -3.717 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.210 -18.108 -2.295 1.00 0.00 H new ATOM 1559 N THR A 102 2.416 -14.664 -4.283 1.00 0.00 N ATOM 1560 CA THR A 102 2.053 -13.641 -5.255 1.00 0.00 C ATOM 1561 C THR A 102 1.549 -12.379 -4.563 1.00 0.00 C ATOM 1562 O THR A 102 0.503 -12.391 -3.913 1.00 0.00 O ATOM 1563 CB THR A 102 0.969 -14.148 -6.225 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.437 -15.311 -6.917 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.597 -13.069 -7.232 1.00 0.00 C ATOM 0 H THR A 102 1.647 -14.973 -3.689 1.00 0.00 H new ATOM 0 HA THR A 102 2.955 -13.407 -5.820 1.00 0.00 H new ATOM 0 HB THR A 102 0.083 -14.403 -5.644 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.416 -15.339 -6.884 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.170 -13.450 -7.907 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.215 -12.195 -6.704 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.479 -12.788 -7.807 1.00 0.00 H new ATOM 1573 N LEU A 103 2.298 -11.292 -4.707 1.00 0.00 N ATOM 1574 CA LEU A 103 1.927 -10.020 -4.096 1.00 0.00 C ATOM 1575 C LEU A 103 1.229 -9.114 -5.105 1.00 0.00 C ATOM 1576 O LEU A 103 1.879 -8.447 -5.911 1.00 0.00 O ATOM 1577 CB LEU A 103 3.166 -9.320 -3.536 1.00 0.00 C ATOM 1578 CG LEU A 103 2.913 -8.029 -2.756 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.059 -8.307 -1.528 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.230 -7.381 -2.355 1.00 0.00 C ATOM 0 H LEU A 103 3.166 -11.265 -5.242 1.00 0.00 H new ATOM 0 HA LEU A 103 1.234 -10.226 -3.280 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.689 -10.019 -2.883 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.837 -9.094 -4.365 1.00 0.00 H new ATOM 0 HG LEU A 103 2.372 -7.337 -3.402 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.889 -7.377 -0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.102 -8.726 -1.838 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.573 -9.017 -0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 103 4.030 -6.464 -1.801 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.797 -8.068 -1.727 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.807 -7.146 -3.249 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.099 -9.094 -5.054 1.00 0.00 N ATOM 1593 CA LEU A 104 -0.886 -8.268 -5.962 1.00 0.00 C ATOM 1594 C LEU A 104 -1.318 -6.972 -5.284 1.00 0.00 C ATOM 1595 O LEU A 104 -1.819 -6.984 -4.159 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.116 -9.038 -6.447 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.281 -8.189 -6.959 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -2.869 -7.410 -8.198 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.490 -9.065 -7.253 1.00 0.00 C ATOM 0 H LEU A 104 -0.652 -9.640 -4.394 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.261 -8.017 -6.819 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.806 -9.713 -7.245 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.478 -9.659 -5.627 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.556 -7.476 -6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.710 -6.812 -8.548 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.034 -6.754 -7.954 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.567 -8.105 -8.981 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.309 -8.444 -7.616 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.229 -9.802 -8.012 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.799 -9.577 -6.341 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.123 -5.854 -5.975 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.496 -4.549 -5.442 1.00 0.00 C ATOM 1613 C LYS A 105 -2.875 -4.131 -5.941 1.00 0.00 C ATOM 1614 O LYS A 105 -2.999 -3.469 -6.971 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.458 -3.498 -5.841 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.775 -2.104 -5.326 1.00 0.00 C ATOM 1617 CD LYS A 105 0.393 -1.154 -5.533 1.00 0.00 C ATOM 1618 CE LYS A 105 0.084 0.234 -4.993 1.00 0.00 C ATOM 1619 NZ LYS A 105 -0.728 1.034 -5.952 1.00 0.00 N ATOM 0 H LYS A 105 -0.708 -5.826 -6.906 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.530 -4.624 -4.355 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.518 -3.802 -5.464 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.384 -3.467 -6.928 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.655 -1.717 -5.839 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.021 -2.154 -4.265 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.278 -1.550 -5.036 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.626 -1.089 -6.596 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.453 0.145 -4.049 1.00 0.00 H new ATOM 0 HE3 LYS A 105 1.016 0.757 -4.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -0.206 1.893 -6.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.917 0.468 -6.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.629 1.300 -5.506 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.909 -4.520 -5.202 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.280 -4.187 -5.570 1.00 0.00 C ATOM 1635 C TYR A 106 -5.375 -2.748 -6.068 1.00 0.00 C ATOM 1636 O TYR A 106 -5.148 -1.802 -5.316 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.214 -4.388 -4.375 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.631 -4.741 -4.767 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.885 -5.709 -5.731 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.715 -4.107 -4.173 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.178 -6.034 -6.092 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -10.011 -4.426 -4.527 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.238 -5.390 -5.488 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.528 -5.712 -5.844 1.00 0.00 O ATOM 0 H TYR A 106 -3.823 -5.066 -4.345 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.585 -4.853 -6.377 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.814 -5.179 -3.741 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.228 -3.476 -3.778 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.058 -6.216 -6.206 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.541 -3.351 -3.421 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.358 -6.789 -6.843 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.842 -3.924 -4.054 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.156 -5.168 -5.324 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.715 -2.592 -7.345 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.835 -1.267 -7.923 1.00 0.00 C ATOM 1656 C GLY A 107 -4.891 -1.055 -9.090 1.00 0.00 C ATOM 1657 O GLY A 107 -5.231 -0.375 -10.059 1.00 0.00 O ATOM 0 H GLY A 107 -5.909 -3.360 -7.988 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.861 -1.111 -8.257 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.633 -0.520 -7.156 1.00 0.00 H new ATOM 1661 N THR A 108 -3.700 -1.638 -8.999 1.00 0.00 N ATOM 1662 CA THR A 108 -2.702 -1.508 -10.053 1.00 0.00 C ATOM 1663 C THR A 108 -2.195 -2.874 -10.501 1.00 0.00 C ATOM 1664 O THR A 108 -2.190 -3.842 -9.740 1.00 0.00 O ATOM 1665 CB THR A 108 -1.506 -0.654 -9.592 1.00 0.00 C ATOM 1666 OG1 THR A 108 -0.969 -1.180 -8.373 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.922 0.794 -9.386 1.00 0.00 C ATOM 0 H THR A 108 -3.403 -2.205 -8.205 1.00 0.00 H new ATOM 0 HA THR A 108 -3.190 -1.012 -10.892 1.00 0.00 H new ATOM 0 HB THR A 108 -0.743 -0.688 -10.369 1.00 0.00 H new ATOM 0 HG1 THR A 108 -0.542 -2.044 -8.550 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.061 1.377 -9.061 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.302 1.200 -10.323 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.702 0.844 -8.626 1.00 0.00 H new ATOM 1675 N PRO A 109 -1.755 -2.957 -11.766 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.236 -4.200 -12.343 1.00 0.00 C ATOM 1677 C PRO A 109 0.109 -4.599 -11.747 1.00 0.00 C ATOM 1678 O PRO A 109 0.662 -5.645 -12.085 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.084 -3.865 -13.829 1.00 0.00 C ATOM 1680 CG PRO A 109 -0.912 -2.385 -13.868 1.00 0.00 C ATOM 1681 CD PRO A 109 -1.732 -1.844 -12.729 1.00 0.00 C ATOM 0 HA PRO A 109 -1.895 -5.046 -12.148 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.224 -4.375 -14.264 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -1.961 -4.177 -14.397 1.00 0.00 H new ATOM 0 HG2 PRO A 109 0.137 -2.111 -13.759 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.250 -1.978 -14.821 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.281 -0.950 -12.299 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -2.737 -1.571 -13.051 1.00 0.00 H new ATOM 1689 N GLN A 110 0.630 -3.759 -10.858 1.00 0.00 N ATOM 1690 CA GLN A 110 1.911 -4.025 -10.215 1.00 0.00 C ATOM 1691 C GLN A 110 1.799 -5.195 -9.242 1.00 0.00 C ATOM 1692 O GLN A 110 1.019 -5.153 -8.291 1.00 0.00 O ATOM 1693 CB GLN A 110 2.404 -2.779 -9.477 1.00 0.00 C ATOM 1694 CG GLN A 110 3.208 -1.832 -10.353 1.00 0.00 C ATOM 1695 CD GLN A 110 4.216 -1.021 -9.563 1.00 0.00 C ATOM 1696 OE1 GLN A 110 5.397 -0.971 -9.908 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.754 -0.379 -8.496 1.00 0.00 N ATOM 0 H GLN A 110 0.185 -2.889 -10.567 1.00 0.00 H new ATOM 0 HA GLN A 110 2.630 -4.288 -10.991 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.546 -2.244 -9.070 1.00 0.00 H new ATOM 0 HB3 GLN A 110 3.018 -3.087 -8.631 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.729 -2.406 -11.119 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.528 -1.155 -10.870 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.767 -0.448 -8.247 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.386 0.183 -7.926 1.00 0.00 H new ATOM 1706 N LYS A 111 2.584 -6.239 -9.488 1.00 0.00 N ATOM 1707 CA LYS A 111 2.575 -7.421 -8.635 1.00 0.00 C ATOM 1708 C LYS A 111 3.969 -8.033 -8.539 1.00 0.00 C ATOM 1709 O LYS A 111 4.738 -8.005 -9.500 1.00 0.00 O ATOM 1710 CB LYS A 111 1.587 -8.458 -9.175 1.00 0.00 C ATOM 1711 CG LYS A 111 1.930 -8.956 -10.568 1.00 0.00 C ATOM 1712 CD LYS A 111 2.825 -10.183 -10.517 1.00 0.00 C ATOM 1713 CE LYS A 111 2.020 -11.450 -10.274 1.00 0.00 C ATOM 1714 NZ LYS A 111 1.135 -11.775 -11.427 1.00 0.00 N ATOM 0 H LYS A 111 3.235 -6.290 -10.272 1.00 0.00 H new ATOM 0 HA LYS A 111 2.262 -7.115 -7.637 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.555 -9.307 -8.492 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.588 -8.023 -9.190 1.00 0.00 H new ATOM 0 HG2 LYS A 111 1.013 -9.196 -11.106 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.429 -8.164 -11.126 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.374 -10.274 -11.454 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.564 -10.063 -9.725 1.00 0.00 H new ATOM 0 HE2 LYS A 111 2.700 -12.283 -10.092 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.416 -11.329 -9.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.896 -12.787 -11.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.263 -11.212 -11.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 1.627 -11.553 -12.316 1.00 0.00 H new ATOM 1728 N LEU A 112 4.287 -8.586 -7.374 1.00 0.00 N ATOM 1729 CA LEU A 112 5.589 -9.208 -7.153 1.00 0.00 C ATOM 1730 C LEU A 112 5.450 -10.717 -6.981 1.00 0.00 C ATOM 1731 O LEU A 112 4.724 -11.188 -6.105 1.00 0.00 O ATOM 1732 CB LEU A 112 6.262 -8.602 -5.919 1.00 0.00 C ATOM 1733 CG LEU A 112 6.403 -7.080 -5.911 1.00 0.00 C ATOM 1734 CD1 LEU A 112 7.194 -6.624 -4.695 1.00 0.00 C ATOM 1735 CD2 LEU A 112 7.068 -6.599 -7.193 1.00 0.00 C ATOM 0 H LEU A 112 3.662 -8.617 -6.568 1.00 0.00 H new ATOM 0 HA LEU A 112 6.209 -9.017 -8.029 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.694 -8.899 -5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.255 -9.039 -5.820 1.00 0.00 H new ATOM 0 HG LEU A 112 5.406 -6.642 -5.856 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.284 -5.538 -4.706 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.678 -6.936 -3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 112 8.188 -7.071 -4.719 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.160 -5.513 -7.170 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.059 -7.045 -7.279 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.462 -6.893 -8.050 1.00 0.00 H new ATOM 1747 N VAL A 113 6.152 -11.470 -7.821 1.00 0.00 N ATOM 1748 CA VAL A 113 6.110 -12.926 -7.760 1.00 0.00 C ATOM 1749 C VAL A 113 7.147 -13.465 -6.781 1.00 0.00 C ATOM 1750 O VAL A 113 7.940 -12.709 -6.223 1.00 0.00 O ATOM 1751 CB VAL A 113 6.354 -13.553 -9.146 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.606 -14.871 -9.275 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.944 -12.587 -10.247 1.00 0.00 C ATOM 0 H VAL A 113 6.757 -11.096 -8.552 1.00 0.00 H new ATOM 0 HA VAL A 113 5.113 -13.200 -7.416 1.00 0.00 H new ATOM 0 HB VAL A 113 7.420 -13.756 -9.251 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.790 -15.299 -10.260 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.953 -15.563 -8.508 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.537 -14.697 -9.149 1.00 0.00 H new ATOM 0 HG21 VAL A 113 6.123 -13.046 -11.219 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.885 -12.350 -10.147 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.530 -11.672 -10.165 1.00 0.00 H new ATOM 1763 N GLU A 114 7.133 -14.779 -6.577 1.00 0.00 N ATOM 1764 CA GLU A 114 8.073 -15.420 -5.664 1.00 0.00 C ATOM 1765 C GLU A 114 9.410 -14.685 -5.656 1.00 0.00 C ATOM 1766 O GLU A 114 9.844 -14.176 -4.622 1.00 0.00 O ATOM 1767 CB GLU A 114 8.285 -16.883 -6.059 1.00 0.00 C ATOM 1768 CG GLU A 114 6.999 -17.609 -6.417 1.00 0.00 C ATOM 1769 CD GLU A 114 7.165 -19.116 -6.429 1.00 0.00 C ATOM 1770 OE1 GLU A 114 8.119 -19.614 -5.796 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.340 -19.798 -7.073 1.00 0.00 O ATOM 0 H GLU A 114 6.482 -15.420 -7.031 1.00 0.00 H new ATOM 0 HA GLU A 114 7.650 -15.380 -4.660 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.965 -16.926 -6.909 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.771 -17.406 -5.235 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.222 -17.338 -5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.659 -17.277 -7.398 1.00 0.00 H new ATOM 1778 N SER A 115 10.058 -14.634 -6.815 1.00 0.00 N ATOM 1779 CA SER A 115 11.348 -13.965 -6.941 1.00 0.00 C ATOM 1780 C SER A 115 11.253 -12.512 -6.488 1.00 0.00 C ATOM 1781 O SER A 115 12.111 -12.022 -5.754 1.00 0.00 O ATOM 1782 CB SER A 115 11.840 -14.029 -8.388 1.00 0.00 C ATOM 1783 OG SER A 115 13.208 -13.672 -8.478 1.00 0.00 O ATOM 0 H SER A 115 9.711 -15.048 -7.680 1.00 0.00 H new ATOM 0 HA SER A 115 12.062 -14.481 -6.299 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.697 -15.036 -8.780 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.245 -13.359 -9.008 1.00 0.00 H new ATOM 0 HG SER A 115 13.498 -13.722 -9.413 1.00 0.00 H new ATOM 1789 N GLU A 116 10.203 -11.827 -6.932 1.00 0.00 N ATOM 1790 CA GLU A 116 9.996 -10.429 -6.573 1.00 0.00 C ATOM 1791 C GLU A 116 9.511 -10.304 -5.131 1.00 0.00 C ATOM 1792 O GLU A 116 9.439 -9.203 -4.583 1.00 0.00 O ATOM 1793 CB GLU A 116 8.986 -9.780 -7.521 1.00 0.00 C ATOM 1794 CG GLU A 116 9.327 -9.960 -8.991 1.00 0.00 C ATOM 1795 CD GLU A 116 8.610 -8.965 -9.882 1.00 0.00 C ATOM 1796 OE1 GLU A 116 7.420 -9.191 -10.186 1.00 0.00 O ATOM 1797 OE2 GLU A 116 9.239 -7.961 -10.276 1.00 0.00 O ATOM 0 H GLU A 116 9.483 -12.217 -7.540 1.00 0.00 H new ATOM 0 HA GLU A 116 10.951 -9.912 -6.663 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.999 -10.202 -7.331 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.925 -8.715 -7.299 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.403 -9.853 -9.126 1.00 0.00 H new ATOM 0 HG3 GLU A 116 9.066 -10.972 -9.299 1.00 0.00 H new ATOM 1804 N CYS A 117 9.178 -11.438 -4.525 1.00 0.00 N ATOM 1805 CA CYS A 117 8.698 -11.456 -3.148 1.00 0.00 C ATOM 1806 C CYS A 117 9.857 -11.621 -2.170 1.00 0.00 C ATOM 1807 O CYS A 117 9.694 -11.442 -0.962 1.00 0.00 O ATOM 1808 CB CYS A 117 7.686 -12.586 -2.953 1.00 0.00 C ATOM 1809 SG CYS A 117 6.090 -12.292 -3.750 1.00 0.00 S ATOM 0 H CYS A 117 9.232 -12.357 -4.965 1.00 0.00 H new ATOM 0 HA CYS A 117 8.210 -10.502 -2.947 1.00 0.00 H new ATOM 0 HB2 CYS A 117 8.110 -13.511 -3.344 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.525 -12.735 -1.885 1.00 0.00 H new ATOM 0 HG CYS A 117 5.606 -13.419 -4.180 1.00 0.00 H new ATOM 1815 N CYS A 118 11.026 -11.964 -2.699 1.00 0.00 N ATOM 1816 CA CYS A 118 12.212 -12.156 -1.873 1.00 0.00 C ATOM 1817 C CYS A 118 13.199 -11.008 -2.062 1.00 0.00 C ATOM 1818 O CYS A 118 14.176 -10.890 -1.324 1.00 0.00 O ATOM 1819 CB CYS A 118 12.887 -13.486 -2.213 1.00 0.00 C ATOM 1820 SG CYS A 118 14.489 -13.728 -1.411 1.00 0.00 S ATOM 0 H CYS A 118 11.178 -12.115 -3.696 1.00 0.00 H new ATOM 0 HA CYS A 118 11.898 -12.173 -0.829 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.223 -14.302 -1.927 1.00 0.00 H new ATOM 0 HB3 CYS A 118 13.021 -13.548 -3.293 1.00 0.00 H new ATOM 0 HG CYS A 118 14.978 -12.575 -1.061 1.00 0.00 H new ATOM 1826 N GLN A 119 12.935 -10.167 -3.057 1.00 0.00 N ATOM 1827 CA GLN A 119 13.802 -9.030 -3.344 1.00 0.00 C ATOM 1828 C GLN A 119 13.243 -7.750 -2.730 1.00 0.00 C ATOM 1829 O GLN A 119 12.383 -7.093 -3.317 1.00 0.00 O ATOM 1830 CB GLN A 119 13.965 -8.855 -4.855 1.00 0.00 C ATOM 1831 CG GLN A 119 15.114 -9.661 -5.440 1.00 0.00 C ATOM 1832 CD GLN A 119 15.376 -10.943 -4.676 1.00 0.00 C ATOM 1833 OE1 GLN A 119 16.162 -10.966 -3.729 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.716 -12.021 -5.084 1.00 0.00 N ATOM 0 H GLN A 119 12.129 -10.251 -3.677 1.00 0.00 H new ATOM 0 HA GLN A 119 14.778 -9.228 -2.900 1.00 0.00 H new ATOM 0 HB2 GLN A 119 13.038 -9.148 -5.348 1.00 0.00 H new ATOM 0 HB3 GLN A 119 14.123 -7.799 -5.075 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.892 -9.901 -6.480 1.00 0.00 H new ATOM 0 HG3 GLN A 119 16.018 -9.051 -5.440 1.00 0.00 H new ATOM 0 HE21 GLN A 119 14.074 -11.957 -5.874 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.851 -12.913 -4.608 1.00 0.00 H new ATOM 1843 N SER A 120 13.736 -7.404 -1.546 1.00 0.00 N ATOM 1844 CA SER A 120 13.283 -6.205 -0.850 1.00 0.00 C ATOM 1845 C SER A 120 13.288 -4.999 -1.785 1.00 0.00 C ATOM 1846 O SER A 120 12.318 -4.243 -1.846 1.00 0.00 O ATOM 1847 CB SER A 120 14.172 -5.927 0.363 1.00 0.00 C ATOM 1848 OG SER A 120 15.482 -6.429 0.161 1.00 0.00 O ATOM 0 H SER A 120 14.449 -7.937 -1.048 1.00 0.00 H new ATOM 0 HA SER A 120 12.261 -6.376 -0.511 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.215 -4.854 0.548 1.00 0.00 H new ATOM 0 HB3 SER A 120 13.736 -6.386 1.250 1.00 0.00 H new ATOM 0 HG SER A 120 16.031 -6.237 0.950 1.00 0.00 H new ATOM 1854 N SER A 121 14.386 -4.827 -2.513 1.00 0.00 N ATOM 1855 CA SER A 121 14.520 -3.712 -3.443 1.00 0.00 C ATOM 1856 C SER A 121 13.202 -3.443 -4.162 1.00 0.00 C ATOM 1857 O SER A 121 12.844 -2.292 -4.417 1.00 0.00 O ATOM 1858 CB SER A 121 15.622 -4.002 -4.464 1.00 0.00 C ATOM 1859 OG SER A 121 15.862 -2.874 -5.289 1.00 0.00 O ATOM 0 H SER A 121 15.196 -5.446 -2.477 1.00 0.00 H new ATOM 0 HA SER A 121 14.789 -2.824 -2.871 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.540 -4.279 -3.945 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.336 -4.854 -5.081 1.00 0.00 H new ATOM 0 HG SER A 121 16.571 -3.084 -5.932 1.00 0.00 H new ATOM 1865 N LEU A 122 12.483 -4.512 -4.486 1.00 0.00 N ATOM 1866 CA LEU A 122 11.203 -4.393 -5.176 1.00 0.00 C ATOM 1867 C LEU A 122 10.074 -4.126 -4.186 1.00 0.00 C ATOM 1868 O LEU A 122 9.256 -3.229 -4.389 1.00 0.00 O ATOM 1869 CB LEU A 122 10.910 -5.667 -5.971 1.00 0.00 C ATOM 1870 CG LEU A 122 11.858 -5.966 -7.133 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.891 -7.458 -7.424 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.443 -5.188 -8.373 1.00 0.00 C ATOM 0 H LEU A 122 12.764 -5.471 -4.282 1.00 0.00 H new ATOM 0 HA LEU A 122 11.265 -3.549 -5.864 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.931 -6.513 -5.284 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.895 -5.601 -6.364 1.00 0.00 H new ATOM 0 HG LEU A 122 12.862 -5.650 -6.849 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.571 -7.652 -8.254 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.236 -7.994 -6.540 1.00 0.00 H new ATOM 0 HD13 LEU A 122 10.890 -7.800 -7.688 1.00 0.00 H new ATOM 0 HD21 LEU A 122 12.129 -5.413 -9.190 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.431 -5.473 -8.660 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.472 -4.120 -8.159 1.00 0.00 H new ATOM 1884 N VAL A 123 10.036 -4.910 -3.113 1.00 0.00 N ATOM 1885 CA VAL A 123 9.010 -4.757 -2.090 1.00 0.00 C ATOM 1886 C VAL A 123 8.898 -3.306 -1.637 1.00 0.00 C ATOM 1887 O VAL A 123 7.798 -2.769 -1.508 1.00 0.00 O ATOM 1888 CB VAL A 123 9.301 -5.645 -0.865 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.221 -5.468 0.192 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.418 -7.103 -1.281 1.00 0.00 C ATOM 0 H VAL A 123 10.705 -5.658 -2.930 1.00 0.00 H new ATOM 0 HA VAL A 123 8.067 -5.068 -2.539 1.00 0.00 H new ATOM 0 HB VAL A 123 10.253 -5.337 -0.432 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.444 -6.103 1.050 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.191 -4.426 0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.254 -5.748 -0.226 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.624 -7.716 -0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.483 -7.427 -1.739 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.231 -7.212 -1.999 1.00 0.00 H new ATOM 1900 N GLU A 124 10.044 -2.676 -1.397 1.00 0.00 N ATOM 1901 CA GLU A 124 10.074 -1.286 -0.958 1.00 0.00 C ATOM 1902 C GLU A 124 9.751 -0.343 -2.114 1.00 0.00 C ATOM 1903 O GLU A 124 9.479 0.839 -1.906 1.00 0.00 O ATOM 1904 CB GLU A 124 11.445 -0.942 -0.373 1.00 0.00 C ATOM 1905 CG GLU A 124 12.559 -0.917 -1.407 1.00 0.00 C ATOM 1906 CD GLU A 124 13.885 -0.470 -0.824 1.00 0.00 C ATOM 1907 OE1 GLU A 124 14.381 -1.142 0.106 1.00 0.00 O ATOM 1908 OE2 GLU A 124 14.428 0.550 -1.296 1.00 0.00 O ATOM 0 H GLU A 124 10.963 -3.106 -1.499 1.00 0.00 H new ATOM 0 HA GLU A 124 9.315 -1.160 -0.186 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.389 0.032 0.113 1.00 0.00 H new ATOM 0 HB3 GLU A 124 11.694 -1.669 0.400 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.672 -1.912 -1.838 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.280 -0.247 -2.221 1.00 0.00 H new ATOM 1915 N MET A 125 9.783 -0.876 -3.331 1.00 0.00 N ATOM 1916 CA MET A 125 9.493 -0.083 -4.520 1.00 0.00 C ATOM 1917 C MET A 125 7.997 -0.071 -4.814 1.00 0.00 C ATOM 1918 O MET A 125 7.356 0.980 -4.779 1.00 0.00 O ATOM 1919 CB MET A 125 10.258 -0.633 -5.725 1.00 0.00 C ATOM 1920 CG MET A 125 10.147 0.239 -6.965 1.00 0.00 C ATOM 1921 SD MET A 125 10.441 -0.679 -8.489 1.00 0.00 S ATOM 1922 CE MET A 125 9.100 -1.865 -8.435 1.00 0.00 C ATOM 0 H MET A 125 10.007 -1.853 -3.520 1.00 0.00 H new ATOM 0 HA MET A 125 9.816 0.941 -4.331 1.00 0.00 H new ATOM 0 HB2 MET A 125 11.310 -0.740 -5.459 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.885 -1.630 -5.958 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.154 0.687 -7.001 1.00 0.00 H new ATOM 0 HG3 MET A 125 10.864 1.057 -6.894 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.863 -2.192 -9.447 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.399 -2.725 -7.836 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.221 -1.400 -7.988 1.00 0.00 H new ATOM 1932 N ILE A 126 7.446 -1.245 -5.104 1.00 0.00 N ATOM 1933 CA ILE A 126 6.025 -1.369 -5.403 1.00 0.00 C ATOM 1934 C ILE A 126 5.184 -0.558 -4.423 1.00 0.00 C ATOM 1935 O ILE A 126 4.228 0.111 -4.814 1.00 0.00 O ATOM 1936 CB ILE A 126 5.567 -2.839 -5.362 1.00 0.00 C ATOM 1937 CG1 ILE A 126 4.139 -2.966 -5.897 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.657 -3.382 -3.944 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.776 -4.372 -6.322 1.00 0.00 C ATOM 0 H ILE A 126 7.962 -2.124 -5.138 1.00 0.00 H new ATOM 0 HA ILE A 126 5.880 -0.980 -6.411 1.00 0.00 H new ATOM 0 HB ILE A 126 6.227 -3.428 -5.999 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.441 -2.636 -5.128 1.00 0.00 H new ATOM 0 HG13 ILE A 126 4.017 -2.295 -6.747 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.330 -4.422 -3.931 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.688 -3.322 -3.596 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.017 -2.792 -3.287 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.750 -4.387 -6.690 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.451 -4.698 -7.113 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.865 -5.044 -5.469 1.00 0.00 H new ATOM 1951 N PHE A 127 5.548 -0.622 -3.146 1.00 0.00 N ATOM 1952 CA PHE A 127 4.827 0.106 -2.109 1.00 0.00 C ATOM 1953 C PHE A 127 4.975 1.613 -2.300 1.00 0.00 C ATOM 1954 O PHE A 127 4.000 2.359 -2.217 1.00 0.00 O ATOM 1955 CB PHE A 127 5.339 -0.296 -0.724 1.00 0.00 C ATOM 1956 CG PHE A 127 4.871 -1.654 -0.284 1.00 0.00 C ATOM 1957 CD1 PHE A 127 3.547 -2.029 -0.440 1.00 0.00 C ATOM 1958 CD2 PHE A 127 5.756 -2.555 0.287 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.113 -3.277 -0.035 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.328 -3.805 0.694 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.006 -4.167 0.532 1.00 0.00 C ATOM 0 H PHE A 127 6.338 -1.170 -2.805 1.00 0.00 H new ATOM 0 HA PHE A 127 3.771 -0.151 -2.187 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.429 -0.280 -0.729 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.013 0.446 0.005 1.00 0.00 H new ATOM 0 HD1 PHE A 127 2.845 -1.338 -0.883 1.00 0.00 H new ATOM 0 HD2 PHE A 127 6.792 -2.277 0.415 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.078 -3.557 -0.161 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.027 -4.498 1.138 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.670 -5.144 0.848 1.00 0.00 H new ATOM 1971 N SER A 128 6.203 2.053 -2.555 1.00 0.00 N ATOM 1972 CA SER A 128 6.481 3.471 -2.754 1.00 0.00 C ATOM 1973 C SER A 128 5.839 3.975 -4.043 1.00 0.00 C ATOM 1974 O SER A 128 4.859 4.718 -4.010 1.00 0.00 O ATOM 1975 CB SER A 128 7.991 3.716 -2.794 1.00 0.00 C ATOM 1976 OG SER A 128 8.280 5.090 -2.984 1.00 0.00 O ATOM 0 H SER A 128 7.021 1.448 -2.629 1.00 0.00 H new ATOM 0 HA SER A 128 6.053 4.021 -1.916 1.00 0.00 H new ATOM 0 HB2 SER A 128 8.443 3.371 -1.864 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.436 3.133 -3.600 1.00 0.00 H new ATOM 0 HG SER A 128 9.251 5.220 -3.004 1.00 0.00 H new ATOM 1982 N GLU A 129 6.399 3.564 -5.176 1.00 0.00 N ATOM 1983 CA GLU A 129 5.882 3.975 -6.476 1.00 0.00 C ATOM 1984 C GLU A 129 6.261 2.966 -7.556 1.00 0.00 C ATOM 1985 O GLU A 129 6.950 1.982 -7.287 1.00 0.00 O ATOM 1986 CB GLU A 129 6.415 5.360 -6.847 1.00 0.00 C ATOM 1987 CG GLU A 129 5.471 6.160 -7.729 1.00 0.00 C ATOM 1988 CD GLU A 129 5.681 7.656 -7.603 1.00 0.00 C ATOM 1989 OE1 GLU A 129 6.844 8.102 -7.692 1.00 0.00 O ATOM 1990 OE2 GLU A 129 4.682 8.382 -7.415 1.00 0.00 O ATOM 0 H GLU A 129 7.210 2.947 -5.220 1.00 0.00 H new ATOM 0 HA GLU A 129 4.795 4.018 -6.409 1.00 0.00 H new ATOM 0 HB2 GLU A 129 6.609 5.922 -5.933 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.370 5.247 -7.360 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.612 5.863 -8.768 1.00 0.00 H new ATOM 0 HG3 GLU A 129 4.441 5.918 -7.466 1.00 0.00 H new ATOM 1997 N ASP A 130 5.804 3.217 -8.778 1.00 0.00 N ATOM 1998 CA ASP A 130 6.094 2.331 -9.899 1.00 0.00 C ATOM 1999 C ASP A 130 7.598 2.229 -10.136 1.00 0.00 C ATOM 2000 O ASP A 130 8.098 1.194 -10.579 1.00 0.00 O ATOM 2001 CB ASP A 130 5.399 2.832 -11.166 1.00 0.00 C ATOM 2002 CG ASP A 130 5.057 1.707 -12.123 1.00 0.00 C ATOM 2003 OD1 ASP A 130 5.975 1.217 -12.813 1.00 0.00 O ATOM 2004 OD2 ASP A 130 3.872 1.318 -12.182 1.00 0.00 O ATOM 0 H ASP A 130 5.231 4.027 -9.017 1.00 0.00 H new ATOM 0 HA ASP A 130 5.714 1.339 -9.654 1.00 0.00 H new ATOM 0 HB2 ASP A 130 4.487 3.361 -10.891 1.00 0.00 H new ATOM 0 HB3 ASP A 130 6.044 3.551 -11.671 1.00 0.00 H new TER 2009 ASP A 130