USER MOD reduce.3.24.130724 H: found=0, std=0, add=799, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 799 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 539 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 119:sc= 0.812 USER MOD Single : A 512 THR OG1 : rot 72:sc= 1.23 USER MOD Single : A 513 HIS : no HD1:sc=-0.00799 X(o=-0.008,f=-0.0074) USER MOD Single : A 515 SER OG : rot 180:sc= 0 USER MOD Single : A 517 SER OG : rot 180:sc= -0.138 USER MOD Single : A 521 MET CE :methyl -115:sc= -0.247 (180deg=-5.38!) USER MOD Single : A 524 LYS NZ :NH3+ -164:sc= 1.21 (180deg=0.194) USER MOD Single : A 528 THR OG1 : rot 118:sc= 1.81 USER MOD Single : A 529 SER OG : rot -150:sc= 0.177 USER MOD Single : A 534 ASN :FLIP amide:sc= -3.74! C(o=-5.3!,f=-3.7!) USER MOD Single : A 540 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 541 THR OG1 : rot 86:sc= 1.31 USER MOD Single : A 545 THR OG1 : rot 180:sc= 0.846 USER MOD Single : A 557 CYS SG : rot 180:sc= 0 USER MOD Single : A 563 GLN :FLIP amide:sc= -0.0327 F(o=-1.2!,f=-0.033) USER MOD Single : A 564 ASN : amide:sc= -0.261 K(o=-0.26,f=-1.3!) USER MOD Single : A 569 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0282) USER MOD Single : A 570 THR OG1 : rot 180:sc= 0 USER MOD Single : A 572 SER OG : rot -95:sc= 1.25 USER MOD Single : A 574 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 585 LYS NZ :NH3+ -167:sc= 1.02 (180deg=0.163) USER MOD Single : A 586 THR OG1 : rot -150:sc= -0.0881 USER MOD Single : A 639 HIS : no HD1:sc= -0.126 X(o=-0.13,f=-0.01) USER MOD Single : A 640 THR OG1 : rot 48:sc= 0.0635 USER MOD Single : A 641 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 502 3.530 -3.501 -0.972 1.00 22.03 N ATOM 19 CA ALA A 502 2.780 -4.658 -0.602 1.00 22.31 C ATOM 20 C ALA A 502 1.294 -4.378 -0.826 1.00 75.12 C ATOM 21 O ALA A 502 0.919 -3.770 -1.823 1.00 64.52 O ATOM 22 CB ALA A 502 3.071 -4.959 0.853 1.00 13.53 C ATOM 0 HA ALA A 502 3.057 -5.522 -1.206 1.00 22.31 H new ATOM 0 HB1 ALA A 502 2.509 -5.841 1.162 1.00 13.53 H new ATOM 0 HB2 ALA A 502 4.137 -5.146 0.980 1.00 13.53 H new ATOM 0 HB3 ALA A 502 2.776 -4.108 1.467 1.00 13.53 H new ATOM 28 N GLY A 503 0.462 -4.819 0.080 1.00 3.45 N ATOM 29 CA GLY A 503 -0.946 -4.623 -0.030 1.00 1.12 C ATOM 30 C GLY A 503 -1.613 -5.064 1.231 1.00 2.45 C ATOM 31 O GLY A 503 -1.030 -4.963 2.296 1.00 12.54 O ATOM 0 H GLY A 503 0.751 -5.326 0.917 1.00 3.45 H new ATOM 0 HA2 GLY A 503 -1.163 -3.572 -0.220 1.00 1.12 H new ATOM 0 HA3 GLY A 503 -1.337 -5.187 -0.877 1.00 1.12 H new ATOM 35 N ILE A 504 -2.777 -5.622 1.112 1.00 23.03 N ATOM 36 CA ILE A 504 -3.542 -6.028 2.256 1.00 64.51 C ATOM 37 C ILE A 504 -3.481 -7.559 2.465 1.00 22.01 C ATOM 38 O ILE A 504 -3.904 -8.318 1.603 1.00 3.33 O ATOM 39 CB ILE A 504 -5.045 -5.557 2.121 1.00 13.44 C ATOM 40 CG1 ILE A 504 -5.214 -4.013 2.224 1.00 73.44 C ATOM 41 CG2 ILE A 504 -5.951 -6.246 3.113 1.00 54.02 C ATOM 42 CD1 ILE A 504 -4.695 -3.211 1.040 1.00 13.31 C ATOM 0 H ILE A 504 -3.228 -5.811 0.217 1.00 23.03 H new ATOM 0 HA ILE A 504 -3.100 -5.550 3.130 1.00 64.51 H new ATOM 0 HB ILE A 504 -5.346 -5.852 1.116 1.00 13.44 H new ATOM 0 HG12 ILE A 504 -6.273 -3.790 2.354 1.00 73.44 H new ATOM 0 HG13 ILE A 504 -4.703 -3.669 3.124 1.00 73.44 H new ATOM 0 HG21 ILE A 504 -6.973 -5.890 2.981 1.00 54.02 H new ATOM 0 HG22 ILE A 504 -5.918 -7.323 2.949 1.00 54.02 H new ATOM 0 HG23 ILE A 504 -5.617 -6.023 4.126 1.00 54.02 H new ATOM 0 HD11 ILE A 504 -4.864 -2.149 1.218 1.00 13.31 H new ATOM 0 HD12 ILE A 504 -3.627 -3.393 0.917 1.00 13.31 H new ATOM 0 HD13 ILE A 504 -5.222 -3.515 0.135 1.00 13.31 H new ATOM 54 N PHE A 505 -2.869 -7.986 3.569 1.00 33.23 N ATOM 55 CA PHE A 505 -2.927 -9.389 4.003 1.00 54.14 C ATOM 56 C PHE A 505 -3.958 -9.507 5.091 1.00 64.14 C ATOM 57 O PHE A 505 -3.892 -8.765 6.072 1.00 23.43 O ATOM 58 CB PHE A 505 -1.595 -9.912 4.594 1.00 22.31 C ATOM 59 CG PHE A 505 -0.544 -10.363 3.626 1.00 14.22 C ATOM 60 CD1 PHE A 505 -0.803 -11.383 2.727 1.00 2.22 C ATOM 61 CD2 PHE A 505 0.723 -9.809 3.654 1.00 62.44 C ATOM 62 CE1 PHE A 505 0.177 -11.834 1.869 1.00 12.04 C ATOM 63 CE2 PHE A 505 1.710 -10.254 2.792 1.00 53.31 C ATOM 64 CZ PHE A 505 1.435 -11.268 1.898 1.00 42.54 C ATOM 0 H PHE A 505 -2.324 -7.381 4.184 1.00 33.23 H new ATOM 0 HA PHE A 505 -3.161 -9.978 3.116 1.00 54.14 H new ATOM 0 HB2 PHE A 505 -1.168 -9.123 5.213 1.00 22.31 H new ATOM 0 HB3 PHE A 505 -1.824 -10.747 5.256 1.00 22.31 H new ATOM 0 HD1 PHE A 505 -1.785 -11.831 2.697 1.00 2.22 H new ATOM 0 HD2 PHE A 505 0.945 -9.020 4.357 1.00 62.44 H new ATOM 0 HE1 PHE A 505 -0.040 -12.631 1.173 1.00 12.04 H new ATOM 0 HE2 PHE A 505 2.693 -9.808 2.819 1.00 53.31 H new ATOM 0 HZ PHE A 505 2.202 -11.618 1.223 1.00 42.54 H new ATOM 74 N THR A 506 -4.898 -10.397 4.937 1.00 53.34 N ATOM 75 CA THR A 506 -5.890 -10.624 5.958 1.00 20.11 C ATOM 76 C THR A 506 -6.682 -11.872 5.606 1.00 1.24 C ATOM 77 O THR A 506 -6.481 -12.445 4.551 1.00 70.50 O ATOM 78 CB THR A 506 -6.838 -9.389 6.149 1.00 75.54 C ATOM 79 OG1 THR A 506 -7.678 -9.581 7.301 1.00 14.34 O ATOM 80 CG2 THR A 506 -7.715 -9.162 4.920 1.00 65.15 C ATOM 0 H THR A 506 -5.001 -10.983 4.108 1.00 53.34 H new ATOM 0 HA THR A 506 -5.381 -10.768 6.911 1.00 20.11 H new ATOM 0 HB THR A 506 -6.208 -8.511 6.292 1.00 75.54 H new ATOM 0 HG1 THR A 506 -7.500 -8.875 7.957 1.00 14.34 H new ATOM 0 HG21 THR A 506 -8.359 -8.299 5.087 1.00 65.15 H new ATOM 0 HG22 THR A 506 -7.083 -8.980 4.051 1.00 65.15 H new ATOM 0 HG23 THR A 506 -8.330 -10.045 4.744 1.00 65.15 H new ATOM 88 N PHE A 507 -7.548 -12.293 6.473 1.00 73.33 N ATOM 89 CA PHE A 507 -8.353 -13.459 6.226 1.00 73.43 C ATOM 90 C PHE A 507 -9.526 -13.109 5.338 1.00 63.43 C ATOM 91 O PHE A 507 -10.031 -11.980 5.397 1.00 40.15 O ATOM 92 CB PHE A 507 -8.847 -14.060 7.529 1.00 73.14 C ATOM 93 CG PHE A 507 -7.790 -14.759 8.307 1.00 12.20 C ATOM 94 CD1 PHE A 507 -7.442 -16.047 7.973 1.00 52.30 C ATOM 95 CD2 PHE A 507 -7.165 -14.152 9.379 1.00 41.32 C ATOM 96 CE1 PHE A 507 -6.493 -16.729 8.681 1.00 54.43 C ATOM 97 CE2 PHE A 507 -6.203 -14.826 10.101 1.00 13.01 C ATOM 98 CZ PHE A 507 -5.868 -16.120 9.750 1.00 41.23 C ATOM 0 H PHE A 507 -7.721 -11.843 7.372 1.00 73.33 H new ATOM 0 HA PHE A 507 -7.733 -14.198 5.719 1.00 73.43 H new ATOM 0 HB2 PHE A 507 -9.274 -13.268 8.144 1.00 73.14 H new ATOM 0 HB3 PHE A 507 -9.651 -14.764 7.312 1.00 73.14 H new ATOM 0 HD1 PHE A 507 -7.927 -16.528 7.136 1.00 52.30 H new ATOM 0 HD2 PHE A 507 -7.432 -13.142 9.654 1.00 41.32 H new ATOM 0 HE1 PHE A 507 -6.233 -17.740 8.405 1.00 54.43 H new ATOM 0 HE2 PHE A 507 -5.714 -14.346 10.936 1.00 13.01 H new ATOM 0 HZ PHE A 507 -5.117 -16.655 10.312 1.00 41.23 H new ATOM 108 N GLU A 508 -9.956 -14.061 4.506 1.00 42.12 N ATOM 109 CA GLU A 508 -11.110 -13.839 3.626 1.00 33.41 C ATOM 110 C GLU A 508 -12.326 -13.621 4.462 1.00 52.55 C ATOM 111 O GLU A 508 -13.145 -12.739 4.211 1.00 74.42 O ATOM 112 CB GLU A 508 -11.389 -15.046 2.761 1.00 34.34 C ATOM 113 CG GLU A 508 -10.245 -15.518 1.934 1.00 4.31 C ATOM 114 CD GLU A 508 -10.696 -16.536 0.945 1.00 75.50 C ATOM 115 OE1 GLU A 508 -11.067 -17.659 1.341 1.00 74.41 O ATOM 116 OE2 GLU A 508 -10.709 -16.226 -0.256 1.00 74.22 O ATOM 0 H GLU A 508 -9.529 -14.984 4.422 1.00 42.12 H new ATOM 0 HA GLU A 508 -10.881 -12.979 2.997 1.00 33.41 H new ATOM 0 HB2 GLU A 508 -11.713 -15.865 3.403 1.00 34.34 H new ATOM 0 HB3 GLU A 508 -12.222 -14.812 2.098 1.00 34.34 H new ATOM 0 HG2 GLU A 508 -9.793 -14.674 1.414 1.00 4.31 H new ATOM 0 HG3 GLU A 508 -9.476 -15.945 2.578 1.00 4.31 H new ATOM 123 N GLU A 509 -12.402 -14.394 5.481 1.00 23.34 N ATOM 124 CA GLU A 509 -13.496 -14.404 6.356 1.00 64.04 C ATOM 125 C GLU A 509 -12.963 -14.133 7.740 1.00 22.35 C ATOM 126 O GLU A 509 -11.910 -14.621 8.095 1.00 11.41 O ATOM 127 CB GLU A 509 -14.223 -15.757 6.241 1.00 30.45 C ATOM 128 CG GLU A 509 -13.323 -16.958 6.495 1.00 61.34 C ATOM 129 CD GLU A 509 -13.864 -18.261 5.943 1.00 21.40 C ATOM 130 OE1 GLU A 509 -14.762 -18.865 6.546 1.00 73.54 O ATOM 131 OE2 GLU A 509 -13.366 -18.726 4.899 1.00 15.31 O ATOM 0 H GLU A 509 -11.671 -15.060 5.731 1.00 23.34 H new ATOM 0 HA GLU A 509 -14.231 -13.637 6.113 1.00 64.04 H new ATOM 0 HB2 GLU A 509 -15.050 -15.777 6.951 1.00 30.45 H new ATOM 0 HB3 GLU A 509 -14.657 -15.843 5.245 1.00 30.45 H new ATOM 0 HG2 GLU A 509 -12.345 -16.766 6.053 1.00 61.34 H new ATOM 0 HG3 GLU A 509 -13.172 -17.065 7.569 1.00 61.34 H new ATOM 138 N PRO A 510 -13.622 -13.279 8.487 1.00 24.21 N ATOM 139 CA PRO A 510 -13.214 -12.939 9.853 1.00 14.13 C ATOM 140 C PRO A 510 -13.555 -14.059 10.835 1.00 0.02 C ATOM 141 O PRO A 510 -12.940 -14.197 11.902 1.00 41.13 O ATOM 142 CB PRO A 510 -14.049 -11.694 10.154 1.00 0.31 C ATOM 143 CG PRO A 510 -15.262 -11.846 9.301 1.00 45.55 C ATOM 144 CD PRO A 510 -14.800 -12.533 8.050 1.00 31.43 C ATOM 0 HA PRO A 510 -12.139 -12.784 9.948 1.00 14.13 H new ATOM 0 HB2 PRO A 510 -14.311 -11.637 11.211 1.00 0.31 H new ATOM 0 HB3 PRO A 510 -13.504 -10.782 9.911 1.00 0.31 H new ATOM 0 HG2 PRO A 510 -16.026 -12.433 9.810 1.00 45.55 H new ATOM 0 HG3 PRO A 510 -15.704 -10.876 9.074 1.00 45.55 H new ATOM 0 HD2 PRO A 510 -15.568 -13.194 7.648 1.00 31.43 H new ATOM 0 HD3 PRO A 510 -14.554 -11.817 7.266 1.00 31.43 H new ATOM 152 N VAL A 511 -14.539 -14.845 10.480 1.00 35.15 N ATOM 153 CA VAL A 511 -14.997 -15.943 11.284 1.00 11.50 C ATOM 154 C VAL A 511 -15.209 -17.111 10.360 1.00 23.33 C ATOM 155 O VAL A 511 -15.802 -16.950 9.292 1.00 3.23 O ATOM 156 CB VAL A 511 -16.352 -15.622 12.001 1.00 33.42 C ATOM 157 CG1 VAL A 511 -16.805 -16.780 12.878 1.00 75.14 C ATOM 158 CG2 VAL A 511 -16.274 -14.332 12.812 1.00 43.20 C ATOM 0 H VAL A 511 -15.053 -14.735 9.606 1.00 35.15 H new ATOM 0 HA VAL A 511 -14.256 -16.151 12.056 1.00 11.50 H new ATOM 0 HB VAL A 511 -17.097 -15.477 11.218 1.00 33.42 H new ATOM 0 HG11 VAL A 511 -17.748 -16.524 13.361 1.00 75.14 H new ATOM 0 HG12 VAL A 511 -16.942 -17.670 12.264 1.00 75.14 H new ATOM 0 HG13 VAL A 511 -16.050 -16.977 13.639 1.00 75.14 H new ATOM 0 HG21 VAL A 511 -17.234 -14.146 13.293 1.00 43.20 H new ATOM 0 HG22 VAL A 511 -15.499 -14.427 13.573 1.00 43.20 H new ATOM 0 HG23 VAL A 511 -16.033 -13.500 12.150 1.00 43.20 H new ATOM 168 N THR A 512 -14.725 -18.245 10.729 1.00 5.14 N ATOM 169 CA THR A 512 -14.905 -19.389 9.938 1.00 30.50 C ATOM 170 C THR A 512 -15.464 -20.497 10.811 1.00 44.13 C ATOM 171 O THR A 512 -15.027 -20.704 11.959 1.00 5.41 O ATOM 172 CB THR A 512 -13.585 -19.824 9.217 1.00 11.02 C ATOM 173 OG1 THR A 512 -13.875 -20.767 8.190 1.00 33.22 O ATOM 174 CG2 THR A 512 -12.569 -20.421 10.173 1.00 33.22 C ATOM 0 H THR A 512 -14.196 -18.395 11.588 1.00 5.14 H new ATOM 0 HA THR A 512 -15.613 -19.163 9.141 1.00 30.50 H new ATOM 0 HB THR A 512 -13.148 -18.922 8.789 1.00 11.02 H new ATOM 0 HG1 THR A 512 -14.316 -20.312 7.443 1.00 33.22 H new ATOM 0 HG21 THR A 512 -11.673 -20.705 9.621 1.00 33.22 H new ATOM 0 HG22 THR A 512 -12.308 -19.685 10.933 1.00 33.22 H new ATOM 0 HG23 THR A 512 -12.995 -21.302 10.653 1.00 33.22 H new ATOM 182 N HIS A 513 -16.459 -21.137 10.329 1.00 11.24 N ATOM 183 CA HIS A 513 -17.031 -22.227 11.030 1.00 25.21 C ATOM 184 C HIS A 513 -16.627 -23.516 10.352 1.00 34.15 C ATOM 185 O HIS A 513 -16.834 -23.693 9.147 1.00 15.40 O ATOM 186 CB HIS A 513 -18.565 -22.053 11.213 1.00 4.40 C ATOM 187 CG HIS A 513 -19.354 -21.714 9.964 1.00 62.13 C ATOM 188 ND1 HIS A 513 -19.964 -20.496 9.760 1.00 12.50 N ATOM 189 CD2 HIS A 513 -19.649 -22.460 8.872 1.00 74.02 C ATOM 190 CE1 HIS A 513 -20.591 -20.534 8.581 1.00 14.10 C ATOM 191 NE2 HIS A 513 -20.429 -21.712 7.998 1.00 63.44 N ATOM 0 H HIS A 513 -16.903 -20.923 9.436 1.00 11.24 H new ATOM 0 HA HIS A 513 -16.642 -22.262 12.048 1.00 25.21 H new ATOM 0 HB2 HIS A 513 -18.967 -22.975 11.632 1.00 4.40 H new ATOM 0 HB3 HIS A 513 -18.735 -21.268 11.949 1.00 4.40 H new ATOM 0 HD2 HIS A 513 -19.328 -23.478 8.706 1.00 74.02 H new ATOM 0 HE1 HIS A 513 -21.154 -19.714 8.160 1.00 14.10 H new ATOM 0 HE2 HIS A 513 -20.800 -22.009 7.095 1.00 63.44 H new ATOM 199 N VAL A 514 -15.990 -24.374 11.091 1.00 20.44 N ATOM 200 CA VAL A 514 -15.498 -25.619 10.560 1.00 62.35 C ATOM 201 C VAL A 514 -16.252 -26.770 11.194 1.00 64.51 C ATOM 202 O VAL A 514 -17.075 -26.555 12.095 1.00 23.14 O ATOM 203 CB VAL A 514 -13.953 -25.790 10.778 1.00 62.50 C ATOM 204 CG1 VAL A 514 -13.179 -24.639 10.140 1.00 43.31 C ATOM 205 CG2 VAL A 514 -13.598 -25.916 12.259 1.00 20.24 C ATOM 0 H VAL A 514 -15.794 -24.234 12.082 1.00 20.44 H new ATOM 0 HA VAL A 514 -15.667 -25.614 9.483 1.00 62.35 H new ATOM 0 HB VAL A 514 -13.661 -26.719 10.287 1.00 62.50 H new ATOM 0 HG11 VAL A 514 -12.111 -24.782 10.306 1.00 43.31 H new ATOM 0 HG12 VAL A 514 -13.380 -24.615 9.069 1.00 43.31 H new ATOM 0 HG13 VAL A 514 -13.493 -23.697 10.589 1.00 43.31 H new ATOM 0 HG21 VAL A 514 -12.520 -26.033 12.366 1.00 20.24 H new ATOM 0 HG22 VAL A 514 -13.920 -25.019 12.788 1.00 20.24 H new ATOM 0 HG23 VAL A 514 -14.101 -26.786 12.681 1.00 20.24 H new ATOM 215 N SER A 515 -15.991 -27.952 10.730 1.00 10.11 N ATOM 216 CA SER A 515 -16.608 -29.131 11.216 1.00 5.23 C ATOM 217 C SER A 515 -15.760 -29.778 12.345 1.00 70.22 C ATOM 218 O SER A 515 -14.595 -29.421 12.536 1.00 3.11 O ATOM 219 CB SER A 515 -16.792 -30.047 10.035 1.00 71.14 C ATOM 220 OG SER A 515 -17.766 -29.539 9.118 1.00 3.14 O ATOM 0 H SER A 515 -15.321 -28.121 9.980 1.00 10.11 H new ATOM 0 HA SER A 515 -17.576 -28.914 11.667 1.00 5.23 H new ATOM 0 HB2 SER A 515 -15.839 -30.174 9.521 1.00 71.14 H new ATOM 0 HB3 SER A 515 -17.100 -31.033 10.384 1.00 71.14 H new ATOM 0 HG SER A 515 -17.859 -30.157 8.363 1.00 3.14 H new ATOM 226 N GLU A 516 -16.358 -30.698 13.070 1.00 42.14 N ATOM 227 CA GLU A 516 -15.772 -31.350 14.235 1.00 5.51 C ATOM 228 C GLU A 516 -14.756 -32.485 13.854 1.00 22.21 C ATOM 229 O GLU A 516 -13.610 -32.496 14.312 1.00 64.45 O ATOM 230 CB GLU A 516 -16.952 -31.863 15.140 1.00 74.43 C ATOM 231 CG GLU A 516 -17.736 -33.112 14.658 1.00 44.53 C ATOM 232 CD GLU A 516 -18.201 -33.040 13.215 1.00 13.24 C ATOM 233 OE1 GLU A 516 -18.657 -32.006 12.790 1.00 62.23 O ATOM 234 OE2 GLU A 516 -18.005 -33.982 12.483 1.00 32.35 O ATOM 0 H GLU A 516 -17.300 -31.029 12.862 1.00 42.14 H new ATOM 0 HA GLU A 516 -15.169 -30.632 14.791 1.00 5.51 H new ATOM 0 HB2 GLU A 516 -16.547 -32.081 16.128 1.00 74.43 H new ATOM 0 HB3 GLU A 516 -17.663 -31.046 15.260 1.00 74.43 H new ATOM 0 HG2 GLU A 516 -17.105 -33.992 14.780 1.00 44.53 H new ATOM 0 HG3 GLU A 516 -18.605 -33.251 15.301 1.00 44.53 H new ATOM 241 N SER A 517 -15.175 -33.381 12.992 1.00 25.11 N ATOM 242 CA SER A 517 -14.405 -34.539 12.587 1.00 54.41 C ATOM 243 C SER A 517 -13.854 -34.347 11.164 1.00 60.15 C ATOM 244 O SER A 517 -13.569 -35.319 10.444 1.00 3.42 O ATOM 245 CB SER A 517 -15.343 -35.746 12.640 1.00 44.44 C ATOM 246 OG SER A 517 -15.864 -35.934 13.946 1.00 23.25 O ATOM 0 H SER A 517 -16.087 -33.325 12.539 1.00 25.11 H new ATOM 0 HA SER A 517 -13.552 -34.686 13.250 1.00 54.41 H new ATOM 0 HB2 SER A 517 -16.163 -35.604 11.936 1.00 44.44 H new ATOM 0 HB3 SER A 517 -14.806 -36.641 12.328 1.00 44.44 H new ATOM 0 HG SER A 517 -16.462 -36.711 13.951 1.00 23.25 H new ATOM 252 N ILE A 518 -13.658 -33.095 10.796 1.00 51.53 N ATOM 253 CA ILE A 518 -13.210 -32.713 9.459 1.00 72.13 C ATOM 254 C ILE A 518 -11.807 -33.248 9.124 1.00 21.43 C ATOM 255 O ILE A 518 -11.510 -33.588 7.964 1.00 63.24 O ATOM 256 CB ILE A 518 -13.247 -31.167 9.287 1.00 54.25 C ATOM 257 CG1 ILE A 518 -12.814 -30.743 7.880 1.00 62.45 C ATOM 258 CG2 ILE A 518 -12.424 -30.451 10.361 1.00 10.42 C ATOM 259 CD1 ILE A 518 -12.868 -29.262 7.645 1.00 74.25 C ATOM 0 H ILE A 518 -13.805 -32.302 11.420 1.00 51.53 H new ATOM 0 HA ILE A 518 -13.906 -33.173 8.757 1.00 72.13 H new ATOM 0 HB ILE A 518 -14.285 -30.861 9.418 1.00 54.25 H new ATOM 0 HG12 ILE A 518 -11.796 -31.092 7.704 1.00 62.45 H new ATOM 0 HG13 ILE A 518 -13.452 -31.240 7.149 1.00 62.45 H new ATOM 0 HG21 ILE A 518 -12.478 -29.374 10.203 1.00 10.42 H new ATOM 0 HG22 ILE A 518 -12.822 -30.693 11.346 1.00 10.42 H new ATOM 0 HG23 ILE A 518 -11.385 -30.775 10.300 1.00 10.42 H new ATOM 0 HD11 ILE A 518 -12.547 -29.043 6.627 1.00 74.25 H new ATOM 0 HD12 ILE A 518 -13.889 -28.908 7.787 1.00 74.25 H new ATOM 0 HD13 ILE A 518 -12.207 -28.757 8.350 1.00 74.25 H new ATOM 271 N GLY A 519 -10.973 -33.341 10.121 1.00 41.13 N ATOM 272 CA GLY A 519 -9.626 -33.748 9.914 1.00 74.31 C ATOM 273 C GLY A 519 -8.722 -32.566 9.984 1.00 5.25 C ATOM 274 O GLY A 519 -8.194 -32.234 11.053 1.00 43.22 O ATOM 0 H GLY A 519 -11.212 -33.137 11.091 1.00 41.13 H new ATOM 0 HA2 GLY A 519 -9.339 -34.481 10.668 1.00 74.31 H new ATOM 0 HA3 GLY A 519 -9.529 -34.234 8.943 1.00 74.31 H new ATOM 278 N ILE A 520 -8.610 -31.884 8.885 1.00 3.15 N ATOM 279 CA ILE A 520 -7.758 -30.740 8.771 1.00 43.11 C ATOM 280 C ILE A 520 -8.577 -29.680 8.082 1.00 10.42 C ATOM 281 O ILE A 520 -9.323 -29.991 7.143 1.00 61.52 O ATOM 282 CB ILE A 520 -6.493 -31.027 7.894 1.00 15.35 C ATOM 283 CG1 ILE A 520 -5.678 -32.241 8.388 1.00 14.21 C ATOM 284 CG2 ILE A 520 -5.594 -29.799 7.840 1.00 15.51 C ATOM 285 CD1 ILE A 520 -5.034 -32.070 9.742 1.00 3.32 C ATOM 0 H ILE A 520 -9.116 -32.110 8.029 1.00 3.15 H new ATOM 0 HA ILE A 520 -7.409 -30.446 9.761 1.00 43.11 H new ATOM 0 HB ILE A 520 -6.860 -31.267 6.896 1.00 15.35 H new ATOM 0 HG12 ILE A 520 -6.335 -33.110 8.422 1.00 14.21 H new ATOM 0 HG13 ILE A 520 -4.899 -32.458 7.657 1.00 14.21 H new ATOM 0 HG21 ILE A 520 -4.719 -30.015 7.227 1.00 15.51 H new ATOM 0 HG22 ILE A 520 -6.144 -28.964 7.406 1.00 15.51 H new ATOM 0 HG23 ILE A 520 -5.274 -29.538 8.849 1.00 15.51 H new ATOM 0 HD11 ILE A 520 -4.485 -32.975 10.001 1.00 3.32 H new ATOM 0 HD12 ILE A 520 -4.347 -31.224 9.714 1.00 3.32 H new ATOM 0 HD13 ILE A 520 -5.805 -31.887 10.491 1.00 3.32 H new ATOM 297 N MET A 521 -8.505 -28.481 8.554 1.00 40.20 N ATOM 298 CA MET A 521 -9.216 -27.406 7.930 1.00 70.23 C ATOM 299 C MET A 521 -8.229 -26.435 7.323 1.00 45.13 C ATOM 300 O MET A 521 -7.150 -26.222 7.887 1.00 41.23 O ATOM 301 CB MET A 521 -10.171 -26.718 8.933 1.00 44.12 C ATOM 302 CG MET A 521 -9.525 -25.896 10.049 1.00 0.32 C ATOM 303 SD MET A 521 -9.119 -24.226 9.507 1.00 23.24 S ATOM 304 CE MET A 521 -8.717 -23.448 11.049 1.00 75.44 C ATOM 0 H MET A 521 -7.959 -28.216 9.374 1.00 40.20 H new ATOM 0 HA MET A 521 -9.840 -27.801 7.128 1.00 70.23 H new ATOM 0 HB2 MET A 521 -10.838 -26.064 8.372 1.00 44.12 H new ATOM 0 HB3 MET A 521 -10.791 -27.487 9.393 1.00 44.12 H new ATOM 0 HG2 MET A 521 -10.202 -25.846 10.901 1.00 0.32 H new ATOM 0 HG3 MET A 521 -8.619 -26.397 10.391 1.00 0.32 H new ATOM 0 HE1 MET A 521 -9.445 -22.665 11.262 1.00 75.44 H new ATOM 0 HE2 MET A 521 -8.737 -24.190 11.847 1.00 75.44 H new ATOM 0 HE3 MET A 521 -7.721 -23.010 10.987 1.00 75.44 H new ATOM 314 N GLU A 522 -8.572 -25.917 6.164 1.00 10.43 N ATOM 315 CA GLU A 522 -7.781 -24.919 5.477 1.00 13.21 C ATOM 316 C GLU A 522 -8.548 -23.604 5.402 1.00 33.54 C ATOM 317 O GLU A 522 -9.734 -23.592 5.057 1.00 33.05 O ATOM 318 CB GLU A 522 -7.417 -25.347 4.039 1.00 74.52 C ATOM 319 CG GLU A 522 -6.194 -26.254 3.862 1.00 30.22 C ATOM 320 CD GLU A 522 -6.334 -27.638 4.423 1.00 35.54 C ATOM 321 OE1 GLU A 522 -7.267 -28.365 4.023 1.00 13.13 O ATOM 322 OE2 GLU A 522 -5.492 -28.037 5.230 1.00 30.42 O ATOM 0 H GLU A 522 -9.421 -26.181 5.665 1.00 10.43 H new ATOM 0 HA GLU A 522 -6.861 -24.801 6.049 1.00 13.21 H new ATOM 0 HB2 GLU A 522 -8.280 -25.857 3.611 1.00 74.52 H new ATOM 0 HB3 GLU A 522 -7.255 -24.445 3.450 1.00 74.52 H new ATOM 0 HG2 GLU A 522 -5.972 -26.332 2.798 1.00 30.22 H new ATOM 0 HG3 GLU A 522 -5.336 -25.774 4.333 1.00 30.22 H new ATOM 329 N VAL A 523 -7.890 -22.518 5.740 1.00 64.23 N ATOM 330 CA VAL A 523 -8.464 -21.166 5.617 1.00 41.22 C ATOM 331 C VAL A 523 -7.536 -20.316 4.755 1.00 2.33 C ATOM 332 O VAL A 523 -6.332 -20.280 5.010 1.00 35.22 O ATOM 333 CB VAL A 523 -8.656 -20.492 7.005 1.00 13.32 C ATOM 334 CG1 VAL A 523 -9.187 -19.069 6.865 1.00 21.23 C ATOM 335 CG2 VAL A 523 -9.593 -21.312 7.861 1.00 43.42 C ATOM 0 H VAL A 523 -6.940 -22.531 6.110 1.00 64.23 H new ATOM 0 HA VAL A 523 -9.448 -21.249 5.155 1.00 41.22 H new ATOM 0 HB VAL A 523 -7.680 -20.442 7.488 1.00 13.32 H new ATOM 0 HG11 VAL A 523 -9.310 -18.627 7.854 1.00 21.23 H new ATOM 0 HG12 VAL A 523 -8.482 -18.473 6.286 1.00 21.23 H new ATOM 0 HG13 VAL A 523 -10.150 -19.089 6.355 1.00 21.23 H new ATOM 0 HG21 VAL A 523 -9.718 -20.828 8.830 1.00 43.42 H new ATOM 0 HG22 VAL A 523 -10.561 -21.391 7.367 1.00 43.42 H new ATOM 0 HG23 VAL A 523 -9.176 -22.309 8.004 1.00 43.42 H new ATOM 345 N LYS A 524 -8.084 -19.661 3.741 1.00 63.45 N ATOM 346 CA LYS A 524 -7.288 -18.893 2.795 1.00 60.31 C ATOM 347 C LYS A 524 -7.043 -17.470 3.282 1.00 62.22 C ATOM 348 O LYS A 524 -7.941 -16.818 3.836 1.00 2.43 O ATOM 349 CB LYS A 524 -7.973 -18.840 1.443 1.00 24.54 C ATOM 350 CG LYS A 524 -8.434 -20.190 0.926 1.00 3.10 C ATOM 351 CD LYS A 524 -8.473 -20.239 -0.579 1.00 64.15 C ATOM 352 CE LYS A 524 -9.377 -19.187 -1.149 1.00 73.45 C ATOM 353 NZ LYS A 524 -10.792 -19.348 -0.741 1.00 24.45 N ATOM 0 H LYS A 524 -9.086 -19.647 3.552 1.00 63.45 H new ATOM 0 HA LYS A 524 -6.327 -19.399 2.705 1.00 60.31 H new ATOM 0 HB2 LYS A 524 -8.835 -18.176 1.511 1.00 24.54 H new ATOM 0 HB3 LYS A 524 -7.288 -18.401 0.718 1.00 24.54 H new ATOM 0 HG2 LYS A 524 -7.765 -20.967 1.296 1.00 3.10 H new ATOM 0 HG3 LYS A 524 -9.426 -20.409 1.321 1.00 3.10 H new ATOM 0 HD2 LYS A 524 -7.466 -20.104 -0.973 1.00 64.15 H new ATOM 0 HD3 LYS A 524 -8.813 -21.223 -0.902 1.00 64.15 H new ATOM 0 HE2 LYS A 524 -9.024 -18.205 -0.834 1.00 73.45 H new ATOM 0 HE3 LYS A 524 -9.314 -19.214 -2.237 1.00 73.45 H new ATOM 0 HZ1 LYS A 524 -11.400 -18.778 -1.363 1.00 24.45 H new ATOM 0 HZ2 LYS A 524 -11.063 -20.349 -0.815 1.00 24.45 H new ATOM 0 HZ3 LYS A 524 -10.908 -19.030 0.242 1.00 24.45 H new ATOM 367 N VAL A 525 -5.838 -16.996 3.081 1.00 71.05 N ATOM 368 CA VAL A 525 -5.470 -15.638 3.452 1.00 74.23 C ATOM 369 C VAL A 525 -5.404 -14.777 2.201 1.00 74.44 C ATOM 370 O VAL A 525 -4.706 -15.123 1.254 1.00 23.25 O ATOM 371 CB VAL A 525 -4.094 -15.597 4.164 1.00 14.10 C ATOM 372 CG1 VAL A 525 -3.766 -14.196 4.662 1.00 60.15 C ATOM 373 CG2 VAL A 525 -4.066 -16.570 5.306 1.00 44.32 C ATOM 0 H VAL A 525 -5.082 -17.533 2.657 1.00 71.05 H new ATOM 0 HA VAL A 525 -6.225 -15.259 4.141 1.00 74.23 H new ATOM 0 HB VAL A 525 -3.336 -15.882 3.435 1.00 14.10 H new ATOM 0 HG11 VAL A 525 -2.794 -14.204 5.156 1.00 60.15 H new ATOM 0 HG12 VAL A 525 -3.738 -13.507 3.818 1.00 60.15 H new ATOM 0 HG13 VAL A 525 -4.530 -13.873 5.369 1.00 60.15 H new ATOM 0 HG21 VAL A 525 -3.093 -16.529 5.795 1.00 44.32 H new ATOM 0 HG22 VAL A 525 -4.844 -16.311 6.024 1.00 44.32 H new ATOM 0 HG23 VAL A 525 -4.240 -17.578 4.930 1.00 44.32 H new ATOM 383 N LEU A 526 -6.123 -13.674 2.216 1.00 53.13 N ATOM 384 CA LEU A 526 -6.181 -12.746 1.106 1.00 25.41 C ATOM 385 C LEU A 526 -4.811 -12.187 0.823 1.00 75.42 C ATOM 386 O LEU A 526 -4.156 -11.619 1.716 1.00 44.12 O ATOM 387 CB LEU A 526 -7.148 -11.591 1.408 1.00 32.43 C ATOM 388 CG LEU A 526 -8.627 -11.954 1.551 1.00 51.40 C ATOM 389 CD1 LEU A 526 -9.419 -10.748 2.011 1.00 24.41 C ATOM 390 CD2 LEU A 526 -9.178 -12.444 0.227 1.00 73.54 C ATOM 0 H LEU A 526 -6.693 -13.392 3.013 1.00 53.13 H new ATOM 0 HA LEU A 526 -6.542 -13.289 0.232 1.00 25.41 H new ATOM 0 HB2 LEU A 526 -6.825 -11.109 2.331 1.00 32.43 H new ATOM 0 HB3 LEU A 526 -7.054 -10.852 0.613 1.00 32.43 H new ATOM 0 HG LEU A 526 -8.717 -12.748 2.292 1.00 51.40 H new ATOM 0 HD11 LEU A 526 -10.470 -11.019 2.109 1.00 24.41 H new ATOM 0 HD12 LEU A 526 -9.040 -10.410 2.975 1.00 24.41 H new ATOM 0 HD13 LEU A 526 -9.318 -9.946 1.280 1.00 24.41 H new ATOM 0 HD21 LEU A 526 -10.231 -12.699 0.343 1.00 73.54 H new ATOM 0 HD22 LEU A 526 -9.075 -11.659 -0.523 1.00 73.54 H new ATOM 0 HD23 LEU A 526 -8.624 -13.327 -0.093 1.00 73.54 H new ATOM 402 N ARG A 527 -4.361 -12.401 -0.387 1.00 71.11 N ATOM 403 CA ARG A 527 -3.108 -11.912 -0.834 1.00 61.13 C ATOM 404 C ARG A 527 -3.131 -10.394 -0.962 1.00 10.51 C ATOM 405 O ARG A 527 -4.178 -9.792 -1.259 1.00 52.12 O ATOM 406 CB ARG A 527 -2.726 -12.550 -2.185 1.00 34.13 C ATOM 407 CG ARG A 527 -1.378 -12.087 -2.701 1.00 14.41 C ATOM 408 CD ARG A 527 -0.291 -12.492 -1.735 1.00 11.32 C ATOM 409 NE ARG A 527 0.945 -11.747 -1.920 1.00 21.54 N ATOM 410 CZ ARG A 527 2.009 -12.259 -2.479 1.00 54.13 C ATOM 411 NH1 ARG A 527 1.892 -13.378 -3.153 1.00 21.13 N ATOM 412 NH2 ARG A 527 3.190 -11.632 -2.403 1.00 14.34 N ATOM 0 H ARG A 527 -4.874 -12.931 -1.092 1.00 71.11 H new ATOM 0 HA ARG A 527 -2.358 -12.186 -0.092 1.00 61.13 H new ATOM 0 HB2 ARG A 527 -2.714 -13.635 -2.077 1.00 34.13 H new ATOM 0 HB3 ARG A 527 -3.492 -12.311 -2.922 1.00 34.13 H new ATOM 0 HG2 ARG A 527 -1.185 -12.522 -3.682 1.00 14.41 H new ATOM 0 HG3 ARG A 527 -1.380 -11.004 -2.827 1.00 14.41 H new ATOM 0 HD2 ARG A 527 -0.647 -12.346 -0.715 1.00 11.32 H new ATOM 0 HD3 ARG A 527 -0.087 -13.556 -1.852 1.00 11.32 H new ATOM 0 HE ARG A 527 0.983 -10.780 -1.598 1.00 21.54 H new ATOM 0 HH11 ARG A 527 0.982 -13.832 -3.233 1.00 21.13 H new ATOM 0 HH12 ARG A 527 2.711 -13.794 -3.597 1.00 21.13 H new ATOM 0 HH21 ARG A 527 3.265 -10.745 -1.905 1.00 14.34 H new ATOM 0 HH22 ARG A 527 4.014 -12.041 -2.843 1.00 14.34 H new ATOM 426 N THR A 528 -1.976 -9.802 -0.724 1.00 34.52 N ATOM 427 CA THR A 528 -1.757 -8.418 -0.867 1.00 21.01 C ATOM 428 C THR A 528 -2.080 -7.937 -2.263 1.00 22.15 C ATOM 429 O THR A 528 -1.780 -8.610 -3.263 1.00 74.12 O ATOM 430 CB THR A 528 -0.294 -8.087 -0.553 1.00 42.33 C ATOM 431 OG1 THR A 528 0.587 -9.035 -1.190 1.00 21.23 O ATOM 432 CG2 THR A 528 -0.043 -8.071 0.920 1.00 43.25 C ATOM 0 H THR A 528 -1.148 -10.312 -0.415 1.00 34.52 H new ATOM 0 HA THR A 528 -2.421 -7.910 -0.167 1.00 21.01 H new ATOM 0 HB THR A 528 -0.091 -7.090 -0.945 1.00 42.33 H new ATOM 0 HG1 THR A 528 1.158 -8.568 -1.835 1.00 21.23 H new ATOM 0 HG21 THR A 528 1.004 -7.833 1.108 1.00 43.25 H new ATOM 0 HG22 THR A 528 -0.676 -7.318 1.389 1.00 43.25 H new ATOM 0 HG23 THR A 528 -0.273 -9.051 1.339 1.00 43.25 H new ATOM 440 N SER A 529 -2.698 -6.797 -2.307 1.00 1.25 N ATOM 441 CA SER A 529 -3.041 -6.075 -3.497 1.00 70.24 C ATOM 442 C SER A 529 -1.774 -5.803 -4.362 1.00 61.11 C ATOM 443 O SER A 529 -1.849 -5.624 -5.587 1.00 33.43 O ATOM 444 CB SER A 529 -3.683 -4.804 -2.981 1.00 73.11 C ATOM 445 OG SER A 529 -4.487 -5.143 -1.851 1.00 40.13 O ATOM 0 H SER A 529 -2.996 -6.314 -1.459 1.00 1.25 H new ATOM 0 HA SER A 529 -3.715 -6.622 -4.157 1.00 70.24 H new ATOM 0 HB2 SER A 529 -2.920 -4.078 -2.701 1.00 73.11 H new ATOM 0 HB3 SER A 529 -4.293 -4.343 -3.758 1.00 73.11 H new ATOM 0 HG SER A 529 -5.242 -4.522 -1.789 1.00 40.13 H new ATOM 451 N GLY A 530 -0.636 -5.791 -3.711 1.00 10.10 N ATOM 452 CA GLY A 530 0.615 -5.706 -4.376 1.00 43.34 C ATOM 453 C GLY A 530 1.458 -6.892 -3.981 1.00 51.32 C ATOM 454 O GLY A 530 1.764 -7.077 -2.793 1.00 30.53 O ATOM 0 H GLY A 530 -0.566 -5.841 -2.695 1.00 10.10 H new ATOM 0 HA2 GLY A 530 0.468 -5.691 -5.456 1.00 43.34 H new ATOM 0 HA3 GLY A 530 1.121 -4.778 -4.110 1.00 43.34 H new ATOM 458 N ALA A 531 1.744 -7.742 -4.910 1.00 1.31 N ATOM 459 CA ALA A 531 2.589 -8.881 -4.658 1.00 13.25 C ATOM 460 C ALA A 531 3.932 -8.640 -5.288 1.00 44.24 C ATOM 461 O ALA A 531 4.095 -8.751 -6.506 1.00 15.51 O ATOM 462 CB ALA A 531 1.965 -10.169 -5.186 1.00 34.31 C ATOM 0 H ALA A 531 1.403 -7.674 -5.869 1.00 1.31 H new ATOM 0 HA ALA A 531 2.706 -9.003 -3.581 1.00 13.25 H new ATOM 0 HB1 ALA A 531 2.630 -11.007 -4.978 1.00 34.31 H new ATOM 0 HB2 ALA A 531 1.006 -10.336 -4.696 1.00 34.31 H new ATOM 0 HB3 ALA A 531 1.812 -10.085 -6.262 1.00 34.31 H new ATOM 468 N ARG A 532 4.884 -8.263 -4.478 1.00 23.41 N ATOM 469 CA ARG A 532 6.206 -7.967 -4.956 1.00 35.42 C ATOM 470 C ARG A 532 7.226 -8.713 -4.130 1.00 12.45 C ATOM 471 O ARG A 532 7.315 -8.503 -2.913 1.00 22.35 O ATOM 472 CB ARG A 532 6.488 -6.456 -4.873 1.00 34.12 C ATOM 473 CG ARG A 532 5.535 -5.572 -5.667 1.00 55.24 C ATOM 474 CD ARG A 532 5.532 -5.927 -7.147 1.00 12.04 C ATOM 475 NE ARG A 532 4.667 -5.035 -7.918 1.00 54.43 N ATOM 476 CZ ARG A 532 3.927 -5.399 -8.976 1.00 62.04 C ATOM 477 NH1 ARG A 532 3.862 -6.680 -9.356 1.00 55.12 N ATOM 478 NH2 ARG A 532 3.230 -4.492 -9.628 1.00 11.24 N ATOM 0 H ARG A 532 4.765 -8.153 -3.471 1.00 23.41 H new ATOM 0 HA ARG A 532 6.274 -8.281 -5.998 1.00 35.42 H new ATOM 0 HB2 ARG A 532 6.452 -6.153 -3.827 1.00 34.12 H new ATOM 0 HB3 ARG A 532 7.504 -6.273 -5.223 1.00 34.12 H new ATOM 0 HG2 ARG A 532 4.526 -5.675 -5.267 1.00 55.24 H new ATOM 0 HG3 ARG A 532 5.822 -4.528 -5.545 1.00 55.24 H new ATOM 0 HD2 ARG A 532 6.549 -5.873 -7.536 1.00 12.04 H new ATOM 0 HD3 ARG A 532 5.197 -6.957 -7.273 1.00 12.04 H new ATOM 0 HE ARG A 532 4.623 -4.058 -7.628 1.00 54.43 H new ATOM 0 HH11 ARG A 532 4.378 -7.392 -8.840 1.00 55.12 H new ATOM 0 HH12 ARG A 532 3.296 -6.945 -10.162 1.00 55.12 H new ATOM 0 HH21 ARG A 532 3.254 -3.517 -9.328 1.00 11.24 H new ATOM 0 HH22 ARG A 532 2.666 -4.764 -10.433 1.00 11.24 H new ATOM 492 N GLY A 533 7.943 -9.613 -4.768 1.00 30.43 N ATOM 493 CA GLY A 533 9.012 -10.325 -4.097 1.00 61.33 C ATOM 494 C GLY A 533 8.498 -11.434 -3.216 1.00 53.21 C ATOM 495 O GLY A 533 7.333 -11.838 -3.334 1.00 23.32 O ATOM 0 H GLY A 533 7.807 -9.869 -5.746 1.00 30.43 H new ATOM 0 HA2 GLY A 533 9.691 -10.741 -4.841 1.00 61.33 H new ATOM 0 HA3 GLY A 533 9.590 -9.624 -3.495 1.00 61.33 H new ATOM 499 N ASN A 534 9.339 -11.924 -2.343 1.00 73.34 N ATOM 500 CA ASN A 534 8.972 -12.991 -1.446 1.00 70.32 C ATOM 501 C ASN A 534 8.720 -12.437 -0.066 1.00 63.53 C ATOM 502 O ASN A 534 9.564 -11.746 0.510 1.00 24.30 O ATOM 503 CB ASN A 534 10.051 -14.093 -1.412 1.00 63.13 C ATOM 504 CG ASN A 534 9.730 -15.262 -0.466 1.00 55.10 C ATOM 505 OD1 ASN A 534 8.469 -15.574 -0.280 1.00 61.40 O flip ATOM 506 ND2 ASN A 534 10.619 -15.892 0.072 1.00 53.13 N flip ATOM 0 H ASN A 534 10.298 -11.595 -2.233 1.00 73.34 H new ATOM 0 HA ASN A 534 8.054 -13.450 -1.813 1.00 70.32 H new ATOM 0 HB2 ASN A 534 10.187 -14.484 -2.420 1.00 63.13 H new ATOM 0 HB3 ASN A 534 11.000 -13.648 -1.112 1.00 63.13 H new ATOM 0 HD21 ASN A 534 11.593 -15.634 -0.085 1.00 53.13 H new ATOM 0 HD22 ASN A 534 10.391 -16.678 0.680 1.00 53.13 H new ATOM 513 N VAL A 535 7.542 -12.686 0.433 1.00 2.41 N ATOM 514 CA VAL A 535 7.151 -12.266 1.740 1.00 32.40 C ATOM 515 C VAL A 535 6.647 -13.485 2.496 1.00 33.30 C ATOM 516 O VAL A 535 5.939 -14.327 1.924 1.00 63.42 O ATOM 517 CB VAL A 535 6.014 -11.207 1.664 1.00 53.44 C ATOM 518 CG1 VAL A 535 5.637 -10.701 3.042 1.00 72.24 C ATOM 519 CG2 VAL A 535 6.408 -10.052 0.760 1.00 23.44 C ATOM 0 H VAL A 535 6.816 -13.196 -0.070 1.00 2.41 H new ATOM 0 HA VAL A 535 8.005 -11.816 2.246 1.00 32.40 H new ATOM 0 HB VAL A 535 5.139 -11.695 1.236 1.00 53.44 H new ATOM 0 HG11 VAL A 535 4.840 -9.963 2.953 1.00 72.24 H new ATOM 0 HG12 VAL A 535 5.293 -11.535 3.654 1.00 72.24 H new ATOM 0 HG13 VAL A 535 6.507 -10.241 3.511 1.00 72.24 H new ATOM 0 HG21 VAL A 535 5.596 -9.325 0.724 1.00 23.44 H new ATOM 0 HG22 VAL A 535 7.306 -9.574 1.151 1.00 23.44 H new ATOM 0 HG23 VAL A 535 6.605 -10.427 -0.244 1.00 23.44 H new ATOM 529 N ILE A 536 7.032 -13.609 3.726 1.00 42.21 N ATOM 530 CA ILE A 536 6.568 -14.692 4.546 1.00 12.53 C ATOM 531 C ILE A 536 5.595 -14.157 5.573 1.00 71.13 C ATOM 532 O ILE A 536 5.834 -13.103 6.181 1.00 10.43 O ATOM 533 CB ILE A 536 7.731 -15.431 5.267 1.00 34.03 C ATOM 534 CG1 ILE A 536 8.676 -16.116 4.267 1.00 41.05 C ATOM 535 CG2 ILE A 536 7.196 -16.435 6.271 1.00 2.54 C ATOM 536 CD1 ILE A 536 8.010 -17.121 3.367 1.00 31.41 C ATOM 0 H ILE A 536 7.674 -12.968 4.193 1.00 42.21 H new ATOM 0 HA ILE A 536 6.079 -15.415 3.893 1.00 12.53 H new ATOM 0 HB ILE A 536 8.308 -14.679 5.805 1.00 34.03 H new ATOM 0 HG12 ILE A 536 9.148 -15.351 3.650 1.00 41.05 H new ATOM 0 HG13 ILE A 536 9.472 -16.614 4.821 1.00 41.05 H new ATOM 0 HG21 ILE A 536 8.029 -16.938 6.762 1.00 2.54 H new ATOM 0 HG22 ILE A 536 6.594 -15.917 7.018 1.00 2.54 H new ATOM 0 HG23 ILE A 536 6.580 -17.172 5.756 1.00 2.54 H new ATOM 0 HD11 ILE A 536 8.751 -17.554 2.695 1.00 31.41 H new ATOM 0 HD12 ILE A 536 7.562 -17.910 3.971 1.00 31.41 H new ATOM 0 HD13 ILE A 536 7.234 -16.628 2.782 1.00 31.41 H new ATOM 548 N VAL A 537 4.505 -14.846 5.749 1.00 41.53 N ATOM 549 CA VAL A 537 3.531 -14.461 6.724 1.00 2.12 C ATOM 550 C VAL A 537 3.352 -15.592 7.728 1.00 50.31 C ATOM 551 O VAL A 537 2.862 -16.670 7.379 1.00 13.41 O ATOM 552 CB VAL A 537 2.168 -14.101 6.086 1.00 1.31 C ATOM 553 CG1 VAL A 537 1.191 -13.587 7.139 1.00 62.24 C ATOM 554 CG2 VAL A 537 2.356 -13.068 4.997 1.00 70.05 C ATOM 0 H VAL A 537 4.268 -15.687 5.222 1.00 41.53 H new ATOM 0 HA VAL A 537 3.897 -13.564 7.224 1.00 2.12 H new ATOM 0 HB VAL A 537 1.749 -15.006 5.646 1.00 1.31 H new ATOM 0 HG11 VAL A 537 0.241 -13.341 6.665 1.00 62.24 H new ATOM 0 HG12 VAL A 537 1.031 -14.357 7.894 1.00 62.24 H new ATOM 0 HG13 VAL A 537 1.602 -12.695 7.612 1.00 62.24 H new ATOM 0 HG21 VAL A 537 1.389 -12.824 4.556 1.00 70.05 H new ATOM 0 HG22 VAL A 537 2.799 -12.167 5.422 1.00 70.05 H new ATOM 0 HG23 VAL A 537 3.015 -13.468 4.226 1.00 70.05 H new ATOM 564 N PRO A 538 3.812 -15.398 8.959 1.00 4.40 N ATOM 565 CA PRO A 538 3.647 -16.388 10.011 1.00 11.42 C ATOM 566 C PRO A 538 2.219 -16.397 10.550 1.00 5.01 C ATOM 567 O PRO A 538 1.479 -15.437 10.377 1.00 34.13 O ATOM 568 CB PRO A 538 4.611 -15.918 11.102 1.00 13.40 C ATOM 569 CG PRO A 538 4.756 -14.450 10.891 1.00 11.34 C ATOM 570 CD PRO A 538 4.539 -14.199 9.425 1.00 34.21 C ATOM 0 HA PRO A 538 3.845 -17.400 9.658 1.00 11.42 H new ATOM 0 HB2 PRO A 538 4.218 -16.136 12.095 1.00 13.40 H new ATOM 0 HB3 PRO A 538 5.573 -16.424 11.022 1.00 13.40 H new ATOM 0 HG2 PRO A 538 4.030 -13.900 11.489 1.00 11.34 H new ATOM 0 HG3 PRO A 538 5.745 -14.111 11.199 1.00 11.34 H new ATOM 0 HD2 PRO A 538 3.960 -13.291 9.257 1.00 34.21 H new ATOM 0 HD3 PRO A 538 5.485 -14.076 8.897 1.00 34.21 H new ATOM 578 N TYR A 539 1.832 -17.471 11.168 1.00 50.34 N ATOM 579 CA TYR A 539 0.537 -17.547 11.795 1.00 25.11 C ATOM 580 C TYR A 539 0.645 -18.355 13.058 1.00 4.14 C ATOM 581 O TYR A 539 1.631 -19.090 13.240 1.00 34.52 O ATOM 582 CB TYR A 539 -0.545 -18.140 10.856 1.00 11.34 C ATOM 583 CG TYR A 539 -0.397 -19.614 10.494 1.00 64.30 C ATOM 584 CD1 TYR A 539 -0.845 -20.610 11.359 1.00 73.13 C ATOM 585 CD2 TYR A 539 0.145 -20.005 9.283 1.00 2.21 C ATOM 586 CE1 TYR A 539 -0.746 -21.939 11.033 1.00 11.14 C ATOM 587 CE2 TYR A 539 0.238 -21.342 8.941 1.00 12.40 C ATOM 588 CZ TYR A 539 -0.211 -22.306 9.829 1.00 52.42 C ATOM 589 OH TYR A 539 -0.138 -23.641 9.510 1.00 63.12 O ATOM 0 H TYR A 539 2.396 -18.316 11.255 1.00 50.34 H new ATOM 0 HA TYR A 539 0.218 -16.532 12.030 1.00 25.11 H new ATOM 0 HB2 TYR A 539 -1.519 -18.000 11.326 1.00 11.34 H new ATOM 0 HB3 TYR A 539 -0.550 -17.561 9.933 1.00 11.34 H new ATOM 0 HD1 TYR A 539 -1.280 -20.330 12.307 1.00 73.13 H new ATOM 0 HD2 TYR A 539 0.501 -19.254 8.593 1.00 2.21 H new ATOM 0 HE1 TYR A 539 -1.090 -22.693 11.725 1.00 11.14 H new ATOM 0 HE2 TYR A 539 0.657 -21.632 7.989 1.00 12.40 H new ATOM 0 HH TYR A 539 0.264 -23.744 8.622 1.00 63.12 H new ATOM 599 N LYS A 540 -0.340 -18.230 13.912 1.00 35.03 N ATOM 600 CA LYS A 540 -0.383 -18.973 15.155 1.00 64.41 C ATOM 601 C LYS A 540 -1.827 -19.153 15.596 1.00 34.23 C ATOM 602 O LYS A 540 -2.716 -18.379 15.187 1.00 15.25 O ATOM 603 CB LYS A 540 0.395 -18.236 16.253 1.00 1.14 C ATOM 604 CG LYS A 540 -0.194 -16.880 16.609 1.00 73.33 C ATOM 605 CD LYS A 540 0.520 -16.251 17.774 1.00 22.41 C ATOM 606 CE LYS A 540 -0.183 -14.988 18.219 1.00 14.05 C ATOM 607 NZ LYS A 540 0.438 -14.414 19.425 1.00 13.30 N ATOM 0 H LYS A 540 -1.137 -17.610 13.768 1.00 35.03 H new ATOM 0 HA LYS A 540 0.077 -19.947 14.990 1.00 64.41 H new ATOM 0 HB2 LYS A 540 0.422 -18.858 17.148 1.00 1.14 H new ATOM 0 HB3 LYS A 540 1.427 -18.101 15.928 1.00 1.14 H new ATOM 0 HG2 LYS A 540 -0.133 -16.219 15.745 1.00 73.33 H new ATOM 0 HG3 LYS A 540 -1.251 -16.994 16.849 1.00 73.33 H new ATOM 0 HD2 LYS A 540 0.566 -16.958 18.602 1.00 22.41 H new ATOM 0 HD3 LYS A 540 1.548 -16.021 17.494 1.00 22.41 H new ATOM 0 HE2 LYS A 540 -0.158 -14.255 17.413 1.00 14.05 H new ATOM 0 HE3 LYS A 540 -1.232 -15.207 18.419 1.00 14.05 H new ATOM 0 HZ1 LYS A 540 -0.071 -13.550 19.700 1.00 13.30 H new ATOM 0 HZ2 LYS A 540 0.392 -15.104 20.201 1.00 13.30 H new ATOM 0 HZ3 LYS A 540 1.432 -14.182 19.227 1.00 13.30 H new ATOM 621 N THR A 541 -2.061 -20.147 16.398 1.00 52.14 N ATOM 622 CA THR A 541 -3.356 -20.397 16.943 1.00 12.14 C ATOM 623 C THR A 541 -3.528 -19.736 18.316 1.00 72.24 C ATOM 624 O THR A 541 -2.599 -19.693 19.139 1.00 5.25 O ATOM 625 CB THR A 541 -3.630 -21.909 17.029 1.00 13.13 C ATOM 626 OG1 THR A 541 -2.443 -22.602 17.423 1.00 12.31 O ATOM 627 CG2 THR A 541 -4.101 -22.461 15.705 1.00 10.22 C ATOM 0 H THR A 541 -1.348 -20.814 16.694 1.00 52.14 H new ATOM 0 HA THR A 541 -4.087 -19.951 16.269 1.00 12.14 H new ATOM 0 HB THR A 541 -4.415 -22.058 17.770 1.00 13.13 H new ATOM 0 HG1 THR A 541 -2.382 -22.616 18.401 1.00 12.31 H new ATOM 0 HG21 THR A 541 -4.285 -23.531 15.802 1.00 10.22 H new ATOM 0 HG22 THR A 541 -5.022 -21.960 15.409 1.00 10.22 H new ATOM 0 HG23 THR A 541 -3.336 -22.291 14.947 1.00 10.22 H new ATOM 635 N ILE A 542 -4.683 -19.181 18.527 1.00 4.25 N ATOM 636 CA ILE A 542 -5.047 -18.559 19.769 1.00 3.04 C ATOM 637 C ILE A 542 -6.081 -19.436 20.432 1.00 42.15 C ATOM 638 O ILE A 542 -7.129 -19.722 19.838 1.00 71.33 O ATOM 639 CB ILE A 542 -5.674 -17.179 19.507 1.00 44.40 C ATOM 640 CG1 ILE A 542 -4.685 -16.260 18.794 1.00 4.12 C ATOM 641 CG2 ILE A 542 -6.176 -16.537 20.808 1.00 44.24 C ATOM 642 CD1 ILE A 542 -5.292 -14.972 18.312 1.00 42.43 C ATOM 0 H ILE A 542 -5.420 -19.146 17.822 1.00 4.25 H new ATOM 0 HA ILE A 542 -4.164 -18.436 20.396 1.00 3.04 H new ATOM 0 HB ILE A 542 -6.536 -17.324 18.855 1.00 44.40 H new ATOM 0 HG12 ILE A 542 -3.862 -16.032 19.472 1.00 4.12 H new ATOM 0 HG13 ILE A 542 -4.259 -16.791 17.943 1.00 4.12 H new ATOM 0 HG21 ILE A 542 -6.613 -15.563 20.588 1.00 44.24 H new ATOM 0 HG22 ILE A 542 -6.930 -17.179 21.263 1.00 44.24 H new ATOM 0 HG23 ILE A 542 -5.341 -16.412 21.498 1.00 44.24 H new ATOM 0 HD11 ILE A 542 -4.528 -14.373 17.816 1.00 42.43 H new ATOM 0 HD12 ILE A 542 -6.096 -15.189 17.609 1.00 42.43 H new ATOM 0 HD13 ILE A 542 -5.693 -14.418 19.161 1.00 42.43 H new ATOM 654 N GLU A 543 -5.800 -19.867 21.627 1.00 11.45 N ATOM 655 CA GLU A 543 -6.706 -20.721 22.345 1.00 41.13 C ATOM 656 C GLU A 543 -7.833 -19.887 22.942 1.00 53.41 C ATOM 657 O GLU A 543 -7.590 -18.995 23.765 1.00 31.32 O ATOM 658 CB GLU A 543 -5.967 -21.469 23.447 1.00 32.31 C ATOM 659 CG GLU A 543 -4.791 -22.300 22.964 1.00 1.10 C ATOM 660 CD GLU A 543 -4.125 -23.033 24.091 1.00 10.34 C ATOM 661 OE1 GLU A 543 -4.652 -24.069 24.519 1.00 44.24 O ATOM 662 OE2 GLU A 543 -3.070 -22.594 24.581 1.00 23.43 O ATOM 0 H GLU A 543 -4.943 -19.639 22.130 1.00 11.45 H new ATOM 0 HA GLU A 543 -7.128 -21.451 21.654 1.00 41.13 H new ATOM 0 HB2 GLU A 543 -5.609 -20.748 24.181 1.00 32.31 H new ATOM 0 HB3 GLU A 543 -6.672 -22.123 23.960 1.00 32.31 H new ATOM 0 HG2 GLU A 543 -5.135 -23.016 22.218 1.00 1.10 H new ATOM 0 HG3 GLU A 543 -4.065 -21.652 22.473 1.00 1.10 H new ATOM 669 N GLY A 544 -9.035 -20.154 22.520 1.00 63.04 N ATOM 670 CA GLY A 544 -10.177 -19.439 23.023 1.00 3.15 C ATOM 671 C GLY A 544 -10.913 -20.287 24.015 1.00 30.50 C ATOM 672 O GLY A 544 -10.392 -20.567 25.099 1.00 70.15 O ATOM 0 H GLY A 544 -9.253 -20.867 21.824 1.00 63.04 H new ATOM 0 HA2 GLY A 544 -9.857 -18.509 23.493 1.00 3.15 H new ATOM 0 HA3 GLY A 544 -10.839 -19.169 22.200 1.00 3.15 H new ATOM 676 N THR A 545 -12.099 -20.714 23.659 1.00 11.01 N ATOM 677 CA THR A 545 -12.831 -21.632 24.482 1.00 3.21 C ATOM 678 C THR A 545 -12.271 -23.036 24.259 1.00 64.32 C ATOM 679 O THR A 545 -12.211 -23.865 25.176 1.00 34.53 O ATOM 680 CB THR A 545 -14.356 -21.572 24.186 1.00 2.51 C ATOM 681 OG1 THR A 545 -14.605 -21.698 22.770 1.00 2.33 O ATOM 682 CG2 THR A 545 -14.940 -20.259 24.675 1.00 24.34 C ATOM 0 H THR A 545 -12.576 -20.437 22.801 1.00 11.01 H new ATOM 0 HA THR A 545 -12.711 -21.356 25.530 1.00 3.21 H new ATOM 0 HB THR A 545 -14.831 -22.401 24.711 1.00 2.51 H new ATOM 0 HG1 THR A 545 -15.570 -21.660 22.603 1.00 2.33 H new ATOM 0 HG21 THR A 545 -16.008 -20.233 24.460 1.00 24.34 H new ATOM 0 HG22 THR A 545 -14.784 -20.169 25.750 1.00 24.34 H new ATOM 0 HG23 THR A 545 -14.448 -19.430 24.167 1.00 24.34 H new ATOM 690 N ALA A 546 -11.823 -23.266 23.035 1.00 11.44 N ATOM 691 CA ALA A 546 -11.190 -24.500 22.654 1.00 65.53 C ATOM 692 C ALA A 546 -9.708 -24.437 23.016 1.00 72.22 C ATOM 693 O ALA A 546 -9.073 -23.382 22.872 1.00 4.13 O ATOM 694 CB ALA A 546 -11.364 -24.733 21.159 1.00 61.11 C ATOM 0 H ALA A 546 -11.894 -22.588 22.276 1.00 11.44 H new ATOM 0 HA ALA A 546 -11.653 -25.330 23.188 1.00 65.53 H new ATOM 0 HB1 ALA A 546 -10.882 -25.669 20.878 1.00 61.11 H new ATOM 0 HB2 ALA A 546 -12.426 -24.786 20.920 1.00 61.11 H new ATOM 0 HB3 ALA A 546 -10.909 -23.911 20.607 1.00 61.11 H new ATOM 700 N ARG A 547 -9.171 -25.540 23.480 1.00 41.13 N ATOM 701 CA ARG A 547 -7.785 -25.612 23.890 1.00 73.34 C ATOM 702 C ARG A 547 -6.940 -26.273 22.834 1.00 32.31 C ATOM 703 O ARG A 547 -7.386 -27.211 22.137 1.00 41.40 O ATOM 704 CB ARG A 547 -7.645 -26.366 25.194 1.00 2.35 C ATOM 705 CG ARG A 547 -8.379 -25.727 26.334 1.00 3.30 C ATOM 706 CD ARG A 547 -8.177 -26.509 27.599 1.00 63.15 C ATOM 707 NE ARG A 547 -9.008 -26.013 28.690 1.00 33.43 N ATOM 708 CZ ARG A 547 -9.738 -26.796 29.484 1.00 62.14 C ATOM 709 NH1 ARG A 547 -9.760 -28.113 29.295 1.00 20.24 N ATOM 710 NH2 ARG A 547 -10.454 -26.265 30.453 1.00 33.34 N ATOM 0 H ARG A 547 -9.682 -26.416 23.585 1.00 41.13 H new ATOM 0 HA ARG A 547 -7.435 -24.589 24.031 1.00 73.34 H new ATOM 0 HB2 ARG A 547 -8.014 -27.383 25.058 1.00 2.35 H new ATOM 0 HB3 ARG A 547 -6.588 -26.442 25.449 1.00 2.35 H new ATOM 0 HG2 ARG A 547 -8.027 -24.705 26.472 1.00 3.30 H new ATOM 0 HG3 ARG A 547 -9.442 -25.669 26.102 1.00 3.30 H new ATOM 0 HD2 ARG A 547 -8.408 -27.559 27.416 1.00 63.15 H new ATOM 0 HD3 ARG A 547 -7.128 -26.460 27.892 1.00 63.15 H new ATOM 0 HE ARG A 547 -9.032 -25.007 28.855 1.00 33.43 H new ATOM 0 HH11 ARG A 547 -9.216 -28.529 28.539 1.00 20.24 H new ATOM 0 HH12 ARG A 547 -10.321 -28.707 29.906 1.00 20.24 H new ATOM 0 HH21 ARG A 547 -10.450 -25.255 30.596 1.00 33.34 H new ATOM 0 HH22 ARG A 547 -11.013 -26.864 31.061 1.00 33.34 H new ATOM 724 N GLY A 548 -5.729 -25.817 22.736 1.00 4.15 N ATOM 725 CA GLY A 548 -4.823 -26.304 21.742 1.00 2.13 C ATOM 726 C GLY A 548 -3.951 -27.408 22.264 1.00 65.11 C ATOM 727 O GLY A 548 -4.283 -28.058 23.260 1.00 33.20 O ATOM 0 H GLY A 548 -5.341 -25.096 23.344 1.00 4.15 H new ATOM 0 HA2 GLY A 548 -5.388 -26.665 20.883 1.00 2.13 H new ATOM 0 HA3 GLY A 548 -4.197 -25.484 21.390 1.00 2.13 H new ATOM 731 N GLY A 549 -2.857 -27.650 21.576 1.00 22.23 N ATOM 732 CA GLY A 549 -1.902 -28.665 21.984 1.00 10.13 C ATOM 733 C GLY A 549 -2.396 -30.062 21.708 1.00 62.40 C ATOM 734 O GLY A 549 -1.793 -31.043 22.134 1.00 22.32 O ATOM 0 H GLY A 549 -2.602 -27.154 20.722 1.00 22.23 H new ATOM 0 HA2 GLY A 549 -0.960 -28.505 21.460 1.00 10.13 H new ATOM 0 HA3 GLY A 549 -1.696 -28.559 23.049 1.00 10.13 H new ATOM 738 N GLY A 550 -3.501 -30.159 21.011 1.00 41.32 N ATOM 739 CA GLY A 550 -4.035 -31.434 20.691 1.00 73.10 C ATOM 740 C GLY A 550 -5.231 -31.802 21.544 1.00 3.42 C ATOM 741 O GLY A 550 -5.671 -32.944 21.513 1.00 12.22 O ATOM 0 H GLY A 550 -4.038 -29.365 20.661 1.00 41.32 H new ATOM 0 HA2 GLY A 550 -4.326 -31.447 19.641 1.00 73.10 H new ATOM 0 HA3 GLY A 550 -3.259 -32.189 20.816 1.00 73.10 H new ATOM 745 N GLU A 551 -5.766 -30.864 22.316 1.00 10.20 N ATOM 746 CA GLU A 551 -6.937 -31.190 23.111 1.00 22.13 C ATOM 747 C GLU A 551 -8.200 -31.058 22.272 1.00 41.44 C ATOM 748 O GLU A 551 -8.876 -32.049 22.005 1.00 73.22 O ATOM 749 CB GLU A 551 -7.030 -30.369 24.401 1.00 42.42 C ATOM 750 CG GLU A 551 -8.139 -30.860 25.323 1.00 53.22 C ATOM 751 CD GLU A 551 -8.070 -30.278 26.703 1.00 65.21 C ATOM 752 OE1 GLU A 551 -7.114 -30.593 27.438 1.00 64.55 O ATOM 753 OE2 GLU A 551 -8.990 -29.540 27.103 1.00 65.40 O ATOM 0 H GLU A 551 -5.423 -29.908 22.406 1.00 10.20 H new ATOM 0 HA GLU A 551 -6.834 -32.229 23.425 1.00 22.13 H new ATOM 0 HB2 GLU A 551 -6.077 -30.415 24.927 1.00 42.42 H new ATOM 0 HB3 GLU A 551 -7.206 -29.323 24.151 1.00 42.42 H new ATOM 0 HG2 GLU A 551 -9.104 -30.613 24.881 1.00 53.22 H new ATOM 0 HG3 GLU A 551 -8.089 -31.947 25.392 1.00 53.22 H new ATOM 760 N ASP A 552 -8.520 -29.849 21.866 1.00 44.14 N ATOM 761 CA ASP A 552 -9.671 -29.628 20.988 1.00 44.53 C ATOM 762 C ASP A 552 -9.167 -29.440 19.596 1.00 24.22 C ATOM 763 O ASP A 552 -9.712 -29.955 18.632 1.00 25.44 O ATOM 764 CB ASP A 552 -10.484 -28.398 21.392 1.00 63.05 C ATOM 765 CG ASP A 552 -11.086 -28.498 22.759 1.00 44.11 C ATOM 766 OD1 ASP A 552 -11.977 -29.341 22.981 1.00 74.01 O ATOM 767 OD2 ASP A 552 -10.697 -27.721 23.649 1.00 74.41 O ATOM 0 H ASP A 552 -8.010 -29.003 22.122 1.00 44.14 H new ATOM 0 HA ASP A 552 -10.328 -30.494 21.065 1.00 44.53 H new ATOM 0 HB2 ASP A 552 -9.841 -27.519 21.351 1.00 63.05 H new ATOM 0 HB3 ASP A 552 -11.281 -28.245 20.664 1.00 63.05 H new ATOM 772 N PHE A 553 -8.108 -28.708 19.494 1.00 30.44 N ATOM 773 CA PHE A 553 -7.466 -28.488 18.247 1.00 55.13 C ATOM 774 C PHE A 553 -5.988 -28.597 18.467 1.00 54.22 C ATOM 775 O PHE A 553 -5.507 -28.505 19.614 1.00 24.04 O ATOM 776 CB PHE A 553 -7.836 -27.110 17.637 1.00 43.20 C ATOM 777 CG PHE A 553 -7.345 -25.907 18.413 1.00 45.12 C ATOM 778 CD1 PHE A 553 -8.090 -25.372 19.439 1.00 54.43 C ATOM 779 CD2 PHE A 553 -6.133 -25.318 18.103 1.00 71.12 C ATOM 780 CE1 PHE A 553 -7.633 -24.275 20.140 1.00 21.41 C ATOM 781 CE2 PHE A 553 -5.674 -24.229 18.797 1.00 73.02 C ATOM 782 CZ PHE A 553 -6.424 -23.703 19.817 1.00 42.14 C ATOM 0 H PHE A 553 -7.662 -28.242 20.284 1.00 30.44 H new ATOM 0 HA PHE A 553 -7.802 -29.237 17.530 1.00 55.13 H new ATOM 0 HB2 PHE A 553 -7.433 -27.059 16.626 1.00 43.20 H new ATOM 0 HB3 PHE A 553 -8.921 -27.048 17.551 1.00 43.20 H new ATOM 0 HD1 PHE A 553 -9.041 -25.815 19.698 1.00 54.43 H new ATOM 0 HD2 PHE A 553 -5.537 -25.724 17.299 1.00 71.12 H new ATOM 0 HE1 PHE A 553 -8.226 -23.864 20.944 1.00 21.41 H new ATOM 0 HE2 PHE A 553 -4.723 -23.786 18.541 1.00 73.02 H new ATOM 0 HZ PHE A 553 -6.067 -22.843 20.365 1.00 42.14 H new ATOM 792 N GLU A 554 -5.282 -28.846 17.430 1.00 72.03 N ATOM 793 CA GLU A 554 -3.866 -28.893 17.493 1.00 73.11 C ATOM 794 C GLU A 554 -3.353 -27.461 17.369 1.00 73.30 C ATOM 795 O GLU A 554 -3.843 -26.687 16.540 1.00 60.33 O ATOM 796 CB GLU A 554 -3.339 -29.762 16.367 1.00 35.13 C ATOM 797 CG GLU A 554 -2.177 -30.643 16.758 1.00 44.42 C ATOM 798 CD GLU A 554 -0.981 -29.885 17.291 1.00 10.23 C ATOM 799 OE1 GLU A 554 -0.992 -29.472 18.474 1.00 43.14 O ATOM 800 OE2 GLU A 554 -0.010 -29.687 16.533 1.00 73.33 O ATOM 0 H GLU A 554 -5.671 -29.025 16.504 1.00 72.03 H new ATOM 0 HA GLU A 554 -3.525 -29.325 18.434 1.00 73.11 H new ATOM 0 HB2 GLU A 554 -4.149 -30.391 15.998 1.00 35.13 H new ATOM 0 HB3 GLU A 554 -3.032 -29.120 15.541 1.00 35.13 H new ATOM 0 HG2 GLU A 554 -2.511 -31.353 17.515 1.00 44.42 H new ATOM 0 HG3 GLU A 554 -1.868 -31.225 15.890 1.00 44.42 H new ATOM 807 N ASP A 555 -2.385 -27.123 18.174 1.00 72.00 N ATOM 808 CA ASP A 555 -1.865 -25.770 18.226 1.00 3.04 C ATOM 809 C ASP A 555 -0.830 -25.605 17.140 1.00 22.54 C ATOM 810 O ASP A 555 0.293 -26.100 17.252 1.00 55.34 O ATOM 811 CB ASP A 555 -1.284 -25.471 19.616 1.00 71.12 C ATOM 812 CG ASP A 555 -0.696 -24.087 19.751 1.00 71.43 C ATOM 813 OD1 ASP A 555 -1.453 -23.098 19.776 1.00 33.12 O ATOM 814 OD2 ASP A 555 0.535 -23.966 19.899 1.00 72.15 O ATOM 0 H ASP A 555 -1.929 -27.772 18.816 1.00 72.00 H new ATOM 0 HA ASP A 555 -2.669 -25.054 18.056 1.00 3.04 H new ATOM 0 HB2 ASP A 555 -2.070 -25.595 20.361 1.00 71.12 H new ATOM 0 HB3 ASP A 555 -0.512 -26.206 19.842 1.00 71.12 H new ATOM 819 N THR A 556 -1.210 -24.938 16.089 1.00 62.20 N ATOM 820 CA THR A 556 -0.385 -24.844 14.934 1.00 0.03 C ATOM 821 C THR A 556 0.157 -23.437 14.738 1.00 61.11 C ATOM 822 O THR A 556 -0.481 -22.436 15.065 1.00 44.42 O ATOM 823 CB THR A 556 -1.131 -25.329 13.639 1.00 41.21 C ATOM 824 OG1 THR A 556 -0.249 -25.337 12.490 1.00 54.43 O ATOM 825 CG2 THR A 556 -2.322 -24.455 13.330 1.00 42.30 C ATOM 0 H THR A 556 -2.101 -24.447 16.015 1.00 62.20 H new ATOM 0 HA THR A 556 0.460 -25.511 15.105 1.00 0.03 H new ATOM 0 HB THR A 556 -1.470 -26.345 13.839 1.00 41.21 H new ATOM 0 HG1 THR A 556 -0.742 -25.645 11.701 1.00 54.43 H new ATOM 0 HG21 THR A 556 -2.815 -24.818 12.428 1.00 42.30 H new ATOM 0 HG22 THR A 556 -3.022 -24.486 14.165 1.00 42.30 H new ATOM 0 HG23 THR A 556 -1.989 -23.429 13.174 1.00 42.30 H new ATOM 833 N CYS A 557 1.336 -23.392 14.233 1.00 45.25 N ATOM 834 CA CYS A 557 1.995 -22.191 13.870 1.00 11.12 C ATOM 835 C CYS A 557 2.816 -22.522 12.651 1.00 42.23 C ATOM 836 O CYS A 557 3.258 -23.670 12.502 1.00 52.35 O ATOM 837 CB CYS A 557 2.871 -21.674 15.022 1.00 64.14 C ATOM 838 SG CYS A 557 4.084 -22.867 15.628 1.00 21.31 S ATOM 0 H CYS A 557 1.892 -24.228 14.054 1.00 45.25 H new ATOM 0 HA CYS A 557 1.285 -21.393 13.655 1.00 11.12 H new ATOM 0 HB2 CYS A 557 3.395 -20.778 14.690 1.00 64.14 H new ATOM 0 HB3 CYS A 557 2.226 -21.378 15.849 1.00 64.14 H new ATOM 0 HG CYS A 557 4.771 -22.334 16.594 1.00 21.31 H new ATOM 844 N GLY A 558 2.983 -21.594 11.776 1.00 63.23 N ATOM 845 CA GLY A 558 3.706 -21.859 10.578 1.00 42.24 C ATOM 846 C GLY A 558 3.969 -20.600 9.852 1.00 11.12 C ATOM 847 O GLY A 558 3.562 -19.526 10.318 1.00 33.31 O ATOM 0 H GLY A 558 2.629 -20.642 11.865 1.00 63.23 H new ATOM 0 HA2 GLY A 558 4.648 -22.354 10.815 1.00 42.24 H new ATOM 0 HA3 GLY A 558 3.138 -22.541 9.945 1.00 42.24 H new ATOM 851 N GLU A 559 4.620 -20.706 8.735 1.00 11.35 N ATOM 852 CA GLU A 559 4.976 -19.568 7.937 1.00 21.33 C ATOM 853 C GLU A 559 4.560 -19.773 6.495 1.00 55.14 C ATOM 854 O GLU A 559 5.062 -20.668 5.807 1.00 41.52 O ATOM 855 CB GLU A 559 6.472 -19.275 8.064 1.00 12.25 C ATOM 856 CG GLU A 559 6.859 -18.696 9.417 1.00 50.34 C ATOM 857 CD GLU A 559 8.339 -18.483 9.585 1.00 3.32 C ATOM 858 OE1 GLU A 559 8.881 -17.457 9.108 1.00 4.12 O ATOM 859 OE2 GLU A 559 8.982 -19.294 10.258 1.00 75.20 O ATOM 0 H GLU A 559 4.925 -21.598 8.344 1.00 11.35 H new ATOM 0 HA GLU A 559 4.437 -18.696 8.307 1.00 21.33 H new ATOM 0 HB2 GLU A 559 7.031 -20.196 7.897 1.00 12.25 H new ATOM 0 HB3 GLU A 559 6.766 -18.577 7.280 1.00 12.25 H new ATOM 0 HG2 GLU A 559 6.346 -17.744 9.554 1.00 50.34 H new ATOM 0 HG3 GLU A 559 6.506 -19.364 10.202 1.00 50.34 H new ATOM 866 N LEU A 560 3.630 -18.961 6.060 1.00 3.15 N ATOM 867 CA LEU A 560 3.098 -19.022 4.726 1.00 11.30 C ATOM 868 C LEU A 560 3.975 -18.224 3.800 1.00 1.34 C ATOM 869 O LEU A 560 4.421 -17.126 4.145 1.00 35.22 O ATOM 870 CB LEU A 560 1.678 -18.466 4.695 1.00 62.21 C ATOM 871 CG LEU A 560 0.644 -19.186 5.552 1.00 24.44 C ATOM 872 CD1 LEU A 560 -0.706 -18.518 5.416 1.00 25.32 C ATOM 873 CD2 LEU A 560 0.558 -20.655 5.174 1.00 43.31 C ATOM 0 H LEU A 560 3.215 -18.227 6.634 1.00 3.15 H new ATOM 0 HA LEU A 560 3.074 -20.062 4.402 1.00 11.30 H new ATOM 0 HB2 LEU A 560 1.714 -17.423 5.009 1.00 62.21 H new ATOM 0 HB3 LEU A 560 1.331 -18.476 3.662 1.00 62.21 H new ATOM 0 HG LEU A 560 0.957 -19.125 6.594 1.00 24.44 H new ATOM 0 HD11 LEU A 560 -1.435 -19.042 6.033 1.00 25.32 H new ATOM 0 HD12 LEU A 560 -0.633 -17.481 5.743 1.00 25.32 H new ATOM 0 HD13 LEU A 560 -1.024 -18.549 4.374 1.00 25.32 H new ATOM 0 HD21 LEU A 560 -0.186 -21.149 5.799 1.00 43.31 H new ATOM 0 HD22 LEU A 560 0.270 -20.745 4.127 1.00 43.31 H new ATOM 0 HD23 LEU A 560 1.529 -21.127 5.325 1.00 43.31 H new ATOM 885 N GLU A 561 4.212 -18.757 2.642 1.00 5.13 N ATOM 886 CA GLU A 561 5.087 -18.143 1.694 1.00 31.52 C ATOM 887 C GLU A 561 4.279 -17.491 0.575 1.00 54.21 C ATOM 888 O GLU A 561 3.519 -18.160 -0.119 1.00 13.41 O ATOM 889 CB GLU A 561 6.023 -19.207 1.141 1.00 61.24 C ATOM 890 CG GLU A 561 7.177 -18.676 0.331 1.00 51.24 C ATOM 891 CD GLU A 561 7.989 -19.792 -0.267 1.00 55.44 C ATOM 892 OE1 GLU A 561 7.477 -20.524 -1.142 1.00 14.34 O ATOM 893 OE2 GLU A 561 9.143 -20.001 0.170 1.00 21.54 O ATOM 0 H GLU A 561 3.801 -19.636 2.326 1.00 5.13 H new ATOM 0 HA GLU A 561 5.673 -17.361 2.176 1.00 31.52 H new ATOM 0 HB2 GLU A 561 6.419 -19.790 1.973 1.00 61.24 H new ATOM 0 HB3 GLU A 561 5.445 -19.891 0.519 1.00 61.24 H new ATOM 0 HG2 GLU A 561 6.800 -18.033 -0.464 1.00 51.24 H new ATOM 0 HG3 GLU A 561 7.815 -18.059 0.965 1.00 51.24 H new ATOM 900 N PHE A 562 4.409 -16.193 0.439 1.00 33.32 N ATOM 901 CA PHE A 562 3.722 -15.465 -0.602 1.00 52.01 C ATOM 902 C PHE A 562 4.735 -14.680 -1.437 1.00 73.12 C ATOM 903 O PHE A 562 5.320 -13.706 -0.967 1.00 13.54 O ATOM 904 CB PHE A 562 2.694 -14.483 -0.010 1.00 34.22 C ATOM 905 CG PHE A 562 1.555 -15.085 0.777 1.00 21.11 C ATOM 906 CD1 PHE A 562 0.362 -15.455 0.155 1.00 62.12 C ATOM 907 CD2 PHE A 562 1.657 -15.244 2.143 1.00 71.54 C ATOM 908 CE1 PHE A 562 -0.682 -15.971 0.888 1.00 22.44 C ATOM 909 CE2 PHE A 562 0.608 -15.754 2.876 1.00 33.02 C ATOM 910 CZ PHE A 562 -0.560 -16.119 2.250 1.00 63.10 C ATOM 0 H PHE A 562 4.991 -15.613 1.044 1.00 33.32 H new ATOM 0 HA PHE A 562 3.197 -16.187 -1.227 1.00 52.01 H new ATOM 0 HB2 PHE A 562 3.224 -13.786 0.639 1.00 34.22 H new ATOM 0 HB3 PHE A 562 2.271 -13.899 -0.828 1.00 34.22 H new ATOM 0 HD1 PHE A 562 0.257 -15.335 -0.913 1.00 62.12 H new ATOM 0 HD2 PHE A 562 2.572 -14.965 2.645 1.00 71.54 H new ATOM 0 HE1 PHE A 562 -1.598 -16.260 0.394 1.00 22.44 H new ATOM 0 HE2 PHE A 562 0.704 -15.867 3.946 1.00 33.02 H new ATOM 0 HZ PHE A 562 -1.380 -16.521 2.826 1.00 63.10 H new ATOM 920 N GLN A 563 4.982 -15.117 -2.640 1.00 71.42 N ATOM 921 CA GLN A 563 5.889 -14.400 -3.530 1.00 31.32 C ATOM 922 C GLN A 563 5.086 -13.763 -4.626 1.00 5.21 C ATOM 923 O GLN A 563 3.903 -13.945 -4.655 1.00 2.42 O ATOM 924 CB GLN A 563 6.886 -15.318 -4.150 1.00 22.01 C ATOM 925 CG GLN A 563 7.460 -16.330 -3.179 1.00 4.32 C ATOM 926 CD GLN A 563 8.699 -17.023 -3.669 1.00 60.51 C ATOM 927 OE1 GLN A 563 9.543 -16.321 -4.364 1.00 32.23 O flip ATOM 928 NE2 GLN A 563 8.931 -18.173 -3.353 1.00 64.22 N flip ATOM 0 H GLN A 563 4.575 -15.963 -3.038 1.00 71.42 H new ATOM 0 HA GLN A 563 6.423 -13.653 -2.943 1.00 31.32 H new ATOM 0 HB2 GLN A 563 6.415 -15.847 -4.978 1.00 22.01 H new ATOM 0 HB3 GLN A 563 7.700 -14.727 -4.571 1.00 22.01 H new ATOM 0 HG2 GLN A 563 7.687 -15.826 -2.239 1.00 4.32 H new ATOM 0 HG3 GLN A 563 6.700 -17.080 -2.963 1.00 4.32 H new ATOM 0 HE21 GLN A 563 8.249 -18.699 -2.807 1.00 64.22 H new ATOM 0 HE22 GLN A 563 9.808 -18.612 -3.634 1.00 64.22 H new ATOM 937 N ASN A 564 5.734 -13.037 -5.522 1.00 14.43 N ATOM 938 CA ASN A 564 5.051 -12.340 -6.636 1.00 32.11 C ATOM 939 C ASN A 564 4.168 -13.311 -7.426 1.00 33.43 C ATOM 940 O ASN A 564 3.017 -13.007 -7.720 1.00 4.00 O ATOM 941 CB ASN A 564 6.089 -11.673 -7.571 1.00 21.04 C ATOM 942 CG ASN A 564 5.494 -10.776 -8.682 1.00 51.22 C ATOM 943 OD1 ASN A 564 4.372 -10.964 -9.163 1.00 4.44 O ATOM 944 ND2 ASN A 564 6.249 -9.790 -9.092 1.00 2.54 N ATOM 0 H ASN A 564 6.745 -12.905 -5.511 1.00 14.43 H new ATOM 0 HA ASN A 564 4.412 -11.565 -6.213 1.00 32.11 H new ATOM 0 HB2 ASN A 564 6.767 -11.072 -6.965 1.00 21.04 H new ATOM 0 HB3 ASN A 564 6.688 -12.454 -8.039 1.00 21.04 H new ATOM 0 HD21 ASN A 564 5.914 -9.160 -9.821 1.00 2.54 H new ATOM 0 HD22 ASN A 564 7.173 -9.651 -8.683 1.00 2.54 H new ATOM 951 N ASP A 565 4.695 -14.482 -7.723 1.00 71.33 N ATOM 952 CA ASP A 565 3.933 -15.482 -8.488 1.00 25.10 C ATOM 953 C ASP A 565 2.820 -16.117 -7.659 1.00 31.41 C ATOM 954 O ASP A 565 1.673 -16.222 -8.126 1.00 75.32 O ATOM 955 CB ASP A 565 4.828 -16.580 -9.066 1.00 51.44 C ATOM 956 CG ASP A 565 4.022 -17.613 -9.844 1.00 63.32 C ATOM 957 OD1 ASP A 565 3.600 -17.322 -10.974 1.00 41.42 O ATOM 958 OD2 ASP A 565 3.803 -18.746 -9.337 1.00 70.24 O ATOM 0 H ASP A 565 5.635 -14.774 -7.456 1.00 71.33 H new ATOM 0 HA ASP A 565 3.482 -14.934 -9.315 1.00 25.10 H new ATOM 0 HB2 ASP A 565 5.575 -16.133 -9.721 1.00 51.44 H new ATOM 0 HB3 ASP A 565 5.367 -17.073 -8.257 1.00 51.44 H new ATOM 963 N GLU A 566 3.162 -16.562 -6.459 1.00 53.42 N ATOM 964 CA GLU A 566 2.228 -17.200 -5.537 1.00 4.31 C ATOM 965 C GLU A 566 1.014 -16.329 -5.272 1.00 44.01 C ATOM 966 O GLU A 566 1.117 -15.106 -5.156 1.00 61.33 O ATOM 967 CB GLU A 566 2.918 -17.512 -4.211 1.00 21.05 C ATOM 968 CG GLU A 566 3.871 -18.713 -4.194 1.00 61.52 C ATOM 969 CD GLU A 566 4.971 -18.658 -5.232 1.00 75.22 C ATOM 970 OE1 GLU A 566 5.491 -17.568 -5.505 1.00 53.41 O ATOM 971 OE2 GLU A 566 5.298 -19.708 -5.821 1.00 72.52 O ATOM 0 H GLU A 566 4.110 -16.490 -6.091 1.00 53.42 H new ATOM 0 HA GLU A 566 1.894 -18.124 -6.008 1.00 4.31 H new ATOM 0 HB2 GLU A 566 3.478 -16.629 -3.904 1.00 21.05 H new ATOM 0 HB3 GLU A 566 2.148 -17.679 -3.458 1.00 21.05 H new ATOM 0 HG2 GLU A 566 4.325 -18.786 -3.206 1.00 61.52 H new ATOM 0 HG3 GLU A 566 3.291 -19.623 -4.346 1.00 61.52 H new ATOM 978 N ILE A 567 -0.114 -16.951 -5.169 1.00 0.03 N ATOM 979 CA ILE A 567 -1.344 -16.254 -4.933 1.00 1.25 C ATOM 980 C ILE A 567 -1.806 -16.337 -3.477 1.00 5.30 C ATOM 981 O ILE A 567 -1.408 -15.509 -2.655 1.00 25.21 O ATOM 982 CB ILE A 567 -2.472 -16.662 -5.925 1.00 61.33 C ATOM 983 CG1 ILE A 567 -2.466 -18.190 -6.184 1.00 40.42 C ATOM 984 CG2 ILE A 567 -2.326 -15.891 -7.230 1.00 22.24 C ATOM 985 CD1 ILE A 567 -3.670 -18.695 -6.930 1.00 41.44 C ATOM 0 H ILE A 567 -0.213 -17.963 -5.246 1.00 0.03 H new ATOM 0 HA ILE A 567 -1.124 -15.205 -5.129 1.00 1.25 H new ATOM 0 HB ILE A 567 -3.432 -16.409 -5.475 1.00 61.33 H new ATOM 0 HG12 ILE A 567 -1.569 -18.448 -6.747 1.00 40.42 H new ATOM 0 HG13 ILE A 567 -2.402 -18.709 -5.228 1.00 40.42 H new ATOM 0 HG21 ILE A 567 -3.120 -16.184 -7.917 1.00 22.24 H new ATOM 0 HG22 ILE A 567 -2.395 -14.822 -7.031 1.00 22.24 H new ATOM 0 HG23 ILE A 567 -1.358 -16.115 -7.678 1.00 22.24 H new ATOM 0 HD11 ILE A 567 -3.586 -19.773 -7.069 1.00 41.44 H new ATOM 0 HD12 ILE A 567 -4.572 -18.472 -6.359 1.00 41.44 H new ATOM 0 HD13 ILE A 567 -3.726 -18.207 -7.903 1.00 41.44 H new ATOM 997 N VAL A 568 -2.583 -17.343 -3.151 1.00 11.12 N ATOM 998 CA VAL A 568 -3.150 -17.472 -1.835 1.00 2.24 C ATOM 999 C VAL A 568 -2.598 -18.720 -1.139 1.00 40.33 C ATOM 1000 O VAL A 568 -2.191 -19.681 -1.801 1.00 2.41 O ATOM 1001 CB VAL A 568 -4.714 -17.555 -1.925 1.00 31.31 C ATOM 1002 CG1 VAL A 568 -5.190 -18.831 -2.586 1.00 4.31 C ATOM 1003 CG2 VAL A 568 -5.367 -17.416 -0.586 1.00 20.12 C ATOM 0 H VAL A 568 -2.838 -18.094 -3.793 1.00 11.12 H new ATOM 0 HA VAL A 568 -2.876 -16.594 -1.250 1.00 2.24 H new ATOM 0 HB VAL A 568 -5.012 -16.712 -2.549 1.00 31.31 H new ATOM 0 HG11 VAL A 568 -6.279 -18.837 -2.623 1.00 4.31 H new ATOM 0 HG12 VAL A 568 -4.793 -18.886 -3.599 1.00 4.31 H new ATOM 0 HG13 VAL A 568 -4.841 -19.690 -2.013 1.00 4.31 H new ATOM 0 HG21 VAL A 568 -6.449 -17.480 -0.701 1.00 20.12 H new ATOM 0 HG22 VAL A 568 -5.024 -18.215 0.071 1.00 20.12 H new ATOM 0 HG23 VAL A 568 -5.105 -16.451 -0.152 1.00 20.12 H new ATOM 1013 N LYS A 569 -2.552 -18.684 0.173 1.00 42.11 N ATOM 1014 CA LYS A 569 -2.169 -19.819 0.972 1.00 22.53 C ATOM 1015 C LYS A 569 -3.211 -20.099 2.006 1.00 71.14 C ATOM 1016 O LYS A 569 -4.064 -19.242 2.282 1.00 63.51 O ATOM 1017 CB LYS A 569 -0.826 -19.654 1.642 1.00 2.01 C ATOM 1018 CG LYS A 569 0.343 -19.785 0.703 1.00 51.25 C ATOM 1019 CD LYS A 569 1.487 -20.514 1.373 1.00 33.13 C ATOM 1020 CE LYS A 569 1.161 -21.986 1.697 1.00 64.24 C ATOM 1021 NZ LYS A 569 0.977 -22.812 0.483 1.00 43.22 N ATOM 0 H LYS A 569 -2.783 -17.854 0.719 1.00 42.11 H new ATOM 0 HA LYS A 569 -2.082 -20.660 0.284 1.00 22.53 H new ATOM 0 HB2 LYS A 569 -0.787 -18.676 2.121 1.00 2.01 H new ATOM 0 HB3 LYS A 569 -0.731 -20.399 2.432 1.00 2.01 H new ATOM 0 HG2 LYS A 569 0.037 -20.324 -0.194 1.00 51.25 H new ATOM 0 HG3 LYS A 569 0.672 -18.796 0.384 1.00 51.25 H new ATOM 0 HD2 LYS A 569 2.363 -20.476 0.725 1.00 33.13 H new ATOM 0 HD3 LYS A 569 1.750 -19.995 2.295 1.00 33.13 H new ATOM 0 HE2 LYS A 569 1.966 -22.408 2.300 1.00 64.24 H new ATOM 0 HE3 LYS A 569 0.255 -22.028 2.301 1.00 64.24 H new ATOM 0 HZ1 LYS A 569 0.827 -23.804 0.757 1.00 43.22 H new ATOM 0 HZ2 LYS A 569 0.150 -22.471 -0.047 1.00 43.22 H new ATOM 0 HZ3 LYS A 569 1.824 -22.743 -0.116 1.00 43.22 H new ATOM 1035 N THR A 570 -3.147 -21.263 2.581 1.00 14.44 N ATOM 1036 CA THR A 570 -4.094 -21.689 3.564 1.00 72.34 C ATOM 1037 C THR A 570 -3.421 -22.077 4.879 1.00 45.41 C ATOM 1038 O THR A 570 -2.255 -22.471 4.899 1.00 72.42 O ATOM 1039 CB THR A 570 -4.907 -22.883 3.025 1.00 34.23 C ATOM 1040 OG1 THR A 570 -4.059 -23.732 2.231 1.00 22.34 O ATOM 1041 CG2 THR A 570 -6.097 -22.427 2.206 1.00 30.24 C ATOM 0 H THR A 570 -2.424 -21.953 2.376 1.00 14.44 H new ATOM 0 HA THR A 570 -4.757 -20.848 3.767 1.00 72.34 H new ATOM 0 HB THR A 570 -5.288 -23.442 3.880 1.00 34.23 H new ATOM 0 HG1 THR A 570 -4.580 -24.490 1.892 1.00 22.34 H new ATOM 0 HG21 THR A 570 -6.644 -23.297 1.844 1.00 30.24 H new ATOM 0 HG22 THR A 570 -6.754 -21.818 2.827 1.00 30.24 H new ATOM 0 HG23 THR A 570 -5.750 -21.838 1.357 1.00 30.24 H new ATOM 1049 N ILE A 571 -4.144 -21.898 5.961 1.00 12.51 N ATOM 1050 CA ILE A 571 -3.720 -22.366 7.269 1.00 64.10 C ATOM 1051 C ILE A 571 -4.348 -23.721 7.471 1.00 54.42 C ATOM 1052 O ILE A 571 -5.560 -23.853 7.313 1.00 74.12 O ATOM 1053 CB ILE A 571 -4.184 -21.422 8.458 1.00 72.53 C ATOM 1054 CG1 ILE A 571 -3.413 -20.101 8.509 1.00 0.10 C ATOM 1055 CG2 ILE A 571 -4.083 -22.115 9.805 1.00 31.23 C ATOM 1056 CD1 ILE A 571 -3.688 -19.166 7.391 1.00 55.32 C ATOM 0 H ILE A 571 -5.046 -21.423 5.963 1.00 12.51 H new ATOM 0 HA ILE A 571 -2.630 -22.385 7.288 1.00 64.10 H new ATOM 0 HB ILE A 571 -5.229 -21.194 8.250 1.00 72.53 H new ATOM 0 HG12 ILE A 571 -3.647 -19.598 9.448 1.00 0.10 H new ATOM 0 HG13 ILE A 571 -2.346 -20.322 8.523 1.00 0.10 H new ATOM 0 HG21 ILE A 571 -4.410 -21.433 10.590 1.00 31.23 H new ATOM 0 HG22 ILE A 571 -4.717 -23.001 9.807 1.00 31.23 H new ATOM 0 HG23 ILE A 571 -3.049 -22.408 9.987 1.00 31.23 H new ATOM 0 HD11 ILE A 571 -3.094 -18.261 7.519 1.00 55.32 H new ATOM 0 HD12 ILE A 571 -3.426 -19.642 6.446 1.00 55.32 H new ATOM 0 HD13 ILE A 571 -4.747 -18.907 7.385 1.00 55.32 H new ATOM 1068 N SER A 572 -3.543 -24.701 7.775 1.00 22.20 N ATOM 1069 CA SER A 572 -4.018 -26.031 8.017 1.00 31.04 C ATOM 1070 C SER A 572 -3.993 -26.336 9.521 1.00 62.42 C ATOM 1071 O SER A 572 -2.923 -26.342 10.156 1.00 5.34 O ATOM 1072 CB SER A 572 -3.154 -27.022 7.239 1.00 2.21 C ATOM 1073 OG SER A 572 -3.213 -26.752 5.839 1.00 15.25 O ATOM 0 H SER A 572 -2.532 -24.596 7.862 1.00 22.20 H new ATOM 0 HA SER A 572 -5.049 -26.122 7.676 1.00 31.04 H new ATOM 0 HB2 SER A 572 -2.122 -26.960 7.583 1.00 2.21 H new ATOM 0 HB3 SER A 572 -3.494 -28.039 7.433 1.00 2.21 H new ATOM 0 HG SER A 572 -3.897 -27.319 5.425 1.00 15.25 H new ATOM 1079 N VAL A 573 -5.163 -26.547 10.093 1.00 0.32 N ATOM 1080 CA VAL A 573 -5.286 -26.861 11.513 1.00 74.43 C ATOM 1081 C VAL A 573 -5.874 -28.244 11.700 1.00 25.20 C ATOM 1082 O VAL A 573 -6.916 -28.568 11.100 1.00 15.22 O ATOM 1083 CB VAL A 573 -6.189 -25.829 12.267 1.00 51.30 C ATOM 1084 CG1 VAL A 573 -6.401 -26.218 13.727 1.00 44.22 C ATOM 1085 CG2 VAL A 573 -5.595 -24.444 12.197 1.00 60.41 C ATOM 0 H VAL A 573 -6.052 -26.507 9.595 1.00 0.32 H new ATOM 0 HA VAL A 573 -4.281 -26.817 11.932 1.00 74.43 H new ATOM 0 HB VAL A 573 -7.158 -25.833 11.768 1.00 51.30 H new ATOM 0 HG11 VAL A 573 -7.033 -25.475 14.213 1.00 44.22 H new ATOM 0 HG12 VAL A 573 -6.884 -27.194 13.777 1.00 44.22 H new ATOM 0 HG13 VAL A 573 -5.438 -26.263 14.235 1.00 44.22 H new ATOM 0 HG21 VAL A 573 -6.240 -23.744 12.728 1.00 60.41 H new ATOM 0 HG22 VAL A 573 -4.607 -24.448 12.658 1.00 60.41 H new ATOM 0 HG23 VAL A 573 -5.508 -24.138 11.155 1.00 60.41 H new ATOM 1095 N LYS A 574 -5.209 -29.060 12.497 1.00 22.34 N ATOM 1096 CA LYS A 574 -5.713 -30.345 12.857 1.00 22.34 C ATOM 1097 C LYS A 574 -6.725 -30.174 13.962 1.00 61.11 C ATOM 1098 O LYS A 574 -6.396 -29.747 15.072 1.00 14.51 O ATOM 1099 CB LYS A 574 -4.565 -31.290 13.285 1.00 22.22 C ATOM 1100 CG LYS A 574 -4.999 -32.619 13.933 1.00 23.25 C ATOM 1101 CD LYS A 574 -5.842 -33.496 13.012 1.00 30.21 C ATOM 1102 CE LYS A 574 -6.263 -34.780 13.720 1.00 52.43 C ATOM 1103 NZ LYS A 574 -7.118 -35.636 12.872 1.00 12.01 N ATOM 0 H LYS A 574 -4.302 -28.837 12.907 1.00 22.34 H new ATOM 0 HA LYS A 574 -6.196 -30.805 11.995 1.00 22.34 H new ATOM 0 HB2 LYS A 574 -3.959 -31.516 12.408 1.00 22.22 H new ATOM 0 HB3 LYS A 574 -3.923 -30.757 13.987 1.00 22.22 H new ATOM 0 HG2 LYS A 574 -4.111 -33.173 14.237 1.00 23.25 H new ATOM 0 HG3 LYS A 574 -5.567 -32.405 14.838 1.00 23.25 H new ATOM 0 HD2 LYS A 574 -6.727 -32.947 12.689 1.00 30.21 H new ATOM 0 HD3 LYS A 574 -5.273 -33.740 12.115 1.00 30.21 H new ATOM 0 HE2 LYS A 574 -5.374 -35.337 14.015 1.00 52.43 H new ATOM 0 HE3 LYS A 574 -6.799 -34.528 14.635 1.00 52.43 H new ATOM 0 HZ1 LYS A 574 -7.378 -36.496 13.397 1.00 12.01 H new ATOM 0 HZ2 LYS A 574 -7.980 -35.116 12.611 1.00 12.01 H new ATOM 0 HZ3 LYS A 574 -6.599 -35.900 12.010 1.00 12.01 H new ATOM 1117 N VAL A 575 -7.945 -30.439 13.644 1.00 60.20 N ATOM 1118 CA VAL A 575 -8.985 -30.390 14.618 1.00 43.22 C ATOM 1119 C VAL A 575 -9.010 -31.749 15.270 1.00 72.41 C ATOM 1120 O VAL A 575 -9.087 -32.776 14.571 1.00 22.30 O ATOM 1121 CB VAL A 575 -10.362 -30.063 13.980 1.00 33.42 C ATOM 1122 CG1 VAL A 575 -11.447 -29.982 15.046 1.00 10.54 C ATOM 1123 CG2 VAL A 575 -10.293 -28.755 13.196 1.00 64.21 C ATOM 0 H VAL A 575 -8.251 -30.695 12.705 1.00 60.20 H new ATOM 0 HA VAL A 575 -8.795 -29.597 15.341 1.00 43.22 H new ATOM 0 HB VAL A 575 -10.615 -30.869 13.292 1.00 33.42 H new ATOM 0 HG11 VAL A 575 -12.403 -29.752 14.575 1.00 10.54 H new ATOM 0 HG12 VAL A 575 -11.519 -30.938 15.565 1.00 10.54 H new ATOM 0 HG13 VAL A 575 -11.197 -29.198 15.761 1.00 10.54 H new ATOM 0 HG21 VAL A 575 -11.267 -28.543 12.756 1.00 64.21 H new ATOM 0 HG22 VAL A 575 -10.013 -27.943 13.867 1.00 64.21 H new ATOM 0 HG23 VAL A 575 -9.549 -28.844 12.404 1.00 64.21 H new ATOM 1133 N ILE A 576 -8.886 -31.780 16.560 1.00 41.41 N ATOM 1134 CA ILE A 576 -8.823 -33.028 17.262 1.00 33.41 C ATOM 1135 C ILE A 576 -10.207 -33.596 17.388 1.00 62.44 C ATOM 1136 O ILE A 576 -11.124 -32.961 17.896 1.00 41.15 O ATOM 1137 CB ILE A 576 -8.177 -32.880 18.644 1.00 13.33 C ATOM 1138 CG1 ILE A 576 -6.815 -32.177 18.530 1.00 71.20 C ATOM 1139 CG2 ILE A 576 -8.038 -34.236 19.334 1.00 70.21 C ATOM 1140 CD1 ILE A 576 -5.785 -32.895 17.672 1.00 23.24 C ATOM 0 H ILE A 576 -8.826 -30.952 17.153 1.00 41.41 H new ATOM 0 HA ILE A 576 -8.194 -33.709 16.689 1.00 33.41 H new ATOM 0 HB ILE A 576 -8.830 -32.261 19.260 1.00 13.33 H new ATOM 0 HG12 ILE A 576 -6.972 -31.179 18.121 1.00 71.20 H new ATOM 0 HG13 ILE A 576 -6.405 -32.050 19.532 1.00 71.20 H new ATOM 0 HG21 ILE A 576 -7.577 -34.101 20.312 1.00 70.21 H new ATOM 0 HG22 ILE A 576 -9.024 -34.685 19.456 1.00 70.21 H new ATOM 0 HG23 ILE A 576 -7.414 -34.891 18.726 1.00 70.21 H new ATOM 0 HD11 ILE A 576 -4.860 -32.319 17.655 1.00 23.24 H new ATOM 0 HD12 ILE A 576 -5.590 -33.883 18.089 1.00 23.24 H new ATOM 0 HD13 ILE A 576 -6.166 -32.998 16.656 1.00 23.24 H new ATOM 1278 N LYS A 585 -17.316 -24.957 20.703 1.00 3.12 N ATOM 1279 CA LYS A 585 -16.124 -24.206 21.003 1.00 21.21 C ATOM 1280 C LYS A 585 -15.444 -23.612 19.806 1.00 62.41 C ATOM 1281 O LYS A 585 -15.611 -24.059 18.667 1.00 61.14 O ATOM 1282 CB LYS A 585 -15.161 -24.993 21.880 1.00 20.02 C ATOM 1283 CG LYS A 585 -15.731 -25.258 23.260 1.00 42.55 C ATOM 1284 CD LYS A 585 -14.746 -25.936 24.184 1.00 32.10 C ATOM 1285 CE LYS A 585 -14.371 -27.324 23.714 1.00 32.30 C ATOM 1286 NZ LYS A 585 -13.475 -27.999 24.676 1.00 41.33 N ATOM 0 HA LYS A 585 -16.470 -23.347 21.578 1.00 21.21 H new ATOM 0 HB2 LYS A 585 -14.925 -25.942 21.398 1.00 20.02 H new ATOM 0 HB3 LYS A 585 -14.225 -24.442 21.975 1.00 20.02 H new ATOM 0 HG2 LYS A 585 -16.047 -24.314 23.704 1.00 42.55 H new ATOM 0 HG3 LYS A 585 -16.621 -25.880 23.166 1.00 42.55 H new ATOM 0 HD2 LYS A 585 -13.846 -25.326 24.260 1.00 32.10 H new ATOM 0 HD3 LYS A 585 -15.175 -25.998 25.184 1.00 32.10 H new ATOM 0 HE2 LYS A 585 -15.274 -27.919 23.577 1.00 32.30 H new ATOM 0 HE3 LYS A 585 -13.881 -27.260 22.742 1.00 32.30 H new ATOM 0 HZ1 LYS A 585 -13.063 -28.845 24.232 1.00 41.33 H new ATOM 0 HZ2 LYS A 585 -12.713 -27.349 24.956 1.00 41.33 H new ATOM 0 HZ3 LYS A 585 -14.017 -28.279 25.518 1.00 41.33 H new ATOM 1300 N THR A 586 -14.663 -22.614 20.078 1.00 3.44 N ATOM 1301 CA THR A 586 -14.021 -21.855 19.069 1.00 11.30 C ATOM 1302 C THR A 586 -12.646 -21.388 19.560 1.00 3.25 C ATOM 1303 O THR A 586 -12.363 -21.394 20.771 1.00 24.23 O ATOM 1304 CB THR A 586 -14.935 -20.640 18.660 1.00 72.12 C ATOM 1305 OG1 THR A 586 -14.310 -19.811 17.690 1.00 10.35 O ATOM 1306 CG2 THR A 586 -15.325 -19.800 19.859 1.00 2.10 C ATOM 0 H THR A 586 -14.454 -22.304 21.027 1.00 3.44 H new ATOM 0 HA THR A 586 -13.865 -22.473 18.185 1.00 11.30 H new ATOM 0 HB THR A 586 -15.836 -21.072 18.225 1.00 72.12 H new ATOM 0 HG1 THR A 586 -14.622 -18.888 17.798 1.00 10.35 H new ATOM 0 HG21 THR A 586 -15.955 -18.972 19.534 1.00 2.10 H new ATOM 0 HG22 THR A 586 -15.874 -20.416 20.572 1.00 2.10 H new ATOM 0 HG23 THR A 586 -14.427 -19.407 20.335 1.00 2.10 H new ATOM 1314 N PHE A 587 -11.791 -21.062 18.632 1.00 44.05 N ATOM 1315 CA PHE A 587 -10.493 -20.538 18.910 1.00 63.52 C ATOM 1316 C PHE A 587 -10.213 -19.469 17.876 1.00 14.41 C ATOM 1317 O PHE A 587 -11.016 -19.280 16.963 1.00 14.55 O ATOM 1318 CB PHE A 587 -9.425 -21.647 18.879 1.00 44.42 C ATOM 1319 CG PHE A 587 -9.188 -22.312 17.538 1.00 72.31 C ATOM 1320 CD1 PHE A 587 -9.985 -23.360 17.106 1.00 14.10 C ATOM 1321 CD2 PHE A 587 -8.139 -21.901 16.731 1.00 61.32 C ATOM 1322 CE1 PHE A 587 -9.738 -23.977 15.893 1.00 54.04 C ATOM 1323 CE2 PHE A 587 -7.894 -22.512 15.522 1.00 14.42 C ATOM 1324 CZ PHE A 587 -8.691 -23.550 15.105 1.00 40.12 C ATOM 0 H PHE A 587 -11.988 -21.158 17.636 1.00 44.05 H new ATOM 0 HA PHE A 587 -10.458 -20.113 19.913 1.00 63.52 H new ATOM 0 HB2 PHE A 587 -8.481 -21.223 19.223 1.00 44.42 H new ATOM 0 HB3 PHE A 587 -9.709 -22.416 19.597 1.00 44.42 H new ATOM 0 HD1 PHE A 587 -10.806 -23.698 17.721 1.00 14.10 H new ATOM 0 HD2 PHE A 587 -7.504 -21.089 17.055 1.00 61.32 H new ATOM 0 HE1 PHE A 587 -10.365 -24.792 15.564 1.00 54.04 H new ATOM 0 HE2 PHE A 587 -7.076 -22.176 14.902 1.00 14.42 H new ATOM 0 HZ PHE A 587 -8.497 -24.032 14.158 1.00 40.12 H new ATOM 1334 N PHE A 588 -9.106 -18.804 17.966 1.00 75.10 N ATOM 1335 CA PHE A 588 -8.839 -17.741 17.040 1.00 25.40 C ATOM 1336 C PHE A 588 -7.556 -18.024 16.301 1.00 61.10 C ATOM 1337 O PHE A 588 -6.708 -18.767 16.780 1.00 32.43 O ATOM 1338 CB PHE A 588 -8.784 -16.360 17.739 1.00 53.01 C ATOM 1339 CG PHE A 588 -10.033 -15.979 18.488 1.00 32.24 C ATOM 1340 CD1 PHE A 588 -11.077 -15.340 17.846 1.00 15.02 C ATOM 1341 CD2 PHE A 588 -10.154 -16.254 19.844 1.00 64.01 C ATOM 1342 CE1 PHE A 588 -12.219 -14.985 18.536 1.00 41.32 C ATOM 1343 CE2 PHE A 588 -11.293 -15.902 20.539 1.00 25.11 C ATOM 1344 CZ PHE A 588 -12.328 -15.268 19.884 1.00 0.43 C ATOM 0 H PHE A 588 -8.378 -18.972 18.660 1.00 75.10 H new ATOM 0 HA PHE A 588 -9.662 -17.698 16.327 1.00 25.40 H new ATOM 0 HB2 PHE A 588 -7.945 -16.354 18.434 1.00 53.01 H new ATOM 0 HB3 PHE A 588 -8.581 -15.597 16.988 1.00 53.01 H new ATOM 0 HD1 PHE A 588 -10.999 -15.116 16.792 1.00 15.02 H new ATOM 0 HD2 PHE A 588 -9.346 -16.750 20.361 1.00 64.01 H new ATOM 0 HE1 PHE A 588 -13.027 -14.486 18.022 1.00 41.32 H new ATOM 0 HE2 PHE A 588 -11.374 -16.122 21.593 1.00 25.11 H new ATOM 0 HZ PHE A 588 -13.222 -14.993 20.424 1.00 0.43 H new ATOM 1354 N LEU A 589 -7.435 -17.481 15.142 1.00 2.25 N ATOM 1355 CA LEU A 589 -6.246 -17.629 14.355 1.00 2.11 C ATOM 1356 C LEU A 589 -5.718 -16.233 14.124 1.00 31.35 C ATOM 1357 O LEU A 589 -6.487 -15.334 13.764 1.00 63.33 O ATOM 1358 CB LEU A 589 -6.586 -18.276 12.999 1.00 72.24 C ATOM 1359 CG LEU A 589 -5.575 -19.268 12.395 1.00 52.10 C ATOM 1360 CD1 LEU A 589 -4.180 -18.682 12.257 1.00 13.43 C ATOM 1361 CD2 LEU A 589 -5.557 -20.542 13.202 1.00 51.42 C ATOM 0 H LEU A 589 -8.161 -16.915 14.702 1.00 2.25 H new ATOM 0 HA LEU A 589 -5.516 -18.262 14.860 1.00 2.11 H new ATOM 0 HB2 LEU A 589 -7.539 -18.795 13.107 1.00 72.24 H new ATOM 0 HB3 LEU A 589 -6.739 -17.475 12.276 1.00 72.24 H new ATOM 0 HG LEU A 589 -5.906 -19.492 11.381 1.00 52.10 H new ATOM 0 HD11 LEU A 589 -3.513 -19.428 11.826 1.00 13.43 H new ATOM 0 HD12 LEU A 589 -4.215 -17.808 11.607 1.00 13.43 H new ATOM 0 HD13 LEU A 589 -3.810 -18.389 13.239 1.00 13.43 H new ATOM 0 HD21 LEU A 589 -4.839 -21.238 12.768 1.00 51.42 H new ATOM 0 HD22 LEU A 589 -5.269 -20.318 14.229 1.00 51.42 H new ATOM 0 HD23 LEU A 589 -6.550 -20.992 13.193 1.00 51.42 H new ATOM 1373 N GLU A 590 -4.464 -16.029 14.360 1.00 32.53 N ATOM 1374 CA GLU A 590 -3.875 -14.753 14.116 1.00 64.41 C ATOM 1375 C GLU A 590 -2.683 -14.921 13.221 1.00 44.51 C ATOM 1376 O GLU A 590 -1.877 -15.844 13.403 1.00 5.24 O ATOM 1377 CB GLU A 590 -3.478 -14.066 15.421 1.00 45.30 C ATOM 1378 CG GLU A 590 -2.902 -12.668 15.244 1.00 44.14 C ATOM 1379 CD GLU A 590 -2.514 -12.033 16.550 1.00 43.40 C ATOM 1380 OE1 GLU A 590 -3.381 -11.389 17.191 1.00 10.14 O ATOM 1381 OE2 GLU A 590 -1.341 -12.153 16.955 1.00 23.11 O ATOM 0 H GLU A 590 -3.823 -16.734 14.724 1.00 32.53 H new ATOM 0 HA GLU A 590 -4.610 -14.115 13.625 1.00 64.41 H new ATOM 0 HB2 GLU A 590 -4.354 -14.006 16.067 1.00 45.30 H new ATOM 0 HB3 GLU A 590 -2.744 -14.686 15.936 1.00 45.30 H new ATOM 0 HG2 GLU A 590 -2.028 -12.719 14.595 1.00 44.14 H new ATOM 0 HG3 GLU A 590 -3.636 -12.038 14.742 1.00 44.14 H new ATOM 1388 N ILE A 591 -2.600 -14.084 12.238 1.00 1.21 N ATOM 1389 CA ILE A 591 -1.478 -14.068 11.361 1.00 23.22 C ATOM 1390 C ILE A 591 -0.549 -12.970 11.789 1.00 62.42 C ATOM 1391 O ILE A 591 -0.994 -11.912 12.270 1.00 54.43 O ATOM 1392 CB ILE A 591 -1.875 -13.927 9.868 1.00 53.03 C ATOM 1393 CG1 ILE A 591 -2.843 -12.741 9.653 1.00 74.45 C ATOM 1394 CG2 ILE A 591 -2.470 -15.234 9.366 1.00 65.02 C ATOM 1395 CD1 ILE A 591 -3.302 -12.549 8.217 1.00 44.31 C ATOM 0 H ILE A 591 -3.314 -13.389 12.021 1.00 1.21 H new ATOM 0 HA ILE A 591 -0.974 -15.032 11.434 1.00 23.22 H new ATOM 0 HB ILE A 591 -0.978 -13.712 9.287 1.00 53.03 H new ATOM 0 HG12 ILE A 591 -3.720 -12.886 10.284 1.00 74.45 H new ATOM 0 HG13 ILE A 591 -2.356 -11.826 9.990 1.00 74.45 H new ATOM 0 HG21 ILE A 591 -2.747 -15.129 8.317 1.00 65.02 H new ATOM 0 HG22 ILE A 591 -1.734 -16.032 9.469 1.00 65.02 H new ATOM 0 HG23 ILE A 591 -3.356 -15.479 9.952 1.00 65.02 H new ATOM 0 HD11 ILE A 591 -3.977 -11.695 8.162 1.00 44.31 H new ATOM 0 HD12 ILE A 591 -2.437 -12.369 7.579 1.00 44.31 H new ATOM 0 HD13 ILE A 591 -3.822 -13.445 7.878 1.00 44.31 H new ATOM 1407 N GLY A 592 0.712 -13.223 11.670 1.00 70.40 N ATOM 1408 CA GLY A 592 1.686 -12.290 12.090 1.00 70.31 C ATOM 1409 C GLY A 592 1.982 -11.294 11.023 1.00 12.33 C ATOM 1410 O GLY A 592 1.515 -11.430 9.886 1.00 60.41 O ATOM 0 H GLY A 592 1.090 -14.085 11.278 1.00 70.40 H new ATOM 0 HA2 GLY A 592 1.336 -11.774 12.984 1.00 70.31 H new ATOM 0 HA3 GLY A 592 2.601 -12.815 12.363 1.00 70.31 H new ATOM 1414 N GLU A 593 2.744 -10.301 11.374 1.00 2.14 N ATOM 1415 CA GLU A 593 3.101 -9.271 10.452 1.00 73.54 C ATOM 1416 C GLU A 593 4.044 -9.809 9.395 1.00 52.45 C ATOM 1417 O GLU A 593 5.015 -10.512 9.716 1.00 1.54 O ATOM 1418 CB GLU A 593 3.662 -8.064 11.180 1.00 4.14 C ATOM 1419 CG GLU A 593 2.614 -7.381 12.034 1.00 42.35 C ATOM 1420 CD GLU A 593 3.150 -6.222 12.807 1.00 25.02 C ATOM 1421 OE1 GLU A 593 3.241 -5.108 12.258 1.00 11.44 O ATOM 1422 OE2 GLU A 593 3.472 -6.388 13.998 1.00 22.33 O ATOM 0 H GLU A 593 3.135 -10.185 12.309 1.00 2.14 H new ATOM 0 HA GLU A 593 2.204 -8.931 9.934 1.00 73.54 H new ATOM 0 HB2 GLU A 593 4.496 -8.375 11.809 1.00 4.14 H new ATOM 0 HB3 GLU A 593 4.058 -7.354 10.454 1.00 4.14 H new ATOM 0 HG2 GLU A 593 1.801 -7.038 11.395 1.00 42.35 H new ATOM 0 HG3 GLU A 593 2.190 -8.107 12.727 1.00 42.35 H new ATOM 1429 N PRO A 594 3.741 -9.521 8.132 1.00 3.54 N ATOM 1430 CA PRO A 594 4.488 -10.031 6.994 1.00 21.42 C ATOM 1431 C PRO A 594 5.963 -9.627 7.021 1.00 71.41 C ATOM 1432 O PRO A 594 6.313 -8.436 7.105 1.00 73.43 O ATOM 1433 CB PRO A 594 3.778 -9.423 5.782 1.00 41.33 C ATOM 1434 CG PRO A 594 2.992 -8.288 6.320 1.00 53.54 C ATOM 1435 CD PRO A 594 2.635 -8.650 7.716 1.00 65.43 C ATOM 0 HA PRO A 594 4.502 -11.121 6.985 1.00 21.42 H new ATOM 0 HB2 PRO A 594 4.495 -9.085 5.034 1.00 41.33 H new ATOM 0 HB3 PRO A 594 3.132 -10.154 5.297 1.00 41.33 H new ATOM 0 HG2 PRO A 594 3.573 -7.366 6.294 1.00 53.54 H new ATOM 0 HG3 PRO A 594 2.097 -8.117 5.722 1.00 53.54 H new ATOM 0 HD2 PRO A 594 2.556 -7.769 8.352 1.00 65.43 H new ATOM 0 HD3 PRO A 594 1.676 -9.166 7.765 1.00 65.43 H new ATOM 1443 N ARG A 595 6.810 -10.609 6.928 1.00 63.05 N ATOM 1444 CA ARG A 595 8.225 -10.402 6.971 1.00 55.00 C ATOM 1445 C ARG A 595 8.794 -10.533 5.572 1.00 73.33 C ATOM 1446 O ARG A 595 8.607 -11.559 4.895 1.00 71.43 O ATOM 1447 CB ARG A 595 8.906 -11.363 7.987 1.00 50.11 C ATOM 1448 CG ARG A 595 8.649 -12.853 7.748 1.00 1.11 C ATOM 1449 CD ARG A 595 9.217 -13.733 8.865 1.00 61.41 C ATOM 1450 NE ARG A 595 8.637 -13.407 10.179 1.00 24.44 N ATOM 1451 CZ ARG A 595 8.391 -14.281 11.176 1.00 65.14 C ATOM 1452 NH1 ARG A 595 8.542 -15.589 11.002 1.00 34.40 N ATOM 1453 NH2 ARG A 595 7.945 -13.831 12.338 1.00 23.45 N ATOM 0 H ARG A 595 6.534 -11.585 6.819 1.00 63.05 H new ATOM 0 HA ARG A 595 8.434 -9.393 7.327 1.00 55.00 H new ATOM 0 HB2 ARG A 595 9.982 -11.188 7.963 1.00 50.11 H new ATOM 0 HB3 ARG A 595 8.563 -11.108 8.990 1.00 50.11 H new ATOM 0 HG2 ARG A 595 7.576 -13.024 7.665 1.00 1.11 H new ATOM 0 HG3 ARG A 595 9.093 -13.147 6.797 1.00 1.11 H new ATOM 0 HD2 ARG A 595 9.023 -14.781 8.634 1.00 61.41 H new ATOM 0 HD3 ARG A 595 10.299 -13.611 8.907 1.00 61.41 H new ATOM 0 HE ARG A 595 8.399 -12.430 10.351 1.00 24.44 H new ATOM 0 HH11 ARG A 595 8.850 -15.951 10.100 1.00 34.40 H new ATOM 0 HH12 ARG A 595 8.350 -16.231 11.771 1.00 34.40 H new ATOM 0 HH21 ARG A 595 7.791 -12.832 12.473 1.00 23.45 H new ATOM 0 HH22 ARG A 595 7.756 -14.483 13.099 1.00 23.45 H new ATOM 1467 N LEU A 596 9.396 -9.462 5.114 1.00 35.11 N ATOM 1468 CA LEU A 596 10.001 -9.393 3.816 1.00 4.03 C ATOM 1469 C LEU A 596 11.213 -10.309 3.795 1.00 62.40 C ATOM 1470 O LEU A 596 12.063 -10.255 4.694 1.00 64.45 O ATOM 1471 CB LEU A 596 10.404 -7.923 3.537 1.00 20.32 C ATOM 1472 CG LEU A 596 10.683 -7.493 2.077 1.00 23.03 C ATOM 1473 CD1 LEU A 596 11.992 -8.044 1.544 1.00 40.31 C ATOM 1474 CD2 LEU A 596 9.533 -7.921 1.193 1.00 0.11 C ATOM 0 H LEU A 596 9.478 -8.598 5.649 1.00 35.11 H new ATOM 0 HA LEU A 596 9.308 -9.718 3.040 1.00 4.03 H new ATOM 0 HB2 LEU A 596 9.610 -7.284 3.924 1.00 20.32 H new ATOM 0 HB3 LEU A 596 11.299 -7.709 4.121 1.00 20.32 H new ATOM 0 HG LEU A 596 10.774 -6.407 2.068 1.00 23.03 H new ATOM 0 HD11 LEU A 596 12.136 -7.710 0.516 1.00 40.31 H new ATOM 0 HD12 LEU A 596 12.816 -7.685 2.161 1.00 40.31 H new ATOM 0 HD13 LEU A 596 11.966 -9.133 1.572 1.00 40.31 H new ATOM 0 HD21 LEU A 596 9.732 -7.617 0.165 1.00 0.11 H new ATOM 0 HD22 LEU A 596 9.424 -9.005 1.237 1.00 0.11 H new ATOM 0 HD23 LEU A 596 8.613 -7.450 1.539 1.00 0.11 H new ATOM 1486 N VAL A 597 11.279 -11.140 2.797 1.00 70.22 N ATOM 1487 CA VAL A 597 12.374 -12.049 2.657 1.00 42.20 C ATOM 1488 C VAL A 597 13.468 -11.353 1.902 1.00 12.11 C ATOM 1489 O VAL A 597 13.266 -10.905 0.758 1.00 24.45 O ATOM 1490 CB VAL A 597 11.954 -13.343 1.941 1.00 73.51 C ATOM 1491 CG1 VAL A 597 13.111 -14.327 1.850 1.00 62.31 C ATOM 1492 CG2 VAL A 597 10.788 -13.968 2.666 1.00 73.23 C ATOM 0 H VAL A 597 10.577 -11.206 2.060 1.00 70.22 H new ATOM 0 HA VAL A 597 12.726 -12.342 3.646 1.00 42.20 H new ATOM 0 HB VAL A 597 11.655 -13.091 0.924 1.00 73.51 H new ATOM 0 HG11 VAL A 597 12.780 -15.231 1.338 1.00 62.31 H new ATOM 0 HG12 VAL A 597 13.931 -13.874 1.293 1.00 62.31 H new ATOM 0 HG13 VAL A 597 13.452 -14.582 2.854 1.00 62.31 H new ATOM 0 HG21 VAL A 597 10.492 -14.885 2.157 1.00 73.23 H new ATOM 0 HG22 VAL A 597 11.079 -14.200 3.691 1.00 73.23 H new ATOM 0 HG23 VAL A 597 9.950 -13.271 2.675 1.00 73.23 H new ATOM 2079 N PRO A 634 6.274 -4.903 3.748 1.00 75.43 N ATOM 2080 CA PRO A 634 4.942 -5.420 3.606 1.00 34.54 C ATOM 2081 C PRO A 634 4.174 -5.318 4.901 1.00 51.41 C ATOM 2082 O PRO A 634 4.707 -5.575 5.987 1.00 35.03 O ATOM 2083 CB PRO A 634 5.139 -6.872 3.179 1.00 32.45 C ATOM 2084 CG PRO A 634 6.490 -7.233 3.686 1.00 60.05 C ATOM 2085 CD PRO A 634 7.295 -5.967 3.645 1.00 53.22 C ATOM 0 HA PRO A 634 4.355 -4.858 2.880 1.00 34.54 H new ATOM 0 HB2 PRO A 634 4.371 -7.518 3.604 1.00 32.45 H new ATOM 0 HB3 PRO A 634 5.081 -6.978 2.096 1.00 32.45 H new ATOM 0 HG2 PRO A 634 6.434 -7.628 4.700 1.00 60.05 H new ATOM 0 HG3 PRO A 634 6.946 -8.006 3.068 1.00 60.05 H new ATOM 0 HD2 PRO A 634 8.009 -5.919 4.467 1.00 53.22 H new ATOM 0 HD3 PRO A 634 7.867 -5.885 2.721 1.00 53.22 H new ATOM 2093 N ILE A 635 2.945 -4.920 4.789 1.00 64.04 N ATOM 2094 CA ILE A 635 2.092 -4.752 5.923 1.00 51.04 C ATOM 2095 C ILE A 635 0.824 -5.566 5.749 1.00 1.43 C ATOM 2096 O ILE A 635 0.598 -6.145 4.675 1.00 13.23 O ATOM 2097 CB ILE A 635 1.808 -3.230 6.221 1.00 11.23 C ATOM 2098 CG1 ILE A 635 1.300 -2.439 4.981 1.00 33.00 C ATOM 2099 CG2 ILE A 635 3.063 -2.567 6.763 1.00 21.54 C ATOM 2100 CD1 ILE A 635 -0.115 -2.731 4.539 1.00 32.10 C ATOM 0 H ILE A 635 2.501 -4.700 3.897 1.00 64.04 H new ATOM 0 HA ILE A 635 2.606 -5.134 6.805 1.00 51.04 H new ATOM 0 HB ILE A 635 1.008 -3.206 6.961 1.00 11.23 H new ATOM 0 HG12 ILE A 635 1.378 -1.374 5.198 1.00 33.00 H new ATOM 0 HG13 ILE A 635 1.969 -2.644 4.146 1.00 33.00 H new ATOM 0 HG21 ILE A 635 2.860 -1.516 6.967 1.00 21.54 H new ATOM 0 HG22 ILE A 635 3.368 -3.063 7.685 1.00 21.54 H new ATOM 0 HG23 ILE A 635 3.863 -2.646 6.027 1.00 21.54 H new ATOM 0 HD11 ILE A 635 -0.357 -2.122 3.668 1.00 32.10 H new ATOM 0 HD12 ILE A 635 -0.205 -3.786 4.280 1.00 32.10 H new ATOM 0 HD13 ILE A 635 -0.805 -2.496 5.349 1.00 32.10 H new ATOM 2112 N LEU A 636 0.036 -5.650 6.780 1.00 2.23 N ATOM 2113 CA LEU A 636 -1.188 -6.397 6.728 1.00 43.41 C ATOM 2114 C LEU A 636 -2.419 -5.496 6.784 1.00 62.05 C ATOM 2115 O LEU A 636 -2.295 -4.267 6.803 1.00 21.11 O ATOM 2116 CB LEU A 636 -1.206 -7.549 7.769 1.00 10.25 C ATOM 2117 CG LEU A 636 -0.710 -7.258 9.205 1.00 14.03 C ATOM 2118 CD1 LEU A 636 -1.559 -6.222 9.915 1.00 23.35 C ATOM 2119 CD2 LEU A 636 -0.671 -8.542 10.007 1.00 35.15 C ATOM 0 H LEU A 636 0.222 -5.205 7.679 1.00 2.23 H new ATOM 0 HA LEU A 636 -1.234 -6.881 5.753 1.00 43.41 H new ATOM 0 HB2 LEU A 636 -2.230 -7.914 7.840 1.00 10.25 H new ATOM 0 HB3 LEU A 636 -0.604 -8.365 7.370 1.00 10.25 H new ATOM 0 HG LEU A 636 0.295 -6.844 9.123 1.00 14.03 H new ATOM 0 HD11 LEU A 636 -1.167 -6.056 10.918 1.00 23.35 H new ATOM 0 HD12 LEU A 636 -1.534 -5.286 9.356 1.00 23.35 H new ATOM 0 HD13 LEU A 636 -2.587 -6.578 9.982 1.00 23.35 H new ATOM 0 HD21 LEU A 636 -0.321 -8.330 11.017 1.00 35.15 H new ATOM 0 HD22 LEU A 636 -1.671 -8.973 10.053 1.00 35.15 H new ATOM 0 HD23 LEU A 636 0.007 -9.249 9.529 1.00 35.15 H new ATOM 2131 N GLY A 637 -3.585 -6.106 6.777 1.00 2.21 N ATOM 2132 CA GLY A 637 -4.829 -5.381 6.750 1.00 74.13 C ATOM 2133 C GLY A 637 -5.214 -4.720 8.069 1.00 70.54 C ATOM 2134 O GLY A 637 -4.433 -4.697 9.033 1.00 64.21 O ATOM 0 H GLY A 637 -3.693 -7.120 6.790 1.00 2.21 H new ATOM 0 HA2 GLY A 637 -4.769 -4.613 5.979 1.00 74.13 H new ATOM 0 HA3 GLY A 637 -5.625 -6.065 6.457 1.00 74.13 H new ATOM 2138 N GLU A 638 -6.421 -4.197 8.098 1.00 72.13 N ATOM 2139 CA GLU A 638 -6.965 -3.474 9.225 1.00 53.43 C ATOM 2140 C GLU A 638 -7.195 -4.423 10.408 1.00 64.32 C ATOM 2141 O GLU A 638 -6.709 -4.174 11.513 1.00 15.40 O ATOM 2142 CB GLU A 638 -8.268 -2.787 8.792 1.00 11.40 C ATOM 2143 CG GLU A 638 -8.879 -1.844 9.815 1.00 61.05 C ATOM 2144 CD GLU A 638 -10.156 -1.216 9.309 1.00 64.24 C ATOM 2145 OE1 GLU A 638 -10.096 -0.171 8.633 1.00 53.54 O ATOM 2146 OE2 GLU A 638 -11.260 -1.767 9.572 1.00 52.34 O ATOM 0 H GLU A 638 -7.070 -4.266 7.314 1.00 72.13 H new ATOM 0 HA GLU A 638 -6.259 -2.712 9.555 1.00 53.43 H new ATOM 0 HB2 GLU A 638 -8.077 -2.228 7.876 1.00 11.40 H new ATOM 0 HB3 GLU A 638 -9.001 -3.556 8.549 1.00 11.40 H new ATOM 0 HG2 GLU A 638 -9.083 -2.390 10.736 1.00 61.05 H new ATOM 0 HG3 GLU A 638 -8.162 -1.061 10.061 1.00 61.05 H new ATOM 2153 N HIS A 639 -7.922 -5.496 10.176 1.00 53.32 N ATOM 2154 CA HIS A 639 -8.152 -6.506 11.202 1.00 3.12 C ATOM 2155 C HIS A 639 -7.617 -7.822 10.719 1.00 61.41 C ATOM 2156 O HIS A 639 -8.032 -8.315 9.676 1.00 13.32 O ATOM 2157 CB HIS A 639 -9.652 -6.684 11.546 1.00 44.43 C ATOM 2158 CG HIS A 639 -10.306 -5.529 12.246 1.00 5.14 C ATOM 2159 ND1 HIS A 639 -10.627 -5.530 13.587 1.00 1.51 N ATOM 2160 CD2 HIS A 639 -10.741 -4.344 11.761 1.00 44.21 C ATOM 2161 CE1 HIS A 639 -11.232 -4.375 13.869 1.00 62.43 C ATOM 2162 NE2 HIS A 639 -11.327 -3.613 12.791 1.00 42.54 N ATOM 0 H HIS A 639 -8.369 -5.697 9.281 1.00 53.32 H new ATOM 0 HA HIS A 639 -7.642 -6.170 12.105 1.00 3.12 H new ATOM 0 HB2 HIS A 639 -10.196 -6.879 10.622 1.00 44.43 H new ATOM 0 HB3 HIS A 639 -9.759 -7.570 12.171 1.00 44.43 H new ATOM 0 HD2 HIS A 639 -10.648 -4.016 10.736 1.00 44.21 H new ATOM 0 HE1 HIS A 639 -11.596 -4.098 14.847 1.00 62.43 H new ATOM 0 HE2 HIS A 639 -11.743 -2.684 12.728 1.00 42.54 H new ATOM 2170 N THR A 640 -6.707 -8.386 11.444 1.00 71.25 N ATOM 2171 CA THR A 640 -6.165 -9.659 11.090 1.00 72.22 C ATOM 2172 C THR A 640 -6.396 -10.665 12.194 1.00 1.12 C ATOM 2173 O THR A 640 -5.631 -10.746 13.168 1.00 1.22 O ATOM 2174 CB THR A 640 -4.678 -9.569 10.704 1.00 34.21 C ATOM 2175 OG1 THR A 640 -3.951 -8.796 11.681 1.00 21.52 O ATOM 2176 CG2 THR A 640 -4.521 -8.943 9.334 1.00 50.03 C ATOM 0 H THR A 640 -6.319 -7.980 12.295 1.00 71.25 H new ATOM 0 HA THR A 640 -6.694 -10.006 10.202 1.00 72.22 H new ATOM 0 HB THR A 640 -4.271 -10.580 10.677 1.00 34.21 H new ATOM 0 HG1 THR A 640 -4.177 -9.111 12.581 1.00 21.52 H new ATOM 0 HG21 THR A 640 -3.463 -8.888 9.078 1.00 50.03 H new ATOM 0 HG22 THR A 640 -5.042 -9.551 8.594 1.00 50.03 H new ATOM 0 HG23 THR A 640 -4.945 -7.939 9.342 1.00 50.03 H new ATOM 2184 N LYS A 641 -7.472 -11.398 12.066 1.00 25.23 N ATOM 2185 CA LYS A 641 -7.867 -12.363 13.051 1.00 21.44 C ATOM 2186 C LYS A 641 -8.925 -13.230 12.428 1.00 64.43 C ATOM 2187 O LYS A 641 -9.621 -12.794 11.512 1.00 32.12 O ATOM 2188 CB LYS A 641 -8.457 -11.670 14.300 1.00 13.23 C ATOM 2189 CG LYS A 641 -8.696 -12.615 15.482 1.00 51.33 C ATOM 2190 CD LYS A 641 -9.512 -11.965 16.593 1.00 24.13 C ATOM 2191 CE LYS A 641 -10.949 -11.695 16.145 1.00 14.43 C ATOM 2192 NZ LYS A 641 -11.782 -11.133 17.222 1.00 20.24 N ATOM 0 H LYS A 641 -8.102 -11.339 11.266 1.00 25.23 H new ATOM 0 HA LYS A 641 -7.000 -12.945 13.364 1.00 21.44 H new ATOM 0 HB2 LYS A 641 -7.781 -10.875 14.615 1.00 13.23 H new ATOM 0 HB3 LYS A 641 -9.401 -11.198 14.029 1.00 13.23 H new ATOM 0 HG2 LYS A 641 -9.213 -13.508 15.130 1.00 51.33 H new ATOM 0 HG3 LYS A 641 -7.736 -12.940 15.883 1.00 51.33 H new ATOM 0 HD2 LYS A 641 -9.518 -12.614 17.469 1.00 24.13 H new ATOM 0 HD3 LYS A 641 -9.041 -11.029 16.893 1.00 24.13 H new ATOM 0 HE2 LYS A 641 -10.939 -11.005 15.301 1.00 14.43 H new ATOM 0 HE3 LYS A 641 -11.396 -12.624 15.792 1.00 14.43 H new ATOM 0 HZ1 LYS A 641 -12.745 -10.969 16.866 1.00 20.24 H new ATOM 0 HZ2 LYS A 641 -11.816 -11.801 18.019 1.00 20.24 H new ATOM 0 HZ3 LYS A 641 -11.373 -10.232 17.543 1.00 20.24 H new ATOM 2206 N LEU A 642 -9.012 -14.425 12.881 1.00 41.11 N ATOM 2207 CA LEU A 642 -9.990 -15.349 12.428 1.00 63.33 C ATOM 2208 C LEU A 642 -10.590 -16.027 13.630 1.00 72.11 C ATOM 2209 O LEU A 642 -9.867 -16.419 14.529 1.00 53.42 O ATOM 2210 CB LEU A 642 -9.314 -16.385 11.561 1.00 3.33 C ATOM 2211 CG LEU A 642 -10.186 -17.480 10.976 1.00 43.52 C ATOM 2212 CD1 LEU A 642 -11.135 -16.932 9.944 1.00 13.10 C ATOM 2213 CD2 LEU A 642 -9.318 -18.559 10.392 1.00 15.35 C ATOM 0 H LEU A 642 -8.389 -14.800 13.596 1.00 41.11 H new ATOM 0 HA LEU A 642 -10.765 -14.839 11.856 1.00 63.33 H new ATOM 0 HB2 LEU A 642 -8.825 -15.867 10.736 1.00 3.33 H new ATOM 0 HB3 LEU A 642 -8.529 -16.858 12.151 1.00 3.33 H new ATOM 0 HG LEU A 642 -10.792 -17.907 11.775 1.00 43.52 H new ATOM 0 HD11 LEU A 642 -11.745 -17.742 9.544 1.00 13.10 H new ATOM 0 HD12 LEU A 642 -11.781 -16.184 10.404 1.00 13.10 H new ATOM 0 HD13 LEU A 642 -10.567 -16.473 9.135 1.00 13.10 H new ATOM 0 HD21 LEU A 642 -9.947 -19.344 9.972 1.00 15.35 H new ATOM 0 HD22 LEU A 642 -8.692 -18.137 9.606 1.00 15.35 H new ATOM 0 HD23 LEU A 642 -8.685 -18.980 11.173 1.00 15.35 H new ATOM 2225 N GLU A 643 -11.875 -16.109 13.672 1.00 73.54 N ATOM 2226 CA GLU A 643 -12.556 -16.834 14.708 1.00 42.01 C ATOM 2227 C GLU A 643 -12.939 -18.178 14.126 1.00 74.31 C ATOM 2228 O GLU A 643 -13.752 -18.245 13.227 1.00 73.41 O ATOM 2229 CB GLU A 643 -13.793 -16.056 15.138 1.00 53.11 C ATOM 2230 CG GLU A 643 -14.572 -16.660 16.291 1.00 10.14 C ATOM 2231 CD GLU A 643 -15.760 -15.815 16.661 1.00 65.35 C ATOM 2232 OE1 GLU A 643 -15.585 -14.609 16.919 1.00 24.03 O ATOM 2233 OE2 GLU A 643 -16.901 -16.312 16.678 1.00 25.45 O ATOM 0 H GLU A 643 -12.494 -15.675 12.988 1.00 73.54 H new ATOM 0 HA GLU A 643 -11.926 -16.970 15.587 1.00 42.01 H new ATOM 0 HB2 GLU A 643 -13.489 -15.047 15.416 1.00 53.11 H new ATOM 0 HB3 GLU A 643 -14.459 -15.963 14.280 1.00 53.11 H new ATOM 0 HG2 GLU A 643 -14.907 -17.661 16.019 1.00 10.14 H new ATOM 0 HG3 GLU A 643 -13.918 -16.767 17.156 1.00 10.14 H new ATOM 2240 N VAL A 644 -12.312 -19.221 14.578 1.00 62.12 N ATOM 2241 CA VAL A 644 -12.575 -20.536 14.054 1.00 2.21 C ATOM 2242 C VAL A 644 -13.458 -21.280 15.009 1.00 13.23 C ATOM 2243 O VAL A 644 -13.040 -21.612 16.119 1.00 64.11 O ATOM 2244 CB VAL A 644 -11.294 -21.364 13.854 1.00 11.41 C ATOM 2245 CG1 VAL A 644 -11.629 -22.702 13.212 1.00 71.24 C ATOM 2246 CG2 VAL A 644 -10.274 -20.609 13.028 1.00 31.14 C ATOM 0 H VAL A 644 -11.608 -19.191 15.315 1.00 62.12 H new ATOM 0 HA VAL A 644 -13.050 -20.401 13.082 1.00 2.21 H new ATOM 0 HB VAL A 644 -10.851 -21.548 14.833 1.00 11.41 H new ATOM 0 HG11 VAL A 644 -10.714 -23.279 13.075 1.00 71.24 H new ATOM 0 HG12 VAL A 644 -12.313 -23.254 13.857 1.00 71.24 H new ATOM 0 HG13 VAL A 644 -12.100 -22.533 12.243 1.00 71.24 H new ATOM 0 HG21 VAL A 644 -9.381 -21.221 12.905 1.00 31.14 H new ATOM 0 HG22 VAL A 644 -10.695 -20.381 12.049 1.00 31.14 H new ATOM 0 HG23 VAL A 644 -10.011 -19.681 13.535 1.00 31.14 H new ATOM 2256 N ILE A 645 -14.655 -21.512 14.610 1.00 44.41 N ATOM 2257 CA ILE A 645 -15.606 -22.215 15.426 1.00 2.32 C ATOM 2258 C ILE A 645 -15.643 -23.666 14.974 1.00 23.34 C ATOM 2259 O ILE A 645 -15.793 -23.938 13.783 1.00 23.45 O ATOM 2260 CB ILE A 645 -17.004 -21.581 15.275 1.00 0.52 C ATOM 2261 CG1 ILE A 645 -16.893 -20.060 15.422 1.00 74.43 C ATOM 2262 CG2 ILE A 645 -17.942 -22.137 16.345 1.00 2.31 C ATOM 2263 CD1 ILE A 645 -18.152 -19.320 15.082 1.00 3.14 C ATOM 0 H ILE A 645 -15.016 -21.221 13.702 1.00 44.41 H new ATOM 0 HA ILE A 645 -15.313 -22.156 16.474 1.00 2.32 H new ATOM 0 HB ILE A 645 -17.406 -21.821 14.290 1.00 0.52 H new ATOM 0 HG12 ILE A 645 -16.611 -19.824 16.448 1.00 74.43 H new ATOM 0 HG13 ILE A 645 -16.088 -19.701 14.780 1.00 74.43 H new ATOM 0 HG21 ILE A 645 -18.928 -21.686 16.234 1.00 2.31 H new ATOM 0 HG22 ILE A 645 -18.022 -23.218 16.232 1.00 2.31 H new ATOM 0 HG23 ILE A 645 -17.545 -21.904 17.333 1.00 2.31 H new ATOM 0 HD11 ILE A 645 -17.991 -18.250 15.211 1.00 3.14 H new ATOM 0 HD12 ILE A 645 -18.425 -19.523 14.047 1.00 3.14 H new ATOM 0 HD13 ILE A 645 -18.956 -19.648 15.741 1.00 3.14 H new ATOM 2275 N ILE A 646 -15.476 -24.577 15.897 1.00 14.21 N ATOM 2276 CA ILE A 646 -15.469 -25.994 15.589 1.00 61.11 C ATOM 2277 C ILE A 646 -16.854 -26.535 15.869 1.00 75.40 C ATOM 2278 O ILE A 646 -17.229 -26.724 17.029 1.00 44.21 O ATOM 2279 CB ILE A 646 -14.432 -26.763 16.456 1.00 53.10 C ATOM 2280 CG1 ILE A 646 -13.032 -26.145 16.299 1.00 64.34 C ATOM 2281 CG2 ILE A 646 -14.413 -28.240 16.070 1.00 71.54 C ATOM 2282 CD1 ILE A 646 -11.995 -26.711 17.254 1.00 22.03 C ATOM 0 H ILE A 646 -15.341 -24.363 16.885 1.00 14.21 H new ATOM 0 HA ILE A 646 -15.192 -26.131 14.544 1.00 61.11 H new ATOM 0 HB ILE A 646 -14.725 -26.681 17.503 1.00 53.10 H new ATOM 0 HG12 ILE A 646 -12.691 -26.300 15.275 1.00 64.34 H new ATOM 0 HG13 ILE A 646 -13.102 -25.068 16.452 1.00 64.34 H new ATOM 0 HG21 ILE A 646 -13.683 -28.767 16.684 1.00 71.54 H new ATOM 0 HG22 ILE A 646 -15.401 -28.671 16.231 1.00 71.54 H new ATOM 0 HG23 ILE A 646 -14.141 -28.338 15.019 1.00 71.54 H new ATOM 0 HD11 ILE A 646 -11.036 -26.224 17.080 1.00 22.03 H new ATOM 0 HD12 ILE A 646 -12.311 -26.533 18.282 1.00 22.03 H new ATOM 0 HD13 ILE A 646 -11.893 -27.783 17.087 1.00 22.03 H new ATOM 2294 N GLU A 647 -17.616 -26.764 14.837 1.00 74.44 N ATOM 2295 CA GLU A 647 -18.987 -27.149 15.017 1.00 15.22 C ATOM 2296 C GLU A 647 -19.246 -28.540 14.493 1.00 65.41 C ATOM 2297 O GLU A 647 -18.826 -28.879 13.385 1.00 52.10 O ATOM 2298 CB GLU A 647 -19.900 -26.171 14.303 1.00 22.53 C ATOM 2299 CG GLU A 647 -19.596 -24.721 14.605 1.00 63.22 C ATOM 2300 CD GLU A 647 -20.600 -23.793 14.027 1.00 75.21 C ATOM 2301 OE1 GLU A 647 -20.812 -23.827 12.800 1.00 13.45 O ATOM 2302 OE2 GLU A 647 -21.247 -23.051 14.797 1.00 61.24 O ATOM 0 H GLU A 647 -17.313 -26.691 13.866 1.00 74.44 H new ATOM 0 HA GLU A 647 -19.193 -27.139 16.087 1.00 15.22 H new ATOM 0 HB2 GLU A 647 -19.821 -26.333 13.228 1.00 22.53 H new ATOM 0 HB3 GLU A 647 -20.932 -26.382 14.582 1.00 22.53 H new ATOM 0 HG2 GLU A 647 -19.556 -24.580 15.685 1.00 63.22 H new ATOM 0 HG3 GLU A 647 -18.609 -24.472 14.214 1.00 63.22 H new