USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=28 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 668 CYS SG : rot 180:sc= -1.3 USER MOD Set 1.2: A 671 ASN : amide:sc= -6.12! C(o=-7.4!,f=-18!) USER MOD Set 2.1: A 588 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 622 GLN : amide:sc= -0.947 K(o=-2.5,f=-19!) USER MOD Set 2.3: A 629 LYS NZ :NH3+ 148:sc= -1.52! (180deg=-5.01!) USER MOD Set 3.1: A 581 ASN : amide:sc= -5.5! C(o=-8!,f=-17!) USER MOD Set 3.2: A 583 ASN :FLIP amide:sc= -2.49! C(o=-10!,f=-8!) USER MOD Set 4.1: A 553 GLN : amide:sc= -1.74 K(o=-6.2,f=-14!) USER MOD Set 4.2: A 565 HIS : no HD1:sc= -4.47! C(o=-6.2!,f=-10!) USER MOD Single : A 544 HIS : no HD1:sc= -0.0565 X(o=-0.056,f=-0.28) USER MOD Single : A 545 MET CE :methyl -134:sc= 0 (180deg=-0.105) USER MOD Single : A 546 GLN : amide:sc= -0.542 X(o=-0.54,f=-0.24) USER MOD Single : A 551 HIS : no HD1:sc= -1.99! C(o=-2!,f=-2.1!) USER MOD Single : A 558 ASN : amide:sc= -0.0942 K(o=-0.094,f=-1.3) USER MOD Single : A 560 MET CE :methyl -108:sc= -1.41 (180deg=-5.81!) USER MOD Single : A 567 SER OG : rot 180:sc= 0 USER MOD Single : A 571 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 575 THR OG1 : rot 180:sc= -0.274 USER MOD Single : A 576 HIS : no HD1:sc= -0.0963 X(o=-0.096,f=-0.071) USER MOD Single : A 577 HIS : no HD1:sc= -12.5! C(o=-13!,f=-17!) USER MOD Single : A 579 ASN :FLIP amide:sc= 0.252 F(o=-2.5,f=0.25) USER MOD Single : A 585 SER OG : rot -72:sc= 0.76 USER MOD Single : A 586 ASN : amide:sc=-0.000136 X(o=-0.00014,f=-0.042) USER MOD Single : A 587 TYR OH : rot 180:sc= 0 USER MOD Single : A 589 ASN : amide:sc= -0.412 X(o=-0.41,f=0) USER MOD Single : A 591 SER OG : rot 180:sc= 0 USER MOD Single : A 598 ASN : amide:sc= -0.279 K(o=-0.28,f=-2!) USER MOD Single : A 599 LYS NZ :NH3+ -175:sc= 1.14 (180deg=1.05) USER MOD Single : A 602 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 605 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 611 SER OG : rot 36:sc= 0.27 USER MOD Single : A 614 ASN :FLIP amide:sc= -3.7! C(o=-4.8!,f=-3.7!) USER MOD Single : A 623 MET CE :methyl -169:sc= -1.97 (180deg=-2.28) USER MOD Single : A 625 TYR OH : rot 150:sc= 0 USER MOD Single : A 626 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 627 SER OG : rot -49:sc= 0.617 USER MOD Single : A 634 LYS NZ :NH3+ 138:sc= -2 (180deg=-5.79!) USER MOD Single : A 637 SER OG : rot 180:sc= 0 USER MOD Single : A 638 MET CE :methyl -104:sc= -1.59 (180deg=-3.18!) USER MOD Single : A 642 THR OG1 : rot -109:sc= 0.372 USER MOD Single : A 644 GLN : amide:sc= -2.55! X(o=-2.6!,f=-3) USER MOD Single : A 648 GLN :FLIP amide:sc= -1.36 F(o=-2.3!,f=-1.4) USER MOD Single : A 650 LYS NZ :NH3+ 123:sc= -0.0737 (180deg=-0.596) 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 USER MOD Single : A 666 GLN : amide:sc= -0.128 K(o=-0.13,f=-2.2!) USER MOD Single : A 667 HIS : no HD1:sc= -4.15! C(o=-4.1!,f=-4.7!) USER MOD Single : A 673 SER OG : rot 8:sc= 0.188 USER MOD Single : A 676 SER OG : rot 10:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 542 1.782 4.048 5.550 1.00 10.25 N ATOM 2 CA GLY A 542 2.956 3.810 4.728 1.00 51.41 C ATOM 3 C GLY A 542 3.241 2.313 4.599 1.00 71.31 C ATOM 4 O GLY A 542 4.000 1.751 5.387 1.00 4.50 O ATOM 0 HA2 GLY A 542 2.805 4.242 3.739 1.00 51.41 H new ATOM 0 HA3 GLY A 542 3.819 4.312 5.166 1.00 51.41 H new ATOM 8 N PRO A 543 2.600 1.692 3.573 1.00 72.04 N ATOM 9 CA PRO A 543 2.777 0.270 3.330 1.00 13.32 C ATOM 10 C PRO A 543 4.140 -0.012 2.695 1.00 32.34 C ATOM 11 O PRO A 543 4.626 0.775 1.885 1.00 63.31 O ATOM 12 CB PRO A 543 1.612 -0.124 2.437 1.00 61.41 C ATOM 13 CG PRO A 543 1.091 1.170 1.834 1.00 5.54 C ATOM 14 CD PRO A 543 1.693 2.325 2.619 1.00 30.33 C ATOM 0 HA PRO A 543 2.774 -0.318 4.248 1.00 13.32 H new ATOM 0 HB2 PRO A 543 1.934 -0.816 1.658 1.00 61.41 H new ATOM 0 HB3 PRO A 543 0.834 -0.629 3.010 1.00 61.41 H new ATOM 0 HG2 PRO A 543 1.366 1.239 0.782 1.00 5.54 H new ATOM 0 HG3 PRO A 543 0.003 1.202 1.881 1.00 5.54 H new ATOM 0 HD2 PRO A 543 2.226 3.014 1.964 1.00 30.33 H new ATOM 0 HD3 PRO A 543 0.922 2.902 3.129 1.00 30.33 H new ATOM 22 N HIS A 544 4.718 -1.138 3.088 1.00 74.22 N ATOM 23 CA HIS A 544 6.015 -1.535 2.567 1.00 11.41 C ATOM 24 C HIS A 544 5.930 -2.955 2.004 1.00 53.53 C ATOM 25 O HIS A 544 6.952 -3.607 1.798 1.00 51.15 O ATOM 26 CB HIS A 544 7.098 -1.385 3.637 1.00 23.30 C ATOM 27 CG HIS A 544 7.496 0.045 3.913 1.00 42.23 C ATOM 28 ND1 HIS A 544 7.762 0.957 2.906 1.00 64.43 N ATOM 29 CD2 HIS A 544 7.669 0.711 5.090 1.00 1.14 C ATOM 30 CE1 HIS A 544 8.081 2.115 3.464 1.00 40.22 C ATOM 31 NE2 HIS A 544 8.023 1.961 4.818 1.00 62.22 N ATOM 0 H HIS A 544 4.312 -1.788 3.761 1.00 74.22 H new ATOM 0 HA HIS A 544 6.300 -0.874 1.748 1.00 11.41 H new ATOM 0 HB2 HIS A 544 6.744 -1.838 4.563 1.00 23.30 H new ATOM 0 HB3 HIS A 544 7.981 -1.943 3.326 1.00 23.30 H new ATOM 0 HD2 HIS A 544 7.540 0.292 6.077 1.00 1.14 H new ATOM 0 HE1 HIS A 544 8.341 3.022 2.939 1.00 40.22 H new ATOM 0 HE2 HIS A 544 8.219 2.687 5.508 1.00 62.22 H new ATOM 39 N MET A 545 4.701 -3.391 1.771 1.00 71.45 N ATOM 40 CA MET A 545 4.469 -4.722 1.235 1.00 54.01 C ATOM 41 C MET A 545 5.216 -5.779 2.050 1.00 21.30 C ATOM 42 O MET A 545 5.737 -6.744 1.493 1.00 43.04 O ATOM 43 CB MET A 545 4.936 -4.775 -0.221 1.00 72.10 C ATOM 44 CG MET A 545 3.812 -4.362 -1.173 1.00 14.40 C ATOM 45 SD MET A 545 4.278 -4.716 -2.859 1.00 42.21 S ATOM 46 CE MET A 545 3.907 -6.461 -2.923 1.00 44.33 C ATOM 0 H MET A 545 3.856 -2.847 1.943 1.00 71.45 H new ATOM 0 HA MET A 545 3.401 -4.935 1.291 1.00 54.01 H new ATOM 0 HB2 MET A 545 5.793 -4.115 -0.356 1.00 72.10 H new ATOM 0 HB3 MET A 545 5.270 -5.784 -0.463 1.00 72.10 H new ATOM 0 HG2 MET A 545 2.896 -4.896 -0.921 1.00 14.40 H new ATOM 0 HG3 MET A 545 3.602 -3.298 -1.061 1.00 14.40 H new ATOM 0 HE1 MET A 545 4.735 -6.992 -3.394 1.00 44.33 H new ATOM 0 HE2 MET A 545 3.762 -6.839 -1.911 1.00 44.33 H new ATOM 0 HE3 MET A 545 2.998 -6.619 -3.503 1.00 44.33 H new ATOM 56 N GLN A 546 5.245 -5.562 3.357 1.00 75.13 N ATOM 57 CA GLN A 546 5.919 -6.484 4.254 1.00 24.31 C ATOM 58 C GLN A 546 4.921 -7.088 5.244 1.00 2.12 C ATOM 59 O GLN A 546 3.850 -6.527 5.471 1.00 5.34 O ATOM 60 CB GLN A 546 7.069 -5.792 4.988 1.00 24.14 C ATOM 61 CG GLN A 546 8.273 -5.600 4.064 1.00 4.11 C ATOM 62 CD GLN A 546 9.192 -4.492 4.584 1.00 62.24 C ATOM 63 OE1 GLN A 546 9.761 -3.718 3.831 1.00 30.23 O ATOM 64 NE2 GLN A 546 9.305 -4.460 5.908 1.00 12.34 N ATOM 0 H GLN A 546 4.812 -4.760 3.816 1.00 75.13 H new ATOM 0 HA GLN A 546 6.345 -7.292 3.660 1.00 24.31 H new ATOM 0 HB2 GLN A 546 6.736 -4.824 5.363 1.00 24.14 H new ATOM 0 HB3 GLN A 546 7.362 -6.386 5.854 1.00 24.14 H new ATOM 0 HG2 GLN A 546 8.830 -6.534 3.988 1.00 4.11 H new ATOM 0 HG3 GLN A 546 7.929 -5.351 3.060 1.00 4.11 H new ATOM 0 HE21 GLN A 546 8.801 -5.138 6.479 1.00 12.34 H new ATOM 0 HE22 GLN A 546 9.896 -3.757 6.353 1.00 12.34 H new ATOM 73 N PHE A 547 5.307 -8.224 5.807 1.00 44.53 N ATOM 74 CA PHE A 547 4.460 -8.909 6.767 1.00 34.31 C ATOM 75 C PHE A 547 5.288 -9.813 7.683 1.00 51.13 C ATOM 76 O PHE A 547 5.601 -10.947 7.323 1.00 5.35 O ATOM 77 CB PHE A 547 3.484 -9.773 5.966 1.00 55.35 C ATOM 78 CG PHE A 547 3.064 -9.159 4.628 1.00 34.13 C ATOM 79 CD1 PHE A 547 3.957 -9.081 3.605 1.00 34.55 C ATOM 80 CD2 PHE A 547 1.797 -8.691 4.462 1.00 23.54 C ATOM 81 CE1 PHE A 547 3.567 -8.512 2.364 1.00 32.23 C ATOM 82 CE2 PHE A 547 1.408 -8.122 3.221 1.00 34.24 C ATOM 83 CZ PHE A 547 2.301 -8.045 2.198 1.00 15.55 C ATOM 0 H PHE A 547 6.196 -8.687 5.616 1.00 44.53 H new ATOM 0 HA PHE A 547 3.942 -8.181 7.391 1.00 34.31 H new ATOM 0 HB2 PHE A 547 3.942 -10.744 5.781 1.00 55.35 H new ATOM 0 HB3 PHE A 547 2.593 -9.951 6.568 1.00 55.35 H new ATOM 0 HD1 PHE A 547 4.963 -9.452 3.737 1.00 34.55 H new ATOM 0 HD2 PHE A 547 1.088 -8.752 5.274 1.00 23.54 H new ATOM 0 HE1 PHE A 547 4.276 -8.450 1.552 1.00 32.23 H new ATOM 0 HE2 PHE A 547 0.403 -7.750 3.089 1.00 34.24 H new ATOM 0 HZ PHE A 547 2.004 -7.613 1.254 1.00 15.55 H new ATOM 93 N PRO A 548 5.628 -9.262 8.879 1.00 35.51 N ATOM 94 CA PRO A 548 6.413 -10.006 9.849 1.00 63.21 C ATOM 95 C PRO A 548 5.563 -11.073 10.542 1.00 53.32 C ATOM 96 O PRO A 548 4.393 -10.840 10.844 1.00 44.51 O ATOM 97 CB PRO A 548 6.948 -8.957 10.809 1.00 5.35 C ATOM 98 CG PRO A 548 6.070 -7.731 10.619 1.00 45.44 C ATOM 99 CD PRO A 548 5.274 -7.923 9.339 1.00 52.45 C ATOM 0 HA PRO A 548 7.231 -10.562 9.390 1.00 63.21 H new ATOM 0 HB2 PRO A 548 6.905 -9.312 11.839 1.00 5.35 H new ATOM 0 HB3 PRO A 548 7.992 -8.727 10.594 1.00 5.35 H new ATOM 0 HG2 PRO A 548 5.400 -7.605 11.470 1.00 45.44 H new ATOM 0 HG3 PRO A 548 6.680 -6.830 10.558 1.00 45.44 H new ATOM 0 HD2 PRO A 548 4.203 -7.838 9.522 1.00 52.45 H new ATOM 0 HD3 PRO A 548 5.531 -7.168 8.596 1.00 52.45 H new ATOM 107 N VAL A 549 6.183 -12.220 10.774 1.00 62.14 N ATOM 108 CA VAL A 549 5.498 -13.323 11.425 1.00 32.24 C ATOM 109 C VAL A 549 4.873 -12.829 12.732 1.00 72.14 C ATOM 110 O VAL A 549 3.715 -13.128 13.022 1.00 5.12 O ATOM 111 CB VAL A 549 6.464 -14.492 11.630 1.00 73.15 C ATOM 112 CG1 VAL A 549 6.874 -15.105 10.289 1.00 51.21 C ATOM 113 CG2 VAL A 549 7.691 -14.055 12.431 1.00 23.34 C ATOM 0 H VAL A 549 7.153 -12.410 10.523 1.00 62.14 H new ATOM 0 HA VAL A 549 4.689 -13.694 10.796 1.00 32.24 H new ATOM 0 HB VAL A 549 5.945 -15.259 12.205 1.00 73.15 H new ATOM 0 HG11 VAL A 549 7.561 -15.934 10.462 1.00 51.21 H new ATOM 0 HG12 VAL A 549 5.988 -15.471 9.770 1.00 51.21 H new ATOM 0 HG13 VAL A 549 7.366 -14.348 9.678 1.00 51.21 H new ATOM 0 HG21 VAL A 549 8.361 -14.905 12.562 1.00 23.34 H new ATOM 0 HG22 VAL A 549 8.212 -13.262 11.895 1.00 23.34 H new ATOM 0 HG23 VAL A 549 7.376 -13.687 13.407 1.00 23.34 H new ATOM 123 N GLU A 550 5.666 -12.081 13.484 1.00 23.44 N ATOM 124 CA GLU A 550 5.205 -11.543 14.753 1.00 63.02 C ATOM 125 C GLU A 550 3.917 -10.742 14.553 1.00 43.23 C ATOM 126 O GLU A 550 3.128 -10.586 15.483 1.00 31.41 O ATOM 127 CB GLU A 550 6.288 -10.685 15.410 1.00 21.13 C ATOM 128 CG GLU A 550 6.800 -9.614 14.445 1.00 24.11 C ATOM 129 CD GLU A 550 7.327 -8.396 15.207 1.00 65.41 C ATOM 130 OE1 GLU A 550 6.547 -7.499 15.558 1.00 71.04 O ATOM 131 OE2 GLU A 550 8.597 -8.403 15.434 1.00 44.13 O ATOM 0 H GLU A 550 6.625 -11.834 13.239 1.00 23.44 H new ATOM 0 HA GLU A 550 4.991 -12.376 15.423 1.00 63.02 H new ATOM 0 HB2 GLU A 550 5.887 -10.211 16.306 1.00 21.13 H new ATOM 0 HB3 GLU A 550 7.116 -11.319 15.728 1.00 21.13 H new ATOM 0 HG2 GLU A 550 7.593 -10.029 13.823 1.00 24.11 H new ATOM 0 HG3 GLU A 550 5.996 -9.309 13.775 1.00 24.11 H new ATOM 139 N HIS A 551 3.745 -10.254 13.333 1.00 71.31 N ATOM 140 CA HIS A 551 2.566 -9.473 12.999 1.00 42.11 C ATOM 141 C HIS A 551 1.521 -10.376 12.342 1.00 70.44 C ATOM 142 O HIS A 551 0.331 -10.066 12.354 1.00 51.35 O ATOM 143 CB HIS A 551 2.940 -8.270 12.131 1.00 41.21 C ATOM 144 CG HIS A 551 3.513 -7.107 12.906 1.00 30.53 C ATOM 145 ND1 HIS A 551 3.678 -5.848 12.357 1.00 73.03 N ATOM 146 CD2 HIS A 551 3.956 -7.027 14.194 1.00 44.13 C ATOM 147 CE1 HIS A 551 4.198 -5.054 13.280 1.00 5.53 C ATOM 148 NE2 HIS A 551 4.371 -5.786 14.418 1.00 71.12 N ATOM 0 H HIS A 551 4.402 -10.384 12.564 1.00 71.31 H new ATOM 0 HA HIS A 551 2.124 -9.068 13.909 1.00 42.11 H new ATOM 0 HB2 HIS A 551 3.666 -8.587 11.382 1.00 41.21 H new ATOM 0 HB3 HIS A 551 2.054 -7.933 11.593 1.00 41.21 H new ATOM 0 HD2 HIS A 551 3.967 -7.836 14.910 1.00 44.13 H new ATOM 0 HE1 HIS A 551 4.442 -4.010 13.154 1.00 5.53 H new ATOM 0 HE2 HIS A 551 4.756 -5.437 15.296 1.00 71.12 H new ATOM 156 N VAL A 552 2.004 -11.477 11.784 1.00 53.24 N ATOM 157 CA VAL A 552 1.126 -12.428 11.123 1.00 41.35 C ATOM 158 C VAL A 552 0.630 -13.453 12.144 1.00 2.02 C ATOM 159 O VAL A 552 1.399 -14.293 12.609 1.00 31.21 O ATOM 160 CB VAL A 552 1.848 -13.068 9.935 1.00 11.00 C ATOM 161 CG1 VAL A 552 0.992 -14.166 9.300 1.00 12.42 C ATOM 162 CG2 VAL A 552 2.243 -12.013 8.900 1.00 52.21 C ATOM 0 H VAL A 552 2.992 -11.731 11.776 1.00 53.24 H new ATOM 0 HA VAL A 552 0.249 -11.922 10.719 1.00 41.35 H new ATOM 0 HB VAL A 552 2.762 -13.530 10.308 1.00 11.00 H new ATOM 0 HG11 VAL A 552 1.528 -14.604 8.458 1.00 12.42 H new ATOM 0 HG12 VAL A 552 0.784 -14.939 10.040 1.00 12.42 H new ATOM 0 HG13 VAL A 552 0.053 -13.738 8.949 1.00 12.42 H new ATOM 0 HG21 VAL A 552 2.754 -12.495 8.066 1.00 52.21 H new ATOM 0 HG22 VAL A 552 1.348 -11.509 8.535 1.00 52.21 H new ATOM 0 HG23 VAL A 552 2.908 -11.283 9.361 1.00 52.21 H new ATOM 172 N GLN A 553 -0.652 -13.350 12.464 1.00 65.24 N ATOM 173 CA GLN A 553 -1.259 -14.258 13.422 1.00 72.13 C ATOM 174 C GLN A 553 -1.971 -15.400 12.693 1.00 13.33 C ATOM 175 O GLN A 553 -2.134 -15.357 11.475 1.00 71.32 O ATOM 176 CB GLN A 553 -2.223 -13.513 14.348 1.00 25.40 C ATOM 177 CG GLN A 553 -2.541 -14.346 15.592 1.00 42.42 C ATOM 178 CD GLN A 553 -2.930 -13.447 16.768 1.00 63.42 C ATOM 179 OE1 GLN A 553 -2.257 -13.385 17.784 1.00 72.22 O ATOM 180 NE2 GLN A 553 -4.050 -12.757 16.574 1.00 61.11 N ATOM 0 H GLN A 553 -1.287 -12.652 12.077 1.00 65.24 H new ATOM 0 HA GLN A 553 -0.469 -14.684 14.041 1.00 72.13 H new ATOM 0 HB2 GLN A 553 -1.784 -12.561 14.646 1.00 25.40 H new ATOM 0 HB3 GLN A 553 -3.145 -13.286 13.813 1.00 25.40 H new ATOM 0 HG2 GLN A 553 -3.355 -15.037 15.373 1.00 42.42 H new ATOM 0 HG3 GLN A 553 -1.674 -14.949 15.862 1.00 42.42 H new ATOM 0 HE21 GLN A 553 -4.565 -12.856 15.699 1.00 61.11 H new ATOM 0 HE22 GLN A 553 -4.394 -12.129 17.300 1.00 61.11 H new ATOM 189 N LEU A 554 -2.377 -16.393 13.470 1.00 23.15 N ATOM 190 CA LEU A 554 -3.068 -17.544 12.914 1.00 23.25 C ATOM 191 C LEU A 554 -4.529 -17.524 13.367 1.00 30.03 C ATOM 192 O LEU A 554 -4.827 -17.801 14.528 1.00 23.22 O ATOM 193 CB LEU A 554 -2.331 -18.836 13.273 1.00 65.12 C ATOM 194 CG LEU A 554 -1.106 -19.169 12.418 1.00 40.21 C ATOM 195 CD1 LEU A 554 -0.855 -20.677 12.384 1.00 25.50 C ATOM 196 CD2 LEU A 554 -1.241 -18.579 11.013 1.00 54.51 C ATOM 0 H LEU A 554 -2.241 -16.424 14.480 1.00 23.15 H new ATOM 0 HA LEU A 554 -3.071 -17.497 11.825 1.00 23.25 H new ATOM 0 HB2 LEU A 554 -2.016 -18.774 14.315 1.00 65.12 H new ATOM 0 HB3 LEU A 554 -3.035 -19.665 13.202 1.00 65.12 H new ATOM 0 HG LEU A 554 -0.233 -18.707 12.879 1.00 40.21 H new ATOM 0 HD11 LEU A 554 0.021 -20.886 11.770 1.00 25.50 H new ATOM 0 HD12 LEU A 554 -0.683 -21.040 13.397 1.00 25.50 H new ATOM 0 HD13 LEU A 554 -1.724 -21.181 11.961 1.00 25.50 H new ATOM 0 HD21 LEU A 554 -0.357 -18.830 10.426 1.00 54.51 H new ATOM 0 HD22 LEU A 554 -2.127 -18.990 10.529 1.00 54.51 H new ATOM 0 HD23 LEU A 554 -1.335 -17.495 11.081 1.00 54.51 H new ATOM 208 N LEU A 555 -5.402 -17.193 12.427 1.00 30.42 N ATOM 209 CA LEU A 555 -6.825 -17.134 12.715 1.00 50.50 C ATOM 210 C LEU A 555 -7.575 -18.057 11.753 1.00 41.24 C ATOM 211 O LEU A 555 -7.020 -18.588 10.791 1.00 31.23 O ATOM 212 CB LEU A 555 -7.317 -15.685 12.686 1.00 20.03 C ATOM 213 CG LEU A 555 -6.393 -14.650 13.332 1.00 73.11 C ATOM 214 CD1 LEU A 555 -5.043 -14.596 12.614 1.00 75.41 C ATOM 215 CD2 LEU A 555 -7.066 -13.277 13.392 1.00 24.01 C ATOM 0 H LEU A 555 -5.151 -16.963 11.465 1.00 30.42 H new ATOM 0 HA LEU A 555 -7.025 -17.495 13.724 1.00 50.50 H new ATOM 0 HB2 LEU A 555 -7.481 -15.398 11.647 1.00 20.03 H new ATOM 0 HB3 LEU A 555 -8.285 -15.641 13.185 1.00 20.03 H new ATOM 0 HG LEU A 555 -6.199 -14.959 14.359 1.00 73.11 H new ATOM 0 HD11 LEU A 555 -4.406 -13.853 13.093 1.00 75.41 H new ATOM 0 HD12 LEU A 555 -4.563 -15.573 12.667 1.00 75.41 H new ATOM 0 HD13 LEU A 555 -5.197 -14.323 11.570 1.00 75.41 H new ATOM 0 HD21 LEU A 555 -6.389 -12.560 13.855 1.00 24.01 H new ATOM 0 HD22 LEU A 555 -7.309 -12.947 12.382 1.00 24.01 H new ATOM 0 HD23 LEU A 555 -7.980 -13.345 13.981 1.00 24.01 H new ATOM 227 N CYS A 556 -8.861 -18.237 12.035 1.00 34.51 N ATOM 228 CA CYS A 556 -9.713 -19.090 11.214 1.00 44.50 C ATOM 229 C CYS A 556 -10.513 -18.259 10.215 1.00 13.02 C ATOM 230 O CYS A 556 -11.463 -17.587 10.616 1.00 44.05 O ATOM 231 CB CYS A 556 -10.663 -19.900 12.097 1.00 0.02 C ATOM 232 SG CYS A 556 -11.525 -21.245 11.222 1.00 72.41 S ATOM 0 H CYS A 556 -9.336 -17.803 12.826 1.00 34.51 H new ATOM 0 HA CYS A 556 -9.072 -19.775 10.659 1.00 44.50 H new ATOM 0 HB2 CYS A 556 -10.098 -20.324 12.927 1.00 0.02 H new ATOM 0 HB3 CYS A 556 -11.405 -19.227 12.528 1.00 0.02 H new ATOM 237 N ILE A 557 -10.118 -18.322 8.952 1.00 0.32 N ATOM 238 CA ILE A 557 -10.806 -17.572 7.915 1.00 44.13 C ATOM 239 C ILE A 557 -12.307 -17.563 8.208 1.00 72.32 C ATOM 240 O ILE A 557 -12.996 -16.590 7.907 1.00 54.10 O ATOM 241 CB ILE A 557 -10.452 -18.123 6.532 1.00 50.12 C ATOM 242 CG1 ILE A 557 -11.436 -19.216 6.109 1.00 25.23 C ATOM 243 CG2 ILE A 557 -9.002 -18.609 6.490 1.00 42.14 C ATOM 244 CD1 ILE A 557 -11.233 -19.599 4.642 1.00 64.00 C ATOM 0 H ILE A 557 -9.330 -18.881 8.623 1.00 0.32 H new ATOM 0 HA ILE A 557 -10.476 -16.533 7.913 1.00 44.13 H new ATOM 0 HB ILE A 557 -10.541 -17.313 5.808 1.00 50.12 H new ATOM 0 HG12 ILE A 557 -11.302 -20.095 6.740 1.00 25.23 H new ATOM 0 HG13 ILE A 557 -12.458 -18.868 6.260 1.00 25.23 H new ATOM 0 HG21 ILE A 557 -8.776 -18.996 5.496 1.00 42.14 H new ATOM 0 HG22 ILE A 557 -8.333 -17.779 6.717 1.00 42.14 H new ATOM 0 HG23 ILE A 557 -8.862 -19.400 7.227 1.00 42.14 H new ATOM 0 HD11 ILE A 557 -11.945 -20.377 4.367 1.00 64.00 H new ATOM 0 HD12 ILE A 557 -11.392 -18.724 4.012 1.00 64.00 H new ATOM 0 HD13 ILE A 557 -10.218 -19.969 4.500 1.00 64.00 H new ATOM 256 N ASN A 558 -12.770 -18.659 8.791 1.00 30.03 N ATOM 257 CA ASN A 558 -14.177 -18.790 9.128 1.00 13.04 C ATOM 258 C ASN A 558 -14.440 -18.113 10.475 1.00 1.01 C ATOM 259 O ASN A 558 -15.372 -17.321 10.605 1.00 72.24 O ATOM 260 CB ASN A 558 -14.579 -20.261 9.252 1.00 14.14 C ATOM 261 CG ASN A 558 -15.041 -20.819 7.905 1.00 53.44 C ATOM 262 OD1 ASN A 558 -14.736 -20.291 6.848 1.00 53.13 O ATOM 263 ND2 ASN A 558 -15.792 -21.912 8.000 1.00 32.14 N ATOM 0 H ASN A 558 -12.195 -19.465 9.039 1.00 30.03 H new ATOM 0 HA ASN A 558 -14.759 -18.323 8.333 1.00 13.04 H new ATOM 0 HB2 ASN A 558 -13.734 -20.843 9.620 1.00 14.14 H new ATOM 0 HB3 ASN A 558 -15.379 -20.362 9.985 1.00 14.14 H new ATOM 0 HD21 ASN A 558 -16.150 -22.360 7.156 1.00 32.14 H new ATOM 0 HD22 ASN A 558 -16.010 -22.303 8.917 1.00 32.14 H new ATOM 270 N CYS A 559 -13.601 -18.449 11.444 1.00 60.31 N ATOM 271 CA CYS A 559 -13.731 -17.884 12.776 1.00 4.20 C ATOM 272 C CYS A 559 -12.410 -17.201 13.139 1.00 72.42 C ATOM 273 O CYS A 559 -11.672 -17.686 13.995 1.00 1.43 O ATOM 274 CB CYS A 559 -14.126 -18.945 13.805 1.00 53.21 C ATOM 275 SG CYS A 559 -15.348 -20.171 13.211 1.00 23.44 S ATOM 0 H CYS A 559 -12.828 -19.106 11.333 1.00 60.31 H new ATOM 0 HA CYS A 559 -14.535 -17.148 12.784 1.00 4.20 H new ATOM 0 HB2 CYS A 559 -13.228 -19.473 14.125 1.00 53.21 H new ATOM 0 HB3 CYS A 559 -14.532 -18.445 14.685 1.00 53.21 H new ATOM 280 N MET A 560 -12.153 -16.088 12.469 1.00 41.40 N ATOM 281 CA MET A 560 -10.934 -15.334 12.710 1.00 13.21 C ATOM 282 C MET A 560 -10.876 -14.834 14.155 1.00 43.20 C ATOM 283 O MET A 560 -11.043 -13.642 14.411 1.00 61.35 O ATOM 284 CB MET A 560 -10.874 -14.141 11.754 1.00 12.11 C ATOM 285 CG MET A 560 -10.988 -14.599 10.299 1.00 52.55 C ATOM 286 SD MET A 560 -11.683 -13.292 9.300 1.00 11.04 S ATOM 287 CE MET A 560 -13.283 -13.996 8.938 1.00 64.33 C ATOM 0 H MET A 560 -12.768 -15.690 11.759 1.00 41.40 H new ATOM 0 HA MET A 560 -10.082 -15.992 12.538 1.00 13.21 H new ATOM 0 HB2 MET A 560 -11.681 -13.445 11.984 1.00 12.11 H new ATOM 0 HB3 MET A 560 -9.937 -13.602 11.897 1.00 12.11 H new ATOM 0 HG2 MET A 560 -10.005 -14.875 9.918 1.00 52.55 H new ATOM 0 HG3 MET A 560 -11.615 -15.488 10.237 1.00 52.55 H new ATOM 0 HE1 MET A 560 -13.318 -14.301 7.892 1.00 64.33 H new ATOM 0 HE2 MET A 560 -13.451 -14.865 9.575 1.00 64.33 H new ATOM 0 HE3 MET A 560 -14.058 -13.253 9.126 1.00 64.33 H new ATOM 297 N VAL A 561 -10.638 -15.770 15.062 1.00 2.31 N ATOM 298 CA VAL A 561 -10.555 -15.439 16.475 1.00 40.04 C ATOM 299 C VAL A 561 -9.110 -15.605 16.949 1.00 20.31 C ATOM 300 O VAL A 561 -8.774 -15.229 18.071 1.00 41.22 O ATOM 301 CB VAL A 561 -11.547 -16.290 17.270 1.00 12.33 C ATOM 302 CG1 VAL A 561 -12.796 -16.595 16.441 1.00 52.50 C ATOM 303 CG2 VAL A 561 -10.890 -17.579 17.766 1.00 64.22 C ATOM 0 H VAL A 561 -10.500 -16.757 14.846 1.00 2.31 H new ATOM 0 HA VAL A 561 -10.834 -14.398 16.641 1.00 40.04 H new ATOM 0 HB VAL A 561 -11.857 -15.715 18.143 1.00 12.33 H new ATOM 0 HG11 VAL A 561 -13.484 -17.201 17.030 1.00 52.50 H new ATOM 0 HG12 VAL A 561 -13.283 -15.661 16.161 1.00 52.50 H new ATOM 0 HG13 VAL A 561 -12.511 -17.140 15.541 1.00 52.50 H new ATOM 0 HG21 VAL A 561 -11.617 -18.165 18.328 1.00 64.22 H new ATOM 0 HG22 VAL A 561 -10.537 -18.159 16.913 1.00 64.22 H new ATOM 0 HG23 VAL A 561 -10.046 -17.333 18.411 1.00 64.22 H new ATOM 313 N ALA A 562 -8.294 -16.170 16.071 1.00 2.32 N ATOM 314 CA ALA A 562 -6.893 -16.391 16.386 1.00 3.43 C ATOM 315 C ALA A 562 -6.756 -17.673 17.210 1.00 45.31 C ATOM 316 O ALA A 562 -7.120 -17.702 18.384 1.00 35.42 O ATOM 317 CB ALA A 562 -6.334 -15.167 17.115 1.00 11.22 C ATOM 0 H ALA A 562 -8.576 -16.481 15.142 1.00 2.32 H new ATOM 0 HA ALA A 562 -6.311 -16.521 15.474 1.00 3.43 H new ATOM 0 HB1 ALA A 562 -5.283 -15.333 17.351 1.00 11.22 H new ATOM 0 HB2 ALA A 562 -6.428 -14.289 16.476 1.00 11.22 H new ATOM 0 HB3 ALA A 562 -6.892 -15.006 18.037 1.00 11.22 H new ATOM 323 N VAL A 563 -6.228 -18.701 16.562 1.00 55.14 N ATOM 324 CA VAL A 563 -6.039 -19.983 17.219 1.00 4.43 C ATOM 325 C VAL A 563 -4.551 -20.184 17.515 1.00 40.12 C ATOM 326 O VAL A 563 -4.174 -21.126 18.210 1.00 74.54 O ATOM 327 CB VAL A 563 -6.635 -21.103 16.365 1.00 54.21 C ATOM 328 CG1 VAL A 563 -8.129 -21.272 16.649 1.00 72.33 C ATOM 329 CG2 VAL A 563 -6.385 -20.850 14.877 1.00 51.12 C ATOM 0 H VAL A 563 -5.925 -18.672 15.588 1.00 55.14 H new ATOM 0 HA VAL A 563 -6.567 -20.005 18.172 1.00 4.43 H new ATOM 0 HB VAL A 563 -6.135 -22.033 16.635 1.00 54.21 H new ATOM 0 HG11 VAL A 563 -8.529 -22.074 16.029 1.00 72.33 H new ATOM 0 HG12 VAL A 563 -8.274 -21.519 17.701 1.00 72.33 H new ATOM 0 HG13 VAL A 563 -8.650 -20.343 16.420 1.00 72.33 H new ATOM 0 HG21 VAL A 563 -6.819 -21.661 14.292 1.00 51.12 H new ATOM 0 HG22 VAL A 563 -6.846 -19.906 14.586 1.00 51.12 H new ATOM 0 HG23 VAL A 563 -5.312 -20.802 14.691 1.00 51.12 H new ATOM 339 N GLY A 564 -3.745 -19.283 16.972 1.00 14.32 N ATOM 340 CA GLY A 564 -2.307 -19.350 17.169 1.00 53.51 C ATOM 341 C GLY A 564 -1.619 -18.102 16.612 1.00 51.41 C ATOM 342 O GLY A 564 -2.205 -17.020 16.597 1.00 62.14 O ATOM 0 H GLY A 564 -4.061 -18.503 16.396 1.00 14.32 H new ATOM 0 HA2 GLY A 564 -2.086 -19.448 18.232 1.00 53.51 H new ATOM 0 HA3 GLY A 564 -1.910 -20.238 16.678 1.00 53.51 H new ATOM 346 N HIS A 565 -0.386 -18.293 16.168 1.00 23.50 N ATOM 347 CA HIS A 565 0.388 -17.197 15.612 1.00 45.14 C ATOM 348 C HIS A 565 1.249 -17.711 14.456 1.00 63.01 C ATOM 349 O HIS A 565 1.716 -18.849 14.483 1.00 53.13 O ATOM 350 CB HIS A 565 1.210 -16.505 16.701 1.00 43.33 C ATOM 351 CG HIS A 565 0.385 -15.969 17.846 1.00 34.32 C ATOM 352 ND1 HIS A 565 -0.356 -16.786 18.683 1.00 61.45 N ATOM 353 CD2 HIS A 565 0.192 -14.693 18.285 1.00 14.53 C ATOM 354 CE1 HIS A 565 -0.964 -16.025 19.580 1.00 0.11 C ATOM 355 NE2 HIS A 565 -0.624 -14.728 19.332 1.00 41.50 N ATOM 0 H HIS A 565 0.097 -19.191 16.182 1.00 23.50 H new ATOM 0 HA HIS A 565 -0.285 -16.440 15.209 1.00 45.14 H new ATOM 0 HB2 HIS A 565 1.942 -17.211 17.093 1.00 43.33 H new ATOM 0 HB3 HIS A 565 1.769 -15.683 16.253 1.00 43.33 H new ATOM 0 HD2 HIS A 565 0.629 -13.804 17.854 1.00 14.53 H new ATOM 0 HE1 HIS A 565 -1.615 -16.371 20.369 1.00 0.11 H new ATOM 0 HE2 HIS A 565 -0.944 -13.918 19.863 1.00 41.50 H new ATOM 363 N GLY A 566 1.434 -16.848 13.468 1.00 13.51 N ATOM 364 CA GLY A 566 2.230 -17.200 12.305 1.00 41.20 C ATOM 365 C GLY A 566 3.699 -17.396 12.685 1.00 20.53 C ATOM 366 O GLY A 566 4.433 -18.105 11.997 1.00 13.43 O ATOM 0 H GLY A 566 1.046 -15.905 13.449 1.00 13.51 H new ATOM 0 HA2 GLY A 566 1.841 -18.115 11.857 1.00 41.20 H new ATOM 0 HA3 GLY A 566 2.147 -16.416 11.552 1.00 41.20 H new ATOM 370 N SER A 567 4.084 -16.757 13.780 1.00 64.11 N ATOM 371 CA SER A 567 5.453 -16.853 14.260 1.00 55.20 C ATOM 372 C SER A 567 5.545 -17.899 15.373 1.00 55.21 C ATOM 373 O SER A 567 6.583 -18.035 16.017 1.00 24.12 O ATOM 374 CB SER A 567 5.956 -15.498 14.762 1.00 61.11 C ATOM 375 OG SER A 567 5.710 -15.320 16.154 1.00 1.41 O ATOM 0 H SER A 567 3.473 -16.171 14.348 1.00 64.11 H new ATOM 0 HA SER A 567 6.087 -17.160 13.428 1.00 55.20 H new ATOM 0 HB2 SER A 567 7.026 -15.414 14.569 1.00 61.11 H new ATOM 0 HB3 SER A 567 5.468 -14.700 14.203 1.00 61.11 H new ATOM 0 HG SER A 567 6.047 -14.444 16.436 1.00 1.41 H new ATOM 381 N ASP A 568 4.444 -18.611 15.564 1.00 13.35 N ATOM 382 CA ASP A 568 4.387 -19.640 16.588 1.00 30.23 C ATOM 383 C ASP A 568 4.293 -21.013 15.920 1.00 75.30 C ATOM 384 O ASP A 568 4.551 -22.035 16.554 1.00 73.21 O ATOM 385 CB ASP A 568 3.157 -19.463 17.480 1.00 14.11 C ATOM 386 CG ASP A 568 3.320 -18.447 18.613 1.00 72.23 C ATOM 387 OD1 ASP A 568 4.140 -17.521 18.527 1.00 61.31 O ATOM 388 OD2 ASP A 568 2.551 -18.638 19.631 1.00 54.53 O ATOM 0 H ASP A 568 3.585 -18.495 15.027 1.00 13.35 H new ATOM 0 HA ASP A 568 5.288 -19.560 17.197 1.00 30.23 H new ATOM 0 HB2 ASP A 568 2.316 -19.158 16.857 1.00 14.11 H new ATOM 0 HB3 ASP A 568 2.899 -20.429 17.913 1.00 14.11 H new ATOM 394 N LEU A 569 3.922 -20.993 14.648 1.00 12.42 N ATOM 395 CA LEU A 569 3.790 -22.223 13.887 1.00 60.30 C ATOM 396 C LEU A 569 5.141 -22.579 13.263 1.00 21.35 C ATOM 397 O LEU A 569 6.072 -21.776 13.291 1.00 63.22 O ATOM 398 CB LEU A 569 2.655 -22.104 12.868 1.00 32.22 C ATOM 399 CG LEU A 569 2.742 -20.921 11.902 1.00 62.22 C ATOM 400 CD1 LEU A 569 4.193 -20.644 11.504 1.00 62.40 C ATOM 401 CD2 LEU A 569 1.846 -21.142 10.682 1.00 74.41 C ATOM 0 H LEU A 569 3.709 -20.143 14.125 1.00 12.42 H new ATOM 0 HA LEU A 569 3.513 -23.048 14.543 1.00 60.30 H new ATOM 0 HB2 LEU A 569 2.621 -23.023 12.283 1.00 32.22 H new ATOM 0 HB3 LEU A 569 1.712 -22.036 13.410 1.00 32.22 H new ATOM 0 HG LEU A 569 2.373 -20.033 12.416 1.00 62.22 H new ATOM 0 HD11 LEU A 569 4.227 -19.798 10.817 1.00 62.40 H new ATOM 0 HD12 LEU A 569 4.777 -20.411 12.395 1.00 62.40 H new ATOM 0 HD13 LEU A 569 4.611 -21.525 11.016 1.00 62.40 H new ATOM 0 HD21 LEU A 569 1.927 -20.286 10.012 1.00 74.41 H new ATOM 0 HD22 LEU A 569 2.161 -22.044 10.158 1.00 74.41 H new ATOM 0 HD23 LEU A 569 0.811 -21.253 11.006 1.00 74.41 H new ATOM 413 N ARG A 570 5.205 -23.784 12.716 1.00 60.10 N ATOM 414 CA ARG A 570 6.427 -24.256 12.087 1.00 74.43 C ATOM 415 C ARG A 570 6.105 -25.320 11.035 1.00 60.10 C ATOM 416 O ARG A 570 4.958 -25.747 10.909 1.00 24.14 O ATOM 417 CB ARG A 570 7.387 -24.846 13.122 1.00 71.15 C ATOM 418 CG ARG A 570 7.250 -24.130 14.467 1.00 61.31 C ATOM 419 CD ARG A 570 8.099 -24.815 15.541 1.00 54.53 C ATOM 420 NE ARG A 570 7.841 -24.195 16.860 1.00 45.22 N ATOM 421 CZ ARG A 570 8.484 -24.540 17.996 1.00 14.32 C ATOM 422 NH1 ARG A 570 9.428 -25.504 17.984 1.00 61.33 N ATOM 423 NH2 ARG A 570 8.174 -23.920 19.120 1.00 51.13 N ATOM 0 H ARG A 570 4.431 -24.448 12.695 1.00 60.10 H new ATOM 0 HA ARG A 570 6.906 -23.401 11.610 1.00 74.43 H new ATOM 0 HB2 ARG A 570 7.182 -25.909 13.249 1.00 71.15 H new ATOM 0 HB3 ARG A 570 8.413 -24.760 12.763 1.00 71.15 H new ATOM 0 HG2 ARG A 570 7.559 -23.090 14.363 1.00 61.31 H new ATOM 0 HG3 ARG A 570 6.204 -24.123 14.775 1.00 61.31 H new ATOM 0 HD2 ARG A 570 7.865 -25.879 15.578 1.00 54.53 H new ATOM 0 HD3 ARG A 570 9.156 -24.730 15.290 1.00 54.53 H new ATOM 0 HE ARG A 570 7.134 -23.462 16.914 1.00 45.22 H new ATOM 0 HH11 ARG A 570 9.661 -25.979 17.112 1.00 61.33 H new ATOM 0 HH12 ARG A 570 9.909 -25.758 18.847 1.00 61.33 H new ATOM 0 HH21 ARG A 570 7.459 -23.193 19.121 1.00 51.13 H new ATOM 0 HH22 ARG A 570 8.650 -24.168 19.987 1.00 51.13 H new ATOM 436 N LYS A 571 7.138 -25.717 10.306 1.00 32.33 N ATOM 437 CA LYS A 571 6.980 -26.723 9.269 1.00 14.15 C ATOM 438 C LYS A 571 7.687 -28.009 9.701 1.00 73.43 C ATOM 439 O LYS A 571 8.887 -28.002 9.970 1.00 51.10 O ATOM 440 CB LYS A 571 7.457 -26.181 7.920 1.00 32.45 C ATOM 441 CG LYS A 571 6.304 -25.535 7.150 1.00 14.43 C ATOM 442 CD LYS A 571 6.689 -25.290 5.690 1.00 52.20 C ATOM 443 CE LYS A 571 7.970 -24.460 5.593 1.00 44.03 C ATOM 444 NZ LYS A 571 8.312 -24.198 4.177 1.00 61.14 N ATOM 0 H LYS A 571 8.088 -25.360 10.413 1.00 32.33 H new ATOM 0 HA LYS A 571 5.927 -26.969 9.133 1.00 14.15 H new ATOM 0 HB2 LYS A 571 8.249 -25.449 8.078 1.00 32.45 H new ATOM 0 HB3 LYS A 571 7.885 -26.991 7.329 1.00 32.45 H new ATOM 0 HG2 LYS A 571 5.426 -26.179 7.195 1.00 14.43 H new ATOM 0 HG3 LYS A 571 6.031 -24.591 7.621 1.00 14.43 H new ATOM 0 HD2 LYS A 571 6.830 -26.244 5.182 1.00 52.20 H new ATOM 0 HD3 LYS A 571 5.877 -24.774 5.178 1.00 52.20 H new ATOM 0 HE2 LYS A 571 7.840 -23.516 6.122 1.00 44.03 H new ATOM 0 HE3 LYS A 571 8.790 -24.988 6.080 1.00 44.03 H new ATOM 0 HZ1 LYS A 571 9.184 -23.633 4.129 1.00 61.14 H new ATOM 0 HZ2 LYS A 571 8.457 -25.101 3.682 1.00 61.14 H new ATOM 0 HZ3 LYS A 571 7.536 -23.675 3.723 1.00 61.14 H new ATOM 457 N VAL A 572 6.913 -29.083 9.753 1.00 74.32 N ATOM 458 CA VAL A 572 7.450 -30.375 10.147 1.00 52.33 C ATOM 459 C VAL A 572 8.216 -30.984 8.971 1.00 51.34 C ATOM 460 O VAL A 572 7.633 -31.264 7.924 1.00 24.22 O ATOM 461 CB VAL A 572 6.324 -31.276 10.658 1.00 60.02 C ATOM 462 CG1 VAL A 572 6.684 -32.753 10.487 1.00 20.21 C ATOM 463 CG2 VAL A 572 5.987 -30.959 12.116 1.00 12.40 C ATOM 0 H VAL A 572 5.918 -29.085 9.529 1.00 74.32 H new ATOM 0 HA VAL A 572 8.155 -30.261 10.970 1.00 52.33 H new ATOM 0 HB VAL A 572 5.436 -31.076 10.058 1.00 60.02 H new ATOM 0 HG11 VAL A 572 5.867 -33.372 10.858 1.00 20.21 H new ATOM 0 HG12 VAL A 572 6.851 -32.967 9.431 1.00 20.21 H new ATOM 0 HG13 VAL A 572 7.591 -32.974 11.050 1.00 20.21 H new ATOM 0 HG21 VAL A 572 5.184 -31.613 12.454 1.00 12.40 H new ATOM 0 HG22 VAL A 572 6.869 -31.117 12.736 1.00 12.40 H new ATOM 0 HG23 VAL A 572 5.667 -29.920 12.198 1.00 12.40 H new ATOM 473 N GLU A 573 9.510 -31.170 9.182 1.00 25.41 N ATOM 474 CA GLU A 573 10.362 -31.741 8.153 1.00 44.04 C ATOM 475 C GLU A 573 10.047 -31.112 6.794 1.00 41.01 C ATOM 476 O GLU A 573 10.106 -31.785 5.766 1.00 52.31 O ATOM 477 CB GLU A 573 10.214 -33.263 8.100 1.00 43.23 C ATOM 478 CG GLU A 573 8.817 -33.662 7.620 1.00 1.55 C ATOM 479 CD GLU A 573 8.789 -35.123 7.168 1.00 50.35 C ATOM 480 OE1 GLU A 573 9.843 -35.694 6.850 1.00 10.23 O ATOM 481 OE2 GLU A 573 7.619 -35.667 7.153 1.00 43.42 O ATOM 0 H GLU A 573 9.990 -30.935 10.051 1.00 25.41 H new ATOM 0 HA GLU A 573 11.399 -31.519 8.403 1.00 44.04 H new ATOM 0 HB2 GLU A 573 10.966 -33.682 7.431 1.00 43.23 H new ATOM 0 HB3 GLU A 573 10.397 -33.684 9.089 1.00 43.23 H new ATOM 0 HG2 GLU A 573 8.096 -33.512 8.424 1.00 1.55 H new ATOM 0 HG3 GLU A 573 8.514 -33.017 6.796 1.00 1.55 H new ATOM 489 N GLY A 574 9.720 -29.829 6.833 1.00 15.24 N ATOM 490 CA GLY A 574 9.395 -29.102 5.618 1.00 11.51 C ATOM 491 C GLY A 574 8.409 -29.891 4.754 1.00 44.54 C ATOM 492 O GLY A 574 8.607 -30.027 3.547 1.00 3.42 O ATOM 0 H GLY A 574 9.673 -29.274 7.687 1.00 15.24 H new ATOM 0 HA2 GLY A 574 8.966 -28.133 5.873 1.00 11.51 H new ATOM 0 HA3 GLY A 574 10.306 -28.908 5.052 1.00 11.51 H new ATOM 496 N THR A 575 7.369 -30.390 5.404 1.00 10.23 N ATOM 497 CA THR A 575 6.352 -31.162 4.710 1.00 2.42 C ATOM 498 C THR A 575 5.019 -30.411 4.712 1.00 42.22 C ATOM 499 O THR A 575 4.469 -30.114 3.653 1.00 54.03 O ATOM 500 CB THR A 575 6.274 -32.540 5.369 1.00 72.54 C ATOM 501 OG1 THR A 575 7.313 -33.285 4.739 1.00 32.32 O ATOM 502 CG2 THR A 575 4.996 -33.295 4.996 1.00 21.41 C ATOM 0 H THR A 575 7.208 -30.275 6.405 1.00 10.23 H new ATOM 0 HA THR A 575 6.609 -31.302 3.660 1.00 2.42 H new ATOM 0 HB THR A 575 6.327 -32.428 6.452 1.00 72.54 H new ATOM 0 HG1 THR A 575 7.335 -34.192 5.108 1.00 32.32 H new ATOM 0 HG21 THR A 575 4.990 -34.267 5.490 1.00 21.41 H new ATOM 0 HG22 THR A 575 4.127 -32.720 5.316 1.00 21.41 H new ATOM 0 HG23 THR A 575 4.959 -33.437 3.916 1.00 21.41 H new ATOM 510 N HIS A 576 4.539 -30.125 5.913 1.00 31.21 N ATOM 511 CA HIS A 576 3.281 -29.415 6.067 1.00 53.35 C ATOM 512 C HIS A 576 3.410 -28.378 7.184 1.00 10.30 C ATOM 513 O HIS A 576 4.162 -28.577 8.137 1.00 42.23 O ATOM 514 CB HIS A 576 2.128 -30.394 6.297 1.00 63.20 C ATOM 515 CG HIS A 576 1.603 -31.033 5.033 1.00 1.23 C ATOM 516 ND1 HIS A 576 1.390 -32.395 4.914 1.00 31.14 N ATOM 517 CD2 HIS A 576 1.250 -30.482 3.837 1.00 50.14 C ATOM 518 CE1 HIS A 576 0.930 -32.642 3.697 1.00 42.24 C ATOM 519 NE2 HIS A 576 0.845 -31.455 3.030 1.00 53.10 N ATOM 0 H HIS A 576 4.999 -30.372 6.789 1.00 31.21 H new ATOM 0 HA HIS A 576 3.047 -28.880 5.147 1.00 53.35 H new ATOM 0 HB2 HIS A 576 2.461 -31.178 6.977 1.00 63.20 H new ATOM 0 HB3 HIS A 576 1.312 -29.868 6.792 1.00 63.20 H new ATOM 0 HD2 HIS A 576 1.293 -29.432 3.588 1.00 50.14 H new ATOM 0 HE1 HIS A 576 0.668 -33.612 3.302 1.00 42.24 H new ATOM 0 HE2 HIS A 576 0.523 -31.335 2.070 1.00 53.10 H new ATOM 527 N HIS A 577 2.665 -27.293 7.030 1.00 33.22 N ATOM 528 CA HIS A 577 2.686 -26.224 8.014 1.00 24.44 C ATOM 529 C HIS A 577 1.923 -26.663 9.266 1.00 62.44 C ATOM 530 O HIS A 577 0.695 -26.738 9.254 1.00 25.30 O ATOM 531 CB HIS A 577 2.146 -24.924 7.416 1.00 2.01 C ATOM 532 CG HIS A 577 2.908 -24.443 6.204 1.00 13.20 C ATOM 533 ND1 HIS A 577 3.564 -23.225 6.166 1.00 62.02 N ATOM 534 CD2 HIS A 577 3.111 -25.028 4.989 1.00 72.12 C ATOM 535 CE1 HIS A 577 4.132 -23.093 4.976 1.00 24.33 C ATOM 536 NE2 HIS A 577 3.850 -24.212 4.248 1.00 12.51 N ATOM 0 H HIS A 577 2.043 -27.131 6.238 1.00 33.22 H new ATOM 0 HA HIS A 577 3.715 -26.019 8.311 1.00 24.44 H new ATOM 0 HB2 HIS A 577 1.101 -25.069 7.142 1.00 2.01 H new ATOM 0 HB3 HIS A 577 2.170 -24.147 8.180 1.00 2.01 H new ATOM 0 HD2 HIS A 577 2.734 -25.992 4.682 1.00 72.12 H new ATOM 0 HE1 HIS A 577 4.716 -22.248 4.641 1.00 24.33 H new ATOM 0 HE2 HIS A 577 4.157 -24.392 3.292 1.00 12.51 H new ATOM 544 N VAL A 578 2.682 -26.942 10.315 1.00 22.31 N ATOM 545 CA VAL A 578 2.093 -27.372 11.572 1.00 52.11 C ATOM 546 C VAL A 578 2.263 -26.265 12.615 1.00 73.24 C ATOM 547 O VAL A 578 3.384 -25.866 12.924 1.00 22.25 O ATOM 548 CB VAL A 578 2.706 -28.704 12.009 1.00 75.12 C ATOM 549 CG1 VAL A 578 2.295 -29.833 11.062 1.00 73.32 C ATOM 550 CG2 VAL A 578 4.229 -28.600 12.110 1.00 34.01 C ATOM 0 H VAL A 578 3.700 -26.879 10.321 1.00 22.31 H new ATOM 0 HA VAL A 578 1.023 -27.545 11.453 1.00 52.11 H new ATOM 0 HB VAL A 578 2.320 -28.941 13.001 1.00 75.12 H new ATOM 0 HG11 VAL A 578 2.744 -30.769 11.395 1.00 73.32 H new ATOM 0 HG12 VAL A 578 1.209 -29.931 11.062 1.00 73.32 H new ATOM 0 HG13 VAL A 578 2.638 -29.605 10.053 1.00 73.32 H new ATOM 0 HG21 VAL A 578 4.639 -29.560 12.422 1.00 34.01 H new ATOM 0 HG22 VAL A 578 4.640 -28.329 11.138 1.00 34.01 H new ATOM 0 HG23 VAL A 578 4.494 -27.837 12.842 1.00 34.01 H new ATOM 560 N ASN A 579 1.133 -25.801 13.127 1.00 12.51 N ATOM 561 CA ASN A 579 1.142 -24.748 14.128 1.00 4.35 C ATOM 562 C ASN A 579 1.159 -25.376 15.523 1.00 30.52 C ATOM 563 O ASN A 579 0.250 -26.123 15.882 1.00 31.22 O ATOM 564 CB ASN A 579 -0.108 -23.872 14.019 1.00 24.44 C ATOM 565 CG ASN A 579 -0.280 -23.004 15.267 1.00 23.13 C ATOM 566 OD1 ASN A 579 0.856 -22.489 15.729 1.00 45.54 O flip ATOM 567 ND2 ASN A 579 -1.372 -22.815 15.778 1.00 43.35 N flip ATOM 0 H ASN A 579 0.205 -26.135 12.867 1.00 12.51 H new ATOM 0 HA ASN A 579 2.027 -24.134 13.963 1.00 4.35 H new ATOM 0 HB2 ASN A 579 -0.035 -23.236 13.137 1.00 24.44 H new ATOM 0 HB3 ASN A 579 -0.987 -24.502 13.886 1.00 24.44 H new ATOM 0 HD21 ASN A 579 -2.205 -23.241 15.372 1.00 43.35 H new ATOM 0 HD22 ASN A 579 -1.451 -22.231 16.611 1.00 43.35 H new ATOM 574 N VAL A 580 2.203 -25.051 16.272 1.00 73.13 N ATOM 575 CA VAL A 580 2.350 -25.575 17.619 1.00 13.21 C ATOM 576 C VAL A 580 1.691 -24.613 18.610 1.00 73.10 C ATOM 577 O VAL A 580 1.819 -23.397 18.479 1.00 52.23 O ATOM 578 CB VAL A 580 3.828 -25.827 17.924 1.00 34.40 C ATOM 579 CG1 VAL A 580 3.987 -26.796 19.097 1.00 24.24 C ATOM 580 CG2 VAL A 580 4.563 -26.341 16.685 1.00 61.04 C ATOM 0 H VAL A 580 2.955 -24.431 15.971 1.00 73.13 H new ATOM 0 HA VAL A 580 1.844 -26.536 17.713 1.00 13.21 H new ATOM 0 HB VAL A 580 4.279 -24.877 18.210 1.00 34.40 H new ATOM 0 HG11 VAL A 580 5.047 -26.958 19.294 1.00 24.24 H new ATOM 0 HG12 VAL A 580 3.514 -26.374 19.984 1.00 24.24 H new ATOM 0 HG13 VAL A 580 3.514 -27.746 18.850 1.00 24.24 H new ATOM 0 HG21 VAL A 580 5.612 -26.512 16.929 1.00 61.04 H new ATOM 0 HG22 VAL A 580 4.110 -27.276 16.355 1.00 61.04 H new ATOM 0 HG23 VAL A 580 4.492 -25.602 15.887 1.00 61.04 H new ATOM 590 N ASN A 581 1.000 -25.195 19.579 1.00 13.44 N ATOM 591 CA ASN A 581 0.320 -24.404 20.592 1.00 24.51 C ATOM 592 C ASN A 581 -0.519 -25.329 21.476 1.00 72.02 C ATOM 593 O ASN A 581 -1.282 -26.152 20.971 1.00 3.15 O ATOM 594 CB ASN A 581 -0.619 -23.380 19.953 1.00 60.02 C ATOM 595 CG ASN A 581 -1.450 -22.659 21.016 1.00 23.24 C ATOM 596 OD1 ASN A 581 -2.639 -22.884 21.170 1.00 22.54 O ATOM 597 ND2 ASN A 581 -0.759 -21.782 21.739 1.00 32.03 N ATOM 0 H ASN A 581 0.896 -26.204 19.685 1.00 13.44 H new ATOM 0 HA ASN A 581 1.077 -23.882 21.177 1.00 24.51 H new ATOM 0 HB2 ASN A 581 -0.038 -22.653 19.386 1.00 60.02 H new ATOM 0 HB3 ASN A 581 -1.281 -23.880 19.246 1.00 60.02 H new ATOM 0 HD21 ASN A 581 -1.223 -21.249 22.475 1.00 32.03 H new ATOM 0 HD22 ASN A 581 0.235 -21.642 21.558 1.00 32.03 H new ATOM 604 N PRO A 582 -0.346 -25.158 22.814 1.00 73.11 N ATOM 605 CA PRO A 582 -1.079 -25.967 23.773 1.00 71.43 C ATOM 606 C PRO A 582 -2.538 -25.517 23.869 1.00 72.14 C ATOM 607 O PRO A 582 -3.418 -26.314 24.192 1.00 5.14 O ATOM 608 CB PRO A 582 -0.322 -25.810 25.081 1.00 45.11 C ATOM 609 CG PRO A 582 0.529 -24.560 24.922 1.00 12.03 C ATOM 610 CD PRO A 582 0.548 -24.193 23.447 1.00 21.53 C ATOM 0 HA PRO A 582 -1.133 -27.016 23.483 1.00 71.43 H new ATOM 0 HB2 PRO A 582 -1.010 -25.710 25.921 1.00 45.11 H new ATOM 0 HB3 PRO A 582 0.300 -26.683 25.280 1.00 45.11 H new ATOM 0 HG2 PRO A 582 0.119 -23.741 25.514 1.00 12.03 H new ATOM 0 HG3 PRO A 582 1.541 -24.739 25.284 1.00 12.03 H new ATOM 0 HD2 PRO A 582 0.204 -23.171 23.289 1.00 21.53 H new ATOM 0 HD3 PRO A 582 1.555 -24.257 23.036 1.00 21.53 H new ATOM 618 N ASN A 583 -2.750 -24.241 23.581 1.00 35.30 N ATOM 619 CA ASN A 583 -4.088 -23.675 23.631 1.00 61.43 C ATOM 620 C ASN A 583 -4.852 -24.073 22.366 1.00 14.04 C ATOM 621 O ASN A 583 -6.014 -23.705 22.197 1.00 3.53 O ATOM 622 CB ASN A 583 -4.038 -22.148 23.692 1.00 45.52 C ATOM 623 CG ASN A 583 -2.770 -21.669 24.402 1.00 0.35 C ATOM 624 OD1 ASN A 583 -2.365 -20.459 24.028 1.00 10.32 O flip ATOM 625 ND2 ASN A 583 -2.198 -22.353 25.235 1.00 5.45 N flip ATOM 0 H ASN A 583 -2.018 -23.583 23.312 1.00 35.30 H new ATOM 0 HA ASN A 583 -4.582 -24.055 24.525 1.00 61.43 H new ATOM 0 HB2 ASN A 583 -4.070 -21.739 22.682 1.00 45.52 H new ATOM 0 HB3 ASN A 583 -4.917 -21.772 24.216 1.00 45.52 H new ATOM 0 HD21 ASN A 583 -2.563 -23.274 25.476 1.00 5.45 H new ATOM 0 HD22 ASN A 583 -1.355 -22.003 25.690 1.00 5.45 H new ATOM 632 N PHE A 584 -4.170 -24.820 21.511 1.00 41.31 N ATOM 633 CA PHE A 584 -4.770 -25.271 20.267 1.00 33.31 C ATOM 634 C PHE A 584 -5.700 -26.462 20.508 1.00 71.32 C ATOM 635 O PHE A 584 -6.670 -26.655 19.776 1.00 64.43 O ATOM 636 CB PHE A 584 -3.626 -25.710 19.351 1.00 3.15 C ATOM 637 CG PHE A 584 -3.883 -25.451 17.866 1.00 53.33 C ATOM 638 CD1 PHE A 584 -4.083 -24.181 17.422 1.00 40.24 C ATOM 639 CD2 PHE A 584 -3.913 -26.490 16.989 1.00 24.12 C ATOM 640 CE1 PHE A 584 -4.322 -23.940 16.043 1.00 71.32 C ATOM 641 CE2 PHE A 584 -4.152 -26.250 15.610 1.00 3.42 C ATOM 642 CZ PHE A 584 -4.351 -24.980 15.166 1.00 14.32 C ATOM 0 H PHE A 584 -3.207 -25.124 21.655 1.00 41.31 H new ATOM 0 HA PHE A 584 -5.359 -24.467 19.825 1.00 33.31 H new ATOM 0 HB2 PHE A 584 -2.716 -25.188 19.648 1.00 3.15 H new ATOM 0 HB3 PHE A 584 -3.445 -26.775 19.497 1.00 3.15 H new ATOM 0 HD1 PHE A 584 -4.060 -23.356 18.118 1.00 40.24 H new ATOM 0 HD2 PHE A 584 -3.755 -27.498 17.342 1.00 24.12 H new ATOM 0 HE1 PHE A 584 -4.481 -22.932 15.690 1.00 71.32 H new ATOM 0 HE2 PHE A 584 -4.176 -27.076 14.914 1.00 3.42 H new ATOM 0 HZ PHE A 584 -4.532 -24.797 14.117 1.00 14.32 H new ATOM 652 N SER A 585 -5.372 -27.230 21.537 1.00 61.05 N ATOM 653 CA SER A 585 -6.166 -28.397 21.883 1.00 44.12 C ATOM 654 C SER A 585 -7.587 -27.971 22.255 1.00 32.01 C ATOM 655 O SER A 585 -8.544 -28.702 22.003 1.00 11.31 O ATOM 656 CB SER A 585 -5.526 -29.176 23.034 1.00 52.10 C ATOM 657 OG SER A 585 -5.429 -28.392 24.220 1.00 12.01 O ATOM 0 H SER A 585 -4.567 -27.067 22.142 1.00 61.05 H new ATOM 0 HA SER A 585 -6.207 -29.054 21.014 1.00 44.12 H new ATOM 0 HB2 SER A 585 -6.115 -30.071 23.238 1.00 52.10 H new ATOM 0 HB3 SER A 585 -4.532 -29.509 22.737 1.00 52.10 H new ATOM 0 HG SER A 585 -4.734 -27.711 24.106 1.00 12.01 H new ATOM 663 N ASN A 586 -7.681 -26.790 22.849 1.00 24.40 N ATOM 664 CA ASN A 586 -8.969 -26.258 23.259 1.00 73.54 C ATOM 665 C ASN A 586 -9.593 -25.490 22.092 1.00 40.11 C ATOM 666 O ASN A 586 -10.754 -25.090 22.157 1.00 34.34 O ATOM 667 CB ASN A 586 -8.817 -25.291 24.434 1.00 34.54 C ATOM 668 CG ASN A 586 -8.803 -26.045 25.766 1.00 61.12 C ATOM 669 OD1 ASN A 586 -9.752 -26.714 26.141 1.00 51.33 O ATOM 670 ND2 ASN A 586 -7.676 -25.900 26.457 1.00 30.41 N ATOM 0 H ASN A 586 -6.885 -26.186 23.056 1.00 24.40 H new ATOM 0 HA ASN A 586 -9.599 -27.095 23.560 1.00 73.54 H new ATOM 0 HB2 ASN A 586 -7.894 -24.722 24.324 1.00 34.54 H new ATOM 0 HB3 ASN A 586 -9.637 -24.573 24.427 1.00 34.54 H new ATOM 0 HD21 ASN A 586 -7.568 -26.364 27.359 1.00 30.41 H new ATOM 0 HD22 ASN A 586 -6.920 -25.325 26.085 1.00 30.41 H new ATOM 677 N TYR A 587 -8.794 -25.306 21.051 1.00 23.24 N ATOM 678 CA TYR A 587 -9.253 -24.593 19.872 1.00 42.42 C ATOM 679 C TYR A 587 -9.801 -25.562 18.823 1.00 63.51 C ATOM 680 O TYR A 587 -10.426 -25.142 17.850 1.00 21.54 O ATOM 681 CB TYR A 587 -8.022 -23.885 19.301 1.00 30.13 C ATOM 682 CG TYR A 587 -7.537 -22.704 20.144 1.00 25.33 C ATOM 683 CD1 TYR A 587 -8.089 -22.470 21.387 1.00 33.22 C ATOM 684 CD2 TYR A 587 -6.546 -21.873 19.662 1.00 21.21 C ATOM 685 CE1 TYR A 587 -7.632 -21.359 22.181 1.00 54.24 C ATOM 686 CE2 TYR A 587 -6.089 -20.762 20.456 1.00 40.14 C ATOM 687 CZ TYR A 587 -6.655 -20.559 21.676 1.00 63.53 C ATOM 688 OH TYR A 587 -6.223 -19.510 22.425 1.00 12.21 O ATOM 0 H TYR A 587 -7.831 -25.639 21.000 1.00 23.24 H new ATOM 0 HA TYR A 587 -10.052 -23.899 20.131 1.00 42.42 H new ATOM 0 HB2 TYR A 587 -7.211 -24.608 19.206 1.00 30.13 H new ATOM 0 HB3 TYR A 587 -8.253 -23.531 18.296 1.00 30.13 H new ATOM 0 HD1 TYR A 587 -8.864 -23.120 21.764 1.00 33.22 H new ATOM 0 HD2 TYR A 587 -6.113 -22.056 18.690 1.00 21.21 H new ATOM 0 HE1 TYR A 587 -8.056 -21.165 23.155 1.00 54.24 H new ATOM 0 HE2 TYR A 587 -5.314 -20.104 20.091 1.00 40.14 H new ATOM 0 HH TYR A 587 -5.522 -19.027 21.939 1.00 12.21 H new ATOM 698 N TYR A 588 -9.546 -26.842 19.056 1.00 51.41 N ATOM 699 CA TYR A 588 -10.006 -27.875 18.143 1.00 10.43 C ATOM 700 C TYR A 588 -10.262 -29.188 18.886 1.00 52.33 C ATOM 701 O TYR A 588 -9.752 -29.393 19.986 1.00 11.40 O ATOM 702 CB TYR A 588 -8.872 -28.084 17.138 1.00 53.04 C ATOM 703 CG TYR A 588 -7.746 -28.985 17.648 1.00 32.11 C ATOM 704 CD1 TYR A 588 -7.976 -30.331 17.847 1.00 31.25 C ATOM 705 CD2 TYR A 588 -6.500 -28.452 17.909 1.00 12.22 C ATOM 706 CE1 TYR A 588 -6.916 -31.179 18.328 1.00 72.31 C ATOM 707 CE2 TYR A 588 -5.440 -29.300 18.390 1.00 53.13 C ATOM 708 CZ TYR A 588 -5.701 -30.622 18.575 1.00 4.24 C ATOM 709 OH TYR A 588 -4.700 -31.423 19.029 1.00 4.32 O ATOM 0 H TYR A 588 -9.027 -27.187 19.864 1.00 51.41 H new ATOM 0 HA TYR A 588 -10.939 -27.578 17.664 1.00 10.43 H new ATOM 0 HB2 TYR A 588 -9.284 -28.516 16.226 1.00 53.04 H new ATOM 0 HB3 TYR A 588 -8.454 -27.114 16.871 1.00 53.04 H new ATOM 0 HD1 TYR A 588 -8.951 -30.748 17.642 1.00 31.25 H new ATOM 0 HD2 TYR A 588 -6.320 -27.399 17.752 1.00 12.22 H new ATOM 0 HE1 TYR A 588 -7.083 -32.234 18.489 1.00 72.31 H new ATOM 0 HE2 TYR A 588 -4.461 -28.896 18.599 1.00 53.13 H new ATOM 0 HH TYR A 588 -3.888 -30.890 19.161 1.00 4.32 H new ATOM 719 N ASN A 589 -11.052 -30.043 18.254 1.00 74.22 N ATOM 720 CA ASN A 589 -11.382 -31.331 18.841 1.00 55.23 C ATOM 721 C ASN A 589 -11.130 -32.435 17.812 1.00 1.01 C ATOM 722 O ASN A 589 -11.571 -32.336 16.668 1.00 14.43 O ATOM 723 CB ASN A 589 -12.857 -31.390 19.245 1.00 3.03 C ATOM 724 CG ASN A 589 -13.132 -30.486 20.449 1.00 43.14 C ATOM 725 OD1 ASN A 589 -13.267 -30.933 21.576 1.00 51.13 O ATOM 726 ND2 ASN A 589 -13.207 -29.193 20.148 1.00 45.45 N ATOM 0 H ASN A 589 -11.473 -29.869 17.341 1.00 74.22 H new ATOM 0 HA ASN A 589 -10.759 -31.468 19.725 1.00 55.23 H new ATOM 0 HB2 ASN A 589 -13.480 -31.083 18.405 1.00 3.03 H new ATOM 0 HB3 ASN A 589 -13.131 -32.417 19.487 1.00 3.03 H new ATOM 0 HD21 ASN A 589 -13.387 -28.508 20.882 1.00 45.45 H new ATOM 0 HD22 ASN A 589 -13.084 -28.886 19.183 1.00 45.45 H new ATOM 733 N VAL A 590 -10.420 -33.462 18.256 1.00 74.10 N ATOM 734 CA VAL A 590 -10.104 -34.584 17.388 1.00 2.23 C ATOM 735 C VAL A 590 -11.369 -35.410 17.148 1.00 22.11 C ATOM 736 O VAL A 590 -12.087 -35.741 18.091 1.00 43.04 O ATOM 737 CB VAL A 590 -8.959 -35.403 17.989 1.00 75.04 C ATOM 738 CG1 VAL A 590 -8.866 -36.780 17.329 1.00 74.31 C ATOM 739 CG2 VAL A 590 -7.631 -34.652 17.879 1.00 12.34 C ATOM 0 H VAL A 590 -10.055 -33.541 19.205 1.00 74.10 H new ATOM 0 HA VAL A 590 -9.758 -34.231 16.417 1.00 2.23 H new ATOM 0 HB VAL A 590 -9.173 -35.552 19.047 1.00 75.04 H new ATOM 0 HG11 VAL A 590 -8.045 -37.342 17.774 1.00 74.31 H new ATOM 0 HG12 VAL A 590 -9.800 -37.320 17.482 1.00 74.31 H new ATOM 0 HG13 VAL A 590 -8.687 -36.660 16.261 1.00 74.31 H new ATOM 0 HG21 VAL A 590 -6.834 -35.256 18.313 1.00 12.34 H new ATOM 0 HG22 VAL A 590 -7.408 -34.458 16.830 1.00 12.34 H new ATOM 0 HG23 VAL A 590 -7.703 -33.706 18.415 1.00 12.34 H new ATOM 749 N SER A 591 -11.603 -35.720 15.881 1.00 12.24 N ATOM 750 CA SER A 591 -12.769 -36.501 15.505 1.00 32.24 C ATOM 751 C SER A 591 -12.859 -37.758 16.374 1.00 50.13 C ATOM 752 O SER A 591 -11.849 -38.235 16.888 1.00 3.00 O ATOM 753 CB SER A 591 -12.723 -36.882 14.024 1.00 1.33 C ATOM 754 OG SER A 591 -13.210 -35.835 13.189 1.00 73.12 O ATOM 0 H SER A 591 -11.005 -35.444 15.102 1.00 12.24 H new ATOM 0 HA SER A 591 -13.657 -35.890 15.667 1.00 32.24 H new ATOM 0 HB2 SER A 591 -11.698 -37.123 13.743 1.00 1.33 H new ATOM 0 HB3 SER A 591 -13.317 -37.781 13.862 1.00 1.33 H new ATOM 0 HG SER A 591 -13.163 -36.116 12.251 1.00 73.12 H new ATOM 760 N ARG A 592 -14.078 -38.258 16.510 1.00 33.10 N ATOM 761 CA ARG A 592 -14.313 -39.450 17.307 1.00 33.11 C ATOM 762 C ARG A 592 -13.285 -40.530 16.964 1.00 41.43 C ATOM 763 O ARG A 592 -12.703 -41.144 17.856 1.00 0.14 O ATOM 764 CB ARG A 592 -15.720 -40.002 17.070 1.00 35.24 C ATOM 765 CG ARG A 592 -15.926 -41.319 17.822 1.00 15.33 C ATOM 766 CD ARG A 592 -17.415 -41.606 18.027 1.00 13.11 C ATOM 767 NE ARG A 592 -17.927 -40.827 19.177 1.00 74.41 N ATOM 768 CZ ARG A 592 -19.086 -41.095 19.816 1.00 22.24 C ATOM 769 NH1 ARG A 592 -19.863 -42.126 19.423 1.00 74.12 N ATOM 770 NH2 ARG A 592 -19.447 -40.334 20.832 1.00 2.34 N ATOM 0 H ARG A 592 -14.914 -37.860 16.082 1.00 33.10 H new ATOM 0 HA ARG A 592 -14.216 -39.171 18.356 1.00 33.11 H new ATOM 0 HB2 ARG A 592 -16.461 -39.272 17.397 1.00 35.24 H new ATOM 0 HB3 ARG A 592 -15.878 -40.160 16.003 1.00 35.24 H new ATOM 0 HG2 ARG A 592 -15.468 -42.136 17.264 1.00 15.33 H new ATOM 0 HG3 ARG A 592 -15.424 -41.272 18.789 1.00 15.33 H new ATOM 0 HD2 ARG A 592 -17.971 -41.348 17.126 1.00 13.11 H new ATOM 0 HD3 ARG A 592 -17.568 -42.671 18.202 1.00 13.11 H new ATOM 0 HE ARG A 592 -17.370 -40.039 19.507 1.00 74.41 H new ATOM 0 HH11 ARG A 592 -19.576 -42.710 18.637 1.00 74.12 H new ATOM 0 HH12 ARG A 592 -20.737 -42.321 19.912 1.00 74.12 H new ATOM 0 HH21 ARG A 592 -18.854 -39.557 21.124 1.00 2.34 H new ATOM 0 HH22 ARG A 592 -20.319 -40.523 21.326 1.00 2.34 H new ATOM 783 N ASP A 593 -13.092 -40.728 15.668 1.00 54.31 N ATOM 784 CA ASP A 593 -12.144 -41.722 15.196 1.00 73.44 C ATOM 785 C ASP A 593 -10.738 -41.342 15.662 1.00 22.15 C ATOM 786 O ASP A 593 -10.444 -40.165 15.863 1.00 4.13 O ATOM 787 CB ASP A 593 -12.133 -41.790 13.667 1.00 21.32 C ATOM 788 CG ASP A 593 -13.498 -41.609 13.002 1.00 55.54 C ATOM 789 OD1 ASP A 593 -14.185 -40.599 13.218 1.00 34.24 O ATOM 790 OD2 ASP A 593 -13.856 -42.571 12.220 1.00 15.43 O ATOM 0 H ASP A 593 -13.576 -40.217 14.930 1.00 54.31 H new ATOM 0 HA ASP A 593 -12.442 -42.690 15.598 1.00 73.44 H new ATOM 0 HB2 ASP A 593 -11.457 -41.023 13.289 1.00 21.32 H new ATOM 0 HB3 ASP A 593 -11.723 -42.753 13.364 1.00 21.32 H new ATOM 796 N PRO A 594 -9.884 -42.388 15.826 1.00 71.11 N ATOM 797 CA PRO A 594 -8.516 -42.176 16.265 1.00 4.44 C ATOM 798 C PRO A 594 -7.658 -41.608 15.133 1.00 41.42 C ATOM 799 O PRO A 594 -7.513 -40.392 15.008 1.00 34.52 O ATOM 800 CB PRO A 594 -8.040 -43.537 16.745 1.00 74.41 C ATOM 801 CG PRO A 594 -8.991 -44.551 16.129 1.00 63.23 C ATOM 802 CD PRO A 594 -10.198 -43.796 15.598 1.00 42.45 C ATOM 0 HA PRO A 594 -8.441 -41.439 17.064 1.00 4.44 H new ATOM 0 HB2 PRO A 594 -7.013 -43.724 16.432 1.00 74.41 H new ATOM 0 HB3 PRO A 594 -8.058 -43.596 17.833 1.00 74.41 H new ATOM 0 HG2 PRO A 594 -8.498 -45.097 15.324 1.00 63.23 H new ATOM 0 HG3 PRO A 594 -9.298 -45.287 16.872 1.00 63.23 H new ATOM 0 HD2 PRO A 594 -10.358 -44.000 14.539 1.00 42.45 H new ATOM 0 HD3 PRO A 594 -11.109 -44.088 16.120 1.00 42.45 H new ATOM 810 N VAL A 595 -7.111 -42.514 14.336 1.00 53.01 N ATOM 811 CA VAL A 595 -6.272 -42.119 13.218 1.00 42.53 C ATOM 812 C VAL A 595 -6.963 -42.500 11.907 1.00 50.50 C ATOM 813 O VAL A 595 -7.316 -43.660 11.702 1.00 41.25 O ATOM 814 CB VAL A 595 -4.881 -42.739 13.362 1.00 22.24 C ATOM 815 CG1 VAL A 595 -4.018 -42.444 12.134 1.00 53.03 C ATOM 816 CG2 VAL A 595 -4.196 -42.257 14.642 1.00 4.54 C ATOM 0 H VAL A 595 -7.233 -43.521 14.443 1.00 53.01 H new ATOM 0 HA VAL A 595 -6.132 -41.038 13.210 1.00 42.53 H new ATOM 0 HB VAL A 595 -5.003 -43.820 13.433 1.00 22.24 H new ATOM 0 HG11 VAL A 595 -3.035 -42.896 12.263 1.00 53.03 H new ATOM 0 HG12 VAL A 595 -4.495 -42.859 11.246 1.00 53.03 H new ATOM 0 HG13 VAL A 595 -3.909 -41.366 12.017 1.00 53.03 H new ATOM 0 HG21 VAL A 595 -3.209 -42.713 14.720 1.00 4.54 H new ATOM 0 HG22 VAL A 595 -4.094 -41.172 14.614 1.00 4.54 H new ATOM 0 HG23 VAL A 595 -4.797 -42.542 15.506 1.00 4.54 H new ATOM 826 N VAL A 596 -7.136 -41.500 11.054 1.00 22.41 N ATOM 827 CA VAL A 596 -7.779 -41.716 9.769 1.00 65.21 C ATOM 828 C VAL A 596 -6.859 -41.215 8.653 1.00 30.43 C ATOM 829 O VAL A 596 -7.020 -40.098 8.166 1.00 53.31 O ATOM 830 CB VAL A 596 -9.155 -41.049 9.754 1.00 52.23 C ATOM 831 CG1 VAL A 596 -10.073 -41.709 8.723 1.00 33.33 C ATOM 832 CG2 VAL A 596 -9.789 -41.069 11.146 1.00 55.41 C ATOM 0 H VAL A 596 -6.842 -40.539 11.228 1.00 22.41 H new ATOM 0 HA VAL A 596 -7.947 -42.780 9.599 1.00 65.21 H new ATOM 0 HB VAL A 596 -9.019 -40.007 9.463 1.00 52.23 H new ATOM 0 HG11 VAL A 596 -11.045 -41.216 8.733 1.00 33.33 H new ATOM 0 HG12 VAL A 596 -9.630 -41.619 7.731 1.00 33.33 H new ATOM 0 HG13 VAL A 596 -10.199 -42.763 8.970 1.00 33.33 H new ATOM 0 HG21 VAL A 596 -10.767 -40.589 11.107 1.00 55.41 H new ATOM 0 HG22 VAL A 596 -9.905 -42.101 11.478 1.00 55.41 H new ATOM 0 HG23 VAL A 596 -9.148 -40.532 11.845 1.00 55.41 H new ATOM 842 N ILE A 597 -5.915 -42.067 8.281 1.00 23.15 N ATOM 843 CA ILE A 597 -4.969 -41.725 7.232 1.00 33.04 C ATOM 844 C ILE A 597 -4.836 -42.905 6.268 1.00 43.04 C ATOM 845 O ILE A 597 -4.841 -42.721 5.051 1.00 14.25 O ATOM 846 CB ILE A 597 -3.639 -41.271 7.837 1.00 70.31 C ATOM 847 CG1 ILE A 597 -3.802 -39.952 8.594 1.00 55.20 C ATOM 848 CG2 ILE A 597 -2.550 -41.186 6.765 1.00 33.32 C ATOM 849 CD1 ILE A 597 -3.461 -38.760 7.698 1.00 51.43 C ATOM 0 H ILE A 597 -5.785 -42.994 8.687 1.00 23.15 H new ATOM 0 HA ILE A 597 -5.333 -40.878 6.651 1.00 33.04 H new ATOM 0 HB ILE A 597 -3.320 -42.020 8.562 1.00 70.31 H new ATOM 0 HG12 ILE A 597 -4.827 -39.859 8.954 1.00 55.20 H new ATOM 0 HG13 ILE A 597 -3.155 -39.949 9.471 1.00 55.20 H new ATOM 0 HG21 ILE A 597 -1.615 -40.861 7.221 1.00 33.32 H new ATOM 0 HG22 ILE A 597 -2.410 -42.166 6.310 1.00 33.32 H new ATOM 0 HG23 ILE A 597 -2.848 -40.470 5.999 1.00 33.32 H new ATOM 0 HD11 ILE A 597 -3.585 -37.835 8.261 1.00 51.43 H new ATOM 0 HD12 ILE A 597 -2.428 -38.843 7.359 1.00 51.43 H new ATOM 0 HD13 ILE A 597 -4.126 -38.752 6.835 1.00 51.43 H new ATOM 861 N ASN A 598 -4.719 -44.091 6.846 1.00 4.04 N ATOM 862 CA ASN A 598 -4.584 -45.301 6.053 1.00 1.11 C ATOM 863 C ASN A 598 -3.207 -45.318 5.387 1.00 24.11 C ATOM 864 O ASN A 598 -3.021 -45.959 4.354 1.00 24.41 O ATOM 865 CB ASN A 598 -5.643 -45.357 4.951 1.00 60.35 C ATOM 866 CG ASN A 598 -6.608 -46.523 5.176 1.00 13.35 C ATOM 867 OD1 ASN A 598 -6.719 -47.070 6.261 1.00 3.34 O ATOM 868 ND2 ASN A 598 -7.299 -46.871 4.094 1.00 2.35 N ATOM 0 H ASN A 598 -4.715 -44.240 7.855 1.00 4.04 H new ATOM 0 HA ASN A 598 -4.709 -46.156 6.717 1.00 1.11 H new ATOM 0 HB2 ASN A 598 -6.199 -44.420 4.928 1.00 60.35 H new ATOM 0 HB3 ASN A 598 -5.158 -45.464 3.981 1.00 60.35 H new ATOM 0 HD21 ASN A 598 -7.970 -47.638 4.142 1.00 2.35 H new ATOM 0 HD22 ASN A 598 -7.158 -46.371 3.216 1.00 2.35 H new ATOM 875 N LYS A 599 -2.277 -44.606 6.006 1.00 45.32 N ATOM 876 CA LYS A 599 -0.922 -44.531 5.486 1.00 43.01 C ATOM 877 C LYS A 599 0.042 -44.208 6.630 1.00 72.33 C ATOM 878 O LYS A 599 -0.179 -43.263 7.384 1.00 15.54 O ATOM 879 CB LYS A 599 -0.848 -43.540 4.322 1.00 34.50 C ATOM 880 CG LYS A 599 0.220 -43.961 3.310 1.00 32.25 C ATOM 881 CD LYS A 599 1.577 -43.348 3.660 1.00 65.50 C ATOM 882 CE LYS A 599 2.722 -44.202 3.111 1.00 60.33 C ATOM 883 NZ LYS A 599 4.030 -43.623 3.491 1.00 53.42 N ATOM 0 H LYS A 599 -2.435 -44.076 6.863 1.00 45.32 H new ATOM 0 HA LYS A 599 -0.619 -45.494 5.075 1.00 43.01 H new ATOM 0 HB2 LYS A 599 -1.818 -43.480 3.829 1.00 34.50 H new ATOM 0 HB3 LYS A 599 -0.622 -42.544 4.702 1.00 34.50 H new ATOM 0 HG2 LYS A 599 0.301 -45.048 3.292 1.00 32.25 H new ATOM 0 HG3 LYS A 599 -0.078 -43.647 2.310 1.00 32.25 H new ATOM 0 HD2 LYS A 599 1.641 -42.340 3.250 1.00 65.50 H new ATOM 0 HD3 LYS A 599 1.672 -43.259 4.742 1.00 65.50 H new ATOM 0 HE2 LYS A 599 2.642 -45.219 3.496 1.00 60.33 H new ATOM 0 HE3 LYS A 599 2.648 -44.266 2.025 1.00 60.33 H new ATOM 0 HZ1 LYS A 599 4.794 -44.166 3.040 1.00 53.42 H new ATOM 0 HZ2 LYS A 599 4.076 -42.633 3.176 1.00 53.42 H new ATOM 0 HZ3 LYS A 599 4.140 -43.663 4.524 1.00 53.42 H new ATOM 896 N VAL A 600 1.091 -45.013 6.722 1.00 54.50 N ATOM 897 CA VAL A 600 2.089 -44.824 7.761 1.00 32.50 C ATOM 898 C VAL A 600 3.255 -44.008 7.200 1.00 12.33 C ATOM 899 O VAL A 600 3.405 -43.887 5.985 1.00 10.35 O ATOM 900 CB VAL A 600 2.523 -46.180 8.321 1.00 64.52 C ATOM 901 CG1 VAL A 600 3.522 -46.006 9.466 1.00 25.03 C ATOM 902 CG2 VAL A 600 1.313 -47.002 8.769 1.00 10.11 C ATOM 0 H VAL A 600 1.271 -45.797 6.095 1.00 54.50 H new ATOM 0 HA VAL A 600 1.671 -44.261 8.595 1.00 32.50 H new ATOM 0 HB VAL A 600 3.022 -46.728 7.522 1.00 64.52 H new ATOM 0 HG11 VAL A 600 3.814 -46.985 9.846 1.00 25.03 H new ATOM 0 HG12 VAL A 600 4.405 -45.480 9.102 1.00 25.03 H new ATOM 0 HG13 VAL A 600 3.060 -45.429 10.267 1.00 25.03 H new ATOM 0 HG21 VAL A 600 1.650 -47.961 9.163 1.00 10.11 H new ATOM 0 HG22 VAL A 600 0.773 -46.461 9.546 1.00 10.11 H new ATOM 0 HG23 VAL A 600 0.653 -47.171 7.918 1.00 10.11 H new ATOM 912 N PHE A 601 4.050 -43.468 8.112 1.00 23.42 N ATOM 913 CA PHE A 601 5.198 -42.667 7.724 1.00 42.40 C ATOM 914 C PHE A 601 6.375 -42.897 8.675 1.00 53.14 C ATOM 915 O PHE A 601 6.197 -42.929 9.891 1.00 21.24 O ATOM 916 CB PHE A 601 4.769 -41.201 7.809 1.00 51.53 C ATOM 917 CG PHE A 601 3.563 -40.854 6.933 1.00 13.25 C ATOM 918 CD1 PHE A 601 3.737 -40.584 5.612 1.00 75.11 C ATOM 919 CD2 PHE A 601 2.317 -40.815 7.477 1.00 34.42 C ATOM 920 CE1 PHE A 601 2.617 -40.262 4.800 1.00 61.44 C ATOM 921 CE2 PHE A 601 1.197 -40.494 6.665 1.00 43.30 C ATOM 922 CZ PHE A 601 1.371 -40.224 5.343 1.00 20.04 C ATOM 0 H PHE A 601 3.922 -43.570 9.119 1.00 23.42 H new ATOM 0 HA PHE A 601 5.519 -42.940 6.719 1.00 42.40 H new ATOM 0 HB2 PHE A 601 4.533 -40.962 8.846 1.00 51.53 H new ATOM 0 HB3 PHE A 601 5.609 -40.570 7.519 1.00 51.53 H new ATOM 0 HD1 PHE A 601 4.726 -40.614 5.180 1.00 75.11 H new ATOM 0 HD2 PHE A 601 2.179 -41.028 8.527 1.00 34.42 H new ATOM 0 HE1 PHE A 601 2.755 -40.047 3.751 1.00 61.44 H new ATOM 0 HE2 PHE A 601 0.208 -40.464 7.097 1.00 43.30 H new ATOM 0 HZ PHE A 601 0.520 -39.980 4.725 1.00 20.04 H new ATOM 932 N LYS A 602 7.550 -43.051 8.083 1.00 4.15 N ATOM 933 CA LYS A 602 8.756 -43.277 8.863 1.00 72.34 C ATOM 934 C LYS A 602 9.428 -41.934 9.156 1.00 34.45 C ATOM 935 O LYS A 602 10.654 -41.839 9.168 1.00 72.01 O ATOM 936 CB LYS A 602 9.670 -44.281 8.156 1.00 12.41 C ATOM 937 CG LYS A 602 9.202 -45.716 8.403 1.00 25.41 C ATOM 938 CD LYS A 602 7.958 -46.038 7.573 1.00 20.32 C ATOM 939 CE LYS A 602 8.268 -47.089 6.505 1.00 30.23 C ATOM 940 NZ LYS A 602 8.369 -46.458 5.171 1.00 41.43 N ATOM 0 H LYS A 602 7.693 -43.024 7.073 1.00 4.15 H new ATOM 0 HA LYS A 602 8.509 -43.727 9.825 1.00 72.34 H new ATOM 0 HB2 LYS A 602 9.681 -44.077 7.085 1.00 12.41 H new ATOM 0 HB3 LYS A 602 10.693 -44.162 8.513 1.00 12.41 H new ATOM 0 HG2 LYS A 602 10.002 -46.412 8.150 1.00 25.41 H new ATOM 0 HG3 LYS A 602 8.983 -45.854 9.462 1.00 25.41 H new ATOM 0 HD2 LYS A 602 7.165 -46.401 8.226 1.00 20.32 H new ATOM 0 HD3 LYS A 602 7.588 -45.129 7.098 1.00 20.32 H new ATOM 0 HE2 LYS A 602 9.202 -47.596 6.746 1.00 30.23 H new ATOM 0 HE3 LYS A 602 7.486 -47.849 6.496 1.00 30.23 H new ATOM 0 HZ1 LYS A 602 8.580 -47.185 4.458 1.00 41.43 H new ATOM 0 HZ2 LYS A 602 7.468 -45.995 4.937 1.00 41.43 H new ATOM 0 HZ3 LYS A 602 9.131 -45.750 5.179 1.00 41.43 H new ATOM 953 N ASP A 603 8.595 -40.930 9.387 1.00 34.31 N ATOM 954 CA ASP A 603 9.093 -39.597 9.680 1.00 35.12 C ATOM 955 C ASP A 603 8.258 -38.982 10.805 1.00 11.42 C ATOM 956 O ASP A 603 8.805 -38.416 11.751 1.00 71.22 O ATOM 957 CB ASP A 603 8.981 -38.686 8.456 1.00 21.12 C ATOM 958 CG ASP A 603 9.593 -39.250 7.172 1.00 20.24 C ATOM 959 OD1 ASP A 603 10.509 -38.655 6.586 1.00 2.33 O ATOM 960 OD2 ASP A 603 9.084 -40.365 6.770 1.00 21.31 O ATOM 0 H ASP A 603 7.578 -41.013 9.377 1.00 34.31 H new ATOM 0 HA ASP A 603 10.140 -39.684 9.970 1.00 35.12 H new ATOM 0 HB2 ASP A 603 7.927 -38.473 8.275 1.00 21.12 H new ATOM 0 HB3 ASP A 603 9.464 -37.736 8.684 1.00 21.12 H new ATOM 966 N TRP A 604 6.947 -39.112 10.666 1.00 71.44 N ATOM 967 CA TRP A 604 6.031 -38.576 11.658 1.00 24.24 C ATOM 968 C TRP A 604 4.711 -39.340 11.545 1.00 34.21 C ATOM 969 O TRP A 604 4.178 -39.508 10.449 1.00 2.40 O ATOM 970 CB TRP A 604 5.864 -37.065 11.490 1.00 10.20 C ATOM 971 CG TRP A 604 5.129 -36.659 10.211 1.00 12.32 C ATOM 972 CD1 TRP A 604 4.998 -37.360 9.077 1.00 43.45 C ATOM 973 CD2 TRP A 604 4.423 -35.421 9.981 1.00 4.21 C ATOM 974 NE1 TRP A 604 4.264 -36.667 8.136 1.00 53.13 N ATOM 975 CE2 TRP A 604 3.903 -35.450 8.703 1.00 31.55 C ATOM 976 CE3 TRP A 604 4.231 -34.313 10.825 1.00 44.41 C ATOM 977 CZ2 TRP A 604 3.157 -34.400 8.155 1.00 33.51 C ATOM 978 CZ3 TRP A 604 3.484 -33.271 10.262 1.00 74.51 C ATOM 979 CH2 TRP A 604 2.953 -33.286 8.977 1.00 11.04 C ATOM 0 H TRP A 604 6.497 -39.581 9.880 1.00 71.44 H new ATOM 0 HA TRP A 604 6.428 -38.715 12.664 1.00 24.24 H new ATOM 0 HB2 TRP A 604 5.321 -36.672 12.349 1.00 10.20 H new ATOM 0 HB3 TRP A 604 6.849 -36.598 11.495 1.00 10.20 H new ATOM 0 HD1 TRP A 604 5.414 -38.344 8.919 1.00 43.45 H new ATOM 0 HE1 TRP A 604 4.029 -36.989 7.197 1.00 53.13 H new ATOM 0 HE3 TRP A 604 4.628 -34.269 11.828 1.00 44.41 H new ATOM 0 HZ2 TRP A 604 2.760 -34.447 7.152 1.00 33.51 H new ATOM 0 HZ3 TRP A 604 3.308 -32.395 10.868 1.00 74.51 H new ATOM 0 HH2 TRP A 604 2.386 -32.441 8.615 1.00 11.04 H new ATOM 990 N LYS A 605 4.220 -39.783 12.693 1.00 30.53 N ATOM 991 CA LYS A 605 2.972 -40.526 12.737 1.00 54.12 C ATOM 992 C LYS A 605 1.802 -39.543 12.819 1.00 33.42 C ATOM 993 O LYS A 605 1.958 -38.425 13.307 1.00 24.45 O ATOM 994 CB LYS A 605 2.996 -41.549 13.874 1.00 64.43 C ATOM 995 CG LYS A 605 2.469 -40.938 15.173 1.00 33.34 C ATOM 996 CD LYS A 605 2.392 -41.990 16.282 1.00 14.21 C ATOM 997 CE LYS A 605 3.703 -42.056 17.068 1.00 51.55 C ATOM 998 NZ LYS A 605 3.573 -42.978 18.217 1.00 33.43 N ATOM 0 H LYS A 605 4.664 -39.642 13.600 1.00 30.53 H new ATOM 0 HA LYS A 605 2.841 -41.104 11.823 1.00 54.12 H new ATOM 0 HB2 LYS A 605 2.390 -42.414 13.603 1.00 64.43 H new ATOM 0 HB3 LYS A 605 4.014 -41.908 14.024 1.00 64.43 H new ATOM 0 HG2 LYS A 605 3.120 -40.122 15.486 1.00 33.34 H new ATOM 0 HG3 LYS A 605 1.481 -40.510 15.003 1.00 33.34 H new ATOM 0 HD2 LYS A 605 1.571 -41.752 16.958 1.00 14.21 H new ATOM 0 HD3 LYS A 605 2.175 -42.966 15.848 1.00 14.21 H new ATOM 0 HE2 LYS A 605 4.509 -42.391 16.415 1.00 51.55 H new ATOM 0 HE3 LYS A 605 3.972 -41.061 17.422 1.00 51.55 H new ATOM 0 HZ1 LYS A 605 4.472 -43.011 18.739 1.00 33.43 H new ATOM 0 HZ2 LYS A 605 2.818 -42.642 18.848 1.00 33.43 H new ATOM 0 HZ3 LYS A 605 3.338 -43.931 17.873 1.00 33.43 H new ATOM 1011 N PRO A 606 0.625 -40.008 12.321 1.00 34.35 N ATOM 1012 CA PRO A 606 -0.571 -39.183 12.334 1.00 34.31 C ATOM 1013 C PRO A 606 -1.162 -39.095 13.743 1.00 60.22 C ATOM 1014 O PRO A 606 -0.483 -39.393 14.724 1.00 30.32 O ATOM 1015 CB PRO A 606 -1.512 -39.838 11.336 1.00 63.24 C ATOM 1016 CG PRO A 606 -0.998 -41.256 11.148 1.00 71.44 C ATOM 1017 CD PRO A 606 0.402 -41.327 11.736 1.00 53.14 C ATOM 0 HA PRO A 606 -0.371 -38.149 12.054 1.00 34.31 H new ATOM 0 HB2 PRO A 606 -2.536 -39.840 11.708 1.00 63.24 H new ATOM 0 HB3 PRO A 606 -1.518 -39.296 10.390 1.00 63.24 H new ATOM 0 HG2 PRO A 606 -1.657 -41.969 11.643 1.00 71.44 H new ATOM 0 HG3 PRO A 606 -0.981 -41.519 10.090 1.00 71.44 H new ATOM 0 HD2 PRO A 606 0.476 -42.112 12.489 1.00 53.14 H new ATOM 0 HD3 PRO A 606 1.143 -41.550 10.969 1.00 53.14 H new ATOM 1025 N GLY A 607 -2.421 -38.685 13.798 1.00 45.24 N ATOM 1026 CA GLY A 607 -3.110 -38.554 15.070 1.00 53.12 C ATOM 1027 C GLY A 607 -4.623 -38.703 14.891 1.00 24.35 C ATOM 1028 O GLY A 607 -5.134 -39.819 14.803 1.00 44.44 O ATOM 0 H GLY A 607 -2.981 -38.439 12.982 1.00 45.24 H new ATOM 0 HA2 GLY A 607 -2.746 -39.311 15.765 1.00 53.12 H new ATOM 0 HA3 GLY A 607 -2.886 -37.583 15.511 1.00 53.12 H new ATOM 1032 N GLY A 608 -5.296 -37.563 14.844 1.00 31.35 N ATOM 1033 CA GLY A 608 -6.740 -37.553 14.678 1.00 24.24 C ATOM 1034 C GLY A 608 -7.197 -36.296 13.935 1.00 32.35 C ATOM 1035 O GLY A 608 -6.638 -35.218 14.129 1.00 65.22 O ATOM 0 H GLY A 608 -4.869 -36.640 14.918 1.00 31.35 H new ATOM 0 HA2 GLY A 608 -7.053 -38.440 14.127 1.00 24.24 H new ATOM 0 HA3 GLY A 608 -7.222 -37.598 15.654 1.00 24.24 H new ATOM 1039 N VAL A 609 -8.210 -36.477 13.101 1.00 15.21 N ATOM 1040 CA VAL A 609 -8.750 -35.371 12.328 1.00 3.23 C ATOM 1041 C VAL A 609 -9.072 -34.207 13.268 1.00 61.12 C ATOM 1042 O VAL A 609 -9.806 -34.375 14.241 1.00 42.24 O ATOM 1043 CB VAL A 609 -9.961 -35.839 11.519 1.00 31.14 C ATOM 1044 CG1 VAL A 609 -10.478 -34.722 10.610 1.00 33.44 C ATOM 1045 CG2 VAL A 609 -9.628 -37.095 10.711 1.00 52.43 C ATOM 0 H VAL A 609 -8.671 -37.373 12.943 1.00 15.21 H new ATOM 0 HA VAL A 609 -8.014 -35.013 11.608 1.00 3.23 H new ATOM 0 HB VAL A 609 -10.755 -36.093 12.221 1.00 31.14 H new ATOM 0 HG11 VAL A 609 -11.339 -35.081 10.046 1.00 33.44 H new ATOM 0 HG12 VAL A 609 -10.773 -33.866 11.217 1.00 33.44 H new ATOM 0 HG13 VAL A 609 -9.691 -34.422 9.918 1.00 33.44 H new ATOM 0 HG21 VAL A 609 -10.506 -37.407 10.145 1.00 52.43 H new ATOM 0 HG22 VAL A 609 -8.811 -36.879 10.023 1.00 52.43 H new ATOM 0 HG23 VAL A 609 -9.330 -37.895 11.389 1.00 52.43 H new ATOM 1055 N ILE A 610 -8.507 -33.053 12.944 1.00 73.11 N ATOM 1056 CA ILE A 610 -8.725 -31.862 13.747 1.00 53.22 C ATOM 1057 C ILE A 610 -9.907 -31.076 13.175 1.00 34.35 C ATOM 1058 O ILE A 610 -10.140 -31.088 11.968 1.00 62.53 O ATOM 1059 CB ILE A 610 -7.437 -31.044 13.852 1.00 3.34 C ATOM 1060 CG1 ILE A 610 -6.205 -31.947 13.761 1.00 41.44 C ATOM 1061 CG2 ILE A 610 -7.430 -30.193 15.124 1.00 52.20 C ATOM 1062 CD1 ILE A 610 -4.971 -31.251 14.339 1.00 30.33 C ATOM 0 H ILE A 610 -7.899 -32.918 12.136 1.00 73.11 H new ATOM 0 HA ILE A 610 -8.987 -32.135 14.769 1.00 53.22 H new ATOM 0 HB ILE A 610 -7.398 -30.359 13.005 1.00 3.34 H new ATOM 0 HG12 ILE A 610 -6.390 -32.876 14.301 1.00 41.44 H new ATOM 0 HG13 ILE A 610 -6.022 -32.215 12.720 1.00 41.44 H new ATOM 0 HG21 ILE A 610 -6.503 -29.621 15.174 1.00 52.20 H new ATOM 0 HG22 ILE A 610 -8.278 -29.509 15.109 1.00 52.20 H new ATOM 0 HG23 ILE A 610 -7.504 -30.842 15.996 1.00 52.20 H new ATOM 0 HD11 ILE A 610 -4.110 -31.914 14.262 1.00 30.33 H new ATOM 0 HD12 ILE A 610 -4.775 -30.335 13.781 1.00 30.33 H new ATOM 0 HD13 ILE A 610 -5.148 -31.007 15.386 1.00 30.33 H new ATOM 1074 N SER A 611 -10.623 -30.412 14.071 1.00 52.23 N ATOM 1075 CA SER A 611 -11.776 -29.622 13.671 1.00 65.12 C ATOM 1076 C SER A 611 -11.782 -28.288 14.421 1.00 64.44 C ATOM 1077 O SER A 611 -11.634 -28.258 15.641 1.00 13.34 O ATOM 1078 CB SER A 611 -13.079 -30.381 13.927 1.00 20.03 C ATOM 1079 OG SER A 611 -12.924 -31.387 14.924 1.00 24.32 O ATOM 0 H SER A 611 -10.427 -30.405 15.072 1.00 52.23 H new ATOM 0 HA SER A 611 -11.704 -29.429 12.601 1.00 65.12 H new ATOM 0 HB2 SER A 611 -13.852 -29.679 14.238 1.00 20.03 H new ATOM 0 HB3 SER A 611 -13.420 -30.840 12.999 1.00 20.03 H new ATOM 0 HG SER A 611 -12.305 -31.071 15.615 1.00 24.32 H new ATOM 1085 N CYS A 612 -11.953 -27.218 13.658 1.00 34.43 N ATOM 1086 CA CYS A 612 -11.981 -25.885 14.235 1.00 25.12 C ATOM 1087 C CYS A 612 -13.121 -25.825 15.253 1.00 31.22 C ATOM 1088 O CYS A 612 -14.293 -25.835 14.879 1.00 1.11 O ATOM 1089 CB CYS A 612 -12.119 -24.806 13.159 1.00 5.04 C ATOM 1090 SG CYS A 612 -12.081 -23.087 13.787 1.00 74.40 S ATOM 0 H CYS A 612 -12.073 -27.247 12.646 1.00 34.43 H new ATOM 0 HA CYS A 612 -11.035 -25.684 14.739 1.00 25.12 H new ATOM 0 HB2 CYS A 612 -11.315 -24.931 12.434 1.00 5.04 H new ATOM 0 HB3 CYS A 612 -13.057 -24.962 12.625 1.00 5.04 H new ATOM 1095 N ARG A 613 -12.738 -25.765 16.520 1.00 14.21 N ATOM 1096 CA ARG A 613 -13.714 -25.703 17.595 1.00 75.43 C ATOM 1097 C ARG A 613 -14.427 -24.350 17.588 1.00 53.43 C ATOM 1098 O ARG A 613 -15.584 -24.251 17.993 1.00 75.22 O ATOM 1099 CB ARG A 613 -13.049 -25.914 18.956 1.00 21.51 C ATOM 1100 CG ARG A 613 -14.062 -25.760 20.092 1.00 54.32 C ATOM 1101 CD ARG A 613 -13.383 -25.901 21.456 1.00 75.34 C ATOM 1102 NE ARG A 613 -14.254 -26.665 22.377 1.00 24.33 N ATOM 1103 CZ ARG A 613 -15.214 -26.110 23.147 1.00 44.32 C ATOM 1104 NH1 ARG A 613 -15.435 -24.778 23.111 1.00 31.54 N ATOM 1105 NH2 ARG A 613 -15.933 -26.888 23.934 1.00 5.34 N ATOM 0 H ARG A 613 -11.765 -25.758 16.826 1.00 14.21 H new ATOM 0 HA ARG A 613 -14.439 -26.500 17.430 1.00 75.43 H new ATOM 0 HB2 ARG A 613 -12.601 -26.907 18.996 1.00 21.51 H new ATOM 0 HB3 ARG A 613 -12.241 -25.194 19.085 1.00 21.51 H new ATOM 0 HG2 ARG A 613 -14.547 -24.786 20.022 1.00 54.32 H new ATOM 0 HG3 ARG A 613 -14.844 -26.513 19.991 1.00 54.32 H new ATOM 0 HD2 ARG A 613 -12.425 -26.408 21.344 1.00 75.34 H new ATOM 0 HD3 ARG A 613 -13.175 -24.915 21.872 1.00 75.34 H new ATOM 0 HE ARG A 613 -14.120 -27.675 22.434 1.00 24.33 H new ATOM 0 HH11 ARG A 613 -14.875 -24.184 22.499 1.00 31.54 H new ATOM 0 HH12 ARG A 613 -16.162 -24.366 23.696 1.00 31.54 H new ATOM 0 HH21 ARG A 613 -15.760 -27.893 23.954 1.00 5.34 H new ATOM 0 HH22 ARG A 613 -16.662 -26.484 24.522 1.00 5.34 H new ATOM 1118 N ASN A 614 -13.707 -23.340 17.123 1.00 45.31 N ATOM 1119 CA ASN A 614 -14.256 -21.996 17.058 1.00 44.13 C ATOM 1120 C ASN A 614 -15.451 -21.984 16.103 1.00 35.04 C ATOM 1121 O ASN A 614 -16.425 -21.268 16.332 1.00 52.13 O ATOM 1122 CB ASN A 614 -13.219 -21.002 16.529 1.00 31.52 C ATOM 1123 CG ASN A 614 -12.226 -20.611 17.626 1.00 53.45 C ATOM 1124 OD1 ASN A 614 -11.009 -20.321 17.175 1.00 73.12 O flip ATOM 1125 ND2 ASN A 614 -12.544 -20.574 18.803 1.00 53.54 N flip ATOM 0 H ASN A 614 -12.748 -23.425 16.787 1.00 45.31 H new ATOM 0 HA ASN A 614 -14.554 -21.705 18.065 1.00 44.13 H new ATOM 0 HB2 ASN A 614 -12.683 -21.443 15.688 1.00 31.52 H new ATOM 0 HB3 ASN A 614 -13.722 -20.111 16.154 1.00 31.52 H new ATOM 0 HD21 ASN A 614 -13.497 -20.809 19.082 1.00 53.54 H new ATOM 0 HD22 ASN A 614 -11.857 -20.308 19.509 1.00 53.54 H new ATOM 1132 N CYS A 615 -15.339 -22.785 15.054 1.00 23.45 N ATOM 1133 CA CYS A 615 -16.399 -22.876 14.065 1.00 64.14 C ATOM 1134 C CYS A 615 -16.673 -24.356 13.789 1.00 12.20 C ATOM 1135 O CYS A 615 -17.680 -24.899 14.242 1.00 43.21 O ATOM 1136 CB CYS A 615 -16.045 -22.113 12.786 1.00 32.51 C ATOM 1137 SG CYS A 615 -15.531 -20.376 13.046 1.00 74.40 S ATOM 0 H CYS A 615 -14.530 -23.377 14.867 1.00 23.45 H new ATOM 0 HA CYS A 615 -17.303 -22.406 14.452 1.00 64.14 H new ATOM 0 HB2 CYS A 615 -15.241 -22.642 12.275 1.00 32.51 H new ATOM 0 HB3 CYS A 615 -16.909 -22.126 12.121 1.00 32.51 H new ATOM 1142 N GLY A 616 -15.760 -24.966 13.048 1.00 73.13 N ATOM 1143 CA GLY A 616 -15.892 -26.372 12.706 1.00 25.45 C ATOM 1144 C GLY A 616 -15.023 -26.727 11.498 1.00 44.20 C ATOM 1145 O GLY A 616 -14.631 -27.880 11.328 1.00 64.24 O ATOM 0 H GLY A 616 -14.926 -24.513 12.675 1.00 73.13 H new ATOM 0 HA2 GLY A 616 -15.603 -26.986 13.559 1.00 25.45 H new ATOM 0 HA3 GLY A 616 -16.935 -26.600 12.488 1.00 25.45 H new ATOM 1149 N GLU A 617 -14.747 -25.714 10.690 1.00 11.51 N ATOM 1150 CA GLU A 617 -13.932 -25.904 9.502 1.00 2.44 C ATOM 1151 C GLU A 617 -12.741 -26.812 9.816 1.00 51.23 C ATOM 1152 O GLU A 617 -11.786 -26.387 10.464 1.00 22.40 O ATOM 1153 CB GLU A 617 -13.464 -24.561 8.938 1.00 4.21 C ATOM 1154 CG GLU A 617 -12.963 -24.715 7.500 1.00 13.34 C ATOM 1155 CD GLU A 617 -12.629 -23.353 6.888 1.00 60.24 C ATOM 1156 OE1 GLU A 617 -11.667 -22.699 7.317 1.00 21.42 O ATOM 1157 OE2 GLU A 617 -13.409 -22.980 5.930 1.00 10.24 O ATOM 0 H GLU A 617 -15.073 -24.759 10.835 1.00 11.51 H new ATOM 0 HA GLU A 617 -14.542 -26.388 8.739 1.00 2.44 H new ATOM 0 HB2 GLU A 617 -14.285 -23.845 8.966 1.00 4.21 H new ATOM 0 HB3 GLU A 617 -12.667 -24.158 9.563 1.00 4.21 H new ATOM 0 HG2 GLU A 617 -12.078 -25.351 7.485 1.00 13.34 H new ATOM 0 HG3 GLU A 617 -13.723 -25.212 6.897 1.00 13.34 H new ATOM 1165 N VAL A 618 -12.837 -28.045 9.341 1.00 51.02 N ATOM 1166 CA VAL A 618 -11.780 -29.017 9.562 1.00 3.32 C ATOM 1167 C VAL A 618 -10.465 -28.469 9.005 1.00 45.34 C ATOM 1168 O VAL A 618 -10.422 -27.973 7.880 1.00 63.35 O ATOM 1169 CB VAL A 618 -12.172 -30.365 8.953 1.00 3.54 C ATOM 1170 CG1 VAL A 618 -10.976 -31.319 8.918 1.00 13.41 C ATOM 1171 CG2 VAL A 618 -13.348 -30.986 9.709 1.00 24.35 C ATOM 0 H VAL A 618 -13.631 -28.393 8.804 1.00 51.02 H new ATOM 0 HA VAL A 618 -11.635 -29.188 10.629 1.00 3.32 H new ATOM 0 HB VAL A 618 -12.490 -30.189 7.925 1.00 3.54 H new ATOM 0 HG11 VAL A 618 -11.281 -32.270 8.481 1.00 13.41 H new ATOM 0 HG12 VAL A 618 -10.179 -30.882 8.316 1.00 13.41 H new ATOM 0 HG13 VAL A 618 -10.614 -31.486 9.932 1.00 13.41 H new ATOM 0 HG21 VAL A 618 -13.607 -31.943 9.256 1.00 24.35 H new ATOM 0 HG22 VAL A 618 -13.069 -31.141 10.751 1.00 24.35 H new ATOM 0 HG23 VAL A 618 -14.207 -30.317 9.659 1.00 24.35 H new ATOM 1181 N TRP A 619 -9.424 -28.576 9.817 1.00 22.23 N ATOM 1182 CA TRP A 619 -8.111 -28.098 9.419 1.00 2.43 C ATOM 1183 C TRP A 619 -7.361 -29.261 8.768 1.00 60.25 C ATOM 1184 O TRP A 619 -6.685 -29.080 7.756 1.00 2.11 O ATOM 1185 CB TRP A 619 -7.362 -27.496 10.610 1.00 31.44 C ATOM 1186 CG TRP A 619 -8.051 -26.277 11.227 1.00 44.01 C ATOM 1187 CD1 TRP A 619 -8.848 -25.386 10.622 1.00 43.12 C ATOM 1188 CD2 TRP A 619 -7.970 -25.848 12.603 1.00 60.24 C ATOM 1189 NE1 TRP A 619 -9.285 -24.418 11.503 1.00 0.01 N ATOM 1190 CE2 TRP A 619 -8.734 -24.708 12.746 1.00 73.31 C ATOM 1191 CE3 TRP A 619 -7.274 -26.405 13.690 1.00 34.40 C ATOM 1192 CZ2 TRP A 619 -8.876 -24.028 13.961 1.00 2.13 C ATOM 1193 CZ3 TRP A 619 -7.426 -25.714 14.898 1.00 50.43 C ATOM 1194 CH2 TRP A 619 -8.192 -24.565 15.058 1.00 3.34 C ATOM 0 H TRP A 619 -9.463 -28.987 10.750 1.00 22.23 H new ATOM 0 HA TRP A 619 -8.199 -27.291 8.692 1.00 2.43 H new ATOM 0 HB2 TRP A 619 -7.245 -28.261 11.377 1.00 31.44 H new ATOM 0 HB3 TRP A 619 -6.360 -27.211 10.289 1.00 31.44 H new ATOM 0 HD1 TRP A 619 -9.115 -25.421 9.576 1.00 43.12 H new ATOM 0 HE1 TRP A 619 -9.899 -23.634 11.283 1.00 0.01 H new ATOM 0 HE3 TRP A 619 -6.670 -27.296 13.600 1.00 34.40 H new ATOM 0 HZ2 TRP A 619 -9.481 -23.137 14.048 1.00 2.13 H new ATOM 0 HZ3 TRP A 619 -6.912 -26.100 15.766 1.00 50.43 H new ATOM 0 HH2 TRP A 619 -8.259 -24.089 16.025 1.00 3.34 H new ATOM 1205 N GLY A 620 -7.506 -30.430 9.374 1.00 71.44 N ATOM 1206 CA GLY A 620 -6.851 -31.623 8.865 1.00 70.51 C ATOM 1207 C GLY A 620 -6.818 -32.726 9.926 1.00 51.43 C ATOM 1208 O GLY A 620 -7.862 -33.239 10.325 1.00 10.12 O ATOM 0 H GLY A 620 -8.067 -30.577 10.213 1.00 71.44 H new ATOM 0 HA2 GLY A 620 -7.376 -31.981 7.980 1.00 70.51 H new ATOM 0 HA3 GLY A 620 -5.834 -31.380 8.556 1.00 70.51 H new ATOM 1212 N LEU A 621 -5.608 -33.057 10.352 1.00 50.32 N ATOM 1213 CA LEU A 621 -5.425 -34.088 11.358 1.00 34.45 C ATOM 1214 C LEU A 621 -4.179 -33.772 12.187 1.00 44.42 C ATOM 1215 O LEU A 621 -3.271 -33.090 11.713 1.00 63.41 O ATOM 1216 CB LEU A 621 -5.396 -35.473 10.708 1.00 41.23 C ATOM 1217 CG LEU A 621 -4.029 -35.954 10.216 1.00 11.11 C ATOM 1218 CD1 LEU A 621 -3.402 -34.938 9.259 1.00 20.13 C ATOM 1219 CD2 LEU A 621 -3.106 -36.279 11.393 1.00 55.44 C ATOM 0 H LEU A 621 -4.744 -32.629 10.018 1.00 50.32 H new ATOM 0 HA LEU A 621 -6.270 -34.102 12.046 1.00 34.45 H new ATOM 0 HB2 LEU A 621 -5.777 -36.198 11.427 1.00 41.23 H new ATOM 0 HB3 LEU A 621 -6.084 -35.470 9.863 1.00 41.23 H new ATOM 0 HG LEU A 621 -4.173 -36.878 9.655 1.00 11.11 H new ATOM 0 HD11 LEU A 621 -2.431 -35.304 8.924 1.00 20.13 H new ATOM 0 HD12 LEU A 621 -4.054 -34.799 8.397 1.00 20.13 H new ATOM 0 HD13 LEU A 621 -3.273 -33.986 9.773 1.00 20.13 H new ATOM 0 HD21 LEU A 621 -2.141 -36.618 11.016 1.00 55.44 H new ATOM 0 HD22 LEU A 621 -2.964 -35.386 12.001 1.00 55.44 H new ATOM 0 HD23 LEU A 621 -3.555 -37.065 12.001 1.00 55.44 H new ATOM 1231 N GLN A 622 -4.175 -34.281 13.410 1.00 43.11 N ATOM 1232 CA GLN A 622 -3.054 -34.061 14.309 1.00 54.23 C ATOM 1233 C GLN A 622 -1.930 -35.054 14.009 1.00 71.32 C ATOM 1234 O GLN A 622 -2.183 -36.242 13.810 1.00 3.43 O ATOM 1235 CB GLN A 622 -3.497 -34.158 15.770 1.00 24.11 C ATOM 1236 CG GLN A 622 -2.819 -33.082 16.621 1.00 53.32 C ATOM 1237 CD GLN A 622 -2.603 -33.571 18.054 1.00 21.31 C ATOM 1238 OE1 GLN A 622 -1.574 -33.339 18.668 1.00 34.51 O ATOM 1239 NE2 GLN A 622 -3.627 -34.259 18.551 1.00 22.42 N ATOM 0 H GLN A 622 -4.930 -34.845 13.800 1.00 43.11 H new ATOM 0 HA GLN A 622 -2.674 -33.053 14.145 1.00 54.23 H new ATOM 0 HB2 GLN A 622 -4.580 -34.048 15.834 1.00 24.11 H new ATOM 0 HB3 GLN A 622 -3.253 -35.145 16.163 1.00 24.11 H new ATOM 0 HG2 GLN A 622 -1.861 -32.812 16.177 1.00 53.32 H new ATOM 0 HG3 GLN A 622 -3.432 -32.180 16.629 1.00 53.32 H new ATOM 0 HE21 GLN A 622 -4.459 -34.417 17.983 1.00 22.42 H new ATOM 0 HE22 GLN A 622 -3.580 -34.629 19.501 1.00 22.42 H new ATOM 1248 N MET A 623 -0.713 -34.532 13.985 1.00 2.13 N ATOM 1249 CA MET A 623 0.451 -35.358 13.713 1.00 60.11 C ATOM 1250 C MET A 623 1.477 -35.249 14.843 1.00 62.53 C ATOM 1251 O MET A 623 1.746 -34.156 15.338 1.00 24.55 O ATOM 1252 CB MET A 623 1.093 -34.918 12.396 1.00 50.22 C ATOM 1253 CG MET A 623 0.149 -35.162 11.217 1.00 73.20 C ATOM 1254 SD MET A 623 1.080 -35.682 9.786 1.00 45.20 S ATOM 1255 CE MET A 623 1.223 -37.428 10.127 1.00 63.25 C ATOM 0 H MET A 623 -0.507 -33.547 14.150 1.00 2.13 H new ATOM 0 HA MET A 623 0.127 -36.396 13.640 1.00 60.11 H new ATOM 0 HB2 MET A 623 1.349 -33.860 12.448 1.00 50.22 H new ATOM 0 HB3 MET A 623 2.023 -35.464 12.241 1.00 50.22 H new ATOM 0 HG2 MET A 623 -0.585 -35.924 11.480 1.00 73.20 H new ATOM 0 HG3 MET A 623 -0.405 -34.251 10.989 1.00 73.20 H new ATOM 0 HE1 MET A 623 1.940 -37.876 9.438 1.00 63.25 H new ATOM 0 HE2 MET A 623 1.566 -37.572 11.152 1.00 63.25 H new ATOM 0 HE3 MET A 623 0.251 -37.904 10.000 1.00 63.25 H new ATOM 1265 N ILE A 624 2.022 -36.398 15.217 1.00 50.24 N ATOM 1266 CA ILE A 624 3.013 -36.446 16.279 1.00 54.54 C ATOM 1267 C ILE A 624 4.404 -36.618 15.665 1.00 14.22 C ATOM 1268 O ILE A 624 4.538 -37.142 14.560 1.00 3.45 O ATOM 1269 CB ILE A 624 2.652 -37.527 17.299 1.00 2.12 C ATOM 1270 CG1 ILE A 624 1.250 -37.300 17.867 1.00 53.52 C ATOM 1271 CG2 ILE A 624 3.710 -37.614 18.402 1.00 75.44 C ATOM 1272 CD1 ILE A 624 0.205 -38.095 17.081 1.00 12.44 C ATOM 0 H ILE A 624 1.796 -37.303 14.803 1.00 50.24 H new ATOM 0 HA ILE A 624 3.024 -35.508 16.834 1.00 54.54 H new ATOM 0 HB ILE A 624 2.639 -38.489 16.787 1.00 2.12 H new ATOM 0 HG12 ILE A 624 1.226 -37.598 18.915 1.00 53.52 H new ATOM 0 HG13 ILE A 624 1.007 -36.238 17.831 1.00 53.52 H new ATOM 0 HG21 ILE A 624 3.430 -38.390 19.114 1.00 75.44 H new ATOM 0 HG22 ILE A 624 4.676 -37.858 17.961 1.00 75.44 H new ATOM 0 HG23 ILE A 624 3.778 -36.656 18.917 1.00 75.44 H new ATOM 0 HD11 ILE A 624 -0.783 -37.916 17.505 1.00 12.44 H new ATOM 0 HD12 ILE A 624 0.215 -37.778 16.038 1.00 12.44 H new ATOM 0 HD13 ILE A 624 0.438 -39.158 17.139 1.00 12.44 H new ATOM 1284 N TYR A 625 5.403 -36.167 16.409 1.00 62.11 N ATOM 1285 CA TYR A 625 6.779 -36.265 15.952 1.00 1.20 C ATOM 1286 C TYR A 625 7.755 -36.162 17.126 1.00 42.22 C ATOM 1287 O TYR A 625 7.748 -35.174 17.859 1.00 63.03 O ATOM 1288 CB TYR A 625 6.998 -35.075 15.016 1.00 2.41 C ATOM 1289 CG TYR A 625 8.468 -34.692 14.829 1.00 33.05 C ATOM 1290 CD1 TYR A 625 9.312 -35.521 14.119 1.00 72.00 C ATOM 1291 CD2 TYR A 625 8.949 -33.518 15.372 1.00 44.32 C ATOM 1292 CE1 TYR A 625 10.695 -35.161 13.943 1.00 11.14 C ATOM 1293 CE2 TYR A 625 10.333 -33.158 15.196 1.00 15.42 C ATOM 1294 CZ TYR A 625 11.137 -33.997 14.491 1.00 60.03 C ATOM 1295 OH TYR A 625 12.443 -33.657 14.325 1.00 43.12 O ATOM 0 H TYR A 625 5.287 -35.733 17.325 1.00 62.11 H new ATOM 0 HA TYR A 625 6.953 -37.222 15.459 1.00 1.20 H new ATOM 0 HB2 TYR A 625 6.567 -35.308 14.042 1.00 2.41 H new ATOM 0 HB3 TYR A 625 6.456 -34.214 15.407 1.00 2.41 H new ATOM 0 HD1 TYR A 625 8.935 -36.440 13.695 1.00 72.00 H new ATOM 0 HD2 TYR A 625 8.289 -32.870 15.928 1.00 44.32 H new ATOM 0 HE1 TYR A 625 11.366 -35.800 13.389 1.00 11.14 H new ATOM 0 HE2 TYR A 625 10.723 -32.242 15.615 1.00 15.42 H new ATOM 0 HH TYR A 625 12.528 -32.681 14.314 1.00 43.12 H new ATOM 1305 N LYS A 626 8.571 -37.196 17.268 1.00 45.34 N ATOM 1306 CA LYS A 626 9.551 -37.234 18.340 1.00 65.03 C ATOM 1307 C LYS A 626 8.836 -37.087 19.684 1.00 21.22 C ATOM 1308 O LYS A 626 9.462 -36.762 20.692 1.00 53.20 O ATOM 1309 CB LYS A 626 10.642 -36.187 18.106 1.00 25.10 C ATOM 1310 CG LYS A 626 12.033 -36.788 18.319 1.00 5.23 C ATOM 1311 CD LYS A 626 12.585 -37.369 17.016 1.00 4.10 C ATOM 1312 CE LYS A 626 11.618 -38.393 16.419 1.00 30.14 C ATOM 1313 NZ LYS A 626 12.146 -38.922 15.142 1.00 61.10 N ATOM 0 H LYS A 626 8.574 -38.014 16.658 1.00 45.34 H new ATOM 0 HA LYS A 626 10.063 -38.196 18.354 1.00 65.03 H new ATOM 0 HB2 LYS A 626 10.563 -35.794 17.092 1.00 25.10 H new ATOM 0 HB3 LYS A 626 10.497 -35.347 18.785 1.00 25.10 H new ATOM 0 HG2 LYS A 626 12.710 -36.021 18.695 1.00 5.23 H new ATOM 0 HG3 LYS A 626 11.983 -37.569 19.077 1.00 5.23 H new ATOM 0 HD2 LYS A 626 12.757 -36.566 16.300 1.00 4.10 H new ATOM 0 HD3 LYS A 626 13.549 -37.841 17.204 1.00 4.10 H new ATOM 0 HE2 LYS A 626 11.465 -39.211 17.123 1.00 30.14 H new ATOM 0 HE3 LYS A 626 10.645 -37.930 16.253 1.00 30.14 H new ATOM 0 HZ1 LYS A 626 11.477 -39.616 14.751 1.00 61.10 H new ATOM 0 HZ2 LYS A 626 12.269 -38.141 14.467 1.00 61.10 H new ATOM 0 HZ3 LYS A 626 13.063 -39.382 15.310 1.00 61.10 H new ATOM 1326 N SER A 627 7.535 -37.334 19.656 1.00 73.21 N ATOM 1327 CA SER A 627 6.728 -37.234 20.860 1.00 55.51 C ATOM 1328 C SER A 627 6.281 -35.785 21.071 1.00 72.52 C ATOM 1329 O SER A 627 6.224 -35.308 22.203 1.00 33.31 O ATOM 1330 CB SER A 627 7.498 -37.735 22.083 1.00 51.11 C ATOM 1331 OG SER A 627 8.221 -36.688 22.725 1.00 55.32 O ATOM 0 H SER A 627 7.019 -37.603 18.818 1.00 73.21 H new ATOM 0 HA SER A 627 5.848 -37.865 20.735 1.00 55.51 H new ATOM 0 HB2 SER A 627 6.801 -38.182 22.792 1.00 51.11 H new ATOM 0 HB3 SER A 627 8.190 -38.520 21.779 1.00 51.11 H new ATOM 0 HG SER A 627 8.737 -36.190 22.057 1.00 55.32 H new ATOM 1337 N VAL A 628 5.975 -35.127 19.963 1.00 44.34 N ATOM 1338 CA VAL A 628 5.536 -33.743 20.012 1.00 55.32 C ATOM 1339 C VAL A 628 4.183 -33.617 19.307 1.00 2.43 C ATOM 1340 O VAL A 628 3.990 -34.166 18.224 1.00 60.11 O ATOM 1341 CB VAL A 628 6.609 -32.831 19.413 1.00 13.15 C ATOM 1342 CG1 VAL A 628 6.072 -31.413 19.209 1.00 74.11 C ATOM 1343 CG2 VAL A 628 7.867 -32.821 20.284 1.00 52.40 C ATOM 0 H VAL A 628 6.022 -35.527 19.026 1.00 44.34 H new ATOM 0 HA VAL A 628 5.397 -33.423 21.045 1.00 55.32 H new ATOM 0 HB VAL A 628 6.881 -33.230 18.436 1.00 13.15 H new ATOM 0 HG11 VAL A 628 6.854 -30.785 18.782 1.00 74.11 H new ATOM 0 HG12 VAL A 628 5.219 -31.441 18.531 1.00 74.11 H new ATOM 0 HG13 VAL A 628 5.759 -31.001 20.168 1.00 74.11 H new ATOM 0 HG21 VAL A 628 8.614 -32.166 19.837 1.00 52.40 H new ATOM 0 HG22 VAL A 628 7.616 -32.458 21.281 1.00 52.40 H new ATOM 0 HG23 VAL A 628 8.268 -33.832 20.356 1.00 52.40 H new ATOM 1353 N LYS A 629 3.282 -32.890 19.951 1.00 1.52 N ATOM 1354 CA LYS A 629 1.953 -32.684 19.400 1.00 64.21 C ATOM 1355 C LYS A 629 1.992 -31.520 18.409 1.00 53.45 C ATOM 1356 O LYS A 629 1.984 -30.357 18.810 1.00 33.14 O ATOM 1357 CB LYS A 629 0.930 -32.503 20.522 1.00 13.15 C ATOM 1358 CG LYS A 629 1.251 -33.412 21.710 1.00 25.31 C ATOM 1359 CD LYS A 629 1.352 -34.874 21.270 1.00 71.11 C ATOM 1360 CE LYS A 629 -0.037 -35.483 21.070 1.00 33.21 C ATOM 1361 NZ LYS A 629 -0.465 -35.348 19.660 1.00 44.34 N ATOM 0 H LYS A 629 3.446 -32.436 20.850 1.00 1.52 H new ATOM 0 HA LYS A 629 1.630 -33.565 18.845 1.00 64.21 H new ATOM 0 HB2 LYS A 629 0.922 -31.463 20.847 1.00 13.15 H new ATOM 0 HB3 LYS A 629 -0.069 -32.727 20.148 1.00 13.15 H new ATOM 0 HG2 LYS A 629 2.190 -33.100 22.168 1.00 25.31 H new ATOM 0 HG3 LYS A 629 0.477 -33.310 22.470 1.00 25.31 H new ATOM 0 HD2 LYS A 629 1.919 -34.940 20.341 1.00 71.11 H new ATOM 0 HD3 LYS A 629 1.900 -35.446 22.019 1.00 71.11 H new ATOM 0 HE2 LYS A 629 -0.023 -36.536 21.353 1.00 33.21 H new ATOM 0 HE3 LYS A 629 -0.755 -34.987 21.723 1.00 33.21 H new ATOM 0 HZ1 LYS A 629 -1.064 -36.157 19.400 1.00 44.34 H new ATOM 0 HZ2 LYS A 629 -1.004 -34.466 19.544 1.00 44.34 H new ATOM 0 HZ3 LYS A 629 0.372 -35.325 19.044 1.00 44.34 H new ATOM 1374 N LEU A 630 2.033 -31.872 17.132 1.00 74.00 N ATOM 1375 CA LEU A 630 2.072 -30.871 16.080 1.00 42.50 C ATOM 1376 C LEU A 630 0.927 -31.124 15.098 1.00 51.45 C ATOM 1377 O LEU A 630 0.935 -32.116 14.372 1.00 70.45 O ATOM 1378 CB LEU A 630 3.453 -30.840 15.421 1.00 74.23 C ATOM 1379 CG LEU A 630 4.649 -30.764 16.372 1.00 74.11 C ATOM 1380 CD1 LEU A 630 5.925 -31.260 15.689 1.00 54.11 C ATOM 1381 CD2 LEU A 630 4.812 -29.351 16.935 1.00 0.02 C ATOM 0 H LEU A 630 2.040 -32.837 16.802 1.00 74.00 H new ATOM 0 HA LEU A 630 1.921 -29.875 16.496 1.00 42.50 H new ATOM 0 HB2 LEU A 630 3.560 -31.733 14.805 1.00 74.23 H new ATOM 0 HB3 LEU A 630 3.494 -29.983 14.749 1.00 74.23 H new ATOM 0 HG LEU A 630 4.458 -31.427 17.216 1.00 74.11 H new ATOM 0 HD11 LEU A 630 6.760 -31.195 16.387 1.00 54.11 H new ATOM 0 HD12 LEU A 630 5.792 -32.296 15.377 1.00 54.11 H new ATOM 0 HD13 LEU A 630 6.134 -30.642 14.815 1.00 54.11 H new ATOM 0 HD21 LEU A 630 5.669 -29.324 17.608 1.00 0.02 H new ATOM 0 HD22 LEU A 630 4.971 -28.649 16.116 1.00 0.02 H new ATOM 0 HD23 LEU A 630 3.912 -29.071 17.482 1.00 0.02 H new ATOM 1393 N PRO A 631 -0.056 -30.184 15.107 1.00 53.03 N ATOM 1394 CA PRO A 631 -1.206 -30.295 14.225 1.00 32.44 C ATOM 1395 C PRO A 631 -0.830 -29.938 12.786 1.00 75.21 C ATOM 1396 O PRO A 631 0.208 -29.325 12.546 1.00 44.04 O ATOM 1397 CB PRO A 631 -2.247 -29.360 14.817 1.00 15.42 C ATOM 1398 CG PRO A 631 -1.486 -28.414 15.732 1.00 12.00 C ATOM 1399 CD PRO A 631 -0.099 -28.995 15.953 1.00 72.10 C ATOM 0 HA PRO A 631 -1.593 -31.312 14.164 1.00 32.44 H new ATOM 0 HB2 PRO A 631 -2.769 -28.810 14.034 1.00 15.42 H new ATOM 0 HB3 PRO A 631 -3.002 -29.917 15.372 1.00 15.42 H new ATOM 0 HG2 PRO A 631 -1.418 -27.422 15.284 1.00 12.00 H new ATOM 0 HG3 PRO A 631 -2.008 -28.300 16.682 1.00 12.00 H new ATOM 0 HD2 PRO A 631 0.678 -28.283 15.675 1.00 72.10 H new ATOM 0 HD3 PRO A 631 0.062 -29.249 17.001 1.00 72.10 H new ATOM 1407 N VAL A 632 -1.696 -30.337 11.866 1.00 74.11 N ATOM 1408 CA VAL A 632 -1.469 -30.067 10.456 1.00 4.45 C ATOM 1409 C VAL A 632 -2.681 -29.334 9.880 1.00 54.52 C ATOM 1410 O VAL A 632 -3.633 -29.965 9.422 1.00 44.34 O ATOM 1411 CB VAL A 632 -1.150 -31.369 9.719 1.00 55.45 C ATOM 1412 CG1 VAL A 632 -1.289 -31.189 8.205 1.00 4.04 C ATOM 1413 CG2 VAL A 632 0.244 -31.880 10.085 1.00 2.21 C ATOM 0 H VAL A 632 -2.557 -30.845 12.069 1.00 74.11 H new ATOM 0 HA VAL A 632 -0.605 -29.416 10.326 1.00 4.45 H new ATOM 0 HB VAL A 632 -1.874 -32.120 10.036 1.00 55.45 H new ATOM 0 HG11 VAL A 632 -1.057 -32.129 7.704 1.00 4.04 H new ATOM 0 HG12 VAL A 632 -2.310 -30.893 7.966 1.00 4.04 H new ATOM 0 HG13 VAL A 632 -0.599 -30.417 7.866 1.00 4.04 H new ATOM 0 HG21 VAL A 632 0.445 -32.806 9.547 1.00 2.21 H new ATOM 0 HG22 VAL A 632 0.989 -31.133 9.811 1.00 2.21 H new ATOM 0 HG23 VAL A 632 0.293 -32.065 11.158 1.00 2.21 H new ATOM 1423 N LEU A 633 -2.608 -28.011 9.921 1.00 33.33 N ATOM 1424 CA LEU A 633 -3.688 -27.186 9.409 1.00 54.44 C ATOM 1425 C LEU A 633 -3.387 -26.802 7.958 1.00 33.33 C ATOM 1426 O LEU A 633 -2.290 -27.053 7.461 1.00 14.12 O ATOM 1427 CB LEU A 633 -3.926 -25.984 10.326 1.00 60.14 C ATOM 1428 CG LEU A 633 -3.859 -26.264 11.828 1.00 3.44 C ATOM 1429 CD1 LEU A 633 -4.141 -27.738 12.125 1.00 11.40 C ATOM 1430 CD2 LEU A 633 -2.520 -25.808 12.411 1.00 5.04 C ATOM 0 H LEU A 633 -1.817 -27.491 10.301 1.00 33.33 H new ATOM 0 HA LEU A 633 -4.624 -27.744 9.404 1.00 54.44 H new ATOM 0 HB2 LEU A 633 -3.189 -25.217 10.086 1.00 60.14 H new ATOM 0 HB3 LEU A 633 -4.907 -25.566 10.098 1.00 60.14 H new ATOM 0 HG LEU A 633 -4.639 -25.682 12.319 1.00 3.44 H new ATOM 0 HD11 LEU A 633 -4.087 -27.909 13.200 1.00 11.40 H new ATOM 0 HD12 LEU A 633 -5.137 -27.997 11.766 1.00 11.40 H new ATOM 0 HD13 LEU A 633 -3.400 -28.359 11.621 1.00 11.40 H new ATOM 0 HD21 LEU A 633 -2.498 -26.018 13.480 1.00 5.04 H new ATOM 0 HD22 LEU A 633 -1.708 -26.343 11.919 1.00 5.04 H new ATOM 0 HD23 LEU A 633 -2.399 -24.737 12.249 1.00 5.04 H new ATOM 1442 N LYS A 634 -4.381 -26.201 7.320 1.00 4.03 N ATOM 1443 CA LYS A 634 -4.236 -25.781 5.937 1.00 42.31 C ATOM 1444 C LYS A 634 -3.952 -24.278 5.892 1.00 5.01 C ATOM 1445 O LYS A 634 -3.793 -23.641 6.932 1.00 23.45 O ATOM 1446 CB LYS A 634 -5.459 -26.200 5.119 1.00 42.13 C ATOM 1447 CG LYS A 634 -5.830 -27.658 5.396 1.00 73.12 C ATOM 1448 CD LYS A 634 -7.347 -27.826 5.505 1.00 71.45 C ATOM 1449 CE LYS A 634 -8.071 -26.947 4.483 1.00 1.43 C ATOM 1450 NZ LYS A 634 -9.363 -27.557 4.096 1.00 5.05 N ATOM 0 H LYS A 634 -5.290 -25.995 7.735 1.00 4.03 H new ATOM 0 HA LYS A 634 -3.385 -26.281 5.474 1.00 42.31 H new ATOM 0 HB2 LYS A 634 -6.302 -25.554 5.362 1.00 42.13 H new ATOM 0 HB3 LYS A 634 -5.253 -26.069 4.057 1.00 42.13 H new ATOM 0 HG2 LYS A 634 -5.447 -28.293 4.597 1.00 73.12 H new ATOM 0 HG3 LYS A 634 -5.356 -27.988 6.321 1.00 73.12 H new ATOM 0 HD2 LYS A 634 -7.613 -28.871 5.345 1.00 71.45 H new ATOM 0 HD3 LYS A 634 -7.674 -27.565 6.511 1.00 71.45 H new ATOM 0 HE2 LYS A 634 -8.242 -25.956 4.903 1.00 1.43 H new ATOM 0 HE3 LYS A 634 -7.446 -26.815 3.600 1.00 1.43 H new ATOM 0 HZ1 LYS A 634 -10.094 -26.819 4.045 1.00 5.05 H new ATOM 0 HZ2 LYS A 634 -9.267 -28.014 3.167 1.00 5.05 H new ATOM 0 HZ3 LYS A 634 -9.637 -28.267 4.804 1.00 5.05 H new ATOM 1463 N VAL A 635 -3.896 -23.755 4.676 1.00 10.32 N ATOM 1464 CA VAL A 635 -3.634 -22.339 4.482 1.00 3.31 C ATOM 1465 C VAL A 635 -4.944 -21.622 4.151 1.00 35.33 C ATOM 1466 O VAL A 635 -5.075 -20.421 4.383 1.00 33.43 O ATOM 1467 CB VAL A 635 -2.561 -22.148 3.408 1.00 5.33 C ATOM 1468 CG1 VAL A 635 -3.170 -22.215 2.006 1.00 3.45 C ATOM 1469 CG2 VAL A 635 -1.805 -20.834 3.616 1.00 50.40 C ATOM 0 H VAL A 635 -4.028 -24.286 3.815 1.00 10.32 H new ATOM 0 HA VAL A 635 -3.243 -21.895 5.397 1.00 3.31 H new ATOM 0 HB VAL A 635 -1.845 -22.965 3.501 1.00 5.33 H new ATOM 0 HG11 VAL A 635 -2.386 -22.076 1.262 1.00 3.45 H new ATOM 0 HG12 VAL A 635 -3.641 -23.187 1.860 1.00 3.45 H new ATOM 0 HG13 VAL A 635 -3.918 -21.429 1.896 1.00 3.45 H new ATOM 0 HG21 VAL A 635 -1.048 -20.723 2.839 1.00 50.40 H new ATOM 0 HG22 VAL A 635 -2.504 -20.000 3.563 1.00 50.40 H new ATOM 0 HG23 VAL A 635 -1.323 -20.842 4.594 1.00 50.40 H new ATOM 1479 N ARG A 636 -5.882 -22.389 3.615 1.00 61.45 N ATOM 1480 CA ARG A 636 -7.178 -21.843 3.250 1.00 42.14 C ATOM 1481 C ARG A 636 -8.096 -21.793 4.472 1.00 12.22 C ATOM 1482 O ARG A 636 -9.134 -21.132 4.447 1.00 25.32 O ATOM 1483 CB ARG A 636 -7.841 -22.682 2.156 1.00 73.40 C ATOM 1484 CG ARG A 636 -8.109 -24.107 2.645 1.00 34.12 C ATOM 1485 CD ARG A 636 -7.915 -25.120 1.515 1.00 34.44 C ATOM 1486 NE ARG A 636 -8.902 -26.216 1.643 1.00 14.20 N ATOM 1487 CZ ARG A 636 -10.240 -26.035 1.623 1.00 31.42 C ATOM 1488 NH1 ARG A 636 -10.763 -24.799 1.481 1.00 43.25 N ATOM 1489 NH2 ARG A 636 -11.030 -27.086 1.746 1.00 64.23 N ATOM 0 H ARG A 636 -5.770 -23.385 3.425 1.00 61.45 H new ATOM 0 HA ARG A 636 -7.018 -20.834 2.871 1.00 42.14 H new ATOM 0 HB2 ARG A 636 -8.778 -22.215 1.853 1.00 73.40 H new ATOM 0 HB3 ARG A 636 -7.199 -22.710 1.275 1.00 73.40 H new ATOM 0 HG2 ARG A 636 -7.438 -24.344 3.470 1.00 34.12 H new ATOM 0 HG3 ARG A 636 -9.126 -24.178 3.031 1.00 34.12 H new ATOM 0 HD2 ARG A 636 -8.030 -24.627 0.550 1.00 34.44 H new ATOM 0 HD3 ARG A 636 -6.903 -25.525 1.548 1.00 34.44 H new ATOM 0 HE ARG A 636 -8.549 -27.167 1.753 1.00 14.20 H new ATOM 0 HH11 ARG A 636 -10.146 -23.992 1.388 1.00 43.25 H new ATOM 0 HH12 ARG A 636 -11.775 -24.672 1.467 1.00 43.25 H new ATOM 0 HH21 ARG A 636 -10.627 -28.017 1.854 1.00 64.23 H new ATOM 0 HH22 ARG A 636 -12.043 -26.967 1.733 1.00 64.23 H new ATOM 1502 N SER A 637 -7.682 -22.500 5.513 1.00 4.33 N ATOM 1503 CA SER A 637 -8.454 -22.544 6.743 1.00 31.12 C ATOM 1504 C SER A 637 -7.880 -21.553 7.758 1.00 55.45 C ATOM 1505 O SER A 637 -8.510 -21.265 8.775 1.00 62.44 O ATOM 1506 CB SER A 637 -8.471 -23.956 7.332 1.00 0.03 C ATOM 1507 OG SER A 637 -9.557 -24.731 6.831 1.00 11.41 O ATOM 0 H SER A 637 -6.821 -23.047 5.530 1.00 4.33 H new ATOM 0 HA SER A 637 -9.481 -22.263 6.512 1.00 31.12 H new ATOM 0 HB2 SER A 637 -7.531 -24.457 7.100 1.00 0.03 H new ATOM 0 HB3 SER A 637 -8.540 -23.895 8.418 1.00 0.03 H new ATOM 0 HG SER A 637 -9.532 -25.626 7.230 1.00 11.41 H new ATOM 1513 N MET A 638 -6.692 -21.057 7.445 1.00 12.33 N ATOM 1514 CA MET A 638 -6.027 -20.103 8.317 1.00 65.43 C ATOM 1515 C MET A 638 -5.877 -18.744 7.630 1.00 33.21 C ATOM 1516 O MET A 638 -5.350 -18.659 6.522 1.00 21.12 O ATOM 1517 CB MET A 638 -4.644 -20.638 8.697 1.00 14.11 C ATOM 1518 CG MET A 638 -4.761 -21.906 9.545 1.00 34.13 C ATOM 1519 SD MET A 638 -5.315 -21.491 11.191 1.00 71.14 S ATOM 1520 CE MET A 638 -6.921 -22.270 11.183 1.00 70.30 C ATOM 0 H MET A 638 -6.173 -21.297 6.600 1.00 12.33 H new ATOM 0 HA MET A 638 -6.635 -19.971 9.212 1.00 65.43 H new ATOM 0 HB2 MET A 638 -4.072 -20.852 7.794 1.00 14.11 H new ATOM 0 HB3 MET A 638 -4.095 -19.876 9.250 1.00 14.11 H new ATOM 0 HG2 MET A 638 -5.461 -22.600 9.081 1.00 34.13 H new ATOM 0 HG3 MET A 638 -3.796 -22.411 9.594 1.00 34.13 H new ATOM 0 HE1 MET A 638 -7.693 -21.510 11.065 1.00 70.30 H new ATOM 0 HE2 MET A 638 -6.978 -22.977 10.355 1.00 70.30 H new ATOM 0 HE3 MET A 638 -7.073 -22.800 12.124 1.00 70.30 H new ATOM 1530 N LEU A 639 -6.351 -17.715 8.317 1.00 71.02 N ATOM 1531 CA LEU A 639 -6.277 -16.364 7.787 1.00 21.00 C ATOM 1532 C LEU A 639 -5.049 -15.660 8.368 1.00 52.31 C ATOM 1533 O LEU A 639 -4.809 -15.716 9.573 1.00 61.21 O ATOM 1534 CB LEU A 639 -7.589 -15.618 8.036 1.00 13.04 C ATOM 1535 CG LEU A 639 -7.572 -14.116 7.746 1.00 13.34 C ATOM 1536 CD1 LEU A 639 -6.988 -13.831 6.361 1.00 31.24 C ATOM 1537 CD2 LEU A 639 -8.967 -13.509 7.916 1.00 5.21 C ATOM 0 H LEU A 639 -6.788 -17.790 9.236 1.00 71.02 H new ATOM 0 HA LEU A 639 -6.150 -16.386 6.705 1.00 21.00 H new ATOM 0 HB2 LEU A 639 -8.366 -16.077 7.425 1.00 13.04 H new ATOM 0 HB3 LEU A 639 -7.875 -15.764 9.078 1.00 13.04 H new ATOM 0 HG LEU A 639 -6.920 -13.635 8.475 1.00 13.34 H new ATOM 0 HD11 LEU A 639 -6.988 -12.756 6.180 1.00 31.24 H new ATOM 0 HD12 LEU A 639 -5.966 -14.207 6.312 1.00 31.24 H new ATOM 0 HD13 LEU A 639 -7.594 -14.326 5.602 1.00 31.24 H new ATOM 0 HD21 LEU A 639 -8.927 -12.441 7.704 1.00 5.21 H new ATOM 0 HD22 LEU A 639 -9.660 -13.990 7.226 1.00 5.21 H new ATOM 0 HD23 LEU A 639 -9.309 -13.663 8.939 1.00 5.21 H new ATOM 1549 N LEU A 640 -4.304 -15.012 7.484 1.00 75.32 N ATOM 1550 CA LEU A 640 -3.107 -14.298 7.894 1.00 55.23 C ATOM 1551 C LEU A 640 -3.448 -12.822 8.109 1.00 14.11 C ATOM 1552 O LEU A 640 -3.665 -12.085 7.149 1.00 51.43 O ATOM 1553 CB LEU A 640 -1.976 -14.527 6.890 1.00 72.54 C ATOM 1554 CG LEU A 640 -1.407 -15.947 6.833 1.00 13.31 C ATOM 1555 CD1 LEU A 640 -1.660 -16.691 8.145 1.00 33.33 C ATOM 1556 CD2 LEU A 640 -1.956 -16.710 5.626 1.00 52.20 C ATOM 0 H LEU A 640 -4.507 -14.967 6.485 1.00 75.32 H new ATOM 0 HA LEU A 640 -2.741 -14.684 8.845 1.00 55.23 H new ATOM 0 HB2 LEU A 640 -2.339 -14.262 5.897 1.00 72.54 H new ATOM 0 HB3 LEU A 640 -1.163 -13.840 7.126 1.00 72.54 H new ATOM 0 HG LEU A 640 -0.327 -15.878 6.705 1.00 13.31 H new ATOM 0 HD11 LEU A 640 -1.246 -17.697 8.078 1.00 33.33 H new ATOM 0 HD12 LEU A 640 -1.182 -16.155 8.965 1.00 33.33 H new ATOM 0 HD13 LEU A 640 -2.733 -16.751 8.328 1.00 33.33 H new ATOM 0 HD21 LEU A 640 -1.536 -17.716 5.609 1.00 52.20 H new ATOM 0 HD22 LEU A 640 -3.042 -16.772 5.698 1.00 52.20 H new ATOM 0 HD23 LEU A 640 -1.682 -16.187 4.710 1.00 52.20 H new ATOM 1568 N GLU A 641 -3.485 -12.435 9.376 1.00 52.13 N ATOM 1569 CA GLU A 641 -3.796 -11.060 9.729 1.00 31.25 C ATOM 1570 C GLU A 641 -2.596 -10.154 9.444 1.00 34.53 C ATOM 1571 O GLU A 641 -1.471 -10.471 9.825 1.00 24.15 O ATOM 1572 CB GLU A 641 -4.227 -10.955 11.194 1.00 42.13 C ATOM 1573 CG GLU A 641 -5.738 -10.742 11.307 1.00 63.01 C ATOM 1574 CD GLU A 641 -6.142 -10.442 12.752 1.00 53.44 C ATOM 1575 OE1 GLU A 641 -5.272 -10.199 13.601 1.00 34.14 O ATOM 1576 OE2 GLU A 641 -7.412 -10.465 12.978 1.00 10.13 O ATOM 0 H GLU A 641 -3.305 -13.049 10.170 1.00 52.13 H new ATOM 0 HA GLU A 641 -4.632 -10.727 9.113 1.00 31.25 H new ATOM 0 HB2 GLU A 641 -3.943 -11.863 11.726 1.00 42.13 H new ATOM 0 HB3 GLU A 641 -3.703 -10.128 11.673 1.00 42.13 H new ATOM 0 HG2 GLU A 641 -6.042 -9.918 10.662 1.00 63.01 H new ATOM 0 HG3 GLU A 641 -6.262 -11.631 10.956 1.00 63.01 H new ATOM 1584 N THR A 642 -2.878 -9.046 8.776 1.00 13.42 N ATOM 1585 CA THR A 642 -1.836 -8.092 8.436 1.00 54.34 C ATOM 1586 C THR A 642 -2.344 -6.660 8.617 1.00 11.03 C ATOM 1587 O THR A 642 -3.551 -6.421 8.619 1.00 5.21 O ATOM 1588 CB THR A 642 -1.366 -8.394 7.011 1.00 14.43 C ATOM 1589 OG1 THR A 642 -2.375 -7.821 6.184 1.00 14.00 O ATOM 1590 CG2 THR A 642 -1.418 -9.887 6.682 1.00 44.11 C ATOM 0 H THR A 642 -3.813 -8.787 8.461 1.00 13.42 H new ATOM 0 HA THR A 642 -0.980 -8.187 9.104 1.00 54.34 H new ATOM 0 HB THR A 642 -0.348 -8.028 6.879 1.00 14.43 H new ATOM 0 HG1 THR A 642 -2.898 -8.535 5.763 1.00 14.00 H new ATOM 0 HG21 THR A 642 -1.074 -10.047 5.660 1.00 44.11 H new ATOM 0 HG22 THR A 642 -0.774 -10.434 7.371 1.00 44.11 H new ATOM 0 HG23 THR A 642 -2.443 -10.246 6.781 1.00 44.11 H new ATOM 1598 N PRO A 643 -1.372 -5.721 8.770 1.00 54.32 N ATOM 1599 CA PRO A 643 -1.708 -4.319 8.952 1.00 55.12 C ATOM 1600 C PRO A 643 -2.160 -3.688 7.633 1.00 11.43 C ATOM 1601 O PRO A 643 -2.796 -2.635 7.631 1.00 41.32 O ATOM 1602 CB PRO A 643 -0.448 -3.682 9.514 1.00 32.13 C ATOM 1603 CG PRO A 643 0.684 -4.643 9.192 1.00 63.32 C ATOM 1604 CD PRO A 643 0.067 -5.967 8.773 1.00 74.41 C ATOM 0 HA PRO A 643 -2.549 -4.173 9.630 1.00 55.12 H new ATOM 0 HB2 PRO A 643 -0.271 -2.705 9.065 1.00 32.13 H new ATOM 0 HB3 PRO A 643 -0.535 -3.527 10.589 1.00 32.13 H new ATOM 0 HG2 PRO A 643 1.308 -4.243 8.393 1.00 63.32 H new ATOM 0 HG3 PRO A 643 1.327 -4.780 10.061 1.00 63.32 H new ATOM 0 HD2 PRO A 643 0.418 -6.273 7.788 1.00 74.41 H new ATOM 0 HD3 PRO A 643 0.331 -6.764 9.468 1.00 74.41 H new ATOM 1612 N GLN A 644 -1.814 -4.358 6.544 1.00 10.11 N ATOM 1613 CA GLN A 644 -2.176 -3.876 5.222 1.00 10.20 C ATOM 1614 C GLN A 644 -3.521 -4.464 4.792 1.00 33.53 C ATOM 1615 O GLN A 644 -4.056 -4.102 3.745 1.00 3.35 O ATOM 1616 CB GLN A 644 -1.084 -4.202 4.201 1.00 1.25 C ATOM 1617 CG GLN A 644 0.294 -4.236 4.865 1.00 22.23 C ATOM 1618 CD GLN A 644 1.408 -4.232 3.816 1.00 22.14 C ATOM 1619 OE1 GLN A 644 1.627 -3.262 3.109 1.00 30.15 O ATOM 1620 NE2 GLN A 644 2.098 -5.368 3.755 1.00 1.45 N ATOM 0 H GLN A 644 -1.287 -5.231 6.550 1.00 10.11 H new ATOM 0 HA GLN A 644 -2.273 -2.791 5.267 1.00 10.20 H new ATOM 0 HB2 GLN A 644 -1.292 -5.166 3.736 1.00 1.25 H new ATOM 0 HB3 GLN A 644 -1.090 -3.457 3.406 1.00 1.25 H new ATOM 0 HG2 GLN A 644 0.406 -3.374 5.523 1.00 22.23 H new ATOM 0 HG3 GLN A 644 0.380 -5.126 5.488 1.00 22.23 H new ATOM 0 HE21 GLN A 644 1.862 -6.142 4.376 1.00 1.45 H new ATOM 0 HE22 GLN A 644 2.863 -5.465 3.087 1.00 1.45 H new ATOM 1629 N GLY A 645 -4.030 -5.363 5.622 1.00 31.14 N ATOM 1630 CA GLY A 645 -5.303 -6.006 5.341 1.00 3.54 C ATOM 1631 C GLY A 645 -5.158 -7.529 5.332 1.00 1.31 C ATOM 1632 O GLY A 645 -4.279 -8.068 4.662 1.00 24.11 O ATOM 0 H GLY A 645 -3.584 -5.661 6.489 1.00 31.14 H new ATOM 0 HA2 GLY A 645 -6.037 -5.711 6.091 1.00 3.54 H new ATOM 0 HA3 GLY A 645 -5.680 -5.667 4.376 1.00 3.54 H new ATOM 1636 N ARG A 646 -6.034 -8.179 6.084 1.00 70.04 N ATOM 1637 CA ARG A 646 -6.015 -9.629 6.170 1.00 22.43 C ATOM 1638 C ARG A 646 -5.707 -10.239 4.801 1.00 11.01 C ATOM 1639 O ARG A 646 -5.942 -9.610 3.771 1.00 53.14 O ATOM 1640 CB ARG A 646 -7.356 -10.169 6.671 1.00 22.05 C ATOM 1641 CG ARG A 646 -7.367 -10.279 8.197 1.00 24.45 C ATOM 1642 CD ARG A 646 -8.793 -10.445 8.725 1.00 13.31 C ATOM 1643 NE ARG A 646 -9.429 -9.118 8.891 1.00 65.35 N ATOM 1644 CZ ARG A 646 -10.457 -8.871 9.729 1.00 12.01 C ATOM 1645 NH1 ARG A 646 -10.976 -9.860 10.487 1.00 74.21 N ATOM 1646 NH2 ARG A 646 -10.948 -7.647 9.797 1.00 62.42 N ATOM 0 H ARG A 646 -6.761 -7.728 6.639 1.00 70.04 H new ATOM 0 HA ARG A 646 -5.236 -9.908 6.879 1.00 22.43 H new ATOM 0 HB2 ARG A 646 -8.162 -9.512 6.344 1.00 22.05 H new ATOM 0 HB3 ARG A 646 -7.545 -11.148 6.231 1.00 22.05 H new ATOM 0 HG2 ARG A 646 -6.759 -11.129 8.508 1.00 24.45 H new ATOM 0 HG3 ARG A 646 -6.916 -9.388 8.633 1.00 24.45 H new ATOM 0 HD2 ARG A 646 -9.377 -11.053 8.034 1.00 13.31 H new ATOM 0 HD3 ARG A 646 -8.777 -10.972 9.679 1.00 13.31 H new ATOM 0 HE ARG A 646 -9.067 -8.342 8.337 1.00 65.35 H new ATOM 0 HH11 ARG A 646 -10.591 -10.803 10.429 1.00 74.21 H new ATOM 0 HH12 ARG A 646 -11.753 -9.665 11.118 1.00 74.21 H new ATOM 0 HH21 ARG A 646 -10.550 -6.905 9.221 1.00 62.42 H new ATOM 0 HH22 ARG A 646 -11.725 -7.443 10.425 1.00 62.42 H new ATOM 1659 N ILE A 647 -5.186 -11.457 4.835 1.00 42.44 N ATOM 1660 CA ILE A 647 -4.844 -12.158 3.609 1.00 25.10 C ATOM 1661 C ILE A 647 -5.260 -13.625 3.733 1.00 23.21 C ATOM 1662 O ILE A 647 -4.837 -14.318 4.658 1.00 53.14 O ATOM 1663 CB ILE A 647 -3.363 -11.965 3.277 1.00 44.12 C ATOM 1664 CG1 ILE A 647 -3.065 -10.506 2.925 1.00 13.34 C ATOM 1665 CG2 ILE A 647 -2.920 -12.923 2.169 1.00 3.11 C ATOM 1666 CD1 ILE A 647 -1.621 -10.141 3.275 1.00 12.20 C ATOM 0 H ILE A 647 -4.993 -11.976 5.692 1.00 42.44 H new ATOM 0 HA ILE A 647 -5.393 -11.740 2.765 1.00 25.10 H new ATOM 0 HB ILE A 647 -2.780 -12.208 4.165 1.00 44.12 H new ATOM 0 HG12 ILE A 647 -3.238 -10.342 1.861 1.00 13.34 H new ATOM 0 HG13 ILE A 647 -3.750 -9.851 3.463 1.00 13.34 H new ATOM 0 HG21 ILE A 647 -1.864 -12.765 1.952 1.00 3.11 H new ATOM 0 HG22 ILE A 647 -3.074 -13.952 2.495 1.00 3.11 H new ATOM 0 HG23 ILE A 647 -3.507 -12.735 1.270 1.00 3.11 H new ATOM 0 HD11 ILE A 647 -1.436 -9.099 3.015 1.00 12.20 H new ATOM 0 HD12 ILE A 647 -1.459 -10.282 4.344 1.00 12.20 H new ATOM 0 HD13 ILE A 647 -0.938 -10.781 2.716 1.00 12.20 H new ATOM 1678 N GLN A 648 -6.083 -14.055 2.788 1.00 22.53 N ATOM 1679 CA GLN A 648 -6.561 -15.428 2.780 1.00 2.32 C ATOM 1680 C GLN A 648 -6.227 -16.098 1.446 1.00 23.21 C ATOM 1681 O GLN A 648 -6.816 -15.770 0.418 1.00 72.14 O ATOM 1682 CB GLN A 648 -8.063 -15.487 3.062 1.00 13.43 C ATOM 1683 CG GLN A 648 -8.429 -16.762 3.825 1.00 45.05 C ATOM 1684 CD GLN A 648 -8.982 -17.828 2.877 1.00 53.34 C ATOM 1685 OE1 GLN A 648 -8.250 -18.937 2.823 1.00 32.33 O flip ATOM 1686 NE2 GLN A 648 -10.006 -17.654 2.236 1.00 53.12 N flip ATOM 0 H GLN A 648 -6.431 -13.478 2.023 1.00 22.53 H new ATOM 0 HA GLN A 648 -6.054 -15.974 3.576 1.00 2.32 H new ATOM 0 HB2 GLN A 648 -8.362 -14.614 3.642 1.00 13.43 H new ATOM 0 HB3 GLN A 648 -8.615 -15.450 2.123 1.00 13.43 H new ATOM 0 HG2 GLN A 648 -7.549 -17.148 4.339 1.00 45.05 H new ATOM 0 HG3 GLN A 648 -9.169 -16.532 4.591 1.00 45.05 H new ATOM 0 HE21 GLN A 648 -10.520 -16.778 2.324 1.00 53.12 H new ATOM 0 HE22 GLN A 648 -10.347 -18.385 1.612 1.00 53.12 H new ATOM 1695 N ALA A 649 -5.282 -17.025 1.506 1.00 32.35 N ATOM 1696 CA ALA A 649 -4.863 -17.745 0.316 1.00 44.12 C ATOM 1697 C ALA A 649 -5.315 -19.203 0.420 1.00 14.41 C ATOM 1698 O ALA A 649 -5.901 -19.604 1.425 1.00 61.24 O ATOM 1699 CB ALA A 649 -3.347 -17.616 0.148 1.00 13.45 C ATOM 0 H ALA A 649 -4.795 -17.294 2.361 1.00 32.35 H new ATOM 0 HA ALA A 649 -5.328 -17.319 -0.573 1.00 44.12 H new ATOM 0 HB1 ALA A 649 -3.033 -18.156 -0.745 1.00 13.45 H new ATOM 0 HB2 ALA A 649 -3.080 -16.564 0.048 1.00 13.45 H new ATOM 0 HB3 ALA A 649 -2.847 -18.036 1.021 1.00 13.45 H new ATOM 1705 N LYS A 650 -5.027 -19.955 -0.632 1.00 32.14 N ATOM 1706 CA LYS A 650 -5.397 -21.360 -0.671 1.00 54.40 C ATOM 1707 C LYS A 650 -4.132 -22.218 -0.620 1.00 1.24 C ATOM 1708 O LYS A 650 -4.198 -23.412 -0.330 1.00 53.54 O ATOM 1709 CB LYS A 650 -6.286 -21.646 -1.883 1.00 43.35 C ATOM 1710 CG LYS A 650 -7.418 -20.622 -1.987 1.00 35.40 C ATOM 1711 CD LYS A 650 -8.753 -21.236 -1.558 1.00 62.45 C ATOM 1712 CE LYS A 650 -9.929 -20.399 -2.064 1.00 12.22 C ATOM 1713 NZ LYS A 650 -10.003 -20.448 -3.541 1.00 54.22 N ATOM 0 H LYS A 650 -4.542 -19.618 -1.464 1.00 32.14 H new ATOM 0 HA LYS A 650 -5.994 -21.621 0.202 1.00 54.40 H new ATOM 0 HB2 LYS A 650 -5.685 -21.623 -2.792 1.00 43.35 H new ATOM 0 HB3 LYS A 650 -6.705 -22.649 -1.803 1.00 43.35 H new ATOM 0 HG2 LYS A 650 -7.192 -19.760 -1.360 1.00 35.40 H new ATOM 0 HG3 LYS A 650 -7.493 -20.260 -3.012 1.00 35.40 H new ATOM 0 HD2 LYS A 650 -8.831 -22.252 -1.946 1.00 62.45 H new ATOM 0 HD3 LYS A 650 -8.793 -21.306 -0.471 1.00 62.45 H new ATOM 0 HE2 LYS A 650 -10.859 -20.771 -1.635 1.00 12.22 H new ATOM 0 HE3 LYS A 650 -9.817 -19.366 -1.734 1.00 12.22 H new ATOM 0 HZ1 LYS A 650 -10.938 -20.800 -3.830 1.00 54.22 H new ATOM 0 HZ2 LYS A 650 -9.858 -19.494 -3.928 1.00 54.22 H new ATOM 0 HZ3 LYS A 650 -9.266 -21.085 -3.905 1.00 54.22 H new ATOM 1726 N LYS A 651 -3.008 -21.576 -0.905 1.00 33.23 N ATOM 1727 CA LYS A 651 -1.729 -22.266 -0.895 1.00 14.14 C ATOM 1728 C LYS A 651 -0.757 -21.515 0.017 1.00 41.40 C ATOM 1729 O LYS A 651 -0.775 -20.286 0.071 1.00 3.11 O ATOM 1730 CB LYS A 651 -1.212 -22.456 -2.322 1.00 30.21 C ATOM 1731 CG LYS A 651 -2.056 -23.484 -3.078 1.00 64.43 C ATOM 1732 CD LYS A 651 -1.782 -24.901 -2.568 1.00 2.52 C ATOM 1733 CE LYS A 651 -0.313 -25.281 -2.767 1.00 53.32 C ATOM 1734 NZ LYS A 651 -0.169 -26.749 -2.881 1.00 21.33 N ATOM 0 H LYS A 651 -2.957 -20.586 -1.144 1.00 33.23 H new ATOM 0 HA LYS A 651 -1.840 -23.270 -0.485 1.00 14.14 H new ATOM 0 HB2 LYS A 651 -1.234 -21.503 -2.850 1.00 30.21 H new ATOM 0 HB3 LYS A 651 -0.172 -22.782 -2.296 1.00 30.21 H new ATOM 0 HG2 LYS A 651 -3.114 -23.249 -2.959 1.00 64.43 H new ATOM 0 HG3 LYS A 651 -1.835 -23.428 -4.144 1.00 64.43 H new ATOM 0 HD2 LYS A 651 -2.038 -24.967 -1.511 1.00 2.52 H new ATOM 0 HD3 LYS A 651 -2.420 -25.611 -3.095 1.00 2.52 H new ATOM 0 HE2 LYS A 651 0.075 -24.801 -3.665 1.00 53.32 H new ATOM 0 HE3 LYS A 651 0.280 -24.915 -1.929 1.00 53.32 H new ATOM 0 HZ1 LYS A 651 0.834 -26.990 -3.016 1.00 21.33 H new ATOM 0 HZ2 LYS A 651 -0.520 -27.201 -2.013 1.00 21.33 H new ATOM 0 HZ3 LYS A 651 -0.719 -27.090 -3.695 1.00 21.33 H new ATOM 1747 N TRP A 652 0.069 -22.285 0.711 1.00 54.44 N ATOM 1748 CA TRP A 652 1.046 -21.707 1.617 1.00 25.21 C ATOM 1749 C TRP A 652 2.075 -20.945 0.780 1.00 65.24 C ATOM 1750 O TRP A 652 2.880 -20.186 1.318 1.00 20.40 O ATOM 1751 CB TRP A 652 1.676 -22.784 2.503 1.00 60.33 C ATOM 1752 CG TRP A 652 0.669 -23.548 3.365 1.00 10.21 C ATOM 1753 CD1 TRP A 652 -0.149 -24.542 2.994 1.00 65.54 C ATOM 1754 CD2 TRP A 652 0.404 -23.337 4.768 1.00 24.01 C ATOM 1755 NE1 TRP A 652 -0.918 -24.986 4.050 1.00 24.41 N ATOM 1756 CE2 TRP A 652 -0.570 -24.230 5.163 1.00 35.15 C ATOM 1757 CE3 TRP A 652 0.970 -22.422 5.673 1.00 24.13 C ATOM 1758 CZ2 TRP A 652 -1.065 -24.296 6.472 1.00 50.34 C ATOM 1759 CZ3 TRP A 652 0.465 -22.500 6.977 1.00 63.43 C ATOM 1760 CH2 TRP A 652 -0.516 -23.394 7.391 1.00 40.44 C ATOM 0 H TRP A 652 0.081 -23.304 0.664 1.00 54.44 H new ATOM 0 HA TRP A 652 0.569 -21.007 2.303 1.00 25.21 H new ATOM 0 HB2 TRP A 652 2.210 -23.494 1.871 1.00 60.33 H new ATOM 0 HB3 TRP A 652 2.416 -22.318 3.154 1.00 60.33 H new ATOM 0 HD1 TRP A 652 -0.200 -24.945 1.993 1.00 65.54 H new ATOM 0 HE1 TRP A 652 -1.614 -25.731 4.019 1.00 24.41 H new ATOM 0 HE3 TRP A 652 1.734 -21.715 5.385 1.00 24.13 H new ATOM 0 HZ2 TRP A 652 -1.829 -25.004 6.757 1.00 50.34 H new ATOM 0 HZ3 TRP A 652 0.866 -21.818 7.712 1.00 63.43 H new ATOM 0 HH2 TRP A 652 -0.853 -23.393 8.417 1.00 40.44 H new ATOM 1771 N SER A 653 2.016 -21.174 -0.524 1.00 41.31 N ATOM 1772 CA SER A 653 2.933 -20.518 -1.441 1.00 71.13 C ATOM 1773 C SER A 653 2.656 -19.014 -1.471 1.00 44.42 C ATOM 1774 O SER A 653 3.434 -18.247 -2.038 1.00 30.04 O ATOM 1775 CB SER A 653 2.819 -21.107 -2.849 1.00 14.12 C ATOM 1776 OG SER A 653 3.611 -22.282 -3.002 1.00 14.40 O ATOM 0 H SER A 653 1.348 -21.804 -0.967 1.00 41.31 H new ATOM 0 HA SER A 653 3.950 -20.687 -1.087 1.00 71.13 H new ATOM 0 HB2 SER A 653 1.776 -21.343 -3.060 1.00 14.12 H new ATOM 0 HB3 SER A 653 3.131 -20.361 -3.580 1.00 14.12 H new ATOM 0 HG SER A 653 3.510 -22.628 -3.913 1.00 14.40 H new ATOM 1782 N ARG A 654 1.546 -18.636 -0.854 1.00 44.13 N ATOM 1783 CA ARG A 654 1.158 -17.237 -0.803 1.00 54.21 C ATOM 1784 C ARG A 654 1.511 -16.637 0.559 1.00 22.14 C ATOM 1785 O ARG A 654 1.757 -15.437 0.668 1.00 13.23 O ATOM 1786 CB ARG A 654 -0.343 -17.073 -1.051 1.00 13.13 C ATOM 1787 CG ARG A 654 -0.790 -17.885 -2.268 1.00 32.32 C ATOM 1788 CD ARG A 654 0.190 -17.715 -3.430 1.00 60.43 C ATOM 1789 NE ARG A 654 -0.480 -18.041 -4.709 1.00 20.40 N ATOM 1790 CZ ARG A 654 0.173 -18.292 -5.863 1.00 44.15 C ATOM 1791 NH1 ARG A 654 1.522 -18.256 -5.909 1.00 41.32 N ATOM 1792 NH2 ARG A 654 -0.526 -18.573 -6.947 1.00 14.40 N ATOM 0 H ARG A 654 0.903 -19.274 -0.385 1.00 44.13 H new ATOM 0 HA ARG A 654 1.704 -16.713 -1.587 1.00 54.21 H new ATOM 0 HB2 ARG A 654 -0.898 -17.396 -0.170 1.00 13.13 H new ATOM 0 HB3 ARG A 654 -0.576 -16.020 -1.206 1.00 13.13 H new ATOM 0 HG2 ARG A 654 -0.862 -18.939 -2.000 1.00 32.32 H new ATOM 0 HG3 ARG A 654 -1.785 -17.566 -2.577 1.00 32.32 H new ATOM 0 HD2 ARG A 654 0.562 -16.691 -3.456 1.00 60.43 H new ATOM 0 HD3 ARG A 654 1.053 -18.365 -3.286 1.00 60.43 H new ATOM 0 HE ARG A 654 -1.499 -18.078 -4.719 1.00 20.40 H new ATOM 0 HH11 ARG A 654 2.055 -18.038 -5.067 1.00 41.32 H new ATOM 0 HH12 ARG A 654 2.008 -18.447 -6.785 1.00 41.32 H new ATOM 0 HH21 ARG A 654 -1.545 -18.598 -6.905 1.00 14.40 H new ATOM 0 HH22 ARG A 654 -0.047 -18.765 -7.827 1.00 14.40 H new ATOM 1805 N VAL A 655 1.526 -17.500 1.564 1.00 31.43 N ATOM 1806 CA VAL A 655 1.845 -17.071 2.915 1.00 5.12 C ATOM 1807 C VAL A 655 2.990 -16.057 2.866 1.00 24.20 C ATOM 1808 O VAL A 655 4.093 -16.382 2.429 1.00 5.14 O ATOM 1809 CB VAL A 655 2.160 -18.286 3.790 1.00 21.10 C ATOM 1810 CG1 VAL A 655 3.130 -17.916 4.914 1.00 60.21 C ATOM 1811 CG2 VAL A 655 0.878 -18.903 4.353 1.00 61.01 C ATOM 0 H VAL A 655 1.322 -18.495 1.470 1.00 31.43 H new ATOM 0 HA VAL A 655 0.988 -16.573 3.370 1.00 5.12 H new ATOM 0 HB VAL A 655 2.645 -19.034 3.163 1.00 21.10 H new ATOM 0 HG11 VAL A 655 3.337 -18.797 5.521 1.00 60.21 H new ATOM 0 HG12 VAL A 655 4.060 -17.545 4.484 1.00 60.21 H new ATOM 0 HG13 VAL A 655 2.685 -17.142 5.539 1.00 60.21 H new ATOM 0 HG21 VAL A 655 1.130 -19.765 4.971 1.00 61.01 H new ATOM 0 HG22 VAL A 655 0.353 -18.163 4.958 1.00 61.01 H new ATOM 0 HG23 VAL A 655 0.236 -19.221 3.532 1.00 61.01 H new ATOM 1821 N PRO A 656 2.681 -14.818 3.332 1.00 11.41 N ATOM 1822 CA PRO A 656 3.671 -13.754 3.345 1.00 20.34 C ATOM 1823 C PRO A 656 4.685 -13.963 4.472 1.00 14.25 C ATOM 1824 O PRO A 656 5.880 -13.739 4.287 1.00 73.44 O ATOM 1825 CB PRO A 656 2.869 -12.472 3.497 1.00 2.03 C ATOM 1826 CG PRO A 656 1.508 -12.892 4.028 1.00 3.25 C ATOM 1827 CD PRO A 656 1.385 -14.397 3.857 1.00 40.12 C ATOM 0 HA PRO A 656 4.271 -13.726 2.436 1.00 20.34 H new ATOM 0 HB2 PRO A 656 3.361 -11.783 4.184 1.00 2.03 H new ATOM 0 HB3 PRO A 656 2.773 -11.956 2.542 1.00 2.03 H new ATOM 0 HG2 PRO A 656 1.407 -12.618 5.078 1.00 3.25 H new ATOM 0 HG3 PRO A 656 0.712 -12.380 3.487 1.00 3.25 H new ATOM 0 HD2 PRO A 656 1.164 -14.886 4.806 1.00 40.12 H new ATOM 0 HD3 PRO A 656 0.578 -14.653 3.171 1.00 40.12 H new ATOM 1835 N PHE A 657 4.170 -14.389 5.617 1.00 51.15 N ATOM 1836 CA PHE A 657 5.015 -14.630 6.774 1.00 61.34 C ATOM 1837 C PHE A 657 5.894 -15.865 6.563 1.00 51.14 C ATOM 1838 O PHE A 657 5.513 -16.787 5.843 1.00 32.03 O ATOM 1839 CB PHE A 657 4.085 -14.878 7.963 1.00 61.11 C ATOM 1840 CG PHE A 657 3.387 -16.239 7.934 1.00 71.32 C ATOM 1841 CD1 PHE A 657 4.022 -17.340 8.418 1.00 2.24 C ATOM 1842 CD2 PHE A 657 2.131 -16.349 7.423 1.00 1.43 C ATOM 1843 CE1 PHE A 657 3.374 -18.603 8.391 1.00 22.15 C ATOM 1844 CE2 PHE A 657 1.483 -17.612 7.396 1.00 1.24 C ATOM 1845 CZ PHE A 657 2.118 -18.712 7.881 1.00 23.40 C ATOM 0 H PHE A 657 3.178 -14.573 5.768 1.00 51.15 H new ATOM 0 HA PHE A 657 5.670 -13.775 6.941 1.00 61.34 H new ATOM 0 HB2 PHE A 657 4.661 -14.796 8.885 1.00 61.11 H new ATOM 0 HB3 PHE A 657 3.328 -14.094 7.989 1.00 61.11 H new ATOM 0 HD1 PHE A 657 5.019 -17.254 8.823 1.00 2.24 H new ATOM 0 HD2 PHE A 657 1.627 -15.475 7.038 1.00 1.43 H new ATOM 0 HE1 PHE A 657 3.878 -19.477 8.775 1.00 22.15 H new ATOM 0 HE2 PHE A 657 0.486 -17.699 6.990 1.00 1.24 H new ATOM 0 HZ PHE A 657 1.625 -19.673 7.861 1.00 23.40 H new ATOM 1855 N SER A 658 7.054 -15.843 7.203 1.00 54.31 N ATOM 1856 CA SER A 658 7.990 -16.949 7.094 1.00 13.25 C ATOM 1857 C SER A 658 7.563 -18.088 8.022 1.00 31.30 C ATOM 1858 O SER A 658 7.118 -17.847 9.143 1.00 20.42 O ATOM 1859 CB SER A 658 9.414 -16.499 7.426 1.00 30.43 C ATOM 1860 OG SER A 658 9.652 -15.149 7.038 1.00 13.13 O ATOM 0 H SER A 658 7.367 -15.077 7.799 1.00 54.31 H new ATOM 0 HA SER A 658 7.981 -17.305 6.064 1.00 13.25 H new ATOM 0 HB2 SER A 658 9.587 -16.604 8.497 1.00 30.43 H new ATOM 0 HB3 SER A 658 10.127 -17.152 6.923 1.00 30.43 H new ATOM 0 HG SER A 658 10.571 -14.900 7.269 1.00 13.13 H new ATOM 1866 N VAL A 659 7.714 -19.305 7.520 1.00 74.11 N ATOM 1867 CA VAL A 659 7.349 -20.483 8.289 1.00 4.45 C ATOM 1868 C VAL A 659 8.575 -21.385 8.443 1.00 22.23 C ATOM 1869 O VAL A 659 8.875 -22.187 7.560 1.00 34.32 O ATOM 1870 CB VAL A 659 6.164 -21.191 7.632 1.00 73.53 C ATOM 1871 CG1 VAL A 659 5.390 -22.027 8.653 1.00 74.41 C ATOM 1872 CG2 VAL A 659 5.244 -20.188 6.934 1.00 75.02 C ATOM 0 H VAL A 659 8.084 -19.501 6.590 1.00 74.11 H new ATOM 0 HA VAL A 659 7.025 -20.200 9.291 1.00 4.45 H new ATOM 0 HB VAL A 659 6.557 -21.868 6.874 1.00 73.53 H new ATOM 0 HG11 VAL A 659 4.552 -22.520 8.160 1.00 74.41 H new ATOM 0 HG12 VAL A 659 6.051 -22.779 9.084 1.00 74.41 H new ATOM 0 HG13 VAL A 659 5.014 -21.378 9.444 1.00 74.41 H new ATOM 0 HG21 VAL A 659 4.409 -20.718 6.475 1.00 75.02 H new ATOM 0 HG22 VAL A 659 4.863 -19.474 7.664 1.00 75.02 H new ATOM 0 HG23 VAL A 659 5.803 -19.656 6.164 1.00 75.02 H new ATOM 1882 N PRO A 660 9.269 -21.220 9.601 1.00 1.22 N ATOM 1883 CA PRO A 660 10.456 -22.010 9.882 1.00 34.01 C ATOM 1884 C PRO A 660 10.081 -23.442 10.270 1.00 4.14 C ATOM 1885 O PRO A 660 9.027 -23.674 10.860 1.00 1.30 O ATOM 1886 CB PRO A 660 11.173 -21.261 10.993 1.00 31.34 C ATOM 1887 CG PRO A 660 10.135 -20.339 11.612 1.00 42.54 C ATOM 1888 CD PRO A 660 8.944 -20.279 10.670 1.00 72.53 C ATOM 0 HA PRO A 660 11.104 -22.121 9.013 1.00 34.01 H new ATOM 0 HB2 PRO A 660 11.573 -21.952 11.735 1.00 31.34 H new ATOM 0 HB3 PRO A 660 12.016 -20.692 10.600 1.00 31.34 H new ATOM 0 HG2 PRO A 660 9.830 -20.710 12.590 1.00 42.54 H new ATOM 0 HG3 PRO A 660 10.551 -19.343 11.765 1.00 42.54 H new ATOM 0 HD2 PRO A 660 8.022 -20.561 11.179 1.00 72.53 H new ATOM 0 HD3 PRO A 660 8.798 -19.272 10.280 1.00 72.53 H new ATOM 1896 N ASP A 661 10.966 -24.365 9.924 1.00 22.30 N ATOM 1897 CA ASP A 661 10.742 -25.768 10.229 1.00 22.21 C ATOM 1898 C ASP A 661 10.743 -25.962 11.747 1.00 53.02 C ATOM 1899 O ASP A 661 11.499 -25.305 12.460 1.00 44.22 O ATOM 1900 CB ASP A 661 11.850 -26.644 9.640 1.00 3.54 C ATOM 1901 CG ASP A 661 13.264 -26.073 9.772 1.00 31.25 C ATOM 1902 OD1 ASP A 661 13.757 -25.374 8.875 1.00 52.21 O ATOM 1903 OD2 ASP A 661 13.874 -26.377 10.867 1.00 24.34 O ATOM 0 H ASP A 661 11.840 -24.169 9.435 1.00 22.30 H new ATOM 0 HA ASP A 661 9.785 -26.058 9.796 1.00 22.21 H new ATOM 0 HB2 ASP A 661 11.821 -27.618 10.128 1.00 3.54 H new ATOM 0 HB3 ASP A 661 11.638 -26.810 8.584 1.00 3.54 H new ATOM 1909 N PHE A 662 9.886 -26.867 12.196 1.00 74.01 N ATOM 1910 CA PHE A 662 9.778 -27.156 13.616 1.00 54.41 C ATOM 1911 C PHE A 662 11.161 -27.307 14.251 1.00 21.24 C ATOM 1912 O PHE A 662 11.868 -28.278 13.985 1.00 74.22 O ATOM 1913 CB PHE A 662 9.021 -28.479 13.747 1.00 24.10 C ATOM 1914 CG PHE A 662 8.949 -29.015 15.178 1.00 30.32 C ATOM 1915 CD1 PHE A 662 7.968 -28.586 16.016 1.00 34.03 C ATOM 1916 CD2 PHE A 662 9.866 -29.921 15.612 1.00 10.14 C ATOM 1917 CE1 PHE A 662 7.900 -29.084 17.345 1.00 44.55 C ATOM 1918 CE2 PHE A 662 9.799 -30.418 16.941 1.00 72.43 C ATOM 1919 CZ PHE A 662 8.817 -29.989 17.779 1.00 64.12 C ATOM 0 H PHE A 662 9.260 -27.410 11.601 1.00 74.01 H new ATOM 0 HA PHE A 662 9.262 -26.341 14.124 1.00 54.41 H new ATOM 0 HB2 PHE A 662 8.008 -28.345 13.369 1.00 24.10 H new ATOM 0 HB3 PHE A 662 9.502 -29.225 13.114 1.00 24.10 H new ATOM 0 HD1 PHE A 662 7.240 -27.866 15.671 1.00 34.03 H new ATOM 0 HD2 PHE A 662 10.645 -30.262 14.946 1.00 10.14 H new ATOM 0 HE1 PHE A 662 7.120 -28.744 18.010 1.00 44.55 H new ATOM 0 HE2 PHE A 662 10.528 -31.136 17.286 1.00 72.43 H new ATOM 0 HZ PHE A 662 8.766 -30.367 18.789 1.00 64.12 H new ATOM 1929 N ASP A 663 11.507 -26.333 15.080 1.00 55.30 N ATOM 1930 CA ASP A 663 12.793 -26.346 15.756 1.00 51.44 C ATOM 1931 C ASP A 663 12.763 -27.382 16.881 1.00 54.30 C ATOM 1932 O ASP A 663 12.405 -27.063 18.014 1.00 53.22 O ATOM 1933 CB ASP A 663 13.102 -24.982 16.377 1.00 65.14 C ATOM 1934 CG ASP A 663 13.717 -23.960 15.419 1.00 44.24 C ATOM 1935 OD1 ASP A 663 14.941 -23.925 15.221 1.00 70.31 O ATOM 1936 OD2 ASP A 663 12.873 -23.164 14.855 1.00 72.21 O ATOM 0 H ASP A 663 10.919 -25.529 15.299 1.00 55.30 H new ATOM 0 HA ASP A 663 13.559 -26.589 15.019 1.00 51.44 H new ATOM 0 HB2 ASP A 663 12.180 -24.567 16.784 1.00 65.14 H new ATOM 0 HB3 ASP A 663 13.783 -25.127 17.216 1.00 65.14 H new ATOM 1942 N PHE A 664 13.143 -28.601 16.530 1.00 60.24 N ATOM 1943 CA PHE A 664 13.164 -29.686 17.496 1.00 70.20 C ATOM 1944 C PHE A 664 14.157 -29.397 18.623 1.00 22.24 C ATOM 1945 O PHE A 664 13.991 -29.882 19.742 1.00 71.15 O ATOM 1946 CB PHE A 664 13.612 -30.943 16.748 1.00 72.15 C ATOM 1947 CG PHE A 664 13.841 -32.157 17.651 1.00 42.42 C ATOM 1948 CD1 PHE A 664 12.952 -32.448 18.638 1.00 52.53 C ATOM 1949 CD2 PHE A 664 14.935 -32.944 17.467 1.00 75.32 C ATOM 1950 CE1 PHE A 664 13.165 -33.574 19.476 1.00 13.30 C ATOM 1951 CE2 PHE A 664 15.147 -34.070 18.305 1.00 25.52 C ATOM 1952 CZ PHE A 664 14.258 -34.361 19.292 1.00 20.41 C ATOM 0 H PHE A 664 13.439 -28.862 15.589 1.00 60.24 H new ATOM 0 HA PHE A 664 12.176 -29.807 17.940 1.00 70.20 H new ATOM 0 HB2 PHE A 664 12.860 -31.196 16.001 1.00 72.15 H new ATOM 0 HB3 PHE A 664 14.535 -30.724 16.210 1.00 72.15 H new ATOM 0 HD1 PHE A 664 12.084 -31.822 18.784 1.00 52.53 H new ATOM 0 HD2 PHE A 664 15.642 -32.712 16.684 1.00 75.32 H new ATOM 0 HE1 PHE A 664 12.459 -33.805 20.260 1.00 13.30 H new ATOM 0 HE2 PHE A 664 16.015 -34.696 18.159 1.00 25.52 H new ATOM 0 HZ PHE A 664 14.420 -35.217 19.930 1.00 20.41 H new ATOM 1962 N LEU A 665 15.168 -28.609 18.290 1.00 4.43 N ATOM 1963 CA LEU A 665 16.188 -28.249 19.261 1.00 64.22 C ATOM 1964 C LEU A 665 15.563 -27.379 20.353 1.00 43.23 C ATOM 1965 O LEU A 665 15.806 -27.595 21.539 1.00 43.00 O ATOM 1966 CB LEU A 665 17.385 -27.597 18.564 1.00 34.43 C ATOM 1967 CG LEU A 665 18.047 -28.421 17.458 1.00 2.10 C ATOM 1968 CD1 LEU A 665 19.437 -27.874 17.125 1.00 55.03 C ATOM 1969 CD2 LEU A 665 18.089 -29.905 17.829 1.00 2.44 C ATOM 0 H LEU A 665 15.303 -28.209 17.361 1.00 4.43 H new ATOM 0 HA LEU A 665 16.580 -29.141 19.750 1.00 64.22 H new ATOM 0 HB2 LEU A 665 17.059 -26.648 18.138 1.00 34.43 H new ATOM 0 HB3 LEU A 665 18.138 -27.366 19.318 1.00 34.43 H new ATOM 0 HG LEU A 665 17.441 -28.332 16.557 1.00 2.10 H new ATOM 0 HD11 LEU A 665 19.886 -28.477 16.336 1.00 55.03 H new ATOM 0 HD12 LEU A 665 19.350 -26.841 16.787 1.00 55.03 H new ATOM 0 HD13 LEU A 665 20.066 -27.913 18.014 1.00 55.03 H new ATOM 0 HD21 LEU A 665 18.564 -30.468 17.026 1.00 2.44 H new ATOM 0 HD22 LEU A 665 18.659 -30.034 18.749 1.00 2.44 H new ATOM 0 HD23 LEU A 665 17.073 -30.272 17.977 1.00 2.44 H new ATOM 1981 N GLN A 666 14.770 -26.413 19.913 1.00 0.11 N ATOM 1982 CA GLN A 666 14.108 -25.509 20.838 1.00 2.23 C ATOM 1983 C GLN A 666 12.996 -26.241 21.592 1.00 24.23 C ATOM 1984 O GLN A 666 12.996 -26.279 22.822 1.00 62.32 O ATOM 1985 CB GLN A 666 13.559 -24.282 20.108 1.00 51.03 C ATOM 1986 CG GLN A 666 12.857 -23.333 21.081 1.00 3.40 C ATOM 1987 CD GLN A 666 13.853 -22.354 21.706 1.00 44.42 C ATOM 1988 OE1 GLN A 666 14.969 -22.183 21.243 1.00 25.52 O ATOM 1989 NE2 GLN A 666 13.389 -21.721 22.780 1.00 62.31 N ATOM 0 H GLN A 666 14.571 -26.237 18.928 1.00 0.11 H new ATOM 0 HA GLN A 666 14.844 -25.161 21.563 1.00 2.23 H new ATOM 0 HB2 GLN A 666 14.373 -23.758 19.607 1.00 51.03 H new ATOM 0 HB3 GLN A 666 12.859 -24.598 19.334 1.00 51.03 H new ATOM 0 HG2 GLN A 666 12.078 -22.780 20.557 1.00 3.40 H new ATOM 0 HG3 GLN A 666 12.366 -23.909 21.866 1.00 3.40 H new ATOM 0 HE21 GLN A 666 12.445 -21.911 23.115 1.00 62.31 H new ATOM 0 HE22 GLN A 666 13.978 -21.046 23.268 1.00 62.31 H new ATOM 1998 N HIS A 667 12.076 -26.805 20.824 1.00 52.31 N ATOM 1999 CA HIS A 667 10.961 -27.534 21.404 1.00 52.20 C ATOM 2000 C HIS A 667 11.480 -28.505 22.466 1.00 72.41 C ATOM 2001 O HIS A 667 11.021 -28.486 23.607 1.00 21.41 O ATOM 2002 CB HIS A 667 10.141 -28.228 20.315 1.00 34.31 C ATOM 2003 CG HIS A 667 8.718 -28.535 20.719 1.00 2.31 C ATOM 2004 ND1 HIS A 667 7.624 -27.929 20.127 1.00 74.43 N ATOM 2005 CD2 HIS A 667 8.223 -29.389 21.661 1.00 43.44 C ATOM 2006 CE1 HIS A 667 6.525 -28.404 20.695 1.00 72.25 C ATOM 2007 NE2 HIS A 667 6.899 -29.308 21.645 1.00 34.03 N ATOM 0 H HIS A 667 12.080 -26.772 19.805 1.00 52.31 H new ATOM 0 HA HIS A 667 10.284 -26.838 21.899 1.00 52.20 H new ATOM 0 HB2 HIS A 667 10.127 -27.596 19.427 1.00 34.31 H new ATOM 0 HB3 HIS A 667 10.638 -29.158 20.037 1.00 34.31 H new ATOM 0 HD2 HIS A 667 8.809 -30.023 22.309 1.00 43.44 H new ATOM 0 HE1 HIS A 667 5.511 -28.124 20.449 1.00 72.25 H new ATOM 0 HE2 HIS A 667 6.265 -29.835 22.245 1.00 34.03 H new ATOM 2015 N CYS A 668 12.429 -29.332 22.052 1.00 4.44 N ATOM 2016 CA CYS A 668 13.016 -30.309 22.954 1.00 52.23 C ATOM 2017 C CYS A 668 13.695 -29.558 24.101 1.00 41.35 C ATOM 2018 O CYS A 668 13.830 -30.089 25.202 1.00 72.24 O ATOM 2019 CB CYS A 668 13.988 -31.238 22.225 1.00 23.40 C ATOM 2020 SG CYS A 668 14.198 -32.791 23.171 1.00 53.11 S ATOM 0 H CYS A 668 12.806 -29.346 21.104 1.00 4.44 H new ATOM 0 HA CYS A 668 12.234 -30.953 23.356 1.00 52.23 H new ATOM 0 HB2 CYS A 668 13.613 -31.459 21.226 1.00 23.40 H new ATOM 0 HB3 CYS A 668 14.952 -30.745 22.101 1.00 23.40 H new ATOM 0 HG CYS A 668 15.024 -33.574 22.542 1.00 53.11 H new ATOM 2026 N ALA A 669 14.105 -28.334 23.803 1.00 41.51 N ATOM 2027 CA ALA A 669 14.767 -27.504 24.795 1.00 1.04 C ATOM 2028 C ALA A 669 13.712 -26.815 25.663 1.00 3.13 C ATOM 2029 O ALA A 669 14.038 -26.231 26.696 1.00 51.33 O ATOM 2030 CB ALA A 669 15.688 -26.504 24.093 1.00 21.31 C ATOM 0 H ALA A 669 13.992 -27.897 22.888 1.00 41.51 H new ATOM 0 HA ALA A 669 15.388 -28.113 25.452 1.00 1.04 H new ATOM 0 HB1 ALA A 669 16.184 -25.882 24.838 1.00 21.31 H new ATOM 0 HB2 ALA A 669 16.437 -27.044 23.514 1.00 21.31 H new ATOM 0 HB3 ALA A 669 15.100 -25.873 23.427 1.00 21.31 H new ATOM 2036 N GLU A 670 12.470 -26.906 25.213 1.00 52.24 N ATOM 2037 CA GLU A 670 11.365 -26.298 25.935 1.00 22.42 C ATOM 2038 C GLU A 670 10.810 -27.274 26.975 1.00 61.34 C ATOM 2039 O GLU A 670 10.100 -26.870 27.894 1.00 74.14 O ATOM 2040 CB GLU A 670 10.268 -25.839 24.973 1.00 15.15 C ATOM 2041 CG GLU A 670 10.501 -24.395 24.524 1.00 64.20 C ATOM 2042 CD GLU A 670 9.188 -23.733 24.102 1.00 3.22 C ATOM 2043 OE1 GLU A 670 8.893 -23.651 22.901 1.00 70.34 O ATOM 2044 OE2 GLU A 670 8.462 -23.294 25.074 1.00 21.30 O ATOM 0 H GLU A 670 12.204 -27.392 24.357 1.00 52.24 H new ATOM 0 HA GLU A 670 11.738 -25.416 26.456 1.00 22.42 H new ATOM 0 HB2 GLU A 670 10.245 -26.495 24.103 1.00 15.15 H new ATOM 0 HB3 GLU A 670 9.296 -25.920 25.459 1.00 15.15 H new ATOM 0 HG2 GLU A 670 10.954 -23.827 25.336 1.00 64.20 H new ATOM 0 HG3 GLU A 670 11.205 -24.378 23.692 1.00 64.20 H new ATOM 2052 N ASN A 671 11.156 -28.541 26.794 1.00 15.43 N ATOM 2053 CA ASN A 671 10.701 -29.577 27.705 1.00 33.41 C ATOM 2054 C ASN A 671 11.897 -30.124 28.487 1.00 12.33 C ATOM 2055 O ASN A 671 11.773 -30.458 29.664 1.00 32.24 O ATOM 2056 CB ASN A 671 10.064 -30.740 26.942 1.00 71.41 C ATOM 2057 CG ASN A 671 10.718 -30.920 25.571 1.00 41.05 C ATOM 2058 OD1 ASN A 671 11.835 -31.394 25.444 1.00 20.21 O ATOM 2059 ND2 ASN A 671 9.962 -30.516 24.554 1.00 43.34 N ATOM 0 H ASN A 671 11.746 -28.873 26.031 1.00 15.43 H new ATOM 0 HA ASN A 671 9.962 -29.137 28.374 1.00 33.41 H new ATOM 0 HB2 ASN A 671 10.165 -31.658 27.521 1.00 71.41 H new ATOM 0 HB3 ASN A 671 8.997 -30.557 26.819 1.00 71.41 H new ATOM 0 HD21 ASN A 671 10.309 -30.594 23.598 1.00 43.34 H new ATOM 0 HD22 ASN A 671 9.035 -30.128 24.730 1.00 43.34 H new ATOM 2066 N LEU A 672 13.028 -30.197 27.801 1.00 31.24 N ATOM 2067 CA LEU A 672 14.245 -30.697 28.417 1.00 24.22 C ATOM 2068 C LEU A 672 14.924 -29.564 29.189 1.00 42.33 C ATOM 2069 O LEU A 672 15.185 -29.691 30.384 1.00 42.10 O ATOM 2070 CB LEU A 672 15.146 -31.353 27.368 1.00 1.24 C ATOM 2071 CG LEU A 672 14.555 -32.560 26.637 1.00 41.32 C ATOM 2072 CD1 LEU A 672 15.646 -33.568 26.271 1.00 5.52 C ATOM 2073 CD2 LEU A 672 13.433 -33.202 27.455 1.00 1.44 C ATOM 0 H LEU A 672 13.127 -29.918 26.825 1.00 31.24 H new ATOM 0 HA LEU A 672 14.013 -31.480 29.139 1.00 24.22 H new ATOM 0 HB2 LEU A 672 15.415 -30.600 26.627 1.00 1.24 H new ATOM 0 HB3 LEU A 672 16.070 -31.665 27.855 1.00 1.24 H new ATOM 0 HG LEU A 672 14.113 -32.210 25.704 1.00 41.32 H new ATOM 0 HD11 LEU A 672 15.199 -34.416 25.752 1.00 5.52 H new ATOM 0 HD12 LEU A 672 16.379 -33.091 25.621 1.00 5.52 H new ATOM 0 HD13 LEU A 672 16.139 -33.917 27.179 1.00 5.52 H new ATOM 0 HD21 LEU A 672 13.031 -34.057 26.912 1.00 1.44 H new ATOM 0 HD22 LEU A 672 13.827 -33.534 28.415 1.00 1.44 H new ATOM 0 HD23 LEU A 672 12.640 -32.472 27.621 1.00 1.44 H new ATOM 2085 N SER A 673 15.191 -28.481 28.473 1.00 12.35 N ATOM 2086 CA SER A 673 15.834 -27.326 29.076 1.00 42.40 C ATOM 2087 C SER A 673 17.245 -27.695 29.538 1.00 2.45 C ATOM 2088 O SER A 673 17.837 -26.993 30.357 1.00 23.13 O ATOM 2089 CB SER A 673 15.014 -26.789 30.251 1.00 41.34 C ATOM 2090 OG SER A 673 13.969 -25.920 29.820 1.00 64.43 O ATOM 0 H SER A 673 14.974 -28.379 27.482 1.00 12.35 H new ATOM 0 HA SER A 673 15.898 -26.539 28.324 1.00 42.40 H new ATOM 0 HB2 SER A 673 14.586 -27.624 30.806 1.00 41.34 H new ATOM 0 HB3 SER A 673 15.671 -26.254 30.937 1.00 41.34 H new ATOM 0 HG SER A 673 13.907 -25.943 28.842 1.00 64.43 H new ATOM 2096 N ASP A 674 17.743 -28.795 28.994 1.00 41.02 N ATOM 2097 CA ASP A 674 19.073 -29.266 29.340 1.00 4.33 C ATOM 2098 C ASP A 674 20.095 -28.173 29.022 1.00 44.51 C ATOM 2099 O ASP A 674 21.165 -28.123 29.627 1.00 42.32 O ATOM 2100 CB ASP A 674 19.445 -30.510 28.532 1.00 61.30 C ATOM 2101 CG ASP A 674 20.765 -31.172 28.933 1.00 1.34 C ATOM 2102 OD1 ASP A 674 21.846 -30.768 28.479 1.00 12.33 O ATOM 2103 OD2 ASP A 674 20.653 -32.155 29.760 1.00 34.52 O ATOM 0 H ASP A 674 17.249 -29.374 28.315 1.00 41.02 H new ATOM 0 HA ASP A 674 19.078 -29.512 30.402 1.00 4.33 H new ATOM 0 HB2 ASP A 674 18.644 -31.242 28.632 1.00 61.30 H new ATOM 0 HB3 ASP A 674 19.498 -30.237 27.478 1.00 61.30 H new ATOM 2109 N LEU A 675 19.730 -27.324 28.073 1.00 52.53 N ATOM 2110 CA LEU A 675 20.602 -26.234 27.667 1.00 75.24 C ATOM 2111 C LEU A 675 20.887 -25.338 28.873 1.00 20.25 C ATOM 2112 O LEU A 675 22.021 -25.268 29.344 1.00 3.41 O ATOM 2113 CB LEU A 675 20.004 -25.486 26.473 1.00 20.31 C ATOM 2114 CG LEU A 675 19.240 -26.341 25.460 1.00 34.32 C ATOM 2115 CD1 LEU A 675 19.243 -25.687 24.077 1.00 31.03 C ATOM 2116 CD2 LEU A 675 19.790 -27.768 25.421 1.00 64.14 C ATOM 0 H LEU A 675 18.842 -27.368 27.573 1.00 52.53 H new ATOM 0 HA LEU A 675 21.561 -26.621 27.324 1.00 75.24 H new ATOM 0 HB2 LEU A 675 19.330 -24.718 26.852 1.00 20.31 H new ATOM 0 HB3 LEU A 675 20.811 -24.973 25.950 1.00 20.31 H new ATOM 0 HG LEU A 675 18.201 -26.406 25.783 1.00 34.32 H new ATOM 0 HD11 LEU A 675 18.693 -26.315 23.376 1.00 31.03 H new ATOM 0 HD12 LEU A 675 18.768 -24.708 24.136 1.00 31.03 H new ATOM 0 HD13 LEU A 675 20.270 -25.571 23.732 1.00 31.03 H new ATOM 0 HD21 LEU A 675 19.229 -28.354 24.693 1.00 64.14 H new ATOM 0 HD22 LEU A 675 20.842 -27.745 25.136 1.00 64.14 H new ATOM 0 HD23 LEU A 675 19.691 -28.223 26.407 1.00 64.14 H new ATOM 2128 N SER A 676 19.838 -24.676 29.340 1.00 65.22 N ATOM 2129 CA SER A 676 19.962 -23.788 30.483 1.00 42.41 C ATOM 2130 C SER A 676 18.575 -23.349 30.957 1.00 23.03 C ATOM 2131 O SER A 676 17.651 -23.227 30.155 1.00 11.42 O ATOM 2132 CB SER A 676 20.817 -22.566 30.141 1.00 41.24 C ATOM 2133 OG SER A 676 22.209 -22.870 30.145 1.00 63.23 O ATOM 0 H SER A 676 18.899 -24.737 28.947 1.00 65.22 H new ATOM 0 HA SER A 676 20.459 -24.332 31.286 1.00 42.41 H new ATOM 0 HB2 SER A 676 20.532 -22.187 29.160 1.00 41.24 H new ATOM 0 HB3 SER A 676 20.617 -21.771 30.860 1.00 41.24 H new ATOM 0 HG SER A 676 22.332 -23.839 30.218 1.00 63.23 H new ATOM 2139 N LEU A 677 18.474 -23.124 32.259 1.00 21.41 N ATOM 2140 CA LEU A 677 17.216 -22.702 32.850 1.00 54.00 C ATOM 2141 C LEU A 677 17.122 -21.176 32.802 1.00 14.42 C ATOM 2142 O LEU A 677 16.076 -20.625 32.461 1.00 41.14 O ATOM 2143 CB LEU A 677 17.062 -23.284 34.257 1.00 41.13 C ATOM 2144 CG LEU A 677 16.997 -24.810 34.348 1.00 40.21 C ATOM 2145 CD1 LEU A 677 18.150 -25.455 33.577 1.00 41.24 C ATOM 2146 CD2 LEU A 677 16.954 -25.271 35.806 1.00 3.42 C ATOM 0 H LEU A 677 19.243 -23.226 32.921 1.00 21.41 H new ATOM 0 HA LEU A 677 16.376 -23.092 32.276 1.00 54.00 H new ATOM 0 HB2 LEU A 677 17.898 -22.939 34.865 1.00 41.13 H new ATOM 0 HB3 LEU A 677 16.155 -22.874 34.701 1.00 41.13 H new ATOM 0 HG LEU A 677 16.071 -25.141 33.878 1.00 40.21 H new ATOM 0 HD11 LEU A 677 18.080 -26.540 33.658 1.00 41.24 H new ATOM 0 HD12 LEU A 677 18.093 -25.165 32.528 1.00 41.24 H new ATOM 0 HD13 LEU A 677 19.099 -25.120 33.995 1.00 41.24 H new ATOM 0 HD21 LEU A 677 16.908 -26.359 35.842 1.00 3.42 H new ATOM 0 HD22 LEU A 677 17.851 -24.928 36.323 1.00 3.42 H new ATOM 0 HD23 LEU A 677 16.073 -24.854 36.294 1.00 3.42 H new ATOM 2158 N ASP A 678 18.228 -20.535 33.150 1.00 62.43 N ATOM 2159 CA ASP A 678 18.284 -19.083 33.151 1.00 72.43 C ATOM 2160 C ASP A 678 17.775 -18.557 31.807 1.00 0.13 C ATOM 2161 O ASP A 678 17.727 -17.347 31.588 1.00 20.45 O ATOM 2162 CB ASP A 678 19.719 -18.587 33.340 1.00 34.32 C ATOM 2163 CG ASP A 678 19.884 -17.066 33.328 1.00 70.34 C ATOM 2164 OD1 ASP A 678 20.157 -16.462 32.280 1.00 60.22 O ATOM 2165 OD2 ASP A 678 19.718 -16.491 34.470 1.00 5.41 O ATOM 0 H ASP A 678 19.093 -20.995 33.433 1.00 62.43 H new ATOM 0 HA ASP A 678 17.667 -18.722 33.974 1.00 72.43 H new ATOM 0 HB2 ASP A 678 20.099 -18.971 34.287 1.00 34.32 H new ATOM 0 HB3 ASP A 678 20.341 -19.011 32.552 1.00 34.32 H new TER 2171 ASP A 678 HETATM 2172 ZN ZN A 679 -13.751 -21.843 12.690 1.00 61.41 ZN