USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 711 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Set 1.2: A 712 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 681 ASN : amide:sc= 0.976 K(o=2,f=1) USER MOD Set 2.2: A 685 THR OG1 : rot -170:sc= 0.984 USER MOD Set 3.1: A 663 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 672 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 659 ASN : amide:sc= -4.09! C(o=-5.1!,f=-8.1!) USER MOD Set 4.2: A 661 LYS NZ :NH3+ 141:sc= -1.04 (180deg=-2.68!) USER MOD Set 5.1: A 644 GLN : amide:sc= 1.56 K(o=2.6,f=1.8) USER MOD Set 5.2: A 679 TYR OH : rot 50:sc= 0.339 USER MOD Set 5.3: A 714 TYR OH : rot 150:sc= 0.727 USER MOD Set 6.1: A 587 THR OG1 : rot 139:sc= 1.34 USER MOD Set 6.2: A 598 GLN : amide:sc= 0.0784 X(o=1.4,f=1.2) USER MOD Single : A 585 SER OG : rot 133:sc= 0.175 USER MOD Single : A 591 ASN : amide:sc= -0.272 X(o=-0.27,f=-0.043) USER MOD Single : A 593 THR OG1 : rot 0:sc= 1.15 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 606 THR OG1 : rot 180:sc= 0.0647 USER MOD Single : A 609 THR OG1 : rot 88:sc= 0.883 USER MOD Single : A 610 LYS NZ :NH3+ -166:sc= -0.0505 (180deg=-0.31) USER MOD Single : A 611 LYS NZ :NH3+ 157:sc= 1.19 (180deg=0.575) USER MOD Single : A 614 TYR OH : rot 22:sc= 0.952 USER MOD Single : A 615 LYS NZ :NH3+ -178:sc= 1.28 (180deg=1.24) USER MOD Single : A 618 THR OG1 : rot -49:sc= 1.6 USER MOD Single : A 620 LYS NZ :NH3+ 180:sc= 1.27 (180deg=1.27) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : no HD1:sc= 1.18 K(o=1.2,f=-5!) USER MOD Single : A 626 ASN : amide:sc= 1.56 K(o=1.6,f=-6.8!) USER MOD Single : A 632 SER OG : rot 106:sc= 1.29 USER MOD Single : A 640 SER OG : rot -94:sc= 1.2 USER MOD Single : A 646 SER OG : rot 170:sc= 2.17 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 652 SER OG : rot 156:sc= 0.844 USER MOD Single : A 654 ASN : amide:sc= -0.151 K(o=-0.15,f=-6.4!) USER MOD Single : A 658 SER OG : rot -78:sc= 1.22 USER MOD Single : A 664 TYR OH : rot 180:sc= -1.31! USER MOD Single : A 665 TYR OH : rot -90:sc= 0.251 USER MOD Single : A 668 MET CE :methyl -162:sc= -0.124 (180deg=-0.529) USER MOD Single : A 670 GLN : amide:sc= -5.2! C(o=-5.2!,f=-5.9!) USER MOD Single : A 673 TYR OH : rot 171:sc= 1.2 USER MOD Single : A 677 THR OG1 : rot -160:sc= -0.151 USER MOD Single : A 680 ASN : amide:sc= -0.554 K(o=-0.55,f=0) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot -20:sc= -4.54! USER MOD Single : A 692 THR OG1 : rot 180:sc= 0 USER MOD Single : A 706 TYR OH : rot -117:sc= 1.24 USER MOD Single : A 707 GLN : amide:sc= -0.926 K(o=-0.93,f=-9.4!) USER MOD Single : A 713 THR OG1 : rot 180:sc= -0.0164 USER MOD Single : A 715 ASN : amide:sc= -0.0335 X(o=-0.033,f=0) USER MOD Single : A 719 TYR OH : rot 180:sc= -0.971 USER MOD Single : A 720 THR OG1 : rot 118:sc= 1.16 USER MOD Single : A 721 SER OG : rot 98:sc= 1.24 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 8.245 6.834 19.142 1.00 40.22 N ATOM 2 CA GLU A 578 8.255 5.571 19.854 1.00 40.31 C ATOM 3 C GLU A 578 8.933 4.537 18.997 1.00 52.42 C ATOM 4 O GLU A 578 8.754 4.522 17.776 1.00 2.45 O ATOM 5 CB GLU A 578 6.824 5.082 20.220 1.00 22.44 C ATOM 6 CG GLU A 578 6.000 6.019 21.113 1.00 1.32 C ATOM 7 CD GLU A 578 5.538 7.284 20.422 1.00 3.40 C ATOM 8 OE1 GLU A 578 6.339 8.232 20.292 1.00 24.44 O ATOM 9 OE2 GLU A 578 4.366 7.350 20.012 1.00 4.14 O ATOM 0 HA GLU A 578 8.794 5.719 20.790 1.00 40.31 H new ATOM 0 HB2 GLU A 578 6.271 4.915 19.296 1.00 22.44 H new ATOM 0 HB3 GLU A 578 6.908 4.117 20.720 1.00 22.44 H new ATOM 0 HG2 GLU A 578 5.127 5.479 21.480 1.00 1.32 H new ATOM 0 HG3 GLU A 578 6.596 6.291 21.984 1.00 1.32 H new ATOM 18 N ALA A 579 9.717 3.689 19.608 1.00 21.33 N ATOM 19 CA ALA A 579 10.361 2.624 18.891 1.00 3.04 C ATOM 20 C ALA A 579 9.427 1.442 18.864 1.00 31.44 C ATOM 21 O ALA A 579 8.961 1.026 17.794 1.00 23.24 O ATOM 22 CB ALA A 579 11.675 2.249 19.552 1.00 42.23 C ATOM 0 H ALA A 579 9.925 3.717 20.606 1.00 21.33 H new ATOM 0 HA ALA A 579 10.586 2.946 17.874 1.00 3.04 H new ATOM 0 HB1 ALA A 579 12.146 1.441 18.993 1.00 42.23 H new ATOM 0 HB2 ALA A 579 12.336 3.115 19.564 1.00 42.23 H new ATOM 0 HB3 ALA A 579 11.487 1.921 20.575 1.00 42.23 H new ATOM 28 N GLU A 580 9.138 0.935 20.061 1.00 14.14 N ATOM 29 CA GLU A 580 8.227 -0.179 20.325 1.00 52.41 C ATOM 30 C GLU A 580 8.710 -1.522 19.757 1.00 51.32 C ATOM 31 O GLU A 580 8.791 -2.513 20.486 1.00 62.35 O ATOM 32 CB GLU A 580 6.791 0.156 19.903 1.00 22.15 C ATOM 33 CG GLU A 580 5.783 -0.936 20.208 1.00 12.25 C ATOM 34 CD GLU A 580 4.382 -0.500 19.923 1.00 70.42 C ATOM 35 OE1 GLU A 580 3.934 -0.616 18.769 1.00 3.23 O ATOM 36 OE2 GLU A 580 3.708 -0.001 20.851 1.00 23.31 O ATOM 0 H GLU A 580 9.553 1.308 20.915 1.00 14.14 H new ATOM 0 HA GLU A 580 8.226 -0.317 21.406 1.00 52.41 H new ATOM 0 HB2 GLU A 580 6.481 1.072 20.406 1.00 22.15 H new ATOM 0 HB3 GLU A 580 6.777 0.359 18.832 1.00 22.15 H new ATOM 0 HG2 GLU A 580 6.015 -1.820 19.614 1.00 12.25 H new ATOM 0 HG3 GLU A 580 5.867 -1.225 21.256 1.00 12.25 H new ATOM 43 N ALA A 581 9.036 -1.550 18.492 1.00 31.32 N ATOM 44 CA ALA A 581 9.479 -2.754 17.849 1.00 34.31 C ATOM 45 C ALA A 581 10.915 -3.092 18.242 1.00 11.41 C ATOM 46 O ALA A 581 11.875 -2.524 17.709 1.00 34.03 O ATOM 47 CB ALA A 581 9.335 -2.644 16.337 1.00 32.32 C ATOM 0 H ALA A 581 9.001 -0.736 17.879 1.00 31.32 H new ATOM 0 HA ALA A 581 8.843 -3.571 18.189 1.00 34.31 H new ATOM 0 HB1 ALA A 581 9.677 -3.568 15.871 1.00 32.32 H new ATOM 0 HB2 ALA A 581 8.289 -2.475 16.083 1.00 32.32 H new ATOM 0 HB3 ALA A 581 9.936 -1.810 15.974 1.00 32.32 H new ATOM 53 N GLU A 582 11.040 -3.957 19.217 1.00 15.53 N ATOM 54 CA GLU A 582 12.326 -4.460 19.648 1.00 3.33 C ATOM 55 C GLU A 582 12.503 -5.828 19.029 1.00 43.14 C ATOM 56 O GLU A 582 13.438 -6.075 18.268 1.00 14.41 O ATOM 57 CB GLU A 582 12.372 -4.546 21.172 1.00 5.10 C ATOM 58 CG GLU A 582 13.682 -5.075 21.723 1.00 15.02 C ATOM 59 CD GLU A 582 13.686 -5.159 23.223 1.00 20.45 C ATOM 60 OE1 GLU A 582 13.192 -6.163 23.775 1.00 74.23 O ATOM 61 OE2 GLU A 582 14.202 -4.241 23.874 1.00 41.40 O ATOM 0 H GLU A 582 10.250 -4.336 19.739 1.00 15.53 H new ATOM 0 HA GLU A 582 13.130 -3.795 19.333 1.00 3.33 H new ATOM 0 HB2 GLU A 582 12.190 -3.555 21.587 1.00 5.10 H new ATOM 0 HB3 GLU A 582 11.561 -5.189 21.514 1.00 5.10 H new ATOM 0 HG2 GLU A 582 13.874 -6.064 21.307 1.00 15.02 H new ATOM 0 HG3 GLU A 582 14.497 -4.428 21.397 1.00 15.02 H new ATOM 68 N PHE A 583 11.588 -6.700 19.348 1.00 3.14 N ATOM 69 CA PHE A 583 11.524 -7.996 18.754 1.00 71.41 C ATOM 70 C PHE A 583 10.542 -7.877 17.613 1.00 32.44 C ATOM 71 O PHE A 583 9.332 -7.764 17.834 1.00 61.10 O ATOM 72 CB PHE A 583 11.047 -9.026 19.793 1.00 71.31 C ATOM 73 CG PHE A 583 10.956 -10.444 19.293 1.00 55.52 C ATOM 74 CD1 PHE A 583 12.094 -11.214 19.147 1.00 13.34 C ATOM 75 CD2 PHE A 583 9.729 -11.006 18.983 1.00 33.33 C ATOM 76 CE1 PHE A 583 12.012 -12.519 18.701 1.00 50.32 C ATOM 77 CE2 PHE A 583 9.638 -12.312 18.541 1.00 53.22 C ATOM 78 CZ PHE A 583 10.782 -13.070 18.398 1.00 1.33 C ATOM 0 H PHE A 583 10.858 -6.523 20.038 1.00 3.14 H new ATOM 0 HA PHE A 583 12.497 -8.334 18.397 1.00 71.41 H new ATOM 0 HB2 PHE A 583 11.726 -9.001 20.645 1.00 71.31 H new ATOM 0 HB3 PHE A 583 10.066 -8.723 20.158 1.00 71.31 H new ATOM 0 HD1 PHE A 583 13.059 -10.791 19.384 1.00 13.34 H new ATOM 0 HD2 PHE A 583 8.831 -10.415 19.088 1.00 33.33 H new ATOM 0 HE1 PHE A 583 12.910 -13.109 18.589 1.00 50.32 H new ATOM 0 HE2 PHE A 583 8.674 -12.739 18.308 1.00 53.22 H new ATOM 0 HZ PHE A 583 10.716 -14.090 18.050 1.00 1.33 H new ATOM 88 N LEU A 584 11.048 -7.817 16.415 1.00 75.55 N ATOM 89 CA LEU A 584 10.199 -7.609 15.283 1.00 33.24 C ATOM 90 C LEU A 584 10.015 -8.839 14.412 1.00 74.31 C ATOM 91 O LEU A 584 8.895 -9.116 13.982 1.00 64.31 O ATOM 92 CB LEU A 584 10.550 -6.292 14.510 1.00 2.21 C ATOM 93 CG LEU A 584 12.018 -6.035 14.070 1.00 32.23 C ATOM 94 CD1 LEU A 584 12.470 -6.958 12.956 1.00 20.32 C ATOM 95 CD2 LEU A 584 12.198 -4.581 13.664 1.00 70.40 C ATOM 0 H LEU A 584 12.041 -7.909 16.199 1.00 75.55 H new ATOM 0 HA LEU A 584 9.197 -7.444 15.679 1.00 33.24 H new ATOM 0 HB2 LEU A 584 9.930 -6.263 13.614 1.00 2.21 H new ATOM 0 HB3 LEU A 584 10.244 -5.454 15.136 1.00 2.21 H new ATOM 0 HG LEU A 584 12.650 -6.253 14.931 1.00 32.23 H new ATOM 0 HD11 LEU A 584 13.503 -6.731 12.692 1.00 20.32 H new ATOM 0 HD12 LEU A 584 12.400 -7.993 13.290 1.00 20.32 H new ATOM 0 HD13 LEU A 584 11.832 -6.815 12.084 1.00 20.32 H new ATOM 0 HD21 LEU A 584 13.231 -4.414 13.358 1.00 70.40 H new ATOM 0 HD22 LEU A 584 11.531 -4.350 12.833 1.00 70.40 H new ATOM 0 HD23 LEU A 584 11.961 -3.935 14.510 1.00 70.40 H new ATOM 103 N SER A 585 11.101 -9.586 14.168 1.00 4.24 N ATOM 104 CA SER A 585 11.069 -10.822 13.348 1.00 24.30 C ATOM 105 C SER A 585 10.475 -10.556 11.945 1.00 13.23 C ATOM 106 O SER A 585 10.013 -11.471 11.261 1.00 53.24 O ATOM 107 CB SER A 585 10.244 -11.892 14.074 1.00 61.21 C ATOM 108 OG SER A 585 10.760 -12.126 15.380 1.00 54.43 O ATOM 0 H SER A 585 12.027 -9.358 14.529 1.00 4.24 H new ATOM 0 HA SER A 585 12.093 -11.172 13.213 1.00 24.30 H new ATOM 0 HB2 SER A 585 9.204 -11.573 14.140 1.00 61.21 H new ATOM 0 HB3 SER A 585 10.257 -12.819 13.501 1.00 61.21 H new ATOM 0 HG SER A 585 10.024 -12.130 16.027 1.00 54.43 H new ATOM 114 N ARG A 586 10.540 -9.312 11.520 1.00 32.13 N ATOM 115 CA ARG A 586 9.951 -8.890 10.280 1.00 22.44 C ATOM 116 C ARG A 586 10.839 -9.252 9.108 1.00 21.43 C ATOM 117 O ARG A 586 11.939 -8.715 8.953 1.00 13.02 O ATOM 118 CB ARG A 586 9.662 -7.382 10.322 1.00 44.01 C ATOM 119 CG ARG A 586 9.014 -6.821 9.065 1.00 10.44 C ATOM 120 CD ARG A 586 8.661 -5.350 9.243 1.00 35.10 C ATOM 121 NE ARG A 586 9.831 -4.511 9.522 1.00 42.43 N ATOM 122 CZ ARG A 586 9.825 -3.441 10.332 1.00 53.23 C ATOM 123 NH1 ARG A 586 8.716 -3.118 11.014 1.00 35.40 N ATOM 124 NH2 ARG A 586 10.928 -2.705 10.467 1.00 30.11 N ATOM 0 H ARG A 586 11.008 -8.565 12.033 1.00 32.13 H new ATOM 0 HA ARG A 586 9.006 -9.415 10.143 1.00 22.44 H new ATOM 0 HB2 ARG A 586 9.012 -7.174 11.172 1.00 44.01 H new ATOM 0 HB3 ARG A 586 10.598 -6.852 10.499 1.00 44.01 H new ATOM 0 HG2 ARG A 586 9.692 -6.936 8.219 1.00 10.44 H new ATOM 0 HG3 ARG A 586 8.114 -7.389 8.831 1.00 10.44 H new ATOM 0 HD2 ARG A 586 8.168 -4.988 8.341 1.00 35.10 H new ATOM 0 HD3 ARG A 586 7.946 -5.250 10.059 1.00 35.10 H new ATOM 0 HE ARG A 586 10.711 -4.758 9.069 1.00 42.43 H new ATOM 0 HH11 ARG A 586 7.874 -3.686 10.918 1.00 35.40 H new ATOM 0 HH12 ARG A 586 8.714 -2.304 11.629 1.00 35.40 H new ATOM 0 HH21 ARG A 586 11.774 -2.955 9.955 1.00 30.11 H new ATOM 0 HH22 ARG A 586 10.926 -1.891 11.082 1.00 30.11 H new ATOM 136 N THR A 587 10.361 -10.161 8.308 1.00 13.53 N ATOM 137 CA THR A 587 11.058 -10.614 7.144 1.00 33.51 C ATOM 138 C THR A 587 10.522 -9.861 5.933 1.00 43.31 C ATOM 139 O THR A 587 9.307 -9.650 5.822 1.00 72.40 O ATOM 140 CB THR A 587 10.825 -12.125 6.943 1.00 62.42 C ATOM 141 OG1 THR A 587 11.126 -12.810 8.159 1.00 52.41 O ATOM 142 CG2 THR A 587 11.726 -12.666 5.852 1.00 34.12 C ATOM 0 H THR A 587 9.459 -10.615 8.451 1.00 13.53 H new ATOM 0 HA THR A 587 12.126 -10.432 7.264 1.00 33.51 H new ATOM 0 HB THR A 587 9.784 -12.281 6.658 1.00 62.42 H new ATOM 0 HG1 THR A 587 10.458 -13.510 8.314 1.00 52.41 H new ATOM 0 HG21 THR A 587 11.545 -13.734 5.727 1.00 34.12 H new ATOM 0 HG22 THR A 587 11.514 -12.150 4.916 1.00 34.12 H new ATOM 0 HG23 THR A 587 12.768 -12.504 6.127 1.00 34.12 H new ATOM 148 N GLU A 588 11.399 -9.423 5.067 1.00 31.13 N ATOM 149 CA GLU A 588 10.985 -8.718 3.884 1.00 44.34 C ATOM 150 C GLU A 588 11.114 -9.552 2.613 1.00 1.12 C ATOM 151 O GLU A 588 11.908 -10.489 2.540 1.00 63.12 O ATOM 152 CB GLU A 588 11.636 -7.309 3.763 1.00 12.41 C ATOM 153 CG GLU A 588 13.173 -7.233 3.860 1.00 72.51 C ATOM 154 CD GLU A 588 13.917 -7.951 2.748 1.00 44.34 C ATOM 155 OE1 GLU A 588 13.974 -7.424 1.611 1.00 2.23 O ATOM 156 OE2 GLU A 588 14.489 -9.024 3.008 1.00 5.33 O ATOM 0 H GLU A 588 12.408 -9.543 5.160 1.00 31.13 H new ATOM 0 HA GLU A 588 9.916 -8.540 4.003 1.00 44.34 H new ATOM 0 HB2 GLU A 588 11.336 -6.879 2.807 1.00 12.41 H new ATOM 0 HB3 GLU A 588 11.216 -6.675 4.544 1.00 12.41 H new ATOM 0 HG2 GLU A 588 13.472 -6.185 3.860 1.00 72.51 H new ATOM 0 HG3 GLU A 588 13.484 -7.653 4.816 1.00 72.51 H new ATOM 163 N GLY A 589 10.282 -9.240 1.677 1.00 22.42 N ATOM 164 CA GLY A 589 10.293 -9.836 0.382 1.00 44.13 C ATOM 165 C GLY A 589 9.947 -8.768 -0.600 1.00 33.34 C ATOM 166 O GLY A 589 9.751 -7.634 -0.197 1.00 2.42 O ATOM 0 H GLY A 589 9.550 -8.539 1.796 1.00 22.42 H new ATOM 0 HA2 GLY A 589 11.273 -10.258 0.161 1.00 44.13 H new ATOM 0 HA3 GLY A 589 9.575 -10.654 0.329 1.00 44.13 H new ATOM 170 N ASP A 590 9.856 -9.077 -1.854 1.00 32.15 N ATOM 171 CA ASP A 590 9.534 -8.052 -2.830 1.00 74.42 C ATOM 172 C ASP A 590 8.795 -8.607 -4.010 1.00 74.13 C ATOM 173 O ASP A 590 8.445 -9.791 -4.035 1.00 61.22 O ATOM 174 CB ASP A 590 10.777 -7.257 -3.270 1.00 63.43 C ATOM 175 CG ASP A 590 11.870 -8.115 -3.843 1.00 63.41 C ATOM 176 OD1 ASP A 590 11.758 -8.546 -5.018 1.00 42.04 O ATOM 177 OD2 ASP A 590 12.873 -8.356 -3.133 1.00 5.11 O ATOM 0 H ASP A 590 9.995 -10.013 -2.235 1.00 32.15 H new ATOM 0 HA ASP A 590 8.864 -7.352 -2.330 1.00 74.42 H new ATOM 0 HB2 ASP A 590 10.480 -6.517 -4.013 1.00 63.43 H new ATOM 0 HB3 ASP A 590 11.169 -6.708 -2.413 1.00 63.43 H new ATOM 182 N ASN A 591 8.509 -7.722 -4.967 1.00 4.11 N ATOM 183 CA ASN A 591 7.796 -8.050 -6.205 1.00 62.32 C ATOM 184 C ASN A 591 6.374 -8.549 -5.865 1.00 45.31 C ATOM 185 O ASN A 591 5.858 -9.487 -6.461 1.00 33.41 O ATOM 186 CB ASN A 591 8.625 -9.068 -7.051 1.00 55.41 C ATOM 187 CG ASN A 591 8.102 -9.278 -8.480 1.00 75.30 C ATOM 188 OD1 ASN A 591 8.447 -8.525 -9.396 1.00 32.22 O ATOM 189 ND2 ASN A 591 7.334 -10.307 -8.693 1.00 12.41 N ATOM 0 H ASN A 591 8.771 -6.738 -4.903 1.00 4.11 H new ATOM 0 HA ASN A 591 7.681 -7.160 -6.824 1.00 62.32 H new ATOM 0 HB2 ASN A 591 9.658 -8.724 -7.102 1.00 55.41 H new ATOM 0 HB3 ASN A 591 8.634 -10.028 -6.535 1.00 55.41 H new ATOM 0 HD21 ASN A 591 7.001 -10.509 -9.636 1.00 12.41 H new ATOM 0 HD22 ASN A 591 7.065 -10.912 -7.917 1.00 12.41 H new ATOM 195 N CYS A 592 5.757 -7.865 -4.883 1.00 43.45 N ATOM 196 CA CYS A 592 4.372 -8.122 -4.430 1.00 43.22 C ATOM 197 C CYS A 592 4.264 -9.400 -3.612 1.00 72.21 C ATOM 198 O CYS A 592 3.156 -9.906 -3.369 1.00 61.03 O ATOM 199 CB CYS A 592 3.394 -8.179 -5.609 1.00 14.23 C ATOM 200 SG CYS A 592 3.376 -6.702 -6.671 1.00 35.20 S ATOM 0 H CYS A 592 6.211 -7.107 -4.373 1.00 43.45 H new ATOM 0 HA CYS A 592 4.101 -7.283 -3.789 1.00 43.22 H new ATOM 0 HB2 CYS A 592 3.640 -9.046 -6.223 1.00 14.23 H new ATOM 0 HB3 CYS A 592 2.389 -8.339 -5.219 1.00 14.23 H new ATOM 205 N THR A 593 5.388 -9.902 -3.144 1.00 0.13 N ATOM 206 CA THR A 593 5.397 -11.114 -2.373 1.00 3.22 C ATOM 207 C THR A 593 6.312 -10.980 -1.182 1.00 24.02 C ATOM 208 O THR A 593 7.290 -10.255 -1.231 1.00 23.12 O ATOM 209 CB THR A 593 5.822 -12.352 -3.222 1.00 70.12 C ATOM 210 OG1 THR A 593 7.070 -12.104 -3.909 1.00 74.25 O ATOM 211 CG2 THR A 593 4.751 -12.740 -4.226 1.00 32.40 C ATOM 0 H THR A 593 6.307 -9.483 -3.288 1.00 0.13 H new ATOM 0 HA THR A 593 4.375 -11.277 -2.032 1.00 3.22 H new ATOM 0 HB THR A 593 5.956 -13.182 -2.529 1.00 70.12 H new ATOM 0 HG1 THR A 593 7.390 -11.204 -3.691 1.00 74.25 H new ATOM 0 HG21 THR A 593 5.085 -13.606 -4.798 1.00 32.40 H new ATOM 0 HG22 THR A 593 3.830 -12.987 -3.698 1.00 32.40 H new ATOM 0 HG23 THR A 593 4.569 -11.906 -4.904 1.00 32.40 H new ATOM 217 N VAL A 594 5.977 -11.650 -0.131 1.00 54.02 N ATOM 218 CA VAL A 594 6.789 -11.698 1.044 1.00 54.32 C ATOM 219 C VAL A 594 7.004 -13.142 1.438 1.00 72.11 C ATOM 220 O VAL A 594 6.056 -13.913 1.539 1.00 54.52 O ATOM 221 CB VAL A 594 6.222 -10.831 2.212 1.00 4.53 C ATOM 222 CG1 VAL A 594 4.753 -11.122 2.467 1.00 70.44 C ATOM 223 CG2 VAL A 594 7.024 -11.048 3.479 1.00 2.24 C ATOM 0 H VAL A 594 5.115 -12.191 -0.061 1.00 54.02 H new ATOM 0 HA VAL A 594 7.756 -11.250 0.816 1.00 54.32 H new ATOM 0 HB VAL A 594 6.309 -9.787 1.912 1.00 4.53 H new ATOM 0 HG11 VAL A 594 4.396 -10.499 3.287 1.00 70.44 H new ATOM 0 HG12 VAL A 594 4.177 -10.903 1.568 1.00 70.44 H new ATOM 0 HG13 VAL A 594 4.631 -12.173 2.730 1.00 70.44 H new ATOM 0 HG21 VAL A 594 6.612 -10.434 4.280 1.00 2.24 H new ATOM 0 HG22 VAL A 594 6.975 -12.099 3.765 1.00 2.24 H new ATOM 0 HG23 VAL A 594 8.063 -10.767 3.305 1.00 2.24 H new ATOM 229 N PHE A 595 8.239 -13.508 1.624 1.00 72.41 N ATOM 230 CA PHE A 595 8.589 -14.872 1.888 1.00 50.21 C ATOM 231 C PHE A 595 9.550 -14.979 3.052 1.00 12.44 C ATOM 232 O PHE A 595 10.491 -14.190 3.178 1.00 24.43 O ATOM 233 CB PHE A 595 9.151 -15.528 0.612 1.00 24.43 C ATOM 234 CG PHE A 595 10.310 -14.781 -0.027 1.00 12.21 C ATOM 235 CD1 PHE A 595 10.075 -13.716 -0.889 1.00 74.41 C ATOM 236 CD2 PHE A 595 11.621 -15.141 0.234 1.00 65.45 C ATOM 237 CE1 PHE A 595 11.119 -13.033 -1.471 1.00 4.44 C ATOM 238 CE2 PHE A 595 12.670 -14.457 -0.350 1.00 22.43 C ATOM 239 CZ PHE A 595 12.418 -13.401 -1.202 1.00 72.43 C ATOM 0 H PHE A 595 9.032 -12.868 1.597 1.00 72.41 H new ATOM 0 HA PHE A 595 7.689 -15.415 2.178 1.00 50.21 H new ATOM 0 HB2 PHE A 595 9.477 -16.540 0.853 1.00 24.43 H new ATOM 0 HB3 PHE A 595 8.347 -15.618 -0.119 1.00 24.43 H new ATOM 0 HD1 PHE A 595 9.059 -13.420 -1.105 1.00 74.41 H new ATOM 0 HD2 PHE A 595 11.826 -15.965 0.901 1.00 65.45 H new ATOM 0 HE1 PHE A 595 10.919 -12.208 -2.139 1.00 4.44 H new ATOM 0 HE2 PHE A 595 13.688 -14.749 -0.139 1.00 22.43 H new ATOM 0 HZ PHE A 595 13.238 -12.865 -1.657 1.00 72.43 H new ATOM 249 N ASP A 596 9.292 -15.939 3.898 1.00 44.24 N ATOM 250 CA ASP A 596 10.082 -16.181 5.083 1.00 41.13 C ATOM 251 C ASP A 596 10.675 -17.588 4.998 1.00 15.33 C ATOM 252 O ASP A 596 9.937 -18.569 4.951 1.00 5.54 O ATOM 253 CB ASP A 596 9.158 -16.104 6.297 1.00 40.51 C ATOM 254 CG ASP A 596 9.901 -16.142 7.587 1.00 33.52 C ATOM 255 OD1 ASP A 596 10.450 -17.170 7.909 1.00 12.23 O ATOM 256 OD2 ASP A 596 9.919 -15.129 8.303 1.00 4.23 O ATOM 0 H ASP A 596 8.514 -16.589 3.785 1.00 44.24 H new ATOM 0 HA ASP A 596 10.882 -15.446 5.168 1.00 41.13 H new ATOM 0 HB2 ASP A 596 8.573 -15.186 6.246 1.00 40.51 H new ATOM 0 HB3 ASP A 596 8.452 -16.934 6.264 1.00 40.51 H new ATOM 261 N SER A 597 11.984 -17.673 4.927 1.00 0.32 N ATOM 262 CA SER A 597 12.710 -18.953 4.884 1.00 54.35 C ATOM 263 C SER A 597 12.654 -19.706 6.234 1.00 60.35 C ATOM 264 O SER A 597 12.758 -20.938 6.286 1.00 51.15 O ATOM 265 CB SER A 597 14.175 -18.687 4.521 1.00 44.44 C ATOM 266 OG SER A 597 14.280 -17.944 3.314 1.00 60.24 O ATOM 0 H SER A 597 12.594 -16.856 4.896 1.00 0.32 H new ATOM 0 HA SER A 597 12.229 -19.580 4.134 1.00 54.35 H new ATOM 0 HB2 SER A 597 14.659 -18.141 5.330 1.00 44.44 H new ATOM 0 HB3 SER A 597 14.704 -19.634 4.415 1.00 44.44 H new ATOM 0 HG SER A 597 15.225 -17.787 3.107 1.00 60.24 H new ATOM 272 N GLN A 598 12.459 -18.960 7.292 1.00 64.30 N ATOM 273 CA GLN A 598 12.584 -19.452 8.663 1.00 63.41 C ATOM 274 C GLN A 598 11.331 -20.198 9.077 1.00 34.14 C ATOM 275 O GLN A 598 11.396 -21.272 9.664 1.00 0.21 O ATOM 276 CB GLN A 598 12.765 -18.236 9.549 1.00 62.10 C ATOM 277 CG GLN A 598 13.900 -17.350 9.093 1.00 52.43 C ATOM 278 CD GLN A 598 13.661 -15.914 9.435 1.00 52.25 C ATOM 279 OE1 GLN A 598 14.045 -15.424 10.499 1.00 55.52 O ATOM 280 NE2 GLN A 598 12.994 -15.230 8.527 1.00 41.03 N ATOM 0 H GLN A 598 12.204 -17.974 7.236 1.00 64.30 H new ATOM 0 HA GLN A 598 13.426 -20.139 8.748 1.00 63.41 H new ATOM 0 HB2 GLN A 598 11.840 -17.659 9.561 1.00 62.10 H new ATOM 0 HB3 GLN A 598 12.951 -18.561 10.573 1.00 62.10 H new ATOM 0 HG2 GLN A 598 14.829 -17.683 9.556 1.00 52.43 H new ATOM 0 HG3 GLN A 598 14.027 -17.450 8.015 1.00 52.43 H new ATOM 0 HE21 GLN A 598 12.699 -15.683 7.662 1.00 41.03 H new ATOM 0 HE22 GLN A 598 12.773 -14.248 8.689 1.00 41.03 H new ATOM 288 N ALA A 599 10.201 -19.629 8.756 1.00 71.10 N ATOM 289 CA ALA A 599 8.933 -20.240 9.056 1.00 31.32 C ATOM 290 C ALA A 599 8.406 -20.972 7.842 1.00 33.31 C ATOM 291 O ALA A 599 7.518 -21.823 7.955 1.00 4.31 O ATOM 292 CB ALA A 599 7.939 -19.180 9.503 1.00 61.21 C ATOM 0 H ALA A 599 10.132 -18.730 8.280 1.00 71.10 H new ATOM 0 HA ALA A 599 9.070 -20.959 9.864 1.00 31.32 H new ATOM 0 HB1 ALA A 599 6.982 -19.651 9.728 1.00 61.21 H new ATOM 0 HB2 ALA A 599 8.316 -18.680 10.395 1.00 61.21 H new ATOM 0 HB3 ALA A 599 7.805 -18.448 8.707 1.00 61.21 H new ATOM 298 N GLY A 600 8.959 -20.645 6.684 1.00 51.31 N ATOM 299 CA GLY A 600 8.552 -21.293 5.453 1.00 41.54 C ATOM 300 C GLY A 600 7.190 -20.833 5.029 1.00 0.03 C ATOM 301 O GLY A 600 6.288 -21.637 4.808 1.00 44.23 O ATOM 0 H GLY A 600 9.686 -19.939 6.574 1.00 51.31 H new ATOM 0 HA2 GLY A 600 9.275 -21.075 4.667 1.00 41.54 H new ATOM 0 HA3 GLY A 600 8.548 -22.374 5.591 1.00 41.54 H new ATOM 305 N PHE A 601 7.036 -19.548 4.928 1.00 30.35 N ATOM 306 CA PHE A 601 5.765 -18.968 4.611 1.00 32.20 C ATOM 307 C PHE A 601 5.950 -17.947 3.503 1.00 50.52 C ATOM 308 O PHE A 601 6.960 -17.247 3.467 1.00 43.35 O ATOM 309 CB PHE A 601 5.200 -18.305 5.882 1.00 15.02 C ATOM 310 CG PHE A 601 3.812 -17.742 5.760 1.00 54.35 C ATOM 311 CD1 PHE A 601 2.706 -18.562 5.921 1.00 54.32 C ATOM 312 CD2 PHE A 601 3.609 -16.396 5.505 1.00 30.30 C ATOM 313 CE1 PHE A 601 1.428 -18.053 5.830 1.00 11.22 C ATOM 314 CE2 PHE A 601 2.334 -15.882 5.410 1.00 73.22 C ATOM 315 CZ PHE A 601 1.242 -16.712 5.573 1.00 62.53 C ATOM 0 H PHE A 601 7.787 -18.871 5.063 1.00 30.35 H new ATOM 0 HA PHE A 601 5.065 -19.729 4.266 1.00 32.20 H new ATOM 0 HB2 PHE A 601 5.205 -19.041 6.686 1.00 15.02 H new ATOM 0 HB3 PHE A 601 5.873 -17.502 6.181 1.00 15.02 H new ATOM 0 HD1 PHE A 601 2.847 -19.614 6.120 1.00 54.32 H new ATOM 0 HD2 PHE A 601 4.459 -15.742 5.379 1.00 30.30 H new ATOM 0 HE1 PHE A 601 0.575 -18.703 5.960 1.00 11.22 H new ATOM 0 HE2 PHE A 601 2.189 -14.831 5.208 1.00 73.22 H new ATOM 0 HZ PHE A 601 0.242 -16.310 5.499 1.00 62.53 H new ATOM 325 N SER A 602 5.007 -17.882 2.610 1.00 12.32 N ATOM 326 CA SER A 602 5.035 -16.931 1.535 1.00 53.14 C ATOM 327 C SER A 602 3.656 -16.329 1.340 1.00 55.40 C ATOM 328 O SER A 602 2.640 -17.049 1.350 1.00 73.11 O ATOM 329 CB SER A 602 5.556 -17.589 0.254 1.00 23.10 C ATOM 330 OG SER A 602 4.844 -18.783 -0.029 1.00 53.30 O ATOM 0 H SER A 602 4.189 -18.492 2.606 1.00 12.32 H new ATOM 0 HA SER A 602 5.720 -16.121 1.787 1.00 53.14 H new ATOM 0 HB2 SER A 602 5.458 -16.896 -0.581 1.00 23.10 H new ATOM 0 HB3 SER A 602 6.618 -17.811 0.361 1.00 23.10 H new ATOM 0 HG SER A 602 5.193 -19.185 -0.852 1.00 53.30 H new ATOM 336 N PHE A 603 3.602 -15.033 1.211 1.00 21.40 N ATOM 337 CA PHE A 603 2.358 -14.369 1.048 1.00 70.03 C ATOM 338 C PHE A 603 2.450 -13.451 -0.155 1.00 52.04 C ATOM 339 O PHE A 603 3.507 -12.859 -0.404 1.00 11.21 O ATOM 340 CB PHE A 603 2.067 -13.557 2.291 1.00 24.33 C ATOM 341 CG PHE A 603 0.611 -13.417 2.560 1.00 2.23 C ATOM 342 CD1 PHE A 603 -0.041 -14.382 3.297 1.00 70.21 C ATOM 343 CD2 PHE A 603 -0.106 -12.342 2.088 1.00 52.32 C ATOM 344 CE1 PHE A 603 -1.377 -14.286 3.558 1.00 35.52 C ATOM 345 CE2 PHE A 603 -1.449 -12.242 2.349 1.00 30.12 C ATOM 346 CZ PHE A 603 -2.083 -13.218 3.087 1.00 65.12 C ATOM 0 H PHE A 603 4.417 -14.419 1.217 1.00 21.40 H new ATOM 0 HA PHE A 603 1.558 -15.093 0.895 1.00 70.03 H new ATOM 0 HB2 PHE A 603 2.547 -14.029 3.148 1.00 24.33 H new ATOM 0 HB3 PHE A 603 2.509 -12.566 2.184 1.00 24.33 H new ATOM 0 HD1 PHE A 603 0.514 -15.228 3.674 1.00 70.21 H new ATOM 0 HD2 PHE A 603 0.389 -11.575 1.511 1.00 52.32 H new ATOM 0 HE1 PHE A 603 -1.873 -15.052 4.135 1.00 35.52 H new ATOM 0 HE2 PHE A 603 -2.010 -11.398 1.976 1.00 30.12 H new ATOM 0 HZ PHE A 603 -3.140 -13.137 3.293 1.00 65.12 H new ATOM 356 N ASP A 604 1.376 -13.339 -0.902 1.00 11.30 N ATOM 357 CA ASP A 604 1.367 -12.480 -2.075 1.00 31.42 C ATOM 358 C ASP A 604 0.199 -11.530 -2.000 1.00 53.55 C ATOM 359 O ASP A 604 -0.858 -11.878 -1.467 1.00 53.32 O ATOM 360 CB ASP A 604 1.302 -13.287 -3.398 1.00 41.34 C ATOM 361 CG ASP A 604 -0.055 -13.910 -3.698 1.00 1.15 C ATOM 362 OD1 ASP A 604 -0.361 -15.001 -3.179 1.00 22.14 O ATOM 363 OD2 ASP A 604 -0.826 -13.318 -4.494 1.00 32.41 O ATOM 0 H ASP A 604 0.498 -13.827 -0.724 1.00 11.30 H new ATOM 0 HA ASP A 604 2.304 -11.924 -2.079 1.00 31.42 H new ATOM 0 HB2 ASP A 604 1.575 -12.629 -4.223 1.00 41.34 H new ATOM 0 HB3 ASP A 604 2.050 -14.079 -3.362 1.00 41.34 H new ATOM 368 N LEU A 605 0.389 -10.337 -2.507 1.00 51.51 N ATOM 369 CA LEU A 605 -0.666 -9.324 -2.551 1.00 74.21 C ATOM 370 C LEU A 605 -0.657 -8.649 -3.902 1.00 72.14 C ATOM 371 O LEU A 605 -1.140 -7.530 -4.058 1.00 51.24 O ATOM 372 CB LEU A 605 -0.483 -8.279 -1.449 1.00 62.22 C ATOM 373 CG LEU A 605 -0.589 -8.773 0.000 1.00 51.12 C ATOM 374 CD1 LEU A 605 -0.298 -7.644 0.957 1.00 63.45 C ATOM 375 CD2 LEU A 605 -1.977 -9.337 0.273 1.00 22.30 C ATOM 0 H LEU A 605 1.277 -10.029 -2.904 1.00 51.51 H new ATOM 0 HA LEU A 605 -1.623 -9.819 -2.388 1.00 74.21 H new ATOM 0 HB2 LEU A 605 0.495 -7.816 -1.579 1.00 62.22 H new ATOM 0 HB3 LEU A 605 -1.228 -7.497 -1.596 1.00 62.22 H new ATOM 0 HG LEU A 605 0.145 -9.565 0.148 1.00 51.12 H new ATOM 0 HD11 LEU A 605 -0.376 -8.007 1.982 1.00 63.45 H new ATOM 0 HD12 LEU A 605 0.710 -7.268 0.781 1.00 63.45 H new ATOM 0 HD13 LEU A 605 -1.017 -6.840 0.801 1.00 63.45 H new ATOM 0 HD21 LEU A 605 -2.033 -9.682 1.305 1.00 22.30 H new ATOM 0 HD22 LEU A 605 -2.724 -8.560 0.109 1.00 22.30 H new ATOM 0 HD23 LEU A 605 -2.169 -10.173 -0.400 1.00 22.30 H new ATOM 383 N THR A 606 -0.154 -9.370 -4.879 1.00 74.32 N ATOM 384 CA THR A 606 -0.028 -8.923 -6.243 1.00 44.55 C ATOM 385 C THR A 606 -1.335 -8.246 -6.811 1.00 20.14 C ATOM 386 O THR A 606 -1.245 -7.157 -7.406 1.00 40.10 O ATOM 387 CB THR A 606 0.384 -10.116 -7.104 1.00 42.55 C ATOM 388 OG1 THR A 606 1.450 -10.806 -6.427 1.00 23.32 O ATOM 389 CG2 THR A 606 0.893 -9.650 -8.441 1.00 71.31 C ATOM 0 H THR A 606 0.191 -10.319 -4.737 1.00 74.32 H new ATOM 0 HA THR A 606 0.733 -8.143 -6.270 1.00 44.55 H new ATOM 0 HB THR A 606 -0.477 -10.766 -7.259 1.00 42.55 H new ATOM 0 HG1 THR A 606 1.731 -11.578 -6.961 1.00 23.32 H new ATOM 0 HG21 THR A 606 1.182 -10.513 -9.041 1.00 71.31 H new ATOM 0 HG22 THR A 606 0.108 -9.096 -8.956 1.00 71.31 H new ATOM 0 HG23 THR A 606 1.758 -9.003 -8.296 1.00 71.31 H new ATOM 395 N PRO A 607 -2.562 -8.855 -6.632 1.00 31.54 N ATOM 396 CA PRO A 607 -3.827 -8.256 -7.111 1.00 43.12 C ATOM 397 C PRO A 607 -4.174 -6.897 -6.463 1.00 55.53 C ATOM 398 O PRO A 607 -5.070 -6.203 -6.934 1.00 23.25 O ATOM 399 CB PRO A 607 -4.895 -9.299 -6.743 1.00 75.25 C ATOM 400 CG PRO A 607 -4.271 -10.116 -5.675 1.00 53.13 C ATOM 401 CD PRO A 607 -2.817 -10.177 -6.012 1.00 11.40 C ATOM 0 HA PRO A 607 -3.757 -8.035 -8.176 1.00 43.12 H new ATOM 0 HB2 PRO A 607 -5.810 -8.822 -6.393 1.00 75.25 H new ATOM 0 HB3 PRO A 607 -5.164 -9.911 -7.604 1.00 75.25 H new ATOM 0 HG2 PRO A 607 -4.427 -9.665 -4.695 1.00 53.13 H new ATOM 0 HG3 PRO A 607 -4.707 -11.114 -5.640 1.00 53.13 H new ATOM 0 HD2 PRO A 607 -2.203 -10.332 -5.125 1.00 11.40 H new ATOM 0 HD3 PRO A 607 -2.596 -10.994 -6.699 1.00 11.40 H new ATOM 409 N LEU A 608 -3.470 -6.506 -5.391 1.00 70.24 N ATOM 410 CA LEU A 608 -3.762 -5.244 -4.733 1.00 61.23 C ATOM 411 C LEU A 608 -3.139 -4.076 -5.499 1.00 14.31 C ATOM 412 O LEU A 608 -3.339 -2.930 -5.150 1.00 60.41 O ATOM 413 CB LEU A 608 -3.219 -5.202 -3.302 1.00 45.01 C ATOM 414 CG LEU A 608 -3.626 -6.296 -2.316 1.00 30.24 C ATOM 415 CD1 LEU A 608 -3.143 -5.938 -0.923 1.00 44.14 C ATOM 416 CD2 LEU A 608 -5.104 -6.522 -2.300 1.00 2.24 C ATOM 0 H LEU A 608 -2.709 -7.042 -4.974 1.00 70.24 H new ATOM 0 HA LEU A 608 -4.848 -5.157 -4.711 1.00 61.23 H new ATOM 0 HB2 LEU A 608 -2.131 -5.205 -3.364 1.00 45.01 H new ATOM 0 HB3 LEU A 608 -3.511 -4.245 -2.869 1.00 45.01 H new ATOM 0 HG LEU A 608 -3.158 -7.224 -2.645 1.00 30.24 H new ATOM 0 HD11 LEU A 608 -3.436 -6.721 -0.224 1.00 44.14 H new ATOM 0 HD12 LEU A 608 -2.057 -5.843 -0.928 1.00 44.14 H new ATOM 0 HD13 LEU A 608 -3.589 -4.992 -0.615 1.00 44.14 H new ATOM 0 HD21 LEU A 608 -5.344 -7.308 -1.584 1.00 2.24 H new ATOM 0 HD22 LEU A 608 -5.610 -5.601 -2.010 1.00 2.24 H new ATOM 0 HD23 LEU A 608 -5.437 -6.822 -3.294 1.00 2.24 H new ATOM 424 N THR A 609 -2.384 -4.382 -6.515 1.00 14.22 N ATOM 425 CA THR A 609 -1.708 -3.374 -7.298 1.00 40.13 C ATOM 426 C THR A 609 -2.694 -2.661 -8.247 1.00 12.12 C ATOM 427 O THR A 609 -3.503 -3.315 -8.926 1.00 42.55 O ATOM 428 CB THR A 609 -0.590 -4.036 -8.130 1.00 71.15 C ATOM 429 OG1 THR A 609 0.253 -4.801 -7.257 1.00 65.34 O ATOM 430 CG2 THR A 609 0.256 -2.994 -8.843 1.00 40.24 C ATOM 0 H THR A 609 -2.216 -5.338 -6.829 1.00 14.22 H new ATOM 0 HA THR A 609 -1.283 -2.635 -6.618 1.00 40.13 H new ATOM 0 HB THR A 609 -1.053 -4.678 -8.879 1.00 71.15 H new ATOM 0 HG1 THR A 609 -0.109 -5.707 -7.164 1.00 65.34 H new ATOM 0 HG21 THR A 609 1.035 -3.491 -9.421 1.00 40.24 H new ATOM 0 HG22 THR A 609 -0.375 -2.409 -9.512 1.00 40.24 H new ATOM 0 HG23 THR A 609 0.715 -2.333 -8.108 1.00 40.24 H new ATOM 436 N LYS A 610 -2.655 -1.342 -8.264 1.00 51.52 N ATOM 437 CA LYS A 610 -3.452 -0.566 -9.192 1.00 55.04 C ATOM 438 C LYS A 610 -2.571 0.392 -9.930 1.00 75.21 C ATOM 439 O LYS A 610 -1.638 0.925 -9.361 1.00 32.40 O ATOM 440 CB LYS A 610 -4.539 0.259 -8.494 1.00 4.43 C ATOM 441 CG LYS A 610 -5.608 -0.522 -7.784 1.00 51.14 C ATOM 442 CD LYS A 610 -6.737 0.400 -7.354 1.00 52.01 C ATOM 443 CE LYS A 610 -7.889 -0.367 -6.732 1.00 50.40 C ATOM 444 NZ LYS A 610 -8.493 -1.336 -7.671 1.00 73.22 N ATOM 0 H LYS A 610 -2.074 -0.783 -7.639 1.00 51.52 H new ATOM 0 HA LYS A 610 -3.930 -1.281 -9.862 1.00 55.04 H new ATOM 0 HB2 LYS A 610 -4.058 0.918 -7.771 1.00 4.43 H new ATOM 0 HB3 LYS A 610 -5.017 0.896 -9.238 1.00 4.43 H new ATOM 0 HG2 LYS A 610 -5.996 -1.301 -8.441 1.00 51.14 H new ATOM 0 HG3 LYS A 610 -5.185 -1.021 -6.912 1.00 51.14 H new ATOM 0 HD2 LYS A 610 -6.358 1.129 -6.638 1.00 52.01 H new ATOM 0 HD3 LYS A 610 -7.098 0.959 -8.217 1.00 52.01 H new ATOM 0 HE2 LYS A 610 -7.534 -0.895 -5.847 1.00 50.40 H new ATOM 0 HE3 LYS A 610 -8.652 0.336 -6.399 1.00 50.40 H new ATOM 0 HZ1 LYS A 610 -9.407 -1.660 -7.295 1.00 73.22 H new ATOM 0 HZ2 LYS A 610 -8.640 -0.880 -8.594 1.00 73.22 H new ATOM 0 HZ3 LYS A 610 -7.857 -2.151 -7.785 1.00 73.22 H new ATOM 458 N LYS A 611 -2.860 0.620 -11.187 1.00 10.13 N ATOM 459 CA LYS A 611 -2.137 1.628 -11.935 1.00 40.53 C ATOM 460 C LYS A 611 -2.632 3.008 -11.516 1.00 52.31 C ATOM 461 O LYS A 611 -1.918 3.990 -11.593 1.00 70.52 O ATOM 462 CB LYS A 611 -2.305 1.450 -13.446 1.00 22.35 C ATOM 463 CG LYS A 611 -3.734 1.530 -13.910 1.00 35.51 C ATOM 464 CD LYS A 611 -3.843 1.475 -15.405 1.00 12.31 C ATOM 465 CE LYS A 611 -5.289 1.512 -15.825 1.00 73.40 C ATOM 466 NZ LYS A 611 -5.997 2.740 -15.368 1.00 25.13 N ATOM 0 H LYS A 611 -3.583 0.129 -11.713 1.00 10.13 H new ATOM 0 HA LYS A 611 -1.075 1.522 -11.712 1.00 40.53 H new ATOM 0 HB2 LYS A 611 -1.722 2.215 -13.960 1.00 22.35 H new ATOM 0 HB3 LYS A 611 -1.891 0.485 -13.737 1.00 22.35 H new ATOM 0 HG2 LYS A 611 -4.303 0.709 -13.475 1.00 35.51 H new ATOM 0 HG3 LYS A 611 -4.182 2.455 -13.548 1.00 35.51 H new ATOM 0 HD2 LYS A 611 -3.307 2.315 -15.847 1.00 12.31 H new ATOM 0 HD3 LYS A 611 -3.372 0.565 -15.778 1.00 12.31 H new ATOM 0 HE2 LYS A 611 -5.348 1.449 -16.912 1.00 73.40 H new ATOM 0 HE3 LYS A 611 -5.800 0.635 -15.427 1.00 73.40 H new ATOM 0 HZ1 LYS A 611 -6.822 2.912 -15.977 1.00 25.13 H new ATOM 0 HZ2 LYS A 611 -6.313 2.613 -14.385 1.00 25.13 H new ATOM 0 HZ3 LYS A 611 -5.351 3.553 -15.422 1.00 25.13 H new ATOM 480 N ASP A 612 -3.869 3.044 -11.039 1.00 61.22 N ATOM 481 CA ASP A 612 -4.537 4.294 -10.651 1.00 61.30 C ATOM 482 C ASP A 612 -4.237 4.628 -9.201 1.00 51.51 C ATOM 483 O ASP A 612 -4.438 5.765 -8.751 1.00 20.42 O ATOM 484 CB ASP A 612 -6.056 4.169 -10.846 1.00 72.21 C ATOM 485 CG ASP A 612 -6.472 3.936 -12.282 1.00 64.44 C ATOM 486 OD1 ASP A 612 -6.530 2.759 -12.726 1.00 4.14 O ATOM 487 OD2 ASP A 612 -6.768 4.914 -12.990 1.00 3.22 O ATOM 0 H ASP A 612 -4.443 2.211 -10.907 1.00 61.22 H new ATOM 0 HA ASP A 612 -4.159 5.095 -11.286 1.00 61.30 H new ATOM 0 HB2 ASP A 612 -6.425 3.347 -10.233 1.00 72.21 H new ATOM 0 HB3 ASP A 612 -6.535 5.078 -10.482 1.00 72.21 H new ATOM 492 N ALA A 613 -3.753 3.620 -8.483 1.00 0.12 N ATOM 493 CA ALA A 613 -3.391 3.704 -7.068 1.00 72.33 C ATOM 494 C ALA A 613 -4.602 3.908 -6.132 1.00 45.13 C ATOM 495 O ALA A 613 -5.755 4.036 -6.569 1.00 44.52 O ATOM 496 CB ALA A 613 -2.301 4.748 -6.822 1.00 52.20 C ATOM 0 H ALA A 613 -3.596 2.693 -8.879 1.00 0.12 H new ATOM 0 HA ALA A 613 -2.980 2.728 -6.810 1.00 72.33 H new ATOM 0 HB1 ALA A 613 -2.061 4.780 -5.759 1.00 52.20 H new ATOM 0 HB2 ALA A 613 -1.408 4.482 -7.388 1.00 52.20 H new ATOM 0 HB3 ALA A 613 -2.656 5.727 -7.143 1.00 52.20 H new ATOM 502 N TYR A 614 -4.314 3.892 -4.864 1.00 62.10 N ATOM 503 CA TYR A 614 -5.287 4.040 -3.779 1.00 53.11 C ATOM 504 C TYR A 614 -5.193 5.401 -3.155 1.00 51.12 C ATOM 505 O TYR A 614 -4.125 6.018 -3.158 1.00 22.21 O ATOM 506 CB TYR A 614 -5.053 2.979 -2.708 1.00 72.24 C ATOM 507 CG TYR A 614 -5.299 1.590 -3.194 1.00 11.01 C ATOM 508 CD1 TYR A 614 -4.372 0.954 -3.995 1.00 61.51 C ATOM 509 CD2 TYR A 614 -6.468 0.916 -2.874 1.00 44.41 C ATOM 510 CE1 TYR A 614 -4.592 -0.295 -4.462 1.00 71.02 C ATOM 511 CE2 TYR A 614 -6.698 -0.351 -3.343 1.00 2.52 C ATOM 512 CZ TYR A 614 -5.752 -0.951 -4.140 1.00 71.22 C ATOM 513 OH TYR A 614 -5.964 -2.203 -4.626 1.00 61.40 O ATOM 0 H TYR A 614 -3.360 3.771 -4.525 1.00 62.10 H new ATOM 0 HA TYR A 614 -6.282 3.915 -4.206 1.00 53.11 H new ATOM 0 HB2 TYR A 614 -4.027 3.055 -2.348 1.00 72.24 H new ATOM 0 HB3 TYR A 614 -5.704 3.180 -1.858 1.00 72.24 H new ATOM 0 HD1 TYR A 614 -3.455 1.463 -4.253 1.00 61.51 H new ATOM 0 HD2 TYR A 614 -7.206 1.395 -2.248 1.00 44.41 H new ATOM 0 HE1 TYR A 614 -3.855 -0.776 -5.088 1.00 71.02 H new ATOM 0 HE2 TYR A 614 -7.610 -0.871 -3.090 1.00 2.52 H new ATOM 0 HH TYR A 614 -5.106 -2.610 -4.867 1.00 61.40 H new ATOM 523 N LYS A 615 -6.293 5.880 -2.638 1.00 52.33 N ATOM 524 CA LYS A 615 -6.318 7.166 -2.016 1.00 55.14 C ATOM 525 C LYS A 615 -6.843 7.135 -0.585 1.00 50.51 C ATOM 526 O LYS A 615 -7.855 6.522 -0.293 1.00 53.34 O ATOM 527 CB LYS A 615 -7.042 8.200 -2.912 1.00 52.35 C ATOM 528 CG LYS A 615 -8.456 7.828 -3.392 1.00 74.30 C ATOM 529 CD LYS A 615 -9.543 7.920 -2.323 1.00 1.10 C ATOM 530 CE LYS A 615 -9.736 9.340 -1.815 1.00 3.02 C ATOM 531 NZ LYS A 615 -10.844 9.420 -0.824 1.00 62.30 N ATOM 0 H LYS A 615 -7.188 5.390 -2.638 1.00 52.33 H new ATOM 0 HA LYS A 615 -5.283 7.495 -1.918 1.00 55.14 H new ATOM 0 HB2 LYS A 615 -7.105 9.140 -2.364 1.00 52.35 H new ATOM 0 HB3 LYS A 615 -6.422 8.383 -3.790 1.00 52.35 H new ATOM 0 HG2 LYS A 615 -8.726 8.482 -4.221 1.00 74.30 H new ATOM 0 HG3 LYS A 615 -8.436 6.810 -3.782 1.00 74.30 H new ATOM 0 HD2 LYS A 615 -10.484 7.552 -2.732 1.00 1.10 H new ATOM 0 HD3 LYS A 615 -9.283 7.270 -1.487 1.00 1.10 H new ATOM 0 HE2 LYS A 615 -8.812 9.693 -1.358 1.00 3.02 H new ATOM 0 HE3 LYS A 615 -9.949 10.002 -2.654 1.00 3.02 H new ATOM 0 HZ1 LYS A 615 -10.971 10.408 -0.524 1.00 62.30 H new ATOM 0 HZ2 LYS A 615 -11.724 9.075 -1.258 1.00 62.30 H new ATOM 0 HZ3 LYS A 615 -10.613 8.834 0.003 1.00 62.30 H new ATOM 545 N VAL A 616 -6.114 7.750 0.292 1.00 2.02 N ATOM 546 CA VAL A 616 -6.520 7.936 1.661 1.00 31.35 C ATOM 547 C VAL A 616 -6.731 9.418 1.813 1.00 52.21 C ATOM 548 O VAL A 616 -5.915 10.193 1.355 1.00 10.31 O ATOM 549 CB VAL A 616 -5.429 7.473 2.661 1.00 3.13 C ATOM 550 CG1 VAL A 616 -5.924 7.582 4.097 1.00 51.31 C ATOM 551 CG2 VAL A 616 -4.959 6.064 2.352 1.00 5.41 C ATOM 0 H VAL A 616 -5.199 8.148 0.078 1.00 2.02 H new ATOM 0 HA VAL A 616 -7.412 7.348 1.877 1.00 31.35 H new ATOM 0 HB VAL A 616 -4.573 8.138 2.549 1.00 3.13 H new ATOM 0 HG11 VAL A 616 -5.140 7.251 4.778 1.00 51.31 H new ATOM 0 HG12 VAL A 616 -6.181 8.618 4.316 1.00 51.31 H new ATOM 0 HG13 VAL A 616 -6.806 6.954 4.227 1.00 51.31 H new ATOM 0 HG21 VAL A 616 -4.195 5.770 3.071 1.00 5.41 H new ATOM 0 HG22 VAL A 616 -5.802 5.377 2.417 1.00 5.41 H new ATOM 0 HG23 VAL A 616 -4.542 6.032 1.345 1.00 5.41 H new ATOM 557 N GLU A 617 -7.790 9.815 2.409 1.00 32.45 N ATOM 558 CA GLU A 617 -8.129 11.178 2.453 1.00 2.41 C ATOM 559 C GLU A 617 -8.476 11.624 3.857 1.00 2.33 C ATOM 560 O GLU A 617 -9.248 10.963 4.543 1.00 35.21 O ATOM 561 CB GLU A 617 -9.272 11.350 1.487 1.00 13.14 C ATOM 562 CG GLU A 617 -9.992 12.633 1.535 1.00 62.50 C ATOM 563 CD GLU A 617 -10.982 12.709 0.417 1.00 34.31 C ATOM 564 OE1 GLU A 617 -11.746 11.751 0.223 1.00 75.03 O ATOM 565 OE2 GLU A 617 -10.987 13.705 -0.311 1.00 33.33 O ATOM 0 H GLU A 617 -8.449 9.197 2.882 1.00 32.45 H new ATOM 0 HA GLU A 617 -7.288 11.810 2.166 1.00 2.41 H new ATOM 0 HB2 GLU A 617 -8.887 11.214 0.477 1.00 13.14 H new ATOM 0 HB3 GLU A 617 -9.991 10.550 1.665 1.00 13.14 H new ATOM 0 HG2 GLU A 617 -10.504 12.736 2.492 1.00 62.50 H new ATOM 0 HG3 GLU A 617 -9.284 13.459 1.461 1.00 62.50 H new ATOM 572 N THR A 618 -7.896 12.738 4.276 1.00 22.10 N ATOM 573 CA THR A 618 -8.149 13.307 5.580 1.00 42.12 C ATOM 574 C THR A 618 -8.220 14.816 5.419 1.00 73.31 C ATOM 575 O THR A 618 -8.100 15.330 4.290 1.00 1.44 O ATOM 576 CB THR A 618 -7.023 12.961 6.623 1.00 63.32 C ATOM 577 OG1 THR A 618 -5.752 13.469 6.187 1.00 23.14 O ATOM 578 CG2 THR A 618 -6.913 11.458 6.871 1.00 12.51 C ATOM 0 H THR A 618 -7.233 13.272 3.714 1.00 22.10 H new ATOM 0 HA THR A 618 -9.080 12.888 5.961 1.00 42.12 H new ATOM 0 HB THR A 618 -7.304 13.440 7.561 1.00 63.32 H new ATOM 0 HG1 THR A 618 -5.599 13.210 5.254 1.00 23.14 H new ATOM 0 HG21 THR A 618 -6.123 11.266 7.597 1.00 12.51 H new ATOM 0 HG22 THR A 618 -7.861 11.083 7.257 1.00 12.51 H new ATOM 0 HG23 THR A 618 -6.676 10.951 5.935 1.00 12.51 H new ATOM 584 N ASP A 619 -8.404 15.520 6.511 1.00 40.30 N ATOM 585 CA ASP A 619 -8.440 16.971 6.483 1.00 61.42 C ATOM 586 C ASP A 619 -7.068 17.545 6.276 1.00 43.44 C ATOM 587 O ASP A 619 -6.910 18.579 5.625 1.00 42.55 O ATOM 588 CB ASP A 619 -9.065 17.563 7.750 1.00 2.12 C ATOM 589 CG ASP A 619 -10.528 17.261 7.877 1.00 61.32 C ATOM 590 OD1 ASP A 619 -11.324 17.865 7.136 1.00 32.30 O ATOM 591 OD2 ASP A 619 -10.913 16.408 8.721 1.00 70.23 O ATOM 0 H ASP A 619 -8.532 15.112 7.437 1.00 40.30 H new ATOM 0 HA ASP A 619 -9.072 17.246 5.639 1.00 61.42 H new ATOM 0 HB2 ASP A 619 -8.542 17.173 8.623 1.00 2.12 H new ATOM 0 HB3 ASP A 619 -8.921 18.643 7.749 1.00 2.12 H new ATOM 596 N LYS A 620 -6.068 16.867 6.796 1.00 43.33 N ATOM 597 CA LYS A 620 -4.723 17.364 6.692 1.00 40.10 C ATOM 598 C LYS A 620 -4.097 16.998 5.361 1.00 72.23 C ATOM 599 O LYS A 620 -3.643 17.879 4.617 1.00 21.11 O ATOM 600 CB LYS A 620 -3.841 16.874 7.852 1.00 63.40 C ATOM 601 CG LYS A 620 -4.296 17.341 9.228 1.00 31.42 C ATOM 602 CD LYS A 620 -3.294 16.962 10.325 1.00 61.33 C ATOM 603 CE LYS A 620 -3.149 15.454 10.513 1.00 11.41 C ATOM 604 NZ LYS A 620 -2.168 15.136 11.579 1.00 41.23 N ATOM 0 H LYS A 620 -6.164 15.979 7.289 1.00 43.33 H new ATOM 0 HA LYS A 620 -4.784 18.451 6.754 1.00 40.10 H new ATOM 0 HB2 LYS A 620 -3.819 15.784 7.840 1.00 63.40 H new ATOM 0 HB3 LYS A 620 -2.819 17.215 7.685 1.00 63.40 H new ATOM 0 HG2 LYS A 620 -4.430 18.423 9.218 1.00 31.42 H new ATOM 0 HG3 LYS A 620 -5.267 16.902 9.457 1.00 31.42 H new ATOM 0 HD2 LYS A 620 -2.320 17.386 10.081 1.00 61.33 H new ATOM 0 HD3 LYS A 620 -3.610 17.410 11.267 1.00 61.33 H new ATOM 0 HE2 LYS A 620 -4.117 15.022 10.766 1.00 11.41 H new ATOM 0 HE3 LYS A 620 -2.832 14.997 9.576 1.00 11.41 H new ATOM 0 HZ1 LYS A 620 -2.091 14.104 11.683 1.00 41.23 H new ATOM 0 HZ2 LYS A 620 -1.239 15.528 11.324 1.00 41.23 H new ATOM 0 HZ3 LYS A 620 -2.485 15.552 12.478 1.00 41.23 H new ATOM 618 N TYR A 621 -4.086 15.722 5.037 1.00 55.41 N ATOM 619 CA TYR A 621 -3.407 15.282 3.835 1.00 41.31 C ATOM 620 C TYR A 621 -4.245 14.252 3.107 1.00 20.33 C ATOM 621 O TYR A 621 -5.148 13.640 3.684 1.00 5.31 O ATOM 622 CB TYR A 621 -2.081 14.579 4.197 1.00 31.22 C ATOM 623 CG TYR A 621 -1.198 15.280 5.209 1.00 64.24 C ATOM 624 CD1 TYR A 621 -0.380 16.342 4.855 1.00 20.22 C ATOM 625 CD2 TYR A 621 -1.169 14.843 6.527 1.00 54.13 C ATOM 626 CE1 TYR A 621 0.441 16.954 5.794 1.00 4.44 C ATOM 627 CE2 TYR A 621 -0.364 15.443 7.462 1.00 14.22 C ATOM 628 CZ TYR A 621 0.439 16.498 7.094 1.00 55.53 C ATOM 629 OH TYR A 621 1.253 17.097 8.034 1.00 71.43 O ATOM 0 H TYR A 621 -4.531 14.981 5.579 1.00 55.41 H new ATOM 0 HA TYR A 621 -3.234 16.163 3.217 1.00 41.31 H new ATOM 0 HB2 TYR A 621 -2.315 13.585 4.579 1.00 31.22 H new ATOM 0 HB3 TYR A 621 -1.507 14.441 3.281 1.00 31.22 H new ATOM 0 HD1 TYR A 621 -0.381 16.698 3.835 1.00 20.22 H new ATOM 0 HD2 TYR A 621 -1.794 14.013 6.822 1.00 54.13 H new ATOM 0 HE1 TYR A 621 1.075 17.780 5.507 1.00 4.44 H new ATOM 0 HE2 TYR A 621 -0.361 15.089 8.482 1.00 14.22 H new ATOM 0 HH TYR A 621 1.131 16.657 8.901 1.00 71.43 H new ATOM 639 N GLU A 622 -3.968 14.076 1.863 1.00 53.41 N ATOM 640 CA GLU A 622 -4.498 12.967 1.146 1.00 70.15 C ATOM 641 C GLU A 622 -3.331 12.148 0.654 1.00 54.25 C ATOM 642 O GLU A 622 -2.392 12.679 0.065 1.00 74.11 O ATOM 643 CB GLU A 622 -5.454 13.364 0.012 1.00 43.23 C ATOM 644 CG GLU A 622 -4.873 14.267 -1.051 1.00 44.00 C ATOM 645 CD GLU A 622 -5.850 14.488 -2.164 1.00 3.41 C ATOM 646 OE1 GLU A 622 -6.712 15.372 -2.047 1.00 73.21 O ATOM 647 OE2 GLU A 622 -5.784 13.756 -3.180 1.00 71.13 O ATOM 0 H GLU A 622 -3.370 14.693 1.314 1.00 53.41 H new ATOM 0 HA GLU A 622 -5.123 12.376 1.816 1.00 70.15 H new ATOM 0 HB2 GLU A 622 -5.816 12.455 -0.468 1.00 43.23 H new ATOM 0 HB3 GLU A 622 -6.321 13.860 0.449 1.00 43.23 H new ATOM 0 HG2 GLU A 622 -4.598 15.225 -0.609 1.00 44.00 H new ATOM 0 HG3 GLU A 622 -3.959 13.825 -1.448 1.00 44.00 H new ATOM 654 N PHE A 623 -3.381 10.890 0.893 1.00 64.13 N ATOM 655 CA PHE A 623 -2.276 10.026 0.607 1.00 24.32 C ATOM 656 C PHE A 623 -2.627 9.146 -0.550 1.00 1.04 C ATOM 657 O PHE A 623 -3.705 8.575 -0.590 1.00 1.10 O ATOM 658 CB PHE A 623 -1.972 9.133 1.820 1.00 13.35 C ATOM 659 CG PHE A 623 -1.745 9.863 3.124 1.00 51.13 C ATOM 660 CD1 PHE A 623 -2.816 10.199 3.945 1.00 64.41 C ATOM 661 CD2 PHE A 623 -0.469 10.191 3.536 1.00 52.44 C ATOM 662 CE1 PHE A 623 -2.612 10.850 5.144 1.00 41.12 C ATOM 663 CE2 PHE A 623 -0.258 10.839 4.739 1.00 52.23 C ATOM 664 CZ PHE A 623 -1.329 11.170 5.543 1.00 33.21 C ATOM 0 H PHE A 623 -4.191 10.419 1.295 1.00 64.13 H new ATOM 0 HA PHE A 623 -1.404 10.637 0.375 1.00 24.32 H new ATOM 0 HB2 PHE A 623 -2.800 8.436 1.953 1.00 13.35 H new ATOM 0 HB3 PHE A 623 -1.086 8.537 1.598 1.00 13.35 H new ATOM 0 HD1 PHE A 623 -3.821 9.947 3.640 1.00 64.41 H new ATOM 0 HD2 PHE A 623 0.375 9.938 2.911 1.00 52.44 H new ATOM 0 HE1 PHE A 623 -3.454 11.109 5.769 1.00 41.12 H new ATOM 0 HE2 PHE A 623 0.746 11.086 5.050 1.00 52.23 H new ATOM 0 HZ PHE A 623 -1.165 11.678 6.482 1.00 33.21 H new ATOM 674 N HIS A 624 -1.763 9.058 -1.497 1.00 53.25 N ATOM 675 CA HIS A 624 -1.975 8.159 -2.587 1.00 1.14 C ATOM 676 C HIS A 624 -0.953 7.064 -2.482 1.00 74.45 C ATOM 677 O HIS A 624 0.252 7.332 -2.497 1.00 65.42 O ATOM 678 CB HIS A 624 -1.946 8.885 -3.936 1.00 42.31 C ATOM 679 CG HIS A 624 -3.064 9.896 -4.092 1.00 13.14 C ATOM 680 ND1 HIS A 624 -4.235 9.629 -4.760 1.00 45.42 N ATOM 681 CD2 HIS A 624 -3.186 11.174 -3.635 1.00 21.23 C ATOM 682 CE1 HIS A 624 -5.027 10.682 -4.702 1.00 63.35 C ATOM 683 NE2 HIS A 624 -4.414 11.629 -4.032 1.00 71.14 N ATOM 0 H HIS A 624 -0.898 9.597 -1.544 1.00 53.25 H new ATOM 0 HA HIS A 624 -2.971 7.720 -2.531 1.00 1.14 H new ATOM 0 HB2 HIS A 624 -0.988 9.392 -4.048 1.00 42.31 H new ATOM 0 HB3 HIS A 624 -2.014 8.151 -4.739 1.00 42.31 H new ATOM 0 HD2 HIS A 624 -2.451 11.725 -3.066 1.00 21.23 H new ATOM 0 HE1 HIS A 624 -6.014 10.753 -5.134 1.00 63.35 H new ATOM 0 HE2 HIS A 624 -4.792 12.556 -3.838 1.00 71.14 H new ATOM 692 N ILE A 625 -1.433 5.848 -2.336 1.00 62.04 N ATOM 693 CA ILE A 625 -0.588 4.698 -2.045 1.00 32.54 C ATOM 694 C ILE A 625 -0.883 3.592 -3.051 1.00 14.01 C ATOM 695 O ILE A 625 -1.945 3.576 -3.664 1.00 1.51 O ATOM 696 CB ILE A 625 -0.908 4.152 -0.610 1.00 51.11 C ATOM 697 CG1 ILE A 625 -0.900 5.290 0.413 1.00 61.11 C ATOM 698 CG2 ILE A 625 0.099 3.076 -0.190 1.00 34.30 C ATOM 699 CD1 ILE A 625 -1.244 4.849 1.815 1.00 45.10 C ATOM 0 H ILE A 625 -2.425 5.623 -2.415 1.00 62.04 H new ATOM 0 HA ILE A 625 0.457 5.002 -2.104 1.00 32.54 H new ATOM 0 HB ILE A 625 -1.902 3.705 -0.642 1.00 51.11 H new ATOM 0 HG12 ILE A 625 0.086 5.754 0.419 1.00 61.11 H new ATOM 0 HG13 ILE A 625 -1.610 6.055 0.098 1.00 61.11 H new ATOM 0 HG21 ILE A 625 -0.148 2.716 0.809 1.00 34.30 H new ATOM 0 HG22 ILE A 625 0.059 2.246 -0.895 1.00 34.30 H new ATOM 0 HG23 ILE A 625 1.103 3.500 -0.185 1.00 34.30 H new ATOM 0 HD11 ILE A 625 -1.218 5.709 2.484 1.00 45.10 H new ATOM 0 HD12 ILE A 625 -2.243 4.412 1.824 1.00 45.10 H new ATOM 0 HD13 ILE A 625 -0.520 4.107 2.151 1.00 45.10 H new ATOM 706 N ASN A 626 0.040 2.698 -3.222 1.00 41.35 N ATOM 707 CA ASN A 626 -0.105 1.568 -4.098 1.00 23.24 C ATOM 708 C ASN A 626 0.640 0.444 -3.429 1.00 23.31 C ATOM 709 O ASN A 626 1.434 0.711 -2.569 1.00 71.43 O ATOM 710 CB ASN A 626 0.441 1.902 -5.485 1.00 41.12 C ATOM 711 CG ASN A 626 -0.047 0.980 -6.570 1.00 14.32 C ATOM 712 OD1 ASN A 626 -1.077 0.298 -6.427 1.00 32.41 O ATOM 713 ND2 ASN A 626 0.603 1.031 -7.690 1.00 22.44 N ATOM 0 H ASN A 626 0.941 2.731 -2.745 1.00 41.35 H new ATOM 0 HA ASN A 626 -1.146 1.286 -4.257 1.00 23.24 H new ATOM 0 HB2 ASN A 626 0.162 2.925 -5.738 1.00 41.12 H new ATOM 0 HB3 ASN A 626 1.530 1.867 -5.454 1.00 41.12 H new ATOM 0 HD21 ASN A 626 0.273 0.499 -8.496 1.00 22.44 H new ATOM 0 HD22 ASN A 626 1.444 1.603 -7.766 1.00 22.44 H new ATOM 719 N VAL A 627 0.299 -0.788 -3.697 1.00 10.23 N ATOM 720 CA VAL A 627 0.983 -1.905 -3.019 1.00 71.52 C ATOM 721 C VAL A 627 2.289 -2.291 -3.714 1.00 5.13 C ATOM 722 O VAL A 627 3.232 -2.784 -3.099 1.00 42.23 O ATOM 723 CB VAL A 627 0.042 -3.123 -2.862 1.00 5.31 C ATOM 724 CG1 VAL A 627 0.734 -4.296 -2.164 1.00 64.44 C ATOM 725 CG2 VAL A 627 -1.160 -2.691 -2.073 1.00 23.42 C ATOM 0 H VAL A 627 -0.427 -1.061 -4.360 1.00 10.23 H new ATOM 0 HA VAL A 627 1.250 -1.558 -2.021 1.00 71.52 H new ATOM 0 HB VAL A 627 -0.250 -3.470 -3.853 1.00 5.31 H new ATOM 0 HG11 VAL A 627 0.037 -5.129 -2.075 1.00 64.44 H new ATOM 0 HG12 VAL A 627 1.599 -4.608 -2.749 1.00 64.44 H new ATOM 0 HG13 VAL A 627 1.059 -3.988 -1.171 1.00 64.44 H new ATOM 0 HG21 VAL A 627 -1.838 -3.536 -1.950 1.00 23.42 H new ATOM 0 HG22 VAL A 627 -0.843 -2.335 -1.093 1.00 23.42 H new ATOM 0 HG23 VAL A 627 -1.673 -1.888 -2.602 1.00 23.42 H new ATOM 731 N CYS A 628 2.354 -2.018 -4.958 1.00 43.34 N ATOM 732 CA CYS A 628 3.499 -2.357 -5.749 1.00 63.15 C ATOM 733 C CYS A 628 3.726 -1.305 -6.786 1.00 64.32 C ATOM 734 O CYS A 628 2.774 -0.764 -7.355 1.00 63.32 O ATOM 735 CB CYS A 628 3.297 -3.702 -6.462 1.00 74.42 C ATOM 736 SG CYS A 628 3.100 -5.162 -5.385 1.00 0.31 S ATOM 0 H CYS A 628 1.612 -1.547 -5.475 1.00 43.34 H new ATOM 0 HA CYS A 628 4.358 -2.428 -5.081 1.00 63.15 H new ATOM 0 HB2 CYS A 628 2.415 -3.624 -7.098 1.00 74.42 H new ATOM 0 HB3 CYS A 628 4.150 -3.873 -7.119 1.00 74.42 H new ATOM 741 N GLY A 629 4.967 -1.023 -7.044 1.00 41.32 N ATOM 742 CA GLY A 629 5.312 -0.098 -8.071 1.00 50.02 C ATOM 743 C GLY A 629 5.054 1.326 -7.656 1.00 74.23 C ATOM 744 O GLY A 629 5.066 1.636 -6.460 1.00 34.42 O ATOM 0 H GLY A 629 5.762 -1.427 -6.550 1.00 41.32 H new ATOM 0 HA2 GLY A 629 6.365 -0.216 -8.327 1.00 50.02 H new ATOM 0 HA3 GLY A 629 4.738 -0.323 -8.970 1.00 50.02 H new ATOM 748 N PRO A 630 4.845 2.219 -8.611 1.00 51.24 N ATOM 749 CA PRO A 630 4.598 3.617 -8.341 1.00 53.32 C ATOM 750 C PRO A 630 3.100 3.943 -8.227 1.00 11.54 C ATOM 751 O PRO A 630 2.237 3.100 -8.508 1.00 2.24 O ATOM 752 CB PRO A 630 5.214 4.272 -9.587 1.00 2.34 C ATOM 753 CG PRO A 630 4.914 3.318 -10.691 1.00 73.41 C ATOM 754 CD PRO A 630 4.855 1.941 -10.064 1.00 72.40 C ATOM 0 HA PRO A 630 5.012 3.955 -7.391 1.00 53.32 H new ATOM 0 HB2 PRO A 630 4.777 5.252 -9.778 1.00 2.34 H new ATOM 0 HB3 PRO A 630 6.288 4.419 -9.469 1.00 2.34 H new ATOM 0 HG2 PRO A 630 3.968 3.566 -11.172 1.00 73.41 H new ATOM 0 HG3 PRO A 630 5.684 3.361 -11.461 1.00 73.41 H new ATOM 0 HD2 PRO A 630 3.963 1.397 -10.374 1.00 72.40 H new ATOM 0 HD3 PRO A 630 5.714 1.333 -10.350 1.00 72.40 H new ATOM 762 N VAL A 631 2.804 5.146 -7.826 1.00 55.32 N ATOM 763 CA VAL A 631 1.428 5.615 -7.756 1.00 3.22 C ATOM 764 C VAL A 631 1.179 6.604 -8.850 1.00 25.43 C ATOM 765 O VAL A 631 2.113 7.244 -9.352 1.00 70.33 O ATOM 766 CB VAL A 631 1.100 6.340 -6.406 1.00 12.22 C ATOM 767 CG1 VAL A 631 1.182 5.405 -5.253 1.00 20.42 C ATOM 768 CG2 VAL A 631 2.009 7.549 -6.172 1.00 3.40 C ATOM 0 H VAL A 631 3.498 5.835 -7.537 1.00 55.32 H new ATOM 0 HA VAL A 631 0.799 4.730 -7.846 1.00 3.22 H new ATOM 0 HB VAL A 631 0.074 6.700 -6.486 1.00 12.22 H new ATOM 0 HG11 VAL A 631 0.949 5.941 -4.333 1.00 20.42 H new ATOM 0 HG12 VAL A 631 0.468 4.593 -5.391 1.00 20.42 H new ATOM 0 HG13 VAL A 631 2.190 4.995 -5.188 1.00 20.42 H new ATOM 0 HG21 VAL A 631 1.748 8.023 -5.226 1.00 3.40 H new ATOM 0 HG22 VAL A 631 3.048 7.222 -6.140 1.00 3.40 H new ATOM 0 HG23 VAL A 631 1.879 8.265 -6.984 1.00 3.40 H new ATOM 774 N SER A 632 -0.044 6.708 -9.275 1.00 4.13 N ATOM 775 CA SER A 632 -0.348 7.753 -10.215 1.00 44.31 C ATOM 776 C SER A 632 -1.020 8.906 -9.487 1.00 5.45 C ATOM 777 O SER A 632 -2.042 8.720 -8.801 1.00 24.10 O ATOM 778 CB SER A 632 -1.219 7.218 -11.339 1.00 44.45 C ATOM 779 OG SER A 632 -0.549 6.150 -12.009 1.00 71.23 O ATOM 0 H SER A 632 -0.823 6.110 -9.002 1.00 4.13 H new ATOM 0 HA SER A 632 0.574 8.120 -10.665 1.00 44.31 H new ATOM 0 HB2 SER A 632 -2.170 6.867 -10.938 1.00 44.45 H new ATOM 0 HB3 SER A 632 -1.446 8.016 -12.046 1.00 44.45 H new ATOM 0 HG SER A 632 -0.957 5.296 -11.754 1.00 71.23 H new ATOM 785 N VAL A 633 -0.433 10.087 -9.633 1.00 41.14 N ATOM 786 CA VAL A 633 -0.904 11.332 -9.036 1.00 51.33 C ATOM 787 C VAL A 633 -0.373 12.448 -9.936 1.00 63.21 C ATOM 788 O VAL A 633 0.668 12.258 -10.577 1.00 42.21 O ATOM 789 CB VAL A 633 -0.313 11.570 -7.585 1.00 30.12 C ATOM 790 CG1 VAL A 633 -0.946 12.779 -6.910 1.00 64.04 C ATOM 791 CG2 VAL A 633 -0.436 10.358 -6.685 1.00 42.12 C ATOM 0 H VAL A 633 0.413 10.210 -10.189 1.00 41.14 H new ATOM 0 HA VAL A 633 -1.990 11.304 -8.950 1.00 51.33 H new ATOM 0 HB VAL A 633 0.750 11.761 -7.734 1.00 30.12 H new ATOM 0 HG11 VAL A 633 -0.515 12.909 -5.917 1.00 64.04 H new ATOM 0 HG12 VAL A 633 -0.756 13.670 -7.508 1.00 64.04 H new ATOM 0 HG13 VAL A 633 -2.021 12.624 -6.821 1.00 64.04 H new ATOM 0 HG21 VAL A 633 -0.013 10.587 -5.707 1.00 42.12 H new ATOM 0 HG22 VAL A 633 -1.487 10.093 -6.573 1.00 42.12 H new ATOM 0 HG23 VAL A 633 0.104 9.520 -7.127 1.00 42.12 H new ATOM 797 N GLY A 634 -1.048 13.574 -9.997 1.00 4.32 N ATOM 798 CA GLY A 634 -0.565 14.660 -10.826 1.00 65.05 C ATOM 799 C GLY A 634 0.317 15.627 -10.053 1.00 62.11 C ATOM 800 O GLY A 634 1.155 16.318 -10.633 1.00 55.34 O ATOM 0 H GLY A 634 -1.916 13.762 -9.495 1.00 4.32 H new ATOM 0 HA2 GLY A 634 -0.003 14.251 -11.666 1.00 65.05 H new ATOM 0 HA3 GLY A 634 -1.414 15.201 -11.244 1.00 65.05 H new ATOM 804 N ALA A 635 0.129 15.679 -8.747 1.00 1.41 N ATOM 805 CA ALA A 635 0.906 16.574 -7.878 1.00 13.25 C ATOM 806 C ALA A 635 2.108 15.861 -7.246 1.00 33.20 C ATOM 807 O ALA A 635 2.778 16.407 -6.348 1.00 43.32 O ATOM 808 CB ALA A 635 0.009 17.157 -6.796 1.00 71.42 C ATOM 0 H ALA A 635 -0.559 15.111 -8.252 1.00 1.41 H new ATOM 0 HA ALA A 635 1.297 17.380 -8.499 1.00 13.25 H new ATOM 0 HB1 ALA A 635 0.593 17.819 -6.157 1.00 71.42 H new ATOM 0 HB2 ALA A 635 -0.800 17.721 -7.259 1.00 71.42 H new ATOM 0 HB3 ALA A 635 -0.409 16.349 -6.196 1.00 71.42 H new ATOM 814 N CYS A 636 2.397 14.672 -7.721 1.00 73.54 N ATOM 815 CA CYS A 636 3.492 13.880 -7.189 1.00 3.32 C ATOM 816 C CYS A 636 4.234 13.200 -8.318 1.00 4.04 C ATOM 817 O CYS A 636 3.636 12.925 -9.368 1.00 75.33 O ATOM 818 CB CYS A 636 2.962 12.814 -6.229 1.00 54.43 C ATOM 819 SG CYS A 636 2.045 13.460 -4.800 1.00 31.04 S ATOM 0 H CYS A 636 1.886 14.225 -8.482 1.00 73.54 H new ATOM 0 HA CYS A 636 4.167 14.546 -6.652 1.00 3.32 H new ATOM 0 HB2 CYS A 636 2.312 12.137 -6.784 1.00 54.43 H new ATOM 0 HB3 CYS A 636 3.803 12.223 -5.866 1.00 54.43 H new ATOM 824 N PRO A 637 5.544 12.930 -8.138 1.00 61.31 N ATOM 825 CA PRO A 637 6.336 12.215 -9.131 1.00 75.42 C ATOM 826 C PRO A 637 5.848 10.770 -9.251 1.00 72.12 C ATOM 827 O PRO A 637 5.656 10.097 -8.229 1.00 35.05 O ATOM 828 CB PRO A 637 7.761 12.247 -8.547 1.00 62.15 C ATOM 829 CG PRO A 637 7.571 12.439 -7.087 1.00 64.50 C ATOM 830 CD PRO A 637 6.354 13.296 -6.951 1.00 34.13 C ATOM 0 HA PRO A 637 6.272 12.654 -10.127 1.00 75.42 H new ATOM 0 HB2 PRO A 637 8.295 11.320 -8.757 1.00 62.15 H new ATOM 0 HB3 PRO A 637 8.347 13.058 -8.979 1.00 62.15 H new ATOM 0 HG2 PRO A 637 7.437 11.484 -6.580 1.00 64.50 H new ATOM 0 HG3 PRO A 637 8.441 12.919 -6.638 1.00 64.50 H new ATOM 0 HD2 PRO A 637 5.821 13.093 -6.022 1.00 34.13 H new ATOM 0 HD3 PRO A 637 6.607 14.356 -6.948 1.00 34.13 H new ATOM 838 N PRO A 638 5.627 10.280 -10.490 1.00 23.35 N ATOM 839 CA PRO A 638 5.132 8.917 -10.735 1.00 4.31 C ATOM 840 C PRO A 638 5.896 7.857 -9.945 1.00 55.24 C ATOM 841 O PRO A 638 5.303 7.084 -9.246 1.00 71.04 O ATOM 842 CB PRO A 638 5.358 8.730 -12.233 1.00 64.14 C ATOM 843 CG PRO A 638 5.247 10.102 -12.796 1.00 53.12 C ATOM 844 CD PRO A 638 5.824 11.023 -11.754 1.00 63.40 C ATOM 0 HA PRO A 638 4.094 8.801 -10.422 1.00 4.31 H new ATOM 0 HB2 PRO A 638 6.336 8.295 -12.436 1.00 64.14 H new ATOM 0 HB3 PRO A 638 4.615 8.061 -12.667 1.00 64.14 H new ATOM 0 HG2 PRO A 638 5.793 10.184 -13.736 1.00 53.12 H new ATOM 0 HG3 PRO A 638 4.208 10.354 -13.008 1.00 53.12 H new ATOM 0 HD2 PRO A 638 6.878 11.228 -11.939 1.00 63.40 H new ATOM 0 HD3 PRO A 638 5.310 11.984 -11.739 1.00 63.40 H new ATOM 852 N ASP A 639 7.224 7.907 -10.040 1.00 60.34 N ATOM 853 CA ASP A 639 8.185 6.961 -9.400 1.00 62.23 C ATOM 854 C ASP A 639 8.059 6.857 -7.841 1.00 75.53 C ATOM 855 O ASP A 639 8.818 6.136 -7.199 1.00 71.34 O ATOM 856 CB ASP A 639 9.637 7.328 -9.823 1.00 43.13 C ATOM 857 CG ASP A 639 10.712 6.356 -9.328 1.00 74.43 C ATOM 858 OD1 ASP A 639 10.785 5.229 -9.853 1.00 63.11 O ATOM 859 OD2 ASP A 639 11.519 6.727 -8.440 1.00 30.00 O ATOM 0 H ASP A 639 7.696 8.630 -10.583 1.00 60.34 H new ATOM 0 HA ASP A 639 7.926 5.967 -9.764 1.00 62.23 H new ATOM 0 HB2 ASP A 639 9.683 7.376 -10.911 1.00 43.13 H new ATOM 0 HB3 ASP A 639 9.869 8.326 -9.450 1.00 43.13 H new ATOM 864 N SER A 640 7.119 7.536 -7.249 1.00 22.23 N ATOM 865 CA SER A 640 6.891 7.386 -5.830 1.00 51.02 C ATOM 866 C SER A 640 5.798 6.333 -5.629 1.00 41.40 C ATOM 867 O SER A 640 4.908 6.211 -6.459 1.00 71.15 O ATOM 868 CB SER A 640 6.479 8.721 -5.181 1.00 33.42 C ATOM 869 OG SER A 640 5.289 9.253 -5.740 1.00 31.10 O ATOM 0 H SER A 640 6.499 8.196 -7.718 1.00 22.23 H new ATOM 0 HA SER A 640 7.816 7.069 -5.348 1.00 51.02 H new ATOM 0 HB2 SER A 640 6.339 8.573 -4.110 1.00 33.42 H new ATOM 0 HB3 SER A 640 7.287 9.443 -5.300 1.00 33.42 H new ATOM 0 HG SER A 640 5.517 9.879 -6.458 1.00 31.10 H new ATOM 875 N GLY A 641 5.883 5.549 -4.579 1.00 52.14 N ATOM 876 CA GLY A 641 4.839 4.567 -4.342 1.00 11.02 C ATOM 877 C GLY A 641 3.895 5.005 -3.249 1.00 50.41 C ATOM 878 O GLY A 641 2.932 4.312 -2.923 1.00 31.33 O ATOM 0 H GLY A 641 6.637 5.565 -3.892 1.00 52.14 H new ATOM 0 HA2 GLY A 641 4.278 4.403 -5.262 1.00 11.02 H new ATOM 0 HA3 GLY A 641 5.292 3.613 -4.071 1.00 11.02 H new ATOM 882 N ALA A 642 4.186 6.146 -2.676 1.00 2.05 N ATOM 883 CA ALA A 642 3.349 6.755 -1.673 1.00 4.23 C ATOM 884 C ALA A 642 3.618 8.250 -1.651 1.00 21.14 C ATOM 885 O ALA A 642 4.768 8.675 -1.509 1.00 70.12 O ATOM 886 CB ALA A 642 3.614 6.140 -0.301 1.00 62.53 C ATOM 0 H ALA A 642 5.023 6.686 -2.896 1.00 2.05 H new ATOM 0 HA ALA A 642 2.302 6.577 -1.917 1.00 4.23 H new ATOM 0 HB1 ALA A 642 2.972 6.615 0.441 1.00 62.53 H new ATOM 0 HB2 ALA A 642 3.402 5.071 -0.334 1.00 62.53 H new ATOM 0 HB3 ALA A 642 4.658 6.294 -0.029 1.00 62.53 H new ATOM 892 N CYS A 643 2.588 9.042 -1.818 1.00 2.04 N ATOM 893 CA CYS A 643 2.736 10.497 -1.802 1.00 73.22 C ATOM 894 C CYS A 643 1.528 11.162 -1.163 1.00 45.41 C ATOM 895 O CYS A 643 0.382 10.765 -1.421 1.00 73.14 O ATOM 896 CB CYS A 643 2.966 11.053 -3.202 1.00 3.41 C ATOM 897 SG CYS A 643 3.188 12.867 -3.247 1.00 71.33 S ATOM 0 H CYS A 643 1.634 8.715 -1.967 1.00 2.04 H new ATOM 0 HA CYS A 643 3.616 10.724 -1.200 1.00 73.22 H new ATOM 0 HB2 CYS A 643 3.848 10.577 -3.632 1.00 3.41 H new ATOM 0 HB3 CYS A 643 2.119 10.784 -3.833 1.00 3.41 H new ATOM 902 N GLN A 644 1.782 12.141 -0.313 1.00 33.32 N ATOM 903 CA GLN A 644 0.734 12.850 0.367 1.00 43.24 C ATOM 904 C GLN A 644 0.617 14.264 -0.152 1.00 51.52 C ATOM 905 O GLN A 644 1.620 14.952 -0.367 1.00 51.34 O ATOM 906 CB GLN A 644 0.956 12.872 1.891 1.00 71.52 C ATOM 907 CG GLN A 644 2.225 13.584 2.353 1.00 13.45 C ATOM 908 CD GLN A 644 2.369 13.584 3.862 1.00 73.13 C ATOM 909 OE1 GLN A 644 1.389 13.582 4.584 1.00 75.55 O ATOM 910 NE2 GLN A 644 3.581 13.580 4.344 1.00 14.10 N ATOM 0 H GLN A 644 2.723 12.460 -0.081 1.00 33.32 H new ATOM 0 HA GLN A 644 -0.195 12.317 0.166 1.00 43.24 H new ATOM 0 HB2 GLN A 644 0.098 13.353 2.360 1.00 71.52 H new ATOM 0 HB3 GLN A 644 0.983 11.844 2.253 1.00 71.52 H new ATOM 0 HG2 GLN A 644 3.094 13.099 1.908 1.00 13.45 H new ATOM 0 HG3 GLN A 644 2.214 14.612 1.991 1.00 13.45 H new ATOM 0 HE21 GLN A 644 4.381 13.582 3.712 1.00 14.10 H new ATOM 0 HE22 GLN A 644 3.728 13.575 5.353 1.00 14.10 H new ATOM 918 N VAL A 645 -0.586 14.679 -0.367 1.00 10.10 N ATOM 919 CA VAL A 645 -0.867 16.018 -0.768 1.00 22.50 C ATOM 920 C VAL A 645 -1.544 16.707 0.401 1.00 22.04 C ATOM 921 O VAL A 645 -2.609 16.277 0.850 1.00 14.33 O ATOM 922 CB VAL A 645 -1.797 16.063 -2.015 1.00 75.11 C ATOM 923 CG1 VAL A 645 -2.057 17.500 -2.453 1.00 40.30 C ATOM 924 CG2 VAL A 645 -1.205 15.254 -3.167 1.00 72.11 C ATOM 0 H VAL A 645 -1.413 14.091 -0.268 1.00 10.10 H new ATOM 0 HA VAL A 645 0.062 16.518 -1.043 1.00 22.50 H new ATOM 0 HB VAL A 645 -2.750 15.614 -1.734 1.00 75.11 H new ATOM 0 HG11 VAL A 645 -2.710 17.502 -3.326 1.00 40.30 H new ATOM 0 HG12 VAL A 645 -2.536 18.047 -1.641 1.00 40.30 H new ATOM 0 HG13 VAL A 645 -1.112 17.980 -2.706 1.00 40.30 H new ATOM 0 HG21 VAL A 645 -1.874 15.301 -4.026 1.00 72.11 H new ATOM 0 HG22 VAL A 645 -0.234 15.667 -3.440 1.00 72.11 H new ATOM 0 HG23 VAL A 645 -1.084 14.216 -2.858 1.00 72.11 H new ATOM 930 N SER A 646 -0.927 17.734 0.905 1.00 63.41 N ATOM 931 CA SER A 646 -1.444 18.447 2.029 1.00 21.31 C ATOM 932 C SER A 646 -2.507 19.407 1.586 1.00 64.45 C ATOM 933 O SER A 646 -2.386 20.067 0.549 1.00 14.21 O ATOM 934 CB SER A 646 -0.322 19.206 2.762 1.00 71.35 C ATOM 935 OG SER A 646 -0.825 19.937 3.885 1.00 41.40 O ATOM 0 H SER A 646 -0.046 18.101 0.544 1.00 63.41 H new ATOM 0 HA SER A 646 -1.879 17.725 2.720 1.00 21.31 H new ATOM 0 HB2 SER A 646 0.437 18.499 3.098 1.00 71.35 H new ATOM 0 HB3 SER A 646 0.166 19.892 2.070 1.00 71.35 H new ATOM 0 HG SER A 646 -0.075 20.270 4.421 1.00 41.40 H new ATOM 941 N ARG A 647 -3.527 19.493 2.365 1.00 55.42 N ATOM 942 CA ARG A 647 -4.603 20.392 2.119 1.00 40.14 C ATOM 943 C ARG A 647 -4.446 21.602 3.001 1.00 20.43 C ATOM 944 O ARG A 647 -4.949 22.676 2.699 1.00 62.53 O ATOM 945 CB ARG A 647 -5.921 19.680 2.364 1.00 41.23 C ATOM 946 CG ARG A 647 -6.144 18.544 1.394 1.00 30.21 C ATOM 947 CD ARG A 647 -7.389 17.752 1.704 1.00 73.12 C ATOM 948 NE ARG A 647 -7.637 16.770 0.663 1.00 4.23 N ATOM 949 CZ ARG A 647 -8.710 16.011 0.574 1.00 52.31 C ATOM 950 NH1 ARG A 647 -9.656 16.056 1.515 1.00 41.15 N ATOM 951 NH2 ARG A 647 -8.837 15.205 -0.448 1.00 50.42 N ATOM 0 H ARG A 647 -3.641 18.930 3.208 1.00 55.42 H new ATOM 0 HA ARG A 647 -4.594 20.727 1.082 1.00 40.14 H new ATOM 0 HB2 ARG A 647 -5.940 19.294 3.383 1.00 41.23 H new ATOM 0 HB3 ARG A 647 -6.740 20.395 2.279 1.00 41.23 H new ATOM 0 HG2 ARG A 647 -6.215 18.944 0.382 1.00 30.21 H new ATOM 0 HG3 ARG A 647 -5.281 17.879 1.414 1.00 30.21 H new ATOM 0 HD2 ARG A 647 -7.279 17.252 2.666 1.00 73.12 H new ATOM 0 HD3 ARG A 647 -8.243 18.424 1.790 1.00 73.12 H new ATOM 0 HE ARG A 647 -6.923 16.659 -0.057 1.00 4.23 H new ATOM 0 HH11 ARG A 647 -9.552 16.683 2.313 1.00 41.15 H new ATOM 0 HH12 ARG A 647 -10.483 15.464 1.436 1.00 41.15 H new ATOM 0 HH21 ARG A 647 -8.111 15.170 -1.163 1.00 50.42 H new ATOM 0 HH22 ARG A 647 -9.662 14.612 -0.530 1.00 50.42 H new ATOM 963 N SER A 648 -3.725 21.425 4.086 1.00 61.31 N ATOM 964 CA SER A 648 -3.464 22.503 4.996 1.00 4.34 C ATOM 965 C SER A 648 -2.275 23.356 4.501 1.00 24.24 C ATOM 966 O SER A 648 -2.323 24.582 4.535 1.00 75.33 O ATOM 967 CB SER A 648 -3.180 21.927 6.384 1.00 54.43 C ATOM 968 OG SER A 648 -4.245 21.072 6.802 1.00 75.12 O ATOM 0 H SER A 648 -3.308 20.534 4.356 1.00 61.31 H new ATOM 0 HA SER A 648 -4.337 23.153 5.049 1.00 4.34 H new ATOM 0 HB2 SER A 648 -2.244 21.369 6.367 1.00 54.43 H new ATOM 0 HB3 SER A 648 -3.055 22.738 7.101 1.00 54.43 H new ATOM 0 HG SER A 648 -4.045 20.711 7.691 1.00 75.12 H new ATOM 974 N ASP A 649 -1.232 22.691 3.990 1.00 33.33 N ATOM 975 CA ASP A 649 -0.009 23.399 3.560 1.00 1.30 C ATOM 976 C ASP A 649 0.006 23.593 2.066 1.00 33.13 C ATOM 977 O ASP A 649 0.838 24.334 1.548 1.00 21.43 O ATOM 978 CB ASP A 649 1.248 22.571 3.900 1.00 64.12 C ATOM 979 CG ASP A 649 1.377 22.186 5.345 1.00 1.25 C ATOM 980 OD1 ASP A 649 0.812 21.150 5.729 1.00 2.03 O ATOM 981 OD2 ASP A 649 2.064 22.898 6.113 1.00 11.34 O ATOM 0 H ASP A 649 -1.204 21.679 3.863 1.00 33.33 H new ATOM 0 HA ASP A 649 -0.005 24.358 4.079 1.00 1.30 H new ATOM 0 HB2 ASP A 649 1.242 21.664 3.296 1.00 64.12 H new ATOM 0 HB3 ASP A 649 2.131 23.141 3.610 1.00 64.12 H new ATOM 986 N ARG A 650 -0.916 22.920 1.373 1.00 34.44 N ATOM 987 CA ARG A 650 -0.994 22.937 -0.110 1.00 60.05 C ATOM 988 C ARG A 650 0.318 22.431 -0.757 1.00 52.24 C ATOM 989 O ARG A 650 0.623 22.731 -1.921 1.00 71.00 O ATOM 990 CB ARG A 650 -1.372 24.336 -0.630 1.00 24.14 C ATOM 991 CG ARG A 650 -2.743 24.816 -0.169 1.00 2.33 C ATOM 992 CD ARG A 650 -3.824 23.856 -0.616 1.00 52.03 C ATOM 993 NE ARG A 650 -5.157 24.280 -0.208 1.00 43.13 N ATOM 994 CZ ARG A 650 -6.261 23.559 -0.387 1.00 61.15 C ATOM 995 NH1 ARG A 650 -6.196 22.374 -0.996 1.00 42.04 N ATOM 996 NH2 ARG A 650 -7.424 24.022 0.033 1.00 52.33 N ATOM 0 H ARG A 650 -1.634 22.345 1.814 1.00 34.44 H new ATOM 0 HA ARG A 650 -1.785 22.247 -0.404 1.00 60.05 H new ATOM 0 HB2 ARG A 650 -0.618 25.051 -0.301 1.00 24.14 H new ATOM 0 HB3 ARG A 650 -1.349 24.326 -1.720 1.00 24.14 H new ATOM 0 HG2 ARG A 650 -2.756 24.906 0.917 1.00 2.33 H new ATOM 0 HG3 ARG A 650 -2.941 25.809 -0.573 1.00 2.33 H new ATOM 0 HD2 ARG A 650 -3.794 23.761 -1.701 1.00 52.03 H new ATOM 0 HD3 ARG A 650 -3.620 22.868 -0.204 1.00 52.03 H new ATOM 0 HE ARG A 650 -5.250 25.189 0.245 1.00 43.13 H new ATOM 0 HH11 ARG A 650 -5.299 22.019 -1.326 1.00 42.04 H new ATOM 0 HH12 ARG A 650 -7.044 21.823 -1.132 1.00 42.04 H new ATOM 0 HH21 ARG A 650 -7.475 24.931 0.494 1.00 52.33 H new ATOM 0 HH22 ARG A 650 -8.272 23.471 -0.103 1.00 52.33 H new ATOM 1008 N LYS A 651 1.041 21.618 -0.014 1.00 50.12 N ATOM 1009 CA LYS A 651 2.297 21.040 -0.460 1.00 31.42 C ATOM 1010 C LYS A 651 2.135 19.561 -0.607 1.00 25.23 C ATOM 1011 O LYS A 651 1.177 18.989 -0.113 1.00 75.13 O ATOM 1012 CB LYS A 651 3.396 21.308 0.566 1.00 61.44 C ATOM 1013 CG LYS A 651 3.692 22.763 0.779 1.00 44.22 C ATOM 1014 CD LYS A 651 4.655 22.973 1.933 1.00 41.44 C ATOM 1015 CE LYS A 651 4.914 24.454 2.180 1.00 62.10 C ATOM 1016 NZ LYS A 651 5.795 24.690 3.345 1.00 41.40 N ATOM 0 H LYS A 651 0.772 21.335 0.928 1.00 50.12 H new ATOM 0 HA LYS A 651 2.571 21.491 -1.414 1.00 31.42 H new ATOM 0 HB2 LYS A 651 3.106 20.864 1.518 1.00 61.44 H new ATOM 0 HB3 LYS A 651 4.309 20.806 0.245 1.00 61.44 H new ATOM 0 HG2 LYS A 651 4.116 23.186 -0.132 1.00 44.22 H new ATOM 0 HG3 LYS A 651 2.764 23.299 0.977 1.00 44.22 H new ATOM 0 HD2 LYS A 651 4.248 22.518 2.836 1.00 41.44 H new ATOM 0 HD3 LYS A 651 5.597 22.468 1.719 1.00 41.44 H new ATOM 0 HE2 LYS A 651 5.367 24.893 1.291 1.00 62.10 H new ATOM 0 HE3 LYS A 651 3.964 24.964 2.338 1.00 62.10 H new ATOM 0 HZ1 LYS A 651 5.939 25.712 3.470 1.00 41.40 H new ATOM 0 HZ2 LYS A 651 5.353 24.296 4.200 1.00 41.40 H new ATOM 0 HZ3 LYS A 651 6.713 24.228 3.186 1.00 41.40 H new ATOM 1030 N SER A 652 3.051 18.955 -1.256 1.00 21.52 N ATOM 1031 CA SER A 652 3.038 17.526 -1.416 1.00 3.22 C ATOM 1032 C SER A 652 4.418 16.942 -1.158 1.00 54.23 C ATOM 1033 O SER A 652 5.442 17.563 -1.490 1.00 13.35 O ATOM 1034 CB SER A 652 2.448 17.116 -2.791 1.00 1.33 C ATOM 1035 OG SER A 652 3.044 17.836 -3.876 1.00 3.55 O ATOM 0 H SER A 652 3.841 19.423 -1.699 1.00 21.52 H new ATOM 0 HA SER A 652 2.373 17.098 -0.666 1.00 3.22 H new ATOM 0 HB2 SER A 652 2.596 16.047 -2.943 1.00 1.33 H new ATOM 0 HB3 SER A 652 1.372 17.292 -2.789 1.00 1.33 H new ATOM 0 HG SER A 652 2.954 17.317 -4.702 1.00 3.55 H new ATOM 1041 N TRP A 653 4.453 15.784 -0.539 1.00 24.02 N ATOM 1042 CA TRP A 653 5.705 15.135 -0.191 1.00 10.13 C ATOM 1043 C TRP A 653 5.635 13.688 -0.530 1.00 62.53 C ATOM 1044 O TRP A 653 4.571 13.064 -0.479 1.00 70.20 O ATOM 1045 CB TRP A 653 6.022 15.236 1.297 1.00 61.01 C ATOM 1046 CG TRP A 653 6.105 16.609 1.901 1.00 24.04 C ATOM 1047 CD1 TRP A 653 7.191 17.436 1.959 1.00 65.23 C ATOM 1048 CD2 TRP A 653 5.055 17.278 2.586 1.00 11.33 C ATOM 1049 NE1 TRP A 653 6.866 18.587 2.643 1.00 31.13 N ATOM 1050 CE2 TRP A 653 5.552 18.512 3.033 1.00 32.42 C ATOM 1051 CE3 TRP A 653 3.739 16.946 2.856 1.00 34.22 C ATOM 1052 CZ2 TRP A 653 4.756 19.414 3.745 1.00 43.45 C ATOM 1053 CZ3 TRP A 653 2.960 17.825 3.549 1.00 35.52 C ATOM 1054 CH2 TRP A 653 3.465 19.049 3.991 1.00 11.25 C ATOM 0 H TRP A 653 3.620 15.264 -0.262 1.00 24.02 H new ATOM 0 HA TRP A 653 6.484 15.646 -0.756 1.00 10.13 H new ATOM 0 HB2 TRP A 653 5.261 14.676 1.841 1.00 61.01 H new ATOM 0 HB3 TRP A 653 6.974 14.734 1.472 1.00 61.01 H new ATOM 0 HD1 TRP A 653 8.159 17.220 1.532 1.00 65.23 H new ATOM 0 HE1 TRP A 653 7.497 19.366 2.829 1.00 31.13 H new ATOM 0 HE3 TRP A 653 3.334 16.002 2.522 1.00 34.22 H new ATOM 0 HZ2 TRP A 653 5.147 20.361 4.086 1.00 43.45 H new ATOM 0 HZ3 TRP A 653 1.932 17.569 3.760 1.00 35.52 H new ATOM 0 HH2 TRP A 653 2.821 19.721 4.539 1.00 11.25 H new ATOM 1065 N ASN A 654 6.764 13.168 -0.822 1.00 52.30 N ATOM 1066 CA ASN A 654 6.940 11.810 -1.196 1.00 74.14 C ATOM 1067 C ASN A 654 7.200 11.004 0.077 1.00 61.42 C ATOM 1068 O ASN A 654 8.018 11.405 0.920 1.00 34.32 O ATOM 1069 CB ASN A 654 8.141 11.799 -2.108 1.00 4.54 C ATOM 1070 CG ASN A 654 8.403 10.549 -2.856 1.00 42.21 C ATOM 1071 OD1 ASN A 654 8.125 9.439 -2.413 1.00 13.13 O ATOM 1072 ND2 ASN A 654 8.929 10.746 -4.030 1.00 73.43 N ATOM 0 H ASN A 654 7.635 13.698 -0.808 1.00 52.30 H new ATOM 0 HA ASN A 654 6.076 11.377 -1.700 1.00 74.14 H new ATOM 0 HB2 ASN A 654 8.027 12.608 -2.829 1.00 4.54 H new ATOM 0 HB3 ASN A 654 9.023 12.028 -1.510 1.00 4.54 H new ATOM 0 HD21 ASN A 654 9.132 9.952 -4.637 1.00 73.43 H new ATOM 0 HD22 ASN A 654 9.138 11.694 -4.343 1.00 73.43 H new ATOM 1078 N LEU A 655 6.497 9.913 0.234 1.00 70.01 N ATOM 1079 CA LEU A 655 6.607 9.079 1.420 1.00 52.31 C ATOM 1080 C LEU A 655 7.540 7.919 1.199 1.00 14.14 C ATOM 1081 O LEU A 655 7.803 7.138 2.114 1.00 52.01 O ATOM 1082 CB LEU A 655 5.234 8.568 1.881 1.00 1.11 C ATOM 1083 CG LEU A 655 4.234 9.603 2.423 1.00 13.12 C ATOM 1084 CD1 LEU A 655 3.769 10.518 1.374 1.00 13.45 C ATOM 1085 CD2 LEU A 655 3.060 8.948 3.117 1.00 64.15 C ATOM 0 H LEU A 655 5.828 9.570 -0.455 1.00 70.01 H new ATOM 0 HA LEU A 655 7.022 9.709 2.207 1.00 52.31 H new ATOM 0 HB2 LEU A 655 4.766 8.057 1.040 1.00 1.11 H new ATOM 0 HB3 LEU A 655 5.397 7.820 2.657 1.00 1.11 H new ATOM 0 HG LEU A 655 4.774 10.191 3.165 1.00 13.12 H new ATOM 0 HD11 LEU A 655 3.065 11.232 1.800 1.00 13.45 H new ATOM 0 HD12 LEU A 655 4.621 11.054 0.955 1.00 13.45 H new ATOM 0 HD13 LEU A 655 3.276 9.948 0.586 1.00 13.45 H new ATOM 0 HD21 LEU A 655 2.379 9.716 3.484 1.00 64.15 H new ATOM 0 HD22 LEU A 655 2.534 8.304 2.412 1.00 64.15 H new ATOM 0 HD23 LEU A 655 3.420 8.351 3.955 1.00 64.15 H new ATOM 1093 N GLY A 656 8.029 7.811 0.004 1.00 23.42 N ATOM 1094 CA GLY A 656 8.949 6.780 -0.319 1.00 12.32 C ATOM 1095 C GLY A 656 8.813 6.375 -1.752 1.00 72.24 C ATOM 1096 O GLY A 656 7.688 6.286 -2.292 1.00 65.53 O ATOM 0 H GLY A 656 7.799 8.435 -0.769 1.00 23.42 H new ATOM 0 HA2 GLY A 656 9.966 7.122 -0.128 1.00 12.32 H new ATOM 0 HA3 GLY A 656 8.776 5.918 0.325 1.00 12.32 H new ATOM 1100 N ARG A 657 9.927 6.148 -2.381 1.00 52.34 N ATOM 1101 CA ARG A 657 9.959 5.802 -3.772 1.00 11.33 C ATOM 1102 C ARG A 657 9.354 4.435 -4.017 1.00 75.31 C ATOM 1103 O ARG A 657 9.389 3.560 -3.133 1.00 34.24 O ATOM 1104 CB ARG A 657 11.356 5.895 -4.333 1.00 50.34 C ATOM 1105 CG ARG A 657 12.343 4.941 -3.733 1.00 61.41 C ATOM 1106 CD ARG A 657 13.669 5.171 -4.358 1.00 71.12 C ATOM 1107 NE ARG A 657 14.709 4.299 -3.822 1.00 0.21 N ATOM 1108 CZ ARG A 657 15.965 4.685 -3.609 1.00 4.52 C ATOM 1109 NH1 ARG A 657 16.325 5.945 -3.856 1.00 30.01 N ATOM 1110 NH2 ARG A 657 16.859 3.814 -3.145 1.00 20.02 N ATOM 0 H ARG A 657 10.846 6.198 -1.941 1.00 52.34 H new ATOM 0 HA ARG A 657 9.346 6.530 -4.303 1.00 11.33 H new ATOM 0 HB2 ARG A 657 11.312 5.721 -5.408 1.00 50.34 H new ATOM 0 HB3 ARG A 657 11.722 6.912 -4.189 1.00 50.34 H new ATOM 0 HG2 ARG A 657 12.403 5.088 -2.655 1.00 61.41 H new ATOM 0 HG3 ARG A 657 12.022 3.912 -3.897 1.00 61.41 H new ATOM 0 HD2 ARG A 657 13.590 5.015 -5.434 1.00 71.12 H new ATOM 0 HD3 ARG A 657 13.960 6.210 -4.208 1.00 71.12 H new ATOM 0 HE ARG A 657 14.459 3.336 -3.597 1.00 0.21 H new ATOM 0 HH11 ARG A 657 15.638 6.612 -4.208 1.00 30.01 H new ATOM 0 HH12 ARG A 657 17.287 6.242 -3.693 1.00 30.01 H new ATOM 0 HH21 ARG A 657 16.581 2.852 -2.953 1.00 20.02 H new ATOM 0 HH22 ARG A 657 17.822 4.109 -2.982 1.00 20.02 H new ATOM 1122 N SER A 658 8.780 4.283 -5.201 1.00 4.41 N ATOM 1123 CA SER A 658 8.091 3.082 -5.628 1.00 5.31 C ATOM 1124 C SER A 658 8.862 1.824 -5.342 1.00 34.13 C ATOM 1125 O SER A 658 10.082 1.761 -5.530 1.00 54.34 O ATOM 1126 CB SER A 658 7.733 3.191 -7.077 1.00 21.11 C ATOM 1127 OG SER A 658 8.858 3.514 -7.884 1.00 35.34 O ATOM 0 H SER A 658 8.783 5.016 -5.910 1.00 4.41 H new ATOM 0 HA SER A 658 7.177 3.003 -5.039 1.00 5.31 H new ATOM 0 HB2 SER A 658 7.304 2.248 -7.416 1.00 21.11 H new ATOM 0 HB3 SER A 658 6.966 3.955 -7.204 1.00 21.11 H new ATOM 0 HG SER A 658 9.055 4.471 -7.803 1.00 35.34 H new ATOM 1133 N ASN A 659 8.150 0.842 -4.885 1.00 44.21 N ATOM 1134 CA ASN A 659 8.703 -0.343 -4.391 1.00 22.23 C ATOM 1135 C ASN A 659 7.595 -1.387 -4.315 1.00 1.41 C ATOM 1136 O ASN A 659 6.415 -1.035 -4.335 1.00 14.12 O ATOM 1137 CB ASN A 659 9.171 0.024 -3.016 1.00 4.21 C ATOM 1138 CG ASN A 659 9.685 -1.066 -2.207 1.00 60.24 C ATOM 1139 OD1 ASN A 659 10.274 -2.026 -2.683 1.00 62.15 O ATOM 1140 ND2 ASN A 659 9.438 -0.952 -0.976 1.00 52.32 N ATOM 0 H ASN A 659 7.131 0.862 -4.852 1.00 44.21 H new ATOM 0 HA ASN A 659 9.509 -0.749 -5.002 1.00 22.23 H new ATOM 0 HB2 ASN A 659 9.950 0.780 -3.109 1.00 4.21 H new ATOM 0 HB3 ASN A 659 8.341 0.486 -2.482 1.00 4.21 H new ATOM 0 HD21 ASN A 659 9.733 -1.681 -0.327 1.00 52.32 H new ATOM 0 HD22 ASN A 659 8.943 -0.130 -0.629 1.00 52.32 H new ATOM 1146 N ALA A 660 7.962 -2.645 -4.268 1.00 34.11 N ATOM 1147 CA ALA A 660 7.000 -3.729 -4.157 1.00 15.10 C ATOM 1148 C ALA A 660 7.403 -4.674 -3.020 1.00 31.23 C ATOM 1149 O ALA A 660 6.976 -5.838 -2.978 1.00 20.54 O ATOM 1150 CB ALA A 660 6.916 -4.478 -5.479 1.00 43.52 C ATOM 0 H ALA A 660 8.934 -2.952 -4.305 1.00 34.11 H new ATOM 0 HA ALA A 660 6.017 -3.318 -3.927 1.00 15.10 H new ATOM 0 HB1 ALA A 660 6.194 -5.290 -5.392 1.00 43.52 H new ATOM 0 HB2 ALA A 660 6.599 -3.793 -6.266 1.00 43.52 H new ATOM 0 HB3 ALA A 660 7.895 -4.888 -5.728 1.00 43.52 H new ATOM 1156 N LYS A 661 8.220 -4.164 -2.101 1.00 21.21 N ATOM 1157 CA LYS A 661 8.707 -4.904 -0.995 1.00 51.32 C ATOM 1158 C LYS A 661 7.652 -5.071 0.092 1.00 52.11 C ATOM 1159 O LYS A 661 7.251 -4.095 0.748 1.00 41.32 O ATOM 1160 CB LYS A 661 9.872 -4.152 -0.454 1.00 21.40 C ATOM 1161 CG LYS A 661 10.559 -4.779 0.699 1.00 54.41 C ATOM 1162 CD LYS A 661 11.631 -3.874 1.227 1.00 32.21 C ATOM 1163 CE LYS A 661 12.926 -3.798 0.375 1.00 74.14 C ATOM 1164 NZ LYS A 661 12.771 -3.083 -0.923 1.00 65.34 N ATOM 0 H LYS A 661 8.555 -3.201 -2.127 1.00 21.21 H new ATOM 0 HA LYS A 661 8.984 -5.907 -1.319 1.00 51.32 H new ATOM 0 HB2 LYS A 661 10.598 -4.015 -1.256 1.00 21.40 H new ATOM 0 HB3 LYS A 661 9.535 -3.159 -0.157 1.00 21.40 H new ATOM 0 HG2 LYS A 661 9.837 -4.995 1.486 1.00 54.41 H new ATOM 0 HG3 LYS A 661 10.995 -5.731 0.396 1.00 54.41 H new ATOM 0 HD2 LYS A 661 11.219 -2.869 1.320 1.00 32.21 H new ATOM 0 HD3 LYS A 661 11.897 -4.204 2.231 1.00 32.21 H new ATOM 0 HE2 LYS A 661 13.701 -3.301 0.959 1.00 74.14 H new ATOM 0 HE3 LYS A 661 13.276 -4.811 0.178 1.00 74.14 H new ATOM 0 HZ1 LYS A 661 13.619 -2.511 -1.107 1.00 65.34 H new ATOM 0 HZ2 LYS A 661 12.648 -3.776 -1.689 1.00 65.34 H new ATOM 0 HZ3 LYS A 661 11.937 -2.463 -0.880 1.00 65.34 H new ATOM 1178 N LEU A 662 7.202 -6.291 0.266 1.00 34.23 N ATOM 1179 CA LEU A 662 6.291 -6.629 1.325 1.00 13.42 C ATOM 1180 C LEU A 662 7.088 -7.136 2.503 1.00 0.35 C ATOM 1181 O LEU A 662 8.147 -7.718 2.338 1.00 12.23 O ATOM 1182 CB LEU A 662 5.281 -7.710 0.898 1.00 31.43 C ATOM 1183 CG LEU A 662 4.257 -7.354 -0.168 1.00 42.13 C ATOM 1184 CD1 LEU A 662 3.320 -8.525 -0.389 1.00 52.11 C ATOM 1185 CD2 LEU A 662 3.473 -6.117 0.217 1.00 10.13 C ATOM 0 H LEU A 662 7.461 -7.079 -0.328 1.00 34.23 H new ATOM 0 HA LEU A 662 5.727 -5.734 1.586 1.00 13.42 H new ATOM 0 HB2 LEU A 662 5.846 -8.572 0.543 1.00 31.43 H new ATOM 0 HB3 LEU A 662 4.738 -8.029 1.788 1.00 31.43 H new ATOM 0 HG LEU A 662 4.787 -7.137 -1.096 1.00 42.13 H new ATOM 0 HD11 LEU A 662 2.588 -8.266 -1.154 1.00 52.11 H new ATOM 0 HD12 LEU A 662 3.893 -9.393 -0.715 1.00 52.11 H new ATOM 0 HD13 LEU A 662 2.805 -8.759 0.542 1.00 52.11 H new ATOM 0 HD21 LEU A 662 2.749 -5.887 -0.565 1.00 10.13 H new ATOM 0 HD22 LEU A 662 2.949 -6.296 1.156 1.00 10.13 H new ATOM 0 HD23 LEU A 662 4.156 -5.276 0.337 1.00 10.13 H new ATOM 1193 N SER A 663 6.609 -6.900 3.660 1.00 43.32 N ATOM 1194 CA SER A 663 7.243 -7.351 4.852 1.00 1.44 C ATOM 1195 C SER A 663 6.235 -8.125 5.679 1.00 2.23 C ATOM 1196 O SER A 663 5.044 -7.940 5.526 1.00 4.41 O ATOM 1197 CB SER A 663 7.781 -6.150 5.619 1.00 71.35 C ATOM 1198 OG SER A 663 8.662 -5.400 4.797 1.00 5.24 O ATOM 0 H SER A 663 5.747 -6.378 3.819 1.00 43.32 H new ATOM 0 HA SER A 663 8.080 -8.009 4.618 1.00 1.44 H new ATOM 0 HB2 SER A 663 6.955 -5.520 5.949 1.00 71.35 H new ATOM 0 HB3 SER A 663 8.304 -6.485 6.515 1.00 71.35 H new ATOM 0 HG SER A 663 9.001 -4.629 5.299 1.00 5.24 H new ATOM 1204 N TYR A 664 6.699 -9.005 6.500 1.00 74.53 N ATOM 1205 CA TYR A 664 5.824 -9.785 7.333 1.00 51.31 C ATOM 1206 C TYR A 664 6.361 -9.733 8.732 1.00 15.40 C ATOM 1207 O TYR A 664 7.497 -10.131 8.970 1.00 11.14 O ATOM 1208 CB TYR A 664 5.780 -11.216 6.800 1.00 54.53 C ATOM 1209 CG TYR A 664 4.766 -12.135 7.430 1.00 61.12 C ATOM 1210 CD1 TYR A 664 3.413 -11.899 7.284 1.00 41.51 C ATOM 1211 CD2 TYR A 664 5.156 -13.266 8.109 1.00 0.22 C ATOM 1212 CE1 TYR A 664 2.485 -12.743 7.785 1.00 74.04 C ATOM 1213 CE2 TYR A 664 4.232 -14.131 8.634 1.00 43.33 C ATOM 1214 CZ TYR A 664 2.894 -13.874 8.473 1.00 32.32 C ATOM 1215 OH TYR A 664 1.968 -14.748 9.007 1.00 31.21 O ATOM 0 H TYR A 664 7.691 -9.210 6.619 1.00 74.53 H new ATOM 0 HA TYR A 664 4.806 -9.395 7.328 1.00 51.31 H new ATOM 0 HB2 TYR A 664 5.585 -11.175 5.728 1.00 54.53 H new ATOM 0 HB3 TYR A 664 6.768 -11.659 6.928 1.00 54.53 H new ATOM 0 HD1 TYR A 664 3.088 -11.015 6.755 1.00 41.51 H new ATOM 0 HD2 TYR A 664 6.208 -13.476 8.230 1.00 0.22 H new ATOM 0 HE1 TYR A 664 1.433 -12.538 7.650 1.00 74.04 H new ATOM 0 HE2 TYR A 664 4.555 -15.010 9.172 1.00 43.33 H new ATOM 0 HH TYR A 664 2.434 -15.485 9.454 1.00 31.21 H new ATOM 1225 N TYR A 665 5.570 -9.239 9.648 1.00 2.01 N ATOM 1226 CA TYR A 665 6.031 -9.023 11.008 1.00 74.30 C ATOM 1227 C TYR A 665 5.925 -10.308 11.817 1.00 25.13 C ATOM 1228 O TYR A 665 6.922 -10.920 12.175 1.00 21.23 O ATOM 1229 CB TYR A 665 5.203 -7.900 11.639 1.00 10.05 C ATOM 1230 CG TYR A 665 5.676 -7.434 12.987 1.00 34.11 C ATOM 1231 CD1 TYR A 665 6.695 -6.502 13.091 1.00 62.31 C ATOM 1232 CD2 TYR A 665 5.104 -7.910 14.150 1.00 73.13 C ATOM 1233 CE1 TYR A 665 7.130 -6.060 14.321 1.00 32.31 C ATOM 1234 CE2 TYR A 665 5.529 -7.476 15.377 1.00 51.44 C ATOM 1235 CZ TYR A 665 6.544 -6.551 15.462 1.00 1.03 C ATOM 1236 OH TYR A 665 6.966 -6.111 16.698 1.00 44.23 O ATOM 0 H TYR A 665 4.599 -8.976 9.483 1.00 2.01 H new ATOM 0 HA TYR A 665 7.081 -8.729 11.000 1.00 74.30 H new ATOM 0 HB2 TYR A 665 5.199 -7.048 10.959 1.00 10.05 H new ATOM 0 HB3 TYR A 665 4.171 -8.239 11.731 1.00 10.05 H new ATOM 0 HD1 TYR A 665 7.156 -6.116 12.194 1.00 62.31 H new ATOM 0 HD2 TYR A 665 4.308 -8.637 14.091 1.00 73.13 H new ATOM 0 HE1 TYR A 665 7.926 -5.333 14.388 1.00 32.31 H new ATOM 0 HE2 TYR A 665 5.069 -7.859 16.276 1.00 51.44 H new ATOM 0 HH TYR A 665 7.690 -6.687 17.021 1.00 44.23 H new ATOM 1246 N ASP A 666 4.727 -10.703 12.074 1.00 53.54 N ATOM 1247 CA ASP A 666 4.430 -11.942 12.786 1.00 62.54 C ATOM 1248 C ASP A 666 3.327 -12.639 12.039 1.00 1.02 C ATOM 1249 O ASP A 666 3.415 -13.817 11.709 1.00 22.03 O ATOM 1250 CB ASP A 666 4.021 -11.649 14.250 1.00 61.32 C ATOM 1251 CG ASP A 666 3.601 -12.884 15.029 1.00 54.03 C ATOM 1252 OD1 ASP A 666 2.412 -13.262 14.954 1.00 32.20 O ATOM 1253 OD2 ASP A 666 4.439 -13.469 15.749 1.00 74.22 O ATOM 0 H ASP A 666 3.896 -10.179 11.799 1.00 53.54 H new ATOM 0 HA ASP A 666 5.312 -12.580 12.829 1.00 62.54 H new ATOM 0 HB2 ASP A 666 4.858 -11.175 14.763 1.00 61.32 H new ATOM 0 HB3 ASP A 666 3.199 -10.933 14.251 1.00 61.32 H new ATOM 1258 N GLY A 667 2.301 -11.884 11.748 1.00 41.02 N ATOM 1259 CA GLY A 667 1.211 -12.375 10.949 1.00 23.21 C ATOM 1260 C GLY A 667 0.600 -11.293 10.120 1.00 22.05 C ATOM 1261 O GLY A 667 -0.118 -11.561 9.163 1.00 54.31 O ATOM 0 H GLY A 667 2.198 -10.917 12.056 1.00 41.02 H new ATOM 0 HA2 GLY A 667 1.568 -13.174 10.299 1.00 23.21 H new ATOM 0 HA3 GLY A 667 0.451 -12.809 11.599 1.00 23.21 H new ATOM 1265 N MET A 668 0.869 -10.066 10.480 1.00 23.40 N ATOM 1266 CA MET A 668 0.420 -8.958 9.702 1.00 25.41 C ATOM 1267 C MET A 668 1.446 -8.681 8.630 1.00 74.55 C ATOM 1268 O MET A 668 2.656 -8.562 8.929 1.00 21.24 O ATOM 1269 CB MET A 668 0.234 -7.702 10.567 1.00 33.41 C ATOM 1270 CG MET A 668 -0.780 -7.851 11.692 1.00 24.22 C ATOM 1271 SD MET A 668 -0.984 -6.340 12.672 1.00 74.34 S ATOM 1272 CE MET A 668 0.681 -6.065 13.284 1.00 51.04 C ATOM 0 H MET A 668 1.401 -9.815 11.313 1.00 23.40 H new ATOM 0 HA MET A 668 -0.546 -9.206 9.262 1.00 25.41 H new ATOM 0 HB2 MET A 668 1.197 -7.428 10.998 1.00 33.41 H new ATOM 0 HB3 MET A 668 -0.074 -6.877 9.925 1.00 33.41 H new ATOM 0 HG2 MET A 668 -1.744 -8.135 11.269 1.00 24.22 H new ATOM 0 HG3 MET A 668 -0.468 -8.663 12.349 1.00 24.22 H new ATOM 0 HE1 MET A 668 0.648 -5.384 14.134 1.00 51.04 H new ATOM 0 HE2 MET A 668 1.115 -7.015 13.597 1.00 51.04 H new ATOM 0 HE3 MET A 668 1.292 -5.630 12.493 1.00 51.04 H new ATOM 1282 N ILE A 669 0.997 -8.642 7.406 1.00 60.55 N ATOM 1283 CA ILE A 669 1.844 -8.268 6.308 1.00 15.35 C ATOM 1284 C ILE A 669 1.938 -6.743 6.302 1.00 14.22 C ATOM 1285 O ILE A 669 0.955 -6.052 6.573 1.00 72.55 O ATOM 1286 CB ILE A 669 1.326 -8.771 4.911 1.00 30.31 C ATOM 1287 CG1 ILE A 669 1.419 -10.285 4.718 1.00 72.43 C ATOM 1288 CG2 ILE A 669 2.030 -8.085 3.752 1.00 54.54 C ATOM 1289 CD1 ILE A 669 0.443 -11.117 5.513 1.00 53.23 C ATOM 0 H ILE A 669 0.038 -8.868 7.142 1.00 60.55 H new ATOM 0 HA ILE A 669 2.815 -8.741 6.453 1.00 15.35 H new ATOM 0 HB ILE A 669 0.270 -8.500 4.912 1.00 30.31 H new ATOM 0 HG12 ILE A 669 1.276 -10.505 3.660 1.00 72.43 H new ATOM 0 HG13 ILE A 669 2.430 -10.602 4.976 1.00 72.43 H new ATOM 0 HG21 ILE A 669 1.637 -8.467 2.810 1.00 54.54 H new ATOM 0 HG22 ILE A 669 1.859 -7.010 3.807 1.00 54.54 H new ATOM 0 HG23 ILE A 669 3.100 -8.285 3.806 1.00 54.54 H new ATOM 0 HD11 ILE A 669 0.603 -12.173 5.295 1.00 53.23 H new ATOM 0 HD12 ILE A 669 0.596 -10.939 6.577 1.00 53.23 H new ATOM 0 HD13 ILE A 669 -0.576 -10.841 5.242 1.00 53.23 H new ATOM 1296 N GLN A 670 3.097 -6.236 6.044 1.00 53.34 N ATOM 1297 CA GLN A 670 3.327 -4.832 6.043 1.00 30.44 C ATOM 1298 C GLN A 670 3.932 -4.419 4.707 1.00 51.50 C ATOM 1299 O GLN A 670 4.642 -5.186 4.089 1.00 71.33 O ATOM 1300 CB GLN A 670 4.278 -4.475 7.183 1.00 15.02 C ATOM 1301 CG GLN A 670 3.798 -4.984 8.531 1.00 74.24 C ATOM 1302 CD GLN A 670 4.710 -4.604 9.657 1.00 11.23 C ATOM 1303 OE1 GLN A 670 5.656 -5.311 9.967 1.00 4.55 O ATOM 1304 NE2 GLN A 670 4.408 -3.524 10.307 1.00 22.42 N ATOM 0 H GLN A 670 3.922 -6.794 5.825 1.00 53.34 H new ATOM 0 HA GLN A 670 2.385 -4.303 6.185 1.00 30.44 H new ATOM 0 HB2 GLN A 670 5.263 -4.891 6.972 1.00 15.02 H new ATOM 0 HB3 GLN A 670 4.393 -3.392 7.229 1.00 15.02 H new ATOM 0 HG2 GLN A 670 2.801 -4.589 8.729 1.00 74.24 H new ATOM 0 HG3 GLN A 670 3.709 -6.070 8.493 1.00 74.24 H new ATOM 0 HE21 GLN A 670 3.609 -2.960 10.016 1.00 22.42 H new ATOM 0 HE22 GLN A 670 4.969 -3.238 11.109 1.00 22.42 H new ATOM 1312 N LEU A 671 3.624 -3.246 4.268 1.00 5.54 N ATOM 1313 CA LEU A 671 4.191 -2.687 3.043 1.00 70.32 C ATOM 1314 C LEU A 671 5.079 -1.570 3.487 1.00 23.44 C ATOM 1315 O LEU A 671 4.715 -0.847 4.400 1.00 11.24 O ATOM 1316 CB LEU A 671 3.074 -2.144 2.140 1.00 31.11 C ATOM 1317 CG LEU A 671 3.472 -1.515 0.789 1.00 2.32 C ATOM 1318 CD1 LEU A 671 4.155 -2.518 -0.126 1.00 10.22 C ATOM 1319 CD2 LEU A 671 2.246 -0.952 0.107 1.00 0.12 C ATOM 0 H LEU A 671 2.966 -2.625 4.740 1.00 5.54 H new ATOM 0 HA LEU A 671 4.736 -3.438 2.471 1.00 70.32 H new ATOM 0 HB2 LEU A 671 2.383 -2.962 1.936 1.00 31.11 H new ATOM 0 HB3 LEU A 671 2.522 -1.394 2.707 1.00 31.11 H new ATOM 0 HG LEU A 671 4.184 -0.716 0.993 1.00 2.32 H new ATOM 0 HD11 LEU A 671 4.418 -2.033 -1.066 1.00 10.22 H new ATOM 0 HD12 LEU A 671 5.059 -2.892 0.355 1.00 10.22 H new ATOM 0 HD13 LEU A 671 3.479 -3.349 -0.324 1.00 10.22 H new ATOM 0 HD21 LEU A 671 2.532 -0.509 -0.847 1.00 0.12 H new ATOM 0 HD22 LEU A 671 1.526 -1.752 -0.066 1.00 0.12 H new ATOM 0 HD23 LEU A 671 1.795 -0.189 0.741 1.00 0.12 H new ATOM 1327 N THR A 672 6.219 -1.423 2.908 1.00 40.11 N ATOM 1328 CA THR A 672 7.126 -0.417 3.390 1.00 15.31 C ATOM 1329 C THR A 672 7.787 0.357 2.259 1.00 55.34 C ATOM 1330 O THR A 672 8.516 -0.202 1.460 1.00 35.34 O ATOM 1331 CB THR A 672 8.206 -1.059 4.299 1.00 24.33 C ATOM 1332 OG1 THR A 672 7.555 -1.782 5.353 1.00 41.31 O ATOM 1333 CG2 THR A 672 9.105 0.007 4.917 1.00 5.51 C ATOM 0 H THR A 672 6.550 -1.971 2.114 1.00 40.11 H new ATOM 0 HA THR A 672 6.538 0.295 3.969 1.00 15.31 H new ATOM 0 HB THR A 672 8.820 -1.725 3.693 1.00 24.33 H new ATOM 0 HG1 THR A 672 8.230 -2.193 5.933 1.00 41.31 H new ATOM 0 HG21 THR A 672 9.853 -0.470 5.550 1.00 5.51 H new ATOM 0 HG22 THR A 672 9.603 0.567 4.125 1.00 5.51 H new ATOM 0 HG23 THR A 672 8.502 0.687 5.518 1.00 5.51 H new ATOM 1339 N TYR A 673 7.508 1.629 2.202 1.00 3.13 N ATOM 1340 CA TYR A 673 8.145 2.512 1.255 1.00 51.42 C ATOM 1341 C TYR A 673 9.222 3.285 1.935 1.00 2.00 C ATOM 1342 O TYR A 673 9.029 3.768 3.055 1.00 24.21 O ATOM 1343 CB TYR A 673 7.154 3.454 0.583 1.00 73.23 C ATOM 1344 CG TYR A 673 6.271 2.758 -0.395 1.00 33.22 C ATOM 1345 CD1 TYR A 673 6.790 2.334 -1.596 1.00 21.53 C ATOM 1346 CD2 TYR A 673 4.938 2.521 -0.133 1.00 22.05 C ATOM 1347 CE1 TYR A 673 6.023 1.691 -2.518 1.00 44.52 C ATOM 1348 CE2 TYR A 673 4.147 1.873 -1.056 1.00 20.52 C ATOM 1349 CZ TYR A 673 4.711 1.452 -2.262 1.00 12.33 C ATOM 1350 OH TYR A 673 3.950 0.807 -3.209 1.00 42.25 O ATOM 0 H TYR A 673 6.831 2.088 2.811 1.00 3.13 H new ATOM 0 HA TYR A 673 8.578 1.896 0.467 1.00 51.42 H new ATOM 0 HB2 TYR A 673 6.539 3.932 1.346 1.00 73.23 H new ATOM 0 HB3 TYR A 673 7.701 4.246 0.072 1.00 73.23 H new ATOM 0 HD1 TYR A 673 7.832 2.516 -1.813 1.00 21.53 H new ATOM 0 HD2 TYR A 673 4.511 2.846 0.804 1.00 22.05 H new ATOM 0 HE1 TYR A 673 6.458 1.371 -3.453 1.00 44.52 H new ATOM 0 HE2 TYR A 673 3.102 1.693 -0.849 1.00 20.52 H new ATOM 0 HH TYR A 673 3.075 0.583 -2.828 1.00 42.25 H new ATOM 1360 N ARG A 674 10.358 3.381 1.291 1.00 44.31 N ATOM 1361 CA ARG A 674 11.493 4.054 1.856 1.00 44.43 C ATOM 1362 C ARG A 674 12.058 5.055 0.866 1.00 23.12 C ATOM 1363 O ARG A 674 11.806 4.958 -0.349 1.00 40.14 O ATOM 1364 CB ARG A 674 12.577 3.039 2.251 1.00 75.34 C ATOM 1365 CG ARG A 674 12.145 2.020 3.296 1.00 22.51 C ATOM 1366 CD ARG A 674 13.270 1.052 3.599 1.00 61.23 C ATOM 1367 NE ARG A 674 12.892 0.026 4.583 1.00 74.10 N ATOM 1368 CZ ARG A 674 13.715 -0.957 4.990 1.00 72.11 C ATOM 1369 NH1 ARG A 674 14.951 -1.025 4.504 1.00 73.43 N ATOM 1370 NH2 ARG A 674 13.300 -1.866 5.870 1.00 15.03 N ATOM 0 H ARG A 674 10.519 2.994 0.361 1.00 44.31 H new ATOM 0 HA ARG A 674 11.168 4.586 2.750 1.00 44.43 H new ATOM 0 HB2 ARG A 674 12.900 2.507 1.356 1.00 75.34 H new ATOM 0 HB3 ARG A 674 13.443 3.582 2.629 1.00 75.34 H new ATOM 0 HG2 ARG A 674 11.845 2.534 4.209 1.00 22.51 H new ATOM 0 HG3 ARG A 674 11.274 1.472 2.938 1.00 22.51 H new ATOM 0 HD2 ARG A 674 13.582 0.565 2.675 1.00 61.23 H new ATOM 0 HD3 ARG A 674 14.130 1.608 3.973 1.00 61.23 H new ATOM 0 HE ARG A 674 11.953 0.062 4.979 1.00 74.10 H new ATOM 0 HH11 ARG A 674 15.271 -0.334 3.826 1.00 73.43 H new ATOM 0 HH12 ARG A 674 15.579 -1.768 4.809 1.00 73.43 H new ATOM 0 HH21 ARG A 674 12.351 -1.820 6.241 1.00 15.03 H new ATOM 0 HH22 ARG A 674 13.931 -2.608 6.173 1.00 15.03 H new ATOM 1382 N ASP A 675 12.812 5.990 1.395 1.00 62.12 N ATOM 1383 CA ASP A 675 13.481 7.068 0.666 1.00 5.01 C ATOM 1384 C ASP A 675 12.462 7.992 0.019 1.00 42.14 C ATOM 1385 O ASP A 675 12.238 7.968 -1.199 1.00 24.14 O ATOM 1386 CB ASP A 675 14.513 6.564 -0.372 1.00 12.41 C ATOM 1387 CG ASP A 675 15.496 7.643 -0.824 1.00 44.23 C ATOM 1388 OD1 ASP A 675 15.144 8.497 -1.665 1.00 23.31 O ATOM 1389 OD2 ASP A 675 16.660 7.630 -0.345 1.00 5.53 O ATOM 0 H ASP A 675 12.991 6.031 2.398 1.00 62.12 H new ATOM 0 HA ASP A 675 14.051 7.630 1.406 1.00 5.01 H new ATOM 0 HB2 ASP A 675 15.071 5.731 0.056 1.00 12.41 H new ATOM 0 HB3 ASP A 675 13.983 6.178 -1.243 1.00 12.41 H new ATOM 1394 N GLY A 676 11.752 8.690 0.859 1.00 75.14 N ATOM 1395 CA GLY A 676 10.844 9.702 0.417 1.00 64.23 C ATOM 1396 C GLY A 676 11.486 11.062 0.506 1.00 23.34 C ATOM 1397 O GLY A 676 12.716 11.170 0.518 1.00 72.12 O ATOM 0 H GLY A 676 11.789 8.571 1.871 1.00 75.14 H new ATOM 0 HA2 GLY A 676 10.541 9.503 -0.611 1.00 64.23 H new ATOM 0 HA3 GLY A 676 9.940 9.679 1.026 1.00 64.23 H new ATOM 1401 N THR A 677 10.688 12.084 0.594 1.00 33.32 N ATOM 1402 CA THR A 677 11.196 13.427 0.705 1.00 11.25 C ATOM 1403 C THR A 677 11.697 13.653 2.134 1.00 3.01 C ATOM 1404 O THR A 677 11.035 13.226 3.089 1.00 53.31 O ATOM 1405 CB THR A 677 10.071 14.444 0.400 1.00 41.13 C ATOM 1406 OG1 THR A 677 9.501 14.159 -0.876 1.00 53.11 O ATOM 1407 CG2 THR A 677 10.596 15.872 0.400 1.00 54.44 C ATOM 0 H THR A 677 9.670 12.016 0.591 1.00 33.32 H new ATOM 0 HA THR A 677 12.009 13.565 -0.007 1.00 11.25 H new ATOM 0 HB THR A 677 9.317 14.353 1.182 1.00 41.13 H new ATOM 0 HG1 THR A 677 9.033 14.953 -1.210 1.00 53.11 H new ATOM 0 HG21 THR A 677 9.779 16.560 0.182 1.00 54.44 H new ATOM 0 HG22 THR A 677 11.016 16.105 1.378 1.00 54.44 H new ATOM 0 HG23 THR A 677 11.370 15.975 -0.361 1.00 54.44 H new ATOM 1413 N PRO A 678 12.894 14.236 2.313 1.00 63.54 N ATOM 1414 CA PRO A 678 13.379 14.605 3.631 1.00 14.53 C ATOM 1415 C PRO A 678 12.578 15.755 4.198 1.00 73.30 C ATOM 1416 O PRO A 678 12.403 16.796 3.546 1.00 11.44 O ATOM 1417 CB PRO A 678 14.829 15.038 3.396 1.00 53.15 C ATOM 1418 CG PRO A 678 15.167 14.507 2.057 1.00 4.53 C ATOM 1419 CD PRO A 678 13.888 14.531 1.274 1.00 11.44 C ATOM 0 HA PRO A 678 13.293 13.785 4.344 1.00 14.53 H new ATOM 0 HB2 PRO A 678 14.929 16.123 3.428 1.00 53.15 H new ATOM 0 HB3 PRO A 678 15.492 14.634 4.161 1.00 53.15 H new ATOM 0 HG2 PRO A 678 15.932 15.117 1.576 1.00 4.53 H new ATOM 0 HG3 PRO A 678 15.564 13.494 2.127 1.00 4.53 H new ATOM 0 HD2 PRO A 678 13.714 15.499 0.805 1.00 11.44 H new ATOM 0 HD3 PRO A 678 13.882 13.786 0.479 1.00 11.44 H new ATOM 1427 N TYR A 679 12.101 15.572 5.393 1.00 53.30 N ATOM 1428 CA TYR A 679 11.303 16.585 6.058 1.00 12.40 C ATOM 1429 C TYR A 679 12.174 17.421 6.957 1.00 2.32 C ATOM 1430 O TYR A 679 13.397 17.217 7.006 1.00 62.33 O ATOM 1431 CB TYR A 679 10.148 15.964 6.863 1.00 52.44 C ATOM 1432 CG TYR A 679 9.136 15.186 6.049 1.00 62.43 C ATOM 1433 CD1 TYR A 679 9.134 15.233 4.667 1.00 44.11 C ATOM 1434 CD2 TYR A 679 8.168 14.418 6.674 1.00 0.14 C ATOM 1435 CE1 TYR A 679 8.214 14.541 3.932 1.00 10.52 C ATOM 1436 CE2 TYR A 679 7.235 13.719 5.940 1.00 23.33 C ATOM 1437 CZ TYR A 679 7.265 13.788 4.562 1.00 22.43 C ATOM 1438 OH TYR A 679 6.346 13.082 3.808 1.00 74.41 O ATOM 0 H TYR A 679 12.247 14.724 5.941 1.00 53.30 H new ATOM 0 HA TYR A 679 10.864 17.220 5.289 1.00 12.40 H new ATOM 0 HB2 TYR A 679 10.569 15.301 7.618 1.00 52.44 H new ATOM 0 HB3 TYR A 679 9.627 16.761 7.394 1.00 52.44 H new ATOM 0 HD1 TYR A 679 9.876 15.830 4.158 1.00 44.11 H new ATOM 0 HD2 TYR A 679 8.144 14.366 7.752 1.00 0.14 H new ATOM 0 HE1 TYR A 679 8.237 14.589 2.853 1.00 10.52 H new ATOM 0 HE2 TYR A 679 6.486 13.122 6.439 1.00 23.33 H new ATOM 0 HH TYR A 679 6.815 12.563 3.122 1.00 74.41 H new ATOM 1448 N ASN A 680 11.563 18.355 7.665 1.00 54.23 N ATOM 1449 CA ASN A 680 12.286 19.238 8.561 1.00 23.14 C ATOM 1450 C ASN A 680 12.799 18.473 9.775 1.00 71.34 C ATOM 1451 O ASN A 680 12.069 18.224 10.730 1.00 20.50 O ATOM 1452 CB ASN A 680 11.414 20.434 8.992 1.00 62.31 C ATOM 1453 CG ASN A 680 12.124 21.417 9.929 1.00 34.32 C ATOM 1454 OD1 ASN A 680 11.485 22.041 10.783 1.00 12.22 O ATOM 1455 ND2 ASN A 680 13.421 21.582 9.768 1.00 63.05 N ATOM 0 H ASN A 680 10.557 18.522 7.635 1.00 54.23 H new ATOM 0 HA ASN A 680 13.145 19.633 8.019 1.00 23.14 H new ATOM 0 HB2 ASN A 680 11.085 20.970 8.102 1.00 62.31 H new ATOM 0 HB3 ASN A 680 10.519 20.058 9.487 1.00 62.31 H new ATOM 0 HD21 ASN A 680 13.928 22.241 10.358 1.00 63.05 H new ATOM 0 HD22 ASN A 680 13.918 21.050 9.053 1.00 63.05 H new ATOM 1461 N ASN A 681 14.032 18.064 9.693 1.00 35.41 N ATOM 1462 CA ASN A 681 14.701 17.357 10.755 1.00 43.42 C ATOM 1463 C ASN A 681 16.160 17.696 10.667 1.00 22.14 C ATOM 1464 O ASN A 681 16.701 17.797 9.565 1.00 61.21 O ATOM 1465 CB ASN A 681 14.502 15.821 10.643 1.00 1.11 C ATOM 1466 CG ASN A 681 15.158 15.066 11.803 1.00 70.03 C ATOM 1467 OD1 ASN A 681 15.273 15.588 12.901 1.00 1.12 O ATOM 1468 ND2 ASN A 681 15.585 13.852 11.574 1.00 63.35 N ATOM 0 H ASN A 681 14.616 18.214 8.870 1.00 35.41 H new ATOM 0 HA ASN A 681 14.281 17.658 11.715 1.00 43.42 H new ATOM 0 HB2 ASN A 681 13.436 15.595 10.622 1.00 1.11 H new ATOM 0 HB3 ASN A 681 14.921 15.470 9.700 1.00 1.11 H new ATOM 0 HD21 ASN A 681 16.027 13.317 12.322 1.00 63.35 H new ATOM 0 HD22 ASN A 681 15.477 13.440 10.647 1.00 63.35 H new ATOM 1474 N GLU A 682 16.790 17.858 11.799 1.00 34.11 N ATOM 1475 CA GLU A 682 18.185 18.267 11.884 1.00 3.11 C ATOM 1476 C GLU A 682 19.121 17.244 11.208 1.00 32.34 C ATOM 1477 O GLU A 682 20.165 17.598 10.662 1.00 62.15 O ATOM 1478 CB GLU A 682 18.531 18.461 13.350 1.00 31.12 C ATOM 1479 CG GLU A 682 19.902 19.016 13.632 1.00 22.13 C ATOM 1480 CD GLU A 682 20.091 19.234 15.097 1.00 41.42 C ATOM 1481 OE1 GLU A 682 19.583 20.246 15.616 1.00 20.13 O ATOM 1482 OE2 GLU A 682 20.736 18.398 15.752 1.00 64.00 O ATOM 0 H GLU A 682 16.351 17.710 12.708 1.00 34.11 H new ATOM 0 HA GLU A 682 18.327 19.204 11.346 1.00 3.11 H new ATOM 0 HB2 GLU A 682 17.792 19.128 13.793 1.00 31.12 H new ATOM 0 HB3 GLU A 682 18.437 17.500 13.856 1.00 31.12 H new ATOM 0 HG2 GLU A 682 20.662 18.328 13.260 1.00 22.13 H new ATOM 0 HG3 GLU A 682 20.036 19.957 13.099 1.00 22.13 H new ATOM 1489 N LYS A 683 18.721 15.991 11.225 1.00 11.44 N ATOM 1490 CA LYS A 683 19.495 14.917 10.604 1.00 21.21 C ATOM 1491 C LYS A 683 19.149 14.792 9.107 1.00 70.41 C ATOM 1492 O LYS A 683 19.859 14.129 8.349 1.00 53.44 O ATOM 1493 CB LYS A 683 19.181 13.594 11.320 1.00 2.42 C ATOM 1494 CG LYS A 683 19.958 12.381 10.809 1.00 24.23 C ATOM 1495 CD LYS A 683 19.507 11.096 11.483 1.00 53.05 C ATOM 1496 CE LYS A 683 19.704 11.140 12.990 1.00 42.23 C ATOM 1497 NZ LYS A 683 19.205 9.909 13.637 1.00 44.11 N ATOM 0 H LYS A 683 17.855 15.680 11.665 1.00 11.44 H new ATOM 0 HA LYS A 683 20.557 15.147 10.693 1.00 21.21 H new ATOM 0 HB2 LYS A 683 19.387 13.716 12.383 1.00 2.42 H new ATOM 0 HB3 LYS A 683 18.115 13.390 11.223 1.00 2.42 H new ATOM 0 HG2 LYS A 683 19.825 12.292 9.731 1.00 24.23 H new ATOM 0 HG3 LYS A 683 21.023 12.530 10.987 1.00 24.23 H new ATOM 0 HD2 LYS A 683 18.454 10.921 11.261 1.00 53.05 H new ATOM 0 HD3 LYS A 683 20.064 10.255 11.070 1.00 53.05 H new ATOM 0 HE2 LYS A 683 20.763 11.268 13.216 1.00 42.23 H new ATOM 0 HE3 LYS A 683 19.184 12.005 13.401 1.00 42.23 H new ATOM 0 HZ1 LYS A 683 19.355 9.972 14.664 1.00 44.11 H new ATOM 0 HZ2 LYS A 683 18.189 9.801 13.441 1.00 44.11 H new ATOM 0 HZ3 LYS A 683 19.719 9.087 13.262 1.00 44.11 H new ATOM 1511 N ARG A 684 18.085 15.485 8.697 1.00 74.44 N ATOM 1512 CA ARG A 684 17.503 15.377 7.349 1.00 22.10 C ATOM 1513 C ARG A 684 17.052 13.956 7.078 1.00 53.51 C ATOM 1514 O ARG A 684 17.830 13.101 6.658 1.00 23.24 O ATOM 1515 CB ARG A 684 18.388 15.928 6.197 1.00 41.20 C ATOM 1516 CG ARG A 684 18.676 17.428 6.271 1.00 35.32 C ATOM 1517 CD ARG A 684 19.768 17.771 7.270 1.00 15.54 C ATOM 1518 NE ARG A 684 21.070 17.241 6.835 1.00 21.52 N ATOM 1519 CZ ARG A 684 22.210 17.322 7.524 1.00 53.25 C ATOM 1520 NH1 ARG A 684 22.225 17.858 8.741 1.00 11.43 N ATOM 1521 NH2 ARG A 684 23.336 16.848 6.997 1.00 5.52 N ATOM 0 H ARG A 684 17.593 16.147 9.297 1.00 74.44 H new ATOM 0 HA ARG A 684 16.637 16.039 7.355 1.00 22.10 H new ATOM 0 HB2 ARG A 684 19.336 15.390 6.197 1.00 41.20 H new ATOM 0 HB3 ARG A 684 17.899 15.713 5.247 1.00 41.20 H new ATOM 0 HG2 ARG A 684 18.968 17.786 5.284 1.00 35.32 H new ATOM 0 HG3 ARG A 684 17.762 17.955 6.544 1.00 35.32 H new ATOM 0 HD2 ARG A 684 19.833 18.853 7.385 1.00 15.54 H new ATOM 0 HD3 ARG A 684 19.513 17.361 8.247 1.00 15.54 H new ATOM 0 HE ARG A 684 21.104 16.772 5.930 1.00 21.52 H new ATOM 0 HH11 ARG A 684 21.361 18.211 9.154 1.00 11.43 H new ATOM 0 HH12 ARG A 684 23.100 17.917 9.262 1.00 11.43 H new ATOM 0 HH21 ARG A 684 23.326 16.424 6.069 1.00 5.52 H new ATOM 0 HH22 ARG A 684 24.209 16.908 7.521 1.00 5.52 H new ATOM 1533 N THR A 685 15.809 13.712 7.343 1.00 22.43 N ATOM 1534 CA THR A 685 15.272 12.380 7.250 1.00 74.24 C ATOM 1535 C THR A 685 14.256 12.235 6.124 1.00 41.11 C ATOM 1536 O THR A 685 13.201 12.899 6.129 1.00 13.11 O ATOM 1537 CB THR A 685 14.642 11.970 8.600 1.00 12.30 C ATOM 1538 OG1 THR A 685 15.664 11.978 9.606 1.00 23.42 O ATOM 1539 CG2 THR A 685 13.992 10.590 8.532 1.00 64.44 C ATOM 0 H THR A 685 15.135 14.422 7.629 1.00 22.43 H new ATOM 0 HA THR A 685 16.101 11.712 7.015 1.00 74.24 H new ATOM 0 HB THR A 685 13.857 12.685 8.845 1.00 12.30 H new ATOM 0 HG1 THR A 685 15.318 11.571 10.427 1.00 23.42 H new ATOM 0 HG21 THR A 685 13.562 10.342 9.502 1.00 64.44 H new ATOM 0 HG22 THR A 685 13.206 10.595 7.777 1.00 64.44 H new ATOM 0 HG23 THR A 685 14.744 9.846 8.268 1.00 64.44 H new ATOM 1545 N PRO A 686 14.583 11.398 5.114 1.00 44.33 N ATOM 1546 CA PRO A 686 13.655 11.037 4.052 1.00 21.24 C ATOM 1547 C PRO A 686 12.500 10.254 4.646 1.00 2.41 C ATOM 1548 O PRO A 686 12.687 9.476 5.590 1.00 13.05 O ATOM 1549 CB PRO A 686 14.479 10.130 3.126 1.00 5.24 C ATOM 1550 CG PRO A 686 15.895 10.400 3.482 1.00 15.14 C ATOM 1551 CD PRO A 686 15.892 10.751 4.935 1.00 73.02 C ATOM 0 HA PRO A 686 13.241 11.900 3.531 1.00 21.24 H new ATOM 0 HB2 PRO A 686 14.228 9.080 3.277 1.00 5.24 H new ATOM 0 HB3 PRO A 686 14.286 10.357 2.078 1.00 5.24 H new ATOM 0 HG2 PRO A 686 16.519 9.527 3.292 1.00 15.14 H new ATOM 0 HG3 PRO A 686 16.299 11.216 2.884 1.00 15.14 H new ATOM 0 HD2 PRO A 686 15.995 9.867 5.564 1.00 73.02 H new ATOM 0 HD3 PRO A 686 16.712 11.422 5.190 1.00 73.02 H new ATOM 1559 N ARG A 687 11.330 10.461 4.133 1.00 41.01 N ATOM 1560 CA ARG A 687 10.181 9.836 4.662 1.00 11.03 C ATOM 1561 C ARG A 687 10.132 8.346 4.308 1.00 74.23 C ATOM 1562 O ARG A 687 10.702 7.904 3.318 1.00 13.24 O ATOM 1563 CB ARG A 687 8.951 10.565 4.167 1.00 63.42 C ATOM 1564 CG ARG A 687 7.627 10.143 4.781 1.00 13.41 C ATOM 1565 CD ARG A 687 7.578 10.370 6.306 1.00 33.34 C ATOM 1566 NE ARG A 687 8.293 9.347 7.102 1.00 11.23 N ATOM 1567 CZ ARG A 687 9.300 9.592 7.984 1.00 75.22 C ATOM 1568 NH1 ARG A 687 9.843 10.808 8.072 1.00 75.24 N ATOM 1569 NH2 ARG A 687 9.750 8.614 8.764 1.00 22.30 N ATOM 0 H ARG A 687 11.153 11.071 3.334 1.00 41.01 H new ATOM 0 HA ARG A 687 10.217 9.892 5.750 1.00 11.03 H new ATOM 0 HB2 ARG A 687 9.088 11.631 4.349 1.00 63.42 H new ATOM 0 HB3 ARG A 687 8.885 10.432 3.087 1.00 63.42 H new ATOM 0 HG2 ARG A 687 6.818 10.701 4.309 1.00 13.41 H new ATOM 0 HG3 ARG A 687 7.453 9.088 4.569 1.00 13.41 H new ATOM 0 HD2 ARG A 687 8.004 11.348 6.529 1.00 33.34 H new ATOM 0 HD3 ARG A 687 6.536 10.396 6.623 1.00 33.34 H new ATOM 0 HE ARG A 687 8.007 8.376 6.979 1.00 11.23 H new ATOM 0 HH11 ARG A 687 9.504 11.562 7.475 1.00 75.24 H new ATOM 0 HH12 ARG A 687 10.597 10.983 8.736 1.00 75.24 H new ATOM 0 HH21 ARG A 687 9.341 7.682 8.701 1.00 22.30 H new ATOM 0 HH22 ARG A 687 10.505 8.796 9.426 1.00 22.30 H new ATOM 1581 N ALA A 688 9.468 7.623 5.155 1.00 32.32 N ATOM 1582 CA ALA A 688 9.231 6.217 5.035 1.00 21.21 C ATOM 1583 C ALA A 688 7.795 5.986 5.456 1.00 34.41 C ATOM 1584 O ALA A 688 7.283 6.717 6.328 1.00 71.33 O ATOM 1585 CB ALA A 688 10.179 5.438 5.942 1.00 23.03 C ATOM 0 H ALA A 688 9.053 8.021 5.997 1.00 32.32 H new ATOM 0 HA ALA A 688 9.403 5.876 4.014 1.00 21.21 H new ATOM 0 HB1 ALA A 688 9.986 4.370 5.839 1.00 23.03 H new ATOM 0 HB2 ALA A 688 11.210 5.649 5.658 1.00 23.03 H new ATOM 0 HB3 ALA A 688 10.019 5.737 6.978 1.00 23.03 H new ATOM 1591 N THR A 689 7.147 5.044 4.841 1.00 30.41 N ATOM 1592 CA THR A 689 5.746 4.744 5.102 1.00 54.33 C ATOM 1593 C THR A 689 5.499 3.254 5.136 1.00 25.02 C ATOM 1594 O THR A 689 6.044 2.514 4.320 1.00 54.14 O ATOM 1595 CB THR A 689 4.887 5.420 4.035 1.00 34.22 C ATOM 1596 OG1 THR A 689 5.006 6.811 4.217 1.00 13.51 O ATOM 1597 CG2 THR A 689 3.420 4.997 4.077 1.00 40.02 C ATOM 0 H THR A 689 7.570 4.446 4.131 1.00 30.41 H new ATOM 0 HA THR A 689 5.475 5.132 6.084 1.00 54.33 H new ATOM 0 HB THR A 689 5.247 5.112 3.053 1.00 34.22 H new ATOM 0 HG1 THR A 689 5.319 6.996 5.127 1.00 13.51 H new ATOM 0 HG21 THR A 689 2.869 5.516 3.292 1.00 40.02 H new ATOM 0 HG22 THR A 689 3.347 3.921 3.921 1.00 40.02 H new ATOM 0 HG23 THR A 689 2.995 5.252 5.048 1.00 40.02 H new ATOM 1603 N LEU A 690 4.696 2.813 6.077 1.00 62.32 N ATOM 1604 CA LEU A 690 4.430 1.449 6.224 1.00 33.12 C ATOM 1605 C LEU A 690 2.918 1.187 6.346 1.00 22.54 C ATOM 1606 O LEU A 690 2.232 1.766 7.194 1.00 51.33 O ATOM 1607 CB LEU A 690 5.251 0.907 7.420 1.00 42.11 C ATOM 1608 CG LEU A 690 5.129 -0.577 7.751 1.00 12.01 C ATOM 1609 CD1 LEU A 690 6.298 -1.014 8.608 1.00 51.12 C ATOM 1610 CD2 LEU A 690 3.847 -0.860 8.508 1.00 63.22 C ATOM 0 H LEU A 690 4.220 3.413 6.751 1.00 62.32 H new ATOM 0 HA LEU A 690 4.742 0.905 5.333 1.00 33.12 H new ATOM 0 HB2 LEU A 690 6.302 1.123 7.230 1.00 42.11 H new ATOM 0 HB3 LEU A 690 4.965 1.473 8.307 1.00 42.11 H new ATOM 0 HG LEU A 690 5.122 -1.128 6.811 1.00 12.01 H new ATOM 0 HD11 LEU A 690 6.203 -2.075 8.840 1.00 51.12 H new ATOM 0 HD12 LEU A 690 7.229 -0.843 8.068 1.00 51.12 H new ATOM 0 HD13 LEU A 690 6.305 -0.440 9.534 1.00 51.12 H new ATOM 0 HD21 LEU A 690 3.784 -1.925 8.732 1.00 63.22 H new ATOM 0 HD22 LEU A 690 3.841 -0.293 9.439 1.00 63.22 H new ATOM 0 HD23 LEU A 690 2.992 -0.566 7.899 1.00 63.22 H new ATOM 1618 N ILE A 691 2.419 0.319 5.492 1.00 12.21 N ATOM 1619 CA ILE A 691 1.023 -0.099 5.520 1.00 21.01 C ATOM 1620 C ILE A 691 0.960 -1.402 6.282 1.00 11.34 C ATOM 1621 O ILE A 691 1.788 -2.267 6.072 1.00 13.43 O ATOM 1622 CB ILE A 691 0.402 -0.378 4.088 1.00 54.12 C ATOM 1623 CG1 ILE A 691 0.333 0.849 3.163 1.00 12.21 C ATOM 1624 CG2 ILE A 691 -0.986 -0.972 4.215 1.00 0.51 C ATOM 1625 CD1 ILE A 691 1.659 1.484 2.801 1.00 52.24 C ATOM 0 H ILE A 691 2.968 -0.122 4.754 1.00 12.21 H new ATOM 0 HA ILE A 691 0.456 0.714 5.972 1.00 21.01 H new ATOM 0 HB ILE A 691 1.091 -1.082 3.621 1.00 54.12 H new ATOM 0 HG12 ILE A 691 -0.171 0.556 2.242 1.00 12.21 H new ATOM 0 HG13 ILE A 691 -0.290 1.605 3.641 1.00 12.21 H new ATOM 0 HG21 ILE A 691 -1.395 -1.156 3.222 1.00 0.51 H new ATOM 0 HG22 ILE A 691 -0.931 -1.912 4.765 1.00 0.51 H new ATOM 0 HG23 ILE A 691 -1.632 -0.276 4.750 1.00 0.51 H new ATOM 0 HD11 ILE A 691 1.487 2.338 2.146 1.00 52.24 H new ATOM 0 HD12 ILE A 691 2.162 1.818 3.708 1.00 52.24 H new ATOM 0 HD13 ILE A 691 2.284 0.754 2.287 1.00 52.24 H new ATOM 1632 N THR A 692 0.029 -1.527 7.153 1.00 40.53 N ATOM 1633 CA THR A 692 -0.168 -2.739 7.870 1.00 20.30 C ATOM 1634 C THR A 692 -1.473 -3.366 7.366 1.00 64.35 C ATOM 1635 O THR A 692 -2.552 -2.752 7.482 1.00 33.42 O ATOM 1636 CB THR A 692 -0.249 -2.418 9.367 1.00 74.43 C ATOM 1637 OG1 THR A 692 0.884 -1.600 9.700 1.00 11.21 O ATOM 1638 CG2 THR A 692 -0.189 -3.682 10.201 1.00 53.05 C ATOM 0 H THR A 692 -0.628 -0.784 7.394 1.00 40.53 H new ATOM 0 HA THR A 692 0.653 -3.439 7.716 1.00 20.30 H new ATOM 0 HB THR A 692 -1.191 -1.911 9.575 1.00 74.43 H new ATOM 0 HG1 THR A 692 0.857 -1.377 10.654 1.00 11.21 H new ATOM 0 HG21 THR A 692 -0.248 -3.424 11.258 1.00 53.05 H new ATOM 0 HG22 THR A 692 -1.024 -4.331 9.939 1.00 53.05 H new ATOM 0 HG23 THR A 692 0.749 -4.202 10.007 1.00 53.05 H new ATOM 1644 N PHE A 693 -1.376 -4.548 6.780 1.00 72.45 N ATOM 1645 CA PHE A 693 -2.532 -5.199 6.208 1.00 14.41 C ATOM 1646 C PHE A 693 -3.204 -6.045 7.244 1.00 72.01 C ATOM 1647 O PHE A 693 -2.624 -7.010 7.758 1.00 25.01 O ATOM 1648 CB PHE A 693 -2.161 -6.068 4.985 1.00 62.20 C ATOM 1649 CG PHE A 693 -1.497 -5.304 3.879 1.00 11.30 C ATOM 1650 CD1 PHE A 693 -2.237 -4.552 2.987 1.00 10.34 C ATOM 1651 CD2 PHE A 693 -0.130 -5.321 3.751 1.00 31.04 C ATOM 1652 CE1 PHE A 693 -1.607 -3.828 1.980 1.00 45.10 C ATOM 1653 CE2 PHE A 693 0.504 -4.605 2.760 1.00 53.14 C ATOM 1654 CZ PHE A 693 -0.237 -3.855 1.874 1.00 21.30 C ATOM 0 H PHE A 693 -0.506 -5.073 6.690 1.00 72.45 H new ATOM 0 HA PHE A 693 -3.213 -4.419 5.866 1.00 14.41 H new ATOM 0 HB2 PHE A 693 -1.498 -6.870 5.309 1.00 62.20 H new ATOM 0 HB3 PHE A 693 -3.065 -6.538 4.598 1.00 62.20 H new ATOM 0 HD1 PHE A 693 -3.313 -4.526 3.072 1.00 10.34 H new ATOM 0 HD2 PHE A 693 0.459 -5.907 4.441 1.00 31.04 H new ATOM 0 HE1 PHE A 693 -2.193 -3.246 1.284 1.00 45.10 H new ATOM 0 HE2 PHE A 693 1.581 -4.632 2.678 1.00 53.14 H new ATOM 0 HZ PHE A 693 0.257 -3.289 1.098 1.00 21.30 H new ATOM 1664 N LEU A 694 -4.401 -5.672 7.564 1.00 20.03 N ATOM 1665 CA LEU A 694 -5.195 -6.385 8.499 1.00 1.25 C ATOM 1666 C LEU A 694 -6.225 -7.145 7.741 1.00 22.32 C ATOM 1667 O LEU A 694 -6.647 -6.722 6.670 1.00 14.13 O ATOM 1668 CB LEU A 694 -5.878 -5.428 9.477 1.00 1.43 C ATOM 1669 CG LEU A 694 -4.957 -4.561 10.328 1.00 42.13 C ATOM 1670 CD1 LEU A 694 -5.770 -3.659 11.231 1.00 12.44 C ATOM 1671 CD2 LEU A 694 -4.015 -5.423 11.151 1.00 14.34 C ATOM 0 H LEU A 694 -4.858 -4.848 7.173 1.00 20.03 H new ATOM 0 HA LEU A 694 -4.562 -7.059 9.077 1.00 1.25 H new ATOM 0 HB2 LEU A 694 -6.537 -4.772 8.909 1.00 1.43 H new ATOM 0 HB3 LEU A 694 -6.509 -6.014 10.145 1.00 1.43 H new ATOM 0 HG LEU A 694 -4.358 -3.941 9.661 1.00 42.13 H new ATOM 0 HD11 LEU A 694 -5.099 -3.046 11.833 1.00 12.44 H new ATOM 0 HD12 LEU A 694 -6.405 -3.014 10.624 1.00 12.44 H new ATOM 0 HD13 LEU A 694 -6.392 -4.267 11.888 1.00 12.44 H new ATOM 0 HD21 LEU A 694 -3.367 -4.784 11.751 1.00 14.34 H new ATOM 0 HD22 LEU A 694 -4.595 -6.070 11.809 1.00 14.34 H new ATOM 0 HD23 LEU A 694 -3.406 -6.034 10.485 1.00 14.34 H new ATOM 1679 N CYS A 695 -6.635 -8.235 8.269 1.00 44.32 N ATOM 1680 CA CYS A 695 -7.618 -9.047 7.617 1.00 2.24 C ATOM 1681 C CYS A 695 -8.939 -8.887 8.335 1.00 3.22 C ATOM 1682 O CYS A 695 -9.909 -9.614 8.102 1.00 4.54 O ATOM 1683 CB CYS A 695 -7.157 -10.497 7.603 1.00 20.31 C ATOM 1684 SG CYS A 695 -8.247 -11.636 6.716 1.00 54.43 S ATOM 0 H CYS A 695 -6.306 -8.599 9.163 1.00 44.32 H new ATOM 0 HA CYS A 695 -7.748 -8.732 6.582 1.00 2.24 H new ATOM 0 HB2 CYS A 695 -6.165 -10.543 7.154 1.00 20.31 H new ATOM 0 HB3 CYS A 695 -7.057 -10.841 8.632 1.00 20.31 H new ATOM 1689 N ASP A 696 -8.979 -7.894 9.181 1.00 11.23 N ATOM 1690 CA ASP A 696 -10.173 -7.562 9.906 1.00 25.53 C ATOM 1691 C ASP A 696 -11.005 -6.741 8.972 1.00 14.33 C ATOM 1692 O ASP A 696 -10.440 -5.968 8.214 1.00 4.23 O ATOM 1693 CB ASP A 696 -9.837 -6.761 11.171 1.00 1.40 C ATOM 1694 CG ASP A 696 -11.054 -6.475 12.032 1.00 5.42 C ATOM 1695 OD1 ASP A 696 -11.719 -5.443 11.833 1.00 24.13 O ATOM 1696 OD2 ASP A 696 -11.349 -7.279 12.942 1.00 2.24 O ATOM 0 H ASP A 696 -8.182 -7.291 9.387 1.00 11.23 H new ATOM 0 HA ASP A 696 -10.701 -8.458 10.231 1.00 25.53 H new ATOM 0 HB2 ASP A 696 -9.104 -7.312 11.760 1.00 1.40 H new ATOM 0 HB3 ASP A 696 -9.372 -5.818 10.884 1.00 1.40 H new ATOM 1701 N ARG A 697 -12.319 -6.932 8.993 1.00 52.51 N ATOM 1702 CA ARG A 697 -13.235 -6.245 8.070 1.00 31.45 C ATOM 1703 C ARG A 697 -12.956 -6.686 6.626 1.00 1.31 C ATOM 1704 O ARG A 697 -11.998 -6.228 5.985 1.00 11.24 O ATOM 1705 CB ARG A 697 -13.128 -4.697 8.171 1.00 51.03 C ATOM 1706 CG ARG A 697 -14.092 -3.948 7.252 1.00 21.02 C ATOM 1707 CD ARG A 697 -13.758 -2.458 7.155 1.00 44.23 C ATOM 1708 NE ARG A 697 -13.803 -1.741 8.443 1.00 14.31 N ATOM 1709 CZ ARG A 697 -13.193 -0.560 8.665 1.00 34.40 C ATOM 1710 NH1 ARG A 697 -12.456 -0.014 7.705 1.00 33.12 N ATOM 1711 NH2 ARG A 697 -13.313 0.059 9.838 1.00 44.12 N ATOM 0 H ARG A 697 -12.785 -7.563 9.645 1.00 52.51 H new ATOM 0 HA ARG A 697 -14.248 -6.525 8.358 1.00 31.45 H new ATOM 0 HB2 ARG A 697 -13.316 -4.396 9.202 1.00 51.03 H new ATOM 0 HB3 ARG A 697 -12.108 -4.397 7.933 1.00 51.03 H new ATOM 0 HG2 ARG A 697 -14.061 -4.391 6.257 1.00 21.02 H new ATOM 0 HG3 ARG A 697 -15.110 -4.067 7.622 1.00 21.02 H new ATOM 0 HD2 ARG A 697 -12.762 -2.348 6.726 1.00 44.23 H new ATOM 0 HD3 ARG A 697 -14.457 -1.985 6.465 1.00 44.23 H new ATOM 0 HE ARG A 697 -14.326 -2.163 9.210 1.00 14.31 H new ATOM 0 HH11 ARG A 697 -12.355 -0.488 6.808 1.00 33.12 H new ATOM 0 HH12 ARG A 697 -11.991 0.880 7.865 1.00 33.12 H new ATOM 0 HH21 ARG A 697 -13.872 -0.360 10.581 1.00 44.12 H new ATOM 0 HH22 ARG A 697 -12.846 0.953 9.993 1.00 44.12 H new ATOM 1723 N ASP A 698 -13.777 -7.554 6.102 1.00 71.11 N ATOM 1724 CA ASP A 698 -13.561 -8.007 4.753 1.00 62.30 C ATOM 1725 C ASP A 698 -14.098 -6.974 3.801 1.00 1.40 C ATOM 1726 O ASP A 698 -15.299 -6.723 3.734 1.00 34.31 O ATOM 1727 CB ASP A 698 -14.217 -9.378 4.476 1.00 50.01 C ATOM 1728 CG ASP A 698 -13.577 -10.545 5.214 1.00 53.14 C ATOM 1729 OD1 ASP A 698 -13.931 -10.799 6.387 1.00 1.31 O ATOM 1730 OD2 ASP A 698 -12.733 -11.253 4.617 1.00 35.32 O ATOM 0 H ASP A 698 -14.586 -7.956 6.575 1.00 71.11 H new ATOM 0 HA ASP A 698 -12.489 -8.138 4.609 1.00 62.30 H new ATOM 0 HB2 ASP A 698 -15.270 -9.325 4.751 1.00 50.01 H new ATOM 0 HB3 ASP A 698 -14.177 -9.576 3.405 1.00 50.01 H new ATOM 1735 N ALA A 699 -13.202 -6.357 3.093 1.00 32.20 N ATOM 1736 CA ALA A 699 -13.530 -5.323 2.138 1.00 34.44 C ATOM 1737 C ALA A 699 -12.946 -5.698 0.793 1.00 50.21 C ATOM 1738 O ALA A 699 -12.612 -4.833 -0.028 1.00 2.32 O ATOM 1739 CB ALA A 699 -12.956 -3.996 2.623 1.00 71.14 C ATOM 0 H ALA A 699 -12.204 -6.555 3.158 1.00 32.20 H new ATOM 0 HA ALA A 699 -14.611 -5.221 2.040 1.00 34.44 H new ATOM 0 HB1 ALA A 699 -13.200 -3.211 1.907 1.00 71.14 H new ATOM 0 HB2 ALA A 699 -13.384 -3.747 3.594 1.00 71.14 H new ATOM 0 HB3 ALA A 699 -11.873 -4.080 2.715 1.00 71.14 H new ATOM 1745 N GLY A 700 -12.857 -6.997 0.563 1.00 43.13 N ATOM 1746 CA GLY A 700 -12.292 -7.519 -0.656 1.00 73.31 C ATOM 1747 C GLY A 700 -10.839 -7.163 -0.788 1.00 20.52 C ATOM 1748 O GLY A 700 -10.008 -7.620 0.007 1.00 0.35 O ATOM 0 H GLY A 700 -13.175 -7.712 1.217 1.00 43.13 H new ATOM 0 HA2 GLY A 700 -12.405 -8.603 -0.675 1.00 73.31 H new ATOM 0 HA3 GLY A 700 -12.843 -7.126 -1.511 1.00 73.31 H new ATOM 1752 N VAL A 701 -10.544 -6.311 -1.754 1.00 55.50 N ATOM 1753 CA VAL A 701 -9.187 -5.846 -2.034 1.00 13.13 C ATOM 1754 C VAL A 701 -8.663 -5.019 -0.859 1.00 20.22 C ATOM 1755 O VAL A 701 -7.465 -4.987 -0.563 1.00 61.13 O ATOM 1756 CB VAL A 701 -9.169 -5.012 -3.348 1.00 54.51 C ATOM 1757 CG1 VAL A 701 -9.963 -3.719 -3.236 1.00 13.13 C ATOM 1758 CG2 VAL A 701 -7.767 -4.774 -3.868 1.00 51.24 C ATOM 0 H VAL A 701 -11.247 -5.914 -2.378 1.00 55.50 H new ATOM 0 HA VAL A 701 -8.534 -6.709 -2.165 1.00 13.13 H new ATOM 0 HB VAL A 701 -9.678 -5.623 -4.093 1.00 54.51 H new ATOM 0 HG11 VAL A 701 -9.915 -3.179 -4.182 1.00 13.13 H new ATOM 0 HG12 VAL A 701 -11.002 -3.949 -3.002 1.00 13.13 H new ATOM 0 HG13 VAL A 701 -9.541 -3.101 -2.444 1.00 13.13 H new ATOM 0 HG21 VAL A 701 -7.814 -4.188 -4.786 1.00 51.24 H new ATOM 0 HG22 VAL A 701 -7.189 -4.232 -3.120 1.00 51.24 H new ATOM 0 HG23 VAL A 701 -7.288 -5.731 -4.073 1.00 51.24 H new ATOM 1764 N GLY A 702 -9.574 -4.399 -0.185 1.00 2.23 N ATOM 1765 CA GLY A 702 -9.252 -3.627 0.961 1.00 2.44 C ATOM 1766 C GLY A 702 -9.053 -2.179 0.658 1.00 72.12 C ATOM 1767 O GLY A 702 -8.609 -1.811 -0.433 1.00 70.04 O ATOM 0 H GLY A 702 -10.567 -4.416 -0.418 1.00 2.23 H new ATOM 0 HA2 GLY A 702 -10.049 -3.731 1.697 1.00 2.44 H new ATOM 0 HA3 GLY A 702 -8.345 -4.024 1.416 1.00 2.44 H new ATOM 1771 N PHE A 703 -9.396 -1.357 1.597 1.00 14.50 N ATOM 1772 CA PHE A 703 -9.226 0.058 1.458 1.00 64.32 C ATOM 1773 C PHE A 703 -8.262 0.556 2.535 1.00 24.13 C ATOM 1774 O PHE A 703 -8.457 0.258 3.726 1.00 31.34 O ATOM 1775 CB PHE A 703 -10.583 0.772 1.548 1.00 71.10 C ATOM 1776 CG PHE A 703 -10.493 2.249 1.321 1.00 1.04 C ATOM 1777 CD1 PHE A 703 -10.327 2.746 0.042 1.00 12.03 C ATOM 1778 CD2 PHE A 703 -10.554 3.136 2.381 1.00 63.12 C ATOM 1779 CE1 PHE A 703 -10.226 4.095 -0.178 1.00 14.44 C ATOM 1780 CE2 PHE A 703 -10.451 4.490 2.166 1.00 13.52 C ATOM 1781 CZ PHE A 703 -10.286 4.969 0.882 1.00 34.54 C ATOM 0 H PHE A 703 -9.804 -1.647 2.486 1.00 14.50 H new ATOM 0 HA PHE A 703 -8.803 0.283 0.479 1.00 64.32 H new ATOM 0 HB2 PHE A 703 -11.262 0.340 0.813 1.00 71.10 H new ATOM 0 HB3 PHE A 703 -11.017 0.589 2.531 1.00 71.10 H new ATOM 0 HD1 PHE A 703 -10.276 2.064 -0.794 1.00 12.03 H new ATOM 0 HD2 PHE A 703 -10.684 2.762 3.386 1.00 63.12 H new ATOM 0 HE1 PHE A 703 -10.099 4.471 -1.182 1.00 14.44 H new ATOM 0 HE2 PHE A 703 -10.499 5.176 2.999 1.00 13.52 H new ATOM 0 HZ PHE A 703 -10.204 6.032 0.710 1.00 34.54 H new ATOM 1791 N PRO A 704 -7.200 1.280 2.146 1.00 21.23 N ATOM 1792 CA PRO A 704 -6.226 1.812 3.095 1.00 24.21 C ATOM 1793 C PRO A 704 -6.747 3.032 3.849 1.00 34.23 C ATOM 1794 O PRO A 704 -7.361 3.932 3.269 1.00 60.21 O ATOM 1795 CB PRO A 704 -5.052 2.216 2.206 1.00 14.14 C ATOM 1796 CG PRO A 704 -5.667 2.532 0.889 1.00 41.33 C ATOM 1797 CD PRO A 704 -6.857 1.622 0.750 1.00 33.43 C ATOM 0 HA PRO A 704 -5.976 1.082 3.865 1.00 24.21 H new ATOM 0 HB2 PRO A 704 -4.525 3.078 2.614 1.00 14.14 H new ATOM 0 HB3 PRO A 704 -4.324 1.409 2.120 1.00 14.14 H new ATOM 0 HG2 PRO A 704 -5.970 3.578 0.842 1.00 41.33 H new ATOM 0 HG3 PRO A 704 -4.956 2.369 0.079 1.00 41.33 H new ATOM 0 HD2 PRO A 704 -7.685 2.119 0.244 1.00 33.43 H new ATOM 0 HD3 PRO A 704 -6.616 0.733 0.167 1.00 33.43 H new ATOM 1805 N GLU A 705 -6.486 3.056 5.124 1.00 71.32 N ATOM 1806 CA GLU A 705 -6.857 4.150 5.976 1.00 74.50 C ATOM 1807 C GLU A 705 -5.647 4.587 6.774 1.00 3.32 C ATOM 1808 O GLU A 705 -4.752 3.792 7.017 1.00 63.11 O ATOM 1809 CB GLU A 705 -7.999 3.729 6.891 1.00 34.21 C ATOM 1810 CG GLU A 705 -9.283 3.416 6.133 1.00 35.14 C ATOM 1811 CD GLU A 705 -10.438 3.062 7.036 1.00 54.10 C ATOM 1812 OE1 GLU A 705 -11.145 3.972 7.513 1.00 1.11 O ATOM 1813 OE2 GLU A 705 -10.674 1.877 7.274 1.00 44.22 O ATOM 0 H GLU A 705 -6.000 2.302 5.610 1.00 71.32 H new ATOM 0 HA GLU A 705 -7.202 4.992 5.376 1.00 74.50 H new ATOM 0 HB2 GLU A 705 -7.696 2.850 7.461 1.00 34.21 H new ATOM 0 HB3 GLU A 705 -8.193 4.524 7.611 1.00 34.21 H new ATOM 0 HG2 GLU A 705 -9.557 4.278 5.525 1.00 35.14 H new ATOM 0 HG3 GLU A 705 -9.100 2.588 5.448 1.00 35.14 H new ATOM 1820 N TYR A 706 -5.606 5.831 7.163 1.00 60.41 N ATOM 1821 CA TYR A 706 -4.467 6.349 7.895 1.00 31.54 C ATOM 1822 C TYR A 706 -4.660 6.154 9.390 1.00 23.04 C ATOM 1823 O TYR A 706 -5.739 6.421 9.918 1.00 74.34 O ATOM 1824 CB TYR A 706 -4.260 7.848 7.574 1.00 60.44 C ATOM 1825 CG TYR A 706 -3.108 8.497 8.326 1.00 54.21 C ATOM 1826 CD1 TYR A 706 -1.832 7.948 8.289 1.00 34.11 C ATOM 1827 CD2 TYR A 706 -3.301 9.647 9.082 1.00 73.23 C ATOM 1828 CE1 TYR A 706 -0.787 8.522 8.979 1.00 51.42 C ATOM 1829 CE2 TYR A 706 -2.258 10.228 9.778 1.00 24.14 C ATOM 1830 CZ TYR A 706 -1.003 9.661 9.723 1.00 54.33 C ATOM 1831 OH TYR A 706 0.047 10.237 10.418 1.00 44.23 O ATOM 0 H TYR A 706 -6.346 6.512 6.989 1.00 60.41 H new ATOM 0 HA TYR A 706 -3.579 5.798 7.586 1.00 31.54 H new ATOM 0 HB2 TYR A 706 -4.087 7.958 6.503 1.00 60.44 H new ATOM 0 HB3 TYR A 706 -5.179 8.387 7.805 1.00 60.44 H new ATOM 0 HD1 TYR A 706 -1.656 7.054 7.708 1.00 34.11 H new ATOM 0 HD2 TYR A 706 -4.283 10.094 9.126 1.00 73.23 H new ATOM 0 HE1 TYR A 706 0.198 8.081 8.937 1.00 51.42 H new ATOM 0 HE2 TYR A 706 -2.425 11.121 10.362 1.00 24.14 H new ATOM 0 HH TYR A 706 -0.140 10.205 11.379 1.00 44.23 H new ATOM 1841 N GLN A 707 -3.649 5.660 10.062 1.00 24.53 N ATOM 1842 CA GLN A 707 -3.707 5.572 11.493 1.00 3.13 C ATOM 1843 C GLN A 707 -2.723 6.579 12.058 1.00 4.52 C ATOM 1844 O GLN A 707 -1.512 6.477 11.836 1.00 51.25 O ATOM 1845 CB GLN A 707 -3.479 4.124 12.011 1.00 14.34 C ATOM 1846 CG GLN A 707 -2.123 3.503 11.715 1.00 52.40 C ATOM 1847 CD GLN A 707 -2.053 2.041 12.113 1.00 63.32 C ATOM 1848 OE1 GLN A 707 -3.044 1.328 12.067 1.00 75.02 O ATOM 1849 NE2 GLN A 707 -0.912 1.593 12.533 1.00 74.32 N ATOM 0 H GLN A 707 -2.785 5.317 9.642 1.00 24.53 H new ATOM 0 HA GLN A 707 -4.709 5.819 11.843 1.00 3.13 H new ATOM 0 HB2 GLN A 707 -3.627 4.121 13.091 1.00 14.34 H new ATOM 0 HB3 GLN A 707 -4.249 3.483 11.582 1.00 14.34 H new ATOM 0 HG2 GLN A 707 -1.909 3.597 10.650 1.00 52.40 H new ATOM 0 HG3 GLN A 707 -1.349 4.058 12.246 1.00 52.40 H new ATOM 0 HE21 GLN A 707 -0.101 2.211 12.561 1.00 74.32 H new ATOM 0 HE22 GLN A 707 -0.825 0.623 12.836 1.00 74.32 H new ATOM 1857 N GLU A 708 -3.251 7.586 12.720 1.00 31.41 N ATOM 1858 CA GLU A 708 -2.443 8.670 13.225 1.00 15.45 C ATOM 1859 C GLU A 708 -1.594 8.234 14.413 1.00 64.02 C ATOM 1860 O GLU A 708 -2.027 8.289 15.574 1.00 71.43 O ATOM 1861 CB GLU A 708 -3.310 9.900 13.563 1.00 34.12 C ATOM 1862 CG GLU A 708 -2.524 11.123 14.028 1.00 3.41 C ATOM 1863 CD GLU A 708 -1.555 11.635 12.983 1.00 51.21 C ATOM 1864 OE1 GLU A 708 -0.434 11.101 12.887 1.00 64.25 O ATOM 1865 OE2 GLU A 708 -1.892 12.582 12.247 1.00 14.13 O ATOM 0 H GLU A 708 -4.247 7.674 12.921 1.00 31.41 H new ATOM 0 HA GLU A 708 -1.754 8.963 12.433 1.00 15.45 H new ATOM 0 HB2 GLU A 708 -3.891 10.172 12.682 1.00 34.12 H new ATOM 0 HB3 GLU A 708 -4.021 9.624 14.341 1.00 34.12 H new ATOM 0 HG2 GLU A 708 -3.222 11.919 14.290 1.00 3.41 H new ATOM 0 HG3 GLU A 708 -1.973 10.871 14.934 1.00 3.41 H new ATOM 1872 N GLU A 709 -0.420 7.748 14.097 1.00 0.42 N ATOM 1873 CA GLU A 709 0.566 7.340 15.056 1.00 22.33 C ATOM 1874 C GLU A 709 1.931 7.744 14.536 1.00 54.45 C ATOM 1875 O GLU A 709 2.089 7.993 13.324 1.00 1.42 O ATOM 1876 CB GLU A 709 0.531 5.818 15.327 1.00 64.22 C ATOM 1877 CG GLU A 709 -0.765 5.301 15.949 1.00 4.33 C ATOM 1878 CD GLU A 709 -0.698 3.832 16.304 1.00 12.33 C ATOM 1879 OE1 GLU A 709 -0.220 3.505 17.404 1.00 54.53 O ATOM 1880 OE2 GLU A 709 -1.113 2.983 15.496 1.00 74.42 O ATOM 0 H GLU A 709 -0.118 7.623 13.131 1.00 0.42 H new ATOM 0 HA GLU A 709 0.350 7.831 16.005 1.00 22.33 H new ATOM 0 HB2 GLU A 709 0.699 5.293 14.387 1.00 64.22 H new ATOM 0 HB3 GLU A 709 1.360 5.563 15.987 1.00 64.22 H new ATOM 0 HG2 GLU A 709 -0.987 5.878 16.847 1.00 4.33 H new ATOM 0 HG3 GLU A 709 -1.588 5.465 15.253 1.00 4.33 H new ATOM 1887 N ASP A 710 2.889 7.824 15.447 1.00 44.24 N ATOM 1888 CA ASP A 710 4.292 8.203 15.188 1.00 42.42 C ATOM 1889 C ASP A 710 4.401 9.687 14.831 1.00 0.14 C ATOM 1890 O ASP A 710 3.424 10.317 14.435 1.00 22.32 O ATOM 1891 CB ASP A 710 4.951 7.317 14.100 1.00 3.32 C ATOM 1892 CG ASP A 710 6.454 7.499 14.021 1.00 13.43 C ATOM 1893 OD1 ASP A 710 6.938 8.412 13.330 1.00 33.51 O ATOM 1894 OD2 ASP A 710 7.178 6.733 14.671 1.00 25.53 O ATOM 0 H ASP A 710 2.715 7.620 16.431 1.00 44.24 H new ATOM 0 HA ASP A 710 4.844 8.031 16.112 1.00 42.42 H new ATOM 0 HB2 ASP A 710 4.727 6.270 14.306 1.00 3.32 H new ATOM 0 HB3 ASP A 710 4.510 7.552 13.131 1.00 3.32 H new ATOM 1899 N ASN A 711 5.570 10.245 14.996 1.00 74.32 N ATOM 1900 CA ASN A 711 5.792 11.643 14.698 1.00 63.03 C ATOM 1901 C ASN A 711 5.852 11.893 13.197 1.00 42.41 C ATOM 1902 O ASN A 711 5.442 12.954 12.723 1.00 53.41 O ATOM 1903 CB ASN A 711 7.073 12.157 15.381 1.00 71.21 C ATOM 1904 CG ASN A 711 7.378 13.622 15.070 1.00 2.52 C ATOM 1905 OD1 ASN A 711 8.095 13.946 14.114 1.00 43.45 O ATOM 1906 ND2 ASN A 711 6.831 14.514 15.850 1.00 63.12 N ATOM 0 H ASN A 711 6.394 9.751 15.339 1.00 74.32 H new ATOM 0 HA ASN A 711 4.942 12.198 15.096 1.00 63.03 H new ATOM 0 HB2 ASN A 711 6.975 12.035 16.460 1.00 71.21 H new ATOM 0 HB3 ASN A 711 7.916 11.543 15.065 1.00 71.21 H new ATOM 0 HD21 ASN A 711 6.990 15.507 15.679 1.00 63.12 H new ATOM 0 HD22 ASN A 711 6.245 14.218 16.630 1.00 63.12 H new ATOM 1912 N SER A 712 6.336 10.922 12.444 1.00 55.21 N ATOM 1913 CA SER A 712 6.497 11.127 11.026 1.00 0.54 C ATOM 1914 C SER A 712 6.381 9.854 10.170 1.00 72.20 C ATOM 1915 O SER A 712 6.112 9.942 8.977 1.00 2.44 O ATOM 1916 CB SER A 712 7.799 11.890 10.755 1.00 74.51 C ATOM 1917 OG SER A 712 8.901 11.304 11.455 1.00 50.30 O ATOM 0 H SER A 712 6.618 10.003 12.786 1.00 55.21 H new ATOM 0 HA SER A 712 5.649 11.732 10.705 1.00 0.54 H new ATOM 0 HB2 SER A 712 8.005 11.893 9.685 1.00 74.51 H new ATOM 0 HB3 SER A 712 7.684 12.930 11.060 1.00 74.51 H new ATOM 0 HG SER A 712 9.718 11.810 11.262 1.00 50.30 H new ATOM 1923 N THR A 713 6.567 8.694 10.748 1.00 55.32 N ATOM 1924 CA THR A 713 6.470 7.477 9.986 1.00 5.50 C ATOM 1925 C THR A 713 5.008 7.076 9.877 1.00 35.24 C ATOM 1926 O THR A 713 4.394 6.606 10.835 1.00 1.35 O ATOM 1927 CB THR A 713 7.313 6.335 10.602 1.00 71.23 C ATOM 1928 OG1 THR A 713 8.684 6.765 10.702 1.00 74.21 O ATOM 1929 CG2 THR A 713 7.252 5.084 9.728 1.00 32.13 C ATOM 0 H THR A 713 6.785 8.568 11.736 1.00 55.32 H new ATOM 0 HA THR A 713 6.877 7.659 8.991 1.00 5.50 H new ATOM 0 HB THR A 713 6.912 6.097 11.587 1.00 71.23 H new ATOM 0 HG1 THR A 713 9.224 6.047 11.093 1.00 74.21 H new ATOM 0 HG21 THR A 713 7.852 4.294 10.181 1.00 32.13 H new ATOM 0 HG22 THR A 713 6.218 4.750 9.642 1.00 32.13 H new ATOM 0 HG23 THR A 713 7.643 5.313 8.737 1.00 32.13 H new ATOM 1935 N TYR A 714 4.466 7.306 8.707 1.00 15.35 N ATOM 1936 CA TYR A 714 3.072 7.103 8.444 1.00 21.11 C ATOM 1937 C TYR A 714 2.704 5.636 8.395 1.00 72.52 C ATOM 1938 O TYR A 714 3.221 4.863 7.569 1.00 75.43 O ATOM 1939 CB TYR A 714 2.666 7.806 7.146 1.00 63.44 C ATOM 1940 CG TYR A 714 2.933 9.295 7.156 1.00 4.04 C ATOM 1941 CD1 TYR A 714 2.094 10.165 7.833 1.00 24.04 C ATOM 1942 CD2 TYR A 714 4.027 9.829 6.490 1.00 51.40 C ATOM 1943 CE1 TYR A 714 2.333 11.521 7.854 1.00 53.52 C ATOM 1944 CE2 TYR A 714 4.267 11.187 6.506 1.00 71.52 C ATOM 1945 CZ TYR A 714 3.420 12.025 7.189 1.00 62.41 C ATOM 1946 OH TYR A 714 3.671 13.383 7.210 1.00 50.34 O ATOM 0 H TYR A 714 4.993 7.644 7.902 1.00 15.35 H new ATOM 0 HA TYR A 714 2.519 7.542 9.274 1.00 21.11 H new ATOM 0 HB2 TYR A 714 3.205 7.354 6.314 1.00 63.44 H new ATOM 0 HB3 TYR A 714 1.604 7.637 6.967 1.00 63.44 H new ATOM 0 HD1 TYR A 714 1.234 9.772 8.355 1.00 24.04 H new ATOM 0 HD2 TYR A 714 4.698 9.174 5.953 1.00 51.40 H new ATOM 0 HE1 TYR A 714 1.669 12.182 8.391 1.00 53.52 H new ATOM 0 HE2 TYR A 714 5.120 11.591 5.982 1.00 71.52 H new ATOM 0 HH TYR A 714 4.636 13.538 7.141 1.00 50.34 H new ATOM 1956 N ASN A 715 1.846 5.256 9.297 1.00 72.45 N ATOM 1957 CA ASN A 715 1.298 3.928 9.338 1.00 64.42 C ATOM 1958 C ASN A 715 -0.080 3.916 8.757 1.00 53.30 C ATOM 1959 O ASN A 715 -0.914 4.781 9.064 1.00 34.42 O ATOM 1960 CB ASN A 715 1.262 3.350 10.759 1.00 4.44 C ATOM 1961 CG ASN A 715 2.588 2.799 11.245 1.00 65.43 C ATOM 1962 OD1 ASN A 715 3.421 3.517 11.795 1.00 72.10 O ATOM 1963 ND2 ASN A 715 2.763 1.497 11.089 1.00 71.40 N ATOM 0 H ASN A 715 1.501 5.868 10.037 1.00 72.45 H new ATOM 0 HA ASN A 715 1.958 3.297 8.742 1.00 64.42 H new ATOM 0 HB2 ASN A 715 0.932 4.129 11.447 1.00 4.44 H new ATOM 0 HB3 ASN A 715 0.517 2.555 10.796 1.00 4.44 H new ATOM 0 HD21 ASN A 715 3.615 1.052 11.431 1.00 71.40 H new ATOM 0 HD22 ASN A 715 2.046 0.938 10.627 1.00 71.40 H new ATOM 1969 N PHE A 716 -0.324 2.975 7.911 1.00 73.14 N ATOM 1970 CA PHE A 716 -1.612 2.828 7.312 1.00 42.11 C ATOM 1971 C PHE A 716 -2.251 1.547 7.698 1.00 12.43 C ATOM 1972 O PHE A 716 -1.594 0.517 7.812 1.00 72.11 O ATOM 1973 CB PHE A 716 -1.561 3.015 5.807 1.00 31.42 C ATOM 1974 CG PHE A 716 -1.312 4.429 5.449 1.00 12.52 C ATOM 1975 CD1 PHE A 716 -0.030 4.929 5.350 1.00 74.45 C ATOM 1976 CD2 PHE A 716 -2.373 5.278 5.244 1.00 1.52 C ATOM 1977 CE1 PHE A 716 0.178 6.253 5.056 1.00 63.44 C ATOM 1978 CE2 PHE A 716 -2.171 6.592 4.945 1.00 65.11 C ATOM 1979 CZ PHE A 716 -0.900 7.078 4.854 1.00 4.42 C ATOM 0 H PHE A 716 0.363 2.283 7.612 1.00 73.14 H new ATOM 0 HA PHE A 716 -2.243 3.626 7.702 1.00 42.11 H new ATOM 0 HB2 PHE A 716 -0.775 2.387 5.387 1.00 31.42 H new ATOM 0 HB3 PHE A 716 -2.502 2.686 5.365 1.00 31.42 H new ATOM 0 HD1 PHE A 716 0.815 4.274 5.505 1.00 74.45 H new ATOM 0 HD2 PHE A 716 -3.381 4.898 5.321 1.00 1.52 H new ATOM 0 HE1 PHE A 716 1.183 6.643 4.984 1.00 63.44 H new ATOM 0 HE2 PHE A 716 -3.014 7.246 4.781 1.00 65.11 H new ATOM 0 HZ PHE A 716 -0.741 8.120 4.621 1.00 4.42 H new ATOM 1989 N ARG A 717 -3.518 1.615 7.903 1.00 72.43 N ATOM 1990 CA ARG A 717 -4.281 0.510 8.321 1.00 14.54 C ATOM 1991 C ARG A 717 -5.150 0.101 7.162 1.00 21.11 C ATOM 1992 O ARG A 717 -6.097 0.785 6.803 1.00 30.33 O ATOM 1993 CB ARG A 717 -5.099 0.905 9.541 1.00 4.10 C ATOM 1994 CG ARG A 717 -5.863 -0.222 10.182 1.00 13.32 C ATOM 1995 CD ARG A 717 -6.556 0.253 11.446 1.00 73.12 C ATOM 1996 NE ARG A 717 -5.612 0.750 12.443 1.00 42.42 N ATOM 1997 CZ ARG A 717 -5.923 1.103 13.692 1.00 20.24 C ATOM 1998 NH1 ARG A 717 -7.166 0.969 14.144 1.00 24.11 N ATOM 1999 NH2 ARG A 717 -4.976 1.573 14.490 1.00 4.24 N ATOM 0 H ARG A 717 -4.062 2.469 7.779 1.00 72.43 H new ATOM 0 HA ARG A 717 -3.656 -0.335 8.610 1.00 14.54 H new ATOM 0 HB2 ARG A 717 -4.430 1.340 10.284 1.00 4.10 H new ATOM 0 HB3 ARG A 717 -5.804 1.684 9.251 1.00 4.10 H new ATOM 0 HG2 ARG A 717 -6.601 -0.613 9.481 1.00 13.32 H new ATOM 0 HG3 ARG A 717 -5.183 -1.041 10.419 1.00 13.32 H new ATOM 0 HD2 ARG A 717 -7.264 1.042 11.194 1.00 73.12 H new ATOM 0 HD3 ARG A 717 -7.132 -0.568 11.872 1.00 73.12 H new ATOM 0 HE ARG A 717 -4.635 0.834 12.162 1.00 42.42 H new ATOM 0 HH11 ARG A 717 -7.893 0.593 13.535 1.00 24.11 H new ATOM 0 HH12 ARG A 717 -7.393 1.242 15.100 1.00 24.11 H new ATOM 0 HH21 ARG A 717 -4.019 1.662 14.148 1.00 4.24 H new ATOM 0 HH22 ARG A 717 -5.204 1.845 15.446 1.00 4.24 H new ATOM 2011 N TRP A 718 -4.786 -0.966 6.558 1.00 13.00 N ATOM 2012 CA TRP A 718 -5.439 -1.448 5.380 1.00 4.34 C ATOM 2013 C TRP A 718 -6.234 -2.681 5.756 1.00 12.32 C ATOM 2014 O TRP A 718 -5.661 -3.692 6.147 1.00 31.14 O ATOM 2015 CB TRP A 718 -4.355 -1.805 4.347 1.00 21.41 C ATOM 2016 CG TRP A 718 -4.823 -2.113 2.947 1.00 70.02 C ATOM 2017 CD1 TRP A 718 -5.766 -3.015 2.562 1.00 32.45 C ATOM 2018 CD2 TRP A 718 -4.302 -1.542 1.733 1.00 21.22 C ATOM 2019 NE1 TRP A 718 -5.883 -3.023 1.193 1.00 14.12 N ATOM 2020 CE2 TRP A 718 -4.999 -2.131 0.664 1.00 50.34 C ATOM 2021 CE3 TRP A 718 -3.315 -0.576 1.446 1.00 64.22 C ATOM 2022 CZ2 TRP A 718 -4.752 -1.800 -0.657 1.00 51.24 C ATOM 2023 CZ3 TRP A 718 -3.076 -0.254 0.129 1.00 43.30 C ATOM 2024 CH2 TRP A 718 -3.792 -0.862 -0.905 1.00 63.53 C ATOM 0 H TRP A 718 -4.009 -1.549 6.868 1.00 13.00 H new ATOM 0 HA TRP A 718 -6.110 -0.700 4.957 1.00 4.34 H new ATOM 0 HB2 TRP A 718 -3.650 -0.975 4.294 1.00 21.41 H new ATOM 0 HB3 TRP A 718 -3.804 -2.669 4.718 1.00 21.41 H new ATOM 0 HD1 TRP A 718 -6.340 -3.635 3.235 1.00 32.45 H new ATOM 0 HE1 TRP A 718 -6.529 -3.604 0.658 1.00 14.12 H new ATOM 0 HE3 TRP A 718 -2.760 -0.100 2.241 1.00 64.22 H new ATOM 0 HZ2 TRP A 718 -5.299 -2.267 -1.463 1.00 51.24 H new ATOM 0 HZ3 TRP A 718 -2.322 0.481 -0.109 1.00 43.30 H new ATOM 0 HH2 TRP A 718 -3.581 -0.583 -1.927 1.00 63.53 H new ATOM 2035 N TYR A 719 -7.529 -2.585 5.677 1.00 74.21 N ATOM 2036 CA TYR A 719 -8.383 -3.715 5.970 1.00 54.43 C ATOM 2037 C TYR A 719 -8.659 -4.462 4.694 1.00 53.11 C ATOM 2038 O TYR A 719 -9.386 -3.972 3.834 1.00 41.54 O ATOM 2039 CB TYR A 719 -9.699 -3.250 6.580 1.00 2.13 C ATOM 2040 CG TYR A 719 -9.578 -2.581 7.926 1.00 14.12 C ATOM 2041 CD1 TYR A 719 -9.550 -3.336 9.080 1.00 43.14 C ATOM 2042 CD2 TYR A 719 -9.522 -1.206 8.047 1.00 45.34 C ATOM 2043 CE1 TYR A 719 -9.474 -2.755 10.313 1.00 51.44 C ATOM 2044 CE2 TYR A 719 -9.440 -0.609 9.285 1.00 44.13 C ATOM 2045 CZ TYR A 719 -9.419 -1.396 10.415 1.00 45.33 C ATOM 2046 OH TYR A 719 -9.349 -0.813 11.653 1.00 11.34 O ATOM 0 H TYR A 719 -8.026 -1.735 5.411 1.00 74.21 H new ATOM 0 HA TYR A 719 -7.880 -4.365 6.686 1.00 54.43 H new ATOM 0 HB2 TYR A 719 -10.177 -2.557 5.888 1.00 2.13 H new ATOM 0 HB3 TYR A 719 -10.361 -4.111 6.677 1.00 2.13 H new ATOM 0 HD1 TYR A 719 -9.589 -4.413 9.006 1.00 43.14 H new ATOM 0 HD2 TYR A 719 -9.543 -0.591 7.159 1.00 45.34 H new ATOM 0 HE1 TYR A 719 -9.458 -3.368 11.202 1.00 51.44 H new ATOM 0 HE2 TYR A 719 -9.393 0.467 9.369 1.00 44.13 H new ATOM 0 HH TYR A 719 -9.315 0.161 11.554 1.00 11.34 H new ATOM 2056 N THR A 720 -8.075 -5.618 4.555 1.00 51.11 N ATOM 2057 CA THR A 720 -8.214 -6.386 3.348 1.00 74.11 C ATOM 2058 C THR A 720 -8.497 -7.850 3.632 1.00 23.12 C ATOM 2059 O THR A 720 -7.959 -8.431 4.575 1.00 25.53 O ATOM 2060 CB THR A 720 -6.989 -6.229 2.397 1.00 33.44 C ATOM 2061 OG1 THR A 720 -7.154 -7.026 1.218 1.00 64.05 O ATOM 2062 CG2 THR A 720 -5.700 -6.610 3.076 1.00 11.12 C ATOM 0 H THR A 720 -7.492 -6.054 5.270 1.00 51.11 H new ATOM 0 HA THR A 720 -9.081 -5.976 2.829 1.00 74.11 H new ATOM 0 HB THR A 720 -6.937 -5.176 2.121 1.00 33.44 H new ATOM 0 HG1 THR A 720 -7.173 -6.444 0.430 1.00 64.05 H new ATOM 0 HG21 THR A 720 -4.871 -6.486 2.379 1.00 11.12 H new ATOM 0 HG22 THR A 720 -5.543 -5.970 3.944 1.00 11.12 H new ATOM 0 HG23 THR A 720 -5.752 -7.650 3.397 1.00 11.12 H new ATOM 2068 N SER A 721 -9.333 -8.443 2.811 1.00 54.51 N ATOM 2069 CA SER A 721 -9.668 -9.831 2.939 1.00 52.22 C ATOM 2070 C SER A 721 -8.445 -10.674 2.503 1.00 1.12 C ATOM 2071 O SER A 721 -8.245 -11.808 2.961 1.00 55.14 O ATOM 2072 CB SER A 721 -10.905 -10.138 2.079 1.00 73.11 C ATOM 2073 OG SER A 721 -11.406 -11.443 2.306 1.00 42.33 O ATOM 0 H SER A 721 -9.798 -7.970 2.036 1.00 54.51 H new ATOM 0 HA SER A 721 -9.911 -10.080 3.972 1.00 52.22 H new ATOM 0 HB2 SER A 721 -11.686 -9.409 2.295 1.00 73.11 H new ATOM 0 HB3 SER A 721 -10.649 -10.028 1.025 1.00 73.11 H new ATOM 0 HG SER A 721 -12.151 -11.402 2.942 1.00 42.33 H new ATOM 2079 N TYR A 722 -7.602 -10.074 1.644 1.00 60.45 N ATOM 2080 CA TYR A 722 -6.413 -10.742 1.123 1.00 50.32 C ATOM 2081 C TYR A 722 -5.345 -10.980 2.180 1.00 31.12 C ATOM 2082 O TYR A 722 -4.467 -11.795 1.975 1.00 32.41 O ATOM 2083 CB TYR A 722 -5.800 -9.989 -0.064 1.00 41.41 C ATOM 2084 CG TYR A 722 -6.592 -10.055 -1.347 1.00 71.42 C ATOM 2085 CD1 TYR A 722 -6.367 -11.077 -2.258 1.00 61.14 C ATOM 2086 CD2 TYR A 722 -7.543 -9.101 -1.663 1.00 33.40 C ATOM 2087 CE1 TYR A 722 -7.063 -11.145 -3.442 1.00 44.01 C ATOM 2088 CE2 TYR A 722 -8.250 -9.166 -2.852 1.00 43.45 C ATOM 2089 CZ TYR A 722 -8.001 -10.189 -3.735 1.00 0.51 C ATOM 2090 OH TYR A 722 -8.692 -10.251 -4.925 1.00 42.03 O ATOM 0 H TYR A 722 -7.730 -9.123 1.299 1.00 60.45 H new ATOM 0 HA TYR A 722 -6.766 -11.715 0.782 1.00 50.32 H new ATOM 0 HB2 TYR A 722 -5.677 -8.942 0.215 1.00 41.41 H new ATOM 0 HB3 TYR A 722 -4.803 -10.388 -0.251 1.00 41.41 H new ATOM 0 HD1 TYR A 722 -5.631 -11.834 -2.033 1.00 61.14 H new ATOM 0 HD2 TYR A 722 -7.737 -8.294 -0.972 1.00 33.40 H new ATOM 0 HE1 TYR A 722 -6.872 -11.948 -4.138 1.00 44.01 H new ATOM 0 HE2 TYR A 722 -8.993 -8.417 -3.084 1.00 43.45 H new ATOM 0 HH TYR A 722 -9.320 -9.500 -4.978 1.00 42.03 H new ATOM 2100 N ALA A 723 -5.420 -10.260 3.306 1.00 3.12 N ATOM 2101 CA ALA A 723 -4.440 -10.419 4.391 1.00 72.13 C ATOM 2102 C ALA A 723 -4.557 -11.776 5.128 1.00 71.24 C ATOM 2103 O ALA A 723 -3.742 -12.082 6.009 1.00 71.23 O ATOM 2104 CB ALA A 723 -4.518 -9.257 5.365 1.00 32.25 C ATOM 0 H ALA A 723 -6.144 -9.565 3.491 1.00 3.12 H new ATOM 0 HA ALA A 723 -3.457 -10.416 3.920 1.00 72.13 H new ATOM 0 HB1 ALA A 723 -3.784 -9.397 6.158 1.00 32.25 H new ATOM 0 HB2 ALA A 723 -4.309 -8.326 4.838 1.00 32.25 H new ATOM 0 HB3 ALA A 723 -5.517 -9.212 5.799 1.00 32.25 H new ATOM 2110 N CYS A 724 -5.565 -12.563 4.790 1.00 12.14 N ATOM 2111 CA CYS A 724 -5.678 -13.922 5.304 1.00 1.23 C ATOM 2112 C CYS A 724 -5.342 -14.899 4.199 1.00 30.04 C ATOM 2113 O CYS A 724 -5.822 -14.737 3.070 1.00 32.12 O ATOM 2114 CB CYS A 724 -7.090 -14.249 5.818 1.00 24.21 C ATOM 2115 SG CYS A 724 -7.591 -13.421 7.347 1.00 73.42 S ATOM 0 H CYS A 724 -6.319 -12.286 4.161 1.00 12.14 H new ATOM 0 HA CYS A 724 -4.986 -14.005 6.142 1.00 1.23 H new ATOM 0 HB2 CYS A 724 -7.807 -13.993 5.038 1.00 24.21 H new ATOM 0 HB3 CYS A 724 -7.158 -15.326 5.973 1.00 24.21 H new ATOM 2120 N PRO A 725 -4.500 -15.902 4.474 1.00 1.11 N ATOM 2121 CA PRO A 725 -4.169 -16.928 3.492 1.00 13.14 C ATOM 2122 C PRO A 725 -5.347 -17.893 3.287 1.00 3.33 C ATOM 2123 O PRO A 725 -6.207 -17.629 2.417 1.00 38.11 O ATOM 2124 CB PRO A 725 -2.965 -17.652 4.112 1.00 63.40 C ATOM 2125 CG PRO A 725 -3.081 -17.420 5.585 1.00 25.02 C ATOM 2126 CD PRO A 725 -3.793 -16.105 5.761 1.00 74.31 C ATOM 2127 OXT PRO A 725 -5.444 -18.896 4.019 1.00 38.11 O ATOM 0 HA PRO A 725 -3.950 -16.515 2.507 1.00 13.14 H new ATOM 0 HB2 PRO A 725 -2.983 -18.717 3.879 1.00 63.40 H new ATOM 0 HB3 PRO A 725 -2.026 -17.257 3.724 1.00 63.40 H new ATOM 0 HG2 PRO A 725 -3.637 -18.228 6.061 1.00 25.02 H new ATOM 0 HG3 PRO A 725 -2.096 -17.392 6.051 1.00 25.02 H new ATOM 0 HD2 PRO A 725 -4.490 -16.138 6.598 1.00 74.31 H new ATOM 0 HD3 PRO A 725 -3.091 -15.296 5.962 1.00 74.31 H new TER 2135 PRO A 725