USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 956 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 644 GLN : amide:sc= 0.196 K(o=-1.1,f=-2.3) USER MOD Set 1.2: A 679 TYR OH : rot -122:sc= -2.01! USER MOD Set 1.3: A 714 TYR OH : rot 180:sc= 0.672 USER MOD Set 2.1: A 681 ASN : amide:sc= -0.833! K(o=0.15!,f=-0.65) USER MOD Set 2.2: A 685 THR OG1 : rot 180:sc= 0.988 USER MOD Set 3.1: A 670 GLN : amide:sc= -5.72! C(o=-4.1!,f=-6.4!) USER MOD Set 3.2: A 692 THR OG1 : rot 170:sc= 1.37 USER MOD Set 3.3: A 715 ASN : amide:sc= 0.261 K(o=-4.1,f=-7.8!) USER MOD Set 4.1: A 640 SER OG : rot -30:sc= -1.67! USER MOD Set 4.2: A 654 ASN : amide:sc= 0.776 K(o=-0.89,f=-7.4!) USER MOD Single : A 585 SER OG : rot 180:sc= -0.372 USER MOD Single : A 587 THR OG1 : rot -143:sc= 1.22 USER MOD Single : A 591 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 593 THR OG1 : rot -6:sc= 1.11 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 598 GLN : amide:sc= -2.77! K(o=-2.8!,f=-0.29) USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 606 THR OG1 : rot 118:sc= 1.19 USER MOD Single : A 609 THR OG1 : rot 84:sc= 0.996 USER MOD Single : A 610 LYS NZ :NH3+ -176:sc= 1.88 (180deg=1.65) USER MOD Single : A 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 TYR OH : rot 16:sc= 1.12 USER MOD Single : A 615 LYS NZ :NH3+ 157:sc= 2.4 (180deg=0.737) USER MOD Single : A 618 THR OG1 : rot -53:sc= 1.83 USER MOD Single : A 620 LYS NZ :NH3+ 161:sc= -0.104 (180deg=-0.479) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : no HD1:sc= 1.16 K(o=1.2,f=-3.8!) USER MOD Single : A 626 ASN : amide:sc= 1.03 K(o=1,f=-6.3!) USER MOD Single : A 632 SER OG : rot 180:sc= 0 USER MOD Single : A 646 SER OG : rot 91:sc= 1.16 USER MOD Single : A 648 SER OG : rot -1:sc= -1.99! USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 652 SER OG : rot 180:sc= 0 USER MOD Single : A 658 SER OG : rot -82:sc= 1.25 USER MOD Single : A 659 ASN : amide:sc= -0.358 K(o=-0.36,f=-3!) USER MOD Single : A 661 LYS NZ :NH3+ -160:sc= 1.25 (180deg=1.07) USER MOD Single : A 663 SER OG : rot 180:sc= 0 USER MOD Single : A 664 TYR OH : rot 74:sc= -1.34 USER MOD Single : A 665 TYR OH : rot 180:sc= 0 USER MOD Single : A 668 MET CE :methyl -161:sc= -0.147 (180deg=-0.578) USER MOD Single : A 672 THR OG1 : rot 180:sc= 0 USER MOD Single : A 673 TYR OH : rot 175:sc= 1.22 USER MOD Single : A 677 THR OG1 : rot -148:sc= 0.404 USER MOD Single : A 680 ASN : amide:sc= -0.193 K(o=-0.19,f=-2.5!) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot -50:sc= -1.55 USER MOD Single : A 706 TYR OH : rot 47:sc= -1.31! USER MOD Single : A 707 GLN : amide:sc= 0.215 K(o=0.21,f=-4!) USER MOD Single : A 711 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 712 SER OG : rot 180:sc= 0 USER MOD Single : A 713 THR OG1 : rot 180:sc= 0 USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 720 THR OG1 : rot 121:sc= 1.03 USER MOD Single : A 721 SER OG : rot 180:sc= 0 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 -0.609 -14.410 24.616 1.00 64.23 N ATOM 2 CA GLU A 578 0.580 -15.209 24.342 1.00 72.43 C ATOM 3 C GLU A 578 0.248 -16.340 23.389 1.00 3.31 C ATOM 4 O GLU A 578 -0.319 -17.369 23.791 1.00 4.03 O ATOM 5 CB GLU A 578 1.163 -15.758 25.634 1.00 2.14 C ATOM 6 CG GLU A 578 1.603 -14.685 26.605 1.00 32.01 C ATOM 7 CD GLU A 578 2.750 -13.866 26.084 1.00 3.10 C ATOM 8 OE1 GLU A 578 2.536 -12.986 25.229 1.00 51.23 O ATOM 9 OE2 GLU A 578 3.888 -14.092 26.533 1.00 65.41 O ATOM 0 HA GLU A 578 1.326 -14.568 23.873 1.00 72.43 H new ATOM 0 HB2 GLU A 578 0.419 -16.391 26.118 1.00 2.14 H new ATOM 0 HB3 GLU A 578 2.016 -16.393 25.396 1.00 2.14 H new ATOM 0 HG2 GLU A 578 0.761 -14.028 26.820 1.00 32.01 H new ATOM 0 HG3 GLU A 578 1.893 -15.150 27.547 1.00 32.01 H new ATOM 18 N ALA A 579 0.554 -16.126 22.132 1.00 3.44 N ATOM 19 CA ALA A 579 0.331 -17.083 21.083 1.00 64.32 C ATOM 20 C ALA A 579 1.328 -16.815 19.979 1.00 44.20 C ATOM 21 O ALA A 579 1.532 -15.652 19.601 1.00 33.43 O ATOM 22 CB ALA A 579 -1.089 -16.972 20.550 1.00 11.11 C ATOM 0 H ALA A 579 0.976 -15.257 21.805 1.00 3.44 H new ATOM 0 HA ALA A 579 0.462 -18.093 21.470 1.00 64.32 H new ATOM 0 HB1 ALA A 579 -1.238 -17.705 19.757 1.00 11.11 H new ATOM 0 HB2 ALA A 579 -1.796 -17.162 21.357 1.00 11.11 H new ATOM 0 HB3 ALA A 579 -1.252 -15.970 20.154 1.00 11.11 H new ATOM 28 N GLU A 580 1.943 -17.874 19.475 1.00 45.34 N ATOM 29 CA GLU A 580 2.968 -17.780 18.444 1.00 1.41 C ATOM 30 C GLU A 580 4.161 -16.930 18.886 1.00 55.50 C ATOM 31 O GLU A 580 4.307 -15.770 18.503 1.00 55.22 O ATOM 32 CB GLU A 580 2.416 -17.344 17.062 1.00 22.04 C ATOM 33 CG GLU A 580 1.579 -18.405 16.320 1.00 25.14 C ATOM 34 CD GLU A 580 0.362 -18.897 17.072 1.00 12.04 C ATOM 35 OE1 GLU A 580 -0.723 -18.278 16.961 1.00 3.35 O ATOM 36 OE2 GLU A 580 0.470 -19.928 17.774 1.00 32.33 O ATOM 0 H GLU A 580 1.744 -18.830 19.771 1.00 45.34 H new ATOM 0 HA GLU A 580 3.336 -18.796 18.305 1.00 1.41 H new ATOM 0 HB2 GLU A 580 1.803 -16.453 17.199 1.00 22.04 H new ATOM 0 HB3 GLU A 580 3.255 -17.059 16.428 1.00 22.04 H new ATOM 0 HG2 GLU A 580 1.255 -17.989 15.366 1.00 25.14 H new ATOM 0 HG3 GLU A 580 2.218 -19.259 16.095 1.00 25.14 H new ATOM 43 N ALA A 581 4.998 -17.519 19.719 1.00 3.01 N ATOM 44 CA ALA A 581 6.172 -16.843 20.262 1.00 20.20 C ATOM 45 C ALA A 581 7.329 -16.971 19.300 1.00 44.12 C ATOM 46 O ALA A 581 8.411 -16.415 19.517 1.00 43.02 O ATOM 47 CB ALA A 581 6.545 -17.434 21.616 1.00 30.04 C ATOM 0 H ALA A 581 4.887 -18.480 20.042 1.00 3.01 H new ATOM 0 HA ALA A 581 5.939 -15.787 20.398 1.00 20.20 H new ATOM 0 HB1 ALA A 581 7.422 -16.920 22.008 1.00 30.04 H new ATOM 0 HB2 ALA A 581 5.712 -17.311 22.309 1.00 30.04 H new ATOM 0 HB3 ALA A 581 6.768 -18.495 21.501 1.00 30.04 H new ATOM 53 N GLU A 582 7.084 -17.716 18.244 1.00 33.01 N ATOM 54 CA GLU A 582 8.047 -17.943 17.197 1.00 55.13 C ATOM 55 C GLU A 582 8.297 -16.639 16.469 1.00 32.30 C ATOM 56 O GLU A 582 9.425 -16.299 16.133 1.00 55.51 O ATOM 57 CB GLU A 582 7.526 -18.981 16.172 1.00 0.23 C ATOM 58 CG GLU A 582 7.129 -20.361 16.722 1.00 61.01 C ATOM 59 CD GLU A 582 5.922 -20.336 17.629 1.00 52.42 C ATOM 60 OE1 GLU A 582 4.802 -20.196 17.126 1.00 75.25 O ATOM 61 OE2 GLU A 582 6.077 -20.475 18.870 1.00 34.30 O ATOM 0 H GLU A 582 6.193 -18.188 18.090 1.00 33.01 H new ATOM 0 HA GLU A 582 8.963 -18.323 17.650 1.00 55.13 H new ATOM 0 HB2 GLU A 582 6.659 -18.554 15.668 1.00 0.23 H new ATOM 0 HB3 GLU A 582 8.296 -19.126 15.414 1.00 0.23 H new ATOM 0 HG2 GLU A 582 6.928 -21.030 15.885 1.00 61.01 H new ATOM 0 HG3 GLU A 582 7.974 -20.779 17.269 1.00 61.01 H new ATOM 68 N PHE A 583 7.228 -15.909 16.250 1.00 4.43 N ATOM 69 CA PHE A 583 7.281 -14.677 15.520 1.00 72.02 C ATOM 70 C PHE A 583 7.694 -13.523 16.394 1.00 75.44 C ATOM 71 O PHE A 583 7.034 -13.203 17.395 1.00 74.51 O ATOM 72 CB PHE A 583 5.950 -14.390 14.828 1.00 32.42 C ATOM 73 CG PHE A 583 5.614 -15.375 13.747 1.00 74.30 C ATOM 74 CD1 PHE A 583 4.946 -16.555 14.036 1.00 3.25 C ATOM 75 CD2 PHE A 583 5.971 -15.120 12.436 1.00 2.25 C ATOM 76 CE1 PHE A 583 4.642 -17.458 13.040 1.00 5.32 C ATOM 77 CE2 PHE A 583 5.672 -16.015 11.436 1.00 24.10 C ATOM 78 CZ PHE A 583 5.004 -17.188 11.737 1.00 12.42 C ATOM 0 H PHE A 583 6.295 -16.160 16.578 1.00 4.43 H new ATOM 0 HA PHE A 583 8.046 -14.791 14.752 1.00 72.02 H new ATOM 0 HB2 PHE A 583 5.154 -14.394 15.573 1.00 32.42 H new ATOM 0 HB3 PHE A 583 5.981 -13.388 14.399 1.00 32.42 H new ATOM 0 HD1 PHE A 583 4.660 -16.770 15.055 1.00 3.25 H new ATOM 0 HD2 PHE A 583 6.492 -14.205 12.194 1.00 2.25 H new ATOM 0 HE1 PHE A 583 4.122 -18.374 13.279 1.00 5.32 H new ATOM 0 HE2 PHE A 583 5.958 -15.802 10.417 1.00 24.10 H new ATOM 0 HZ PHE A 583 4.766 -17.891 10.953 1.00 12.42 H new ATOM 88 N LEU A 584 8.799 -12.935 16.030 1.00 34.01 N ATOM 89 CA LEU A 584 9.330 -11.770 16.684 1.00 31.34 C ATOM 90 C LEU A 584 10.160 -10.929 15.712 1.00 73.43 C ATOM 91 O LEU A 584 10.319 -9.728 15.892 1.00 20.04 O ATOM 92 CB LEU A 584 10.072 -12.135 18.009 1.00 51.11 C ATOM 93 CG LEU A 584 11.192 -13.207 17.973 1.00 73.45 C ATOM 94 CD1 LEU A 584 12.435 -12.730 17.245 1.00 60.22 C ATOM 95 CD2 LEU A 584 11.535 -13.657 19.381 1.00 34.51 C ATOM 0 H LEU A 584 9.371 -13.260 15.250 1.00 34.01 H new ATOM 0 HA LEU A 584 8.499 -11.136 16.994 1.00 31.34 H new ATOM 0 HB2 LEU A 584 10.507 -11.218 18.406 1.00 51.11 H new ATOM 0 HB3 LEU A 584 9.321 -12.468 18.726 1.00 51.11 H new ATOM 0 HG LEU A 584 10.805 -14.056 17.409 1.00 73.45 H new ATOM 0 HD11 LEU A 584 13.186 -13.520 17.251 1.00 60.22 H new ATOM 0 HD12 LEU A 584 12.180 -12.479 16.215 1.00 60.22 H new ATOM 0 HD13 LEU A 584 12.834 -11.847 17.745 1.00 60.22 H new ATOM 0 HD21 LEU A 584 12.323 -14.410 19.341 1.00 34.51 H new ATOM 0 HD22 LEU A 584 11.880 -12.802 19.962 1.00 34.51 H new ATOM 0 HD23 LEU A 584 10.650 -14.083 19.853 1.00 34.51 H new ATOM 103 N SER A 585 10.671 -11.565 14.677 1.00 54.22 N ATOM 104 CA SER A 585 11.413 -10.887 13.641 1.00 12.23 C ATOM 105 C SER A 585 10.500 -10.611 12.452 1.00 61.20 C ATOM 106 O SER A 585 9.364 -11.087 12.414 1.00 71.44 O ATOM 107 CB SER A 585 12.581 -11.759 13.188 1.00 0.31 C ATOM 108 OG SER A 585 13.452 -12.038 14.268 1.00 42.50 O ATOM 0 H SER A 585 10.581 -12.571 14.533 1.00 54.22 H new ATOM 0 HA SER A 585 11.794 -9.945 14.035 1.00 12.23 H new ATOM 0 HB2 SER A 585 12.203 -12.692 12.770 1.00 0.31 H new ATOM 0 HB3 SER A 585 13.130 -11.254 12.394 1.00 0.31 H new ATOM 0 HG SER A 585 14.192 -12.599 13.955 1.00 42.50 H new ATOM 114 N ARG A 586 10.973 -9.819 11.511 1.00 54.52 N ATOM 115 CA ARG A 586 10.234 -9.604 10.303 1.00 42.11 C ATOM 116 C ARG A 586 10.840 -10.430 9.209 1.00 44.43 C ATOM 117 O ARG A 586 12.059 -10.619 9.166 1.00 21.53 O ATOM 118 CB ARG A 586 10.215 -8.140 9.801 1.00 73.23 C ATOM 119 CG ARG A 586 9.481 -7.088 10.633 1.00 72.31 C ATOM 120 CD ARG A 586 10.334 -6.441 11.735 1.00 65.41 C ATOM 121 NE ARG A 586 10.636 -7.291 12.893 1.00 24.41 N ATOM 122 CZ ARG A 586 11.627 -7.017 13.770 1.00 31.14 C ATOM 123 NH1 ARG A 586 12.469 -6.024 13.532 1.00 72.44 N ATOM 124 NH2 ARG A 586 11.771 -7.736 14.869 1.00 64.35 N ATOM 0 H ARG A 586 11.861 -9.320 11.567 1.00 54.52 H new ATOM 0 HA ARG A 586 9.207 -9.881 10.542 1.00 42.11 H new ATOM 0 HB2 ARG A 586 11.250 -7.814 9.694 1.00 73.23 H new ATOM 0 HB3 ARG A 586 9.775 -8.138 8.804 1.00 73.23 H new ATOM 0 HG2 ARG A 586 9.116 -6.306 9.967 1.00 72.31 H new ATOM 0 HG3 ARG A 586 8.607 -7.550 11.092 1.00 72.31 H new ATOM 0 HD2 ARG A 586 11.275 -6.113 11.294 1.00 65.41 H new ATOM 0 HD3 ARG A 586 9.819 -5.548 12.089 1.00 65.41 H new ATOM 0 HE ARG A 586 10.072 -8.127 13.043 1.00 24.41 H new ATOM 0 HH11 ARG A 586 12.371 -5.464 12.685 1.00 72.44 H new ATOM 0 HH12 ARG A 586 13.216 -5.819 14.195 1.00 72.44 H new ATOM 0 HH21 ARG A 586 11.131 -8.506 15.062 1.00 64.35 H new ATOM 0 HH22 ARG A 586 12.522 -7.521 15.524 1.00 64.35 H new ATOM 136 N THR A 587 10.023 -10.942 8.366 1.00 34.00 N ATOM 137 CA THR A 587 10.487 -11.595 7.185 1.00 65.43 C ATOM 138 C THR A 587 10.204 -10.631 6.029 1.00 4.32 C ATOM 139 O THR A 587 9.124 -10.052 5.977 1.00 71.24 O ATOM 140 CB THR A 587 9.745 -12.931 6.981 1.00 11.54 C ATOM 141 OG1 THR A 587 9.869 -13.721 8.188 1.00 60.42 O ATOM 142 CG2 THR A 587 10.348 -13.704 5.820 1.00 41.44 C ATOM 0 H THR A 587 9.008 -10.924 8.469 1.00 34.00 H new ATOM 0 HA THR A 587 11.549 -11.831 7.249 1.00 65.43 H new ATOM 0 HB THR A 587 8.697 -12.727 6.761 1.00 11.54 H new ATOM 0 HG1 THR A 587 9.967 -14.667 7.951 1.00 60.42 H new ATOM 0 HG21 THR A 587 9.812 -14.644 5.691 1.00 41.44 H new ATOM 0 HG22 THR A 587 10.268 -13.112 4.908 1.00 41.44 H new ATOM 0 HG23 THR A 587 11.398 -13.911 6.027 1.00 41.44 H new ATOM 148 N GLU A 588 11.157 -10.412 5.154 1.00 65.13 N ATOM 149 CA GLU A 588 10.959 -9.452 4.081 1.00 23.13 C ATOM 150 C GLU A 588 11.163 -10.016 2.679 1.00 65.24 C ATOM 151 O GLU A 588 11.886 -10.993 2.485 1.00 32.22 O ATOM 152 CB GLU A 588 11.688 -8.100 4.332 1.00 21.44 C ATOM 153 CG GLU A 588 13.182 -8.163 4.681 1.00 21.14 C ATOM 154 CD GLU A 588 14.050 -8.738 3.595 1.00 2.04 C ATOM 155 OE1 GLU A 588 14.310 -8.045 2.585 1.00 75.45 O ATOM 156 OE2 GLU A 588 14.518 -9.882 3.746 1.00 34.51 O ATOM 0 H GLU A 588 12.066 -10.875 5.158 1.00 65.13 H new ATOM 0 HA GLU A 588 9.895 -9.219 4.110 1.00 23.13 H new ATOM 0 HB2 GLU A 588 11.575 -7.485 3.440 1.00 21.44 H new ATOM 0 HB3 GLU A 588 11.173 -7.584 5.142 1.00 21.44 H new ATOM 0 HG2 GLU A 588 13.531 -7.157 4.914 1.00 21.14 H new ATOM 0 HG3 GLU A 588 13.307 -8.761 5.584 1.00 21.14 H new ATOM 163 N GLY A 589 10.480 -9.419 1.728 1.00 0.42 N ATOM 164 CA GLY A 589 10.567 -9.830 0.353 1.00 35.03 C ATOM 165 C GLY A 589 10.287 -8.669 -0.578 1.00 43.01 C ATOM 166 O GLY A 589 10.050 -7.547 -0.124 1.00 13.03 O ATOM 0 H GLY A 589 9.849 -8.634 1.891 1.00 0.42 H new ATOM 0 HA2 GLY A 589 11.560 -10.231 0.152 1.00 35.03 H new ATOM 0 HA3 GLY A 589 9.855 -10.633 0.164 1.00 35.03 H new ATOM 170 N ASP A 590 10.294 -8.932 -1.858 1.00 2.45 N ATOM 171 CA ASP A 590 10.056 -7.908 -2.867 1.00 50.54 C ATOM 172 C ASP A 590 9.115 -8.541 -3.893 1.00 52.52 C ATOM 173 O ASP A 590 8.573 -9.623 -3.629 1.00 75.23 O ATOM 174 CB ASP A 590 11.409 -7.522 -3.538 1.00 64.02 C ATOM 175 CG ASP A 590 11.401 -6.193 -4.318 1.00 2.34 C ATOM 176 OD1 ASP A 590 10.717 -6.065 -5.347 1.00 43.23 O ATOM 177 OD2 ASP A 590 12.136 -5.275 -3.927 1.00 35.51 O ATOM 0 H ASP A 590 10.464 -9.862 -2.242 1.00 2.45 H new ATOM 0 HA ASP A 590 9.623 -7.003 -2.441 1.00 50.54 H new ATOM 0 HB2 ASP A 590 12.176 -7.466 -2.766 1.00 64.02 H new ATOM 0 HB3 ASP A 590 11.700 -8.322 -4.219 1.00 64.02 H new ATOM 182 N ASN A 591 8.916 -7.893 -5.029 1.00 0.01 N ATOM 183 CA ASN A 591 8.087 -8.409 -6.133 1.00 25.25 C ATOM 184 C ASN A 591 6.653 -8.636 -5.700 1.00 21.10 C ATOM 185 O ASN A 591 5.960 -9.487 -6.261 1.00 23.54 O ATOM 186 CB ASN A 591 8.693 -9.709 -6.706 1.00 42.31 C ATOM 187 CG ASN A 591 10.066 -9.498 -7.325 1.00 61.33 C ATOM 188 OD1 ASN A 591 11.097 -9.613 -6.647 1.00 72.14 O ATOM 189 ND2 ASN A 591 10.101 -9.201 -8.598 1.00 45.54 N ATOM 0 H ASN A 591 9.327 -6.980 -5.224 1.00 0.01 H new ATOM 0 HA ASN A 591 8.077 -7.652 -6.917 1.00 25.25 H new ATOM 0 HB2 ASN A 591 8.768 -10.450 -5.911 1.00 42.31 H new ATOM 0 HB3 ASN A 591 8.019 -10.117 -7.459 1.00 42.31 H new ATOM 0 HD21 ASN A 591 10.997 -9.056 -9.063 1.00 45.54 H new ATOM 0 HD22 ASN A 591 9.232 -9.114 -9.126 1.00 45.54 H new ATOM 195 N CYS A 592 6.204 -7.840 -4.714 1.00 72.21 N ATOM 196 CA CYS A 592 4.832 -7.900 -4.176 1.00 74.03 C ATOM 197 C CYS A 592 4.617 -9.189 -3.406 1.00 0.01 C ATOM 198 O CYS A 592 3.473 -9.624 -3.205 1.00 32.43 O ATOM 199 CB CYS A 592 3.791 -7.798 -5.305 1.00 25.43 C ATOM 200 SG CYS A 592 3.964 -6.333 -6.357 1.00 52.53 S ATOM 0 H CYS A 592 6.786 -7.133 -4.265 1.00 72.21 H new ATOM 0 HA CYS A 592 4.704 -7.053 -3.502 1.00 74.03 H new ATOM 0 HB2 CYS A 592 3.863 -8.689 -5.929 1.00 25.43 H new ATOM 0 HB3 CYS A 592 2.794 -7.797 -4.864 1.00 25.43 H new ATOM 205 N THR A 593 5.700 -9.771 -2.909 1.00 1.34 N ATOM 206 CA THR A 593 5.615 -11.036 -2.229 1.00 3.15 C ATOM 207 C THR A 593 6.517 -11.075 -1.012 1.00 72.54 C ATOM 208 O THR A 593 7.557 -10.424 -0.974 1.00 73.31 O ATOM 209 CB THR A 593 5.969 -12.224 -3.168 1.00 73.41 C ATOM 210 OG1 THR A 593 7.250 -12.008 -3.790 1.00 14.10 O ATOM 211 CG2 THR A 593 4.913 -12.439 -4.239 1.00 20.14 C ATOM 0 H THR A 593 6.641 -9.381 -2.969 1.00 1.34 H new ATOM 0 HA THR A 593 4.579 -11.141 -1.908 1.00 3.15 H new ATOM 0 HB THR A 593 6.008 -13.121 -2.549 1.00 73.41 H new ATOM 0 HG1 THR A 593 7.578 -11.113 -3.562 1.00 14.10 H new ATOM 0 HG21 THR A 593 5.202 -13.278 -4.871 1.00 20.14 H new ATOM 0 HG22 THR A 593 3.954 -12.653 -3.767 1.00 20.14 H new ATOM 0 HG23 THR A 593 4.824 -11.540 -4.848 1.00 20.14 H new ATOM 217 N VAL A 594 6.098 -11.817 -0.032 1.00 4.21 N ATOM 218 CA VAL A 594 6.863 -12.044 1.158 1.00 22.25 C ATOM 219 C VAL A 594 6.602 -13.463 1.655 1.00 52.10 C ATOM 220 O VAL A 594 5.458 -13.845 1.914 1.00 14.53 O ATOM 221 CB VAL A 594 6.584 -10.970 2.267 1.00 73.01 C ATOM 222 CG1 VAL A 594 5.098 -10.846 2.590 1.00 71.13 C ATOM 223 CG2 VAL A 594 7.385 -11.267 3.523 1.00 22.53 C ATOM 0 H VAL A 594 5.195 -12.292 -0.037 1.00 4.21 H new ATOM 0 HA VAL A 594 7.921 -11.940 0.916 1.00 22.25 H new ATOM 0 HB VAL A 594 6.907 -10.009 1.868 1.00 73.01 H new ATOM 0 HG11 VAL A 594 4.955 -10.091 3.363 1.00 71.13 H new ATOM 0 HG12 VAL A 594 4.554 -10.554 1.692 1.00 71.13 H new ATOM 0 HG13 VAL A 594 4.722 -11.805 2.946 1.00 71.13 H new ATOM 0 HG21 VAL A 594 7.174 -10.508 4.277 1.00 22.53 H new ATOM 0 HG22 VAL A 594 7.107 -12.248 3.908 1.00 22.53 H new ATOM 0 HG23 VAL A 594 8.449 -11.258 3.287 1.00 22.53 H new ATOM 229 N PHE A 595 7.645 -14.245 1.755 1.00 75.42 N ATOM 230 CA PHE A 595 7.511 -15.627 2.140 1.00 43.24 C ATOM 231 C PHE A 595 8.533 -15.995 3.185 1.00 42.01 C ATOM 232 O PHE A 595 9.637 -15.453 3.191 1.00 54.12 O ATOM 233 CB PHE A 595 7.623 -16.557 0.901 1.00 14.45 C ATOM 234 CG PHE A 595 8.926 -16.470 0.134 1.00 32.14 C ATOM 235 CD1 PHE A 595 9.097 -15.524 -0.867 1.00 2.31 C ATOM 236 CD2 PHE A 595 9.971 -17.339 0.411 1.00 41.14 C ATOM 237 CE1 PHE A 595 10.283 -15.448 -1.573 1.00 72.23 C ATOM 238 CE2 PHE A 595 11.157 -17.267 -0.291 1.00 33.04 C ATOM 239 CZ PHE A 595 11.314 -16.319 -1.285 1.00 33.22 C ATOM 0 H PHE A 595 8.603 -13.946 1.574 1.00 75.42 H new ATOM 0 HA PHE A 595 6.521 -15.763 2.576 1.00 43.24 H new ATOM 0 HB2 PHE A 595 7.483 -17.587 1.228 1.00 14.45 H new ATOM 0 HB3 PHE A 595 6.805 -16.325 0.219 1.00 14.45 H new ATOM 0 HD1 PHE A 595 8.294 -14.839 -1.097 1.00 2.31 H new ATOM 0 HD2 PHE A 595 9.855 -18.082 1.186 1.00 41.14 H new ATOM 0 HE1 PHE A 595 10.403 -14.707 -2.350 1.00 72.23 H new ATOM 0 HE2 PHE A 595 11.962 -17.951 -0.064 1.00 33.04 H new ATOM 0 HZ PHE A 595 12.242 -16.260 -1.835 1.00 33.22 H new ATOM 249 N ASP A 596 8.159 -16.897 4.070 1.00 30.43 N ATOM 250 CA ASP A 596 9.061 -17.365 5.117 1.00 14.42 C ATOM 251 C ASP A 596 9.244 -18.851 4.942 1.00 21.24 C ATOM 252 O ASP A 596 8.255 -19.604 4.941 1.00 50.20 O ATOM 253 CB ASP A 596 8.493 -17.073 6.509 1.00 73.32 C ATOM 254 CG ASP A 596 9.465 -17.372 7.626 1.00 43.52 C ATOM 255 OD1 ASP A 596 9.580 -18.546 8.033 1.00 50.13 O ATOM 256 OD2 ASP A 596 10.133 -16.442 8.106 1.00 34.31 O ATOM 0 H ASP A 596 7.234 -17.325 4.089 1.00 30.43 H new ATOM 0 HA ASP A 596 10.015 -16.844 5.034 1.00 14.42 H new ATOM 0 HB2 ASP A 596 8.201 -16.024 6.562 1.00 73.32 H new ATOM 0 HB3 ASP A 596 7.589 -17.663 6.656 1.00 73.32 H new ATOM 261 N SER A 597 10.478 -19.271 4.784 1.00 30.21 N ATOM 262 CA SER A 597 10.799 -20.654 4.505 1.00 45.21 C ATOM 263 C SER A 597 10.512 -21.589 5.692 1.00 71.44 C ATOM 264 O SER A 597 9.968 -22.677 5.509 1.00 11.52 O ATOM 265 CB SER A 597 12.262 -20.756 4.072 1.00 23.43 C ATOM 266 OG SER A 597 12.511 -19.897 2.957 1.00 21.12 O ATOM 0 H SER A 597 11.293 -18.660 4.846 1.00 30.21 H new ATOM 0 HA SER A 597 10.148 -20.988 3.697 1.00 45.21 H new ATOM 0 HB2 SER A 597 12.914 -20.484 4.902 1.00 23.43 H new ATOM 0 HB3 SER A 597 12.498 -21.786 3.806 1.00 23.43 H new ATOM 0 HG SER A 597 13.451 -19.971 2.691 1.00 21.12 H new ATOM 272 N GLN A 598 10.838 -21.163 6.900 1.00 44.42 N ATOM 273 CA GLN A 598 10.629 -22.016 8.056 1.00 32.35 C ATOM 274 C GLN A 598 9.200 -22.039 8.579 1.00 13.40 C ATOM 275 O GLN A 598 8.714 -23.084 9.011 1.00 21.24 O ATOM 276 CB GLN A 598 11.676 -21.867 9.184 1.00 20.43 C ATOM 277 CG GLN A 598 12.008 -20.457 9.694 1.00 73.33 C ATOM 278 CD GLN A 598 12.845 -19.644 8.725 1.00 74.21 C ATOM 279 OE1 GLN A 598 14.068 -19.722 8.746 1.00 42.34 O ATOM 280 NE2 GLN A 598 12.222 -18.814 7.948 1.00 72.31 N ATOM 0 H GLN A 598 11.241 -20.249 7.104 1.00 44.42 H new ATOM 0 HA GLN A 598 10.804 -23.010 7.644 1.00 32.35 H new ATOM 0 HB2 GLN A 598 11.332 -22.455 10.035 1.00 20.43 H new ATOM 0 HB3 GLN A 598 12.604 -22.321 8.837 1.00 20.43 H new ATOM 0 HG2 GLN A 598 11.079 -19.924 9.895 1.00 73.33 H new ATOM 0 HG3 GLN A 598 12.540 -20.538 10.642 1.00 73.33 H new ATOM 0 HE21 GLN A 598 11.203 -18.775 7.956 1.00 72.31 H new ATOM 0 HE22 GLN A 598 12.751 -18.200 7.329 1.00 72.31 H new ATOM 288 N ALA A 599 8.525 -20.917 8.550 1.00 53.32 N ATOM 289 CA ALA A 599 7.139 -20.898 8.986 1.00 34.43 C ATOM 290 C ALA A 599 6.225 -21.397 7.865 1.00 54.11 C ATOM 291 O ALA A 599 5.075 -21.778 8.105 1.00 14.03 O ATOM 292 CB ALA A 599 6.743 -19.525 9.456 1.00 53.33 C ATOM 0 H ALA A 599 8.896 -20.020 8.238 1.00 53.32 H new ATOM 0 HA ALA A 599 7.029 -21.574 9.834 1.00 34.43 H new ATOM 0 HB1 ALA A 599 5.701 -19.537 9.777 1.00 53.33 H new ATOM 0 HB2 ALA A 599 7.377 -19.230 10.292 1.00 53.33 H new ATOM 0 HB3 ALA A 599 6.863 -18.812 8.640 1.00 53.33 H new ATOM 298 N GLY A 600 6.755 -21.388 6.651 1.00 41.24 N ATOM 299 CA GLY A 600 6.095 -22.030 5.527 1.00 55.44 C ATOM 300 C GLY A 600 4.914 -21.280 4.968 1.00 0.54 C ATOM 301 O GLY A 600 3.843 -21.852 4.772 1.00 31.55 O ATOM 0 H GLY A 600 7.643 -20.942 6.420 1.00 41.24 H new ATOM 0 HA2 GLY A 600 6.825 -22.174 4.730 1.00 55.44 H new ATOM 0 HA3 GLY A 600 5.763 -23.021 5.838 1.00 55.44 H new ATOM 305 N PHE A 601 5.090 -20.020 4.710 1.00 32.12 N ATOM 306 CA PHE A 601 4.028 -19.232 4.127 1.00 75.41 C ATOM 307 C PHE A 601 4.560 -18.339 3.052 1.00 44.43 C ATOM 308 O PHE A 601 5.760 -18.048 3.020 1.00 54.20 O ATOM 309 CB PHE A 601 3.281 -18.397 5.182 1.00 54.55 C ATOM 310 CG PHE A 601 4.149 -17.456 5.963 1.00 52.11 C ATOM 311 CD1 PHE A 601 4.600 -16.265 5.409 1.00 55.34 C ATOM 312 CD2 PHE A 601 4.512 -17.763 7.250 1.00 35.21 C ATOM 313 CE1 PHE A 601 5.393 -15.419 6.125 1.00 23.24 C ATOM 314 CE2 PHE A 601 5.304 -16.915 7.972 1.00 12.42 C ATOM 315 CZ PHE A 601 5.746 -15.747 7.413 1.00 73.22 C ATOM 0 H PHE A 601 5.954 -19.509 4.891 1.00 32.12 H new ATOM 0 HA PHE A 601 3.315 -19.932 3.691 1.00 75.41 H new ATOM 0 HB2 PHE A 601 2.500 -17.822 4.685 1.00 54.55 H new ATOM 0 HB3 PHE A 601 2.785 -19.074 5.877 1.00 54.55 H new ATOM 0 HD1 PHE A 601 4.319 -16.006 4.399 1.00 55.34 H new ATOM 0 HD2 PHE A 601 4.168 -18.684 7.697 1.00 35.21 H new ATOM 0 HE1 PHE A 601 5.742 -14.497 5.684 1.00 23.24 H new ATOM 0 HE2 PHE A 601 5.581 -17.167 8.985 1.00 12.42 H new ATOM 0 HZ PHE A 601 6.374 -15.080 7.985 1.00 73.22 H new ATOM 325 N SER A 602 3.688 -17.927 2.181 1.00 54.02 N ATOM 326 CA SER A 602 3.993 -16.982 1.160 1.00 75.31 C ATOM 327 C SER A 602 2.799 -16.051 1.000 1.00 62.44 C ATOM 328 O SER A 602 1.675 -16.515 0.823 1.00 22.40 O ATOM 329 CB SER A 602 4.297 -17.703 -0.159 1.00 2.21 C ATOM 330 OG SER A 602 4.593 -16.783 -1.200 1.00 13.14 O ATOM 0 H SER A 602 2.721 -18.250 2.164 1.00 54.02 H new ATOM 0 HA SER A 602 4.877 -16.405 1.434 1.00 75.31 H new ATOM 0 HB2 SER A 602 5.140 -18.379 -0.019 1.00 2.21 H new ATOM 0 HB3 SER A 602 3.442 -18.315 -0.446 1.00 2.21 H new ATOM 0 HG SER A 602 4.784 -17.274 -2.026 1.00 13.14 H new ATOM 336 N PHE A 603 3.022 -14.769 1.121 1.00 35.22 N ATOM 337 CA PHE A 603 1.979 -13.804 0.897 1.00 23.05 C ATOM 338 C PHE A 603 2.235 -13.011 -0.354 1.00 71.10 C ATOM 339 O PHE A 603 3.359 -12.557 -0.609 1.00 62.33 O ATOM 340 CB PHE A 603 1.738 -12.899 2.109 1.00 14.12 C ATOM 341 CG PHE A 603 1.078 -13.612 3.252 1.00 62.10 C ATOM 342 CD1 PHE A 603 -0.306 -13.677 3.324 1.00 43.23 C ATOM 343 CD2 PHE A 603 1.824 -14.226 4.241 1.00 30.51 C ATOM 344 CE1 PHE A 603 -0.930 -14.335 4.357 1.00 51.34 C ATOM 345 CE2 PHE A 603 1.202 -14.890 5.279 1.00 51.41 C ATOM 346 CZ PHE A 603 -0.179 -14.944 5.335 1.00 51.51 C ATOM 0 H PHE A 603 3.924 -14.367 1.376 1.00 35.22 H new ATOM 0 HA PHE A 603 1.055 -14.364 0.753 1.00 23.05 H new ATOM 0 HB2 PHE A 603 2.691 -12.490 2.445 1.00 14.12 H new ATOM 0 HB3 PHE A 603 1.117 -12.055 1.808 1.00 14.12 H new ATOM 0 HD1 PHE A 603 -0.902 -13.204 2.557 1.00 43.23 H new ATOM 0 HD2 PHE A 603 2.903 -14.186 4.201 1.00 30.51 H new ATOM 0 HE1 PHE A 603 -2.008 -14.374 4.401 1.00 51.34 H new ATOM 0 HE2 PHE A 603 1.793 -15.367 6.047 1.00 51.41 H new ATOM 0 HZ PHE A 603 -0.667 -15.464 6.146 1.00 51.51 H new ATOM 356 N ASP A 604 1.193 -12.860 -1.119 1.00 75.13 N ATOM 357 CA ASP A 604 1.224 -12.179 -2.405 1.00 30.34 C ATOM 358 C ASP A 604 0.222 -11.059 -2.396 1.00 23.21 C ATOM 359 O ASP A 604 -0.955 -11.275 -2.101 1.00 24.10 O ATOM 360 CB ASP A 604 0.893 -13.169 -3.543 1.00 23.32 C ATOM 361 CG ASP A 604 0.734 -12.497 -4.904 1.00 35.44 C ATOM 362 OD1 ASP A 604 1.728 -12.360 -5.637 1.00 33.34 O ATOM 363 OD2 ASP A 604 -0.392 -12.105 -5.254 1.00 51.42 O ATOM 0 H ASP A 604 0.269 -13.212 -0.870 1.00 75.13 H new ATOM 0 HA ASP A 604 2.223 -11.776 -2.574 1.00 30.34 H new ATOM 0 HB2 ASP A 604 1.684 -13.917 -3.605 1.00 23.32 H new ATOM 0 HB3 ASP A 604 -0.028 -13.698 -3.298 1.00 23.32 H new ATOM 368 N LEU A 605 0.670 -9.874 -2.696 1.00 51.02 N ATOM 369 CA LEU A 605 -0.208 -8.723 -2.704 1.00 23.33 C ATOM 370 C LEU A 605 -0.246 -8.082 -4.078 1.00 32.52 C ATOM 371 O LEU A 605 -0.700 -6.947 -4.238 1.00 23.42 O ATOM 372 CB LEU A 605 0.224 -7.711 -1.651 1.00 22.52 C ATOM 373 CG LEU A 605 0.205 -8.196 -0.200 1.00 54.51 C ATOM 374 CD1 LEU A 605 0.682 -7.107 0.712 1.00 10.20 C ATOM 375 CD2 LEU A 605 -1.187 -8.651 0.213 1.00 53.41 C ATOM 0 H LEU A 605 1.640 -9.672 -2.940 1.00 51.02 H new ATOM 0 HA LEU A 605 -1.215 -9.063 -2.461 1.00 23.33 H new ATOM 0 HB2 LEU A 605 1.235 -7.380 -1.888 1.00 22.52 H new ATOM 0 HB3 LEU A 605 -0.424 -6.838 -1.729 1.00 22.52 H new ATOM 0 HG LEU A 605 0.876 -9.051 -0.122 1.00 54.51 H new ATOM 0 HD11 LEU A 605 0.665 -7.462 1.742 1.00 10.20 H new ATOM 0 HD12 LEU A 605 1.700 -6.826 0.442 1.00 10.20 H new ATOM 0 HD13 LEU A 605 0.029 -6.240 0.616 1.00 10.20 H new ATOM 0 HD21 LEU A 605 -1.167 -8.990 1.249 1.00 53.41 H new ATOM 0 HD22 LEU A 605 -1.885 -7.819 0.117 1.00 53.41 H new ATOM 0 HD23 LEU A 605 -1.508 -9.470 -0.430 1.00 53.41 H new ATOM 383 N THR A 606 0.181 -8.841 -5.069 1.00 15.03 N ATOM 384 CA THR A 606 0.216 -8.409 -6.434 1.00 73.22 C ATOM 385 C THR A 606 -1.180 -7.869 -6.944 1.00 43.13 C ATOM 386 O THR A 606 -1.227 -6.786 -7.534 1.00 14.13 O ATOM 387 CB THR A 606 0.719 -9.556 -7.331 1.00 23.14 C ATOM 388 OG1 THR A 606 1.978 -10.040 -6.815 1.00 70.31 O ATOM 389 CG2 THR A 606 0.926 -9.063 -8.735 1.00 11.31 C ATOM 0 H THR A 606 0.518 -9.794 -4.934 1.00 15.03 H new ATOM 0 HA THR A 606 0.908 -7.569 -6.492 1.00 73.22 H new ATOM 0 HB THR A 606 -0.022 -10.356 -7.336 1.00 23.14 H new ATOM 0 HG1 THR A 606 1.885 -10.980 -6.555 1.00 70.31 H new ATOM 0 HG21 THR A 606 1.282 -9.882 -9.360 1.00 11.31 H new ATOM 0 HG22 THR A 606 -0.017 -8.687 -9.132 1.00 11.31 H new ATOM 0 HG23 THR A 606 1.664 -8.261 -8.734 1.00 11.31 H new ATOM 395 N PRO A 607 -2.340 -8.587 -6.689 1.00 23.35 N ATOM 396 CA PRO A 607 -3.675 -8.141 -7.157 1.00 40.41 C ATOM 397 C PRO A 607 -4.129 -6.803 -6.560 1.00 73.12 C ATOM 398 O PRO A 607 -5.117 -6.219 -7.012 1.00 34.33 O ATOM 399 CB PRO A 607 -4.618 -9.261 -6.697 1.00 52.14 C ATOM 400 CG PRO A 607 -3.734 -10.429 -6.476 1.00 53.24 C ATOM 401 CD PRO A 607 -2.453 -9.871 -5.965 1.00 42.54 C ATOM 0 HA PRO A 607 -3.664 -7.971 -8.234 1.00 40.41 H new ATOM 0 HB2 PRO A 607 -5.145 -8.985 -5.784 1.00 52.14 H new ATOM 0 HB3 PRO A 607 -5.376 -9.475 -7.450 1.00 52.14 H new ATOM 0 HG2 PRO A 607 -4.173 -11.123 -5.759 1.00 53.24 H new ATOM 0 HG3 PRO A 607 -3.578 -10.983 -7.401 1.00 53.24 H new ATOM 0 HD2 PRO A 607 -2.478 -9.725 -4.885 1.00 42.54 H new ATOM 0 HD3 PRO A 607 -1.612 -10.530 -6.178 1.00 42.54 H new ATOM 409 N LEU A 608 -3.423 -6.315 -5.543 1.00 63.43 N ATOM 410 CA LEU A 608 -3.788 -5.089 -4.916 1.00 11.31 C ATOM 411 C LEU A 608 -3.154 -3.919 -5.646 1.00 34.15 C ATOM 412 O LEU A 608 -3.426 -2.785 -5.333 1.00 53.52 O ATOM 413 CB LEU A 608 -3.370 -5.067 -3.422 1.00 31.53 C ATOM 414 CG LEU A 608 -4.067 -6.029 -2.435 1.00 64.11 C ATOM 415 CD1 LEU A 608 -3.788 -7.477 -2.756 1.00 63.44 C ATOM 416 CD2 LEU A 608 -3.635 -5.723 -1.017 1.00 52.24 C ATOM 0 H LEU A 608 -2.597 -6.765 -5.149 1.00 63.43 H new ATOM 0 HA LEU A 608 -4.873 -5.002 -4.964 1.00 11.31 H new ATOM 0 HB2 LEU A 608 -2.300 -5.268 -3.377 1.00 31.53 H new ATOM 0 HB3 LEU A 608 -3.520 -4.052 -3.053 1.00 31.53 H new ATOM 0 HG LEU A 608 -5.141 -5.872 -2.534 1.00 64.11 H new ATOM 0 HD11 LEU A 608 -4.299 -8.115 -2.035 1.00 63.44 H new ATOM 0 HD12 LEU A 608 -4.148 -7.703 -3.760 1.00 63.44 H new ATOM 0 HD13 LEU A 608 -2.715 -7.661 -2.706 1.00 63.44 H new ATOM 0 HD21 LEU A 608 -4.132 -6.407 -0.329 1.00 52.24 H new ATOM 0 HD22 LEU A 608 -2.555 -5.844 -0.931 1.00 52.24 H new ATOM 0 HD23 LEU A 608 -3.906 -4.697 -0.767 1.00 52.24 H new ATOM 424 N THR A 609 -2.302 -4.208 -6.607 1.00 15.44 N ATOM 425 CA THR A 609 -1.602 -3.176 -7.341 1.00 13.13 C ATOM 426 C THR A 609 -2.555 -2.445 -8.285 1.00 35.02 C ATOM 427 O THR A 609 -3.190 -3.063 -9.149 1.00 42.11 O ATOM 428 CB THR A 609 -0.443 -3.783 -8.163 1.00 13.22 C ATOM 429 OG1 THR A 609 0.392 -4.557 -7.299 1.00 10.40 O ATOM 430 CG2 THR A 609 0.396 -2.687 -8.816 1.00 2.35 C ATOM 0 H THR A 609 -2.076 -5.159 -6.900 1.00 15.44 H new ATOM 0 HA THR A 609 -1.199 -2.468 -6.616 1.00 13.13 H new ATOM 0 HB THR A 609 -0.867 -4.412 -8.946 1.00 13.22 H new ATOM 0 HG1 THR A 609 0.018 -5.458 -7.203 1.00 10.40 H new ATOM 0 HG21 THR A 609 1.205 -3.141 -9.389 1.00 2.35 H new ATOM 0 HG22 THR A 609 -0.233 -2.096 -9.482 1.00 2.35 H new ATOM 0 HG23 THR A 609 0.815 -2.041 -8.044 1.00 2.35 H new ATOM 436 N LYS A 610 -2.673 -1.154 -8.108 1.00 50.23 N ATOM 437 CA LYS A 610 -3.478 -0.346 -8.986 1.00 43.52 C ATOM 438 C LYS A 610 -2.609 0.609 -9.727 1.00 43.41 C ATOM 439 O LYS A 610 -1.678 1.159 -9.164 1.00 63.13 O ATOM 440 CB LYS A 610 -4.491 0.501 -8.231 1.00 14.14 C ATOM 441 CG LYS A 610 -5.602 -0.230 -7.513 1.00 2.14 C ATOM 442 CD LYS A 610 -6.531 0.760 -6.796 1.00 61.32 C ATOM 443 CE LYS A 610 -7.002 1.841 -7.724 1.00 30.42 C ATOM 444 NZ LYS A 610 -7.866 2.842 -7.063 1.00 54.11 N ATOM 0 H LYS A 610 -2.217 -0.637 -7.356 1.00 50.23 H new ATOM 0 HA LYS A 610 -3.997 -1.039 -9.648 1.00 43.52 H new ATOM 0 HB2 LYS A 610 -3.951 1.100 -7.498 1.00 14.14 H new ATOM 0 HB3 LYS A 610 -4.945 1.196 -8.938 1.00 14.14 H new ATOM 0 HG2 LYS A 610 -6.175 -0.822 -8.227 1.00 2.14 H new ATOM 0 HG3 LYS A 610 -5.177 -0.926 -6.790 1.00 2.14 H new ATOM 0 HD2 LYS A 610 -7.391 0.226 -6.391 1.00 61.32 H new ATOM 0 HD3 LYS A 610 -6.006 1.207 -5.951 1.00 61.32 H new ATOM 0 HE2 LYS A 610 -6.136 2.345 -8.153 1.00 30.42 H new ATOM 0 HE3 LYS A 610 -7.549 1.388 -8.551 1.00 30.42 H new ATOM 0 HZ1 LYS A 610 -8.213 3.522 -7.769 1.00 54.11 H new ATOM 0 HZ2 LYS A 610 -8.675 2.363 -6.618 1.00 54.11 H new ATOM 0 HZ3 LYS A 610 -7.319 3.346 -6.336 1.00 54.11 H new ATOM 458 N LYS A 611 -2.902 0.814 -10.968 1.00 12.01 N ATOM 459 CA LYS A 611 -2.238 1.841 -11.710 1.00 13.34 C ATOM 460 C LYS A 611 -2.820 3.192 -11.286 1.00 53.14 C ATOM 461 O LYS A 611 -2.165 4.208 -11.338 1.00 44.22 O ATOM 462 CB LYS A 611 -2.372 1.622 -13.228 1.00 74.22 C ATOM 463 CG LYS A 611 -1.648 2.671 -14.060 1.00 43.34 C ATOM 464 CD LYS A 611 -0.173 2.723 -13.690 1.00 73.10 C ATOM 465 CE LYS A 611 0.567 3.797 -14.450 1.00 22.14 C ATOM 466 NZ LYS A 611 1.997 3.847 -14.062 1.00 51.31 N ATOM 0 H LYS A 611 -3.598 0.285 -11.493 1.00 12.01 H new ATOM 0 HA LYS A 611 -1.170 1.815 -11.492 1.00 13.34 H new ATOM 0 HB2 LYS A 611 -1.981 0.636 -13.481 1.00 74.22 H new ATOM 0 HB3 LYS A 611 -3.429 1.624 -13.495 1.00 74.22 H new ATOM 0 HG2 LYS A 611 -1.755 2.440 -15.120 1.00 43.34 H new ATOM 0 HG3 LYS A 611 -2.103 3.648 -13.900 1.00 43.34 H new ATOM 0 HD2 LYS A 611 -0.075 2.904 -12.620 1.00 73.10 H new ATOM 0 HD3 LYS A 611 0.285 1.755 -13.893 1.00 73.10 H new ATOM 0 HE2 LYS A 611 0.485 3.609 -15.521 1.00 22.14 H new ATOM 0 HE3 LYS A 611 0.103 4.765 -14.260 1.00 22.14 H new ATOM 0 HZ1 LYS A 611 2.477 4.595 -14.602 1.00 51.31 H new ATOM 0 HZ2 LYS A 611 2.074 4.050 -13.045 1.00 51.31 H new ATOM 0 HZ3 LYS A 611 2.444 2.931 -14.267 1.00 51.31 H new ATOM 480 N ASP A 612 -4.060 3.151 -10.817 1.00 53.34 N ATOM 481 CA ASP A 612 -4.782 4.346 -10.362 1.00 11.00 C ATOM 482 C ASP A 612 -4.369 4.710 -8.946 1.00 5.54 C ATOM 483 O ASP A 612 -4.550 5.844 -8.502 1.00 2.04 O ATOM 484 CB ASP A 612 -6.301 4.096 -10.446 1.00 2.35 C ATOM 485 CG ASP A 612 -7.150 5.193 -9.831 1.00 53.43 C ATOM 486 OD1 ASP A 612 -7.209 6.310 -10.392 1.00 44.41 O ATOM 487 OD2 ASP A 612 -7.783 4.939 -8.771 1.00 55.15 O ATOM 0 H ASP A 612 -4.600 2.289 -10.739 1.00 53.34 H new ATOM 0 HA ASP A 612 -4.529 5.186 -11.009 1.00 11.00 H new ATOM 0 HB2 ASP A 612 -6.581 3.980 -11.493 1.00 2.35 H new ATOM 0 HB3 ASP A 612 -6.530 3.154 -9.949 1.00 2.35 H new ATOM 492 N ALA A 613 -3.776 3.730 -8.268 1.00 65.42 N ATOM 493 CA ALA A 613 -3.309 3.840 -6.888 1.00 52.20 C ATOM 494 C ALA A 613 -4.453 4.044 -5.879 1.00 33.33 C ATOM 495 O ALA A 613 -5.612 4.247 -6.237 1.00 63.41 O ATOM 496 CB ALA A 613 -2.227 4.908 -6.737 1.00 20.34 C ATOM 0 H ALA A 613 -3.602 2.811 -8.675 1.00 65.42 H new ATOM 0 HA ALA A 613 -2.858 2.878 -6.646 1.00 52.20 H new ATOM 0 HB1 ALA A 613 -1.907 4.958 -5.696 1.00 20.34 H new ATOM 0 HB2 ALA A 613 -1.374 4.654 -7.367 1.00 20.34 H new ATOM 0 HB3 ALA A 613 -2.626 5.876 -7.040 1.00 20.34 H new ATOM 502 N TYR A 614 -4.112 3.939 -4.644 1.00 14.11 N ATOM 503 CA TYR A 614 -5.042 4.090 -3.535 1.00 51.00 C ATOM 504 C TYR A 614 -4.853 5.433 -2.890 1.00 34.43 C ATOM 505 O TYR A 614 -3.733 5.851 -2.669 1.00 2.05 O ATOM 506 CB TYR A 614 -4.792 2.983 -2.505 1.00 35.23 C ATOM 507 CG TYR A 614 -5.104 1.614 -3.036 1.00 22.14 C ATOM 508 CD1 TYR A 614 -4.208 0.940 -3.862 1.00 4.32 C ATOM 509 CD2 TYR A 614 -6.314 1.002 -2.748 1.00 41.40 C ATOM 510 CE1 TYR A 614 -4.511 -0.269 -4.361 1.00 13.41 C ATOM 511 CE2 TYR A 614 -6.620 -0.234 -3.264 1.00 21.23 C ATOM 512 CZ TYR A 614 -5.714 -0.862 -4.071 1.00 11.11 C ATOM 513 OH TYR A 614 -6.000 -2.090 -4.604 1.00 24.23 O ATOM 0 H TYR A 614 -3.156 3.740 -4.348 1.00 14.11 H new ATOM 0 HA TYR A 614 -6.063 4.015 -3.909 1.00 51.00 H new ATOM 0 HB2 TYR A 614 -3.750 3.016 -2.188 1.00 35.23 H new ATOM 0 HB3 TYR A 614 -5.400 3.172 -1.620 1.00 35.23 H new ATOM 0 HD1 TYR A 614 -3.259 1.395 -4.104 1.00 4.32 H new ATOM 0 HD2 TYR A 614 -7.026 1.504 -2.109 1.00 41.40 H new ATOM 0 HE1 TYR A 614 -3.802 -0.779 -4.996 1.00 13.41 H new ATOM 0 HE2 TYR A 614 -7.565 -0.703 -3.034 1.00 21.23 H new ATOM 0 HH TYR A 614 -5.177 -2.499 -4.944 1.00 24.23 H new ATOM 523 N LYS A 615 -5.921 6.126 -2.605 1.00 64.03 N ATOM 524 CA LYS A 615 -5.786 7.396 -1.986 1.00 10.41 C ATOM 525 C LYS A 615 -6.599 7.486 -0.710 1.00 42.12 C ATOM 526 O LYS A 615 -7.773 7.119 -0.673 1.00 75.53 O ATOM 527 CB LYS A 615 -6.125 8.497 -2.981 1.00 74.44 C ATOM 528 CG LYS A 615 -7.549 8.465 -3.488 1.00 14.25 C ATOM 529 CD LYS A 615 -8.422 9.518 -2.837 1.00 53.34 C ATOM 530 CE LYS A 615 -7.857 10.926 -3.063 1.00 62.41 C ATOM 531 NZ LYS A 615 -8.816 11.991 -2.738 1.00 24.21 N ATOM 0 H LYS A 615 -6.879 5.830 -2.792 1.00 64.03 H new ATOM 0 HA LYS A 615 -4.747 7.532 -1.685 1.00 10.41 H new ATOM 0 HB2 LYS A 615 -5.941 9.463 -2.511 1.00 74.44 H new ATOM 0 HB3 LYS A 615 -5.448 8.422 -3.832 1.00 74.44 H new ATOM 0 HG2 LYS A 615 -7.550 8.614 -4.568 1.00 14.25 H new ATOM 0 HG3 LYS A 615 -7.975 7.479 -3.302 1.00 14.25 H new ATOM 0 HD2 LYS A 615 -9.432 9.459 -3.244 1.00 53.34 H new ATOM 0 HD3 LYS A 615 -8.497 9.321 -1.768 1.00 53.34 H new ATOM 0 HE2 LYS A 615 -6.962 11.054 -2.455 1.00 62.41 H new ATOM 0 HE3 LYS A 615 -7.552 11.026 -4.105 1.00 62.41 H new ATOM 0 HZ1 LYS A 615 -8.301 12.870 -2.530 1.00 24.21 H new ATOM 0 HZ2 LYS A 615 -9.451 12.145 -3.547 1.00 24.21 H new ATOM 0 HZ3 LYS A 615 -9.375 11.713 -1.907 1.00 24.21 H new ATOM 545 N VAL A 616 -5.967 7.963 0.313 1.00 50.15 N ATOM 546 CA VAL A 616 -6.581 8.144 1.604 1.00 0.12 C ATOM 547 C VAL A 616 -6.650 9.627 1.820 1.00 13.14 C ATOM 548 O VAL A 616 -5.659 10.302 1.632 1.00 5.13 O ATOM 549 CB VAL A 616 -5.696 7.546 2.722 1.00 13.30 C ATOM 550 CG1 VAL A 616 -6.421 7.538 4.058 1.00 30.23 C ATOM 551 CG2 VAL A 616 -5.188 6.165 2.352 1.00 74.32 C ATOM 0 H VAL A 616 -4.988 8.246 0.282 1.00 50.15 H new ATOM 0 HA VAL A 616 -7.556 7.657 1.634 1.00 0.12 H new ATOM 0 HB VAL A 616 -4.824 8.191 2.829 1.00 13.30 H new ATOM 0 HG11 VAL A 616 -5.771 7.111 4.822 1.00 30.23 H new ATOM 0 HG12 VAL A 616 -6.685 8.559 4.335 1.00 30.23 H new ATOM 0 HG13 VAL A 616 -7.327 6.938 3.976 1.00 30.23 H new ATOM 0 HG21 VAL A 616 -4.570 5.776 3.161 1.00 74.32 H new ATOM 0 HG22 VAL A 616 -6.034 5.498 2.189 1.00 74.32 H new ATOM 0 HG23 VAL A 616 -4.595 6.228 1.440 1.00 74.32 H new ATOM 557 N GLU A 617 -7.770 10.144 2.182 1.00 33.20 N ATOM 558 CA GLU A 617 -7.876 11.567 2.320 1.00 63.11 C ATOM 559 C GLU A 617 -8.423 11.978 3.654 1.00 70.24 C ATOM 560 O GLU A 617 -9.322 11.345 4.198 1.00 51.23 O ATOM 561 CB GLU A 617 -8.697 12.178 1.185 1.00 14.54 C ATOM 562 CG GLU A 617 -10.142 11.726 1.123 1.00 65.24 C ATOM 563 CD GLU A 617 -10.849 12.318 -0.051 1.00 63.32 C ATOM 564 OE1 GLU A 617 -11.374 13.440 0.053 1.00 61.52 O ATOM 565 OE2 GLU A 617 -10.857 11.679 -1.114 1.00 62.44 O ATOM 0 H GLU A 617 -8.620 9.619 2.387 1.00 33.20 H new ATOM 0 HA GLU A 617 -6.860 11.958 2.258 1.00 63.11 H new ATOM 0 HB2 GLU A 617 -8.676 13.263 1.285 1.00 14.54 H new ATOM 0 HB3 GLU A 617 -8.216 11.936 0.238 1.00 14.54 H new ATOM 0 HG2 GLU A 617 -10.182 10.638 1.063 1.00 65.24 H new ATOM 0 HG3 GLU A 617 -10.654 12.014 2.041 1.00 65.24 H new ATOM 572 N THR A 618 -7.859 13.016 4.175 1.00 74.54 N ATOM 573 CA THR A 618 -8.298 13.615 5.390 1.00 13.22 C ATOM 574 C THR A 618 -8.374 15.105 5.147 1.00 51.33 C ATOM 575 O THR A 618 -8.049 15.563 4.043 1.00 12.03 O ATOM 576 CB THR A 618 -7.303 13.332 6.557 1.00 10.55 C ATOM 577 OG1 THR A 618 -5.985 13.800 6.203 1.00 52.53 O ATOM 578 CG2 THR A 618 -7.234 11.848 6.880 1.00 34.31 C ATOM 0 H THR A 618 -7.056 13.484 3.754 1.00 74.54 H new ATOM 0 HA THR A 618 -9.265 13.201 5.677 1.00 13.22 H new ATOM 0 HB THR A 618 -7.665 13.862 7.438 1.00 10.55 H new ATOM 0 HG1 THR A 618 -5.726 13.424 5.336 1.00 52.53 H new ATOM 0 HG21 THR A 618 -6.532 11.686 7.698 1.00 34.31 H new ATOM 0 HG22 THR A 618 -8.222 11.493 7.175 1.00 34.31 H new ATOM 0 HG23 THR A 618 -6.899 11.299 6.000 1.00 34.31 H new ATOM 584 N ASP A 619 -8.770 15.860 6.141 1.00 13.33 N ATOM 585 CA ASP A 619 -8.798 17.324 6.026 1.00 13.22 C ATOM 586 C ASP A 619 -7.386 17.842 6.030 1.00 15.24 C ATOM 587 O ASP A 619 -7.100 18.950 5.573 1.00 20.41 O ATOM 588 CB ASP A 619 -9.555 17.967 7.193 1.00 62.32 C ATOM 589 CG ASP A 619 -10.985 17.537 7.283 1.00 10.34 C ATOM 590 OD1 ASP A 619 -11.841 18.147 6.616 1.00 71.24 O ATOM 591 OD2 ASP A 619 -11.280 16.580 8.027 1.00 42.32 O ATOM 0 H ASP A 619 -9.080 15.500 7.044 1.00 13.33 H new ATOM 0 HA ASP A 619 -9.309 17.580 5.098 1.00 13.22 H new ATOM 0 HB2 ASP A 619 -9.049 17.718 8.126 1.00 62.32 H new ATOM 0 HB3 ASP A 619 -9.515 19.051 7.089 1.00 62.32 H new ATOM 596 N LYS A 620 -6.508 17.017 6.535 1.00 14.14 N ATOM 597 CA LYS A 620 -5.137 17.353 6.712 1.00 71.15 C ATOM 598 C LYS A 620 -4.384 17.133 5.406 1.00 32.13 C ATOM 599 O LYS A 620 -3.887 18.090 4.777 1.00 11.43 O ATOM 600 CB LYS A 620 -4.548 16.450 7.804 1.00 30.10 C ATOM 601 CG LYS A 620 -5.405 16.373 9.065 1.00 35.11 C ATOM 602 CD LYS A 620 -4.798 15.463 10.126 1.00 52.42 C ATOM 603 CE LYS A 620 -3.522 16.045 10.710 1.00 33.11 C ATOM 604 NZ LYS A 620 -3.770 17.356 11.344 1.00 4.35 N ATOM 0 H LYS A 620 -6.741 16.072 6.839 1.00 14.14 H new ATOM 0 HA LYS A 620 -5.045 18.399 7.004 1.00 71.15 H new ATOM 0 HB2 LYS A 620 -4.418 15.445 7.402 1.00 30.10 H new ATOM 0 HB3 LYS A 620 -3.557 16.817 8.071 1.00 30.10 H new ATOM 0 HG2 LYS A 620 -5.530 17.374 9.477 1.00 35.11 H new ATOM 0 HG3 LYS A 620 -6.399 16.009 8.804 1.00 35.11 H new ATOM 0 HD2 LYS A 620 -5.523 15.303 10.924 1.00 52.42 H new ATOM 0 HD3 LYS A 620 -4.585 14.488 9.689 1.00 52.42 H new ATOM 0 HE2 LYS A 620 -3.109 15.355 11.446 1.00 33.11 H new ATOM 0 HE3 LYS A 620 -2.776 16.155 9.923 1.00 33.11 H new ATOM 0 HZ1 LYS A 620 -2.992 17.578 11.998 1.00 4.35 H new ATOM 0 HZ2 LYS A 620 -3.827 18.091 10.611 1.00 4.35 H new ATOM 0 HZ3 LYS A 620 -4.666 17.323 11.871 1.00 4.35 H new ATOM 618 N TYR A 621 -4.322 15.883 4.976 1.00 23.11 N ATOM 619 CA TYR A 621 -3.579 15.514 3.782 1.00 75.53 C ATOM 620 C TYR A 621 -4.300 14.388 3.070 1.00 64.04 C ATOM 621 O TYR A 621 -5.103 13.673 3.683 1.00 33.02 O ATOM 622 CB TYR A 621 -2.189 14.954 4.167 1.00 0.44 C ATOM 623 CG TYR A 621 -1.391 15.785 5.135 1.00 22.02 C ATOM 624 CD1 TYR A 621 -0.680 16.883 4.715 1.00 50.21 C ATOM 625 CD2 TYR A 621 -1.361 15.462 6.486 1.00 71.04 C ATOM 626 CE1 TYR A 621 0.041 17.644 5.602 1.00 23.21 C ATOM 627 CE2 TYR A 621 -0.644 16.220 7.381 1.00 34.25 C ATOM 628 CZ TYR A 621 0.056 17.310 6.928 1.00 10.44 C ATOM 629 OH TYR A 621 0.769 18.082 7.807 1.00 14.22 O ATOM 0 H TYR A 621 -4.782 15.100 5.441 1.00 23.11 H new ATOM 0 HA TYR A 621 -3.487 16.402 3.156 1.00 75.53 H new ATOM 0 HB2 TYR A 621 -2.325 13.961 4.596 1.00 0.44 H new ATOM 0 HB3 TYR A 621 -1.604 14.830 3.256 1.00 0.44 H new ATOM 0 HD1 TYR A 621 -0.688 17.152 3.669 1.00 50.21 H new ATOM 0 HD2 TYR A 621 -1.910 14.601 6.839 1.00 71.04 H new ATOM 0 HE1 TYR A 621 0.594 18.503 5.254 1.00 23.21 H new ATOM 0 HE2 TYR A 621 -0.632 15.961 8.429 1.00 34.25 H new ATOM 0 HH TYR A 621 0.680 17.715 8.711 1.00 14.22 H new ATOM 639 N GLU A 622 -4.046 14.239 1.805 1.00 34.23 N ATOM 640 CA GLU A 622 -4.472 13.066 1.112 1.00 73.33 C ATOM 641 C GLU A 622 -3.267 12.319 0.615 1.00 53.44 C ATOM 642 O GLU A 622 -2.383 12.887 -0.017 1.00 21.21 O ATOM 643 CB GLU A 622 -5.502 13.292 0.002 1.00 50.30 C ATOM 644 CG GLU A 622 -5.124 14.254 -1.090 1.00 25.24 C ATOM 645 CD GLU A 622 -6.086 14.147 -2.245 1.00 30.01 C ATOM 646 OE1 GLU A 622 -7.315 14.287 -2.038 1.00 63.20 O ATOM 647 OE2 GLU A 622 -5.632 13.836 -3.368 1.00 54.11 O ATOM 0 H GLU A 622 -3.544 14.918 1.233 1.00 34.23 H new ATOM 0 HA GLU A 622 -5.017 12.464 1.839 1.00 73.33 H new ATOM 0 HB2 GLU A 622 -5.724 12.328 -0.456 1.00 50.30 H new ATOM 0 HB3 GLU A 622 -6.425 13.646 0.462 1.00 50.30 H new ATOM 0 HG2 GLU A 622 -5.125 15.272 -0.702 1.00 25.24 H new ATOM 0 HG3 GLU A 622 -4.111 14.044 -1.433 1.00 25.24 H new ATOM 654 N PHE A 623 -3.246 11.066 0.882 1.00 14.43 N ATOM 655 CA PHE A 623 -2.107 10.244 0.615 1.00 72.51 C ATOM 656 C PHE A 623 -2.407 9.331 -0.524 1.00 11.24 C ATOM 657 O PHE A 623 -3.441 8.685 -0.539 1.00 31.33 O ATOM 658 CB PHE A 623 -1.791 9.399 1.850 1.00 25.31 C ATOM 659 CG PHE A 623 -1.511 10.195 3.094 1.00 43.05 C ATOM 660 CD1 PHE A 623 -2.551 10.657 3.897 1.00 64.54 C ATOM 661 CD2 PHE A 623 -0.213 10.476 3.462 1.00 1.43 C ATOM 662 CE1 PHE A 623 -2.286 11.380 5.030 1.00 53.34 C ATOM 663 CE2 PHE A 623 0.050 11.199 4.599 1.00 45.13 C ATOM 664 CZ PHE A 623 -0.984 11.655 5.384 1.00 34.12 C ATOM 0 H PHE A 623 -4.030 10.566 1.300 1.00 14.43 H new ATOM 0 HA PHE A 623 -1.256 10.879 0.368 1.00 72.51 H new ATOM 0 HB2 PHE A 623 -2.631 8.731 2.042 1.00 25.31 H new ATOM 0 HB3 PHE A 623 -0.927 8.771 1.634 1.00 25.31 H new ATOM 0 HD1 PHE A 623 -3.574 10.444 3.624 1.00 64.54 H new ATOM 0 HD2 PHE A 623 0.605 10.124 2.850 1.00 1.43 H new ATOM 0 HE1 PHE A 623 -3.099 11.735 5.646 1.00 53.34 H new ATOM 0 HE2 PHE A 623 1.072 11.411 4.878 1.00 45.13 H new ATOM 0 HZ PHE A 623 -0.775 12.227 6.276 1.00 34.12 H new ATOM 674 N HIS A 624 -1.538 9.297 -1.484 1.00 10.53 N ATOM 675 CA HIS A 624 -1.694 8.397 -2.587 1.00 53.13 C ATOM 676 C HIS A 624 -0.652 7.320 -2.432 1.00 53.42 C ATOM 677 O HIS A 624 0.550 7.613 -2.415 1.00 24.32 O ATOM 678 CB HIS A 624 -1.556 9.136 -3.927 1.00 55.34 C ATOM 679 CG HIS A 624 -2.614 10.204 -4.173 1.00 53.32 C ATOM 680 ND1 HIS A 624 -3.661 10.039 -5.051 1.00 54.34 N ATOM 681 CD2 HIS A 624 -2.757 11.462 -3.669 1.00 41.24 C ATOM 682 CE1 HIS A 624 -4.396 11.130 -5.084 1.00 55.04 C ATOM 683 NE2 HIS A 624 -3.875 12.010 -4.257 1.00 25.33 N ATOM 0 H HIS A 624 -0.706 9.886 -1.528 1.00 10.53 H new ATOM 0 HA HIS A 624 -2.691 7.955 -2.588 1.00 53.13 H new ATOM 0 HB2 HIS A 624 -0.571 9.602 -3.971 1.00 55.34 H new ATOM 0 HB3 HIS A 624 -1.600 8.406 -4.736 1.00 55.34 H new ATOM 0 HD2 HIS A 624 -2.114 11.940 -2.944 1.00 41.24 H new ATOM 0 HE1 HIS A 624 -5.279 11.278 -5.689 1.00 55.04 H new ATOM 0 HE2 HIS A 624 -4.240 12.946 -4.080 1.00 25.33 H new ATOM 692 N ILE A 625 -1.110 6.100 -2.297 1.00 24.31 N ATOM 693 CA ILE A 625 -0.267 4.962 -1.986 1.00 50.12 C ATOM 694 C ILE A 625 -0.585 3.842 -2.966 1.00 35.41 C ATOM 695 O ILE A 625 -1.654 3.825 -3.572 1.00 54.04 O ATOM 696 CB ILE A 625 -0.601 4.432 -0.554 1.00 12.51 C ATOM 697 CG1 ILE A 625 -0.669 5.581 0.445 1.00 4.32 C ATOM 698 CG2 ILE A 625 0.443 3.411 -0.090 1.00 1.44 C ATOM 699 CD1 ILE A 625 -1.073 5.150 1.825 1.00 44.31 C ATOM 0 H ILE A 625 -2.096 5.861 -2.401 1.00 24.31 H new ATOM 0 HA ILE A 625 0.779 5.264 -2.046 1.00 50.12 H new ATOM 0 HB ILE A 625 -1.574 3.944 -0.602 1.00 12.51 H new ATOM 0 HG12 ILE A 625 0.305 6.067 0.495 1.00 4.32 H new ATOM 0 HG13 ILE A 625 -1.378 6.326 0.083 1.00 4.32 H new ATOM 0 HG21 ILE A 625 0.188 3.058 0.909 1.00 1.44 H new ATOM 0 HG22 ILE A 625 0.459 2.567 -0.780 1.00 1.44 H new ATOM 0 HG23 ILE A 625 1.426 3.880 -0.068 1.00 1.44 H new ATOM 0 HD11 ILE A 625 -1.101 6.018 2.484 1.00 44.31 H new ATOM 0 HD12 ILE A 625 -2.061 4.691 1.788 1.00 44.31 H new ATOM 0 HD13 ILE A 625 -0.351 4.428 2.207 1.00 44.31 H new ATOM 706 N ASN A 626 0.318 2.940 -3.125 1.00 43.32 N ATOM 707 CA ASN A 626 0.129 1.799 -3.961 1.00 45.23 C ATOM 708 C ASN A 626 0.840 0.684 -3.266 1.00 22.21 C ATOM 709 O ASN A 626 1.651 0.950 -2.420 1.00 63.34 O ATOM 710 CB ASN A 626 0.664 2.055 -5.374 1.00 15.23 C ATOM 711 CG ASN A 626 0.085 1.118 -6.410 1.00 20.35 C ATOM 712 OD1 ASN A 626 -0.989 0.522 -6.216 1.00 61.32 O ATOM 713 ND2 ASN A 626 0.715 1.055 -7.540 1.00 50.13 N ATOM 0 H ASN A 626 1.230 2.972 -2.669 1.00 43.32 H new ATOM 0 HA ASN A 626 -0.924 1.557 -4.103 1.00 45.23 H new ATOM 0 HB2 ASN A 626 0.441 3.083 -5.659 1.00 15.23 H new ATOM 0 HB3 ASN A 626 1.749 1.954 -5.368 1.00 15.23 H new ATOM 0 HD21 ASN A 626 0.332 0.503 -8.307 1.00 50.13 H new ATOM 0 HD22 ASN A 626 1.594 1.558 -7.663 1.00 50.13 H new ATOM 719 N VAL A 627 0.455 -0.528 -3.496 1.00 50.20 N ATOM 720 CA VAL A 627 1.110 -1.650 -2.815 1.00 13.01 C ATOM 721 C VAL A 627 2.433 -2.052 -3.510 1.00 63.13 C ATOM 722 O VAL A 627 3.338 -2.616 -2.899 1.00 40.40 O ATOM 723 CB VAL A 627 0.145 -2.856 -2.677 1.00 71.24 C ATOM 724 CG1 VAL A 627 -0.392 -3.204 -4.004 1.00 61.42 C ATOM 725 CG2 VAL A 627 0.817 -4.063 -2.032 1.00 24.25 C ATOM 0 H VAL A 627 -0.296 -0.788 -4.136 1.00 50.20 H new ATOM 0 HA VAL A 627 1.371 -1.318 -1.810 1.00 13.01 H new ATOM 0 HB VAL A 627 -0.671 -2.564 -2.015 1.00 71.24 H new ATOM 0 HG11 VAL A 627 -1.071 -4.052 -3.911 1.00 61.42 H new ATOM 0 HG12 VAL A 627 -0.932 -2.350 -4.413 1.00 61.42 H new ATOM 0 HG13 VAL A 627 0.429 -3.468 -4.671 1.00 61.42 H new ATOM 0 HG21 VAL A 627 0.101 -4.881 -1.957 1.00 24.25 H new ATOM 0 HG22 VAL A 627 1.664 -4.377 -2.642 1.00 24.25 H new ATOM 0 HG23 VAL A 627 1.167 -3.795 -1.035 1.00 24.25 H new ATOM 731 N CYS A 628 2.545 -1.727 -4.745 1.00 72.21 N ATOM 732 CA CYS A 628 3.696 -2.094 -5.515 1.00 25.35 C ATOM 733 C CYS A 628 4.026 -1.016 -6.499 1.00 43.22 C ATOM 734 O CYS A 628 3.131 -0.386 -7.058 1.00 34.43 O ATOM 735 CB CYS A 628 3.438 -3.386 -6.283 1.00 45.33 C ATOM 736 SG CYS A 628 3.117 -4.857 -5.268 1.00 5.41 S ATOM 0 H CYS A 628 1.843 -1.197 -5.261 1.00 72.21 H new ATOM 0 HA CYS A 628 4.528 -2.237 -4.825 1.00 25.35 H new ATOM 0 HB2 CYS A 628 2.585 -3.230 -6.943 1.00 45.33 H new ATOM 0 HB3 CYS A 628 4.300 -3.587 -6.919 1.00 45.33 H new ATOM 741 N GLY A 629 5.303 -0.815 -6.713 1.00 41.25 N ATOM 742 CA GLY A 629 5.758 0.131 -7.685 1.00 13.15 C ATOM 743 C GLY A 629 5.415 1.550 -7.306 1.00 62.33 C ATOM 744 O GLY A 629 5.440 1.901 -6.124 1.00 22.50 O ATOM 0 H GLY A 629 6.049 -1.304 -6.217 1.00 41.25 H new ATOM 0 HA2 GLY A 629 6.838 0.039 -7.801 1.00 13.15 H new ATOM 0 HA3 GLY A 629 5.313 -0.102 -8.652 1.00 13.15 H new ATOM 748 N PRO A 630 5.142 2.401 -8.284 1.00 10.33 N ATOM 749 CA PRO A 630 4.769 3.761 -8.046 1.00 23.34 C ATOM 750 C PRO A 630 3.255 3.983 -8.054 1.00 62.12 C ATOM 751 O PRO A 630 2.466 3.074 -8.361 1.00 52.05 O ATOM 752 CB PRO A 630 5.411 4.489 -9.222 1.00 11.01 C ATOM 753 CG PRO A 630 5.514 3.468 -10.324 1.00 30.41 C ATOM 754 CD PRO A 630 5.218 2.113 -9.715 1.00 73.01 C ATOM 0 HA PRO A 630 5.090 4.104 -7.062 1.00 23.34 H new ATOM 0 HB2 PRO A 630 4.806 5.341 -9.533 1.00 11.01 H new ATOM 0 HB3 PRO A 630 6.394 4.876 -8.954 1.00 11.01 H new ATOM 0 HG2 PRO A 630 4.807 3.693 -11.123 1.00 30.41 H new ATOM 0 HG3 PRO A 630 6.510 3.480 -10.767 1.00 30.41 H new ATOM 0 HD2 PRO A 630 4.284 1.697 -10.092 1.00 73.01 H new ATOM 0 HD3 PRO A 630 6.002 1.390 -9.939 1.00 73.01 H new ATOM 762 N VAL A 631 2.875 5.193 -7.752 1.00 63.53 N ATOM 763 CA VAL A 631 1.491 5.617 -7.746 1.00 21.24 C ATOM 764 C VAL A 631 1.230 6.535 -8.910 1.00 72.15 C ATOM 765 O VAL A 631 2.166 7.118 -9.484 1.00 14.22 O ATOM 766 CB VAL A 631 1.148 6.435 -6.457 1.00 63.31 C ATOM 767 CG1 VAL A 631 1.231 5.586 -5.242 1.00 63.25 C ATOM 768 CG2 VAL A 631 2.068 7.644 -6.299 1.00 72.22 C ATOM 0 H VAL A 631 3.529 5.933 -7.497 1.00 63.53 H new ATOM 0 HA VAL A 631 0.884 4.713 -7.796 1.00 21.24 H new ATOM 0 HB VAL A 631 0.123 6.789 -6.572 1.00 63.31 H new ATOM 0 HG11 VAL A 631 0.987 6.183 -4.363 1.00 63.25 H new ATOM 0 HG12 VAL A 631 0.525 4.760 -5.326 1.00 63.25 H new ATOM 0 HG13 VAL A 631 2.242 5.191 -5.143 1.00 63.25 H new ATOM 0 HG21 VAL A 631 1.801 8.189 -5.393 1.00 72.22 H new ATOM 0 HG22 VAL A 631 3.102 7.307 -6.228 1.00 72.22 H new ATOM 0 HG23 VAL A 631 1.958 8.300 -7.163 1.00 72.22 H new ATOM 774 N SER A 632 -0.009 6.643 -9.292 1.00 51.51 N ATOM 775 CA SER A 632 -0.366 7.631 -10.277 1.00 14.01 C ATOM 776 C SER A 632 -0.997 8.810 -9.548 1.00 44.32 C ATOM 777 O SER A 632 -1.959 8.635 -8.788 1.00 33.42 O ATOM 778 CB SER A 632 -1.349 7.043 -11.296 1.00 0.23 C ATOM 779 OG SER A 632 -1.686 7.977 -12.310 1.00 11.33 O ATOM 0 H SER A 632 -0.780 6.072 -8.946 1.00 51.51 H new ATOM 0 HA SER A 632 0.520 7.955 -10.823 1.00 14.01 H new ATOM 0 HB2 SER A 632 -0.911 6.155 -11.752 1.00 0.23 H new ATOM 0 HB3 SER A 632 -2.255 6.723 -10.782 1.00 0.23 H new ATOM 0 HG SER A 632 -2.313 7.564 -12.940 1.00 11.33 H new ATOM 785 N VAL A 633 -0.466 10.002 -9.777 1.00 72.13 N ATOM 786 CA VAL A 633 -0.933 11.239 -9.140 1.00 60.23 C ATOM 787 C VAL A 633 -0.589 12.380 -10.085 1.00 2.33 C ATOM 788 O VAL A 633 0.389 12.278 -10.818 1.00 73.50 O ATOM 789 CB VAL A 633 -0.187 11.528 -7.784 1.00 31.45 C ATOM 790 CG1 VAL A 633 -0.770 12.729 -7.058 1.00 0.11 C ATOM 791 CG2 VAL A 633 -0.149 10.336 -6.861 1.00 43.12 C ATOM 0 H VAL A 633 0.313 10.146 -10.419 1.00 72.13 H new ATOM 0 HA VAL A 633 -2.000 11.144 -8.937 1.00 60.23 H new ATOM 0 HB VAL A 633 0.841 11.755 -8.066 1.00 31.45 H new ATOM 0 HG11 VAL A 633 -0.225 12.892 -6.128 1.00 0.11 H new ATOM 0 HG12 VAL A 633 -0.683 13.613 -7.689 1.00 0.11 H new ATOM 0 HG13 VAL A 633 -1.821 12.545 -6.835 1.00 0.11 H new ATOM 0 HG21 VAL A 633 0.379 10.602 -5.945 1.00 43.12 H new ATOM 0 HG22 VAL A 633 -1.167 10.031 -6.618 1.00 43.12 H new ATOM 0 HG23 VAL A 633 0.369 9.512 -7.352 1.00 43.12 H new ATOM 797 N GLY A 634 -1.364 13.439 -10.073 1.00 71.23 N ATOM 798 CA GLY A 634 -1.063 14.574 -10.910 1.00 1.40 C ATOM 799 C GLY A 634 -0.022 15.473 -10.285 1.00 70.32 C ATOM 800 O GLY A 634 0.917 15.911 -10.951 1.00 12.05 O ATOM 0 H GLY A 634 -2.201 13.538 -9.498 1.00 71.23 H new ATOM 0 HA2 GLY A 634 -0.707 14.226 -11.880 1.00 1.40 H new ATOM 0 HA3 GLY A 634 -1.974 15.144 -11.090 1.00 1.40 H new ATOM 804 N ALA A 635 -0.168 15.715 -8.998 1.00 34.24 N ATOM 805 CA ALA A 635 0.722 16.606 -8.258 1.00 42.14 C ATOM 806 C ALA A 635 1.973 15.893 -7.734 1.00 62.41 C ATOM 807 O ALA A 635 2.749 16.471 -6.969 1.00 21.51 O ATOM 808 CB ALA A 635 -0.032 17.255 -7.108 1.00 4.51 C ATOM 0 H ALA A 635 -0.907 15.302 -8.429 1.00 34.24 H new ATOM 0 HA ALA A 635 1.063 17.371 -8.956 1.00 42.14 H new ATOM 0 HB1 ALA A 635 0.639 17.918 -6.561 1.00 4.51 H new ATOM 0 HB2 ALA A 635 -0.870 17.831 -7.501 1.00 4.51 H new ATOM 0 HB3 ALA A 635 -0.406 16.482 -6.436 1.00 4.51 H new ATOM 814 N CYS A 636 2.186 14.668 -8.146 1.00 61.53 N ATOM 815 CA CYS A 636 3.342 13.907 -7.700 1.00 22.31 C ATOM 816 C CYS A 636 3.936 13.156 -8.875 1.00 12.33 C ATOM 817 O CYS A 636 3.220 12.851 -9.833 1.00 23.41 O ATOM 818 CB CYS A 636 2.952 12.919 -6.584 1.00 21.30 C ATOM 819 SG CYS A 636 2.203 13.688 -5.110 1.00 71.24 S ATOM 0 H CYS A 636 1.575 14.169 -8.792 1.00 61.53 H new ATOM 0 HA CYS A 636 4.082 14.599 -7.297 1.00 22.31 H new ATOM 0 HB2 CYS A 636 2.252 12.190 -6.992 1.00 21.30 H new ATOM 0 HB3 CYS A 636 3.842 12.369 -6.277 1.00 21.30 H new ATOM 824 N PRO A 637 5.249 12.862 -8.840 1.00 21.32 N ATOM 825 CA PRO A 637 5.908 12.130 -9.915 1.00 30.50 C ATOM 826 C PRO A 637 5.479 10.651 -9.948 1.00 50.44 C ATOM 827 O PRO A 637 5.251 10.032 -8.898 1.00 15.22 O ATOM 828 CB PRO A 637 7.401 12.244 -9.570 1.00 43.32 C ATOM 829 CG PRO A 637 7.441 12.457 -8.098 1.00 43.14 C ATOM 830 CD PRO A 637 6.196 13.217 -7.750 1.00 11.12 C ATOM 0 HA PRO A 637 5.656 12.531 -10.897 1.00 30.50 H new ATOM 0 HB2 PRO A 637 7.942 11.341 -9.853 1.00 43.32 H new ATOM 0 HB3 PRO A 637 7.867 13.074 -10.102 1.00 43.32 H new ATOM 0 HG2 PRO A 637 7.477 11.505 -7.568 1.00 43.14 H new ATOM 0 HG3 PRO A 637 8.331 13.016 -7.810 1.00 43.14 H new ATOM 0 HD2 PRO A 637 5.809 12.926 -6.773 1.00 11.12 H new ATOM 0 HD3 PRO A 637 6.380 14.291 -7.713 1.00 11.12 H new ATOM 838 N PRO A 638 5.391 10.059 -11.149 1.00 41.00 N ATOM 839 CA PRO A 638 4.982 8.650 -11.331 1.00 30.04 C ATOM 840 C PRO A 638 6.108 7.656 -10.984 1.00 44.20 C ATOM 841 O PRO A 638 6.106 6.517 -11.437 1.00 3.42 O ATOM 842 CB PRO A 638 4.662 8.585 -12.826 1.00 2.43 C ATOM 843 CG PRO A 638 5.558 9.600 -13.441 1.00 20.00 C ATOM 844 CD PRO A 638 5.671 10.714 -12.444 1.00 11.43 C ATOM 0 HA PRO A 638 4.154 8.374 -10.678 1.00 30.04 H new ATOM 0 HB2 PRO A 638 4.852 7.591 -13.230 1.00 2.43 H new ATOM 0 HB3 PRO A 638 3.613 8.812 -13.018 1.00 2.43 H new ATOM 0 HG2 PRO A 638 6.537 9.173 -13.661 1.00 20.00 H new ATOM 0 HG3 PRO A 638 5.148 9.961 -14.384 1.00 20.00 H new ATOM 0 HD2 PRO A 638 6.664 11.164 -12.458 1.00 11.43 H new ATOM 0 HD3 PRO A 638 4.957 11.511 -12.652 1.00 11.43 H new ATOM 852 N ASP A 639 7.042 8.098 -10.169 1.00 11.23 N ATOM 853 CA ASP A 639 8.164 7.275 -9.727 1.00 45.22 C ATOM 854 C ASP A 639 8.141 7.094 -8.230 1.00 74.22 C ATOM 855 O ASP A 639 8.983 6.400 -7.660 1.00 35.51 O ATOM 856 CB ASP A 639 9.516 7.864 -10.166 1.00 44.14 C ATOM 857 CG ASP A 639 9.779 7.727 -11.647 1.00 11.10 C ATOM 858 OD1 ASP A 639 9.219 8.518 -12.446 1.00 31.23 O ATOM 859 OD2 ASP A 639 10.569 6.831 -12.035 1.00 51.25 O ATOM 0 H ASP A 639 7.050 9.044 -9.788 1.00 11.23 H new ATOM 0 HA ASP A 639 8.052 6.301 -10.204 1.00 45.22 H new ATOM 0 HB2 ASP A 639 9.549 8.919 -9.895 1.00 44.14 H new ATOM 0 HB3 ASP A 639 10.316 7.368 -9.615 1.00 44.14 H new ATOM 864 N SER A 640 7.181 7.701 -7.594 1.00 50.42 N ATOM 865 CA SER A 640 7.043 7.607 -6.165 1.00 42.03 C ATOM 866 C SER A 640 5.953 6.588 -5.847 1.00 71.01 C ATOM 867 O SER A 640 4.990 6.483 -6.595 1.00 32.31 O ATOM 868 CB SER A 640 6.635 8.966 -5.634 1.00 53.30 C ATOM 869 OG SER A 640 7.519 9.954 -6.112 1.00 63.41 O ATOM 0 H SER A 640 6.471 8.275 -8.049 1.00 50.42 H new ATOM 0 HA SER A 640 7.981 7.296 -5.706 1.00 42.03 H new ATOM 0 HB2 SER A 640 5.616 9.196 -5.945 1.00 53.30 H new ATOM 0 HB3 SER A 640 6.641 8.957 -4.544 1.00 53.30 H new ATOM 0 HG SER A 640 8.406 9.561 -6.249 1.00 63.41 H new ATOM 875 N GLY A 641 6.110 5.840 -4.777 1.00 23.41 N ATOM 876 CA GLY A 641 5.095 4.865 -4.409 1.00 62.44 C ATOM 877 C GLY A 641 4.181 5.369 -3.304 1.00 54.42 C ATOM 878 O GLY A 641 3.169 4.751 -2.998 1.00 11.41 O ATOM 0 H GLY A 641 6.915 5.882 -4.152 1.00 23.41 H new ATOM 0 HA2 GLY A 641 4.498 4.618 -5.286 1.00 62.44 H new ATOM 0 HA3 GLY A 641 5.580 3.945 -4.084 1.00 62.44 H new ATOM 882 N ALA A 642 4.557 6.471 -2.691 1.00 63.44 N ATOM 883 CA ALA A 642 3.716 7.122 -1.694 1.00 73.44 C ATOM 884 C ALA A 642 3.927 8.635 -1.742 1.00 22.11 C ATOM 885 O ALA A 642 5.053 9.106 -1.641 1.00 63.44 O ATOM 886 CB ALA A 642 4.023 6.584 -0.304 1.00 32.44 C ATOM 0 H ALA A 642 5.445 6.942 -2.863 1.00 63.44 H new ATOM 0 HA ALA A 642 2.672 6.906 -1.920 1.00 73.44 H new ATOM 0 HB1 ALA A 642 3.386 7.081 0.427 1.00 32.44 H new ATOM 0 HB2 ALA A 642 3.834 5.511 -0.279 1.00 32.44 H new ATOM 0 HB3 ALA A 642 5.069 6.774 -0.063 1.00 32.44 H new ATOM 892 N CYS A 643 2.859 9.386 -1.928 1.00 42.50 N ATOM 893 CA CYS A 643 2.949 10.854 -1.989 1.00 61.30 C ATOM 894 C CYS A 643 1.697 11.499 -1.382 1.00 70.24 C ATOM 895 O CYS A 643 0.576 11.036 -1.631 1.00 4.24 O ATOM 896 CB CYS A 643 3.151 11.325 -3.430 1.00 42.31 C ATOM 897 SG CYS A 643 3.439 13.129 -3.611 1.00 60.34 S ATOM 0 H CYS A 643 1.915 9.016 -2.041 1.00 42.50 H new ATOM 0 HA CYS A 643 3.814 11.166 -1.403 1.00 61.30 H new ATOM 0 HB2 CYS A 643 3.999 10.790 -3.858 1.00 42.31 H new ATOM 0 HB3 CYS A 643 2.273 11.050 -4.015 1.00 42.31 H new ATOM 902 N GLN A 644 1.879 12.544 -0.581 1.00 31.30 N ATOM 903 CA GLN A 644 0.756 13.207 0.059 1.00 41.10 C ATOM 904 C GLN A 644 0.548 14.591 -0.503 1.00 75.14 C ATOM 905 O GLN A 644 1.512 15.323 -0.776 1.00 34.15 O ATOM 906 CB GLN A 644 0.916 13.293 1.600 1.00 52.14 C ATOM 907 CG GLN A 644 2.076 14.156 2.105 1.00 44.21 C ATOM 908 CD GLN A 644 2.168 14.180 3.633 1.00 44.23 C ATOM 909 OE1 GLN A 644 1.177 14.069 4.321 1.00 23.04 O ATOM 910 NE2 GLN A 644 3.358 14.331 4.160 1.00 24.41 N ATOM 0 H GLN A 644 2.791 12.946 -0.362 1.00 31.30 H new ATOM 0 HA GLN A 644 -0.120 12.594 -0.154 1.00 41.10 H new ATOM 0 HB2 GLN A 644 -0.011 13.682 2.021 1.00 52.14 H new ATOM 0 HB3 GLN A 644 1.044 12.283 1.990 1.00 52.14 H new ATOM 0 HG2 GLN A 644 3.012 13.777 1.694 1.00 44.21 H new ATOM 0 HG3 GLN A 644 1.954 15.174 1.736 1.00 44.21 H new ATOM 0 HE21 GLN A 644 4.175 14.422 3.556 1.00 24.41 H new ATOM 0 HE22 GLN A 644 3.467 14.357 5.174 1.00 24.41 H new ATOM 918 N VAL A 645 -0.689 14.934 -0.690 1.00 42.21 N ATOM 919 CA VAL A 645 -1.068 16.246 -1.105 1.00 60.21 C ATOM 920 C VAL A 645 -1.746 16.886 0.086 1.00 70.14 C ATOM 921 O VAL A 645 -2.760 16.372 0.583 1.00 55.34 O ATOM 922 CB VAL A 645 -2.047 16.217 -2.316 1.00 23.14 C ATOM 923 CG1 VAL A 645 -2.411 17.631 -2.760 1.00 33.44 C ATOM 924 CG2 VAL A 645 -1.448 15.430 -3.480 1.00 32.23 C ATOM 0 H VAL A 645 -1.475 14.298 -0.556 1.00 42.21 H new ATOM 0 HA VAL A 645 -0.190 16.803 -1.431 1.00 60.21 H new ATOM 0 HB VAL A 645 -2.960 15.715 -1.995 1.00 23.14 H new ATOM 0 HG11 VAL A 645 -3.095 17.582 -3.607 1.00 33.44 H new ATOM 0 HG12 VAL A 645 -2.891 18.159 -1.936 1.00 33.44 H new ATOM 0 HG13 VAL A 645 -1.507 18.164 -3.055 1.00 33.44 H new ATOM 0 HG21 VAL A 645 -2.150 15.423 -4.314 1.00 32.23 H new ATOM 0 HG22 VAL A 645 -0.515 15.898 -3.794 1.00 32.23 H new ATOM 0 HG23 VAL A 645 -1.251 14.406 -3.164 1.00 32.23 H new ATOM 930 N SER A 646 -1.191 17.955 0.567 1.00 11.10 N ATOM 931 CA SER A 646 -1.709 18.590 1.729 1.00 61.21 C ATOM 932 C SER A 646 -2.935 19.385 1.381 1.00 14.44 C ATOM 933 O SER A 646 -2.992 20.049 0.349 1.00 43.53 O ATOM 934 CB SER A 646 -0.648 19.487 2.375 1.00 32.35 C ATOM 935 OG SER A 646 -1.124 20.085 3.578 1.00 61.35 O ATOM 0 H SER A 646 -0.370 18.407 0.164 1.00 11.10 H new ATOM 0 HA SER A 646 -1.986 17.821 2.451 1.00 61.21 H new ATOM 0 HB2 SER A 646 0.244 18.899 2.589 1.00 32.35 H new ATOM 0 HB3 SER A 646 -0.354 20.267 1.672 1.00 32.35 H new ATOM 0 HG SER A 646 -0.902 19.510 4.340 1.00 61.35 H new ATOM 941 N ARG A 647 -3.896 19.323 2.241 1.00 42.12 N ATOM 942 CA ARG A 647 -5.120 20.024 2.056 1.00 42.13 C ATOM 943 C ARG A 647 -5.190 21.171 3.046 1.00 32.23 C ATOM 944 O ARG A 647 -5.846 22.177 2.799 1.00 34.35 O ATOM 945 CB ARG A 647 -6.294 19.040 2.172 1.00 13.44 C ATOM 946 CG ARG A 647 -6.221 17.955 1.092 1.00 42.51 C ATOM 947 CD ARG A 647 -7.260 16.859 1.244 1.00 32.04 C ATOM 948 NE ARG A 647 -8.649 17.331 1.161 1.00 32.30 N ATOM 949 CZ ARG A 647 -9.665 16.581 0.698 1.00 32.44 C ATOM 950 NH1 ARG A 647 -9.419 15.421 0.080 1.00 51.42 N ATOM 951 NH2 ARG A 647 -10.908 17.008 0.800 1.00 21.14 N ATOM 0 H ARG A 647 -3.852 18.777 3.102 1.00 42.12 H new ATOM 0 HA ARG A 647 -5.178 20.462 1.059 1.00 42.13 H new ATOM 0 HB2 ARG A 647 -6.286 18.576 3.158 1.00 13.44 H new ATOM 0 HB3 ARG A 647 -7.236 19.582 2.083 1.00 13.44 H new ATOM 0 HG2 ARG A 647 -6.341 18.422 0.114 1.00 42.51 H new ATOM 0 HG3 ARG A 647 -5.228 17.505 1.111 1.00 42.51 H new ATOM 0 HD2 ARG A 647 -7.096 16.109 0.471 1.00 32.04 H new ATOM 0 HD3 ARG A 647 -7.113 16.365 2.204 1.00 32.04 H new ATOM 0 HE ARG A 647 -8.854 18.281 1.472 1.00 32.30 H new ATOM 0 HH11 ARG A 647 -8.458 15.102 -0.042 1.00 51.42 H new ATOM 0 HH12 ARG A 647 -10.192 14.855 -0.270 1.00 51.42 H new ATOM 0 HH21 ARG A 647 -11.103 17.911 1.232 1.00 21.14 H new ATOM 0 HH22 ARG A 647 -11.675 16.435 0.447 1.00 21.14 H new ATOM 963 N SER A 648 -4.478 21.025 4.163 1.00 51.22 N ATOM 964 CA SER A 648 -4.406 22.087 5.146 1.00 72.32 C ATOM 965 C SER A 648 -3.331 23.128 4.751 1.00 55.11 C ATOM 966 O SER A 648 -3.560 24.334 4.836 1.00 1.12 O ATOM 967 CB SER A 648 -4.035 21.496 6.510 1.00 64.33 C ATOM 968 OG SER A 648 -4.916 20.448 6.886 1.00 41.43 O ATOM 0 H SER A 648 -3.949 20.186 4.402 1.00 51.22 H new ATOM 0 HA SER A 648 -5.379 22.576 5.194 1.00 72.32 H new ATOM 0 HB2 SER A 648 -3.013 21.118 6.477 1.00 64.33 H new ATOM 0 HB3 SER A 648 -4.060 22.281 7.266 1.00 64.33 H new ATOM 0 HG SER A 648 -5.601 20.332 6.195 1.00 41.43 H new ATOM 974 N ASP A 649 -2.174 22.641 4.276 1.00 12.13 N ATOM 975 CA ASP A 649 -1.030 23.524 3.976 1.00 40.11 C ATOM 976 C ASP A 649 -0.856 23.672 2.462 1.00 13.31 C ATOM 977 O ASP A 649 -0.106 24.517 1.977 1.00 21.22 O ATOM 978 CB ASP A 649 0.244 22.937 4.607 1.00 72.51 C ATOM 979 CG ASP A 649 1.420 23.892 4.616 1.00 34.13 C ATOM 980 OD1 ASP A 649 2.188 23.938 3.646 1.00 10.54 O ATOM 981 OD2 ASP A 649 1.601 24.589 5.632 1.00 61.40 O ATOM 0 H ASP A 649 -2.004 21.652 4.092 1.00 12.13 H new ATOM 0 HA ASP A 649 -1.217 24.512 4.396 1.00 40.11 H new ATOM 0 HB2 ASP A 649 0.025 22.636 5.631 1.00 72.51 H new ATOM 0 HB3 ASP A 649 0.525 22.035 4.063 1.00 72.51 H new ATOM 986 N ARG A 650 -1.601 22.853 1.740 1.00 15.11 N ATOM 987 CA ARG A 650 -1.644 22.798 0.297 1.00 74.34 C ATOM 988 C ARG A 650 -0.253 22.572 -0.400 1.00 74.25 C ATOM 989 O ARG A 650 -0.064 22.903 -1.581 1.00 44.12 O ATOM 990 CB ARG A 650 -2.346 24.036 -0.155 1.00 74.13 C ATOM 991 CG ARG A 650 -2.792 24.052 -1.572 1.00 25.14 C ATOM 992 CD ARG A 650 -3.642 25.241 -1.756 1.00 34.11 C ATOM 993 NE ARG A 650 -2.896 26.490 -1.559 1.00 73.21 N ATOM 994 CZ ARG A 650 -3.443 27.647 -1.173 1.00 72.11 C ATOM 995 NH1 ARG A 650 -4.744 27.722 -0.923 1.00 63.12 N ATOM 996 NH2 ARG A 650 -2.685 28.724 -1.034 1.00 73.23 N ATOM 0 H ARG A 650 -2.225 22.173 2.173 1.00 15.11 H new ATOM 0 HA ARG A 650 -2.191 21.908 -0.014 1.00 74.34 H new ATOM 0 HB2 ARG A 650 -3.218 24.188 0.481 1.00 74.13 H new ATOM 0 HB3 ARG A 650 -1.682 24.885 0.006 1.00 74.13 H new ATOM 0 HG2 ARG A 650 -1.934 24.087 -2.243 1.00 25.14 H new ATOM 0 HG3 ARG A 650 -3.346 23.144 -1.810 1.00 25.14 H new ATOM 0 HD2 ARG A 650 -4.069 25.229 -2.759 1.00 34.11 H new ATOM 0 HD3 ARG A 650 -4.475 25.202 -1.054 1.00 34.11 H new ATOM 0 HE ARG A 650 -1.890 26.474 -1.728 1.00 73.21 H new ATOM 0 HH11 ARG A 650 -5.331 26.894 -1.025 1.00 63.12 H new ATOM 0 HH12 ARG A 650 -5.157 28.607 -0.629 1.00 63.12 H new ATOM 0 HH21 ARG A 650 -1.684 28.671 -1.222 1.00 73.23 H new ATOM 0 HH22 ARG A 650 -3.102 29.607 -0.739 1.00 73.23 H new ATOM 1008 N LYS A 651 0.688 21.976 0.309 1.00 32.31 N ATOM 1009 CA LYS A 651 1.932 21.524 -0.323 1.00 5.15 C ATOM 1010 C LYS A 651 1.794 20.067 -0.709 1.00 41.12 C ATOM 1011 O LYS A 651 0.746 19.465 -0.511 1.00 12.14 O ATOM 1012 CB LYS A 651 3.147 21.659 0.591 1.00 25.14 C ATOM 1013 CG LYS A 651 3.623 23.059 0.868 1.00 4.41 C ATOM 1014 CD LYS A 651 4.846 23.003 1.765 1.00 4.12 C ATOM 1015 CE LYS A 651 5.426 24.365 2.046 1.00 60.33 C ATOM 1016 NZ LYS A 651 6.580 24.283 2.969 1.00 4.23 N ATOM 0 H LYS A 651 0.625 21.791 1.310 1.00 32.31 H new ATOM 0 HA LYS A 651 2.093 22.160 -1.193 1.00 5.15 H new ATOM 0 HB2 LYS A 651 2.913 21.183 1.543 1.00 25.14 H new ATOM 0 HB3 LYS A 651 3.971 21.099 0.149 1.00 25.14 H new ATOM 0 HG2 LYS A 651 3.866 23.565 -0.067 1.00 4.41 H new ATOM 0 HG3 LYS A 651 2.832 23.636 1.347 1.00 4.41 H new ATOM 0 HD2 LYS A 651 4.578 22.526 2.708 1.00 4.12 H new ATOM 0 HD3 LYS A 651 5.607 22.379 1.296 1.00 4.12 H new ATOM 0 HE2 LYS A 651 5.739 24.828 1.110 1.00 60.33 H new ATOM 0 HE3 LYS A 651 4.658 25.007 2.478 1.00 60.33 H new ATOM 0 HZ1 LYS A 651 6.955 25.238 3.141 1.00 4.23 H new ATOM 0 HZ2 LYS A 651 6.275 23.863 3.870 1.00 4.23 H new ATOM 0 HZ3 LYS A 651 7.322 23.691 2.545 1.00 4.23 H new ATOM 1030 N SER A 652 2.832 19.513 -1.239 1.00 74.51 N ATOM 1031 CA SER A 652 2.854 18.127 -1.587 1.00 41.13 C ATOM 1032 C SER A 652 4.237 17.569 -1.289 1.00 32.32 C ATOM 1033 O SER A 652 5.243 18.256 -1.495 1.00 20.04 O ATOM 1034 CB SER A 652 2.478 17.966 -3.063 1.00 74.53 C ATOM 1035 OG SER A 652 3.308 18.776 -3.890 1.00 23.33 O ATOM 0 H SER A 652 3.698 20.011 -1.446 1.00 74.51 H new ATOM 0 HA SER A 652 2.126 17.568 -0.999 1.00 41.13 H new ATOM 0 HB2 SER A 652 2.576 16.921 -3.355 1.00 74.53 H new ATOM 0 HB3 SER A 652 1.433 18.241 -3.208 1.00 74.53 H new ATOM 0 HG SER A 652 3.051 18.656 -4.828 1.00 23.33 H new ATOM 1041 N TRP A 653 4.298 16.356 -0.803 1.00 64.33 N ATOM 1042 CA TRP A 653 5.570 15.753 -0.431 1.00 21.44 C ATOM 1043 C TRP A 653 5.563 14.317 -0.769 1.00 61.33 C ATOM 1044 O TRP A 653 4.518 13.668 -0.790 1.00 42.42 O ATOM 1045 CB TRP A 653 5.847 15.876 1.067 1.00 22.43 C ATOM 1046 CG TRP A 653 5.825 17.259 1.638 1.00 3.20 C ATOM 1047 CD1 TRP A 653 6.812 18.194 1.595 1.00 21.11 C ATOM 1048 CD2 TRP A 653 4.756 17.837 2.376 1.00 43.52 C ATOM 1049 NE1 TRP A 653 6.415 19.323 2.270 1.00 2.44 N ATOM 1050 CE2 TRP A 653 5.150 19.123 2.757 1.00 71.45 C ATOM 1051 CE3 TRP A 653 3.503 17.380 2.747 1.00 23.22 C ATOM 1052 CZ2 TRP A 653 4.321 19.960 3.500 1.00 52.32 C ATOM 1053 CZ3 TRP A 653 2.685 18.196 3.473 1.00 44.52 C ATOM 1054 CH2 TRP A 653 3.092 19.479 3.847 1.00 14.31 C ATOM 0 H TRP A 653 3.485 15.759 -0.652 1.00 64.33 H new ATOM 0 HA TRP A 653 6.345 16.285 -0.982 1.00 21.44 H new ATOM 0 HB2 TRP A 653 5.111 15.275 1.601 1.00 22.43 H new ATOM 0 HB3 TRP A 653 6.824 15.438 1.270 1.00 22.43 H new ATOM 0 HD1 TRP A 653 7.765 18.068 1.104 1.00 21.11 H new ATOM 0 HE1 TRP A 653 6.970 20.170 2.389 1.00 2.44 H new ATOM 0 HE3 TRP A 653 3.177 16.390 2.465 1.00 23.22 H new ATOM 0 HZ2 TRP A 653 4.638 20.951 3.790 1.00 52.32 H new ATOM 0 HZ3 TRP A 653 1.706 17.844 3.763 1.00 44.52 H new ATOM 0 HH2 TRP A 653 2.422 20.102 4.421 1.00 14.31 H new ATOM 1065 N ASN A 654 6.718 13.826 -0.977 1.00 24.43 N ATOM 1066 CA ASN A 654 6.948 12.485 -1.351 1.00 14.35 C ATOM 1067 C ASN A 654 7.211 11.699 -0.084 1.00 11.10 C ATOM 1068 O ASN A 654 7.959 12.153 0.784 1.00 31.22 O ATOM 1069 CB ASN A 654 8.170 12.503 -2.235 1.00 33.35 C ATOM 1070 CG ASN A 654 8.470 11.236 -2.945 1.00 64.11 C ATOM 1071 OD1 ASN A 654 8.205 10.131 -2.472 1.00 11.11 O ATOM 1072 ND2 ASN A 654 9.003 11.405 -4.098 1.00 40.24 N ATOM 0 H ASN A 654 7.574 14.373 -0.888 1.00 24.43 H new ATOM 0 HA ASN A 654 6.109 12.032 -1.878 1.00 14.35 H new ATOM 0 HB2 ASN A 654 8.048 13.293 -2.976 1.00 33.35 H new ATOM 0 HB3 ASN A 654 9.033 12.769 -1.625 1.00 33.35 H new ATOM 0 HD21 ASN A 654 9.231 10.597 -4.678 1.00 40.24 H new ATOM 0 HD22 ASN A 654 9.199 12.347 -4.436 1.00 40.24 H new ATOM 1078 N LEU A 655 6.595 10.561 0.054 1.00 22.22 N ATOM 1079 CA LEU A 655 6.762 9.762 1.245 1.00 44.13 C ATOM 1080 C LEU A 655 7.482 8.487 0.943 1.00 22.01 C ATOM 1081 O LEU A 655 7.577 7.606 1.800 1.00 41.23 O ATOM 1082 CB LEU A 655 5.444 9.407 1.908 1.00 51.00 C ATOM 1083 CG LEU A 655 4.548 10.514 2.409 1.00 44.44 C ATOM 1084 CD1 LEU A 655 3.900 11.241 1.330 1.00 65.43 C ATOM 1085 CD2 LEU A 655 3.555 10.012 3.401 1.00 0.23 C ATOM 0 H LEU A 655 5.969 10.159 -0.644 1.00 22.22 H new ATOM 0 HA LEU A 655 7.344 10.380 1.928 1.00 44.13 H new ATOM 0 HB2 LEU A 655 4.868 8.816 1.196 1.00 51.00 H new ATOM 0 HB3 LEU A 655 5.667 8.758 2.755 1.00 51.00 H new ATOM 0 HG LEU A 655 5.196 11.226 2.920 1.00 44.44 H new ATOM 0 HD11 LEU A 655 3.268 12.025 1.748 1.00 65.43 H new ATOM 0 HD12 LEU A 655 4.657 11.689 0.687 1.00 65.43 H new ATOM 0 HD13 LEU A 655 3.288 10.555 0.745 1.00 65.43 H new ATOM 0 HD21 LEU A 655 2.928 10.838 3.738 1.00 0.23 H new ATOM 0 HD22 LEU A 655 2.931 9.249 2.936 1.00 0.23 H new ATOM 0 HD23 LEU A 655 4.079 9.582 4.255 1.00 0.23 H new ATOM 1093 N GLY A 656 7.966 8.367 -0.249 1.00 3.21 N ATOM 1094 CA GLY A 656 8.691 7.212 -0.578 1.00 31.15 C ATOM 1095 C GLY A 656 8.715 6.933 -2.040 1.00 52.10 C ATOM 1096 O GLY A 656 7.675 6.958 -2.726 1.00 30.23 O ATOM 0 H GLY A 656 7.868 9.054 -0.996 1.00 3.21 H new ATOM 0 HA2 GLY A 656 9.714 7.318 -0.218 1.00 31.15 H new ATOM 0 HA3 GLY A 656 8.257 6.358 -0.058 1.00 31.15 H new ATOM 1100 N ARG A 657 9.886 6.663 -2.512 1.00 64.14 N ATOM 1101 CA ARG A 657 10.140 6.332 -3.867 1.00 4.10 C ATOM 1102 C ARG A 657 9.606 4.925 -4.113 1.00 43.52 C ATOM 1103 O ARG A 657 9.580 4.118 -3.195 1.00 65.53 O ATOM 1104 CB ARG A 657 11.640 6.385 -4.115 1.00 60.31 C ATOM 1105 CG ARG A 657 12.027 6.142 -5.542 1.00 65.32 C ATOM 1106 CD ARG A 657 13.513 6.226 -5.744 1.00 55.24 C ATOM 1107 NE ARG A 657 14.074 7.501 -5.291 1.00 11.41 N ATOM 1108 CZ ARG A 657 14.757 8.359 -6.043 1.00 10.22 C ATOM 1109 NH1 ARG A 657 14.845 8.183 -7.368 1.00 44.12 N ATOM 1110 NH2 ARG A 657 15.324 9.408 -5.461 1.00 65.44 N ATOM 0 H ARG A 657 10.727 6.668 -1.935 1.00 64.14 H new ATOM 0 HA ARG A 657 9.651 7.033 -4.543 1.00 4.10 H new ATOM 0 HB2 ARG A 657 12.015 7.361 -3.808 1.00 60.31 H new ATOM 0 HB3 ARG A 657 12.129 5.643 -3.484 1.00 60.31 H new ATOM 0 HG2 ARG A 657 11.674 5.158 -5.851 1.00 65.32 H new ATOM 0 HG3 ARG A 657 11.532 6.873 -6.181 1.00 65.32 H new ATOM 0 HD2 ARG A 657 13.995 5.410 -5.206 1.00 55.24 H new ATOM 0 HD3 ARG A 657 13.740 6.089 -6.801 1.00 55.24 H new ATOM 0 HE ARG A 657 13.928 7.753 -4.313 1.00 11.41 H new ATOM 0 HH11 ARG A 657 14.386 7.386 -7.808 1.00 44.12 H new ATOM 0 HH12 ARG A 657 15.371 8.846 -7.937 1.00 44.12 H new ATOM 0 HH21 ARG A 657 15.232 9.545 -4.454 1.00 65.44 H new ATOM 0 HH22 ARG A 657 15.852 10.078 -6.020 1.00 65.44 H new ATOM 1122 N SER A 658 9.165 4.655 -5.318 1.00 42.22 N ATOM 1123 CA SER A 658 8.577 3.372 -5.670 1.00 32.13 C ATOM 1124 C SER A 658 9.475 2.172 -5.356 1.00 12.55 C ATOM 1125 O SER A 658 10.684 2.190 -5.619 1.00 10.21 O ATOM 1126 CB SER A 658 8.198 3.377 -7.122 1.00 72.42 C ATOM 1127 OG SER A 658 9.293 3.760 -7.941 1.00 53.50 O ATOM 0 H SER A 658 9.201 5.319 -6.091 1.00 42.22 H new ATOM 0 HA SER A 658 7.692 3.250 -5.046 1.00 32.13 H new ATOM 0 HB2 SER A 658 7.853 2.385 -7.413 1.00 72.42 H new ATOM 0 HB3 SER A 658 7.366 4.063 -7.280 1.00 72.42 H new ATOM 0 HG SER A 658 9.363 4.737 -7.958 1.00 53.50 H new ATOM 1133 N ASN A 659 8.859 1.147 -4.802 1.00 13.32 N ATOM 1134 CA ASN A 659 9.521 -0.101 -4.423 1.00 42.10 C ATOM 1135 C ASN A 659 8.450 -1.118 -4.005 1.00 50.55 C ATOM 1136 O ASN A 659 7.348 -0.733 -3.638 1.00 64.31 O ATOM 1137 CB ASN A 659 10.584 0.119 -3.289 1.00 33.04 C ATOM 1138 CG ASN A 659 10.024 0.584 -1.954 1.00 71.00 C ATOM 1139 OD1 ASN A 659 9.867 1.769 -1.709 1.00 74.30 O ATOM 1140 ND2 ASN A 659 9.799 -0.334 -1.063 1.00 22.04 N ATOM 0 H ASN A 659 7.860 1.151 -4.595 1.00 13.32 H new ATOM 0 HA ASN A 659 10.073 -0.487 -5.280 1.00 42.10 H new ATOM 0 HB2 ASN A 659 11.123 -0.816 -3.133 1.00 33.04 H new ATOM 0 HB3 ASN A 659 11.312 0.853 -3.634 1.00 33.04 H new ATOM 0 HD21 ASN A 659 9.482 -0.072 -0.130 1.00 22.04 H new ATOM 0 HD22 ASN A 659 9.939 -1.317 -1.297 1.00 22.04 H new ATOM 1146 N ALA A 660 8.754 -2.400 -4.088 1.00 23.50 N ATOM 1147 CA ALA A 660 7.762 -3.448 -3.765 1.00 21.45 C ATOM 1148 C ALA A 660 8.202 -4.272 -2.558 1.00 52.05 C ATOM 1149 O ALA A 660 7.934 -5.475 -2.474 1.00 53.45 O ATOM 1150 CB ALA A 660 7.545 -4.349 -4.978 1.00 14.54 C ATOM 0 H ALA A 660 9.667 -2.754 -4.372 1.00 23.50 H new ATOM 0 HA ALA A 660 6.820 -2.962 -3.509 1.00 21.45 H new ATOM 0 HB1 ALA A 660 6.813 -5.119 -4.733 1.00 14.54 H new ATOM 0 HB2 ALA A 660 7.179 -3.752 -5.813 1.00 14.54 H new ATOM 0 HB3 ALA A 660 8.488 -4.820 -5.255 1.00 14.54 H new ATOM 1156 N LYS A 661 8.827 -3.602 -1.613 1.00 51.23 N ATOM 1157 CA LYS A 661 9.321 -4.240 -0.394 1.00 75.05 C ATOM 1158 C LYS A 661 8.221 -4.558 0.593 1.00 2.40 C ATOM 1159 O LYS A 661 7.607 -3.651 1.181 1.00 13.21 O ATOM 1160 CB LYS A 661 10.390 -3.394 0.306 1.00 23.34 C ATOM 1161 CG LYS A 661 11.734 -3.342 -0.386 1.00 20.43 C ATOM 1162 CD LYS A 661 12.338 -4.732 -0.468 1.00 42.34 C ATOM 1163 CE LYS A 661 13.761 -4.699 -0.975 1.00 42.01 C ATOM 1164 NZ LYS A 661 13.870 -4.097 -2.313 1.00 45.14 N ATOM 0 H LYS A 661 9.011 -2.600 -1.661 1.00 51.23 H new ATOM 0 HA LYS A 661 9.765 -5.178 -0.727 1.00 75.05 H new ATOM 0 HB2 LYS A 661 10.014 -2.376 0.408 1.00 23.34 H new ATOM 0 HB3 LYS A 661 10.534 -3.783 1.314 1.00 23.34 H new ATOM 0 HG2 LYS A 661 11.619 -2.928 -1.388 1.00 20.43 H new ATOM 0 HG3 LYS A 661 12.405 -2.678 0.158 1.00 20.43 H new ATOM 0 HD2 LYS A 661 12.315 -5.197 0.518 1.00 42.34 H new ATOM 0 HD3 LYS A 661 11.732 -5.353 -1.128 1.00 42.34 H new ATOM 0 HE2 LYS A 661 14.379 -4.136 -0.276 1.00 42.01 H new ATOM 0 HE3 LYS A 661 14.156 -5.714 -1.004 1.00 42.01 H new ATOM 0 HZ1 LYS A 661 14.764 -4.392 -2.755 1.00 45.14 H new ATOM 0 HZ2 LYS A 661 13.073 -4.412 -2.902 1.00 45.14 H new ATOM 0 HZ3 LYS A 661 13.850 -3.061 -2.230 1.00 45.14 H new ATOM 1178 N LEU A 662 7.990 -5.829 0.778 1.00 63.44 N ATOM 1179 CA LEU A 662 7.057 -6.298 1.758 1.00 2.03 C ATOM 1180 C LEU A 662 7.825 -6.831 2.951 1.00 63.22 C ATOM 1181 O LEU A 662 8.929 -7.343 2.810 1.00 14.12 O ATOM 1182 CB LEU A 662 6.134 -7.410 1.212 1.00 4.11 C ATOM 1183 CG LEU A 662 5.148 -7.048 0.108 1.00 65.32 C ATOM 1184 CD1 LEU A 662 4.258 -8.234 -0.188 1.00 60.53 C ATOM 1185 CD2 LEU A 662 4.308 -5.853 0.490 1.00 31.34 C ATOM 0 H LEU A 662 8.448 -6.571 0.248 1.00 63.44 H new ATOM 0 HA LEU A 662 6.423 -5.457 2.041 1.00 2.03 H new ATOM 0 HB2 LEU A 662 6.767 -8.217 0.842 1.00 4.11 H new ATOM 0 HB3 LEU A 662 5.564 -7.811 2.050 1.00 4.11 H new ATOM 0 HG LEU A 662 5.716 -6.785 -0.784 1.00 65.32 H new ATOM 0 HD11 LEU A 662 3.554 -7.972 -0.978 1.00 60.53 H new ATOM 0 HD12 LEU A 662 4.870 -9.076 -0.512 1.00 60.53 H new ATOM 0 HD13 LEU A 662 3.708 -8.510 0.712 1.00 60.53 H new ATOM 0 HD21 LEU A 662 3.615 -5.621 -0.319 1.00 31.34 H new ATOM 0 HD22 LEU A 662 3.745 -6.078 1.396 1.00 31.34 H new ATOM 0 HD23 LEU A 662 4.956 -4.995 0.670 1.00 31.34 H new ATOM 1193 N SER A 663 7.264 -6.683 4.098 1.00 60.42 N ATOM 1194 CA SER A 663 7.826 -7.186 5.321 1.00 72.22 C ATOM 1195 C SER A 663 6.687 -7.789 6.107 1.00 32.20 C ATOM 1196 O SER A 663 5.560 -7.486 5.833 1.00 54.35 O ATOM 1197 CB SER A 663 8.493 -6.051 6.080 1.00 45.44 C ATOM 1198 OG SER A 663 9.462 -5.415 5.252 1.00 70.55 O ATOM 0 H SER A 663 6.377 -6.197 4.225 1.00 60.42 H new ATOM 0 HA SER A 663 8.591 -7.941 5.138 1.00 72.22 H new ATOM 0 HB2 SER A 663 7.744 -5.327 6.400 1.00 45.44 H new ATOM 0 HB3 SER A 663 8.969 -6.436 6.982 1.00 45.44 H new ATOM 0 HG SER A 663 9.886 -4.684 5.748 1.00 70.55 H new ATOM 1204 N TYR A 664 6.951 -8.674 7.004 1.00 74.50 N ATOM 1205 CA TYR A 664 5.867 -9.316 7.709 1.00 64.21 C ATOM 1206 C TYR A 664 6.115 -9.389 9.207 1.00 3.24 C ATOM 1207 O TYR A 664 7.173 -9.843 9.641 1.00 32.24 O ATOM 1208 CB TYR A 664 5.696 -10.704 7.100 1.00 23.23 C ATOM 1209 CG TYR A 664 4.539 -11.575 7.583 1.00 61.44 C ATOM 1210 CD1 TYR A 664 3.199 -11.225 7.375 1.00 72.34 C ATOM 1211 CD2 TYR A 664 4.793 -12.776 8.201 1.00 53.35 C ATOM 1212 CE1 TYR A 664 2.186 -12.042 7.766 1.00 55.40 C ATOM 1213 CE2 TYR A 664 3.777 -13.611 8.592 1.00 33.43 C ATOM 1214 CZ TYR A 664 2.478 -13.252 8.377 1.00 43.33 C ATOM 1215 OH TYR A 664 1.464 -14.103 8.772 1.00 24.00 O ATOM 0 H TYR A 664 7.888 -8.975 7.273 1.00 74.50 H new ATOM 0 HA TYR A 664 4.954 -8.731 7.598 1.00 64.21 H new ATOM 0 HB2 TYR A 664 5.591 -10.582 6.022 1.00 23.23 H new ATOM 0 HB3 TYR A 664 6.620 -11.257 7.270 1.00 23.23 H new ATOM 0 HD1 TYR A 664 2.966 -10.287 6.894 1.00 72.34 H new ATOM 0 HD2 TYR A 664 5.816 -13.069 8.383 1.00 53.35 H new ATOM 0 HE1 TYR A 664 1.159 -11.750 7.602 1.00 55.40 H new ATOM 0 HE2 TYR A 664 4.005 -14.552 9.070 1.00 33.43 H new ATOM 0 HH TYR A 664 1.073 -14.534 7.984 1.00 24.00 H new ATOM 1225 N TYR A 665 5.162 -8.898 9.979 1.00 32.55 N ATOM 1226 CA TYR A 665 5.134 -9.125 11.418 1.00 70.42 C ATOM 1227 C TYR A 665 4.279 -10.355 11.629 1.00 34.13 C ATOM 1228 O TYR A 665 4.036 -11.090 10.682 1.00 62.13 O ATOM 1229 CB TYR A 665 4.508 -7.950 12.190 1.00 31.25 C ATOM 1230 CG TYR A 665 5.334 -6.684 12.294 1.00 34.15 C ATOM 1231 CD1 TYR A 665 6.583 -6.688 12.899 1.00 41.22 C ATOM 1232 CD2 TYR A 665 4.842 -5.483 11.837 1.00 62.24 C ATOM 1233 CE1 TYR A 665 7.310 -5.517 13.036 1.00 70.22 C ATOM 1234 CE2 TYR A 665 5.564 -4.312 11.960 1.00 11.04 C ATOM 1235 CZ TYR A 665 6.794 -4.335 12.559 1.00 33.14 C ATOM 1236 OH TYR A 665 7.509 -3.162 12.691 1.00 31.10 O ATOM 0 H TYR A 665 4.388 -8.333 9.631 1.00 32.55 H new ATOM 0 HA TYR A 665 6.153 -9.239 11.789 1.00 70.42 H new ATOM 0 HB2 TYR A 665 3.559 -7.699 11.716 1.00 31.25 H new ATOM 0 HB3 TYR A 665 4.279 -8.290 13.200 1.00 31.25 H new ATOM 0 HD1 TYR A 665 6.994 -7.616 13.268 1.00 41.22 H new ATOM 0 HD2 TYR A 665 3.868 -5.455 11.371 1.00 62.24 H new ATOM 0 HE1 TYR A 665 8.278 -5.532 13.515 1.00 70.22 H new ATOM 0 HE2 TYR A 665 5.160 -3.383 11.585 1.00 11.04 H new ATOM 0 HH TYR A 665 6.999 -2.422 12.299 1.00 31.10 H new ATOM 1246 N ASP A 666 3.805 -10.595 12.828 1.00 12.43 N ATOM 1247 CA ASP A 666 2.947 -11.749 13.029 1.00 34.34 C ATOM 1248 C ASP A 666 1.565 -11.522 12.413 1.00 42.32 C ATOM 1249 O ASP A 666 0.685 -10.911 13.017 1.00 34.35 O ATOM 1250 CB ASP A 666 2.840 -12.166 14.497 1.00 54.40 C ATOM 1251 CG ASP A 666 1.972 -13.401 14.670 1.00 31.24 C ATOM 1252 OD1 ASP A 666 2.393 -14.491 14.250 1.00 34.15 O ATOM 1253 OD2 ASP A 666 0.849 -13.292 15.211 1.00 62.15 O ATOM 0 H ASP A 666 3.988 -10.031 13.658 1.00 12.43 H new ATOM 0 HA ASP A 666 3.422 -12.581 12.509 1.00 34.34 H new ATOM 0 HB2 ASP A 666 3.836 -12.363 14.892 1.00 54.40 H new ATOM 0 HB3 ASP A 666 2.423 -11.344 15.079 1.00 54.40 H new ATOM 1258 N GLY A 667 1.434 -11.927 11.167 1.00 65.44 N ATOM 1259 CA GLY A 667 0.177 -11.858 10.445 1.00 50.03 C ATOM 1260 C GLY A 667 -0.077 -10.537 9.774 1.00 72.04 C ATOM 1261 O GLY A 667 -0.957 -10.425 8.917 1.00 54.45 O ATOM 0 H GLY A 667 2.202 -12.317 10.621 1.00 65.44 H new ATOM 0 HA2 GLY A 667 0.160 -12.645 9.691 1.00 50.03 H new ATOM 0 HA3 GLY A 667 -0.639 -12.064 11.138 1.00 50.03 H new ATOM 1265 N MET A 668 0.661 -9.545 10.152 1.00 51.31 N ATOM 1266 CA MET A 668 0.506 -8.251 9.562 1.00 71.22 C ATOM 1267 C MET A 668 1.592 -8.032 8.547 1.00 24.24 C ATOM 1268 O MET A 668 2.778 -7.947 8.898 1.00 42.53 O ATOM 1269 CB MET A 668 0.521 -7.141 10.623 1.00 35.12 C ATOM 1270 CG MET A 668 -0.613 -7.228 11.637 1.00 54.41 C ATOM 1271 SD MET A 668 -0.587 -5.891 12.863 1.00 1.54 S ATOM 1272 CE MET A 668 1.023 -6.138 13.618 1.00 64.51 C ATOM 0 H MET A 668 1.382 -9.604 10.871 1.00 51.31 H new ATOM 0 HA MET A 668 -0.465 -8.210 9.068 1.00 71.22 H new ATOM 0 HB2 MET A 668 1.472 -7.176 11.155 1.00 35.12 H new ATOM 0 HB3 MET A 668 0.471 -6.174 10.122 1.00 35.12 H new ATOM 0 HG2 MET A 668 -1.566 -7.208 11.108 1.00 54.41 H new ATOM 0 HG3 MET A 668 -0.556 -8.186 12.154 1.00 54.41 H new ATOM 0 HE1 MET A 668 1.052 -5.636 14.585 1.00 64.51 H new ATOM 0 HE2 MET A 668 1.200 -7.205 13.757 1.00 64.51 H new ATOM 0 HE3 MET A 668 1.796 -5.724 12.971 1.00 64.51 H new ATOM 1282 N ILE A 669 1.211 -8.005 7.294 1.00 55.23 N ATOM 1283 CA ILE A 669 2.148 -7.724 6.241 1.00 5.23 C ATOM 1284 C ILE A 669 2.393 -6.229 6.234 1.00 45.44 C ATOM 1285 O ILE A 669 1.477 -5.446 6.411 1.00 30.04 O ATOM 1286 CB ILE A 669 1.660 -8.154 4.815 1.00 61.11 C ATOM 1287 CG1 ILE A 669 1.516 -9.650 4.608 1.00 74.32 C ATOM 1288 CG2 ILE A 669 2.536 -7.584 3.715 1.00 23.01 C ATOM 1289 CD1 ILE A 669 0.370 -10.316 5.328 1.00 74.53 C ATOM 0 H ILE A 669 0.255 -8.175 6.980 1.00 55.23 H new ATOM 0 HA ILE A 669 3.048 -8.304 6.445 1.00 5.23 H new ATOM 0 HB ILE A 669 0.658 -7.730 4.754 1.00 61.11 H new ATOM 0 HG12 ILE A 669 1.405 -9.839 3.540 1.00 74.32 H new ATOM 0 HG13 ILE A 669 2.443 -10.130 4.922 1.00 74.32 H new ATOM 0 HG21 ILE A 669 2.159 -7.909 2.745 1.00 23.01 H new ATOM 0 HG22 ILE A 669 2.520 -6.495 3.765 1.00 23.01 H new ATOM 0 HG23 ILE A 669 3.559 -7.938 3.844 1.00 23.01 H new ATOM 0 HD11 ILE A 669 0.370 -11.383 5.103 1.00 74.53 H new ATOM 0 HD12 ILE A 669 0.482 -10.171 6.403 1.00 74.53 H new ATOM 0 HD13 ILE A 669 -0.571 -9.876 4.999 1.00 74.53 H new ATOM 1296 N GLN A 670 3.599 -5.850 6.050 1.00 15.21 N ATOM 1297 CA GLN A 670 3.963 -4.490 6.028 1.00 43.24 C ATOM 1298 C GLN A 670 4.520 -4.155 4.670 1.00 73.42 C ATOM 1299 O GLN A 670 5.073 -5.008 3.982 1.00 33.23 O ATOM 1300 CB GLN A 670 5.024 -4.215 7.081 1.00 54.41 C ATOM 1301 CG GLN A 670 4.675 -4.749 8.454 1.00 54.42 C ATOM 1302 CD GLN A 670 3.400 -4.173 9.050 1.00 62.50 C ATOM 1303 OE1 GLN A 670 2.708 -4.835 9.796 1.00 43.12 O ATOM 1304 NE2 GLN A 670 3.109 -2.951 8.754 1.00 21.30 N ATOM 0 H GLN A 670 4.378 -6.493 5.907 1.00 15.21 H new ATOM 0 HA GLN A 670 3.085 -3.880 6.238 1.00 43.24 H new ATOM 0 HB2 GLN A 670 5.966 -4.657 6.758 1.00 54.41 H new ATOM 0 HB3 GLN A 670 5.184 -3.139 7.150 1.00 54.41 H new ATOM 0 HG2 GLN A 670 4.575 -5.833 8.394 1.00 54.42 H new ATOM 0 HG3 GLN A 670 5.503 -4.542 9.132 1.00 54.42 H new ATOM 0 HE21 GLN A 670 3.711 -2.422 8.124 1.00 21.30 H new ATOM 0 HE22 GLN A 670 2.277 -2.515 9.150 1.00 21.30 H new ATOM 1312 N LEU A 671 4.379 -2.947 4.315 1.00 62.21 N ATOM 1313 CA LEU A 671 4.880 -2.405 3.070 1.00 2.31 C ATOM 1314 C LEU A 671 5.593 -1.155 3.431 1.00 73.21 C ATOM 1315 O LEU A 671 5.066 -0.349 4.193 1.00 71.25 O ATOM 1316 CB LEU A 671 3.712 -2.110 2.128 1.00 41.33 C ATOM 1317 CG LEU A 671 3.989 -1.372 0.807 1.00 42.20 C ATOM 1318 CD1 LEU A 671 4.849 -2.188 -0.149 1.00 30.23 C ATOM 1319 CD2 LEU A 671 2.683 -1.010 0.149 1.00 1.13 C ATOM 0 H LEU A 671 3.895 -2.257 4.889 1.00 62.21 H new ATOM 0 HA LEU A 671 5.543 -3.101 2.556 1.00 2.31 H new ATOM 0 HB2 LEU A 671 3.240 -3.061 1.881 1.00 41.33 H new ATOM 0 HB3 LEU A 671 2.980 -1.525 2.685 1.00 41.33 H new ATOM 0 HG LEU A 671 4.551 -0.469 1.047 1.00 42.20 H new ATOM 0 HD11 LEU A 671 5.014 -1.620 -1.065 1.00 30.23 H new ATOM 0 HD12 LEU A 671 5.808 -2.406 0.320 1.00 30.23 H new ATOM 0 HD13 LEU A 671 4.341 -3.123 -0.388 1.00 30.23 H new ATOM 0 HD21 LEU A 671 2.880 -0.487 -0.787 1.00 1.13 H new ATOM 0 HD22 LEU A 671 2.114 -1.917 -0.055 1.00 1.13 H new ATOM 0 HD23 LEU A 671 2.108 -0.363 0.812 1.00 1.13 H new ATOM 1327 N THR A 672 6.775 -0.991 2.958 1.00 51.35 N ATOM 1328 CA THR A 672 7.543 0.140 3.367 1.00 50.13 C ATOM 1329 C THR A 672 8.091 0.925 2.184 1.00 4.04 C ATOM 1330 O THR A 672 8.884 0.412 1.399 1.00 44.11 O ATOM 1331 CB THR A 672 8.693 -0.305 4.301 1.00 32.11 C ATOM 1332 OG1 THR A 672 8.138 -1.090 5.376 1.00 14.14 O ATOM 1333 CG2 THR A 672 9.403 0.902 4.901 1.00 75.03 C ATOM 0 H THR A 672 7.233 -1.615 2.294 1.00 51.35 H new ATOM 0 HA THR A 672 6.875 0.807 3.911 1.00 50.13 H new ATOM 0 HB THR A 672 9.410 -0.885 3.721 1.00 32.11 H new ATOM 0 HG1 THR A 672 8.858 -1.380 5.975 1.00 14.14 H new ATOM 0 HG21 THR A 672 10.207 0.563 5.554 1.00 75.03 H new ATOM 0 HG22 THR A 672 9.819 1.515 4.101 1.00 75.03 H new ATOM 0 HG23 THR A 672 8.692 1.493 5.478 1.00 75.03 H new ATOM 1339 N TYR A 673 7.645 2.148 2.063 1.00 3.40 N ATOM 1340 CA TYR A 673 8.159 3.061 1.076 1.00 52.14 C ATOM 1341 C TYR A 673 9.115 3.998 1.722 1.00 53.35 C ATOM 1342 O TYR A 673 8.808 4.586 2.766 1.00 11.00 O ATOM 1343 CB TYR A 673 7.060 3.854 0.381 1.00 51.13 C ATOM 1344 CG TYR A 673 6.262 3.045 -0.570 1.00 1.51 C ATOM 1345 CD1 TYR A 673 6.826 2.650 -1.759 1.00 44.32 C ATOM 1346 CD2 TYR A 673 4.962 2.684 -0.304 1.00 42.30 C ATOM 1347 CE1 TYR A 673 6.133 1.912 -2.658 1.00 21.32 C ATOM 1348 CE2 TYR A 673 4.252 1.939 -1.209 1.00 52.22 C ATOM 1349 CZ TYR A 673 4.851 1.549 -2.390 1.00 72.00 C ATOM 1350 OH TYR A 673 4.159 0.800 -3.302 1.00 15.20 O ATOM 0 H TYR A 673 6.910 2.541 2.651 1.00 3.40 H new ATOM 0 HA TYR A 673 8.660 2.466 0.312 1.00 52.14 H new ATOM 0 HB2 TYR A 673 6.395 4.276 1.134 1.00 51.13 H new ATOM 0 HB3 TYR A 673 7.509 4.691 -0.153 1.00 51.13 H new ATOM 0 HD1 TYR A 673 7.844 2.934 -1.981 1.00 44.32 H new ATOM 0 HD2 TYR A 673 4.498 2.989 0.622 1.00 42.30 H new ATOM 0 HE1 TYR A 673 6.598 1.613 -3.586 1.00 21.32 H new ATOM 0 HE2 TYR A 673 3.230 1.659 -1.000 1.00 52.22 H new ATOM 0 HH TYR A 673 3.286 0.555 -2.929 1.00 15.20 H new ATOM 1360 N ARG A 674 10.273 4.117 1.144 1.00 0.22 N ATOM 1361 CA ARG A 674 11.294 4.987 1.667 1.00 41.31 C ATOM 1362 C ARG A 674 11.851 5.860 0.563 1.00 1.03 C ATOM 1363 O ARG A 674 11.468 5.700 -0.590 1.00 31.10 O ATOM 1364 CB ARG A 674 12.419 4.176 2.312 1.00 62.23 C ATOM 1365 CG ARG A 674 11.981 3.325 3.489 1.00 50.54 C ATOM 1366 CD ARG A 674 13.172 2.727 4.196 1.00 21.54 C ATOM 1367 NE ARG A 674 14.026 3.779 4.767 1.00 22.20 N ATOM 1368 CZ ARG A 674 15.288 3.615 5.167 1.00 22.33 C ATOM 1369 NH1 ARG A 674 15.911 2.455 4.962 1.00 45.32 N ATOM 1370 NH2 ARG A 674 15.932 4.621 5.745 1.00 4.30 N ATOM 0 H ARG A 674 10.540 3.616 0.297 1.00 0.22 H new ATOM 0 HA ARG A 674 10.845 5.622 2.431 1.00 41.31 H new ATOM 0 HB2 ARG A 674 12.863 3.528 1.556 1.00 62.23 H new ATOM 0 HB3 ARG A 674 13.200 4.860 2.644 1.00 62.23 H new ATOM 0 HG2 ARG A 674 11.406 3.933 4.188 1.00 50.54 H new ATOM 0 HG3 ARG A 674 11.322 2.529 3.142 1.00 50.54 H new ATOM 0 HD2 ARG A 674 12.832 2.059 4.988 1.00 21.54 H new ATOM 0 HD3 ARG A 674 13.750 2.124 3.496 1.00 21.54 H new ATOM 0 HE ARG A 674 13.621 4.710 4.865 1.00 22.20 H new ATOM 0 HH11 ARG A 674 15.423 1.689 4.498 1.00 45.32 H new ATOM 0 HH12 ARG A 674 16.876 2.333 5.269 1.00 45.32 H new ATOM 0 HH21 ARG A 674 15.462 5.516 5.882 1.00 4.30 H new ATOM 0 HH22 ARG A 674 16.897 4.499 6.052 1.00 4.30 H new ATOM 1382 N ASP A 675 12.763 6.754 0.934 1.00 31.32 N ATOM 1383 CA ASP A 675 13.451 7.715 0.023 1.00 72.24 C ATOM 1384 C ASP A 675 12.531 8.905 -0.291 1.00 52.44 C ATOM 1385 O ASP A 675 12.687 9.590 -1.300 1.00 20.35 O ATOM 1386 CB ASP A 675 13.952 7.049 -1.295 1.00 64.21 C ATOM 1387 CG ASP A 675 15.056 7.852 -1.962 1.00 22.13 C ATOM 1388 OD1 ASP A 675 16.229 7.677 -1.577 1.00 71.43 O ATOM 1389 OD2 ASP A 675 14.780 8.659 -2.872 1.00 53.15 O ATOM 0 H ASP A 675 13.066 6.847 1.904 1.00 31.32 H new ATOM 0 HA ASP A 675 14.337 8.071 0.550 1.00 72.24 H new ATOM 0 HB2 ASP A 675 14.317 6.045 -1.077 1.00 64.21 H new ATOM 0 HB3 ASP A 675 13.116 6.941 -1.986 1.00 64.21 H new ATOM 1394 N GLY A 676 11.582 9.162 0.599 1.00 15.24 N ATOM 1395 CA GLY A 676 10.688 10.296 0.431 1.00 4.04 C ATOM 1396 C GLY A 676 11.384 11.639 0.675 1.00 65.23 C ATOM 1397 O GLY A 676 12.608 11.715 0.727 1.00 34.51 O ATOM 0 H GLY A 676 11.413 8.605 1.437 1.00 15.24 H new ATOM 0 HA2 GLY A 676 10.277 10.283 -0.578 1.00 4.04 H new ATOM 0 HA3 GLY A 676 9.848 10.196 1.119 1.00 4.04 H new ATOM 1401 N THR A 677 10.615 12.680 0.833 1.00 74.11 N ATOM 1402 CA THR A 677 11.155 14.007 1.057 1.00 34.42 C ATOM 1403 C THR A 677 11.660 14.114 2.509 1.00 1.23 C ATOM 1404 O THR A 677 10.881 13.917 3.441 1.00 51.21 O ATOM 1405 CB THR A 677 10.049 15.057 0.842 1.00 41.20 C ATOM 1406 OG1 THR A 677 9.352 14.765 -0.373 1.00 70.33 O ATOM 1407 CG2 THR A 677 10.640 16.455 0.741 1.00 61.52 C ATOM 0 H THR A 677 9.596 12.641 0.811 1.00 74.11 H new ATOM 0 HA THR A 677 11.975 14.183 0.360 1.00 34.42 H new ATOM 0 HB THR A 677 9.369 15.021 1.693 1.00 41.20 H new ATOM 0 HG1 THR A 677 9.043 15.600 -0.782 1.00 70.33 H new ATOM 0 HG21 THR A 677 9.839 17.179 0.589 1.00 61.52 H new ATOM 0 HG22 THR A 677 11.173 16.692 1.662 1.00 61.52 H new ATOM 0 HG23 THR A 677 11.332 16.498 -0.100 1.00 61.52 H new ATOM 1413 N PRO A 678 12.962 14.383 2.719 1.00 72.20 N ATOM 1414 CA PRO A 678 13.544 14.515 4.064 1.00 20.21 C ATOM 1415 C PRO A 678 13.037 15.739 4.807 1.00 61.30 C ATOM 1416 O PRO A 678 12.945 16.826 4.239 1.00 4.45 O ATOM 1417 CB PRO A 678 15.050 14.654 3.795 1.00 62.42 C ATOM 1418 CG PRO A 678 15.233 14.174 2.405 1.00 65.21 C ATOM 1419 CD PRO A 678 13.985 14.564 1.681 1.00 72.33 C ATOM 0 HA PRO A 678 13.280 13.667 4.695 1.00 20.21 H new ATOM 0 HB2 PRO A 678 15.377 15.688 3.902 1.00 62.42 H new ATOM 0 HB3 PRO A 678 15.634 14.060 4.498 1.00 62.42 H new ATOM 0 HG2 PRO A 678 16.111 14.627 1.946 1.00 65.21 H new ATOM 0 HG3 PRO A 678 15.381 13.094 2.379 1.00 65.21 H new ATOM 0 HD2 PRO A 678 14.025 15.593 1.323 1.00 72.33 H new ATOM 0 HD3 PRO A 678 13.802 13.931 0.813 1.00 72.33 H new ATOM 1427 N TYR A 679 12.712 15.559 6.078 1.00 51.44 N ATOM 1428 CA TYR A 679 12.232 16.646 6.908 1.00 52.12 C ATOM 1429 C TYR A 679 12.524 16.421 8.382 1.00 72.32 C ATOM 1430 O TYR A 679 12.698 15.275 8.819 1.00 40.30 O ATOM 1431 CB TYR A 679 10.735 16.946 6.678 1.00 42.02 C ATOM 1432 CG TYR A 679 9.758 15.824 6.985 1.00 25.30 C ATOM 1433 CD1 TYR A 679 9.905 14.586 6.413 1.00 20.34 C ATOM 1434 CD2 TYR A 679 8.656 16.035 7.806 1.00 30.14 C ATOM 1435 CE1 TYR A 679 8.998 13.581 6.641 1.00 42.05 C ATOM 1436 CE2 TYR A 679 7.742 15.021 8.042 1.00 52.40 C ATOM 1437 CZ TYR A 679 7.926 13.803 7.449 1.00 13.32 C ATOM 1438 OH TYR A 679 7.026 12.801 7.657 1.00 74.12 O ATOM 0 H TYR A 679 12.774 14.661 6.558 1.00 51.44 H new ATOM 0 HA TYR A 679 12.791 17.528 6.596 1.00 52.12 H new ATOM 0 HB2 TYR A 679 10.464 17.809 7.286 1.00 42.02 H new ATOM 0 HB3 TYR A 679 10.603 17.236 5.636 1.00 42.02 H new ATOM 0 HD1 TYR A 679 10.752 14.398 5.770 1.00 20.34 H new ATOM 0 HD2 TYR A 679 8.511 17.001 8.266 1.00 30.14 H new ATOM 0 HE1 TYR A 679 9.135 12.614 6.179 1.00 42.05 H new ATOM 0 HE2 TYR A 679 6.893 15.191 8.688 1.00 52.40 H new ATOM 0 HH TYR A 679 6.134 13.100 7.382 1.00 74.12 H new ATOM 1448 N ASN A 680 12.592 17.541 9.113 1.00 11.42 N ATOM 1449 CA ASN A 680 12.832 17.635 10.569 1.00 52.14 C ATOM 1450 C ASN A 680 13.948 16.711 11.066 1.00 35.15 C ATOM 1451 O ASN A 680 13.682 15.659 11.663 1.00 31.03 O ATOM 1452 CB ASN A 680 11.531 17.457 11.362 1.00 54.31 C ATOM 1453 CG ASN A 680 11.615 17.894 12.826 1.00 5.04 C ATOM 1454 OD1 ASN A 680 12.653 17.822 13.476 1.00 64.34 O ATOM 1455 ND2 ASN A 680 10.518 18.384 13.334 1.00 15.43 N ATOM 0 H ASN A 680 12.475 18.460 8.686 1.00 11.42 H new ATOM 0 HA ASN A 680 13.196 18.646 10.754 1.00 52.14 H new ATOM 0 HB2 ASN A 680 10.741 18.025 10.871 1.00 54.31 H new ATOM 0 HB3 ASN A 680 11.239 16.408 11.326 1.00 54.31 H new ATOM 0 HD21 ASN A 680 10.508 18.720 14.297 1.00 15.43 H new ATOM 0 HD22 ASN A 680 9.670 18.431 12.768 1.00 15.43 H new ATOM 1461 N ASN A 681 15.179 17.094 10.736 1.00 21.14 N ATOM 1462 CA ASN A 681 16.424 16.408 11.120 1.00 31.42 C ATOM 1463 C ASN A 681 17.531 16.955 10.260 1.00 61.12 C ATOM 1464 O ASN A 681 17.389 16.993 9.039 1.00 35.41 O ATOM 1465 CB ASN A 681 16.341 14.870 10.928 1.00 22.43 C ATOM 1466 CG ASN A 681 17.628 14.151 11.309 1.00 44.43 C ATOM 1467 OD1 ASN A 681 18.414 14.637 12.119 1.00 4.14 O ATOM 1468 ND2 ASN A 681 17.832 12.981 10.773 1.00 43.33 N ATOM 0 H ASN A 681 15.350 17.925 10.170 1.00 21.14 H new ATOM 0 HA ASN A 681 16.605 16.587 12.180 1.00 31.42 H new ATOM 0 HB2 ASN A 681 15.521 14.478 11.530 1.00 22.43 H new ATOM 0 HB3 ASN A 681 16.104 14.652 9.887 1.00 22.43 H new ATOM 0 HD21 ASN A 681 18.662 12.443 11.023 1.00 43.33 H new ATOM 0 HD22 ASN A 681 17.162 12.603 10.103 1.00 43.33 H new ATOM 1474 N GLU A 682 18.625 17.387 10.870 1.00 73.55 N ATOM 1475 CA GLU A 682 19.743 17.950 10.110 1.00 73.42 C ATOM 1476 C GLU A 682 20.432 16.909 9.256 1.00 63.03 C ATOM 1477 O GLU A 682 20.962 17.222 8.188 1.00 12.30 O ATOM 1478 CB GLU A 682 20.745 18.662 10.997 1.00 1.11 C ATOM 1479 CG GLU A 682 20.174 19.853 11.723 1.00 52.14 C ATOM 1480 CD GLU A 682 21.242 20.667 12.380 1.00 32.04 C ATOM 1481 OE1 GLU A 682 21.608 20.373 13.534 1.00 75.42 O ATOM 1482 OE2 GLU A 682 21.751 21.623 11.740 1.00 25.11 O ATOM 0 H GLU A 682 18.767 17.361 11.880 1.00 73.55 H new ATOM 0 HA GLU A 682 19.307 18.695 9.444 1.00 73.42 H new ATOM 0 HB2 GLU A 682 21.136 17.955 11.729 1.00 1.11 H new ATOM 0 HB3 GLU A 682 21.588 18.989 10.388 1.00 1.11 H new ATOM 0 HG2 GLU A 682 19.622 20.477 11.020 1.00 52.14 H new ATOM 0 HG3 GLU A 682 19.462 19.513 12.475 1.00 52.14 H new ATOM 1489 N LYS A 683 20.410 15.667 9.716 1.00 31.42 N ATOM 1490 CA LYS A 683 20.969 14.558 8.951 1.00 41.54 C ATOM 1491 C LYS A 683 20.054 14.282 7.756 1.00 14.33 C ATOM 1492 O LYS A 683 20.446 13.652 6.778 1.00 23.22 O ATOM 1493 CB LYS A 683 21.053 13.316 9.838 1.00 13.23 C ATOM 1494 CG LYS A 683 21.731 12.114 9.197 1.00 52.24 C ATOM 1495 CD LYS A 683 21.634 10.877 10.081 1.00 73.42 C ATOM 1496 CE LYS A 683 22.263 11.096 11.449 1.00 21.24 C ATOM 1497 NZ LYS A 683 22.139 9.902 12.307 1.00 14.12 N ATOM 0 H LYS A 683 20.011 15.400 10.616 1.00 31.42 H new ATOM 0 HA LYS A 683 21.970 14.809 8.601 1.00 41.54 H new ATOM 0 HB2 LYS A 683 21.591 13.575 10.750 1.00 13.23 H new ATOM 0 HB3 LYS A 683 20.044 13.030 10.134 1.00 13.23 H new ATOM 0 HG2 LYS A 683 21.270 11.908 8.231 1.00 52.24 H new ATOM 0 HG3 LYS A 683 22.779 12.345 9.008 1.00 52.24 H new ATOM 0 HD2 LYS A 683 20.586 10.602 10.205 1.00 73.42 H new ATOM 0 HD3 LYS A 683 22.127 10.040 9.586 1.00 73.42 H new ATOM 0 HE2 LYS A 683 23.316 11.349 11.328 1.00 21.24 H new ATOM 0 HE3 LYS A 683 21.785 11.945 11.937 1.00 21.24 H new ATOM 0 HZ1 LYS A 683 22.579 10.091 13.230 1.00 14.12 H new ATOM 0 HZ2 LYS A 683 21.133 9.675 12.443 1.00 14.12 H new ATOM 0 HZ3 LYS A 683 22.617 9.097 11.853 1.00 14.12 H new ATOM 1511 N ARG A 684 18.830 14.799 7.872 1.00 53.22 N ATOM 1512 CA ARG A 684 17.789 14.681 6.877 1.00 12.44 C ATOM 1513 C ARG A 684 17.330 13.265 6.675 1.00 14.15 C ATOM 1514 O ARG A 684 18.001 12.439 6.056 1.00 24.23 O ATOM 1515 CB ARG A 684 18.148 15.392 5.575 1.00 54.11 C ATOM 1516 CG ARG A 684 18.273 16.888 5.765 1.00 14.53 C ATOM 1517 CD ARG A 684 18.599 17.602 4.485 1.00 64.44 C ATOM 1518 NE ARG A 684 18.655 19.048 4.699 1.00 21.02 N ATOM 1519 CZ ARG A 684 18.992 19.955 3.786 1.00 51.43 C ATOM 1520 NH1 ARG A 684 19.348 19.582 2.566 1.00 63.15 N ATOM 1521 NH2 ARG A 684 18.958 21.244 4.103 1.00 62.34 N ATOM 0 H ARG A 684 18.537 15.328 8.693 1.00 53.22 H new ATOM 0 HA ARG A 684 16.922 15.208 7.276 1.00 12.44 H new ATOM 0 HB2 ARG A 684 19.088 14.995 5.192 1.00 54.11 H new ATOM 0 HB3 ARG A 684 17.385 15.184 4.825 1.00 54.11 H new ATOM 0 HG2 ARG A 684 17.339 17.280 6.169 1.00 14.53 H new ATOM 0 HG3 ARG A 684 19.050 17.094 6.501 1.00 14.53 H new ATOM 0 HD2 ARG A 684 19.556 17.249 4.099 1.00 64.44 H new ATOM 0 HD3 ARG A 684 17.846 17.370 3.731 1.00 64.44 H new ATOM 0 HE ARG A 684 18.415 19.391 5.629 1.00 21.02 H new ATOM 0 HH11 ARG A 684 19.365 18.592 2.320 1.00 63.15 H new ATOM 0 HH12 ARG A 684 19.605 20.284 1.872 1.00 63.15 H new ATOM 0 HH21 ARG A 684 18.675 21.531 5.040 1.00 62.34 H new ATOM 0 HH22 ARG A 684 19.215 21.947 3.410 1.00 62.34 H new ATOM 1533 N THR A 685 16.207 12.979 7.236 1.00 50.12 N ATOM 1534 CA THR A 685 15.619 11.685 7.137 1.00 22.23 C ATOM 1535 C THR A 685 14.488 11.744 6.140 1.00 72.12 C ATOM 1536 O THR A 685 13.540 12.526 6.324 1.00 41.32 O ATOM 1537 CB THR A 685 15.088 11.241 8.505 1.00 14.42 C ATOM 1538 OG1 THR A 685 16.169 11.289 9.443 1.00 0.24 O ATOM 1539 CG2 THR A 685 14.541 9.819 8.450 1.00 24.43 C ATOM 0 H THR A 685 15.662 13.645 7.784 1.00 50.12 H new ATOM 0 HA THR A 685 16.367 10.964 6.807 1.00 22.23 H new ATOM 0 HB THR A 685 14.278 11.906 8.803 1.00 14.42 H new ATOM 0 HG1 THR A 685 15.849 11.010 10.326 1.00 0.24 H new ATOM 0 HG21 THR A 685 14.172 9.533 9.435 1.00 24.43 H new ATOM 0 HG22 THR A 685 13.725 9.771 7.729 1.00 24.43 H new ATOM 0 HG23 THR A 685 15.334 9.136 8.147 1.00 24.43 H new ATOM 1545 N PRO A 686 14.589 10.981 5.039 1.00 24.00 N ATOM 1546 CA PRO A 686 13.555 10.940 4.038 1.00 50.20 C ATOM 1547 C PRO A 686 12.266 10.385 4.605 1.00 64.21 C ATOM 1548 O PRO A 686 12.275 9.474 5.458 1.00 60.14 O ATOM 1549 CB PRO A 686 14.111 10.030 2.941 1.00 24.54 C ATOM 1550 CG PRO A 686 15.569 9.937 3.215 1.00 31.51 C ATOM 1551 CD PRO A 686 15.722 10.106 4.692 1.00 40.14 C ATOM 0 HA PRO A 686 13.310 11.933 3.662 1.00 50.20 H new ATOM 0 HB2 PRO A 686 13.641 9.047 2.969 1.00 24.54 H new ATOM 0 HB3 PRO A 686 13.922 10.445 1.951 1.00 24.54 H new ATOM 0 HG2 PRO A 686 15.967 8.976 2.889 1.00 31.51 H new ATOM 0 HG3 PRO A 686 16.118 10.709 2.675 1.00 31.51 H new ATOM 0 HD2 PRO A 686 15.671 9.151 5.216 1.00 40.14 H new ATOM 0 HD3 PRO A 686 16.678 10.561 4.950 1.00 40.14 H new ATOM 1559 N ARG A 687 11.185 10.961 4.163 1.00 34.14 N ATOM 1560 CA ARG A 687 9.862 10.606 4.581 1.00 13.40 C ATOM 1561 C ARG A 687 9.591 9.151 4.212 1.00 11.03 C ATOM 1562 O ARG A 687 9.999 8.698 3.139 1.00 4.24 O ATOM 1563 CB ARG A 687 8.908 11.553 3.873 1.00 52.14 C ATOM 1564 CG ARG A 687 7.498 11.586 4.382 1.00 3.13 C ATOM 1565 CD ARG A 687 6.721 12.706 3.690 1.00 31.31 C ATOM 1566 NE ARG A 687 7.443 13.992 3.731 1.00 63.44 N ATOM 1567 CZ ARG A 687 7.022 15.122 4.343 1.00 10.33 C ATOM 1568 NH1 ARG A 687 5.976 15.095 5.155 1.00 44.15 N ATOM 1569 NH2 ARG A 687 7.699 16.257 4.199 1.00 70.24 N ATOM 0 H ARG A 687 11.203 11.717 3.478 1.00 34.14 H new ATOM 0 HA ARG A 687 9.734 10.695 5.660 1.00 13.40 H new ATOM 0 HB2 ARG A 687 9.318 12.561 3.937 1.00 52.14 H new ATOM 0 HB3 ARG A 687 8.883 11.286 2.817 1.00 52.14 H new ATOM 0 HG2 ARG A 687 7.013 10.627 4.198 1.00 3.13 H new ATOM 0 HG3 ARG A 687 7.495 11.742 5.461 1.00 3.13 H new ATOM 0 HD2 ARG A 687 6.534 12.429 2.652 1.00 31.31 H new ATOM 0 HD3 ARG A 687 5.749 12.821 4.169 1.00 31.31 H new ATOM 0 HE ARG A 687 8.343 14.032 3.253 1.00 63.44 H new ATOM 0 HH11 ARG A 687 5.483 14.218 5.322 1.00 44.15 H new ATOM 0 HH12 ARG A 687 5.664 15.951 5.613 1.00 44.15 H new ATOM 0 HH21 ARG A 687 8.541 16.279 3.624 1.00 70.24 H new ATOM 0 HH22 ARG A 687 7.376 17.106 4.663 1.00 70.24 H new ATOM 1581 N ALA A 688 8.940 8.432 5.092 1.00 62.51 N ATOM 1582 CA ALA A 688 8.692 7.029 4.875 1.00 3.51 C ATOM 1583 C ALA A 688 7.250 6.679 5.168 1.00 21.13 C ATOM 1584 O ALA A 688 6.610 7.298 6.033 1.00 0.44 O ATOM 1585 CB ALA A 688 9.633 6.188 5.730 1.00 52.34 C ATOM 0 H ALA A 688 8.571 8.798 5.970 1.00 62.51 H new ATOM 0 HA ALA A 688 8.882 6.808 3.825 1.00 3.51 H new ATOM 0 HB1 ALA A 688 9.435 5.130 5.556 1.00 52.34 H new ATOM 0 HB2 ALA A 688 10.666 6.412 5.463 1.00 52.34 H new ATOM 0 HB3 ALA A 688 9.472 6.419 6.783 1.00 52.34 H new ATOM 1591 N THR A 689 6.748 5.706 4.454 1.00 73.24 N ATOM 1592 CA THR A 689 5.397 5.234 4.617 1.00 1.42 C ATOM 1593 C THR A 689 5.425 3.750 4.869 1.00 0.23 C ATOM 1594 O THR A 689 6.091 3.005 4.142 1.00 3.52 O ATOM 1595 CB THR A 689 4.587 5.489 3.342 1.00 23.51 C ATOM 1596 OG1 THR A 689 4.688 6.843 3.014 1.00 34.41 O ATOM 1597 CG2 THR A 689 3.123 5.134 3.529 1.00 34.24 C ATOM 0 H THR A 689 7.273 5.212 3.733 1.00 73.24 H new ATOM 0 HA THR A 689 4.938 5.762 5.453 1.00 1.42 H new ATOM 0 HB THR A 689 4.988 4.861 2.547 1.00 23.51 H new ATOM 0 HG1 THR A 689 4.482 7.387 3.803 1.00 34.41 H new ATOM 0 HG21 THR A 689 2.580 5.328 2.604 1.00 34.24 H new ATOM 0 HG22 THR A 689 3.035 4.079 3.787 1.00 34.24 H new ATOM 0 HG23 THR A 689 2.701 5.740 4.331 1.00 34.24 H new ATOM 1603 N LEU A 690 4.739 3.314 5.873 1.00 73.04 N ATOM 1604 CA LEU A 690 4.677 1.955 6.169 1.00 20.22 C ATOM 1605 C LEU A 690 3.216 1.537 6.326 1.00 23.44 C ATOM 1606 O LEU A 690 2.498 2.042 7.185 1.00 74.33 O ATOM 1607 CB LEU A 690 5.572 1.652 7.392 1.00 14.11 C ATOM 1608 CG LEU A 690 5.649 0.207 7.863 1.00 24.14 C ATOM 1609 CD1 LEU A 690 6.913 -0.008 8.667 1.00 62.40 C ATOM 1610 CD2 LEU A 690 4.469 -0.129 8.739 1.00 34.42 C ATOM 0 H LEU A 690 4.207 3.911 6.506 1.00 73.04 H new ATOM 0 HA LEU A 690 5.075 1.350 5.354 1.00 20.22 H new ATOM 0 HB2 LEU A 690 6.584 1.985 7.160 1.00 14.11 H new ATOM 0 HB3 LEU A 690 5.220 2.260 8.226 1.00 14.11 H new ATOM 0 HG LEU A 690 5.647 -0.435 6.982 1.00 24.14 H new ATOM 0 HD11 LEU A 690 6.960 -1.045 9.000 1.00 62.40 H new ATOM 0 HD12 LEU A 690 7.781 0.214 8.046 1.00 62.40 H new ATOM 0 HD13 LEU A 690 6.909 0.652 9.534 1.00 62.40 H new ATOM 0 HD21 LEU A 690 4.542 -1.166 9.066 1.00 34.42 H new ATOM 0 HD22 LEU A 690 4.464 0.526 9.610 1.00 34.42 H new ATOM 0 HD23 LEU A 690 3.546 0.010 8.176 1.00 34.42 H new ATOM 1618 N ILE A 691 2.787 0.647 5.468 1.00 52.42 N ATOM 1619 CA ILE A 691 1.422 0.154 5.460 1.00 50.31 C ATOM 1620 C ILE A 691 1.374 -1.143 6.234 1.00 2.22 C ATOM 1621 O ILE A 691 2.265 -1.978 6.085 1.00 73.24 O ATOM 1622 CB ILE A 691 0.868 -0.159 4.015 1.00 23.51 C ATOM 1623 CG1 ILE A 691 0.845 1.040 3.056 1.00 42.55 C ATOM 1624 CG2 ILE A 691 -0.516 -0.760 4.085 1.00 2.42 C ATOM 1625 CD1 ILE A 691 2.190 1.618 2.687 1.00 34.24 C ATOM 0 H ILE A 691 3.378 0.236 4.745 1.00 52.42 H new ATOM 0 HA ILE A 691 0.809 0.942 5.897 1.00 50.31 H new ATOM 0 HB ILE A 691 1.581 -0.873 3.601 1.00 23.51 H new ATOM 0 HG12 ILE A 691 0.338 0.737 2.140 1.00 42.55 H new ATOM 0 HG13 ILE A 691 0.244 1.829 3.507 1.00 42.55 H new ATOM 0 HG21 ILE A 691 -0.875 -0.966 3.077 1.00 2.42 H new ATOM 0 HG22 ILE A 691 -0.481 -1.689 4.655 1.00 2.42 H new ATOM 0 HG23 ILE A 691 -1.193 -0.059 4.574 1.00 2.42 H new ATOM 0 HD11 ILE A 691 2.051 2.458 2.007 1.00 34.24 H new ATOM 0 HD12 ILE A 691 2.698 1.961 3.588 1.00 34.24 H new ATOM 0 HD13 ILE A 691 2.794 0.852 2.199 1.00 34.24 H new ATOM 1632 N THR A 692 0.383 -1.284 7.055 1.00 12.34 N ATOM 1633 CA THR A 692 0.143 -2.482 7.777 1.00 1.51 C ATOM 1634 C THR A 692 -1.105 -3.160 7.180 1.00 32.42 C ATOM 1635 O THR A 692 -2.193 -2.575 7.180 1.00 13.31 O ATOM 1636 CB THR A 692 -0.103 -2.143 9.263 1.00 31.14 C ATOM 1637 OG1 THR A 692 0.994 -1.344 9.760 1.00 2.21 O ATOM 1638 CG2 THR A 692 -0.196 -3.400 10.099 1.00 21.21 C ATOM 0 H THR A 692 -0.297 -0.547 7.243 1.00 12.34 H new ATOM 0 HA THR A 692 1.001 -3.151 7.706 1.00 1.51 H new ATOM 0 HB THR A 692 -1.043 -1.597 9.335 1.00 31.14 H new ATOM 0 HG1 THR A 692 0.768 -0.994 10.647 1.00 2.21 H new ATOM 0 HG21 THR A 692 -0.369 -3.132 11.141 1.00 21.21 H new ATOM 0 HG22 THR A 692 -1.021 -4.015 9.740 1.00 21.21 H new ATOM 0 HG23 THR A 692 0.736 -3.960 10.019 1.00 21.21 H new ATOM 1644 N PHE A 693 -0.929 -4.341 6.634 1.00 2.21 N ATOM 1645 CA PHE A 693 -2.018 -5.112 6.056 1.00 51.12 C ATOM 1646 C PHE A 693 -2.620 -6.022 7.108 1.00 23.44 C ATOM 1647 O PHE A 693 -1.948 -6.924 7.624 1.00 53.21 O ATOM 1648 CB PHE A 693 -1.531 -5.964 4.859 1.00 54.32 C ATOM 1649 CG PHE A 693 -1.077 -5.178 3.647 1.00 61.00 C ATOM 1650 CD1 PHE A 693 0.199 -4.666 3.561 1.00 10.04 C ATOM 1651 CD2 PHE A 693 -1.946 -4.948 2.608 1.00 43.14 C ATOM 1652 CE1 PHE A 693 0.592 -3.931 2.443 1.00 3.31 C ATOM 1653 CE2 PHE A 693 -1.561 -4.230 1.497 1.00 63.23 C ATOM 1654 CZ PHE A 693 -0.299 -3.717 1.409 1.00 4.25 C ATOM 0 H PHE A 693 -0.021 -4.802 6.575 1.00 2.21 H new ATOM 0 HA PHE A 693 -2.771 -4.411 5.696 1.00 51.12 H new ATOM 0 HB2 PHE A 693 -0.706 -6.593 5.194 1.00 54.32 H new ATOM 0 HB3 PHE A 693 -2.338 -6.631 4.557 1.00 54.32 H new ATOM 0 HD1 PHE A 693 0.900 -4.835 4.365 1.00 10.04 H new ATOM 0 HD2 PHE A 693 -2.952 -5.338 2.663 1.00 43.14 H new ATOM 0 HE1 PHE A 693 1.593 -3.529 2.385 1.00 3.31 H new ATOM 0 HE2 PHE A 693 -2.262 -4.072 0.691 1.00 63.23 H new ATOM 0 HZ PHE A 693 -0.000 -3.150 0.540 1.00 4.25 H new ATOM 1664 N LEU A 694 -3.870 -5.788 7.435 1.00 44.24 N ATOM 1665 CA LEU A 694 -4.558 -6.598 8.415 1.00 53.03 C ATOM 1666 C LEU A 694 -5.706 -7.326 7.758 1.00 4.55 C ATOM 1667 O LEU A 694 -6.329 -6.810 6.823 1.00 1.14 O ATOM 1668 CB LEU A 694 -5.150 -5.766 9.597 1.00 41.11 C ATOM 1669 CG LEU A 694 -4.208 -4.908 10.466 1.00 63.41 C ATOM 1670 CD1 LEU A 694 -3.744 -3.665 9.733 1.00 54.32 C ATOM 1671 CD2 LEU A 694 -4.886 -4.534 11.775 1.00 2.14 C ATOM 0 H LEU A 694 -4.434 -5.039 7.034 1.00 44.24 H new ATOM 0 HA LEU A 694 -3.812 -7.285 8.816 1.00 53.03 H new ATOM 0 HB2 LEU A 694 -5.908 -5.101 9.182 1.00 41.11 H new ATOM 0 HB3 LEU A 694 -5.665 -6.461 10.261 1.00 41.11 H new ATOM 0 HG LEU A 694 -3.325 -5.508 10.685 1.00 63.41 H new ATOM 0 HD11 LEU A 694 -3.082 -3.087 10.379 1.00 54.32 H new ATOM 0 HD12 LEU A 694 -3.207 -3.954 8.830 1.00 54.32 H new ATOM 0 HD13 LEU A 694 -4.608 -3.058 9.463 1.00 54.32 H new ATOM 0 HD21 LEU A 694 -4.208 -3.929 12.376 1.00 2.14 H new ATOM 0 HD22 LEU A 694 -5.792 -3.965 11.566 1.00 2.14 H new ATOM 0 HD23 LEU A 694 -5.145 -5.440 12.322 1.00 2.14 H new ATOM 1679 N CYS A 695 -5.993 -8.492 8.243 1.00 14.53 N ATOM 1680 CA CYS A 695 -7.153 -9.221 7.819 1.00 41.32 C ATOM 1681 C CYS A 695 -8.165 -9.128 8.932 1.00 4.30 C ATOM 1682 O CYS A 695 -8.266 -10.000 9.797 1.00 64.32 O ATOM 1683 CB CYS A 695 -6.828 -10.688 7.483 1.00 12.42 C ATOM 1684 SG CYS A 695 -8.288 -11.714 7.063 1.00 13.14 S ATOM 0 H CYS A 695 -5.430 -8.970 8.947 1.00 14.53 H new ATOM 0 HA CYS A 695 -7.546 -8.789 6.899 1.00 41.32 H new ATOM 0 HB2 CYS A 695 -6.131 -10.710 6.645 1.00 12.42 H new ATOM 0 HB3 CYS A 695 -6.317 -11.138 8.334 1.00 12.42 H new ATOM 1689 N ASP A 696 -8.819 -7.999 8.978 1.00 32.24 N ATOM 1690 CA ASP A 696 -9.779 -7.715 10.009 1.00 53.54 C ATOM 1691 C ASP A 696 -11.173 -8.078 9.543 1.00 22.20 C ATOM 1692 O ASP A 696 -11.693 -7.470 8.604 1.00 14.44 O ATOM 1693 CB ASP A 696 -9.696 -6.236 10.394 1.00 63.10 C ATOM 1694 CG ASP A 696 -10.637 -5.840 11.504 1.00 1.24 C ATOM 1695 OD1 ASP A 696 -10.247 -5.909 12.688 1.00 72.23 O ATOM 1696 OD2 ASP A 696 -11.766 -5.430 11.217 1.00 74.32 O ATOM 0 H ASP A 696 -8.700 -7.248 8.299 1.00 32.24 H new ATOM 0 HA ASP A 696 -9.553 -8.317 10.889 1.00 53.54 H new ATOM 0 HB2 ASP A 696 -8.675 -6.006 10.698 1.00 63.10 H new ATOM 0 HB3 ASP A 696 -9.911 -5.629 9.515 1.00 63.10 H new ATOM 1701 N ARG A 697 -11.751 -9.066 10.203 1.00 11.34 N ATOM 1702 CA ARG A 697 -13.092 -9.602 9.936 1.00 2.22 C ATOM 1703 C ARG A 697 -13.242 -10.115 8.495 1.00 11.04 C ATOM 1704 O ARG A 697 -12.984 -11.286 8.211 1.00 60.04 O ATOM 1705 CB ARG A 697 -14.207 -8.588 10.273 1.00 72.15 C ATOM 1706 CG ARG A 697 -15.611 -9.162 10.137 1.00 2.31 C ATOM 1707 CD ARG A 697 -16.672 -8.106 10.332 1.00 12.13 C ATOM 1708 NE ARG A 697 -18.017 -8.679 10.280 1.00 22.31 N ATOM 1709 CZ ARG A 697 -19.132 -8.004 9.997 1.00 4.32 C ATOM 1710 NH1 ARG A 697 -19.073 -6.734 9.607 1.00 74.03 N ATOM 1711 NH2 ARG A 697 -20.299 -8.615 10.079 1.00 71.02 N ATOM 0 H ARG A 697 -11.286 -9.544 10.975 1.00 11.34 H new ATOM 0 HA ARG A 697 -13.208 -10.456 10.603 1.00 2.22 H new ATOM 0 HB2 ARG A 697 -14.066 -8.231 11.293 1.00 72.15 H new ATOM 0 HB3 ARG A 697 -14.111 -7.723 9.616 1.00 72.15 H new ATOM 0 HG2 ARG A 697 -15.725 -9.613 9.151 1.00 2.31 H new ATOM 0 HG3 ARG A 697 -15.751 -9.957 10.870 1.00 2.31 H new ATOM 0 HD2 ARG A 697 -16.523 -7.612 11.292 1.00 12.13 H new ATOM 0 HD3 ARG A 697 -16.571 -7.341 9.562 1.00 12.13 H new ATOM 0 HE ARG A 697 -18.110 -9.676 10.476 1.00 22.31 H new ATOM 0 HH11 ARG A 697 -18.170 -6.268 9.522 1.00 74.03 H new ATOM 0 HH12 ARG A 697 -19.931 -6.226 9.393 1.00 74.03 H new ATOM 0 HH21 ARG A 697 -20.343 -9.595 10.357 1.00 71.02 H new ATOM 0 HH22 ARG A 697 -21.157 -8.107 9.864 1.00 71.02 H new ATOM 1723 N ASP A 698 -13.610 -9.217 7.598 1.00 1.22 N ATOM 1724 CA ASP A 698 -13.858 -9.517 6.204 1.00 52.45 C ATOM 1725 C ASP A 698 -13.519 -8.326 5.378 1.00 52.52 C ATOM 1726 O ASP A 698 -13.914 -7.197 5.704 1.00 51.23 O ATOM 1727 CB ASP A 698 -15.324 -9.889 5.937 1.00 41.23 C ATOM 1728 CG ASP A 698 -15.740 -11.235 6.469 1.00 5.20 C ATOM 1729 OD1 ASP A 698 -15.525 -12.249 5.771 1.00 62.42 O ATOM 1730 OD2 ASP A 698 -16.321 -11.305 7.570 1.00 53.50 O ATOM 0 H ASP A 698 -13.748 -8.233 7.828 1.00 1.22 H new ATOM 0 HA ASP A 698 -13.237 -10.373 5.942 1.00 52.45 H new ATOM 0 HB2 ASP A 698 -15.964 -9.125 6.379 1.00 41.23 H new ATOM 0 HB3 ASP A 698 -15.499 -9.869 4.861 1.00 41.23 H new ATOM 1735 N ALA A 699 -12.819 -8.552 4.318 1.00 45.22 N ATOM 1736 CA ALA A 699 -12.407 -7.502 3.436 1.00 34.40 C ATOM 1737 C ALA A 699 -12.210 -8.079 2.061 1.00 4.35 C ATOM 1738 O ALA A 699 -12.327 -9.289 1.883 1.00 13.42 O ATOM 1739 CB ALA A 699 -11.114 -6.876 3.942 1.00 64.34 C ATOM 0 H ALA A 699 -12.511 -9.481 4.032 1.00 45.22 H new ATOM 0 HA ALA A 699 -13.170 -6.724 3.398 1.00 34.40 H new ATOM 0 HB1 ALA A 699 -10.807 -6.078 3.266 1.00 64.34 H new ATOM 0 HB2 ALA A 699 -11.274 -6.465 4.939 1.00 64.34 H new ATOM 0 HB3 ALA A 699 -10.334 -7.636 3.984 1.00 64.34 H new ATOM 1745 N GLY A 700 -11.929 -7.238 1.107 1.00 63.52 N ATOM 1746 CA GLY A 700 -11.658 -7.698 -0.222 1.00 74.45 C ATOM 1747 C GLY A 700 -10.226 -7.436 -0.584 1.00 54.15 C ATOM 1748 O GLY A 700 -9.310 -8.031 -0.002 1.00 42.21 O ATOM 0 H GLY A 700 -11.882 -6.226 1.227 1.00 63.52 H new ATOM 0 HA2 GLY A 700 -11.869 -8.765 -0.294 1.00 74.45 H new ATOM 0 HA3 GLY A 700 -12.317 -7.194 -0.929 1.00 74.45 H new ATOM 1752 N VAL A 701 -10.022 -6.518 -1.498 1.00 43.40 N ATOM 1753 CA VAL A 701 -8.689 -6.140 -1.937 1.00 2.21 C ATOM 1754 C VAL A 701 -8.062 -5.218 -0.885 1.00 62.34 C ATOM 1755 O VAL A 701 -6.846 -5.217 -0.669 1.00 63.34 O ATOM 1756 CB VAL A 701 -8.728 -5.440 -3.323 1.00 60.44 C ATOM 1757 CG1 VAL A 701 -7.329 -5.111 -3.808 1.00 32.43 C ATOM 1758 CG2 VAL A 701 -9.447 -6.314 -4.340 1.00 45.51 C ATOM 0 H VAL A 701 -10.773 -6.008 -1.963 1.00 43.40 H new ATOM 0 HA VAL A 701 -8.083 -7.040 -2.046 1.00 2.21 H new ATOM 0 HB VAL A 701 -9.277 -4.505 -3.212 1.00 60.44 H new ATOM 0 HG11 VAL A 701 -7.387 -4.622 -4.780 1.00 32.43 H new ATOM 0 HG12 VAL A 701 -6.844 -4.445 -3.095 1.00 32.43 H new ATOM 0 HG13 VAL A 701 -6.750 -6.030 -3.898 1.00 32.43 H new ATOM 0 HG21 VAL A 701 -9.465 -5.809 -5.306 1.00 45.51 H new ATOM 0 HG22 VAL A 701 -8.923 -7.265 -4.438 1.00 45.51 H new ATOM 0 HG23 VAL A 701 -10.469 -6.496 -4.006 1.00 45.51 H new ATOM 1764 N GLY A 702 -8.904 -4.471 -0.215 1.00 41.44 N ATOM 1765 CA GLY A 702 -8.459 -3.646 0.858 1.00 24.14 C ATOM 1766 C GLY A 702 -8.270 -2.197 0.511 1.00 3.32 C ATOM 1767 O GLY A 702 -7.861 -1.850 -0.599 1.00 43.03 O ATOM 0 H GLY A 702 -9.906 -4.424 -0.402 1.00 41.44 H new ATOM 0 HA2 GLY A 702 -9.179 -3.717 1.673 1.00 24.14 H new ATOM 0 HA3 GLY A 702 -7.514 -4.040 1.231 1.00 24.14 H new ATOM 1771 N PHE A 703 -8.603 -1.361 1.454 1.00 71.01 N ATOM 1772 CA PHE A 703 -8.386 0.050 1.359 1.00 60.34 C ATOM 1773 C PHE A 703 -7.443 0.471 2.492 1.00 12.53 C ATOM 1774 O PHE A 703 -7.635 0.047 3.637 1.00 42.10 O ATOM 1775 CB PHE A 703 -9.735 0.801 1.440 1.00 62.25 C ATOM 1776 CG PHE A 703 -9.618 2.301 1.379 1.00 21.22 C ATOM 1777 CD1 PHE A 703 -9.302 2.936 0.190 1.00 31.34 C ATOM 1778 CD2 PHE A 703 -9.826 3.073 2.513 1.00 14.02 C ATOM 1779 CE1 PHE A 703 -9.188 4.308 0.131 1.00 35.50 C ATOM 1780 CE2 PHE A 703 -9.717 4.449 2.459 1.00 54.33 C ATOM 1781 CZ PHE A 703 -9.395 5.066 1.268 1.00 71.53 C ATOM 0 H PHE A 703 -9.042 -1.651 2.328 1.00 71.01 H new ATOM 0 HA PHE A 703 -7.930 0.302 0.402 1.00 60.34 H new ATOM 0 HB2 PHE A 703 -10.373 0.465 0.623 1.00 62.25 H new ATOM 0 HB3 PHE A 703 -10.235 0.525 2.369 1.00 62.25 H new ATOM 0 HD1 PHE A 703 -9.143 2.349 -0.702 1.00 31.34 H new ATOM 0 HD2 PHE A 703 -10.076 2.593 3.448 1.00 14.02 H new ATOM 0 HE1 PHE A 703 -8.937 4.790 -0.802 1.00 35.50 H new ATOM 0 HE2 PHE A 703 -9.884 5.040 3.347 1.00 54.33 H new ATOM 0 HZ PHE A 703 -9.305 6.141 1.224 1.00 71.53 H new ATOM 1791 N PRO A 704 -6.385 1.245 2.192 1.00 33.55 N ATOM 1792 CA PRO A 704 -5.490 1.769 3.219 1.00 12.12 C ATOM 1793 C PRO A 704 -6.147 2.923 3.965 1.00 60.53 C ATOM 1794 O PRO A 704 -6.823 3.751 3.364 1.00 74.23 O ATOM 1795 CB PRO A 704 -4.282 2.270 2.428 1.00 22.24 C ATOM 1796 CG PRO A 704 -4.819 2.590 1.075 1.00 41.12 C ATOM 1797 CD PRO A 704 -5.969 1.646 0.837 1.00 61.11 C ATOM 0 HA PRO A 704 -5.229 1.023 3.970 1.00 12.12 H new ATOM 0 HB2 PRO A 704 -3.840 3.149 2.896 1.00 22.24 H new ATOM 0 HB3 PRO A 704 -3.502 1.511 2.375 1.00 22.24 H new ATOM 0 HG2 PRO A 704 -5.151 3.627 1.025 1.00 41.12 H new ATOM 0 HG3 PRO A 704 -4.050 2.465 0.313 1.00 41.12 H new ATOM 0 HD2 PRO A 704 -6.781 2.134 0.298 1.00 61.11 H new ATOM 0 HD3 PRO A 704 -5.663 0.786 0.242 1.00 61.11 H new ATOM 1805 N GLU A 705 -5.962 2.972 5.246 1.00 60.53 N ATOM 1806 CA GLU A 705 -6.564 3.988 6.043 1.00 35.54 C ATOM 1807 C GLU A 705 -5.473 4.649 6.912 1.00 32.15 C ATOM 1808 O GLU A 705 -4.512 3.988 7.311 1.00 13.02 O ATOM 1809 CB GLU A 705 -7.662 3.329 6.867 1.00 13.33 C ATOM 1810 CG GLU A 705 -8.898 4.172 7.046 1.00 43.13 C ATOM 1811 CD GLU A 705 -8.699 5.376 7.911 1.00 10.45 C ATOM 1812 OE1 GLU A 705 -8.299 6.431 7.385 1.00 75.22 O ATOM 1813 OE2 GLU A 705 -8.955 5.283 9.141 1.00 33.31 O ATOM 0 H GLU A 705 -5.389 2.308 5.767 1.00 60.53 H new ATOM 0 HA GLU A 705 -7.014 4.779 5.443 1.00 35.54 H new ATOM 0 HB2 GLU A 705 -7.943 2.390 6.390 1.00 13.33 H new ATOM 0 HB3 GLU A 705 -7.262 3.080 7.850 1.00 13.33 H new ATOM 0 HG2 GLU A 705 -9.248 4.496 6.066 1.00 43.13 H new ATOM 0 HG3 GLU A 705 -9.686 3.555 7.478 1.00 43.13 H new ATOM 1820 N TYR A 706 -5.634 5.919 7.201 1.00 0.32 N ATOM 1821 CA TYR A 706 -4.601 6.725 7.848 1.00 1.31 C ATOM 1822 C TYR A 706 -4.771 6.788 9.381 1.00 4.43 C ATOM 1823 O TYR A 706 -5.876 6.850 9.892 1.00 43.34 O ATOM 1824 CB TYR A 706 -4.596 8.126 7.209 1.00 52.14 C ATOM 1825 CG TYR A 706 -3.569 9.095 7.742 1.00 35.30 C ATOM 1826 CD1 TYR A 706 -2.247 8.714 7.960 1.00 74.42 C ATOM 1827 CD2 TYR A 706 -3.926 10.392 8.023 1.00 64.52 C ATOM 1828 CE1 TYR A 706 -1.323 9.611 8.445 1.00 2.11 C ATOM 1829 CE2 TYR A 706 -3.014 11.292 8.502 1.00 23.42 C ATOM 1830 CZ TYR A 706 -1.714 10.904 8.713 1.00 21.13 C ATOM 1831 OH TYR A 706 -0.813 11.815 9.203 1.00 11.32 O ATOM 0 H TYR A 706 -6.490 6.435 6.996 1.00 0.32 H new ATOM 0 HA TYR A 706 -3.633 6.250 7.687 1.00 1.31 H new ATOM 0 HB2 TYR A 706 -4.437 8.013 6.137 1.00 52.14 H new ATOM 0 HB3 TYR A 706 -5.584 8.567 7.340 1.00 52.14 H new ATOM 0 HD1 TYR A 706 -1.943 7.700 7.745 1.00 74.42 H new ATOM 0 HD2 TYR A 706 -4.947 10.707 7.863 1.00 64.52 H new ATOM 0 HE1 TYR A 706 -0.301 9.304 8.614 1.00 2.11 H new ATOM 0 HE2 TYR A 706 -3.316 12.307 8.714 1.00 23.42 H new ATOM 0 HH TYR A 706 0.017 11.766 8.684 1.00 11.32 H new ATOM 1841 N GLN A 707 -3.651 6.770 10.094 1.00 50.25 N ATOM 1842 CA GLN A 707 -3.628 6.776 11.568 1.00 22.32 C ATOM 1843 C GLN A 707 -3.480 8.167 12.199 1.00 4.21 C ATOM 1844 O GLN A 707 -2.777 8.335 13.195 1.00 23.31 O ATOM 1845 CB GLN A 707 -2.590 5.758 12.090 1.00 62.21 C ATOM 1846 CG GLN A 707 -1.243 5.762 11.391 1.00 70.23 C ATOM 1847 CD GLN A 707 -0.281 6.901 11.691 1.00 21.41 C ATOM 1848 OE1 GLN A 707 0.467 7.333 10.816 1.00 21.12 O ATOM 1849 NE2 GLN A 707 -0.194 7.290 12.914 1.00 2.11 N ATOM 0 H GLN A 707 -2.723 6.751 9.671 1.00 50.25 H new ATOM 0 HA GLN A 707 -4.617 6.456 11.897 1.00 22.32 H new ATOM 0 HB2 GLN A 707 -2.427 5.947 13.151 1.00 62.21 H new ATOM 0 HB3 GLN A 707 -3.017 4.759 12.007 1.00 62.21 H new ATOM 0 HG2 GLN A 707 -0.739 4.827 11.635 1.00 70.23 H new ATOM 0 HG3 GLN A 707 -1.426 5.755 10.316 1.00 70.23 H new ATOM 0 HE21 GLN A 707 -0.830 6.912 13.616 1.00 2.11 H new ATOM 0 HE22 GLN A 707 0.511 7.977 13.182 1.00 2.11 H new ATOM 1857 N GLU A 708 -4.202 9.140 11.642 1.00 64.21 N ATOM 1858 CA GLU A 708 -4.278 10.528 12.164 1.00 23.43 C ATOM 1859 C GLU A 708 -2.985 11.324 11.967 1.00 44.50 C ATOM 1860 O GLU A 708 -2.991 12.344 11.270 1.00 10.12 O ATOM 1861 CB GLU A 708 -4.725 10.547 13.628 1.00 3.25 C ATOM 1862 CG GLU A 708 -6.050 9.853 13.858 1.00 34.21 C ATOM 1863 CD GLU A 708 -6.450 9.830 15.297 1.00 62.14 C ATOM 1864 OE1 GLU A 708 -5.909 9.010 16.062 1.00 62.02 O ATOM 1865 OE2 GLU A 708 -7.334 10.610 15.686 1.00 12.43 O ATOM 0 H GLU A 708 -4.763 8.996 10.802 1.00 64.21 H new ATOM 0 HA GLU A 708 -5.036 11.034 11.566 1.00 23.43 H new ATOM 0 HB2 GLU A 708 -3.961 10.068 14.240 1.00 3.25 H new ATOM 0 HB3 GLU A 708 -4.801 11.581 13.964 1.00 3.25 H new ATOM 0 HG2 GLU A 708 -6.824 10.357 13.279 1.00 34.21 H new ATOM 0 HG3 GLU A 708 -5.988 8.830 13.486 1.00 34.21 H new ATOM 1872 N GLU A 709 -1.888 10.878 12.565 1.00 11.12 N ATOM 1873 CA GLU A 709 -0.611 11.556 12.401 1.00 42.04 C ATOM 1874 C GLU A 709 0.537 10.778 13.021 1.00 15.02 C ATOM 1875 O GLU A 709 0.375 10.084 14.037 1.00 45.40 O ATOM 1876 CB GLU A 709 -0.630 12.991 13.004 1.00 31.12 C ATOM 1877 CG GLU A 709 0.667 13.766 12.768 1.00 12.32 C ATOM 1878 CD GLU A 709 0.700 15.117 13.419 1.00 14.13 C ATOM 1879 OE1 GLU A 709 0.296 16.098 12.788 1.00 44.45 O ATOM 1880 OE2 GLU A 709 1.164 15.221 14.560 1.00 70.44 O ATOM 0 H GLU A 709 -1.857 10.054 13.165 1.00 11.12 H new ATOM 0 HA GLU A 709 -0.452 11.623 11.325 1.00 42.04 H new ATOM 0 HB2 GLU A 709 -1.461 13.548 12.571 1.00 31.12 H new ATOM 0 HB3 GLU A 709 -0.815 12.924 14.076 1.00 31.12 H new ATOM 0 HG2 GLU A 709 1.504 13.175 13.140 1.00 12.32 H new ATOM 0 HG3 GLU A 709 0.815 13.888 11.695 1.00 12.32 H new ATOM 1887 N ASP A 710 1.668 10.881 12.375 1.00 11.34 N ATOM 1888 CA ASP A 710 2.941 10.455 12.891 1.00 55.10 C ATOM 1889 C ASP A 710 3.902 11.570 12.534 1.00 71.13 C ATOM 1890 O ASP A 710 3.648 12.314 11.563 1.00 12.12 O ATOM 1891 CB ASP A 710 3.421 9.119 12.301 1.00 41.14 C ATOM 1892 CG ASP A 710 4.772 8.690 12.886 1.00 61.25 C ATOM 1893 OD1 ASP A 710 5.824 9.112 12.363 1.00 34.40 O ATOM 1894 OD2 ASP A 710 4.801 7.963 13.906 1.00 53.33 O ATOM 0 H ASP A 710 1.730 11.280 11.438 1.00 11.34 H new ATOM 0 HA ASP A 710 2.874 10.276 13.964 1.00 55.10 H new ATOM 0 HB2 ASP A 710 2.678 8.347 12.499 1.00 41.14 H new ATOM 0 HB3 ASP A 710 3.506 9.210 11.218 1.00 41.14 H new ATOM 1899 N ASN A 711 4.960 11.720 13.279 1.00 63.01 N ATOM 1900 CA ASN A 711 5.872 12.820 13.066 1.00 25.52 C ATOM 1901 C ASN A 711 6.754 12.657 11.829 1.00 21.04 C ATOM 1902 O ASN A 711 7.233 13.656 11.292 1.00 20.10 O ATOM 1903 CB ASN A 711 6.703 13.145 14.319 1.00 75.43 C ATOM 1904 CG ASN A 711 5.852 13.641 15.490 1.00 52.41 C ATOM 1905 OD1 ASN A 711 5.582 14.837 15.618 1.00 62.53 O ATOM 1906 ND2 ASN A 711 5.449 12.743 16.354 1.00 2.22 N ATOM 0 H ASN A 711 5.217 11.095 14.043 1.00 63.01 H new ATOM 0 HA ASN A 711 5.234 13.681 12.866 1.00 25.52 H new ATOM 0 HB2 ASN A 711 7.250 12.254 14.627 1.00 75.43 H new ATOM 0 HB3 ASN A 711 7.445 13.904 14.069 1.00 75.43 H new ATOM 0 HD21 ASN A 711 4.894 13.026 17.162 1.00 2.22 H new ATOM 0 HD22 ASN A 711 5.690 11.761 16.219 1.00 2.22 H new ATOM 1912 N SER A 712 6.970 11.426 11.353 1.00 21.45 N ATOM 1913 CA SER A 712 7.793 11.259 10.159 1.00 10.34 C ATOM 1914 C SER A 712 7.517 9.975 9.350 1.00 41.21 C ATOM 1915 O SER A 712 7.722 9.958 8.125 1.00 5.41 O ATOM 1916 CB SER A 712 9.287 11.428 10.465 1.00 32.22 C ATOM 1917 OG SER A 712 9.730 10.518 11.465 1.00 13.55 O ATOM 0 H SER A 712 6.602 10.565 11.759 1.00 21.45 H new ATOM 0 HA SER A 712 7.484 12.071 9.501 1.00 10.34 H new ATOM 0 HB2 SER A 712 9.864 11.274 9.553 1.00 32.22 H new ATOM 0 HB3 SER A 712 9.477 12.450 10.794 1.00 32.22 H new ATOM 0 HG SER A 712 10.686 10.655 11.631 1.00 13.55 H new ATOM 1923 N THR A 713 7.050 8.927 9.998 1.00 62.33 N ATOM 1924 CA THR A 713 6.788 7.679 9.322 1.00 10.14 C ATOM 1925 C THR A 713 5.295 7.385 9.355 1.00 60.23 C ATOM 1926 O THR A 713 4.762 6.901 10.359 1.00 2.55 O ATOM 1927 CB THR A 713 7.570 6.520 9.976 1.00 25.33 C ATOM 1928 OG1 THR A 713 8.969 6.871 10.022 1.00 1.01 O ATOM 1929 CG2 THR A 713 7.405 5.229 9.173 1.00 62.43 C ATOM 0 H THR A 713 6.844 8.918 10.997 1.00 62.33 H new ATOM 0 HA THR A 713 7.119 7.769 8.288 1.00 10.14 H new ATOM 0 HB THR A 713 7.181 6.356 10.981 1.00 25.33 H new ATOM 0 HG1 THR A 713 9.476 6.142 10.437 1.00 1.01 H new ATOM 0 HG21 THR A 713 7.965 4.427 9.654 1.00 62.43 H new ATOM 0 HG22 THR A 713 6.350 4.959 9.130 1.00 62.43 H new ATOM 0 HG23 THR A 713 7.782 5.379 8.161 1.00 62.43 H new ATOM 1935 N TYR A 714 4.632 7.695 8.274 1.00 45.23 N ATOM 1936 CA TYR A 714 3.199 7.558 8.193 1.00 14.13 C ATOM 1937 C TYR A 714 2.812 6.088 8.118 1.00 3.54 C ATOM 1938 O TYR A 714 3.357 5.326 7.304 1.00 0.14 O ATOM 1939 CB TYR A 714 2.659 8.335 6.987 1.00 22.02 C ATOM 1940 CG TYR A 714 2.977 9.830 7.011 1.00 31.32 C ATOM 1941 CD1 TYR A 714 4.199 10.308 6.552 1.00 24.23 C ATOM 1942 CD2 TYR A 714 2.057 10.759 7.478 1.00 43.05 C ATOM 1943 CE1 TYR A 714 4.487 11.648 6.553 1.00 51.42 C ATOM 1944 CE2 TYR A 714 2.347 12.114 7.483 1.00 52.03 C ATOM 1945 CZ TYR A 714 3.565 12.549 7.016 1.00 34.42 C ATOM 1946 OH TYR A 714 3.862 13.901 6.999 1.00 34.20 O ATOM 0 H TYR A 714 5.068 8.050 7.423 1.00 45.23 H new ATOM 0 HA TYR A 714 2.752 7.978 9.094 1.00 14.13 H new ATOM 0 HB2 TYR A 714 3.071 7.902 6.076 1.00 22.02 H new ATOM 0 HB3 TYR A 714 1.578 8.206 6.940 1.00 22.02 H new ATOM 0 HD1 TYR A 714 4.937 9.609 6.187 1.00 24.23 H new ATOM 0 HD2 TYR A 714 1.099 10.420 7.844 1.00 43.05 H new ATOM 0 HE1 TYR A 714 5.443 11.994 6.188 1.00 51.42 H new ATOM 0 HE2 TYR A 714 1.621 12.824 7.851 1.00 52.03 H new ATOM 0 HH TYR A 714 3.104 14.407 7.359 1.00 34.20 H new ATOM 1956 N ASN A 715 1.909 5.689 8.977 1.00 73.42 N ATOM 1957 CA ASN A 715 1.475 4.308 9.041 1.00 34.25 C ATOM 1958 C ASN A 715 0.077 4.223 8.456 1.00 71.21 C ATOM 1959 O ASN A 715 -0.678 5.204 8.493 1.00 23.40 O ATOM 1960 CB ASN A 715 1.419 3.842 10.489 1.00 22.22 C ATOM 1961 CG ASN A 715 1.278 2.318 10.675 1.00 74.43 C ATOM 1962 OD1 ASN A 715 0.718 1.876 11.650 1.00 41.21 O ATOM 1963 ND2 ASN A 715 1.766 1.522 9.753 1.00 64.13 N ATOM 0 H ASN A 715 1.453 6.305 9.650 1.00 73.42 H new ATOM 0 HA ASN A 715 2.174 3.681 8.487 1.00 34.25 H new ATOM 0 HB2 ASN A 715 2.324 4.173 10.997 1.00 22.22 H new ATOM 0 HB3 ASN A 715 0.579 4.333 10.981 1.00 22.22 H new ATOM 0 HD21 ASN A 715 1.676 0.511 9.852 1.00 64.13 H new ATOM 0 HD22 ASN A 715 2.235 1.914 8.937 1.00 64.13 H new ATOM 1969 N PHE A 716 -0.278 3.090 7.923 1.00 43.54 N ATOM 1970 CA PHE A 716 -1.580 2.911 7.318 1.00 61.00 C ATOM 1971 C PHE A 716 -2.170 1.570 7.646 1.00 11.11 C ATOM 1972 O PHE A 716 -1.464 0.577 7.675 1.00 31.32 O ATOM 1973 CB PHE A 716 -1.504 3.121 5.790 1.00 74.21 C ATOM 1974 CG PHE A 716 -1.325 4.559 5.409 1.00 35.04 C ATOM 1975 CD1 PHE A 716 -0.061 5.122 5.305 1.00 32.35 C ATOM 1976 CD2 PHE A 716 -2.426 5.360 5.182 1.00 1.54 C ATOM 1977 CE1 PHE A 716 0.090 6.454 4.982 1.00 33.21 C ATOM 1978 CE2 PHE A 716 -2.278 6.689 4.862 1.00 14.04 C ATOM 1979 CZ PHE A 716 -1.020 7.235 4.764 1.00 13.31 C ATOM 0 H PHE A 716 0.319 2.263 7.892 1.00 43.54 H new ATOM 0 HA PHE A 716 -2.243 3.667 7.739 1.00 61.00 H new ATOM 0 HB2 PHE A 716 -0.675 2.538 5.389 1.00 74.21 H new ATOM 0 HB3 PHE A 716 -2.415 2.739 5.330 1.00 74.21 H new ATOM 0 HD1 PHE A 716 0.813 4.511 5.479 1.00 32.35 H new ATOM 0 HD2 PHE A 716 -3.417 4.937 5.257 1.00 1.54 H new ATOM 0 HE1 PHE A 716 1.078 6.883 4.900 1.00 33.21 H new ATOM 0 HE2 PHE A 716 -3.149 7.303 4.688 1.00 14.04 H new ATOM 0 HZ PHE A 716 -0.904 8.280 4.515 1.00 13.31 H new ATOM 1989 N ARG A 717 -3.460 1.548 7.921 1.00 75.23 N ATOM 1990 CA ARG A 717 -4.164 0.307 8.148 1.00 63.43 C ATOM 1991 C ARG A 717 -4.828 -0.100 6.880 1.00 72.34 C ATOM 1992 O ARG A 717 -5.771 0.526 6.453 1.00 24.24 O ATOM 1993 CB ARG A 717 -5.234 0.392 9.246 1.00 3.42 C ATOM 1994 CG ARG A 717 -4.770 0.353 10.698 1.00 73.35 C ATOM 1995 CD ARG A 717 -3.933 1.539 11.108 1.00 63.55 C ATOM 1996 NE ARG A 717 -3.693 1.541 12.568 1.00 21.23 N ATOM 1997 CZ ARG A 717 -2.684 2.147 13.204 1.00 74.31 C ATOM 1998 NH1 ARG A 717 -1.706 2.689 12.522 1.00 53.30 N ATOM 1999 NH2 ARG A 717 -2.648 2.178 14.528 1.00 10.41 N ATOM 0 H ARG A 717 -4.042 2.383 7.992 1.00 75.23 H new ATOM 0 HA ARG A 717 -3.422 -0.418 8.481 1.00 63.43 H new ATOM 0 HB2 ARG A 717 -5.793 1.316 9.098 1.00 3.42 H new ATOM 0 HB3 ARG A 717 -5.933 -0.431 9.096 1.00 3.42 H new ATOM 0 HG2 ARG A 717 -5.644 0.297 11.346 1.00 73.35 H new ATOM 0 HG3 ARG A 717 -4.194 -0.558 10.860 1.00 73.35 H new ATOM 0 HD2 ARG A 717 -2.980 1.516 10.580 1.00 63.55 H new ATOM 0 HD3 ARG A 717 -4.436 2.461 10.818 1.00 63.55 H new ATOM 0 HE ARG A 717 -4.361 1.031 13.145 1.00 21.23 H new ATOM 0 HH11 ARG A 717 -1.712 2.650 11.503 1.00 53.30 H new ATOM 0 HH12 ARG A 717 -0.938 3.150 13.010 1.00 53.30 H new ATOM 0 HH21 ARG A 717 -3.393 1.738 15.069 1.00 10.41 H new ATOM 0 HH22 ARG A 717 -1.876 2.642 15.006 1.00 10.41 H new ATOM 2011 N TRP A 718 -4.330 -1.104 6.273 1.00 0.23 N ATOM 2012 CA TRP A 718 -4.898 -1.595 5.056 1.00 31.12 C ATOM 2013 C TRP A 718 -5.613 -2.879 5.414 1.00 12.23 C ATOM 2014 O TRP A 718 -4.983 -3.857 5.818 1.00 3.53 O ATOM 2015 CB TRP A 718 -3.765 -1.860 4.052 1.00 54.21 C ATOM 2016 CG TRP A 718 -4.175 -2.179 2.636 1.00 24.41 C ATOM 2017 CD1 TRP A 718 -5.075 -3.113 2.222 1.00 2.34 C ATOM 2018 CD2 TRP A 718 -3.631 -1.590 1.436 1.00 11.33 C ATOM 2019 NE1 TRP A 718 -5.144 -3.128 0.852 1.00 40.31 N ATOM 2020 CE2 TRP A 718 -4.271 -2.208 0.348 1.00 22.43 C ATOM 2021 CE3 TRP A 718 -2.671 -0.595 1.176 1.00 51.25 C ATOM 2022 CZ2 TRP A 718 -3.988 -1.875 -0.969 1.00 55.33 C ATOM 2023 CZ3 TRP A 718 -2.395 -0.269 -0.135 1.00 15.01 C ATOM 2024 CH2 TRP A 718 -3.050 -0.907 -1.189 1.00 24.13 C ATOM 0 H TRP A 718 -3.512 -1.620 6.597 1.00 0.23 H new ATOM 0 HA TRP A 718 -5.590 -0.886 4.602 1.00 31.12 H new ATOM 0 HB2 TRP A 718 -3.118 -0.983 4.029 1.00 54.21 H new ATOM 0 HB3 TRP A 718 -3.165 -2.689 4.427 1.00 54.21 H new ATOM 0 HD1 TRP A 718 -5.651 -3.750 2.877 1.00 2.34 H new ATOM 0 HE1 TRP A 718 -5.752 -3.731 0.298 1.00 40.31 H new ATOM 0 HE3 TRP A 718 -2.161 -0.097 1.987 1.00 51.25 H new ATOM 0 HZ2 TRP A 718 -4.491 -2.364 -1.790 1.00 55.33 H new ATOM 0 HZ3 TRP A 718 -1.660 0.493 -0.350 1.00 15.01 H new ATOM 0 HH2 TRP A 718 -2.809 -0.628 -2.204 1.00 24.13 H new ATOM 2035 N TYR A 719 -6.906 -2.876 5.313 1.00 21.11 N ATOM 2036 CA TYR A 719 -7.664 -4.042 5.679 1.00 1.33 C ATOM 2037 C TYR A 719 -7.983 -4.827 4.442 1.00 11.11 C ATOM 2038 O TYR A 719 -8.816 -4.426 3.644 1.00 20.13 O ATOM 2039 CB TYR A 719 -8.943 -3.639 6.400 1.00 2.23 C ATOM 2040 CG TYR A 719 -8.706 -2.794 7.623 1.00 12.11 C ATOM 2041 CD1 TYR A 719 -8.412 -3.376 8.837 1.00 13.34 C ATOM 2042 CD2 TYR A 719 -8.783 -1.404 7.561 1.00 31.52 C ATOM 2043 CE1 TYR A 719 -8.202 -2.610 9.964 1.00 72.03 C ATOM 2044 CE2 TYR A 719 -8.570 -0.631 8.683 1.00 21.11 C ATOM 2045 CZ TYR A 719 -8.282 -1.238 9.877 1.00 23.43 C ATOM 2046 OH TYR A 719 -8.079 -0.467 10.996 1.00 20.15 O ATOM 0 H TYR A 719 -7.460 -2.086 4.983 1.00 21.11 H new ATOM 0 HA TYR A 719 -7.076 -4.660 6.357 1.00 1.33 H new ATOM 0 HB2 TYR A 719 -9.582 -3.091 5.708 1.00 2.23 H new ATOM 0 HB3 TYR A 719 -9.485 -4.539 6.690 1.00 2.23 H new ATOM 0 HD1 TYR A 719 -8.345 -4.452 8.907 1.00 13.34 H new ATOM 0 HD2 TYR A 719 -9.013 -0.925 6.621 1.00 31.52 H new ATOM 0 HE1 TYR A 719 -7.976 -3.083 10.908 1.00 72.03 H new ATOM 0 HE2 TYR A 719 -8.630 0.446 8.621 1.00 21.11 H new ATOM 0 HH TYR A 719 -8.170 0.480 10.762 1.00 20.15 H new ATOM 2056 N THR A 720 -7.325 -5.931 4.291 1.00 13.55 N ATOM 2057 CA THR A 720 -7.444 -6.737 3.110 1.00 70.31 C ATOM 2058 C THR A 720 -7.593 -8.207 3.451 1.00 43.25 C ATOM 2059 O THR A 720 -7.011 -8.691 4.430 1.00 15.51 O ATOM 2060 CB THR A 720 -6.255 -6.524 2.134 1.00 54.25 C ATOM 2061 OG1 THR A 720 -6.407 -7.334 0.970 1.00 24.54 O ATOM 2062 CG2 THR A 720 -4.940 -6.845 2.787 1.00 61.02 C ATOM 0 H THR A 720 -6.682 -6.306 4.989 1.00 13.55 H new ATOM 0 HA THR A 720 -8.352 -6.410 2.603 1.00 70.31 H new ATOM 0 HB THR A 720 -6.258 -5.471 1.851 1.00 54.25 H new ATOM 0 HG1 THR A 720 -6.427 -6.763 0.174 1.00 24.54 H new ATOM 0 HG21 THR A 720 -4.131 -6.684 2.074 1.00 61.02 H new ATOM 0 HG22 THR A 720 -4.796 -6.197 3.652 1.00 61.02 H new ATOM 0 HG23 THR A 720 -4.938 -7.886 3.109 1.00 61.02 H new ATOM 2068 N SER A 721 -8.384 -8.909 2.664 1.00 15.04 N ATOM 2069 CA SER A 721 -8.553 -10.334 2.827 1.00 10.11 C ATOM 2070 C SER A 721 -7.229 -11.030 2.465 1.00 5.33 C ATOM 2071 O SER A 721 -6.926 -12.094 2.952 1.00 1.55 O ATOM 2072 CB SER A 721 -9.705 -10.837 1.933 1.00 15.44 C ATOM 2073 OG SER A 721 -9.987 -12.217 2.138 1.00 63.02 O ATOM 0 H SER A 721 -8.924 -8.507 1.898 1.00 15.04 H new ATOM 0 HA SER A 721 -8.810 -10.566 3.861 1.00 10.11 H new ATOM 0 HB2 SER A 721 -10.602 -10.251 2.136 1.00 15.44 H new ATOM 0 HB3 SER A 721 -9.448 -10.673 0.887 1.00 15.44 H new ATOM 0 HG SER A 721 -10.724 -12.491 1.552 1.00 63.02 H new ATOM 2079 N TYR A 722 -6.435 -10.376 1.631 1.00 71.01 N ATOM 2080 CA TYR A 722 -5.144 -10.904 1.184 1.00 40.32 C ATOM 2081 C TYR A 722 -4.110 -11.007 2.311 1.00 50.32 C ATOM 2082 O TYR A 722 -3.053 -11.605 2.136 1.00 64.23 O ATOM 2083 CB TYR A 722 -4.594 -10.087 0.022 1.00 23.42 C ATOM 2084 CG TYR A 722 -5.386 -10.224 -1.254 1.00 71.12 C ATOM 2085 CD1 TYR A 722 -6.508 -9.443 -1.508 1.00 43.44 C ATOM 2086 CD2 TYR A 722 -5.004 -11.141 -2.210 1.00 60.53 C ATOM 2087 CE1 TYR A 722 -7.217 -9.581 -2.683 1.00 54.42 C ATOM 2088 CE2 TYR A 722 -5.702 -11.285 -3.384 1.00 73.45 C ATOM 2089 CZ TYR A 722 -6.805 -10.506 -3.616 1.00 63.52 C ATOM 2090 OH TYR A 722 -7.497 -10.650 -4.788 1.00 41.01 O ATOM 0 H TYR A 722 -6.663 -9.462 1.241 1.00 71.01 H new ATOM 0 HA TYR A 722 -5.333 -11.922 0.843 1.00 40.32 H new ATOM 0 HB2 TYR A 722 -4.568 -9.036 0.310 1.00 23.42 H new ATOM 0 HB3 TYR A 722 -3.564 -10.391 -0.167 1.00 23.42 H new ATOM 0 HD1 TYR A 722 -6.829 -8.718 -0.775 1.00 43.44 H new ATOM 0 HD2 TYR A 722 -4.137 -11.760 -2.032 1.00 60.53 H new ATOM 0 HE1 TYR A 722 -8.087 -8.969 -2.870 1.00 54.42 H new ATOM 0 HE2 TYR A 722 -5.383 -12.008 -4.120 1.00 73.45 H new ATOM 0 HH TYR A 722 -7.073 -11.344 -5.335 1.00 41.01 H new ATOM 2100 N ALA A 723 -4.413 -10.421 3.459 1.00 74.54 N ATOM 2101 CA ALA A 723 -3.510 -10.471 4.600 1.00 23.11 C ATOM 2102 C ALA A 723 -3.728 -11.747 5.417 1.00 32.21 C ATOM 2103 O ALA A 723 -3.131 -11.937 6.481 1.00 33.34 O ATOM 2104 CB ALA A 723 -3.689 -9.242 5.472 1.00 65.13 C ATOM 0 H ALA A 723 -5.277 -9.905 3.626 1.00 74.54 H new ATOM 0 HA ALA A 723 -2.487 -10.483 4.223 1.00 23.11 H new ATOM 0 HB1 ALA A 723 -3.007 -9.295 6.320 1.00 65.13 H new ATOM 0 HB2 ALA A 723 -3.473 -8.347 4.888 1.00 65.13 H new ATOM 0 HB3 ALA A 723 -4.716 -9.200 5.835 1.00 65.13 H new ATOM 2110 N CYS A 724 -4.582 -12.605 4.920 1.00 63.32 N ATOM 2111 CA CYS A 724 -4.866 -13.868 5.541 1.00 12.45 C ATOM 2112 C CYS A 724 -5.171 -14.886 4.444 1.00 24.34 C ATOM 2113 O CYS A 724 -5.547 -14.495 3.339 1.00 55.50 O ATOM 2114 CB CYS A 724 -6.056 -13.726 6.513 1.00 64.13 C ATOM 2115 SG CYS A 724 -7.591 -13.091 5.748 1.00 62.13 S ATOM 0 H CYS A 724 -5.106 -12.441 4.060 1.00 63.32 H new ATOM 0 HA CYS A 724 -4.007 -14.207 6.120 1.00 12.45 H new ATOM 0 HB2 CYS A 724 -6.263 -14.699 6.958 1.00 64.13 H new ATOM 0 HB3 CYS A 724 -5.767 -13.059 7.325 1.00 64.13 H new ATOM 2120 N PRO A 725 -4.969 -16.189 4.693 1.00 73.01 N ATOM 2121 CA PRO A 725 -5.282 -17.222 3.715 1.00 43.51 C ATOM 2122 C PRO A 725 -6.791 -17.455 3.626 1.00 33.14 C ATOM 2123 O PRO A 725 -7.455 -16.840 2.773 1.00 37.95 O ATOM 2124 CB PRO A 725 -4.568 -18.480 4.259 1.00 63.22 C ATOM 2125 CG PRO A 725 -3.740 -18.007 5.414 1.00 61.11 C ATOM 2126 CD PRO A 725 -4.409 -16.767 5.919 1.00 74.31 C ATOM 2127 OXT PRO A 725 -7.326 -18.244 4.424 1.00 37.95 O ATOM 0 HA PRO A 725 -4.959 -16.954 2.709 1.00 43.51 H new ATOM 0 HB2 PRO A 725 -5.289 -19.233 4.576 1.00 63.22 H new ATOM 0 HB3 PRO A 725 -3.944 -18.939 3.492 1.00 63.22 H new ATOM 0 HG2 PRO A 725 -3.687 -18.767 6.193 1.00 61.11 H new ATOM 0 HG3 PRO A 725 -2.717 -17.799 5.101 1.00 61.11 H new ATOM 0 HD2 PRO A 725 -5.183 -16.993 6.652 1.00 74.31 H new ATOM 0 HD3 PRO A 725 -3.702 -16.091 6.400 1.00 74.31 H new TER 2135 PRO A 725