USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=41 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 681 ASN : amide:sc= 2.4 K(o=3.1,f=-8.9!) USER MOD Set 1.2: A 685 THR OG1 : rot 180:sc= 0.691 USER MOD Set 2.1: A 670 GLN :FLIP amide:sc= -1.38 F(o=-4,f=-3.3) USER MOD Set 2.2: A 692 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: A 711 ASN : amide:sc= -0.208 K(o=-3.3,f=-4.7) USER MOD Set 2.4: A 715 ASN : amide:sc= -1.7! K(o=-3.3!,f=-5.9) USER MOD Set 3.1: A 663 SER OG : rot -40:sc= 2.15 USER MOD Set 3.2: A 672 THR OG1 : rot 107:sc= 0.98 USER MOD Set 4.1: A 587 THR OG1 : rot -140:sc= 0 USER MOD Set 4.2: A 598 GLN : amide:sc= 0.772 K(o=0.77,f=-1.4) USER MOD Single : A 585 SER OG : rot 180:sc= 0 USER MOD Single : A 591 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 593 THR OG1 : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= 0.0584 USER MOD Single : A 602 SER OG : rot 25:sc= 0.132 USER MOD Single : A 606 THR OG1 : rot 152:sc= 1.28 USER MOD Single : A 609 THR OG1 : rot -77:sc= 1.2 USER MOD Single : A 610 LYS NZ :NH3+ -168:sc=-0.00567 (180deg=-0.135) USER MOD Single : A 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 TYR OH : rot 20:sc= 0.536 USER MOD Single : A 615 LYS NZ :NH3+ -160:sc= 0.00121 (180deg=0) USER MOD Single : A 618 THR OG1 : rot -39:sc= 0.755 USER MOD Single : A 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : +bothHN:sc= -3.14! C(o=-3.1!,f=-7.3!) USER MOD Single : A 626 ASN : amide:sc= 0.0434 K(o=0.043,f=-7.6!) USER MOD Single : A 632 SER OG : rot 180:sc= 0 USER MOD Single : A 640 SER OG : rot -40:sc= 0.295 USER MOD Single : A 644 GLN : amide:sc= -0.876 X(o=-0.88,f=-0.65) USER MOD Single : A 646 SER OG : rot -170:sc= 0.523 USER MOD Single : A 648 SER OG : rot 170:sc= -0.867 USER MOD Single : A 651 LYS NZ :NH3+ 161:sc= 1.24 (180deg=0.96) USER MOD Single : A 652 SER OG : rot -162:sc= 0.173 USER MOD Single : A 654 ASN : amide:sc= 0.456 K(o=0.46,f=-7.6!) USER MOD Single : A 658 SER OG : rot 160:sc= -0.593 USER MOD Single : A 659 ASN : amide:sc= -3.76! C(o=-3.8!,f=-4.9!) USER MOD Single : A 661 LYS NZ :NH3+ -160:sc= 1.22 (180deg=1.14) USER MOD Single : A 664 TYR OH : rot 164:sc= 0.262 USER MOD Single : A 665 TYR OH : rot 40:sc= 1.28 USER MOD Single : A 668 MET CE :methyl 167:sc= -0.223 (180deg=-0.694) USER MOD Single : A 673 TYR OH : rot -165:sc= 1.19 USER MOD Single : A 677 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 679 TYR OH : rot -20:sc= 0.405 USER MOD Single : A 680 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot 83:sc= 0.535 USER MOD Single : A 706 TYR OH : rot 180:sc= 0.703 USER MOD Single : A 707 GLN : amide:sc= -0.549 X(o=-0.55,f=-0.95) USER MOD Single : A 712 SER OG : rot 2:sc= 1.24 USER MOD Single : A 713 THR OG1 : rot 180:sc= 0 USER MOD Single : A 714 TYR OH : rot 180:sc= 0.559 USER MOD Single : A 719 TYR OH : rot 180:sc= -0.238 USER MOD Single : A 720 THR OG1 : rot 101:sc= 0.862 USER MOD Single : A 721 SER OG : rot -77:sc= 1.22 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 -23.927 2.254 -12.782 1.00 54.44 N ATOM 2 CA GLU A 578 -24.574 0.946 -12.749 1.00 33.00 C ATOM 3 C GLU A 578 -23.721 -0.053 -11.985 1.00 31.32 C ATOM 4 O GLU A 578 -24.161 -0.590 -10.965 1.00 22.22 O ATOM 5 CB GLU A 578 -24.864 0.448 -14.175 1.00 12.41 C ATOM 6 CG GLU A 578 -25.502 -0.934 -14.243 1.00 44.41 C ATOM 7 CD GLU A 578 -25.810 -1.363 -15.656 1.00 52.44 C ATOM 8 OE1 GLU A 578 -24.885 -1.789 -16.377 1.00 5.24 O ATOM 9 OE2 GLU A 578 -26.986 -1.292 -16.063 1.00 72.12 O ATOM 0 HA GLU A 578 -25.526 1.045 -12.228 1.00 33.00 H new ATOM 0 HB2 GLU A 578 -25.522 1.163 -14.669 1.00 12.41 H new ATOM 0 HB3 GLU A 578 -23.931 0.432 -14.738 1.00 12.41 H new ATOM 0 HG2 GLU A 578 -24.833 -1.662 -13.784 1.00 44.41 H new ATOM 0 HG3 GLU A 578 -26.422 -0.934 -13.659 1.00 44.41 H new ATOM 18 N ALA A 579 -22.497 -0.282 -12.477 1.00 65.51 N ATOM 19 CA ALA A 579 -21.558 -1.247 -11.907 1.00 44.24 C ATOM 20 C ALA A 579 -22.146 -2.649 -11.928 1.00 22.14 C ATOM 21 O ALA A 579 -22.737 -3.121 -10.950 1.00 54.41 O ATOM 22 CB ALA A 579 -21.070 -0.845 -10.511 1.00 1.24 C ATOM 0 H ALA A 579 -22.129 0.206 -13.294 1.00 65.51 H new ATOM 0 HA ALA A 579 -20.671 -1.247 -12.540 1.00 44.24 H new ATOM 0 HB1 ALA A 579 -20.376 -1.598 -10.137 1.00 1.24 H new ATOM 0 HB2 ALA A 579 -20.565 0.119 -10.566 1.00 1.24 H new ATOM 0 HB3 ALA A 579 -21.922 -0.770 -9.835 1.00 1.24 H new ATOM 28 N GLU A 580 -22.048 -3.264 -13.071 1.00 2.21 N ATOM 29 CA GLU A 580 -22.573 -4.579 -13.296 1.00 3.22 C ATOM 30 C GLU A 580 -21.425 -5.545 -13.546 1.00 54.42 C ATOM 31 O GLU A 580 -20.325 -5.109 -13.954 1.00 15.11 O ATOM 32 CB GLU A 580 -23.523 -4.518 -14.483 1.00 71.42 C ATOM 33 CG GLU A 580 -24.165 -5.821 -14.883 1.00 52.34 C ATOM 34 CD GLU A 580 -25.121 -5.623 -16.003 1.00 0.12 C ATOM 35 OE1 GLU A 580 -24.689 -5.578 -17.169 1.00 45.43 O ATOM 36 OE2 GLU A 580 -26.331 -5.480 -15.731 1.00 5.40 O ATOM 0 H GLU A 580 -21.592 -2.858 -13.888 1.00 2.21 H new ATOM 0 HA GLU A 580 -23.122 -4.935 -12.425 1.00 3.22 H new ATOM 0 HB2 GLU A 580 -24.312 -3.802 -14.255 1.00 71.42 H new ATOM 0 HB3 GLU A 580 -22.976 -4.127 -15.341 1.00 71.42 H new ATOM 0 HG2 GLU A 580 -23.395 -6.534 -15.179 1.00 52.34 H new ATOM 0 HG3 GLU A 580 -24.686 -6.251 -14.028 1.00 52.34 H new ATOM 43 N ALA A 581 -21.686 -6.844 -13.302 1.00 72.33 N ATOM 44 CA ALA A 581 -20.712 -7.936 -13.408 1.00 40.32 C ATOM 45 C ALA A 581 -19.777 -7.923 -12.219 1.00 60.42 C ATOM 46 O ALA A 581 -19.375 -6.844 -11.743 1.00 4.14 O ATOM 47 CB ALA A 581 -19.954 -7.944 -14.743 1.00 35.14 C ATOM 0 H ALA A 581 -22.611 -7.167 -13.017 1.00 72.33 H new ATOM 0 HA ALA A 581 -21.272 -8.871 -13.394 1.00 40.32 H new ATOM 0 HB1 ALA A 581 -19.250 -8.776 -14.757 1.00 35.14 H new ATOM 0 HB2 ALA A 581 -20.663 -8.055 -15.563 1.00 35.14 H new ATOM 0 HB3 ALA A 581 -19.410 -7.006 -14.858 1.00 35.14 H new ATOM 53 N GLU A 582 -19.462 -9.112 -11.722 1.00 0.33 N ATOM 54 CA GLU A 582 -18.615 -9.292 -10.553 1.00 32.11 C ATOM 55 C GLU A 582 -19.372 -8.787 -9.279 1.00 63.14 C ATOM 56 O GLU A 582 -20.567 -8.461 -9.353 1.00 72.25 O ATOM 57 CB GLU A 582 -17.223 -8.607 -10.800 1.00 52.32 C ATOM 58 CG GLU A 582 -16.156 -8.823 -9.737 1.00 32.42 C ATOM 59 CD GLU A 582 -14.834 -8.248 -10.130 1.00 10.01 C ATOM 60 OE1 GLU A 582 -14.636 -7.028 -9.984 1.00 41.23 O ATOM 61 OE2 GLU A 582 -13.970 -9.003 -10.582 1.00 50.32 O ATOM 0 H GLU A 582 -19.792 -9.989 -12.125 1.00 0.33 H new ATOM 0 HA GLU A 582 -18.400 -10.346 -10.377 1.00 32.11 H new ATOM 0 HB2 GLU A 582 -16.832 -8.965 -11.752 1.00 52.32 H new ATOM 0 HB3 GLU A 582 -17.386 -7.534 -10.906 1.00 52.32 H new ATOM 0 HG2 GLU A 582 -16.482 -8.369 -8.801 1.00 32.42 H new ATOM 0 HG3 GLU A 582 -16.044 -9.891 -9.551 1.00 32.42 H new ATOM 68 N PHE A 583 -18.695 -8.783 -8.145 1.00 75.01 N ATOM 69 CA PHE A 583 -19.234 -8.383 -6.855 1.00 24.13 C ATOM 70 C PHE A 583 -20.111 -9.472 -6.253 1.00 65.53 C ATOM 71 O PHE A 583 -21.343 -9.417 -6.273 1.00 51.40 O ATOM 72 CB PHE A 583 -19.887 -6.970 -6.831 1.00 62.13 C ATOM 73 CG PHE A 583 -20.375 -6.534 -5.466 1.00 15.53 C ATOM 74 CD1 PHE A 583 -19.470 -6.196 -4.472 1.00 21.43 C ATOM 75 CD2 PHE A 583 -21.732 -6.460 -5.183 1.00 73.12 C ATOM 76 CE1 PHE A 583 -19.906 -5.794 -3.223 1.00 60.30 C ATOM 77 CE2 PHE A 583 -22.171 -6.060 -3.934 1.00 44.43 C ATOM 78 CZ PHE A 583 -21.258 -5.728 -2.955 1.00 2.23 C ATOM 0 H PHE A 583 -17.717 -9.069 -8.094 1.00 75.01 H new ATOM 0 HA PHE A 583 -18.372 -8.269 -6.198 1.00 24.13 H new ATOM 0 HB2 PHE A 583 -19.163 -6.241 -7.195 1.00 62.13 H new ATOM 0 HB3 PHE A 583 -20.727 -6.959 -7.525 1.00 62.13 H new ATOM 0 HD1 PHE A 583 -18.411 -6.247 -4.676 1.00 21.43 H new ATOM 0 HD2 PHE A 583 -22.452 -6.717 -5.946 1.00 73.12 H new ATOM 0 HE1 PHE A 583 -19.190 -5.532 -2.458 1.00 60.30 H new ATOM 0 HE2 PHE A 583 -23.229 -6.008 -3.725 1.00 44.43 H new ATOM 0 HZ PHE A 583 -21.601 -5.417 -1.979 1.00 2.23 H new ATOM 88 N LEU A 584 -19.436 -10.503 -5.825 1.00 1.50 N ATOM 89 CA LEU A 584 -20.009 -11.639 -5.125 1.00 12.22 C ATOM 90 C LEU A 584 -18.846 -12.244 -4.378 1.00 71.44 C ATOM 91 O LEU A 584 -18.915 -12.531 -3.190 1.00 73.52 O ATOM 92 CB LEU A 584 -20.627 -12.645 -6.144 1.00 31.23 C ATOM 93 CG LEU A 584 -21.493 -13.822 -5.602 1.00 62.43 C ATOM 94 CD1 LEU A 584 -22.126 -14.565 -6.761 1.00 73.55 C ATOM 95 CD2 LEU A 584 -20.682 -14.806 -4.763 1.00 50.31 C ATOM 0 H LEU A 584 -18.428 -10.586 -5.956 1.00 1.50 H new ATOM 0 HA LEU A 584 -20.819 -11.361 -4.451 1.00 12.22 H new ATOM 0 HB2 LEU A 584 -21.243 -12.075 -6.840 1.00 31.23 H new ATOM 0 HB3 LEU A 584 -19.809 -13.075 -6.721 1.00 31.23 H new ATOM 0 HG LEU A 584 -22.258 -13.388 -4.958 1.00 62.43 H new ATOM 0 HD11 LEU A 584 -22.731 -15.387 -6.379 1.00 73.55 H new ATOM 0 HD12 LEU A 584 -22.758 -13.883 -7.329 1.00 73.55 H new ATOM 0 HD13 LEU A 584 -21.345 -14.960 -7.410 1.00 73.55 H new ATOM 0 HD21 LEU A 584 -21.333 -15.606 -4.410 1.00 50.31 H new ATOM 0 HD22 LEU A 584 -19.883 -15.230 -5.371 1.00 50.31 H new ATOM 0 HD23 LEU A 584 -20.250 -14.286 -3.908 1.00 50.31 H new ATOM 103 N SER A 585 -17.746 -12.366 -5.099 1.00 41.23 N ATOM 104 CA SER A 585 -16.494 -12.829 -4.566 1.00 1.04 C ATOM 105 C SER A 585 -15.726 -11.639 -3.957 1.00 61.12 C ATOM 106 O SER A 585 -14.546 -11.737 -3.654 1.00 42.32 O ATOM 107 CB SER A 585 -15.678 -13.443 -5.698 1.00 11.24 C ATOM 108 OG SER A 585 -16.446 -14.407 -6.410 1.00 14.14 O ATOM 0 H SER A 585 -17.706 -12.139 -6.093 1.00 41.23 H new ATOM 0 HA SER A 585 -16.669 -13.575 -3.791 1.00 1.04 H new ATOM 0 HB2 SER A 585 -15.347 -12.660 -6.380 1.00 11.24 H new ATOM 0 HB3 SER A 585 -14.782 -13.913 -5.293 1.00 11.24 H new ATOM 0 HG SER A 585 -15.905 -14.787 -7.133 1.00 14.14 H new ATOM 114 N ARG A 586 -16.424 -10.525 -3.792 1.00 73.32 N ATOM 115 CA ARG A 586 -15.882 -9.337 -3.182 1.00 21.33 C ATOM 116 C ARG A 586 -16.663 -9.028 -1.939 1.00 53.34 C ATOM 117 O ARG A 586 -17.867 -8.785 -1.996 1.00 3.43 O ATOM 118 CB ARG A 586 -15.874 -8.110 -4.120 1.00 23.04 C ATOM 119 CG ARG A 586 -15.443 -6.828 -3.386 1.00 31.12 C ATOM 120 CD ARG A 586 -15.387 -5.600 -4.279 1.00 50.41 C ATOM 121 NE ARG A 586 -15.134 -4.387 -3.477 1.00 54.34 N ATOM 122 CZ ARG A 586 -14.476 -3.294 -3.887 1.00 25.12 C ATOM 123 NH1 ARG A 586 -13.923 -3.253 -5.090 1.00 15.31 N ATOM 124 NH2 ARG A 586 -14.360 -2.244 -3.069 1.00 72.11 N ATOM 0 H ARG A 586 -17.396 -10.428 -4.085 1.00 73.32 H new ATOM 0 HA ARG A 586 -14.838 -9.543 -2.945 1.00 21.33 H new ATOM 0 HB2 ARG A 586 -15.197 -8.295 -4.954 1.00 23.04 H new ATOM 0 HB3 ARG A 586 -16.869 -7.969 -4.542 1.00 23.04 H new ATOM 0 HG2 ARG A 586 -16.137 -6.639 -2.567 1.00 31.12 H new ATOM 0 HG3 ARG A 586 -14.461 -6.988 -2.941 1.00 31.12 H new ATOM 0 HD2 ARG A 586 -14.601 -5.721 -5.024 1.00 50.41 H new ATOM 0 HD3 ARG A 586 -16.327 -5.495 -4.821 1.00 50.41 H new ATOM 0 HE ARG A 586 -15.493 -4.380 -2.522 1.00 54.34 H new ATOM 0 HH11 ARG A 586 -13.996 -4.058 -5.713 1.00 15.31 H new ATOM 0 HH12 ARG A 586 -13.424 -2.417 -5.394 1.00 15.31 H new ATOM 0 HH21 ARG A 586 -14.771 -2.276 -2.136 1.00 72.11 H new ATOM 0 HH22 ARG A 586 -13.860 -1.410 -3.377 1.00 72.11 H new ATOM 136 N THR A 587 -15.993 -9.058 -0.851 1.00 72.31 N ATOM 137 CA THR A 587 -16.569 -8.813 0.421 1.00 22.33 C ATOM 138 C THR A 587 -15.983 -7.500 0.960 1.00 51.45 C ATOM 139 O THR A 587 -14.782 -7.300 0.885 1.00 23.15 O ATOM 140 CB THR A 587 -16.186 -9.980 1.326 1.00 60.32 C ATOM 141 OG1 THR A 587 -16.422 -11.223 0.636 1.00 31.41 O ATOM 142 CG2 THR A 587 -16.997 -9.983 2.577 1.00 31.43 C ATOM 0 H THR A 587 -14.994 -9.260 -0.816 1.00 72.31 H new ATOM 0 HA THR A 587 -17.654 -8.727 0.372 1.00 22.33 H new ATOM 0 HB THR A 587 -15.132 -9.871 1.582 1.00 60.32 H new ATOM 0 HG1 THR A 587 -16.797 -11.878 1.261 1.00 31.41 H new ATOM 0 HG21 THR A 587 -16.701 -10.826 3.201 1.00 31.43 H new ATOM 0 HG22 THR A 587 -16.830 -9.053 3.121 1.00 31.43 H new ATOM 0 HG23 THR A 587 -18.054 -10.072 2.325 1.00 31.43 H new ATOM 148 N GLU A 588 -16.810 -6.619 1.474 1.00 61.54 N ATOM 149 CA GLU A 588 -16.321 -5.318 1.921 1.00 23.13 C ATOM 150 C GLU A 588 -16.258 -5.286 3.461 1.00 30.52 C ATOM 151 O GLU A 588 -17.157 -5.818 4.143 1.00 72.11 O ATOM 152 CB GLU A 588 -17.258 -4.214 1.403 1.00 10.14 C ATOM 153 CG GLU A 588 -16.685 -2.803 1.480 1.00 4.22 C ATOM 154 CD GLU A 588 -15.509 -2.605 0.537 1.00 72.32 C ATOM 155 OE1 GLU A 588 -14.379 -2.906 0.922 1.00 35.04 O ATOM 156 OE2 GLU A 588 -15.731 -2.141 -0.627 1.00 60.41 O ATOM 0 H GLU A 588 -17.812 -6.768 1.596 1.00 61.54 H new ATOM 0 HA GLU A 588 -15.319 -5.149 1.526 1.00 23.13 H new ATOM 0 HB2 GLU A 588 -17.514 -4.431 0.366 1.00 10.14 H new ATOM 0 HB3 GLU A 588 -18.186 -4.246 1.974 1.00 10.14 H new ATOM 0 HG2 GLU A 588 -17.466 -2.082 1.239 1.00 4.22 H new ATOM 0 HG3 GLU A 588 -16.367 -2.598 2.502 1.00 4.22 H new ATOM 163 N GLY A 589 -15.206 -4.703 3.995 1.00 20.23 N ATOM 164 CA GLY A 589 -15.045 -4.585 5.434 1.00 2.15 C ATOM 165 C GLY A 589 -15.205 -3.150 5.908 1.00 3.11 C ATOM 166 O GLY A 589 -15.782 -2.319 5.193 1.00 61.43 O ATOM 0 H GLY A 589 -14.443 -4.300 3.452 1.00 20.23 H new ATOM 0 HA2 GLY A 589 -15.780 -5.216 5.934 1.00 2.15 H new ATOM 0 HA3 GLY A 589 -14.060 -4.954 5.720 1.00 2.15 H new ATOM 170 N ASP A 590 -14.694 -2.846 7.101 1.00 24.52 N ATOM 171 CA ASP A 590 -14.795 -1.489 7.658 1.00 71.22 C ATOM 172 C ASP A 590 -13.491 -1.020 8.241 1.00 23.23 C ATOM 173 O ASP A 590 -13.076 0.110 8.010 1.00 21.20 O ATOM 174 CB ASP A 590 -15.900 -1.348 8.731 1.00 51.12 C ATOM 175 CG ASP A 590 -17.307 -1.471 8.198 1.00 62.43 C ATOM 176 OD1 ASP A 590 -17.743 -0.575 7.435 1.00 30.32 O ATOM 177 OD2 ASP A 590 -18.016 -2.430 8.569 1.00 74.54 O ATOM 0 H ASP A 590 -14.208 -3.513 7.700 1.00 24.52 H new ATOM 0 HA ASP A 590 -15.063 -0.861 6.809 1.00 71.22 H new ATOM 0 HB2 ASP A 590 -15.746 -2.110 9.495 1.00 51.12 H new ATOM 0 HB3 ASP A 590 -15.793 -0.380 9.220 1.00 51.12 H new ATOM 182 N ASN A 591 -12.861 -1.873 9.001 1.00 33.24 N ATOM 183 CA ASN A 591 -11.624 -1.530 9.675 1.00 10.41 C ATOM 184 C ASN A 591 -10.458 -2.164 8.962 1.00 20.21 C ATOM 185 O ASN A 591 -10.620 -2.749 7.902 1.00 61.30 O ATOM 186 CB ASN A 591 -11.641 -2.009 11.138 1.00 13.55 C ATOM 187 CG ASN A 591 -12.761 -1.407 11.948 1.00 32.03 C ATOM 188 OD1 ASN A 591 -12.616 -0.334 12.537 1.00 15.35 O ATOM 189 ND2 ASN A 591 -13.877 -2.095 12.010 1.00 13.33 N ATOM 0 H ASN A 591 -13.184 -2.825 9.175 1.00 33.24 H new ATOM 0 HA ASN A 591 -11.523 -0.445 9.661 1.00 10.41 H new ATOM 0 HB2 ASN A 591 -11.731 -3.095 11.157 1.00 13.55 H new ATOM 0 HB3 ASN A 591 -10.689 -1.760 11.606 1.00 13.55 H new ATOM 0 HD21 ASN A 591 -14.662 -1.745 12.560 1.00 13.33 H new ATOM 0 HD22 ASN A 591 -13.959 -2.979 11.509 1.00 13.33 H new ATOM 195 N CYS A 592 -9.287 -2.085 9.579 1.00 44.43 N ATOM 196 CA CYS A 592 -8.046 -2.633 9.057 1.00 43.44 C ATOM 197 C CYS A 592 -8.058 -4.178 9.108 1.00 2.44 C ATOM 198 O CYS A 592 -7.025 -4.842 8.913 1.00 21.14 O ATOM 199 CB CYS A 592 -6.928 -2.112 9.924 1.00 13.31 C ATOM 200 SG CYS A 592 -7.027 -0.324 10.236 1.00 43.10 S ATOM 0 H CYS A 592 -9.173 -1.625 10.482 1.00 44.43 H new ATOM 0 HA CYS A 592 -7.917 -2.335 8.016 1.00 43.44 H new ATOM 0 HB2 CYS A 592 -6.941 -2.641 10.877 1.00 13.31 H new ATOM 0 HB3 CYS A 592 -5.974 -2.338 9.448 1.00 13.31 H new ATOM 205 N THR A 593 -9.215 -4.729 9.349 1.00 22.23 N ATOM 206 CA THR A 593 -9.417 -6.117 9.404 1.00 1.44 C ATOM 207 C THR A 593 -10.466 -6.453 8.374 1.00 63.31 C ATOM 208 O THR A 593 -11.372 -5.654 8.128 1.00 61.41 O ATOM 209 CB THR A 593 -9.946 -6.497 10.806 1.00 44.10 C ATOM 210 OG1 THR A 593 -11.117 -5.712 11.098 1.00 4.21 O ATOM 211 CG2 THR A 593 -8.905 -6.221 11.867 1.00 2.33 C ATOM 0 H THR A 593 -10.063 -4.188 9.516 1.00 22.23 H new ATOM 0 HA THR A 593 -8.490 -6.657 9.212 1.00 1.44 H new ATOM 0 HB THR A 593 -10.184 -7.561 10.808 1.00 44.10 H new ATOM 0 HG1 THR A 593 -11.458 -5.950 11.985 1.00 4.21 H new ATOM 0 HG21 THR A 593 -9.300 -6.496 12.845 1.00 2.33 H new ATOM 0 HG22 THR A 593 -8.010 -6.807 11.659 1.00 2.33 H new ATOM 0 HG23 THR A 593 -8.654 -5.160 11.863 1.00 2.33 H new ATOM 217 N VAL A 594 -10.368 -7.576 7.768 1.00 33.33 N ATOM 218 CA VAL A 594 -11.370 -7.960 6.838 1.00 0.21 C ATOM 219 C VAL A 594 -11.876 -9.337 7.157 1.00 41.25 C ATOM 220 O VAL A 594 -11.099 -10.269 7.343 1.00 52.44 O ATOM 221 CB VAL A 594 -10.915 -7.846 5.345 1.00 65.15 C ATOM 222 CG1 VAL A 594 -9.765 -8.782 5.006 1.00 0.13 C ATOM 223 CG2 VAL A 594 -12.086 -8.048 4.391 1.00 2.51 C ATOM 0 H VAL A 594 -9.609 -8.246 7.895 1.00 33.33 H new ATOM 0 HA VAL A 594 -12.188 -7.248 6.945 1.00 0.21 H new ATOM 0 HB VAL A 594 -10.540 -6.831 5.215 1.00 65.15 H new ATOM 0 HG11 VAL A 594 -9.493 -8.659 3.958 1.00 0.13 H new ATOM 0 HG12 VAL A 594 -8.906 -8.546 5.634 1.00 0.13 H new ATOM 0 HG13 VAL A 594 -10.071 -9.813 5.183 1.00 0.13 H new ATOM 0 HG21 VAL A 594 -11.736 -7.963 3.362 1.00 2.51 H new ATOM 0 HG22 VAL A 594 -12.516 -9.037 4.547 1.00 2.51 H new ATOM 0 HG23 VAL A 594 -12.845 -7.289 4.580 1.00 2.51 H new ATOM 229 N PHE A 595 -13.145 -9.448 7.296 1.00 23.10 N ATOM 230 CA PHE A 595 -13.748 -10.713 7.462 1.00 54.23 C ATOM 231 C PHE A 595 -14.691 -10.933 6.337 1.00 71.24 C ATOM 232 O PHE A 595 -15.561 -10.080 6.051 1.00 15.43 O ATOM 233 CB PHE A 595 -14.439 -10.890 8.816 1.00 64.00 C ATOM 234 CG PHE A 595 -15.142 -12.212 8.908 1.00 33.24 C ATOM 235 CD1 PHE A 595 -14.448 -13.376 8.659 1.00 35.10 C ATOM 236 CD2 PHE A 595 -16.493 -12.290 9.189 1.00 14.31 C ATOM 237 CE1 PHE A 595 -15.065 -14.585 8.692 1.00 4.44 C ATOM 238 CE2 PHE A 595 -17.127 -13.511 9.224 1.00 53.22 C ATOM 239 CZ PHE A 595 -16.407 -14.662 8.972 1.00 41.03 C ATOM 0 H PHE A 595 -13.795 -8.662 7.298 1.00 23.10 H new ATOM 0 HA PHE A 595 -12.961 -11.467 7.451 1.00 54.23 H new ATOM 0 HB2 PHE A 595 -13.701 -10.813 9.615 1.00 64.00 H new ATOM 0 HB3 PHE A 595 -15.157 -10.084 8.967 1.00 64.00 H new ATOM 0 HD1 PHE A 595 -13.393 -13.326 8.433 1.00 35.10 H new ATOM 0 HD2 PHE A 595 -17.054 -11.388 9.382 1.00 14.31 H new ATOM 0 HE1 PHE A 595 -14.501 -15.485 8.498 1.00 4.44 H new ATOM 0 HE2 PHE A 595 -18.182 -13.569 9.447 1.00 53.22 H new ATOM 0 HZ PHE A 595 -16.899 -15.623 8.995 1.00 41.03 H new ATOM 249 N ASP A 596 -14.524 -12.028 5.683 1.00 31.21 N ATOM 250 CA ASP A 596 -15.313 -12.316 4.565 1.00 33.33 C ATOM 251 C ASP A 596 -16.193 -13.507 4.816 1.00 43.01 C ATOM 252 O ASP A 596 -15.788 -14.485 5.422 1.00 11.33 O ATOM 253 CB ASP A 596 -14.453 -12.542 3.359 1.00 41.42 C ATOM 254 CG ASP A 596 -13.724 -13.814 3.392 1.00 73.32 C ATOM 255 OD1 ASP A 596 -12.923 -14.052 4.299 1.00 70.33 O ATOM 256 OD2 ASP A 596 -13.989 -14.597 2.537 1.00 40.32 O ATOM 0 H ASP A 596 -13.834 -12.741 5.917 1.00 31.21 H new ATOM 0 HA ASP A 596 -15.956 -11.457 4.377 1.00 33.33 H new ATOM 0 HB2 ASP A 596 -15.078 -12.513 2.466 1.00 41.42 H new ATOM 0 HB3 ASP A 596 -13.738 -11.724 3.274 1.00 41.42 H new ATOM 261 N SER A 597 -17.407 -13.393 4.398 1.00 52.34 N ATOM 262 CA SER A 597 -18.362 -14.439 4.520 1.00 60.22 C ATOM 263 C SER A 597 -18.094 -15.624 3.566 1.00 51.44 C ATOM 264 O SER A 597 -18.529 -16.747 3.833 1.00 3.12 O ATOM 265 CB SER A 597 -19.744 -13.853 4.342 1.00 2.13 C ATOM 266 OG SER A 597 -19.780 -13.016 3.192 1.00 64.13 O ATOM 0 H SER A 597 -17.771 -12.551 3.952 1.00 52.34 H new ATOM 0 HA SER A 597 -18.278 -14.872 5.517 1.00 60.22 H new ATOM 0 HB2 SER A 597 -20.476 -14.654 4.240 1.00 2.13 H new ATOM 0 HB3 SER A 597 -20.020 -13.279 5.227 1.00 2.13 H new ATOM 0 HG SER A 597 -20.680 -12.644 3.086 1.00 64.13 H new ATOM 272 N GLN A 598 -17.361 -15.384 2.474 1.00 60.31 N ATOM 273 CA GLN A 598 -17.153 -16.420 1.471 1.00 73.14 C ATOM 274 C GLN A 598 -16.079 -17.433 1.880 1.00 44.14 C ATOM 275 O GLN A 598 -16.279 -18.651 1.754 1.00 41.24 O ATOM 276 CB GLN A 598 -16.806 -15.796 0.118 1.00 61.21 C ATOM 277 CG GLN A 598 -15.652 -14.826 0.174 1.00 2.42 C ATOM 278 CD GLN A 598 -15.181 -14.327 -1.156 1.00 1.33 C ATOM 279 OE1 GLN A 598 -15.273 -15.012 -2.173 1.00 72.22 O ATOM 280 NE2 GLN A 598 -14.680 -13.139 -1.163 1.00 31.22 N ATOM 0 H GLN A 598 -16.910 -14.493 2.268 1.00 60.31 H new ATOM 0 HA GLN A 598 -18.092 -16.967 1.386 1.00 73.14 H new ATOM 0 HB2 GLN A 598 -16.566 -16.591 -0.588 1.00 61.21 H new ATOM 0 HB3 GLN A 598 -17.684 -15.280 -0.270 1.00 61.21 H new ATOM 0 HG2 GLN A 598 -15.945 -13.971 0.783 1.00 2.42 H new ATOM 0 HG3 GLN A 598 -14.816 -15.308 0.681 1.00 2.42 H new ATOM 0 HE21 GLN A 598 -14.622 -12.605 -0.296 1.00 31.22 H new ATOM 0 HE22 GLN A 598 -14.341 -12.734 -2.035 1.00 31.22 H new ATOM 288 N ALA A 599 -14.975 -16.954 2.394 1.00 62.32 N ATOM 289 CA ALA A 599 -13.919 -17.816 2.844 1.00 71.25 C ATOM 290 C ALA A 599 -14.129 -18.092 4.286 1.00 5.43 C ATOM 291 O ALA A 599 -13.692 -19.119 4.819 1.00 43.53 O ATOM 292 CB ALA A 599 -12.589 -17.098 2.689 1.00 43.23 C ATOM 0 H ALA A 599 -14.786 -15.959 2.511 1.00 62.32 H new ATOM 0 HA ALA A 599 -13.917 -18.739 2.264 1.00 71.25 H new ATOM 0 HB1 ALA A 599 -11.783 -17.748 3.029 1.00 43.23 H new ATOM 0 HB2 ALA A 599 -12.433 -16.844 1.641 1.00 43.23 H new ATOM 0 HB3 ALA A 599 -12.596 -16.186 3.286 1.00 43.23 H new ATOM 298 N GLY A 600 -14.868 -17.203 4.908 1.00 23.34 N ATOM 299 CA GLY A 600 -15.146 -17.314 6.292 1.00 32.53 C ATOM 300 C GLY A 600 -13.895 -17.177 7.106 1.00 14.31 C ATOM 301 O GLY A 600 -13.731 -17.868 8.112 1.00 24.52 O ATOM 0 H GLY A 600 -15.286 -16.390 4.456 1.00 23.34 H new ATOM 0 HA2 GLY A 600 -15.861 -16.545 6.585 1.00 32.53 H new ATOM 0 HA3 GLY A 600 -15.613 -18.278 6.496 1.00 32.53 H new ATOM 305 N PHE A 601 -12.992 -16.298 6.697 1.00 65.15 N ATOM 306 CA PHE A 601 -11.771 -16.159 7.449 1.00 23.31 C ATOM 307 C PHE A 601 -11.482 -14.710 7.699 1.00 1.04 C ATOM 308 O PHE A 601 -11.605 -13.877 6.818 1.00 1.53 O ATOM 309 CB PHE A 601 -10.591 -16.867 6.764 1.00 43.15 C ATOM 310 CG PHE A 601 -9.368 -17.028 7.647 1.00 63.42 C ATOM 311 CD1 PHE A 601 -9.244 -18.137 8.468 1.00 61.54 C ATOM 312 CD2 PHE A 601 -8.359 -16.082 7.664 1.00 20.41 C ATOM 313 CE1 PHE A 601 -8.140 -18.298 9.283 1.00 11.00 C ATOM 314 CE2 PHE A 601 -7.253 -16.236 8.477 1.00 54.11 C ATOM 315 CZ PHE A 601 -7.144 -17.346 9.288 1.00 75.24 C ATOM 0 H PHE A 601 -13.081 -15.695 5.879 1.00 65.15 H new ATOM 0 HA PHE A 601 -11.907 -16.652 8.412 1.00 23.31 H new ATOM 0 HB2 PHE A 601 -10.917 -17.852 6.430 1.00 43.15 H new ATOM 0 HB3 PHE A 601 -10.311 -16.305 5.873 1.00 43.15 H new ATOM 0 HD1 PHE A 601 -10.022 -18.887 8.471 1.00 61.54 H new ATOM 0 HD2 PHE A 601 -8.437 -15.210 7.032 1.00 20.41 H new ATOM 0 HE1 PHE A 601 -8.058 -19.169 9.916 1.00 11.00 H new ATOM 0 HE2 PHE A 601 -6.474 -15.488 8.478 1.00 54.11 H new ATOM 0 HZ PHE A 601 -6.281 -17.469 9.925 1.00 75.24 H new ATOM 325 N SER A 602 -11.132 -14.403 8.896 1.00 51.54 N ATOM 326 CA SER A 602 -10.872 -13.055 9.241 1.00 65.10 C ATOM 327 C SER A 602 -9.375 -12.754 9.116 1.00 73.42 C ATOM 328 O SER A 602 -8.534 -13.470 9.671 1.00 11.30 O ATOM 329 CB SER A 602 -11.396 -12.825 10.654 1.00 53.34 C ATOM 330 OG SER A 602 -10.817 -13.766 11.556 1.00 33.21 O ATOM 0 H SER A 602 -11.019 -15.073 9.657 1.00 51.54 H new ATOM 0 HA SER A 602 -11.380 -12.371 8.561 1.00 65.10 H new ATOM 0 HB2 SER A 602 -11.161 -11.810 10.976 1.00 53.34 H new ATOM 0 HB3 SER A 602 -12.482 -12.920 10.666 1.00 53.34 H new ATOM 0 HG SER A 602 -9.955 -14.070 11.203 1.00 33.21 H new ATOM 336 N PHE A 603 -9.066 -11.698 8.417 1.00 2.25 N ATOM 337 CA PHE A 603 -7.706 -11.277 8.182 1.00 11.44 C ATOM 338 C PHE A 603 -7.432 -9.939 8.839 1.00 21.12 C ATOM 339 O PHE A 603 -8.121 -8.950 8.572 1.00 34.33 O ATOM 340 CB PHE A 603 -7.412 -11.186 6.670 1.00 31.01 C ATOM 341 CG PHE A 603 -7.325 -12.510 5.939 1.00 0.33 C ATOM 342 CD1 PHE A 603 -8.459 -13.184 5.490 1.00 33.41 C ATOM 343 CD2 PHE A 603 -6.089 -13.072 5.689 1.00 74.22 C ATOM 344 CE1 PHE A 603 -8.337 -14.386 4.814 1.00 64.13 C ATOM 345 CE2 PHE A 603 -5.970 -14.267 5.015 1.00 74.33 C ATOM 346 CZ PHE A 603 -7.093 -14.925 4.577 1.00 23.00 C ATOM 0 H PHE A 603 -9.763 -11.092 7.985 1.00 2.25 H new ATOM 0 HA PHE A 603 -7.048 -12.026 8.624 1.00 11.44 H new ATOM 0 HB2 PHE A 603 -8.191 -10.584 6.202 1.00 31.01 H new ATOM 0 HB3 PHE A 603 -6.471 -10.653 6.532 1.00 31.01 H new ATOM 0 HD1 PHE A 603 -9.439 -12.766 5.670 1.00 33.41 H new ATOM 0 HD2 PHE A 603 -5.198 -12.565 6.029 1.00 74.22 H new ATOM 0 HE1 PHE A 603 -9.221 -14.903 4.471 1.00 64.13 H new ATOM 0 HE2 PHE A 603 -4.992 -14.687 4.831 1.00 74.33 H new ATOM 0 HZ PHE A 603 -7.000 -15.862 4.048 1.00 23.00 H new ATOM 356 N ASP A 604 -6.450 -9.914 9.700 1.00 13.11 N ATOM 357 CA ASP A 604 -6.033 -8.700 10.365 1.00 41.11 C ATOM 358 C ASP A 604 -4.784 -8.209 9.661 1.00 14.41 C ATOM 359 O ASP A 604 -3.734 -8.856 9.708 1.00 51.41 O ATOM 360 CB ASP A 604 -5.716 -9.057 11.833 1.00 21.14 C ATOM 361 CG ASP A 604 -5.298 -7.886 12.674 1.00 33.45 C ATOM 362 OD1 ASP A 604 -6.170 -7.157 13.161 1.00 73.53 O ATOM 363 OD2 ASP A 604 -4.103 -7.687 12.878 1.00 35.01 O ATOM 0 H ASP A 604 -5.911 -10.739 9.964 1.00 13.11 H new ATOM 0 HA ASP A 604 -6.800 -7.926 10.338 1.00 41.11 H new ATOM 0 HB2 ASP A 604 -6.597 -9.517 12.282 1.00 21.14 H new ATOM 0 HB3 ASP A 604 -4.923 -9.804 11.850 1.00 21.14 H new ATOM 368 N LEU A 605 -4.901 -7.082 8.989 1.00 15.34 N ATOM 369 CA LEU A 605 -3.773 -6.497 8.272 1.00 23.24 C ATOM 370 C LEU A 605 -3.297 -5.277 9.010 1.00 11.01 C ATOM 371 O LEU A 605 -2.496 -4.496 8.534 1.00 42.24 O ATOM 372 CB LEU A 605 -4.128 -6.184 6.816 1.00 72.32 C ATOM 373 CG LEU A 605 -4.581 -7.389 5.967 1.00 4.30 C ATOM 374 CD1 LEU A 605 -4.757 -6.991 4.528 1.00 55.45 C ATOM 375 CD2 LEU A 605 -3.599 -8.542 6.074 1.00 21.11 C ATOM 0 H LEU A 605 -5.767 -6.547 8.921 1.00 15.34 H new ATOM 0 HA LEU A 605 -2.961 -7.223 8.235 1.00 23.24 H new ATOM 0 HB2 LEU A 605 -4.922 -5.437 6.807 1.00 72.32 H new ATOM 0 HB3 LEU A 605 -3.259 -5.732 6.338 1.00 72.32 H new ATOM 0 HG LEU A 605 -5.541 -7.723 6.359 1.00 4.30 H new ATOM 0 HD11 LEU A 605 -5.077 -7.856 3.948 1.00 55.45 H new ATOM 0 HD12 LEU A 605 -5.511 -6.208 4.457 1.00 55.45 H new ATOM 0 HD13 LEU A 605 -3.811 -6.620 4.135 1.00 55.45 H new ATOM 0 HD21 LEU A 605 -3.948 -9.375 5.464 1.00 21.11 H new ATOM 0 HD22 LEU A 605 -2.619 -8.219 5.721 1.00 21.11 H new ATOM 0 HD23 LEU A 605 -3.524 -8.860 7.114 1.00 21.11 H new ATOM 383 N THR A 606 -3.784 -5.182 10.186 1.00 15.54 N ATOM 384 CA THR A 606 -3.546 -4.147 11.105 1.00 11.43 C ATOM 385 C THR A 606 -2.015 -4.000 11.465 1.00 1.33 C ATOM 386 O THR A 606 -1.525 -2.882 11.583 1.00 73.22 O ATOM 387 CB THR A 606 -4.368 -4.465 12.344 1.00 21.10 C ATOM 388 OG1 THR A 606 -5.693 -4.851 11.927 1.00 70.34 O ATOM 389 CG2 THR A 606 -4.504 -3.276 13.199 1.00 53.42 C ATOM 0 H THR A 606 -4.415 -5.891 10.560 1.00 15.54 H new ATOM 0 HA THR A 606 -3.836 -3.191 10.670 1.00 11.43 H new ATOM 0 HB THR A 606 -3.869 -5.260 12.898 1.00 21.10 H new ATOM 0 HG1 THR A 606 -6.079 -5.463 12.588 1.00 70.34 H new ATOM 0 HG21 THR A 606 -5.096 -3.527 14.079 1.00 53.42 H new ATOM 0 HG22 THR A 606 -3.516 -2.937 13.510 1.00 53.42 H new ATOM 0 HG23 THR A 606 -5.001 -2.482 12.642 1.00 53.42 H new ATOM 395 N PRO A 607 -1.225 -5.126 11.656 1.00 14.04 N ATOM 396 CA PRO A 607 0.228 -5.033 11.902 1.00 22.35 C ATOM 397 C PRO A 607 0.967 -4.395 10.727 1.00 53.13 C ATOM 398 O PRO A 607 2.079 -3.904 10.870 1.00 2.12 O ATOM 399 CB PRO A 607 0.673 -6.490 12.084 1.00 0.32 C ATOM 400 CG PRO A 607 -0.414 -7.303 11.489 1.00 12.12 C ATOM 401 CD PRO A 607 -1.668 -6.533 11.707 1.00 21.11 C ATOM 0 HA PRO A 607 0.450 -4.405 12.765 1.00 22.35 H new ATOM 0 HB2 PRO A 607 1.624 -6.677 11.585 1.00 0.32 H new ATOM 0 HB3 PRO A 607 0.814 -6.731 13.138 1.00 0.32 H new ATOM 0 HG2 PRO A 607 -0.239 -7.471 10.426 1.00 12.12 H new ATOM 0 HG3 PRO A 607 -0.471 -8.284 11.961 1.00 12.12 H new ATOM 0 HD2 PRO A 607 -2.409 -6.748 10.937 1.00 21.11 H new ATOM 0 HD3 PRO A 607 -2.125 -6.775 12.666 1.00 21.11 H new ATOM 409 N LEU A 608 0.331 -4.410 9.575 1.00 22.53 N ATOM 410 CA LEU A 608 0.894 -3.851 8.366 1.00 5.23 C ATOM 411 C LEU A 608 0.815 -2.324 8.376 1.00 45.20 C ATOM 412 O LEU A 608 1.462 -1.665 7.586 1.00 0.14 O ATOM 413 CB LEU A 608 0.196 -4.419 7.110 1.00 14.22 C ATOM 414 CG LEU A 608 0.469 -5.891 6.716 1.00 3.55 C ATOM 415 CD1 LEU A 608 0.002 -6.859 7.775 1.00 52.30 C ATOM 416 CD2 LEU A 608 -0.191 -6.205 5.388 1.00 72.14 C ATOM 0 H LEU A 608 -0.598 -4.813 9.451 1.00 22.53 H new ATOM 0 HA LEU A 608 1.945 -4.139 8.331 1.00 5.23 H new ATOM 0 HB2 LEU A 608 -0.879 -4.307 7.249 1.00 14.22 H new ATOM 0 HB3 LEU A 608 0.475 -3.792 6.263 1.00 14.22 H new ATOM 0 HG LEU A 608 1.548 -6.011 6.622 1.00 3.55 H new ATOM 0 HD11 LEU A 608 0.214 -7.879 7.455 1.00 52.30 H new ATOM 0 HD12 LEU A 608 0.525 -6.656 8.710 1.00 52.30 H new ATOM 0 HD13 LEU A 608 -1.071 -6.742 7.927 1.00 52.30 H new ATOM 0 HD21 LEU A 608 0.007 -7.243 5.120 1.00 72.14 H new ATOM 0 HD22 LEU A 608 -1.267 -6.050 5.471 1.00 72.14 H new ATOM 0 HD23 LEU A 608 0.212 -5.548 4.617 1.00 72.14 H new ATOM 424 N THR A 609 0.021 -1.790 9.266 1.00 24.33 N ATOM 425 CA THR A 609 -0.139 -0.359 9.418 1.00 2.23 C ATOM 426 C THR A 609 1.081 0.251 10.119 1.00 3.10 C ATOM 427 O THR A 609 1.474 -0.183 11.203 1.00 0.45 O ATOM 428 CB THR A 609 -1.415 -0.064 10.236 1.00 72.11 C ATOM 429 OG1 THR A 609 -2.542 -0.671 9.593 1.00 21.30 O ATOM 430 CG2 THR A 609 -1.656 1.433 10.382 1.00 12.35 C ATOM 0 H THR A 609 -0.542 -2.339 9.916 1.00 24.33 H new ATOM 0 HA THR A 609 -0.228 0.089 8.428 1.00 2.23 H new ATOM 0 HB THR A 609 -1.281 -0.480 11.234 1.00 72.11 H new ATOM 0 HG1 THR A 609 -2.809 -0.130 8.821 1.00 21.30 H new ATOM 0 HG21 THR A 609 -2.563 1.601 10.963 1.00 12.35 H new ATOM 0 HG22 THR A 609 -0.808 1.890 10.892 1.00 12.35 H new ATOM 0 HG23 THR A 609 -1.770 1.881 9.395 1.00 12.35 H new ATOM 436 N LYS A 610 1.658 1.246 9.494 1.00 61.02 N ATOM 437 CA LYS A 610 2.808 1.963 10.005 1.00 61.03 C ATOM 438 C LYS A 610 2.485 3.437 10.096 1.00 13.22 C ATOM 439 O LYS A 610 1.776 3.954 9.254 1.00 74.21 O ATOM 440 CB LYS A 610 4.000 1.798 9.070 1.00 52.34 C ATOM 441 CG LYS A 610 4.679 0.449 9.071 1.00 62.01 C ATOM 442 CD LYS A 610 5.831 0.455 8.076 1.00 52.34 C ATOM 443 CE LYS A 610 6.665 -0.812 8.148 1.00 12.23 C ATOM 444 NZ LYS A 610 7.407 -0.916 9.420 1.00 51.24 N ATOM 0 H LYS A 610 1.335 1.592 8.591 1.00 61.02 H new ATOM 0 HA LYS A 610 3.053 1.560 10.988 1.00 61.03 H new ATOM 0 HB2 LYS A 610 3.668 2.011 8.054 1.00 52.34 H new ATOM 0 HB3 LYS A 610 4.742 2.553 9.328 1.00 52.34 H new ATOM 0 HG2 LYS A 610 5.049 0.218 10.070 1.00 62.01 H new ATOM 0 HG3 LYS A 610 3.963 -0.330 8.809 1.00 62.01 H new ATOM 0 HD2 LYS A 610 5.435 0.569 7.067 1.00 52.34 H new ATOM 0 HD3 LYS A 610 6.469 1.318 8.268 1.00 52.34 H new ATOM 0 HE2 LYS A 610 6.015 -1.680 8.036 1.00 12.23 H new ATOM 0 HE3 LYS A 610 7.369 -0.830 7.316 1.00 12.23 H new ATOM 0 HZ1 LYS A 610 8.112 -1.677 9.349 1.00 51.24 H new ATOM 0 HZ2 LYS A 610 7.889 -0.015 9.616 1.00 51.24 H new ATOM 0 HZ3 LYS A 610 6.744 -1.129 10.192 1.00 51.24 H new ATOM 458 N LYS A 611 3.006 4.116 11.102 1.00 14.13 N ATOM 459 CA LYS A 611 2.775 5.551 11.222 1.00 21.02 C ATOM 460 C LYS A 611 3.554 6.257 10.127 1.00 52.23 C ATOM 461 O LYS A 611 3.046 7.129 9.434 1.00 23.43 O ATOM 462 CB LYS A 611 3.325 6.048 12.538 1.00 33.43 C ATOM 463 CG LYS A 611 3.002 7.512 12.830 1.00 3.04 C ATOM 464 CD LYS A 611 3.829 8.054 13.978 1.00 35.12 C ATOM 465 CE LYS A 611 5.306 8.096 13.600 1.00 22.22 C ATOM 466 NZ LYS A 611 6.164 8.603 14.686 1.00 42.41 N ATOM 0 H LYS A 611 3.583 3.709 11.838 1.00 14.13 H new ATOM 0 HA LYS A 611 1.705 5.747 11.152 1.00 21.02 H new ATOM 0 HB2 LYS A 611 2.927 5.431 13.343 1.00 33.43 H new ATOM 0 HB3 LYS A 611 4.407 5.917 12.541 1.00 33.43 H new ATOM 0 HG2 LYS A 611 3.185 8.109 11.937 1.00 3.04 H new ATOM 0 HG3 LYS A 611 1.943 7.610 13.068 1.00 3.04 H new ATOM 0 HD2 LYS A 611 3.486 9.055 14.240 1.00 35.12 H new ATOM 0 HD3 LYS A 611 3.691 7.429 14.860 1.00 35.12 H new ATOM 0 HE2 LYS A 611 5.633 7.094 13.324 1.00 22.22 H new ATOM 0 HE3 LYS A 611 5.432 8.727 12.720 1.00 22.22 H new ATOM 0 HZ1 LYS A 611 7.155 8.609 14.371 1.00 42.41 H new ATOM 0 HZ2 LYS A 611 5.874 9.570 14.935 1.00 42.41 H new ATOM 0 HZ3 LYS A 611 6.069 7.988 15.519 1.00 42.41 H new ATOM 480 N ASP A 612 4.786 5.808 9.965 1.00 63.42 N ATOM 481 CA ASP A 612 5.730 6.387 9.000 1.00 52.31 C ATOM 482 C ASP A 612 5.352 5.938 7.599 1.00 52.31 C ATOM 483 O ASP A 612 5.727 6.561 6.583 1.00 40.45 O ATOM 484 CB ASP A 612 7.150 5.940 9.343 1.00 63.12 C ATOM 485 CG ASP A 612 8.205 6.657 8.543 1.00 34.13 C ATOM 486 OD1 ASP A 612 8.643 7.749 8.980 1.00 50.03 O ATOM 487 OD2 ASP A 612 8.635 6.143 7.496 1.00 74.41 O ATOM 0 H ASP A 612 5.171 5.028 10.498 1.00 63.42 H new ATOM 0 HA ASP A 612 5.688 7.475 9.045 1.00 52.31 H new ATOM 0 HB2 ASP A 612 7.331 6.108 10.405 1.00 63.12 H new ATOM 0 HB3 ASP A 612 7.238 4.867 9.171 1.00 63.12 H new ATOM 492 N ALA A 613 4.592 4.845 7.571 1.00 34.30 N ATOM 493 CA ALA A 613 4.010 4.270 6.376 1.00 4.54 C ATOM 494 C ALA A 613 5.045 3.686 5.423 1.00 51.24 C ATOM 495 O ALA A 613 6.222 3.548 5.760 1.00 64.24 O ATOM 496 CB ALA A 613 3.144 5.287 5.696 1.00 14.40 C ATOM 0 H ALA A 613 4.360 4.322 8.415 1.00 34.30 H new ATOM 0 HA ALA A 613 3.395 3.425 6.686 1.00 4.54 H new ATOM 0 HB1 ALA A 613 2.708 4.851 4.797 1.00 14.40 H new ATOM 0 HB2 ALA A 613 2.347 5.597 6.372 1.00 14.40 H new ATOM 0 HB3 ALA A 613 3.746 6.154 5.423 1.00 14.40 H new ATOM 502 N TYR A 614 4.583 3.312 4.253 1.00 32.43 N ATOM 503 CA TYR A 614 5.399 2.697 3.237 1.00 0.24 C ATOM 504 C TYR A 614 5.571 3.652 2.085 1.00 22.55 C ATOM 505 O TYR A 614 4.620 4.347 1.704 1.00 61.20 O ATOM 506 CB TYR A 614 4.712 1.416 2.733 1.00 43.12 C ATOM 507 CG TYR A 614 4.544 0.337 3.789 1.00 21.21 C ATOM 508 CD1 TYR A 614 3.616 0.472 4.813 1.00 34.45 C ATOM 509 CD2 TYR A 614 5.326 -0.814 3.767 1.00 13.21 C ATOM 510 CE1 TYR A 614 3.470 -0.488 5.761 1.00 21.41 C ATOM 511 CE2 TYR A 614 5.180 -1.786 4.728 1.00 22.32 C ATOM 512 CZ TYR A 614 4.247 -1.616 5.721 1.00 62.24 C ATOM 513 OH TYR A 614 4.098 -2.561 6.691 1.00 73.42 O ATOM 0 H TYR A 614 3.608 3.430 3.977 1.00 32.43 H new ATOM 0 HA TYR A 614 6.374 2.449 3.657 1.00 0.24 H new ATOM 0 HB2 TYR A 614 3.730 1.676 2.338 1.00 43.12 H new ATOM 0 HB3 TYR A 614 5.292 1.009 1.904 1.00 43.12 H new ATOM 0 HD1 TYR A 614 2.999 1.357 4.856 1.00 34.45 H new ATOM 0 HD2 TYR A 614 6.058 -0.945 2.984 1.00 13.21 H new ATOM 0 HE1 TYR A 614 2.741 -0.363 6.548 1.00 21.41 H new ATOM 0 HE2 TYR A 614 5.793 -2.675 4.702 1.00 22.32 H new ATOM 0 HH TYR A 614 3.229 -2.446 7.129 1.00 73.42 H new ATOM 523 N LYS A 615 6.757 3.721 1.549 1.00 70.52 N ATOM 524 CA LYS A 615 7.011 4.542 0.406 1.00 24.33 C ATOM 525 C LYS A 615 7.459 3.689 -0.753 1.00 51.31 C ATOM 526 O LYS A 615 8.415 2.910 -0.637 1.00 4.33 O ATOM 527 CB LYS A 615 8.079 5.605 0.673 1.00 14.32 C ATOM 528 CG LYS A 615 8.335 6.501 -0.534 1.00 74.03 C ATOM 529 CD LYS A 615 9.586 7.373 -0.374 1.00 42.03 C ATOM 530 CE LYS A 615 9.536 8.265 0.852 1.00 73.33 C ATOM 531 NZ LYS A 615 10.674 9.205 0.927 1.00 15.24 N ATOM 0 H LYS A 615 7.570 3.210 1.893 1.00 70.52 H new ATOM 0 HA LYS A 615 6.076 5.051 0.172 1.00 24.33 H new ATOM 0 HB2 LYS A 615 7.769 6.221 1.518 1.00 14.32 H new ATOM 0 HB3 LYS A 615 9.009 5.115 0.960 1.00 14.32 H new ATOM 0 HG2 LYS A 615 8.442 5.881 -1.424 1.00 74.03 H new ATOM 0 HG3 LYS A 615 7.469 7.143 -0.694 1.00 74.03 H new ATOM 0 HD2 LYS A 615 10.464 6.730 -0.313 1.00 42.03 H new ATOM 0 HD3 LYS A 615 9.706 7.993 -1.263 1.00 42.03 H new ATOM 0 HE2 LYS A 615 8.604 8.830 0.846 1.00 73.33 H new ATOM 0 HE3 LYS A 615 9.525 7.643 1.747 1.00 73.33 H new ATOM 0 HZ1 LYS A 615 10.785 9.539 1.906 1.00 15.24 H new ATOM 0 HZ2 LYS A 615 11.544 8.721 0.626 1.00 15.24 H new ATOM 0 HZ3 LYS A 615 10.495 10.017 0.302 1.00 15.24 H new ATOM 545 N VAL A 616 6.774 3.825 -1.834 1.00 0.13 N ATOM 546 CA VAL A 616 7.139 3.185 -3.063 1.00 40.14 C ATOM 547 C VAL A 616 7.768 4.262 -3.918 1.00 21.21 C ATOM 548 O VAL A 616 7.283 5.389 -3.936 1.00 11.52 O ATOM 549 CB VAL A 616 5.901 2.622 -3.799 1.00 53.43 C ATOM 550 CG1 VAL A 616 6.311 1.837 -5.041 1.00 33.25 C ATOM 551 CG2 VAL A 616 5.045 1.772 -2.873 1.00 23.11 C ATOM 0 H VAL A 616 5.929 4.392 -1.897 1.00 0.13 H new ATOM 0 HA VAL A 616 7.811 2.349 -2.870 1.00 40.14 H new ATOM 0 HB VAL A 616 5.296 3.469 -4.122 1.00 53.43 H new ATOM 0 HG11 VAL A 616 5.421 1.453 -5.539 1.00 33.25 H new ATOM 0 HG12 VAL A 616 6.854 2.492 -5.723 1.00 33.25 H new ATOM 0 HG13 VAL A 616 6.952 1.005 -4.750 1.00 33.25 H new ATOM 0 HG21 VAL A 616 4.183 1.392 -3.421 1.00 23.11 H new ATOM 0 HG22 VAL A 616 5.635 0.935 -2.498 1.00 23.11 H new ATOM 0 HG23 VAL A 616 4.703 2.379 -2.035 1.00 23.11 H new ATOM 557 N GLU A 617 8.818 3.949 -4.597 1.00 52.24 N ATOM 558 CA GLU A 617 9.521 4.939 -5.371 1.00 12.31 C ATOM 559 C GLU A 617 9.440 4.631 -6.843 1.00 1.03 C ATOM 560 O GLU A 617 9.395 3.465 -7.239 1.00 61.05 O ATOM 561 CB GLU A 617 10.993 4.981 -4.964 1.00 64.10 C ATOM 562 CG GLU A 617 11.254 5.370 -3.522 1.00 10.54 C ATOM 563 CD GLU A 617 12.722 5.328 -3.191 1.00 32.11 C ATOM 564 OE1 GLU A 617 13.453 6.266 -3.565 1.00 72.43 O ATOM 565 OE2 GLU A 617 13.174 4.347 -2.555 1.00 42.05 O ATOM 0 H GLU A 617 9.218 3.012 -4.638 1.00 52.24 H new ATOM 0 HA GLU A 617 9.051 5.903 -5.178 1.00 12.31 H new ATOM 0 HB2 GLU A 617 11.431 3.999 -5.144 1.00 64.10 H new ATOM 0 HB3 GLU A 617 11.513 5.686 -5.613 1.00 64.10 H new ATOM 0 HG2 GLU A 617 10.869 6.373 -3.340 1.00 10.54 H new ATOM 0 HG3 GLU A 617 10.712 4.695 -2.859 1.00 10.54 H new ATOM 572 N THR A 618 9.390 5.659 -7.645 1.00 31.05 N ATOM 573 CA THR A 618 9.486 5.519 -9.062 1.00 42.50 C ATOM 574 C THR A 618 10.638 6.416 -9.493 1.00 25.44 C ATOM 575 O THR A 618 11.470 6.783 -8.641 1.00 64.54 O ATOM 576 CB THR A 618 8.164 5.920 -9.778 1.00 12.50 C ATOM 577 OG1 THR A 618 7.833 7.283 -9.503 1.00 25.13 O ATOM 578 CG2 THR A 618 7.014 5.024 -9.343 1.00 44.23 C ATOM 0 H THR A 618 9.281 6.622 -7.326 1.00 31.05 H new ATOM 0 HA THR A 618 9.662 4.479 -9.337 1.00 42.50 H new ATOM 0 HB THR A 618 8.321 5.798 -10.850 1.00 12.50 H new ATOM 0 HG1 THR A 618 8.044 7.489 -8.568 1.00 25.13 H new ATOM 0 HG21 THR A 618 6.102 5.326 -9.858 1.00 44.23 H new ATOM 0 HG22 THR A 618 7.245 3.988 -9.592 1.00 44.23 H new ATOM 0 HG23 THR A 618 6.869 5.115 -8.266 1.00 44.23 H new ATOM 584 N ASP A 619 10.724 6.758 -10.760 1.00 34.35 N ATOM 585 CA ASP A 619 11.808 7.623 -11.220 1.00 74.14 C ATOM 586 C ASP A 619 11.700 9.023 -10.632 1.00 5.13 C ATOM 587 O ASP A 619 12.686 9.580 -10.151 1.00 74.05 O ATOM 588 CB ASP A 619 11.878 7.713 -12.751 1.00 13.43 C ATOM 589 CG ASP A 619 12.220 6.407 -13.423 1.00 4.43 C ATOM 590 OD1 ASP A 619 13.404 6.003 -13.401 1.00 62.21 O ATOM 591 OD2 ASP A 619 11.316 5.781 -14.017 1.00 35.23 O ATOM 0 H ASP A 619 10.072 6.460 -11.486 1.00 34.35 H new ATOM 0 HA ASP A 619 12.728 7.160 -10.865 1.00 74.14 H new ATOM 0 HB2 ASP A 619 10.918 8.065 -13.129 1.00 13.43 H new ATOM 0 HB3 ASP A 619 12.623 8.459 -13.028 1.00 13.43 H new ATOM 596 N LYS A 620 10.504 9.590 -10.656 1.00 72.12 N ATOM 597 CA LYS A 620 10.323 10.960 -10.180 1.00 44.42 C ATOM 598 C LYS A 620 9.227 11.111 -9.146 1.00 44.42 C ATOM 599 O LYS A 620 8.978 12.215 -8.658 1.00 65.10 O ATOM 600 CB LYS A 620 10.064 11.912 -11.339 1.00 13.30 C ATOM 601 CG LYS A 620 11.219 12.086 -12.306 1.00 31.14 C ATOM 602 CD LYS A 620 10.864 13.066 -13.415 1.00 32.54 C ATOM 603 CE LYS A 620 9.738 12.539 -14.302 1.00 3.50 C ATOM 604 NZ LYS A 620 9.359 13.505 -15.351 1.00 34.12 N ATOM 0 H LYS A 620 9.655 9.136 -10.993 1.00 72.12 H new ATOM 0 HA LYS A 620 11.261 11.218 -9.688 1.00 44.42 H new ATOM 0 HB2 LYS A 620 9.197 11.554 -11.895 1.00 13.30 H new ATOM 0 HB3 LYS A 620 9.801 12.889 -10.933 1.00 13.30 H new ATOM 0 HG2 LYS A 620 12.097 12.444 -11.768 1.00 31.14 H new ATOM 0 HG3 LYS A 620 11.482 11.121 -12.740 1.00 31.14 H new ATOM 0 HD2 LYS A 620 10.565 14.018 -12.976 1.00 32.54 H new ATOM 0 HD3 LYS A 620 11.746 13.259 -14.025 1.00 32.54 H new ATOM 0 HE2 LYS A 620 10.051 11.604 -14.767 1.00 3.50 H new ATOM 0 HE3 LYS A 620 8.867 12.313 -13.686 1.00 3.50 H new ATOM 0 HZ1 LYS A 620 8.592 13.106 -15.929 1.00 34.12 H new ATOM 0 HZ2 LYS A 620 9.036 14.389 -14.909 1.00 34.12 H new ATOM 0 HZ3 LYS A 620 10.182 13.702 -15.956 1.00 34.12 H new ATOM 618 N TYR A 621 8.581 10.060 -8.809 1.00 51.54 N ATOM 619 CA TYR A 621 7.514 10.134 -7.847 1.00 22.41 C ATOM 620 C TYR A 621 7.707 9.127 -6.763 1.00 13.40 C ATOM 621 O TYR A 621 8.518 8.204 -6.889 1.00 23.21 O ATOM 622 CB TYR A 621 6.129 9.950 -8.525 1.00 23.01 C ATOM 623 CG TYR A 621 5.731 11.091 -9.447 1.00 3.25 C ATOM 624 CD1 TYR A 621 6.421 11.335 -10.620 1.00 13.55 C ATOM 625 CD2 TYR A 621 4.681 11.935 -9.125 1.00 52.01 C ATOM 626 CE1 TYR A 621 6.090 12.374 -11.445 1.00 73.31 C ATOM 627 CE2 TYR A 621 4.337 12.986 -9.952 1.00 43.14 C ATOM 628 CZ TYR A 621 5.046 13.202 -11.108 1.00 70.42 C ATOM 629 OH TYR A 621 4.712 14.255 -11.932 1.00 5.35 O ATOM 0 H TYR A 621 8.762 9.127 -9.179 1.00 51.54 H new ATOM 0 HA TYR A 621 7.538 11.128 -7.401 1.00 22.41 H new ATOM 0 HB2 TYR A 621 6.137 9.022 -9.096 1.00 23.01 H new ATOM 0 HB3 TYR A 621 5.369 9.841 -7.751 1.00 23.01 H new ATOM 0 HD1 TYR A 621 7.242 10.688 -10.892 1.00 13.55 H new ATOM 0 HD2 TYR A 621 4.124 11.769 -8.215 1.00 52.01 H new ATOM 0 HE1 TYR A 621 6.645 12.543 -12.356 1.00 73.31 H new ATOM 0 HE2 TYR A 621 3.514 13.635 -9.691 1.00 43.14 H new ATOM 0 HH TYR A 621 3.951 14.741 -11.550 1.00 5.35 H new ATOM 639 N GLU A 622 7.032 9.329 -5.696 1.00 73.22 N ATOM 640 CA GLU A 622 6.981 8.383 -4.653 1.00 60.31 C ATOM 641 C GLU A 622 5.548 8.261 -4.286 1.00 52.32 C ATOM 642 O GLU A 622 4.769 9.226 -4.443 1.00 21.01 O ATOM 643 CB GLU A 622 7.772 8.803 -3.395 1.00 12.10 C ATOM 644 CG GLU A 622 7.180 9.997 -2.663 1.00 62.40 C ATOM 645 CD GLU A 622 7.812 10.253 -1.312 1.00 45.13 C ATOM 646 OE1 GLU A 622 8.903 10.854 -1.261 1.00 10.30 O ATOM 647 OE2 GLU A 622 7.218 9.844 -0.262 1.00 70.30 O ATOM 0 H GLU A 622 6.489 10.174 -5.521 1.00 73.22 H new ATOM 0 HA GLU A 622 7.431 7.453 -5.000 1.00 60.31 H new ATOM 0 HB2 GLU A 622 7.820 7.957 -2.709 1.00 12.10 H new ATOM 0 HB3 GLU A 622 8.796 9.038 -3.684 1.00 12.10 H new ATOM 0 HG2 GLU A 622 7.295 10.886 -3.283 1.00 62.40 H new ATOM 0 HG3 GLU A 622 6.110 9.837 -2.530 1.00 62.40 H new ATOM 654 N PHE A 623 5.175 7.136 -3.855 1.00 63.54 N ATOM 655 CA PHE A 623 3.872 6.966 -3.370 1.00 54.00 C ATOM 656 C PHE A 623 4.008 6.562 -1.947 1.00 54.54 C ATOM 657 O PHE A 623 4.654 5.560 -1.643 1.00 43.54 O ATOM 658 CB PHE A 623 3.143 5.874 -4.151 1.00 61.14 C ATOM 659 CG PHE A 623 3.042 6.122 -5.636 1.00 61.10 C ATOM 660 CD1 PHE A 623 4.076 5.763 -6.482 1.00 65.42 C ATOM 661 CD2 PHE A 623 1.917 6.708 -6.185 1.00 34.25 C ATOM 662 CE1 PHE A 623 3.990 5.986 -7.830 1.00 64.34 C ATOM 663 CE2 PHE A 623 1.830 6.929 -7.540 1.00 52.12 C ATOM 664 CZ PHE A 623 2.871 6.570 -8.361 1.00 32.21 C ATOM 0 H PHE A 623 5.761 6.301 -3.826 1.00 63.54 H new ATOM 0 HA PHE A 623 3.294 7.884 -3.477 1.00 54.00 H new ATOM 0 HB2 PHE A 623 3.656 4.926 -3.989 1.00 61.14 H new ATOM 0 HB3 PHE A 623 2.137 5.766 -3.745 1.00 61.14 H new ATOM 0 HD1 PHE A 623 4.963 5.301 -6.074 1.00 65.42 H new ATOM 0 HD2 PHE A 623 1.097 6.996 -5.543 1.00 34.25 H new ATOM 0 HE1 PHE A 623 4.807 5.701 -8.476 1.00 64.34 H new ATOM 0 HE2 PHE A 623 0.944 7.384 -7.958 1.00 52.12 H new ATOM 0 HZ PHE A 623 2.807 6.748 -9.424 1.00 32.21 H new ATOM 674 N HIS A 624 3.440 7.307 -1.079 1.00 42.42 N ATOM 675 CA HIS A 624 3.499 6.968 0.283 1.00 35.40 C ATOM 676 C HIS A 624 2.127 6.530 0.688 1.00 32.44 C ATOM 677 O HIS A 624 1.163 7.281 0.552 1.00 13.40 O ATOM 678 CB HIS A 624 3.938 8.175 1.088 1.00 40.21 C ATOM 679 CG HIS A 624 5.007 7.857 2.058 1.00 70.53 C ATOM 680 ND1 HIS A 624 6.287 8.317 1.925 1.00 13.01 N ATOM 681 CD2 HIS A 624 4.987 7.119 3.187 1.00 40.23 C ATOM 682 CE1 HIS A 624 7.011 7.868 2.931 1.00 73.11 C ATOM 683 NE2 HIS A 624 6.244 7.144 3.714 1.00 74.54 N ATOM 0 H HIS A 624 2.926 8.162 -1.292 1.00 42.42 H new ATOM 0 HA HIS A 624 4.218 6.168 0.463 1.00 35.40 H new ATOM 0 HB2 HIS A 624 4.289 8.951 0.408 1.00 40.21 H new ATOM 0 HB3 HIS A 624 3.079 8.583 1.621 1.00 40.21 H new ATOM 0 HD1 HIS A 624 6.627 8.912 1.169 1.00 13.01 H new ATOM 0 HD2 HIS A 624 4.132 6.603 3.598 1.00 40.23 H new ATOM 0 HE1 HIS A 624 8.062 8.063 3.086 1.00 73.11 H new ATOM 0 HE2 HIS A 624 6.539 6.679 4.572 1.00 74.54 H new ATOM 692 N ILE A 625 2.029 5.345 1.198 1.00 45.33 N ATOM 693 CA ILE A 625 0.749 4.780 1.522 1.00 20.34 C ATOM 694 C ILE A 625 0.849 4.037 2.816 1.00 71.44 C ATOM 695 O ILE A 625 1.942 3.615 3.228 1.00 52.42 O ATOM 696 CB ILE A 625 0.239 3.793 0.415 1.00 60.32 C ATOM 697 CG1 ILE A 625 1.155 2.580 0.319 1.00 21.51 C ATOM 698 CG2 ILE A 625 0.115 4.480 -0.947 1.00 21.43 C ATOM 699 CD1 ILE A 625 0.794 1.603 -0.785 1.00 20.10 C ATOM 0 H ILE A 625 2.825 4.741 1.403 1.00 45.33 H new ATOM 0 HA ILE A 625 0.038 5.603 1.596 1.00 20.34 H new ATOM 0 HB ILE A 625 -0.758 3.461 0.706 1.00 60.32 H new ATOM 0 HG12 ILE A 625 2.177 2.924 0.162 1.00 21.51 H new ATOM 0 HG13 ILE A 625 1.139 2.053 1.273 1.00 21.51 H new ATOM 0 HG21 ILE A 625 -0.241 3.762 -1.686 1.00 21.43 H new ATOM 0 HG22 ILE A 625 -0.592 5.307 -0.875 1.00 21.43 H new ATOM 0 HG23 ILE A 625 1.089 4.861 -1.252 1.00 21.43 H new ATOM 0 HD11 ILE A 625 1.498 0.771 -0.780 1.00 20.10 H new ATOM 0 HD12 ILE A 625 -0.215 1.225 -0.621 1.00 20.10 H new ATOM 0 HD13 ILE A 625 0.839 2.110 -1.749 1.00 20.10 H new ATOM 706 N ASN A 626 -0.239 3.907 3.461 1.00 24.22 N ATOM 707 CA ASN A 626 -0.311 3.163 4.688 1.00 64.22 C ATOM 708 C ASN A 626 -1.498 2.223 4.622 1.00 53.43 C ATOM 709 O ASN A 626 -2.425 2.457 3.839 1.00 54.22 O ATOM 710 CB ASN A 626 -0.469 4.123 5.874 1.00 10.43 C ATOM 711 CG ASN A 626 -0.460 3.422 7.213 1.00 31.30 C ATOM 712 OD1 ASN A 626 0.175 2.367 7.380 1.00 70.32 O ATOM 713 ND2 ASN A 626 -1.142 3.988 8.168 1.00 51.44 N ATOM 0 H ASN A 626 -1.127 4.312 3.164 1.00 24.22 H new ATOM 0 HA ASN A 626 0.606 2.589 4.824 1.00 64.22 H new ATOM 0 HB2 ASN A 626 0.337 4.856 5.850 1.00 10.43 H new ATOM 0 HB3 ASN A 626 -1.404 4.673 5.766 1.00 10.43 H new ATOM 0 HD21 ASN A 626 -1.168 3.565 9.096 1.00 51.44 H new ATOM 0 HD22 ASN A 626 -1.649 4.854 7.988 1.00 51.44 H new ATOM 719 N VAL A 627 -1.463 1.159 5.395 1.00 60.34 N ATOM 720 CA VAL A 627 -2.584 0.265 5.480 1.00 14.14 C ATOM 721 C VAL A 627 -3.582 0.851 6.412 1.00 41.41 C ATOM 722 O VAL A 627 -3.301 0.997 7.586 1.00 61.11 O ATOM 723 CB VAL A 627 -2.204 -1.153 5.980 1.00 42.53 C ATOM 724 CG1 VAL A 627 -3.455 -2.030 6.145 1.00 2.15 C ATOM 725 CG2 VAL A 627 -1.258 -1.803 5.007 1.00 14.13 C ATOM 0 H VAL A 627 -0.665 0.896 5.973 1.00 60.34 H new ATOM 0 HA VAL A 627 -2.984 0.149 4.473 1.00 14.14 H new ATOM 0 HB VAL A 627 -1.719 -1.053 6.951 1.00 42.53 H new ATOM 0 HG11 VAL A 627 -3.162 -3.019 6.497 1.00 2.15 H new ATOM 0 HG12 VAL A 627 -4.128 -1.572 6.870 1.00 2.15 H new ATOM 0 HG13 VAL A 627 -3.964 -2.122 5.186 1.00 2.15 H new ATOM 0 HG21 VAL A 627 -0.995 -2.799 5.365 1.00 14.13 H new ATOM 0 HG22 VAL A 627 -1.737 -1.883 4.031 1.00 14.13 H new ATOM 0 HG23 VAL A 627 -0.355 -1.199 4.919 1.00 14.13 H new ATOM 731 N CYS A 628 -4.689 1.247 5.839 1.00 22.40 N ATOM 732 CA CYS A 628 -5.884 1.773 6.489 1.00 0.24 C ATOM 733 C CYS A 628 -5.664 3.123 7.176 1.00 13.11 C ATOM 734 O CYS A 628 -4.583 3.434 7.698 1.00 25.51 O ATOM 735 CB CYS A 628 -6.528 0.757 7.465 1.00 41.41 C ATOM 736 SG CYS A 628 -5.626 0.432 9.016 1.00 72.42 S ATOM 0 H CYS A 628 -4.797 1.211 4.825 1.00 22.40 H new ATOM 0 HA CYS A 628 -6.588 1.946 5.675 1.00 0.24 H new ATOM 0 HB2 CYS A 628 -7.526 1.114 7.719 1.00 41.41 H new ATOM 0 HB3 CYS A 628 -6.653 -0.189 6.939 1.00 41.41 H new ATOM 741 N GLY A 629 -6.704 3.913 7.174 1.00 75.44 N ATOM 742 CA GLY A 629 -6.685 5.178 7.848 1.00 64.41 C ATOM 743 C GLY A 629 -5.855 6.179 7.112 1.00 51.50 C ATOM 744 O GLY A 629 -5.714 6.097 5.896 1.00 43.31 O ATOM 0 H GLY A 629 -7.584 3.697 6.706 1.00 75.44 H new ATOM 0 HA2 GLY A 629 -7.704 5.553 7.949 1.00 64.41 H new ATOM 0 HA3 GLY A 629 -6.291 5.048 8.856 1.00 64.41 H new ATOM 748 N PRO A 630 -5.348 7.165 7.810 1.00 70.14 N ATOM 749 CA PRO A 630 -4.444 8.139 7.238 1.00 53.23 C ATOM 750 C PRO A 630 -2.992 7.664 7.192 1.00 2.14 C ATOM 751 O PRO A 630 -2.605 6.671 7.846 1.00 54.01 O ATOM 752 CB PRO A 630 -4.558 9.312 8.179 1.00 72.21 C ATOM 753 CG PRO A 630 -4.923 8.712 9.502 1.00 32.51 C ATOM 754 CD PRO A 630 -5.678 7.460 9.218 1.00 72.11 C ATOM 0 HA PRO A 630 -4.705 8.355 6.202 1.00 53.23 H new ATOM 0 HB2 PRO A 630 -3.619 9.862 8.240 1.00 72.21 H new ATOM 0 HB3 PRO A 630 -5.318 10.016 7.842 1.00 72.21 H new ATOM 0 HG2 PRO A 630 -4.029 8.499 10.089 1.00 32.51 H new ATOM 0 HG3 PRO A 630 -5.530 9.404 10.085 1.00 32.51 H new ATOM 0 HD2 PRO A 630 -5.372 6.649 9.879 1.00 72.11 H new ATOM 0 HD3 PRO A 630 -6.750 7.598 9.358 1.00 72.11 H new ATOM 762 N VAL A 631 -2.210 8.371 6.425 1.00 11.24 N ATOM 763 CA VAL A 631 -0.810 8.148 6.314 1.00 13.32 C ATOM 764 C VAL A 631 -0.118 9.316 7.017 1.00 34.04 C ATOM 765 O VAL A 631 -0.500 10.481 6.818 1.00 12.35 O ATOM 766 CB VAL A 631 -0.375 8.056 4.809 1.00 65.02 C ATOM 767 CG1 VAL A 631 -0.560 9.338 4.024 1.00 43.10 C ATOM 768 CG2 VAL A 631 1.000 7.512 4.648 1.00 34.02 C ATOM 0 H VAL A 631 -2.547 9.140 5.846 1.00 11.24 H new ATOM 0 HA VAL A 631 -0.530 7.201 6.776 1.00 13.32 H new ATOM 0 HB VAL A 631 -1.071 7.342 4.369 1.00 65.02 H new ATOM 0 HG11 VAL A 631 -0.235 9.185 2.995 1.00 43.10 H new ATOM 0 HG12 VAL A 631 -1.612 9.622 4.033 1.00 43.10 H new ATOM 0 HG13 VAL A 631 0.034 10.131 4.478 1.00 43.10 H new ATOM 0 HG21 VAL A 631 1.252 7.469 3.589 1.00 34.02 H new ATOM 0 HG22 VAL A 631 1.710 8.158 5.164 1.00 34.02 H new ATOM 0 HG23 VAL A 631 1.047 6.509 5.073 1.00 34.02 H new ATOM 774 N SER A 632 0.845 9.039 7.850 1.00 52.42 N ATOM 775 CA SER A 632 1.477 10.102 8.569 1.00 3.33 C ATOM 776 C SER A 632 2.812 10.450 7.923 1.00 52.25 C ATOM 777 O SER A 632 3.872 9.981 8.344 1.00 2.43 O ATOM 778 CB SER A 632 1.611 9.755 10.068 1.00 54.21 C ATOM 779 OG SER A 632 2.110 10.840 10.832 1.00 50.31 O ATOM 0 H SER A 632 1.203 8.104 8.044 1.00 52.42 H new ATOM 0 HA SER A 632 0.850 10.992 8.516 1.00 3.33 H new ATOM 0 HB2 SER A 632 0.637 9.457 10.458 1.00 54.21 H new ATOM 0 HB3 SER A 632 2.275 8.898 10.182 1.00 54.21 H new ATOM 0 HG SER A 632 2.176 10.574 11.773 1.00 50.31 H new ATOM 785 N VAL A 633 2.738 11.194 6.838 1.00 23.25 N ATOM 786 CA VAL A 633 3.931 11.628 6.128 1.00 72.54 C ATOM 787 C VAL A 633 4.032 13.132 6.187 1.00 51.54 C ATOM 788 O VAL A 633 3.037 13.835 5.976 1.00 0.55 O ATOM 789 CB VAL A 633 3.878 11.212 4.640 1.00 34.54 C ATOM 790 CG1 VAL A 633 5.195 11.476 3.928 1.00 32.33 C ATOM 791 CG2 VAL A 633 3.489 9.786 4.519 1.00 61.33 C ATOM 0 H VAL A 633 1.862 11.513 6.425 1.00 23.25 H new ATOM 0 HA VAL A 633 4.792 11.158 6.604 1.00 72.54 H new ATOM 0 HB VAL A 633 3.122 11.827 4.151 1.00 34.54 H new ATOM 0 HG11 VAL A 633 5.113 11.169 2.885 1.00 32.33 H new ATOM 0 HG12 VAL A 633 5.428 12.540 3.976 1.00 32.33 H new ATOM 0 HG13 VAL A 633 5.990 10.909 4.412 1.00 32.33 H new ATOM 0 HG21 VAL A 633 3.455 9.506 3.466 1.00 61.33 H new ATOM 0 HG22 VAL A 633 4.220 9.164 5.037 1.00 61.33 H new ATOM 0 HG23 VAL A 633 2.506 9.638 4.965 1.00 61.33 H new ATOM 797 N GLY A 634 5.223 13.629 6.419 1.00 3.35 N ATOM 798 CA GLY A 634 5.435 15.057 6.483 1.00 75.22 C ATOM 799 C GLY A 634 5.559 15.687 5.108 1.00 31.20 C ATOM 800 O GLY A 634 6.360 16.595 4.905 1.00 11.43 O ATOM 0 H GLY A 634 6.061 13.067 6.567 1.00 3.35 H new ATOM 0 HA2 GLY A 634 4.606 15.521 7.018 1.00 75.22 H new ATOM 0 HA3 GLY A 634 6.339 15.262 7.056 1.00 75.22 H new ATOM 804 N ALA A 635 4.777 15.194 4.169 1.00 30.11 N ATOM 805 CA ALA A 635 4.771 15.716 2.821 1.00 51.24 C ATOM 806 C ALA A 635 3.343 15.811 2.296 1.00 55.02 C ATOM 807 O ALA A 635 3.102 16.347 1.210 1.00 10.51 O ATOM 808 CB ALA A 635 5.615 14.836 1.906 1.00 42.20 C ATOM 0 H ALA A 635 4.129 14.421 4.320 1.00 30.11 H new ATOM 0 HA ALA A 635 5.204 16.716 2.835 1.00 51.24 H new ATOM 0 HB1 ALA A 635 5.600 15.243 0.895 1.00 42.20 H new ATOM 0 HB2 ALA A 635 6.642 14.810 2.272 1.00 42.20 H new ATOM 0 HB3 ALA A 635 5.208 13.825 1.896 1.00 42.20 H new ATOM 814 N CYS A 636 2.399 15.299 3.067 1.00 71.14 N ATOM 815 CA CYS A 636 1.014 15.300 2.672 1.00 20.40 C ATOM 816 C CYS A 636 0.122 15.469 3.903 1.00 34.11 C ATOM 817 O CYS A 636 0.566 15.191 5.025 1.00 51.13 O ATOM 818 CB CYS A 636 0.685 14.006 1.925 1.00 4.33 C ATOM 819 SG CYS A 636 0.991 12.481 2.874 1.00 31.13 S ATOM 0 H CYS A 636 2.576 14.875 3.978 1.00 71.14 H new ATOM 0 HA CYS A 636 0.828 16.138 2.000 1.00 20.40 H new ATOM 0 HB2 CYS A 636 -0.364 14.030 1.629 1.00 4.33 H new ATOM 0 HB3 CYS A 636 1.274 13.972 1.008 1.00 4.33 H new ATOM 824 N PRO A 637 -1.127 15.947 3.732 1.00 42.33 N ATOM 825 CA PRO A 637 -2.054 16.164 4.844 1.00 44.44 C ATOM 826 C PRO A 637 -2.557 14.855 5.476 1.00 52.41 C ATOM 827 O PRO A 637 -2.703 13.828 4.787 1.00 53.11 O ATOM 828 CB PRO A 637 -3.235 16.914 4.195 1.00 30.11 C ATOM 829 CG PRO A 637 -2.737 17.356 2.866 1.00 61.13 C ATOM 830 CD PRO A 637 -1.737 16.331 2.451 1.00 2.32 C ATOM 0 HA PRO A 637 -1.569 16.705 5.656 1.00 44.44 H new ATOM 0 HB2 PRO A 637 -4.105 16.265 4.093 1.00 30.11 H new ATOM 0 HB3 PRO A 637 -3.542 17.765 4.803 1.00 30.11 H new ATOM 0 HG2 PRO A 637 -3.552 17.423 2.145 1.00 61.13 H new ATOM 0 HG3 PRO A 637 -2.283 18.345 2.927 1.00 61.13 H new ATOM 0 HD2 PRO A 637 -2.208 15.482 1.955 1.00 2.32 H new ATOM 0 HD3 PRO A 637 -1.002 16.739 1.757 1.00 2.32 H new ATOM 838 N PRO A 638 -2.843 14.879 6.803 1.00 11.31 N ATOM 839 CA PRO A 638 -3.394 13.723 7.549 1.00 24.42 C ATOM 840 C PRO A 638 -4.742 13.221 6.985 1.00 70.12 C ATOM 841 O PRO A 638 -5.210 12.166 7.358 1.00 75.24 O ATOM 842 CB PRO A 638 -3.585 14.264 8.971 1.00 12.12 C ATOM 843 CG PRO A 638 -2.639 15.405 9.068 1.00 44.20 C ATOM 844 CD PRO A 638 -2.606 16.027 7.705 1.00 5.02 C ATOM 0 HA PRO A 638 -2.728 12.862 7.486 1.00 24.42 H new ATOM 0 HB2 PRO A 638 -4.613 14.586 9.138 1.00 12.12 H new ATOM 0 HB3 PRO A 638 -3.365 13.502 9.718 1.00 12.12 H new ATOM 0 HG2 PRO A 638 -2.969 16.124 9.818 1.00 44.20 H new ATOM 0 HG3 PRO A 638 -1.647 15.066 9.367 1.00 44.20 H new ATOM 0 HD2 PRO A 638 -3.374 16.792 7.593 1.00 5.02 H new ATOM 0 HD3 PRO A 638 -1.648 16.506 7.504 1.00 5.02 H new ATOM 852 N ASP A 639 -5.356 13.999 6.089 1.00 61.43 N ATOM 853 CA ASP A 639 -6.635 13.610 5.446 1.00 4.44 C ATOM 854 C ASP A 639 -6.460 12.448 4.511 1.00 1.35 C ATOM 855 O ASP A 639 -7.426 11.794 4.143 1.00 42.35 O ATOM 856 CB ASP A 639 -7.248 14.759 4.628 1.00 12.03 C ATOM 857 CG ASP A 639 -7.864 15.845 5.446 1.00 12.41 C ATOM 858 OD1 ASP A 639 -7.136 16.728 5.929 1.00 22.00 O ATOM 859 OD2 ASP A 639 -9.104 15.854 5.591 1.00 60.31 O ATOM 0 H ASP A 639 -4.996 14.904 5.786 1.00 61.43 H new ATOM 0 HA ASP A 639 -7.297 13.341 6.269 1.00 4.44 H new ATOM 0 HB2 ASP A 639 -6.472 15.193 3.998 1.00 12.03 H new ATOM 0 HB3 ASP A 639 -8.007 14.349 3.962 1.00 12.03 H new ATOM 864 N SER A 640 -5.252 12.184 4.128 1.00 35.43 N ATOM 865 CA SER A 640 -5.007 11.154 3.174 1.00 21.34 C ATOM 866 C SER A 640 -4.342 9.948 3.803 1.00 73.04 C ATOM 867 O SER A 640 -3.548 10.081 4.730 1.00 45.11 O ATOM 868 CB SER A 640 -4.218 11.702 1.971 1.00 61.01 C ATOM 869 OG SER A 640 -3.028 12.378 2.373 1.00 43.43 O ATOM 0 H SER A 640 -4.419 12.669 4.463 1.00 35.43 H new ATOM 0 HA SER A 640 -5.970 10.806 2.799 1.00 21.34 H new ATOM 0 HB2 SER A 640 -3.960 10.880 1.303 1.00 61.01 H new ATOM 0 HB3 SER A 640 -4.850 12.387 1.405 1.00 61.01 H new ATOM 0 HG SER A 640 -3.208 12.907 3.178 1.00 43.43 H new ATOM 875 N GLY A 641 -4.722 8.778 3.330 1.00 31.33 N ATOM 876 CA GLY A 641 -4.112 7.537 3.775 1.00 53.33 C ATOM 877 C GLY A 641 -3.116 7.037 2.757 1.00 2.43 C ATOM 878 O GLY A 641 -2.362 6.083 2.993 1.00 31.14 O ATOM 0 H GLY A 641 -5.456 8.659 2.632 1.00 31.33 H new ATOM 0 HA2 GLY A 641 -3.614 7.693 4.732 1.00 53.33 H new ATOM 0 HA3 GLY A 641 -4.884 6.784 3.936 1.00 53.33 H new ATOM 882 N ALA A 642 -3.125 7.693 1.625 1.00 25.10 N ATOM 883 CA ALA A 642 -2.219 7.441 0.547 1.00 14.43 C ATOM 884 C ALA A 642 -1.984 8.760 -0.149 1.00 13.42 C ATOM 885 O ALA A 642 -2.936 9.442 -0.543 1.00 3.21 O ATOM 886 CB ALA A 642 -2.812 6.415 -0.406 1.00 54.32 C ATOM 0 H ALA A 642 -3.788 8.442 1.427 1.00 25.10 H new ATOM 0 HA ALA A 642 -1.276 7.033 0.910 1.00 14.43 H new ATOM 0 HB1 ALA A 642 -2.114 6.231 -1.223 1.00 54.32 H new ATOM 0 HB2 ALA A 642 -2.997 5.484 0.130 1.00 54.32 H new ATOM 0 HB3 ALA A 642 -3.751 6.794 -0.810 1.00 54.32 H new ATOM 892 N CYS A 643 -0.753 9.146 -0.258 1.00 22.11 N ATOM 893 CA CYS A 643 -0.415 10.416 -0.834 1.00 60.10 C ATOM 894 C CYS A 643 0.814 10.307 -1.716 1.00 74.03 C ATOM 895 O CYS A 643 1.788 9.632 -1.365 1.00 54.25 O ATOM 896 CB CYS A 643 -0.193 11.457 0.272 1.00 40.11 C ATOM 897 SG CYS A 643 1.180 11.074 1.428 1.00 35.45 S ATOM 0 H CYS A 643 0.048 8.594 0.048 1.00 22.11 H new ATOM 0 HA CYS A 643 -1.247 10.739 -1.459 1.00 60.10 H new ATOM 0 HB2 CYS A 643 0.001 12.424 -0.193 1.00 40.11 H new ATOM 0 HB3 CYS A 643 -1.114 11.559 0.846 1.00 40.11 H new ATOM 902 N GLN A 644 0.763 10.914 -2.871 1.00 34.10 N ATOM 903 CA GLN A 644 1.921 10.940 -3.730 1.00 53.53 C ATOM 904 C GLN A 644 2.523 12.300 -3.755 1.00 53.13 C ATOM 905 O GLN A 644 1.814 13.297 -3.696 1.00 63.15 O ATOM 906 CB GLN A 644 1.625 10.525 -5.158 1.00 5.33 C ATOM 907 CG GLN A 644 0.485 11.267 -5.830 1.00 35.54 C ATOM 908 CD GLN A 644 0.346 10.919 -7.305 1.00 22.30 C ATOM 909 OE1 GLN A 644 0.666 9.818 -7.733 1.00 75.32 O ATOM 910 NE2 GLN A 644 -0.122 11.856 -8.087 1.00 71.13 N ATOM 0 H GLN A 644 -0.059 11.394 -3.239 1.00 34.10 H new ATOM 0 HA GLN A 644 2.614 10.213 -3.306 1.00 53.53 H new ATOM 0 HB2 GLN A 644 2.527 10.665 -5.753 1.00 5.33 H new ATOM 0 HB3 GLN A 644 1.398 9.459 -5.169 1.00 5.33 H new ATOM 0 HG2 GLN A 644 -0.448 11.034 -5.316 1.00 35.54 H new ATOM 0 HG3 GLN A 644 0.645 12.340 -5.728 1.00 35.54 H new ATOM 0 HE21 GLN A 644 -0.380 12.763 -7.698 1.00 71.13 H new ATOM 0 HE22 GLN A 644 -0.230 11.680 -9.086 1.00 71.13 H new ATOM 918 N VAL A 645 3.806 12.339 -3.828 1.00 12.14 N ATOM 919 CA VAL A 645 4.526 13.556 -3.951 1.00 24.42 C ATOM 920 C VAL A 645 5.602 13.372 -4.999 1.00 70.14 C ATOM 921 O VAL A 645 6.256 12.318 -5.062 1.00 2.45 O ATOM 922 CB VAL A 645 5.098 14.085 -2.576 1.00 4.40 C ATOM 923 CG1 VAL A 645 5.994 13.078 -1.906 1.00 52.11 C ATOM 924 CG2 VAL A 645 5.830 15.412 -2.740 1.00 64.02 C ATOM 0 H VAL A 645 4.397 11.508 -3.803 1.00 12.14 H new ATOM 0 HA VAL A 645 3.839 14.339 -4.272 1.00 24.42 H new ATOM 0 HB VAL A 645 4.234 14.246 -1.931 1.00 4.40 H new ATOM 0 HG11 VAL A 645 6.362 13.488 -0.965 1.00 52.11 H new ATOM 0 HG12 VAL A 645 5.432 12.165 -1.709 1.00 52.11 H new ATOM 0 HG13 VAL A 645 6.838 12.851 -2.558 1.00 52.11 H new ATOM 0 HG21 VAL A 645 6.208 15.741 -1.772 1.00 64.02 H new ATOM 0 HG22 VAL A 645 6.664 15.285 -3.431 1.00 64.02 H new ATOM 0 HG23 VAL A 645 5.143 16.160 -3.135 1.00 64.02 H new ATOM 930 N SER A 646 5.739 14.332 -5.859 1.00 24.23 N ATOM 931 CA SER A 646 6.730 14.267 -6.865 1.00 4.34 C ATOM 932 C SER A 646 8.071 14.642 -6.270 1.00 62.51 C ATOM 933 O SER A 646 8.244 15.731 -5.766 1.00 21.54 O ATOM 934 CB SER A 646 6.349 15.161 -8.063 1.00 14.22 C ATOM 935 OG SER A 646 6.090 16.512 -7.677 1.00 60.41 O ATOM 0 H SER A 646 5.166 15.176 -5.877 1.00 24.23 H new ATOM 0 HA SER A 646 6.803 13.249 -7.247 1.00 4.34 H new ATOM 0 HB2 SER A 646 7.156 15.144 -8.796 1.00 14.22 H new ATOM 0 HB3 SER A 646 5.466 14.751 -8.552 1.00 14.22 H new ATOM 0 HG SER A 646 5.703 17.000 -8.434 1.00 60.41 H new ATOM 941 N ARG A 647 9.008 13.729 -6.304 1.00 4.53 N ATOM 942 CA ARG A 647 10.342 13.993 -5.776 1.00 4.44 C ATOM 943 C ARG A 647 11.054 14.971 -6.706 1.00 20.22 C ATOM 944 O ARG A 647 12.050 15.611 -6.349 1.00 3.13 O ATOM 945 CB ARG A 647 11.131 12.677 -5.609 1.00 34.21 C ATOM 946 CG ARG A 647 11.510 11.985 -6.894 1.00 75.13 C ATOM 947 CD ARG A 647 12.000 10.575 -6.637 1.00 12.34 C ATOM 948 NE ARG A 647 13.144 10.524 -5.733 1.00 73.12 N ATOM 949 CZ ARG A 647 13.516 9.440 -5.045 1.00 33.10 C ATOM 950 NH1 ARG A 647 12.812 8.315 -5.140 1.00 52.43 N ATOM 951 NH2 ARG A 647 14.589 9.483 -4.265 1.00 33.01 N ATOM 0 H ARG A 647 8.882 12.793 -6.690 1.00 4.53 H new ATOM 0 HA ARG A 647 10.269 14.443 -4.786 1.00 4.44 H new ATOM 0 HB2 ARG A 647 12.041 12.887 -5.047 1.00 34.21 H new ATOM 0 HB3 ARG A 647 10.536 11.990 -5.007 1.00 34.21 H new ATOM 0 HG2 ARG A 647 10.649 11.957 -7.562 1.00 75.13 H new ATOM 0 HG3 ARG A 647 12.288 12.556 -7.401 1.00 75.13 H new ATOM 0 HD2 ARG A 647 11.186 9.984 -6.217 1.00 12.34 H new ATOM 0 HD3 ARG A 647 12.273 10.113 -7.586 1.00 12.34 H new ATOM 0 HE ARG A 647 13.697 11.373 -5.618 1.00 73.12 H new ATOM 0 HH11 ARG A 647 11.987 8.279 -5.739 1.00 52.43 H new ATOM 0 HH12 ARG A 647 13.097 7.489 -4.614 1.00 52.43 H new ATOM 0 HH21 ARG A 647 15.131 10.344 -4.190 1.00 33.01 H new ATOM 0 HH22 ARG A 647 14.872 8.655 -3.741 1.00 33.01 H new ATOM 963 N SER A 648 10.505 15.076 -7.895 1.00 23.11 N ATOM 964 CA SER A 648 10.992 15.902 -8.932 1.00 53.51 C ATOM 965 C SER A 648 10.581 17.386 -8.771 1.00 43.40 C ATOM 966 O SER A 648 11.427 18.275 -8.861 1.00 33.23 O ATOM 967 CB SER A 648 10.420 15.317 -10.208 1.00 65.22 C ATOM 968 OG SER A 648 9.035 15.023 -10.027 1.00 14.14 O ATOM 0 H SER A 648 9.668 14.556 -8.159 1.00 23.11 H new ATOM 0 HA SER A 648 12.082 15.916 -8.928 1.00 53.51 H new ATOM 0 HB2 SER A 648 10.547 16.021 -11.030 1.00 65.22 H new ATOM 0 HB3 SER A 648 10.961 14.410 -10.478 1.00 65.22 H new ATOM 0 HG SER A 648 8.632 14.799 -10.892 1.00 14.14 H new ATOM 974 N ASP A 649 9.298 17.661 -8.548 1.00 64.22 N ATOM 975 CA ASP A 649 8.860 19.063 -8.396 1.00 51.42 C ATOM 976 C ASP A 649 8.505 19.420 -6.949 1.00 22.51 C ATOM 977 O ASP A 649 8.512 20.588 -6.555 1.00 43.40 O ATOM 978 CB ASP A 649 7.705 19.384 -9.342 1.00 12.44 C ATOM 979 CG ASP A 649 7.382 20.859 -9.393 1.00 10.12 C ATOM 980 OD1 ASP A 649 7.966 21.571 -10.235 1.00 71.23 O ATOM 981 OD2 ASP A 649 6.546 21.329 -8.610 1.00 60.12 O ATOM 0 H ASP A 649 8.558 16.963 -8.469 1.00 64.22 H new ATOM 0 HA ASP A 649 9.711 19.686 -8.669 1.00 51.42 H new ATOM 0 HB2 ASP A 649 7.955 19.037 -10.344 1.00 12.44 H new ATOM 0 HB3 ASP A 649 6.819 18.833 -9.026 1.00 12.44 H new ATOM 986 N ARG A 650 8.241 18.397 -6.176 1.00 53.11 N ATOM 987 CA ARG A 650 7.773 18.493 -4.781 1.00 34.13 C ATOM 988 C ARG A 650 6.329 18.969 -4.631 1.00 34.52 C ATOM 989 O ARG A 650 6.011 19.801 -3.769 1.00 2.53 O ATOM 990 CB ARG A 650 8.747 19.190 -3.789 1.00 14.30 C ATOM 991 CG ARG A 650 9.976 18.358 -3.384 1.00 51.41 C ATOM 992 CD ARG A 650 10.952 18.121 -4.523 1.00 52.12 C ATOM 993 NE ARG A 650 11.591 19.359 -4.975 1.00 4.43 N ATOM 994 CZ ARG A 650 12.580 19.426 -5.873 1.00 72.30 C ATOM 995 NH1 ARG A 650 13.063 18.312 -6.433 1.00 54.44 N ATOM 996 NH2 ARG A 650 13.095 20.602 -6.201 1.00 13.51 N ATOM 0 H ARG A 650 8.344 17.433 -6.494 1.00 53.11 H new ATOM 0 HA ARG A 650 7.775 17.450 -4.466 1.00 34.13 H new ATOM 0 HB2 ARG A 650 9.091 20.122 -4.237 1.00 14.30 H new ATOM 0 HB3 ARG A 650 8.194 19.455 -2.888 1.00 14.30 H new ATOM 0 HG2 ARG A 650 10.496 18.865 -2.571 1.00 51.41 H new ATOM 0 HG3 ARG A 650 9.641 17.395 -2.997 1.00 51.41 H new ATOM 0 HD2 ARG A 650 11.718 17.416 -4.201 1.00 52.12 H new ATOM 0 HD3 ARG A 650 10.426 17.660 -5.359 1.00 52.12 H new ATOM 0 HE ARG A 650 11.257 20.236 -4.575 1.00 4.43 H new ATOM 0 HH11 ARG A 650 12.677 17.403 -6.176 1.00 54.44 H new ATOM 0 HH12 ARG A 650 13.817 18.371 -7.117 1.00 54.44 H new ATOM 0 HH21 ARG A 650 12.737 21.454 -5.769 1.00 13.51 H new ATOM 0 HH22 ARG A 650 13.849 20.655 -6.886 1.00 13.51 H new ATOM 1008 N LYS A 651 5.464 18.447 -5.488 1.00 15.33 N ATOM 1009 CA LYS A 651 4.034 18.633 -5.363 1.00 3.44 C ATOM 1010 C LYS A 651 3.413 17.375 -4.826 1.00 10.10 C ATOM 1011 O LYS A 651 3.888 16.289 -5.148 1.00 12.12 O ATOM 1012 CB LYS A 651 3.393 18.903 -6.683 1.00 2.40 C ATOM 1013 CG LYS A 651 3.790 20.168 -7.307 1.00 53.24 C ATOM 1014 CD LYS A 651 2.781 20.499 -8.352 1.00 2.43 C ATOM 1015 CE LYS A 651 3.043 21.807 -8.990 1.00 10.35 C ATOM 1016 NZ LYS A 651 4.269 21.804 -9.817 1.00 72.41 N ATOM 0 H LYS A 651 5.739 17.881 -6.291 1.00 15.33 H new ATOM 0 HA LYS A 651 3.877 19.483 -4.699 1.00 3.44 H new ATOM 0 HB2 LYS A 651 3.634 18.086 -7.363 1.00 2.40 H new ATOM 0 HB3 LYS A 651 2.311 18.901 -6.554 1.00 2.40 H new ATOM 0 HG2 LYS A 651 3.842 20.962 -6.562 1.00 53.24 H new ATOM 0 HG3 LYS A 651 4.783 20.081 -7.749 1.00 53.24 H new ATOM 0 HD2 LYS A 651 2.781 19.719 -9.114 1.00 2.43 H new ATOM 0 HD3 LYS A 651 1.787 20.508 -7.905 1.00 2.43 H new ATOM 0 HE2 LYS A 651 2.191 22.080 -9.612 1.00 10.35 H new ATOM 0 HE3 LYS A 651 3.132 22.572 -8.218 1.00 10.35 H new ATOM 0 HZ1 LYS A 651 4.241 22.604 -10.481 1.00 72.41 H new ATOM 0 HZ2 LYS A 651 5.103 21.893 -9.202 1.00 72.41 H new ATOM 0 HZ3 LYS A 651 4.326 20.913 -10.350 1.00 72.41 H new ATOM 1030 N SER A 652 2.367 17.480 -4.044 1.00 54.11 N ATOM 1031 CA SER A 652 1.718 16.287 -3.564 1.00 34.51 C ATOM 1032 C SER A 652 0.244 16.262 -3.912 1.00 75.14 C ATOM 1033 O SER A 652 -0.407 17.309 -4.036 1.00 34.20 O ATOM 1034 CB SER A 652 1.948 16.060 -2.074 1.00 13.55 C ATOM 1035 OG SER A 652 1.477 17.161 -1.300 1.00 74.53 O ATOM 0 H SER A 652 1.954 18.359 -3.732 1.00 54.11 H new ATOM 0 HA SER A 652 2.186 15.452 -4.086 1.00 34.51 H new ATOM 0 HB2 SER A 652 1.438 15.149 -1.761 1.00 13.55 H new ATOM 0 HB3 SER A 652 3.011 15.911 -1.887 1.00 13.55 H new ATOM 0 HG SER A 652 1.885 17.133 -0.409 1.00 74.53 H new ATOM 1041 N TRP A 653 -0.268 15.072 -4.086 1.00 23.54 N ATOM 1042 CA TRP A 653 -1.641 14.858 -4.445 1.00 12.12 C ATOM 1043 C TRP A 653 -2.248 13.814 -3.531 1.00 41.43 C ATOM 1044 O TRP A 653 -1.526 12.992 -2.941 1.00 55.44 O ATOM 1045 CB TRP A 653 -1.737 14.420 -5.909 1.00 33.14 C ATOM 1046 CG TRP A 653 -1.190 15.443 -6.873 1.00 71.35 C ATOM 1047 CD1 TRP A 653 -1.857 16.509 -7.412 1.00 12.43 C ATOM 1048 CD2 TRP A 653 0.146 15.498 -7.398 1.00 4.25 C ATOM 1049 NE1 TRP A 653 -1.013 17.213 -8.249 1.00 13.13 N ATOM 1050 CE2 TRP A 653 0.216 16.609 -8.253 1.00 1.30 C ATOM 1051 CE3 TRP A 653 1.285 14.711 -7.225 1.00 50.22 C ATOM 1052 CZ2 TRP A 653 1.384 16.949 -8.935 1.00 43.51 C ATOM 1053 CZ3 TRP A 653 2.436 15.043 -7.891 1.00 22.14 C ATOM 1054 CH2 TRP A 653 2.483 16.154 -8.741 1.00 62.43 C ATOM 0 H TRP A 653 0.268 14.211 -3.980 1.00 23.54 H new ATOM 0 HA TRP A 653 -2.196 15.789 -4.330 1.00 12.12 H new ATOM 0 HB2 TRP A 653 -1.195 13.483 -6.037 1.00 33.14 H new ATOM 0 HB3 TRP A 653 -2.780 14.221 -6.154 1.00 33.14 H new ATOM 0 HD1 TRP A 653 -2.888 16.762 -7.213 1.00 12.43 H new ATOM 0 HE1 TRP A 653 -1.265 18.048 -8.778 1.00 13.13 H new ATOM 0 HE3 TRP A 653 1.260 13.850 -6.574 1.00 50.22 H new ATOM 0 HZ2 TRP A 653 1.421 17.806 -9.591 1.00 43.51 H new ATOM 0 HZ3 TRP A 653 3.321 14.438 -7.758 1.00 22.14 H new ATOM 0 HH2 TRP A 653 3.404 16.389 -9.254 1.00 62.43 H new ATOM 1065 N ASN A 654 -3.549 13.823 -3.438 1.00 32.01 N ATOM 1066 CA ASN A 654 -4.275 12.949 -2.531 1.00 13.50 C ATOM 1067 C ASN A 654 -4.717 11.717 -3.299 1.00 45.52 C ATOM 1068 O ASN A 654 -5.394 11.834 -4.317 1.00 13.35 O ATOM 1069 CB ASN A 654 -5.518 13.691 -2.029 1.00 13.42 C ATOM 1070 CG ASN A 654 -6.236 13.030 -0.872 1.00 64.34 C ATOM 1071 OD1 ASN A 654 -6.230 11.815 -0.713 1.00 4.53 O ATOM 1072 ND2 ASN A 654 -6.868 13.832 -0.062 1.00 2.34 N ATOM 0 H ASN A 654 -4.148 14.438 -3.989 1.00 32.01 H new ATOM 0 HA ASN A 654 -3.643 12.662 -1.690 1.00 13.50 H new ATOM 0 HB2 ASN A 654 -5.225 14.697 -1.728 1.00 13.42 H new ATOM 0 HB3 ASN A 654 -6.218 13.798 -2.858 1.00 13.42 H new ATOM 0 HD21 ASN A 654 -7.379 13.453 0.735 1.00 2.34 H new ATOM 0 HD22 ASN A 654 -6.851 14.839 -0.225 1.00 2.34 H new ATOM 1078 N LEU A 655 -4.335 10.553 -2.816 1.00 11.50 N ATOM 1079 CA LEU A 655 -4.643 9.301 -3.491 1.00 24.11 C ATOM 1080 C LEU A 655 -5.674 8.513 -2.711 1.00 13.52 C ATOM 1081 O LEU A 655 -5.816 7.301 -2.882 1.00 63.14 O ATOM 1082 CB LEU A 655 -3.378 8.467 -3.649 1.00 4.51 C ATOM 1083 CG LEU A 655 -2.244 9.105 -4.429 1.00 15.20 C ATOM 1084 CD1 LEU A 655 -1.080 8.156 -4.531 1.00 12.32 C ATOM 1085 CD2 LEU A 655 -2.706 9.530 -5.803 1.00 62.34 C ATOM 0 H LEU A 655 -3.806 10.444 -1.951 1.00 11.50 H new ATOM 0 HA LEU A 655 -5.049 9.534 -4.475 1.00 24.11 H new ATOM 0 HB2 LEU A 655 -3.009 8.214 -2.655 1.00 4.51 H new ATOM 0 HB3 LEU A 655 -3.645 7.530 -4.138 1.00 4.51 H new ATOM 0 HG LEU A 655 -1.920 9.997 -3.892 1.00 15.20 H new ATOM 0 HD11 LEU A 655 -0.274 8.628 -5.093 1.00 12.32 H new ATOM 0 HD12 LEU A 655 -0.726 7.905 -3.531 1.00 12.32 H new ATOM 0 HD13 LEU A 655 -1.396 7.247 -5.043 1.00 12.32 H new ATOM 0 HD21 LEU A 655 -1.875 9.984 -6.342 1.00 62.34 H new ATOM 0 HD22 LEU A 655 -3.062 8.659 -6.353 1.00 62.34 H new ATOM 0 HD23 LEU A 655 -3.515 10.254 -5.707 1.00 62.34 H new ATOM 1093 N GLY A 656 -6.388 9.190 -1.875 1.00 42.53 N ATOM 1094 CA GLY A 656 -7.407 8.554 -1.121 1.00 25.32 C ATOM 1095 C GLY A 656 -7.431 9.051 0.269 1.00 22.21 C ATOM 1096 O GLY A 656 -6.407 8.999 0.983 1.00 54.11 O ATOM 0 H GLY A 656 -6.281 10.189 -1.699 1.00 42.53 H new ATOM 0 HA2 GLY A 656 -8.375 8.731 -1.590 1.00 25.32 H new ATOM 0 HA3 GLY A 656 -7.245 7.476 -1.122 1.00 25.32 H new ATOM 1100 N ARG A 657 -8.576 9.539 0.689 1.00 44.44 N ATOM 1101 CA ARG A 657 -8.688 10.065 1.988 1.00 15.21 C ATOM 1102 C ARG A 657 -8.755 8.924 2.994 1.00 73.12 C ATOM 1103 O ARG A 657 -8.996 7.775 2.597 1.00 32.22 O ATOM 1104 CB ARG A 657 -9.860 11.042 2.086 1.00 44.33 C ATOM 1105 CG ARG A 657 -11.260 10.471 2.036 1.00 11.25 C ATOM 1106 CD ARG A 657 -12.309 11.578 2.119 1.00 71.02 C ATOM 1107 NE ARG A 657 -12.338 12.401 0.898 1.00 5.41 N ATOM 1108 CZ ARG A 657 -12.103 13.720 0.829 1.00 1.01 C ATOM 1109 NH1 ARG A 657 -11.746 14.412 1.920 1.00 61.31 N ATOM 1110 NH2 ARG A 657 -12.219 14.336 -0.340 1.00 65.03 N ATOM 0 H ARG A 657 -9.431 9.573 0.134 1.00 44.44 H new ATOM 0 HA ARG A 657 -7.802 10.652 2.229 1.00 15.21 H new ATOM 0 HB2 ARG A 657 -9.757 11.596 3.019 1.00 44.33 H new ATOM 0 HB3 ARG A 657 -9.763 11.764 1.275 1.00 44.33 H new ATOM 0 HG2 ARG A 657 -11.394 9.908 1.112 1.00 11.25 H new ATOM 0 HG3 ARG A 657 -11.400 9.771 2.859 1.00 11.25 H new ATOM 0 HD2 ARG A 657 -13.292 11.135 2.282 1.00 71.02 H new ATOM 0 HD3 ARG A 657 -12.099 12.213 2.980 1.00 71.02 H new ATOM 0 HE ARG A 657 -12.557 11.924 0.024 1.00 5.41 H new ATOM 0 HH11 ARG A 657 -11.650 13.936 2.817 1.00 61.31 H new ATOM 0 HH12 ARG A 657 -11.570 15.415 1.853 1.00 61.31 H new ATOM 0 HH21 ARG A 657 -12.484 13.807 -1.171 1.00 65.03 H new ATOM 0 HH22 ARG A 657 -12.043 15.338 -0.408 1.00 65.03 H new ATOM 1122 N SER A 658 -8.560 9.236 4.263 1.00 44.11 N ATOM 1123 CA SER A 658 -8.449 8.232 5.312 1.00 64.20 C ATOM 1124 C SER A 658 -9.658 7.299 5.336 1.00 73.21 C ATOM 1125 O SER A 658 -10.811 7.724 5.541 1.00 53.14 O ATOM 1126 CB SER A 658 -8.302 8.927 6.645 1.00 5.02 C ATOM 1127 OG SER A 658 -7.259 9.887 6.589 1.00 74.41 O ATOM 0 H SER A 658 -8.474 10.195 4.598 1.00 44.11 H new ATOM 0 HA SER A 658 -7.571 7.618 5.109 1.00 64.20 H new ATOM 0 HB2 SER A 658 -9.239 9.414 6.914 1.00 5.02 H new ATOM 0 HB3 SER A 658 -8.089 8.194 7.423 1.00 5.02 H new ATOM 0 HG SER A 658 -7.374 10.537 7.313 1.00 74.41 H new ATOM 1133 N ASN A 659 -9.376 6.042 5.098 1.00 43.52 N ATOM 1134 CA ASN A 659 -10.374 5.022 4.981 1.00 61.13 C ATOM 1135 C ASN A 659 -9.725 3.679 5.264 1.00 54.33 C ATOM 1136 O ASN A 659 -8.539 3.513 5.030 1.00 42.43 O ATOM 1137 CB ASN A 659 -10.975 5.098 3.566 1.00 23.24 C ATOM 1138 CG ASN A 659 -12.000 4.048 3.259 1.00 3.24 C ATOM 1139 OD1 ASN A 659 -13.161 4.197 3.588 1.00 61.35 O ATOM 1140 ND2 ASN A 659 -11.608 3.036 2.536 1.00 4.12 N ATOM 0 H ASN A 659 -8.423 5.698 4.978 1.00 43.52 H new ATOM 0 HA ASN A 659 -11.183 5.157 5.699 1.00 61.13 H new ATOM 0 HB2 ASN A 659 -11.430 6.079 3.432 1.00 23.24 H new ATOM 0 HB3 ASN A 659 -10.167 5.020 2.839 1.00 23.24 H new ATOM 0 HD21 ASN A 659 -12.284 2.337 2.228 1.00 4.12 H new ATOM 0 HD22 ASN A 659 -10.625 2.943 2.279 1.00 4.12 H new ATOM 1146 N ALA A 660 -10.470 2.750 5.787 1.00 62.44 N ATOM 1147 CA ALA A 660 -9.907 1.467 6.176 1.00 53.12 C ATOM 1148 C ALA A 660 -10.677 0.320 5.574 1.00 5.25 C ATOM 1149 O ALA A 660 -10.509 -0.802 5.981 1.00 45.22 O ATOM 1150 CB ALA A 660 -9.883 1.340 7.706 1.00 4.35 C ATOM 0 H ALA A 660 -11.471 2.846 5.959 1.00 62.44 H new ATOM 0 HA ALA A 660 -8.887 1.423 5.795 1.00 53.12 H new ATOM 0 HB1 ALA A 660 -9.459 0.375 7.984 1.00 4.35 H new ATOM 0 HB2 ALA A 660 -9.274 2.139 8.128 1.00 4.35 H new ATOM 0 HB3 ALA A 660 -10.899 1.415 8.093 1.00 4.35 H new ATOM 1156 N LYS A 661 -11.483 0.599 4.574 1.00 65.14 N ATOM 1157 CA LYS A 661 -12.323 -0.443 3.992 1.00 55.23 C ATOM 1158 C LYS A 661 -11.488 -1.466 3.229 1.00 23.40 C ATOM 1159 O LYS A 661 -10.995 -1.192 2.119 1.00 20.21 O ATOM 1160 CB LYS A 661 -13.403 0.136 3.066 1.00 43.21 C ATOM 1161 CG LYS A 661 -14.244 1.237 3.667 1.00 4.54 C ATOM 1162 CD LYS A 661 -14.879 0.830 4.968 1.00 24.22 C ATOM 1163 CE LYS A 661 -15.821 1.902 5.437 1.00 63.53 C ATOM 1164 NZ LYS A 661 -16.401 1.616 6.765 1.00 23.24 N ATOM 0 H LYS A 661 -11.580 1.520 4.147 1.00 65.14 H new ATOM 0 HA LYS A 661 -12.820 -0.940 4.825 1.00 55.23 H new ATOM 0 HB2 LYS A 661 -12.920 0.519 2.167 1.00 43.21 H new ATOM 0 HB3 LYS A 661 -14.063 -0.673 2.753 1.00 43.21 H new ATOM 0 HG2 LYS A 661 -13.622 2.117 3.829 1.00 4.54 H new ATOM 0 HG3 LYS A 661 -15.023 1.523 2.960 1.00 4.54 H new ATOM 0 HD2 LYS A 661 -15.418 -0.109 4.841 1.00 24.22 H new ATOM 0 HD3 LYS A 661 -14.109 0.657 5.720 1.00 24.22 H new ATOM 0 HE2 LYS A 661 -15.291 2.854 5.475 1.00 63.53 H new ATOM 0 HE3 LYS A 661 -16.626 2.014 4.711 1.00 63.53 H new ATOM 0 HZ1 LYS A 661 -17.267 2.177 6.894 1.00 23.24 H new ATOM 0 HZ2 LYS A 661 -16.631 0.604 6.833 1.00 23.24 H new ATOM 0 HZ3 LYS A 661 -15.714 1.865 7.505 1.00 23.24 H new ATOM 1178 N LEU A 662 -11.278 -2.600 3.850 1.00 33.12 N ATOM 1179 CA LEU A 662 -10.624 -3.697 3.202 1.00 73.05 C ATOM 1180 C LEU A 662 -11.622 -4.490 2.423 1.00 72.42 C ATOM 1181 O LEU A 662 -12.671 -4.867 2.930 1.00 74.23 O ATOM 1182 CB LEU A 662 -9.898 -4.610 4.186 1.00 5.52 C ATOM 1183 CG LEU A 662 -8.615 -4.097 4.819 1.00 40.15 C ATOM 1184 CD1 LEU A 662 -8.109 -5.124 5.791 1.00 62.11 C ATOM 1185 CD2 LEU A 662 -7.559 -3.875 3.759 1.00 14.45 C ATOM 0 H LEU A 662 -11.556 -2.783 4.814 1.00 33.12 H new ATOM 0 HA LEU A 662 -9.872 -3.276 2.535 1.00 73.05 H new ATOM 0 HB2 LEU A 662 -10.593 -4.855 4.990 1.00 5.52 H new ATOM 0 HB3 LEU A 662 -9.667 -5.542 3.669 1.00 5.52 H new ATOM 0 HG LEU A 662 -8.821 -3.154 5.326 1.00 40.15 H new ATOM 0 HD11 LEU A 662 -7.188 -4.766 6.252 1.00 62.11 H new ATOM 0 HD12 LEU A 662 -8.859 -5.294 6.564 1.00 62.11 H new ATOM 0 HD13 LEU A 662 -7.912 -6.058 5.264 1.00 62.11 H new ATOM 0 HD21 LEU A 662 -6.646 -3.508 4.227 1.00 14.45 H new ATOM 0 HD22 LEU A 662 -7.352 -4.816 3.249 1.00 14.45 H new ATOM 0 HD23 LEU A 662 -7.917 -3.141 3.037 1.00 14.45 H new ATOM 1193 N SER A 663 -11.289 -4.745 1.229 1.00 61.33 N ATOM 1194 CA SER A 663 -12.113 -5.463 0.333 1.00 2.20 C ATOM 1195 C SER A 663 -11.497 -6.837 0.163 1.00 33.23 C ATOM 1196 O SER A 663 -10.295 -6.970 0.020 1.00 1.50 O ATOM 1197 CB SER A 663 -12.124 -4.726 -1.003 1.00 4.24 C ATOM 1198 OG SER A 663 -12.467 -3.351 -0.824 1.00 32.24 O ATOM 0 H SER A 663 -10.401 -4.452 0.823 1.00 61.33 H new ATOM 0 HA SER A 663 -13.135 -5.551 0.701 1.00 2.20 H new ATOM 0 HB2 SER A 663 -11.143 -4.802 -1.473 1.00 4.24 H new ATOM 0 HB3 SER A 663 -12.838 -5.198 -1.678 1.00 4.24 H new ATOM 0 HG SER A 663 -13.185 -3.277 -0.161 1.00 32.24 H new ATOM 1204 N TYR A 664 -12.280 -7.836 0.180 1.00 14.24 N ATOM 1205 CA TYR A 664 -11.761 -9.147 0.043 1.00 32.12 C ATOM 1206 C TYR A 664 -12.246 -9.681 -1.261 1.00 34.22 C ATOM 1207 O TYR A 664 -13.442 -9.763 -1.493 1.00 53.03 O ATOM 1208 CB TYR A 664 -12.273 -10.033 1.187 1.00 71.20 C ATOM 1209 CG TYR A 664 -11.605 -11.393 1.322 1.00 10.01 C ATOM 1210 CD1 TYR A 664 -11.635 -12.347 0.302 1.00 32.32 C ATOM 1211 CD2 TYR A 664 -10.962 -11.720 2.489 1.00 61.31 C ATOM 1212 CE1 TYR A 664 -11.031 -13.581 0.456 1.00 5.31 C ATOM 1213 CE2 TYR A 664 -10.358 -12.942 2.649 1.00 22.55 C ATOM 1214 CZ TYR A 664 -10.393 -13.870 1.636 1.00 61.32 C ATOM 1215 OH TYR A 664 -9.788 -15.100 1.816 1.00 32.01 O ATOM 0 H TYR A 664 -13.293 -7.779 0.288 1.00 14.24 H new ATOM 0 HA TYR A 664 -10.672 -9.136 0.078 1.00 32.12 H new ATOM 0 HB2 TYR A 664 -12.146 -9.492 2.125 1.00 71.20 H new ATOM 0 HB3 TYR A 664 -13.343 -10.187 1.051 1.00 71.20 H new ATOM 0 HD1 TYR A 664 -12.140 -12.116 -0.625 1.00 32.32 H new ATOM 0 HD2 TYR A 664 -10.931 -11.003 3.296 1.00 61.31 H new ATOM 0 HE1 TYR A 664 -11.061 -14.308 -0.342 1.00 5.31 H new ATOM 0 HE2 TYR A 664 -9.853 -13.175 3.575 1.00 22.55 H new ATOM 0 HH TYR A 664 -9.180 -15.056 2.583 1.00 32.01 H new ATOM 1225 N TYR A 665 -11.339 -10.010 -2.105 1.00 30.22 N ATOM 1226 CA TYR A 665 -11.653 -10.586 -3.359 1.00 12.20 C ATOM 1227 C TYR A 665 -11.222 -12.015 -3.253 1.00 13.31 C ATOM 1228 O TYR A 665 -10.233 -12.284 -2.589 1.00 32.14 O ATOM 1229 CB TYR A 665 -10.894 -9.870 -4.472 1.00 4.21 C ATOM 1230 CG TYR A 665 -11.393 -10.232 -5.836 1.00 33.10 C ATOM 1231 CD1 TYR A 665 -12.640 -9.804 -6.238 1.00 33.41 C ATOM 1232 CD2 TYR A 665 -10.644 -11.001 -6.713 1.00 1.54 C ATOM 1233 CE1 TYR A 665 -13.136 -10.118 -7.466 1.00 72.22 C ATOM 1234 CE2 TYR A 665 -11.137 -11.324 -7.962 1.00 54.20 C ATOM 1235 CZ TYR A 665 -12.387 -10.878 -8.332 1.00 70.31 C ATOM 1236 OH TYR A 665 -12.894 -11.188 -9.578 1.00 34.20 O ATOM 0 H TYR A 665 -10.340 -9.884 -1.941 1.00 30.22 H new ATOM 0 HA TYR A 665 -12.713 -10.503 -3.598 1.00 12.20 H new ATOM 0 HB2 TYR A 665 -10.982 -8.793 -4.331 1.00 4.21 H new ATOM 0 HB3 TYR A 665 -9.834 -10.116 -4.400 1.00 4.21 H new ATOM 0 HD1 TYR A 665 -13.236 -9.207 -5.564 1.00 33.41 H new ATOM 0 HD2 TYR A 665 -9.666 -11.351 -6.417 1.00 1.54 H new ATOM 0 HE1 TYR A 665 -14.116 -9.771 -7.759 1.00 72.22 H new ATOM 0 HE2 TYR A 665 -10.548 -11.921 -8.643 1.00 54.20 H new ATOM 0 HH TYR A 665 -13.361 -10.408 -9.944 1.00 34.20 H new ATOM 1246 N ASP A 666 -11.976 -12.932 -3.810 1.00 13.13 N ATOM 1247 CA ASP A 666 -11.628 -14.354 -3.711 1.00 63.44 C ATOM 1248 C ASP A 666 -10.158 -14.589 -4.068 1.00 31.24 C ATOM 1249 O ASP A 666 -9.708 -14.282 -5.183 1.00 21.41 O ATOM 1250 CB ASP A 666 -12.541 -15.194 -4.612 1.00 32.03 C ATOM 1251 CG ASP A 666 -12.183 -16.665 -4.620 1.00 31.11 C ATOM 1252 OD1 ASP A 666 -12.641 -17.413 -3.727 1.00 2.04 O ATOM 1253 OD2 ASP A 666 -11.456 -17.103 -5.534 1.00 33.23 O ATOM 0 H ASP A 666 -12.829 -12.736 -4.334 1.00 13.13 H new ATOM 0 HA ASP A 666 -11.777 -14.666 -2.677 1.00 63.44 H new ATOM 0 HB2 ASP A 666 -13.573 -15.080 -4.280 1.00 32.03 H new ATOM 0 HB3 ASP A 666 -12.489 -14.809 -5.630 1.00 32.03 H new ATOM 1258 N GLY A 667 -9.419 -15.102 -3.100 1.00 34.40 N ATOM 1259 CA GLY A 667 -8.023 -15.378 -3.286 1.00 64.20 C ATOM 1260 C GLY A 667 -7.080 -14.268 -2.801 1.00 4.44 C ATOM 1261 O GLY A 667 -5.920 -14.544 -2.486 1.00 61.34 O ATOM 0 H GLY A 667 -9.775 -15.334 -2.173 1.00 34.40 H new ATOM 0 HA2 GLY A 667 -7.776 -16.301 -2.761 1.00 64.20 H new ATOM 0 HA3 GLY A 667 -7.839 -15.555 -4.346 1.00 64.20 H new ATOM 1265 N MET A 668 -7.557 -13.024 -2.717 1.00 61.52 N ATOM 1266 CA MET A 668 -6.663 -11.910 -2.361 1.00 3.02 C ATOM 1267 C MET A 668 -7.401 -10.732 -1.746 1.00 33.20 C ATOM 1268 O MET A 668 -8.481 -10.348 -2.180 1.00 63.03 O ATOM 1269 CB MET A 668 -5.840 -11.449 -3.576 1.00 21.14 C ATOM 1270 CG MET A 668 -6.682 -10.980 -4.765 1.00 22.41 C ATOM 1271 SD MET A 668 -5.706 -10.604 -6.246 1.00 34.14 S ATOM 1272 CE MET A 668 -4.983 -12.213 -6.597 1.00 71.24 C ATOM 0 H MET A 668 -8.529 -12.762 -2.884 1.00 61.52 H new ATOM 0 HA MET A 668 -5.986 -12.296 -1.599 1.00 3.02 H new ATOM 0 HB2 MET A 668 -5.183 -10.636 -3.268 1.00 21.14 H new ATOM 0 HB3 MET A 668 -5.201 -12.270 -3.900 1.00 21.14 H new ATOM 0 HG2 MET A 668 -7.413 -11.751 -5.008 1.00 22.41 H new ATOM 0 HG3 MET A 668 -7.242 -10.091 -4.474 1.00 22.41 H new ATOM 0 HE1 MET A 668 -4.547 -12.206 -7.596 1.00 71.24 H new ATOM 0 HE2 MET A 668 -4.206 -12.431 -5.864 1.00 71.24 H new ATOM 0 HE3 MET A 668 -5.757 -12.979 -6.544 1.00 71.24 H new ATOM 1282 N ILE A 669 -6.808 -10.160 -0.753 1.00 15.34 N ATOM 1283 CA ILE A 669 -7.380 -9.033 -0.070 1.00 30.04 C ATOM 1284 C ILE A 669 -6.925 -7.751 -0.773 1.00 23.41 C ATOM 1285 O ILE A 669 -5.809 -7.678 -1.253 1.00 4.21 O ATOM 1286 CB ILE A 669 -7.016 -8.977 1.474 1.00 1.31 C ATOM 1287 CG1 ILE A 669 -7.508 -10.231 2.258 1.00 24.12 C ATOM 1288 CG2 ILE A 669 -7.581 -7.720 2.130 1.00 53.22 C ATOM 1289 CD1 ILE A 669 -6.791 -11.535 1.942 1.00 1.40 C ATOM 0 H ILE A 669 -5.905 -10.459 -0.384 1.00 15.34 H new ATOM 0 HA ILE A 669 -8.464 -9.136 -0.115 1.00 30.04 H new ATOM 0 HB ILE A 669 -5.927 -8.958 1.521 1.00 1.31 H new ATOM 0 HG12 ILE A 669 -7.406 -10.032 3.325 1.00 24.12 H new ATOM 0 HG13 ILE A 669 -8.571 -10.366 2.059 1.00 24.12 H new ATOM 0 HG21 ILE A 669 -7.315 -7.710 3.187 1.00 53.22 H new ATOM 0 HG22 ILE A 669 -7.166 -6.838 1.643 1.00 53.22 H new ATOM 0 HG23 ILE A 669 -8.666 -7.713 2.029 1.00 53.22 H new ATOM 0 HD11 ILE A 669 -7.215 -12.338 2.544 1.00 1.40 H new ATOM 0 HD12 ILE A 669 -6.913 -11.771 0.885 1.00 1.40 H new ATOM 0 HD13 ILE A 669 -5.730 -11.431 2.170 1.00 1.40 H new ATOM 1296 N GLN A 670 -7.811 -6.810 -0.903 1.00 23.30 N ATOM 1297 CA GLN A 670 -7.515 -5.526 -1.485 1.00 24.44 C ATOM 1298 C GLN A 670 -7.942 -4.424 -0.526 1.00 60.20 C ATOM 1299 O GLN A 670 -8.787 -4.634 0.314 1.00 12.52 O ATOM 1300 CB GLN A 670 -8.205 -5.368 -2.850 1.00 23.20 C ATOM 1301 CG GLN A 670 -7.632 -6.273 -3.950 1.00 23.21 C ATOM 1302 CD GLN A 670 -8.370 -6.186 -5.264 1.00 42.34 C ATOM 1303 OE1 GLN A 670 -9.647 -5.919 -5.217 1.00 71.03 O flip ATOM 1304 NE2 GLN A 670 -7.775 -6.372 -6.328 1.00 11.21 N flip ATOM 0 H GLN A 670 -8.781 -6.911 -0.603 1.00 23.30 H new ATOM 0 HA GLN A 670 -6.441 -5.452 -1.653 1.00 24.44 H new ATOM 0 HB2 GLN A 670 -9.268 -5.582 -2.735 1.00 23.20 H new ATOM 0 HB3 GLN A 670 -8.122 -4.329 -3.169 1.00 23.20 H new ATOM 0 HG2 GLN A 670 -6.587 -6.011 -4.114 1.00 23.21 H new ATOM 0 HG3 GLN A 670 -7.651 -7.306 -3.602 1.00 23.21 H new ATOM 0 HE21 GLN A 670 -6.776 -6.578 -6.324 1.00 11.21 H new ATOM 0 HE22 GLN A 670 -8.282 -6.319 -7.212 1.00 11.21 H new ATOM 1312 N LEU A 671 -7.339 -3.284 -0.623 1.00 52.40 N ATOM 1313 CA LEU A 671 -7.714 -2.179 0.231 1.00 74.13 C ATOM 1314 C LEU A 671 -8.171 -1.058 -0.668 1.00 51.44 C ATOM 1315 O LEU A 671 -7.434 -0.643 -1.568 1.00 1.25 O ATOM 1316 CB LEU A 671 -6.499 -1.744 1.101 1.00 53.12 C ATOM 1317 CG LEU A 671 -6.757 -0.853 2.355 1.00 13.21 C ATOM 1318 CD1 LEU A 671 -5.465 -0.594 3.085 1.00 75.31 C ATOM 1319 CD2 LEU A 671 -7.432 0.456 2.027 1.00 42.51 C ATOM 0 H LEU A 671 -6.585 -3.083 -1.280 1.00 52.40 H new ATOM 0 HA LEU A 671 -8.516 -2.460 0.914 1.00 74.13 H new ATOM 0 HB2 LEU A 671 -5.992 -2.649 1.437 1.00 53.12 H new ATOM 0 HB3 LEU A 671 -5.803 -1.210 0.454 1.00 53.12 H new ATOM 0 HG LEU A 671 -7.442 -1.410 2.994 1.00 13.21 H new ATOM 0 HD11 LEU A 671 -5.659 0.029 3.958 1.00 75.31 H new ATOM 0 HD12 LEU A 671 -5.031 -1.542 3.404 1.00 75.31 H new ATOM 0 HD13 LEU A 671 -4.768 -0.082 2.421 1.00 75.31 H new ATOM 0 HD21 LEU A 671 -7.582 1.027 2.943 1.00 42.51 H new ATOM 0 HD22 LEU A 671 -6.805 1.027 1.342 1.00 42.51 H new ATOM 0 HD23 LEU A 671 -8.397 0.261 1.559 1.00 42.51 H new ATOM 1327 N THR A 672 -9.361 -0.587 -0.442 1.00 50.42 N ATOM 1328 CA THR A 672 -9.927 0.467 -1.234 1.00 55.21 C ATOM 1329 C THR A 672 -9.860 1.793 -0.465 1.00 60.14 C ATOM 1330 O THR A 672 -10.204 1.844 0.697 1.00 70.13 O ATOM 1331 CB THR A 672 -11.413 0.136 -1.563 1.00 2.12 C ATOM 1332 OG1 THR A 672 -11.493 -1.130 -2.250 1.00 54.24 O ATOM 1333 CG2 THR A 672 -12.044 1.216 -2.436 1.00 43.22 C ATOM 0 H THR A 672 -9.972 -0.925 0.302 1.00 50.42 H new ATOM 0 HA THR A 672 -9.360 0.558 -2.160 1.00 55.21 H new ATOM 0 HB THR A 672 -11.959 0.088 -0.621 1.00 2.12 H new ATOM 0 HG1 THR A 672 -11.860 -1.808 -1.645 1.00 54.24 H new ATOM 0 HG21 THR A 672 -13.081 0.954 -2.647 1.00 43.22 H new ATOM 0 HG22 THR A 672 -12.011 2.172 -1.913 1.00 43.22 H new ATOM 0 HG23 THR A 672 -11.492 1.295 -3.373 1.00 43.22 H new ATOM 1339 N TYR A 673 -9.360 2.834 -1.094 1.00 60.12 N ATOM 1340 CA TYR A 673 -9.394 4.169 -0.513 1.00 52.53 C ATOM 1341 C TYR A 673 -10.437 5.042 -1.174 1.00 60.44 C ATOM 1342 O TYR A 673 -11.100 4.620 -2.115 1.00 13.24 O ATOM 1343 CB TYR A 673 -8.038 4.843 -0.502 1.00 43.32 C ATOM 1344 CG TYR A 673 -7.172 4.462 0.660 1.00 20.23 C ATOM 1345 CD1 TYR A 673 -7.381 5.058 1.889 1.00 2.41 C ATOM 1346 CD2 TYR A 673 -6.167 3.514 0.553 1.00 44.33 C ATOM 1347 CE1 TYR A 673 -6.627 4.733 2.976 1.00 74.02 C ATOM 1348 CE2 TYR A 673 -5.399 3.173 1.655 1.00 62.23 C ATOM 1349 CZ TYR A 673 -5.642 3.794 2.865 1.00 53.22 C ATOM 1350 OH TYR A 673 -4.917 3.460 3.969 1.00 12.41 O ATOM 0 H TYR A 673 -8.921 2.786 -2.014 1.00 60.12 H new ATOM 0 HA TYR A 673 -9.682 4.036 0.530 1.00 52.53 H new ATOM 0 HB2 TYR A 673 -7.515 4.597 -1.426 1.00 43.32 H new ATOM 0 HB3 TYR A 673 -8.182 5.923 -0.495 1.00 43.32 H new ATOM 0 HD1 TYR A 673 -8.160 5.799 1.990 1.00 2.41 H new ATOM 0 HD2 TYR A 673 -5.981 3.037 -0.398 1.00 44.33 H new ATOM 0 HE1 TYR A 673 -6.808 5.217 3.924 1.00 74.02 H new ATOM 0 HE2 TYR A 673 -4.620 2.430 1.569 1.00 62.23 H new ATOM 0 HH TYR A 673 -4.113 2.970 3.697 1.00 12.41 H new ATOM 1360 N ARG A 674 -10.577 6.261 -0.684 1.00 11.01 N ATOM 1361 CA ARG A 674 -11.615 7.148 -1.131 1.00 64.44 C ATOM 1362 C ARG A 674 -11.158 8.084 -2.218 1.00 11.34 C ATOM 1363 O ARG A 674 -10.012 8.058 -2.616 1.00 34.44 O ATOM 1364 CB ARG A 674 -12.187 7.903 0.031 1.00 3.24 C ATOM 1365 CG ARG A 674 -12.864 7.028 1.058 1.00 32.23 C ATOM 1366 CD ARG A 674 -14.016 6.235 0.438 1.00 2.12 C ATOM 1367 NE ARG A 674 -14.712 5.387 1.406 1.00 52.32 N ATOM 1368 CZ ARG A 674 -15.483 4.340 1.077 1.00 71.21 C ATOM 1369 NH1 ARG A 674 -15.624 3.986 -0.195 1.00 14.32 N ATOM 1370 NH2 ARG A 674 -16.107 3.657 2.016 1.00 14.44 N ATOM 0 H ARG A 674 -9.970 6.656 0.035 1.00 11.01 H new ATOM 0 HA ARG A 674 -12.397 6.531 -1.573 1.00 64.44 H new ATOM 0 HB2 ARG A 674 -11.388 8.463 0.516 1.00 3.24 H new ATOM 0 HB3 ARG A 674 -12.907 8.632 -0.341 1.00 3.24 H new ATOM 0 HG2 ARG A 674 -12.137 6.340 1.489 1.00 32.23 H new ATOM 0 HG3 ARG A 674 -13.242 7.645 1.873 1.00 32.23 H new ATOM 0 HD2 ARG A 674 -14.729 6.929 -0.008 1.00 2.12 H new ATOM 0 HD3 ARG A 674 -13.629 5.613 -0.369 1.00 2.12 H new ATOM 0 HE ARG A 674 -14.604 5.606 2.396 1.00 52.32 H new ATOM 0 HH11 ARG A 674 -15.145 4.511 -0.927 1.00 14.32 H new ATOM 0 HH12 ARG A 674 -16.211 3.189 -0.440 1.00 14.32 H new ATOM 0 HH21 ARG A 674 -16.004 3.924 2.995 1.00 14.44 H new ATOM 0 HH22 ARG A 674 -16.693 2.861 1.764 1.00 14.44 H new ATOM 1382 N ASP A 675 -12.085 8.913 -2.649 1.00 34.44 N ATOM 1383 CA ASP A 675 -11.949 9.854 -3.771 1.00 5.22 C ATOM 1384 C ASP A 675 -10.681 10.736 -3.680 1.00 63.35 C ATOM 1385 O ASP A 675 -10.063 11.040 -4.690 1.00 22.42 O ATOM 1386 CB ASP A 675 -13.184 10.784 -3.771 1.00 64.22 C ATOM 1387 CG ASP A 675 -13.205 11.740 -2.575 1.00 1.44 C ATOM 1388 OD1 ASP A 675 -13.277 11.265 -1.412 1.00 30.03 O ATOM 1389 OD2 ASP A 675 -13.070 12.966 -2.781 1.00 13.13 O ATOM 0 H ASP A 675 -13.006 8.961 -2.212 1.00 34.44 H new ATOM 0 HA ASP A 675 -11.869 9.263 -4.684 1.00 5.22 H new ATOM 0 HB2 ASP A 675 -13.197 11.363 -4.694 1.00 64.22 H new ATOM 0 HB3 ASP A 675 -14.090 10.178 -3.762 1.00 64.22 H new ATOM 1394 N GLY A 676 -10.347 11.160 -2.481 1.00 11.50 N ATOM 1395 CA GLY A 676 -9.172 11.982 -2.257 1.00 55.13 C ATOM 1396 C GLY A 676 -9.226 13.298 -3.020 1.00 0.23 C ATOM 1397 O GLY A 676 -9.999 14.192 -2.683 1.00 73.11 O ATOM 0 H GLY A 676 -10.877 10.948 -1.636 1.00 11.50 H new ATOM 0 HA2 GLY A 676 -9.075 12.188 -1.191 1.00 55.13 H new ATOM 0 HA3 GLY A 676 -8.283 11.428 -2.557 1.00 55.13 H new ATOM 1401 N THR A 677 -8.415 13.404 -4.038 1.00 10.55 N ATOM 1402 CA THR A 677 -8.366 14.558 -4.900 1.00 35.44 C ATOM 1403 C THR A 677 -8.309 14.076 -6.364 1.00 72.45 C ATOM 1404 O THR A 677 -7.591 13.125 -6.670 1.00 1.20 O ATOM 1405 CB THR A 677 -7.135 15.447 -4.559 1.00 4.15 C ATOM 1406 OG1 THR A 677 -7.272 15.948 -3.214 1.00 64.41 O ATOM 1407 CG2 THR A 677 -6.983 16.626 -5.522 1.00 10.22 C ATOM 0 H THR A 677 -7.753 12.673 -4.299 1.00 10.55 H new ATOM 0 HA THR A 677 -9.258 15.167 -4.752 1.00 35.44 H new ATOM 0 HB THR A 677 -6.243 14.827 -4.655 1.00 4.15 H new ATOM 0 HG1 THR A 677 -6.498 16.508 -2.993 1.00 64.41 H new ATOM 0 HG21 THR A 677 -6.110 17.215 -5.241 1.00 10.22 H new ATOM 0 HG22 THR A 677 -6.857 16.252 -6.538 1.00 10.22 H new ATOM 0 HG23 THR A 677 -7.874 17.252 -5.474 1.00 10.22 H new ATOM 1413 N PRO A 678 -9.084 14.680 -7.282 1.00 72.22 N ATOM 1414 CA PRO A 678 -9.104 14.263 -8.666 1.00 41.05 C ATOM 1415 C PRO A 678 -7.837 14.656 -9.430 1.00 24.34 C ATOM 1416 O PRO A 678 -7.146 15.601 -9.051 1.00 43.24 O ATOM 1417 CB PRO A 678 -10.337 14.939 -9.227 1.00 65.52 C ATOM 1418 CG PRO A 678 -10.407 16.207 -8.463 1.00 61.21 C ATOM 1419 CD PRO A 678 -10.011 15.823 -7.056 1.00 2.31 C ATOM 0 HA PRO A 678 -9.134 13.178 -8.762 1.00 41.05 H new ATOM 0 HB2 PRO A 678 -10.245 15.119 -10.298 1.00 65.52 H new ATOM 0 HB3 PRO A 678 -11.230 14.332 -9.081 1.00 65.52 H new ATOM 0 HG2 PRO A 678 -9.731 16.957 -8.875 1.00 61.21 H new ATOM 0 HG3 PRO A 678 -11.410 16.632 -8.491 1.00 61.21 H new ATOM 0 HD2 PRO A 678 -9.522 16.645 -6.534 1.00 2.31 H new ATOM 0 HD3 PRO A 678 -10.874 15.533 -6.456 1.00 2.31 H new ATOM 1427 N TYR A 679 -7.533 13.882 -10.474 1.00 63.31 N ATOM 1428 CA TYR A 679 -6.325 14.058 -11.314 1.00 0.33 C ATOM 1429 C TYR A 679 -6.157 15.486 -11.835 1.00 22.42 C ATOM 1430 O TYR A 679 -5.500 16.307 -11.201 1.00 14.32 O ATOM 1431 CB TYR A 679 -6.294 13.062 -12.513 1.00 3.42 C ATOM 1432 CG TYR A 679 -6.238 11.607 -12.125 1.00 43.20 C ATOM 1433 CD1 TYR A 679 -7.378 10.933 -11.760 1.00 45.33 C ATOM 1434 CD2 TYR A 679 -5.043 10.912 -12.114 1.00 63.41 C ATOM 1435 CE1 TYR A 679 -7.346 9.621 -11.379 1.00 3.42 C ATOM 1436 CE2 TYR A 679 -5.001 9.587 -11.740 1.00 71.24 C ATOM 1437 CZ TYR A 679 -6.162 8.954 -11.370 1.00 21.13 C ATOM 1438 OH TYR A 679 -6.131 7.663 -10.966 1.00 54.22 O ATOM 0 H TYR A 679 -8.120 13.103 -10.772 1.00 63.31 H new ATOM 0 HA TYR A 679 -5.487 13.843 -10.651 1.00 0.33 H new ATOM 0 HB2 TYR A 679 -7.180 13.226 -13.126 1.00 3.42 H new ATOM 0 HB3 TYR A 679 -5.429 13.291 -13.135 1.00 3.42 H new ATOM 0 HD1 TYR A 679 -8.324 11.454 -11.775 1.00 45.33 H new ATOM 0 HD2 TYR A 679 -4.131 11.414 -12.402 1.00 63.41 H new ATOM 0 HE1 TYR A 679 -8.256 9.117 -11.087 1.00 3.42 H new ATOM 0 HE2 TYR A 679 -4.063 9.051 -11.738 1.00 71.24 H new ATOM 0 HH TYR A 679 -6.929 7.468 -10.431 1.00 54.22 H new ATOM 1448 N ASN A 680 -6.761 15.762 -12.985 1.00 21.32 N ATOM 1449 CA ASN A 680 -6.655 17.069 -13.665 1.00 41.40 C ATOM 1450 C ASN A 680 -7.430 17.039 -14.970 1.00 31.22 C ATOM 1451 O ASN A 680 -7.178 17.829 -15.873 1.00 53.31 O ATOM 1452 CB ASN A 680 -5.170 17.445 -13.960 1.00 65.24 C ATOM 1453 CG ASN A 680 -4.407 16.370 -14.730 1.00 24.32 C ATOM 1454 OD1 ASN A 680 -4.430 16.316 -15.956 1.00 33.45 O ATOM 1455 ND2 ASN A 680 -3.700 15.536 -14.014 1.00 12.11 N ATOM 0 H ASN A 680 -7.344 15.089 -13.483 1.00 21.32 H new ATOM 0 HA ASN A 680 -7.074 17.822 -12.997 1.00 41.40 H new ATOM 0 HB2 ASN A 680 -5.146 18.374 -14.530 1.00 65.24 H new ATOM 0 HB3 ASN A 680 -4.658 17.636 -13.017 1.00 65.24 H new ATOM 0 HD21 ASN A 680 -3.146 14.813 -14.473 1.00 12.11 H new ATOM 0 HD22 ASN A 680 -3.703 15.608 -12.997 1.00 12.11 H new ATOM 1461 N ASN A 681 -8.420 16.182 -15.037 1.00 51.11 N ATOM 1462 CA ASN A 681 -9.185 16.004 -16.241 1.00 51.23 C ATOM 1463 C ASN A 681 -10.509 16.717 -16.116 1.00 14.15 C ATOM 1464 O ASN A 681 -10.909 17.105 -15.001 1.00 0.33 O ATOM 1465 CB ASN A 681 -9.396 14.510 -16.538 1.00 20.34 C ATOM 1466 CG ASN A 681 -10.114 13.758 -15.427 1.00 75.04 C ATOM 1467 OD1 ASN A 681 -10.000 14.093 -14.232 1.00 55.34 O ATOM 1468 ND2 ASN A 681 -10.853 12.757 -15.795 1.00 74.54 N ATOM 0 H ASN A 681 -8.715 15.591 -14.259 1.00 51.11 H new ATOM 0 HA ASN A 681 -8.631 16.435 -17.075 1.00 51.23 H new ATOM 0 HB2 ASN A 681 -9.968 14.410 -17.460 1.00 20.34 H new ATOM 0 HB3 ASN A 681 -8.426 14.043 -16.712 1.00 20.34 H new ATOM 0 HD21 ASN A 681 -11.364 12.216 -15.097 1.00 74.54 H new ATOM 0 HD22 ASN A 681 -10.923 12.511 -16.782 1.00 74.54 H new ATOM 1474 N GLU A 682 -11.191 16.873 -17.226 1.00 40.30 N ATOM 1475 CA GLU A 682 -12.457 17.591 -17.284 1.00 72.14 C ATOM 1476 C GLU A 682 -13.533 16.889 -16.450 1.00 43.33 C ATOM 1477 O GLU A 682 -14.409 17.532 -15.863 1.00 33.13 O ATOM 1478 CB GLU A 682 -12.901 17.737 -18.744 1.00 71.41 C ATOM 1479 CG GLU A 682 -14.184 18.523 -18.935 1.00 42.45 C ATOM 1480 CD GLU A 682 -14.567 18.650 -20.381 1.00 52.35 C ATOM 1481 OE1 GLU A 682 -15.287 17.767 -20.903 1.00 24.33 O ATOM 1482 OE2 GLU A 682 -14.157 19.630 -21.022 1.00 22.23 O ATOM 0 H GLU A 682 -10.886 16.504 -18.127 1.00 40.30 H new ATOM 0 HA GLU A 682 -12.314 18.584 -16.857 1.00 72.14 H new ATOM 0 HB2 GLU A 682 -12.104 18.224 -19.306 1.00 71.41 H new ATOM 0 HB3 GLU A 682 -13.031 16.743 -19.172 1.00 71.41 H new ATOM 0 HG2 GLU A 682 -14.991 18.034 -18.390 1.00 42.45 H new ATOM 0 HG3 GLU A 682 -14.065 19.517 -18.505 1.00 42.45 H new ATOM 1489 N LYS A 683 -13.450 15.583 -16.378 1.00 11.10 N ATOM 1490 CA LYS A 683 -14.403 14.805 -15.625 1.00 75.13 C ATOM 1491 C LYS A 683 -14.137 14.891 -14.115 1.00 51.41 C ATOM 1492 O LYS A 683 -15.032 14.615 -13.319 1.00 5.13 O ATOM 1493 CB LYS A 683 -14.392 13.346 -16.106 1.00 12.44 C ATOM 1494 CG LYS A 683 -15.393 12.450 -15.398 1.00 53.41 C ATOM 1495 CD LYS A 683 -15.474 11.075 -16.022 1.00 41.04 C ATOM 1496 CE LYS A 683 -14.143 10.337 -15.994 1.00 23.34 C ATOM 1497 NZ LYS A 683 -14.255 8.969 -16.545 1.00 62.35 N ATOM 0 H LYS A 683 -12.724 15.032 -16.837 1.00 11.10 H new ATOM 0 HA LYS A 683 -15.395 15.223 -15.800 1.00 75.13 H new ATOM 0 HB2 LYS A 683 -14.597 13.326 -17.176 1.00 12.44 H new ATOM 0 HB3 LYS A 683 -13.392 12.936 -15.966 1.00 12.44 H new ATOM 0 HG2 LYS A 683 -15.113 12.355 -14.349 1.00 53.41 H new ATOM 0 HG3 LYS A 683 -16.378 12.917 -15.424 1.00 53.41 H new ATOM 0 HD2 LYS A 683 -16.223 10.485 -15.494 1.00 41.04 H new ATOM 0 HD3 LYS A 683 -15.811 11.168 -17.054 1.00 41.04 H new ATOM 0 HE2 LYS A 683 -13.405 10.899 -16.567 1.00 23.34 H new ATOM 0 HE3 LYS A 683 -13.779 10.286 -14.968 1.00 23.34 H new ATOM 0 HZ1 LYS A 683 -13.326 8.502 -16.507 1.00 62.35 H new ATOM 0 HZ2 LYS A 683 -14.940 8.424 -15.984 1.00 62.35 H new ATOM 0 HZ3 LYS A 683 -14.578 9.018 -17.532 1.00 62.35 H new ATOM 1511 N ARG A 684 -12.913 15.324 -13.728 1.00 32.20 N ATOM 1512 CA ARG A 684 -12.511 15.361 -12.312 1.00 13.11 C ATOM 1513 C ARG A 684 -12.548 13.939 -11.753 1.00 15.44 C ATOM 1514 O ARG A 684 -13.451 13.583 -10.993 1.00 61.31 O ATOM 1515 CB ARG A 684 -13.420 16.263 -11.424 1.00 50.14 C ATOM 1516 CG ARG A 684 -13.481 17.772 -11.708 1.00 51.52 C ATOM 1517 CD ARG A 684 -12.176 18.520 -11.411 1.00 62.35 C ATOM 1518 NE ARG A 684 -11.184 18.450 -12.487 1.00 53.15 N ATOM 1519 CZ ARG A 684 -10.005 19.090 -12.460 1.00 13.21 C ATOM 1520 NH1 ARG A 684 -9.536 19.591 -11.319 1.00 32.00 N ATOM 1521 NH2 ARG A 684 -9.295 19.210 -13.572 1.00 4.14 N ATOM 0 H ARG A 684 -12.195 15.649 -14.376 1.00 32.20 H new ATOM 0 HA ARG A 684 -11.509 15.790 -12.282 1.00 13.11 H new ATOM 0 HB2 ARG A 684 -14.436 15.874 -11.493 1.00 50.14 H new ATOM 0 HB3 ARG A 684 -13.099 16.136 -10.390 1.00 50.14 H new ATOM 0 HG2 ARG A 684 -13.743 17.923 -12.755 1.00 51.52 H new ATOM 0 HG3 ARG A 684 -14.282 18.210 -11.112 1.00 51.52 H new ATOM 0 HD2 ARG A 684 -12.407 19.567 -11.213 1.00 62.35 H new ATOM 0 HD3 ARG A 684 -11.737 18.113 -10.500 1.00 62.35 H new ATOM 0 HE ARG A 684 -11.403 17.881 -13.305 1.00 53.15 H new ATOM 0 HH11 ARG A 684 -10.074 19.489 -10.458 1.00 32.00 H new ATOM 0 HH12 ARG A 684 -8.639 20.076 -11.306 1.00 32.00 H new ATOM 0 HH21 ARG A 684 -9.645 18.816 -14.446 1.00 4.14 H new ATOM 0 HH22 ARG A 684 -8.398 19.696 -13.555 1.00 4.14 H new ATOM 1533 N THR A 685 -11.635 13.125 -12.185 1.00 43.24 N ATOM 1534 CA THR A 685 -11.582 11.758 -11.737 1.00 54.03 C ATOM 1535 C THR A 685 -10.800 11.666 -10.441 1.00 24.44 C ATOM 1536 O THR A 685 -9.659 12.093 -10.391 1.00 54.13 O ATOM 1537 CB THR A 685 -10.923 10.868 -12.788 1.00 25.24 C ATOM 1538 OG1 THR A 685 -11.673 10.926 -14.006 1.00 1.30 O ATOM 1539 CG2 THR A 685 -10.860 9.450 -12.295 1.00 35.44 C ATOM 0 H THR A 685 -10.908 13.382 -12.853 1.00 43.24 H new ATOM 0 HA THR A 685 -12.604 11.415 -11.574 1.00 54.03 H new ATOM 0 HB THR A 685 -9.909 11.223 -12.972 1.00 25.24 H new ATOM 0 HG1 THR A 685 -11.247 10.356 -14.680 1.00 1.30 H new ATOM 0 HG21 THR A 685 -10.388 8.822 -13.051 1.00 35.44 H new ATOM 0 HG22 THR A 685 -10.277 9.410 -11.375 1.00 35.44 H new ATOM 0 HG23 THR A 685 -11.869 9.087 -12.100 1.00 35.44 H new ATOM 1545 N PRO A 686 -11.401 11.117 -9.382 1.00 4.21 N ATOM 1546 CA PRO A 686 -10.753 11.001 -8.079 1.00 72.02 C ATOM 1547 C PRO A 686 -9.569 10.025 -8.077 1.00 1.24 C ATOM 1548 O PRO A 686 -9.698 8.866 -8.502 1.00 72.23 O ATOM 1549 CB PRO A 686 -11.859 10.469 -7.164 1.00 55.20 C ATOM 1550 CG PRO A 686 -12.870 9.846 -8.059 1.00 60.52 C ATOM 1551 CD PRO A 686 -12.771 10.551 -9.378 1.00 71.14 C ATOM 0 HA PRO A 686 -10.335 11.958 -7.768 1.00 72.02 H new ATOM 0 HB2 PRO A 686 -11.463 9.740 -6.457 1.00 55.20 H new ATOM 0 HB3 PRO A 686 -12.301 11.275 -6.578 1.00 55.20 H new ATOM 0 HG2 PRO A 686 -12.679 8.779 -8.175 1.00 60.52 H new ATOM 0 HG3 PRO A 686 -13.871 9.947 -7.641 1.00 60.52 H new ATOM 0 HD2 PRO A 686 -12.921 9.863 -10.210 1.00 71.14 H new ATOM 0 HD3 PRO A 686 -13.526 11.332 -9.470 1.00 71.14 H new ATOM 1559 N ARG A 687 -8.420 10.499 -7.621 1.00 10.32 N ATOM 1560 CA ARG A 687 -7.269 9.641 -7.448 1.00 44.34 C ATOM 1561 C ARG A 687 -7.482 8.788 -6.230 1.00 1.33 C ATOM 1562 O ARG A 687 -7.550 9.307 -5.118 1.00 14.45 O ATOM 1563 CB ARG A 687 -5.957 10.443 -7.298 1.00 4.15 C ATOM 1564 CG ARG A 687 -5.433 11.064 -8.577 1.00 0.44 C ATOM 1565 CD ARG A 687 -4.118 11.816 -8.354 1.00 23.21 C ATOM 1566 NE ARG A 687 -3.372 11.989 -9.620 1.00 62.53 N ATOM 1567 CZ ARG A 687 -2.909 13.137 -10.142 1.00 34.42 C ATOM 1568 NH1 ARG A 687 -3.088 14.278 -9.517 1.00 33.23 N ATOM 1569 NH2 ARG A 687 -2.249 13.121 -11.291 1.00 62.45 N ATOM 0 H ARG A 687 -8.264 11.474 -7.365 1.00 10.32 H new ATOM 0 HA ARG A 687 -7.169 9.024 -8.341 1.00 44.34 H new ATOM 0 HB2 ARG A 687 -6.115 11.235 -6.566 1.00 4.15 H new ATOM 0 HB3 ARG A 687 -5.190 9.783 -6.892 1.00 4.15 H new ATOM 0 HG2 ARG A 687 -5.282 10.284 -9.323 1.00 0.44 H new ATOM 0 HG3 ARG A 687 -6.179 11.750 -8.979 1.00 0.44 H new ATOM 0 HD2 ARG A 687 -4.326 12.792 -7.916 1.00 23.21 H new ATOM 0 HD3 ARG A 687 -3.502 11.270 -7.639 1.00 23.21 H new ATOM 0 HE ARG A 687 -3.189 11.141 -10.157 1.00 62.53 H new ATOM 0 HH11 ARG A 687 -3.583 14.299 -8.625 1.00 33.23 H new ATOM 0 HH12 ARG A 687 -2.732 15.143 -9.923 1.00 33.23 H new ATOM 0 HH21 ARG A 687 -2.093 12.238 -11.777 1.00 62.45 H new ATOM 0 HH22 ARG A 687 -1.897 13.992 -11.689 1.00 62.45 H new ATOM 1581 N ALA A 688 -7.590 7.495 -6.423 1.00 15.12 N ATOM 1582 CA ALA A 688 -7.803 6.623 -5.303 1.00 75.42 C ATOM 1583 C ALA A 688 -6.795 5.523 -5.344 1.00 0.12 C ATOM 1584 O ALA A 688 -6.176 5.298 -6.372 1.00 3.03 O ATOM 1585 CB ALA A 688 -9.218 6.066 -5.308 1.00 12.32 C ATOM 0 H ALA A 688 -7.534 7.033 -7.331 1.00 15.12 H new ATOM 0 HA ALA A 688 -7.681 7.188 -4.379 1.00 75.42 H new ATOM 0 HB1 ALA A 688 -9.353 5.408 -4.449 1.00 12.32 H new ATOM 0 HB2 ALA A 688 -9.933 6.887 -5.252 1.00 12.32 H new ATOM 0 HB3 ALA A 688 -9.384 5.502 -6.226 1.00 12.32 H new ATOM 1591 N THR A 689 -6.610 4.861 -4.246 1.00 11.13 N ATOM 1592 CA THR A 689 -5.651 3.804 -4.153 1.00 43.35 C ATOM 1593 C THR A 689 -6.339 2.476 -3.873 1.00 65.42 C ATOM 1594 O THR A 689 -7.262 2.400 -3.047 1.00 35.31 O ATOM 1595 CB THR A 689 -4.618 4.121 -3.047 1.00 71.13 C ATOM 1596 OG1 THR A 689 -3.976 5.353 -3.358 1.00 63.31 O ATOM 1597 CG2 THR A 689 -3.568 3.028 -2.926 1.00 32.24 C ATOM 0 H THR A 689 -7.123 5.039 -3.383 1.00 11.13 H new ATOM 0 HA THR A 689 -5.131 3.722 -5.107 1.00 43.35 H new ATOM 0 HB THR A 689 -5.145 4.186 -2.095 1.00 71.13 H new ATOM 0 HG1 THR A 689 -4.536 6.099 -3.057 1.00 63.31 H new ATOM 0 HG21 THR A 689 -2.861 3.288 -2.138 1.00 32.24 H new ATOM 0 HG22 THR A 689 -4.053 2.083 -2.681 1.00 32.24 H new ATOM 0 HG23 THR A 689 -3.036 2.928 -3.872 1.00 32.24 H new ATOM 1603 N LEU A 690 -5.923 1.464 -4.587 1.00 0.42 N ATOM 1604 CA LEU A 690 -6.397 0.135 -4.404 1.00 72.41 C ATOM 1605 C LEU A 690 -5.153 -0.720 -4.210 1.00 73.45 C ATOM 1606 O LEU A 690 -4.312 -0.825 -5.101 1.00 75.21 O ATOM 1607 CB LEU A 690 -7.204 -0.309 -5.659 1.00 12.03 C ATOM 1608 CG LEU A 690 -8.065 -1.603 -5.583 1.00 4.45 C ATOM 1609 CD1 LEU A 690 -7.249 -2.843 -5.299 1.00 21.34 C ATOM 1610 CD2 LEU A 690 -9.177 -1.451 -4.565 1.00 31.14 C ATOM 0 H LEU A 690 -5.228 1.553 -5.328 1.00 0.42 H new ATOM 0 HA LEU A 690 -7.067 0.043 -3.549 1.00 72.41 H new ATOM 0 HB2 LEU A 690 -7.867 0.512 -5.931 1.00 12.03 H new ATOM 0 HB3 LEU A 690 -6.496 -0.432 -6.479 1.00 12.03 H new ATOM 0 HG LEU A 690 -8.503 -1.739 -6.572 1.00 4.45 H new ATOM 0 HD11 LEU A 690 -7.908 -3.711 -5.258 1.00 21.34 H new ATOM 0 HD12 LEU A 690 -6.513 -2.983 -6.090 1.00 21.34 H new ATOM 0 HD13 LEU A 690 -6.737 -2.731 -4.343 1.00 21.34 H new ATOM 0 HD21 LEU A 690 -9.766 -2.368 -4.529 1.00 31.14 H new ATOM 0 HD22 LEU A 690 -8.747 -1.258 -3.582 1.00 31.14 H new ATOM 0 HD23 LEU A 690 -9.820 -0.618 -4.850 1.00 31.14 H new ATOM 1618 N ILE A 691 -5.017 -1.286 -3.062 1.00 41.31 N ATOM 1619 CA ILE A 691 -3.860 -2.098 -2.772 1.00 72.41 C ATOM 1620 C ILE A 691 -4.254 -3.553 -2.864 1.00 3.13 C ATOM 1621 O ILE A 691 -5.156 -3.981 -2.180 1.00 22.44 O ATOM 1622 CB ILE A 691 -3.303 -1.799 -1.357 1.00 44.43 C ATOM 1623 CG1 ILE A 691 -3.013 -0.297 -1.203 1.00 34.04 C ATOM 1624 CG2 ILE A 691 -2.027 -2.606 -1.116 1.00 30.14 C ATOM 1625 CD1 ILE A 691 -2.540 0.104 0.183 1.00 10.55 C ATOM 0 H ILE A 691 -5.688 -1.209 -2.298 1.00 41.31 H new ATOM 0 HA ILE A 691 -3.078 -1.867 -3.496 1.00 72.41 H new ATOM 0 HB ILE A 691 -4.051 -2.088 -0.619 1.00 44.43 H new ATOM 0 HG12 ILE A 691 -2.256 -0.008 -1.932 1.00 34.04 H new ATOM 0 HG13 ILE A 691 -3.917 0.263 -1.443 1.00 34.04 H new ATOM 0 HG21 ILE A 691 -1.642 -2.390 -0.119 1.00 30.14 H new ATOM 0 HG22 ILE A 691 -2.249 -3.670 -1.196 1.00 30.14 H new ATOM 0 HG23 ILE A 691 -1.279 -2.334 -1.860 1.00 30.14 H new ATOM 0 HD11 ILE A 691 -2.357 1.178 0.208 1.00 10.55 H new ATOM 0 HD12 ILE A 691 -3.305 -0.152 0.917 1.00 10.55 H new ATOM 0 HD13 ILE A 691 -1.618 -0.426 0.420 1.00 10.55 H new ATOM 1632 N THR A 692 -3.604 -4.283 -3.711 1.00 74.22 N ATOM 1633 CA THR A 692 -3.889 -5.676 -3.909 1.00 20.45 C ATOM 1634 C THR A 692 -2.827 -6.517 -3.186 1.00 3.33 C ATOM 1635 O THR A 692 -1.638 -6.398 -3.463 1.00 52.23 O ATOM 1636 CB THR A 692 -3.870 -5.985 -5.410 1.00 72.15 C ATOM 1637 OG1 THR A 692 -4.755 -5.069 -6.107 1.00 1.34 O ATOM 1638 CG2 THR A 692 -4.318 -7.404 -5.682 1.00 71.20 C ATOM 0 H THR A 692 -2.848 -3.928 -4.296 1.00 74.22 H new ATOM 0 HA THR A 692 -4.872 -5.917 -3.505 1.00 20.45 H new ATOM 0 HB THR A 692 -2.847 -5.867 -5.766 1.00 72.15 H new ATOM 0 HG1 THR A 692 -4.741 -5.267 -7.067 1.00 1.34 H new ATOM 0 HG21 THR A 692 -4.294 -7.594 -6.755 1.00 71.20 H new ATOM 0 HG22 THR A 692 -3.649 -8.100 -5.175 1.00 71.20 H new ATOM 0 HG23 THR A 692 -5.334 -7.542 -5.312 1.00 71.20 H new ATOM 1644 N PHE A 693 -3.263 -7.345 -2.275 1.00 51.44 N ATOM 1645 CA PHE A 693 -2.375 -8.133 -1.443 1.00 5.24 C ATOM 1646 C PHE A 693 -2.228 -9.552 -1.961 1.00 4.14 C ATOM 1647 O PHE A 693 -3.212 -10.238 -2.203 1.00 2.33 O ATOM 1648 CB PHE A 693 -2.922 -8.183 -0.021 1.00 41.35 C ATOM 1649 CG PHE A 693 -3.028 -6.831 0.677 1.00 3.12 C ATOM 1650 CD1 PHE A 693 -3.977 -5.902 0.294 1.00 33.20 C ATOM 1651 CD2 PHE A 693 -2.177 -6.500 1.715 1.00 14.03 C ATOM 1652 CE1 PHE A 693 -4.078 -4.692 0.922 1.00 34.03 C ATOM 1653 CE2 PHE A 693 -2.278 -5.284 2.352 1.00 35.53 C ATOM 1654 CZ PHE A 693 -3.232 -4.383 1.953 1.00 71.54 C ATOM 0 H PHE A 693 -4.253 -7.498 -2.083 1.00 51.44 H new ATOM 0 HA PHE A 693 -1.394 -7.657 -1.463 1.00 5.24 H new ATOM 0 HB2 PHE A 693 -3.911 -8.642 -0.044 1.00 41.35 H new ATOM 0 HB3 PHE A 693 -2.283 -8.834 0.575 1.00 41.35 H new ATOM 0 HD1 PHE A 693 -4.651 -6.136 -0.516 1.00 33.20 H new ATOM 0 HD2 PHE A 693 -1.422 -7.205 2.030 1.00 14.03 H new ATOM 0 HE1 PHE A 693 -4.825 -3.980 0.605 1.00 34.03 H new ATOM 0 HE2 PHE A 693 -1.608 -5.040 3.163 1.00 35.53 H new ATOM 0 HZ PHE A 693 -3.316 -3.429 2.452 1.00 71.54 H new ATOM 1664 N LEU A 694 -1.003 -9.969 -2.123 1.00 1.51 N ATOM 1665 CA LEU A 694 -0.671 -11.317 -2.537 1.00 55.45 C ATOM 1666 C LEU A 694 0.048 -11.992 -1.408 1.00 21.11 C ATOM 1667 O LEU A 694 0.718 -11.325 -0.609 1.00 41.21 O ATOM 1668 CB LEU A 694 0.254 -11.327 -3.773 1.00 61.32 C ATOM 1669 CG LEU A 694 -0.316 -10.879 -5.129 1.00 61.02 C ATOM 1670 CD1 LEU A 694 -1.473 -11.760 -5.558 1.00 43.04 C ATOM 1671 CD2 LEU A 694 -0.718 -9.413 -5.138 1.00 31.23 C ATOM 0 H LEU A 694 -0.188 -9.376 -1.970 1.00 1.51 H new ATOM 0 HA LEU A 694 -1.596 -11.833 -2.796 1.00 55.45 H new ATOM 0 HB2 LEU A 694 1.111 -10.691 -3.549 1.00 61.32 H new ATOM 0 HB3 LEU A 694 0.633 -12.342 -3.893 1.00 61.32 H new ATOM 0 HG LEU A 694 0.489 -10.992 -5.856 1.00 61.02 H new ATOM 0 HD11 LEU A 694 -1.854 -11.417 -6.520 1.00 43.04 H new ATOM 0 HD12 LEU A 694 -1.131 -12.791 -5.649 1.00 43.04 H new ATOM 0 HD13 LEU A 694 -2.267 -11.706 -4.813 1.00 43.04 H new ATOM 0 HD21 LEU A 694 -1.114 -9.150 -6.119 1.00 31.23 H new ATOM 0 HD22 LEU A 694 -1.482 -9.241 -4.380 1.00 31.23 H new ATOM 0 HD23 LEU A 694 0.154 -8.795 -4.921 1.00 31.23 H new ATOM 1679 N CYS A 695 -0.076 -13.280 -1.330 1.00 42.10 N ATOM 1680 CA CYS A 695 0.572 -14.025 -0.295 1.00 10.20 C ATOM 1681 C CYS A 695 2.020 -14.304 -0.661 1.00 60.43 C ATOM 1682 O CYS A 695 2.301 -15.048 -1.607 1.00 33.24 O ATOM 1683 CB CYS A 695 -0.151 -15.324 -0.031 1.00 22.14 C ATOM 1684 SG CYS A 695 0.671 -16.349 1.216 1.00 72.24 S ATOM 0 H CYS A 695 -0.626 -13.843 -1.978 1.00 42.10 H new ATOM 0 HA CYS A 695 0.548 -13.423 0.613 1.00 10.20 H new ATOM 0 HB2 CYS A 695 -1.168 -15.108 0.297 1.00 22.14 H new ATOM 0 HB3 CYS A 695 -0.229 -15.886 -0.962 1.00 22.14 H new ATOM 1689 N ASP A 696 2.938 -13.704 0.057 1.00 22.21 N ATOM 1690 CA ASP A 696 4.354 -13.908 -0.205 1.00 34.45 C ATOM 1691 C ASP A 696 5.079 -13.865 1.125 1.00 35.11 C ATOM 1692 O ASP A 696 4.722 -13.069 1.989 1.00 22.24 O ATOM 1693 CB ASP A 696 4.875 -12.812 -1.133 1.00 52.43 C ATOM 1694 CG ASP A 696 6.220 -13.138 -1.735 1.00 23.24 C ATOM 1695 OD1 ASP A 696 7.248 -12.936 -1.082 1.00 71.33 O ATOM 1696 OD2 ASP A 696 6.252 -13.624 -2.892 1.00 54.23 O ATOM 0 H ASP A 696 2.736 -13.069 0.829 1.00 22.21 H new ATOM 0 HA ASP A 696 4.521 -14.868 -0.693 1.00 34.45 H new ATOM 0 HB2 ASP A 696 4.154 -12.649 -1.934 1.00 52.43 H new ATOM 0 HB3 ASP A 696 4.949 -11.878 -0.577 1.00 52.43 H new ATOM 1701 N ARG A 697 6.072 -14.701 1.312 1.00 51.54 N ATOM 1702 CA ARG A 697 6.726 -14.801 2.608 1.00 34.25 C ATOM 1703 C ARG A 697 7.923 -13.831 2.731 1.00 41.32 C ATOM 1704 O ARG A 697 8.589 -13.777 3.776 1.00 52.05 O ATOM 1705 CB ARG A 697 7.163 -16.263 2.876 1.00 30.23 C ATOM 1706 CG ARG A 697 7.637 -16.540 4.302 1.00 1.22 C ATOM 1707 CD ARG A 697 6.506 -16.305 5.286 1.00 41.41 C ATOM 1708 NE ARG A 697 6.893 -16.524 6.680 1.00 32.22 N ATOM 1709 CZ ARG A 697 6.018 -16.582 7.691 1.00 2.10 C ATOM 1710 NH1 ARG A 697 4.717 -16.516 7.449 1.00 12.14 N ATOM 1711 NH2 ARG A 697 6.442 -16.737 8.931 1.00 0.43 N ATOM 0 H ARG A 697 6.447 -15.320 0.594 1.00 51.54 H new ATOM 0 HA ARG A 697 6.003 -14.506 3.368 1.00 34.25 H new ATOM 0 HB2 ARG A 697 6.326 -16.924 2.652 1.00 30.23 H new ATOM 0 HB3 ARG A 697 7.966 -16.520 2.185 1.00 30.23 H new ATOM 0 HG2 ARG A 697 7.991 -17.568 4.382 1.00 1.22 H new ATOM 0 HG3 ARG A 697 8.480 -15.893 4.545 1.00 1.22 H new ATOM 0 HD2 ARG A 697 6.143 -15.283 5.174 1.00 41.41 H new ATOM 0 HD3 ARG A 697 5.676 -16.967 5.039 1.00 41.41 H new ATOM 0 HE ARG A 697 7.884 -16.639 6.893 1.00 32.22 H new ATOM 0 HH11 ARG A 697 4.381 -16.421 6.491 1.00 12.14 H new ATOM 0 HH12 ARG A 697 4.052 -16.560 8.221 1.00 12.14 H new ATOM 0 HH21 ARG A 697 7.441 -16.813 9.123 1.00 0.43 H new ATOM 0 HH22 ARG A 697 5.771 -16.781 9.698 1.00 0.43 H new ATOM 1723 N ASP A 698 8.164 -13.040 1.710 1.00 51.44 N ATOM 1724 CA ASP A 698 9.309 -12.135 1.724 1.00 74.14 C ATOM 1725 C ASP A 698 8.949 -10.864 2.447 1.00 34.50 C ATOM 1726 O ASP A 698 7.871 -10.307 2.237 1.00 43.31 O ATOM 1727 CB ASP A 698 9.790 -11.829 0.310 1.00 24.22 C ATOM 1728 CG ASP A 698 11.013 -10.940 0.267 1.00 21.04 C ATOM 1729 OD1 ASP A 698 12.107 -11.407 0.651 1.00 42.22 O ATOM 1730 OD2 ASP A 698 10.909 -9.781 -0.165 1.00 3.42 O ATOM 0 H ASP A 698 7.594 -12.999 0.865 1.00 51.44 H new ATOM 0 HA ASP A 698 10.127 -12.626 2.252 1.00 74.14 H new ATOM 0 HB2 ASP A 698 10.014 -12.766 -0.200 1.00 24.22 H new ATOM 0 HB3 ASP A 698 8.983 -11.350 -0.244 1.00 24.22 H new ATOM 1735 N ALA A 699 9.837 -10.459 3.359 1.00 43.42 N ATOM 1736 CA ALA A 699 9.687 -9.276 4.223 1.00 34.15 C ATOM 1737 C ALA A 699 8.709 -9.531 5.374 1.00 10.12 C ATOM 1738 O ALA A 699 8.751 -8.851 6.403 1.00 44.12 O ATOM 1739 CB ALA A 699 9.336 -8.003 3.440 1.00 22.42 C ATOM 0 H ALA A 699 10.710 -10.959 3.525 1.00 43.42 H new ATOM 0 HA ALA A 699 10.667 -9.096 4.665 1.00 34.15 H new ATOM 0 HB1 ALA A 699 9.239 -7.166 4.131 1.00 22.42 H new ATOM 0 HB2 ALA A 699 10.126 -7.789 2.720 1.00 22.42 H new ATOM 0 HB3 ALA A 699 8.394 -8.149 2.912 1.00 22.42 H new ATOM 1745 N GLY A 700 7.824 -10.493 5.196 1.00 62.44 N ATOM 1746 CA GLY A 700 6.900 -10.861 6.243 1.00 50.53 C ATOM 1747 C GLY A 700 5.697 -9.964 6.257 1.00 74.13 C ATOM 1748 O GLY A 700 4.598 -10.378 5.844 1.00 10.51 O ATOM 0 H GLY A 700 7.728 -11.032 4.335 1.00 62.44 H new ATOM 0 HA2 GLY A 700 6.583 -11.894 6.103 1.00 50.53 H new ATOM 0 HA3 GLY A 700 7.404 -10.810 7.208 1.00 50.53 H new ATOM 1752 N VAL A 701 5.903 -8.733 6.715 1.00 21.52 N ATOM 1753 CA VAL A 701 4.854 -7.731 6.760 1.00 11.41 C ATOM 1754 C VAL A 701 4.459 -7.365 5.336 1.00 32.33 C ATOM 1755 O VAL A 701 3.271 -7.199 5.012 1.00 73.02 O ATOM 1756 CB VAL A 701 5.295 -6.467 7.579 1.00 52.14 C ATOM 1757 CG1 VAL A 701 6.469 -5.710 6.944 1.00 62.41 C ATOM 1758 CG2 VAL A 701 4.120 -5.548 7.863 1.00 14.22 C ATOM 0 H VAL A 701 6.804 -8.406 7.065 1.00 21.52 H new ATOM 0 HA VAL A 701 3.988 -8.144 7.277 1.00 11.41 H new ATOM 0 HB VAL A 701 5.664 -6.841 8.534 1.00 52.14 H new ATOM 0 HG11 VAL A 701 6.722 -4.848 7.561 1.00 62.41 H new ATOM 0 HG12 VAL A 701 7.332 -6.371 6.872 1.00 62.41 H new ATOM 0 HG13 VAL A 701 6.187 -5.372 5.947 1.00 62.41 H new ATOM 0 HG21 VAL A 701 4.463 -4.684 8.432 1.00 14.22 H new ATOM 0 HG22 VAL A 701 3.684 -5.213 6.922 1.00 14.22 H new ATOM 0 HG23 VAL A 701 3.368 -6.086 8.440 1.00 14.22 H new ATOM 1764 N GLY A 702 5.451 -7.285 4.492 1.00 23.35 N ATOM 1765 CA GLY A 702 5.231 -7.058 3.135 1.00 45.35 C ATOM 1766 C GLY A 702 5.427 -5.644 2.741 1.00 64.11 C ATOM 1767 O GLY A 702 5.229 -4.729 3.530 1.00 50.43 O ATOM 0 H GLY A 702 6.433 -7.379 4.752 1.00 23.35 H new ATOM 0 HA2 GLY A 702 5.905 -7.687 2.554 1.00 45.35 H new ATOM 0 HA3 GLY A 702 4.215 -7.361 2.882 1.00 45.35 H new ATOM 1771 N PHE A 703 5.833 -5.478 1.546 1.00 44.04 N ATOM 1772 CA PHE A 703 6.023 -4.188 0.957 1.00 54.04 C ATOM 1773 C PHE A 703 5.163 -4.070 -0.305 1.00 75.52 C ATOM 1774 O PHE A 703 4.981 -5.059 -1.036 1.00 42.33 O ATOM 1775 CB PHE A 703 7.520 -3.945 0.637 1.00 62.20 C ATOM 1776 CG PHE A 703 8.131 -4.963 -0.300 1.00 34.14 C ATOM 1777 CD1 PHE A 703 8.722 -6.113 0.196 1.00 73.25 C ATOM 1778 CD2 PHE A 703 8.109 -4.766 -1.671 1.00 74.55 C ATOM 1779 CE1 PHE A 703 9.275 -7.043 -0.657 1.00 5.45 C ATOM 1780 CE2 PHE A 703 8.660 -5.692 -2.524 1.00 42.33 C ATOM 1781 CZ PHE A 703 9.243 -6.832 -2.019 1.00 71.11 C ATOM 0 H PHE A 703 6.053 -6.252 0.919 1.00 44.04 H new ATOM 0 HA PHE A 703 5.711 -3.422 1.667 1.00 54.04 H new ATOM 0 HB2 PHE A 703 7.629 -2.953 0.198 1.00 62.20 H new ATOM 0 HB3 PHE A 703 8.083 -3.944 1.570 1.00 62.20 H new ATOM 0 HD1 PHE A 703 8.750 -6.283 1.262 1.00 73.25 H new ATOM 0 HD2 PHE A 703 7.653 -3.874 -2.074 1.00 74.55 H new ATOM 0 HE1 PHE A 703 9.733 -7.936 -0.259 1.00 5.45 H new ATOM 0 HE2 PHE A 703 8.636 -5.525 -3.591 1.00 42.33 H new ATOM 0 HZ PHE A 703 9.675 -7.561 -2.689 1.00 71.11 H new ATOM 1791 N PRO A 704 4.562 -2.904 -0.537 1.00 32.52 N ATOM 1792 CA PRO A 704 3.801 -2.645 -1.754 1.00 43.43 C ATOM 1793 C PRO A 704 4.695 -2.245 -2.938 1.00 5.43 C ATOM 1794 O PRO A 704 5.710 -1.556 -2.772 1.00 12.22 O ATOM 1795 CB PRO A 704 2.907 -1.474 -1.356 1.00 61.33 C ATOM 1796 CG PRO A 704 3.693 -0.734 -0.325 1.00 34.12 C ATOM 1797 CD PRO A 704 4.518 -1.762 0.399 1.00 42.54 C ATOM 0 HA PRO A 704 3.262 -3.530 -2.092 1.00 43.43 H new ATOM 0 HB2 PRO A 704 2.680 -0.839 -2.213 1.00 61.33 H new ATOM 0 HB3 PRO A 704 1.955 -1.821 -0.955 1.00 61.33 H new ATOM 0 HG2 PRO A 704 4.330 0.019 -0.789 1.00 34.12 H new ATOM 0 HG3 PRO A 704 3.032 -0.210 0.365 1.00 34.12 H new ATOM 0 HD2 PRO A 704 5.518 -1.388 0.621 1.00 42.54 H new ATOM 0 HD3 PRO A 704 4.064 -2.042 1.350 1.00 42.54 H new ATOM 1805 N GLU A 705 4.314 -2.691 -4.104 1.00 11.53 N ATOM 1806 CA GLU A 705 4.979 -2.364 -5.346 1.00 63.10 C ATOM 1807 C GLU A 705 3.985 -1.619 -6.225 1.00 30.34 C ATOM 1808 O GLU A 705 2.829 -2.032 -6.334 1.00 33.00 O ATOM 1809 CB GLU A 705 5.416 -3.667 -6.041 1.00 32.04 C ATOM 1810 CG GLU A 705 6.084 -3.487 -7.401 1.00 23.44 C ATOM 1811 CD GLU A 705 7.403 -2.764 -7.327 1.00 12.43 C ATOM 1812 OE1 GLU A 705 7.412 -1.526 -7.171 1.00 52.31 O ATOM 1813 OE2 GLU A 705 8.458 -3.424 -7.458 1.00 5.24 O ATOM 0 H GLU A 705 3.511 -3.309 -4.225 1.00 11.53 H new ATOM 0 HA GLU A 705 5.859 -1.746 -5.166 1.00 63.10 H new ATOM 0 HB2 GLU A 705 6.105 -4.197 -5.383 1.00 32.04 H new ATOM 0 HB3 GLU A 705 4.541 -4.304 -6.166 1.00 32.04 H new ATOM 0 HG2 GLU A 705 6.239 -4.466 -7.854 1.00 23.44 H new ATOM 0 HG3 GLU A 705 5.412 -2.935 -8.058 1.00 23.44 H new ATOM 1820 N TYR A 706 4.401 -0.540 -6.838 1.00 13.12 N ATOM 1821 CA TYR A 706 3.502 0.206 -7.691 1.00 45.21 C ATOM 1822 C TYR A 706 3.390 -0.441 -9.051 1.00 60.10 C ATOM 1823 O TYR A 706 4.374 -0.531 -9.790 1.00 53.35 O ATOM 1824 CB TYR A 706 3.894 1.691 -7.801 1.00 33.24 C ATOM 1825 CG TYR A 706 3.031 2.466 -8.770 1.00 1.45 C ATOM 1826 CD1 TYR A 706 1.674 2.647 -8.534 1.00 54.20 C ATOM 1827 CD2 TYR A 706 3.573 3.000 -9.928 1.00 34.41 C ATOM 1828 CE1 TYR A 706 0.884 3.335 -9.422 1.00 21.42 C ATOM 1829 CE2 TYR A 706 2.793 3.691 -10.824 1.00 52.40 C ATOM 1830 CZ TYR A 706 1.452 3.859 -10.571 1.00 51.14 C ATOM 1831 OH TYR A 706 0.681 4.555 -11.469 1.00 70.45 O ATOM 0 H TYR A 706 5.345 -0.159 -6.766 1.00 13.12 H new ATOM 0 HA TYR A 706 2.518 0.181 -7.222 1.00 45.21 H new ATOM 0 HB2 TYR A 706 3.826 2.152 -6.816 1.00 33.24 H new ATOM 0 HB3 TYR A 706 4.935 1.763 -8.115 1.00 33.24 H new ATOM 0 HD1 TYR A 706 1.233 2.240 -7.636 1.00 54.20 H new ATOM 0 HD2 TYR A 706 4.626 2.871 -10.130 1.00 34.41 H new ATOM 0 HE1 TYR A 706 -0.170 3.466 -9.226 1.00 21.42 H new ATOM 0 HE2 TYR A 706 3.231 4.100 -11.722 1.00 52.40 H new ATOM 0 HH TYR A 706 1.239 4.853 -12.217 1.00 70.45 H new ATOM 1841 N GLN A 707 2.200 -0.897 -9.376 1.00 43.23 N ATOM 1842 CA GLN A 707 1.969 -1.537 -10.641 1.00 34.31 C ATOM 1843 C GLN A 707 1.584 -0.529 -11.693 1.00 11.22 C ATOM 1844 O GLN A 707 2.430 -0.123 -12.499 1.00 75.52 O ATOM 1845 CB GLN A 707 0.937 -2.661 -10.519 1.00 61.35 C ATOM 1846 CG GLN A 707 1.428 -3.817 -9.665 1.00 64.32 C ATOM 1847 CD GLN A 707 2.651 -4.488 -10.270 1.00 4.02 C ATOM 1848 OE1 GLN A 707 2.809 -4.525 -11.479 1.00 73.01 O ATOM 1849 NE2 GLN A 707 3.531 -4.992 -9.441 1.00 55.34 N ATOM 0 H GLN A 707 1.378 -0.833 -8.775 1.00 43.23 H new ATOM 0 HA GLN A 707 2.903 -1.999 -10.960 1.00 34.31 H new ATOM 0 HB2 GLN A 707 0.019 -2.261 -10.088 1.00 61.35 H new ATOM 0 HB3 GLN A 707 0.688 -3.030 -11.514 1.00 61.35 H new ATOM 0 HG2 GLN A 707 1.670 -3.454 -8.666 1.00 64.32 H new ATOM 0 HG3 GLN A 707 0.630 -4.550 -9.553 1.00 64.32 H new ATOM 0 HE21 GLN A 707 3.369 -4.945 -8.435 1.00 55.34 H new ATOM 0 HE22 GLN A 707 4.378 -5.431 -9.801 1.00 55.34 H new ATOM 1857 N GLU A 708 0.348 -0.083 -11.671 1.00 61.44 N ATOM 1858 CA GLU A 708 -0.099 0.868 -12.651 1.00 65.12 C ATOM 1859 C GLU A 708 -1.371 1.553 -12.246 1.00 4.41 C ATOM 1860 O GLU A 708 -2.314 0.916 -11.759 1.00 71.14 O ATOM 1861 CB GLU A 708 -0.340 0.194 -14.017 1.00 24.15 C ATOM 1862 CG GLU A 708 -1.348 -0.957 -13.980 1.00 13.14 C ATOM 1863 CD GLU A 708 -1.682 -1.483 -15.344 1.00 3.42 C ATOM 1864 OE1 GLU A 708 -0.784 -2.022 -16.014 1.00 35.52 O ATOM 1865 OE2 GLU A 708 -2.838 -1.346 -15.777 1.00 21.31 O ATOM 0 H GLU A 708 -0.357 -0.364 -10.989 1.00 61.44 H new ATOM 0 HA GLU A 708 0.698 1.607 -12.727 1.00 65.12 H new ATOM 0 HB2 GLU A 708 -0.690 0.946 -14.724 1.00 24.15 H new ATOM 0 HB3 GLU A 708 0.610 -0.182 -14.397 1.00 24.15 H new ATOM 0 HG2 GLU A 708 -0.945 -1.767 -13.372 1.00 13.14 H new ATOM 0 HG3 GLU A 708 -2.262 -0.617 -13.493 1.00 13.14 H new ATOM 1872 N GLU A 709 -1.370 2.840 -12.343 1.00 22.13 N ATOM 1873 CA GLU A 709 -2.594 3.550 -12.362 1.00 0.31 C ATOM 1874 C GLU A 709 -2.988 3.551 -13.802 1.00 15.34 C ATOM 1875 O GLU A 709 -2.172 3.919 -14.676 1.00 71.30 O ATOM 1876 CB GLU A 709 -2.445 4.971 -11.819 1.00 10.10 C ATOM 1877 CG GLU A 709 -3.755 5.789 -11.703 1.00 64.35 C ATOM 1878 CD GLU A 709 -4.393 6.178 -13.030 1.00 34.23 C ATOM 1879 OE1 GLU A 709 -3.829 7.049 -13.724 1.00 64.33 O ATOM 1880 OE2 GLU A 709 -5.452 5.606 -13.401 1.00 51.33 O ATOM 0 H GLU A 709 -0.532 3.418 -12.410 1.00 22.13 H new ATOM 0 HA GLU A 709 -3.345 3.089 -11.721 1.00 0.31 H new ATOM 0 HB2 GLU A 709 -1.984 4.916 -10.833 1.00 10.10 H new ATOM 0 HB3 GLU A 709 -1.755 5.515 -12.463 1.00 10.10 H new ATOM 0 HG2 GLU A 709 -4.477 5.210 -11.126 1.00 64.35 H new ATOM 0 HG3 GLU A 709 -3.549 6.697 -11.136 1.00 64.35 H new ATOM 1887 N ASP A 710 -4.164 3.141 -14.067 1.00 52.44 N ATOM 1888 CA ASP A 710 -4.652 3.069 -15.420 1.00 62.31 C ATOM 1889 C ASP A 710 -6.142 2.909 -15.363 1.00 1.12 C ATOM 1890 O ASP A 710 -6.884 3.472 -16.154 1.00 15.31 O ATOM 1891 CB ASP A 710 -3.994 1.887 -16.133 1.00 44.13 C ATOM 1892 CG ASP A 710 -4.359 1.783 -17.579 1.00 71.33 C ATOM 1893 OD1 ASP A 710 -3.739 2.498 -18.411 1.00 33.52 O ATOM 1894 OD2 ASP A 710 -5.234 0.976 -17.922 1.00 63.43 O ATOM 0 H ASP A 710 -4.835 2.839 -13.360 1.00 52.44 H new ATOM 0 HA ASP A 710 -4.407 3.973 -15.977 1.00 62.31 H new ATOM 0 HB2 ASP A 710 -2.911 1.977 -16.046 1.00 44.13 H new ATOM 0 HB3 ASP A 710 -4.279 0.964 -15.628 1.00 44.13 H new ATOM 1899 N ASN A 711 -6.560 2.179 -14.366 1.00 3.32 N ATOM 1900 CA ASN A 711 -7.956 1.912 -14.067 1.00 60.42 C ATOM 1901 C ASN A 711 -8.578 2.997 -13.152 1.00 13.22 C ATOM 1902 O ASN A 711 -9.526 2.715 -12.428 1.00 63.14 O ATOM 1903 CB ASN A 711 -8.055 0.514 -13.416 1.00 2.05 C ATOM 1904 CG ASN A 711 -7.079 0.327 -12.254 1.00 20.02 C ATOM 1905 OD1 ASN A 711 -5.933 -0.079 -12.462 1.00 61.13 O ATOM 1906 ND2 ASN A 711 -7.502 0.591 -11.045 1.00 4.31 N ATOM 0 H ASN A 711 -5.920 1.733 -13.709 1.00 3.32 H new ATOM 0 HA ASN A 711 -8.527 1.936 -14.995 1.00 60.42 H new ATOM 0 HB2 ASN A 711 -9.072 0.357 -13.058 1.00 2.05 H new ATOM 0 HB3 ASN A 711 -7.862 -0.247 -14.172 1.00 2.05 H new ATOM 0 HD21 ASN A 711 -6.879 0.462 -10.247 1.00 4.31 H new ATOM 0 HD22 ASN A 711 -8.455 0.926 -10.900 1.00 4.31 H new ATOM 1912 N SER A 712 -8.031 4.240 -13.210 1.00 44.14 N ATOM 1913 CA SER A 712 -8.517 5.447 -12.468 1.00 0.13 C ATOM 1914 C SER A 712 -8.238 5.389 -10.965 1.00 2.41 C ATOM 1915 O SER A 712 -8.533 6.311 -10.225 1.00 31.41 O ATOM 1916 CB SER A 712 -9.987 5.867 -12.804 1.00 12.50 C ATOM 1917 OG SER A 712 -10.958 4.884 -12.464 1.00 54.01 O ATOM 0 H SER A 712 -7.216 4.442 -13.789 1.00 44.14 H new ATOM 0 HA SER A 712 -7.905 6.262 -12.854 1.00 0.13 H new ATOM 0 HB2 SER A 712 -10.220 6.792 -12.276 1.00 12.50 H new ATOM 0 HB3 SER A 712 -10.059 6.081 -13.870 1.00 12.50 H new ATOM 0 HG SER A 712 -10.515 4.121 -12.038 1.00 54.01 H new ATOM 1923 N THR A 713 -7.628 4.335 -10.562 1.00 64.24 N ATOM 1924 CA THR A 713 -7.298 4.066 -9.225 1.00 71.41 C ATOM 1925 C THR A 713 -5.868 3.508 -9.251 1.00 15.33 C ATOM 1926 O THR A 713 -5.519 2.744 -10.163 1.00 32.04 O ATOM 1927 CB THR A 713 -8.278 2.991 -8.675 1.00 64.33 C ATOM 1928 OG1 THR A 713 -9.641 3.398 -8.923 1.00 11.31 O ATOM 1929 CG2 THR A 713 -8.097 2.780 -7.190 1.00 41.42 C ATOM 0 H THR A 713 -7.331 3.598 -11.201 1.00 64.24 H new ATOM 0 HA THR A 713 -7.366 4.951 -8.593 1.00 71.41 H new ATOM 0 HB THR A 713 -8.060 2.055 -9.189 1.00 64.33 H new ATOM 0 HG1 THR A 713 -10.254 2.717 -8.576 1.00 11.31 H new ATOM 0 HG21 THR A 713 -8.799 2.022 -6.842 1.00 41.42 H new ATOM 0 HG22 THR A 713 -7.078 2.449 -6.991 1.00 41.42 H new ATOM 0 HG23 THR A 713 -8.284 3.716 -6.664 1.00 41.42 H new ATOM 1935 N TYR A 714 -5.051 3.911 -8.317 1.00 70.01 N ATOM 1936 CA TYR A 714 -3.684 3.453 -8.246 1.00 23.11 C ATOM 1937 C TYR A 714 -3.633 2.096 -7.596 1.00 43.01 C ATOM 1938 O TYR A 714 -4.039 1.943 -6.454 1.00 10.21 O ATOM 1939 CB TYR A 714 -2.817 4.455 -7.448 1.00 62.43 C ATOM 1940 CG TYR A 714 -2.646 5.808 -8.116 1.00 62.41 C ATOM 1941 CD1 TYR A 714 -3.679 6.733 -8.148 1.00 31.30 C ATOM 1942 CD2 TYR A 714 -1.447 6.151 -8.723 1.00 12.13 C ATOM 1943 CE1 TYR A 714 -3.522 7.951 -8.768 1.00 65.34 C ATOM 1944 CE2 TYR A 714 -1.282 7.372 -9.340 1.00 34.43 C ATOM 1945 CZ TYR A 714 -2.323 8.267 -9.363 1.00 33.10 C ATOM 1946 OH TYR A 714 -2.166 9.483 -9.999 1.00 41.22 O ATOM 0 H TYR A 714 -5.311 4.567 -7.581 1.00 70.01 H new ATOM 0 HA TYR A 714 -3.287 3.381 -9.258 1.00 23.11 H new ATOM 0 HB2 TYR A 714 -3.265 4.603 -6.466 1.00 62.43 H new ATOM 0 HB3 TYR A 714 -1.832 4.016 -7.286 1.00 62.43 H new ATOM 0 HD1 TYR A 714 -4.622 6.493 -7.679 1.00 31.30 H new ATOM 0 HD2 TYR A 714 -0.627 5.448 -8.712 1.00 12.13 H new ATOM 0 HE1 TYR A 714 -4.339 8.658 -8.787 1.00 65.34 H new ATOM 0 HE2 TYR A 714 -0.339 7.624 -9.803 1.00 34.43 H new ATOM 0 HH TYR A 714 -1.259 9.546 -10.365 1.00 41.22 H new ATOM 1956 N ASN A 715 -3.148 1.121 -8.319 1.00 25.35 N ATOM 1957 CA ASN A 715 -3.005 -0.219 -7.783 1.00 65.05 C ATOM 1958 C ASN A 715 -1.604 -0.523 -7.385 1.00 40.35 C ATOM 1959 O ASN A 715 -0.642 -0.356 -8.171 1.00 22.44 O ATOM 1960 CB ASN A 715 -3.482 -1.288 -8.759 1.00 64.24 C ATOM 1961 CG ASN A 715 -4.987 -1.512 -8.748 1.00 64.13 C ATOM 1962 OD1 ASN A 715 -5.730 -0.847 -9.455 1.00 2.35 O ATOM 1963 ND2 ASN A 715 -5.446 -2.492 -7.965 1.00 31.20 N ATOM 0 H ASN A 715 -2.842 1.225 -9.287 1.00 25.35 H new ATOM 0 HA ASN A 715 -3.638 -0.241 -6.896 1.00 65.05 H new ATOM 0 HB2 ASN A 715 -3.174 -1.008 -9.767 1.00 64.24 H new ATOM 0 HB3 ASN A 715 -2.984 -2.228 -8.523 1.00 64.24 H new ATOM 0 HD21 ASN A 715 -6.444 -2.704 -7.945 1.00 31.20 H new ATOM 0 HD22 ASN A 715 -4.799 -3.028 -7.387 1.00 31.20 H new ATOM 1969 N PHE A 716 -1.481 -0.957 -6.173 1.00 13.22 N ATOM 1970 CA PHE A 716 -0.243 -1.390 -5.635 1.00 40.10 C ATOM 1971 C PHE A 716 -0.341 -2.839 -5.348 1.00 3.11 C ATOM 1972 O PHE A 716 -1.379 -3.319 -4.912 1.00 62.33 O ATOM 1973 CB PHE A 716 0.124 -0.631 -4.358 1.00 44.35 C ATOM 1974 CG PHE A 716 0.384 0.818 -4.585 1.00 23.03 C ATOM 1975 CD1 PHE A 716 -0.656 1.724 -4.675 1.00 4.31 C ATOM 1976 CD2 PHE A 716 1.673 1.271 -4.724 1.00 74.23 C ATOM 1977 CE1 PHE A 716 -0.406 3.056 -4.898 1.00 75.52 C ATOM 1978 CE2 PHE A 716 1.928 2.595 -4.949 1.00 42.31 C ATOM 1979 CZ PHE A 716 0.888 3.489 -5.036 1.00 74.25 C ATOM 0 H PHE A 716 -2.260 -1.020 -5.518 1.00 13.22 H new ATOM 0 HA PHE A 716 0.543 -1.191 -6.364 1.00 40.10 H new ATOM 0 HB2 PHE A 716 -0.685 -0.739 -3.635 1.00 44.35 H new ATOM 0 HB3 PHE A 716 1.010 -1.086 -3.915 1.00 44.35 H new ATOM 0 HD1 PHE A 716 -1.675 1.381 -4.569 1.00 4.31 H new ATOM 0 HD2 PHE A 716 2.494 0.573 -4.655 1.00 74.23 H new ATOM 0 HE1 PHE A 716 -1.224 3.758 -4.964 1.00 75.52 H new ATOM 0 HE2 PHE A 716 2.946 2.938 -5.058 1.00 42.31 H new ATOM 0 HZ PHE A 716 1.090 4.535 -5.213 1.00 74.25 H new ATOM 1989 N ARG A 717 0.701 -3.527 -5.600 1.00 43.10 N ATOM 1990 CA ARG A 717 0.746 -4.922 -5.372 1.00 32.32 C ATOM 1991 C ARG A 717 1.559 -5.156 -4.126 1.00 32.41 C ATOM 1992 O ARG A 717 2.725 -4.821 -4.073 1.00 63.11 O ATOM 1993 CB ARG A 717 1.362 -5.593 -6.596 1.00 43.51 C ATOM 1994 CG ARG A 717 1.524 -7.077 -6.490 1.00 74.23 C ATOM 1995 CD ARG A 717 2.007 -7.678 -7.810 1.00 53.12 C ATOM 1996 NE ARG A 717 1.039 -7.463 -8.895 1.00 24.23 N ATOM 1997 CZ ARG A 717 1.210 -7.822 -10.180 1.00 34.41 C ATOM 1998 NH1 ARG A 717 2.346 -8.366 -10.581 1.00 40.01 N ATOM 1999 NH2 ARG A 717 0.241 -7.612 -11.055 1.00 33.22 N ATOM 0 H ARG A 717 1.564 -3.135 -5.977 1.00 43.10 H new ATOM 0 HA ARG A 717 -0.246 -5.348 -5.224 1.00 32.32 H new ATOM 0 HB2 ARG A 717 0.741 -5.372 -7.464 1.00 43.51 H new ATOM 0 HB3 ARG A 717 2.340 -5.148 -6.782 1.00 43.51 H new ATOM 0 HG2 ARG A 717 2.236 -7.312 -5.699 1.00 74.23 H new ATOM 0 HG3 ARG A 717 0.573 -7.530 -6.208 1.00 74.23 H new ATOM 0 HD2 ARG A 717 2.964 -7.233 -8.083 1.00 53.12 H new ATOM 0 HD3 ARG A 717 2.178 -8.747 -7.682 1.00 53.12 H new ATOM 0 HE ARG A 717 0.162 -7.002 -8.653 1.00 24.23 H new ATOM 0 HH11 ARG A 717 3.103 -8.517 -9.914 1.00 40.01 H new ATOM 0 HH12 ARG A 717 2.466 -8.635 -11.558 1.00 40.01 H new ATOM 0 HH21 ARG A 717 -0.632 -7.179 -10.755 1.00 33.22 H new ATOM 0 HH22 ARG A 717 0.367 -7.883 -12.030 1.00 33.22 H new ATOM 2011 N TRP A 718 0.940 -5.703 -3.139 1.00 2.42 N ATOM 2012 CA TRP A 718 1.560 -5.896 -1.857 1.00 4.22 C ATOM 2013 C TRP A 718 1.871 -7.365 -1.696 1.00 40.12 C ATOM 2014 O TRP A 718 1.021 -8.205 -1.941 1.00 23.41 O ATOM 2015 CB TRP A 718 0.586 -5.437 -0.759 1.00 33.22 C ATOM 2016 CG TRP A 718 1.184 -5.297 0.611 1.00 65.14 C ATOM 2017 CD1 TRP A 718 1.746 -6.269 1.372 1.00 51.23 C ATOM 2018 CD2 TRP A 718 1.228 -4.105 1.395 1.00 24.55 C ATOM 2019 NE1 TRP A 718 2.162 -5.752 2.569 1.00 41.44 N ATOM 2020 CE2 TRP A 718 1.853 -4.427 2.607 1.00 62.34 C ATOM 2021 CE3 TRP A 718 0.806 -2.795 1.184 1.00 55.45 C ATOM 2022 CZ2 TRP A 718 2.068 -3.492 3.601 1.00 2.41 C ATOM 2023 CZ3 TRP A 718 1.017 -1.866 2.176 1.00 3.34 C ATOM 2024 CH2 TRP A 718 1.642 -2.219 3.368 1.00 71.53 C ATOM 0 H TRP A 718 -0.023 -6.036 -3.191 1.00 2.42 H new ATOM 0 HA TRP A 718 2.480 -5.317 -1.780 1.00 4.22 H new ATOM 0 HB2 TRP A 718 0.161 -4.477 -1.052 1.00 33.22 H new ATOM 0 HB3 TRP A 718 -0.238 -6.148 -0.707 1.00 33.22 H new ATOM 0 HD1 TRP A 718 1.850 -7.302 1.076 1.00 51.23 H new ATOM 0 HE1 TRP A 718 2.627 -6.274 3.311 1.00 41.44 H new ATOM 0 HE3 TRP A 718 0.323 -2.514 0.260 1.00 55.45 H new ATOM 0 HZ2 TRP A 718 2.555 -3.760 4.527 1.00 2.41 H new ATOM 0 HZ3 TRP A 718 0.693 -0.847 2.027 1.00 3.34 H new ATOM 0 HH2 TRP A 718 1.793 -1.466 4.127 1.00 71.53 H new ATOM 2035 N TYR A 719 3.064 -7.669 -1.304 1.00 32.41 N ATOM 2036 CA TYR A 719 3.463 -9.047 -1.122 1.00 33.13 C ATOM 2037 C TYR A 719 3.548 -9.308 0.378 1.00 44.32 C ATOM 2038 O TYR A 719 4.482 -8.865 1.013 1.00 1.23 O ATOM 2039 CB TYR A 719 4.835 -9.267 -1.771 1.00 12.31 C ATOM 2040 CG TYR A 719 4.917 -8.733 -3.181 1.00 74.31 C ATOM 2041 CD1 TYR A 719 4.275 -9.369 -4.230 1.00 34.42 C ATOM 2042 CD2 TYR A 719 5.632 -7.576 -3.455 1.00 50.24 C ATOM 2043 CE1 TYR A 719 4.345 -8.868 -5.512 1.00 50.30 C ATOM 2044 CE2 TYR A 719 5.708 -7.071 -4.731 1.00 43.11 C ATOM 2045 CZ TYR A 719 5.065 -7.717 -5.754 1.00 41.42 C ATOM 2046 OH TYR A 719 5.132 -7.207 -7.033 1.00 63.31 O ATOM 0 H TYR A 719 3.792 -6.985 -1.099 1.00 32.41 H new ATOM 0 HA TYR A 719 2.746 -9.726 -1.584 1.00 33.13 H new ATOM 0 HB2 TYR A 719 5.600 -8.785 -1.162 1.00 12.31 H new ATOM 0 HB3 TYR A 719 5.059 -10.334 -1.779 1.00 12.31 H new ATOM 0 HD1 TYR A 719 3.711 -10.271 -4.041 1.00 34.42 H new ATOM 0 HD2 TYR A 719 6.138 -7.063 -2.651 1.00 50.24 H new ATOM 0 HE1 TYR A 719 3.839 -9.373 -6.322 1.00 50.30 H new ATOM 0 HE2 TYR A 719 6.271 -6.170 -4.926 1.00 43.11 H new ATOM 0 HH TYR A 719 5.677 -6.393 -7.032 1.00 63.31 H new ATOM 2056 N THR A 720 2.565 -9.982 0.942 1.00 0.44 N ATOM 2057 CA THR A 720 2.510 -10.157 2.384 1.00 70.33 C ATOM 2058 C THR A 720 2.114 -11.577 2.783 1.00 62.12 C ATOM 2059 O THR A 720 1.287 -12.220 2.133 1.00 54.45 O ATOM 2060 CB THR A 720 1.543 -9.141 3.063 1.00 41.53 C ATOM 2061 OG1 THR A 720 1.593 -9.289 4.482 1.00 45.10 O ATOM 2062 CG2 THR A 720 0.107 -9.335 2.596 1.00 30.34 C ATOM 0 H THR A 720 1.797 -10.416 0.430 1.00 0.44 H new ATOM 0 HA THR A 720 3.523 -9.968 2.739 1.00 70.33 H new ATOM 0 HB THR A 720 1.869 -8.141 2.778 1.00 41.53 H new ATOM 0 HG1 THR A 720 2.161 -8.588 4.864 1.00 45.10 H new ATOM 0 HG21 THR A 720 -0.538 -8.609 3.091 1.00 30.34 H new ATOM 0 HG22 THR A 720 0.053 -9.192 1.517 1.00 30.34 H new ATOM 0 HG23 THR A 720 -0.224 -10.343 2.845 1.00 30.34 H new ATOM 2068 N SER A 721 2.726 -12.066 3.838 1.00 53.41 N ATOM 2069 CA SER A 721 2.416 -13.375 4.373 1.00 4.24 C ATOM 2070 C SER A 721 1.006 -13.375 4.984 1.00 52.52 C ATOM 2071 O SER A 721 0.328 -14.403 5.040 1.00 55.41 O ATOM 2072 CB SER A 721 3.473 -13.777 5.411 1.00 72.51 C ATOM 2073 OG SER A 721 3.572 -12.816 6.462 1.00 24.03 O ATOM 0 H SER A 721 3.454 -11.568 4.351 1.00 53.41 H new ATOM 0 HA SER A 721 2.433 -14.109 3.568 1.00 4.24 H new ATOM 0 HB2 SER A 721 3.219 -14.751 5.831 1.00 72.51 H new ATOM 0 HB3 SER A 721 4.441 -13.883 4.922 1.00 72.51 H new ATOM 0 HG SER A 721 4.071 -12.034 6.145 1.00 24.03 H new ATOM 2079 N TYR A 722 0.559 -12.185 5.386 1.00 75.42 N ATOM 2080 CA TYR A 722 -0.736 -11.984 6.002 1.00 51.53 C ATOM 2081 C TYR A 722 -1.872 -12.179 5.005 1.00 2.13 C ATOM 2082 O TYR A 722 -3.036 -12.228 5.386 1.00 5.11 O ATOM 2083 CB TYR A 722 -0.810 -10.606 6.656 1.00 11.03 C ATOM 2084 CG TYR A 722 0.187 -10.405 7.790 1.00 11.10 C ATOM 2085 CD1 TYR A 722 1.520 -10.091 7.535 1.00 42.24 C ATOM 2086 CD2 TYR A 722 -0.208 -10.532 9.113 1.00 13.21 C ATOM 2087 CE1 TYR A 722 2.418 -9.909 8.564 1.00 71.31 C ATOM 2088 CE2 TYR A 722 0.691 -10.348 10.147 1.00 42.25 C ATOM 2089 CZ TYR A 722 2.001 -10.039 9.863 1.00 72.24 C ATOM 2090 OH TYR A 722 2.901 -9.847 10.886 1.00 44.30 O ATOM 0 H TYR A 722 1.101 -11.326 5.288 1.00 75.42 H new ATOM 0 HA TYR A 722 -0.856 -12.741 6.777 1.00 51.53 H new ATOM 0 HB2 TYR A 722 -0.638 -9.844 5.895 1.00 11.03 H new ATOM 0 HB3 TYR A 722 -1.818 -10.451 7.040 1.00 11.03 H new ATOM 0 HD1 TYR A 722 1.855 -9.988 6.513 1.00 42.24 H new ATOM 0 HD2 TYR A 722 -1.235 -10.779 9.339 1.00 13.21 H new ATOM 0 HE1 TYR A 722 3.447 -9.665 8.348 1.00 71.31 H new ATOM 0 HE2 TYR A 722 0.366 -10.446 11.172 1.00 42.25 H new ATOM 0 HH TYR A 722 2.450 -9.974 11.747 1.00 44.30 H new ATOM 2100 N ALA A 723 -1.531 -12.272 3.721 1.00 0.10 N ATOM 2101 CA ALA A 723 -2.525 -12.525 2.691 1.00 60.53 C ATOM 2102 C ALA A 723 -2.829 -14.020 2.604 1.00 12.34 C ATOM 2103 O ALA A 723 -3.673 -14.454 1.826 1.00 21.20 O ATOM 2104 CB ALA A 723 -2.089 -11.977 1.352 1.00 73.21 C ATOM 0 H ALA A 723 -0.577 -12.176 3.374 1.00 0.10 H new ATOM 0 HA ALA A 723 -3.440 -12.002 2.969 1.00 60.53 H new ATOM 0 HB1 ALA A 723 -2.857 -12.185 0.606 1.00 73.21 H new ATOM 0 HB2 ALA A 723 -1.941 -10.900 1.430 1.00 73.21 H new ATOM 0 HB3 ALA A 723 -1.154 -12.451 1.052 1.00 73.21 H new ATOM 2110 N CYS A 724 -2.135 -14.792 3.410 1.00 25.33 N ATOM 2111 CA CYS A 724 -2.432 -16.193 3.551 1.00 14.51 C ATOM 2112 C CYS A 724 -3.087 -16.420 4.895 1.00 23.22 C ATOM 2113 O CYS A 724 -2.770 -15.706 5.845 1.00 70.21 O ATOM 2114 CB CYS A 724 -1.193 -17.085 3.453 1.00 22.33 C ATOM 2115 SG CYS A 724 -0.774 -17.606 1.769 1.00 24.34 S ATOM 0 H CYS A 724 -1.355 -14.466 3.981 1.00 25.33 H new ATOM 0 HA CYS A 724 -3.093 -16.465 2.728 1.00 14.51 H new ATOM 0 HB2 CYS A 724 -0.342 -16.552 3.877 1.00 22.33 H new ATOM 0 HB3 CYS A 724 -1.350 -17.973 4.066 1.00 22.33 H new ATOM 2120 N PRO A 725 -4.020 -17.381 5.009 1.00 23.32 N ATOM 2121 CA PRO A 725 -4.694 -17.677 6.274 1.00 61.34 C ATOM 2122 C PRO A 725 -3.746 -18.337 7.279 1.00 31.35 C ATOM 2123 O PRO A 725 -3.141 -17.617 8.107 1.00 36.77 O ATOM 2124 CB PRO A 725 -5.828 -18.649 5.879 1.00 41.11 C ATOM 2125 CG PRO A 725 -5.871 -18.629 4.386 1.00 72.31 C ATOM 2126 CD PRO A 725 -4.499 -18.253 3.929 1.00 53.43 C ATOM 2127 OXT PRO A 725 -3.602 -19.582 7.247 1.00 36.77 O ATOM 0 HA PRO A 725 -5.058 -16.773 6.762 1.00 61.34 H new ATOM 0 HB2 PRO A 725 -5.631 -19.654 6.252 1.00 41.11 H new ATOM 0 HB3 PRO A 725 -6.781 -18.333 6.303 1.00 41.11 H new ATOM 0 HG2 PRO A 725 -6.158 -19.604 3.993 1.00 72.31 H new ATOM 0 HG3 PRO A 725 -6.610 -17.912 4.028 1.00 72.31 H new ATOM 0 HD2 PRO A 725 -3.861 -19.128 3.804 1.00 53.43 H new ATOM 0 HD3 PRO A 725 -4.521 -17.734 2.971 1.00 53.43 H new TER 2135 PRO A 725