USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1069 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 106 SER OG : rot 180:sc= 0.0227 USER MOD Set 1.2: A 108 ASN : amide:sc= -0.483 X(o=-0.84,f=-1.1) USER MOD Set 1.3: A 127 MET CE :methyl 156:sc= -0.375 (180deg=-1.15) USER MOD Set 2.1: A 67 LYS NZ :NH3+ -107:sc= 0.552 (180deg=-0.288) USER MOD Set 2.2: A 70 THR OG1 : rot 161:sc= -0.102 USER MOD Set 3.1: A 32 MET CE :methyl -137:sc= -5.49! (180deg=-6.69!) USER MOD Set 3.2: A 114 ASN : amide:sc= 0 X(o=-5.5,f=-5.6) USER MOD Set 4.1: A 22 GLN : amide:sc= -2.06 K(o=-1.9,f=-8.4!) USER MOD Set 4.2: A 100 LYS NZ :NH3+ 157:sc= 0.127 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0638) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -152:sc= -0.303 (180deg=-1.31) USER MOD Single : A 6 ASN : amide:sc= -0.0276 K(o=-0.028,f=-1.2) USER MOD Single : A 14 SER OG : rot 39:sc= 0.309 USER MOD Single : A 16 ASN : amide:sc= -0.148 X(o=-0.15,f=-0.15) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 CYS SG : rot 138:sc= 0.594 USER MOD Single : A 24 SER OG : rot 180:sc= -0.558 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 MET CE :methyl -157:sc= -0.121 (180deg=-1.02) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.419 USER MOD Single : A 47 LYS NZ :NH3+ -160:sc= -0.0729 (180deg=-0.417) USER MOD Single : A 58 MET CE :methyl -177:sc= -0.243 (180deg=-0.258) USER MOD Single : A 59 LYS NZ :NH3+ 160:sc= 0.118 (180deg=-0.336) USER MOD Single : A 60 CYS SG : rot -160:sc= 0.857 USER MOD Single : A 71 THR OG1 : rot 162:sc= 0.778 USER MOD Single : A 73 HIS : no HE2:sc= -0.588 K(o=-0.59,f=-1.6) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot -140:sc= -0.672 USER MOD Single : A 84 THR OG1 : rot -90:sc= -1.05 USER MOD Single : A 85 TYR OH : rot 180:sc= -0.529 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot 50:sc= 0.864 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -1.71 K(o=-1.7,f=-3.1!) USER MOD Single : A 91 LYS NZ :NH3+ -122:sc= -0.807 (180deg=-3.33!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= -0.1 X(o=-0.1,f=-0.2) USER MOD Single : A 101 SER OG : rot 180:sc=-0.00451 USER MOD Single : A 112 LYS NZ :NH3+ -166:sc= -0.163 (180deg=-0.536) USER MOD Single : A 124 ASN : amide:sc= -0.0417 X(o=-0.042,f=-0.49) USER MOD Single : A 125 LYS NZ :NH3+ -148:sc= -0.0755 (180deg=-0.728) USER MOD Single : A 128 THR OG1 : rot 91:sc= 0.703 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.378 0.817 1.050 1.00 24.34 N ATOM 2 CA MET A 1 3.680 0.625 -0.216 1.00 3.14 C ATOM 3 C MET A 1 3.435 -0.857 -0.482 1.00 45.35 C ATOM 4 O MET A 1 2.356 -1.248 -0.926 1.00 72.11 O ATOM 5 CB MET A 1 4.486 1.236 -1.364 1.00 74.11 C ATOM 6 CG MET A 1 4.180 2.705 -1.606 1.00 50.14 C ATOM 7 SD MET A 1 5.216 3.802 -0.620 1.00 4.14 S ATOM 8 CE MET A 1 6.696 3.866 -1.626 1.00 64.13 C ATOM 0 H1 MET A 1 4.414 1.831 1.276 1.00 24.34 H new ATOM 0 H2 MET A 1 3.872 0.312 1.805 1.00 24.34 H new ATOM 0 H3 MET A 1 5.346 0.445 0.973 1.00 24.34 H new ATOM 0 HA MET A 1 2.715 1.128 -0.151 1.00 3.14 H new ATOM 0 HB2 MET A 1 5.549 1.125 -1.150 1.00 74.11 H new ATOM 0 HB3 MET A 1 4.284 0.676 -2.277 1.00 74.11 H new ATOM 0 HG2 MET A 1 4.320 2.932 -2.663 1.00 50.14 H new ATOM 0 HG3 MET A 1 3.132 2.897 -1.375 1.00 50.14 H new ATOM 0 HE1 MET A 1 7.434 4.509 -1.147 1.00 64.13 H new ATOM 0 HE2 MET A 1 7.105 2.862 -1.735 1.00 64.13 H new ATOM 0 HE3 MET A 1 6.450 4.267 -2.610 1.00 64.13 H new ATOM 18 N LYS A 2 4.445 -1.677 -0.210 1.00 14.01 N ATOM 19 CA LYS A 2 4.339 -3.116 -0.419 1.00 64.14 C ATOM 20 C LYS A 2 4.272 -3.856 0.913 1.00 64.35 C ATOM 21 O LYS A 2 4.211 -3.239 1.976 1.00 45.42 O ATOM 22 CB LYS A 2 5.530 -3.622 -1.237 1.00 4.43 C ATOM 23 CG LYS A 2 5.602 -3.034 -2.635 1.00 74.05 C ATOM 24 CD LYS A 2 4.420 -3.471 -3.485 1.00 32.13 C ATOM 25 CE LYS A 2 4.678 -3.233 -4.965 1.00 5.25 C ATOM 26 NZ LYS A 2 4.453 -1.811 -5.345 1.00 54.11 N ATOM 0 H LYS A 2 5.346 -1.369 0.156 1.00 14.01 H new ATOM 0 HA LYS A 2 3.419 -3.311 -0.969 1.00 64.14 H new ATOM 0 HB2 LYS A 2 6.452 -3.386 -0.705 1.00 4.43 H new ATOM 0 HB3 LYS A 2 5.474 -4.708 -1.311 1.00 4.43 H new ATOM 0 HG2 LYS A 2 5.624 -1.946 -2.572 1.00 74.05 H new ATOM 0 HG3 LYS A 2 6.531 -3.345 -3.114 1.00 74.05 H new ATOM 0 HD2 LYS A 2 4.220 -4.529 -3.315 1.00 32.13 H new ATOM 0 HD3 LYS A 2 3.528 -2.925 -3.178 1.00 32.13 H new ATOM 0 HE2 LYS A 2 5.703 -3.515 -5.205 1.00 5.25 H new ATOM 0 HE3 LYS A 2 4.024 -3.875 -5.556 1.00 5.25 H new ATOM 0 HZ1 LYS A 2 4.639 -1.690 -6.361 1.00 54.11 H new ATOM 0 HZ2 LYS A 2 3.468 -1.548 -5.140 1.00 54.11 H new ATOM 0 HZ3 LYS A 2 5.095 -1.200 -4.800 1.00 54.11 H new ATOM 40 N LYS A 3 4.285 -5.183 0.848 1.00 64.40 N ATOM 41 CA LYS A 3 4.229 -6.009 2.049 1.00 41.15 C ATOM 42 C LYS A 3 5.497 -5.846 2.881 1.00 52.11 C ATOM 43 O LYS A 3 6.517 -6.478 2.607 1.00 60.11 O ATOM 44 CB LYS A 3 4.039 -7.480 1.672 1.00 30.13 C ATOM 45 CG LYS A 3 3.942 -8.407 2.872 1.00 54.14 C ATOM 46 CD LYS A 3 2.521 -8.482 3.405 1.00 53.32 C ATOM 47 CE LYS A 3 1.717 -9.563 2.699 1.00 31.23 C ATOM 48 NZ LYS A 3 1.103 -9.064 1.438 1.00 55.00 N ATOM 0 H LYS A 3 4.334 -5.710 -0.024 1.00 64.40 H new ATOM 0 HA LYS A 3 3.379 -5.680 2.647 1.00 41.15 H new ATOM 0 HB2 LYS A 3 3.134 -7.579 1.073 1.00 30.13 H new ATOM 0 HB3 LYS A 3 4.873 -7.797 1.045 1.00 30.13 H new ATOM 0 HG2 LYS A 3 4.279 -9.405 2.590 1.00 54.14 H new ATOM 0 HG3 LYS A 3 4.609 -8.056 3.659 1.00 54.14 H new ATOM 0 HD2 LYS A 3 2.543 -8.685 4.476 1.00 53.32 H new ATOM 0 HD3 LYS A 3 2.030 -7.518 3.273 1.00 53.32 H new ATOM 0 HE2 LYS A 3 2.365 -10.411 2.476 1.00 31.23 H new ATOM 0 HE3 LYS A 3 0.934 -9.926 3.365 1.00 31.23 H new ATOM 0 HZ1 LYS A 3 0.234 -9.600 1.239 1.00 55.00 H new ATOM 0 HZ2 LYS A 3 0.872 -8.055 1.540 1.00 55.00 H new ATOM 0 HZ3 LYS A 3 1.774 -9.188 0.653 1.00 55.00 H new ATOM 62 N VAL A 4 5.425 -4.995 3.900 1.00 61.03 N ATOM 63 CA VAL A 4 6.566 -4.751 4.774 1.00 62.21 C ATOM 64 C VAL A 4 6.897 -5.987 5.604 1.00 55.51 C ATOM 65 O VAL A 4 6.221 -6.283 6.590 1.00 4.42 O ATOM 66 CB VAL A 4 6.304 -3.565 5.721 1.00 45.12 C ATOM 67 CG1 VAL A 4 7.502 -3.333 6.630 1.00 54.10 C ATOM 68 CG2 VAL A 4 5.978 -2.310 4.925 1.00 61.33 C ATOM 0 H VAL A 4 4.588 -4.463 4.140 1.00 61.03 H new ATOM 0 HA VAL A 4 7.412 -4.512 4.130 1.00 62.21 H new ATOM 0 HB VAL A 4 5.444 -3.805 6.347 1.00 45.12 H new ATOM 0 HG11 VAL A 4 7.299 -2.491 7.292 1.00 54.10 H new ATOM 0 HG12 VAL A 4 7.685 -4.227 7.226 1.00 54.10 H new ATOM 0 HG13 VAL A 4 8.381 -3.114 6.024 1.00 54.10 H new ATOM 0 HG21 VAL A 4 5.796 -1.482 5.610 1.00 61.33 H new ATOM 0 HG22 VAL A 4 6.817 -2.064 4.274 1.00 61.33 H new ATOM 0 HG23 VAL A 4 5.088 -2.484 4.320 1.00 61.33 H new ATOM 78 N ILE A 5 7.939 -6.703 5.198 1.00 21.55 N ATOM 79 CA ILE A 5 8.360 -7.906 5.906 1.00 21.30 C ATOM 80 C ILE A 5 9.303 -7.566 7.055 1.00 31.43 C ATOM 81 O ILE A 5 10.356 -6.964 6.850 1.00 14.13 O ATOM 82 CB ILE A 5 9.059 -8.900 4.960 1.00 23.30 C ATOM 83 CG1 ILE A 5 8.292 -9.008 3.640 1.00 3.15 C ATOM 84 CG2 ILE A 5 9.181 -10.265 5.621 1.00 35.03 C ATOM 85 CD1 ILE A 5 6.842 -9.401 3.815 1.00 41.21 C ATOM 0 H ILE A 5 8.507 -6.472 4.383 1.00 21.55 H new ATOM 0 HA ILE A 5 7.458 -8.370 6.305 1.00 21.30 H new ATOM 0 HB ILE A 5 10.062 -8.531 4.746 1.00 23.30 H new ATOM 0 HG12 ILE A 5 8.341 -8.051 3.121 1.00 3.15 H new ATOM 0 HG13 ILE A 5 8.785 -9.742 3.002 1.00 3.15 H new ATOM 0 HG21 ILE A 5 9.677 -10.956 4.940 1.00 35.03 H new ATOM 0 HG22 ILE A 5 9.766 -10.175 6.536 1.00 35.03 H new ATOM 0 HG23 ILE A 5 8.187 -10.643 5.861 1.00 35.03 H new ATOM 0 HD11 ILE A 5 6.360 -9.458 2.839 1.00 41.21 H new ATOM 0 HD12 ILE A 5 6.785 -10.373 4.306 1.00 41.21 H new ATOM 0 HD13 ILE A 5 6.334 -8.655 4.427 1.00 41.21 H new ATOM 97 N ASN A 6 8.918 -7.959 8.265 1.00 33.03 N ATOM 98 CA ASN A 6 9.730 -7.697 9.448 1.00 34.22 C ATOM 99 C ASN A 6 10.369 -8.983 9.965 1.00 53.42 C ATOM 100 O ASN A 6 9.711 -9.801 10.607 1.00 73.41 O ATOM 101 CB ASN A 6 8.876 -7.061 10.547 1.00 22.14 C ATOM 102 CG ASN A 6 8.799 -5.552 10.419 1.00 73.12 C ATOM 103 OD1 ASN A 6 8.842 -5.009 9.315 1.00 43.11 O ATOM 104 ND2 ASN A 6 8.683 -4.867 11.551 1.00 64.23 N ATOM 0 H ASN A 6 8.049 -8.460 8.452 1.00 33.03 H new ATOM 0 HA ASN A 6 10.524 -7.005 9.168 1.00 34.22 H new ATOM 0 HB2 ASN A 6 7.870 -7.478 10.508 1.00 22.14 H new ATOM 0 HB3 ASN A 6 9.291 -7.320 11.521 1.00 22.14 H new ATOM 0 HD21 ASN A 6 8.626 -3.849 11.527 1.00 64.23 H new ATOM 0 HD22 ASN A 6 8.651 -5.359 12.444 1.00 64.23 H new ATOM 111 N VAL A 7 11.656 -9.153 9.681 1.00 40.34 N ATOM 112 CA VAL A 7 12.385 -10.337 10.118 1.00 63.25 C ATOM 113 C VAL A 7 13.581 -9.958 10.984 1.00 11.21 C ATOM 114 O VAL A 7 14.042 -8.817 10.959 1.00 3.32 O ATOM 115 CB VAL A 7 12.878 -11.167 8.917 1.00 21.44 C ATOM 116 CG1 VAL A 7 11.721 -11.919 8.277 1.00 61.02 C ATOM 117 CG2 VAL A 7 13.572 -10.274 7.901 1.00 41.42 C ATOM 0 H VAL A 7 12.215 -8.485 9.150 1.00 40.34 H new ATOM 0 HA VAL A 7 11.690 -10.937 10.706 1.00 63.25 H new ATOM 0 HB VAL A 7 13.601 -11.899 9.276 1.00 21.44 H new ATOM 0 HG11 VAL A 7 12.088 -12.500 7.431 1.00 61.02 H new ATOM 0 HG12 VAL A 7 11.273 -12.590 9.010 1.00 61.02 H new ATOM 0 HG13 VAL A 7 10.972 -11.207 7.931 1.00 61.02 H new ATOM 0 HG21 VAL A 7 13.914 -10.877 7.060 1.00 41.42 H new ATOM 0 HG22 VAL A 7 12.873 -9.517 7.545 1.00 41.42 H new ATOM 0 HG23 VAL A 7 14.427 -9.787 8.369 1.00 41.42 H new ATOM 127 N VAL A 8 14.079 -10.923 11.751 1.00 43.24 N ATOM 128 CA VAL A 8 15.223 -10.691 12.625 1.00 50.04 C ATOM 129 C VAL A 8 16.142 -11.907 12.661 1.00 1.21 C ATOM 130 O VAL A 8 15.753 -13.005 12.265 1.00 13.52 O ATOM 131 CB VAL A 8 14.774 -10.357 14.060 1.00 61.33 C ATOM 132 CG1 VAL A 8 13.878 -9.128 14.067 1.00 61.11 C ATOM 133 CG2 VAL A 8 14.064 -11.548 14.686 1.00 24.10 C ATOM 0 H VAL A 8 13.708 -11.873 11.785 1.00 43.24 H new ATOM 0 HA VAL A 8 15.767 -9.840 12.216 1.00 50.04 H new ATOM 0 HB VAL A 8 15.659 -10.135 14.657 1.00 61.33 H new ATOM 0 HG11 VAL A 8 13.571 -8.908 15.089 1.00 61.11 H new ATOM 0 HG12 VAL A 8 14.425 -8.277 13.661 1.00 61.11 H new ATOM 0 HG13 VAL A 8 12.996 -9.318 13.456 1.00 61.11 H new ATOM 0 HG21 VAL A 8 13.753 -11.295 15.700 1.00 24.10 H new ATOM 0 HG22 VAL A 8 13.187 -11.803 14.091 1.00 24.10 H new ATOM 0 HG23 VAL A 8 14.742 -12.401 14.717 1.00 24.10 H new ATOM 143 N GLY A 9 17.366 -11.703 13.140 1.00 14.10 N ATOM 144 CA GLY A 9 18.322 -12.792 13.220 1.00 11.50 C ATOM 145 C GLY A 9 19.094 -12.791 14.525 1.00 55.23 C ATOM 146 O GLY A 9 18.731 -12.088 15.468 1.00 74.42 O ATOM 0 H GLY A 9 17.712 -10.803 13.474 1.00 14.10 H new ATOM 0 HA2 GLY A 9 17.797 -13.741 13.113 1.00 11.50 H new ATOM 0 HA3 GLY A 9 19.022 -12.719 12.387 1.00 11.50 H new ATOM 150 N ALA A 10 20.160 -13.581 14.580 1.00 64.31 N ATOM 151 CA ALA A 10 20.985 -13.669 15.778 1.00 2.25 C ATOM 152 C ALA A 10 22.371 -14.214 15.452 1.00 23.44 C ATOM 153 O ALA A 10 22.516 -15.108 14.618 1.00 21.41 O ATOM 154 CB ALA A 10 20.306 -14.540 16.824 1.00 34.04 C ATOM 0 H ALA A 10 20.473 -14.170 13.808 1.00 64.31 H new ATOM 0 HA ALA A 10 21.105 -12.663 16.181 1.00 2.25 H new ATOM 0 HB1 ALA A 10 20.934 -14.597 17.713 1.00 34.04 H new ATOM 0 HB2 ALA A 10 19.341 -14.107 17.088 1.00 34.04 H new ATOM 0 HB3 ALA A 10 20.156 -15.542 16.421 1.00 34.04 H new ATOM 160 N ILE A 11 23.387 -13.671 16.115 1.00 51.34 N ATOM 161 CA ILE A 11 24.761 -14.104 15.895 1.00 61.04 C ATOM 162 C ILE A 11 25.395 -14.601 17.190 1.00 51.43 C ATOM 163 O ILE A 11 25.875 -13.808 18.001 1.00 34.42 O ATOM 164 CB ILE A 11 25.624 -12.967 15.317 1.00 43.11 C ATOM 165 CG1 ILE A 11 25.294 -11.644 16.010 1.00 54.40 C ATOM 166 CG2 ILE A 11 25.412 -12.852 13.815 1.00 43.13 C ATOM 167 CD1 ILE A 11 26.196 -10.503 15.596 1.00 43.40 C ATOM 0 H ILE A 11 23.284 -12.930 16.809 1.00 51.34 H new ATOM 0 HA ILE A 11 24.723 -14.922 15.175 1.00 61.04 H new ATOM 0 HB ILE A 11 26.673 -13.199 15.499 1.00 43.11 H new ATOM 0 HG12 ILE A 11 24.260 -11.377 15.791 1.00 54.40 H new ATOM 0 HG13 ILE A 11 25.367 -11.781 17.089 1.00 54.40 H new ATOM 0 HG21 ILE A 11 26.029 -12.044 13.421 1.00 43.13 H new ATOM 0 HG22 ILE A 11 25.693 -13.790 13.335 1.00 43.13 H new ATOM 0 HG23 ILE A 11 24.363 -12.640 13.611 1.00 43.13 H new ATOM 0 HD11 ILE A 11 25.904 -9.597 16.127 1.00 43.40 H new ATOM 0 HD12 ILE A 11 27.229 -10.749 15.840 1.00 43.40 H new ATOM 0 HD13 ILE A 11 26.106 -10.339 14.522 1.00 43.40 H new ATOM 179 N ILE A 12 25.395 -15.916 17.375 1.00 34.25 N ATOM 180 CA ILE A 12 25.972 -16.519 18.570 1.00 4.45 C ATOM 181 C ILE A 12 27.492 -16.594 18.468 1.00 10.35 C ATOM 182 O ILE A 12 28.034 -17.240 17.571 1.00 34.14 O ATOM 183 CB ILE A 12 25.415 -17.933 18.814 1.00 72.55 C ATOM 184 CG1 ILE A 12 23.900 -17.879 19.025 1.00 64.21 C ATOM 185 CG2 ILE A 12 26.100 -18.574 20.012 1.00 73.15 C ATOM 186 CD1 ILE A 12 23.106 -18.028 17.746 1.00 1.22 C ATOM 0 H ILE A 12 25.002 -16.585 16.713 1.00 34.25 H new ATOM 0 HA ILE A 12 25.697 -15.880 19.409 1.00 4.45 H new ATOM 0 HB ILE A 12 25.619 -18.544 17.935 1.00 72.55 H new ATOM 0 HG12 ILE A 12 23.609 -18.669 19.718 1.00 64.21 H new ATOM 0 HG13 ILE A 12 23.640 -16.931 19.496 1.00 64.21 H new ATOM 0 HG21 ILE A 12 25.695 -19.573 20.171 1.00 73.15 H new ATOM 0 HG22 ILE A 12 27.172 -18.642 19.825 1.00 73.15 H new ATOM 0 HG23 ILE A 12 25.925 -17.966 20.900 1.00 73.15 H new ATOM 0 HD11 ILE A 12 22.041 -17.980 17.971 1.00 1.22 H new ATOM 0 HD12 ILE A 12 23.368 -17.223 17.059 1.00 1.22 H new ATOM 0 HD13 ILE A 12 23.336 -18.988 17.284 1.00 1.22 H new ATOM 198 N PHE A 13 28.175 -15.930 19.395 1.00 42.31 N ATOM 199 CA PHE A 13 29.633 -15.922 19.410 1.00 4.44 C ATOM 200 C PHE A 13 30.172 -16.926 20.425 1.00 1.32 C ATOM 201 O PHE A 13 29.627 -17.072 21.519 1.00 3.34 O ATOM 202 CB PHE A 13 30.153 -14.520 19.737 1.00 23.22 C ATOM 203 CG PHE A 13 30.217 -13.611 18.543 1.00 24.13 C ATOM 204 CD1 PHE A 13 29.057 -13.120 17.967 1.00 70.12 C ATOM 205 CD2 PHE A 13 31.438 -13.247 17.998 1.00 52.02 C ATOM 206 CE1 PHE A 13 29.113 -12.284 16.868 1.00 62.13 C ATOM 207 CE2 PHE A 13 31.500 -12.411 16.899 1.00 44.11 C ATOM 208 CZ PHE A 13 30.336 -11.928 16.334 1.00 64.01 C ATOM 0 H PHE A 13 27.742 -15.391 20.145 1.00 42.31 H new ATOM 0 HA PHE A 13 29.983 -16.210 18.419 1.00 4.44 H new ATOM 0 HB2 PHE A 13 29.509 -14.069 20.493 1.00 23.22 H new ATOM 0 HB3 PHE A 13 31.148 -14.603 20.174 1.00 23.22 H new ATOM 0 HD1 PHE A 13 28.098 -13.394 18.381 1.00 70.12 H new ATOM 0 HD2 PHE A 13 32.351 -13.621 18.437 1.00 52.02 H new ATOM 0 HE1 PHE A 13 28.201 -11.909 16.427 1.00 62.13 H new ATOM 0 HE2 PHE A 13 32.458 -12.136 16.483 1.00 44.11 H new ATOM 0 HZ PHE A 13 30.382 -11.273 15.476 1.00 64.01 H new ATOM 218 N SER A 14 31.246 -17.616 20.053 1.00 15.24 N ATOM 219 CA SER A 14 31.856 -18.610 20.928 1.00 2.45 C ATOM 220 C SER A 14 33.299 -18.883 20.516 1.00 5.11 C ATOM 221 O SER A 14 33.563 -19.341 19.404 1.00 51.40 O ATOM 222 CB SER A 14 31.051 -19.910 20.899 1.00 14.10 C ATOM 223 OG SER A 14 30.880 -20.374 19.571 1.00 32.11 O ATOM 0 H SER A 14 31.711 -17.505 19.152 1.00 15.24 H new ATOM 0 HA SER A 14 31.855 -18.213 21.943 1.00 2.45 H new ATOM 0 HB2 SER A 14 31.561 -20.670 21.491 1.00 14.10 H new ATOM 0 HB3 SER A 14 30.076 -19.748 21.359 1.00 14.10 H new ATOM 0 HG SER A 14 31.705 -20.226 19.064 1.00 32.11 H new ATOM 229 N ASP A 15 34.230 -18.599 21.420 1.00 2.24 N ATOM 230 CA ASP A 15 35.647 -18.814 21.153 1.00 64.23 C ATOM 231 C ASP A 15 36.100 -18.008 19.939 1.00 10.14 C ATOM 232 O ASP A 15 36.941 -18.457 19.162 1.00 21.02 O ATOM 233 CB ASP A 15 35.925 -20.301 20.925 1.00 40.00 C ATOM 234 CG ASP A 15 36.051 -21.072 22.224 1.00 23.02 C ATOM 235 OD1 ASP A 15 37.074 -20.899 22.920 1.00 52.45 O ATOM 236 OD2 ASP A 15 35.128 -21.850 22.545 1.00 10.53 O ATOM 0 H ASP A 15 34.028 -18.219 22.345 1.00 2.24 H new ATOM 0 HA ASP A 15 36.210 -18.476 22.023 1.00 64.23 H new ATOM 0 HB2 ASP A 15 35.121 -20.731 20.327 1.00 40.00 H new ATOM 0 HB3 ASP A 15 36.844 -20.412 20.349 1.00 40.00 H new ATOM 241 N ASN A 16 35.535 -16.815 19.784 1.00 72.14 N ATOM 242 CA ASN A 16 35.879 -15.947 18.664 1.00 50.43 C ATOM 243 C ASN A 16 35.475 -16.583 17.337 1.00 31.14 C ATOM 244 O ASN A 16 36.201 -16.496 16.347 1.00 1.20 O ATOM 245 CB ASN A 16 37.380 -15.650 18.664 1.00 61.43 C ATOM 246 CG ASN A 16 37.926 -15.429 20.061 1.00 13.02 C ATOM 247 OD1 ASN A 16 37.463 -14.550 20.788 1.00 34.24 O ATOM 248 ND2 ASN A 16 38.916 -16.228 20.443 1.00 53.50 N ATOM 0 H ASN A 16 34.837 -16.428 20.419 1.00 72.14 H new ATOM 0 HA ASN A 16 35.330 -15.012 18.780 1.00 50.43 H new ATOM 0 HB2 ASN A 16 37.911 -16.479 18.196 1.00 61.43 H new ATOM 0 HB3 ASN A 16 37.572 -14.765 18.058 1.00 61.43 H new ATOM 0 HD21 ASN A 16 39.324 -16.126 21.372 1.00 53.50 H new ATOM 0 HD22 ASN A 16 39.268 -16.943 19.807 1.00 53.50 H new ATOM 255 N LYS A 17 34.311 -17.223 17.325 1.00 33.42 N ATOM 256 CA LYS A 17 33.807 -17.874 16.121 1.00 1.33 C ATOM 257 C LYS A 17 32.308 -17.641 15.964 1.00 51.34 C ATOM 258 O LYS A 17 31.621 -17.288 16.923 1.00 60.51 O ATOM 259 CB LYS A 17 34.099 -19.375 16.168 1.00 75.31 C ATOM 260 CG LYS A 17 35.482 -19.742 15.660 1.00 61.50 C ATOM 261 CD LYS A 17 36.427 -20.070 16.804 1.00 43.32 C ATOM 262 CE LYS A 17 37.297 -21.275 16.481 1.00 41.14 C ATOM 263 NZ LYS A 17 38.426 -21.418 17.441 1.00 0.22 N ATOM 0 H LYS A 17 33.698 -17.305 18.136 1.00 33.42 H new ATOM 0 HA LYS A 17 34.316 -17.438 15.262 1.00 1.33 H new ATOM 0 HB2 LYS A 17 33.994 -19.725 17.195 1.00 75.31 H new ATOM 0 HB3 LYS A 17 33.352 -19.901 15.574 1.00 75.31 H new ATOM 0 HG2 LYS A 17 35.409 -20.599 14.990 1.00 61.50 H new ATOM 0 HG3 LYS A 17 35.888 -18.915 15.077 1.00 61.50 H new ATOM 0 HD2 LYS A 17 37.061 -19.208 17.012 1.00 43.32 H new ATOM 0 HD3 LYS A 17 35.851 -20.268 17.708 1.00 43.32 H new ATOM 0 HE2 LYS A 17 36.687 -22.178 16.500 1.00 41.14 H new ATOM 0 HE3 LYS A 17 37.691 -21.178 15.469 1.00 41.14 H new ATOM 0 HZ1 LYS A 17 38.995 -22.251 17.186 1.00 0.22 H new ATOM 0 HZ2 LYS A 17 39.023 -20.567 17.405 1.00 0.22 H new ATOM 0 HZ3 LYS A 17 38.050 -21.537 18.404 1.00 0.22 H new ATOM 277 N ILE A 18 31.807 -17.841 14.749 1.00 2.22 N ATOM 278 CA ILE A 18 30.389 -17.655 14.468 1.00 42.10 C ATOM 279 C ILE A 18 29.735 -18.967 14.051 1.00 72.54 C ATOM 280 O ILE A 18 30.377 -19.832 13.452 1.00 1.52 O ATOM 281 CB ILE A 18 30.167 -16.609 13.360 1.00 45.42 C ATOM 282 CG1 ILE A 18 30.941 -15.327 13.676 1.00 12.23 C ATOM 283 CG2 ILE A 18 28.684 -16.313 13.200 1.00 52.41 C ATOM 284 CD1 ILE A 18 32.324 -15.289 13.065 1.00 52.14 C ATOM 0 H ILE A 18 32.362 -18.132 13.944 1.00 2.22 H new ATOM 0 HA ILE A 18 29.929 -17.299 15.390 1.00 42.10 H new ATOM 0 HB ILE A 18 30.540 -17.014 12.419 1.00 45.42 H new ATOM 0 HG12 ILE A 18 30.371 -14.470 13.317 1.00 12.23 H new ATOM 0 HG13 ILE A 18 31.028 -15.222 14.757 1.00 12.23 H new ATOM 0 HG21 ILE A 18 28.544 -15.572 12.413 1.00 52.41 H new ATOM 0 HG22 ILE A 18 28.157 -17.229 12.934 1.00 52.41 H new ATOM 0 HG23 ILE A 18 28.287 -15.926 14.138 1.00 52.41 H new ATOM 0 HD11 ILE A 18 32.814 -14.352 13.331 1.00 52.14 H new ATOM 0 HD12 ILE A 18 32.912 -16.125 13.443 1.00 52.14 H new ATOM 0 HD13 ILE A 18 32.245 -15.362 11.980 1.00 52.14 H new ATOM 296 N LEU A 19 28.453 -19.110 14.368 1.00 32.13 N ATOM 297 CA LEU A 19 27.709 -20.317 14.025 1.00 62.23 C ATOM 298 C LEU A 19 27.028 -20.170 12.668 1.00 41.52 C ATOM 299 O LEU A 19 26.855 -19.058 12.167 1.00 45.24 O ATOM 300 CB LEU A 19 26.666 -20.621 15.101 1.00 31.13 C ATOM 301 CG LEU A 19 25.306 -19.943 14.929 1.00 61.34 C ATOM 302 CD1 LEU A 19 24.337 -20.410 16.003 1.00 33.24 C ATOM 303 CD2 LEU A 19 25.456 -18.429 14.964 1.00 24.55 C ATOM 0 H LEU A 19 27.907 -18.405 14.862 1.00 32.13 H new ATOM 0 HA LEU A 19 28.416 -21.145 13.969 1.00 62.23 H new ATOM 0 HB2 LEU A 19 26.510 -21.699 15.133 1.00 31.13 H new ATOM 0 HB3 LEU A 19 27.075 -20.329 16.068 1.00 31.13 H new ATOM 0 HG LEU A 19 24.902 -20.225 13.957 1.00 61.34 H new ATOM 0 HD11 LEU A 19 23.375 -19.917 15.864 1.00 33.24 H new ATOM 0 HD12 LEU A 19 24.205 -21.490 15.930 1.00 33.24 H new ATOM 0 HD13 LEU A 19 24.735 -20.159 16.986 1.00 33.24 H new ATOM 0 HD21 LEU A 19 24.478 -17.964 14.840 1.00 24.55 H new ATOM 0 HD22 LEU A 19 25.883 -18.128 15.921 1.00 24.55 H new ATOM 0 HD23 LEU A 19 26.115 -18.110 14.156 1.00 24.55 H new ATOM 315 N CYS A 20 26.642 -21.296 12.080 1.00 72.30 N ATOM 316 CA CYS A 20 25.978 -21.292 10.781 1.00 32.43 C ATOM 317 C CYS A 20 24.762 -22.213 10.790 1.00 55.42 C ATOM 318 O CYS A 20 24.796 -23.298 11.369 1.00 12.33 O ATOM 319 CB CYS A 20 26.953 -21.726 9.685 1.00 14.44 C ATOM 320 SG CYS A 20 26.155 -22.208 8.136 1.00 31.33 S ATOM 0 H CYS A 20 26.777 -22.224 12.482 1.00 72.30 H new ATOM 0 HA CYS A 20 25.641 -20.276 10.576 1.00 32.43 H new ATOM 0 HB2 CYS A 20 27.646 -20.909 9.485 1.00 14.44 H new ATOM 0 HB3 CYS A 20 27.546 -22.564 10.052 1.00 14.44 H new ATOM 0 HG CYS A 20 26.827 -21.725 7.133 1.00 31.33 H new ATOM 326 N ALA A 21 23.687 -21.771 10.144 1.00 1.34 N ATOM 327 CA ALA A 21 22.460 -22.555 10.077 1.00 0.53 C ATOM 328 C ALA A 21 21.741 -22.336 8.750 1.00 20.34 C ATOM 329 O ALA A 21 21.365 -21.213 8.416 1.00 34.40 O ATOM 330 CB ALA A 21 21.544 -22.202 11.240 1.00 3.02 C ATOM 0 H ALA A 21 23.642 -20.874 9.660 1.00 1.34 H new ATOM 0 HA ALA A 21 22.727 -23.609 10.146 1.00 0.53 H new ATOM 0 HB1 ALA A 21 20.632 -22.795 11.177 1.00 3.02 H new ATOM 0 HB2 ALA A 21 22.052 -22.415 12.181 1.00 3.02 H new ATOM 0 HB3 ALA A 21 21.292 -21.142 11.196 1.00 3.02 H new ATOM 336 N GLN A 22 21.555 -23.417 7.999 1.00 52.31 N ATOM 337 CA GLN A 22 20.882 -23.342 6.707 1.00 10.45 C ATOM 338 C GLN A 22 19.474 -23.922 6.793 1.00 41.24 C ATOM 339 O GLN A 22 19.297 -25.138 6.860 1.00 34.24 O ATOM 340 CB GLN A 22 21.690 -24.087 5.644 1.00 50.34 C ATOM 341 CG GLN A 22 21.187 -23.858 4.227 1.00 24.32 C ATOM 342 CD GLN A 22 21.961 -24.658 3.198 1.00 74.45 C ATOM 343 OE1 GLN A 22 22.928 -25.345 3.527 1.00 44.23 O ATOM 344 NE2 GLN A 22 21.537 -24.574 1.942 1.00 75.50 N ATOM 0 H GLN A 22 21.860 -24.354 8.262 1.00 52.31 H new ATOM 0 HA GLN A 22 20.806 -22.292 6.425 1.00 10.45 H new ATOM 0 HB2 GLN A 22 22.732 -23.774 5.706 1.00 50.34 H new ATOM 0 HB3 GLN A 22 21.664 -25.155 5.862 1.00 50.34 H new ATOM 0 HG2 GLN A 22 20.132 -24.126 4.172 1.00 24.32 H new ATOM 0 HG3 GLN A 22 21.259 -22.797 3.987 1.00 24.32 H new ATOM 0 HE21 GLN A 22 20.731 -23.992 1.714 1.00 75.50 H new ATOM 0 HE22 GLN A 22 22.018 -25.091 1.206 1.00 75.50 H new ATOM 353 N ARG A 23 18.476 -23.044 6.789 1.00 4.21 N ATOM 354 CA ARG A 23 17.084 -23.469 6.868 1.00 61.24 C ATOM 355 C ARG A 23 16.645 -24.134 5.566 1.00 33.34 C ATOM 356 O ARG A 23 16.404 -25.341 5.525 1.00 53.32 O ATOM 357 CB ARG A 23 16.180 -22.274 7.172 1.00 12.45 C ATOM 358 CG ARG A 23 14.760 -22.664 7.549 1.00 71.23 C ATOM 359 CD ARG A 23 14.076 -21.570 8.353 1.00 33.01 C ATOM 360 NE ARG A 23 14.436 -21.624 9.767 1.00 12.14 N ATOM 361 CZ ARG A 23 13.874 -22.456 10.638 1.00 40.44 C ATOM 362 NH1 ARG A 23 12.931 -23.299 10.240 1.00 3.10 N ATOM 363 NH2 ARG A 23 14.255 -22.445 11.908 1.00 24.15 N ATOM 0 H ARG A 23 18.606 -22.034 6.732 1.00 4.21 H new ATOM 0 HA ARG A 23 16.997 -24.196 7.676 1.00 61.24 H new ATOM 0 HB2 ARG A 23 16.617 -21.696 7.986 1.00 12.45 H new ATOM 0 HB3 ARG A 23 16.149 -21.622 6.299 1.00 12.45 H new ATOM 0 HG2 ARG A 23 14.185 -22.866 6.645 1.00 71.23 H new ATOM 0 HG3 ARG A 23 14.777 -23.587 8.129 1.00 71.23 H new ATOM 0 HD2 ARG A 23 14.349 -20.596 7.946 1.00 33.01 H new ATOM 0 HD3 ARG A 23 12.995 -21.666 8.250 1.00 33.01 H new ATOM 0 HE ARG A 23 15.159 -20.988 10.105 1.00 12.14 H new ATOM 0 HH11 ARG A 23 12.636 -23.310 9.264 1.00 3.10 H new ATOM 0 HH12 ARG A 23 12.501 -23.937 10.910 1.00 3.10 H new ATOM 0 HH21 ARG A 23 14.980 -21.798 12.217 1.00 24.15 H new ATOM 0 HH22 ARG A 23 13.823 -23.084 12.576 1.00 24.15 H new ATOM 377 N SER A 24 16.542 -23.339 4.506 1.00 1.25 N ATOM 378 CA SER A 24 16.127 -23.849 3.205 1.00 65.20 C ATOM 379 C SER A 24 16.545 -22.896 2.089 1.00 11.24 C ATOM 380 O SER A 24 17.305 -21.955 2.315 1.00 11.14 O ATOM 381 CB SER A 24 14.612 -24.056 3.174 1.00 70.20 C ATOM 382 OG SER A 24 14.071 -24.060 4.484 1.00 51.13 O ATOM 0 H SER A 24 16.740 -22.339 4.523 1.00 1.25 H new ATOM 0 HA SER A 24 16.620 -24.807 3.044 1.00 65.20 H new ATOM 0 HB2 SER A 24 14.146 -23.265 2.587 1.00 70.20 H new ATOM 0 HB3 SER A 24 14.381 -24.999 2.679 1.00 70.20 H new ATOM 0 HG SER A 24 13.101 -24.192 4.437 1.00 51.13 H new ATOM 388 N GLU A 25 16.041 -23.148 0.885 1.00 4.41 N ATOM 389 CA GLU A 25 16.363 -22.312 -0.266 1.00 74.32 C ATOM 390 C GLU A 25 15.564 -21.012 -0.235 1.00 72.52 C ATOM 391 O GLU A 25 15.680 -20.177 -1.132 1.00 4.22 O ATOM 392 CB GLU A 25 16.079 -23.067 -1.567 1.00 2.02 C ATOM 393 CG GLU A 25 16.758 -22.460 -2.783 1.00 54.42 C ATOM 394 CD GLU A 25 16.743 -23.387 -3.983 1.00 52.41 C ATOM 395 OE1 GLU A 25 17.485 -23.118 -4.950 1.00 64.03 O ATOM 396 OE2 GLU A 25 15.988 -24.381 -3.954 1.00 71.22 O ATOM 0 H GLU A 25 15.409 -23.923 0.681 1.00 4.41 H new ATOM 0 HA GLU A 25 17.424 -22.067 -0.220 1.00 74.32 H new ATOM 0 HB2 GLU A 25 16.407 -24.101 -1.456 1.00 2.02 H new ATOM 0 HB3 GLU A 25 15.002 -23.090 -1.736 1.00 2.02 H new ATOM 0 HG2 GLU A 25 16.260 -21.526 -3.044 1.00 54.42 H new ATOM 0 HG3 GLU A 25 17.790 -22.212 -2.533 1.00 54.42 H new ATOM 403 N LYS A 26 14.751 -20.849 0.803 1.00 22.13 N ATOM 404 CA LYS A 26 13.932 -19.652 0.954 1.00 64.11 C ATOM 405 C LYS A 26 14.781 -18.465 1.400 1.00 35.43 C ATOM 406 O LYS A 26 14.628 -17.355 0.892 1.00 72.44 O ATOM 407 CB LYS A 26 12.811 -19.900 1.965 1.00 30.22 C ATOM 408 CG LYS A 26 11.731 -20.840 1.458 1.00 64.52 C ATOM 409 CD LYS A 26 10.884 -20.187 0.379 1.00 2.52 C ATOM 410 CE LYS A 26 9.775 -19.337 0.980 1.00 32.24 C ATOM 411 NZ LYS A 26 8.616 -20.165 1.415 1.00 72.34 N ATOM 0 H LYS A 26 14.642 -21.532 1.553 1.00 22.13 H new ATOM 0 HA LYS A 26 13.492 -19.418 -0.016 1.00 64.11 H new ATOM 0 HB2 LYS A 26 13.241 -20.313 2.878 1.00 30.22 H new ATOM 0 HB3 LYS A 26 12.355 -18.946 2.231 1.00 30.22 H new ATOM 0 HG2 LYS A 26 12.192 -21.745 1.062 1.00 64.52 H new ATOM 0 HG3 LYS A 26 11.093 -21.144 2.288 1.00 64.52 H new ATOM 0 HD2 LYS A 26 11.516 -19.566 -0.256 1.00 2.52 H new ATOM 0 HD3 LYS A 26 10.449 -20.956 -0.259 1.00 2.52 H new ATOM 0 HE2 LYS A 26 10.165 -18.781 1.833 1.00 32.24 H new ATOM 0 HE3 LYS A 26 9.442 -18.603 0.246 1.00 32.24 H new ATOM 0 HZ1 LYS A 26 7.882 -19.549 1.819 1.00 72.34 H new ATOM 0 HZ2 LYS A 26 8.228 -20.676 0.597 1.00 72.34 H new ATOM 0 HZ3 LYS A 26 8.928 -20.849 2.134 1.00 72.34 H new ATOM 425 N MET A 27 15.675 -18.708 2.353 1.00 61.32 N ATOM 426 CA MET A 27 16.549 -17.659 2.865 1.00 62.30 C ATOM 427 C MET A 27 17.400 -17.066 1.746 1.00 32.14 C ATOM 428 O MET A 27 17.237 -17.416 0.578 1.00 70.44 O ATOM 429 CB MET A 27 17.452 -18.212 3.969 1.00 31.35 C ATOM 430 CG MET A 27 16.858 -18.080 5.363 1.00 63.14 C ATOM 431 SD MET A 27 15.315 -18.994 5.550 1.00 41.43 S ATOM 432 CE MET A 27 14.116 -17.691 5.280 1.00 33.01 C ATOM 0 H MET A 27 15.813 -19.621 2.786 1.00 61.32 H new ATOM 0 HA MET A 27 15.923 -16.869 3.279 1.00 62.30 H new ATOM 0 HB2 MET A 27 17.656 -19.264 3.768 1.00 31.35 H new ATOM 0 HB3 MET A 27 18.409 -17.691 3.940 1.00 31.35 H new ATOM 0 HG2 MET A 27 17.580 -18.439 6.097 1.00 63.14 H new ATOM 0 HG3 MET A 27 16.680 -17.027 5.580 1.00 63.14 H new ATOM 0 HE1 MET A 27 13.169 -17.965 5.746 1.00 33.01 H new ATOM 0 HE2 MET A 27 14.482 -16.763 5.720 1.00 33.01 H new ATOM 0 HE3 MET A 27 13.966 -17.550 4.210 1.00 33.01 H new ATOM 442 N SER A 28 18.307 -16.166 2.112 1.00 31.14 N ATOM 443 CA SER A 28 19.180 -15.521 1.139 1.00 62.42 C ATOM 444 C SER A 28 20.443 -16.347 0.911 1.00 11.21 C ATOM 445 O SER A 28 21.155 -16.688 1.857 1.00 73.13 O ATOM 446 CB SER A 28 19.555 -14.115 1.611 1.00 73.14 C ATOM 447 OG SER A 28 18.686 -13.143 1.056 1.00 40.33 O ATOM 0 H SER A 28 18.456 -15.867 3.076 1.00 31.14 H new ATOM 0 HA SER A 28 18.639 -15.447 0.195 1.00 62.42 H new ATOM 0 HB2 SER A 28 19.510 -14.069 2.699 1.00 73.14 H new ATOM 0 HB3 SER A 28 20.583 -13.894 1.325 1.00 73.14 H new ATOM 0 HG SER A 28 18.945 -12.253 1.374 1.00 40.33 H new ATOM 453 N LEU A 29 20.715 -16.665 -0.350 1.00 12.42 N ATOM 454 CA LEU A 29 21.892 -17.450 -0.704 1.00 32.40 C ATOM 455 C LEU A 29 22.214 -18.470 0.384 1.00 54.10 C ATOM 456 O LEU A 29 23.337 -18.551 0.881 1.00 42.53 O ATOM 457 CB LEU A 29 23.094 -16.532 -0.929 1.00 52.54 C ATOM 458 CG LEU A 29 22.863 -15.341 -1.861 1.00 2.13 C ATOM 459 CD1 LEU A 29 23.564 -14.102 -1.327 1.00 5.34 C ATOM 460 CD2 LEU A 29 23.344 -15.663 -3.268 1.00 24.51 C ATOM 0 H LEU A 29 20.136 -16.391 -1.144 1.00 12.42 H new ATOM 0 HA LEU A 29 21.675 -17.987 -1.627 1.00 32.40 H new ATOM 0 HB2 LEU A 29 23.422 -16.152 0.039 1.00 52.54 H new ATOM 0 HB3 LEU A 29 23.912 -17.129 -1.331 1.00 52.54 H new ATOM 0 HG LEU A 29 21.793 -15.139 -1.902 1.00 2.13 H new ATOM 0 HD11 LEU A 29 23.389 -13.265 -2.003 1.00 5.34 H new ATOM 0 HD12 LEU A 29 23.172 -13.859 -0.339 1.00 5.34 H new ATOM 0 HD13 LEU A 29 24.635 -14.292 -1.255 1.00 5.34 H new ATOM 0 HD21 LEU A 29 23.172 -14.804 -3.917 1.00 24.51 H new ATOM 0 HD22 LEU A 29 24.409 -15.892 -3.245 1.00 24.51 H new ATOM 0 HD23 LEU A 29 22.796 -16.524 -3.652 1.00 24.51 H new ATOM 472 N PRO A 30 21.205 -19.269 0.763 1.00 65.52 N ATOM 473 CA PRO A 30 21.357 -20.300 1.794 1.00 64.52 C ATOM 474 C PRO A 30 22.232 -21.460 1.330 1.00 44.23 C ATOM 475 O PRO A 30 22.837 -22.159 2.144 1.00 64.05 O ATOM 476 CB PRO A 30 19.922 -20.776 2.034 1.00 65.22 C ATOM 477 CG PRO A 30 19.207 -20.478 0.762 1.00 54.21 C ATOM 478 CD PRO A 30 19.840 -19.229 0.214 1.00 52.05 C ATOM 0 HA PRO A 30 21.848 -19.913 2.687 1.00 64.52 H new ATOM 0 HB2 PRO A 30 19.891 -21.841 2.265 1.00 65.22 H new ATOM 0 HB3 PRO A 30 19.467 -20.254 2.876 1.00 65.22 H new ATOM 0 HG2 PRO A 30 19.302 -21.305 0.058 1.00 54.21 H new ATOM 0 HG3 PRO A 30 18.142 -20.330 0.939 1.00 54.21 H new ATOM 0 HD2 PRO A 30 19.845 -19.226 -0.876 1.00 52.05 H new ATOM 0 HD3 PRO A 30 19.305 -18.334 0.532 1.00 52.05 H new ATOM 486 N LEU A 31 22.296 -21.659 0.018 1.00 51.42 N ATOM 487 CA LEU A 31 23.098 -22.734 -0.555 1.00 42.12 C ATOM 488 C LEU A 31 24.560 -22.603 -0.140 1.00 42.13 C ATOM 489 O LEU A 31 25.286 -23.594 -0.069 1.00 44.21 O ATOM 490 CB LEU A 31 22.986 -22.723 -2.081 1.00 23.13 C ATOM 491 CG LEU A 31 21.583 -22.510 -2.649 1.00 72.32 C ATOM 492 CD1 LEU A 31 21.557 -21.297 -3.566 1.00 74.53 C ATOM 493 CD2 LEU A 31 21.114 -23.753 -3.392 1.00 22.11 C ATOM 0 H LEU A 31 21.802 -21.090 -0.669 1.00 51.42 H new ATOM 0 HA LEU A 31 22.715 -23.681 -0.176 1.00 42.12 H new ATOM 0 HB2 LEU A 31 23.636 -21.938 -2.467 1.00 23.13 H new ATOM 0 HB3 LEU A 31 23.370 -23.670 -2.460 1.00 23.13 H new ATOM 0 HG LEU A 31 20.900 -22.327 -1.820 1.00 72.32 H new ATOM 0 HD11 LEU A 31 20.550 -21.161 -3.961 1.00 74.53 H new ATOM 0 HD12 LEU A 31 21.849 -20.410 -3.004 1.00 74.53 H new ATOM 0 HD13 LEU A 31 22.253 -21.450 -4.391 1.00 74.53 H new ATOM 0 HD21 LEU A 31 20.113 -23.583 -3.790 1.00 22.11 H new ATOM 0 HD22 LEU A 31 21.799 -23.967 -4.212 1.00 22.11 H new ATOM 0 HD23 LEU A 31 21.093 -24.600 -2.707 1.00 22.11 H new ATOM 505 N MET A 32 24.984 -21.374 0.134 1.00 1.45 N ATOM 506 CA MET A 32 26.359 -21.114 0.546 1.00 12.10 C ATOM 507 C MET A 32 26.435 -20.836 2.044 1.00 55.41 C ATOM 508 O MET A 32 27.254 -21.420 2.752 1.00 4.22 O ATOM 509 CB MET A 32 26.932 -19.929 -0.234 1.00 62.43 C ATOM 510 CG MET A 32 26.027 -18.708 -0.237 1.00 22.12 C ATOM 511 SD MET A 32 26.652 -17.383 -1.288 1.00 73.13 S ATOM 512 CE MET A 32 26.328 -15.953 -0.259 1.00 72.24 C ATOM 0 H MET A 32 24.396 -20.543 0.078 1.00 1.45 H new ATOM 0 HA MET A 32 26.951 -22.003 0.329 1.00 12.10 H new ATOM 0 HB2 MET A 32 27.896 -19.655 0.194 1.00 62.43 H new ATOM 0 HB3 MET A 32 27.116 -20.237 -1.263 1.00 62.43 H new ATOM 0 HG2 MET A 32 25.033 -18.998 -0.577 1.00 22.12 H new ATOM 0 HG3 MET A 32 25.919 -18.338 0.783 1.00 22.12 H new ATOM 0 HE1 MET A 32 25.920 -15.149 -0.872 1.00 72.24 H new ATOM 0 HE2 MET A 32 25.610 -16.218 0.517 1.00 72.24 H new ATOM 0 HE3 MET A 32 27.257 -15.621 0.205 1.00 72.24 H new ATOM 522 N TRP A 33 25.576 -19.941 2.519 1.00 53.23 N ATOM 523 CA TRP A 33 25.546 -19.585 3.933 1.00 64.40 C ATOM 524 C TRP A 33 24.195 -18.993 4.317 1.00 22.05 C ATOM 525 O TRP A 33 23.435 -18.551 3.457 1.00 13.22 O ATOM 526 CB TRP A 33 26.663 -18.590 4.253 1.00 21.42 C ATOM 527 CG TRP A 33 28.035 -19.187 4.161 1.00 71.14 C ATOM 528 CD1 TRP A 33 28.879 -19.139 3.088 1.00 0.41 C ATOM 529 CD2 TRP A 33 28.720 -19.923 5.180 1.00 73.32 C ATOM 530 NE1 TRP A 33 30.047 -19.800 3.379 1.00 25.53 N ATOM 531 CE2 TRP A 33 29.975 -20.290 4.656 1.00 21.15 C ATOM 532 CE3 TRP A 33 28.396 -20.307 6.484 1.00 53.40 C ATOM 533 CZ2 TRP A 33 30.903 -21.022 5.393 1.00 50.13 C ATOM 534 CZ3 TRP A 33 29.318 -21.033 7.213 1.00 33.12 C ATOM 535 CH2 TRP A 33 30.559 -21.384 6.667 1.00 44.02 C ATOM 0 H TRP A 33 24.891 -19.449 1.946 1.00 53.23 H new ATOM 0 HA TRP A 33 25.701 -20.494 4.514 1.00 64.40 H new ATOM 0 HB2 TRP A 33 26.595 -17.746 3.567 1.00 21.42 H new ATOM 0 HB3 TRP A 33 26.512 -18.197 5.258 1.00 21.42 H new ATOM 0 HD1 TRP A 33 28.660 -18.653 2.149 1.00 0.41 H new ATOM 0 HE1 TRP A 33 30.840 -19.909 2.747 1.00 25.53 H new ATOM 0 HE3 TRP A 33 27.442 -20.041 6.914 1.00 53.40 H new ATOM 0 HZ2 TRP A 33 31.860 -21.294 4.974 1.00 50.13 H new ATOM 0 HZ3 TRP A 33 29.078 -21.335 8.222 1.00 33.12 H new ATOM 0 HH2 TRP A 33 31.258 -21.952 7.263 1.00 44.02 H new ATOM 546 N GLU A 34 23.903 -18.988 5.614 1.00 5.45 N ATOM 547 CA GLU A 34 22.642 -18.449 6.111 1.00 65.31 C ATOM 548 C GLU A 34 22.598 -18.486 7.636 1.00 42.21 C ATOM 549 O GLU A 34 23.174 -19.375 8.264 1.00 41.52 O ATOM 550 CB GLU A 34 21.464 -19.239 5.537 1.00 41.55 C ATOM 551 CG GLU A 34 20.123 -18.852 6.136 1.00 33.35 C ATOM 552 CD GLU A 34 19.813 -17.377 5.972 1.00 70.12 C ATOM 553 OE1 GLU A 34 20.299 -16.774 4.993 1.00 44.22 O ATOM 554 OE2 GLU A 34 19.083 -16.826 6.823 1.00 64.12 O ATOM 0 H GLU A 34 24.522 -19.351 6.339 1.00 5.45 H new ATOM 0 HA GLU A 34 22.567 -17.411 5.788 1.00 65.31 H new ATOM 0 HB2 GLU A 34 21.428 -19.088 4.458 1.00 41.55 H new ATOM 0 HB3 GLU A 34 21.634 -20.302 5.705 1.00 41.55 H new ATOM 0 HG2 GLU A 34 19.336 -19.439 5.664 1.00 33.35 H new ATOM 0 HG3 GLU A 34 20.117 -19.105 7.196 1.00 33.35 H new ATOM 561 N PHE A 35 21.911 -17.513 8.225 1.00 33.23 N ATOM 562 CA PHE A 35 21.792 -17.432 9.676 1.00 32.14 C ATOM 563 C PHE A 35 20.397 -17.850 10.132 1.00 12.10 C ATOM 564 O PHE A 35 19.424 -17.779 9.381 1.00 32.40 O ATOM 565 CB PHE A 35 22.092 -16.010 10.155 1.00 25.33 C ATOM 566 CG PHE A 35 23.558 -15.735 10.334 1.00 63.25 C ATOM 567 CD1 PHE A 35 24.177 -14.717 9.626 1.00 73.23 C ATOM 568 CD2 PHE A 35 24.318 -16.495 11.209 1.00 51.15 C ATOM 569 CE1 PHE A 35 25.525 -14.461 9.788 1.00 63.15 C ATOM 570 CE2 PHE A 35 25.667 -16.243 11.375 1.00 74.22 C ATOM 571 CZ PHE A 35 26.271 -15.226 10.663 1.00 43.14 C ATOM 0 H PHE A 35 21.428 -16.770 7.720 1.00 33.23 H new ATOM 0 HA PHE A 35 22.519 -18.117 10.113 1.00 32.14 H new ATOM 0 HB2 PHE A 35 21.682 -15.299 9.437 1.00 25.33 H new ATOM 0 HB3 PHE A 35 21.580 -15.838 11.102 1.00 25.33 H new ATOM 0 HD1 PHE A 35 23.599 -14.117 8.939 1.00 73.23 H new ATOM 0 HD2 PHE A 35 23.851 -17.293 11.767 1.00 51.15 H new ATOM 0 HE1 PHE A 35 25.995 -13.664 9.231 1.00 63.15 H new ATOM 0 HE2 PHE A 35 26.248 -16.841 12.061 1.00 74.22 H new ATOM 0 HZ PHE A 35 27.325 -15.029 10.790 1.00 43.14 H new ATOM 581 N PRO A 36 20.296 -18.297 11.393 1.00 52.23 N ATOM 582 CA PRO A 36 19.025 -18.735 11.978 1.00 62.23 C ATOM 583 C PRO A 36 18.062 -17.575 12.208 1.00 62.52 C ATOM 584 O PRO A 36 18.433 -16.411 12.070 1.00 45.23 O ATOM 585 CB PRO A 36 19.445 -19.355 13.313 1.00 14.21 C ATOM 586 CG PRO A 36 20.730 -18.684 13.655 1.00 63.34 C ATOM 587 CD PRO A 36 21.414 -18.408 12.344 1.00 1.12 C ATOM 0 HA PRO A 36 18.490 -19.422 11.323 1.00 62.23 H new ATOM 0 HB2 PRO A 36 18.692 -19.185 14.083 1.00 14.21 H new ATOM 0 HB3 PRO A 36 19.573 -20.434 13.226 1.00 14.21 H new ATOM 0 HG2 PRO A 36 20.553 -17.760 14.205 1.00 63.34 H new ATOM 0 HG3 PRO A 36 21.346 -19.321 14.290 1.00 63.34 H new ATOM 0 HD2 PRO A 36 22.001 -17.491 12.383 1.00 1.12 H new ATOM 0 HD3 PRO A 36 22.097 -19.212 12.070 1.00 1.12 H new ATOM 595 N GLY A 37 16.822 -17.902 12.560 1.00 24.40 N ATOM 596 CA GLY A 37 15.825 -16.876 12.804 1.00 65.41 C ATOM 597 C GLY A 37 14.539 -17.126 12.042 1.00 13.44 C ATOM 598 O GLY A 37 14.421 -18.110 11.315 1.00 73.35 O ATOM 0 H GLY A 37 16.490 -18.859 12.680 1.00 24.40 H new ATOM 0 HA2 GLY A 37 15.608 -16.830 13.871 1.00 65.41 H new ATOM 0 HA3 GLY A 37 16.230 -15.905 12.519 1.00 65.41 H new ATOM 602 N GLY A 38 13.570 -16.231 12.212 1.00 53.25 N ATOM 603 CA GLY A 38 12.297 -16.378 11.529 1.00 3.54 C ATOM 604 C GLY A 38 11.671 -15.043 11.177 1.00 11.24 C ATOM 605 O GLY A 38 12.229 -14.273 10.396 1.00 45.22 O ATOM 0 H GLY A 38 13.643 -15.408 12.810 1.00 53.25 H new ATOM 0 HA2 GLY A 38 12.442 -16.959 10.618 1.00 3.54 H new ATOM 0 HA3 GLY A 38 11.612 -16.942 12.162 1.00 3.54 H new ATOM 609 N LYS A 39 10.506 -14.767 11.754 1.00 71.41 N ATOM 610 CA LYS A 39 9.801 -13.517 11.497 1.00 4.14 C ATOM 611 C LYS A 39 9.385 -12.849 12.804 1.00 75.30 C ATOM 612 O LYS A 39 9.431 -13.464 13.869 1.00 30.34 O ATOM 613 CB LYS A 39 8.569 -13.771 10.627 1.00 71.45 C ATOM 614 CG LYS A 39 7.535 -14.669 11.284 1.00 55.43 C ATOM 615 CD LYS A 39 7.718 -16.121 10.877 1.00 34.34 C ATOM 616 CE LYS A 39 7.027 -16.422 9.556 1.00 51.31 C ATOM 617 NZ LYS A 39 7.524 -17.685 8.945 1.00 60.50 N ATOM 0 H LYS A 39 10.030 -15.393 12.403 1.00 71.41 H new ATOM 0 HA LYS A 39 10.480 -12.849 10.967 1.00 4.14 H new ATOM 0 HB2 LYS A 39 8.105 -12.816 10.381 1.00 71.45 H new ATOM 0 HB3 LYS A 39 8.885 -14.223 9.687 1.00 71.45 H new ATOM 0 HG2 LYS A 39 7.612 -14.582 12.368 1.00 55.43 H new ATOM 0 HG3 LYS A 39 6.535 -14.336 11.008 1.00 55.43 H new ATOM 0 HD2 LYS A 39 8.781 -16.345 10.792 1.00 34.34 H new ATOM 0 HD3 LYS A 39 7.317 -16.771 11.655 1.00 34.34 H new ATOM 0 HE2 LYS A 39 5.952 -16.495 9.717 1.00 51.31 H new ATOM 0 HE3 LYS A 39 7.190 -15.595 8.864 1.00 51.31 H new ATOM 0 HZ1 LYS A 39 7.028 -17.854 8.047 1.00 60.50 H new ATOM 0 HZ2 LYS A 39 8.546 -17.606 8.767 1.00 60.50 H new ATOM 0 HZ3 LYS A 39 7.346 -18.478 9.594 1.00 60.50 H new ATOM 631 N VAL A 40 8.976 -11.587 12.715 1.00 71.55 N ATOM 632 CA VAL A 40 8.548 -10.837 13.889 1.00 22.33 C ATOM 633 C VAL A 40 7.163 -10.234 13.682 1.00 24.31 C ATOM 634 O VAL A 40 6.817 -9.815 12.578 1.00 24.41 O ATOM 635 CB VAL A 40 9.542 -9.710 14.228 1.00 54.03 C ATOM 636 CG1 VAL A 40 9.052 -8.908 15.424 1.00 41.12 C ATOM 637 CG2 VAL A 40 10.927 -10.282 14.490 1.00 53.24 C ATOM 0 H VAL A 40 8.932 -11.063 11.841 1.00 71.55 H new ATOM 0 HA VAL A 40 8.513 -11.542 14.719 1.00 22.33 H new ATOM 0 HB VAL A 40 9.608 -9.038 13.373 1.00 54.03 H new ATOM 0 HG11 VAL A 40 9.767 -8.116 15.649 1.00 41.12 H new ATOM 0 HG12 VAL A 40 8.082 -8.467 15.194 1.00 41.12 H new ATOM 0 HG13 VAL A 40 8.955 -9.565 16.288 1.00 41.12 H new ATOM 0 HG21 VAL A 40 11.616 -9.472 14.728 1.00 53.24 H new ATOM 0 HG22 VAL A 40 10.881 -10.977 15.328 1.00 53.24 H new ATOM 0 HG23 VAL A 40 11.278 -10.808 13.602 1.00 53.24 H new ATOM 647 N GLU A 41 6.375 -10.194 14.752 1.00 5.51 N ATOM 648 CA GLU A 41 5.027 -9.642 14.687 1.00 44.54 C ATOM 649 C GLU A 41 5.054 -8.197 14.197 1.00 44.52 C ATOM 650 O GLU A 41 6.113 -7.573 14.124 1.00 4.25 O ATOM 651 CB GLU A 41 4.356 -9.714 16.059 1.00 14.35 C ATOM 652 CG GLU A 41 3.176 -10.670 16.110 1.00 20.23 C ATOM 653 CD GLU A 41 2.415 -10.589 17.419 1.00 22.25 C ATOM 654 OE1 GLU A 41 3.053 -10.722 18.485 1.00 44.11 O ATOM 655 OE2 GLU A 41 1.183 -10.394 17.379 1.00 13.50 O ATOM 0 H GLU A 41 6.647 -10.537 15.673 1.00 5.51 H new ATOM 0 HA GLU A 41 4.452 -10.237 13.978 1.00 44.54 H new ATOM 0 HB2 GLU A 41 5.094 -10.022 16.799 1.00 14.35 H new ATOM 0 HB3 GLU A 41 4.018 -8.717 16.341 1.00 14.35 H new ATOM 0 HG2 GLU A 41 2.498 -10.449 15.286 1.00 20.23 H new ATOM 0 HG3 GLU A 41 3.533 -11.690 15.964 1.00 20.23 H new ATOM 662 N LYS A 42 3.882 -7.670 13.861 1.00 73.14 N ATOM 663 CA LYS A 42 3.768 -6.299 13.378 1.00 41.10 C ATOM 664 C LYS A 42 3.918 -5.304 14.525 1.00 70.33 C ATOM 665 O LYS A 42 4.458 -4.213 14.346 1.00 73.43 O ATOM 666 CB LYS A 42 2.421 -6.091 12.682 1.00 63.54 C ATOM 667 CG LYS A 42 1.230 -6.510 13.525 1.00 15.22 C ATOM 668 CD LYS A 42 0.490 -7.683 12.903 1.00 2.42 C ATOM 669 CE LYS A 42 -0.912 -7.824 13.476 1.00 62.55 C ATOM 670 NZ LYS A 42 -1.798 -8.621 12.582 1.00 23.11 N ATOM 0 H LYS A 42 2.996 -8.172 13.914 1.00 73.14 H new ATOM 0 HA LYS A 42 4.571 -6.125 12.661 1.00 41.10 H new ATOM 0 HB2 LYS A 42 2.317 -5.039 12.418 1.00 63.54 H new ATOM 0 HB3 LYS A 42 2.412 -6.656 11.750 1.00 63.54 H new ATOM 0 HG2 LYS A 42 1.569 -6.781 14.525 1.00 15.22 H new ATOM 0 HG3 LYS A 42 0.548 -5.667 13.637 1.00 15.22 H new ATOM 0 HD2 LYS A 42 0.431 -7.546 11.823 1.00 2.42 H new ATOM 0 HD3 LYS A 42 1.050 -8.602 13.078 1.00 2.42 H new ATOM 0 HE2 LYS A 42 -0.858 -8.302 14.454 1.00 62.55 H new ATOM 0 HE3 LYS A 42 -1.344 -6.835 13.628 1.00 62.55 H new ATOM 0 HZ1 LYS A 42 -2.744 -8.695 13.007 1.00 23.11 H new ATOM 0 HZ2 LYS A 42 -1.870 -8.152 11.656 1.00 23.11 H new ATOM 0 HZ3 LYS A 42 -1.399 -9.573 12.458 1.00 23.11 H new ATOM 684 N ASN A 43 3.438 -5.689 15.703 1.00 72.53 N ATOM 685 CA ASN A 43 3.520 -4.831 16.879 1.00 74.20 C ATOM 686 C ASN A 43 4.547 -5.366 17.872 1.00 11.11 C ATOM 687 O ASN A 43 4.327 -5.339 19.082 1.00 13.44 O ATOM 688 CB ASN A 43 2.150 -4.723 17.553 1.00 4.11 C ATOM 689 CG ASN A 43 1.230 -3.751 16.840 1.00 60.32 C ATOM 690 OD1 ASN A 43 1.408 -2.536 16.923 1.00 15.11 O ATOM 691 ND2 ASN A 43 0.240 -4.284 16.134 1.00 73.52 N ATOM 0 H ASN A 43 2.988 -6.589 15.868 1.00 72.53 H new ATOM 0 HA ASN A 43 3.837 -3.840 16.554 1.00 74.20 H new ATOM 0 HB2 ASN A 43 1.683 -5.708 17.580 1.00 4.11 H new ATOM 0 HB3 ASN A 43 2.281 -4.403 18.587 1.00 4.11 H new ATOM 0 HD21 ASN A 43 -0.411 -3.680 15.632 1.00 73.52 H new ATOM 0 HD22 ASN A 43 0.131 -5.297 16.093 1.00 73.52 H new ATOM 698 N GLU A 44 5.670 -5.851 17.351 1.00 55.14 N ATOM 699 CA GLU A 44 6.730 -6.392 18.192 1.00 45.10 C ATOM 700 C GLU A 44 8.098 -5.904 17.724 1.00 64.25 C ATOM 701 O GLU A 44 8.377 -5.857 16.525 1.00 42.01 O ATOM 702 CB GLU A 44 6.691 -7.921 18.181 1.00 72.53 C ATOM 703 CG GLU A 44 6.203 -8.527 19.486 1.00 73.32 C ATOM 704 CD GLU A 44 4.751 -8.197 19.776 1.00 64.04 C ATOM 705 OE1 GLU A 44 4.431 -7.916 20.949 1.00 34.04 O ATOM 706 OE2 GLU A 44 3.937 -8.220 18.829 1.00 11.35 O ATOM 0 H GLU A 44 5.868 -5.880 16.351 1.00 55.14 H new ATOM 0 HA GLU A 44 6.566 -6.039 19.210 1.00 45.10 H new ATOM 0 HB2 GLU A 44 6.042 -8.254 17.371 1.00 72.53 H new ATOM 0 HB3 GLU A 44 7.690 -8.300 17.965 1.00 72.53 H new ATOM 0 HG2 GLU A 44 6.325 -9.609 19.448 1.00 73.32 H new ATOM 0 HG3 GLU A 44 6.824 -8.165 20.305 1.00 73.32 H new ATOM 713 N THR A 45 8.950 -5.541 18.678 1.00 34.11 N ATOM 714 CA THR A 45 10.287 -5.055 18.365 1.00 64.21 C ATOM 715 C THR A 45 11.237 -6.211 18.072 1.00 44.34 C ATOM 716 O THR A 45 10.949 -7.361 18.400 1.00 61.12 O ATOM 717 CB THR A 45 10.863 -4.212 19.518 1.00 23.24 C ATOM 718 OG1 THR A 45 10.243 -4.584 20.754 1.00 32.11 O ATOM 719 CG2 THR A 45 10.648 -2.728 19.264 1.00 45.04 C ATOM 0 H THR A 45 8.737 -5.575 19.675 1.00 34.11 H new ATOM 0 HA THR A 45 10.196 -4.429 17.478 1.00 64.21 H new ATOM 0 HB THR A 45 11.935 -4.403 19.577 1.00 23.24 H new ATOM 0 HG1 THR A 45 10.616 -4.045 21.482 1.00 32.11 H new ATOM 0 HG21 THR A 45 11.063 -2.153 20.092 1.00 45.04 H new ATOM 0 HG22 THR A 45 11.146 -2.442 18.338 1.00 45.04 H new ATOM 0 HG23 THR A 45 9.581 -2.524 19.180 1.00 45.04 H new ATOM 727 N GLU A 46 12.371 -5.896 17.453 1.00 61.44 N ATOM 728 CA GLU A 46 13.363 -6.910 17.116 1.00 62.55 C ATOM 729 C GLU A 46 13.965 -7.523 18.377 1.00 61.21 C ATOM 730 O GLU A 46 14.265 -8.717 18.419 1.00 0.54 O ATOM 731 CB GLU A 46 14.471 -6.305 16.251 1.00 11.30 C ATOM 732 CG GLU A 46 13.959 -5.637 14.986 1.00 51.30 C ATOM 733 CD GLU A 46 14.868 -4.522 14.506 1.00 13.54 C ATOM 734 OE1 GLU A 46 15.301 -3.706 15.346 1.00 1.25 O ATOM 735 OE2 GLU A 46 15.146 -4.465 13.290 1.00 75.30 O ATOM 0 H GLU A 46 12.625 -4.948 17.175 1.00 61.44 H new ATOM 0 HA GLU A 46 12.862 -7.698 16.553 1.00 62.55 H new ATOM 0 HB2 GLU A 46 15.022 -5.573 16.841 1.00 11.30 H new ATOM 0 HB3 GLU A 46 15.176 -7.090 15.978 1.00 11.30 H new ATOM 0 HG2 GLU A 46 13.861 -6.385 14.199 1.00 51.30 H new ATOM 0 HG3 GLU A 46 12.963 -5.235 15.170 1.00 51.30 H new ATOM 742 N LYS A 47 14.140 -6.698 19.403 1.00 13.52 N ATOM 743 CA LYS A 47 14.705 -7.156 20.667 1.00 51.32 C ATOM 744 C LYS A 47 13.680 -7.957 21.463 1.00 54.13 C ATOM 745 O LYS A 47 13.991 -9.019 22.002 1.00 12.23 O ATOM 746 CB LYS A 47 15.190 -5.963 21.494 1.00 31.33 C ATOM 747 CG LYS A 47 16.586 -5.493 21.123 1.00 13.13 C ATOM 748 CD LYS A 47 17.648 -6.473 21.592 1.00 34.24 C ATOM 749 CE LYS A 47 17.879 -6.369 23.092 1.00 11.11 C ATOM 750 NZ LYS A 47 18.451 -5.048 23.474 1.00 24.55 N ATOM 0 H LYS A 47 13.898 -5.707 19.384 1.00 13.52 H new ATOM 0 HA LYS A 47 15.552 -7.804 20.444 1.00 51.32 H new ATOM 0 HB2 LYS A 47 14.492 -5.136 21.367 1.00 31.33 H new ATOM 0 HB3 LYS A 47 15.175 -6.234 22.550 1.00 31.33 H new ATOM 0 HG2 LYS A 47 16.654 -5.371 20.042 1.00 13.13 H new ATOM 0 HG3 LYS A 47 16.771 -4.515 21.567 1.00 13.13 H new ATOM 0 HD2 LYS A 47 17.344 -7.489 21.339 1.00 34.24 H new ATOM 0 HD3 LYS A 47 18.582 -6.279 21.065 1.00 34.24 H new ATOM 0 HE2 LYS A 47 16.936 -6.522 23.616 1.00 11.11 H new ATOM 0 HE3 LYS A 47 18.554 -7.163 23.412 1.00 11.11 H new ATOM 0 HZ1 LYS A 47 18.903 -5.122 24.408 1.00 24.55 H new ATOM 0 HZ2 LYS A 47 19.159 -4.759 22.769 1.00 24.55 H new ATOM 0 HZ3 LYS A 47 17.691 -4.339 23.513 1.00 24.55 H new ATOM 764 N ASP A 48 12.457 -7.442 21.530 1.00 32.33 N ATOM 765 CA ASP A 48 11.385 -8.111 22.258 1.00 32.52 C ATOM 766 C ASP A 48 10.973 -9.401 21.555 1.00 24.33 C ATOM 767 O ASP A 48 10.572 -10.370 22.199 1.00 24.15 O ATOM 768 CB ASP A 48 10.177 -7.184 22.396 1.00 13.34 C ATOM 769 CG ASP A 48 8.979 -7.880 23.011 1.00 20.45 C ATOM 770 OD1 ASP A 48 8.076 -8.288 22.252 1.00 54.10 O ATOM 771 OD2 ASP A 48 8.945 -8.018 24.253 1.00 54.55 O ATOM 0 H ASP A 48 12.183 -6.564 21.089 1.00 32.33 H new ATOM 0 HA ASP A 48 11.756 -8.362 23.252 1.00 32.52 H new ATOM 0 HB2 ASP A 48 10.450 -6.326 23.010 1.00 13.34 H new ATOM 0 HB3 ASP A 48 9.905 -6.799 21.413 1.00 13.34 H new ATOM 776 N ALA A 49 11.075 -9.405 20.230 1.00 31.41 N ATOM 777 CA ALA A 49 10.714 -10.576 19.440 1.00 44.00 C ATOM 778 C ALA A 49 11.781 -11.660 19.547 1.00 64.15 C ATOM 779 O ALA A 49 11.473 -12.853 19.533 1.00 42.43 O ATOM 780 CB ALA A 49 10.500 -10.185 17.985 1.00 32.13 C ATOM 0 H ALA A 49 11.404 -8.611 19.681 1.00 31.41 H new ATOM 0 HA ALA A 49 9.783 -10.979 19.837 1.00 44.00 H new ATOM 0 HB1 ALA A 49 10.231 -11.069 17.407 1.00 32.13 H new ATOM 0 HB2 ALA A 49 9.697 -9.451 17.920 1.00 32.13 H new ATOM 0 HB3 ALA A 49 11.418 -9.755 17.585 1.00 32.13 H new ATOM 786 N LEU A 50 13.037 -11.239 19.652 1.00 20.31 N ATOM 787 CA LEU A 50 14.151 -12.175 19.760 1.00 30.14 C ATOM 788 C LEU A 50 14.309 -12.670 21.195 1.00 41.34 C ATOM 789 O LEU A 50 14.414 -13.872 21.439 1.00 70.13 O ATOM 790 CB LEU A 50 15.447 -11.512 19.292 1.00 42.23 C ATOM 791 CG LEU A 50 15.644 -11.417 17.778 1.00 34.22 C ATOM 792 CD1 LEU A 50 16.938 -10.689 17.452 1.00 24.14 C ATOM 793 CD2 LEU A 50 15.637 -12.804 17.152 1.00 64.11 C ATOM 0 H LEU A 50 13.309 -10.256 19.665 1.00 20.31 H new ATOM 0 HA LEU A 50 13.937 -13.032 19.121 1.00 30.14 H new ATOM 0 HB2 LEU A 50 15.487 -10.505 19.707 1.00 42.23 H new ATOM 0 HB3 LEU A 50 16.287 -12.064 19.714 1.00 42.23 H new ATOM 0 HG LEU A 50 14.816 -10.846 17.358 1.00 34.22 H new ATOM 0 HD11 LEU A 50 17.061 -10.631 16.370 1.00 24.14 H new ATOM 0 HD12 LEU A 50 16.903 -9.682 17.867 1.00 24.14 H new ATOM 0 HD13 LEU A 50 17.779 -11.231 17.884 1.00 24.14 H new ATOM 0 HD21 LEU A 50 15.778 -12.718 16.075 1.00 64.11 H new ATOM 0 HD22 LEU A 50 16.445 -13.399 17.577 1.00 64.11 H new ATOM 0 HD23 LEU A 50 14.683 -13.290 17.355 1.00 64.11 H new ATOM 805 N ILE A 51 14.323 -11.735 22.139 1.00 24.20 N ATOM 806 CA ILE A 51 14.465 -12.077 23.549 1.00 42.21 C ATOM 807 C ILE A 51 13.445 -13.132 23.964 1.00 3.32 C ATOM 808 O ILE A 51 13.713 -13.959 24.836 1.00 72.24 O ATOM 809 CB ILE A 51 14.300 -10.837 24.448 1.00 71.21 C ATOM 810 CG1 ILE A 51 14.827 -11.127 25.855 1.00 50.32 C ATOM 811 CG2 ILE A 51 12.840 -10.412 24.500 1.00 1.14 C ATOM 812 CD1 ILE A 51 15.422 -9.915 26.538 1.00 20.42 C ATOM 0 H ILE A 51 14.238 -10.736 21.953 1.00 24.20 H new ATOM 0 HA ILE A 51 15.471 -12.477 23.677 1.00 42.21 H new ATOM 0 HB ILE A 51 14.882 -10.018 24.024 1.00 71.21 H new ATOM 0 HG12 ILE A 51 14.013 -11.516 26.467 1.00 50.32 H new ATOM 0 HG13 ILE A 51 15.584 -11.910 25.797 1.00 50.32 H new ATOM 0 HG21 ILE A 51 12.739 -9.535 25.139 1.00 1.14 H new ATOM 0 HG22 ILE A 51 12.495 -10.170 23.495 1.00 1.14 H new ATOM 0 HG23 ILE A 51 12.238 -11.226 24.904 1.00 1.14 H new ATOM 0 HD11 ILE A 51 15.775 -10.194 27.531 1.00 20.42 H new ATOM 0 HD12 ILE A 51 16.258 -9.538 25.948 1.00 20.42 H new ATOM 0 HD13 ILE A 51 14.662 -9.139 26.628 1.00 20.42 H new ATOM 824 N ARG A 52 12.276 -13.097 23.333 1.00 21.23 N ATOM 825 CA ARG A 52 11.216 -14.051 23.637 1.00 51.23 C ATOM 826 C ARG A 52 11.428 -15.359 22.880 1.00 41.31 C ATOM 827 O ARG A 52 11.308 -16.443 23.450 1.00 54.53 O ATOM 828 CB ARG A 52 9.851 -13.459 23.280 1.00 0.35 C ATOM 829 CG ARG A 52 8.980 -13.165 24.491 1.00 40.31 C ATOM 830 CD ARG A 52 9.198 -11.750 25.004 1.00 41.23 C ATOM 831 NE ARG A 52 8.239 -10.807 24.435 1.00 75.33 N ATOM 832 CZ ARG A 52 6.995 -10.666 24.880 1.00 71.23 C ATOM 833 NH1 ARG A 52 6.563 -11.402 25.894 1.00 32.23 N ATOM 834 NH2 ARG A 52 6.181 -9.787 24.310 1.00 52.13 N ATOM 0 H ARG A 52 12.039 -12.419 22.609 1.00 21.23 H new ATOM 0 HA ARG A 52 11.246 -14.261 24.706 1.00 51.23 H new ATOM 0 HB2 ARG A 52 10.000 -12.537 22.717 1.00 0.35 H new ATOM 0 HB3 ARG A 52 9.324 -14.152 22.623 1.00 0.35 H new ATOM 0 HG2 ARG A 52 7.931 -13.300 24.227 1.00 40.31 H new ATOM 0 HG3 ARG A 52 9.204 -13.879 25.284 1.00 40.31 H new ATOM 0 HD2 ARG A 52 9.113 -11.741 26.091 1.00 41.23 H new ATOM 0 HD3 ARG A 52 10.211 -11.428 24.761 1.00 41.23 H new ATOM 0 HE ARG A 52 8.541 -10.225 23.654 1.00 75.33 H new ATOM 0 HH11 ARG A 52 7.186 -12.079 26.335 1.00 32.23 H new ATOM 0 HH12 ARG A 52 5.608 -11.292 26.234 1.00 32.23 H new ATOM 0 HH21 ARG A 52 6.510 -9.219 23.529 1.00 52.13 H new ATOM 0 HH22 ARG A 52 5.226 -9.679 24.652 1.00 52.13 H new ATOM 848 N GLU A 53 11.744 -15.248 21.593 1.00 12.53 N ATOM 849 CA GLU A 53 11.971 -16.422 20.759 1.00 1.30 C ATOM 850 C GLU A 53 13.191 -17.203 21.240 1.00 52.34 C ATOM 851 O GLU A 53 13.333 -18.391 20.951 1.00 72.40 O ATOM 852 CB GLU A 53 12.160 -16.008 19.298 1.00 11.01 C ATOM 853 CG GLU A 53 10.878 -15.547 18.626 1.00 51.45 C ATOM 854 CD GLU A 53 10.065 -16.698 18.068 1.00 74.44 C ATOM 855 OE1 GLU A 53 10.584 -17.834 18.044 1.00 1.02 O ATOM 856 OE2 GLU A 53 8.910 -16.465 17.654 1.00 12.35 O ATOM 0 H GLU A 53 11.848 -14.358 21.106 1.00 12.53 H new ATOM 0 HA GLU A 53 11.095 -17.066 20.836 1.00 1.30 H new ATOM 0 HB2 GLU A 53 12.895 -15.205 19.249 1.00 11.01 H new ATOM 0 HB3 GLU A 53 12.570 -16.850 18.741 1.00 11.01 H new ATOM 0 HG2 GLU A 53 10.273 -14.995 19.346 1.00 51.45 H new ATOM 0 HG3 GLU A 53 11.123 -14.856 17.820 1.00 51.45 H new ATOM 863 N ILE A 54 14.068 -16.526 21.973 1.00 12.03 N ATOM 864 CA ILE A 54 15.275 -17.156 22.494 1.00 13.12 C ATOM 865 C ILE A 54 14.944 -18.132 23.618 1.00 1.23 C ATOM 866 O ILE A 54 15.414 -19.270 23.624 1.00 14.22 O ATOM 867 CB ILE A 54 16.276 -16.109 23.017 1.00 52.44 C ATOM 868 CG1 ILE A 54 16.963 -15.401 21.847 1.00 3.43 C ATOM 869 CG2 ILE A 54 17.305 -16.766 23.924 1.00 71.01 C ATOM 870 CD1 ILE A 54 17.608 -14.087 22.231 1.00 21.21 C ATOM 0 H ILE A 54 13.966 -15.542 22.220 1.00 12.03 H new ATOM 0 HA ILE A 54 15.730 -17.699 21.666 1.00 13.12 H new ATOM 0 HB ILE A 54 15.731 -15.365 23.599 1.00 52.44 H new ATOM 0 HG12 ILE A 54 17.723 -16.061 21.429 1.00 3.43 H new ATOM 0 HG13 ILE A 54 16.230 -15.221 21.061 1.00 3.43 H new ATOM 0 HG21 ILE A 54 18.005 -16.013 24.285 1.00 71.01 H new ATOM 0 HG22 ILE A 54 16.800 -17.229 24.772 1.00 71.01 H new ATOM 0 HG23 ILE A 54 17.848 -17.528 23.366 1.00 71.01 H new ATOM 0 HD11 ILE A 54 18.076 -13.641 21.353 1.00 21.21 H new ATOM 0 HD12 ILE A 54 16.849 -13.409 22.622 1.00 21.21 H new ATOM 0 HD13 ILE A 54 18.365 -14.263 22.995 1.00 21.21 H new ATOM 882 N ARG A 55 14.131 -17.679 24.568 1.00 65.14 N ATOM 883 CA ARG A 55 13.737 -18.512 25.697 1.00 60.41 C ATOM 884 C ARG A 55 12.532 -19.377 25.340 1.00 71.44 C ATOM 885 O ARG A 55 12.270 -20.390 25.987 1.00 33.31 O ATOM 886 CB ARG A 55 13.411 -17.641 26.911 1.00 32.35 C ATOM 887 CG ARG A 55 13.559 -18.367 28.239 1.00 40.12 C ATOM 888 CD ARG A 55 12.593 -17.825 29.281 1.00 73.34 C ATOM 889 NE ARG A 55 12.474 -18.715 30.432 1.00 24.35 N ATOM 890 CZ ARG A 55 11.830 -19.877 30.401 1.00 43.42 C ATOM 891 NH1 ARG A 55 11.250 -20.286 29.281 1.00 30.33 N ATOM 892 NH2 ARG A 55 11.766 -20.631 31.490 1.00 23.14 N ATOM 0 H ARG A 55 13.733 -16.740 24.577 1.00 65.14 H new ATOM 0 HA ARG A 55 14.573 -19.167 25.942 1.00 60.41 H new ATOM 0 HB2 ARG A 55 14.065 -16.769 26.908 1.00 32.35 H new ATOM 0 HB3 ARG A 55 12.389 -17.273 26.820 1.00 32.35 H new ATOM 0 HG2 ARG A 55 13.380 -19.432 28.094 1.00 40.12 H new ATOM 0 HG3 ARG A 55 14.582 -18.262 28.600 1.00 40.12 H new ATOM 0 HD2 ARG A 55 12.932 -16.844 29.615 1.00 73.34 H new ATOM 0 HD3 ARG A 55 11.612 -17.685 28.828 1.00 73.34 H new ATOM 0 HE ARG A 55 12.909 -18.429 31.309 1.00 24.35 H new ATOM 0 HH11 ARG A 55 11.298 -19.708 28.442 1.00 30.33 H new ATOM 0 HH12 ARG A 55 10.756 -21.178 29.259 1.00 30.33 H new ATOM 0 HH21 ARG A 55 12.211 -20.319 32.353 1.00 23.14 H new ATOM 0 HH22 ARG A 55 11.271 -21.523 31.465 1.00 23.14 H new ATOM 906 N GLU A 56 11.803 -18.970 24.305 1.00 11.44 N ATOM 907 CA GLU A 56 10.625 -19.707 23.864 1.00 61.13 C ATOM 908 C GLU A 56 10.998 -20.748 22.812 1.00 31.31 C ATOM 909 O GLU A 56 10.800 -21.946 23.013 1.00 24.03 O ATOM 910 CB GLU A 56 9.577 -18.747 23.297 1.00 3.33 C ATOM 911 CG GLU A 56 8.299 -19.436 22.849 1.00 2.54 C ATOM 912 CD GLU A 56 7.255 -18.458 22.345 1.00 3.15 C ATOM 913 OE1 GLU A 56 7.500 -17.811 21.306 1.00 70.43 O ATOM 914 OE2 GLU A 56 6.193 -18.340 22.992 1.00 40.13 O ATOM 0 H GLU A 56 12.008 -18.134 23.757 1.00 11.44 H new ATOM 0 HA GLU A 56 10.205 -20.222 24.728 1.00 61.13 H new ATOM 0 HB2 GLU A 56 9.332 -18.002 24.054 1.00 3.33 H new ATOM 0 HB3 GLU A 56 10.007 -18.212 22.450 1.00 3.33 H new ATOM 0 HG2 GLU A 56 8.533 -20.150 22.060 1.00 2.54 H new ATOM 0 HG3 GLU A 56 7.886 -20.005 23.682 1.00 2.54 H new ATOM 921 N GLU A 57 11.537 -20.281 21.690 1.00 23.14 N ATOM 922 CA GLU A 57 11.936 -21.172 20.607 1.00 41.42 C ATOM 923 C GLU A 57 13.250 -21.875 20.936 1.00 35.23 C ATOM 924 O GLU A 57 13.296 -23.098 21.063 1.00 34.42 O ATOM 925 CB GLU A 57 12.078 -20.389 19.300 1.00 41.12 C ATOM 926 CG GLU A 57 11.268 -20.968 18.152 1.00 33.14 C ATOM 927 CD GLU A 57 11.987 -20.867 16.821 1.00 15.00 C ATOM 928 OE1 GLU A 57 12.945 -20.073 16.722 1.00 1.15 O ATOM 929 OE2 GLU A 57 11.590 -21.583 15.878 1.00 50.14 O ATOM 0 H GLU A 57 11.707 -19.292 21.508 1.00 23.14 H new ATOM 0 HA GLU A 57 11.160 -21.928 20.488 1.00 41.42 H new ATOM 0 HB2 GLU A 57 11.768 -19.358 19.469 1.00 41.12 H new ATOM 0 HB3 GLU A 57 13.130 -20.363 19.015 1.00 41.12 H new ATOM 0 HG2 GLU A 57 11.045 -22.014 18.361 1.00 33.14 H new ATOM 0 HG3 GLU A 57 10.314 -20.445 18.086 1.00 33.14 H new ATOM 936 N MET A 58 14.315 -21.093 21.073 1.00 41.32 N ATOM 937 CA MET A 58 15.629 -21.640 21.388 1.00 24.21 C ATOM 938 C MET A 58 15.622 -22.318 22.754 1.00 24.35 C ATOM 939 O MET A 58 16.387 -23.251 23.000 1.00 24.31 O ATOM 940 CB MET A 58 16.686 -20.534 21.360 1.00 63.41 C ATOM 941 CG MET A 58 17.352 -20.364 20.004 1.00 73.22 C ATOM 942 SD MET A 58 19.152 -20.397 20.104 1.00 13.55 S ATOM 943 CE MET A 58 19.592 -19.674 18.526 1.00 61.54 C ATOM 0 H MET A 58 14.294 -20.078 20.971 1.00 41.32 H new ATOM 0 HA MET A 58 15.875 -22.386 20.633 1.00 24.21 H new ATOM 0 HB2 MET A 58 16.221 -19.591 21.648 1.00 63.41 H new ATOM 0 HB3 MET A 58 17.450 -20.754 22.106 1.00 63.41 H new ATOM 0 HG2 MET A 58 17.015 -21.157 19.336 1.00 73.22 H new ATOM 0 HG3 MET A 58 17.034 -19.419 19.563 1.00 73.22 H new ATOM 0 HE1 MET A 58 20.676 -19.675 18.415 1.00 61.54 H new ATOM 0 HE2 MET A 58 19.144 -20.257 17.721 1.00 61.54 H new ATOM 0 HE3 MET A 58 19.224 -18.649 18.480 1.00 61.54 H new ATOM 953 N LYS A 59 14.754 -21.843 23.641 1.00 22.52 N ATOM 954 CA LYS A 59 14.646 -22.404 24.983 1.00 44.11 C ATOM 955 C LYS A 59 16.019 -22.512 25.639 1.00 21.22 C ATOM 956 O LYS A 59 16.335 -23.518 26.276 1.00 3.21 O ATOM 957 CB LYS A 59 13.984 -23.783 24.930 1.00 3.44 C ATOM 958 CG LYS A 59 12.517 -23.738 24.540 1.00 20.24 C ATOM 959 CD LYS A 59 11.699 -24.744 25.333 1.00 53.03 C ATOM 960 CE LYS A 59 11.476 -24.278 26.763 1.00 1.13 C ATOM 961 NZ LYS A 59 10.751 -22.978 26.817 1.00 72.43 N ATOM 0 H LYS A 59 14.115 -21.070 23.455 1.00 22.52 H new ATOM 0 HA LYS A 59 14.028 -21.734 25.581 1.00 44.11 H new ATOM 0 HB2 LYS A 59 14.522 -24.408 24.217 1.00 3.44 H new ATOM 0 HB3 LYS A 59 14.078 -24.260 25.906 1.00 3.44 H new ATOM 0 HG2 LYS A 59 12.125 -22.735 24.709 1.00 20.24 H new ATOM 0 HG3 LYS A 59 12.416 -23.945 23.475 1.00 20.24 H new ATOM 0 HD2 LYS A 59 10.736 -24.897 24.845 1.00 53.03 H new ATOM 0 HD3 LYS A 59 12.210 -25.707 25.339 1.00 53.03 H new ATOM 0 HE2 LYS A 59 10.908 -25.033 27.306 1.00 1.13 H new ATOM 0 HE3 LYS A 59 12.438 -24.179 27.267 1.00 1.13 H new ATOM 0 HZ1 LYS A 59 10.324 -22.857 27.758 1.00 72.43 H new ATOM 0 HZ2 LYS A 59 11.418 -22.201 26.637 1.00 72.43 H new ATOM 0 HZ3 LYS A 59 10.004 -22.967 26.094 1.00 72.43 H new ATOM 975 N CYS A 60 16.829 -21.471 25.481 1.00 20.31 N ATOM 976 CA CYS A 60 18.168 -21.450 26.059 1.00 10.44 C ATOM 977 C CYS A 60 18.422 -20.137 26.794 1.00 72.31 C ATOM 978 O CYS A 60 17.546 -19.275 26.866 1.00 71.12 O ATOM 979 CB CYS A 60 19.221 -21.649 24.968 1.00 34.10 C ATOM 980 SG CYS A 60 19.237 -23.310 24.253 1.00 2.30 S ATOM 0 H CYS A 60 16.582 -20.631 24.958 1.00 20.31 H new ATOM 0 HA CYS A 60 18.240 -22.268 26.776 1.00 10.44 H new ATOM 0 HB2 CYS A 60 19.046 -20.924 24.173 1.00 34.10 H new ATOM 0 HB3 CYS A 60 20.205 -21.435 25.384 1.00 34.10 H new ATOM 0 HG CYS A 60 20.379 -23.520 23.669 1.00 2.30 H new ATOM 986 N ASP A 61 19.625 -19.994 27.339 1.00 14.32 N ATOM 987 CA ASP A 61 19.994 -18.787 28.069 1.00 10.34 C ATOM 988 C ASP A 61 20.743 -17.813 27.166 1.00 44.35 C ATOM 989 O ASP A 61 21.566 -17.024 27.632 1.00 5.01 O ATOM 990 CB ASP A 61 20.855 -19.142 29.282 1.00 23.12 C ATOM 991 CG ASP A 61 20.024 -19.520 30.492 1.00 34.40 C ATOM 992 OD1 ASP A 61 19.183 -20.436 30.372 1.00 54.04 O ATOM 993 OD2 ASP A 61 20.214 -18.902 31.560 1.00 44.44 O ATOM 0 H ASP A 61 20.361 -20.699 27.289 1.00 14.32 H new ATOM 0 HA ASP A 61 19.078 -18.305 28.412 1.00 10.34 H new ATOM 0 HB2 ASP A 61 21.515 -19.971 29.025 1.00 23.12 H new ATOM 0 HB3 ASP A 61 21.491 -18.293 29.533 1.00 23.12 H new ATOM 998 N LEU A 62 20.454 -17.874 25.870 1.00 3.34 N ATOM 999 CA LEU A 62 21.102 -16.998 24.900 1.00 54.31 C ATOM 1000 C LEU A 62 21.041 -15.543 25.354 1.00 54.21 C ATOM 1001 O LEU A 62 19.960 -14.999 25.583 1.00 11.14 O ATOM 1002 CB LEU A 62 20.439 -17.144 23.529 1.00 34.42 C ATOM 1003 CG LEU A 62 21.358 -17.561 22.380 1.00 35.33 C ATOM 1004 CD1 LEU A 62 20.619 -17.489 21.053 1.00 72.51 C ATOM 1005 CD2 LEU A 62 22.602 -16.686 22.348 1.00 20.13 C ATOM 0 H LEU A 62 19.776 -18.521 25.467 1.00 3.34 H new ATOM 0 HA LEU A 62 22.149 -17.292 24.824 1.00 54.31 H new ATOM 0 HB2 LEU A 62 19.638 -17.878 23.612 1.00 34.42 H new ATOM 0 HB3 LEU A 62 19.974 -16.193 23.269 1.00 34.42 H new ATOM 0 HG LEU A 62 21.668 -18.593 22.544 1.00 35.33 H new ATOM 0 HD11 LEU A 62 21.289 -17.789 20.247 1.00 72.51 H new ATOM 0 HD12 LEU A 62 19.759 -18.158 21.079 1.00 72.51 H new ATOM 0 HD13 LEU A 62 20.279 -16.468 20.881 1.00 72.51 H new ATOM 0 HD21 LEU A 62 23.244 -16.997 21.524 1.00 20.13 H new ATOM 0 HD22 LEU A 62 22.311 -15.645 22.208 1.00 20.13 H new ATOM 0 HD23 LEU A 62 23.143 -16.788 23.289 1.00 20.13 H new ATOM 1017 N ILE A 63 22.207 -14.918 25.479 1.00 34.22 N ATOM 1018 CA ILE A 63 22.285 -13.525 25.902 1.00 31.52 C ATOM 1019 C ILE A 63 22.408 -12.593 24.702 1.00 10.42 C ATOM 1020 O ILE A 63 22.998 -12.950 23.682 1.00 11.34 O ATOM 1021 CB ILE A 63 23.479 -13.290 26.846 1.00 61.12 C ATOM 1022 CG1 ILE A 63 23.501 -14.349 27.950 1.00 12.33 C ATOM 1023 CG2 ILE A 63 23.414 -11.893 27.445 1.00 74.13 C ATOM 1024 CD1 ILE A 63 24.355 -15.552 27.617 1.00 12.03 C ATOM 0 H ILE A 63 23.110 -15.354 25.293 1.00 34.22 H new ATOM 0 HA ILE A 63 21.361 -13.305 26.437 1.00 31.52 H new ATOM 0 HB ILE A 63 24.400 -13.374 26.270 1.00 61.12 H new ATOM 0 HG12 ILE A 63 23.870 -13.895 28.870 1.00 12.33 H new ATOM 0 HG13 ILE A 63 22.481 -14.680 28.145 1.00 12.33 H new ATOM 0 HG21 ILE A 63 24.265 -11.742 28.110 1.00 74.13 H new ATOM 0 HG22 ILE A 63 23.443 -11.153 26.646 1.00 74.13 H new ATOM 0 HG23 ILE A 63 22.488 -11.782 28.009 1.00 74.13 H new ATOM 0 HD11 ILE A 63 24.324 -16.261 28.444 1.00 12.03 H new ATOM 0 HD12 ILE A 63 23.974 -16.030 26.715 1.00 12.03 H new ATOM 0 HD13 ILE A 63 25.384 -15.233 27.451 1.00 12.03 H new ATOM 1036 N VAL A 64 21.848 -11.394 24.832 1.00 44.23 N ATOM 1037 CA VAL A 64 21.898 -10.407 23.759 1.00 33.23 C ATOM 1038 C VAL A 64 22.726 -9.194 24.167 1.00 55.44 C ATOM 1039 O VAL A 64 22.813 -8.857 25.347 1.00 43.45 O ATOM 1040 CB VAL A 64 20.485 -9.941 23.360 1.00 0.13 C ATOM 1041 CG1 VAL A 64 19.841 -9.157 24.494 1.00 62.21 C ATOM 1042 CG2 VAL A 64 20.539 -9.108 22.089 1.00 52.24 C ATOM 0 H VAL A 64 21.355 -11.083 25.669 1.00 44.23 H new ATOM 0 HA VAL A 64 22.368 -10.892 22.903 1.00 33.23 H new ATOM 0 HB VAL A 64 19.872 -10.821 23.165 1.00 0.13 H new ATOM 0 HG11 VAL A 64 18.844 -8.836 24.194 1.00 62.21 H new ATOM 0 HG12 VAL A 64 19.768 -9.790 25.378 1.00 62.21 H new ATOM 0 HG13 VAL A 64 20.450 -8.282 24.723 1.00 62.21 H new ATOM 0 HG21 VAL A 64 19.532 -8.787 21.821 1.00 52.24 H new ATOM 0 HG22 VAL A 64 21.167 -8.233 22.254 1.00 52.24 H new ATOM 0 HG23 VAL A 64 20.956 -9.706 21.279 1.00 52.24 H new ATOM 1052 N GLY A 65 23.332 -8.539 23.180 1.00 32.35 N ATOM 1053 CA GLY A 65 24.145 -7.369 23.456 1.00 31.43 C ATOM 1054 C GLY A 65 23.502 -6.088 22.965 1.00 11.40 C ATOM 1055 O GLY A 65 22.698 -5.478 23.671 1.00 62.11 O ATOM 0 H GLY A 65 23.274 -8.798 22.195 1.00 32.35 H new ATOM 0 HA2 GLY A 65 24.319 -7.296 24.530 1.00 31.43 H new ATOM 0 HA3 GLY A 65 25.120 -7.488 22.982 1.00 31.43 H new ATOM 1059 N ASP A 66 23.857 -5.676 21.753 1.00 61.52 N ATOM 1060 CA ASP A 66 23.310 -4.458 21.168 1.00 74.03 C ATOM 1061 C ASP A 66 23.058 -4.638 19.674 1.00 34.10 C ATOM 1062 O ASP A 66 23.391 -5.673 19.097 1.00 23.43 O ATOM 1063 CB ASP A 66 24.261 -3.283 21.399 1.00 25.41 C ATOM 1064 CG ASP A 66 23.849 -2.428 22.581 1.00 53.24 C ATOM 1065 OD1 ASP A 66 24.377 -2.654 23.689 1.00 12.33 O ATOM 1066 OD2 ASP A 66 22.997 -1.533 22.397 1.00 40.12 O ATOM 0 H ASP A 66 24.522 -6.168 21.156 1.00 61.52 H new ATOM 0 HA ASP A 66 22.359 -4.246 21.656 1.00 74.03 H new ATOM 0 HB2 ASP A 66 25.270 -3.663 21.563 1.00 25.41 H new ATOM 0 HB3 ASP A 66 24.295 -2.665 20.502 1.00 25.41 H new ATOM 1071 N LYS A 67 22.466 -3.624 19.053 1.00 53.34 N ATOM 1072 CA LYS A 67 22.168 -3.668 17.626 1.00 63.41 C ATOM 1073 C LYS A 67 23.451 -3.633 16.801 1.00 1.44 C ATOM 1074 O LYS A 67 24.362 -2.854 17.085 1.00 32.41 O ATOM 1075 CB LYS A 67 21.265 -2.496 17.235 1.00 24.22 C ATOM 1076 CG LYS A 67 20.878 -2.490 15.767 1.00 73.24 C ATOM 1077 CD LYS A 67 19.613 -3.295 15.521 1.00 74.04 C ATOM 1078 CE LYS A 67 18.824 -2.747 14.341 1.00 31.01 C ATOM 1079 NZ LYS A 67 18.215 -1.423 14.648 1.00 31.21 N ATOM 0 H LYS A 67 22.183 -2.760 19.516 1.00 53.34 H new ATOM 0 HA LYS A 67 21.648 -4.603 17.418 1.00 63.41 H new ATOM 0 HB2 LYS A 67 20.359 -2.528 17.841 1.00 24.22 H new ATOM 0 HB3 LYS A 67 21.774 -1.562 17.472 1.00 24.22 H new ATOM 0 HG2 LYS A 67 20.728 -1.463 15.434 1.00 73.24 H new ATOM 0 HG3 LYS A 67 21.694 -2.902 15.173 1.00 73.24 H new ATOM 0 HD2 LYS A 67 19.874 -4.337 15.333 1.00 74.04 H new ATOM 0 HD3 LYS A 67 18.990 -3.279 16.415 1.00 74.04 H new ATOM 0 HE2 LYS A 67 19.482 -2.653 13.477 1.00 31.01 H new ATOM 0 HE3 LYS A 67 18.040 -3.453 14.069 1.00 31.01 H new ATOM 0 HZ1 LYS A 67 17.189 -1.534 14.773 1.00 31.21 H new ATOM 0 HZ2 LYS A 67 18.632 -1.044 15.522 1.00 31.21 H new ATOM 0 HZ3 LYS A 67 18.399 -0.766 13.863 1.00 31.21 H new ATOM 1093 N VAL A 68 23.516 -4.479 15.778 1.00 15.03 N ATOM 1094 CA VAL A 68 24.686 -4.542 14.911 1.00 73.11 C ATOM 1095 C VAL A 68 24.523 -3.629 13.701 1.00 74.32 C ATOM 1096 O VAL A 68 25.408 -2.832 13.388 1.00 35.03 O ATOM 1097 CB VAL A 68 24.947 -5.980 14.424 1.00 13.11 C ATOM 1098 CG1 VAL A 68 26.253 -6.052 13.648 1.00 72.21 C ATOM 1099 CG2 VAL A 68 24.961 -6.945 15.600 1.00 64.44 C ATOM 0 H VAL A 68 22.772 -5.130 15.529 1.00 15.03 H new ATOM 0 HA VAL A 68 25.537 -4.207 15.503 1.00 73.11 H new ATOM 0 HB VAL A 68 24.138 -6.272 13.754 1.00 13.11 H new ATOM 0 HG11 VAL A 68 26.421 -7.075 13.312 1.00 72.21 H new ATOM 0 HG12 VAL A 68 26.199 -5.390 12.783 1.00 72.21 H new ATOM 0 HG13 VAL A 68 27.076 -5.742 14.292 1.00 72.21 H new ATOM 0 HG21 VAL A 68 25.147 -7.956 15.239 1.00 64.44 H new ATOM 0 HG22 VAL A 68 25.749 -6.658 16.297 1.00 64.44 H new ATOM 0 HG23 VAL A 68 23.998 -6.913 16.109 1.00 64.44 H new ATOM 1109 N ILE A 69 23.386 -3.751 13.024 1.00 71.23 N ATOM 1110 CA ILE A 69 23.106 -2.936 11.848 1.00 2.44 C ATOM 1111 C ILE A 69 21.694 -3.185 11.330 1.00 11.40 C ATOM 1112 O ILE A 69 21.146 -4.277 11.485 1.00 4.24 O ATOM 1113 CB ILE A 69 24.113 -3.215 10.717 1.00 51.21 C ATOM 1114 CG1 ILE A 69 23.961 -2.178 9.602 1.00 12.00 C ATOM 1115 CG2 ILE A 69 23.918 -4.621 10.170 1.00 64.11 C ATOM 1116 CD1 ILE A 69 25.194 -2.035 8.738 1.00 52.24 C ATOM 0 H ILE A 69 22.644 -4.406 13.270 1.00 71.23 H new ATOM 0 HA ILE A 69 23.198 -1.895 12.156 1.00 2.44 H new ATOM 0 HB ILE A 69 25.122 -3.140 11.122 1.00 51.21 H new ATOM 0 HG12 ILE A 69 23.116 -2.455 8.972 1.00 12.00 H new ATOM 0 HG13 ILE A 69 23.724 -1.211 10.046 1.00 12.00 H new ATOM 0 HG21 ILE A 69 24.637 -4.804 9.371 1.00 64.11 H new ATOM 0 HG22 ILE A 69 24.071 -5.347 10.969 1.00 64.11 H new ATOM 0 HG23 ILE A 69 22.906 -4.722 9.777 1.00 64.11 H new ATOM 0 HD11 ILE A 69 25.014 -1.283 7.969 1.00 52.24 H new ATOM 0 HD12 ILE A 69 26.038 -1.728 9.356 1.00 52.24 H new ATOM 0 HD13 ILE A 69 25.420 -2.991 8.265 1.00 52.24 H new ATOM 1128 N THR A 70 21.108 -2.164 10.711 1.00 61.32 N ATOM 1129 CA THR A 70 19.760 -2.272 10.168 1.00 13.22 C ATOM 1130 C THR A 70 19.782 -2.309 8.644 1.00 34.15 C ATOM 1131 O THR A 70 19.713 -1.271 7.986 1.00 3.40 O ATOM 1132 CB THR A 70 18.874 -1.099 10.629 1.00 34.21 C ATOM 1133 OG1 THR A 70 19.049 -0.875 12.032 1.00 12.34 O ATOM 1134 CG2 THR A 70 17.408 -1.380 10.334 1.00 32.25 C ATOM 0 H THR A 70 21.546 -1.253 10.574 1.00 61.32 H new ATOM 0 HA THR A 70 19.341 -3.205 10.545 1.00 13.22 H new ATOM 0 HB THR A 70 19.175 -0.207 10.079 1.00 34.21 H new ATOM 0 HG1 THR A 70 18.741 0.027 12.260 1.00 12.34 H new ATOM 0 HG21 THR A 70 16.802 -0.538 10.668 1.00 32.25 H new ATOM 0 HG22 THR A 70 17.273 -1.521 9.262 1.00 32.25 H new ATOM 0 HG23 THR A 70 17.097 -2.282 10.861 1.00 32.25 H new ATOM 1142 N THR A 71 19.877 -3.513 8.088 1.00 55.33 N ATOM 1143 CA THR A 71 19.908 -3.685 6.641 1.00 73.31 C ATOM 1144 C THR A 71 18.515 -3.971 6.091 1.00 30.21 C ATOM 1145 O THR A 71 17.847 -4.908 6.526 1.00 31.34 O ATOM 1146 CB THR A 71 20.854 -4.830 6.232 1.00 73.10 C ATOM 1147 OG1 THR A 71 21.889 -4.983 7.210 1.00 73.24 O ATOM 1148 CG2 THR A 71 21.473 -4.560 4.869 1.00 54.21 C ATOM 0 H THR A 71 19.934 -4.383 8.618 1.00 55.33 H new ATOM 0 HA THR A 71 20.277 -2.750 6.219 1.00 73.31 H new ATOM 0 HB THR A 71 20.272 -5.749 6.173 1.00 73.10 H new ATOM 0 HG1 THR A 71 22.305 -5.865 7.111 1.00 73.24 H new ATOM 0 HG21 THR A 71 22.137 -5.382 4.602 1.00 54.21 H new ATOM 0 HG22 THR A 71 20.684 -4.473 4.122 1.00 54.21 H new ATOM 0 HG23 THR A 71 22.042 -3.631 4.905 1.00 54.21 H new ATOM 1156 N GLU A 72 18.084 -3.158 5.132 1.00 51.11 N ATOM 1157 CA GLU A 72 16.769 -3.325 4.523 1.00 24.03 C ATOM 1158 C GLU A 72 16.872 -3.333 3.001 1.00 71.42 C ATOM 1159 O GLU A 72 17.645 -2.574 2.415 1.00 34.21 O ATOM 1160 CB GLU A 72 15.827 -2.207 4.976 1.00 65.42 C ATOM 1161 CG GLU A 72 15.416 -2.312 6.435 1.00 40.42 C ATOM 1162 CD GLU A 72 15.190 -0.956 7.076 1.00 43.14 C ATOM 1163 OE1 GLU A 72 14.782 -0.020 6.357 1.00 35.11 O ATOM 1164 OE2 GLU A 72 15.422 -0.831 8.296 1.00 25.54 O ATOM 0 H GLU A 72 18.625 -2.378 4.760 1.00 51.11 H new ATOM 0 HA GLU A 72 16.365 -4.284 4.848 1.00 24.03 H new ATOM 0 HB2 GLU A 72 16.313 -1.245 4.812 1.00 65.42 H new ATOM 0 HB3 GLU A 72 14.933 -2.222 4.353 1.00 65.42 H new ATOM 0 HG2 GLU A 72 14.503 -2.902 6.510 1.00 40.42 H new ATOM 0 HG3 GLU A 72 16.187 -2.847 6.988 1.00 40.42 H new ATOM 1171 N HIS A 73 16.087 -4.198 2.365 1.00 22.14 N ATOM 1172 CA HIS A 73 16.089 -4.306 0.911 1.00 70.22 C ATOM 1173 C HIS A 73 14.673 -4.186 0.355 1.00 1.04 C ATOM 1174 O HIS A 73 13.771 -4.912 0.770 1.00 34.31 O ATOM 1175 CB HIS A 73 16.708 -5.636 0.478 1.00 50.51 C ATOM 1176 CG HIS A 73 18.037 -5.912 1.111 1.00 13.02 C ATOM 1177 ND1 HIS A 73 19.225 -5.883 0.411 1.00 14.15 N ATOM 1178 CD2 HIS A 73 18.361 -6.223 2.388 1.00 5.40 C ATOM 1179 CE1 HIS A 73 20.222 -6.165 1.230 1.00 22.31 C ATOM 1180 NE2 HIS A 73 19.725 -6.375 2.436 1.00 63.13 N ATOM 0 H HIS A 73 15.442 -4.834 2.834 1.00 22.14 H new ATOM 0 HA HIS A 73 16.688 -3.488 0.512 1.00 70.22 H new ATOM 0 HB2 HIS A 73 16.021 -6.445 0.727 1.00 50.51 H new ATOM 0 HB3 HIS A 73 16.824 -5.638 -0.606 1.00 50.51 H new ATOM 0 HD1 HIS A 73 19.319 -5.676 -0.583 1.00 14.15 H new ATOM 0 HD2 HIS A 73 17.675 -6.331 3.215 1.00 5.40 H new ATOM 0 HE1 HIS A 73 21.266 -6.215 0.960 1.00 22.31 H new ATOM 1188 N GLU A 74 14.487 -3.264 -0.584 1.00 2.20 N ATOM 1189 CA GLU A 74 13.180 -3.048 -1.194 1.00 65.31 C ATOM 1190 C GLU A 74 12.871 -4.138 -2.216 1.00 72.50 C ATOM 1191 O GLU A 74 13.685 -4.433 -3.092 1.00 32.14 O ATOM 1192 CB GLU A 74 13.127 -1.674 -1.865 1.00 73.44 C ATOM 1193 CG GLU A 74 11.820 -1.403 -2.593 1.00 24.14 C ATOM 1194 CD GLU A 74 11.733 0.013 -3.127 1.00 5.42 C ATOM 1195 OE1 GLU A 74 11.465 0.177 -4.335 1.00 64.13 O ATOM 1196 OE2 GLU A 74 11.934 0.959 -2.335 1.00 75.44 O ATOM 0 H GLU A 74 15.224 -2.655 -0.939 1.00 2.20 H new ATOM 0 HA GLU A 74 12.428 -3.089 -0.406 1.00 65.31 H new ATOM 0 HB2 GLU A 74 13.279 -0.904 -1.109 1.00 73.44 H new ATOM 0 HB3 GLU A 74 13.952 -1.593 -2.573 1.00 73.44 H new ATOM 0 HG2 GLU A 74 11.716 -2.106 -3.419 1.00 24.14 H new ATOM 0 HG3 GLU A 74 10.986 -1.583 -1.914 1.00 24.14 H new ATOM 1203 N TYR A 75 11.689 -4.734 -2.097 1.00 43.22 N ATOM 1204 CA TYR A 75 11.272 -5.793 -3.008 1.00 23.41 C ATOM 1205 C TYR A 75 9.965 -5.430 -3.705 1.00 12.52 C ATOM 1206 O TYR A 75 9.319 -4.439 -3.360 1.00 63.53 O ATOM 1207 CB TYR A 75 11.109 -7.112 -2.249 1.00 42.44 C ATOM 1208 CG TYR A 75 12.305 -8.029 -2.366 1.00 61.42 C ATOM 1209 CD1 TYR A 75 12.717 -8.512 -3.602 1.00 23.30 C ATOM 1210 CD2 TYR A 75 13.024 -8.413 -1.240 1.00 54.23 C ATOM 1211 CE1 TYR A 75 13.809 -9.352 -3.713 1.00 52.40 C ATOM 1212 CE2 TYR A 75 14.117 -9.251 -1.342 1.00 44.50 C ATOM 1213 CZ TYR A 75 14.506 -9.718 -2.580 1.00 53.34 C ATOM 1214 OH TYR A 75 15.594 -10.552 -2.687 1.00 25.40 O ATOM 0 H TYR A 75 11.003 -4.501 -1.379 1.00 43.22 H new ATOM 0 HA TYR A 75 12.046 -5.910 -3.766 1.00 23.41 H new ATOM 0 HB2 TYR A 75 10.929 -6.896 -1.196 1.00 42.44 H new ATOM 0 HB3 TYR A 75 10.226 -7.630 -2.623 1.00 42.44 H new ATOM 0 HD1 TYR A 75 12.175 -8.226 -4.491 1.00 23.30 H new ATOM 0 HD2 TYR A 75 12.723 -8.050 -0.269 1.00 54.23 H new ATOM 0 HE1 TYR A 75 14.115 -9.720 -4.681 1.00 52.40 H new ATOM 0 HE2 TYR A 75 14.664 -9.539 -0.457 1.00 44.50 H new ATOM 0 HH TYR A 75 15.973 -10.711 -1.797 1.00 25.40 H new ATOM 1224 N ASP A 76 9.581 -6.238 -4.686 1.00 53.15 N ATOM 1225 CA ASP A 76 8.350 -6.004 -5.432 1.00 55.22 C ATOM 1226 C ASP A 76 7.147 -6.576 -4.688 1.00 53.34 C ATOM 1227 O ASP A 76 6.086 -5.953 -4.631 1.00 30.25 O ATOM 1228 CB ASP A 76 8.446 -6.626 -6.826 1.00 21.10 C ATOM 1229 CG ASP A 76 8.986 -8.042 -6.792 1.00 32.45 C ATOM 1230 OD1 ASP A 76 8.170 -8.989 -6.795 1.00 5.33 O ATOM 1231 OD2 ASP A 76 10.223 -8.205 -6.762 1.00 44.43 O ATOM 0 H ASP A 76 10.104 -7.061 -4.984 1.00 53.15 H new ATOM 0 HA ASP A 76 8.215 -4.927 -5.532 1.00 55.22 H new ATOM 0 HB2 ASP A 76 7.459 -6.628 -7.289 1.00 21.10 H new ATOM 0 HB3 ASP A 76 9.091 -6.009 -7.452 1.00 21.10 H new ATOM 1236 N PHE A 77 7.319 -7.765 -4.121 1.00 72.24 N ATOM 1237 CA PHE A 77 6.247 -8.422 -3.383 1.00 31.50 C ATOM 1238 C PHE A 77 6.148 -7.872 -1.963 1.00 73.32 C ATOM 1239 O PHE A 77 5.102 -7.964 -1.322 1.00 11.22 O ATOM 1240 CB PHE A 77 6.480 -9.934 -3.341 1.00 61.11 C ATOM 1241 CG PHE A 77 7.843 -10.317 -2.839 1.00 40.32 C ATOM 1242 CD1 PHE A 77 8.143 -10.248 -1.488 1.00 51.42 C ATOM 1243 CD2 PHE A 77 8.824 -10.746 -3.718 1.00 42.02 C ATOM 1244 CE1 PHE A 77 9.397 -10.598 -1.024 1.00 75.30 C ATOM 1245 CE2 PHE A 77 10.080 -11.098 -3.260 1.00 34.52 C ATOM 1246 CZ PHE A 77 10.366 -11.025 -1.911 1.00 33.44 C ATOM 0 H PHE A 77 8.191 -8.293 -4.158 1.00 72.24 H new ATOM 0 HA PHE A 77 5.308 -8.220 -3.899 1.00 31.50 H new ATOM 0 HB2 PHE A 77 5.725 -10.392 -2.703 1.00 61.11 H new ATOM 0 HB3 PHE A 77 6.342 -10.343 -4.342 1.00 61.11 H new ATOM 0 HD1 PHE A 77 7.388 -9.917 -0.790 1.00 51.42 H new ATOM 0 HD2 PHE A 77 8.605 -10.806 -4.774 1.00 42.02 H new ATOM 0 HE1 PHE A 77 9.619 -10.538 0.031 1.00 75.30 H new ATOM 0 HE2 PHE A 77 10.836 -11.430 -3.956 1.00 34.52 H new ATOM 0 HZ PHE A 77 11.346 -11.301 -1.550 1.00 33.44 H new ATOM 1256 N GLY A 78 7.246 -7.300 -1.478 1.00 71.43 N ATOM 1257 CA GLY A 78 7.263 -6.744 -0.138 1.00 32.41 C ATOM 1258 C GLY A 78 8.670 -6.531 0.383 1.00 10.44 C ATOM 1259 O GLY A 78 9.481 -7.457 0.398 1.00 60.13 O ATOM 0 H GLY A 78 8.124 -7.212 -1.990 1.00 71.43 H new ATOM 0 HA2 GLY A 78 6.730 -5.793 -0.136 1.00 32.41 H new ATOM 0 HA3 GLY A 78 6.726 -7.412 0.536 1.00 32.41 H new ATOM 1263 N ILE A 79 8.961 -5.307 0.811 1.00 2.21 N ATOM 1264 CA ILE A 79 10.280 -4.975 1.335 1.00 43.12 C ATOM 1265 C ILE A 79 10.683 -5.928 2.454 1.00 22.55 C ATOM 1266 O ILE A 79 9.850 -6.347 3.258 1.00 73.30 O ATOM 1267 CB ILE A 79 10.328 -3.530 1.865 1.00 44.44 C ATOM 1268 CG1 ILE A 79 9.929 -2.546 0.763 1.00 43.23 C ATOM 1269 CG2 ILE A 79 11.717 -3.205 2.394 1.00 64.40 C ATOM 1270 CD1 ILE A 79 10.183 -1.099 1.124 1.00 42.15 C ATOM 0 H ILE A 79 8.301 -4.529 0.805 1.00 2.21 H new ATOM 0 HA ILE A 79 10.982 -5.073 0.507 1.00 43.12 H new ATOM 0 HB ILE A 79 9.617 -3.436 2.686 1.00 44.44 H new ATOM 0 HG12 ILE A 79 10.480 -2.788 -0.146 1.00 43.23 H new ATOM 0 HG13 ILE A 79 8.870 -2.675 0.537 1.00 43.23 H new ATOM 0 HG21 ILE A 79 11.734 -2.180 2.765 1.00 64.40 H new ATOM 0 HG22 ILE A 79 11.967 -3.889 3.205 1.00 64.40 H new ATOM 0 HG23 ILE A 79 12.446 -3.313 1.591 1.00 64.40 H new ATOM 0 HD11 ILE A 79 9.877 -0.459 0.297 1.00 42.15 H new ATOM 0 HD12 ILE A 79 9.610 -0.840 2.015 1.00 42.15 H new ATOM 0 HD13 ILE A 79 11.245 -0.954 1.321 1.00 42.15 H new ATOM 1282 N VAL A 80 11.968 -6.267 2.503 1.00 52.04 N ATOM 1283 CA VAL A 80 12.483 -7.169 3.526 1.00 51.02 C ATOM 1284 C VAL A 80 13.456 -6.450 4.453 1.00 41.31 C ATOM 1285 O VAL A 80 14.465 -5.903 4.007 1.00 23.41 O ATOM 1286 CB VAL A 80 13.192 -8.384 2.898 1.00 52.32 C ATOM 1287 CG1 VAL A 80 14.306 -7.930 1.967 1.00 1.43 C ATOM 1288 CG2 VAL A 80 13.733 -9.303 3.982 1.00 72.40 C ATOM 0 H VAL A 80 12.671 -5.930 1.846 1.00 52.04 H new ATOM 0 HA VAL A 80 11.626 -7.516 4.103 1.00 51.02 H new ATOM 0 HB VAL A 80 12.465 -8.943 2.309 1.00 52.32 H new ATOM 0 HG11 VAL A 80 14.795 -8.802 1.533 1.00 1.43 H new ATOM 0 HG12 VAL A 80 13.887 -7.315 1.171 1.00 1.43 H new ATOM 0 HG13 VAL A 80 15.035 -7.347 2.530 1.00 1.43 H new ATOM 0 HG21 VAL A 80 14.231 -10.156 3.521 1.00 72.40 H new ATOM 0 HG22 VAL A 80 14.446 -8.757 4.599 1.00 72.40 H new ATOM 0 HG23 VAL A 80 12.910 -9.656 4.604 1.00 72.40 H new ATOM 1298 N ARG A 81 13.146 -6.454 5.745 1.00 24.13 N ATOM 1299 CA ARG A 81 13.994 -5.801 6.736 1.00 35.32 C ATOM 1300 C ARG A 81 14.708 -6.833 7.605 1.00 13.40 C ATOM 1301 O ARG A 81 14.092 -7.478 8.454 1.00 33.40 O ATOM 1302 CB ARG A 81 13.160 -4.868 7.615 1.00 13.45 C ATOM 1303 CG ARG A 81 12.132 -4.058 6.841 1.00 23.12 C ATOM 1304 CD ARG A 81 11.368 -3.111 7.753 1.00 54.14 C ATOM 1305 NE ARG A 81 11.974 -1.783 7.795 1.00 24.20 N ATOM 1306 CZ ARG A 81 11.357 -0.708 8.271 1.00 53.20 C ATOM 1307 NH1 ARG A 81 10.121 -0.803 8.743 1.00 64.21 N ATOM 1308 NH2 ARG A 81 11.975 0.466 8.276 1.00 41.21 N ATOM 0 H ARG A 81 12.314 -6.902 6.130 1.00 24.13 H new ATOM 0 HA ARG A 81 14.745 -5.215 6.206 1.00 35.32 H new ATOM 0 HB2 ARG A 81 12.647 -5.459 8.374 1.00 13.45 H new ATOM 0 HB3 ARG A 81 13.827 -4.185 8.140 1.00 13.45 H new ATOM 0 HG2 ARG A 81 12.631 -3.487 6.058 1.00 23.12 H new ATOM 0 HG3 ARG A 81 11.433 -4.732 6.347 1.00 23.12 H new ATOM 0 HD2 ARG A 81 10.337 -3.028 7.408 1.00 54.14 H new ATOM 0 HD3 ARG A 81 11.335 -3.526 8.760 1.00 54.14 H new ATOM 0 HE ARG A 81 12.924 -1.675 7.439 1.00 24.20 H new ATOM 0 HH11 ARG A 81 9.642 -1.704 8.741 1.00 64.21 H new ATOM 0 HH12 ARG A 81 9.649 0.025 9.108 1.00 64.21 H new ATOM 0 HH21 ARG A 81 12.925 0.544 7.914 1.00 41.21 H new ATOM 0 HH22 ARG A 81 11.500 1.291 8.642 1.00 41.21 H new ATOM 1322 N LEU A 82 16.009 -6.982 7.387 1.00 65.42 N ATOM 1323 CA LEU A 82 16.808 -7.936 8.149 1.00 3.44 C ATOM 1324 C LEU A 82 17.708 -7.216 9.149 1.00 13.40 C ATOM 1325 O LEU A 82 18.366 -6.231 8.812 1.00 65.11 O ATOM 1326 CB LEU A 82 17.657 -8.790 7.206 1.00 53.11 C ATOM 1327 CG LEU A 82 17.972 -10.208 7.684 1.00 14.45 C ATOM 1328 CD1 LEU A 82 18.821 -10.169 8.946 1.00 75.03 C ATOM 1329 CD2 LEU A 82 16.687 -10.986 7.928 1.00 72.02 C ATOM 0 H LEU A 82 16.534 -6.455 6.689 1.00 65.42 H new ATOM 0 HA LEU A 82 16.126 -8.583 8.701 1.00 3.44 H new ATOM 0 HB2 LEU A 82 17.143 -8.857 6.247 1.00 53.11 H new ATOM 0 HB3 LEU A 82 18.599 -8.271 7.027 1.00 53.11 H new ATOM 0 HG LEU A 82 18.539 -10.717 6.904 1.00 14.45 H new ATOM 0 HD11 LEU A 82 19.035 -11.187 9.272 1.00 75.03 H new ATOM 0 HD12 LEU A 82 19.757 -9.649 8.739 1.00 75.03 H new ATOM 0 HD13 LEU A 82 18.280 -9.643 9.732 1.00 75.03 H new ATOM 0 HD21 LEU A 82 16.930 -11.993 8.268 1.00 72.02 H new ATOM 0 HD22 LEU A 82 16.094 -10.479 8.690 1.00 72.02 H new ATOM 0 HD23 LEU A 82 16.115 -11.044 7.002 1.00 72.02 H new ATOM 1341 N THR A 83 17.732 -7.714 10.381 1.00 25.12 N ATOM 1342 CA THR A 83 18.552 -7.120 11.430 1.00 54.31 C ATOM 1343 C THR A 83 19.339 -8.186 12.183 1.00 11.33 C ATOM 1344 O THR A 83 18.960 -9.358 12.199 1.00 3.52 O ATOM 1345 CB THR A 83 17.692 -6.328 12.433 1.00 11.31 C ATOM 1346 OG1 THR A 83 18.534 -5.565 13.305 1.00 20.51 O ATOM 1347 CG2 THR A 83 16.818 -7.264 13.254 1.00 0.32 C ATOM 0 H THR A 83 17.193 -8.528 10.677 1.00 25.12 H new ATOM 0 HA THR A 83 19.247 -6.438 10.940 1.00 54.31 H new ATOM 0 HB THR A 83 17.046 -5.654 11.871 1.00 11.31 H new ATOM 0 HG1 THR A 83 18.175 -5.596 14.216 1.00 20.51 H new ATOM 0 HG21 THR A 83 16.220 -6.682 13.955 1.00 0.32 H new ATOM 0 HG22 THR A 83 16.158 -7.822 12.590 1.00 0.32 H new ATOM 0 HG23 THR A 83 17.449 -7.960 13.806 1.00 0.32 H new ATOM 1355 N THR A 84 20.437 -7.773 12.808 1.00 1.44 N ATOM 1356 CA THR A 84 21.278 -8.692 13.564 1.00 63.33 C ATOM 1357 C THR A 84 21.594 -8.138 14.948 1.00 3.31 C ATOM 1358 O THR A 84 21.765 -6.930 15.120 1.00 73.53 O ATOM 1359 CB THR A 84 22.599 -8.981 12.825 1.00 31.22 C ATOM 1360 OG1 THR A 84 23.130 -7.769 12.279 1.00 2.32 O ATOM 1361 CG2 THR A 84 22.385 -9.994 11.711 1.00 63.32 C ATOM 0 H THR A 84 20.765 -6.807 12.805 1.00 1.44 H new ATOM 0 HA THR A 84 20.717 -9.621 13.668 1.00 63.33 H new ATOM 0 HB THR A 84 23.307 -9.397 13.542 1.00 31.22 H new ATOM 0 HG1 THR A 84 22.783 -7.639 11.372 1.00 2.32 H new ATOM 0 HG21 THR A 84 23.331 -10.182 11.204 1.00 63.32 H new ATOM 0 HG22 THR A 84 22.008 -10.925 12.134 1.00 63.32 H new ATOM 0 HG23 THR A 84 21.662 -9.601 10.996 1.00 63.32 H new ATOM 1369 N TYR A 85 21.672 -9.026 15.932 1.00 32.25 N ATOM 1370 CA TYR A 85 21.966 -8.625 17.303 1.00 52.30 C ATOM 1371 C TYR A 85 23.059 -9.502 17.905 1.00 62.00 C ATOM 1372 O TYR A 85 22.956 -10.729 17.910 1.00 15.10 O ATOM 1373 CB TYR A 85 20.703 -8.703 18.162 1.00 74.51 C ATOM 1374 CG TYR A 85 19.883 -7.433 18.152 1.00 42.23 C ATOM 1375 CD1 TYR A 85 18.697 -7.353 17.433 1.00 60.23 C ATOM 1376 CD2 TYR A 85 20.295 -6.312 18.862 1.00 0.21 C ATOM 1377 CE1 TYR A 85 17.946 -6.194 17.420 1.00 32.01 C ATOM 1378 CE2 TYR A 85 19.549 -5.149 18.856 1.00 4.23 C ATOM 1379 CZ TYR A 85 18.376 -5.095 18.133 1.00 10.35 C ATOM 1380 OH TYR A 85 17.630 -3.939 18.125 1.00 53.45 O ATOM 0 H TYR A 85 21.536 -10.029 15.806 1.00 32.25 H new ATOM 0 HA TYR A 85 22.321 -7.595 17.284 1.00 52.30 H new ATOM 0 HB2 TYR A 85 20.084 -9.528 17.809 1.00 74.51 H new ATOM 0 HB3 TYR A 85 20.986 -8.934 19.189 1.00 74.51 H new ATOM 0 HD1 TYR A 85 18.356 -8.212 16.874 1.00 60.23 H new ATOM 0 HD2 TYR A 85 21.214 -6.350 19.428 1.00 0.21 H new ATOM 0 HE1 TYR A 85 17.027 -6.149 16.854 1.00 32.01 H new ATOM 0 HE2 TYR A 85 19.883 -4.287 19.414 1.00 4.23 H new ATOM 0 HH TYR A 85 18.072 -3.261 18.678 1.00 53.45 H new ATOM 1390 N LYS A 86 24.108 -8.864 18.413 1.00 40.31 N ATOM 1391 CA LYS A 86 25.222 -9.583 19.020 1.00 14.10 C ATOM 1392 C LYS A 86 24.735 -10.487 20.148 1.00 20.00 C ATOM 1393 O LYS A 86 23.931 -10.074 20.985 1.00 43.43 O ATOM 1394 CB LYS A 86 26.262 -8.596 19.556 1.00 75.14 C ATOM 1395 CG LYS A 86 27.617 -8.714 18.880 1.00 54.24 C ATOM 1396 CD LYS A 86 27.715 -7.805 17.666 1.00 70.33 C ATOM 1397 CE LYS A 86 29.157 -7.630 17.216 1.00 64.31 C ATOM 1398 NZ LYS A 86 29.758 -6.378 17.754 1.00 62.41 N ATOM 0 H LYS A 86 24.210 -7.849 18.416 1.00 40.31 H new ATOM 0 HA LYS A 86 25.682 -10.205 18.252 1.00 14.10 H new ATOM 0 HB2 LYS A 86 25.888 -7.581 19.426 1.00 75.14 H new ATOM 0 HB3 LYS A 86 26.384 -8.756 20.627 1.00 75.14 H new ATOM 0 HG2 LYS A 86 28.403 -8.459 19.591 1.00 54.24 H new ATOM 0 HG3 LYS A 86 27.785 -9.747 18.577 1.00 54.24 H new ATOM 0 HD2 LYS A 86 27.126 -8.222 16.849 1.00 70.33 H new ATOM 0 HD3 LYS A 86 27.286 -6.831 17.903 1.00 70.33 H new ATOM 0 HE2 LYS A 86 29.746 -8.486 17.545 1.00 64.31 H new ATOM 0 HE3 LYS A 86 29.198 -7.614 16.127 1.00 64.31 H new ATOM 0 HZ1 LYS A 86 30.741 -6.295 17.425 1.00 62.41 H new ATOM 0 HZ2 LYS A 86 29.211 -5.559 17.420 1.00 62.41 H new ATOM 0 HZ3 LYS A 86 29.742 -6.404 18.794 1.00 62.41 H new ATOM 1412 N CYS A 87 25.228 -11.720 20.165 1.00 34.55 N ATOM 1413 CA CYS A 87 24.843 -12.683 21.192 1.00 41.11 C ATOM 1414 C CYS A 87 26.074 -13.286 21.861 1.00 43.34 C ATOM 1415 O CYS A 87 27.146 -13.363 21.259 1.00 4.34 O ATOM 1416 CB CYS A 87 23.983 -13.792 20.584 1.00 25.10 C ATOM 1417 SG CYS A 87 22.442 -13.208 19.840 1.00 4.14 S ATOM 0 H CYS A 87 25.895 -12.077 19.480 1.00 34.55 H new ATOM 0 HA CYS A 87 24.262 -12.157 21.949 1.00 41.11 H new ATOM 0 HB2 CYS A 87 24.566 -14.314 19.825 1.00 25.10 H new ATOM 0 HB3 CYS A 87 23.746 -14.520 21.360 1.00 25.10 H new ATOM 0 HG CYS A 87 22.694 -12.210 19.046 1.00 4.14 H new ATOM 1423 N THR A 88 25.914 -13.711 23.110 1.00 63.21 N ATOM 1424 CA THR A 88 27.013 -14.304 23.862 1.00 72.31 C ATOM 1425 C THR A 88 26.832 -15.811 24.003 1.00 33.34 C ATOM 1426 O THR A 88 25.774 -16.353 23.678 1.00 65.20 O ATOM 1427 CB THR A 88 27.135 -13.680 25.264 1.00 4.55 C ATOM 1428 OG1 THR A 88 26.547 -12.374 25.272 1.00 31.14 O ATOM 1429 CG2 THR A 88 28.593 -13.587 25.690 1.00 10.21 C ATOM 0 H THR A 88 25.034 -13.656 23.622 1.00 63.21 H new ATOM 0 HA THR A 88 27.926 -14.101 23.301 1.00 72.31 H new ATOM 0 HB THR A 88 26.606 -14.321 25.970 1.00 4.55 H new ATOM 0 HG1 THR A 88 26.627 -11.985 26.168 1.00 31.14 H new ATOM 0 HG21 THR A 88 28.654 -13.143 26.684 1.00 10.21 H new ATOM 0 HG22 THR A 88 29.030 -14.585 25.711 1.00 10.21 H new ATOM 0 HG23 THR A 88 29.140 -12.966 24.981 1.00 10.21 H new ATOM 1437 N LEU A 89 27.868 -16.484 24.491 1.00 3.32 N ATOM 1438 CA LEU A 89 27.823 -17.930 24.677 1.00 43.01 C ATOM 1439 C LEU A 89 27.360 -18.284 26.086 1.00 10.24 C ATOM 1440 O LEU A 89 27.594 -17.534 27.033 1.00 35.35 O ATOM 1441 CB LEU A 89 29.200 -18.541 24.412 1.00 63.12 C ATOM 1442 CG LEU A 89 29.373 -20.006 24.815 1.00 5.23 C ATOM 1443 CD1 LEU A 89 28.556 -20.910 23.906 1.00 34.14 C ATOM 1444 CD2 LEU A 89 30.843 -20.399 24.779 1.00 2.21 C ATOM 0 H LEU A 89 28.750 -16.051 24.765 1.00 3.32 H new ATOM 0 HA LEU A 89 27.107 -18.341 23.965 1.00 43.01 H new ATOM 0 HB2 LEU A 89 29.417 -18.450 23.348 1.00 63.12 H new ATOM 0 HB3 LEU A 89 29.946 -17.949 24.942 1.00 63.12 H new ATOM 0 HG LEU A 89 29.010 -20.127 25.835 1.00 5.23 H new ATOM 0 HD11 LEU A 89 28.692 -21.948 24.208 1.00 34.14 H new ATOM 0 HD12 LEU A 89 27.501 -20.645 23.982 1.00 34.14 H new ATOM 0 HD13 LEU A 89 28.888 -20.786 22.875 1.00 34.14 H new ATOM 0 HD21 LEU A 89 30.947 -21.445 25.069 1.00 2.21 H new ATOM 0 HD22 LEU A 89 31.232 -20.261 23.770 1.00 2.21 H new ATOM 0 HD23 LEU A 89 31.404 -19.773 25.473 1.00 2.21 H new ATOM 1456 N ASN A 90 26.704 -19.432 26.217 1.00 32.22 N ATOM 1457 CA ASN A 90 26.209 -19.887 27.512 1.00 42.33 C ATOM 1458 C ASN A 90 26.429 -21.387 27.682 1.00 5.32 C ATOM 1459 O ASN A 90 26.820 -22.079 26.742 1.00 21.11 O ATOM 1460 CB ASN A 90 24.722 -19.559 27.656 1.00 13.44 C ATOM 1461 CG ASN A 90 23.881 -20.192 26.565 1.00 42.25 C ATOM 1462 OD1 ASN A 90 24.131 -19.988 25.376 1.00 24.34 O ATOM 1463 ND2 ASN A 90 22.877 -20.964 26.964 1.00 65.34 N ATOM 0 H ASN A 90 26.503 -20.065 25.443 1.00 32.22 H new ATOM 0 HA ASN A 90 26.767 -19.366 28.290 1.00 42.33 H new ATOM 0 HB2 ASN A 90 24.370 -19.903 28.628 1.00 13.44 H new ATOM 0 HB3 ASN A 90 24.588 -18.478 27.633 1.00 13.44 H new ATOM 0 HD21 ASN A 90 22.276 -21.416 26.275 1.00 65.34 H new ATOM 0 HD22 ASN A 90 22.707 -21.105 27.960 1.00 65.34 H new ATOM 1470 N LYS A 91 26.176 -21.883 28.888 1.00 32.03 N ATOM 1471 CA LYS A 91 26.344 -23.301 29.184 1.00 52.04 C ATOM 1472 C LYS A 91 25.627 -24.161 28.148 1.00 61.13 C ATOM 1473 O LYS A 91 26.130 -25.208 27.743 1.00 64.42 O ATOM 1474 CB LYS A 91 25.811 -23.618 30.583 1.00 73.44 C ATOM 1475 CG LYS A 91 24.489 -22.941 30.898 1.00 54.51 C ATOM 1476 CD LYS A 91 24.668 -21.801 31.887 1.00 30.11 C ATOM 1477 CE LYS A 91 23.497 -20.831 31.839 1.00 62.53 C ATOM 1478 NZ LYS A 91 23.821 -19.610 31.050 1.00 33.24 N ATOM 0 H LYS A 91 25.853 -21.323 29.677 1.00 32.03 H new ATOM 0 HA LYS A 91 27.409 -23.531 29.147 1.00 52.04 H new ATOM 0 HB2 LYS A 91 25.689 -24.697 30.680 1.00 73.44 H new ATOM 0 HB3 LYS A 91 26.551 -23.313 31.322 1.00 73.44 H new ATOM 0 HG2 LYS A 91 24.046 -22.560 29.978 1.00 54.51 H new ATOM 0 HG3 LYS A 91 23.793 -23.673 31.307 1.00 54.51 H new ATOM 0 HD2 LYS A 91 24.766 -22.205 32.895 1.00 30.11 H new ATOM 0 HD3 LYS A 91 25.593 -21.268 31.666 1.00 30.11 H new ATOM 0 HE2 LYS A 91 22.631 -21.328 31.401 1.00 62.53 H new ATOM 0 HE3 LYS A 91 23.220 -20.545 32.854 1.00 62.53 H new ATOM 0 HZ1 LYS A 91 23.700 -18.768 31.648 1.00 33.24 H new ATOM 0 HZ2 LYS A 91 24.806 -19.661 30.720 1.00 33.24 H new ATOM 0 HZ3 LYS A 91 23.184 -19.547 30.230 1.00 33.24 H new ATOM 1492 N GLU A 92 24.451 -23.711 27.723 1.00 52.44 N ATOM 1493 CA GLU A 92 23.667 -24.440 26.733 1.00 35.11 C ATOM 1494 C GLU A 92 23.893 -23.874 25.334 1.00 23.12 C ATOM 1495 O GLU A 92 24.070 -22.667 25.161 1.00 30.35 O ATOM 1496 CB GLU A 92 22.178 -24.380 27.084 1.00 25.33 C ATOM 1497 CG GLU A 92 21.448 -25.694 26.865 1.00 71.34 C ATOM 1498 CD GLU A 92 21.558 -26.629 28.053 1.00 23.14 C ATOM 1499 OE1 GLU A 92 22.411 -27.540 28.015 1.00 24.14 O ATOM 1500 OE2 GLU A 92 20.791 -26.449 29.022 1.00 10.22 O ATOM 0 H GLU A 92 24.020 -22.846 28.048 1.00 52.44 H new ATOM 0 HA GLU A 92 23.995 -25.480 26.743 1.00 35.11 H new ATOM 0 HB2 GLU A 92 22.071 -24.084 28.128 1.00 25.33 H new ATOM 0 HB3 GLU A 92 21.702 -23.605 26.483 1.00 25.33 H new ATOM 0 HG2 GLU A 92 20.396 -25.491 26.663 1.00 71.34 H new ATOM 0 HG3 GLU A 92 21.853 -26.187 25.981 1.00 71.34 H new ATOM 1507 N LEU A 93 23.888 -24.754 24.339 1.00 53.53 N ATOM 1508 CA LEU A 93 24.093 -24.343 22.954 1.00 62.00 C ATOM 1509 C LEU A 93 22.767 -23.995 22.287 1.00 55.24 C ATOM 1510 O LEU A 93 21.696 -24.423 22.718 1.00 54.33 O ATOM 1511 CB LEU A 93 24.795 -25.454 22.171 1.00 50.12 C ATOM 1512 CG LEU A 93 26.319 -25.498 22.288 1.00 50.11 C ATOM 1513 CD1 LEU A 93 26.789 -26.909 22.606 1.00 45.33 C ATOM 1514 CD2 LEU A 93 26.967 -24.994 21.007 1.00 50.43 C ATOM 0 H LEU A 93 23.744 -25.756 24.465 1.00 53.53 H new ATOM 0 HA LEU A 93 24.722 -23.453 22.954 1.00 62.00 H new ATOM 0 HB2 LEU A 93 24.397 -26.413 22.504 1.00 50.12 H new ATOM 0 HB3 LEU A 93 24.534 -25.349 21.118 1.00 50.12 H new ATOM 0 HG LEU A 93 26.621 -24.844 23.106 1.00 50.11 H new ATOM 0 HD11 LEU A 93 27.876 -26.921 22.686 1.00 45.33 H new ATOM 0 HD12 LEU A 93 26.352 -27.234 23.550 1.00 45.33 H new ATOM 0 HD13 LEU A 93 26.476 -27.585 21.810 1.00 45.33 H new ATOM 0 HD21 LEU A 93 28.052 -25.032 21.108 1.00 50.43 H new ATOM 0 HD22 LEU A 93 26.658 -25.622 20.171 1.00 50.43 H new ATOM 0 HD23 LEU A 93 26.656 -23.966 20.822 1.00 50.43 H new ATOM 1526 N PRO A 94 22.837 -23.201 21.208 1.00 70.24 N ATOM 1527 CA PRO A 94 21.651 -22.780 20.456 1.00 70.32 C ATOM 1528 C PRO A 94 21.012 -23.933 19.688 1.00 42.40 C ATOM 1529 O PRO A 94 21.703 -24.832 19.208 1.00 23.15 O ATOM 1530 CB PRO A 94 22.200 -21.731 19.486 1.00 12.31 C ATOM 1531 CG PRO A 94 23.637 -22.085 19.319 1.00 42.53 C ATOM 1532 CD PRO A 94 24.080 -22.654 20.638 1.00 32.21 C ATOM 0 HA PRO A 94 20.865 -22.405 21.111 1.00 70.32 H new ATOM 0 HB2 PRO A 94 21.672 -21.759 18.533 1.00 12.31 H new ATOM 0 HB3 PRO A 94 22.084 -20.723 19.885 1.00 12.31 H new ATOM 0 HG2 PRO A 94 23.769 -22.811 18.517 1.00 42.53 H new ATOM 0 HG3 PRO A 94 24.227 -21.207 19.055 1.00 42.53 H new ATOM 0 HD2 PRO A 94 24.837 -23.427 20.508 1.00 32.21 H new ATOM 0 HD3 PRO A 94 24.514 -21.888 21.281 1.00 32.21 H new ATOM 1540 N THR A 95 19.688 -23.900 19.574 1.00 40.20 N ATOM 1541 CA THR A 95 18.956 -24.942 18.865 1.00 50.40 C ATOM 1542 C THR A 95 18.926 -24.669 17.365 1.00 22.34 C ATOM 1543 O THR A 95 19.153 -23.542 16.924 1.00 3.11 O ATOM 1544 CB THR A 95 17.510 -25.063 19.382 1.00 61.31 C ATOM 1545 OG1 THR A 95 16.986 -26.359 19.071 1.00 22.23 O ATOM 1546 CG2 THR A 95 16.623 -23.991 18.767 1.00 63.45 C ATOM 0 H THR A 95 19.101 -23.163 19.964 1.00 40.20 H new ATOM 0 HA THR A 95 19.480 -25.879 19.051 1.00 50.40 H new ATOM 0 HB THR A 95 17.522 -24.925 20.463 1.00 61.31 H new ATOM 0 HG1 THR A 95 16.067 -26.429 19.404 1.00 22.23 H new ATOM 0 HG21 THR A 95 15.607 -24.097 19.147 1.00 63.45 H new ATOM 0 HG22 THR A 95 17.008 -23.006 19.030 1.00 63.45 H new ATOM 0 HG23 THR A 95 16.618 -24.101 17.683 1.00 63.45 H new ATOM 1554 N LEU A 96 18.644 -25.707 16.586 1.00 63.31 N ATOM 1555 CA LEU A 96 18.584 -25.580 15.134 1.00 52.31 C ATOM 1556 C LEU A 96 19.933 -25.146 14.569 1.00 74.12 C ATOM 1557 O LEU A 96 20.023 -24.686 13.430 1.00 74.42 O ATOM 1558 CB LEU A 96 17.503 -24.573 14.735 1.00 5.23 C ATOM 1559 CG LEU A 96 17.981 -23.144 14.475 1.00 41.24 C ATOM 1560 CD1 LEU A 96 17.877 -22.808 12.995 1.00 1.10 C ATOM 1561 CD2 LEU A 96 17.179 -22.153 15.306 1.00 61.30 C ATOM 0 H LEU A 96 18.453 -26.646 16.935 1.00 63.31 H new ATOM 0 HA LEU A 96 18.334 -26.556 14.718 1.00 52.31 H new ATOM 0 HB2 LEU A 96 17.008 -24.939 13.835 1.00 5.23 H new ATOM 0 HB3 LEU A 96 16.751 -24.546 15.524 1.00 5.23 H new ATOM 0 HG LEU A 96 19.028 -23.072 14.771 1.00 41.24 H new ATOM 0 HD11 LEU A 96 18.221 -21.787 12.829 1.00 1.10 H new ATOM 0 HD12 LEU A 96 18.496 -23.498 12.421 1.00 1.10 H new ATOM 0 HD13 LEU A 96 16.839 -22.898 12.674 1.00 1.10 H new ATOM 0 HD21 LEU A 96 17.533 -21.141 15.108 1.00 61.30 H new ATOM 0 HD22 LEU A 96 16.124 -22.226 15.042 1.00 61.30 H new ATOM 0 HD23 LEU A 96 17.304 -22.380 16.365 1.00 61.30 H new ATOM 1573 N THR A 97 20.981 -25.297 15.372 1.00 63.21 N ATOM 1574 CA THR A 97 22.326 -24.923 14.952 1.00 13.51 C ATOM 1575 C THR A 97 22.962 -26.018 14.104 1.00 3.14 C ATOM 1576 O THR A 97 23.755 -25.738 13.206 1.00 54.44 O ATOM 1577 CB THR A 97 23.233 -24.634 16.163 1.00 34.23 C ATOM 1578 OG1 THR A 97 24.482 -24.091 15.722 1.00 55.52 O ATOM 1579 CG2 THR A 97 23.481 -25.902 16.967 1.00 1.41 C ATOM 0 H THR A 97 20.925 -25.676 16.317 1.00 63.21 H new ATOM 0 HA THR A 97 22.230 -24.016 14.355 1.00 13.51 H new ATOM 0 HB THR A 97 22.729 -23.909 16.802 1.00 34.23 H new ATOM 0 HG1 THR A 97 25.052 -23.909 16.498 1.00 55.52 H new ATOM 0 HG21 THR A 97 24.124 -25.674 17.817 1.00 1.41 H new ATOM 0 HG22 THR A 97 22.531 -26.297 17.326 1.00 1.41 H new ATOM 0 HG23 THR A 97 23.966 -26.645 16.334 1.00 1.41 H new ATOM 1587 N GLU A 98 22.610 -27.266 14.396 1.00 31.15 N ATOM 1588 CA GLU A 98 23.148 -28.403 13.660 1.00 62.43 C ATOM 1589 C GLU A 98 22.388 -28.615 12.353 1.00 0.45 C ATOM 1590 O GLU A 98 22.688 -29.532 11.589 1.00 42.13 O ATOM 1591 CB GLU A 98 23.079 -29.671 14.513 1.00 22.44 C ATOM 1592 CG GLU A 98 21.696 -29.951 15.077 1.00 61.32 C ATOM 1593 CD GLU A 98 21.318 -31.417 14.994 1.00 70.35 C ATOM 1594 OE1 GLU A 98 22.074 -32.257 15.526 1.00 15.31 O ATOM 1595 OE2 GLU A 98 20.266 -31.725 14.395 1.00 15.25 O ATOM 0 H GLU A 98 21.955 -27.515 15.137 1.00 31.15 H new ATOM 0 HA GLU A 98 24.190 -28.189 13.424 1.00 62.43 H new ATOM 0 HB2 GLU A 98 23.395 -30.522 13.910 1.00 22.44 H new ATOM 0 HB3 GLU A 98 23.787 -29.583 15.337 1.00 22.44 H new ATOM 0 HG2 GLU A 98 21.660 -29.629 16.118 1.00 61.32 H new ATOM 0 HG3 GLU A 98 20.960 -29.358 14.534 1.00 61.32 H new ATOM 1602 N HIS A 99 21.401 -27.759 12.105 1.00 64.12 N ATOM 1603 CA HIS A 99 20.597 -27.851 10.891 1.00 23.23 C ATOM 1604 C HIS A 99 21.475 -28.150 9.680 1.00 72.14 C ATOM 1605 O HIS A 99 21.107 -28.944 8.814 1.00 54.05 O ATOM 1606 CB HIS A 99 19.824 -26.552 10.667 1.00 14.32 C ATOM 1607 CG HIS A 99 18.337 -26.734 10.658 1.00 10.44 C ATOM 1608 ND1 HIS A 99 17.653 -27.392 11.659 1.00 44.30 N ATOM 1609 CD2 HIS A 99 17.402 -26.338 9.764 1.00 52.54 C ATOM 1610 CE1 HIS A 99 16.362 -27.394 11.379 1.00 23.11 C ATOM 1611 NE2 HIS A 99 16.183 -26.760 10.234 1.00 30.23 N ATOM 0 H HIS A 99 21.139 -26.995 12.728 1.00 64.12 H new ATOM 0 HA HIS A 99 19.888 -28.670 11.015 1.00 23.23 H new ATOM 0 HB2 HIS A 99 20.090 -25.841 11.449 1.00 14.32 H new ATOM 0 HB3 HIS A 99 20.134 -26.113 9.719 1.00 14.32 H new ATOM 0 HD2 HIS A 99 17.581 -25.791 8.850 1.00 52.54 H new ATOM 0 HE1 HIS A 99 15.585 -27.838 11.983 1.00 23.11 H new ATOM 0 HE2 HIS A 99 15.285 -26.609 9.774 1.00 30.23 H new ATOM 1619 N LYS A 100 22.637 -27.509 9.624 1.00 1.31 N ATOM 1620 CA LYS A 100 23.568 -27.705 8.519 1.00 22.34 C ATOM 1621 C LYS A 100 24.734 -28.594 8.942 1.00 73.12 C ATOM 1622 O LYS A 100 24.945 -29.667 8.377 1.00 50.04 O ATOM 1623 CB LYS A 100 24.095 -26.357 8.023 1.00 0.13 C ATOM 1624 CG LYS A 100 25.195 -26.479 6.983 1.00 71.11 C ATOM 1625 CD LYS A 100 24.823 -25.768 5.692 1.00 22.53 C ATOM 1626 CE LYS A 100 25.439 -24.380 5.623 1.00 5.44 C ATOM 1627 NZ LYS A 100 25.646 -23.934 4.218 1.00 43.43 N ATOM 0 H LYS A 100 22.957 -26.848 10.332 1.00 1.31 H new ATOM 0 HA LYS A 100 23.032 -28.199 7.708 1.00 22.34 H new ATOM 0 HB2 LYS A 100 23.268 -25.787 7.600 1.00 0.13 H new ATOM 0 HB3 LYS A 100 24.472 -25.789 8.873 1.00 0.13 H new ATOM 0 HG2 LYS A 100 26.119 -26.057 7.378 1.00 71.11 H new ATOM 0 HG3 LYS A 100 25.387 -27.532 6.777 1.00 71.11 H new ATOM 0 HD2 LYS A 100 25.159 -26.359 4.840 1.00 22.53 H new ATOM 0 HD3 LYS A 100 23.738 -25.690 5.618 1.00 22.53 H new ATOM 0 HE2 LYS A 100 24.792 -23.670 6.138 1.00 5.44 H new ATOM 0 HE3 LYS A 100 26.394 -24.380 6.148 1.00 5.44 H new ATOM 0 HZ1 LYS A 100 25.688 -22.895 4.186 1.00 43.43 H new ATOM 0 HZ2 LYS A 100 26.538 -24.328 3.857 1.00 43.43 H new ATOM 0 HZ3 LYS A 100 24.857 -24.267 3.628 1.00 43.43 H new ATOM 1641 N SER A 101 25.486 -28.141 9.940 1.00 61.25 N ATOM 1642 CA SER A 101 26.632 -28.895 10.436 1.00 53.30 C ATOM 1643 C SER A 101 27.379 -28.105 11.506 1.00 42.41 C ATOM 1644 O SER A 101 26.976 -27.000 11.872 1.00 20.45 O ATOM 1645 CB SER A 101 27.579 -29.240 9.286 1.00 42.15 C ATOM 1646 OG SER A 101 27.701 -28.155 8.382 1.00 3.23 O ATOM 0 H SER A 101 25.323 -27.256 10.421 1.00 61.25 H new ATOM 0 HA SER A 101 26.263 -29.819 10.882 1.00 53.30 H new ATOM 0 HB2 SER A 101 28.560 -29.498 9.684 1.00 42.15 H new ATOM 0 HB3 SER A 101 27.209 -30.118 8.757 1.00 42.15 H new ATOM 0 HG SER A 101 28.313 -28.401 7.657 1.00 3.23 H new ATOM 1652 N ILE A 102 28.470 -28.679 12.002 1.00 12.43 N ATOM 1653 CA ILE A 102 29.275 -28.029 13.029 1.00 14.51 C ATOM 1654 C ILE A 102 30.518 -27.384 12.427 1.00 41.35 C ATOM 1655 O ILE A 102 31.501 -28.063 12.135 1.00 65.25 O ATOM 1656 CB ILE A 102 29.705 -29.025 14.122 1.00 40.12 C ATOM 1657 CG1 ILE A 102 28.498 -29.445 14.963 1.00 22.42 C ATOM 1658 CG2 ILE A 102 30.784 -28.412 15.002 1.00 32.12 C ATOM 1659 CD1 ILE A 102 28.192 -30.924 14.883 1.00 33.52 C ATOM 0 H ILE A 102 28.817 -29.593 11.709 1.00 12.43 H new ATOM 0 HA ILE A 102 28.650 -27.257 13.478 1.00 14.51 H new ATOM 0 HB ILE A 102 30.116 -29.913 13.643 1.00 40.12 H new ATOM 0 HG12 ILE A 102 28.679 -29.175 16.004 1.00 22.42 H new ATOM 0 HG13 ILE A 102 27.624 -28.883 14.635 1.00 22.42 H new ATOM 0 HG21 ILE A 102 31.078 -29.128 15.770 1.00 32.12 H new ATOM 0 HG22 ILE A 102 31.651 -28.159 14.392 1.00 32.12 H new ATOM 0 HG23 ILE A 102 30.398 -27.510 15.476 1.00 32.12 H new ATOM 0 HD11 ILE A 102 27.325 -31.150 15.503 1.00 33.52 H new ATOM 0 HD12 ILE A 102 27.979 -31.196 13.849 1.00 33.52 H new ATOM 0 HD13 ILE A 102 29.051 -31.493 15.239 1.00 33.52 H new ATOM 1671 N GLU A 103 30.467 -26.068 12.245 1.00 11.31 N ATOM 1672 CA GLU A 103 31.590 -25.331 11.678 1.00 24.21 C ATOM 1673 C GLU A 103 31.752 -23.976 12.360 1.00 51.51 C ATOM 1674 O GLU A 103 30.860 -23.129 12.300 1.00 44.10 O ATOM 1675 CB GLU A 103 31.394 -25.137 10.173 1.00 24.20 C ATOM 1676 CG GLU A 103 30.422 -26.126 9.553 1.00 34.44 C ATOM 1677 CD GLU A 103 30.348 -26.005 8.044 1.00 43.23 C ATOM 1678 OE1 GLU A 103 29.244 -25.742 7.523 1.00 33.43 O ATOM 1679 OE2 GLU A 103 31.394 -26.172 7.383 1.00 65.10 O ATOM 0 H GLU A 103 29.660 -25.491 12.482 1.00 11.31 H new ATOM 0 HA GLU A 103 32.496 -25.914 11.847 1.00 24.21 H new ATOM 0 HB2 GLU A 103 31.035 -24.124 9.990 1.00 24.20 H new ATOM 0 HB3 GLU A 103 32.359 -25.228 9.675 1.00 24.20 H new ATOM 0 HG2 GLU A 103 30.723 -27.140 9.818 1.00 34.44 H new ATOM 0 HG3 GLU A 103 29.430 -25.967 9.975 1.00 34.44 H new ATOM 1686 N TRP A 104 32.894 -23.778 13.008 1.00 64.54 N ATOM 1687 CA TRP A 104 33.173 -22.526 13.702 1.00 61.32 C ATOM 1688 C TRP A 104 34.385 -21.826 13.096 1.00 33.33 C ATOM 1689 O TRP A 104 35.527 -22.211 13.349 1.00 21.20 O ATOM 1690 CB TRP A 104 33.410 -22.786 15.190 1.00 32.33 C ATOM 1691 CG TRP A 104 32.542 -23.873 15.749 1.00 52.10 C ATOM 1692 CD1 TRP A 104 32.947 -24.947 16.488 1.00 22.23 C ATOM 1693 CD2 TRP A 104 31.122 -23.991 15.611 1.00 34.22 C ATOM 1694 NE1 TRP A 104 31.865 -25.726 16.818 1.00 34.25 N ATOM 1695 CE2 TRP A 104 30.733 -25.161 16.293 1.00 11.10 C ATOM 1696 CE3 TRP A 104 30.140 -23.222 14.980 1.00 23.02 C ATOM 1697 CZ2 TRP A 104 29.406 -25.578 16.359 1.00 41.31 C ATOM 1698 CZ3 TRP A 104 28.824 -23.637 15.046 1.00 31.22 C ATOM 1699 CH2 TRP A 104 28.466 -24.806 15.732 1.00 42.40 C ATOM 0 H TRP A 104 33.642 -24.469 13.067 1.00 64.54 H new ATOM 0 HA TRP A 104 32.306 -21.875 13.588 1.00 61.32 H new ATOM 0 HB2 TRP A 104 34.456 -23.051 15.343 1.00 32.33 H new ATOM 0 HB3 TRP A 104 33.230 -21.866 15.745 1.00 32.33 H new ATOM 0 HD1 TRP A 104 33.968 -25.154 16.772 1.00 22.23 H new ATOM 0 HE1 TRP A 104 31.899 -26.586 17.365 1.00 34.25 H new ATOM 0 HE3 TRP A 104 30.405 -22.319 14.450 1.00 23.02 H new ATOM 0 HZ2 TRP A 104 29.129 -26.479 16.886 1.00 41.31 H new ATOM 0 HZ3 TRP A 104 28.058 -23.051 14.561 1.00 31.22 H new ATOM 0 HH2 TRP A 104 27.428 -25.103 15.766 1.00 42.40 H new ATOM 1710 N LEU A 105 34.129 -20.797 12.297 1.00 42.25 N ATOM 1711 CA LEU A 105 35.200 -20.042 11.655 1.00 62.31 C ATOM 1712 C LEU A 105 35.588 -18.828 12.492 1.00 10.32 C ATOM 1713 O LEU A 105 34.752 -18.245 13.183 1.00 22.33 O ATOM 1714 CB LEU A 105 34.769 -19.596 10.257 1.00 43.42 C ATOM 1715 CG LEU A 105 34.850 -20.657 9.159 1.00 54.44 C ATOM 1716 CD1 LEU A 105 36.267 -21.194 9.039 1.00 60.43 C ATOM 1717 CD2 LEU A 105 33.870 -21.787 9.437 1.00 71.32 C ATOM 0 H LEU A 105 33.190 -20.466 12.078 1.00 42.25 H new ATOM 0 HA LEU A 105 36.070 -20.694 11.570 1.00 62.31 H new ATOM 0 HB2 LEU A 105 33.741 -19.237 10.313 1.00 43.42 H new ATOM 0 HB3 LEU A 105 35.387 -18.748 9.961 1.00 43.42 H new ATOM 0 HG LEU A 105 34.579 -20.193 8.211 1.00 54.44 H new ATOM 0 HD11 LEU A 105 36.305 -21.948 8.253 1.00 60.43 H new ATOM 0 HD12 LEU A 105 36.946 -20.378 8.792 1.00 60.43 H new ATOM 0 HD13 LEU A 105 36.568 -21.642 9.986 1.00 60.43 H new ATOM 0 HD21 LEU A 105 33.941 -22.533 8.646 1.00 71.32 H new ATOM 0 HD22 LEU A 105 34.110 -22.249 10.394 1.00 71.32 H new ATOM 0 HD23 LEU A 105 32.856 -21.389 9.470 1.00 71.32 H new ATOM 1729 N SER A 106 36.860 -18.450 12.424 1.00 45.14 N ATOM 1730 CA SER A 106 37.360 -17.305 13.177 1.00 74.24 C ATOM 1731 C SER A 106 36.768 -16.004 12.643 1.00 63.13 C ATOM 1732 O SER A 106 35.992 -16.009 11.687 1.00 40.31 O ATOM 1733 CB SER A 106 38.887 -17.250 13.109 1.00 60.22 C ATOM 1734 OG SER A 106 39.415 -16.445 14.149 1.00 60.41 O ATOM 0 H SER A 106 37.564 -18.920 11.855 1.00 45.14 H new ATOM 0 HA SER A 106 37.054 -17.423 14.217 1.00 74.24 H new ATOM 0 HB2 SER A 106 39.294 -18.258 13.183 1.00 60.22 H new ATOM 0 HB3 SER A 106 39.197 -16.851 12.143 1.00 60.22 H new ATOM 0 HG SER A 106 40.393 -16.427 14.085 1.00 60.41 H new ATOM 1740 N ILE A 107 37.141 -14.892 13.267 1.00 23.12 N ATOM 1741 CA ILE A 107 36.649 -13.583 12.855 1.00 23.50 C ATOM 1742 C ILE A 107 37.293 -13.142 11.545 1.00 53.01 C ATOM 1743 O ILE A 107 36.749 -12.305 10.826 1.00 71.02 O ATOM 1744 CB ILE A 107 36.919 -12.516 13.932 1.00 41.13 C ATOM 1745 CG1 ILE A 107 36.395 -12.986 15.290 1.00 24.52 C ATOM 1746 CG2 ILE A 107 36.277 -11.194 13.539 1.00 12.34 C ATOM 1747 CD1 ILE A 107 36.624 -11.989 16.404 1.00 24.45 C ATOM 0 H ILE A 107 37.782 -14.871 14.060 1.00 23.12 H new ATOM 0 HA ILE A 107 35.573 -13.680 12.713 1.00 23.50 H new ATOM 0 HB ILE A 107 37.996 -12.366 14.012 1.00 41.13 H new ATOM 0 HG12 ILE A 107 35.327 -13.188 15.208 1.00 24.52 H new ATOM 0 HG13 ILE A 107 36.878 -13.927 15.551 1.00 24.52 H new ATOM 0 HG21 ILE A 107 36.476 -10.449 14.310 1.00 12.34 H new ATOM 0 HG22 ILE A 107 36.694 -10.855 12.591 1.00 12.34 H new ATOM 0 HG23 ILE A 107 35.200 -11.329 13.435 1.00 12.34 H new ATOM 0 HD11 ILE A 107 36.227 -12.389 17.337 1.00 24.45 H new ATOM 0 HD12 ILE A 107 37.693 -11.805 16.513 1.00 24.45 H new ATOM 0 HD13 ILE A 107 36.117 -11.054 16.165 1.00 24.45 H new ATOM 1759 N ASN A 108 38.454 -13.713 11.240 1.00 11.54 N ATOM 1760 CA ASN A 108 39.172 -13.379 10.015 1.00 15.25 C ATOM 1761 C ASN A 108 38.870 -14.392 8.915 1.00 11.32 C ATOM 1762 O ASN A 108 39.563 -14.444 7.900 1.00 23.40 O ATOM 1763 CB ASN A 108 40.678 -13.329 10.280 1.00 72.25 C ATOM 1764 CG ASN A 108 41.005 -12.803 11.663 1.00 1.54 C ATOM 1765 OD1 ASN A 108 41.275 -11.614 11.840 1.00 70.43 O ATOM 1766 ND2 ASN A 108 40.983 -13.687 12.654 1.00 72.24 N ATOM 0 H ASN A 108 38.918 -14.409 11.824 1.00 11.54 H new ATOM 0 HA ASN A 108 38.836 -12.397 9.682 1.00 15.25 H new ATOM 0 HB2 ASN A 108 41.097 -14.329 10.166 1.00 72.25 H new ATOM 0 HB3 ASN A 108 41.155 -12.696 9.532 1.00 72.25 H new ATOM 0 HD21 ASN A 108 41.195 -13.391 13.607 1.00 72.24 H new ATOM 0 HD22 ASN A 108 40.754 -14.662 12.462 1.00 72.24 H new ATOM 1773 N GLU A 109 37.830 -15.193 9.125 1.00 63.30 N ATOM 1774 CA GLU A 109 37.437 -16.205 8.151 1.00 44.44 C ATOM 1775 C GLU A 109 35.998 -15.988 7.692 1.00 42.01 C ATOM 1776 O GLU A 109 35.622 -16.378 6.586 1.00 73.11 O ATOM 1777 CB GLU A 109 37.589 -17.605 8.747 1.00 32.42 C ATOM 1778 CG GLU A 109 39.033 -18.015 8.979 1.00 24.41 C ATOM 1779 CD GLU A 109 39.832 -18.091 7.692 1.00 1.04 C ATOM 1780 OE1 GLU A 109 39.221 -18.312 6.626 1.00 0.41 O ATOM 1781 OE2 GLU A 109 41.069 -17.929 7.752 1.00 21.14 O ATOM 0 H GLU A 109 37.245 -15.161 9.960 1.00 63.30 H new ATOM 0 HA GLU A 109 38.094 -16.114 7.286 1.00 44.44 H new ATOM 0 HB2 GLU A 109 37.052 -17.648 9.694 1.00 32.42 H new ATOM 0 HB3 GLU A 109 37.118 -18.327 8.081 1.00 32.42 H new ATOM 0 HG2 GLU A 109 39.505 -17.301 9.654 1.00 24.41 H new ATOM 0 HG3 GLU A 109 39.056 -18.986 9.474 1.00 24.41 H new ATOM 1788 N LEU A 110 35.198 -15.364 8.549 1.00 31.23 N ATOM 1789 CA LEU A 110 33.799 -15.095 8.234 1.00 63.43 C ATOM 1790 C LEU A 110 33.661 -14.503 6.835 1.00 72.11 C ATOM 1791 O LEU A 110 32.689 -14.773 6.129 1.00 12.11 O ATOM 1792 CB LEU A 110 33.197 -14.141 9.266 1.00 4.41 C ATOM 1793 CG LEU A 110 34.041 -12.915 9.619 1.00 22.33 C ATOM 1794 CD1 LEU A 110 33.780 -11.786 8.635 1.00 3.30 C ATOM 1795 CD2 LEU A 110 33.753 -12.462 11.043 1.00 2.20 C ATOM 0 H LEU A 110 35.494 -15.035 9.468 1.00 31.23 H new ATOM 0 HA LEU A 110 33.257 -16.040 8.264 1.00 63.43 H new ATOM 0 HB2 LEU A 110 32.231 -13.798 8.894 1.00 4.41 H new ATOM 0 HB3 LEU A 110 33.006 -14.701 10.181 1.00 4.41 H new ATOM 0 HG LEU A 110 35.094 -13.190 9.552 1.00 22.33 H new ATOM 0 HD11 LEU A 110 34.389 -10.922 8.902 1.00 3.30 H new ATOM 0 HD12 LEU A 110 34.038 -12.114 7.628 1.00 3.30 H new ATOM 0 HD13 LEU A 110 32.726 -11.511 8.668 1.00 3.30 H new ATOM 0 HD21 LEU A 110 34.362 -11.589 11.277 1.00 2.20 H new ATOM 0 HD22 LEU A 110 32.698 -12.204 11.136 1.00 2.20 H new ATOM 0 HD23 LEU A 110 33.992 -13.268 11.737 1.00 2.20 H new ATOM 1807 N ASP A 111 34.640 -13.697 6.440 1.00 11.10 N ATOM 1808 CA ASP A 111 34.629 -13.069 5.124 1.00 43.21 C ATOM 1809 C ASP A 111 34.443 -14.111 4.026 1.00 73.12 C ATOM 1810 O ASP A 111 33.590 -13.961 3.151 1.00 73.23 O ATOM 1811 CB ASP A 111 35.928 -12.295 4.894 1.00 4.22 C ATOM 1812 CG ASP A 111 35.832 -11.337 3.723 1.00 1.43 C ATOM 1813 OD1 ASP A 111 36.887 -10.843 3.273 1.00 72.23 O ATOM 1814 OD2 ASP A 111 34.702 -11.079 3.258 1.00 72.50 O ATOM 0 H ASP A 111 35.451 -13.463 7.012 1.00 11.10 H new ATOM 0 HA ASP A 111 33.790 -12.375 5.087 1.00 43.21 H new ATOM 0 HB2 ASP A 111 36.180 -11.737 5.796 1.00 4.22 H new ATOM 0 HB3 ASP A 111 36.741 -12.999 4.718 1.00 4.22 H new ATOM 1819 N LYS A 112 35.247 -15.168 4.077 1.00 12.32 N ATOM 1820 CA LYS A 112 35.171 -16.236 3.088 1.00 63.11 C ATOM 1821 C LYS A 112 33.830 -16.959 3.169 1.00 45.33 C ATOM 1822 O LYS A 112 33.440 -17.670 2.242 1.00 41.12 O ATOM 1823 CB LYS A 112 36.313 -17.233 3.296 1.00 65.22 C ATOM 1824 CG LYS A 112 36.224 -18.456 2.399 1.00 2.11 C ATOM 1825 CD LYS A 112 35.533 -19.613 3.101 1.00 53.31 C ATOM 1826 CE LYS A 112 36.336 -20.100 4.297 1.00 3.51 C ATOM 1827 NZ LYS A 112 37.772 -20.302 3.956 1.00 54.32 N ATOM 0 H LYS A 112 35.959 -15.307 4.794 1.00 12.32 H new ATOM 0 HA LYS A 112 35.263 -15.788 2.099 1.00 63.11 H new ATOM 0 HB2 LYS A 112 37.262 -16.728 3.115 1.00 65.22 H new ATOM 0 HB3 LYS A 112 36.317 -17.556 4.337 1.00 65.22 H new ATOM 0 HG2 LYS A 112 35.679 -18.203 1.490 1.00 2.11 H new ATOM 0 HG3 LYS A 112 37.226 -18.759 2.095 1.00 2.11 H new ATOM 0 HD2 LYS A 112 34.542 -19.300 3.430 1.00 53.31 H new ATOM 0 HD3 LYS A 112 35.391 -20.434 2.398 1.00 53.31 H new ATOM 0 HE2 LYS A 112 36.254 -19.377 5.108 1.00 3.51 H new ATOM 0 HE3 LYS A 112 35.914 -21.037 4.661 1.00 3.51 H new ATOM 0 HZ1 LYS A 112 38.234 -20.850 4.709 1.00 54.32 H new ATOM 0 HZ2 LYS A 112 37.846 -20.819 3.057 1.00 54.32 H new ATOM 0 HZ3 LYS A 112 38.240 -19.378 3.864 1.00 54.32 H new ATOM 1841 N LEU A 113 33.129 -16.771 4.281 1.00 32.40 N ATOM 1842 CA LEU A 113 31.830 -17.404 4.482 1.00 20.51 C ATOM 1843 C LEU A 113 30.707 -16.531 3.931 1.00 64.32 C ATOM 1844 O LEU A 113 29.669 -16.362 4.568 1.00 21.44 O ATOM 1845 CB LEU A 113 31.597 -17.675 5.970 1.00 63.14 C ATOM 1846 CG LEU A 113 32.754 -18.335 6.721 1.00 61.44 C ATOM 1847 CD1 LEU A 113 32.242 -19.069 7.951 1.00 44.33 C ATOM 1848 CD2 LEU A 113 33.510 -19.288 5.805 1.00 14.14 C ATOM 0 H LEU A 113 33.438 -16.186 5.057 1.00 32.40 H new ATOM 0 HA LEU A 113 31.828 -18.351 3.942 1.00 20.51 H new ATOM 0 HB2 LEU A 113 31.365 -16.729 6.459 1.00 63.14 H new ATOM 0 HB3 LEU A 113 30.716 -18.310 6.070 1.00 63.14 H new ATOM 0 HG LEU A 113 33.442 -17.555 7.048 1.00 61.44 H new ATOM 0 HD11 LEU A 113 33.079 -19.532 8.473 1.00 44.33 H new ATOM 0 HD12 LEU A 113 31.746 -18.362 8.616 1.00 44.33 H new ATOM 0 HD13 LEU A 113 31.533 -19.839 7.646 1.00 44.33 H new ATOM 0 HD21 LEU A 113 34.330 -19.749 6.356 1.00 14.14 H new ATOM 0 HD22 LEU A 113 32.832 -20.063 5.447 1.00 14.14 H new ATOM 0 HD23 LEU A 113 33.910 -18.735 4.955 1.00 14.14 H new ATOM 1860 N ASN A 114 30.923 -15.980 2.741 1.00 64.33 N ATOM 1861 CA ASN A 114 29.929 -15.126 2.102 1.00 11.33 C ATOM 1862 C ASN A 114 28.528 -15.443 2.617 1.00 61.12 C ATOM 1863 O ASN A 114 27.978 -16.507 2.332 1.00 54.42 O ATOM 1864 CB ASN A 114 29.978 -15.298 0.583 1.00 74.32 C ATOM 1865 CG ASN A 114 29.749 -13.993 -0.155 1.00 24.20 C ATOM 1866 OD1 ASN A 114 28.725 -13.335 0.028 1.00 43.23 O ATOM 1867 ND2 ASN A 114 30.706 -13.613 -0.994 1.00 73.35 N ATOM 0 H ASN A 114 31.778 -16.110 2.200 1.00 64.33 H new ATOM 0 HA ASN A 114 30.162 -14.091 2.350 1.00 11.33 H new ATOM 0 HB2 ASN A 114 30.947 -15.708 0.298 1.00 74.32 H new ATOM 0 HB3 ASN A 114 29.223 -16.022 0.278 1.00 74.32 H new ATOM 0 HD21 ASN A 114 30.609 -12.744 -1.518 1.00 73.35 H new ATOM 0 HD22 ASN A 114 31.538 -14.191 -1.114 1.00 73.35 H new ATOM 1874 N TRP A 115 27.958 -14.514 3.375 1.00 51.32 N ATOM 1875 CA TRP A 115 26.621 -14.694 3.929 1.00 73.03 C ATOM 1876 C TRP A 115 25.587 -13.917 3.120 1.00 23.43 C ATOM 1877 O TRP A 115 25.892 -13.389 2.051 1.00 34.23 O ATOM 1878 CB TRP A 115 26.587 -14.244 5.390 1.00 13.40 C ATOM 1879 CG TRP A 115 27.849 -14.552 6.136 1.00 4.02 C ATOM 1880 CD1 TRP A 115 29.061 -13.941 5.984 1.00 3.01 C ATOM 1881 CD2 TRP A 115 28.024 -15.548 7.150 1.00 65.24 C ATOM 1882 NE1 TRP A 115 29.979 -14.497 6.842 1.00 63.41 N ATOM 1883 CE2 TRP A 115 29.368 -15.485 7.568 1.00 10.24 C ATOM 1884 CE3 TRP A 115 27.177 -16.486 7.745 1.00 11.14 C ATOM 1885 CZ2 TRP A 115 29.881 -16.324 8.554 1.00 75.43 C ATOM 1886 CZ3 TRP A 115 27.687 -17.319 8.723 1.00 43.31 C ATOM 1887 CH2 TRP A 115 29.028 -17.233 9.120 1.00 64.12 C ATOM 0 H TRP A 115 28.400 -13.628 3.620 1.00 51.32 H new ATOM 0 HA TRP A 115 26.373 -15.754 3.877 1.00 73.03 H new ATOM 0 HB2 TRP A 115 26.404 -13.170 5.428 1.00 13.40 H new ATOM 0 HB3 TRP A 115 25.749 -14.728 5.892 1.00 13.40 H new ATOM 0 HD1 TRP A 115 29.268 -13.139 5.291 1.00 3.01 H new ATOM 0 HE1 TRP A 115 30.957 -14.219 6.925 1.00 63.41 H new ATOM 0 HE3 TRP A 115 26.142 -16.559 7.446 1.00 11.14 H new ATOM 0 HZ2 TRP A 115 30.914 -16.260 8.861 1.00 75.43 H new ATOM 0 HZ3 TRP A 115 27.041 -18.048 9.189 1.00 43.31 H new ATOM 0 HH2 TRP A 115 29.396 -17.897 9.888 1.00 64.12 H new ATOM 1898 N ALA A 116 24.365 -13.852 3.638 1.00 50.13 N ATOM 1899 CA ALA A 116 23.288 -13.138 2.964 1.00 14.52 C ATOM 1900 C ALA A 116 23.685 -11.695 2.671 1.00 12.32 C ATOM 1901 O ALA A 116 24.670 -11.177 3.198 1.00 31.42 O ATOM 1902 CB ALA A 116 22.021 -13.178 3.806 1.00 52.31 C ATOM 0 H ALA A 116 24.096 -14.285 4.522 1.00 50.13 H new ATOM 0 HA ALA A 116 23.095 -13.635 2.013 1.00 14.52 H new ATOM 0 HB1 ALA A 116 21.225 -12.641 3.291 1.00 52.31 H new ATOM 0 HB2 ALA A 116 21.719 -14.214 3.960 1.00 52.31 H new ATOM 0 HB3 ALA A 116 22.210 -12.708 4.771 1.00 52.31 H new ATOM 1908 N PRO A 117 22.902 -11.028 1.810 1.00 41.10 N ATOM 1909 CA PRO A 117 23.153 -9.635 1.427 1.00 30.24 C ATOM 1910 C PRO A 117 22.889 -8.663 2.572 1.00 0.01 C ATOM 1911 O PRO A 117 23.440 -7.563 2.604 1.00 24.35 O ATOM 1912 CB PRO A 117 22.163 -9.397 0.285 1.00 74.33 C ATOM 1913 CG PRO A 117 21.064 -10.373 0.527 1.00 74.54 C ATOM 1914 CD PRO A 117 21.711 -11.582 1.144 1.00 44.02 C ATOM 0 HA PRO A 117 24.194 -9.470 1.148 1.00 30.24 H new ATOM 0 HB2 PRO A 117 21.791 -8.372 0.291 1.00 74.33 H new ATOM 0 HB3 PRO A 117 22.631 -9.561 -0.686 1.00 74.33 H new ATOM 0 HG2 PRO A 117 20.309 -9.953 1.191 1.00 74.54 H new ATOM 0 HG3 PRO A 117 20.561 -10.633 -0.404 1.00 74.54 H new ATOM 0 HD2 PRO A 117 21.047 -12.075 1.853 1.00 44.02 H new ATOM 0 HD3 PRO A 117 21.980 -12.323 0.391 1.00 44.02 H new ATOM 1922 N ALA A 118 22.043 -9.076 3.510 1.00 72.11 N ATOM 1923 CA ALA A 118 21.708 -8.242 4.658 1.00 61.33 C ATOM 1924 C ALA A 118 22.656 -8.506 5.823 1.00 50.12 C ATOM 1925 O ALA A 118 22.894 -7.628 6.653 1.00 72.23 O ATOM 1926 CB ALA A 118 20.267 -8.483 5.082 1.00 10.24 C ATOM 0 H ALA A 118 21.577 -9.983 3.498 1.00 72.11 H new ATOM 0 HA ALA A 118 21.819 -7.198 4.363 1.00 61.33 H new ATOM 0 HB1 ALA A 118 20.030 -7.854 5.940 1.00 10.24 H new ATOM 0 HB2 ALA A 118 19.599 -8.237 4.257 1.00 10.24 H new ATOM 0 HB3 ALA A 118 20.138 -9.531 5.354 1.00 10.24 H new ATOM 1932 N ASP A 119 23.194 -9.719 5.879 1.00 74.31 N ATOM 1933 CA ASP A 119 24.116 -10.098 6.943 1.00 62.32 C ATOM 1934 C ASP A 119 25.556 -9.776 6.554 1.00 13.11 C ATOM 1935 O ASP A 119 26.405 -9.545 7.416 1.00 54.23 O ATOM 1936 CB ASP A 119 23.981 -11.589 7.257 1.00 64.12 C ATOM 1937 CG ASP A 119 22.789 -11.888 8.144 1.00 71.31 C ATOM 1938 OD1 ASP A 119 21.732 -12.279 7.605 1.00 25.21 O ATOM 1939 OD2 ASP A 119 22.912 -11.731 9.377 1.00 53.22 O ATOM 0 H ASP A 119 23.008 -10.457 5.200 1.00 74.31 H new ATOM 0 HA ASP A 119 23.861 -9.523 7.833 1.00 62.32 H new ATOM 0 HB2 ASP A 119 23.886 -12.146 6.325 1.00 64.12 H new ATOM 0 HB3 ASP A 119 24.891 -11.938 7.746 1.00 64.12 H new ATOM 1944 N ILE A 120 25.823 -9.763 5.253 1.00 61.24 N ATOM 1945 CA ILE A 120 27.160 -9.469 4.751 1.00 75.34 C ATOM 1946 C ILE A 120 27.749 -8.244 5.441 1.00 53.33 C ATOM 1947 O ILE A 120 28.831 -8.290 6.025 1.00 23.13 O ATOM 1948 CB ILE A 120 27.150 -9.233 3.229 1.00 51.42 C ATOM 1949 CG1 ILE A 120 27.358 -10.553 2.484 1.00 10.11 C ATOM 1950 CG2 ILE A 120 28.223 -8.226 2.843 1.00 52.54 C ATOM 1951 CD1 ILE A 120 26.703 -10.587 1.121 1.00 60.40 C ATOM 0 H ILE A 120 25.132 -9.952 4.527 1.00 61.24 H new ATOM 0 HA ILE A 120 27.779 -10.339 4.971 1.00 75.34 H new ATOM 0 HB ILE A 120 26.179 -8.827 2.945 1.00 51.42 H new ATOM 0 HG12 ILE A 120 28.427 -10.731 2.369 1.00 10.11 H new ATOM 0 HG13 ILE A 120 26.962 -11.369 3.089 1.00 10.11 H new ATOM 0 HG21 ILE A 120 28.204 -8.069 1.764 1.00 52.54 H new ATOM 0 HG22 ILE A 120 28.034 -7.280 3.350 1.00 52.54 H new ATOM 0 HG23 ILE A 120 29.201 -8.606 3.137 1.00 52.54 H new ATOM 0 HD11 ILE A 120 26.892 -11.552 0.651 1.00 60.40 H new ATOM 0 HD12 ILE A 120 25.628 -10.440 1.230 1.00 60.40 H new ATOM 0 HD13 ILE A 120 27.116 -9.793 0.499 1.00 60.40 H new ATOM 1963 N PRO A 121 27.020 -7.120 5.374 1.00 11.31 N ATOM 1964 CA PRO A 121 27.449 -5.860 5.989 1.00 23.21 C ATOM 1965 C PRO A 121 27.406 -5.915 7.512 1.00 0.54 C ATOM 1966 O PRO A 121 28.132 -5.187 8.190 1.00 70.44 O ATOM 1967 CB PRO A 121 26.434 -4.843 5.461 1.00 21.52 C ATOM 1968 CG PRO A 121 25.220 -5.648 5.147 1.00 23.13 C ATOM 1969 CD PRO A 121 25.720 -6.992 4.694 1.00 42.12 C ATOM 0 HA PRO A 121 28.483 -5.617 5.743 1.00 23.21 H new ATOM 0 HB2 PRO A 121 26.219 -4.076 6.205 1.00 21.52 H new ATOM 0 HB3 PRO A 121 26.810 -4.332 4.575 1.00 21.52 H new ATOM 0 HG2 PRO A 121 24.579 -5.745 6.023 1.00 23.13 H new ATOM 0 HG3 PRO A 121 24.625 -5.170 4.368 1.00 23.13 H new ATOM 0 HD2 PRO A 121 25.037 -7.792 4.980 1.00 42.12 H new ATOM 0 HD3 PRO A 121 25.827 -7.036 3.610 1.00 42.12 H new ATOM 1977 N ALA A 122 26.551 -6.781 8.045 1.00 73.21 N ATOM 1978 CA ALA A 122 26.415 -6.932 9.488 1.00 0.24 C ATOM 1979 C ALA A 122 27.573 -7.737 10.068 1.00 44.14 C ATOM 1980 O ALA A 122 27.961 -7.545 11.220 1.00 32.12 O ATOM 1981 CB ALA A 122 25.088 -7.594 9.827 1.00 32.05 C ATOM 0 H ALA A 122 25.941 -7.389 7.498 1.00 73.21 H new ATOM 0 HA ALA A 122 26.438 -5.938 9.935 1.00 0.24 H new ATOM 0 HB1 ALA A 122 25.000 -7.700 10.908 1.00 32.05 H new ATOM 0 HB2 ALA A 122 24.269 -6.978 9.455 1.00 32.05 H new ATOM 0 HB3 ALA A 122 25.043 -8.578 9.361 1.00 32.05 H new ATOM 1987 N VAL A 123 28.122 -8.640 9.261 1.00 45.52 N ATOM 1988 CA VAL A 123 29.237 -9.474 9.693 1.00 1.14 C ATOM 1989 C VAL A 123 30.568 -8.753 9.508 1.00 74.03 C ATOM 1990 O VAL A 123 31.489 -8.913 10.307 1.00 34.13 O ATOM 1991 CB VAL A 123 29.275 -10.805 8.920 1.00 71.31 C ATOM 1992 CG1 VAL A 123 30.576 -11.544 9.192 1.00 62.42 C ATOM 1993 CG2 VAL A 123 28.076 -11.667 9.285 1.00 21.54 C ATOM 0 H VAL A 123 27.812 -8.812 8.305 1.00 45.52 H new ATOM 0 HA VAL A 123 29.084 -9.682 10.752 1.00 1.14 H new ATOM 0 HB VAL A 123 29.226 -10.587 7.853 1.00 71.31 H new ATOM 0 HG11 VAL A 123 30.584 -12.482 8.637 1.00 62.42 H new ATOM 0 HG12 VAL A 123 31.418 -10.928 8.876 1.00 62.42 H new ATOM 0 HG13 VAL A 123 30.660 -11.753 10.259 1.00 62.42 H new ATOM 0 HG21 VAL A 123 28.119 -12.604 8.729 1.00 21.54 H new ATOM 0 HG22 VAL A 123 28.092 -11.878 10.354 1.00 21.54 H new ATOM 0 HG23 VAL A 123 27.157 -11.138 9.033 1.00 21.54 H new ATOM 2003 N ASN A 124 30.660 -7.958 8.447 1.00 45.13 N ATOM 2004 CA ASN A 124 31.879 -7.211 8.155 1.00 21.54 C ATOM 2005 C ASN A 124 32.234 -6.278 9.309 1.00 50.24 C ATOM 2006 O ASN A 124 33.380 -6.232 9.755 1.00 24.44 O ATOM 2007 CB ASN A 124 31.712 -6.406 6.865 1.00 24.12 C ATOM 2008 CG ASN A 124 31.968 -7.241 5.625 1.00 21.13 C ATOM 2009 OD1 ASN A 124 32.931 -8.006 5.566 1.00 42.41 O ATOM 2010 ND2 ASN A 124 31.104 -7.098 4.627 1.00 0.32 N ATOM 0 H ASN A 124 29.906 -7.814 7.775 1.00 45.13 H new ATOM 0 HA ASN A 124 32.692 -7.926 8.026 1.00 21.54 H new ATOM 0 HB2 ASN A 124 30.702 -5.998 6.823 1.00 24.12 H new ATOM 0 HB3 ASN A 124 32.398 -5.559 6.877 1.00 24.12 H new ATOM 0 HD21 ASN A 124 31.224 -7.634 3.768 1.00 0.32 H new ATOM 0 HD22 ASN A 124 30.320 -6.452 4.720 1.00 0.32 H new ATOM 2017 N LYS A 125 31.242 -5.534 9.787 1.00 22.32 N ATOM 2018 CA LYS A 125 31.447 -4.602 10.890 1.00 63.42 C ATOM 2019 C LYS A 125 32.062 -5.310 12.093 1.00 32.12 C ATOM 2020 O LYS A 125 32.816 -4.710 12.859 1.00 3.11 O ATOM 2021 CB LYS A 125 30.120 -3.953 11.289 1.00 23.24 C ATOM 2022 CG LYS A 125 29.197 -4.881 12.061 1.00 43.43 C ATOM 2023 CD LYS A 125 29.343 -4.691 13.561 1.00 1.12 C ATOM 2024 CE LYS A 125 28.596 -3.457 14.042 1.00 15.42 C ATOM 2025 NZ LYS A 125 29.518 -2.318 14.307 1.00 12.15 N ATOM 0 H LYS A 125 30.288 -5.558 9.428 1.00 22.32 H new ATOM 0 HA LYS A 125 32.137 -3.827 10.555 1.00 63.42 H new ATOM 0 HB2 LYS A 125 30.324 -3.071 11.895 1.00 23.24 H new ATOM 0 HB3 LYS A 125 29.608 -3.610 10.390 1.00 23.24 H new ATOM 0 HG2 LYS A 125 28.164 -4.694 11.768 1.00 43.43 H new ATOM 0 HG3 LYS A 125 29.420 -5.916 11.801 1.00 43.43 H new ATOM 0 HD2 LYS A 125 28.964 -5.572 14.079 1.00 1.12 H new ATOM 0 HD3 LYS A 125 30.399 -4.601 13.816 1.00 1.12 H new ATOM 0 HE2 LYS A 125 27.861 -3.162 13.293 1.00 15.42 H new ATOM 0 HE3 LYS A 125 28.045 -3.697 14.951 1.00 15.42 H new ATOM 0 HZ1 LYS A 125 29.141 -1.740 15.085 1.00 12.15 H new ATOM 0 HZ2 LYS A 125 30.455 -2.684 14.571 1.00 12.15 H new ATOM 0 HZ3 LYS A 125 29.603 -1.734 13.451 1.00 12.15 H new ATOM 2039 N ILE A 126 31.735 -6.588 12.252 1.00 22.24 N ATOM 2040 CA ILE A 126 32.258 -7.377 13.361 1.00 33.21 C ATOM 2041 C ILE A 126 33.779 -7.468 13.303 1.00 52.15 C ATOM 2042 O ILE A 126 34.459 -7.319 14.317 1.00 10.12 O ATOM 2043 CB ILE A 126 31.669 -8.801 13.366 1.00 45.55 C ATOM 2044 CG1 ILE A 126 30.143 -8.745 13.279 1.00 31.35 C ATOM 2045 CG2 ILE A 126 32.108 -9.551 14.614 1.00 22.01 C ATOM 2046 CD1 ILE A 126 29.484 -10.105 13.346 1.00 63.43 C ATOM 0 H ILE A 126 31.111 -7.099 11.628 1.00 22.24 H new ATOM 0 HA ILE A 126 31.962 -6.867 14.278 1.00 33.21 H new ATOM 0 HB ILE A 126 32.044 -9.337 12.494 1.00 45.55 H new ATOM 0 HG12 ILE A 126 29.763 -8.126 14.092 1.00 31.35 H new ATOM 0 HG13 ILE A 126 29.858 -8.258 12.347 1.00 31.35 H new ATOM 0 HG21 ILE A 126 31.684 -10.555 14.603 1.00 22.01 H new ATOM 0 HG22 ILE A 126 33.196 -9.617 14.635 1.00 22.01 H new ATOM 0 HG23 ILE A 126 31.759 -9.020 15.499 1.00 22.01 H new ATOM 0 HD11 ILE A 126 28.402 -9.989 13.279 1.00 63.43 H new ATOM 0 HD12 ILE A 126 29.835 -10.721 12.518 1.00 63.43 H new ATOM 0 HD13 ILE A 126 29.739 -10.587 14.290 1.00 63.43 H new ATOM 2058 N MET A 127 34.306 -7.712 12.107 1.00 11.41 N ATOM 2059 CA MET A 127 35.748 -7.819 11.916 1.00 74.05 C ATOM 2060 C MET A 127 36.468 -6.619 12.523 1.00 75.13 C ATOM 2061 O MET A 127 37.586 -6.741 13.025 1.00 55.04 O ATOM 2062 CB MET A 127 36.079 -7.927 10.426 1.00 70.21 C ATOM 2063 CG MET A 127 36.241 -9.359 9.942 1.00 71.02 C ATOM 2064 SD MET A 127 37.949 -9.764 9.530 1.00 71.10 S ATOM 2065 CE MET A 127 38.797 -9.191 11.000 1.00 53.10 C ATOM 0 H MET A 127 33.757 -7.839 11.257 1.00 11.41 H new ATOM 0 HA MET A 127 36.091 -8.720 12.424 1.00 74.05 H new ATOM 0 HB2 MET A 127 35.289 -7.445 9.851 1.00 70.21 H new ATOM 0 HB3 MET A 127 36.999 -7.378 10.226 1.00 70.21 H new ATOM 0 HG2 MET A 127 35.886 -10.042 10.714 1.00 71.02 H new ATOM 0 HG3 MET A 127 35.613 -9.515 9.065 1.00 71.02 H new ATOM 0 HE1 MET A 127 39.742 -9.724 11.106 1.00 53.10 H new ATOM 0 HE2 MET A 127 38.991 -8.122 10.915 1.00 53.10 H new ATOM 0 HE3 MET A 127 38.175 -9.378 11.875 1.00 53.10 H new ATOM 2075 N THR A 128 35.820 -5.459 12.474 1.00 41.13 N ATOM 2076 CA THR A 128 36.399 -4.237 13.017 1.00 1.03 C ATOM 2077 C THR A 128 36.897 -4.451 14.442 1.00 22.00 C ATOM 2078 O THR A 128 37.891 -3.857 14.857 1.00 45.30 O ATOM 2079 CB THR A 128 35.381 -3.081 13.010 1.00 60.13 C ATOM 2080 OG1 THR A 128 34.729 -3.011 11.737 1.00 51.02 O ATOM 2081 CG2 THR A 128 36.065 -1.756 13.309 1.00 51.54 C ATOM 0 H THR A 128 34.894 -5.341 12.064 1.00 41.13 H new ATOM 0 HA THR A 128 37.240 -3.974 12.376 1.00 1.03 H new ATOM 0 HB THR A 128 34.641 -3.273 13.787 1.00 60.13 H new ATOM 0 HG1 THR A 128 33.915 -3.556 11.756 1.00 51.02 H new ATOM 0 HG21 THR A 128 35.326 -0.955 13.299 1.00 51.54 H new ATOM 0 HG22 THR A 128 36.536 -1.803 14.291 1.00 51.54 H new ATOM 0 HG23 THR A 128 36.824 -1.559 12.552 1.00 51.54 H new ATOM 2089 N GLU A 129 36.200 -5.304 15.186 1.00 71.10 N ATOM 2090 CA GLU A 129 36.573 -5.596 16.565 1.00 11.41 C ATOM 2091 C GLU A 129 37.976 -6.191 16.635 1.00 62.11 C ATOM 2092 O GLU A 129 38.762 -5.854 17.519 1.00 2.22 O ATOM 2093 CB GLU A 129 35.566 -6.559 17.196 1.00 20.53 C ATOM 2094 CG GLU A 129 35.758 -6.747 18.692 1.00 64.32 C ATOM 2095 CD GLU A 129 34.831 -5.873 19.514 1.00 61.14 C ATOM 2096 OE1 GLU A 129 34.053 -6.425 20.319 1.00 25.35 O ATOM 2097 OE2 GLU A 129 34.884 -4.636 19.350 1.00 12.14 O ATOM 0 H GLU A 129 35.374 -5.805 14.857 1.00 71.10 H new ATOM 0 HA GLU A 129 36.567 -4.659 17.122 1.00 11.41 H new ATOM 0 HB2 GLU A 129 34.557 -6.189 17.011 1.00 20.53 H new ATOM 0 HB3 GLU A 129 35.645 -7.528 16.703 1.00 20.53 H new ATOM 0 HG2 GLU A 129 35.587 -7.793 18.948 1.00 64.32 H new ATOM 0 HG3 GLU A 129 36.792 -6.520 18.953 1.00 64.32 H new ATOM 2104 N GLY A 130 38.283 -7.080 15.695 1.00 20.31 N ATOM 2105 CA GLY A 130 39.590 -7.710 15.668 1.00 44.53 C ATOM 2106 C GLY A 130 39.930 -8.283 14.306 1.00 14.21 C ATOM 2107 O GLY A 130 40.804 -9.141 14.187 1.00 41.22 O ATOM 0 H GLY A 130 37.650 -7.375 14.952 1.00 20.31 H new ATOM 0 HA2 GLY A 130 40.348 -6.979 15.951 1.00 44.53 H new ATOM 0 HA3 GLY A 130 39.622 -8.506 16.412 1.00 44.53 H new TER 2111 GLY A 130