USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1080 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+ -142:sc= 0.84 (180deg=0) USER MOD Set 1.2: A 637 SER OG : rot -100:sc= -1.78 USER MOD Set 2.1: A 622 GLN : amide:sc= -0.621 K(o=-0.89,f=-2.4) USER MOD Set 2.2: A 629 LYS NZ :NH3+ -164:sc= -0.265 (180deg=-1.24) USER MOD Set 3.1: A 581 ASN : amide:sc= -4.79! C(o=-4.5!,f=-12!) USER MOD Set 3.2: A 583 ASN : amide:sc= 0.274 K(o=-4.5,f=-12) USER MOD Set 4.1: A 571 LYS NZ :NH3+ 138:sc= -0.762 (180deg=0) USER MOD Set 4.2: A 577 HIS : no HE2:sc= -23! C(o=-24!,f=-20!) USER MOD Set 5.1: A 553 GLN : amide:sc= -1.8 K(o=-3.3,f=-9!) USER MOD Set 5.2: A 565 HIS : no HD1:sc= -1.51 K(o=-3.3,f=-5.9!) USER MOD Single : A 544 HIS : no HD1:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 545 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 546 GLN : amide:sc= -1.89 K(o=-1.9,f=-0.26) USER MOD Single : A 551 HIS : no HD1:sc= -0.874 X(o=-0.87,f=-1.3) USER MOD Single : A 558 ASN : amide:sc=-0.00829 K(o=-0.0083,f=-2.7) USER MOD Single : A 560 MET CE :methyl 155:sc= -0.143 (180deg=-1.15) USER MOD Single : A 567 SER OG : rot -43:sc= -0.397 USER MOD Single : A 575 THR OG1 : rot -160:sc= -0.111 USER MOD Single : A 576 HIS : no HE2:sc= -3.75 K(o=-3.7,f=-4.5!) USER MOD Single : A 579 ASN : amide:sc= -4.91! C(o=-4.9!,f=-2.7!) USER MOD Single : A 585 SER OG : rot -79:sc= 0.473 USER MOD Single : A 586 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 587 TYR OH : rot -70:sc= 0.491 USER MOD Single : A 588 TYR OH : rot 180:sc= 0 USER MOD Single : A 589 ASN : amide:sc= -0.465 X(o=-0.47,f=-0.022) USER MOD Single : A 591 SER OG : rot -131:sc= 0.256 USER MOD Single : A 598 ASN : amide:sc= -0.072 K(o=-0.072,f=-1.4) USER MOD Single : A 599 LYS NZ :NH3+ -125:sc= 0.0513 (180deg=0) USER MOD Single : A 602 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 605 LYS NZ :NH3+ -140:sc= -0.366 (180deg=-1.87!) USER MOD Single : A 611 SER OG : rot 42:sc= 0.273 USER MOD Single : A 614 ASN : amide:sc= -3.31! K(o=-3.3!,f=-2.5) USER MOD Single : A 623 MET CE :methyl 180:sc= 0 (180deg=0) 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 -48:sc= 0.585 USER MOD Single : A 638 MET CE :methyl -147:sc= -8.37! (180deg=-10.3!) USER MOD Single : A 642 THR OG1 : rot -98:sc= 0.879 USER MOD Single : A 644 GLN : amide:sc= -0.0422 X(o=-0.042,f=0) USER MOD Single : A 648 GLN : amide:sc= -4.62 K(o=-4.6,f=-6.1!) 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 180:sc= 0 USER MOD Single : A 658 SER OG : rot 180:sc= 0.107 USER MOD Single : A 666 GLN : amide:sc= -0.0436 X(o=-0.044,f=-0.029) USER MOD Single : A 667 HIS : no HE2:sc= -10.1! C(o=-10!,f=-11!) USER MOD Single : A 668 CYS SG : rot 180:sc= -2.6 USER MOD Single : A 671 ASN : amide:sc= -4.66! K(o=-4.7!,f=-1.9) USER MOD Single : A 673 SER OG : rot 180:sc= 0 USER MOD Single : A 676 SER OG : rot 4:sc= 0.949 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 542 5.044 3.933 -1.986 1.00 71.51 N ATOM 2 CA GLY A 542 3.885 3.261 -1.423 1.00 73.25 C ATOM 3 C GLY A 542 4.309 2.117 -0.499 1.00 55.34 C ATOM 4 O GLY A 542 5.487 1.982 -0.173 1.00 13.41 O ATOM 0 HA2 GLY A 542 3.280 3.977 -0.867 1.00 73.25 H new ATOM 0 HA3 GLY A 542 3.260 2.871 -2.227 1.00 73.25 H new ATOM 8 N PRO A 543 3.299 1.302 -0.094 1.00 35.15 N ATOM 9 CA PRO A 543 3.555 0.174 0.786 1.00 14.44 C ATOM 10 C PRO A 543 4.222 -0.974 0.027 1.00 44.54 C ATOM 11 O PRO A 543 3.972 -1.165 -1.162 1.00 55.32 O ATOM 12 CB PRO A 543 2.195 -0.200 1.352 1.00 15.35 C ATOM 13 CG PRO A 543 1.169 0.425 0.420 1.00 30.42 C ATOM 14 CD PRO A 543 1.891 1.431 -0.460 1.00 43.31 C ATOM 0 HA PRO A 543 4.253 0.416 1.588 1.00 14.44 H new ATOM 0 HB2 PRO A 543 2.075 -1.282 1.396 1.00 15.35 H new ATOM 0 HB3 PRO A 543 2.079 0.175 2.369 1.00 15.35 H new ATOM 0 HG2 PRO A 543 0.690 -0.341 -0.190 1.00 30.42 H new ATOM 0 HG3 PRO A 543 0.381 0.915 0.993 1.00 30.42 H new ATOM 0 HD2 PRO A 543 1.735 1.216 -1.517 1.00 43.31 H new ATOM 0 HD3 PRO A 543 1.527 2.443 -0.284 1.00 43.31 H new ATOM 22 N HIS A 544 5.060 -1.708 0.744 1.00 13.35 N ATOM 23 CA HIS A 544 5.765 -2.832 0.153 1.00 43.21 C ATOM 24 C HIS A 544 5.170 -4.142 0.672 1.00 72.11 C ATOM 25 O HIS A 544 4.517 -4.162 1.714 1.00 54.30 O ATOM 26 CB HIS A 544 7.270 -2.723 0.407 1.00 41.13 C ATOM 27 CG HIS A 544 7.996 -1.837 -0.577 1.00 64.03 C ATOM 28 ND1 HIS A 544 8.500 -0.594 -0.237 1.00 13.40 N ATOM 29 CD2 HIS A 544 8.299 -2.028 -1.894 1.00 1.05 C ATOM 30 CE1 HIS A 544 9.076 -0.068 -1.308 1.00 23.41 C ATOM 31 NE2 HIS A 544 8.951 -0.959 -2.334 1.00 15.44 N ATOM 0 H HIS A 544 5.267 -1.546 1.730 1.00 13.35 H new ATOM 0 HA HIS A 544 5.635 -2.818 -0.929 1.00 43.21 H new ATOM 0 HB2 HIS A 544 7.431 -2.339 1.414 1.00 41.13 H new ATOM 0 HB3 HIS A 544 7.707 -3.721 0.373 1.00 41.13 H new ATOM 0 HD2 HIS A 544 8.050 -2.901 -2.479 1.00 1.05 H new ATOM 0 HE1 HIS A 544 9.559 0.896 -1.360 1.00 23.41 H new ATOM 0 HE2 HIS A 544 9.301 -0.825 -3.283 1.00 15.44 H new ATOM 39 N MET A 545 5.417 -5.205 -0.079 1.00 74.32 N ATOM 40 CA MET A 545 4.913 -6.517 0.292 1.00 50.13 C ATOM 41 C MET A 545 5.763 -7.136 1.403 1.00 32.41 C ATOM 42 O MET A 545 6.601 -7.997 1.141 1.00 24.34 O ATOM 43 CB MET A 545 4.926 -7.434 -0.933 1.00 23.02 C ATOM 44 CG MET A 545 3.686 -7.209 -1.800 1.00 42.42 C ATOM 45 SD MET A 545 3.538 -8.517 -3.006 1.00 3.43 S ATOM 46 CE MET A 545 2.569 -9.690 -2.073 1.00 13.41 C ATOM 0 H MET A 545 5.959 -5.185 -0.943 1.00 74.32 H new ATOM 0 HA MET A 545 3.894 -6.404 0.661 1.00 50.13 H new ATOM 0 HB2 MET A 545 5.824 -7.248 -1.522 1.00 23.02 H new ATOM 0 HB3 MET A 545 4.966 -8.475 -0.612 1.00 23.02 H new ATOM 0 HG2 MET A 545 2.795 -7.179 -1.173 1.00 42.42 H new ATOM 0 HG3 MET A 545 3.755 -6.245 -2.304 1.00 42.42 H new ATOM 0 HE1 MET A 545 2.383 -10.575 -2.682 1.00 13.41 H new ATOM 0 HE2 MET A 545 3.113 -9.977 -1.173 1.00 13.41 H new ATOM 0 HE3 MET A 545 1.618 -9.236 -1.793 1.00 13.41 H new ATOM 56 N GLN A 546 5.516 -6.674 2.620 1.00 25.00 N ATOM 57 CA GLN A 546 6.249 -7.172 3.772 1.00 15.02 C ATOM 58 C GLN A 546 5.283 -7.505 4.911 1.00 31.22 C ATOM 59 O GLN A 546 4.405 -6.708 5.238 1.00 32.54 O ATOM 60 CB GLN A 546 7.306 -6.164 4.227 1.00 21.32 C ATOM 61 CG GLN A 546 8.564 -6.262 3.362 1.00 3.41 C ATOM 62 CD GLN A 546 9.332 -4.938 3.360 1.00 21.22 C ATOM 63 OE1 GLN A 546 10.426 -4.825 3.888 1.00 44.14 O ATOM 64 NE2 GLN A 546 8.700 -3.947 2.739 1.00 15.32 N ATOM 0 H GLN A 546 4.819 -5.961 2.833 1.00 25.00 H new ATOM 0 HA GLN A 546 6.767 -8.086 3.482 1.00 15.02 H new ATOM 0 HB2 GLN A 546 6.899 -5.154 4.171 1.00 21.32 H new ATOM 0 HB3 GLN A 546 7.563 -6.346 5.271 1.00 21.32 H new ATOM 0 HG2 GLN A 546 9.206 -7.059 3.737 1.00 3.41 H new ATOM 0 HG3 GLN A 546 8.288 -6.528 2.342 1.00 3.41 H new ATOM 0 HE21 GLN A 546 7.785 -4.110 2.318 1.00 15.32 H new ATOM 0 HE22 GLN A 546 9.130 -3.024 2.683 1.00 15.32 H new ATOM 73 N PHE A 547 5.478 -8.684 5.484 1.00 51.02 N ATOM 74 CA PHE A 547 4.635 -9.132 6.579 1.00 22.43 C ATOM 75 C PHE A 547 5.414 -10.038 7.535 1.00 62.51 C ATOM 76 O PHE A 547 5.675 -11.199 7.222 1.00 74.12 O ATOM 77 CB PHE A 547 3.486 -9.931 5.961 1.00 32.04 C ATOM 78 CG PHE A 547 3.025 -9.406 4.600 1.00 35.12 C ATOM 79 CD1 PHE A 547 3.852 -9.488 3.524 1.00 74.42 C ATOM 80 CD2 PHE A 547 1.787 -8.857 4.467 1.00 64.22 C ATOM 81 CE1 PHE A 547 3.424 -9.001 2.261 1.00 75.35 C ATOM 82 CE2 PHE A 547 1.359 -8.370 3.204 1.00 63.14 C ATOM 83 CZ PHE A 547 2.186 -8.452 2.127 1.00 24.41 C ATOM 0 H PHE A 547 6.207 -9.342 5.210 1.00 51.02 H new ATOM 0 HA PHE A 547 4.275 -8.274 7.146 1.00 22.43 H new ATOM 0 HB2 PHE A 547 3.797 -10.970 5.852 1.00 32.04 H new ATOM 0 HB3 PHE A 547 2.640 -9.922 6.648 1.00 32.04 H new ATOM 0 HD1 PHE A 547 4.835 -9.924 3.630 1.00 74.42 H new ATOM 0 HD2 PHE A 547 1.130 -8.792 5.322 1.00 64.22 H new ATOM 0 HE1 PHE A 547 4.081 -9.066 1.406 1.00 75.35 H new ATOM 0 HE2 PHE A 547 0.376 -7.934 3.098 1.00 63.14 H new ATOM 0 HZ PHE A 547 1.860 -8.082 1.166 1.00 24.41 H new ATOM 93 N PRO A 548 5.774 -9.459 8.712 1.00 75.03 N ATOM 94 CA PRO A 548 6.517 -10.201 9.715 1.00 64.40 C ATOM 95 C PRO A 548 5.613 -11.198 10.442 1.00 32.23 C ATOM 96 O PRO A 548 4.477 -10.875 10.787 1.00 43.41 O ATOM 97 CB PRO A 548 7.097 -9.142 10.638 1.00 24.32 C ATOM 98 CG PRO A 548 6.281 -7.884 10.394 1.00 15.11 C ATOM 99 CD PRO A 548 5.482 -8.087 9.117 1.00 43.13 C ATOM 0 HA PRO A 548 7.310 -10.812 9.284 1.00 64.40 H new ATOM 0 HB2 PRO A 548 7.031 -9.454 11.680 1.00 24.32 H new ATOM 0 HB3 PRO A 548 8.152 -8.971 10.422 1.00 24.32 H new ATOM 0 HG2 PRO A 548 5.614 -7.692 11.235 1.00 15.11 H new ATOM 0 HG3 PRO A 548 6.935 -7.017 10.301 1.00 15.11 H new ATOM 0 HD2 PRO A 548 4.415 -7.944 9.290 1.00 43.13 H new ATOM 0 HD3 PRO A 548 5.779 -7.375 8.347 1.00 43.13 H new ATOM 107 N VAL A 549 6.150 -12.391 10.654 1.00 2.54 N ATOM 108 CA VAL A 549 5.406 -13.437 11.335 1.00 52.34 C ATOM 109 C VAL A 549 4.789 -12.868 12.614 1.00 23.33 C ATOM 110 O VAL A 549 3.651 -13.188 12.954 1.00 2.24 O ATOM 111 CB VAL A 549 6.313 -14.642 11.592 1.00 11.41 C ATOM 112 CG1 VAL A 549 6.814 -15.242 10.277 1.00 52.31 C ATOM 113 CG2 VAL A 549 7.483 -14.263 12.503 1.00 54.44 C ATOM 0 H VAL A 549 7.092 -12.656 10.366 1.00 2.54 H new ATOM 0 HA VAL A 549 4.587 -13.792 10.710 1.00 52.34 H new ATOM 0 HB VAL A 549 5.723 -15.402 12.103 1.00 11.41 H new ATOM 0 HG11 VAL A 549 7.456 -16.097 10.489 1.00 52.31 H new ATOM 0 HG12 VAL A 549 5.963 -15.567 9.678 1.00 52.31 H new ATOM 0 HG13 VAL A 549 7.380 -14.490 9.726 1.00 52.31 H new ATOM 0 HG21 VAL A 549 8.112 -15.137 12.670 1.00 54.44 H new ATOM 0 HG22 VAL A 549 8.072 -13.477 12.031 1.00 54.44 H new ATOM 0 HG23 VAL A 549 7.099 -13.905 13.458 1.00 54.44 H new ATOM 123 N GLU A 550 5.568 -12.035 13.289 1.00 61.40 N ATOM 124 CA GLU A 550 5.113 -11.419 14.524 1.00 71.42 C ATOM 125 C GLU A 550 3.831 -10.621 14.278 1.00 43.24 C ATOM 126 O GLU A 550 2.958 -10.560 15.142 1.00 41.33 O ATOM 127 CB GLU A 550 6.203 -10.533 15.129 1.00 64.31 C ATOM 128 CG GLU A 550 6.753 -9.554 14.090 1.00 65.00 C ATOM 129 CD GLU A 550 7.264 -8.275 14.758 1.00 74.42 C ATOM 130 OE1 GLU A 550 8.463 -8.165 15.051 1.00 65.32 O ATOM 131 OE2 GLU A 550 6.364 -7.375 14.970 1.00 24.24 O ATOM 0 H GLU A 550 6.511 -11.772 13.004 1.00 61.40 H new ATOM 0 HA GLU A 550 4.894 -12.209 15.242 1.00 71.42 H new ATOM 0 HB2 GLU A 550 5.798 -9.980 15.977 1.00 64.31 H new ATOM 0 HB3 GLU A 550 7.012 -11.155 15.511 1.00 64.31 H new ATOM 0 HG2 GLU A 550 7.562 -10.026 13.533 1.00 65.00 H new ATOM 0 HG3 GLU A 550 5.973 -9.306 13.370 1.00 65.00 H new ATOM 139 N HIS A 551 3.759 -10.028 13.095 1.00 62.53 N ATOM 140 CA HIS A 551 2.599 -9.236 12.724 1.00 71.21 C ATOM 141 C HIS A 551 1.494 -10.157 12.203 1.00 33.22 C ATOM 142 O HIS A 551 0.336 -9.753 12.111 1.00 14.11 O ATOM 143 CB HIS A 551 2.983 -8.146 11.722 1.00 43.12 C ATOM 144 CG HIS A 551 3.396 -6.842 12.362 1.00 40.35 C ATOM 145 ND1 HIS A 551 3.591 -5.680 11.636 1.00 44.42 N ATOM 146 CD2 HIS A 551 3.647 -6.529 13.665 1.00 1.41 C ATOM 147 CE1 HIS A 551 3.945 -4.717 12.475 1.00 71.02 C ATOM 148 NE2 HIS A 551 3.979 -5.245 13.732 1.00 63.31 N ATOM 0 H HIS A 551 4.486 -10.080 12.381 1.00 62.53 H new ATOM 0 HA HIS A 551 2.211 -8.720 13.602 1.00 71.21 H new ATOM 0 HB2 HIS A 551 3.802 -8.510 11.101 1.00 43.12 H new ATOM 0 HB3 HIS A 551 2.138 -7.962 11.059 1.00 43.12 H new ATOM 0 HD2 HIS A 551 3.586 -7.210 14.501 1.00 1.41 H new ATOM 0 HE1 HIS A 551 4.167 -3.694 12.210 1.00 71.02 H new ATOM 0 HE2 HIS A 551 4.220 -4.737 14.583 1.00 63.31 H new ATOM 156 N VAL A 552 1.890 -11.378 11.876 1.00 25.32 N ATOM 157 CA VAL A 552 0.948 -12.360 11.367 1.00 21.21 C ATOM 158 C VAL A 552 0.453 -13.232 12.523 1.00 72.25 C ATOM 159 O VAL A 552 1.251 -13.741 13.308 1.00 44.23 O ATOM 160 CB VAL A 552 1.594 -13.170 10.241 1.00 74.21 C ATOM 161 CG1 VAL A 552 0.683 -14.318 9.799 1.00 0.44 C ATOM 162 CG2 VAL A 552 1.956 -12.271 9.057 1.00 22.12 C ATOM 0 H VAL A 552 2.851 -11.710 11.954 1.00 25.32 H new ATOM 0 HA VAL A 552 0.077 -11.867 10.936 1.00 21.21 H new ATOM 0 HB VAL A 552 2.517 -13.604 10.627 1.00 74.21 H new ATOM 0 HG11 VAL A 552 1.166 -14.878 8.998 1.00 0.44 H new ATOM 0 HG12 VAL A 552 0.497 -14.981 10.644 1.00 0.44 H new ATOM 0 HG13 VAL A 552 -0.263 -13.914 9.440 1.00 0.44 H new ATOM 0 HG21 VAL A 552 2.413 -12.872 8.271 1.00 22.12 H new ATOM 0 HG22 VAL A 552 1.054 -11.795 8.672 1.00 22.12 H new ATOM 0 HG23 VAL A 552 2.659 -11.505 9.384 1.00 22.12 H new ATOM 172 N GLN A 553 -0.862 -13.378 12.590 1.00 73.21 N ATOM 173 CA GLN A 553 -1.474 -14.180 13.636 1.00 3.13 C ATOM 174 C GLN A 553 -2.246 -15.351 13.025 1.00 11.31 C ATOM 175 O GLN A 553 -2.737 -15.256 11.901 1.00 25.10 O ATOM 176 CB GLN A 553 -2.383 -13.325 14.521 1.00 32.31 C ATOM 177 CG GLN A 553 -2.899 -14.130 15.716 1.00 3.43 C ATOM 178 CD GLN A 553 -3.059 -13.238 16.949 1.00 12.31 C ATOM 179 OE1 GLN A 553 -2.271 -13.274 17.880 1.00 54.40 O ATOM 180 NE2 GLN A 553 -4.121 -12.438 16.904 1.00 43.34 N ATOM 0 H GLN A 553 -1.521 -12.954 11.937 1.00 73.21 H new ATOM 0 HA GLN A 553 -0.682 -14.583 14.268 1.00 3.13 H new ATOM 0 HB2 GLN A 553 -1.835 -12.452 14.875 1.00 32.31 H new ATOM 0 HB3 GLN A 553 -3.225 -12.957 13.935 1.00 32.31 H new ATOM 0 HG2 GLN A 553 -3.857 -14.586 15.466 1.00 3.43 H new ATOM 0 HG3 GLN A 553 -2.207 -14.943 15.938 1.00 3.43 H new ATOM 0 HE21 GLN A 553 -4.741 -12.458 16.094 1.00 43.34 H new ATOM 0 HE22 GLN A 553 -4.316 -11.805 17.679 1.00 43.34 H new ATOM 189 N LEU A 554 -2.330 -16.428 13.792 1.00 13.54 N ATOM 190 CA LEU A 554 -3.035 -17.615 13.340 1.00 22.34 C ATOM 191 C LEU A 554 -4.479 -17.569 13.843 1.00 51.50 C ATOM 192 O LEU A 554 -4.723 -17.624 15.047 1.00 32.53 O ATOM 193 CB LEU A 554 -2.279 -18.878 13.758 1.00 22.24 C ATOM 194 CG LEU A 554 -1.072 -19.254 12.896 1.00 50.20 C ATOM 195 CD1 LEU A 554 -0.908 -20.773 12.815 1.00 42.43 C ATOM 196 CD2 LEU A 554 -1.168 -18.613 11.510 1.00 3.41 C ATOM 0 H LEU A 554 -1.921 -16.503 14.724 1.00 13.54 H new ATOM 0 HA LEU A 554 -3.077 -17.641 12.251 1.00 22.34 H new ATOM 0 HB2 LEU A 554 -1.941 -18.751 14.786 1.00 22.24 H new ATOM 0 HB3 LEU A 554 -2.978 -19.714 13.753 1.00 22.24 H new ATOM 0 HG LEU A 554 -0.175 -18.859 13.373 1.00 50.20 H new ATOM 0 HD11 LEU A 554 -0.043 -21.013 12.197 1.00 42.43 H new ATOM 0 HD12 LEU A 554 -0.761 -21.177 13.817 1.00 42.43 H new ATOM 0 HD13 LEU A 554 -1.803 -21.213 12.374 1.00 42.43 H new ATOM 0 HD21 LEU A 554 -0.298 -18.896 10.917 1.00 3.41 H new ATOM 0 HD22 LEU A 554 -2.074 -18.957 11.012 1.00 3.41 H new ATOM 0 HD23 LEU A 554 -1.200 -17.528 11.612 1.00 3.41 H new ATOM 208 N LEU A 555 -5.399 -17.466 12.895 1.00 62.42 N ATOM 209 CA LEU A 555 -6.813 -17.411 13.226 1.00 25.43 C ATOM 210 C LEU A 555 -7.585 -18.356 12.304 1.00 73.22 C ATOM 211 O LEU A 555 -7.032 -18.988 11.404 1.00 34.33 O ATOM 212 CB LEU A 555 -7.316 -15.967 13.189 1.00 61.13 C ATOM 213 CG LEU A 555 -6.279 -14.887 13.502 1.00 4.13 C ATOM 214 CD1 LEU A 555 -5.801 -14.198 12.223 1.00 40.52 C ATOM 215 CD2 LEU A 555 -6.821 -13.886 14.524 1.00 12.13 C ATOM 0 H LEU A 555 -5.193 -17.419 11.897 1.00 62.42 H new ATOM 0 HA LEU A 555 -6.979 -17.755 14.247 1.00 25.43 H new ATOM 0 HB2 LEU A 555 -7.727 -15.772 12.199 1.00 61.13 H new ATOM 0 HB3 LEU A 555 -8.137 -15.871 13.899 1.00 61.13 H new ATOM 0 HG LEU A 555 -5.411 -15.368 13.952 1.00 4.13 H new ATOM 0 HD11 LEU A 555 -5.064 -13.435 12.474 1.00 40.52 H new ATOM 0 HD12 LEU A 555 -5.348 -14.935 11.560 1.00 40.52 H new ATOM 0 HD13 LEU A 555 -6.649 -13.732 11.722 1.00 40.52 H new ATOM 0 HD21 LEU A 555 -6.064 -13.129 14.729 1.00 12.13 H new ATOM 0 HD22 LEU A 555 -7.715 -13.407 14.125 1.00 12.13 H new ATOM 0 HD23 LEU A 555 -7.071 -14.408 15.448 1.00 12.13 H new ATOM 227 N CYS A 556 -8.889 -18.439 12.549 1.00 33.01 N ATOM 228 CA CYS A 556 -9.764 -19.297 11.758 1.00 4.44 C ATOM 229 C CYS A 556 -10.609 -18.471 10.793 1.00 41.30 C ATOM 230 O CYS A 556 -11.583 -17.854 11.222 1.00 3.11 O ATOM 231 CB CYS A 556 -10.673 -20.118 12.675 1.00 44.42 C ATOM 232 SG CYS A 556 -11.344 -21.624 11.900 1.00 52.43 S ATOM 0 H CYS A 556 -9.363 -17.922 13.290 1.00 33.01 H new ATOM 0 HA CYS A 556 -9.138 -19.974 11.177 1.00 4.44 H new ATOM 0 HB2 CYS A 556 -10.113 -20.400 13.567 1.00 44.42 H new ATOM 0 HB3 CYS A 556 -11.502 -19.491 13.004 1.00 44.42 H new ATOM 237 N ILE A 557 -10.223 -18.476 9.526 1.00 61.04 N ATOM 238 CA ILE A 557 -10.952 -17.725 8.518 1.00 1.40 C ATOM 239 C ILE A 557 -12.445 -17.747 8.852 1.00 2.24 C ATOM 240 O ILE A 557 -13.155 -16.774 8.604 1.00 3.52 O ATOM 241 CB ILE A 557 -10.627 -18.250 7.118 1.00 34.43 C ATOM 242 CG1 ILE A 557 -11.593 -19.367 6.715 1.00 45.14 C ATOM 243 CG2 ILE A 557 -9.166 -18.694 7.025 1.00 71.24 C ATOM 244 CD1 ILE A 557 -11.387 -19.768 5.252 1.00 5.44 C ATOM 0 H ILE A 557 -9.414 -18.988 9.174 1.00 61.04 H new ATOM 0 HA ILE A 557 -10.639 -16.681 8.522 1.00 1.40 H new ATOM 0 HB ILE A 557 -10.761 -17.435 6.407 1.00 34.43 H new ATOM 0 HG12 ILE A 557 -11.441 -20.234 7.358 1.00 45.14 H new ATOM 0 HG13 ILE A 557 -12.621 -19.035 6.864 1.00 45.14 H new ATOM 0 HG21 ILE A 557 -8.961 -19.063 6.020 1.00 71.24 H new ATOM 0 HG22 ILE A 557 -8.514 -17.848 7.241 1.00 71.24 H new ATOM 0 HG23 ILE A 557 -8.980 -19.488 7.748 1.00 71.24 H new ATOM 0 HD11 ILE A 557 -12.085 -20.563 4.991 1.00 5.44 H new ATOM 0 HD12 ILE A 557 -11.563 -18.905 4.610 1.00 5.44 H new ATOM 0 HD13 ILE A 557 -10.366 -20.122 5.112 1.00 5.44 H new ATOM 256 N ASN A 558 -12.877 -18.868 9.411 1.00 61.04 N ATOM 257 CA ASN A 558 -14.272 -19.030 9.782 1.00 54.23 C ATOM 258 C ASN A 558 -14.548 -18.247 11.067 1.00 21.32 C ATOM 259 O ASN A 558 -15.350 -17.315 11.071 1.00 41.34 O ATOM 260 CB ASN A 558 -14.606 -20.500 10.042 1.00 11.04 C ATOM 261 CG ASN A 558 -14.767 -21.267 8.728 1.00 34.05 C ATOM 262 OD1 ASN A 558 -13.960 -21.169 7.819 1.00 51.40 O ATOM 263 ND2 ASN A 558 -15.852 -22.034 8.680 1.00 75.52 N ATOM 0 H ASN A 558 -12.285 -19.673 9.616 1.00 61.04 H new ATOM 0 HA ASN A 558 -14.885 -18.662 8.959 1.00 54.23 H new ATOM 0 HB2 ASN A 558 -13.816 -20.956 10.639 1.00 11.04 H new ATOM 0 HB3 ASN A 558 -15.525 -20.570 10.623 1.00 11.04 H new ATOM 0 HD21 ASN A 558 -16.049 -22.587 7.846 1.00 75.52 H new ATOM 0 HD22 ASN A 558 -16.487 -22.070 9.478 1.00 75.52 H new ATOM 270 N CYS A 559 -13.867 -18.656 12.128 1.00 14.30 N ATOM 271 CA CYS A 559 -14.029 -18.005 13.417 1.00 42.50 C ATOM 272 C CYS A 559 -13.289 -16.666 13.375 1.00 61.02 C ATOM 273 O CYS A 559 -13.914 -15.607 13.389 1.00 42.31 O ATOM 274 CB CYS A 559 -13.540 -18.891 14.564 1.00 65.22 C ATOM 275 SG CYS A 559 -13.919 -20.671 14.373 1.00 30.33 S ATOM 0 H CYS A 559 -13.202 -19.430 12.121 1.00 14.30 H new ATOM 0 HA CYS A 559 -15.088 -17.829 13.608 1.00 42.50 H new ATOM 0 HB2 CYS A 559 -12.461 -18.772 14.662 1.00 65.22 H new ATOM 0 HB3 CYS A 559 -13.985 -18.537 15.494 1.00 65.22 H new ATOM 280 N MET A 560 -11.968 -16.758 13.324 1.00 12.41 N ATOM 281 CA MET A 560 -11.137 -15.567 13.280 1.00 44.22 C ATOM 282 C MET A 560 -11.027 -14.923 14.663 1.00 14.53 C ATOM 283 O MET A 560 -11.190 -13.711 14.802 1.00 31.35 O ATOM 284 CB MET A 560 -11.736 -14.562 12.294 1.00 0.32 C ATOM 285 CG MET A 560 -12.107 -15.242 10.975 1.00 35.32 C ATOM 286 SD MET A 560 -12.890 -14.068 9.882 1.00 65.14 S ATOM 287 CE MET A 560 -14.605 -14.440 10.203 1.00 34.41 C ATOM 0 H MET A 560 -11.453 -17.638 13.312 1.00 12.41 H new ATOM 0 HA MET A 560 -10.138 -15.856 12.955 1.00 44.22 H new ATOM 0 HB2 MET A 560 -12.622 -14.102 12.732 1.00 0.32 H new ATOM 0 HB3 MET A 560 -11.021 -13.761 12.106 1.00 0.32 H new ATOM 0 HG2 MET A 560 -11.213 -15.651 10.503 1.00 35.32 H new ATOM 0 HG3 MET A 560 -12.779 -16.079 11.164 1.00 35.32 H new ATOM 0 HE1 MET A 560 -15.215 -13.565 9.979 1.00 34.41 H new ATOM 0 HE2 MET A 560 -14.920 -15.273 9.575 1.00 34.41 H new ATOM 0 HE3 MET A 560 -14.729 -14.710 11.252 1.00 34.41 H new ATOM 297 N VAL A 561 -10.753 -15.761 15.651 1.00 23.24 N ATOM 298 CA VAL A 561 -10.620 -15.289 17.019 1.00 1.31 C ATOM 299 C VAL A 561 -9.170 -15.463 17.476 1.00 50.33 C ATOM 300 O VAL A 561 -8.827 -15.122 18.607 1.00 65.33 O ATOM 301 CB VAL A 561 -11.622 -16.011 17.922 1.00 62.10 C ATOM 302 CG1 VAL A 561 -12.903 -16.350 17.158 1.00 53.30 C ATOM 303 CG2 VAL A 561 -11.001 -17.268 18.535 1.00 5.41 C ATOM 0 H VAL A 561 -10.619 -16.765 15.532 1.00 23.24 H new ATOM 0 HA VAL A 561 -10.855 -14.226 17.080 1.00 1.31 H new ATOM 0 HB VAL A 561 -11.886 -15.336 18.736 1.00 62.10 H new ATOM 0 HG11 VAL A 561 -13.598 -16.863 17.823 1.00 53.30 H new ATOM 0 HG12 VAL A 561 -13.362 -15.432 16.791 1.00 53.30 H new ATOM 0 HG13 VAL A 561 -12.663 -16.998 16.315 1.00 53.30 H new ATOM 0 HG21 VAL A 561 -11.734 -17.762 19.172 1.00 5.41 H new ATOM 0 HG22 VAL A 561 -10.695 -17.948 17.740 1.00 5.41 H new ATOM 0 HG23 VAL A 561 -10.131 -16.991 19.130 1.00 5.41 H new ATOM 313 N ALA A 562 -8.358 -15.993 16.572 1.00 13.55 N ATOM 314 CA ALA A 562 -6.953 -16.216 16.868 1.00 13.13 C ATOM 315 C ALA A 562 -6.803 -17.522 17.651 1.00 42.01 C ATOM 316 O ALA A 562 -7.066 -17.564 18.852 1.00 73.34 O ATOM 317 CB ALA A 562 -6.394 -15.012 17.630 1.00 72.34 C ATOM 0 H ALA A 562 -8.646 -16.274 15.635 1.00 13.55 H new ATOM 0 HA ALA A 562 -6.378 -16.315 15.947 1.00 13.13 H new ATOM 0 HB1 ALA A 562 -5.340 -15.179 17.852 1.00 72.34 H new ATOM 0 HB2 ALA A 562 -6.498 -14.115 17.020 1.00 72.34 H new ATOM 0 HB3 ALA A 562 -6.945 -14.883 18.562 1.00 72.34 H new ATOM 323 N VAL A 563 -6.379 -18.556 16.939 1.00 55.14 N ATOM 324 CA VAL A 563 -6.191 -19.860 17.551 1.00 3.24 C ATOM 325 C VAL A 563 -4.705 -20.066 17.855 1.00 53.42 C ATOM 326 O VAL A 563 -4.323 -21.074 18.446 1.00 63.33 O ATOM 327 CB VAL A 563 -6.774 -20.951 16.651 1.00 44.43 C ATOM 328 CG1 VAL A 563 -8.290 -21.055 16.827 1.00 23.44 C ATOM 329 CG2 VAL A 563 -6.408 -20.705 15.185 1.00 20.14 C ATOM 0 H VAL A 563 -6.160 -18.517 15.943 1.00 55.14 H new ATOM 0 HA VAL A 563 -6.728 -19.918 18.498 1.00 3.24 H new ATOM 0 HB VAL A 563 -6.336 -21.903 16.951 1.00 44.43 H new ATOM 0 HG11 VAL A 563 -8.679 -21.838 16.176 1.00 23.44 H new ATOM 0 HG12 VAL A 563 -8.520 -21.298 17.864 1.00 23.44 H new ATOM 0 HG13 VAL A 563 -8.753 -20.103 16.566 1.00 23.44 H new ATOM 0 HG21 VAL A 563 -6.834 -21.494 14.566 1.00 20.14 H new ATOM 0 HG22 VAL A 563 -6.805 -19.741 14.868 1.00 20.14 H new ATOM 0 HG23 VAL A 563 -5.323 -20.704 15.076 1.00 20.14 H new ATOM 339 N GLY A 564 -3.908 -19.093 17.437 1.00 74.23 N ATOM 340 CA GLY A 564 -2.473 -19.155 17.656 1.00 34.14 C ATOM 341 C GLY A 564 -1.771 -17.944 17.038 1.00 34.24 C ATOM 342 O GLY A 564 -2.399 -16.914 16.797 1.00 33.34 O ATOM 0 H GLY A 564 -4.229 -18.257 16.948 1.00 74.23 H new ATOM 0 HA2 GLY A 564 -2.266 -19.193 18.726 1.00 34.14 H new ATOM 0 HA3 GLY A 564 -2.074 -20.072 17.221 1.00 34.14 H new ATOM 346 N HIS A 565 -0.479 -18.108 16.799 1.00 25.15 N ATOM 347 CA HIS A 565 0.316 -17.041 16.214 1.00 34.31 C ATOM 348 C HIS A 565 1.043 -17.564 14.974 1.00 73.13 C ATOM 349 O HIS A 565 1.387 -18.743 14.902 1.00 11.11 O ATOM 350 CB HIS A 565 1.268 -16.441 17.251 1.00 74.43 C ATOM 351 CG HIS A 565 0.598 -15.511 18.234 1.00 51.34 C ATOM 352 ND1 HIS A 565 -0.063 -15.962 19.363 1.00 71.35 N ATOM 353 CD2 HIS A 565 0.495 -14.151 18.245 1.00 2.32 C ATOM 354 CE1 HIS A 565 -0.539 -14.913 20.016 1.00 12.22 C ATOM 355 NE2 HIS A 565 -0.193 -13.791 19.322 1.00 64.11 N ATOM 0 H HIS A 565 0.038 -18.964 17.000 1.00 25.15 H new ATOM 0 HA HIS A 565 -0.337 -16.229 15.894 1.00 34.31 H new ATOM 0 HB2 HIS A 565 1.747 -17.251 17.801 1.00 74.43 H new ATOM 0 HB3 HIS A 565 2.058 -15.897 16.733 1.00 74.43 H new ATOM 0 HD2 HIS A 565 0.904 -13.481 17.503 1.00 2.32 H new ATOM 0 HE1 HIS A 565 -1.103 -14.941 20.937 1.00 12.22 H new ATOM 0 HE2 HIS A 565 -0.425 -12.834 19.587 1.00 64.11 H new ATOM 363 N GLY A 566 1.255 -16.662 14.027 1.00 0.43 N ATOM 364 CA GLY A 566 1.935 -17.017 12.793 1.00 0.23 C ATOM 365 C GLY A 566 3.431 -17.231 13.034 1.00 72.04 C ATOM 366 O GLY A 566 4.113 -17.845 12.215 1.00 60.23 O ATOM 0 H GLY A 566 0.968 -15.685 14.090 1.00 0.43 H new ATOM 0 HA2 GLY A 566 1.496 -17.925 12.380 1.00 0.23 H new ATOM 0 HA3 GLY A 566 1.791 -16.229 12.054 1.00 0.23 H new ATOM 370 N SER A 567 3.897 -16.713 14.160 1.00 12.33 N ATOM 371 CA SER A 567 5.299 -16.840 14.519 1.00 43.43 C ATOM 372 C SER A 567 5.475 -17.945 15.562 1.00 51.11 C ATOM 373 O SER A 567 6.532 -18.057 16.181 1.00 70.33 O ATOM 374 CB SER A 567 5.854 -15.516 15.049 1.00 20.12 C ATOM 375 OG SER A 567 7.277 -15.524 15.121 1.00 63.24 O ATOM 0 H SER A 567 3.328 -16.204 14.837 1.00 12.33 H new ATOM 0 HA SER A 567 5.859 -17.104 13.622 1.00 43.43 H new ATOM 0 HB2 SER A 567 5.528 -14.702 14.402 1.00 20.12 H new ATOM 0 HB3 SER A 567 5.442 -15.321 16.039 1.00 20.12 H new ATOM 0 HG SER A 567 7.581 -16.380 15.490 1.00 63.24 H new ATOM 381 N ASP A 568 4.422 -18.733 15.725 1.00 65.20 N ATOM 382 CA ASP A 568 4.447 -19.826 16.683 1.00 50.34 C ATOM 383 C ASP A 568 4.340 -21.156 15.935 1.00 64.23 C ATOM 384 O ASP A 568 4.522 -22.220 16.524 1.00 22.24 O ATOM 385 CB ASP A 568 3.268 -19.733 17.654 1.00 63.54 C ATOM 386 CG ASP A 568 3.525 -18.890 18.904 1.00 50.21 C ATOM 387 OD1 ASP A 568 2.702 -18.855 19.831 1.00 41.11 O ATOM 388 OD2 ASP A 568 4.639 -18.240 18.904 1.00 44.03 O ATOM 0 H ASP A 568 3.547 -18.637 15.210 1.00 65.20 H new ATOM 0 HA ASP A 568 5.381 -19.764 17.242 1.00 50.34 H new ATOM 0 HB2 ASP A 568 2.412 -19.317 17.123 1.00 63.54 H new ATOM 0 HB3 ASP A 568 2.992 -20.741 17.964 1.00 63.54 H new ATOM 394 N LEU A 569 4.046 -21.053 14.647 1.00 0.41 N ATOM 395 CA LEU A 569 3.913 -22.235 13.812 1.00 0.43 C ATOM 396 C LEU A 569 5.274 -22.581 13.206 1.00 42.14 C ATOM 397 O LEU A 569 6.193 -21.763 13.225 1.00 33.12 O ATOM 398 CB LEU A 569 2.809 -22.034 12.772 1.00 30.42 C ATOM 399 CG LEU A 569 2.895 -20.753 11.940 1.00 24.14 C ATOM 400 CD1 LEU A 569 4.347 -20.429 11.581 1.00 31.53 C ATOM 401 CD2 LEU A 569 2.004 -20.844 10.700 1.00 45.41 C ATOM 0 H LEU A 569 3.896 -20.169 14.161 1.00 0.41 H new ATOM 0 HA LEU A 569 3.603 -23.092 14.410 1.00 0.43 H new ATOM 0 HB2 LEU A 569 2.818 -22.886 12.092 1.00 30.42 H new ATOM 0 HB3 LEU A 569 1.847 -22.046 13.285 1.00 30.42 H new ATOM 0 HG LEU A 569 2.521 -19.927 12.545 1.00 24.14 H new ATOM 0 HD11 LEU A 569 4.380 -19.514 10.990 1.00 31.53 H new ATOM 0 HD12 LEU A 569 4.926 -20.292 12.494 1.00 31.53 H new ATOM 0 HD13 LEU A 569 4.771 -21.250 11.003 1.00 31.53 H new ATOM 0 HD21 LEU A 569 2.084 -19.921 10.126 1.00 45.41 H new ATOM 0 HD22 LEU A 569 2.324 -21.684 10.083 1.00 45.41 H new ATOM 0 HD23 LEU A 569 0.969 -20.993 11.006 1.00 45.41 H new ATOM 413 N ARG A 570 5.361 -23.794 12.681 1.00 72.33 N ATOM 414 CA ARG A 570 6.594 -24.259 12.069 1.00 4.13 C ATOM 415 C ARG A 570 6.288 -25.106 10.832 1.00 13.44 C ATOM 416 O ARG A 570 5.137 -25.198 10.409 1.00 55.01 O ATOM 417 CB ARG A 570 7.419 -25.089 13.055 1.00 2.32 C ATOM 418 CG ARG A 570 7.763 -24.274 14.304 1.00 62.21 C ATOM 419 CD ARG A 570 8.911 -23.301 14.025 1.00 34.20 C ATOM 420 NE ARG A 570 9.061 -22.359 15.156 1.00 3.11 N ATOM 421 CZ ARG A 570 10.147 -21.582 15.354 1.00 5.05 C ATOM 422 NH1 ARG A 570 11.189 -21.629 14.497 1.00 23.13 N ATOM 423 NH2 ARG A 570 10.176 -20.776 16.399 1.00 15.23 N ATOM 0 H ARG A 570 4.597 -24.470 12.667 1.00 72.33 H new ATOM 0 HA ARG A 570 7.171 -23.381 11.778 1.00 4.13 H new ATOM 0 HB2 ARG A 570 6.861 -25.981 13.341 1.00 2.32 H new ATOM 0 HB3 ARG A 570 8.336 -25.427 12.573 1.00 2.32 H new ATOM 0 HG2 ARG A 570 6.884 -23.720 14.635 1.00 62.21 H new ATOM 0 HG3 ARG A 570 8.040 -24.946 15.116 1.00 62.21 H new ATOM 0 HD2 ARG A 570 9.839 -23.853 13.875 1.00 34.20 H new ATOM 0 HD3 ARG A 570 8.716 -22.750 13.105 1.00 34.20 H new ATOM 0 HE ARG A 570 8.296 -22.293 15.828 1.00 3.11 H new ATOM 0 HH11 ARG A 570 11.160 -22.255 13.692 1.00 23.13 H new ATOM 0 HH12 ARG A 570 12.006 -21.038 14.654 1.00 23.13 H new ATOM 0 HH21 ARG A 570 9.385 -20.747 17.043 1.00 15.23 H new ATOM 0 HH22 ARG A 570 10.989 -20.182 16.563 1.00 15.23 H new ATOM 436 N LYS A 571 7.338 -25.702 10.288 1.00 72.32 N ATOM 437 CA LYS A 571 7.195 -26.538 9.108 1.00 61.21 C ATOM 438 C LYS A 571 7.879 -27.884 9.356 1.00 63.01 C ATOM 439 O LYS A 571 9.094 -27.943 9.538 1.00 45.55 O ATOM 440 CB LYS A 571 7.710 -25.806 7.867 1.00 71.00 C ATOM 441 CG LYS A 571 6.932 -26.228 6.619 1.00 32.20 C ATOM 442 CD LYS A 571 7.550 -25.624 5.357 1.00 65.22 C ATOM 443 CE LYS A 571 7.600 -24.098 5.447 1.00 52.31 C ATOM 444 NZ LYS A 571 7.609 -23.499 4.094 1.00 53.45 N ATOM 0 H LYS A 571 8.291 -25.623 10.642 1.00 72.32 H new ATOM 0 HA LYS A 571 6.143 -26.746 8.914 1.00 61.21 H new ATOM 0 HB2 LYS A 571 7.617 -24.730 8.011 1.00 71.00 H new ATOM 0 HB3 LYS A 571 8.770 -26.019 7.728 1.00 71.00 H new ATOM 0 HG2 LYS A 571 6.926 -27.315 6.541 1.00 32.20 H new ATOM 0 HG3 LYS A 571 5.894 -25.909 6.708 1.00 32.20 H new ATOM 0 HD2 LYS A 571 8.557 -26.017 5.217 1.00 65.22 H new ATOM 0 HD3 LYS A 571 6.968 -25.921 4.485 1.00 65.22 H new ATOM 0 HE2 LYS A 571 6.739 -23.732 6.007 1.00 52.31 H new ATOM 0 HE3 LYS A 571 8.491 -23.789 5.994 1.00 52.31 H new ATOM 0 HZ1 LYS A 571 6.979 -22.672 4.076 1.00 53.45 H new ATOM 0 HZ2 LYS A 571 8.576 -23.203 3.852 1.00 53.45 H new ATOM 0 HZ3 LYS A 571 7.278 -24.201 3.401 1.00 53.45 H new ATOM 457 N VAL A 572 7.069 -28.932 9.356 1.00 63.54 N ATOM 458 CA VAL A 572 7.581 -30.274 9.578 1.00 4.14 C ATOM 459 C VAL A 572 8.240 -30.784 8.295 1.00 54.43 C ATOM 460 O VAL A 572 7.556 -31.059 7.310 1.00 43.24 O ATOM 461 CB VAL A 572 6.459 -31.186 10.078 1.00 62.33 C ATOM 462 CG1 VAL A 572 6.701 -32.636 9.653 1.00 42.12 C ATOM 463 CG2 VAL A 572 6.300 -31.079 11.596 1.00 51.14 C ATOM 0 H VAL A 572 6.061 -28.879 9.206 1.00 63.54 H new ATOM 0 HA VAL A 572 8.346 -30.267 10.354 1.00 4.14 H new ATOM 0 HB VAL A 572 5.528 -30.853 9.620 1.00 62.33 H new ATOM 0 HG11 VAL A 572 5.889 -33.263 10.021 1.00 42.12 H new ATOM 0 HG12 VAL A 572 6.740 -32.695 8.565 1.00 42.12 H new ATOM 0 HG13 VAL A 572 7.646 -32.984 10.070 1.00 42.12 H new ATOM 0 HG21 VAL A 572 5.496 -31.737 11.925 1.00 51.14 H new ATOM 0 HG22 VAL A 572 7.231 -31.373 12.081 1.00 51.14 H new ATOM 0 HG23 VAL A 572 6.060 -30.050 11.865 1.00 51.14 H new ATOM 473 N GLU A 573 9.559 -30.894 8.348 1.00 52.15 N ATOM 474 CA GLU A 573 10.317 -31.366 7.201 1.00 11.42 C ATOM 475 C GLU A 573 9.727 -30.803 5.907 1.00 73.15 C ATOM 476 O GLU A 573 9.652 -31.504 4.898 1.00 2.23 O ATOM 477 CB GLU A 573 10.361 -32.894 7.165 1.00 62.54 C ATOM 478 CG GLU A 573 8.974 -33.477 6.884 1.00 45.43 C ATOM 479 CD GLU A 573 9.081 -34.847 6.211 1.00 0.04 C ATOM 480 OE1 GLU A 573 9.904 -35.029 5.302 1.00 54.25 O ATOM 481 OE2 GLU A 573 8.271 -35.742 6.667 1.00 63.13 O ATOM 0 H GLU A 573 10.122 -30.665 9.167 1.00 52.15 H new ATOM 0 HA GLU A 573 11.342 -31.008 7.295 1.00 11.42 H new ATOM 0 HB2 GLU A 573 11.060 -33.223 6.396 1.00 62.54 H new ATOM 0 HB3 GLU A 573 10.733 -33.273 8.117 1.00 62.54 H new ATOM 0 HG2 GLU A 573 8.418 -33.569 7.817 1.00 45.43 H new ATOM 0 HG3 GLU A 573 8.412 -32.796 6.244 1.00 45.43 H new ATOM 489 N GLY A 574 9.322 -29.543 5.976 1.00 21.45 N ATOM 490 CA GLY A 574 8.741 -28.879 4.822 1.00 12.25 C ATOM 491 C GLY A 574 7.781 -29.810 4.079 1.00 64.41 C ATOM 492 O GLY A 574 7.867 -29.951 2.860 1.00 61.10 O ATOM 0 H GLY A 574 9.385 -28.965 6.814 1.00 21.45 H new ATOM 0 HA2 GLY A 574 8.209 -27.983 5.143 1.00 12.25 H new ATOM 0 HA3 GLY A 574 9.533 -28.555 4.148 1.00 12.25 H new ATOM 496 N THR A 575 6.890 -30.422 4.844 1.00 33.51 N ATOM 497 CA THR A 575 5.915 -31.337 4.273 1.00 2.41 C ATOM 498 C THR A 575 4.508 -30.745 4.370 1.00 12.52 C ATOM 499 O THR A 575 3.770 -30.723 3.386 1.00 23.00 O ATOM 500 CB THR A 575 6.058 -32.684 4.984 1.00 71.14 C ATOM 501 OG1 THR A 575 7.093 -33.348 4.264 1.00 71.23 O ATOM 502 CG2 THR A 575 4.834 -33.581 4.789 1.00 72.21 C ATOM 0 H THR A 575 6.822 -30.303 5.855 1.00 33.51 H new ATOM 0 HA THR A 575 6.095 -31.494 3.209 1.00 2.41 H new ATOM 0 HB THR A 575 6.220 -32.517 6.049 1.00 71.14 H new ATOM 0 HG1 THR A 575 7.042 -34.312 4.432 1.00 71.23 H new ATOM 0 HG21 THR A 575 4.987 -34.524 5.314 1.00 72.21 H new ATOM 0 HG22 THR A 575 3.951 -33.083 5.188 1.00 72.21 H new ATOM 0 HG23 THR A 575 4.691 -33.776 3.726 1.00 72.21 H new ATOM 510 N HIS A 576 4.178 -30.278 5.566 1.00 72.44 N ATOM 511 CA HIS A 576 2.872 -29.688 5.804 1.00 11.41 C ATOM 512 C HIS A 576 2.945 -28.753 7.013 1.00 14.13 C ATOM 513 O HIS A 576 3.124 -29.206 8.143 1.00 44.23 O ATOM 514 CB HIS A 576 1.804 -30.773 5.957 1.00 44.11 C ATOM 515 CG HIS A 576 1.507 -31.525 4.682 1.00 73.31 C ATOM 516 ND1 HIS A 576 1.688 -32.892 4.558 1.00 11.31 N ATOM 517 CD2 HIS A 576 1.038 -31.088 3.478 1.00 61.22 C ATOM 518 CE1 HIS A 576 1.342 -33.250 3.330 1.00 12.04 C ATOM 519 NE2 HIS A 576 0.940 -32.131 2.662 1.00 11.23 N ATOM 0 H HIS A 576 4.793 -30.297 6.380 1.00 72.44 H new ATOM 0 HA HIS A 576 2.577 -29.090 4.942 1.00 11.41 H new ATOM 0 HB2 HIS A 576 2.128 -31.483 6.718 1.00 44.11 H new ATOM 0 HB3 HIS A 576 0.884 -30.314 6.319 1.00 44.11 H new ATOM 0 HD1 HIS A 576 2.030 -33.517 5.288 1.00 11.31 H new ATOM 0 HD2 HIS A 576 0.789 -30.067 3.230 1.00 61.22 H new ATOM 0 HE1 HIS A 576 1.373 -34.252 2.929 1.00 12.04 H new ATOM 527 N HIS A 577 2.801 -27.466 6.735 1.00 1.41 N ATOM 528 CA HIS A 577 2.848 -26.463 7.786 1.00 42.02 C ATOM 529 C HIS A 577 2.112 -26.981 9.023 1.00 72.12 C ATOM 530 O HIS A 577 0.923 -27.291 8.958 1.00 41.41 O ATOM 531 CB HIS A 577 2.299 -25.126 7.286 1.00 52.45 C ATOM 532 CG HIS A 577 3.264 -24.350 6.421 1.00 60.00 C ATOM 533 ND1 HIS A 577 3.976 -24.930 5.386 1.00 24.40 N ATOM 534 CD2 HIS A 577 3.626 -23.035 6.448 1.00 70.22 C ATOM 535 CE1 HIS A 577 4.731 -23.998 4.823 1.00 54.00 C ATOM 536 NE2 HIS A 577 4.512 -22.824 5.483 1.00 64.33 N ATOM 0 H HIS A 577 2.652 -27.094 5.797 1.00 1.41 H new ATOM 0 HA HIS A 577 3.884 -26.280 8.073 1.00 42.02 H new ATOM 0 HB2 HIS A 577 1.386 -25.309 6.720 1.00 52.45 H new ATOM 0 HB3 HIS A 577 2.024 -24.514 8.145 1.00 52.45 H new ATOM 0 HD1 HIS A 577 3.928 -25.909 5.104 1.00 24.40 H new ATOM 0 HD2 HIS A 577 3.254 -22.292 7.138 1.00 70.22 H new ATOM 0 HE1 HIS A 577 5.402 -24.142 3.989 1.00 54.00 H new ATOM 544 N VAL A 578 2.849 -27.059 10.121 1.00 32.50 N ATOM 545 CA VAL A 578 2.281 -27.535 11.371 1.00 12.32 C ATOM 546 C VAL A 578 2.444 -26.455 12.443 1.00 33.32 C ATOM 547 O VAL A 578 3.552 -26.206 12.915 1.00 70.20 O ATOM 548 CB VAL A 578 2.921 -28.868 11.763 1.00 34.12 C ATOM 549 CG1 VAL A 578 2.466 -29.990 10.828 1.00 32.31 C ATOM 550 CG2 VAL A 578 4.446 -28.758 11.787 1.00 64.25 C ATOM 0 H VAL A 578 3.834 -26.801 10.171 1.00 32.50 H new ATOM 0 HA VAL A 578 1.213 -27.724 11.258 1.00 12.32 H new ATOM 0 HB VAL A 578 2.588 -29.116 12.771 1.00 34.12 H new ATOM 0 HG11 VAL A 578 2.935 -30.927 11.128 1.00 32.31 H new ATOM 0 HG12 VAL A 578 1.382 -30.093 10.884 1.00 32.31 H new ATOM 0 HG13 VAL A 578 2.756 -29.751 9.805 1.00 32.31 H new ATOM 0 HG21 VAL A 578 4.876 -29.719 12.069 1.00 64.25 H new ATOM 0 HG22 VAL A 578 4.806 -28.475 10.798 1.00 64.25 H new ATOM 0 HG23 VAL A 578 4.745 -28.001 12.512 1.00 64.25 H new ATOM 560 N ASN A 579 1.323 -25.844 12.797 1.00 51.43 N ATOM 561 CA ASN A 579 1.327 -24.797 13.804 1.00 4.34 C ATOM 562 C ASN A 579 1.373 -25.433 15.195 1.00 64.42 C ATOM 563 O ASN A 579 0.389 -26.016 15.647 1.00 25.54 O ATOM 564 CB ASN A 579 0.061 -23.943 13.717 1.00 11.21 C ATOM 565 CG ASN A 579 -0.180 -23.184 15.023 1.00 4.55 C ATOM 566 OD1 ASN A 579 -1.303 -22.956 15.442 1.00 41.35 O ATOM 567 ND2 ASN A 579 0.935 -22.806 15.643 1.00 42.23 N ATOM 0 H ASN A 579 0.405 -26.054 12.404 1.00 51.43 H new ATOM 0 HA ASN A 579 2.199 -24.167 13.631 1.00 4.34 H new ATOM 0 HB2 ASN A 579 0.151 -23.236 12.893 1.00 11.21 H new ATOM 0 HB3 ASN A 579 -0.797 -24.579 13.499 1.00 11.21 H new ATOM 0 HD21 ASN A 579 0.880 -22.293 16.523 1.00 42.23 H new ATOM 0 HD22 ASN A 579 1.844 -23.029 15.238 1.00 42.23 H new ATOM 574 N VAL A 580 2.526 -25.300 15.834 1.00 64.12 N ATOM 575 CA VAL A 580 2.714 -25.855 17.164 1.00 73.15 C ATOM 576 C VAL A 580 2.145 -24.885 18.201 1.00 4.21 C ATOM 577 O VAL A 580 2.217 -23.670 18.025 1.00 45.42 O ATOM 578 CB VAL A 580 4.192 -26.177 17.393 1.00 72.22 C ATOM 579 CG1 VAL A 580 4.368 -27.134 18.573 1.00 34.34 C ATOM 580 CG2 VAL A 580 4.832 -26.747 16.125 1.00 12.41 C ATOM 0 H VAL A 580 3.340 -24.816 15.455 1.00 64.12 H new ATOM 0 HA VAL A 580 2.172 -26.795 17.266 1.00 73.15 H new ATOM 0 HB VAL A 580 4.704 -25.246 17.637 1.00 72.22 H new ATOM 0 HG11 VAL A 580 5.428 -27.347 18.714 1.00 34.34 H new ATOM 0 HG12 VAL A 580 3.966 -26.675 19.477 1.00 34.34 H new ATOM 0 HG13 VAL A 580 3.835 -28.063 18.370 1.00 34.34 H new ATOM 0 HG21 VAL A 580 5.882 -26.967 16.315 1.00 12.41 H new ATOM 0 HG22 VAL A 580 4.316 -27.663 15.837 1.00 12.41 H new ATOM 0 HG23 VAL A 580 4.754 -26.018 15.319 1.00 12.41 H new ATOM 590 N ASN A 581 1.593 -25.458 19.260 1.00 10.02 N ATOM 591 CA ASN A 581 1.013 -24.659 20.326 1.00 34.01 C ATOM 592 C ASN A 581 0.254 -25.575 21.289 1.00 53.34 C ATOM 593 O ASN A 581 -0.631 -26.321 20.873 1.00 32.21 O ATOM 594 CB ASN A 581 0.023 -23.634 19.770 1.00 51.25 C ATOM 595 CG ASN A 581 -0.749 -22.948 20.898 1.00 35.35 C ATOM 596 OD1 ASN A 581 -1.965 -23.013 20.982 1.00 1.24 O ATOM 597 ND2 ASN A 581 0.021 -22.290 21.759 1.00 5.12 N ATOM 0 H ASN A 581 1.535 -26.466 19.403 1.00 10.02 H new ATOM 0 HA ASN A 581 1.823 -24.138 20.836 1.00 34.01 H new ATOM 0 HB2 ASN A 581 0.559 -22.887 19.184 1.00 51.25 H new ATOM 0 HB3 ASN A 581 -0.676 -24.128 19.094 1.00 51.25 H new ATOM 0 HD21 ASN A 581 -0.400 -21.800 22.548 1.00 5.12 H new ATOM 0 HD22 ASN A 581 1.033 -22.275 21.630 1.00 5.12 H new ATOM 604 N PRO A 582 0.637 -25.485 22.590 1.00 24.02 N ATOM 605 CA PRO A 582 0.003 -26.296 23.615 1.00 21.41 C ATOM 606 C PRO A 582 -1.390 -25.762 23.953 1.00 33.11 C ATOM 607 O PRO A 582 -2.247 -26.507 24.426 1.00 61.40 O ATOM 608 CB PRO A 582 0.958 -26.255 24.797 1.00 40.31 C ATOM 609 CG PRO A 582 1.859 -25.053 24.562 1.00 22.34 C ATOM 610 CD PRO A 582 1.682 -24.612 23.119 1.00 75.12 C ATOM 0 HA PRO A 582 -0.166 -27.323 23.293 1.00 21.41 H new ATOM 0 HB2 PRO A 582 0.413 -26.157 25.736 1.00 40.31 H new ATOM 0 HB3 PRO A 582 1.541 -27.174 24.860 1.00 40.31 H new ATOM 0 HG2 PRO A 582 1.599 -24.243 25.243 1.00 22.34 H new ATOM 0 HG3 PRO A 582 2.900 -25.312 24.757 1.00 22.34 H new ATOM 0 HD2 PRO A 582 1.390 -23.563 23.058 1.00 75.12 H new ATOM 0 HD3 PRO A 582 2.609 -24.718 22.556 1.00 75.12 H new ATOM 618 N ASN A 583 -1.574 -24.475 23.697 1.00 23.20 N ATOM 619 CA ASN A 583 -2.848 -23.833 23.968 1.00 15.50 C ATOM 620 C ASN A 583 -3.780 -24.031 22.770 1.00 23.34 C ATOM 621 O ASN A 583 -4.853 -23.433 22.708 1.00 45.12 O ATOM 622 CB ASN A 583 -2.672 -22.328 24.185 1.00 22.40 C ATOM 623 CG ASN A 583 -1.294 -22.017 24.773 1.00 60.31 C ATOM 624 OD1 ASN A 583 -0.553 -21.184 24.278 1.00 63.54 O ATOM 625 ND2 ASN A 583 -0.993 -22.731 25.854 1.00 35.12 N ATOM 0 H ASN A 583 -0.861 -23.860 23.305 1.00 23.20 H new ATOM 0 HA ASN A 583 -3.266 -24.281 24.869 1.00 15.50 H new ATOM 0 HB2 ASN A 583 -2.794 -21.803 23.237 1.00 22.40 H new ATOM 0 HB3 ASN A 583 -3.449 -21.960 24.855 1.00 22.40 H new ATOM 0 HD21 ASN A 583 -0.096 -22.597 26.320 1.00 35.12 H new ATOM 0 HD22 ASN A 583 -1.659 -23.413 26.217 1.00 35.12 H new ATOM 632 N PHE A 584 -3.335 -24.874 21.849 1.00 14.25 N ATOM 633 CA PHE A 584 -4.116 -25.159 20.657 1.00 4.12 C ATOM 634 C PHE A 584 -5.145 -26.259 20.925 1.00 3.15 C ATOM 635 O PHE A 584 -6.161 -26.344 20.238 1.00 14.43 O ATOM 636 CB PHE A 584 -3.136 -25.644 19.587 1.00 43.31 C ATOM 637 CG PHE A 584 -3.541 -25.273 18.159 1.00 61.33 C ATOM 638 CD1 PHE A 584 -3.908 -23.997 17.865 1.00 11.04 C ATOM 639 CD2 PHE A 584 -3.534 -26.220 17.183 1.00 70.24 C ATOM 640 CE1 PHE A 584 -4.284 -23.653 16.540 1.00 32.21 C ATOM 641 CE2 PHE A 584 -3.910 -25.876 15.857 1.00 32.42 C ATOM 642 CZ PHE A 584 -4.277 -24.600 15.564 1.00 74.11 C ATOM 0 H PHE A 584 -2.444 -25.368 21.904 1.00 14.25 H new ATOM 0 HA PHE A 584 -4.654 -24.265 20.342 1.00 4.12 H new ATOM 0 HB2 PHE A 584 -2.151 -25.226 19.795 1.00 43.31 H new ATOM 0 HB3 PHE A 584 -3.044 -26.728 19.658 1.00 43.31 H new ATOM 0 HD1 PHE A 584 -3.913 -23.245 18.640 1.00 11.04 H new ATOM 0 HD2 PHE A 584 -3.243 -27.234 17.416 1.00 70.24 H new ATOM 0 HE1 PHE A 584 -4.576 -22.639 16.307 1.00 32.21 H new ATOM 0 HE2 PHE A 584 -3.904 -26.628 15.082 1.00 32.42 H new ATOM 0 HZ PHE A 584 -4.563 -24.338 14.556 1.00 74.11 H new ATOM 652 N SER A 585 -4.845 -27.074 21.926 1.00 12.11 N ATOM 653 CA SER A 585 -5.732 -28.165 22.294 1.00 43.03 C ATOM 654 C SER A 585 -7.094 -27.612 22.718 1.00 22.21 C ATOM 655 O SER A 585 -8.114 -28.282 22.567 1.00 31.54 O ATOM 656 CB SER A 585 -5.128 -29.010 23.417 1.00 33.22 C ATOM 657 OG SER A 585 -4.591 -28.204 24.462 1.00 13.23 O ATOM 0 H SER A 585 -4.001 -27.001 22.493 1.00 12.11 H new ATOM 0 HA SER A 585 -5.864 -28.808 21.424 1.00 43.03 H new ATOM 0 HB2 SER A 585 -5.893 -29.670 23.825 1.00 33.22 H new ATOM 0 HB3 SER A 585 -4.342 -29.646 23.010 1.00 33.22 H new ATOM 0 HG SER A 585 -3.714 -27.860 24.192 1.00 13.23 H new ATOM 663 N ASN A 586 -7.066 -26.395 23.241 1.00 41.05 N ATOM 664 CA ASN A 586 -8.286 -25.744 23.688 1.00 63.41 C ATOM 665 C ASN A 586 -8.925 -25.005 22.511 1.00 12.21 C ATOM 666 O ASN A 586 -10.048 -24.514 22.618 1.00 2.52 O ATOM 667 CB ASN A 586 -7.993 -24.721 24.787 1.00 41.03 C ATOM 668 CG ASN A 586 -8.024 -25.376 26.169 1.00 63.41 C ATOM 669 OD1 ASN A 586 -9.029 -25.382 26.859 1.00 35.25 O ATOM 670 ND2 ASN A 586 -6.869 -25.927 26.533 1.00 42.55 N ATOM 0 H ASN A 586 -6.218 -25.843 23.365 1.00 41.05 H new ATOM 0 HA ASN A 586 -8.954 -26.511 24.079 1.00 63.41 H new ATOM 0 HB2 ASN A 586 -7.016 -24.269 24.617 1.00 41.03 H new ATOM 0 HB3 ASN A 586 -8.728 -23.917 24.745 1.00 41.03 H new ATOM 0 HD21 ASN A 586 -6.788 -26.390 27.438 1.00 42.55 H new ATOM 0 HD22 ASN A 586 -6.065 -25.886 25.907 1.00 42.55 H new ATOM 677 N TYR A 587 -8.183 -24.949 21.415 1.00 1.41 N ATOM 678 CA TYR A 587 -8.663 -24.277 20.219 1.00 34.24 C ATOM 679 C TYR A 587 -9.161 -25.289 19.185 1.00 45.23 C ATOM 680 O TYR A 587 -9.521 -24.915 18.070 1.00 70.34 O ATOM 681 CB TYR A 587 -7.460 -23.527 19.645 1.00 71.34 C ATOM 682 CG TYR A 587 -7.304 -22.101 20.176 1.00 51.03 C ATOM 683 CD1 TYR A 587 -8.381 -21.238 20.163 1.00 73.13 C ATOM 684 CD2 TYR A 587 -6.086 -21.677 20.668 1.00 74.03 C ATOM 685 CE1 TYR A 587 -8.235 -19.896 20.663 1.00 44.34 C ATOM 686 CE2 TYR A 587 -5.940 -20.335 21.168 1.00 43.44 C ATOM 687 CZ TYR A 587 -7.021 -19.510 21.140 1.00 30.24 C ATOM 688 OH TYR A 587 -6.882 -18.242 21.612 1.00 34.35 O ATOM 0 H TYR A 587 -7.253 -25.358 21.330 1.00 1.41 H new ATOM 0 HA TYR A 587 -9.493 -23.613 20.458 1.00 34.24 H new ATOM 0 HB2 TYR A 587 -6.553 -24.089 19.870 1.00 71.34 H new ATOM 0 HB3 TYR A 587 -7.551 -23.491 18.559 1.00 71.34 H new ATOM 0 HD1 TYR A 587 -9.334 -21.570 19.778 1.00 73.13 H new ATOM 0 HD2 TYR A 587 -5.243 -22.352 20.678 1.00 74.03 H new ATOM 0 HE1 TYR A 587 -9.070 -19.211 20.659 1.00 44.34 H new ATOM 0 HE2 TYR A 587 -4.993 -19.991 21.557 1.00 43.44 H new ATOM 0 HH TYR A 587 -6.928 -17.608 20.866 1.00 34.35 H new ATOM 698 N TYR A 588 -9.164 -26.550 19.591 1.00 1.22 N ATOM 699 CA TYR A 588 -9.611 -27.618 18.713 1.00 1.13 C ATOM 700 C TYR A 588 -9.759 -28.933 19.481 1.00 11.02 C ATOM 701 O TYR A 588 -9.162 -29.107 20.542 1.00 25.22 O ATOM 702 CB TYR A 588 -8.518 -27.779 17.655 1.00 24.43 C ATOM 703 CG TYR A 588 -7.321 -28.613 18.119 1.00 12.40 C ATOM 704 CD1 TYR A 588 -7.468 -29.967 18.340 1.00 23.13 C ATOM 705 CD2 TYR A 588 -6.095 -28.010 18.316 1.00 14.11 C ATOM 706 CE1 TYR A 588 -6.342 -30.751 18.777 1.00 64.33 C ATOM 707 CE2 TYR A 588 -4.969 -28.794 18.753 1.00 73.14 C ATOM 708 CZ TYR A 588 -5.148 -30.126 18.961 1.00 20.13 C ATOM 709 OH TYR A 588 -4.084 -30.867 19.373 1.00 14.25 O ATOM 0 H TYR A 588 -8.864 -26.856 20.517 1.00 1.22 H new ATOM 0 HA TYR A 588 -10.581 -27.377 18.278 1.00 1.13 H new ATOM 0 HB2 TYR A 588 -8.950 -28.244 16.769 1.00 24.43 H new ATOM 0 HB3 TYR A 588 -8.166 -26.791 17.357 1.00 24.43 H new ATOM 0 HD1 TYR A 588 -8.427 -30.439 18.185 1.00 23.13 H new ATOM 0 HD2 TYR A 588 -5.980 -26.950 18.142 1.00 14.11 H new ATOM 0 HE1 TYR A 588 -6.443 -31.811 18.955 1.00 64.33 H new ATOM 0 HE2 TYR A 588 -4.004 -28.335 18.912 1.00 73.14 H new ATOM 0 HH TYR A 588 -3.297 -30.289 19.461 1.00 14.25 H new ATOM 719 N ASN A 589 -10.559 -29.825 18.915 1.00 1.23 N ATOM 720 CA ASN A 589 -10.793 -31.119 19.533 1.00 12.34 C ATOM 721 C ASN A 589 -10.575 -32.222 18.496 1.00 44.21 C ATOM 722 O ASN A 589 -11.088 -32.141 17.381 1.00 42.20 O ATOM 723 CB ASN A 589 -12.230 -31.231 20.048 1.00 63.44 C ATOM 724 CG ASN A 589 -12.487 -30.233 21.178 1.00 74.00 C ATOM 725 OD1 ASN A 589 -12.437 -30.559 22.353 1.00 72.14 O ATOM 726 ND2 ASN A 589 -12.765 -29.002 20.759 1.00 12.33 N ATOM 0 H ASN A 589 -11.053 -29.677 18.035 1.00 1.23 H new ATOM 0 HA ASN A 589 -10.101 -31.224 20.368 1.00 12.34 H new ATOM 0 HB2 ASN A 589 -12.928 -31.048 19.231 1.00 63.44 H new ATOM 0 HB3 ASN A 589 -12.414 -32.244 20.404 1.00 63.44 H new ATOM 0 HD21 ASN A 589 -12.953 -28.263 21.436 1.00 12.33 H new ATOM 0 HD22 ASN A 589 -12.791 -28.797 19.760 1.00 12.33 H new ATOM 733 N VAL A 590 -9.812 -33.227 18.900 1.00 71.13 N ATOM 734 CA VAL A 590 -9.519 -34.345 18.019 1.00 72.11 C ATOM 735 C VAL A 590 -10.772 -35.209 17.865 1.00 75.14 C ATOM 736 O VAL A 590 -11.446 -35.513 18.848 1.00 53.12 O ATOM 737 CB VAL A 590 -8.315 -35.127 18.548 1.00 35.15 C ATOM 738 CG1 VAL A 590 -8.283 -36.543 17.969 1.00 53.31 C ATOM 739 CG2 VAL A 590 -7.009 -34.386 18.258 1.00 51.31 C ATOM 0 H VAL A 590 -9.388 -33.291 19.825 1.00 71.13 H new ATOM 0 HA VAL A 590 -9.246 -33.987 17.026 1.00 72.11 H new ATOM 0 HB VAL A 590 -8.419 -35.210 19.630 1.00 35.15 H new ATOM 0 HG11 VAL A 590 -7.417 -37.077 18.361 1.00 53.31 H new ATOM 0 HG12 VAL A 590 -9.194 -37.072 18.250 1.00 53.31 H new ATOM 0 HG13 VAL A 590 -8.215 -36.490 16.882 1.00 53.31 H new ATOM 0 HG21 VAL A 590 -6.169 -34.964 18.645 1.00 51.31 H new ATOM 0 HG22 VAL A 590 -6.895 -34.256 17.182 1.00 51.31 H new ATOM 0 HG23 VAL A 590 -7.030 -33.409 18.741 1.00 51.31 H new ATOM 749 N SER A 591 -11.047 -35.580 16.623 1.00 71.42 N ATOM 750 CA SER A 591 -12.208 -36.403 16.327 1.00 25.41 C ATOM 751 C SER A 591 -12.153 -37.697 17.143 1.00 54.32 C ATOM 752 O SER A 591 -11.171 -37.957 17.837 1.00 55.35 O ATOM 753 CB SER A 591 -12.291 -36.721 14.833 1.00 62.41 C ATOM 754 OG SER A 591 -13.479 -37.437 14.505 1.00 43.03 O ATOM 0 H SER A 591 -10.486 -35.326 15.810 1.00 71.42 H new ATOM 0 HA SER A 591 -13.103 -35.845 16.602 1.00 25.41 H new ATOM 0 HB2 SER A 591 -12.258 -35.793 14.262 1.00 62.41 H new ATOM 0 HB3 SER A 591 -11.421 -37.308 14.538 1.00 62.41 H new ATOM 0 HG SER A 591 -13.250 -38.220 13.961 1.00 43.03 H new ATOM 760 N ARG A 592 -13.221 -38.473 17.032 1.00 31.43 N ATOM 761 CA ARG A 592 -13.308 -39.733 17.751 1.00 64.30 C ATOM 762 C ARG A 592 -12.407 -40.782 17.095 1.00 40.33 C ATOM 763 O ARG A 592 -11.737 -41.549 17.784 1.00 0.13 O ATOM 764 CB ARG A 592 -14.746 -40.253 17.780 1.00 73.10 C ATOM 765 CG ARG A 592 -14.850 -41.534 18.610 1.00 23.30 C ATOM 766 CD ARG A 592 -16.312 -41.907 18.863 1.00 61.22 C ATOM 767 NE ARG A 592 -16.900 -40.997 19.871 1.00 45.43 N ATOM 768 CZ ARG A 592 -16.748 -41.145 21.204 1.00 52.50 C ATOM 769 NH1 ARG A 592 -16.026 -42.170 21.702 1.00 65.31 N ATOM 770 NH2 ARG A 592 -17.318 -40.271 22.014 1.00 62.25 N ATOM 0 H ARG A 592 -14.033 -38.254 16.455 1.00 31.43 H new ATOM 0 HA ARG A 592 -12.978 -39.554 18.774 1.00 64.30 H new ATOM 0 HB2 ARG A 592 -15.404 -39.491 18.198 1.00 73.10 H new ATOM 0 HB3 ARG A 592 -15.087 -40.446 16.763 1.00 73.10 H new ATOM 0 HG2 ARG A 592 -14.348 -42.350 18.090 1.00 23.30 H new ATOM 0 HG3 ARG A 592 -14.336 -41.398 19.561 1.00 23.30 H new ATOM 0 HD2 ARG A 592 -16.877 -41.847 17.933 1.00 61.22 H new ATOM 0 HD3 ARG A 592 -16.378 -42.938 19.210 1.00 61.22 H new ATOM 0 HE ARG A 592 -17.455 -40.209 19.538 1.00 45.43 H new ATOM 0 HH11 ARG A 592 -15.590 -42.841 21.070 1.00 65.31 H new ATOM 0 HH12 ARG A 592 -15.916 -42.274 22.711 1.00 65.31 H new ATOM 0 HH21 ARG A 592 -17.863 -39.499 21.629 1.00 62.25 H new ATOM 0 HH22 ARG A 592 -17.213 -40.368 23.024 1.00 62.25 H new ATOM 783 N ASP A 593 -12.420 -40.781 15.770 1.00 51.22 N ATOM 784 CA ASP A 593 -11.613 -41.722 15.013 1.00 62.42 C ATOM 785 C ASP A 593 -10.133 -41.477 15.315 1.00 31.43 C ATOM 786 O ASP A 593 -9.726 -40.344 15.564 1.00 51.44 O ATOM 787 CB ASP A 593 -11.824 -41.543 13.508 1.00 24.21 C ATOM 788 CG ASP A 593 -13.236 -41.122 13.099 1.00 52.43 C ATOM 789 OD1 ASP A 593 -13.521 -39.927 12.925 1.00 71.31 O ATOM 790 OD2 ASP A 593 -14.075 -42.091 12.956 1.00 21.42 O ATOM 0 H ASP A 593 -12.977 -40.143 15.201 1.00 51.22 H new ATOM 0 HA ASP A 593 -11.911 -42.730 15.302 1.00 62.42 H new ATOM 0 HB2 ASP A 593 -11.119 -40.796 13.144 1.00 24.21 H new ATOM 0 HB3 ASP A 593 -11.582 -42.481 13.008 1.00 24.21 H new ATOM 796 N PRO A 594 -9.349 -42.588 15.284 1.00 45.22 N ATOM 797 CA PRO A 594 -7.923 -42.505 15.552 1.00 41.43 C ATOM 798 C PRO A 594 -7.176 -41.901 14.361 1.00 5.51 C ATOM 799 O PRO A 594 -6.999 -40.686 14.286 1.00 5.43 O ATOM 800 CB PRO A 594 -7.496 -43.931 15.859 1.00 15.21 C ATOM 801 CG PRO A 594 -8.593 -44.823 15.300 1.00 22.22 C ATOM 802 CD PRO A 594 -9.796 -43.947 14.993 1.00 11.25 C ATOM 0 HA PRO A 594 -7.690 -41.845 16.388 1.00 41.43 H new ATOM 0 HB2 PRO A 594 -6.535 -44.159 15.399 1.00 15.21 H new ATOM 0 HB3 PRO A 594 -7.379 -44.081 16.932 1.00 15.21 H new ATOM 0 HG2 PRO A 594 -8.250 -45.330 14.398 1.00 22.22 H new ATOM 0 HG3 PRO A 594 -8.859 -45.598 16.019 1.00 22.22 H new ATOM 0 HD2 PRO A 594 -10.104 -44.048 13.952 1.00 11.25 H new ATOM 0 HD3 PRO A 594 -10.653 -44.222 15.608 1.00 11.25 H new ATOM 810 N VAL A 595 -6.757 -42.777 13.460 1.00 53.35 N ATOM 811 CA VAL A 595 -6.033 -42.345 12.276 1.00 53.10 C ATOM 812 C VAL A 595 -6.977 -42.362 11.072 1.00 41.32 C ATOM 813 O VAL A 595 -7.647 -43.361 10.817 1.00 23.53 O ATOM 814 CB VAL A 595 -4.792 -43.217 12.075 1.00 41.41 C ATOM 815 CG1 VAL A 595 -4.152 -42.953 10.711 1.00 42.53 C ATOM 816 CG2 VAL A 595 -3.783 -43.003 13.205 1.00 41.51 C ATOM 0 H VAL A 595 -6.905 -43.784 13.526 1.00 53.35 H new ATOM 0 HA VAL A 595 -5.679 -41.321 12.397 1.00 53.10 H new ATOM 0 HB VAL A 595 -5.107 -44.260 12.101 1.00 41.41 H new ATOM 0 HG11 VAL A 595 -3.272 -43.585 10.593 1.00 42.53 H new ATOM 0 HG12 VAL A 595 -4.870 -43.179 9.922 1.00 42.53 H new ATOM 0 HG13 VAL A 595 -3.858 -41.906 10.644 1.00 42.53 H new ATOM 0 HG21 VAL A 595 -2.910 -43.634 13.038 1.00 41.51 H new ATOM 0 HG22 VAL A 595 -3.476 -41.957 13.225 1.00 41.51 H new ATOM 0 HG23 VAL A 595 -4.243 -43.264 14.158 1.00 41.51 H new ATOM 826 N VAL A 596 -7.000 -41.243 10.363 1.00 43.33 N ATOM 827 CA VAL A 596 -7.850 -41.116 9.191 1.00 32.14 C ATOM 828 C VAL A 596 -7.067 -40.432 8.069 1.00 22.12 C ATOM 829 O VAL A 596 -7.256 -39.245 7.810 1.00 2.40 O ATOM 830 CB VAL A 596 -9.139 -40.377 9.558 1.00 43.13 C ATOM 831 CG1 VAL A 596 -10.235 -40.642 8.524 1.00 14.42 C ATOM 832 CG2 VAL A 596 -9.607 -40.756 10.964 1.00 53.20 C ATOM 0 H VAL A 596 -6.443 -40.416 10.578 1.00 43.33 H new ATOM 0 HA VAL A 596 -8.147 -42.099 8.826 1.00 32.14 H new ATOM 0 HB VAL A 596 -8.926 -39.308 9.554 1.00 43.13 H new ATOM 0 HG11 VAL A 596 -11.140 -40.106 8.808 1.00 14.42 H new ATOM 0 HG12 VAL A 596 -9.902 -40.299 7.545 1.00 14.42 H new ATOM 0 HG13 VAL A 596 -10.445 -41.711 8.482 1.00 14.42 H new ATOM 0 HG21 VAL A 596 -10.525 -40.217 11.200 1.00 53.20 H new ATOM 0 HG22 VAL A 596 -9.795 -41.829 11.008 1.00 53.20 H new ATOM 0 HG23 VAL A 596 -8.835 -40.493 11.688 1.00 53.20 H new ATOM 842 N ILE A 597 -6.204 -41.211 7.433 1.00 1.14 N ATOM 843 CA ILE A 597 -5.391 -40.695 6.345 1.00 11.00 C ATOM 844 C ILE A 597 -5.145 -41.809 5.326 1.00 63.12 C ATOM 845 O ILE A 597 -5.306 -42.988 5.638 1.00 2.12 O ATOM 846 CB ILE A 597 -4.108 -40.063 6.888 1.00 62.03 C ATOM 847 CG1 ILE A 597 -4.361 -38.632 7.365 1.00 42.51 C ATOM 848 CG2 ILE A 597 -2.983 -40.132 5.853 1.00 3.10 C ATOM 849 CD1 ILE A 597 -3.051 -37.846 7.460 1.00 54.45 C ATOM 0 H ILE A 597 -6.050 -42.196 7.651 1.00 1.14 H new ATOM 0 HA ILE A 597 -5.916 -39.895 5.823 1.00 11.00 H new ATOM 0 HB ILE A 597 -3.784 -40.638 7.755 1.00 62.03 H new ATOM 0 HG12 ILE A 597 -5.041 -38.130 6.677 1.00 42.51 H new ATOM 0 HG13 ILE A 597 -4.850 -38.651 8.339 1.00 42.51 H new ATOM 0 HG21 ILE A 597 -2.082 -39.676 6.264 1.00 3.10 H new ATOM 0 HG22 ILE A 597 -2.781 -41.174 5.604 1.00 3.10 H new ATOM 0 HG23 ILE A 597 -3.283 -39.595 4.953 1.00 3.10 H new ATOM 0 HD11 ILE A 597 -3.259 -36.832 7.801 1.00 54.45 H new ATOM 0 HD12 ILE A 597 -2.383 -38.337 8.167 1.00 54.45 H new ATOM 0 HD13 ILE A 597 -2.577 -37.809 6.479 1.00 54.45 H new ATOM 861 N ASN A 598 -4.758 -41.396 4.128 1.00 71.53 N ATOM 862 CA ASN A 598 -4.488 -42.345 3.061 1.00 61.04 C ATOM 863 C ASN A 598 -3.664 -43.509 3.615 1.00 10.12 C ATOM 864 O ASN A 598 -4.113 -44.654 3.602 1.00 14.23 O ATOM 865 CB ASN A 598 -3.685 -41.692 1.934 1.00 61.23 C ATOM 866 CG ASN A 598 -3.770 -42.519 0.649 1.00 33.34 C ATOM 867 OD1 ASN A 598 -4.170 -43.672 0.648 1.00 54.11 O ATOM 868 ND2 ASN A 598 -3.373 -41.869 -0.440 1.00 40.34 N ATOM 0 H ASN A 598 -4.625 -40.417 3.873 1.00 71.53 H new ATOM 0 HA ASN A 598 -5.444 -42.692 2.669 1.00 61.04 H new ATOM 0 HB2 ASN A 598 -4.063 -40.686 1.749 1.00 61.23 H new ATOM 0 HB3 ASN A 598 -2.643 -41.590 2.237 1.00 61.23 H new ATOM 0 HD21 ASN A 598 -3.392 -42.335 -1.347 1.00 40.34 H new ATOM 0 HD22 ASN A 598 -3.049 -40.904 -0.369 1.00 40.34 H new ATOM 875 N LYS A 599 -2.473 -43.176 4.089 1.00 4.33 N ATOM 876 CA LYS A 599 -1.582 -44.179 4.647 1.00 1.15 C ATOM 877 C LYS A 599 -0.758 -43.553 5.774 1.00 3.32 C ATOM 878 O LYS A 599 -0.878 -42.359 6.046 1.00 24.24 O ATOM 879 CB LYS A 599 -0.733 -44.815 3.545 1.00 40.32 C ATOM 880 CG LYS A 599 0.623 -44.116 3.425 1.00 52.12 C ATOM 881 CD LYS A 599 0.452 -42.659 2.989 1.00 62.32 C ATOM 882 CE LYS A 599 -0.111 -42.574 1.569 1.00 61.53 C ATOM 883 NZ LYS A 599 -0.062 -41.180 1.074 1.00 33.34 N ATOM 0 H LYS A 599 -2.104 -42.225 4.098 1.00 4.33 H new ATOM 0 HA LYS A 599 -2.156 -44.995 5.086 1.00 1.15 H new ATOM 0 HB2 LYS A 599 -0.583 -45.873 3.761 1.00 40.32 H new ATOM 0 HB3 LYS A 599 -1.262 -44.756 2.594 1.00 40.32 H new ATOM 0 HG2 LYS A 599 1.142 -44.154 4.383 1.00 52.12 H new ATOM 0 HG3 LYS A 599 1.246 -44.645 2.704 1.00 52.12 H new ATOM 0 HD2 LYS A 599 -0.216 -42.145 3.680 1.00 62.32 H new ATOM 0 HD3 LYS A 599 1.413 -42.147 3.034 1.00 62.32 H new ATOM 0 HE2 LYS A 599 0.461 -43.222 0.905 1.00 61.53 H new ATOM 0 HE3 LYS A 599 -1.140 -42.934 1.557 1.00 61.53 H new ATOM 0 HZ1 LYS A 599 -1.012 -40.886 0.770 1.00 33.34 H new ATOM 0 HZ2 LYS A 599 0.267 -40.553 1.835 1.00 33.34 H new ATOM 0 HZ3 LYS A 599 0.593 -41.120 0.269 1.00 33.34 H new ATOM 896 N VAL A 600 0.061 -44.386 6.399 1.00 71.30 N ATOM 897 CA VAL A 600 0.905 -43.929 7.490 1.00 32.30 C ATOM 898 C VAL A 600 2.328 -43.713 6.972 1.00 40.40 C ATOM 899 O VAL A 600 2.813 -44.478 6.140 1.00 54.45 O ATOM 900 CB VAL A 600 0.837 -44.920 8.654 1.00 13.44 C ATOM 901 CG1 VAL A 600 1.365 -44.287 9.944 1.00 73.14 C ATOM 902 CG2 VAL A 600 -0.588 -45.445 8.845 1.00 64.04 C ATOM 0 H VAL A 600 0.158 -45.375 6.171 1.00 71.30 H new ATOM 0 HA VAL A 600 0.550 -42.972 7.873 1.00 32.30 H new ATOM 0 HB VAL A 600 1.477 -45.768 8.410 1.00 13.44 H new ATOM 0 HG11 VAL A 600 1.306 -45.012 10.756 1.00 73.14 H new ATOM 0 HG12 VAL A 600 2.403 -43.984 9.803 1.00 73.14 H new ATOM 0 HG13 VAL A 600 0.763 -43.413 10.193 1.00 73.14 H new ATOM 0 HG21 VAL A 600 -0.608 -46.147 9.678 1.00 64.04 H new ATOM 0 HG22 VAL A 600 -1.258 -44.611 9.057 1.00 64.04 H new ATOM 0 HG23 VAL A 600 -0.914 -45.951 7.936 1.00 64.04 H new ATOM 912 N PHE A 601 2.958 -42.666 7.486 1.00 32.50 N ATOM 913 CA PHE A 601 4.316 -42.339 7.086 1.00 72.53 C ATOM 914 C PHE A 601 5.302 -42.601 8.226 1.00 13.02 C ATOM 915 O PHE A 601 4.898 -42.755 9.378 1.00 54.42 O ATOM 916 CB PHE A 601 4.334 -40.849 6.743 1.00 4.52 C ATOM 917 CG PHE A 601 3.199 -40.409 5.816 1.00 2.23 C ATOM 918 CD1 PHE A 601 1.947 -40.227 6.314 1.00 74.31 C ATOM 919 CD2 PHE A 601 3.443 -40.199 4.495 1.00 71.53 C ATOM 920 CE1 PHE A 601 0.893 -39.819 5.454 1.00 61.23 C ATOM 921 CE2 PHE A 601 2.389 -39.791 3.635 1.00 64.45 C ATOM 922 CZ PHE A 601 1.137 -39.610 4.132 1.00 12.21 C ATOM 0 H PHE A 601 2.553 -42.033 8.176 1.00 32.50 H new ATOM 0 HA PHE A 601 4.613 -42.955 6.237 1.00 72.53 H new ATOM 0 HB2 PHE A 601 4.278 -40.273 7.667 1.00 4.52 H new ATOM 0 HB3 PHE A 601 5.287 -40.606 6.273 1.00 4.52 H new ATOM 0 HD1 PHE A 601 1.754 -40.393 7.364 1.00 74.31 H new ATOM 0 HD2 PHE A 601 4.438 -40.342 4.100 1.00 71.53 H new ATOM 0 HE1 PHE A 601 -0.102 -39.675 5.849 1.00 61.23 H new ATOM 0 HE2 PHE A 601 2.582 -39.624 2.586 1.00 64.45 H new ATOM 0 HZ PHE A 601 0.336 -39.300 3.477 1.00 12.21 H new ATOM 932 N LYS A 602 6.576 -42.643 7.866 1.00 30.41 N ATOM 933 CA LYS A 602 7.623 -42.884 8.845 1.00 53.41 C ATOM 934 C LYS A 602 8.066 -41.550 9.449 1.00 43.44 C ATOM 935 O LYS A 602 8.229 -41.437 10.663 1.00 54.13 O ATOM 936 CB LYS A 602 8.766 -43.687 8.221 1.00 53.31 C ATOM 937 CG LYS A 602 8.370 -45.154 8.040 1.00 3.32 C ATOM 938 CD LYS A 602 7.540 -45.345 6.769 1.00 22.22 C ATOM 939 CE LYS A 602 7.490 -46.820 6.364 1.00 1.32 C ATOM 940 NZ LYS A 602 6.263 -47.102 5.586 1.00 44.13 N ATOM 0 H LYS A 602 6.907 -42.514 6.910 1.00 30.41 H new ATOM 0 HA LYS A 602 7.246 -43.496 9.664 1.00 53.41 H new ATOM 0 HB2 LYS A 602 9.033 -43.257 7.256 1.00 53.31 H new ATOM 0 HB3 LYS A 602 9.650 -43.621 8.855 1.00 53.31 H new ATOM 0 HG2 LYS A 602 9.266 -45.773 7.990 1.00 3.32 H new ATOM 0 HG3 LYS A 602 7.799 -45.490 8.906 1.00 3.32 H new ATOM 0 HD2 LYS A 602 6.528 -44.974 6.932 1.00 22.22 H new ATOM 0 HD3 LYS A 602 7.969 -44.756 5.958 1.00 22.22 H new ATOM 0 HE2 LYS A 602 8.370 -47.070 5.771 1.00 1.32 H new ATOM 0 HE3 LYS A 602 7.516 -47.449 7.254 1.00 1.32 H new ATOM 0 HZ1 LYS A 602 6.245 -48.107 5.319 1.00 44.13 H new ATOM 0 HZ2 LYS A 602 5.427 -46.882 6.164 1.00 44.13 H new ATOM 0 HZ3 LYS A 602 6.254 -46.515 4.727 1.00 44.13 H new ATOM 953 N ASP A 603 8.250 -40.572 8.573 1.00 30.30 N ATOM 954 CA ASP A 603 8.672 -39.250 9.004 1.00 33.45 C ATOM 955 C ASP A 603 7.902 -38.861 10.268 1.00 74.30 C ATOM 956 O ASP A 603 8.473 -38.294 11.198 1.00 43.24 O ATOM 957 CB ASP A 603 8.379 -38.201 7.930 1.00 31.13 C ATOM 958 CG ASP A 603 9.093 -38.425 6.596 1.00 74.33 C ATOM 959 OD1 ASP A 603 8.566 -38.088 5.525 1.00 13.11 O ATOM 960 OD2 ASP A 603 10.254 -38.979 6.685 1.00 61.31 O ATOM 0 H ASP A 603 8.114 -40.669 7.567 1.00 30.30 H new ATOM 0 HA ASP A 603 9.745 -39.283 9.192 1.00 33.45 H new ATOM 0 HB2 ASP A 603 7.304 -38.177 7.750 1.00 31.13 H new ATOM 0 HB3 ASP A 603 8.659 -37.221 8.315 1.00 31.13 H new ATOM 966 N TRP A 604 6.616 -39.182 10.261 1.00 1.13 N ATOM 967 CA TRP A 604 5.762 -38.873 11.395 1.00 12.03 C ATOM 968 C TRP A 604 4.564 -39.824 11.357 1.00 15.44 C ATOM 969 O TRP A 604 4.315 -40.475 10.344 1.00 24.31 O ATOM 970 CB TRP A 604 5.355 -37.398 11.390 1.00 62.14 C ATOM 971 CG TRP A 604 4.562 -36.976 10.151 1.00 1.02 C ATOM 972 CD1 TRP A 604 4.233 -37.723 9.088 1.00 13.33 C ATOM 973 CD2 TRP A 604 4.008 -35.669 9.889 1.00 63.31 C ATOM 974 NE1 TRP A 604 3.510 -36.996 8.164 1.00 42.11 N ATOM 975 CE2 TRP A 604 3.369 -35.708 8.666 1.00 4.44 C ATOM 976 CE3 TRP A 604 4.046 -34.494 10.659 1.00 10.24 C ATOM 977 CZ2 TRP A 604 2.720 -34.601 8.106 1.00 62.23 C ATOM 978 CZ3 TRP A 604 3.393 -33.397 10.085 1.00 14.20 C ATOM 979 CH2 TRP A 604 2.745 -33.419 8.855 1.00 31.14 C ATOM 0 H TRP A 604 6.145 -39.653 9.488 1.00 1.13 H new ATOM 0 HA TRP A 604 6.297 -39.023 12.333 1.00 12.03 H new ATOM 0 HB2 TRP A 604 4.757 -37.193 12.278 1.00 62.14 H new ATOM 0 HB3 TRP A 604 6.253 -36.784 11.461 1.00 62.14 H new ATOM 0 HD1 TRP A 604 4.500 -38.763 8.969 1.00 13.33 H new ATOM 0 HE1 TRP A 604 3.146 -37.341 7.276 1.00 42.11 H new ATOM 0 HE3 TRP A 604 4.540 -34.442 11.618 1.00 10.24 H new ATOM 0 HZ2 TRP A 604 2.226 -34.656 7.147 1.00 62.23 H new ATOM 0 HZ3 TRP A 604 3.392 -32.468 10.636 1.00 14.20 H new ATOM 0 HH2 TRP A 604 2.263 -32.528 8.479 1.00 31.14 H new ATOM 990 N LYS A 605 3.852 -39.873 12.474 1.00 2.41 N ATOM 991 CA LYS A 605 2.686 -40.733 12.581 1.00 11.34 C ATOM 992 C LYS A 605 1.435 -39.869 12.755 1.00 20.00 C ATOM 993 O LYS A 605 1.513 -38.751 13.263 1.00 64.53 O ATOM 994 CB LYS A 605 2.881 -41.764 13.695 1.00 0.50 C ATOM 995 CG LYS A 605 2.374 -41.226 15.035 1.00 43.22 C ATOM 996 CD LYS A 605 2.847 -42.107 16.193 1.00 14.32 C ATOM 997 CE LYS A 605 4.266 -41.731 16.624 1.00 13.14 C ATOM 998 NZ LYS A 605 5.263 -42.524 15.872 1.00 62.20 N ATOM 0 H LYS A 605 4.061 -39.331 13.312 1.00 2.41 H new ATOM 0 HA LYS A 605 2.552 -41.309 11.665 1.00 11.34 H new ATOM 0 HB2 LYS A 605 2.350 -42.682 13.443 1.00 0.50 H new ATOM 0 HB3 LYS A 605 3.937 -42.020 13.778 1.00 0.50 H new ATOM 0 HG2 LYS A 605 2.730 -40.206 15.180 1.00 43.22 H new ATOM 0 HG3 LYS A 605 1.285 -41.185 15.026 1.00 43.22 H new ATOM 0 HD2 LYS A 605 2.166 -42.000 17.038 1.00 14.32 H new ATOM 0 HD3 LYS A 605 2.820 -43.154 15.892 1.00 14.32 H new ATOM 0 HE2 LYS A 605 4.435 -40.668 16.453 1.00 13.14 H new ATOM 0 HE3 LYS A 605 4.386 -41.905 17.693 1.00 13.14 H new ATOM 0 HZ1 LYS A 605 6.034 -42.808 16.510 1.00 62.20 H new ATOM 0 HZ2 LYS A 605 4.808 -43.373 15.481 1.00 62.20 H new ATOM 0 HZ3 LYS A 605 5.650 -41.950 15.096 1.00 62.20 H new ATOM 1011 N PRO A 606 0.280 -40.435 12.312 1.00 1.52 N ATOM 1012 CA PRO A 606 -0.986 -39.729 12.414 1.00 43.44 C ATOM 1013 C PRO A 606 -1.499 -39.727 13.855 1.00 3.21 C ATOM 1014 O PRO A 606 -1.065 -40.537 14.673 1.00 11.31 O ATOM 1015 CB PRO A 606 -1.917 -40.450 11.453 1.00 64.03 C ATOM 1016 CG PRO A 606 -1.283 -41.808 11.199 1.00 22.21 C ATOM 1017 CD PRO A 606 0.149 -41.756 11.706 1.00 64.04 C ATOM 0 HA PRO A 606 -0.902 -38.675 12.151 1.00 43.44 H new ATOM 0 HB2 PRO A 606 -2.913 -40.558 11.882 1.00 64.03 H new ATOM 0 HB3 PRO A 606 -2.029 -39.891 10.524 1.00 64.03 H new ATOM 0 HG2 PRO A 606 -1.841 -42.592 11.711 1.00 22.21 H new ATOM 0 HG3 PRO A 606 -1.303 -42.046 10.135 1.00 22.21 H new ATOM 0 HD2 PRO A 606 0.341 -42.546 12.432 1.00 64.04 H new ATOM 0 HD3 PRO A 606 0.862 -41.891 10.893 1.00 64.04 H new ATOM 1025 N GLY A 607 -2.415 -38.808 14.122 1.00 1.22 N ATOM 1026 CA GLY A 607 -2.992 -38.690 15.451 1.00 63.04 C ATOM 1027 C GLY A 607 -4.520 -38.717 15.389 1.00 13.51 C ATOM 1028 O GLY A 607 -5.132 -39.778 15.506 1.00 45.50 O ATOM 0 H GLY A 607 -2.772 -38.138 13.441 1.00 1.22 H new ATOM 0 HA2 GLY A 607 -2.635 -39.506 16.080 1.00 63.04 H new ATOM 0 HA3 GLY A 607 -2.660 -37.761 15.915 1.00 63.04 H new ATOM 1032 N GLY A 608 -5.094 -37.536 15.206 1.00 62.44 N ATOM 1033 CA GLY A 608 -6.539 -37.411 15.127 1.00 13.21 C ATOM 1034 C GLY A 608 -6.939 -36.133 14.387 1.00 74.14 C ATOM 1035 O GLY A 608 -6.273 -35.107 14.508 1.00 44.43 O ATOM 0 H GLY A 608 -4.584 -36.658 15.110 1.00 62.44 H new ATOM 0 HA2 GLY A 608 -6.955 -38.278 14.614 1.00 13.21 H new ATOM 0 HA3 GLY A 608 -6.962 -37.402 16.131 1.00 13.21 H new ATOM 1039 N VAL A 609 -8.026 -36.238 13.636 1.00 51.20 N ATOM 1040 CA VAL A 609 -8.523 -35.103 12.876 1.00 61.41 C ATOM 1041 C VAL A 609 -8.751 -33.922 13.821 1.00 32.33 C ATOM 1042 O VAL A 609 -9.406 -34.066 14.853 1.00 43.32 O ATOM 1043 CB VAL A 609 -9.782 -35.502 12.103 1.00 64.32 C ATOM 1044 CG1 VAL A 609 -10.275 -34.350 11.226 1.00 2.41 C ATOM 1045 CG2 VAL A 609 -9.536 -36.760 11.268 1.00 72.55 C ATOM 0 H VAL A 609 -8.576 -37.091 13.538 1.00 51.20 H new ATOM 0 HA VAL A 609 -7.788 -34.789 12.135 1.00 61.41 H new ATOM 0 HB VAL A 609 -10.563 -35.728 12.829 1.00 64.32 H new ATOM 0 HG11 VAL A 609 -11.171 -34.660 10.688 1.00 2.41 H new ATOM 0 HG12 VAL A 609 -10.508 -33.489 11.853 1.00 2.41 H new ATOM 0 HG13 VAL A 609 -9.498 -34.078 10.511 1.00 2.41 H new ATOM 0 HG21 VAL A 609 -10.446 -37.022 10.729 1.00 72.55 H new ATOM 0 HG22 VAL A 609 -8.733 -36.572 10.555 1.00 72.55 H new ATOM 0 HG23 VAL A 609 -9.253 -37.583 11.925 1.00 72.55 H new ATOM 1055 N ILE A 610 -8.199 -32.782 13.436 1.00 43.54 N ATOM 1056 CA ILE A 610 -8.334 -31.576 14.236 1.00 62.31 C ATOM 1057 C ILE A 610 -9.500 -30.743 13.702 1.00 52.44 C ATOM 1058 O ILE A 610 -9.765 -30.737 12.500 1.00 2.14 O ATOM 1059 CB ILE A 610 -7.007 -30.816 14.287 1.00 12.24 C ATOM 1060 CG1 ILE A 610 -5.821 -31.775 14.176 1.00 25.20 C ATOM 1061 CG2 ILE A 610 -6.924 -29.944 15.542 1.00 45.22 C ATOM 1062 CD1 ILE A 610 -4.526 -31.102 14.637 1.00 71.12 C ATOM 0 H ILE A 610 -7.657 -32.667 12.580 1.00 43.54 H new ATOM 0 HA ILE A 610 -8.570 -31.829 15.270 1.00 62.31 H new ATOM 0 HB ILE A 610 -6.962 -30.148 13.427 1.00 12.24 H new ATOM 0 HG12 ILE A 610 -6.009 -32.663 14.780 1.00 25.20 H new ATOM 0 HG13 ILE A 610 -5.714 -32.109 13.144 1.00 25.20 H new ATOM 0 HG21 ILE A 610 -5.971 -29.414 15.555 1.00 45.22 H new ATOM 0 HG22 ILE A 610 -7.741 -29.222 15.538 1.00 45.22 H new ATOM 0 HG23 ILE A 610 -7.001 -30.574 16.428 1.00 45.22 H new ATOM 0 HD11 ILE A 610 -3.698 -31.806 14.548 1.00 71.12 H new ATOM 0 HD12 ILE A 610 -4.328 -30.229 14.015 1.00 71.12 H new ATOM 0 HD13 ILE A 610 -4.628 -30.791 15.677 1.00 71.12 H new ATOM 1074 N SER A 611 -10.167 -30.059 14.620 1.00 4.31 N ATOM 1075 CA SER A 611 -11.299 -29.223 14.256 1.00 25.44 C ATOM 1076 C SER A 611 -11.354 -27.993 15.164 1.00 32.24 C ATOM 1077 O SER A 611 -11.422 -28.121 16.386 1.00 74.41 O ATOM 1078 CB SER A 611 -12.610 -30.006 14.342 1.00 54.02 C ATOM 1079 OG SER A 611 -12.522 -31.098 15.253 1.00 71.21 O ATOM 0 H SER A 611 -9.945 -30.067 15.616 1.00 4.31 H new ATOM 0 HA SER A 611 -11.168 -28.898 13.224 1.00 25.44 H new ATOM 0 HB2 SER A 611 -13.412 -29.337 14.655 1.00 54.02 H new ATOM 0 HB3 SER A 611 -12.874 -30.380 13.353 1.00 54.02 H new ATOM 0 HG SER A 611 -12.036 -30.816 16.056 1.00 71.21 H new ATOM 1085 N CYS A 612 -11.323 -26.829 14.533 1.00 60.14 N ATOM 1086 CA CYS A 612 -11.369 -25.577 15.268 1.00 10.22 C ATOM 1087 C CYS A 612 -12.532 -25.645 16.260 1.00 51.32 C ATOM 1088 O CYS A 612 -13.684 -25.811 15.861 1.00 63.11 O ATOM 1089 CB CYS A 612 -11.488 -24.374 14.330 1.00 12.12 C ATOM 1090 SG CYS A 612 -11.201 -22.750 15.124 1.00 20.41 S ATOM 0 H CYS A 612 -11.267 -26.726 13.520 1.00 60.14 H new ATOM 0 HA CYS A 612 -10.435 -25.438 15.813 1.00 10.22 H new ATOM 0 HB2 CYS A 612 -10.775 -24.495 13.515 1.00 12.12 H new ATOM 0 HB3 CYS A 612 -12.483 -24.375 13.886 1.00 12.12 H new ATOM 1095 N ARG A 613 -12.191 -25.513 17.533 1.00 3.52 N ATOM 1096 CA ARG A 613 -13.192 -25.557 18.585 1.00 53.30 C ATOM 1097 C ARG A 613 -14.040 -24.283 18.565 1.00 5.11 C ATOM 1098 O ARG A 613 -15.180 -24.284 19.027 1.00 63.34 O ATOM 1099 CB ARG A 613 -12.540 -25.706 19.961 1.00 42.32 C ATOM 1100 CG ARG A 613 -13.572 -25.539 21.078 1.00 61.40 C ATOM 1101 CD ARG A 613 -12.896 -25.519 22.450 1.00 1.44 C ATOM 1102 NE ARG A 613 -13.736 -26.230 23.439 1.00 14.45 N ATOM 1103 CZ ARG A 613 -14.875 -25.729 23.964 1.00 75.34 C ATOM 1104 NH1 ARG A 613 -15.320 -24.509 23.597 1.00 53.44 N ATOM 1105 NH2 ARG A 613 -15.548 -26.451 24.840 1.00 22.55 N ATOM 0 H ARG A 613 -11.235 -25.375 17.860 1.00 3.52 H new ATOM 0 HA ARG A 613 -13.827 -26.423 18.401 1.00 53.30 H new ATOM 0 HB2 ARG A 613 -12.069 -26.686 20.040 1.00 42.32 H new ATOM 0 HB3 ARG A 613 -11.751 -24.963 20.076 1.00 42.32 H new ATOM 0 HG2 ARG A 613 -14.128 -24.613 20.929 1.00 61.40 H new ATOM 0 HG3 ARG A 613 -14.294 -26.355 21.036 1.00 61.40 H new ATOM 0 HD2 ARG A 613 -11.915 -25.990 22.388 1.00 1.44 H new ATOM 0 HD3 ARG A 613 -12.735 -24.490 22.770 1.00 1.44 H new ATOM 0 HE ARG A 613 -13.436 -27.156 23.743 1.00 14.45 H new ATOM 0 HH11 ARG A 613 -14.795 -23.958 22.918 1.00 53.44 H new ATOM 0 HH12 ARG A 613 -16.181 -24.138 23.998 1.00 53.44 H new ATOM 0 HH21 ARG A 613 -15.206 -27.373 25.111 1.00 22.55 H new ATOM 0 HH22 ARG A 613 -16.410 -26.087 25.246 1.00 22.55 H new ATOM 1118 N ASN A 614 -13.449 -23.226 18.026 1.00 75.32 N ATOM 1119 CA ASN A 614 -14.136 -21.948 17.940 1.00 61.52 C ATOM 1120 C ASN A 614 -15.274 -22.053 16.923 1.00 72.41 C ATOM 1121 O ASN A 614 -16.305 -21.399 17.070 1.00 12.12 O ATOM 1122 CB ASN A 614 -13.186 -20.843 17.474 1.00 70.42 C ATOM 1123 CG ASN A 614 -12.188 -20.478 18.574 1.00 23.32 C ATOM 1124 OD1 ASN A 614 -12.477 -20.545 19.758 1.00 62.04 O ATOM 1125 ND2 ASN A 614 -11.000 -20.090 18.120 1.00 42.43 N ATOM 0 H ASN A 614 -12.503 -23.228 17.645 1.00 75.32 H new ATOM 0 HA ASN A 614 -14.517 -21.702 18.931 1.00 61.52 H new ATOM 0 HB2 ASN A 614 -12.648 -21.172 16.585 1.00 70.42 H new ATOM 0 HB3 ASN A 614 -13.760 -19.960 17.191 1.00 70.42 H new ATOM 0 HD21 ASN A 614 -10.265 -19.826 18.776 1.00 42.43 H new ATOM 0 HD22 ASN A 614 -10.824 -20.056 17.116 1.00 42.43 H new ATOM 1132 N CYS A 615 -15.049 -22.882 15.914 1.00 41.22 N ATOM 1133 CA CYS A 615 -16.043 -23.081 14.873 1.00 41.13 C ATOM 1134 C CYS A 615 -16.243 -24.586 14.681 1.00 14.54 C ATOM 1135 O CYS A 615 -17.254 -25.140 15.110 1.00 20.23 O ATOM 1136 CB CYS A 615 -15.643 -22.388 13.569 1.00 43.04 C ATOM 1137 SG CYS A 615 -14.547 -20.937 13.776 1.00 63.25 S ATOM 0 H CYS A 615 -14.193 -23.424 15.795 1.00 41.22 H new ATOM 0 HA CYS A 615 -16.986 -22.626 15.175 1.00 41.13 H new ATOM 0 HB2 CYS A 615 -15.144 -23.114 12.926 1.00 43.04 H new ATOM 0 HB3 CYS A 615 -16.548 -22.071 13.050 1.00 43.04 H new ATOM 1142 N GLY A 616 -15.264 -25.203 14.037 1.00 75.41 N ATOM 1143 CA GLY A 616 -15.321 -26.633 13.783 1.00 23.05 C ATOM 1144 C GLY A 616 -14.599 -26.988 12.482 1.00 61.10 C ATOM 1145 O GLY A 616 -14.240 -28.144 12.263 1.00 42.15 O ATOM 0 H GLY A 616 -14.427 -24.740 13.683 1.00 75.41 H new ATOM 0 HA2 GLY A 616 -14.866 -27.172 14.614 1.00 23.05 H new ATOM 0 HA3 GLY A 616 -16.361 -26.955 13.725 1.00 23.05 H new ATOM 1149 N GLU A 617 -14.408 -25.973 11.653 1.00 42.43 N ATOM 1150 CA GLU A 617 -13.735 -26.163 10.379 1.00 73.02 C ATOM 1151 C GLU A 617 -12.516 -27.071 10.553 1.00 41.52 C ATOM 1152 O GLU A 617 -11.473 -26.630 11.033 1.00 0.53 O ATOM 1153 CB GLU A 617 -13.336 -24.820 9.763 1.00 32.44 C ATOM 1154 CG GLU A 617 -12.886 -24.995 8.312 1.00 44.23 C ATOM 1155 CD GLU A 617 -14.087 -25.033 7.366 1.00 73.55 C ATOM 1156 OE1 GLU A 617 -13.910 -25.101 6.140 1.00 3.12 O ATOM 1157 OE2 GLU A 617 -15.239 -24.992 7.945 1.00 31.00 O ATOM 0 H GLU A 617 -14.708 -25.016 11.838 1.00 42.43 H new ATOM 0 HA GLU A 617 -14.429 -26.647 9.692 1.00 73.02 H new ATOM 0 HB2 GLU A 617 -14.180 -24.131 9.805 1.00 32.44 H new ATOM 0 HB3 GLU A 617 -12.531 -24.373 10.346 1.00 32.44 H new ATOM 0 HG2 GLU A 617 -12.224 -24.176 8.032 1.00 44.23 H new ATOM 0 HG3 GLU A 617 -12.312 -25.917 8.214 1.00 44.23 H new ATOM 1165 N VAL A 618 -12.687 -28.322 10.152 1.00 13.24 N ATOM 1166 CA VAL A 618 -11.614 -29.295 10.258 1.00 23.20 C ATOM 1167 C VAL A 618 -10.335 -28.705 9.660 1.00 52.21 C ATOM 1168 O VAL A 618 -10.255 -28.485 8.452 1.00 4.13 O ATOM 1169 CB VAL A 618 -12.032 -30.610 9.596 1.00 40.41 C ATOM 1170 CG1 VAL A 618 -10.879 -31.615 9.596 1.00 3.12 C ATOM 1171 CG2 VAL A 618 -13.271 -31.196 10.276 1.00 41.02 C ATOM 0 H VAL A 618 -13.553 -28.684 9.753 1.00 13.24 H new ATOM 0 HA VAL A 618 -11.409 -29.524 11.304 1.00 23.20 H new ATOM 0 HB VAL A 618 -12.289 -30.396 8.559 1.00 40.41 H new ATOM 0 HG11 VAL A 618 -11.203 -32.540 9.120 1.00 3.12 H new ATOM 0 HG12 VAL A 618 -10.035 -31.200 9.046 1.00 3.12 H new ATOM 0 HG13 VAL A 618 -10.577 -31.822 10.623 1.00 3.12 H new ATOM 0 HG21 VAL A 618 -13.547 -32.130 9.787 1.00 41.02 H new ATOM 0 HG22 VAL A 618 -13.053 -31.388 11.327 1.00 41.02 H new ATOM 0 HG23 VAL A 618 -14.097 -30.489 10.200 1.00 41.02 H new ATOM 1181 N TRP A 619 -9.368 -28.465 10.533 1.00 44.05 N ATOM 1182 CA TRP A 619 -8.097 -27.904 10.106 1.00 62.34 C ATOM 1183 C TRP A 619 -7.365 -28.966 9.282 1.00 43.30 C ATOM 1184 O TRP A 619 -6.967 -28.710 8.146 1.00 34.23 O ATOM 1185 CB TRP A 619 -7.284 -27.413 11.305 1.00 51.51 C ATOM 1186 CG TRP A 619 -7.785 -26.094 11.897 1.00 1.15 C ATOM 1187 CD1 TRP A 619 -8.519 -25.146 11.298 1.00 4.03 C ATOM 1188 CD2 TRP A 619 -7.558 -25.613 13.239 1.00 4.21 C ATOM 1189 NE1 TRP A 619 -8.780 -24.093 12.152 1.00 63.41 N ATOM 1190 CE2 TRP A 619 -8.177 -24.387 13.370 1.00 42.54 C ATOM 1191 CE3 TRP A 619 -6.852 -26.195 14.307 1.00 13.10 C ATOM 1192 CZ2 TRP A 619 -8.153 -23.638 14.552 1.00 1.33 C ATOM 1193 CZ3 TRP A 619 -6.838 -25.434 15.482 1.00 2.21 C ATOM 1194 CH2 TRP A 619 -7.456 -24.198 15.630 1.00 40.34 C ATOM 0 H TRP A 619 -9.439 -28.649 11.534 1.00 44.05 H new ATOM 0 HA TRP A 619 -8.254 -27.025 9.481 1.00 62.34 H new ATOM 0 HB2 TRP A 619 -7.302 -28.178 12.081 1.00 51.51 H new ATOM 0 HB3 TRP A 619 -6.244 -27.292 11.001 1.00 51.51 H new ATOM 0 HD1 TRP A 619 -8.863 -25.199 10.276 1.00 4.03 H new ATOM 0 HE1 TRP A 619 -9.316 -23.254 11.930 1.00 63.41 H new ATOM 0 HE3 TRP A 619 -6.360 -27.153 14.227 1.00 13.10 H new ATOM 0 HZ2 TRP A 619 -8.645 -22.680 14.629 1.00 1.33 H new ATOM 0 HZ3 TRP A 619 -6.310 -25.836 16.334 1.00 2.21 H new ATOM 0 HH2 TRP A 619 -7.399 -23.672 16.572 1.00 40.34 H new ATOM 1205 N GLY A 620 -7.208 -30.134 9.887 1.00 74.24 N ATOM 1206 CA GLY A 620 -6.531 -31.235 9.223 1.00 20.33 C ATOM 1207 C GLY A 620 -6.486 -32.473 10.122 1.00 54.20 C ATOM 1208 O GLY A 620 -7.485 -33.176 10.266 1.00 33.01 O ATOM 0 H GLY A 620 -7.538 -30.342 10.830 1.00 74.24 H new ATOM 0 HA2 GLY A 620 -7.046 -31.475 8.293 1.00 20.33 H new ATOM 0 HA3 GLY A 620 -5.517 -30.936 8.958 1.00 20.33 H new ATOM 1212 N LEU A 621 -5.318 -32.701 10.703 1.00 22.01 N ATOM 1213 CA LEU A 621 -5.130 -33.841 11.584 1.00 60.42 C ATOM 1214 C LEU A 621 -3.863 -33.634 12.416 1.00 20.21 C ATOM 1215 O LEU A 621 -2.950 -32.924 11.997 1.00 21.51 O ATOM 1216 CB LEU A 621 -5.133 -35.144 10.781 1.00 25.25 C ATOM 1217 CG LEU A 621 -3.766 -35.644 10.309 1.00 4.32 C ATOM 1218 CD1 LEU A 621 -3.058 -34.585 9.461 1.00 21.04 C ATOM 1219 CD2 LEU A 621 -2.909 -36.097 11.493 1.00 44.11 C ATOM 0 H LEU A 621 -4.492 -32.116 10.581 1.00 22.01 H new ATOM 0 HA LEU A 621 -5.961 -33.923 12.284 1.00 60.42 H new ATOM 0 HB2 LEU A 621 -5.592 -35.922 11.391 1.00 25.25 H new ATOM 0 HB3 LEU A 621 -5.770 -35.007 9.907 1.00 25.25 H new ATOM 0 HG LEU A 621 -3.922 -36.515 9.673 1.00 4.32 H new ATOM 0 HD11 LEU A 621 -2.089 -34.966 9.138 1.00 21.04 H new ATOM 0 HD12 LEU A 621 -3.666 -34.353 8.587 1.00 21.04 H new ATOM 0 HD13 LEU A 621 -2.914 -33.681 10.053 1.00 21.04 H new ATOM 0 HD21 LEU A 621 -1.943 -36.448 11.130 1.00 44.11 H new ATOM 0 HD22 LEU A 621 -2.758 -35.260 12.175 1.00 44.11 H new ATOM 0 HD23 LEU A 621 -3.414 -36.907 12.019 1.00 44.11 H new ATOM 1231 N GLN A 622 -3.848 -34.267 13.580 1.00 11.22 N ATOM 1232 CA GLN A 622 -2.708 -34.161 14.475 1.00 12.30 C ATOM 1233 C GLN A 622 -1.643 -35.194 14.103 1.00 71.13 C ATOM 1234 O GLN A 622 -1.956 -36.365 13.894 1.00 24.31 O ATOM 1235 CB GLN A 622 -3.140 -34.320 15.934 1.00 0.21 C ATOM 1236 CG GLN A 622 -2.491 -33.252 16.817 1.00 33.14 C ATOM 1237 CD GLN A 622 -2.265 -33.778 18.236 1.00 4.13 C ATOM 1238 OE1 GLN A 622 -1.208 -33.618 18.824 1.00 45.41 O ATOM 1239 NE2 GLN A 622 -3.313 -34.413 18.752 1.00 53.11 N ATOM 0 H GLN A 622 -4.607 -34.855 13.924 1.00 11.22 H new ATOM 0 HA GLN A 622 -2.276 -33.167 14.365 1.00 12.30 H new ATOM 0 HB2 GLN A 622 -4.225 -34.246 16.006 1.00 0.21 H new ATOM 0 HB3 GLN A 622 -2.863 -35.311 16.293 1.00 0.21 H new ATOM 0 HG2 GLN A 622 -1.539 -32.945 16.383 1.00 33.14 H new ATOM 0 HG3 GLN A 622 -3.126 -32.367 16.850 1.00 33.14 H new ATOM 0 HE21 GLN A 622 -4.169 -34.512 18.206 1.00 53.11 H new ATOM 0 HE22 GLN A 622 -3.261 -34.801 19.694 1.00 53.11 H new ATOM 1248 N MET A 623 -0.407 -34.723 14.031 1.00 41.05 N ATOM 1249 CA MET A 623 0.706 -35.592 13.687 1.00 42.51 C ATOM 1250 C MET A 623 1.793 -35.542 14.763 1.00 50.32 C ATOM 1251 O MET A 623 1.977 -34.517 15.418 1.00 53.24 O ATOM 1252 CB MET A 623 1.297 -35.158 12.344 1.00 52.31 C ATOM 1253 CG MET A 623 0.605 -35.875 11.183 1.00 31.52 C ATOM 1254 SD MET A 623 1.452 -37.404 10.818 1.00 1.45 S ATOM 1255 CE MET A 623 0.451 -37.998 9.466 1.00 73.13 C ATOM 0 H MET A 623 -0.151 -33.751 14.205 1.00 41.05 H new ATOM 0 HA MET A 623 0.336 -36.615 13.618 1.00 42.51 H new ATOM 0 HB2 MET A 623 1.189 -34.080 12.226 1.00 52.31 H new ATOM 0 HB3 MET A 623 2.365 -35.375 12.325 1.00 52.31 H new ATOM 0 HG2 MET A 623 -0.435 -36.078 11.438 1.00 31.52 H new ATOM 0 HG3 MET A 623 0.598 -35.234 10.301 1.00 31.52 H new ATOM 0 HE1 MET A 623 0.844 -38.952 9.114 1.00 73.13 H new ATOM 0 HE2 MET A 623 -0.576 -38.131 9.805 1.00 73.13 H new ATOM 0 HE3 MET A 623 0.473 -37.274 8.651 1.00 73.13 H new ATOM 1265 N ILE A 624 2.485 -36.662 14.912 1.00 40.42 N ATOM 1266 CA ILE A 624 3.549 -36.759 15.897 1.00 53.40 C ATOM 1267 C ILE A 624 4.869 -37.064 15.187 1.00 21.30 C ATOM 1268 O ILE A 624 4.930 -37.950 14.336 1.00 72.12 O ATOM 1269 CB ILE A 624 3.184 -37.775 16.981 1.00 11.52 C ATOM 1270 CG1 ILE A 624 1.837 -37.433 17.622 1.00 2.30 C ATOM 1271 CG2 ILE A 624 4.300 -37.891 18.021 1.00 62.50 C ATOM 1272 CD1 ILE A 624 0.678 -37.809 16.697 1.00 63.33 C ATOM 0 H ILE A 624 2.330 -37.510 14.367 1.00 40.42 H new ATOM 0 HA ILE A 624 3.678 -35.808 16.414 1.00 53.40 H new ATOM 0 HB ILE A 624 3.078 -38.753 16.511 1.00 11.52 H new ATOM 0 HG12 ILE A 624 1.737 -37.962 18.570 1.00 2.30 H new ATOM 0 HG13 ILE A 624 1.797 -36.367 17.846 1.00 2.30 H new ATOM 0 HG21 ILE A 624 4.016 -38.619 18.780 1.00 62.50 H new ATOM 0 HG22 ILE A 624 5.219 -38.215 17.533 1.00 62.50 H new ATOM 0 HG23 ILE A 624 4.461 -36.921 18.491 1.00 62.50 H new ATOM 0 HD11 ILE A 624 -0.267 -37.555 17.177 1.00 63.33 H new ATOM 0 HD12 ILE A 624 0.768 -37.260 15.760 1.00 63.33 H new ATOM 0 HD13 ILE A 624 0.707 -38.880 16.495 1.00 63.33 H new ATOM 1284 N TYR A 625 5.894 -36.314 15.563 1.00 0.25 N ATOM 1285 CA TYR A 625 7.210 -36.493 14.973 1.00 33.44 C ATOM 1286 C TYR A 625 8.299 -36.474 16.047 1.00 25.43 C ATOM 1287 O TYR A 625 8.398 -35.523 16.820 1.00 12.41 O ATOM 1288 CB TYR A 625 7.416 -35.304 14.033 1.00 21.32 C ATOM 1289 CG TYR A 625 8.885 -34.964 13.774 1.00 51.22 C ATOM 1290 CD1 TYR A 625 9.767 -35.956 13.397 1.00 42.02 C ATOM 1291 CD2 TYR A 625 9.328 -33.665 13.917 1.00 53.52 C ATOM 1292 CE1 TYR A 625 11.150 -35.635 13.153 1.00 73.54 C ATOM 1293 CE2 TYR A 625 10.710 -33.344 13.673 1.00 62.04 C ATOM 1294 CZ TYR A 625 11.553 -34.345 13.303 1.00 71.35 C ATOM 1295 OH TYR A 625 12.859 -34.043 13.072 1.00 54.41 O ATOM 0 H TYR A 625 5.840 -35.580 16.270 1.00 0.25 H new ATOM 0 HA TYR A 625 7.272 -37.450 14.455 1.00 33.44 H new ATOM 0 HB2 TYR A 625 6.930 -35.518 13.081 1.00 21.32 H new ATOM 0 HB3 TYR A 625 6.920 -34.430 14.455 1.00 21.32 H new ATOM 0 HD1 TYR A 625 9.421 -36.973 13.285 1.00 42.02 H new ATOM 0 HD2 TYR A 625 8.638 -32.889 14.212 1.00 53.52 H new ATOM 0 HE1 TYR A 625 11.851 -36.402 12.858 1.00 73.54 H new ATOM 0 HE2 TYR A 625 11.069 -32.331 13.781 1.00 62.04 H new ATOM 0 HH TYR A 625 13.004 -33.085 13.216 1.00 54.41 H new ATOM 1305 N LYS A 626 9.091 -37.537 16.061 1.00 73.00 N ATOM 1306 CA LYS A 626 10.170 -37.654 17.027 1.00 34.42 C ATOM 1307 C LYS A 626 9.600 -37.515 18.440 1.00 2.44 C ATOM 1308 O LYS A 626 10.335 -37.229 19.384 1.00 4.22 O ATOM 1309 CB LYS A 626 11.283 -36.654 16.711 1.00 1.21 C ATOM 1310 CG LYS A 626 12.314 -37.264 15.760 1.00 45.13 C ATOM 1311 CD LYS A 626 13.434 -37.959 16.537 1.00 33.42 C ATOM 1312 CE LYS A 626 12.862 -38.841 17.650 1.00 44.14 C ATOM 1313 NZ LYS A 626 13.950 -39.361 18.509 1.00 53.23 N ATOM 0 H LYS A 626 9.007 -38.325 15.419 1.00 73.00 H new ATOM 0 HA LYS A 626 10.632 -38.639 16.965 1.00 34.42 H new ATOM 0 HB2 LYS A 626 10.855 -35.758 16.262 1.00 1.21 H new ATOM 0 HB3 LYS A 626 11.773 -36.346 17.635 1.00 1.21 H new ATOM 0 HG2 LYS A 626 11.826 -37.981 15.100 1.00 45.13 H new ATOM 0 HG3 LYS A 626 12.736 -36.484 15.127 1.00 45.13 H new ATOM 0 HD2 LYS A 626 14.031 -38.567 15.857 1.00 33.42 H new ATOM 0 HD3 LYS A 626 14.102 -37.212 16.966 1.00 33.42 H new ATOM 0 HE2 LYS A 626 12.158 -38.266 18.252 1.00 44.14 H new ATOM 0 HE3 LYS A 626 12.306 -39.671 17.215 1.00 44.14 H new ATOM 0 HZ1 LYS A 626 13.545 -39.957 19.259 1.00 53.23 H new ATOM 0 HZ2 LYS A 626 14.607 -39.926 17.934 1.00 53.23 H new ATOM 0 HZ3 LYS A 626 14.463 -38.565 18.939 1.00 53.23 H new ATOM 1326 N SER A 627 8.296 -37.723 18.542 1.00 53.34 N ATOM 1327 CA SER A 627 7.619 -37.624 19.824 1.00 42.43 C ATOM 1328 C SER A 627 7.240 -36.168 20.104 1.00 5.03 C ATOM 1329 O SER A 627 7.334 -35.706 21.241 1.00 72.53 O ATOM 1330 CB SER A 627 8.495 -38.171 20.952 1.00 21.23 C ATOM 1331 OG SER A 627 9.309 -37.158 21.536 1.00 45.33 O ATOM 0 H SER A 627 7.689 -37.960 17.757 1.00 53.34 H new ATOM 0 HA SER A 627 6.712 -38.227 19.780 1.00 42.43 H new ATOM 0 HB2 SER A 627 7.861 -38.614 21.720 1.00 21.23 H new ATOM 0 HB3 SER A 627 9.130 -38.967 20.564 1.00 21.23 H new ATOM 0 HG SER A 627 9.758 -36.651 20.828 1.00 45.33 H new ATOM 1337 N VAL A 628 6.821 -35.485 19.049 1.00 21.22 N ATOM 1338 CA VAL A 628 6.428 -34.091 19.168 1.00 71.44 C ATOM 1339 C VAL A 628 5.024 -33.911 18.587 1.00 40.13 C ATOM 1340 O VAL A 628 4.785 -34.226 17.422 1.00 41.20 O ATOM 1341 CB VAL A 628 7.472 -33.195 18.499 1.00 54.53 C ATOM 1342 CG1 VAL A 628 6.972 -31.752 18.400 1.00 4.45 C ATOM 1343 CG2 VAL A 628 8.809 -33.263 19.239 1.00 72.10 C ATOM 0 H VAL A 628 6.745 -35.871 18.108 1.00 21.22 H new ATOM 0 HA VAL A 628 6.387 -33.793 20.216 1.00 71.44 H new ATOM 0 HB VAL A 628 7.632 -33.565 17.486 1.00 54.53 H new ATOM 0 HG11 VAL A 628 7.733 -31.135 17.921 1.00 4.45 H new ATOM 0 HG12 VAL A 628 6.057 -31.724 17.809 1.00 4.45 H new ATOM 0 HG13 VAL A 628 6.770 -31.367 19.400 1.00 4.45 H new ATOM 0 HG21 VAL A 628 9.533 -32.617 18.742 1.00 72.10 H new ATOM 0 HG22 VAL A 628 8.672 -32.931 20.268 1.00 72.10 H new ATOM 0 HG23 VAL A 628 9.176 -34.289 19.234 1.00 72.10 H new ATOM 1353 N LYS A 629 4.132 -33.405 19.425 1.00 11.43 N ATOM 1354 CA LYS A 629 2.758 -33.178 19.010 1.00 61.53 C ATOM 1355 C LYS A 629 2.711 -31.992 18.045 1.00 75.25 C ATOM 1356 O LYS A 629 2.673 -30.840 18.473 1.00 12.11 O ATOM 1357 CB LYS A 629 1.849 -33.016 20.230 1.00 41.44 C ATOM 1358 CG LYS A 629 2.199 -34.037 21.314 1.00 13.20 C ATOM 1359 CD LYS A 629 2.303 -35.446 20.727 1.00 14.01 C ATOM 1360 CE LYS A 629 0.922 -35.987 20.351 1.00 14.51 C ATOM 1361 NZ LYS A 629 -0.058 -35.694 21.421 1.00 54.42 N ATOM 0 H LYS A 629 4.334 -33.145 20.391 1.00 11.43 H new ATOM 0 HA LYS A 629 2.375 -34.044 18.470 1.00 61.53 H new ATOM 0 HB2 LYS A 629 1.948 -32.007 20.630 1.00 41.44 H new ATOM 0 HB3 LYS A 629 0.808 -33.140 19.931 1.00 41.44 H new ATOM 0 HG2 LYS A 629 3.144 -33.764 21.784 1.00 13.20 H new ATOM 0 HG3 LYS A 629 1.438 -34.020 22.094 1.00 13.20 H new ATOM 0 HD2 LYS A 629 2.944 -35.430 19.845 1.00 14.01 H new ATOM 0 HD3 LYS A 629 2.773 -36.111 21.451 1.00 14.01 H new ATOM 0 HE2 LYS A 629 0.592 -35.538 19.414 1.00 14.51 H new ATOM 0 HE3 LYS A 629 0.979 -37.063 20.186 1.00 14.51 H new ATOM 0 HZ1 LYS A 629 -0.903 -36.286 21.289 1.00 54.42 H new ATOM 0 HZ2 LYS A 629 0.368 -35.899 22.347 1.00 54.42 H new ATOM 0 HZ3 LYS A 629 -0.328 -34.691 21.379 1.00 54.42 H new ATOM 1374 N LEU A 630 2.714 -32.315 16.760 1.00 72.34 N ATOM 1375 CA LEU A 630 2.672 -31.291 15.730 1.00 14.32 C ATOM 1376 C LEU A 630 1.443 -31.513 14.846 1.00 51.31 C ATOM 1377 O LEU A 630 1.379 -32.488 14.100 1.00 73.51 O ATOM 1378 CB LEU A 630 3.990 -31.256 14.954 1.00 33.21 C ATOM 1379 CG LEU A 630 5.261 -31.131 15.796 1.00 31.14 C ATOM 1380 CD1 LEU A 630 6.502 -31.477 14.971 1.00 34.41 C ATOM 1381 CD2 LEU A 630 5.364 -29.743 16.431 1.00 53.41 C ATOM 0 H LEU A 630 2.745 -33.272 16.409 1.00 72.34 H new ATOM 0 HA LEU A 630 2.568 -30.303 16.179 1.00 14.32 H new ATOM 0 HB2 LEU A 630 4.061 -32.165 14.357 1.00 33.21 H new ATOM 0 HB3 LEU A 630 3.956 -30.419 14.257 1.00 33.21 H new ATOM 0 HG LEU A 630 5.204 -31.854 16.610 1.00 31.14 H new ATOM 0 HD11 LEU A 630 7.391 -31.380 15.594 1.00 34.41 H new ATOM 0 HD12 LEU A 630 6.423 -32.502 14.608 1.00 34.41 H new ATOM 0 HD13 LEU A 630 6.577 -30.796 14.123 1.00 34.41 H new ATOM 0 HD21 LEU A 630 6.276 -29.681 17.024 1.00 53.41 H new ATOM 0 HD22 LEU A 630 5.388 -28.985 15.648 1.00 53.41 H new ATOM 0 HD23 LEU A 630 4.501 -29.572 17.074 1.00 53.41 H new ATOM 1393 N PRO A 631 0.473 -30.567 14.962 1.00 52.42 N ATOM 1394 CA PRO A 631 -0.750 -30.649 14.182 1.00 73.41 C ATOM 1395 C PRO A 631 -0.498 -30.262 12.724 1.00 51.45 C ATOM 1396 O PRO A 631 0.456 -29.545 12.424 1.00 14.21 O ATOM 1397 CB PRO A 631 -1.728 -29.720 14.883 1.00 24.11 C ATOM 1398 CG PRO A 631 -0.881 -28.801 15.749 1.00 31.41 C ATOM 1399 CD PRO A 631 0.515 -29.397 15.835 1.00 35.41 C ATOM 0 HA PRO A 631 -1.150 -31.662 14.133 1.00 73.41 H new ATOM 0 HB2 PRO A 631 -2.310 -29.149 14.160 1.00 24.11 H new ATOM 0 HB3 PRO A 631 -2.437 -30.284 15.489 1.00 24.11 H new ATOM 0 HG2 PRO A 631 -0.843 -27.800 15.319 1.00 31.41 H new ATOM 0 HG3 PRO A 631 -1.317 -28.705 16.743 1.00 31.41 H new ATOM 0 HD2 PRO A 631 1.271 -28.684 15.506 1.00 35.41 H new ATOM 0 HD3 PRO A 631 0.764 -29.676 16.859 1.00 35.41 H new ATOM 1407 N VAL A 632 -1.370 -30.753 11.855 1.00 43.42 N ATOM 1408 CA VAL A 632 -1.254 -30.466 10.435 1.00 25.30 C ATOM 1409 C VAL A 632 -2.437 -29.602 9.995 1.00 61.21 C ATOM 1410 O VAL A 632 -3.555 -30.096 9.862 1.00 74.43 O ATOM 1411 CB VAL A 632 -1.140 -31.772 9.645 1.00 34.05 C ATOM 1412 CG1 VAL A 632 -1.145 -31.504 8.139 1.00 12.02 C ATOM 1413 CG2 VAL A 632 0.106 -32.556 10.059 1.00 64.40 C ATOM 0 H VAL A 632 -2.160 -31.348 12.107 1.00 43.42 H new ATOM 0 HA VAL A 632 -0.345 -29.899 10.233 1.00 25.30 H new ATOM 0 HB VAL A 632 -2.012 -32.382 9.879 1.00 34.05 H new ATOM 0 HG11 VAL A 632 -1.063 -32.448 7.601 1.00 12.02 H new ATOM 0 HG12 VAL A 632 -2.075 -31.008 7.861 1.00 12.02 H new ATOM 0 HG13 VAL A 632 -0.301 -30.865 7.880 1.00 12.02 H new ATOM 0 HG21 VAL A 632 0.163 -33.479 9.483 1.00 64.40 H new ATOM 0 HG22 VAL A 632 0.995 -31.954 9.869 1.00 64.40 H new ATOM 0 HG23 VAL A 632 0.050 -32.794 11.121 1.00 64.40 H new ATOM 1423 N LEU A 633 -2.150 -28.326 9.781 1.00 21.53 N ATOM 1424 CA LEU A 633 -3.176 -27.389 9.359 1.00 55.10 C ATOM 1425 C LEU A 633 -2.927 -26.987 7.904 1.00 63.10 C ATOM 1426 O LEU A 633 -1.892 -27.327 7.331 1.00 14.33 O ATOM 1427 CB LEU A 633 -3.247 -26.202 10.321 1.00 5.35 C ATOM 1428 CG LEU A 633 -2.879 -26.496 11.777 1.00 2.13 C ATOM 1429 CD1 LEU A 633 -3.488 -25.455 12.718 1.00 54.41 C ATOM 1430 CD2 LEU A 633 -3.276 -27.921 12.166 1.00 61.43 C ATOM 0 H LEU A 633 -1.221 -27.920 9.892 1.00 21.53 H new ATOM 0 HA LEU A 633 -4.159 -27.859 9.397 1.00 55.10 H new ATOM 0 HB2 LEU A 633 -2.585 -25.419 9.951 1.00 5.35 H new ATOM 0 HB3 LEU A 633 -4.260 -25.800 10.297 1.00 5.35 H new ATOM 0 HG LEU A 633 -1.796 -26.425 11.876 1.00 2.13 H new ATOM 0 HD11 LEU A 633 -3.211 -25.688 13.746 1.00 54.41 H new ATOM 0 HD12 LEU A 633 -3.114 -24.465 12.457 1.00 54.41 H new ATOM 0 HD13 LEU A 633 -4.574 -25.469 12.623 1.00 54.41 H new ATOM 0 HD21 LEU A 633 -3.003 -28.104 13.205 1.00 61.43 H new ATOM 0 HD22 LEU A 633 -4.352 -28.044 12.046 1.00 61.43 H new ATOM 0 HD23 LEU A 633 -2.756 -28.632 11.524 1.00 61.43 H new ATOM 1442 N LYS A 634 -3.892 -26.270 7.348 1.00 44.43 N ATOM 1443 CA LYS A 634 -3.789 -25.818 5.970 1.00 13.14 C ATOM 1444 C LYS A 634 -3.656 -24.294 5.947 1.00 44.14 C ATOM 1445 O LYS A 634 -3.614 -23.654 6.997 1.00 73.45 O ATOM 1446 CB LYS A 634 -4.965 -26.345 5.145 1.00 63.01 C ATOM 1447 CG LYS A 634 -6.129 -26.755 6.049 1.00 53.23 C ATOM 1448 CD LYS A 634 -7.214 -27.480 5.250 1.00 14.10 C ATOM 1449 CE LYS A 634 -8.168 -26.482 4.589 1.00 23.23 C ATOM 1450 NZ LYS A 634 -9.573 -26.817 4.911 1.00 0.04 N ATOM 0 H LYS A 634 -4.749 -25.991 7.826 1.00 44.43 H new ATOM 0 HA LYS A 634 -2.893 -26.224 5.501 1.00 13.14 H new ATOM 0 HB2 LYS A 634 -5.296 -25.577 4.446 1.00 63.01 H new ATOM 0 HB3 LYS A 634 -4.643 -27.200 4.551 1.00 63.01 H new ATOM 0 HG2 LYS A 634 -5.765 -27.403 6.846 1.00 53.23 H new ATOM 0 HG3 LYS A 634 -6.553 -25.871 6.526 1.00 53.23 H new ATOM 0 HD2 LYS A 634 -6.752 -28.106 4.487 1.00 14.10 H new ATOM 0 HD3 LYS A 634 -7.775 -28.142 5.909 1.00 14.10 H new ATOM 0 HE2 LYS A 634 -7.941 -25.472 4.931 1.00 23.23 H new ATOM 0 HE3 LYS A 634 -8.024 -26.493 3.509 1.00 23.23 H new ATOM 0 HZ1 LYS A 634 -10.171 -26.644 4.078 1.00 0.04 H new ATOM 0 HZ2 LYS A 634 -9.638 -27.819 5.182 1.00 0.04 H new ATOM 0 HZ3 LYS A 634 -9.899 -26.224 5.700 1.00 0.04 H new ATOM 1463 N VAL A 635 -3.592 -23.756 4.737 1.00 24.24 N ATOM 1464 CA VAL A 635 -3.463 -22.319 4.563 1.00 34.41 C ATOM 1465 C VAL A 635 -4.789 -21.752 4.051 1.00 2.12 C ATOM 1466 O VAL A 635 -4.881 -20.565 3.740 1.00 34.34 O ATOM 1467 CB VAL A 635 -2.283 -22.007 3.640 1.00 34.45 C ATOM 1468 CG1 VAL A 635 -2.633 -22.311 2.182 1.00 3.41 C ATOM 1469 CG2 VAL A 635 -1.828 -20.556 3.805 1.00 24.20 C ATOM 0 H VAL A 635 -3.627 -24.289 3.868 1.00 24.24 H new ATOM 0 HA VAL A 635 -3.248 -21.836 5.516 1.00 34.41 H new ATOM 0 HB VAL A 635 -1.453 -22.653 3.926 1.00 34.45 H new ATOM 0 HG11 VAL A 635 -1.778 -22.081 1.547 1.00 3.41 H new ATOM 0 HG12 VAL A 635 -2.886 -23.366 2.081 1.00 3.41 H new ATOM 0 HG13 VAL A 635 -3.485 -21.703 1.878 1.00 3.41 H new ATOM 0 HG21 VAL A 635 -0.988 -20.360 3.138 1.00 24.20 H new ATOM 0 HG22 VAL A 635 -2.652 -19.886 3.558 1.00 24.20 H new ATOM 0 HG23 VAL A 635 -1.519 -20.387 4.837 1.00 24.20 H new ATOM 1479 N ARG A 636 -5.782 -22.626 3.979 1.00 23.13 N ATOM 1480 CA ARG A 636 -7.098 -22.227 3.510 1.00 1.04 C ATOM 1481 C ARG A 636 -8.109 -22.281 4.657 1.00 30.44 C ATOM 1482 O ARG A 636 -9.292 -22.009 4.460 1.00 11.21 O ATOM 1483 CB ARG A 636 -7.576 -23.134 2.375 1.00 52.44 C ATOM 1484 CG ARG A 636 -6.816 -24.461 2.376 1.00 62.34 C ATOM 1485 CD ARG A 636 -7.424 -25.442 1.371 1.00 32.45 C ATOM 1486 NE ARG A 636 -6.567 -26.643 1.254 1.00 33.34 N ATOM 1487 CZ ARG A 636 -6.871 -27.719 0.497 1.00 0.12 C ATOM 1488 NH1 ARG A 636 -8.016 -27.752 -0.218 1.00 23.54 N ATOM 1489 NH2 ARG A 636 -6.032 -28.737 0.466 1.00 21.55 N ATOM 0 H ARG A 636 -5.702 -23.609 4.238 1.00 23.13 H new ATOM 0 HA ARG A 636 -7.022 -21.206 3.136 1.00 1.04 H new ATOM 0 HB2 ARG A 636 -8.644 -23.323 2.481 1.00 52.44 H new ATOM 0 HB3 ARG A 636 -7.435 -22.631 1.419 1.00 52.44 H new ATOM 0 HG2 ARG A 636 -5.769 -24.285 2.130 1.00 62.34 H new ATOM 0 HG3 ARG A 636 -6.839 -24.897 3.375 1.00 62.34 H new ATOM 0 HD2 ARG A 636 -8.425 -25.730 1.691 1.00 32.45 H new ATOM 0 HD3 ARG A 636 -7.526 -24.962 0.398 1.00 32.45 H new ATOM 0 HE ARG A 636 -5.692 -26.659 1.778 1.00 33.34 H new ATOM 0 HH11 ARG A 636 -8.659 -26.960 -0.189 1.00 23.54 H new ATOM 0 HH12 ARG A 636 -8.238 -28.569 -0.787 1.00 23.54 H new ATOM 0 HH21 ARG A 636 -5.169 -28.703 1.009 1.00 21.55 H new ATOM 0 HH22 ARG A 636 -6.246 -29.558 -0.101 1.00 21.55 H new ATOM 1502 N SER A 637 -7.606 -22.635 5.831 1.00 71.20 N ATOM 1503 CA SER A 637 -8.451 -22.729 7.010 1.00 43.24 C ATOM 1504 C SER A 637 -7.949 -21.769 8.091 1.00 64.53 C ATOM 1505 O SER A 637 -8.575 -21.628 9.140 1.00 61.21 O ATOM 1506 CB SER A 637 -8.489 -24.161 7.547 1.00 14.31 C ATOM 1507 OG SER A 637 -9.195 -25.039 6.675 1.00 62.43 O ATOM 0 H SER A 637 -6.624 -22.860 5.991 1.00 71.20 H new ATOM 0 HA SER A 637 -9.466 -22.449 6.727 1.00 43.24 H new ATOM 0 HB2 SER A 637 -7.470 -24.525 7.681 1.00 14.31 H new ATOM 0 HB3 SER A 637 -8.962 -24.168 8.529 1.00 14.31 H new ATOM 0 HG SER A 637 -10.103 -25.178 7.016 1.00 62.43 H new ATOM 1513 N MET A 638 -6.823 -21.135 7.797 1.00 12.13 N ATOM 1514 CA MET A 638 -6.230 -20.193 8.731 1.00 2.00 C ATOM 1515 C MET A 638 -6.247 -18.773 8.163 1.00 55.53 C ATOM 1516 O MET A 638 -6.158 -18.584 6.950 1.00 0.05 O ATOM 1517 CB MET A 638 -4.787 -20.607 9.026 1.00 2.02 C ATOM 1518 CG MET A 638 -4.743 -21.906 9.833 1.00 33.22 C ATOM 1519 SD MET A 638 -5.150 -21.579 11.540 1.00 52.30 S ATOM 1520 CE MET A 638 -6.696 -22.462 11.665 1.00 14.21 C ATOM 0 H MET A 638 -6.306 -21.255 6.926 1.00 12.13 H new ATOM 0 HA MET A 638 -6.816 -20.204 9.650 1.00 2.00 H new ATOM 0 HB2 MET A 638 -4.244 -20.738 8.090 1.00 2.02 H new ATOM 0 HB3 MET A 638 -4.283 -19.814 9.579 1.00 2.02 H new ATOM 0 HG2 MET A 638 -5.445 -22.627 9.415 1.00 33.22 H new ATOM 0 HG3 MET A 638 -3.751 -22.352 9.766 1.00 33.22 H new ATOM 0 HE1 MET A 638 -7.355 -21.945 12.362 1.00 14.21 H new ATOM 0 HE2 MET A 638 -7.169 -22.508 10.684 1.00 14.21 H new ATOM 0 HE3 MET A 638 -6.509 -23.474 12.025 1.00 14.21 H new ATOM 1530 N LEU A 639 -6.364 -17.810 9.065 1.00 5.34 N ATOM 1531 CA LEU A 639 -6.394 -16.412 8.669 1.00 31.01 C ATOM 1532 C LEU A 639 -5.147 -15.707 9.207 1.00 55.41 C ATOM 1533 O LEU A 639 -4.829 -15.817 10.390 1.00 52.21 O ATOM 1534 CB LEU A 639 -7.707 -15.760 9.107 1.00 40.42 C ATOM 1535 CG LEU A 639 -8.012 -14.391 8.495 1.00 14.10 C ATOM 1536 CD1 LEU A 639 -7.523 -14.316 7.047 1.00 1.25 C ATOM 1537 CD2 LEU A 639 -9.501 -14.057 8.615 1.00 44.51 C ATOM 0 H LEU A 639 -6.439 -17.970 10.070 1.00 5.34 H new ATOM 0 HA LEU A 639 -6.367 -16.322 7.583 1.00 31.01 H new ATOM 0 HB2 LEU A 639 -8.526 -16.437 8.861 1.00 40.42 H new ATOM 0 HB3 LEU A 639 -7.694 -15.656 10.192 1.00 40.42 H new ATOM 0 HG LEU A 639 -7.465 -13.635 9.059 1.00 14.10 H new ATOM 0 HD11 LEU A 639 -7.752 -13.333 6.636 1.00 1.25 H new ATOM 0 HD12 LEU A 639 -6.446 -14.479 7.018 1.00 1.25 H new ATOM 0 HD13 LEU A 639 -8.022 -15.082 6.454 1.00 1.25 H new ATOM 0 HD21 LEU A 639 -9.691 -13.079 8.173 1.00 44.51 H new ATOM 0 HD22 LEU A 639 -10.087 -14.812 8.091 1.00 44.51 H new ATOM 0 HD23 LEU A 639 -9.787 -14.041 9.667 1.00 44.51 H new ATOM 1549 N LEU A 640 -4.476 -14.997 8.312 1.00 64.41 N ATOM 1550 CA LEU A 640 -3.271 -14.274 8.682 1.00 42.03 C ATOM 1551 C LEU A 640 -3.615 -12.801 8.909 1.00 53.32 C ATOM 1552 O LEU A 640 -3.742 -12.035 7.955 1.00 41.14 O ATOM 1553 CB LEU A 640 -2.172 -14.495 7.640 1.00 31.22 C ATOM 1554 CG LEU A 640 -1.971 -15.938 7.173 1.00 34.31 C ATOM 1555 CD1 LEU A 640 -1.128 -15.990 5.898 1.00 41.52 C ATOM 1556 CD2 LEU A 640 -1.375 -16.798 8.290 1.00 72.05 C ATOM 0 H LEU A 640 -4.744 -14.907 7.332 1.00 64.41 H new ATOM 0 HA LEU A 640 -2.870 -14.657 9.621 1.00 42.03 H new ATOM 0 HB2 LEU A 640 -2.396 -13.880 6.768 1.00 31.22 H new ATOM 0 HB3 LEU A 640 -1.230 -14.133 8.052 1.00 31.22 H new ATOM 0 HG LEU A 640 -2.947 -16.357 6.930 1.00 34.31 H new ATOM 0 HD11 LEU A 640 -1.001 -17.027 5.588 1.00 41.52 H new ATOM 0 HD12 LEU A 640 -1.631 -15.434 5.107 1.00 41.52 H new ATOM 0 HD13 LEU A 640 -0.151 -15.546 6.089 1.00 41.52 H new ATOM 0 HD21 LEU A 640 -1.242 -17.819 7.932 1.00 72.05 H new ATOM 0 HD22 LEU A 640 -0.409 -16.390 8.588 1.00 72.05 H new ATOM 0 HD23 LEU A 640 -2.048 -16.799 9.147 1.00 72.05 H new ATOM 1568 N GLU A 641 -3.757 -12.448 10.178 1.00 33.10 N ATOM 1569 CA GLU A 641 -4.085 -11.080 10.543 1.00 64.14 C ATOM 1570 C GLU A 641 -2.866 -10.174 10.353 1.00 32.34 C ATOM 1571 O GLU A 641 -1.823 -10.394 10.968 1.00 74.24 O ATOM 1572 CB GLU A 641 -4.606 -11.005 11.979 1.00 24.21 C ATOM 1573 CG GLU A 641 -6.113 -10.744 12.003 1.00 70.22 C ATOM 1574 CD GLU A 641 -6.658 -10.809 13.431 1.00 53.41 C ATOM 1575 OE1 GLU A 641 -7.874 -10.959 13.624 1.00 22.13 O ATOM 1576 OE2 GLU A 641 -5.770 -10.697 14.359 1.00 24.13 O ATOM 0 H GLU A 641 -3.651 -13.086 10.967 1.00 33.10 H new ATOM 0 HA GLU A 641 -4.880 -10.729 9.885 1.00 64.14 H new ATOM 0 HB2 GLU A 641 -4.387 -11.938 12.498 1.00 24.21 H new ATOM 0 HB3 GLU A 641 -4.087 -10.211 12.517 1.00 24.21 H new ATOM 0 HG2 GLU A 641 -6.323 -9.764 11.574 1.00 70.22 H new ATOM 0 HG3 GLU A 641 -6.623 -11.480 11.381 1.00 70.22 H new ATOM 1584 N THR A 642 -3.038 -9.175 9.501 1.00 54.22 N ATOM 1585 CA THR A 642 -1.966 -8.235 9.223 1.00 2.21 C ATOM 1586 C THR A 642 -2.460 -6.797 9.391 1.00 12.33 C ATOM 1587 O THR A 642 -3.663 -6.542 9.357 1.00 41.10 O ATOM 1588 CB THR A 642 -1.427 -8.532 7.822 1.00 34.32 C ATOM 1589 OG1 THR A 642 -2.102 -7.597 6.985 1.00 34.31 O ATOM 1590 CG2 THR A 642 -1.881 -9.896 7.298 1.00 24.52 C ATOM 0 H THR A 642 -3.904 -8.996 8.993 1.00 54.22 H new ATOM 0 HA THR A 642 -1.147 -8.349 9.933 1.00 2.21 H new ATOM 0 HB THR A 642 -0.338 -8.492 7.836 1.00 34.32 H new ATOM 0 HG1 THR A 642 -2.865 -8.035 6.554 1.00 34.31 H new ATOM 0 HG21 THR A 642 -1.471 -10.057 6.301 1.00 24.52 H new ATOM 0 HG22 THR A 642 -1.526 -10.680 7.967 1.00 24.52 H new ATOM 0 HG23 THR A 642 -2.970 -9.924 7.252 1.00 24.52 H new ATOM 1598 N PRO A 643 -1.481 -5.870 9.574 1.00 35.34 N ATOM 1599 CA PRO A 643 -1.805 -4.464 9.748 1.00 23.51 C ATOM 1600 C PRO A 643 -2.208 -3.826 8.417 1.00 31.04 C ATOM 1601 O PRO A 643 -2.460 -2.624 8.353 1.00 55.12 O ATOM 1602 CB PRO A 643 -0.554 -3.845 10.349 1.00 0.45 C ATOM 1603 CG PRO A 643 0.575 -4.820 10.060 1.00 62.10 C ATOM 1604 CD PRO A 643 -0.047 -6.136 9.621 1.00 45.33 C ATOM 0 HA PRO A 643 -2.664 -4.307 10.400 1.00 23.51 H new ATOM 0 HB2 PRO A 643 -0.350 -2.870 9.907 1.00 0.45 H new ATOM 0 HB3 PRO A 643 -0.671 -3.691 11.422 1.00 0.45 H new ATOM 0 HG2 PRO A 643 1.228 -4.428 9.281 1.00 62.10 H new ATOM 0 HG3 PRO A 643 1.190 -4.966 10.948 1.00 62.10 H new ATOM 0 HD2 PRO A 643 0.330 -6.447 8.647 1.00 45.33 H new ATOM 0 HD3 PRO A 643 0.184 -6.937 10.323 1.00 45.33 H new ATOM 1612 N GLN A 644 -2.256 -4.659 7.389 1.00 73.35 N ATOM 1613 CA GLN A 644 -2.625 -4.191 6.063 1.00 22.41 C ATOM 1614 C GLN A 644 -3.935 -4.843 5.615 1.00 24.13 C ATOM 1615 O GLN A 644 -4.427 -4.568 4.522 1.00 11.33 O ATOM 1616 CB GLN A 644 -1.506 -4.461 5.056 1.00 64.35 C ATOM 1617 CG GLN A 644 -0.133 -4.381 5.726 1.00 22.23 C ATOM 1618 CD GLN A 644 0.979 -4.235 4.685 1.00 54.20 C ATOM 1619 OE1 GLN A 644 1.336 -3.145 4.270 1.00 41.41 O ATOM 1620 NE2 GLN A 644 1.503 -5.391 4.287 1.00 2.55 N ATOM 0 H GLN A 644 -2.046 -5.655 7.447 1.00 73.35 H new ATOM 0 HA GLN A 644 -2.776 -3.112 6.109 1.00 22.41 H new ATOM 0 HB2 GLN A 644 -1.641 -5.448 4.613 1.00 64.35 H new ATOM 0 HB3 GLN A 644 -1.561 -3.736 4.244 1.00 64.35 H new ATOM 0 HG2 GLN A 644 -0.108 -3.534 6.411 1.00 22.23 H new ATOM 0 HG3 GLN A 644 0.037 -5.278 6.322 1.00 22.23 H new ATOM 0 HE21 GLN A 644 1.157 -6.268 4.675 1.00 2.55 H new ATOM 0 HE22 GLN A 644 2.251 -5.400 3.593 1.00 2.55 H new ATOM 1629 N GLY A 645 -4.461 -5.695 6.483 1.00 55.23 N ATOM 1630 CA GLY A 645 -5.705 -6.388 6.190 1.00 4.11 C ATOM 1631 C GLY A 645 -5.493 -7.903 6.158 1.00 52.03 C ATOM 1632 O GLY A 645 -4.587 -8.393 5.485 1.00 12.42 O ATOM 0 H GLY A 645 -4.049 -5.921 7.388 1.00 55.23 H new ATOM 0 HA2 GLY A 645 -6.452 -6.137 6.944 1.00 4.11 H new ATOM 0 HA3 GLY A 645 -6.096 -6.051 5.230 1.00 4.11 H new ATOM 1636 N ARG A 646 -6.345 -8.603 6.893 1.00 44.11 N ATOM 1637 CA ARG A 646 -6.263 -10.052 6.957 1.00 65.32 C ATOM 1638 C ARG A 646 -6.068 -10.635 5.556 1.00 60.24 C ATOM 1639 O ARG A 646 -6.638 -10.135 4.587 1.00 61.41 O ATOM 1640 CB ARG A 646 -7.527 -10.649 7.579 1.00 43.42 C ATOM 1641 CG ARG A 646 -7.370 -10.809 9.092 1.00 23.43 C ATOM 1642 CD ARG A 646 -8.702 -11.182 9.745 1.00 33.52 C ATOM 1643 NE ARG A 646 -8.901 -10.390 10.979 1.00 42.30 N ATOM 1644 CZ ARG A 646 -9.022 -9.045 11.003 1.00 34.45 C ATOM 1645 NH1 ARG A 646 -8.967 -8.331 9.859 1.00 24.41 N ATOM 1646 NH2 ARG A 646 -9.197 -8.440 12.163 1.00 4.52 N ATOM 0 H ARG A 646 -7.095 -8.193 7.449 1.00 44.11 H new ATOM 0 HA ARG A 646 -5.408 -10.308 7.583 1.00 65.32 H new ATOM 0 HB2 ARG A 646 -8.381 -10.006 7.364 1.00 43.42 H new ATOM 0 HB3 ARG A 646 -7.736 -11.619 7.127 1.00 43.42 H new ATOM 0 HG2 ARG A 646 -6.628 -11.579 9.305 1.00 23.43 H new ATOM 0 HG3 ARG A 646 -6.997 -9.880 9.523 1.00 23.43 H new ATOM 0 HD2 ARG A 646 -9.521 -10.999 9.050 1.00 33.52 H new ATOM 0 HD3 ARG A 646 -8.716 -12.246 9.980 1.00 33.52 H new ATOM 0 HE ARG A 646 -8.950 -10.891 11.866 1.00 42.30 H new ATOM 0 HH11 ARG A 646 -8.833 -8.807 8.967 1.00 24.41 H new ATOM 0 HH12 ARG A 646 -9.059 -7.316 9.887 1.00 24.41 H new ATOM 0 HH21 ARG A 646 -9.239 -8.988 13.023 1.00 4.52 H new ATOM 0 HH22 ARG A 646 -9.290 -7.425 12.200 1.00 4.52 H new ATOM 1659 N ILE A 647 -5.261 -11.684 5.493 1.00 72.24 N ATOM 1660 CA ILE A 647 -4.984 -12.341 4.226 1.00 14.51 C ATOM 1661 C ILE A 647 -5.384 -13.814 4.322 1.00 20.33 C ATOM 1662 O ILE A 647 -5.106 -14.472 5.323 1.00 23.55 O ATOM 1663 CB ILE A 647 -3.526 -12.124 3.818 1.00 62.10 C ATOM 1664 CG1 ILE A 647 -3.267 -10.658 3.463 1.00 75.51 C ATOM 1665 CG2 ILE A 647 -3.129 -13.068 2.681 1.00 2.01 C ATOM 1666 CD1 ILE A 647 -1.847 -10.243 3.849 1.00 4.14 C ATOM 0 H ILE A 647 -4.790 -12.096 6.299 1.00 72.24 H new ATOM 0 HA ILE A 647 -5.582 -11.900 3.429 1.00 14.51 H new ATOM 0 HB ILE A 647 -2.893 -12.364 4.672 1.00 62.10 H new ATOM 0 HG12 ILE A 647 -3.416 -10.507 2.394 1.00 75.51 H new ATOM 0 HG13 ILE A 647 -3.988 -10.023 3.978 1.00 75.51 H new ATOM 0 HG21 ILE A 647 -2.088 -12.893 2.410 1.00 2.01 H new ATOM 0 HG22 ILE A 647 -3.251 -14.101 3.007 1.00 2.01 H new ATOM 0 HG23 ILE A 647 -3.765 -12.883 1.816 1.00 2.01 H new ATOM 0 HD11 ILE A 647 -1.689 -9.197 3.586 1.00 4.14 H new ATOM 0 HD12 ILE A 647 -1.709 -10.372 4.923 1.00 4.14 H new ATOM 0 HD13 ILE A 647 -1.128 -10.864 3.314 1.00 4.14 H new ATOM 1678 N GLN A 648 -6.030 -14.289 3.268 1.00 72.23 N ATOM 1679 CA GLN A 648 -6.471 -15.673 3.221 1.00 62.03 C ATOM 1680 C GLN A 648 -6.120 -16.296 1.868 1.00 24.32 C ATOM 1681 O GLN A 648 -6.675 -15.912 0.840 1.00 13.35 O ATOM 1682 CB GLN A 648 -7.971 -15.781 3.501 1.00 51.42 C ATOM 1683 CG GLN A 648 -8.284 -17.018 4.344 1.00 31.22 C ATOM 1684 CD GLN A 648 -7.721 -18.283 3.693 1.00 45.44 C ATOM 1685 OE1 GLN A 648 -6.526 -18.529 3.686 1.00 45.34 O ATOM 1686 NE2 GLN A 648 -8.645 -19.068 3.147 1.00 22.11 N ATOM 0 H GLN A 648 -6.259 -13.740 2.439 1.00 72.23 H new ATOM 0 HA GLN A 648 -5.949 -16.227 4.001 1.00 62.03 H new ATOM 0 HB2 GLN A 648 -8.313 -14.886 4.021 1.00 51.42 H new ATOM 0 HB3 GLN A 648 -8.518 -15.831 2.559 1.00 51.42 H new ATOM 0 HG2 GLN A 648 -7.861 -16.899 5.341 1.00 31.22 H new ATOM 0 HG3 GLN A 648 -9.363 -17.116 4.465 1.00 31.22 H new ATOM 0 HE21 GLN A 648 -9.629 -18.802 3.188 1.00 22.11 H new ATOM 0 HE22 GLN A 648 -8.370 -19.936 2.687 1.00 22.11 H new ATOM 1695 N ALA A 649 -5.199 -17.248 1.912 1.00 31.25 N ATOM 1696 CA ALA A 649 -4.767 -17.928 0.703 1.00 32.43 C ATOM 1697 C ALA A 649 -5.243 -19.382 0.743 1.00 1.04 C ATOM 1698 O ALA A 649 -5.884 -19.803 1.705 1.00 1.22 O ATOM 1699 CB ALA A 649 -3.247 -17.816 0.569 1.00 12.22 C ATOM 0 H ALA A 649 -4.740 -17.564 2.766 1.00 31.25 H new ATOM 0 HA ALA A 649 -5.207 -17.461 -0.178 1.00 32.43 H new ATOM 0 HB1 ALA A 649 -2.923 -18.326 -0.338 1.00 12.22 H new ATOM 0 HB2 ALA A 649 -2.963 -16.765 0.515 1.00 12.22 H new ATOM 0 HB3 ALA A 649 -2.771 -18.277 1.434 1.00 12.22 H new ATOM 1705 N LYS A 650 -4.911 -20.109 -0.313 1.00 62.12 N ATOM 1706 CA LYS A 650 -5.296 -21.507 -0.411 1.00 11.22 C ATOM 1707 C LYS A 650 -4.045 -22.383 -0.323 1.00 32.50 C ATOM 1708 O LYS A 650 -4.127 -23.552 0.052 1.00 71.22 O ATOM 1709 CB LYS A 650 -6.128 -21.746 -1.673 1.00 24.44 C ATOM 1710 CG LYS A 650 -7.207 -20.673 -1.830 1.00 31.52 C ATOM 1711 CD LYS A 650 -8.396 -21.205 -2.633 1.00 22.31 C ATOM 1712 CE LYS A 650 -9.577 -20.235 -2.571 1.00 33.21 C ATOM 1713 NZ LYS A 650 -10.528 -20.506 -3.672 1.00 54.21 N ATOM 0 H LYS A 650 -4.379 -19.756 -1.109 1.00 62.12 H new ATOM 0 HA LYS A 650 -5.939 -21.785 0.424 1.00 11.22 H new ATOM 0 HB2 LYS A 650 -5.477 -21.743 -2.548 1.00 24.44 H new ATOM 0 HB3 LYS A 650 -6.593 -22.730 -1.625 1.00 24.44 H new ATOM 0 HG2 LYS A 650 -7.545 -20.345 -0.847 1.00 31.52 H new ATOM 0 HG3 LYS A 650 -6.787 -19.800 -2.330 1.00 31.52 H new ATOM 0 HD2 LYS A 650 -8.100 -21.357 -3.671 1.00 22.31 H new ATOM 0 HD3 LYS A 650 -8.698 -22.177 -2.242 1.00 22.31 H new ATOM 0 HE2 LYS A 650 -10.085 -20.332 -1.612 1.00 33.21 H new ATOM 0 HE3 LYS A 650 -9.216 -19.209 -2.638 1.00 33.21 H new ATOM 0 HZ1 LYS A 650 -11.324 -19.839 -3.615 1.00 54.21 H new ATOM 0 HZ2 LYS A 650 -10.044 -20.391 -4.585 1.00 54.21 H new ATOM 0 HZ3 LYS A 650 -10.886 -21.479 -3.590 1.00 54.21 H new ATOM 1726 N LYS A 651 -2.917 -21.785 -0.675 1.00 25.53 N ATOM 1727 CA LYS A 651 -1.650 -22.497 -0.640 1.00 72.23 C ATOM 1728 C LYS A 651 -0.656 -21.719 0.225 1.00 73.53 C ATOM 1729 O LYS A 651 -0.654 -20.489 0.220 1.00 63.51 O ATOM 1730 CB LYS A 651 -1.149 -22.768 -2.060 1.00 71.23 C ATOM 1731 CG LYS A 651 -2.185 -23.554 -2.867 1.00 31.13 C ATOM 1732 CD LYS A 651 -3.184 -22.612 -3.542 1.00 63.12 C ATOM 1733 CE LYS A 651 -2.712 -22.228 -4.946 1.00 3.11 C ATOM 1734 NZ LYS A 651 -3.834 -21.675 -5.737 1.00 21.12 N ATOM 0 H LYS A 651 -2.853 -20.816 -0.986 1.00 25.53 H new ATOM 0 HA LYS A 651 -1.776 -23.476 -0.178 1.00 72.23 H new ATOM 0 HB2 LYS A 651 -0.934 -21.824 -2.560 1.00 71.23 H new ATOM 0 HB3 LYS A 651 -0.214 -23.327 -2.019 1.00 71.23 H new ATOM 0 HG2 LYS A 651 -1.681 -24.157 -3.622 1.00 31.13 H new ATOM 0 HG3 LYS A 651 -2.716 -24.243 -2.210 1.00 31.13 H new ATOM 0 HD2 LYS A 651 -4.160 -23.093 -3.601 1.00 63.12 H new ATOM 0 HD3 LYS A 651 -3.308 -21.713 -2.937 1.00 63.12 H new ATOM 0 HE2 LYS A 651 -1.910 -21.493 -4.878 1.00 3.11 H new ATOM 0 HE3 LYS A 651 -2.301 -23.103 -5.450 1.00 3.11 H new ATOM 0 HZ1 LYS A 651 -3.496 -21.420 -6.687 1.00 21.12 H new ATOM 0 HZ2 LYS A 651 -4.587 -22.388 -5.817 1.00 21.12 H new ATOM 0 HZ3 LYS A 651 -4.208 -20.828 -5.263 1.00 21.12 H new ATOM 1747 N TRP A 652 0.164 -22.469 0.946 1.00 11.15 N ATOM 1748 CA TRP A 652 1.160 -21.865 1.815 1.00 64.13 C ATOM 1749 C TRP A 652 2.155 -21.104 0.936 1.00 54.25 C ATOM 1750 O TRP A 652 2.913 -20.270 1.428 1.00 22.45 O ATOM 1751 CB TRP A 652 1.829 -22.920 2.698 1.00 64.10 C ATOM 1752 CG TRP A 652 0.856 -23.694 3.588 1.00 34.55 C ATOM 1753 CD1 TRP A 652 0.106 -24.757 3.263 1.00 44.30 C ATOM 1754 CD2 TRP A 652 0.555 -23.422 4.973 1.00 35.14 C ATOM 1755 NE1 TRP A 652 -0.653 -25.187 4.332 1.00 24.23 N ATOM 1756 CE2 TRP A 652 -0.371 -24.350 5.405 1.00 12.25 C ATOM 1757 CE3 TRP A 652 1.048 -22.425 5.833 1.00 44.22 C ATOM 1758 CZ2 TRP A 652 -0.883 -24.372 6.708 1.00 34.32 C ATOM 1759 CZ3 TRP A 652 0.526 -22.461 7.131 1.00 5.14 C ATOM 1760 CH2 TRP A 652 -0.406 -23.388 7.582 1.00 60.12 C ATOM 0 H TRP A 652 0.159 -23.489 0.946 1.00 11.15 H new ATOM 0 HA TRP A 652 0.694 -21.161 2.504 1.00 64.13 H new ATOM 0 HB2 TRP A 652 2.363 -23.626 2.062 1.00 64.10 H new ATOM 0 HB3 TRP A 652 2.573 -22.433 3.328 1.00 64.10 H new ATOM 0 HD1 TRP A 652 0.097 -25.219 2.287 1.00 44.30 H new ATOM 0 HE1 TRP A 652 -1.302 -25.974 4.334 1.00 24.23 H new ATOM 0 HE3 TRP A 652 1.773 -21.689 5.517 1.00 44.22 H new ATOM 0 HZ2 TRP A 652 -1.607 -25.109 7.022 1.00 34.32 H new ATOM 0 HZ3 TRP A 652 0.872 -21.716 7.832 1.00 5.14 H new ATOM 0 HH2 TRP A 652 -0.760 -23.349 8.601 1.00 60.12 H new ATOM 1771 N SER A 653 2.118 -21.417 -0.351 1.00 65.52 N ATOM 1772 CA SER A 653 3.007 -20.773 -1.304 1.00 31.43 C ATOM 1773 C SER A 653 2.673 -19.284 -1.406 1.00 53.24 C ATOM 1774 O SER A 653 3.425 -18.515 -2.003 1.00 1.24 O ATOM 1775 CB SER A 653 2.912 -21.435 -2.680 1.00 14.20 C ATOM 1776 OG SER A 653 3.693 -22.624 -2.756 1.00 44.21 O ATOM 0 H SER A 653 1.487 -22.108 -0.756 1.00 65.52 H new ATOM 0 HA SER A 653 4.031 -20.885 -0.948 1.00 31.43 H new ATOM 0 HB2 SER A 653 1.870 -21.671 -2.897 1.00 14.20 H new ATOM 0 HB3 SER A 653 3.246 -20.733 -3.444 1.00 14.20 H new ATOM 0 HG SER A 653 3.604 -23.017 -3.649 1.00 44.21 H new ATOM 1782 N ARG A 654 1.543 -18.921 -0.816 1.00 24.41 N ATOM 1783 CA ARG A 654 1.100 -17.538 -0.833 1.00 43.34 C ATOM 1784 C ARG A 654 1.362 -16.879 0.523 1.00 61.33 C ATOM 1785 O ARG A 654 1.544 -15.665 0.603 1.00 62.55 O ATOM 1786 CB ARG A 654 -0.391 -17.441 -1.160 1.00 33.21 C ATOM 1787 CG ARG A 654 -0.780 -18.444 -2.248 1.00 53.23 C ATOM 1788 CD ARG A 654 0.140 -18.318 -3.464 1.00 51.42 C ATOM 1789 NE ARG A 654 -0.571 -18.760 -4.685 1.00 23.03 N ATOM 1790 CZ ARG A 654 -0.005 -18.823 -5.909 1.00 31.32 C ATOM 1791 NH1 ARG A 654 1.286 -18.472 -6.086 1.00 25.42 N ATOM 1792 NH2 ARG A 654 -0.734 -19.233 -6.930 1.00 62.32 N ATOM 0 H ARG A 654 0.921 -19.562 -0.323 1.00 24.41 H new ATOM 0 HA ARG A 654 1.665 -17.019 -1.608 1.00 43.34 H new ATOM 0 HB2 ARG A 654 -0.977 -17.629 -0.261 1.00 33.21 H new ATOM 0 HB3 ARG A 654 -0.630 -16.430 -1.490 1.00 33.21 H new ATOM 0 HG2 ARG A 654 -0.726 -19.457 -1.850 1.00 53.23 H new ATOM 0 HG3 ARG A 654 -1.814 -18.275 -2.550 1.00 53.23 H new ATOM 0 HD2 ARG A 654 0.467 -17.284 -3.578 1.00 51.42 H new ATOM 0 HD3 ARG A 654 1.036 -18.921 -3.317 1.00 51.42 H new ATOM 0 HE ARG A 654 -1.549 -19.034 -4.596 1.00 23.03 H new ATOM 0 HH11 ARG A 654 1.842 -18.156 -5.291 1.00 25.42 H new ATOM 0 HH12 ARG A 654 1.706 -18.523 -7.014 1.00 25.42 H new ATOM 0 HH21 ARG A 654 -1.709 -19.496 -6.787 1.00 62.32 H new ATOM 0 HH22 ARG A 654 -0.322 -19.287 -7.862 1.00 62.32 H new ATOM 1805 N VAL A 655 1.373 -17.709 1.555 1.00 33.34 N ATOM 1806 CA VAL A 655 1.609 -17.223 2.904 1.00 2.10 C ATOM 1807 C VAL A 655 2.706 -16.157 2.872 1.00 42.20 C ATOM 1808 O VAL A 655 3.811 -16.412 2.397 1.00 64.45 O ATOM 1809 CB VAL A 655 1.940 -18.394 3.832 1.00 1.50 C ATOM 1810 CG1 VAL A 655 2.818 -17.937 4.999 1.00 65.05 C ATOM 1811 CG2 VAL A 655 0.664 -19.070 4.338 1.00 42.41 C ATOM 0 H VAL A 655 1.222 -18.715 1.485 1.00 33.34 H new ATOM 0 HA VAL A 655 0.710 -16.753 3.304 1.00 2.10 H new ATOM 0 HB VAL A 655 2.503 -19.129 3.257 1.00 1.50 H new ATOM 0 HG11 VAL A 655 3.039 -18.788 5.643 1.00 65.05 H new ATOM 0 HG12 VAL A 655 3.749 -17.523 4.613 1.00 65.05 H new ATOM 0 HG13 VAL A 655 2.292 -17.174 5.573 1.00 65.05 H new ATOM 0 HG21 VAL A 655 0.927 -19.899 4.995 1.00 42.41 H new ATOM 0 HG22 VAL A 655 0.063 -18.347 4.889 1.00 42.41 H new ATOM 0 HG23 VAL A 655 0.091 -19.447 3.491 1.00 42.41 H new ATOM 1821 N PRO A 656 2.353 -14.953 3.398 1.00 65.23 N ATOM 1822 CA PRO A 656 3.295 -13.847 3.434 1.00 62.32 C ATOM 1823 C PRO A 656 4.345 -14.056 4.527 1.00 32.32 C ATOM 1824 O PRO A 656 5.541 -13.915 4.279 1.00 3.34 O ATOM 1825 CB PRO A 656 2.441 -12.610 3.659 1.00 61.41 C ATOM 1826 CG PRO A 656 1.114 -13.114 4.203 1.00 51.42 C ATOM 1827 CD PRO A 656 1.054 -14.614 3.970 1.00 74.44 C ATOM 0 HA PRO A 656 3.871 -13.755 2.513 1.00 62.32 H new ATOM 0 HB2 PRO A 656 2.918 -11.928 4.363 1.00 61.41 H new ATOM 0 HB3 PRO A 656 2.298 -12.059 2.729 1.00 61.41 H new ATOM 0 HG2 PRO A 656 1.027 -12.889 5.266 1.00 51.42 H new ATOM 0 HG3 PRO A 656 0.283 -12.617 3.703 1.00 51.42 H new ATOM 0 HD2 PRO A 656 0.879 -15.153 4.901 1.00 74.44 H new ATOM 0 HD3 PRO A 656 0.242 -14.877 3.292 1.00 74.44 H new ATOM 1835 N PHE A 657 3.859 -14.390 5.714 1.00 74.04 N ATOM 1836 CA PHE A 657 4.740 -14.620 6.846 1.00 72.11 C ATOM 1837 C PHE A 657 5.648 -15.826 6.598 1.00 71.24 C ATOM 1838 O PHE A 657 5.256 -16.773 5.917 1.00 44.11 O ATOM 1839 CB PHE A 657 3.848 -14.908 8.055 1.00 21.52 C ATOM 1840 CG PHE A 657 3.236 -16.311 8.057 1.00 53.35 C ATOM 1841 CD1 PHE A 657 3.949 -17.364 8.538 1.00 11.34 C ATOM 1842 CD2 PHE A 657 1.978 -16.504 7.576 1.00 42.01 C ATOM 1843 CE1 PHE A 657 3.381 -18.665 8.540 1.00 55.03 C ATOM 1844 CE2 PHE A 657 1.410 -17.805 7.577 1.00 31.22 C ATOM 1845 CZ PHE A 657 2.123 -18.858 8.059 1.00 30.31 C ATOM 0 H PHE A 657 2.866 -14.507 5.916 1.00 74.04 H new ATOM 0 HA PHE A 657 5.375 -13.749 7.007 1.00 72.11 H new ATOM 0 HB2 PHE A 657 4.433 -14.777 8.965 1.00 21.52 H new ATOM 0 HB3 PHE A 657 3.044 -14.172 8.084 1.00 21.52 H new ATOM 0 HD1 PHE A 657 4.948 -17.211 8.919 1.00 11.34 H new ATOM 0 HD2 PHE A 657 1.412 -15.668 7.194 1.00 42.01 H new ATOM 0 HE1 PHE A 657 3.947 -19.501 8.923 1.00 55.03 H new ATOM 0 HE2 PHE A 657 0.412 -17.959 7.195 1.00 31.22 H new ATOM 0 HZ PHE A 657 1.691 -19.848 8.060 1.00 30.31 H new ATOM 1855 N SER A 658 6.844 -15.752 7.163 1.00 32.42 N ATOM 1856 CA SER A 658 7.811 -16.826 7.012 1.00 72.42 C ATOM 1857 C SER A 658 7.444 -17.994 7.930 1.00 72.23 C ATOM 1858 O SER A 658 7.058 -17.787 9.079 1.00 34.50 O ATOM 1859 CB SER A 658 9.228 -16.338 7.315 1.00 5.24 C ATOM 1860 OG SER A 658 9.227 -15.175 8.140 1.00 64.41 O ATOM 0 H SER A 658 7.166 -14.965 7.726 1.00 32.42 H new ATOM 0 HA SER A 658 7.786 -17.165 5.976 1.00 72.42 H new ATOM 0 HB2 SER A 658 9.787 -17.133 7.809 1.00 5.24 H new ATOM 0 HB3 SER A 658 9.744 -16.119 6.380 1.00 5.24 H new ATOM 0 HG SER A 658 10.150 -14.895 8.312 1.00 64.41 H new ATOM 1866 N VAL A 659 7.578 -19.196 7.388 1.00 55.34 N ATOM 1867 CA VAL A 659 7.265 -20.397 8.143 1.00 11.34 C ATOM 1868 C VAL A 659 8.525 -21.255 8.273 1.00 73.25 C ATOM 1869 O VAL A 659 8.886 -21.977 7.345 1.00 61.14 O ATOM 1870 CB VAL A 659 6.100 -21.140 7.487 1.00 52.24 C ATOM 1871 CG1 VAL A 659 5.425 -22.088 8.480 1.00 71.14 C ATOM 1872 CG2 VAL A 659 5.088 -20.158 6.892 1.00 4.42 C ATOM 0 H VAL A 659 7.899 -19.363 6.435 1.00 55.34 H new ATOM 0 HA VAL A 659 6.941 -20.140 9.152 1.00 11.34 H new ATOM 0 HB VAL A 659 6.503 -21.741 6.672 1.00 52.24 H new ATOM 0 HG11 VAL A 659 4.600 -22.603 7.988 1.00 71.14 H new ATOM 0 HG12 VAL A 659 6.150 -22.820 8.835 1.00 71.14 H new ATOM 0 HG13 VAL A 659 5.043 -21.517 9.326 1.00 71.14 H new ATOM 0 HG21 VAL A 659 4.270 -20.713 6.432 1.00 4.42 H new ATOM 0 HG22 VAL A 659 4.694 -19.519 7.682 1.00 4.42 H new ATOM 0 HG23 VAL A 659 5.578 -19.542 6.138 1.00 4.42 H new ATOM 1882 N PRO A 660 9.176 -21.146 9.462 1.00 55.43 N ATOM 1883 CA PRO A 660 10.387 -21.903 9.724 1.00 23.13 C ATOM 1884 C PRO A 660 10.066 -23.374 9.996 1.00 22.12 C ATOM 1885 O PRO A 660 9.017 -23.691 10.555 1.00 63.31 O ATOM 1886 CB PRO A 660 11.037 -21.208 10.910 1.00 53.14 C ATOM 1887 CG PRO A 660 9.941 -20.378 11.558 1.00 53.33 C ATOM 1888 CD PRO A 660 8.777 -20.301 10.583 1.00 14.45 C ATOM 0 HA PRO A 660 11.064 -21.922 8.870 1.00 23.13 H new ATOM 0 HB2 PRO A 660 11.444 -21.934 11.613 1.00 53.14 H new ATOM 0 HB3 PRO A 660 11.865 -20.577 10.587 1.00 53.14 H new ATOM 0 HG2 PRO A 660 9.623 -20.831 12.497 1.00 53.33 H new ATOM 0 HG3 PRO A 660 10.308 -19.379 11.794 1.00 53.33 H new ATOM 0 HD2 PRO A 660 7.854 -20.658 11.039 1.00 14.45 H new ATOM 0 HD3 PRO A 660 8.597 -19.275 10.261 1.00 14.45 H new ATOM 1896 N ASP A 661 10.989 -24.233 9.589 1.00 71.24 N ATOM 1897 CA ASP A 661 10.817 -25.663 9.781 1.00 23.14 C ATOM 1898 C ASP A 661 11.062 -26.008 11.252 1.00 72.02 C ATOM 1899 O ASP A 661 11.902 -25.392 11.906 1.00 34.13 O ATOM 1900 CB ASP A 661 11.817 -26.456 8.937 1.00 33.53 C ATOM 1901 CG ASP A 661 12.116 -25.861 7.560 1.00 3.11 C ATOM 1902 OD1 ASP A 661 11.822 -26.472 6.522 1.00 25.52 O ATOM 1903 OD2 ASP A 661 12.684 -24.703 7.579 1.00 52.42 O ATOM 0 H ASP A 661 11.858 -23.966 9.127 1.00 71.24 H new ATOM 0 HA ASP A 661 9.803 -25.925 9.479 1.00 23.14 H new ATOM 0 HB2 ASP A 661 12.752 -26.539 9.491 1.00 33.53 H new ATOM 0 HB3 ASP A 661 11.435 -27.468 8.804 1.00 33.53 H new ATOM 1909 N PHE A 662 10.313 -26.992 11.728 1.00 13.42 N ATOM 1910 CA PHE A 662 10.437 -27.426 13.109 1.00 5.23 C ATOM 1911 C PHE A 662 11.847 -27.947 13.395 1.00 44.10 C ATOM 1912 O PHE A 662 12.449 -28.614 12.554 1.00 12.43 O ATOM 1913 CB PHE A 662 9.435 -28.564 13.313 1.00 41.44 C ATOM 1914 CG PHE A 662 9.418 -29.132 14.733 1.00 3.53 C ATOM 1915 CD1 PHE A 662 10.387 -30.000 15.130 1.00 72.11 C ATOM 1916 CD2 PHE A 662 8.435 -28.768 15.599 1.00 12.14 C ATOM 1917 CE1 PHE A 662 10.371 -30.527 16.448 1.00 21.22 C ATOM 1918 CE2 PHE A 662 8.419 -29.295 16.918 1.00 62.12 C ATOM 1919 CZ PHE A 662 9.388 -30.164 17.314 1.00 13.34 C ATOM 0 H PHE A 662 9.618 -27.501 11.182 1.00 13.42 H new ATOM 0 HA PHE A 662 10.244 -26.589 13.780 1.00 5.23 H new ATOM 0 HB2 PHE A 662 8.437 -28.204 13.065 1.00 41.44 H new ATOM 0 HB3 PHE A 662 9.667 -29.368 12.614 1.00 41.44 H new ATOM 0 HD1 PHE A 662 11.169 -30.288 14.443 1.00 72.11 H new ATOM 0 HD2 PHE A 662 7.666 -28.078 15.284 1.00 12.14 H new ATOM 0 HE1 PHE A 662 11.140 -31.217 16.763 1.00 21.22 H new ATOM 0 HE2 PHE A 662 7.638 -29.006 17.606 1.00 62.12 H new ATOM 0 HZ PHE A 662 9.376 -30.566 18.317 1.00 13.34 H new ATOM 1929 N ASP A 663 12.334 -27.623 14.584 1.00 33.11 N ATOM 1930 CA ASP A 663 13.662 -28.050 14.991 1.00 34.21 C ATOM 1931 C ASP A 663 13.596 -28.626 16.407 1.00 74.41 C ATOM 1932 O ASP A 663 13.758 -27.899 17.385 1.00 12.33 O ATOM 1933 CB ASP A 663 14.639 -26.873 15.005 1.00 73.01 C ATOM 1934 CG ASP A 663 14.006 -25.511 15.297 1.00 0.10 C ATOM 1935 OD1 ASP A 663 14.460 -24.773 16.185 1.00 75.34 O ATOM 1936 OD2 ASP A 663 12.991 -25.212 14.559 1.00 43.41 O ATOM 0 H ASP A 663 11.832 -27.070 15.279 1.00 33.11 H new ATOM 0 HA ASP A 663 14.009 -28.798 14.278 1.00 34.21 H new ATOM 0 HB2 ASP A 663 15.408 -27.067 15.753 1.00 73.01 H new ATOM 0 HB3 ASP A 663 15.140 -26.824 14.038 1.00 73.01 H new ATOM 1942 N PHE A 664 13.357 -29.928 16.471 1.00 22.11 N ATOM 1943 CA PHE A 664 13.268 -30.610 17.751 1.00 72.30 C ATOM 1944 C PHE A 664 14.359 -30.126 18.708 1.00 51.10 C ATOM 1945 O PHE A 664 14.119 -29.978 19.905 1.00 33.22 O ATOM 1946 CB PHE A 664 13.471 -32.102 17.478 1.00 50.12 C ATOM 1947 CG PHE A 664 13.294 -32.990 18.711 1.00 75.21 C ATOM 1948 CD1 PHE A 664 12.244 -32.786 19.551 1.00 55.23 C ATOM 1949 CD2 PHE A 664 14.186 -33.984 18.967 1.00 31.11 C ATOM 1950 CE1 PHE A 664 12.079 -33.610 20.695 1.00 32.31 C ATOM 1951 CE2 PHE A 664 14.021 -34.808 20.111 1.00 21.45 C ATOM 1952 CZ PHE A 664 12.971 -34.604 20.951 1.00 21.23 C ATOM 0 H PHE A 664 13.222 -30.528 15.657 1.00 22.11 H new ATOM 0 HA PHE A 664 12.302 -30.408 18.213 1.00 72.30 H new ATOM 0 HB2 PHE A 664 12.766 -32.420 16.710 1.00 50.12 H new ATOM 0 HB3 PHE A 664 14.472 -32.254 17.074 1.00 50.12 H new ATOM 0 HD1 PHE A 664 11.535 -31.997 19.348 1.00 55.23 H new ATOM 0 HD2 PHE A 664 15.020 -34.146 18.300 1.00 31.11 H new ATOM 0 HE1 PHE A 664 11.245 -33.448 21.362 1.00 32.31 H new ATOM 0 HE2 PHE A 664 14.730 -35.597 20.314 1.00 21.45 H new ATOM 0 HZ PHE A 664 12.846 -35.231 21.821 1.00 21.23 H new ATOM 1962 N LEU A 665 15.535 -29.892 18.144 1.00 32.11 N ATOM 1963 CA LEU A 665 16.664 -29.427 18.932 1.00 34.54 C ATOM 1964 C LEU A 665 16.220 -28.254 19.809 1.00 72.43 C ATOM 1965 O LEU A 665 16.311 -28.321 21.034 1.00 41.45 O ATOM 1966 CB LEU A 665 17.853 -29.103 18.026 1.00 54.41 C ATOM 1967 CG LEU A 665 18.401 -30.265 17.196 1.00 21.55 C ATOM 1968 CD1 LEU A 665 19.844 -29.998 16.765 1.00 24.31 C ATOM 1969 CD2 LEU A 665 18.264 -31.590 17.951 1.00 41.52 C ATOM 0 H LEU A 665 15.730 -30.016 17.151 1.00 32.11 H new ATOM 0 HA LEU A 665 17.010 -30.213 19.603 1.00 34.54 H new ATOM 0 HB2 LEU A 665 17.559 -28.304 17.346 1.00 54.41 H new ATOM 0 HB3 LEU A 665 18.660 -28.713 18.646 1.00 54.41 H new ATOM 0 HG LEU A 665 17.804 -30.348 16.288 1.00 21.55 H new ATOM 0 HD11 LEU A 665 20.210 -30.839 16.176 1.00 24.31 H new ATOM 0 HD12 LEU A 665 19.882 -29.090 16.163 1.00 24.31 H new ATOM 0 HD13 LEU A 665 20.470 -29.874 17.648 1.00 24.31 H new ATOM 0 HD21 LEU A 665 18.661 -32.400 17.339 1.00 41.52 H new ATOM 0 HD22 LEU A 665 18.821 -31.535 18.886 1.00 41.52 H new ATOM 0 HD23 LEU A 665 17.212 -31.779 18.166 1.00 41.52 H new ATOM 1981 N GLN A 666 15.749 -27.208 19.147 1.00 53.13 N ATOM 1982 CA GLN A 666 15.290 -26.022 19.850 1.00 5.20 C ATOM 1983 C GLN A 666 13.924 -26.278 20.488 1.00 33.02 C ATOM 1984 O GLN A 666 13.758 -26.113 21.696 1.00 52.13 O ATOM 1985 CB GLN A 666 15.240 -24.814 18.913 1.00 41.34 C ATOM 1986 CG GLN A 666 15.425 -23.509 19.690 1.00 53.33 C ATOM 1987 CD GLN A 666 16.905 -23.244 19.973 1.00 52.12 C ATOM 1988 OE1 GLN A 666 17.702 -23.010 19.079 1.00 1.34 O ATOM 1989 NE2 GLN A 666 17.226 -23.294 21.262 1.00 4.34 N ATOM 0 H GLN A 666 15.675 -27.157 18.131 1.00 53.13 H new ATOM 0 HA GLN A 666 16.003 -25.796 20.643 1.00 5.20 H new ATOM 0 HB2 GLN A 666 16.019 -24.904 18.156 1.00 41.34 H new ATOM 0 HB3 GLN A 666 14.285 -24.796 18.387 1.00 41.34 H new ATOM 0 HG2 GLN A 666 15.006 -22.680 19.120 1.00 53.33 H new ATOM 0 HG3 GLN A 666 14.875 -23.560 20.630 1.00 53.33 H new ATOM 0 HE21 GLN A 666 16.509 -23.495 21.959 1.00 4.34 H new ATOM 0 HE22 GLN A 666 18.190 -23.131 21.554 1.00 4.34 H new ATOM 1998 N HIS A 667 12.980 -26.677 19.649 1.00 73.34 N ATOM 1999 CA HIS A 667 11.633 -26.958 20.116 1.00 53.13 C ATOM 2000 C HIS A 667 11.697 -27.773 21.409 1.00 63.23 C ATOM 2001 O HIS A 667 10.791 -27.702 22.238 1.00 45.12 O ATOM 2002 CB HIS A 667 10.811 -27.644 19.023 1.00 53.34 C ATOM 2003 CG HIS A 667 9.332 -27.343 19.086 1.00 21.14 C ATOM 2004 ND1 HIS A 667 8.411 -28.223 19.627 1.00 31.03 N ATOM 2005 CD2 HIS A 667 8.626 -26.252 18.673 1.00 12.01 C ATOM 2006 CE1 HIS A 667 7.207 -27.676 19.537 1.00 25.23 C ATOM 2007 NE2 HIS A 667 7.343 -26.455 18.945 1.00 13.12 N ATOM 0 H HIS A 667 13.121 -26.813 18.648 1.00 73.34 H new ATOM 0 HA HIS A 667 11.121 -26.023 20.342 1.00 53.13 H new ATOM 0 HB2 HIS A 667 11.193 -27.337 18.049 1.00 53.34 H new ATOM 0 HB3 HIS A 667 10.955 -28.722 19.097 1.00 53.34 H new ATOM 0 HD1 HIS A 667 8.623 -29.137 20.027 1.00 31.03 H new ATOM 0 HD2 HIS A 667 9.041 -25.372 18.204 1.00 12.01 H new ATOM 0 HE1 HIS A 667 6.281 -28.119 19.873 1.00 25.23 H new ATOM 2015 N CYS A 668 12.777 -28.529 21.540 1.00 22.42 N ATOM 2016 CA CYS A 668 12.972 -29.358 22.718 1.00 0.42 C ATOM 2017 C CYS A 668 13.684 -28.520 23.782 1.00 45.22 C ATOM 2018 O CYS A 668 13.331 -28.574 24.959 1.00 43.32 O ATOM 2019 CB CYS A 668 13.743 -30.637 22.389 1.00 61.33 C ATOM 2020 SG CYS A 668 13.905 -31.674 23.888 1.00 1.11 S ATOM 0 H CYS A 668 13.526 -28.585 20.850 1.00 22.42 H new ATOM 0 HA CYS A 668 12.005 -29.684 23.100 1.00 0.42 H new ATOM 0 HB2 CYS A 668 13.225 -31.192 21.607 1.00 61.33 H new ATOM 0 HB3 CYS A 668 14.731 -30.387 22.002 1.00 61.33 H new ATOM 0 HG CYS A 668 14.560 -32.759 23.597 1.00 1.11 H new ATOM 2026 N ALA A 669 14.675 -27.765 23.329 1.00 13.23 N ATOM 2027 CA ALA A 669 15.440 -26.917 24.228 1.00 51.25 C ATOM 2028 C ALA A 669 14.532 -25.817 24.781 1.00 53.33 C ATOM 2029 O ALA A 669 14.904 -25.112 25.717 1.00 3.14 O ATOM 2030 CB ALA A 669 16.654 -26.353 23.487 1.00 41.12 C ATOM 0 H ALA A 669 14.965 -27.723 22.352 1.00 13.23 H new ATOM 0 HA ALA A 669 15.813 -27.493 25.075 1.00 51.25 H new ATOM 0 HB1 ALA A 669 17.228 -25.717 24.161 1.00 41.12 H new ATOM 0 HB2 ALA A 669 17.282 -27.174 23.140 1.00 41.12 H new ATOM 0 HB3 ALA A 669 16.318 -25.766 22.632 1.00 41.12 H new ATOM 2036 N GLU A 670 13.357 -25.704 24.178 1.00 65.24 N ATOM 2037 CA GLU A 670 12.393 -24.702 24.598 1.00 2.21 C ATOM 2038 C GLU A 670 11.146 -25.374 25.175 1.00 31.42 C ATOM 2039 O GLU A 670 10.223 -24.697 25.625 1.00 0.01 O ATOM 2040 CB GLU A 670 12.028 -23.772 23.439 1.00 1.03 C ATOM 2041 CG GLU A 670 12.964 -22.562 23.392 1.00 74.14 C ATOM 2042 CD GLU A 670 12.385 -21.456 22.507 1.00 73.11 C ATOM 2043 OE1 GLU A 670 12.786 -21.321 21.342 1.00 41.45 O ATOM 2044 OE2 GLU A 670 11.485 -20.722 23.070 1.00 62.42 O ATOM 0 H GLU A 670 13.051 -26.291 23.402 1.00 65.24 H new ATOM 0 HA GLU A 670 12.848 -24.093 25.379 1.00 2.21 H new ATOM 0 HB2 GLU A 670 12.086 -24.318 22.497 1.00 1.03 H new ATOM 0 HB3 GLU A 670 10.997 -23.435 23.549 1.00 1.03 H new ATOM 0 HG2 GLU A 670 13.122 -22.180 24.401 1.00 74.14 H new ATOM 0 HG3 GLU A 670 13.939 -22.866 23.010 1.00 74.14 H new ATOM 2052 N ASN A 671 11.158 -26.699 25.143 1.00 5.24 N ATOM 2053 CA ASN A 671 10.040 -27.470 25.658 1.00 72.43 C ATOM 2054 C ASN A 671 10.471 -28.198 26.932 1.00 21.44 C ATOM 2055 O ASN A 671 9.631 -28.688 27.686 1.00 24.21 O ATOM 2056 CB ASN A 671 9.584 -28.522 24.644 1.00 14.22 C ATOM 2057 CG ASN A 671 8.524 -27.950 23.700 1.00 44.21 C ATOM 2058 OD1 ASN A 671 7.553 -28.599 23.349 1.00 72.01 O ATOM 2059 ND2 ASN A 671 8.765 -26.702 23.309 1.00 2.55 N ATOM 0 H ASN A 671 11.925 -27.258 24.768 1.00 5.24 H new ATOM 0 HA ASN A 671 9.219 -26.781 25.858 1.00 72.43 H new ATOM 0 HB2 ASN A 671 10.440 -28.871 24.067 1.00 14.22 H new ATOM 0 HB3 ASN A 671 9.180 -29.387 25.169 1.00 14.22 H new ATOM 0 HD21 ASN A 671 8.117 -26.231 22.677 1.00 2.55 H new ATOM 0 HD22 ASN A 671 9.598 -26.215 23.641 1.00 2.55 H new ATOM 2066 N LEU A 672 11.780 -28.246 27.134 1.00 34.43 N ATOM 2067 CA LEU A 672 12.333 -28.906 28.305 1.00 74.42 C ATOM 2068 C LEU A 672 12.758 -27.850 29.327 1.00 61.41 C ATOM 2069 O LEU A 672 12.542 -26.657 29.119 1.00 61.51 O ATOM 2070 CB LEU A 672 13.459 -29.860 27.900 1.00 11.33 C ATOM 2071 CG LEU A 672 13.037 -31.096 27.103 1.00 24.15 C ATOM 2072 CD1 LEU A 672 14.178 -32.112 27.023 1.00 4.05 C ATOM 2073 CD2 LEU A 672 11.761 -31.712 27.681 1.00 43.31 C ATOM 0 H LEU A 672 12.473 -27.839 26.507 1.00 34.43 H new ATOM 0 HA LEU A 672 11.577 -29.528 28.785 1.00 74.42 H new ATOM 0 HB2 LEU A 672 14.186 -29.302 27.310 1.00 11.33 H new ATOM 0 HB3 LEU A 672 13.970 -30.192 28.804 1.00 11.33 H new ATOM 0 HG LEU A 672 12.811 -30.784 26.083 1.00 24.15 H new ATOM 0 HD11 LEU A 672 13.852 -32.981 26.451 1.00 4.05 H new ATOM 0 HD12 LEU A 672 15.037 -31.656 26.532 1.00 4.05 H new ATOM 0 HD13 LEU A 672 14.459 -32.424 28.029 1.00 4.05 H new ATOM 0 HD21 LEU A 672 11.483 -32.589 27.096 1.00 43.31 H new ATOM 0 HD22 LEU A 672 11.936 -32.007 28.716 1.00 43.31 H new ATOM 0 HD23 LEU A 672 10.954 -30.980 27.643 1.00 43.31 H new ATOM 2085 N SER A 673 13.355 -28.327 30.409 1.00 23.31 N ATOM 2086 CA SER A 673 13.813 -27.439 31.464 1.00 30.22 C ATOM 2087 C SER A 673 15.331 -27.549 31.618 1.00 3.42 C ATOM 2088 O SER A 673 15.917 -26.918 32.497 1.00 33.34 O ATOM 2089 CB SER A 673 13.121 -27.757 32.791 1.00 74.32 C ATOM 2090 OG SER A 673 11.716 -27.525 32.729 1.00 31.30 O ATOM 0 H SER A 673 13.532 -29.317 30.578 1.00 23.31 H new ATOM 0 HA SER A 673 13.555 -26.417 31.186 1.00 30.22 H new ATOM 0 HB2 SER A 673 13.305 -28.798 33.056 1.00 74.32 H new ATOM 0 HB3 SER A 673 13.555 -27.145 33.582 1.00 74.32 H new ATOM 0 HG SER A 673 11.310 -27.741 33.594 1.00 31.30 H new ATOM 2096 N ASP A 674 15.926 -28.353 30.750 1.00 74.44 N ATOM 2097 CA ASP A 674 17.365 -28.554 30.778 1.00 15.50 C ATOM 2098 C ASP A 674 18.064 -27.193 30.816 1.00 74.14 C ATOM 2099 O ASP A 674 19.193 -27.084 31.292 1.00 74.44 O ATOM 2100 CB ASP A 674 17.842 -29.296 29.528 1.00 21.15 C ATOM 2101 CG ASP A 674 19.269 -29.842 29.607 1.00 61.33 C ATOM 2102 OD1 ASP A 674 19.482 -31.046 29.815 1.00 74.10 O ATOM 2103 OD2 ASP A 674 20.199 -28.964 29.441 1.00 10.35 O ATOM 0 H ASP A 674 15.437 -28.874 30.022 1.00 74.44 H new ATOM 0 HA ASP A 674 17.606 -29.145 31.662 1.00 15.50 H new ATOM 0 HB2 ASP A 674 17.162 -30.125 29.334 1.00 21.15 H new ATOM 0 HB3 ASP A 674 17.774 -28.621 28.675 1.00 21.15 H new ATOM 2109 N LEU A 675 17.364 -26.190 30.308 1.00 54.45 N ATOM 2110 CA LEU A 675 17.903 -24.841 30.277 1.00 11.30 C ATOM 2111 C LEU A 675 17.526 -24.116 31.570 1.00 15.25 C ATOM 2112 O LEU A 675 18.364 -23.457 32.184 1.00 34.35 O ATOM 2113 CB LEU A 675 17.452 -24.112 29.010 1.00 41.14 C ATOM 2114 CG LEU A 675 17.738 -24.827 27.687 1.00 15.23 C ATOM 2115 CD1 LEU A 675 19.181 -25.330 27.637 1.00 64.13 C ATOM 2116 CD2 LEU A 675 16.730 -25.952 27.443 1.00 14.25 C ATOM 0 H LEU A 675 16.428 -26.284 29.914 1.00 54.45 H new ATOM 0 HA LEU A 675 18.992 -24.867 30.231 1.00 11.30 H new ATOM 0 HB2 LEU A 675 16.379 -23.934 29.079 1.00 41.14 H new ATOM 0 HB3 LEU A 675 17.936 -23.136 28.985 1.00 41.14 H new ATOM 0 HG LEU A 675 17.620 -24.107 26.877 1.00 15.23 H new ATOM 0 HD11 LEU A 675 19.358 -25.834 26.687 1.00 64.13 H new ATOM 0 HD12 LEU A 675 19.864 -24.486 27.733 1.00 64.13 H new ATOM 0 HD13 LEU A 675 19.351 -26.029 28.456 1.00 64.13 H new ATOM 0 HD21 LEU A 675 16.956 -26.444 26.497 1.00 14.25 H new ATOM 0 HD22 LEU A 675 16.792 -26.678 28.253 1.00 14.25 H new ATOM 0 HD23 LEU A 675 15.723 -25.536 27.405 1.00 14.25 H new ATOM 2128 N SER A 676 16.263 -24.262 31.946 1.00 4.42 N ATOM 2129 CA SER A 676 15.765 -23.629 33.155 1.00 14.15 C ATOM 2130 C SER A 676 14.329 -24.082 33.429 1.00 22.24 C ATOM 2131 O SER A 676 13.549 -24.280 32.500 1.00 72.25 O ATOM 2132 CB SER A 676 15.828 -22.104 33.046 1.00 71.24 C ATOM 2133 OG SER A 676 17.163 -21.617 33.149 1.00 11.51 O ATOM 0 H SER A 676 15.571 -24.809 31.435 1.00 4.42 H new ATOM 0 HA SER A 676 16.401 -23.933 33.986 1.00 14.15 H new ATOM 0 HB2 SER A 676 15.400 -21.790 32.094 1.00 71.24 H new ATOM 0 HB3 SER A 676 15.218 -21.659 33.832 1.00 71.24 H new ATOM 0 HG SER A 676 17.784 -22.373 33.206 1.00 11.51 H new ATOM 2139 N LEU A 677 14.025 -24.233 34.710 1.00 74.51 N ATOM 2140 CA LEU A 677 12.697 -24.660 35.118 1.00 12.20 C ATOM 2141 C LEU A 677 11.671 -23.617 34.670 1.00 51.11 C ATOM 2142 O LEU A 677 10.686 -23.952 34.013 1.00 1.14 O ATOM 2143 CB LEU A 677 12.665 -24.948 36.620 1.00 12.03 C ATOM 2144 CG LEU A 677 13.812 -25.802 37.164 1.00 1.21 C ATOM 2145 CD1 LEU A 677 13.499 -26.308 38.573 1.00 13.25 C ATOM 2146 CD2 LEU A 677 14.146 -26.946 36.205 1.00 31.42 C ATOM 0 H LEU A 677 14.675 -24.067 35.478 1.00 74.51 H new ATOM 0 HA LEU A 677 12.432 -25.599 34.631 1.00 12.20 H new ATOM 0 HB2 LEU A 677 12.663 -23.997 37.152 1.00 12.03 H new ATOM 0 HB3 LEU A 677 11.724 -25.447 36.854 1.00 12.03 H new ATOM 0 HG LEU A 677 14.700 -25.174 37.238 1.00 1.21 H new ATOM 0 HD11 LEU A 677 14.331 -26.912 38.936 1.00 13.25 H new ATOM 0 HD12 LEU A 677 13.350 -25.459 39.240 1.00 13.25 H new ATOM 0 HD13 LEU A 677 12.593 -26.914 38.549 1.00 13.25 H new ATOM 0 HD21 LEU A 677 14.964 -27.538 36.615 1.00 31.42 H new ATOM 0 HD22 LEU A 677 13.269 -27.580 36.076 1.00 31.42 H new ATOM 0 HD23 LEU A 677 14.443 -26.536 35.239 1.00 31.42 H new ATOM 2158 N ASP A 678 11.937 -22.374 35.043 1.00 51.35 N ATOM 2159 CA ASP A 678 11.049 -21.280 34.687 1.00 0.31 C ATOM 2160 C ASP A 678 10.767 -21.325 33.184 1.00 21.10 C ATOM 2161 O ASP A 678 9.853 -20.660 32.700 1.00 54.10 O ATOM 2162 CB ASP A 678 11.687 -19.926 35.008 1.00 73.52 C ATOM 2163 CG ASP A 678 10.781 -18.715 34.780 1.00 11.43 C ATOM 2164 OD1 ASP A 678 9.555 -18.849 34.653 1.00 52.33 O ATOM 2165 OD2 ASP A 678 11.391 -17.579 34.735 1.00 11.21 O ATOM 0 H ASP A 678 12.754 -22.100 35.588 1.00 51.35 H new ATOM 0 HA ASP A 678 10.130 -21.392 35.262 1.00 0.31 H new ATOM 0 HB2 ASP A 678 12.008 -19.930 36.050 1.00 73.52 H new ATOM 0 HB3 ASP A 678 12.584 -19.810 34.399 1.00 73.52 H new TER 2171 ASP A 678 HETATM 2172 ZN ZN A 679 -13.063 -22.742 13.706 1.00 63.01 ZN