USER MOD reduce.3.24.130724 H: found=0, std=0, add=844, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 832 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 634 LYS NZ :NH3+ -178:sc= -1.05 (180deg=-1.63) USER MOD Set 1.2: A 637 SER OG : rot 40:sc= -0.417! USER MOD Set 2.1: A 588 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 622 GLN : amide:sc= -4.82! C(o=-4.8!,f=-16!) USER MOD Set 3.1: A 579 ASN : amide:sc= -6.48! C(o=-8.8!,f=-6.7!) USER MOD Set 3.2: A 581 ASN : amide:sc= -2.31! C(o=-8.8!,f=-10!) USER MOD Set 4.1: A 556 CYS SG : rot -146:sc= 0.176 USER MOD Set 4.2: A 559 CYS SG : rot 3:sc= -19.7! USER MOD Set 4.3: A 612 CYS SG : rot -134:sc= -2.21 USER MOD Set 4.4: A 615 CYS SG : rot 21:sc= -25.2! USER MOD Set 5.1: A 553 GLN : amide:sc= -0.317 X(o=0.0096,f=0.33) USER MOD Set 5.2: A 565 HIS : no HD1:sc= 0.327 K(o=0.0096,f=-2.3) USER MOD Single : A 546 GLN : amide:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 551 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-2.2) USER MOD Single : A 558 ASN : amide:sc= -1.42! X(o=-1.4!,f=-1.1) USER MOD Single : A 560 MET CE :methyl 145:sc= -0.476 (180deg=-0.98) USER MOD Single : A 567 SER OG : rot -49:sc= -1.94 USER MOD Single : A 571 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 575 THR OG1 : rot 66:sc= 1.02 USER MOD Single : A 576 HIS : no HD1:sc= -0.474 X(o=-0.47,f=-0.45) USER MOD Single : A 577 HIS : no HE2:sc= -12.7! C(o=-13!,f=-12!) USER MOD Single : A 583 ASN : amide:sc= -0.22 X(o=-0.22,f=-0.22) USER MOD Single : A 585 SER OG : rot 180:sc= 0 USER MOD Single : A 586 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 587 TYR OH : rot -79:sc= 1.03 USER MOD Single : A 589 ASN : amide:sc= -1.24 K(o=-1.2,f=-0.41) USER MOD Single : A 591 SER OG : rot 180:sc= 0 USER MOD Single : A 605 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 611 SER OG : rot 48:sc= 0.165 USER MOD Single : A 614 ASN : amide:sc= -4.44! C(o=-4.4!,f=-2.9!) USER MOD Single : A 623 MET CE :methyl 146:sc= 0 (180deg=-0.381) USER MOD Single : A 625 TYR OH : rot 180:sc= 0 USER MOD Single : A 626 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 627 SER OG : rot -55:sc= 0.577 USER MOD Single : A 629 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 638 MET CE :methyl -152:sc= -10.3! (180deg=-12.1!) USER MOD Single : A 642 THR OG1 : rot -92:sc= 1.62 USER MOD Single : A 644 GLN : amide:sc= 0.708 K(o=0.71,f=-0.084) USER MOD Single : A 648 GLN : amide:sc= -5.42 K(o=-5.4,f=-8.7!) USER MOD Single : A 650 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 653 SER OG : rot -28:sc= 0.0404 USER MOD Single : A 658 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 56 N GLN A 546 5.217 -6.887 1.953 1.00 33.02 N ATOM 57 CA GLN A 546 5.894 -7.452 3.108 1.00 45.51 C ATOM 58 C GLN A 546 4.893 -7.718 4.233 1.00 31.24 C ATOM 59 O GLN A 546 4.012 -6.899 4.492 1.00 22.53 O ATOM 60 CB GLN A 546 7.023 -6.534 3.584 1.00 72.41 C ATOM 61 CG GLN A 546 6.465 -5.316 4.323 1.00 75.34 C ATOM 62 CD GLN A 546 7.583 -4.341 4.696 1.00 61.42 C ATOM 63 OE1 GLN A 546 7.795 -4.012 5.851 1.00 13.03 O ATOM 64 NE2 GLN A 546 8.285 -3.900 3.656 1.00 2.11 N ATOM 0 HA GLN A 546 6.341 -8.402 2.814 1.00 45.51 H new ATOM 0 HB2 GLN A 546 7.693 -7.087 4.242 1.00 72.41 H new ATOM 0 HB3 GLN A 546 7.614 -6.206 2.729 1.00 72.41 H new ATOM 0 HG2 GLN A 546 5.731 -4.810 3.695 1.00 75.34 H new ATOM 0 HG3 GLN A 546 5.945 -5.640 5.224 1.00 75.34 H new ATOM 0 HE21 GLN A 546 8.054 -4.216 2.714 1.00 2.11 H new ATOM 0 HE22 GLN A 546 9.054 -3.246 3.800 1.00 2.11 H new ATOM 73 N PHE A 547 5.061 -8.867 4.872 1.00 2.42 N ATOM 74 CA PHE A 547 4.183 -9.251 5.964 1.00 71.40 C ATOM 75 C PHE A 547 4.928 -10.104 6.993 1.00 4.41 C ATOM 76 O PHE A 547 5.165 -11.289 6.768 1.00 62.41 O ATOM 77 CB PHE A 547 3.051 -10.082 5.356 1.00 51.31 C ATOM 78 CG PHE A 547 2.494 -9.512 4.049 1.00 24.51 C ATOM 79 CD1 PHE A 547 3.106 -9.798 2.868 1.00 0.43 C ATOM 80 CD2 PHE A 547 1.388 -8.721 4.068 1.00 24.45 C ATOM 81 CE1 PHE A 547 2.590 -9.269 1.656 1.00 73.34 C ATOM 82 CE2 PHE A 547 0.872 -8.193 2.856 1.00 60.12 C ATOM 83 CZ PHE A 547 1.484 -8.478 1.675 1.00 74.21 C ATOM 0 H PHE A 547 5.792 -9.544 4.654 1.00 2.42 H new ATOM 0 HA PHE A 547 3.809 -8.361 6.471 1.00 71.40 H new ATOM 0 HB2 PHE A 547 3.414 -11.094 5.174 1.00 51.31 H new ATOM 0 HB3 PHE A 547 2.241 -10.160 6.081 1.00 51.31 H new ATOM 0 HD1 PHE A 547 3.984 -10.427 2.853 1.00 0.43 H new ATOM 0 HD2 PHE A 547 0.902 -8.495 5.006 1.00 24.45 H new ATOM 0 HE1 PHE A 547 3.076 -9.495 0.718 1.00 73.34 H new ATOM 0 HE2 PHE A 547 -0.006 -7.565 2.871 1.00 60.12 H new ATOM 0 HZ PHE A 547 1.092 -8.076 0.753 1.00 74.21 H new ATOM 93 N PRO A 548 5.287 -9.449 8.130 1.00 34.01 N ATOM 94 CA PRO A 548 6.000 -10.134 9.195 1.00 43.34 C ATOM 95 C PRO A 548 5.063 -11.055 9.979 1.00 44.32 C ATOM 96 O PRO A 548 3.898 -10.724 10.194 1.00 44.13 O ATOM 97 CB PRO A 548 6.594 -9.024 10.047 1.00 35.25 C ATOM 98 CG PRO A 548 5.810 -7.768 9.702 1.00 33.50 C ATOM 99 CD PRO A 548 5.023 -8.045 8.431 1.00 32.04 C ATOM 0 HA PRO A 548 6.783 -10.793 8.821 1.00 43.34 H new ATOM 0 HB2 PRO A 548 6.509 -9.258 11.108 1.00 35.25 H new ATOM 0 HB3 PRO A 548 7.655 -8.893 9.834 1.00 35.25 H new ATOM 0 HG2 PRO A 548 5.137 -7.502 10.517 1.00 33.50 H new ATOM 0 HG3 PRO A 548 6.485 -6.924 9.557 1.00 33.50 H new ATOM 0 HD2 PRO A 548 3.958 -7.865 8.578 1.00 32.04 H new ATOM 0 HD3 PRO A 548 5.347 -7.398 7.616 1.00 32.04 H new ATOM 107 N VAL A 549 5.608 -12.192 10.385 1.00 35.40 N ATOM 108 CA VAL A 549 4.835 -13.164 11.141 1.00 50.41 C ATOM 109 C VAL A 549 4.143 -12.460 12.310 1.00 1.20 C ATOM 110 O VAL A 549 2.960 -12.683 12.561 1.00 30.45 O ATOM 111 CB VAL A 549 5.736 -14.317 11.586 1.00 3.13 C ATOM 112 CG1 VAL A 549 6.239 -15.116 10.382 1.00 22.04 C ATOM 113 CG2 VAL A 549 6.904 -13.805 12.431 1.00 4.04 C ATOM 0 H VAL A 549 6.575 -12.462 10.205 1.00 35.40 H new ATOM 0 HA VAL A 549 4.055 -13.601 10.517 1.00 50.41 H new ATOM 0 HB VAL A 549 5.141 -14.987 12.207 1.00 3.13 H new ATOM 0 HG11 VAL A 549 6.877 -15.930 10.726 1.00 22.04 H new ATOM 0 HG12 VAL A 549 5.389 -15.527 9.837 1.00 22.04 H new ATOM 0 HG13 VAL A 549 6.810 -14.461 9.723 1.00 22.04 H new ATOM 0 HG21 VAL A 549 7.529 -14.645 12.734 1.00 4.04 H new ATOM 0 HG22 VAL A 549 7.498 -13.104 11.844 1.00 4.04 H new ATOM 0 HG23 VAL A 549 6.518 -13.301 13.317 1.00 4.04 H new ATOM 123 N GLU A 550 4.910 -11.623 12.993 1.00 24.55 N ATOM 124 CA GLU A 550 4.386 -10.886 14.130 1.00 1.50 C ATOM 125 C GLU A 550 3.115 -10.132 13.733 1.00 33.42 C ATOM 126 O GLU A 550 2.230 -9.922 14.561 1.00 13.10 O ATOM 127 CB GLU A 550 5.437 -9.928 14.694 1.00 2.40 C ATOM 128 CG GLU A 550 6.087 -9.107 13.578 1.00 74.24 C ATOM 129 CD GLU A 550 6.595 -7.765 14.108 1.00 30.12 C ATOM 130 OE1 GLU A 550 5.928 -6.735 13.930 1.00 71.21 O ATOM 131 OE2 GLU A 550 7.726 -7.816 14.726 1.00 20.44 O ATOM 0 H GLU A 550 5.891 -11.439 12.781 1.00 24.55 H new ATOM 0 HA GLU A 550 4.133 -11.599 14.915 1.00 1.50 H new ATOM 0 HB2 GLU A 550 4.973 -9.259 15.419 1.00 2.40 H new ATOM 0 HB3 GLU A 550 6.202 -10.494 15.226 1.00 2.40 H new ATOM 0 HG2 GLU A 550 6.915 -9.668 13.145 1.00 74.24 H new ATOM 0 HG3 GLU A 550 5.365 -8.937 12.779 1.00 74.24 H new ATOM 139 N HIS A 551 3.064 -9.747 12.466 1.00 25.25 N ATOM 140 CA HIS A 551 1.916 -9.022 11.950 1.00 62.02 C ATOM 141 C HIS A 551 0.856 -10.015 11.469 1.00 42.12 C ATOM 142 O HIS A 551 -0.337 -9.717 11.497 1.00 41.14 O ATOM 143 CB HIS A 551 2.342 -8.035 10.861 1.00 71.32 C ATOM 144 CG HIS A 551 2.697 -6.663 11.381 1.00 40.44 C ATOM 145 ND1 HIS A 551 2.979 -5.595 10.546 1.00 11.14 N ATOM 146 CD2 HIS A 551 2.812 -6.195 12.657 1.00 71.12 C ATOM 147 CE1 HIS A 551 3.251 -4.538 11.297 1.00 12.23 C ATOM 148 NE2 HIS A 551 3.147 -4.912 12.605 1.00 43.11 N ATOM 0 H HIS A 551 3.800 -9.924 11.782 1.00 25.25 H new ATOM 0 HA HIS A 551 1.470 -8.425 12.746 1.00 62.02 H new ATOM 0 HB2 HIS A 551 3.201 -8.444 10.330 1.00 71.32 H new ATOM 0 HB3 HIS A 551 1.534 -7.940 10.135 1.00 71.32 H new ATOM 0 HD2 HIS A 551 2.657 -6.771 13.557 1.00 71.12 H new ATOM 0 HE1 HIS A 551 3.510 -3.553 10.937 1.00 12.23 H new ATOM 0 HE2 HIS A 551 3.301 -4.305 13.410 1.00 43.11 H new ATOM 156 N VAL A 552 1.330 -11.175 11.039 1.00 61.11 N ATOM 157 CA VAL A 552 0.438 -12.214 10.552 1.00 1.14 C ATOM 158 C VAL A 552 -0.039 -13.064 11.732 1.00 63.13 C ATOM 159 O VAL A 552 0.770 -13.678 12.426 1.00 0.21 O ATOM 160 CB VAL A 552 1.135 -13.036 9.466 1.00 1.41 C ATOM 161 CG1 VAL A 552 0.312 -14.273 9.102 1.00 25.35 C ATOM 162 CG2 VAL A 552 1.417 -12.181 8.229 1.00 71.34 C ATOM 0 H VAL A 552 2.320 -11.419 11.018 1.00 61.11 H new ATOM 0 HA VAL A 552 -0.445 -11.773 10.090 1.00 1.14 H new ATOM 0 HB VAL A 552 2.091 -13.376 9.864 1.00 1.41 H new ATOM 0 HG11 VAL A 552 0.830 -14.840 8.328 1.00 25.35 H new ATOM 0 HG12 VAL A 552 0.185 -14.898 9.986 1.00 25.35 H new ATOM 0 HG13 VAL A 552 -0.666 -13.964 8.732 1.00 25.35 H new ATOM 0 HG21 VAL A 552 1.913 -12.789 7.472 1.00 71.34 H new ATOM 0 HG22 VAL A 552 0.478 -11.798 7.829 1.00 71.34 H new ATOM 0 HG23 VAL A 552 2.062 -11.346 8.503 1.00 71.34 H new ATOM 172 N GLN A 553 -1.350 -13.073 11.922 1.00 41.13 N ATOM 173 CA GLN A 553 -1.944 -13.838 13.005 1.00 50.41 C ATOM 174 C GLN A 553 -2.684 -15.057 12.450 1.00 11.45 C ATOM 175 O GLN A 553 -3.278 -14.990 11.375 1.00 31.54 O ATOM 176 CB GLN A 553 -2.878 -12.964 13.845 1.00 73.24 C ATOM 177 CG GLN A 553 -3.400 -13.732 15.061 1.00 54.50 C ATOM 178 CD GLN A 553 -3.810 -12.772 16.180 1.00 5.03 C ATOM 179 OE1 GLN A 553 -3.321 -12.835 17.296 1.00 2.34 O ATOM 180 NE2 GLN A 553 -4.731 -11.883 15.821 1.00 50.22 N ATOM 0 H GLN A 553 -2.018 -12.563 11.344 1.00 41.13 H new ATOM 0 HA GLN A 553 -1.145 -14.189 13.657 1.00 50.41 H new ATOM 0 HB2 GLN A 553 -2.347 -12.071 14.175 1.00 73.24 H new ATOM 0 HB3 GLN A 553 -3.716 -12.630 13.234 1.00 73.24 H new ATOM 0 HG2 GLN A 553 -4.254 -14.344 14.770 1.00 54.50 H new ATOM 0 HG3 GLN A 553 -2.630 -14.412 15.424 1.00 54.50 H new ATOM 0 HE21 GLN A 553 -5.099 -11.885 14.870 1.00 50.22 H new ATOM 0 HE22 GLN A 553 -5.070 -11.199 16.497 1.00 50.22 H new ATOM 189 N LEU A 554 -2.624 -16.141 13.209 1.00 31.03 N ATOM 190 CA LEU A 554 -3.281 -17.373 12.807 1.00 32.02 C ATOM 191 C LEU A 554 -4.730 -17.357 13.299 1.00 70.12 C ATOM 192 O LEU A 554 -4.981 -17.366 14.503 1.00 61.41 O ATOM 193 CB LEU A 554 -2.483 -18.587 13.286 1.00 63.10 C ATOM 194 CG LEU A 554 -1.263 -18.963 12.442 1.00 71.11 C ATOM 195 CD1 LEU A 554 -1.080 -20.481 12.389 1.00 72.13 C ATOM 196 CD2 LEU A 554 -1.353 -18.347 11.044 1.00 23.22 C ATOM 0 H LEU A 554 -2.131 -16.192 14.100 1.00 31.03 H new ATOM 0 HA LEU A 554 -3.313 -17.450 11.720 1.00 32.02 H new ATOM 0 HB2 LEU A 554 -2.150 -18.398 14.307 1.00 63.10 H new ATOM 0 HB3 LEU A 554 -3.153 -19.446 13.323 1.00 63.10 H new ATOM 0 HG LEU A 554 -0.376 -18.548 12.920 1.00 71.11 H new ATOM 0 HD11 LEU A 554 -0.206 -20.721 11.783 1.00 72.13 H new ATOM 0 HD12 LEU A 554 -0.938 -20.866 13.399 1.00 72.13 H new ATOM 0 HD13 LEU A 554 -1.965 -20.939 11.947 1.00 72.13 H new ATOM 0 HD21 LEU A 554 -0.474 -18.629 10.465 1.00 23.22 H new ATOM 0 HD22 LEU A 554 -2.250 -18.711 10.543 1.00 23.22 H new ATOM 0 HD23 LEU A 554 -1.399 -17.261 11.127 1.00 23.22 H new ATOM 208 N LEU A 555 -5.646 -17.333 12.342 1.00 62.44 N ATOM 209 CA LEU A 555 -7.063 -17.316 12.662 1.00 20.01 C ATOM 210 C LEU A 555 -7.791 -18.340 11.789 1.00 14.11 C ATOM 211 O LEU A 555 -7.205 -19.008 10.938 1.00 51.32 O ATOM 212 CB LEU A 555 -7.622 -15.897 12.542 1.00 11.11 C ATOM 213 CG LEU A 555 -6.632 -14.761 12.809 1.00 33.23 C ATOM 214 CD1 LEU A 555 -6.199 -14.093 11.503 1.00 11.32 C ATOM 215 CD2 LEU A 555 -7.210 -13.753 13.805 1.00 71.31 C ATOM 0 H LEU A 555 -5.434 -17.325 11.344 1.00 62.44 H new ATOM 0 HA LEU A 555 -7.223 -17.610 13.699 1.00 20.01 H new ATOM 0 HB2 LEU A 555 -8.027 -15.771 11.538 1.00 11.11 H new ATOM 0 HB3 LEU A 555 -8.456 -15.796 13.237 1.00 11.11 H new ATOM 0 HG LEU A 555 -5.738 -15.187 13.264 1.00 33.23 H new ATOM 0 HD11 LEU A 555 -5.496 -13.289 11.721 1.00 11.32 H new ATOM 0 HD12 LEU A 555 -5.719 -14.830 10.859 1.00 11.32 H new ATOM 0 HD13 LEU A 555 -7.073 -13.683 10.997 1.00 11.32 H new ATOM 0 HD21 LEU A 555 -6.487 -12.956 13.977 1.00 71.31 H new ATOM 0 HD22 LEU A 555 -8.129 -13.328 13.401 1.00 71.31 H new ATOM 0 HD23 LEU A 555 -7.427 -14.256 14.747 1.00 71.31 H new ATOM 227 N CYS A 556 -9.096 -18.449 12.021 1.00 22.43 N ATOM 228 CA CYS A 556 -9.930 -19.381 11.273 1.00 34.41 C ATOM 229 C CYS A 556 -10.837 -18.638 10.296 1.00 2.23 C ATOM 230 O CYS A 556 -11.859 -18.098 10.716 1.00 74.11 O ATOM 231 CB CYS A 556 -10.776 -20.223 12.230 1.00 32.23 C ATOM 232 SG CYS A 556 -11.359 -21.796 11.519 1.00 32.34 S ATOM 0 H CYS A 556 -9.598 -17.903 12.721 1.00 22.43 H new ATOM 0 HA CYS A 556 -9.273 -20.039 10.704 1.00 34.41 H new ATOM 0 HB2 CYS A 556 -10.190 -20.436 13.124 1.00 32.23 H new ATOM 0 HB3 CYS A 556 -11.639 -19.637 12.546 1.00 32.23 H new ATOM 0 HG CYS A 556 -12.530 -22.084 12.004 1.00 32.34 H new ATOM 237 N ILE A 557 -10.447 -18.625 9.030 1.00 1.02 N ATOM 238 CA ILE A 557 -11.231 -17.946 8.012 1.00 32.54 C ATOM 239 C ILE A 557 -12.718 -18.084 8.345 1.00 73.13 C ATOM 240 O ILE A 557 -13.504 -17.175 8.080 1.00 61.52 O ATOM 241 CB ILE A 557 -10.862 -18.461 6.620 1.00 70.33 C ATOM 242 CG1 ILE A 557 -11.751 -19.640 6.217 1.00 12.42 C ATOM 243 CG2 ILE A 557 -9.375 -18.812 6.541 1.00 21.55 C ATOM 244 CD1 ILE A 557 -11.491 -20.052 4.767 1.00 74.20 C ATOM 0 H ILE A 557 -9.598 -19.074 8.686 1.00 1.02 H new ATOM 0 HA ILE A 557 -11.003 -16.880 8.003 1.00 32.54 H new ATOM 0 HB ILE A 557 -11.043 -17.661 5.902 1.00 70.33 H new ATOM 0 HG12 ILE A 557 -11.562 -20.485 6.879 1.00 12.42 H new ATOM 0 HG13 ILE A 557 -12.799 -19.368 6.339 1.00 12.42 H new ATOM 0 HG21 ILE A 557 -9.140 -19.176 5.541 1.00 21.55 H new ATOM 0 HG22 ILE A 557 -8.780 -17.924 6.754 1.00 21.55 H new ATOM 0 HG23 ILE A 557 -9.145 -19.587 7.272 1.00 21.55 H new ATOM 0 HD11 ILE A 557 -12.135 -20.892 4.506 1.00 74.20 H new ATOM 0 HD12 ILE A 557 -11.704 -19.212 4.106 1.00 74.20 H new ATOM 0 HD13 ILE A 557 -10.448 -20.347 4.654 1.00 74.20 H new ATOM 256 N ASN A 558 -13.060 -19.228 8.920 1.00 0.41 N ATOM 257 CA ASN A 558 -14.439 -19.496 9.291 1.00 1.13 C ATOM 258 C ASN A 558 -14.791 -18.693 10.545 1.00 5.32 C ATOM 259 O ASN A 558 -15.683 -17.847 10.515 1.00 35.30 O ATOM 260 CB ASN A 558 -14.646 -20.979 9.606 1.00 0.33 C ATOM 261 CG ASN A 558 -15.036 -21.757 8.348 1.00 21.22 C ATOM 262 OD1 ASN A 558 -14.416 -21.650 7.303 1.00 3.40 O ATOM 263 ND2 ASN A 558 -16.096 -22.545 8.506 1.00 24.24 N ATOM 0 H ASN A 558 -12.406 -19.980 9.138 1.00 0.41 H new ATOM 0 HA ASN A 558 -15.075 -19.213 8.452 1.00 1.13 H new ATOM 0 HB2 ASN A 558 -13.731 -21.396 10.027 1.00 0.33 H new ATOM 0 HB3 ASN A 558 -15.424 -21.089 10.362 1.00 0.33 H new ATOM 0 HD21 ASN A 558 -16.435 -23.106 7.725 1.00 24.24 H new ATOM 0 HD22 ASN A 558 -16.570 -22.588 9.408 1.00 24.24 H new ATOM 270 N CYS A 559 -14.070 -18.985 11.618 1.00 60.32 N ATOM 271 CA CYS A 559 -14.295 -18.301 12.880 1.00 44.12 C ATOM 272 C CYS A 559 -13.632 -16.924 12.804 1.00 2.01 C ATOM 273 O CYS A 559 -14.317 -15.903 12.754 1.00 64.51 O ATOM 274 CB CYS A 559 -13.779 -19.118 14.066 1.00 20.10 C ATOM 275 SG CYS A 559 -13.963 -20.930 13.887 1.00 24.04 S ATOM 0 H CYS A 559 -13.330 -19.686 11.639 1.00 60.32 H new ATOM 0 HA CYS A 559 -15.366 -18.180 13.045 1.00 44.12 H new ATOM 0 HB2 CYS A 559 -12.724 -18.887 14.217 1.00 20.10 H new ATOM 0 HB3 CYS A 559 -14.307 -18.800 14.965 1.00 20.10 H new ATOM 0 HG CYS A 559 -14.468 -21.202 12.720 1.00 24.04 H new ATOM 280 N MET A 560 -12.307 -16.940 12.798 1.00 10.23 N ATOM 281 CA MET A 560 -11.544 -15.705 12.730 1.00 71.05 C ATOM 282 C MET A 560 -11.468 -15.030 14.101 1.00 73.33 C ATOM 283 O MET A 560 -11.676 -13.823 14.215 1.00 63.31 O ATOM 284 CB MET A 560 -12.202 -14.754 11.728 1.00 43.41 C ATOM 285 CG MET A 560 -12.508 -15.470 10.411 1.00 32.12 C ATOM 286 SD MET A 560 -13.391 -14.376 9.312 1.00 53.31 S ATOM 287 CE MET A 560 -15.067 -14.898 9.635 1.00 73.22 C ATOM 0 H MET A 560 -11.742 -17.789 12.839 1.00 10.23 H new ATOM 0 HA MET A 560 -10.530 -15.943 12.408 1.00 71.05 H new ATOM 0 HB2 MET A 560 -13.124 -14.355 12.152 1.00 43.41 H new ATOM 0 HB3 MET A 560 -11.544 -13.906 11.540 1.00 43.41 H new ATOM 0 HG2 MET A 560 -11.580 -15.799 9.942 1.00 32.12 H new ATOM 0 HG3 MET A 560 -13.102 -16.363 10.603 1.00 32.12 H new ATOM 0 HE1 MET A 560 -15.733 -14.037 9.579 1.00 73.22 H new ATOM 0 HE2 MET A 560 -15.367 -15.638 8.893 1.00 73.22 H new ATOM 0 HE3 MET A 560 -15.126 -15.338 10.631 1.00 73.22 H new ATOM 297 N VAL A 561 -11.170 -15.839 15.107 1.00 74.10 N ATOM 298 CA VAL A 561 -11.065 -15.335 16.466 1.00 65.42 C ATOM 299 C VAL A 561 -9.623 -15.495 16.953 1.00 11.43 C ATOM 300 O VAL A 561 -9.354 -15.395 18.149 1.00 1.04 O ATOM 301 CB VAL A 561 -12.081 -16.040 17.366 1.00 73.41 C ATOM 302 CG1 VAL A 561 -13.354 -16.385 16.590 1.00 70.20 C ATOM 303 CG2 VAL A 561 -11.473 -17.290 18.006 1.00 74.13 C ATOM 0 H VAL A 561 -10.998 -16.840 15.008 1.00 74.10 H new ATOM 0 HA VAL A 561 -11.305 -14.272 16.499 1.00 65.42 H new ATOM 0 HB VAL A 561 -12.353 -15.352 18.167 1.00 73.41 H new ATOM 0 HG11 VAL A 561 -14.060 -16.885 17.253 1.00 70.20 H new ATOM 0 HG12 VAL A 561 -13.804 -15.470 16.204 1.00 70.20 H new ATOM 0 HG13 VAL A 561 -13.106 -17.045 15.759 1.00 70.20 H new ATOM 0 HG21 VAL A 561 -12.216 -17.772 18.641 1.00 74.13 H new ATOM 0 HG22 VAL A 561 -11.159 -17.982 17.225 1.00 74.13 H new ATOM 0 HG23 VAL A 561 -10.610 -17.007 18.609 1.00 74.13 H new ATOM 313 N ALA A 562 -8.734 -15.739 16.002 1.00 71.31 N ATOM 314 CA ALA A 562 -7.327 -15.913 16.319 1.00 22.34 C ATOM 315 C ALA A 562 -7.150 -17.182 17.157 1.00 54.34 C ATOM 316 O ALA A 562 -7.577 -17.233 18.309 1.00 32.50 O ATOM 317 CB ALA A 562 -6.807 -14.665 17.035 1.00 23.22 C ATOM 0 H ALA A 562 -8.961 -15.820 15.011 1.00 71.31 H new ATOM 0 HA ALA A 562 -6.741 -16.035 15.408 1.00 22.34 H new ATOM 0 HB1 ALA A 562 -5.751 -14.795 17.273 1.00 23.22 H new ATOM 0 HB2 ALA A 562 -6.928 -13.797 16.387 1.00 23.22 H new ATOM 0 HB3 ALA A 562 -7.370 -14.512 17.956 1.00 23.22 H new ATOM 323 N VAL A 563 -6.521 -18.174 16.544 1.00 4.43 N ATOM 324 CA VAL A 563 -6.282 -19.438 17.219 1.00 75.42 C ATOM 325 C VAL A 563 -4.786 -19.589 17.498 1.00 44.14 C ATOM 326 O VAL A 563 -4.365 -20.540 18.154 1.00 34.31 O ATOM 327 CB VAL A 563 -6.855 -20.590 16.389 1.00 2.34 C ATOM 328 CG1 VAL A 563 -8.365 -20.718 16.598 1.00 51.42 C ATOM 329 CG2 VAL A 563 -6.518 -20.418 14.907 1.00 53.51 C ATOM 0 H VAL A 563 -6.170 -18.128 15.587 1.00 4.43 H new ATOM 0 HA VAL A 563 -6.795 -19.460 18.181 1.00 75.42 H new ATOM 0 HB VAL A 563 -6.391 -21.514 16.732 1.00 2.34 H new ATOM 0 HG11 VAL A 563 -8.747 -21.543 15.997 1.00 51.42 H new ATOM 0 HG12 VAL A 563 -8.572 -20.910 17.651 1.00 51.42 H new ATOM 0 HG13 VAL A 563 -8.854 -19.792 16.295 1.00 51.42 H new ATOM 0 HG21 VAL A 563 -6.937 -21.249 14.340 1.00 53.51 H new ATOM 0 HG22 VAL A 563 -6.941 -19.481 14.544 1.00 53.51 H new ATOM 0 HG23 VAL A 563 -5.436 -20.400 14.780 1.00 53.51 H new ATOM 339 N GLY A 564 -4.022 -18.635 16.984 1.00 20.55 N ATOM 340 CA GLY A 564 -2.581 -18.650 17.170 1.00 41.11 C ATOM 341 C GLY A 564 -1.929 -17.442 16.495 1.00 40.43 C ATOM 342 O GLY A 564 -2.596 -16.447 16.216 1.00 13.55 O ATOM 0 H GLY A 564 -4.374 -17.848 16.439 1.00 20.55 H new ATOM 0 HA2 GLY A 564 -2.348 -18.646 18.235 1.00 41.11 H new ATOM 0 HA3 GLY A 564 -2.167 -19.570 16.757 1.00 41.11 H new ATOM 346 N HIS A 565 -0.633 -17.568 16.251 1.00 61.23 N ATOM 347 CA HIS A 565 0.117 -16.499 15.613 1.00 14.14 C ATOM 348 C HIS A 565 0.916 -17.063 14.437 1.00 1.01 C ATOM 349 O HIS A 565 1.215 -18.256 14.400 1.00 54.33 O ATOM 350 CB HIS A 565 0.995 -15.769 16.632 1.00 70.43 C ATOM 351 CG HIS A 565 1.012 -14.269 16.464 1.00 5.33 C ATOM 352 ND1 HIS A 565 -0.140 -13.502 16.455 1.00 44.03 N ATOM 353 CD2 HIS A 565 2.053 -13.402 16.301 1.00 21.22 C ATOM 354 CE1 HIS A 565 0.204 -12.233 16.291 1.00 11.15 C ATOM 355 NE2 HIS A 565 1.563 -12.173 16.196 1.00 23.10 N ATOM 0 H HIS A 565 -0.083 -18.395 16.484 1.00 61.23 H new ATOM 0 HA HIS A 565 -0.572 -15.754 15.214 1.00 14.14 H new ATOM 0 HB2 HIS A 565 0.644 -16.008 17.636 1.00 70.43 H new ATOM 0 HB3 HIS A 565 2.015 -16.145 16.553 1.00 70.43 H new ATOM 0 HD2 HIS A 565 3.098 -13.670 16.264 1.00 21.22 H new ATOM 0 HE1 HIS A 565 -0.473 -11.393 16.241 1.00 11.15 H new ATOM 0 HE2 HIS A 565 2.112 -11.324 16.066 1.00 23.10 H new ATOM 363 N GLY A 566 1.240 -16.179 13.505 1.00 11.21 N ATOM 364 CA GLY A 566 1.999 -16.573 12.331 1.00 71.34 C ATOM 365 C GLY A 566 3.487 -16.709 12.659 1.00 20.05 C ATOM 366 O GLY A 566 4.276 -17.137 11.818 1.00 11.41 O ATOM 0 H GLY A 566 0.990 -15.191 13.539 1.00 11.21 H new ATOM 0 HA2 GLY A 566 1.619 -17.521 11.949 1.00 71.34 H new ATOM 0 HA3 GLY A 566 1.863 -15.834 11.541 1.00 71.34 H new ATOM 370 N SER A 567 3.826 -16.337 13.885 1.00 12.11 N ATOM 371 CA SER A 567 5.205 -16.412 14.336 1.00 42.34 C ATOM 372 C SER A 567 5.364 -17.547 15.349 1.00 11.22 C ATOM 373 O SER A 567 6.399 -17.658 16.005 1.00 73.53 O ATOM 374 CB SER A 567 5.657 -15.085 14.949 1.00 32.14 C ATOM 375 OG SER A 567 7.073 -14.933 14.910 1.00 23.52 O ATOM 0 H SER A 567 3.169 -15.983 14.580 1.00 12.11 H new ATOM 0 HA SER A 567 5.837 -16.615 13.471 1.00 42.34 H new ATOM 0 HB2 SER A 567 5.189 -14.260 14.412 1.00 32.14 H new ATOM 0 HB3 SER A 567 5.315 -15.028 15.982 1.00 32.14 H new ATOM 0 HG SER A 567 7.499 -15.742 15.264 1.00 23.52 H new ATOM 381 N ASP A 568 4.323 -18.361 15.446 1.00 52.50 N ATOM 382 CA ASP A 568 4.333 -19.483 16.369 1.00 65.04 C ATOM 383 C ASP A 568 4.392 -20.790 15.575 1.00 43.43 C ATOM 384 O ASP A 568 5.003 -21.762 16.017 1.00 54.23 O ATOM 385 CB ASP A 568 3.065 -19.506 17.223 1.00 14.20 C ATOM 386 CG ASP A 568 3.047 -18.506 18.381 1.00 32.22 C ATOM 387 OD1 ASP A 568 4.090 -18.203 18.980 1.00 72.44 O ATOM 388 OD2 ASP A 568 1.885 -18.024 18.667 1.00 20.15 O ATOM 0 H ASP A 568 3.467 -18.266 14.900 1.00 52.50 H new ATOM 0 HA ASP A 568 5.202 -19.377 17.018 1.00 65.04 H new ATOM 0 HB2 ASP A 568 2.208 -19.309 16.579 1.00 14.20 H new ATOM 0 HB3 ASP A 568 2.936 -20.510 17.628 1.00 14.20 H new ATOM 394 N LEU A 569 3.750 -20.770 14.416 1.00 34.33 N ATOM 395 CA LEU A 569 3.721 -21.941 13.557 1.00 61.44 C ATOM 396 C LEU A 569 5.042 -22.039 12.791 1.00 24.34 C ATOM 397 O LEU A 569 5.753 -21.046 12.643 1.00 21.33 O ATOM 398 CB LEU A 569 2.487 -21.912 12.652 1.00 24.32 C ATOM 399 CG LEU A 569 2.277 -20.629 11.846 1.00 13.02 C ATOM 400 CD1 LEU A 569 3.616 -19.993 11.468 1.00 72.34 C ATOM 401 CD2 LEU A 569 1.399 -20.889 10.620 1.00 32.25 C ATOM 0 H LEU A 569 3.246 -19.961 14.052 1.00 34.33 H new ATOM 0 HA LEU A 569 3.629 -22.848 14.154 1.00 61.44 H new ATOM 0 HB2 LEU A 569 2.552 -22.748 11.956 1.00 24.32 H new ATOM 0 HB3 LEU A 569 1.604 -22.078 13.269 1.00 24.32 H new ATOM 0 HG LEU A 569 1.748 -19.914 12.475 1.00 13.02 H new ATOM 0 HD11 LEU A 569 3.438 -19.083 10.896 1.00 72.34 H new ATOM 0 HD12 LEU A 569 4.172 -19.749 12.374 1.00 72.34 H new ATOM 0 HD13 LEU A 569 4.194 -20.693 10.865 1.00 72.34 H new ATOM 0 HD21 LEU A 569 1.265 -19.961 10.065 1.00 32.25 H new ATOM 0 HD22 LEU A 569 1.878 -21.629 9.980 1.00 32.25 H new ATOM 0 HD23 LEU A 569 0.427 -21.263 10.941 1.00 32.25 H new ATOM 413 N ARG A 570 5.332 -23.245 12.325 1.00 34.35 N ATOM 414 CA ARG A 570 6.555 -23.486 11.579 1.00 10.22 C ATOM 415 C ARG A 570 6.253 -24.278 10.305 1.00 12.34 C ATOM 416 O ARG A 570 5.091 -24.492 9.964 1.00 15.34 O ATOM 417 CB ARG A 570 7.572 -24.258 12.422 1.00 13.04 C ATOM 418 CG ARG A 570 7.596 -23.740 13.862 1.00 60.20 C ATOM 419 CD ARG A 570 8.350 -24.706 14.779 1.00 12.41 C ATOM 420 NE ARG A 570 7.463 -25.820 15.179 1.00 35.51 N ATOM 421 CZ ARG A 570 7.362 -26.987 14.506 1.00 11.52 C ATOM 422 NH1 ARG A 570 8.094 -27.200 13.392 1.00 24.25 N ATOM 423 NH2 ARG A 570 6.537 -27.914 14.954 1.00 74.55 N ATOM 0 H ARG A 570 4.740 -24.066 12.450 1.00 34.35 H new ATOM 0 HA ARG A 570 6.979 -22.517 11.316 1.00 10.22 H new ATOM 0 HB2 ARG A 570 7.323 -25.319 12.417 1.00 13.04 H new ATOM 0 HB3 ARG A 570 8.564 -24.162 11.980 1.00 13.04 H new ATOM 0 HG2 ARG A 570 8.071 -22.759 13.892 1.00 60.20 H new ATOM 0 HG3 ARG A 570 6.576 -23.611 14.223 1.00 60.20 H new ATOM 0 HD2 ARG A 570 9.229 -25.096 14.266 1.00 12.41 H new ATOM 0 HD3 ARG A 570 8.706 -24.178 15.664 1.00 12.41 H new ATOM 0 HE ARG A 570 6.892 -25.700 16.015 1.00 35.51 H new ATOM 0 HH11 ARG A 570 8.729 -26.477 13.053 1.00 24.25 H new ATOM 0 HH12 ARG A 570 8.012 -28.084 12.889 1.00 24.25 H new ATOM 0 HH21 ARG A 570 5.988 -27.744 15.796 1.00 74.55 H new ATOM 0 HH22 ARG A 570 6.449 -28.801 14.458 1.00 74.55 H new ATOM 436 N LYS A 571 7.319 -24.691 9.637 1.00 63.12 N ATOM 437 CA LYS A 571 7.183 -25.455 8.408 1.00 13.31 C ATOM 438 C LYS A 571 8.110 -26.670 8.462 1.00 23.35 C ATOM 439 O LYS A 571 9.328 -26.531 8.361 1.00 22.23 O ATOM 440 CB LYS A 571 7.416 -24.557 7.191 1.00 74.30 C ATOM 441 CG LYS A 571 7.462 -25.382 5.903 1.00 53.32 C ATOM 442 CD LYS A 571 8.456 -24.785 4.905 1.00 40.50 C ATOM 443 CE LYS A 571 8.304 -23.264 4.823 1.00 25.32 C ATOM 444 NZ LYS A 571 8.649 -22.781 3.467 1.00 31.32 N ATOM 0 H LYS A 571 8.281 -24.511 9.923 1.00 63.12 H new ATOM 0 HA LYS A 571 6.166 -25.834 8.306 1.00 13.31 H new ATOM 0 HB2 LYS A 571 6.620 -23.815 7.124 1.00 74.30 H new ATOM 0 HB3 LYS A 571 8.352 -24.011 7.311 1.00 74.30 H new ATOM 0 HG2 LYS A 571 7.746 -26.409 6.134 1.00 53.32 H new ATOM 0 HG3 LYS A 571 6.469 -25.419 5.455 1.00 53.32 H new ATOM 0 HD2 LYS A 571 9.473 -25.037 5.205 1.00 40.50 H new ATOM 0 HD3 LYS A 571 8.296 -25.224 3.920 1.00 40.50 H new ATOM 0 HE2 LYS A 571 7.280 -22.981 5.067 1.00 25.32 H new ATOM 0 HE3 LYS A 571 8.950 -22.788 5.560 1.00 25.32 H new ATOM 0 HZ1 LYS A 571 8.541 -21.747 3.429 1.00 31.32 H new ATOM 0 HZ2 LYS A 571 9.634 -23.034 3.248 1.00 31.32 H new ATOM 0 HZ3 LYS A 571 8.015 -23.222 2.770 1.00 31.32 H new ATOM 457 N VAL A 572 7.499 -27.835 8.622 1.00 15.41 N ATOM 458 CA VAL A 572 8.254 -29.074 8.691 1.00 2.21 C ATOM 459 C VAL A 572 8.635 -29.513 7.276 1.00 71.41 C ATOM 460 O VAL A 572 7.773 -29.905 6.491 1.00 52.03 O ATOM 461 CB VAL A 572 7.454 -30.133 9.451 1.00 32.22 C ATOM 462 CG1 VAL A 572 7.830 -31.542 8.988 1.00 42.12 C ATOM 463 CG2 VAL A 572 7.643 -29.984 10.962 1.00 22.01 C ATOM 0 H VAL A 572 6.489 -27.947 8.706 1.00 15.41 H new ATOM 0 HA VAL A 572 9.180 -28.926 9.246 1.00 2.21 H new ATOM 0 HB VAL A 572 6.398 -29.978 9.229 1.00 32.22 H new ATOM 0 HG11 VAL A 572 7.247 -32.276 9.544 1.00 42.12 H new ATOM 0 HG12 VAL A 572 7.620 -31.643 7.923 1.00 42.12 H new ATOM 0 HG13 VAL A 572 8.892 -31.712 9.166 1.00 42.12 H new ATOM 0 HG21 VAL A 572 7.063 -30.749 11.478 1.00 22.01 H new ATOM 0 HG22 VAL A 572 8.698 -30.099 11.210 1.00 22.01 H new ATOM 0 HG23 VAL A 572 7.302 -28.997 11.276 1.00 22.01 H new ATOM 473 N GLU A 573 9.927 -29.434 6.993 1.00 11.24 N ATOM 474 CA GLU A 573 10.432 -29.819 5.687 1.00 42.45 C ATOM 475 C GLU A 573 9.415 -29.466 4.599 1.00 22.12 C ATOM 476 O GLU A 573 9.160 -30.266 3.700 1.00 45.42 O ATOM 477 CB GLU A 573 10.780 -31.308 5.650 1.00 71.11 C ATOM 478 CG GLU A 573 9.612 -32.156 6.156 1.00 34.43 C ATOM 479 CD GLU A 573 9.786 -33.623 5.758 1.00 24.55 C ATOM 480 OE1 GLU A 573 9.746 -34.510 6.625 1.00 42.22 O ATOM 481 OE2 GLU A 573 9.968 -33.829 4.498 1.00 45.40 O ATOM 0 H GLU A 573 10.639 -29.109 7.647 1.00 11.24 H new ATOM 0 HA GLU A 573 11.348 -29.261 5.495 1.00 42.45 H new ATOM 0 HB2 GLU A 573 11.032 -31.601 4.631 1.00 71.11 H new ATOM 0 HB3 GLU A 573 11.662 -31.494 6.263 1.00 71.11 H new ATOM 0 HG2 GLU A 573 9.543 -32.076 7.241 1.00 34.43 H new ATOM 0 HG3 GLU A 573 8.677 -31.773 5.748 1.00 34.43 H new ATOM 489 N GLY A 574 8.861 -28.268 4.718 1.00 63.44 N ATOM 490 CA GLY A 574 7.878 -27.800 3.756 1.00 73.20 C ATOM 491 C GLY A 574 7.006 -28.954 3.258 1.00 74.44 C ATOM 492 O GLY A 574 6.848 -29.142 2.052 1.00 34.23 O ATOM 0 H GLY A 574 9.074 -27.608 5.466 1.00 63.44 H new ATOM 0 HA2 GLY A 574 7.250 -27.036 4.215 1.00 73.20 H new ATOM 0 HA3 GLY A 574 8.384 -27.331 2.912 1.00 73.20 H new ATOM 496 N THR A 575 6.462 -29.698 4.210 1.00 3.45 N ATOM 497 CA THR A 575 5.610 -30.828 3.883 1.00 22.24 C ATOM 498 C THR A 575 4.197 -30.605 4.424 1.00 54.41 C ATOM 499 O THR A 575 3.215 -30.926 3.756 1.00 12.22 O ATOM 500 CB THR A 575 6.275 -32.094 4.427 1.00 64.30 C ATOM 501 OG1 THR A 575 7.304 -32.379 3.483 1.00 51.13 O ATOM 502 CG2 THR A 575 5.356 -33.315 4.356 1.00 21.31 C ATOM 0 H THR A 575 6.595 -29.540 5.209 1.00 3.45 H new ATOM 0 HA THR A 575 5.498 -30.939 2.805 1.00 22.24 H new ATOM 0 HB THR A 575 6.579 -31.928 5.460 1.00 64.30 H new ATOM 0 HG1 THR A 575 7.981 -31.671 3.513 1.00 51.13 H new ATOM 0 HG21 THR A 575 5.877 -34.186 4.754 1.00 21.31 H new ATOM 0 HG22 THR A 575 4.458 -33.129 4.944 1.00 21.31 H new ATOM 0 HG23 THR A 575 5.078 -33.501 3.319 1.00 21.31 H new ATOM 510 N HIS A 576 4.138 -30.055 5.628 1.00 20.31 N ATOM 511 CA HIS A 576 2.861 -29.785 6.266 1.00 12.21 C ATOM 512 C HIS A 576 3.055 -28.770 7.394 1.00 4.13 C ATOM 513 O HIS A 576 3.694 -29.071 8.402 1.00 42.45 O ATOM 514 CB HIS A 576 2.206 -31.083 6.743 1.00 50.14 C ATOM 515 CG HIS A 576 1.245 -31.688 5.747 1.00 43.33 C ATOM 516 ND1 HIS A 576 1.408 -32.959 5.225 1.00 30.44 N ATOM 517 CD2 HIS A 576 0.110 -31.183 5.184 1.00 42.14 C ATOM 518 CE1 HIS A 576 0.411 -33.198 4.387 1.00 74.33 C ATOM 519 NE2 HIS A 576 -0.392 -32.096 4.362 1.00 53.03 N ATOM 0 H HIS A 576 4.954 -29.789 6.179 1.00 20.31 H new ATOM 0 HA HIS A 576 2.175 -29.345 5.542 1.00 12.21 H new ATOM 0 HB2 HIS A 576 2.986 -31.810 6.968 1.00 50.14 H new ATOM 0 HB3 HIS A 576 1.674 -30.889 7.674 1.00 50.14 H new ATOM 0 HD2 HIS A 576 -0.309 -30.206 5.375 1.00 42.14 H new ATOM 0 HE1 HIS A 576 0.260 -34.106 3.822 1.00 74.33 H new ATOM 0 HE2 HIS A 576 -1.239 -31.991 3.803 1.00 53.03 H new ATOM 527 N HIS A 577 2.493 -27.588 7.187 1.00 33.45 N ATOM 528 CA HIS A 577 2.596 -26.527 8.175 1.00 62.14 C ATOM 529 C HIS A 577 1.839 -26.929 9.442 1.00 60.32 C ATOM 530 O HIS A 577 0.629 -27.146 9.404 1.00 71.11 O ATOM 531 CB HIS A 577 2.115 -25.196 7.594 1.00 70.14 C ATOM 532 CG HIS A 577 2.761 -24.830 6.279 1.00 63.54 C ATOM 533 ND1 HIS A 577 3.865 -24.001 6.191 1.00 4.40 N ATOM 534 CD2 HIS A 577 2.448 -25.191 5.001 1.00 41.00 C ATOM 535 CE1 HIS A 577 4.193 -23.874 4.914 1.00 52.54 C ATOM 536 NE2 HIS A 577 3.313 -24.612 4.178 1.00 51.44 N ATOM 0 H HIS A 577 1.965 -27.342 6.350 1.00 33.45 H new ATOM 0 HA HIS A 577 3.641 -26.381 8.450 1.00 62.14 H new ATOM 0 HB2 HIS A 577 1.035 -25.241 7.456 1.00 70.14 H new ATOM 0 HB3 HIS A 577 2.312 -24.404 8.316 1.00 70.14 H new ATOM 0 HD1 HIS A 577 4.345 -23.562 6.977 1.00 4.40 H new ATOM 0 HD2 HIS A 577 1.634 -25.838 4.709 1.00 41.00 H new ATOM 0 HE1 HIS A 577 5.013 -23.289 4.524 1.00 52.54 H new ATOM 544 N VAL A 578 2.583 -27.017 10.534 1.00 2.35 N ATOM 545 CA VAL A 578 1.997 -27.389 11.811 1.00 25.01 C ATOM 546 C VAL A 578 2.224 -26.261 12.819 1.00 13.25 C ATOM 547 O VAL A 578 3.358 -25.994 13.214 1.00 51.14 O ATOM 548 CB VAL A 578 2.567 -28.730 12.277 1.00 63.41 C ATOM 549 CG1 VAL A 578 2.442 -29.790 11.180 1.00 10.23 C ATOM 550 CG2 VAL A 578 4.021 -28.581 12.731 1.00 15.44 C ATOM 0 H VAL A 578 3.587 -26.837 10.561 1.00 2.35 H new ATOM 0 HA VAL A 578 0.920 -27.525 11.712 1.00 25.01 H new ATOM 0 HB VAL A 578 1.981 -29.063 13.134 1.00 63.41 H new ATOM 0 HG11 VAL A 578 2.855 -30.734 11.537 1.00 10.23 H new ATOM 0 HG12 VAL A 578 1.391 -29.927 10.924 1.00 10.23 H new ATOM 0 HG13 VAL A 578 2.991 -29.465 10.296 1.00 10.23 H new ATOM 0 HG21 VAL A 578 4.401 -29.549 13.057 1.00 15.44 H new ATOM 0 HG22 VAL A 578 4.625 -28.214 11.901 1.00 15.44 H new ATOM 0 HG23 VAL A 578 4.073 -27.873 13.558 1.00 15.44 H new ATOM 560 N ASN A 579 1.126 -25.629 13.208 1.00 0.21 N ATOM 561 CA ASN A 579 1.190 -24.535 14.163 1.00 63.40 C ATOM 562 C ASN A 579 1.360 -25.105 15.573 1.00 41.21 C ATOM 563 O ASN A 579 0.486 -25.814 16.069 1.00 2.23 O ATOM 564 CB ASN A 579 -0.096 -23.707 14.139 1.00 22.23 C ATOM 565 CG ASN A 579 -0.154 -22.751 15.333 1.00 75.53 C ATOM 566 OD1 ASN A 579 -1.204 -22.479 15.892 1.00 71.11 O ATOM 567 ND2 ASN A 579 1.028 -22.259 15.690 1.00 1.00 N ATOM 0 H ASN A 579 0.187 -25.854 12.879 1.00 0.21 H new ATOM 0 HA ASN A 579 2.033 -23.899 13.892 1.00 63.40 H new ATOM 0 HB2 ASN A 579 -0.150 -23.139 13.210 1.00 22.23 H new ATOM 0 HB3 ASN A 579 -0.961 -24.371 14.157 1.00 22.23 H new ATOM 0 HD21 ASN A 579 1.095 -21.612 16.476 1.00 1.00 H new ATOM 0 HD22 ASN A 579 1.868 -22.529 15.178 1.00 1.00 H new ATOM 574 N VAL A 580 2.491 -24.773 16.178 1.00 30.13 N ATOM 575 CA VAL A 580 2.787 -25.242 17.521 1.00 34.53 C ATOM 576 C VAL A 580 2.293 -24.211 18.538 1.00 75.13 C ATOM 577 O VAL A 580 2.657 -23.038 18.465 1.00 74.55 O ATOM 578 CB VAL A 580 4.281 -25.544 17.653 1.00 11.43 C ATOM 579 CG1 VAL A 580 4.592 -26.191 19.004 1.00 63.31 C ATOM 580 CG2 VAL A 580 4.767 -26.422 16.499 1.00 42.23 C ATOM 0 H VAL A 580 3.213 -24.185 15.763 1.00 30.13 H new ATOM 0 HA VAL A 580 2.262 -26.175 17.723 1.00 34.53 H new ATOM 0 HB VAL A 580 4.820 -24.598 17.603 1.00 11.43 H new ATOM 0 HG11 VAL A 580 5.660 -26.395 19.072 1.00 63.31 H new ATOM 0 HG12 VAL A 580 4.300 -25.514 19.807 1.00 63.31 H new ATOM 0 HG13 VAL A 580 4.037 -27.125 19.097 1.00 63.31 H new ATOM 0 HG21 VAL A 580 5.832 -26.622 16.617 1.00 42.23 H new ATOM 0 HG22 VAL A 580 4.219 -27.364 16.503 1.00 42.23 H new ATOM 0 HG23 VAL A 580 4.597 -25.907 15.553 1.00 42.23 H new ATOM 590 N ASN A 581 1.471 -24.685 19.462 1.00 33.44 N ATOM 591 CA ASN A 581 0.923 -23.819 20.492 1.00 30.03 C ATOM 592 C ASN A 581 0.138 -24.663 21.498 1.00 33.11 C ATOM 593 O ASN A 581 -0.622 -25.549 21.111 1.00 71.52 O ATOM 594 CB ASN A 581 -0.034 -22.787 19.892 1.00 2.02 C ATOM 595 CG ASN A 581 0.713 -21.510 19.500 1.00 34.20 C ATOM 596 OD1 ASN A 581 0.769 -21.123 18.344 1.00 31.33 O ATOM 597 ND2 ASN A 581 1.281 -20.880 20.524 1.00 52.31 N ATOM 0 H ASN A 581 1.171 -25.658 19.519 1.00 33.44 H new ATOM 0 HA ASN A 581 1.753 -23.303 20.975 1.00 30.03 H new ATOM 0 HB2 ASN A 581 -0.526 -23.208 19.015 1.00 2.02 H new ATOM 0 HB3 ASN A 581 -0.816 -22.549 20.613 1.00 2.02 H new ATOM 0 HD21 ASN A 581 1.803 -20.018 20.366 1.00 52.31 H new ATOM 0 HD22 ASN A 581 1.195 -21.259 21.467 1.00 52.31 H new ATOM 604 N PRO A 582 0.354 -24.350 22.804 1.00 54.12 N ATOM 605 CA PRO A 582 -0.325 -25.069 23.868 1.00 31.42 C ATOM 606 C PRO A 582 -1.790 -24.641 23.972 1.00 74.22 C ATOM 607 O PRO A 582 -2.661 -25.460 24.262 1.00 71.24 O ATOM 608 CB PRO A 582 0.474 -24.761 25.124 1.00 42.34 C ATOM 609 CG PRO A 582 1.288 -23.517 24.804 1.00 20.23 C ATOM 610 CD PRO A 582 1.246 -23.306 23.300 1.00 63.44 C ATOM 0 HA PRO A 582 -0.364 -26.144 23.690 1.00 31.42 H new ATOM 0 HB2 PRO A 582 -0.186 -24.588 25.974 1.00 42.34 H new ATOM 0 HB3 PRO A 582 1.123 -25.596 25.389 1.00 42.34 H new ATOM 0 HG2 PRO A 582 0.879 -22.650 25.323 1.00 20.23 H new ATOM 0 HG3 PRO A 582 2.317 -23.636 25.144 1.00 20.23 H new ATOM 0 HD2 PRO A 582 0.872 -22.313 23.050 1.00 63.44 H new ATOM 0 HD3 PRO A 582 2.240 -23.392 22.860 1.00 63.44 H new ATOM 618 N ASN A 583 -2.017 -23.359 23.729 1.00 14.43 N ATOM 619 CA ASN A 583 -3.362 -22.812 23.792 1.00 52.25 C ATOM 620 C ASN A 583 -4.148 -23.261 22.558 1.00 34.34 C ATOM 621 O ASN A 583 -5.348 -23.007 22.456 1.00 65.23 O ATOM 622 CB ASN A 583 -3.335 -21.282 23.803 1.00 23.20 C ATOM 623 CG ASN A 583 -2.095 -20.761 24.533 1.00 33.55 C ATOM 624 OD1 ASN A 583 -1.211 -20.153 23.954 1.00 60.05 O ATOM 625 ND2 ASN A 583 -2.080 -21.034 25.835 1.00 14.52 N ATOM 0 H ASN A 583 -1.292 -22.683 23.488 1.00 14.43 H new ATOM 0 HA ASN A 583 -3.829 -23.171 24.709 1.00 52.25 H new ATOM 0 HB2 ASN A 583 -3.343 -20.907 22.780 1.00 23.20 H new ATOM 0 HB3 ASN A 583 -4.234 -20.902 24.289 1.00 23.20 H new ATOM 0 HD21 ASN A 583 -1.295 -20.730 26.411 1.00 14.52 H new ATOM 0 HD22 ASN A 583 -2.853 -21.548 26.257 1.00 14.52 H new ATOM 632 N PHE A 584 -3.441 -23.921 21.653 1.00 30.53 N ATOM 633 CA PHE A 584 -4.058 -24.409 20.431 1.00 3.32 C ATOM 634 C PHE A 584 -4.971 -25.603 20.716 1.00 23.11 C ATOM 635 O PHE A 584 -5.997 -25.775 20.060 1.00 64.24 O ATOM 636 CB PHE A 584 -2.924 -24.857 19.506 1.00 35.44 C ATOM 637 CG PHE A 584 -3.236 -24.696 18.017 1.00 22.11 C ATOM 638 CD1 PHE A 584 -3.317 -23.454 17.470 1.00 1.40 C ATOM 639 CD2 PHE A 584 -3.431 -25.795 17.240 1.00 35.24 C ATOM 640 CE1 PHE A 584 -3.606 -23.304 16.088 1.00 40.11 C ATOM 641 CE2 PHE A 584 -3.721 -25.645 15.858 1.00 24.52 C ATOM 642 CZ PHE A 584 -3.802 -24.403 15.311 1.00 3.11 C ATOM 0 H PHE A 584 -2.446 -24.129 21.741 1.00 30.53 H new ATOM 0 HA PHE A 584 -4.664 -23.623 19.980 1.00 3.32 H new ATOM 0 HB2 PHE A 584 -2.028 -24.284 19.743 1.00 35.44 H new ATOM 0 HB3 PHE A 584 -2.696 -25.904 19.708 1.00 35.44 H new ATOM 0 HD1 PHE A 584 -3.161 -22.581 18.087 1.00 1.40 H new ATOM 0 HD2 PHE A 584 -3.365 -26.782 17.674 1.00 35.24 H new ATOM 0 HE1 PHE A 584 -3.670 -22.317 15.654 1.00 40.11 H new ATOM 0 HE2 PHE A 584 -3.877 -26.518 15.241 1.00 24.52 H new ATOM 0 HZ PHE A 584 -4.022 -24.289 14.260 1.00 3.11 H new ATOM 652 N SER A 585 -4.564 -26.397 21.696 1.00 74.23 N ATOM 653 CA SER A 585 -5.333 -27.570 22.076 1.00 70.44 C ATOM 654 C SER A 585 -6.756 -27.161 22.462 1.00 61.35 C ATOM 655 O SER A 585 -7.686 -27.958 22.350 1.00 35.03 O ATOM 656 CB SER A 585 -4.664 -28.317 23.231 1.00 45.00 C ATOM 657 OG SER A 585 -5.577 -29.170 23.916 1.00 63.12 O ATOM 0 H SER A 585 -3.712 -26.251 22.238 1.00 74.23 H new ATOM 0 HA SER A 585 -5.375 -28.243 21.220 1.00 70.44 H new ATOM 0 HB2 SER A 585 -3.833 -28.909 22.847 1.00 45.00 H new ATOM 0 HB3 SER A 585 -4.244 -27.597 23.933 1.00 45.00 H new ATOM 0 HG SER A 585 -5.111 -29.630 24.645 1.00 63.12 H new ATOM 663 N ASN A 586 -6.880 -25.920 22.907 1.00 11.22 N ATOM 664 CA ASN A 586 -8.174 -25.395 23.310 1.00 21.33 C ATOM 665 C ASN A 586 -8.885 -24.810 22.089 1.00 73.24 C ATOM 666 O ASN A 586 -10.098 -24.605 22.111 1.00 2.22 O ATOM 667 CB ASN A 586 -8.018 -24.280 24.346 1.00 44.34 C ATOM 668 CG ASN A 586 -8.005 -24.848 25.766 1.00 13.21 C ATOM 669 OD1 ASN A 586 -8.996 -24.830 26.478 1.00 21.31 O ATOM 670 ND2 ASN A 586 -6.831 -25.351 26.137 1.00 15.03 N ATOM 0 H ASN A 586 -6.106 -25.262 22.998 1.00 11.22 H new ATOM 0 HA ASN A 586 -8.749 -26.213 23.745 1.00 21.33 H new ATOM 0 HB2 ASN A 586 -7.093 -23.734 24.161 1.00 44.34 H new ATOM 0 HB3 ASN A 586 -8.836 -23.567 24.243 1.00 44.34 H new ATOM 0 HD21 ASN A 586 -6.720 -25.754 27.067 1.00 15.03 H new ATOM 0 HD22 ASN A 586 -6.042 -25.334 25.491 1.00 15.03 H new ATOM 677 N TYR A 587 -8.101 -24.559 21.051 1.00 3.51 N ATOM 678 CA TYR A 587 -8.640 -24.001 19.822 1.00 34.25 C ATOM 679 C TYR A 587 -9.053 -25.110 18.852 1.00 1.02 C ATOM 680 O TYR A 587 -9.452 -24.834 17.722 1.00 44.12 O ATOM 681 CB TYR A 587 -7.507 -23.187 19.195 1.00 11.24 C ATOM 682 CG TYR A 587 -7.460 -21.729 19.656 1.00 52.50 C ATOM 683 CD1 TYR A 587 -8.627 -20.998 19.755 1.00 60.15 C ATOM 684 CD2 TYR A 587 -6.251 -21.143 19.973 1.00 60.41 C ATOM 685 CE1 TYR A 587 -8.583 -19.626 20.188 1.00 42.40 C ATOM 686 CE2 TYR A 587 -6.207 -19.771 20.406 1.00 2.13 C ATOM 687 CZ TYR A 587 -7.375 -19.080 20.492 1.00 1.34 C ATOM 688 OH TYR A 587 -7.333 -17.783 20.902 1.00 72.52 O ATOM 0 H TYR A 587 -7.096 -24.732 21.036 1.00 3.51 H new ATOM 0 HA TYR A 587 -9.523 -23.396 20.030 1.00 34.25 H new ATOM 0 HB2 TYR A 587 -6.556 -23.664 19.433 1.00 11.24 H new ATOM 0 HB3 TYR A 587 -7.613 -23.211 18.110 1.00 11.24 H new ATOM 0 HD1 TYR A 587 -9.573 -21.456 19.507 1.00 60.15 H new ATOM 0 HD2 TYR A 587 -5.338 -21.714 19.896 1.00 60.41 H new ATOM 0 HE1 TYR A 587 -9.489 -19.043 20.270 1.00 42.40 H new ATOM 0 HE2 TYR A 587 -5.268 -19.301 20.657 1.00 2.13 H new ATOM 0 HH TYR A 587 -7.405 -17.191 20.124 1.00 72.52 H new ATOM 698 N TYR A 588 -8.943 -26.341 19.329 1.00 21.14 N ATOM 699 CA TYR A 588 -9.300 -27.493 18.518 1.00 4.33 C ATOM 700 C TYR A 588 -9.465 -28.743 19.384 1.00 34.13 C ATOM 701 O TYR A 588 -8.944 -28.806 20.497 1.00 52.33 O ATOM 702 CB TYR A 588 -8.132 -27.707 17.553 1.00 1.51 C ATOM 703 CG TYR A 588 -6.961 -28.486 18.156 1.00 52.43 C ATOM 704 CD1 TYR A 588 -7.107 -29.824 18.461 1.00 1.41 C ATOM 705 CD2 TYR A 588 -5.759 -27.850 18.394 1.00 32.40 C ATOM 706 CE1 TYR A 588 -6.005 -30.557 19.028 1.00 10.23 C ATOM 707 CE2 TYR A 588 -4.657 -28.584 18.961 1.00 13.32 C ATOM 708 CZ TYR A 588 -4.835 -29.901 19.250 1.00 4.34 C ATOM 709 OH TYR A 588 -3.794 -30.593 19.786 1.00 21.21 O ATOM 0 H TYR A 588 -8.612 -26.566 20.267 1.00 21.14 H new ATOM 0 HA TYR A 588 -10.244 -27.321 18.001 1.00 4.33 H new ATOM 0 HB2 TYR A 588 -8.494 -28.239 16.673 1.00 1.51 H new ATOM 0 HB3 TYR A 588 -7.772 -26.736 17.213 1.00 1.51 H new ATOM 0 HD1 TYR A 588 -8.047 -30.321 18.274 1.00 1.41 H new ATOM 0 HD2 TYR A 588 -5.645 -26.803 18.155 1.00 32.40 H new ATOM 0 HE1 TYR A 588 -6.106 -31.604 19.271 1.00 10.23 H new ATOM 0 HE2 TYR A 588 -3.711 -28.100 19.152 1.00 13.32 H new ATOM 0 HH TYR A 588 -3.023 -29.997 19.888 1.00 21.21 H new ATOM 719 N ASN A 589 -10.193 -29.708 18.841 1.00 13.22 N ATOM 720 CA ASN A 589 -10.434 -30.953 19.550 1.00 13.03 C ATOM 721 C ASN A 589 -10.216 -32.129 18.596 1.00 55.21 C ATOM 722 O ASN A 589 -10.778 -32.158 17.502 1.00 15.52 O ATOM 723 CB ASN A 589 -11.873 -31.023 20.066 1.00 22.34 C ATOM 724 CG ASN A 589 -12.083 -30.060 21.236 1.00 13.03 C ATOM 725 OD1 ASN A 589 -11.890 -30.396 22.393 1.00 3.32 O ATOM 726 ND2 ASN A 589 -12.490 -28.847 20.872 1.00 23.20 N ATOM 0 H ASN A 589 -10.624 -29.653 17.918 1.00 13.22 H new ATOM 0 HA ASN A 589 -9.745 -30.999 20.394 1.00 13.03 H new ATOM 0 HB2 ASN A 589 -12.565 -30.778 19.260 1.00 22.34 H new ATOM 0 HB3 ASN A 589 -12.101 -32.041 20.383 1.00 22.34 H new ATOM 0 HD21 ASN A 589 -12.660 -28.132 21.580 1.00 23.20 H new ATOM 0 HD22 ASN A 589 -12.632 -28.632 19.885 1.00 23.20 H new ATOM 733 N VAL A 590 -9.399 -33.070 19.045 1.00 73.23 N ATOM 734 CA VAL A 590 -9.100 -34.245 18.244 1.00 32.42 C ATOM 735 C VAL A 590 -10.323 -35.165 18.220 1.00 63.04 C ATOM 736 O VAL A 590 -10.922 -35.435 19.259 1.00 21.04 O ATOM 737 CB VAL A 590 -7.843 -34.936 18.778 1.00 53.14 C ATOM 738 CG1 VAL A 590 -7.749 -36.375 18.266 1.00 14.22 C ATOM 739 CG2 VAL A 590 -6.586 -34.142 18.416 1.00 74.10 C ATOM 0 H VAL A 590 -8.935 -33.043 19.953 1.00 73.23 H new ATOM 0 HA VAL A 590 -8.886 -33.961 17.214 1.00 32.42 H new ATOM 0 HB VAL A 590 -7.916 -34.971 19.865 1.00 53.14 H new ATOM 0 HG11 VAL A 590 -6.847 -36.843 18.660 1.00 14.22 H new ATOM 0 HG12 VAL A 590 -8.623 -36.936 18.596 1.00 14.22 H new ATOM 0 HG13 VAL A 590 -7.710 -36.372 17.177 1.00 14.22 H new ATOM 0 HG21 VAL A 590 -5.707 -34.654 18.807 1.00 74.10 H new ATOM 0 HG22 VAL A 590 -6.507 -34.061 17.332 1.00 74.10 H new ATOM 0 HG23 VAL A 590 -6.648 -33.144 18.851 1.00 74.10 H new ATOM 749 N SER A 591 -10.657 -35.621 17.021 1.00 5.22 N ATOM 750 CA SER A 591 -11.797 -36.504 16.847 1.00 21.45 C ATOM 751 C SER A 591 -11.665 -37.717 17.771 1.00 65.21 C ATOM 752 O SER A 591 -10.590 -37.977 18.310 1.00 10.13 O ATOM 753 CB SER A 591 -11.926 -36.957 15.392 1.00 70.22 C ATOM 754 OG SER A 591 -13.078 -37.771 15.186 1.00 41.41 O ATOM 0 H SER A 591 -10.157 -35.395 16.161 1.00 5.22 H new ATOM 0 HA SER A 591 -12.700 -35.952 17.109 1.00 21.45 H new ATOM 0 HB2 SER A 591 -11.979 -36.083 14.743 1.00 70.22 H new ATOM 0 HB3 SER A 591 -11.033 -37.513 15.105 1.00 70.22 H new ATOM 0 HG SER A 591 -13.126 -38.038 14.244 1.00 41.41 H new ATOM 966 N TRP A 604 7.561 -38.574 10.787 1.00 72.14 N ATOM 967 CA TRP A 604 6.664 -38.345 11.907 1.00 60.51 C ATOM 968 C TRP A 604 5.476 -39.300 11.764 1.00 4.51 C ATOM 969 O TRP A 604 5.273 -39.888 10.704 1.00 74.43 O ATOM 970 CB TRP A 604 6.245 -36.876 11.983 1.00 73.15 C ATOM 971 CG TRP A 604 5.463 -36.388 10.761 1.00 30.31 C ATOM 972 CD1 TRP A 604 5.187 -37.061 9.636 1.00 70.24 C ATOM 973 CD2 TRP A 604 4.864 -35.087 10.587 1.00 11.12 C ATOM 974 NE1 TRP A 604 4.457 -36.292 8.753 1.00 52.15 N ATOM 975 CE2 TRP A 604 4.254 -35.053 9.350 1.00 61.22 C ATOM 976 CE3 TRP A 604 4.838 -33.975 11.447 1.00 11.03 C ATOM 977 CZ2 TRP A 604 3.574 -33.932 8.860 1.00 1.55 C ATOM 978 CZ3 TRP A 604 4.154 -32.862 10.944 1.00 44.25 C ATOM 979 CH2 TRP A 604 3.535 -32.812 9.700 1.00 4.10 C ATOM 0 HA TRP A 604 7.166 -38.553 12.852 1.00 60.51 H new ATOM 0 HB2 TRP A 604 5.635 -36.728 12.874 1.00 73.15 H new ATOM 0 HB3 TRP A 604 7.137 -36.260 12.101 1.00 73.15 H new ATOM 0 HD1 TRP A 604 5.497 -38.078 9.444 1.00 70.24 H new ATOM 0 HE1 TRP A 604 4.127 -36.580 7.832 1.00 52.15 H new ATOM 0 HE3 TRP A 604 5.309 -33.979 12.419 1.00 11.03 H new ATOM 0 HZ2 TRP A 604 3.105 -33.931 7.887 1.00 1.55 H new ATOM 0 HZ3 TRP A 604 4.104 -31.980 11.566 1.00 44.25 H new ATOM 0 HH2 TRP A 604 3.026 -31.914 9.383 1.00 4.10 H new ATOM 990 N LYS A 605 4.724 -39.422 12.847 1.00 34.44 N ATOM 991 CA LYS A 605 3.562 -40.295 12.856 1.00 14.23 C ATOM 992 C LYS A 605 2.293 -39.446 12.964 1.00 60.31 C ATOM 993 O LYS A 605 2.340 -38.309 13.429 1.00 44.42 O ATOM 994 CB LYS A 605 3.692 -41.349 13.957 1.00 34.15 C ATOM 995 CG LYS A 605 3.740 -40.695 15.340 1.00 43.02 C ATOM 996 CD LYS A 605 3.147 -41.619 16.405 1.00 62.40 C ATOM 997 CE LYS A 605 1.619 -41.550 16.401 1.00 32.25 C ATOM 998 NZ LYS A 605 1.052 -42.568 17.315 1.00 51.25 N ATOM 0 H LYS A 605 4.896 -38.931 13.725 1.00 34.44 H new ATOM 0 HA LYS A 605 3.496 -40.851 11.921 1.00 14.23 H new ATOM 0 HB2 LYS A 605 2.850 -42.039 13.906 1.00 34.15 H new ATOM 0 HB3 LYS A 605 4.596 -41.937 13.797 1.00 34.15 H new ATOM 0 HG2 LYS A 605 4.772 -40.454 15.596 1.00 43.02 H new ATOM 0 HG3 LYS A 605 3.188 -39.755 15.321 1.00 43.02 H new ATOM 0 HD2 LYS A 605 3.469 -42.644 16.222 1.00 62.40 H new ATOM 0 HD3 LYS A 605 3.525 -41.337 17.388 1.00 62.40 H new ATOM 0 HE2 LYS A 605 1.293 -40.556 16.707 1.00 32.25 H new ATOM 0 HE3 LYS A 605 1.244 -41.711 15.390 1.00 32.25 H new ATOM 0 HZ1 LYS A 605 0.014 -42.508 17.301 1.00 51.25 H new ATOM 0 HZ2 LYS A 605 1.348 -43.516 17.006 1.00 51.25 H new ATOM 0 HZ3 LYS A 605 1.395 -42.396 18.282 1.00 51.25 H new ATOM 1011 N PRO A 606 1.159 -40.048 12.515 1.00 62.23 N ATOM 1012 CA PRO A 606 -0.120 -39.360 12.556 1.00 60.30 C ATOM 1013 C PRO A 606 -0.670 -39.311 13.983 1.00 52.22 C ATOM 1014 O PRO A 606 -0.125 -39.945 14.885 1.00 43.14 O ATOM 1015 CB PRO A 606 -1.014 -40.134 11.601 1.00 21.41 C ATOM 1016 CG PRO A 606 -0.352 -41.491 11.418 1.00 52.45 C ATOM 1017 CD PRO A 606 1.065 -41.394 11.958 1.00 63.44 C ATOM 0 HA PRO A 606 -0.046 -38.316 12.253 1.00 60.30 H new ATOM 0 HB2 PRO A 606 -2.020 -40.242 12.008 1.00 21.41 H new ATOM 0 HB3 PRO A 606 -1.110 -39.614 10.648 1.00 21.41 H new ATOM 0 HG2 PRO A 606 -0.910 -42.263 11.948 1.00 52.45 H new ATOM 0 HG3 PRO A 606 -0.341 -41.772 10.365 1.00 52.45 H new ATOM 0 HD2 PRO A 606 1.251 -42.151 12.719 1.00 63.44 H new ATOM 0 HD3 PRO A 606 1.801 -41.548 11.169 1.00 63.44 H new ATOM 1025 N GLY A 607 -1.744 -38.551 14.143 1.00 71.53 N ATOM 1026 CA GLY A 607 -2.374 -38.411 15.444 1.00 33.04 C ATOM 1027 C GLY A 607 -3.896 -38.520 15.331 1.00 13.54 C ATOM 1028 O GLY A 607 -4.429 -39.601 15.086 1.00 45.15 O ATOM 0 H GLY A 607 -2.193 -38.026 13.393 1.00 71.53 H new ATOM 0 HA2 GLY A 607 -2.000 -39.182 16.118 1.00 33.04 H new ATOM 0 HA3 GLY A 607 -2.106 -37.449 15.880 1.00 33.04 H new ATOM 1032 N GLY A 608 -4.554 -37.384 15.516 1.00 22.33 N ATOM 1033 CA GLY A 608 -6.004 -37.338 15.438 1.00 30.11 C ATOM 1034 C GLY A 608 -6.471 -36.130 14.624 1.00 11.44 C ATOM 1035 O GLY A 608 -5.821 -35.086 14.628 1.00 43.44 O ATOM 0 H GLY A 608 -4.109 -36.489 15.720 1.00 22.33 H new ATOM 0 HA2 GLY A 608 -6.376 -38.255 14.981 1.00 30.11 H new ATOM 0 HA3 GLY A 608 -6.424 -37.289 16.442 1.00 30.11 H new ATOM 1039 N VAL A 609 -7.595 -36.311 13.947 1.00 61.44 N ATOM 1040 CA VAL A 609 -8.157 -35.249 13.130 1.00 43.11 C ATOM 1041 C VAL A 609 -8.394 -34.014 14.001 1.00 52.52 C ATOM 1042 O VAL A 609 -9.053 -34.097 15.036 1.00 54.20 O ATOM 1043 CB VAL A 609 -9.426 -35.741 12.432 1.00 61.05 C ATOM 1044 CG1 VAL A 609 -9.884 -34.747 11.363 1.00 14.30 C ATOM 1045 CG2 VAL A 609 -9.217 -37.133 11.832 1.00 70.02 C ATOM 0 H VAL A 609 -8.132 -37.178 13.947 1.00 61.44 H new ATOM 0 HA VAL A 609 -7.460 -34.963 12.342 1.00 43.11 H new ATOM 0 HB VAL A 609 -10.214 -35.814 13.182 1.00 61.05 H new ATOM 0 HG11 VAL A 609 -10.788 -35.121 10.882 1.00 14.30 H new ATOM 0 HG12 VAL A 609 -10.092 -33.783 11.828 1.00 14.30 H new ATOM 0 HG13 VAL A 609 -9.099 -34.628 10.617 1.00 14.30 H new ATOM 0 HG21 VAL A 609 -10.134 -37.459 11.342 1.00 70.02 H new ATOM 0 HG22 VAL A 609 -8.408 -37.097 11.102 1.00 70.02 H new ATOM 0 HG23 VAL A 609 -8.959 -37.836 12.624 1.00 70.02 H new ATOM 1055 N ILE A 610 -7.844 -32.896 13.549 1.00 31.03 N ATOM 1056 CA ILE A 610 -7.988 -31.645 14.274 1.00 21.04 C ATOM 1057 C ILE A 610 -9.168 -30.859 13.698 1.00 24.43 C ATOM 1058 O ILE A 610 -9.422 -30.908 12.496 1.00 53.41 O ATOM 1059 CB ILE A 610 -6.670 -30.868 14.269 1.00 40.14 C ATOM 1060 CG1 ILE A 610 -5.473 -31.819 14.203 1.00 50.24 C ATOM 1061 CG2 ILE A 610 -6.586 -29.923 15.469 1.00 44.32 C ATOM 1062 CD1 ILE A 610 -4.193 -31.121 14.666 1.00 25.31 C ATOM 0 H ILE A 610 -7.298 -32.831 12.690 1.00 31.03 H new ATOM 0 HA ILE A 610 -8.214 -31.837 15.323 1.00 21.04 H new ATOM 0 HB ILE A 610 -6.641 -30.251 13.371 1.00 40.14 H new ATOM 0 HG12 ILE A 610 -5.662 -32.692 14.828 1.00 50.24 H new ATOM 0 HG13 ILE A 610 -5.346 -32.180 13.182 1.00 50.24 H new ATOM 0 HG21 ILE A 610 -5.640 -29.383 15.441 1.00 44.32 H new ATOM 0 HG22 ILE A 610 -7.411 -29.212 15.430 1.00 44.32 H new ATOM 0 HG23 ILE A 610 -6.648 -30.500 16.392 1.00 44.32 H new ATOM 0 HD11 ILE A 610 -3.357 -31.819 14.609 1.00 25.31 H new ATOM 0 HD12 ILE A 610 -3.994 -30.263 14.024 1.00 25.31 H new ATOM 0 HD13 ILE A 610 -4.315 -30.783 15.695 1.00 25.31 H new ATOM 1074 N SER A 611 -9.856 -30.154 14.584 1.00 52.15 N ATOM 1075 CA SER A 611 -11.003 -29.359 14.178 1.00 0.01 C ATOM 1076 C SER A 611 -11.118 -28.117 15.064 1.00 13.01 C ATOM 1077 O SER A 611 -11.234 -28.229 16.284 1.00 43.53 O ATOM 1078 CB SER A 611 -12.293 -30.179 14.244 1.00 63.43 C ATOM 1079 OG SER A 611 -12.180 -31.280 15.142 1.00 70.24 O ATOM 0 H SER A 611 -9.642 -30.117 15.581 1.00 52.15 H new ATOM 0 HA SER A 611 -10.855 -29.048 13.144 1.00 0.01 H new ATOM 0 HB2 SER A 611 -13.115 -29.537 14.559 1.00 63.43 H new ATOM 0 HB3 SER A 611 -12.540 -30.547 13.248 1.00 63.43 H new ATOM 0 HG SER A 611 -11.794 -30.973 15.989 1.00 70.24 H new ATOM 1085 N CYS A 612 -11.083 -26.962 14.416 1.00 0.22 N ATOM 1086 CA CYS A 612 -11.182 -25.700 15.130 1.00 31.00 C ATOM 1087 C CYS A 612 -12.371 -25.783 16.090 1.00 63.13 C ATOM 1088 O CYS A 612 -13.506 -25.983 15.661 1.00 32.23 O ATOM 1089 CB CYS A 612 -11.305 -24.515 14.170 1.00 74.21 C ATOM 1090 SG CYS A 612 -11.164 -22.870 14.959 1.00 72.10 S ATOM 0 H CYS A 612 -10.987 -26.873 13.404 1.00 0.22 H new ATOM 0 HA CYS A 612 -10.268 -25.529 15.699 1.00 31.00 H new ATOM 0 HB2 CYS A 612 -10.533 -24.603 13.406 1.00 74.21 H new ATOM 0 HB3 CYS A 612 -12.267 -24.577 13.660 1.00 74.21 H new ATOM 0 HG CYS A 612 -12.105 -22.092 14.512 1.00 72.10 H new ATOM 1095 N ARG A 613 -12.069 -25.625 17.370 1.00 23.21 N ATOM 1096 CA ARG A 613 -13.098 -25.680 18.394 1.00 12.20 C ATOM 1097 C ARG A 613 -13.988 -24.437 18.319 1.00 71.51 C ATOM 1098 O ARG A 613 -15.145 -24.472 18.736 1.00 42.01 O ATOM 1099 CB ARG A 613 -12.481 -25.773 19.791 1.00 52.10 C ATOM 1100 CG ARG A 613 -13.543 -25.569 20.874 1.00 63.31 C ATOM 1101 CD ARG A 613 -12.913 -25.584 22.268 1.00 31.14 C ATOM 1102 NE ARG A 613 -13.767 -26.353 23.201 1.00 20.10 N ATOM 1103 CZ ARG A 613 -13.442 -26.614 24.485 1.00 4.20 C ATOM 1104 NH1 ARG A 613 -12.276 -26.168 25.000 1.00 31.35 N ATOM 1105 NH2 ARG A 613 -14.280 -27.311 25.229 1.00 60.11 N ATOM 0 H ARG A 613 -11.126 -25.459 17.721 1.00 23.21 H new ATOM 0 HA ARG A 613 -13.697 -26.572 18.214 1.00 12.20 H new ATOM 0 HB2 ARG A 613 -12.008 -26.746 19.919 1.00 52.10 H new ATOM 0 HB3 ARG A 613 -11.699 -25.022 19.898 1.00 52.10 H new ATOM 0 HG2 ARG A 613 -14.055 -24.620 20.712 1.00 63.31 H new ATOM 0 HG3 ARG A 613 -14.296 -26.354 20.803 1.00 63.31 H new ATOM 0 HD2 ARG A 613 -11.919 -26.028 22.222 1.00 31.14 H new ATOM 0 HD3 ARG A 613 -12.790 -24.564 22.631 1.00 31.14 H new ATOM 0 HE ARG A 613 -14.657 -26.708 22.852 1.00 20.10 H new ATOM 0 HH11 ARG A 613 -11.634 -25.630 24.418 1.00 31.35 H new ATOM 0 HH12 ARG A 613 -12.037 -26.369 25.971 1.00 31.35 H new ATOM 0 HH21 ARG A 613 -15.159 -27.644 24.832 1.00 60.11 H new ATOM 0 HH22 ARG A 613 -14.049 -27.517 26.201 1.00 60.11 H new ATOM 1118 N ASN A 614 -13.415 -23.369 17.784 1.00 22.51 N ATOM 1119 CA ASN A 614 -14.142 -22.119 17.649 1.00 44.51 C ATOM 1120 C ASN A 614 -15.266 -22.295 16.627 1.00 74.12 C ATOM 1121 O ASN A 614 -16.346 -21.727 16.782 1.00 11.23 O ATOM 1122 CB ASN A 614 -13.224 -20.999 17.153 1.00 20.24 C ATOM 1123 CG ASN A 614 -12.103 -20.724 18.158 1.00 14.40 C ATOM 1124 OD1 ASN A 614 -12.183 -21.068 19.326 1.00 62.13 O ATOM 1125 ND2 ASN A 614 -11.058 -20.085 17.641 1.00 40.24 N ATOM 0 H ASN A 614 -12.455 -23.344 17.439 1.00 22.51 H new ATOM 0 HA ASN A 614 -14.540 -21.853 18.628 1.00 44.51 H new ATOM 0 HB2 ASN A 614 -12.794 -21.275 16.190 1.00 20.24 H new ATOM 0 HB3 ASN A 614 -13.805 -20.091 16.994 1.00 20.24 H new ATOM 0 HD21 ASN A 614 -10.259 -19.854 18.231 1.00 40.24 H new ATOM 0 HD22 ASN A 614 -11.056 -19.826 16.654 1.00 40.24 H new ATOM 1132 N CYS A 615 -14.975 -23.085 15.604 1.00 24.21 N ATOM 1133 CA CYS A 615 -15.948 -23.344 14.557 1.00 41.23 C ATOM 1134 C CYS A 615 -16.100 -24.859 14.405 1.00 4.32 C ATOM 1135 O CYS A 615 -17.100 -25.432 14.834 1.00 3.15 O ATOM 1136 CB CYS A 615 -15.552 -22.675 13.239 1.00 63.33 C ATOM 1137 SG CYS A 615 -14.444 -21.229 13.414 1.00 21.34 S ATOM 0 H CYS A 615 -14.078 -23.555 15.478 1.00 24.21 H new ATOM 0 HA CYS A 615 -16.909 -22.910 14.835 1.00 41.23 H new ATOM 0 HB2 CYS A 615 -15.063 -23.415 12.605 1.00 63.33 H new ATOM 0 HB3 CYS A 615 -16.458 -22.360 12.721 1.00 63.33 H new ATOM 0 HG CYS A 615 -13.845 -21.278 14.567 1.00 21.34 H new ATOM 1142 N GLY A 616 -15.092 -25.464 13.793 1.00 13.14 N ATOM 1143 CA GLY A 616 -15.101 -26.901 13.580 1.00 71.20 C ATOM 1144 C GLY A 616 -14.368 -27.268 12.288 1.00 24.34 C ATOM 1145 O GLY A 616 -13.991 -28.422 12.091 1.00 73.54 O ATOM 0 H GLY A 616 -14.264 -24.985 13.438 1.00 13.14 H new ATOM 0 HA2 GLY A 616 -14.628 -27.401 14.425 1.00 71.20 H new ATOM 0 HA3 GLY A 616 -16.129 -27.259 13.533 1.00 71.20 H new ATOM 1149 N GLU A 617 -14.187 -26.265 11.443 1.00 44.43 N ATOM 1150 CA GLU A 617 -13.505 -26.467 10.176 1.00 61.34 C ATOM 1151 C GLU A 617 -12.278 -27.361 10.370 1.00 40.42 C ATOM 1152 O GLU A 617 -11.245 -26.905 10.859 1.00 72.14 O ATOM 1153 CB GLU A 617 -13.115 -25.130 9.543 1.00 63.12 C ATOM 1154 CG GLU A 617 -12.887 -25.282 8.037 1.00 3.45 C ATOM 1155 CD GLU A 617 -14.217 -25.355 7.286 1.00 35.31 C ATOM 1156 OE1 GLU A 617 -15.221 -24.789 7.745 1.00 43.12 O ATOM 1157 OE2 GLU A 617 -14.186 -26.030 6.187 1.00 53.11 O ATOM 0 H GLU A 617 -14.501 -25.309 11.611 1.00 44.43 H new ATOM 0 HA GLU A 617 -14.191 -26.968 9.493 1.00 61.34 H new ATOM 0 HB2 GLU A 617 -13.900 -24.395 9.723 1.00 63.12 H new ATOM 0 HB3 GLU A 617 -12.209 -24.751 10.015 1.00 63.12 H new ATOM 0 HG2 GLU A 617 -12.302 -24.440 7.667 1.00 3.45 H new ATOM 0 HG3 GLU A 617 -12.306 -26.183 7.843 1.00 3.45 H new ATOM 1165 N VAL A 618 -12.432 -28.616 9.977 1.00 61.50 N ATOM 1166 CA VAL A 618 -11.349 -29.578 10.102 1.00 54.33 C ATOM 1167 C VAL A 618 -10.068 -28.974 9.523 1.00 72.44 C ATOM 1168 O VAL A 618 -10.007 -28.661 8.335 1.00 51.12 O ATOM 1169 CB VAL A 618 -11.743 -30.898 9.436 1.00 45.01 C ATOM 1170 CG1 VAL A 618 -10.516 -31.785 9.211 1.00 54.23 C ATOM 1171 CG2 VAL A 618 -12.806 -31.630 10.257 1.00 60.54 C ATOM 0 H VAL A 618 -13.290 -28.990 9.572 1.00 61.50 H new ATOM 0 HA VAL A 618 -11.156 -29.804 11.151 1.00 54.33 H new ATOM 0 HB VAL A 618 -12.173 -30.667 8.461 1.00 45.01 H new ATOM 0 HG11 VAL A 618 -10.823 -32.717 8.736 1.00 54.23 H new ATOM 0 HG12 VAL A 618 -9.806 -31.267 8.567 1.00 54.23 H new ATOM 0 HG13 VAL A 618 -10.045 -32.004 10.169 1.00 54.23 H new ATOM 0 HG21 VAL A 618 -13.068 -32.565 9.762 1.00 60.54 H new ATOM 0 HG22 VAL A 618 -12.414 -31.844 11.251 1.00 60.54 H new ATOM 0 HG23 VAL A 618 -13.694 -31.004 10.344 1.00 60.54 H new ATOM 1181 N TRP A 619 -9.076 -28.830 10.389 1.00 51.22 N ATOM 1182 CA TRP A 619 -7.800 -28.270 9.978 1.00 2.43 C ATOM 1183 C TRP A 619 -6.985 -29.384 9.318 1.00 2.33 C ATOM 1184 O TRP A 619 -6.298 -29.150 8.325 1.00 71.22 O ATOM 1185 CB TRP A 619 -7.079 -27.623 11.162 1.00 3.44 C ATOM 1186 CG TRP A 619 -7.677 -26.284 11.599 1.00 2.22 C ATOM 1187 CD1 TRP A 619 -8.478 -25.470 10.898 1.00 60.10 C ATOM 1188 CD2 TRP A 619 -7.488 -25.632 12.873 1.00 23.30 C ATOM 1189 NE1 TRP A 619 -8.818 -24.346 11.624 1.00 64.35 N ATOM 1190 CE2 TRP A 619 -8.196 -24.448 12.863 1.00 73.32 C ATOM 1191 CE3 TRP A 619 -6.743 -26.031 13.997 1.00 45.51 C ATOM 1192 CZ2 TRP A 619 -8.230 -23.565 13.949 1.00 63.42 C ATOM 1193 CZ3 TRP A 619 -6.786 -25.137 15.074 1.00 71.10 C ATOM 1194 CH2 TRP A 619 -7.495 -23.941 15.079 1.00 25.34 C ATOM 0 H TRP A 619 -9.130 -29.091 11.373 1.00 51.22 H new ATOM 0 HA TRP A 619 -7.946 -27.469 9.253 1.00 2.43 H new ATOM 0 HB2 TRP A 619 -7.100 -28.311 12.007 1.00 3.44 H new ATOM 0 HB3 TRP A 619 -6.032 -27.473 10.899 1.00 3.44 H new ATOM 0 HD1 TRP A 619 -8.815 -25.668 9.891 1.00 60.10 H new ATOM 0 HE1 TRP A 619 -9.415 -23.582 11.309 1.00 64.35 H new ATOM 0 HE3 TRP A 619 -6.182 -26.954 14.027 1.00 45.51 H new ATOM 0 HZ2 TRP A 619 -8.793 -22.644 13.916 1.00 63.42 H new ATOM 0 HZ3 TRP A 619 -6.229 -25.395 15.963 1.00 71.10 H new ATOM 0 HH2 TRP A 619 -7.479 -23.305 15.951 1.00 25.34 H new ATOM 1205 N GLY A 620 -7.088 -30.571 9.897 1.00 2.13 N ATOM 1206 CA GLY A 620 -6.369 -31.722 9.378 1.00 41.22 C ATOM 1207 C GLY A 620 -6.248 -32.818 10.439 1.00 41.52 C ATOM 1208 O GLY A 620 -7.249 -33.403 10.849 1.00 51.31 O ATOM 0 H GLY A 620 -7.659 -30.761 10.721 1.00 2.13 H new ATOM 0 HA2 GLY A 620 -6.887 -32.114 8.503 1.00 41.22 H new ATOM 0 HA3 GLY A 620 -5.375 -31.417 9.050 1.00 41.22 H new ATOM 1212 N LEU A 621 -5.013 -33.062 10.853 1.00 74.00 N ATOM 1213 CA LEU A 621 -4.749 -34.077 11.858 1.00 24.14 C ATOM 1214 C LEU A 621 -3.534 -33.661 12.690 1.00 44.42 C ATOM 1215 O LEU A 621 -2.743 -32.820 12.263 1.00 73.33 O ATOM 1216 CB LEU A 621 -4.604 -35.453 11.205 1.00 34.24 C ATOM 1217 CG LEU A 621 -3.207 -35.811 10.696 1.00 3.20 C ATOM 1218 CD1 LEU A 621 -2.701 -34.764 9.701 1.00 34.30 C ATOM 1219 CD2 LEU A 621 -2.234 -36.012 11.860 1.00 61.03 C ATOM 0 H LEU A 621 -4.185 -32.574 10.511 1.00 74.00 H new ATOM 0 HA LEU A 621 -5.592 -34.162 12.544 1.00 24.14 H new ATOM 0 HB2 LEU A 621 -4.911 -36.210 11.927 1.00 34.24 H new ATOM 0 HB3 LEU A 621 -5.300 -35.511 10.368 1.00 34.24 H new ATOM 0 HG LEU A 621 -3.271 -36.759 10.162 1.00 3.20 H new ATOM 0 HD11 LEU A 621 -1.706 -35.042 9.355 1.00 34.30 H new ATOM 0 HD12 LEU A 621 -3.380 -34.713 8.850 1.00 34.30 H new ATOM 0 HD13 LEU A 621 -2.656 -33.790 10.189 1.00 34.30 H new ATOM 0 HD21 LEU A 621 -1.248 -36.266 11.470 1.00 61.03 H new ATOM 0 HD22 LEU A 621 -2.169 -35.093 12.442 1.00 61.03 H new ATOM 0 HD23 LEU A 621 -2.591 -36.821 12.497 1.00 61.03 H new ATOM 1231 N GLN A 622 -3.423 -34.268 13.862 1.00 4.42 N ATOM 1232 CA GLN A 622 -2.317 -33.970 14.757 1.00 32.22 C ATOM 1233 C GLN A 622 -1.132 -34.891 14.461 1.00 43.23 C ATOM 1234 O GLN A 622 -1.298 -36.104 14.343 1.00 44.14 O ATOM 1235 CB GLN A 622 -2.750 -34.087 16.220 1.00 24.11 C ATOM 1236 CG GLN A 622 -2.105 -32.991 17.072 1.00 75.15 C ATOM 1237 CD GLN A 622 -1.880 -33.473 18.506 1.00 14.43 C ATOM 1238 OE1 GLN A 622 -0.778 -33.804 18.912 1.00 53.52 O ATOM 1239 NE2 GLN A 622 -2.983 -33.493 19.249 1.00 33.04 N ATOM 0 H GLN A 622 -4.080 -34.965 14.213 1.00 4.42 H new ATOM 0 HA GLN A 622 -2.003 -32.940 14.586 1.00 32.22 H new ATOM 0 HB2 GLN A 622 -3.835 -34.015 16.289 1.00 24.11 H new ATOM 0 HB3 GLN A 622 -2.471 -35.066 16.609 1.00 24.11 H new ATOM 0 HG2 GLN A 622 -1.153 -32.695 16.631 1.00 75.15 H new ATOM 0 HG3 GLN A 622 -2.743 -32.107 17.077 1.00 75.15 H new ATOM 0 HE21 GLN A 622 -3.874 -33.203 18.847 1.00 33.04 H new ATOM 0 HE22 GLN A 622 -2.938 -33.799 20.221 1.00 33.04 H new ATOM 1248 N MET A 623 0.038 -34.279 14.349 1.00 41.02 N ATOM 1249 CA MET A 623 1.251 -35.029 14.068 1.00 11.53 C ATOM 1250 C MET A 623 2.132 -35.133 15.315 1.00 51.30 C ATOM 1251 O MET A 623 2.227 -34.185 16.093 1.00 44.31 O ATOM 1252 CB MET A 623 2.031 -34.337 12.948 1.00 31.22 C ATOM 1253 CG MET A 623 1.547 -34.805 11.574 1.00 40.30 C ATOM 1254 SD MET A 623 2.057 -36.491 11.288 1.00 21.24 S ATOM 1255 CE MET A 623 1.199 -36.820 9.758 1.00 11.40 C ATOM 0 H MET A 623 0.172 -33.273 14.448 1.00 41.02 H new ATOM 0 HA MET A 623 0.970 -36.036 13.759 1.00 11.53 H new ATOM 0 HB2 MET A 623 1.912 -33.257 13.031 1.00 31.22 H new ATOM 0 HB3 MET A 623 3.095 -34.550 13.055 1.00 31.22 H new ATOM 0 HG2 MET A 623 0.461 -34.730 11.517 1.00 40.30 H new ATOM 0 HG3 MET A 623 1.952 -34.157 10.797 1.00 40.30 H new ATOM 0 HE1 MET A 623 1.799 -37.489 9.141 1.00 11.40 H new ATOM 0 HE2 MET A 623 0.239 -37.289 9.973 1.00 11.40 H new ATOM 0 HE3 MET A 623 1.035 -35.884 9.224 1.00 11.40 H new ATOM 1265 N ILE A 624 2.753 -36.293 15.466 1.00 21.12 N ATOM 1266 CA ILE A 624 3.623 -36.533 16.605 1.00 30.51 C ATOM 1267 C ILE A 624 5.041 -36.820 16.107 1.00 72.42 C ATOM 1268 O ILE A 624 5.287 -37.854 15.487 1.00 44.45 O ATOM 1269 CB ILE A 624 3.048 -37.638 17.494 1.00 3.14 C ATOM 1270 CG1 ILE A 624 1.620 -37.304 17.929 1.00 75.55 C ATOM 1271 CG2 ILE A 624 3.962 -37.909 18.691 1.00 24.40 C ATOM 1272 CD1 ILE A 624 0.645 -37.439 16.757 1.00 40.23 C ATOM 0 H ILE A 624 2.671 -37.077 14.819 1.00 21.12 H new ATOM 0 HA ILE A 624 3.680 -35.645 17.235 1.00 30.51 H new ATOM 0 HB ILE A 624 3.000 -38.557 16.909 1.00 3.14 H new ATOM 0 HG12 ILE A 624 1.317 -37.969 18.737 1.00 75.55 H new ATOM 0 HG13 ILE A 624 1.584 -36.288 18.322 1.00 75.55 H new ATOM 0 HG21 ILE A 624 3.531 -38.698 19.307 1.00 24.40 H new ATOM 0 HG22 ILE A 624 4.944 -38.222 18.336 1.00 24.40 H new ATOM 0 HG23 ILE A 624 4.063 -37.000 19.284 1.00 24.40 H new ATOM 0 HD11 ILE A 624 -0.363 -37.196 17.093 1.00 40.23 H new ATOM 0 HD12 ILE A 624 0.937 -36.755 15.960 1.00 40.23 H new ATOM 0 HD13 ILE A 624 0.666 -38.462 16.382 1.00 40.23 H new ATOM 1284 N TYR A 625 5.936 -35.888 16.397 1.00 52.42 N ATOM 1285 CA TYR A 625 7.322 -36.027 15.986 1.00 65.30 C ATOM 1286 C TYR A 625 8.255 -36.035 17.199 1.00 65.44 C ATOM 1287 O TYR A 625 8.400 -35.023 17.882 1.00 34.13 O ATOM 1288 CB TYR A 625 7.633 -34.800 15.127 1.00 63.34 C ATOM 1289 CG TYR A 625 9.128 -34.520 14.960 1.00 1.30 C ATOM 1290 CD1 TYR A 625 9.845 -35.162 13.971 1.00 71.40 C ATOM 1291 CD2 TYR A 625 9.760 -33.624 15.799 1.00 72.13 C ATOM 1292 CE1 TYR A 625 11.252 -34.898 13.814 1.00 33.42 C ATOM 1293 CE2 TYR A 625 11.167 -33.360 15.642 1.00 74.11 C ATOM 1294 CZ TYR A 625 11.843 -34.010 14.657 1.00 22.23 C ATOM 1295 OH TYR A 625 13.172 -33.761 14.509 1.00 11.12 O ATOM 0 H TYR A 625 5.728 -35.033 16.912 1.00 52.42 H new ATOM 0 HA TYR A 625 7.470 -36.963 15.447 1.00 65.30 H new ATOM 0 HB2 TYR A 625 7.187 -34.936 14.142 1.00 63.34 H new ATOM 0 HB3 TYR A 625 7.158 -33.927 15.574 1.00 63.34 H new ATOM 0 HD1 TYR A 625 9.351 -35.863 13.314 1.00 71.40 H new ATOM 0 HD2 TYR A 625 9.199 -33.121 16.573 1.00 72.13 H new ATOM 0 HE1 TYR A 625 11.825 -35.394 13.044 1.00 33.42 H new ATOM 0 HE2 TYR A 625 11.674 -32.662 16.292 1.00 74.11 H new ATOM 0 HH TYR A 625 13.459 -33.106 15.179 1.00 11.12 H new ATOM 1305 N LYS A 626 8.865 -37.189 17.428 1.00 20.14 N ATOM 1306 CA LYS A 626 9.780 -37.342 18.547 1.00 61.44 C ATOM 1307 C LYS A 626 9.005 -37.197 19.858 1.00 61.32 C ATOM 1308 O LYS A 626 9.598 -36.974 20.912 1.00 1.11 O ATOM 1309 CB LYS A 626 10.954 -36.370 18.415 1.00 21.13 C ATOM 1310 CG LYS A 626 11.457 -36.310 16.972 1.00 43.24 C ATOM 1311 CD LYS A 626 12.210 -37.589 16.600 1.00 45.43 C ATOM 1312 CE LYS A 626 11.269 -38.615 15.966 1.00 10.21 C ATOM 1313 NZ LYS A 626 12.000 -39.458 14.995 1.00 62.55 N ATOM 0 H LYS A 626 8.744 -38.026 16.858 1.00 20.14 H new ATOM 0 HA LYS A 626 10.220 -38.339 18.546 1.00 61.44 H new ATOM 0 HB2 LYS A 626 10.645 -35.376 18.738 1.00 21.13 H new ATOM 0 HB3 LYS A 626 11.765 -36.682 19.074 1.00 21.13 H new ATOM 0 HG2 LYS A 626 10.614 -36.170 16.295 1.00 43.24 H new ATOM 0 HG3 LYS A 626 12.113 -35.448 16.847 1.00 43.24 H new ATOM 0 HD2 LYS A 626 13.016 -37.352 15.906 1.00 45.43 H new ATOM 0 HD3 LYS A 626 12.672 -38.015 17.491 1.00 45.43 H new ATOM 0 HE2 LYS A 626 10.829 -39.242 16.742 1.00 10.21 H new ATOM 0 HE3 LYS A 626 10.447 -38.103 15.466 1.00 10.21 H new ATOM 0 HZ1 LYS A 626 11.347 -40.149 14.574 1.00 62.55 H new ATOM 0 HZ2 LYS A 626 12.399 -38.858 14.245 1.00 62.55 H new ATOM 0 HZ3 LYS A 626 12.769 -39.961 15.482 1.00 62.55 H new ATOM 1326 N SER A 627 7.691 -37.330 19.749 1.00 24.34 N ATOM 1327 CA SER A 627 6.829 -37.217 20.913 1.00 1.24 C ATOM 1328 C SER A 627 6.449 -35.753 21.142 1.00 13.51 C ATOM 1329 O SER A 627 6.403 -35.290 22.281 1.00 40.12 O ATOM 1330 CB SER A 627 7.507 -37.790 22.159 1.00 4.23 C ATOM 1331 OG SER A 627 8.248 -36.799 22.867 1.00 63.30 O ATOM 0 H SER A 627 7.203 -37.515 18.873 1.00 24.34 H new ATOM 0 HA SER A 627 5.925 -37.796 20.726 1.00 1.24 H new ATOM 0 HB2 SER A 627 6.752 -38.218 22.818 1.00 4.23 H new ATOM 0 HB3 SER A 627 8.173 -38.602 21.868 1.00 4.23 H new ATOM 0 HG SER A 627 8.890 -36.375 22.260 1.00 63.30 H new ATOM 1337 N VAL A 628 6.186 -35.064 20.041 1.00 35.02 N ATOM 1338 CA VAL A 628 5.811 -33.662 20.107 1.00 14.32 C ATOM 1339 C VAL A 628 4.444 -33.472 19.445 1.00 3.13 C ATOM 1340 O VAL A 628 4.280 -33.757 18.260 1.00 13.21 O ATOM 1341 CB VAL A 628 6.905 -32.797 19.478 1.00 70.21 C ATOM 1342 CG1 VAL A 628 6.455 -31.339 19.366 1.00 62.23 C ATOM 1343 CG2 VAL A 628 8.212 -32.909 20.265 1.00 2.10 C ATOM 0 H VAL A 628 6.225 -35.451 19.098 1.00 35.02 H new ATOM 0 HA VAL A 628 5.718 -33.341 21.144 1.00 14.32 H new ATOM 0 HB VAL A 628 7.088 -33.169 18.470 1.00 70.21 H new ATOM 0 HG11 VAL A 628 7.251 -30.746 18.916 1.00 62.23 H new ATOM 0 HG12 VAL A 628 5.562 -31.281 18.743 1.00 62.23 H new ATOM 0 HG13 VAL A 628 6.230 -30.950 20.359 1.00 62.23 H new ATOM 0 HG21 VAL A 628 8.973 -32.285 19.797 1.00 2.10 H new ATOM 0 HG22 VAL A 628 8.049 -32.576 21.290 1.00 2.10 H new ATOM 0 HG23 VAL A 628 8.546 -33.946 20.269 1.00 2.10 H new ATOM 1353 N LYS A 629 3.499 -32.992 20.240 1.00 41.20 N ATOM 1354 CA LYS A 629 2.152 -32.761 19.746 1.00 2.40 C ATOM 1355 C LYS A 629 2.143 -31.506 18.870 1.00 64.54 C ATOM 1356 O LYS A 629 2.118 -30.388 19.381 1.00 53.13 O ATOM 1357 CB LYS A 629 1.158 -32.706 20.907 1.00 34.33 C ATOM 1358 CG LYS A 629 1.227 -33.982 21.749 1.00 24.11 C ATOM 1359 CD LYS A 629 0.567 -35.155 21.022 1.00 24.42 C ATOM 1360 CE LYS A 629 -0.953 -35.120 21.192 1.00 62.22 C ATOM 1361 NZ LYS A 629 -1.352 -35.821 22.433 1.00 52.22 N ATOM 0 H LYS A 629 3.639 -32.757 21.223 1.00 41.20 H new ATOM 0 HA LYS A 629 1.829 -33.592 19.118 1.00 2.40 H new ATOM 0 HB2 LYS A 629 1.373 -31.840 21.534 1.00 34.33 H new ATOM 0 HB3 LYS A 629 0.148 -32.576 20.519 1.00 34.33 H new ATOM 0 HG2 LYS A 629 2.268 -34.223 21.966 1.00 24.11 H new ATOM 0 HG3 LYS A 629 0.732 -33.818 22.706 1.00 24.11 H new ATOM 0 HD2 LYS A 629 0.819 -35.119 19.962 1.00 24.42 H new ATOM 0 HD3 LYS A 629 0.958 -36.095 21.411 1.00 24.42 H new ATOM 0 HE2 LYS A 629 -1.298 -34.086 21.224 1.00 62.22 H new ATOM 0 HE3 LYS A 629 -1.432 -35.589 20.332 1.00 62.22 H new ATOM 0 HZ1 LYS A 629 -2.387 -35.788 22.533 1.00 52.22 H new ATOM 0 HZ2 LYS A 629 -1.040 -36.812 22.387 1.00 52.22 H new ATOM 0 HZ3 LYS A 629 -0.910 -35.356 23.252 1.00 52.22 H new ATOM 1374 N LEU A 630 2.165 -31.735 17.565 1.00 62.12 N ATOM 1375 CA LEU A 630 2.160 -30.638 16.613 1.00 40.55 C ATOM 1376 C LEU A 630 0.980 -30.806 15.653 1.00 22.11 C ATOM 1377 O LEU A 630 0.961 -31.731 14.843 1.00 25.40 O ATOM 1378 CB LEU A 630 3.515 -30.532 15.909 1.00 34.20 C ATOM 1379 CG LEU A 630 4.745 -30.541 16.818 1.00 21.13 C ATOM 1380 CD1 LEU A 630 6.032 -30.643 15.998 1.00 44.22 C ATOM 1381 CD2 LEU A 630 4.751 -29.324 17.745 1.00 12.31 C ATOM 0 H LEU A 630 2.186 -32.664 17.145 1.00 62.12 H new ATOM 0 HA LEU A 630 2.020 -29.688 17.129 1.00 40.55 H new ATOM 0 HB2 LEU A 630 3.602 -31.359 15.205 1.00 34.20 H new ATOM 0 HB3 LEU A 630 3.527 -29.613 15.324 1.00 34.20 H new ATOM 0 HG LEU A 630 4.695 -31.427 17.451 1.00 21.13 H new ATOM 0 HD11 LEU A 630 6.891 -30.647 16.669 1.00 44.22 H new ATOM 0 HD12 LEU A 630 6.021 -31.565 15.416 1.00 44.22 H new ATOM 0 HD13 LEU A 630 6.102 -29.790 15.324 1.00 44.22 H new ATOM 0 HD21 LEU A 630 5.636 -29.355 18.380 1.00 12.31 H new ATOM 0 HD22 LEU A 630 4.765 -28.412 17.148 1.00 12.31 H new ATOM 0 HD23 LEU A 630 3.857 -29.337 18.368 1.00 12.31 H new ATOM 1393 N PRO A 631 -0.001 -29.873 15.780 1.00 72.15 N ATOM 1394 CA PRO A 631 -1.182 -29.909 14.933 1.00 22.44 C ATOM 1395 C PRO A 631 -0.857 -29.427 13.518 1.00 14.43 C ATOM 1396 O PRO A 631 -0.120 -28.458 13.343 1.00 64.22 O ATOM 1397 CB PRO A 631 -2.201 -29.031 15.642 1.00 64.43 C ATOM 1398 CG PRO A 631 -1.406 -28.168 16.608 1.00 13.12 C ATOM 1399 CD PRO A 631 -0.013 -28.763 16.728 1.00 61.02 C ATOM 0 HA PRO A 631 -1.572 -30.918 14.797 1.00 22.44 H new ATOM 0 HB2 PRO A 631 -2.750 -28.416 14.929 1.00 64.43 H new ATOM 0 HB3 PRO A 631 -2.936 -29.636 16.173 1.00 64.43 H new ATOM 0 HG2 PRO A 631 -1.352 -27.141 16.247 1.00 13.12 H new ATOM 0 HG3 PRO A 631 -1.893 -28.138 17.583 1.00 13.12 H new ATOM 0 HD2 PRO A 631 0.754 -28.027 16.486 1.00 61.02 H new ATOM 0 HD3 PRO A 631 0.184 -29.107 17.743 1.00 61.02 H new ATOM 1407 N VAL A 632 -1.425 -30.124 12.545 1.00 43.10 N ATOM 1408 CA VAL A 632 -1.205 -29.778 11.151 1.00 72.42 C ATOM 1409 C VAL A 632 -2.468 -29.123 10.587 1.00 22.24 C ATOM 1410 O VAL A 632 -3.507 -29.770 10.468 1.00 61.50 O ATOM 1411 CB VAL A 632 -0.774 -31.019 10.366 1.00 72.02 C ATOM 1412 CG1 VAL A 632 -0.363 -30.650 8.939 1.00 14.41 C ATOM 1413 CG2 VAL A 632 0.354 -31.760 11.087 1.00 14.30 C ATOM 0 H VAL A 632 -2.037 -30.926 12.694 1.00 43.10 H new ATOM 0 HA VAL A 632 -0.395 -29.054 11.060 1.00 72.42 H new ATOM 0 HB VAL A 632 -1.630 -31.690 10.305 1.00 72.02 H new ATOM 0 HG11 VAL A 632 -0.061 -31.550 8.403 1.00 14.41 H new ATOM 0 HG12 VAL A 632 -1.206 -30.187 8.426 1.00 14.41 H new ATOM 0 HG13 VAL A 632 0.471 -29.949 8.970 1.00 14.41 H new ATOM 0 HG21 VAL A 632 0.641 -32.638 10.508 1.00 14.30 H new ATOM 0 HG22 VAL A 632 1.214 -31.099 11.194 1.00 14.30 H new ATOM 0 HG23 VAL A 632 0.012 -32.072 12.074 1.00 14.30 H new ATOM 1423 N LEU A 633 -2.336 -27.847 10.256 1.00 73.21 N ATOM 1424 CA LEU A 633 -3.454 -27.097 9.708 1.00 63.21 C ATOM 1425 C LEU A 633 -3.143 -26.713 8.260 1.00 51.11 C ATOM 1426 O LEU A 633 -2.023 -26.906 7.789 1.00 11.53 O ATOM 1427 CB LEU A 633 -3.788 -25.902 10.603 1.00 24.43 C ATOM 1428 CG LEU A 633 -3.544 -26.098 12.101 1.00 33.02 C ATOM 1429 CD1 LEU A 633 -3.780 -27.553 12.509 1.00 34.45 C ATOM 1430 CD2 LEU A 633 -2.150 -25.610 12.498 1.00 24.34 C ATOM 0 H LEU A 633 -1.473 -27.313 10.357 1.00 73.21 H new ATOM 0 HA LEU A 633 -4.353 -27.713 9.689 1.00 63.21 H new ATOM 0 HB2 LEU A 633 -3.201 -25.047 10.268 1.00 24.43 H new ATOM 0 HB3 LEU A 633 -4.837 -25.645 10.456 1.00 24.43 H new ATOM 0 HG LEU A 633 -4.265 -25.490 12.647 1.00 33.02 H new ATOM 0 HD11 LEU A 633 -3.600 -27.665 13.578 1.00 34.45 H new ATOM 0 HD12 LEU A 633 -4.809 -27.832 12.283 1.00 34.45 H new ATOM 0 HD13 LEU A 633 -3.099 -28.201 11.957 1.00 34.45 H new ATOM 0 HD21 LEU A 633 -2.003 -25.761 13.567 1.00 24.34 H new ATOM 0 HD22 LEU A 633 -1.397 -26.171 11.945 1.00 24.34 H new ATOM 0 HD23 LEU A 633 -2.056 -24.549 12.265 1.00 24.34 H new ATOM 1442 N LYS A 634 -4.155 -26.176 7.594 1.00 61.22 N ATOM 1443 CA LYS A 634 -4.004 -25.763 6.209 1.00 60.01 C ATOM 1444 C LYS A 634 -3.850 -24.242 6.149 1.00 61.01 C ATOM 1445 O LYS A 634 -3.758 -23.583 7.183 1.00 14.51 O ATOM 1446 CB LYS A 634 -5.160 -26.298 5.361 1.00 1.02 C ATOM 1447 CG LYS A 634 -5.720 -27.593 5.953 1.00 54.10 C ATOM 1448 CD LYS A 634 -6.967 -28.049 5.192 1.00 10.11 C ATOM 1449 CE LYS A 634 -8.149 -27.117 5.467 1.00 3.14 C ATOM 1450 NZ LYS A 634 -8.576 -27.225 6.880 1.00 3.24 N ATOM 0 H LYS A 634 -5.082 -26.017 7.988 1.00 61.22 H new ATOM 0 HA LYS A 634 -3.099 -26.193 5.780 1.00 60.01 H new ATOM 0 HB2 LYS A 634 -5.950 -25.549 5.303 1.00 1.02 H new ATOM 0 HB3 LYS A 634 -4.816 -26.478 4.343 1.00 1.02 H new ATOM 0 HG2 LYS A 634 -4.960 -28.373 5.914 1.00 54.10 H new ATOM 0 HG3 LYS A 634 -5.966 -27.440 7.004 1.00 54.10 H new ATOM 0 HD2 LYS A 634 -6.757 -28.070 4.123 1.00 10.11 H new ATOM 0 HD3 LYS A 634 -7.225 -29.066 5.486 1.00 10.11 H new ATOM 0 HE2 LYS A 634 -7.868 -26.088 5.243 1.00 3.14 H new ATOM 0 HE3 LYS A 634 -8.980 -27.370 4.809 1.00 3.14 H new ATOM 0 HZ1 LYS A 634 -9.400 -26.612 7.041 1.00 3.24 H new ATOM 0 HZ2 LYS A 634 -8.831 -28.211 7.091 1.00 3.24 H new ATOM 0 HZ3 LYS A 634 -7.797 -26.928 7.502 1.00 3.24 H new ATOM 1463 N VAL A 635 -3.826 -23.729 4.927 1.00 22.44 N ATOM 1464 CA VAL A 635 -3.684 -22.298 4.719 1.00 74.40 C ATOM 1465 C VAL A 635 -5.025 -21.719 4.261 1.00 25.15 C ATOM 1466 O VAL A 635 -5.258 -20.517 4.379 1.00 21.11 O ATOM 1467 CB VAL A 635 -2.546 -22.023 3.734 1.00 75.01 C ATOM 1468 CG1 VAL A 635 -2.862 -22.607 2.355 1.00 4.22 C ATOM 1469 CG2 VAL A 635 -2.253 -20.524 3.641 1.00 63.43 C ATOM 0 H VAL A 635 -3.903 -24.279 4.071 1.00 22.44 H new ATOM 0 HA VAL A 635 -3.416 -21.801 5.651 1.00 74.40 H new ATOM 0 HB VAL A 635 -1.650 -22.517 4.110 1.00 75.01 H new ATOM 0 HG11 VAL A 635 -2.037 -22.398 1.674 1.00 4.22 H new ATOM 0 HG12 VAL A 635 -2.999 -23.685 2.439 1.00 4.22 H new ATOM 0 HG13 VAL A 635 -3.775 -22.155 1.969 1.00 4.22 H new ATOM 0 HG21 VAL A 635 -1.440 -20.355 2.934 1.00 63.43 H new ATOM 0 HG22 VAL A 635 -3.145 -19.999 3.300 1.00 63.43 H new ATOM 0 HG23 VAL A 635 -1.964 -20.148 4.623 1.00 63.43 H new ATOM 1479 N ARG A 636 -5.870 -22.601 3.749 1.00 31.12 N ATOM 1480 CA ARG A 636 -7.181 -22.192 3.273 1.00 22.45 C ATOM 1481 C ARG A 636 -8.163 -22.093 4.443 1.00 44.53 C ATOM 1482 O ARG A 636 -9.164 -21.384 4.358 1.00 12.41 O ATOM 1483 CB ARG A 636 -7.726 -23.182 2.242 1.00 23.41 C ATOM 1484 CG ARG A 636 -8.258 -24.446 2.922 1.00 4.53 C ATOM 1485 CD ARG A 636 -8.579 -25.529 1.891 1.00 34.33 C ATOM 1486 NE ARG A 636 -7.478 -26.517 1.835 1.00 55.23 N ATOM 1487 CZ ARG A 636 -7.477 -27.604 1.034 1.00 12.22 C ATOM 1488 NH1 ARG A 636 -8.521 -27.852 0.215 1.00 62.43 N ATOM 1489 NH2 ARG A 636 -6.440 -28.420 1.065 1.00 73.10 N ATOM 0 H ARG A 636 -5.673 -23.597 3.653 1.00 31.12 H new ATOM 0 HA ARG A 636 -7.073 -21.216 2.801 1.00 22.45 H new ATOM 0 HB2 ARG A 636 -8.523 -22.711 1.667 1.00 23.41 H new ATOM 0 HB3 ARG A 636 -6.939 -23.448 1.537 1.00 23.41 H new ATOM 0 HG2 ARG A 636 -7.519 -24.821 3.630 1.00 4.53 H new ATOM 0 HG3 ARG A 636 -9.154 -24.206 3.494 1.00 4.53 H new ATOM 0 HD2 ARG A 636 -9.512 -26.027 2.153 1.00 34.33 H new ATOM 0 HD3 ARG A 636 -8.723 -25.077 0.910 1.00 34.33 H new ATOM 0 HE ARG A 636 -6.670 -26.367 2.439 1.00 55.23 H new ATOM 0 HH11 ARG A 636 -9.318 -27.216 0.198 1.00 62.43 H new ATOM 0 HH12 ARG A 636 -8.513 -28.675 -0.387 1.00 62.43 H new ATOM 0 HH21 ARG A 636 -5.656 -28.225 1.687 1.00 73.10 H new ATOM 0 HH22 ARG A 636 -6.423 -29.246 0.467 1.00 73.10 H new ATOM 1502 N SER A 637 -7.841 -22.813 5.507 1.00 21.11 N ATOM 1503 CA SER A 637 -8.682 -22.815 6.692 1.00 50.51 C ATOM 1504 C SER A 637 -8.151 -21.805 7.712 1.00 71.12 C ATOM 1505 O SER A 637 -8.807 -21.527 8.715 1.00 64.51 O ATOM 1506 CB SER A 637 -8.754 -24.210 7.315 1.00 60.25 C ATOM 1507 OG SER A 637 -9.738 -25.026 6.685 1.00 53.35 O ATOM 0 H SER A 637 -7.009 -23.399 5.574 1.00 21.11 H new ATOM 0 HA SER A 637 -9.691 -22.527 6.396 1.00 50.51 H new ATOM 0 HB2 SER A 637 -7.780 -24.692 7.238 1.00 60.25 H new ATOM 0 HB3 SER A 637 -8.982 -24.121 8.377 1.00 60.25 H new ATOM 0 HG SER A 637 -9.719 -24.873 5.717 1.00 53.35 H new ATOM 1513 N MET A 638 -6.969 -21.283 7.420 1.00 63.42 N ATOM 1514 CA MET A 638 -6.342 -20.311 8.299 1.00 52.21 C ATOM 1515 C MET A 638 -6.341 -18.919 7.664 1.00 10.40 C ATOM 1516 O MET A 638 -6.066 -18.776 6.474 1.00 45.52 O ATOM 1517 CB MET A 638 -4.903 -20.740 8.592 1.00 51.31 C ATOM 1518 CG MET A 638 -4.872 -21.988 9.476 1.00 14.12 C ATOM 1519 SD MET A 638 -5.375 -21.571 11.138 1.00 63.54 S ATOM 1520 CE MET A 638 -6.908 -22.480 11.235 1.00 53.14 C ATOM 0 H MET A 638 -6.429 -21.515 6.587 1.00 63.42 H new ATOM 0 HA MET A 638 -6.913 -20.267 9.227 1.00 52.21 H new ATOM 0 HB2 MET A 638 -4.382 -20.940 7.656 1.00 51.31 H new ATOM 0 HB3 MET A 638 -4.371 -19.927 9.086 1.00 51.31 H new ATOM 0 HG2 MET A 638 -5.535 -22.750 9.067 1.00 14.12 H new ATOM 0 HG3 MET A 638 -3.868 -22.412 9.487 1.00 14.12 H new ATOM 0 HE1 MET A 638 -7.581 -21.985 11.935 1.00 53.14 H new ATOM 0 HE2 MET A 638 -7.372 -22.517 10.249 1.00 53.14 H new ATOM 0 HE3 MET A 638 -6.708 -23.494 11.580 1.00 53.14 H new ATOM 1530 N LEU A 639 -6.652 -17.928 8.487 1.00 51.23 N ATOM 1531 CA LEU A 639 -6.690 -16.552 8.021 1.00 74.15 C ATOM 1532 C LEU A 639 -5.409 -15.836 8.452 1.00 61.10 C ATOM 1533 O LEU A 639 -4.914 -16.054 9.557 1.00 64.25 O ATOM 1534 CB LEU A 639 -7.970 -15.861 8.495 1.00 74.11 C ATOM 1535 CG LEU A 639 -8.347 -14.571 7.763 1.00 73.53 C ATOM 1536 CD1 LEU A 639 -8.257 -14.755 6.247 1.00 71.44 C ATOM 1537 CD2 LEU A 639 -9.728 -14.077 8.199 1.00 3.30 C ATOM 0 H LEU A 639 -6.880 -18.051 9.474 1.00 51.23 H new ATOM 0 HA LEU A 639 -6.722 -16.520 6.932 1.00 74.15 H new ATOM 0 HB2 LEU A 639 -8.796 -16.565 8.398 1.00 74.11 H new ATOM 0 HB3 LEU A 639 -7.866 -15.636 9.556 1.00 74.11 H new ATOM 0 HG LEU A 639 -7.627 -13.800 8.037 1.00 73.53 H new ATOM 0 HD11 LEU A 639 -8.530 -13.824 5.751 1.00 71.44 H new ATOM 0 HD12 LEU A 639 -7.238 -15.027 5.973 1.00 71.44 H new ATOM 0 HD13 LEU A 639 -8.939 -15.546 5.935 1.00 71.44 H new ATOM 0 HD21 LEU A 639 -9.972 -13.159 7.664 1.00 3.30 H new ATOM 0 HD22 LEU A 639 -10.475 -14.838 7.973 1.00 3.30 H new ATOM 0 HD23 LEU A 639 -9.723 -13.881 9.271 1.00 3.30 H new ATOM 1549 N LEU A 640 -4.909 -14.996 7.558 1.00 63.12 N ATOM 1550 CA LEU A 640 -3.694 -14.247 7.832 1.00 14.32 C ATOM 1551 C LEU A 640 -4.043 -12.768 8.015 1.00 60.23 C ATOM 1552 O LEU A 640 -4.067 -12.008 7.048 1.00 70.54 O ATOM 1553 CB LEU A 640 -2.650 -14.503 6.744 1.00 4.41 C ATOM 1554 CG LEU A 640 -2.069 -15.917 6.691 1.00 72.21 C ATOM 1555 CD1 LEU A 640 -2.156 -16.597 8.059 1.00 71.34 C ATOM 1556 CD2 LEU A 640 -2.743 -16.745 5.595 1.00 20.51 C ATOM 0 H LEU A 640 -5.323 -14.817 6.643 1.00 63.12 H new ATOM 0 HA LEU A 640 -3.239 -14.585 8.763 1.00 14.32 H new ATOM 0 HB2 LEU A 640 -3.100 -14.280 5.777 1.00 4.41 H new ATOM 0 HB3 LEU A 640 -1.829 -13.799 6.883 1.00 4.41 H new ATOM 0 HG LEU A 640 -1.012 -15.843 6.435 1.00 72.21 H new ATOM 0 HD11 LEU A 640 -1.736 -17.601 7.994 1.00 71.34 H new ATOM 0 HD12 LEU A 640 -1.595 -16.016 8.791 1.00 71.34 H new ATOM 0 HD13 LEU A 640 -3.199 -16.659 8.369 1.00 71.34 H new ATOM 0 HD21 LEU A 640 -2.312 -17.746 5.578 1.00 20.51 H new ATOM 0 HD22 LEU A 640 -3.812 -16.814 5.796 1.00 20.51 H new ATOM 0 HD23 LEU A 640 -2.586 -16.266 4.629 1.00 20.51 H new ATOM 1568 N GLU A 641 -4.304 -12.404 9.261 1.00 33.35 N ATOM 1569 CA GLU A 641 -4.650 -11.030 9.583 1.00 35.22 C ATOM 1570 C GLU A 641 -3.404 -10.144 9.536 1.00 53.12 C ATOM 1571 O GLU A 641 -2.421 -10.412 10.224 1.00 21.23 O ATOM 1572 CB GLU A 641 -5.334 -10.942 10.949 1.00 32.40 C ATOM 1573 CG GLU A 641 -6.845 -10.755 10.795 1.00 42.30 C ATOM 1574 CD GLU A 641 -7.541 -10.774 12.157 1.00 14.12 C ATOM 1575 OE1 GLU A 641 -6.902 -10.500 13.184 1.00 35.20 O ATOM 1576 OE2 GLU A 641 -8.793 -11.086 12.125 1.00 24.03 O ATOM 0 H GLU A 641 -4.283 -13.037 10.061 1.00 33.35 H new ATOM 0 HA GLU A 641 -5.357 -10.670 8.836 1.00 35.22 H new ATOM 0 HB2 GLU A 641 -5.133 -11.849 11.520 1.00 32.40 H new ATOM 0 HB3 GLU A 641 -4.917 -10.109 11.516 1.00 32.40 H new ATOM 0 HG2 GLU A 641 -7.049 -9.810 10.292 1.00 42.30 H new ATOM 0 HG3 GLU A 641 -7.251 -11.546 10.164 1.00 42.30 H new ATOM 1584 N THR A 642 -3.486 -9.106 8.717 1.00 52.23 N ATOM 1585 CA THR A 642 -2.377 -8.178 8.571 1.00 72.44 C ATOM 1586 C THR A 642 -2.871 -6.735 8.680 1.00 14.42 C ATOM 1587 O THR A 642 -4.058 -6.466 8.502 1.00 14.24 O ATOM 1588 CB THR A 642 -1.678 -8.482 7.244 1.00 73.40 C ATOM 1589 OG1 THR A 642 -2.224 -7.528 6.338 1.00 43.35 O ATOM 1590 CG2 THR A 642 -2.096 -9.833 6.658 1.00 5.13 C ATOM 0 H THR A 642 -4.303 -8.887 8.147 1.00 52.23 H new ATOM 0 HA THR A 642 -1.650 -8.301 9.374 1.00 72.44 H new ATOM 0 HB THR A 642 -0.598 -8.468 7.391 1.00 73.40 H new ATOM 0 HG1 THR A 642 -3.003 -7.914 5.886 1.00 43.35 H new ATOM 0 HG21 THR A 642 -1.571 -10.000 5.717 1.00 5.13 H new ATOM 0 HG22 THR A 642 -1.844 -10.628 7.360 1.00 5.13 H new ATOM 0 HG23 THR A 642 -3.171 -9.835 6.479 1.00 5.13 H new ATOM 1598 N PRO A 643 -1.911 -5.820 8.980 1.00 1.33 N ATOM 1599 CA PRO A 643 -2.236 -4.410 9.116 1.00 73.12 C ATOM 1600 C PRO A 643 -2.470 -3.767 7.747 1.00 30.31 C ATOM 1601 O PRO A 643 -2.706 -2.564 7.655 1.00 52.32 O ATOM 1602 CB PRO A 643 -1.059 -3.805 9.863 1.00 14.32 C ATOM 1603 CG PRO A 643 0.085 -4.793 9.710 1.00 71.51 C ATOM 1604 CD PRO A 643 -0.495 -6.102 9.198 1.00 51.23 C ATOM 0 HA PRO A 643 -3.165 -4.243 9.662 1.00 73.12 H new ATOM 0 HB2 PRO A 643 -0.793 -2.832 9.450 1.00 14.32 H new ATOM 0 HB3 PRO A 643 -1.302 -3.649 10.914 1.00 14.32 H new ATOM 0 HG2 PRO A 643 0.831 -4.408 9.015 1.00 71.51 H new ATOM 0 HG3 PRO A 643 0.588 -4.946 10.665 1.00 71.51 H new ATOM 0 HD2 PRO A 643 -0.007 -6.417 8.275 1.00 51.23 H new ATOM 0 HD3 PRO A 643 -0.358 -6.906 9.922 1.00 51.23 H new ATOM 1612 N GLN A 644 -2.396 -4.599 6.718 1.00 11.41 N ATOM 1613 CA GLN A 644 -2.597 -4.126 5.359 1.00 62.43 C ATOM 1614 C GLN A 644 -3.869 -4.736 4.767 1.00 32.53 C ATOM 1615 O GLN A 644 -4.268 -4.393 3.655 1.00 2.15 O ATOM 1616 CB GLN A 644 -1.381 -4.440 4.484 1.00 0.33 C ATOM 1617 CG GLN A 644 -0.093 -4.427 5.311 1.00 54.23 C ATOM 1618 CD GLN A 644 1.133 -4.252 4.412 1.00 31.34 C ATOM 1619 OE1 GLN A 644 1.656 -3.164 4.236 1.00 32.15 O ATOM 1620 NE2 GLN A 644 1.561 -5.382 3.856 1.00 51.11 N ATOM 0 H GLN A 644 -2.200 -5.597 6.798 1.00 11.41 H new ATOM 0 HA GLN A 644 -2.715 -3.043 5.386 1.00 62.43 H new ATOM 0 HB2 GLN A 644 -1.507 -5.416 4.016 1.00 0.33 H new ATOM 0 HB3 GLN A 644 -1.308 -3.708 3.680 1.00 0.33 H new ATOM 0 HG2 GLN A 644 -0.133 -3.618 6.040 1.00 54.23 H new ATOM 0 HG3 GLN A 644 -0.007 -5.357 5.872 1.00 54.23 H new ATOM 0 HE21 GLN A 644 1.076 -6.259 4.046 1.00 51.11 H new ATOM 0 HE22 GLN A 644 2.374 -5.371 3.240 1.00 51.11 H new ATOM 1629 N GLY A 645 -4.471 -5.631 5.537 1.00 14.11 N ATOM 1630 CA GLY A 645 -5.691 -6.292 5.103 1.00 25.02 C ATOM 1631 C GLY A 645 -5.558 -7.812 5.211 1.00 21.51 C ATOM 1632 O GLY A 645 -4.491 -8.366 4.951 1.00 23.14 O ATOM 0 H GLY A 645 -4.137 -5.914 6.458 1.00 14.11 H new ATOM 0 HA2 GLY A 645 -6.529 -5.952 5.711 1.00 25.02 H new ATOM 0 HA3 GLY A 645 -5.912 -6.015 4.072 1.00 25.02 H new ATOM 1636 N ARG A 646 -6.657 -8.445 5.595 1.00 53.43 N ATOM 1637 CA ARG A 646 -6.677 -9.890 5.740 1.00 34.21 C ATOM 1638 C ARG A 646 -6.291 -10.562 4.421 1.00 40.22 C ATOM 1639 O ARG A 646 -6.547 -10.021 3.346 1.00 13.24 O ATOM 1640 CB ARG A 646 -8.062 -10.382 6.168 1.00 4.53 C ATOM 1641 CG ARG A 646 -8.202 -10.365 7.692 1.00 71.12 C ATOM 1642 CD ARG A 646 -9.560 -10.922 8.123 1.00 32.42 C ATOM 1643 NE ARG A 646 -10.596 -9.871 8.014 1.00 74.31 N ATOM 1644 CZ ARG A 646 -10.899 -9.001 9.001 1.00 61.22 C ATOM 1645 NH1 ARG A 646 -10.245 -9.050 10.181 1.00 14.31 N ATOM 1646 NH2 ARG A 646 -11.843 -8.102 8.794 1.00 34.44 N ATOM 0 H ARG A 646 -7.540 -7.983 5.810 1.00 53.43 H new ATOM 0 HA ARG A 646 -5.955 -10.155 6.512 1.00 34.21 H new ATOM 0 HB2 ARG A 646 -8.830 -9.751 5.721 1.00 4.53 H new ATOM 0 HB3 ARG A 646 -8.224 -11.393 5.795 1.00 4.53 H new ATOM 0 HG2 ARG A 646 -7.403 -10.956 8.141 1.00 71.12 H new ATOM 0 HG3 ARG A 646 -8.090 -9.345 8.060 1.00 71.12 H new ATOM 0 HD2 ARG A 646 -9.828 -11.774 7.498 1.00 32.42 H new ATOM 0 HD3 ARG A 646 -9.504 -11.284 9.150 1.00 32.42 H new ATOM 0 HE ARG A 646 -11.114 -9.799 7.138 1.00 74.31 H new ATOM 0 HH11 ARG A 646 -9.516 -9.748 10.332 1.00 14.31 H new ATOM 0 HH12 ARG A 646 -10.480 -8.389 10.922 1.00 14.31 H new ATOM 0 HH21 ARG A 646 -12.331 -8.072 7.899 1.00 34.44 H new ATOM 0 HH22 ARG A 646 -12.084 -7.437 9.529 1.00 34.44 H new ATOM 1659 N ILE A 647 -5.680 -11.731 4.545 1.00 35.05 N ATOM 1660 CA ILE A 647 -5.256 -12.482 3.376 1.00 32.22 C ATOM 1661 C ILE A 647 -5.601 -13.960 3.572 1.00 53.22 C ATOM 1662 O ILE A 647 -5.235 -14.558 4.582 1.00 30.12 O ATOM 1663 CB ILE A 647 -3.775 -12.230 3.086 1.00 54.24 C ATOM 1664 CG1 ILE A 647 -3.510 -10.743 2.841 1.00 13.21 C ATOM 1665 CG2 ILE A 647 -3.289 -13.097 1.923 1.00 72.41 C ATOM 1666 CD1 ILE A 647 -2.032 -10.408 3.051 1.00 14.53 C ATOM 0 H ILE A 647 -5.468 -12.177 5.438 1.00 35.05 H new ATOM 0 HA ILE A 647 -5.793 -12.143 2.490 1.00 32.22 H new ATOM 0 HB ILE A 647 -3.201 -12.519 3.966 1.00 54.24 H new ATOM 0 HG12 ILE A 647 -3.806 -10.480 1.825 1.00 13.21 H new ATOM 0 HG13 ILE A 647 -4.122 -10.145 3.516 1.00 13.21 H new ATOM 0 HG21 ILE A 647 -2.233 -12.898 1.738 1.00 72.41 H new ATOM 0 HG22 ILE A 647 -3.422 -14.149 2.174 1.00 72.41 H new ATOM 0 HG23 ILE A 647 -3.865 -12.862 1.028 1.00 72.41 H new ATOM 0 HD11 ILE A 647 -1.871 -9.345 2.871 1.00 14.53 H new ATOM 0 HD12 ILE A 647 -1.746 -10.650 4.075 1.00 14.53 H new ATOM 0 HD13 ILE A 647 -1.425 -10.990 2.358 1.00 14.53 H new ATOM 1678 N GLN A 648 -6.302 -14.506 2.589 1.00 12.10 N ATOM 1679 CA GLN A 648 -6.701 -15.902 2.640 1.00 21.34 C ATOM 1680 C GLN A 648 -6.293 -16.619 1.351 1.00 1.44 C ATOM 1681 O GLN A 648 -6.832 -16.336 0.283 1.00 42.44 O ATOM 1682 CB GLN A 648 -8.205 -16.034 2.888 1.00 21.34 C ATOM 1683 CG GLN A 648 -8.509 -17.235 3.786 1.00 32.13 C ATOM 1684 CD GLN A 648 -7.936 -18.523 3.192 1.00 25.24 C ATOM 1685 OE1 GLN A 648 -6.741 -18.772 3.220 1.00 75.10 O ATOM 1686 NE2 GLN A 648 -8.850 -19.326 2.655 1.00 13.44 N ATOM 0 H GLN A 648 -6.604 -14.007 1.752 1.00 12.10 H new ATOM 0 HA GLN A 648 -6.185 -16.376 3.475 1.00 21.34 H new ATOM 0 HB2 GLN A 648 -8.582 -15.123 3.353 1.00 21.34 H new ATOM 0 HB3 GLN A 648 -8.726 -16.145 1.937 1.00 21.34 H new ATOM 0 HG2 GLN A 648 -8.087 -17.068 4.777 1.00 32.13 H new ATOM 0 HG3 GLN A 648 -9.587 -17.336 3.911 1.00 32.13 H new ATOM 0 HE21 GLN A 648 -9.834 -19.057 2.665 1.00 13.44 H new ATOM 0 HE22 GLN A 648 -8.567 -20.211 2.233 1.00 13.44 H new ATOM 1695 N ALA A 649 -5.344 -17.532 1.495 1.00 73.42 N ATOM 1696 CA ALA A 649 -4.858 -18.291 0.355 1.00 22.32 C ATOM 1697 C ALA A 649 -5.260 -19.759 0.516 1.00 53.42 C ATOM 1698 O ALA A 649 -5.457 -20.233 1.633 1.00 32.34 O ATOM 1699 CB ALA A 649 -3.343 -18.112 0.231 1.00 34.34 C ATOM 0 H ALA A 649 -4.899 -17.763 2.383 1.00 73.42 H new ATOM 0 HA ALA A 649 -5.307 -17.926 -0.569 1.00 22.32 H new ATOM 0 HB1 ALA A 649 -2.978 -18.681 -0.624 1.00 34.34 H new ATOM 0 HB2 ALA A 649 -3.112 -17.056 0.089 1.00 34.34 H new ATOM 0 HB3 ALA A 649 -2.859 -18.471 1.139 1.00 34.34 H new ATOM 1705 N LYS A 650 -5.371 -20.436 -0.617 1.00 63.24 N ATOM 1706 CA LYS A 650 -5.746 -21.840 -0.616 1.00 52.15 C ATOM 1707 C LYS A 650 -4.484 -22.701 -0.531 1.00 13.11 C ATOM 1708 O LYS A 650 -4.568 -23.917 -0.368 1.00 33.12 O ATOM 1709 CB LYS A 650 -6.628 -22.159 -1.825 1.00 61.44 C ATOM 1710 CG LYS A 650 -7.526 -20.972 -2.178 1.00 41.12 C ATOM 1711 CD LYS A 650 -8.852 -21.446 -2.776 1.00 33.04 C ATOM 1712 CE LYS A 650 -9.852 -20.292 -2.875 1.00 33.41 C ATOM 1713 NZ LYS A 650 -10.586 -20.131 -1.600 1.00 21.24 N ATOM 0 H LYS A 650 -5.208 -20.039 -1.542 1.00 63.24 H new ATOM 0 HA LYS A 650 -6.350 -22.073 0.261 1.00 52.15 H new ATOM 0 HB2 LYS A 650 -6.001 -22.412 -2.680 1.00 61.44 H new ATOM 0 HB3 LYS A 650 -7.243 -23.033 -1.610 1.00 61.44 H new ATOM 0 HG2 LYS A 650 -7.718 -20.378 -1.284 1.00 41.12 H new ATOM 0 HG3 LYS A 650 -7.014 -20.323 -2.888 1.00 41.12 H new ATOM 0 HD2 LYS A 650 -8.679 -21.868 -3.766 1.00 33.04 H new ATOM 0 HD3 LYS A 650 -9.269 -22.242 -2.159 1.00 33.04 H new ATOM 0 HE2 LYS A 650 -9.327 -19.368 -3.118 1.00 33.41 H new ATOM 0 HE3 LYS A 650 -10.556 -20.482 -3.685 1.00 33.41 H new ATOM 0 HZ1 LYS A 650 -11.260 -19.344 -1.685 1.00 21.24 H new ATOM 0 HZ2 LYS A 650 -11.102 -21.007 -1.384 1.00 21.24 H new ATOM 0 HZ3 LYS A 650 -9.912 -19.929 -0.834 1.00 21.24 H new ATOM 1726 N LYS A 651 -3.344 -22.036 -0.645 1.00 10.11 N ATOM 1727 CA LYS A 651 -2.066 -22.725 -0.582 1.00 74.14 C ATOM 1728 C LYS A 651 -1.084 -21.895 0.246 1.00 41.21 C ATOM 1729 O LYS A 651 -1.215 -20.675 0.331 1.00 2.33 O ATOM 1730 CB LYS A 651 -1.563 -23.049 -1.990 1.00 70.24 C ATOM 1731 CG LYS A 651 -2.471 -24.073 -2.675 1.00 52.43 C ATOM 1732 CD LYS A 651 -3.636 -23.382 -3.388 1.00 45.13 C ATOM 1733 CE LYS A 651 -3.274 -23.055 -4.839 1.00 30.34 C ATOM 1734 NZ LYS A 651 -3.628 -24.184 -5.728 1.00 24.42 N ATOM 0 H LYS A 651 -3.278 -21.027 -0.781 1.00 10.11 H new ATOM 0 HA LYS A 651 -2.175 -23.685 -0.078 1.00 74.14 H new ATOM 0 HB2 LYS A 651 -1.524 -22.137 -2.585 1.00 70.24 H new ATOM 0 HB3 LYS A 651 -0.546 -23.438 -1.936 1.00 70.24 H new ATOM 0 HG2 LYS A 651 -1.893 -24.654 -3.394 1.00 52.43 H new ATOM 0 HG3 LYS A 651 -2.857 -24.774 -1.935 1.00 52.43 H new ATOM 0 HD2 LYS A 651 -4.515 -24.026 -3.365 1.00 45.13 H new ATOM 0 HD3 LYS A 651 -3.899 -22.466 -2.859 1.00 45.13 H new ATOM 0 HE2 LYS A 651 -3.800 -22.155 -5.157 1.00 30.34 H new ATOM 0 HE3 LYS A 651 -2.207 -22.845 -4.915 1.00 30.34 H new ATOM 0 HZ1 LYS A 651 -3.376 -23.946 -6.709 1.00 24.42 H new ATOM 0 HZ2 LYS A 651 -3.107 -25.034 -5.433 1.00 24.42 H new ATOM 0 HZ3 LYS A 651 -4.650 -24.366 -5.668 1.00 24.42 H new ATOM 1747 N TRP A 652 -0.122 -22.589 0.835 1.00 22.33 N ATOM 1748 CA TRP A 652 0.882 -21.931 1.654 1.00 64.41 C ATOM 1749 C TRP A 652 1.871 -21.233 0.718 1.00 2.35 C ATOM 1750 O TRP A 652 2.712 -20.455 1.167 1.00 21.10 O ATOM 1751 CB TRP A 652 1.556 -22.927 2.600 1.00 1.35 C ATOM 1752 CG TRP A 652 0.593 -23.611 3.573 1.00 51.33 C ATOM 1753 CD1 TRP A 652 -0.275 -24.599 3.316 1.00 24.41 C ATOM 1754 CD2 TRP A 652 0.434 -23.315 4.976 1.00 13.22 C ATOM 1755 NE1 TRP A 652 -0.978 -24.961 4.447 1.00 54.22 N ATOM 1756 CE2 TRP A 652 -0.534 -24.155 5.488 1.00 1.14 C ATOM 1757 CE3 TRP A 652 1.086 -22.369 5.786 1.00 11.43 C ATOM 1758 CZ2 TRP A 652 -0.936 -24.133 6.829 1.00 34.22 C ATOM 1759 CZ3 TRP A 652 0.672 -22.359 7.124 1.00 62.52 C ATOM 1760 CH2 TRP A 652 -0.300 -23.198 7.655 1.00 74.51 C ATOM 0 H TRP A 652 -0.016 -23.601 0.762 1.00 22.33 H new ATOM 0 HA TRP A 652 0.424 -21.181 2.299 1.00 64.41 H new ATOM 0 HB2 TRP A 652 2.061 -23.690 2.008 1.00 1.35 H new ATOM 0 HB3 TRP A 652 2.325 -22.407 3.171 1.00 1.35 H new ATOM 0 HD1 TRP A 652 -0.408 -25.055 2.346 1.00 24.41 H new ATOM 0 HE1 TRP A 652 -1.692 -25.687 4.508 1.00 54.22 H new ATOM 0 HE3 TRP A 652 1.846 -21.702 5.406 1.00 11.43 H new ATOM 0 HZ2 TRP A 652 -1.696 -24.801 7.206 1.00 34.22 H new ATOM 0 HZ3 TRP A 652 1.141 -21.650 7.790 1.00 62.52 H new ATOM 0 HH2 TRP A 652 -0.564 -23.129 8.700 1.00 74.51 H new ATOM 1771 N SER A 653 1.738 -21.535 -0.565 1.00 35.05 N ATOM 1772 CA SER A 653 2.609 -20.946 -1.567 1.00 52.30 C ATOM 1773 C SER A 653 2.372 -19.436 -1.644 1.00 20.12 C ATOM 1774 O SER A 653 3.141 -18.715 -2.278 1.00 74.01 O ATOM 1775 CB SER A 653 2.385 -21.588 -2.937 1.00 62.43 C ATOM 1776 OG SER A 653 3.447 -21.298 -3.843 1.00 14.12 O ATOM 0 H SER A 653 1.040 -22.180 -0.934 1.00 35.05 H new ATOM 0 HA SER A 653 3.642 -21.131 -1.273 1.00 52.30 H new ATOM 0 HB2 SER A 653 2.293 -22.668 -2.821 1.00 62.43 H new ATOM 0 HB3 SER A 653 1.444 -21.231 -3.355 1.00 62.43 H new ATOM 0 HG SER A 653 3.851 -20.437 -3.608 1.00 14.12 H new ATOM 1782 N ARG A 654 1.305 -19.003 -0.989 1.00 2.34 N ATOM 1783 CA ARG A 654 0.958 -17.592 -0.975 1.00 15.14 C ATOM 1784 C ARG A 654 1.292 -16.976 0.386 1.00 62.25 C ATOM 1785 O ARG A 654 1.291 -15.755 0.535 1.00 22.34 O ATOM 1786 CB ARG A 654 -0.531 -17.388 -1.266 1.00 65.45 C ATOM 1787 CG ARG A 654 -1.057 -18.471 -2.210 1.00 72.53 C ATOM 1788 CD ARG A 654 -0.251 -18.506 -3.510 1.00 44.40 C ATOM 1789 NE ARG A 654 -1.040 -19.157 -4.579 1.00 33.13 N ATOM 1790 CZ ARG A 654 -1.915 -18.508 -5.376 1.00 41.13 C ATOM 1791 NH1 ARG A 654 -2.119 -17.181 -5.232 1.00 35.31 N ATOM 1792 NH2 ARG A 654 -2.567 -19.190 -6.299 1.00 52.33 N ATOM 0 H ARG A 654 0.670 -19.604 -0.464 1.00 2.34 H new ATOM 0 HA ARG A 654 1.541 -17.100 -1.754 1.00 15.14 H new ATOM 0 HB2 ARG A 654 -1.094 -17.409 -0.333 1.00 65.45 H new ATOM 0 HB3 ARG A 654 -0.687 -16.405 -1.711 1.00 65.45 H new ATOM 0 HG2 ARG A 654 -1.004 -19.443 -1.719 1.00 72.53 H new ATOM 0 HG3 ARG A 654 -2.107 -18.284 -2.434 1.00 72.53 H new ATOM 0 HD2 ARG A 654 0.015 -17.492 -3.810 1.00 44.40 H new ATOM 0 HD3 ARG A 654 0.682 -19.048 -3.354 1.00 44.40 H new ATOM 0 HE ARG A 654 -0.915 -20.159 -4.723 1.00 33.13 H new ATOM 0 HH11 ARG A 654 -1.610 -16.661 -4.517 1.00 35.31 H new ATOM 0 HH12 ARG A 654 -2.782 -16.698 -5.838 1.00 35.31 H new ATOM 0 HH21 ARG A 654 -2.406 -20.192 -6.402 1.00 52.33 H new ATOM 0 HH22 ARG A 654 -3.232 -18.715 -6.910 1.00 52.33 H new ATOM 1805 N VAL A 655 1.571 -17.849 1.342 1.00 34.42 N ATOM 1806 CA VAL A 655 1.907 -17.407 2.685 1.00 55.11 C ATOM 1807 C VAL A 655 2.810 -16.175 2.600 1.00 13.21 C ATOM 1808 O VAL A 655 3.961 -16.272 2.177 1.00 33.44 O ATOM 1809 CB VAL A 655 2.537 -18.557 3.473 1.00 73.13 C ATOM 1810 CG1 VAL A 655 3.355 -18.030 4.653 1.00 41.41 C ATOM 1811 CG2 VAL A 655 1.470 -19.548 3.944 1.00 3.20 C ATOM 0 H VAL A 655 1.571 -18.861 1.214 1.00 34.42 H new ATOM 0 HA VAL A 655 1.008 -17.115 3.227 1.00 55.11 H new ATOM 0 HB VAL A 655 3.216 -19.088 2.806 1.00 73.13 H new ATOM 0 HG11 VAL A 655 3.792 -18.868 5.196 1.00 41.41 H new ATOM 0 HG12 VAL A 655 4.151 -17.383 4.284 1.00 41.41 H new ATOM 0 HG13 VAL A 655 2.706 -17.463 5.321 1.00 41.41 H new ATOM 0 HG21 VAL A 655 1.944 -20.356 4.502 1.00 3.20 H new ATOM 0 HG22 VAL A 655 0.755 -19.035 4.587 1.00 3.20 H new ATOM 0 HG23 VAL A 655 0.950 -19.961 3.080 1.00 3.20 H new ATOM 1821 N PRO A 656 2.239 -15.014 3.020 1.00 41.24 N ATOM 1822 CA PRO A 656 2.980 -13.764 2.995 1.00 31.22 C ATOM 1823 C PRO A 656 4.004 -13.712 4.131 1.00 40.53 C ATOM 1824 O PRO A 656 5.048 -13.074 4.001 1.00 70.11 O ATOM 1825 CB PRO A 656 1.922 -12.678 3.098 1.00 1.44 C ATOM 1826 CG PRO A 656 0.677 -13.359 3.643 1.00 52.54 C ATOM 1827 CD PRO A 656 0.878 -14.861 3.526 1.00 5.44 C ATOM 0 HA PRO A 656 3.570 -13.642 2.086 1.00 31.22 H new ATOM 0 HB2 PRO A 656 2.249 -11.875 3.759 1.00 1.44 H new ATOM 0 HB3 PRO A 656 1.727 -12.229 2.124 1.00 1.44 H new ATOM 0 HG2 PRO A 656 0.511 -13.076 4.682 1.00 52.54 H new ATOM 0 HG3 PRO A 656 -0.205 -13.047 3.083 1.00 52.54 H new ATOM 0 HD2 PRO A 656 0.757 -15.353 4.491 1.00 5.44 H new ATOM 0 HD3 PRO A 656 0.151 -15.306 2.847 1.00 5.44 H new ATOM 1835 N PHE A 657 3.670 -14.390 5.218 1.00 35.33 N ATOM 1836 CA PHE A 657 4.547 -14.429 6.376 1.00 41.03 C ATOM 1837 C PHE A 657 5.609 -15.520 6.222 1.00 0.35 C ATOM 1838 O PHE A 657 5.484 -16.398 5.370 1.00 52.41 O ATOM 1839 CB PHE A 657 3.673 -14.752 7.589 1.00 11.21 C ATOM 1840 CG PHE A 657 2.985 -16.117 7.515 1.00 1.41 C ATOM 1841 CD1 PHE A 657 1.784 -16.240 6.889 1.00 12.43 C ATOM 1842 CD2 PHE A 657 3.575 -17.207 8.075 1.00 51.40 C ATOM 1843 CE1 PHE A 657 1.145 -17.506 6.821 1.00 65.14 C ATOM 1844 CE2 PHE A 657 2.936 -18.473 8.006 1.00 25.23 C ATOM 1845 CZ PHE A 657 1.735 -18.596 7.381 1.00 62.24 C ATOM 0 H PHE A 657 2.803 -14.918 5.322 1.00 35.33 H new ATOM 0 HA PHE A 657 5.059 -13.473 6.487 1.00 41.03 H new ATOM 0 HB2 PHE A 657 4.289 -14.715 8.488 1.00 11.21 H new ATOM 0 HB3 PHE A 657 2.912 -13.978 7.692 1.00 11.21 H new ATOM 0 HD1 PHE A 657 1.316 -15.374 6.444 1.00 12.43 H new ATOM 0 HD2 PHE A 657 4.529 -17.110 8.572 1.00 51.40 H new ATOM 0 HE1 PHE A 657 0.191 -17.603 6.325 1.00 65.14 H new ATOM 0 HE2 PHE A 657 3.404 -19.339 8.450 1.00 25.23 H new ATOM 0 HZ PHE A 657 1.249 -19.559 7.329 1.00 62.24 H new ATOM 1855 N SER A 658 6.630 -15.429 7.061 1.00 4.44 N ATOM 1856 CA SER A 658 7.714 -16.397 7.030 1.00 55.22 C ATOM 1857 C SER A 658 7.384 -17.581 7.941 1.00 55.12 C ATOM 1858 O SER A 658 6.678 -17.425 8.936 1.00 22.24 O ATOM 1859 CB SER A 658 9.037 -15.756 7.451 1.00 44.01 C ATOM 1860 OG SER A 658 9.084 -14.368 7.131 1.00 64.11 O ATOM 0 H SER A 658 6.730 -14.700 7.767 1.00 4.44 H new ATOM 0 HA SER A 658 7.824 -16.754 6.006 1.00 55.22 H new ATOM 0 HB2 SER A 658 9.177 -15.885 8.524 1.00 44.01 H new ATOM 0 HB3 SER A 658 9.862 -16.270 6.958 1.00 44.01 H new ATOM 0 HG SER A 658 9.944 -13.995 7.417 1.00 64.11 H new ATOM 1866 N VAL A 659 7.909 -18.738 7.567 1.00 24.22 N ATOM 1867 CA VAL A 659 7.680 -19.948 8.338 1.00 34.31 C ATOM 1868 C VAL A 659 8.961 -20.785 8.360 1.00 55.20 C ATOM 1869 O VAL A 659 9.269 -21.480 7.394 1.00 75.45 O ATOM 1870 CB VAL A 659 6.478 -20.709 7.773 1.00 45.25 C ATOM 1871 CG1 VAL A 659 5.826 -21.580 8.847 1.00 32.24 C ATOM 1872 CG2 VAL A 659 5.462 -19.747 7.154 1.00 10.25 C ATOM 0 H VAL A 659 8.493 -18.863 6.740 1.00 24.22 H new ATOM 0 HA VAL A 659 7.436 -19.701 9.371 1.00 34.31 H new ATOM 0 HB VAL A 659 6.839 -21.368 6.983 1.00 45.25 H new ATOM 0 HG11 VAL A 659 4.975 -22.109 8.419 1.00 32.24 H new ATOM 0 HG12 VAL A 659 6.552 -22.302 9.220 1.00 32.24 H new ATOM 0 HG13 VAL A 659 5.485 -20.950 9.669 1.00 32.24 H new ATOM 0 HG21 VAL A 659 4.618 -20.313 6.760 1.00 10.25 H new ATOM 0 HG22 VAL A 659 5.109 -19.052 7.915 1.00 10.25 H new ATOM 0 HG23 VAL A 659 5.934 -19.190 6.345 1.00 10.25 H new ATOM 1882 N PRO A 660 9.691 -20.687 9.503 1.00 44.13 N ATOM 1883 CA PRO A 660 10.932 -21.426 9.663 1.00 31.13 C ATOM 1884 C PRO A 660 10.657 -22.908 9.925 1.00 61.40 C ATOM 1885 O PRO A 660 9.525 -23.292 10.216 1.00 1.52 O ATOM 1886 CB PRO A 660 11.651 -20.743 10.815 1.00 13.12 C ATOM 1887 CG PRO A 660 10.588 -19.947 11.556 1.00 24.53 C ATOM 1888 CD PRO A 660 9.357 -19.873 10.668 1.00 44.01 C ATOM 0 HA PRO A 660 11.548 -21.414 8.764 1.00 31.13 H new ATOM 0 HB2 PRO A 660 12.120 -21.475 11.472 1.00 13.12 H new ATOM 0 HB3 PRO A 660 12.443 -20.090 10.449 1.00 13.12 H new ATOM 0 HG2 PRO A 660 10.346 -20.425 12.505 1.00 24.53 H new ATOM 0 HG3 PRO A 660 10.953 -18.946 11.787 1.00 24.53 H new ATOM 0 HD2 PRO A 660 8.475 -20.258 11.180 1.00 44.01 H new ATOM 0 HD3 PRO A 660 9.136 -18.845 10.382 1.00 44.01 H new ATOM 1896 N ASP A 661 11.712 -23.702 9.812 1.00 50.12 N ATOM 1897 CA ASP A 661 11.599 -25.134 10.033 1.00 53.44 C ATOM 1898 C ASP A 661 11.852 -25.439 11.510 1.00 10.13 C ATOM 1899 O ASP A 661 12.581 -24.711 12.182 1.00 12.33 O ATOM 1900 CB ASP A 661 12.633 -25.902 9.207 1.00 13.22 C ATOM 1901 CG ASP A 661 14.049 -25.323 9.244 1.00 33.43 C ATOM 1902 OD1 ASP A 661 14.328 -24.279 8.637 1.00 62.33 O ATOM 1903 OD2 ASP A 661 14.896 -26.001 9.943 1.00 51.52 O ATOM 0 H ASP A 661 12.649 -23.381 9.570 1.00 50.12 H new ATOM 0 HA ASP A 661 10.597 -25.443 9.734 1.00 53.44 H new ATOM 0 HB2 ASP A 661 12.668 -26.932 9.563 1.00 13.22 H new ATOM 0 HB3 ASP A 661 12.297 -25.934 8.171 1.00 13.22 H new ATOM 1909 N PHE A 662 11.236 -26.517 11.973 1.00 41.11 N ATOM 1910 CA PHE A 662 11.386 -26.928 13.359 1.00 53.43 C ATOM 1911 C PHE A 662 12.862 -26.979 13.759 1.00 75.51 C ATOM 1912 O PHE A 662 13.739 -27.059 12.900 1.00 32.24 O ATOM 1913 CB PHE A 662 10.788 -28.331 13.476 1.00 10.02 C ATOM 1914 CG PHE A 662 10.330 -28.696 14.890 1.00 44.01 C ATOM 1915 CD1 PHE A 662 9.717 -27.764 15.668 1.00 25.21 C ATOM 1916 CD2 PHE A 662 10.537 -29.952 15.368 1.00 35.42 C ATOM 1917 CE1 PHE A 662 9.293 -28.103 16.980 1.00 13.11 C ATOM 1918 CE2 PHE A 662 10.112 -30.291 16.680 1.00 32.11 C ATOM 1919 CZ PHE A 662 9.499 -29.359 17.458 1.00 32.34 C ATOM 0 H PHE A 662 10.632 -27.118 11.413 1.00 41.11 H new ATOM 0 HA PHE A 662 10.885 -26.216 14.015 1.00 53.43 H new ATOM 0 HB2 PHE A 662 9.938 -28.410 12.798 1.00 10.02 H new ATOM 0 HB3 PHE A 662 11.529 -29.059 13.146 1.00 10.02 H new ATOM 0 HD1 PHE A 662 9.553 -26.766 15.288 1.00 25.21 H new ATOM 0 HD2 PHE A 662 11.024 -30.692 14.750 1.00 35.42 H new ATOM 0 HE1 PHE A 662 8.807 -27.363 17.598 1.00 13.11 H new ATOM 0 HE2 PHE A 662 10.276 -31.289 17.060 1.00 32.11 H new ATOM 0 HZ PHE A 662 9.176 -29.617 18.456 1.00 32.34 H new