USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 968 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 653 LYS NZ :NH3+ -131:sc= 1.2 (180deg=0) USER MOD Set 1.2: A 661 THR OG1 : rot 73:sc= 1.9 USER MOD Single : A 580 SER OG : rot 180:sc=-0.00787 USER MOD Single : A 583 THR OG1 : rot 180:sc= 0 USER MOD Single : A 588 THR OG1 : rot 180:sc= 0 USER MOD Single : A 594 ASN : amide:sc= 0.561 K(o=0.56,f=-2.5!) USER MOD Single : A 596 SER OG : rot -84:sc= 1.05 USER MOD Single : A 598 SER OG : rot 180:sc= 0 USER MOD Single : A 604 SER OG : rot 180:sc= -0.807 USER MOD Single : A 606 LYS NZ :NH3+ -156:sc= 0.693 (180deg=-0.978) USER MOD Single : A 608 ASN : amide:sc= -2.65! C(o=-2.6!,f=-2.9!) USER MOD Single : A 610 SER OG : rot -160:sc=-0.00901 USER MOD Single : A 611 LYS NZ :NH3+ 172:sc= 1.29 (180deg=1.24) USER MOD Single : A 613 ASN : amide:sc=-0.00975 K(o=-0.0098,f=-1.9!) USER MOD Single : A 614 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 622 LYS NZ :NH3+ 148:sc= -0.151 (180deg=-1.38!) USER MOD Single : A 623 SER OG : rot 180:sc= 0 USER MOD Single : A 626 ASN : amide:sc= -0.268 K(o=-0.27,f=-3.5!) USER MOD Single : A 631 SER OG : rot -25:sc= 1.23 USER MOD Single : A 632 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 639 ASN : amide:sc= -0.376 X(o=-0.38,f=-0.63) USER MOD Single : A 641 GLN : amide:sc= 0.375 K(o=0.37,f=-2!) USER MOD Single : A 646 ASN : amide:sc= -1.83 K(o=-1.8,f=-13!) USER MOD Single : A 649 SER OG : rot 180:sc= 0.0124 USER MOD Single : A 655 ASN : amide:sc= -0.701 K(o=-0.7,f=-3.6!) USER MOD Single : A 656 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 659 MET CE :methyl -145:sc= -0.562 (180deg=-2.17) USER MOD Single : A 665 SER OG : rot 77:sc= 0.494 USER MOD Single : A 666 MET CE :methyl 163:sc= -3.08! (180deg=-4.26!) USER MOD Single : A 667 SER OG : rot 180:sc= 0 USER MOD Single : A 668 THR OG1 : rot 83:sc= 0.022 USER MOD Single : A 671 ASN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : A 672 LYS NZ :NH3+ 161:sc= 1.24 (180deg=0.854) USER MOD Single : A 675 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 677 GLN : amide:sc= -0.823 X(o=-0.82,f=-0.58) USER MOD Single : A 685 SER OG : rot 180:sc= -0.0667 USER MOD Single : A 687 CYS SG : rot 180:sc= 0 USER MOD Single : A 688 ASN : amide:sc= 0.834 K(o=0.83,f=-4.7!) USER MOD Single : B 769 MET CE :methyl 167:sc= -0.0526 (180deg=-0.339) USER MOD Single : B 774 TYR OH : rot 180:sc= 0 USER MOD Single : B 776 SER OG : rot 42:sc= 0.378 USER MOD Single : B 779 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 579 -13.300 -9.841 -10.276 1.00 3.33 N ATOM 2 CA GLY A 579 -13.086 -11.193 -9.759 1.00 31.54 C ATOM 3 C GLY A 579 -14.218 -11.595 -8.864 1.00 1.40 C ATOM 4 O GLY A 579 -15.241 -10.909 -8.818 1.00 64.24 O ATOM 0 HA2 GLY A 579 -13.001 -11.897 -10.587 1.00 31.54 H new ATOM 0 HA3 GLY A 579 -12.146 -11.234 -9.208 1.00 31.54 H new ATOM 10 N SER A 580 -14.055 -12.673 -8.147 1.00 12.00 N ATOM 11 CA SER A 580 -15.082 -13.158 -7.264 1.00 34.53 C ATOM 12 C SER A 580 -14.414 -13.963 -6.153 1.00 74.11 C ATOM 13 O SER A 580 -13.193 -14.182 -6.202 1.00 55.32 O ATOM 14 CB SER A 580 -16.105 -14.010 -8.047 1.00 22.10 C ATOM 15 OG SER A 580 -17.215 -14.389 -7.239 1.00 61.34 O ATOM 0 H SER A 580 -13.207 -13.240 -8.158 1.00 12.00 H new ATOM 0 HA SER A 580 -15.631 -12.326 -6.824 1.00 34.53 H new ATOM 0 HB2 SER A 580 -16.461 -13.447 -8.910 1.00 22.10 H new ATOM 0 HB3 SER A 580 -15.614 -14.904 -8.430 1.00 22.10 H new ATOM 0 HG SER A 580 -17.839 -14.925 -7.771 1.00 61.34 H new ATOM 21 N ASP A 581 -15.204 -14.401 -5.182 1.00 24.22 N ATOM 22 CA ASP A 581 -14.723 -15.123 -4.000 1.00 61.54 C ATOM 23 C ASP A 581 -13.750 -14.278 -3.210 1.00 11.52 C ATOM 24 O ASP A 581 -12.536 -14.255 -3.464 1.00 42.52 O ATOM 25 CB ASP A 581 -14.150 -16.509 -4.324 1.00 62.41 C ATOM 26 CG ASP A 581 -13.704 -17.256 -3.081 1.00 23.44 C ATOM 27 OD1 ASP A 581 -14.565 -17.597 -2.247 1.00 51.22 O ATOM 28 OD2 ASP A 581 -12.485 -17.546 -2.938 1.00 31.34 O ATOM 0 H ASP A 581 -16.215 -14.265 -5.189 1.00 24.22 H new ATOM 0 HA ASP A 581 -15.595 -15.311 -3.374 1.00 61.54 H new ATOM 0 HB2 ASP A 581 -14.904 -17.097 -4.847 1.00 62.41 H new ATOM 0 HB3 ASP A 581 -13.304 -16.400 -5.002 1.00 62.41 H new ATOM 33 N GLY A 582 -14.294 -13.550 -2.307 1.00 70.12 N ATOM 34 CA GLY A 582 -13.550 -12.633 -1.521 1.00 51.43 C ATOM 35 C GLY A 582 -14.412 -11.463 -1.226 1.00 1.34 C ATOM 36 O GLY A 582 -14.471 -10.514 -2.016 1.00 25.20 O ATOM 0 H GLY A 582 -15.290 -13.574 -2.087 1.00 70.12 H new ATOM 0 HA2 GLY A 582 -13.222 -13.106 -0.595 1.00 51.43 H new ATOM 0 HA3 GLY A 582 -12.652 -12.318 -2.053 1.00 51.43 H new ATOM 40 N THR A 583 -15.114 -11.526 -0.122 1.00 71.52 N ATOM 41 CA THR A 583 -16.060 -10.501 0.218 1.00 60.33 C ATOM 42 C THR A 583 -15.348 -9.265 0.777 1.00 1.10 C ATOM 43 O THR A 583 -15.352 -8.995 1.987 1.00 4.21 O ATOM 44 CB THR A 583 -17.096 -11.018 1.218 1.00 54.44 C ATOM 45 OG1 THR A 583 -17.570 -12.310 0.774 1.00 32.04 O ATOM 46 CG2 THR A 583 -18.284 -10.067 1.310 1.00 52.02 C ATOM 0 H THR A 583 -15.045 -12.283 0.558 1.00 71.52 H new ATOM 0 HA THR A 583 -16.582 -10.215 -0.695 1.00 60.33 H new ATOM 0 HB THR A 583 -16.627 -11.092 2.199 1.00 54.44 H new ATOM 0 HG1 THR A 583 -18.234 -12.651 1.409 1.00 32.04 H new ATOM 0 HG21 THR A 583 -19.007 -10.456 2.027 1.00 52.02 H new ATOM 0 HG22 THR A 583 -17.940 -9.086 1.637 1.00 52.02 H new ATOM 0 HG23 THR A 583 -18.756 -9.978 0.331 1.00 52.02 H new ATOM 54 N ARG A 584 -14.670 -8.596 -0.097 1.00 14.25 N ATOM 55 CA ARG A 584 -13.979 -7.386 0.196 1.00 13.22 C ATOM 56 C ARG A 584 -14.023 -6.483 -1.006 1.00 72.31 C ATOM 57 O ARG A 584 -14.103 -6.958 -2.140 1.00 11.54 O ATOM 58 CB ARG A 584 -12.522 -7.647 0.613 1.00 11.23 C ATOM 59 CG ARG A 584 -11.671 -8.354 -0.436 1.00 1.23 C ATOM 60 CD ARG A 584 -10.235 -8.491 0.034 1.00 32.30 C ATOM 61 NE ARG A 584 -10.135 -9.231 1.294 1.00 1.23 N ATOM 62 CZ ARG A 584 -9.052 -9.266 2.068 1.00 34.43 C ATOM 63 NH1 ARG A 584 -7.948 -8.622 1.702 1.00 32.12 N ATOM 64 NH2 ARG A 584 -9.076 -9.941 3.205 1.00 62.23 N ATOM 0 H ARG A 584 -14.580 -8.889 -1.070 1.00 14.25 H new ATOM 0 HA ARG A 584 -14.476 -6.905 1.038 1.00 13.22 H new ATOM 0 HB2 ARG A 584 -12.053 -6.694 0.858 1.00 11.23 H new ATOM 0 HB3 ARG A 584 -12.522 -8.246 1.524 1.00 11.23 H new ATOM 0 HG2 ARG A 584 -12.086 -9.341 -0.642 1.00 1.23 H new ATOM 0 HG3 ARG A 584 -11.700 -7.794 -1.371 1.00 1.23 H new ATOM 0 HD2 ARG A 584 -9.650 -9.000 -0.732 1.00 32.30 H new ATOM 0 HD3 ARG A 584 -9.800 -7.500 0.161 1.00 32.30 H new ATOM 0 HE ARG A 584 -10.953 -9.757 1.600 1.00 1.23 H new ATOM 0 HH11 ARG A 584 -7.929 -8.099 0.826 1.00 32.12 H new ATOM 0 HH12 ARG A 584 -7.120 -8.651 2.297 1.00 32.12 H new ATOM 0 HH21 ARG A 584 -9.923 -10.434 3.488 1.00 62.23 H new ATOM 0 HH22 ARG A 584 -8.247 -9.969 3.799 1.00 62.23 H new ATOM 78 N GLU A 585 -13.988 -5.214 -0.766 1.00 1.41 N ATOM 79 CA GLU A 585 -13.957 -4.252 -1.826 1.00 25.41 C ATOM 80 C GLU A 585 -12.818 -3.288 -1.582 1.00 34.24 C ATOM 81 O GLU A 585 -12.317 -3.172 -0.441 1.00 3.12 O ATOM 82 CB GLU A 585 -15.284 -3.494 -1.953 1.00 13.20 C ATOM 83 CG GLU A 585 -15.669 -2.688 -0.732 1.00 4.00 C ATOM 84 CD GLU A 585 -16.890 -1.849 -0.963 1.00 1.51 C ATOM 85 OE1 GLU A 585 -16.752 -0.721 -1.457 1.00 34.14 O ATOM 86 OE2 GLU A 585 -18.000 -2.297 -0.649 1.00 50.25 O ATOM 0 H GLU A 585 -13.980 -4.811 0.171 1.00 1.41 H new ATOM 0 HA GLU A 585 -13.803 -4.780 -2.767 1.00 25.41 H new ATOM 0 HB2 GLU A 585 -15.224 -2.824 -2.810 1.00 13.20 H new ATOM 0 HB3 GLU A 585 -16.078 -4.211 -2.164 1.00 13.20 H new ATOM 0 HG2 GLU A 585 -15.849 -3.364 0.104 1.00 4.00 H new ATOM 0 HG3 GLU A 585 -14.837 -2.044 -0.448 1.00 4.00 H new ATOM 93 N PHE A 586 -12.407 -2.622 -2.617 1.00 74.11 N ATOM 94 CA PHE A 586 -11.336 -1.674 -2.540 1.00 25.03 C ATOM 95 C PHE A 586 -11.855 -0.276 -2.558 1.00 24.04 C ATOM 96 O PHE A 586 -12.674 0.089 -3.414 1.00 51.11 O ATOM 97 CB PHE A 586 -10.347 -1.884 -3.672 1.00 24.33 C ATOM 98 CG PHE A 586 -9.605 -3.157 -3.543 1.00 14.14 C ATOM 99 CD1 PHE A 586 -8.518 -3.218 -2.716 1.00 50.01 C ATOM 100 CD2 PHE A 586 -9.998 -4.296 -4.225 1.00 21.45 C ATOM 101 CE1 PHE A 586 -7.819 -4.374 -2.560 1.00 4.44 C ATOM 102 CE2 PHE A 586 -9.298 -5.474 -4.074 1.00 44.12 C ATOM 103 CZ PHE A 586 -8.202 -5.514 -3.236 1.00 50.11 C ATOM 0 H PHE A 586 -12.809 -2.722 -3.549 1.00 74.11 H new ATOM 0 HA PHE A 586 -10.818 -1.834 -1.594 1.00 25.03 H new ATOM 0 HB2 PHE A 586 -10.879 -1.872 -4.623 1.00 24.33 H new ATOM 0 HB3 PHE A 586 -9.640 -1.055 -3.692 1.00 24.33 H new ATOM 0 HD1 PHE A 586 -8.209 -2.334 -2.178 1.00 50.01 H new ATOM 0 HD2 PHE A 586 -10.857 -4.261 -4.878 1.00 21.45 H new ATOM 0 HE1 PHE A 586 -6.961 -4.400 -1.905 1.00 4.44 H new ATOM 0 HE2 PHE A 586 -9.606 -6.361 -4.608 1.00 44.12 H new ATOM 0 HZ PHE A 586 -7.648 -6.432 -3.110 1.00 50.11 H new ATOM 113 N LEU A 587 -11.408 0.500 -1.624 1.00 53.34 N ATOM 114 CA LEU A 587 -11.791 1.868 -1.549 1.00 11.02 C ATOM 115 C LEU A 587 -10.613 2.750 -1.683 1.00 72.21 C ATOM 116 O LEU A 587 -9.575 2.541 -1.049 1.00 24.22 O ATOM 117 CB LEU A 587 -12.556 2.183 -0.281 1.00 3.13 C ATOM 118 CG LEU A 587 -13.918 1.536 -0.165 1.00 1.35 C ATOM 119 CD1 LEU A 587 -14.545 1.878 1.159 1.00 32.33 C ATOM 120 CD2 LEU A 587 -14.818 1.993 -1.298 1.00 72.32 C ATOM 0 H LEU A 587 -10.765 0.200 -0.891 1.00 53.34 H new ATOM 0 HA LEU A 587 -12.466 2.056 -2.384 1.00 11.02 H new ATOM 0 HB2 LEU A 587 -11.953 1.875 0.573 1.00 3.13 H new ATOM 0 HB3 LEU A 587 -12.679 3.264 -0.211 1.00 3.13 H new ATOM 0 HG LEU A 587 -13.794 0.455 -0.229 1.00 1.35 H new ATOM 0 HD11 LEU A 587 -15.525 1.406 1.230 1.00 32.33 H new ATOM 0 HD12 LEU A 587 -13.909 1.517 1.967 1.00 32.33 H new ATOM 0 HD13 LEU A 587 -14.656 2.959 1.241 1.00 32.33 H new ATOM 0 HD21 LEU A 587 -15.795 1.519 -1.201 1.00 72.32 H new ATOM 0 HD22 LEU A 587 -14.935 3.076 -1.256 1.00 72.32 H new ATOM 0 HD23 LEU A 587 -14.372 1.713 -2.252 1.00 72.32 H new ATOM 132 N THR A 588 -10.753 3.703 -2.514 1.00 23.42 N ATOM 133 CA THR A 588 -9.738 4.648 -2.742 1.00 5.40 C ATOM 134 C THR A 588 -10.135 5.968 -2.113 1.00 10.23 C ATOM 135 O THR A 588 -11.202 6.527 -2.413 1.00 21.50 O ATOM 136 CB THR A 588 -9.517 4.817 -4.245 1.00 43.51 C ATOM 137 OG1 THR A 588 -9.249 3.522 -4.802 1.00 62.45 O ATOM 138 CG2 THR A 588 -8.337 5.732 -4.518 1.00 23.22 C ATOM 0 H THR A 588 -11.596 3.852 -3.068 1.00 23.42 H new ATOM 0 HA THR A 588 -8.807 4.305 -2.292 1.00 5.40 H new ATOM 0 HB THR A 588 -10.405 5.261 -4.695 1.00 43.51 H new ATOM 0 HG1 THR A 588 -9.105 3.605 -5.768 1.00 62.45 H new ATOM 0 HG21 THR A 588 -8.199 5.837 -5.594 1.00 23.22 H new ATOM 0 HG22 THR A 588 -8.527 6.712 -4.079 1.00 23.22 H new ATOM 0 HG23 THR A 588 -7.436 5.305 -4.077 1.00 23.22 H new ATOM 146 N PHE A 589 -9.310 6.438 -1.237 1.00 31.43 N ATOM 147 CA PHE A 589 -9.533 7.673 -0.569 1.00 44.44 C ATOM 148 C PHE A 589 -8.436 8.628 -0.918 1.00 10.44 C ATOM 149 O PHE A 589 -7.275 8.257 -0.921 1.00 22.24 O ATOM 150 CB PHE A 589 -9.576 7.466 0.944 1.00 44.14 C ATOM 151 CG PHE A 589 -10.699 6.590 1.360 1.00 55.25 C ATOM 152 CD1 PHE A 589 -11.976 6.912 0.990 1.00 54.44 C ATOM 153 CD2 PHE A 589 -10.486 5.439 2.097 1.00 75.11 C ATOM 154 CE1 PHE A 589 -13.025 6.130 1.335 1.00 14.43 C ATOM 155 CE2 PHE A 589 -11.549 4.634 2.456 1.00 14.14 C ATOM 156 CZ PHE A 589 -12.824 4.984 2.072 1.00 41.24 C ATOM 0 H PHE A 589 -8.449 5.966 -0.962 1.00 31.43 H new ATOM 0 HA PHE A 589 -10.492 8.080 -0.889 1.00 44.44 H new ATOM 0 HB2 PHE A 589 -8.634 7.028 1.276 1.00 44.14 H new ATOM 0 HB3 PHE A 589 -9.670 8.433 1.438 1.00 44.14 H new ATOM 0 HD1 PHE A 589 -12.150 7.807 0.412 1.00 54.44 H new ATOM 0 HD2 PHE A 589 -9.483 5.169 2.393 1.00 75.11 H new ATOM 0 HE1 PHE A 589 -14.024 6.406 1.031 1.00 14.43 H new ATOM 0 HE2 PHE A 589 -11.382 3.737 3.033 1.00 14.14 H new ATOM 0 HZ PHE A 589 -13.663 4.362 2.348 1.00 41.24 H new ATOM 166 N GLU A 590 -8.786 9.818 -1.241 1.00 31.02 N ATOM 167 CA GLU A 590 -7.811 10.823 -1.525 1.00 73.22 C ATOM 168 C GLU A 590 -7.835 11.838 -0.428 1.00 32.52 C ATOM 169 O GLU A 590 -8.891 12.360 -0.070 1.00 62.31 O ATOM 170 CB GLU A 590 -8.036 11.461 -2.890 1.00 72.12 C ATOM 171 CG GLU A 590 -7.864 10.485 -4.051 1.00 42.01 C ATOM 172 CD GLU A 590 -8.120 11.120 -5.391 1.00 32.10 C ATOM 173 OE1 GLU A 590 -7.292 11.925 -5.846 1.00 63.33 O ATOM 174 OE2 GLU A 590 -9.155 10.812 -6.027 1.00 24.43 O ATOM 0 H GLU A 590 -9.754 10.130 -1.318 1.00 31.02 H new ATOM 0 HA GLU A 590 -6.824 10.363 -1.568 1.00 73.22 H new ATOM 0 HB2 GLU A 590 -9.041 11.882 -2.925 1.00 72.12 H new ATOM 0 HB3 GLU A 590 -7.339 12.289 -3.015 1.00 72.12 H new ATOM 0 HG2 GLU A 590 -6.852 10.081 -4.033 1.00 42.01 H new ATOM 0 HG3 GLU A 590 -8.545 9.644 -3.917 1.00 42.01 H new ATOM 181 N VAL A 591 -6.703 12.099 0.112 1.00 35.12 N ATOM 182 CA VAL A 591 -6.580 12.986 1.221 1.00 32.30 C ATOM 183 C VAL A 591 -5.699 14.108 0.807 1.00 35.25 C ATOM 184 O VAL A 591 -4.541 13.890 0.491 1.00 71.12 O ATOM 185 CB VAL A 591 -5.915 12.246 2.424 1.00 22.31 C ATOM 186 CG1 VAL A 591 -5.757 13.163 3.629 1.00 52.03 C ATOM 187 CG2 VAL A 591 -6.732 11.043 2.815 1.00 21.44 C ATOM 0 H VAL A 591 -5.819 11.700 -0.204 1.00 35.12 H new ATOM 0 HA VAL A 591 -7.564 13.346 1.523 1.00 32.30 H new ATOM 0 HB VAL A 591 -4.923 11.928 2.102 1.00 22.31 H new ATOM 0 HG11 VAL A 591 -5.291 12.613 4.446 1.00 52.03 H new ATOM 0 HG12 VAL A 591 -5.130 14.013 3.360 1.00 52.03 H new ATOM 0 HG13 VAL A 591 -6.737 13.521 3.945 1.00 52.03 H new ATOM 0 HG21 VAL A 591 -6.256 10.537 3.655 1.00 21.44 H new ATOM 0 HG22 VAL A 591 -7.734 11.362 3.104 1.00 21.44 H new ATOM 0 HG23 VAL A 591 -6.799 10.358 1.970 1.00 21.44 H new ATOM 197 N PRO A 592 -6.209 15.311 0.756 1.00 44.23 N ATOM 198 CA PRO A 592 -5.391 16.440 0.475 1.00 42.42 C ATOM 199 C PRO A 592 -4.605 16.782 1.704 1.00 3.03 C ATOM 200 O PRO A 592 -5.092 16.611 2.837 1.00 64.23 O ATOM 201 CB PRO A 592 -6.378 17.540 0.120 1.00 50.20 C ATOM 202 CG PRO A 592 -7.618 17.170 0.828 1.00 22.15 C ATOM 203 CD PRO A 592 -7.621 15.672 0.942 1.00 70.52 C ATOM 0 HA PRO A 592 -4.673 16.278 -0.329 1.00 42.42 H new ATOM 0 HB2 PRO A 592 -6.015 18.517 0.440 1.00 50.20 H new ATOM 0 HB3 PRO A 592 -6.538 17.597 -0.957 1.00 50.20 H new ATOM 0 HG2 PRO A 592 -7.653 17.633 1.814 1.00 22.15 H new ATOM 0 HG3 PRO A 592 -8.494 17.518 0.281 1.00 22.15 H new ATOM 0 HD2 PRO A 592 -7.995 15.344 1.912 1.00 70.52 H new ATOM 0 HD3 PRO A 592 -8.256 15.213 0.184 1.00 70.52 H new ATOM 211 N LEU A 593 -3.409 17.219 1.517 1.00 32.22 N ATOM 212 CA LEU A 593 -2.590 17.556 2.629 1.00 75.15 C ATOM 213 C LEU A 593 -2.981 18.917 3.121 1.00 50.43 C ATOM 214 O LEU A 593 -2.445 19.941 2.699 1.00 62.31 O ATOM 215 CB LEU A 593 -1.099 17.435 2.303 1.00 64.32 C ATOM 216 CG LEU A 593 -0.639 16.029 1.862 1.00 71.42 C ATOM 217 CD1 LEU A 593 0.830 16.014 1.541 1.00 52.11 C ATOM 218 CD2 LEU A 593 -0.952 14.983 2.922 1.00 45.20 C ATOM 0 H LEU A 593 -2.975 17.352 0.603 1.00 32.22 H new ATOM 0 HA LEU A 593 -2.755 16.841 3.435 1.00 75.15 H new ATOM 0 HB2 LEU A 593 -0.857 18.145 1.512 1.00 64.32 H new ATOM 0 HB3 LEU A 593 -0.525 17.729 3.182 1.00 64.32 H new ATOM 0 HG LEU A 593 -1.195 15.778 0.959 1.00 71.42 H new ATOM 0 HD11 LEU A 593 1.125 15.011 1.234 1.00 52.11 H new ATOM 0 HD12 LEU A 593 1.033 16.716 0.732 1.00 52.11 H new ATOM 0 HD13 LEU A 593 1.398 16.305 2.424 1.00 52.11 H new ATOM 0 HD21 LEU A 593 -0.615 14.005 2.579 1.00 45.20 H new ATOM 0 HD22 LEU A 593 -0.439 15.239 3.849 1.00 45.20 H new ATOM 0 HD23 LEU A 593 -2.027 14.955 3.099 1.00 45.20 H new ATOM 230 N ASN A 594 -4.012 18.909 3.927 1.00 10.43 N ATOM 231 CA ASN A 594 -4.582 20.128 4.496 1.00 62.21 C ATOM 232 C ASN A 594 -3.589 20.742 5.449 1.00 61.43 C ATOM 233 O ASN A 594 -2.928 21.733 5.135 1.00 53.11 O ATOM 234 CB ASN A 594 -5.909 19.848 5.230 1.00 42.33 C ATOM 235 CG ASN A 594 -6.999 19.242 4.354 1.00 72.22 C ATOM 236 OD1 ASN A 594 -7.066 19.482 3.149 1.00 14.02 O ATOM 237 ND2 ASN A 594 -7.866 18.467 4.968 1.00 41.21 N ATOM 0 H ASN A 594 -4.491 18.056 4.216 1.00 10.43 H new ATOM 0 HA ASN A 594 -4.796 20.819 3.680 1.00 62.21 H new ATOM 0 HB2 ASN A 594 -5.713 19.174 6.064 1.00 42.33 H new ATOM 0 HB3 ASN A 594 -6.279 20.781 5.655 1.00 42.33 H new ATOM 0 HD21 ASN A 594 -8.629 18.040 4.443 1.00 41.21 H new ATOM 0 HD22 ASN A 594 -7.775 18.293 5.969 1.00 41.21 H new ATOM 244 N ASP A 595 -3.465 20.141 6.603 1.00 3.30 N ATOM 245 CA ASP A 595 -2.475 20.556 7.562 1.00 34.20 C ATOM 246 C ASP A 595 -1.342 19.602 7.448 1.00 4.00 C ATOM 247 O ASP A 595 -0.287 19.937 6.895 1.00 60.10 O ATOM 248 CB ASP A 595 -3.037 20.586 8.989 1.00 23.22 C ATOM 249 CG ASP A 595 -4.115 21.628 9.158 1.00 72.20 C ATOM 250 OD1 ASP A 595 -3.785 22.795 9.433 1.00 24.20 O ATOM 251 OD2 ASP A 595 -5.311 21.301 9.000 1.00 2.24 O ATOM 0 H ASP A 595 -4.043 19.356 6.903 1.00 3.30 H new ATOM 0 HA ASP A 595 -2.149 21.575 7.353 1.00 34.20 H new ATOM 0 HB2 ASP A 595 -3.441 19.605 9.239 1.00 23.22 H new ATOM 0 HB3 ASP A 595 -2.228 20.786 9.692 1.00 23.22 H new ATOM 256 N SER A 596 -1.569 18.396 7.953 1.00 3.44 N ATOM 257 CA SER A 596 -0.674 17.256 7.777 1.00 52.21 C ATOM 258 C SER A 596 0.708 17.433 8.400 1.00 35.25 C ATOM 259 O SER A 596 1.569 16.575 8.244 1.00 21.52 O ATOM 260 CB SER A 596 -0.568 16.936 6.293 1.00 62.10 C ATOM 261 OG SER A 596 -1.860 16.675 5.753 1.00 73.24 O ATOM 0 H SER A 596 -2.397 18.177 8.508 1.00 3.44 H new ATOM 0 HA SER A 596 -1.115 16.420 8.320 1.00 52.21 H new ATOM 0 HB2 SER A 596 -0.107 17.771 5.765 1.00 62.10 H new ATOM 0 HB3 SER A 596 0.078 16.070 6.145 1.00 62.10 H new ATOM 0 HG SER A 596 -2.101 15.740 5.920 1.00 73.24 H new ATOM 267 N GLY A 597 0.908 18.497 9.118 1.00 40.13 N ATOM 268 CA GLY A 597 2.197 18.735 9.687 1.00 24.35 C ATOM 269 C GLY A 597 2.431 17.897 10.917 1.00 33.05 C ATOM 270 O GLY A 597 3.501 17.292 11.080 1.00 1.41 O ATOM 0 H GLY A 597 0.203 19.206 9.321 1.00 40.13 H new ATOM 0 HA2 GLY A 597 2.967 18.516 8.947 1.00 24.35 H new ATOM 0 HA3 GLY A 597 2.292 19.790 9.943 1.00 24.35 H new ATOM 274 N SER A 598 1.435 17.835 11.772 1.00 74.31 N ATOM 275 CA SER A 598 1.535 17.068 12.987 1.00 0.24 C ATOM 276 C SER A 598 1.300 15.601 12.703 1.00 41.40 C ATOM 277 O SER A 598 1.962 14.716 13.260 1.00 12.23 O ATOM 278 CB SER A 598 0.568 17.604 14.026 1.00 62.11 C ATOM 279 OG SER A 598 0.799 18.992 14.246 1.00 53.41 O ATOM 0 H SER A 598 0.542 18.311 11.644 1.00 74.31 H new ATOM 0 HA SER A 598 2.542 17.166 13.392 1.00 0.24 H new ATOM 0 HB2 SER A 598 -0.458 17.447 13.693 1.00 62.11 H new ATOM 0 HB3 SER A 598 0.687 17.056 14.961 1.00 62.11 H new ATOM 0 HG SER A 598 0.168 19.326 14.917 1.00 53.41 H new ATOM 285 N ALA A 599 0.403 15.357 11.827 1.00 42.23 N ATOM 286 CA ALA A 599 0.086 14.056 11.390 1.00 22.11 C ATOM 287 C ALA A 599 -0.273 14.176 9.951 1.00 11.11 C ATOM 288 O ALA A 599 -1.119 14.994 9.600 1.00 41.32 O ATOM 289 CB ALA A 599 -1.053 13.474 12.201 1.00 3.41 C ATOM 0 H ALA A 599 -0.151 16.086 11.378 1.00 42.23 H new ATOM 0 HA ALA A 599 0.928 13.377 11.523 1.00 22.11 H new ATOM 0 HB1 ALA A 599 -1.278 12.469 11.843 1.00 3.41 H new ATOM 0 HB2 ALA A 599 -0.766 13.430 13.252 1.00 3.41 H new ATOM 0 HB3 ALA A 599 -1.936 14.104 12.092 1.00 3.41 H new ATOM 295 N GLY A 600 0.365 13.392 9.138 1.00 1.45 N ATOM 296 CA GLY A 600 0.229 13.490 7.707 1.00 41.10 C ATOM 297 C GLY A 600 -1.172 13.254 7.273 1.00 13.21 C ATOM 298 O GLY A 600 -1.773 14.080 6.583 1.00 60.35 O ATOM 0 H GLY A 600 1.002 12.657 9.446 1.00 1.45 H new ATOM 0 HA2 GLY A 600 0.551 14.478 7.377 1.00 41.10 H new ATOM 0 HA3 GLY A 600 0.886 12.764 7.228 1.00 41.10 H new ATOM 302 N LEU A 601 -1.709 12.152 7.672 1.00 2.32 N ATOM 303 CA LEU A 601 -3.063 11.844 7.348 1.00 21.22 C ATOM 304 C LEU A 601 -3.874 11.950 8.588 1.00 33.33 C ATOM 305 O LEU A 601 -5.081 12.240 8.548 1.00 62.51 O ATOM 306 CB LEU A 601 -3.191 10.432 6.753 1.00 44.21 C ATOM 307 CG LEU A 601 -2.289 10.122 5.564 1.00 25.32 C ATOM 308 CD1 LEU A 601 -2.770 8.925 4.797 1.00 12.10 C ATOM 309 CD2 LEU A 601 -2.132 11.291 4.656 1.00 43.31 C ATOM 0 H LEU A 601 -1.229 11.444 8.227 1.00 2.32 H new ATOM 0 HA LEU A 601 -3.420 12.547 6.596 1.00 21.22 H new ATOM 0 HB2 LEU A 601 -2.982 9.708 7.540 1.00 44.21 H new ATOM 0 HB3 LEU A 601 -4.226 10.281 6.447 1.00 44.21 H new ATOM 0 HG LEU A 601 -1.308 9.890 5.979 1.00 25.32 H new ATOM 0 HD11 LEU A 601 -2.100 8.737 3.958 1.00 12.10 H new ATOM 0 HD12 LEU A 601 -2.783 8.054 5.452 1.00 12.10 H new ATOM 0 HD13 LEU A 601 -3.776 9.113 4.423 1.00 12.10 H new ATOM 0 HD21 LEU A 601 -1.481 11.021 3.824 1.00 43.31 H new ATOM 0 HD22 LEU A 601 -3.108 11.587 4.271 1.00 43.31 H new ATOM 0 HD23 LEU A 601 -1.692 12.123 5.206 1.00 43.31 H new ATOM 321 N GLY A 602 -3.204 11.728 9.696 1.00 42.21 N ATOM 322 CA GLY A 602 -3.827 11.756 10.948 1.00 73.22 C ATOM 323 C GLY A 602 -4.528 10.478 11.172 1.00 32.41 C ATOM 324 O GLY A 602 -5.705 10.434 11.519 1.00 44.33 O ATOM 0 H GLY A 602 -2.205 11.524 9.727 1.00 42.21 H new ATOM 0 HA2 GLY A 602 -3.087 11.920 11.732 1.00 73.22 H new ATOM 0 HA3 GLY A 602 -4.533 12.585 10.997 1.00 73.22 H new ATOM 328 N VAL A 603 -3.818 9.417 10.921 1.00 62.53 N ATOM 329 CA VAL A 603 -4.313 8.116 11.166 1.00 74.22 C ATOM 330 C VAL A 603 -3.201 7.357 11.822 1.00 43.32 C ATOM 331 O VAL A 603 -2.026 7.677 11.631 1.00 11.21 O ATOM 332 CB VAL A 603 -4.703 7.368 9.838 1.00 12.33 C ATOM 333 CG1 VAL A 603 -5.416 6.068 10.116 1.00 44.22 C ATOM 334 CG2 VAL A 603 -5.513 8.238 8.898 1.00 73.01 C ATOM 0 H VAL A 603 -2.873 9.442 10.538 1.00 62.53 H new ATOM 0 HA VAL A 603 -5.210 8.182 11.781 1.00 74.22 H new ATOM 0 HB VAL A 603 -3.765 7.136 9.334 1.00 12.33 H new ATOM 0 HG11 VAL A 603 -5.668 5.582 9.173 1.00 44.22 H new ATOM 0 HG12 VAL A 603 -4.767 5.414 10.699 1.00 44.22 H new ATOM 0 HG13 VAL A 603 -6.329 6.267 10.677 1.00 44.22 H new ATOM 0 HG21 VAL A 603 -5.755 7.673 7.998 1.00 73.01 H new ATOM 0 HG22 VAL A 603 -6.434 8.547 9.392 1.00 73.01 H new ATOM 0 HG23 VAL A 603 -4.933 9.120 8.628 1.00 73.01 H new ATOM 344 N SER A 604 -3.532 6.407 12.598 1.00 40.20 N ATOM 345 CA SER A 604 -2.562 5.558 13.132 1.00 11.10 C ATOM 346 C SER A 604 -2.786 4.211 12.538 1.00 52.25 C ATOM 347 O SER A 604 -3.935 3.753 12.420 1.00 63.41 O ATOM 348 CB SER A 604 -2.671 5.487 14.647 1.00 14.20 C ATOM 349 OG SER A 604 -2.582 6.773 15.230 1.00 45.54 O ATOM 0 H SER A 604 -4.490 6.198 12.880 1.00 40.20 H new ATOM 0 HA SER A 604 -1.565 5.931 12.899 1.00 11.10 H new ATOM 0 HB2 SER A 604 -3.618 5.025 14.924 1.00 14.20 H new ATOM 0 HB3 SER A 604 -1.878 4.851 15.041 1.00 14.20 H new ATOM 0 HG SER A 604 -2.657 6.696 16.204 1.00 45.54 H new ATOM 355 N VAL A 605 -1.750 3.584 12.171 1.00 43.35 N ATOM 356 CA VAL A 605 -1.828 2.282 11.644 1.00 33.04 C ATOM 357 C VAL A 605 -0.978 1.332 12.418 1.00 45.44 C ATOM 358 O VAL A 605 -0.100 1.731 13.162 1.00 72.31 O ATOM 359 CB VAL A 605 -1.453 2.180 10.167 1.00 23.43 C ATOM 360 CG1 VAL A 605 -2.602 2.590 9.259 1.00 31.43 C ATOM 361 CG2 VAL A 605 -0.217 3.005 9.831 1.00 13.15 C ATOM 0 H VAL A 605 -0.804 3.962 12.227 1.00 43.35 H new ATOM 0 HA VAL A 605 -2.881 2.014 11.733 1.00 33.04 H new ATOM 0 HB VAL A 605 -1.226 1.129 9.988 1.00 23.43 H new ATOM 0 HG11 VAL A 605 -2.292 2.502 8.218 1.00 31.43 H new ATOM 0 HG12 VAL A 605 -3.458 1.939 9.439 1.00 31.43 H new ATOM 0 HG13 VAL A 605 -2.881 3.623 9.469 1.00 31.43 H new ATOM 0 HG21 VAL A 605 0.012 2.902 8.770 1.00 13.15 H new ATOM 0 HG22 VAL A 605 -0.406 4.054 10.061 1.00 13.15 H new ATOM 0 HG23 VAL A 605 0.628 2.651 10.421 1.00 13.15 H new ATOM 371 N LYS A 606 -1.252 0.098 12.229 1.00 42.23 N ATOM 372 CA LYS A 606 -0.573 -0.985 12.886 1.00 54.04 C ATOM 373 C LYS A 606 -0.380 -2.072 11.872 1.00 12.13 C ATOM 374 O LYS A 606 -1.135 -2.162 10.914 1.00 71.13 O ATOM 375 CB LYS A 606 -1.395 -1.583 14.054 1.00 3.22 C ATOM 376 CG LYS A 606 -2.719 -2.206 13.579 1.00 65.45 C ATOM 377 CD LYS A 606 -3.342 -3.249 14.523 1.00 10.33 C ATOM 378 CE LYS A 606 -3.858 -2.721 15.865 1.00 44.22 C ATOM 379 NZ LYS A 606 -2.796 -2.354 16.806 1.00 24.22 N ATOM 0 H LYS A 606 -1.983 -0.213 11.589 1.00 42.23 H new ATOM 0 HA LYS A 606 0.363 -0.602 13.292 1.00 54.04 H new ATOM 0 HB2 LYS A 606 -0.801 -2.342 14.562 1.00 3.22 H new ATOM 0 HB3 LYS A 606 -1.605 -0.802 14.784 1.00 3.22 H new ATOM 0 HG2 LYS A 606 -3.442 -1.405 13.425 1.00 65.45 H new ATOM 0 HG3 LYS A 606 -2.551 -2.675 12.609 1.00 65.45 H new ATOM 0 HD2 LYS A 606 -4.170 -3.731 14.003 1.00 10.33 H new ATOM 0 HD3 LYS A 606 -2.598 -4.020 14.721 1.00 10.33 H new ATOM 0 HE2 LYS A 606 -4.487 -1.849 15.684 1.00 44.22 H new ATOM 0 HE3 LYS A 606 -4.491 -3.481 16.324 1.00 44.22 H new ATOM 0 HZ1 LYS A 606 -3.162 -2.400 17.778 1.00 24.22 H new ATOM 0 HZ2 LYS A 606 -1.999 -3.014 16.705 1.00 24.22 H new ATOM 0 HZ3 LYS A 606 -2.472 -1.387 16.604 1.00 24.22 H new ATOM 393 N GLY A 607 0.608 -2.850 12.043 1.00 63.34 N ATOM 394 CA GLY A 607 0.776 -3.961 11.184 1.00 35.43 C ATOM 395 C GLY A 607 0.497 -5.217 11.917 1.00 65.35 C ATOM 396 O GLY A 607 1.175 -5.526 12.902 1.00 54.50 O ATOM 0 H GLY A 607 1.318 -2.745 12.768 1.00 63.34 H new ATOM 0 HA2 GLY A 607 0.106 -3.874 10.328 1.00 35.43 H new ATOM 0 HA3 GLY A 607 1.793 -3.977 10.792 1.00 35.43 H new ATOM 400 N ASN A 608 -0.494 -5.938 11.483 1.00 74.41 N ATOM 401 CA ASN A 608 -0.827 -7.162 12.141 1.00 54.14 C ATOM 402 C ASN A 608 -0.141 -8.296 11.429 1.00 63.40 C ATOM 403 O ASN A 608 -0.134 -8.374 10.191 1.00 14.23 O ATOM 404 CB ASN A 608 -2.348 -7.370 12.257 1.00 3.43 C ATOM 405 CG ASN A 608 -2.711 -8.622 13.051 1.00 3.14 C ATOM 406 OD1 ASN A 608 -1.945 -9.079 13.902 1.00 30.31 O ATOM 407 ND2 ASN A 608 -3.890 -9.139 12.829 1.00 24.01 N ATOM 0 H ASN A 608 -1.080 -5.701 10.683 1.00 74.41 H new ATOM 0 HA ASN A 608 -0.469 -7.123 13.170 1.00 54.14 H new ATOM 0 HB2 ASN A 608 -2.795 -6.499 12.736 1.00 3.43 H new ATOM 0 HB3 ASN A 608 -2.778 -7.440 11.258 1.00 3.43 H new ATOM 0 HD21 ASN A 608 -4.202 -9.947 13.368 1.00 24.01 H new ATOM 0 HD22 ASN A 608 -4.498 -8.735 12.117 1.00 24.01 H new ATOM 414 N ARG A 609 0.481 -9.117 12.187 1.00 74.54 N ATOM 415 CA ARG A 609 1.270 -10.187 11.693 1.00 55.42 C ATOM 416 C ARG A 609 0.952 -11.431 12.472 1.00 23.10 C ATOM 417 O ARG A 609 1.019 -11.430 13.704 1.00 10.52 O ATOM 418 CB ARG A 609 2.736 -9.805 11.824 1.00 70.23 C ATOM 419 CG ARG A 609 3.742 -10.842 11.375 1.00 20.30 C ATOM 420 CD ARG A 609 5.150 -10.288 11.534 1.00 31.21 C ATOM 421 NE ARG A 609 5.403 -9.863 12.916 1.00 33.03 N ATOM 422 CZ ARG A 609 5.741 -8.616 13.293 1.00 35.25 C ATOM 423 NH1 ARG A 609 5.907 -7.653 12.394 1.00 33.20 N ATOM 424 NH2 ARG A 609 5.905 -8.327 14.569 1.00 34.32 N ATOM 0 H ARG A 609 0.456 -9.064 13.205 1.00 74.54 H new ATOM 0 HA ARG A 609 1.054 -10.382 10.643 1.00 55.42 H new ATOM 0 HB2 ARG A 609 2.905 -8.894 11.250 1.00 70.23 H new ATOM 0 HB3 ARG A 609 2.935 -9.565 12.869 1.00 70.23 H new ATOM 0 HG2 ARG A 609 3.629 -11.752 11.964 1.00 20.30 H new ATOM 0 HG3 ARG A 609 3.562 -11.112 10.334 1.00 20.30 H new ATOM 0 HD2 ARG A 609 5.877 -11.048 11.246 1.00 31.21 H new ATOM 0 HD3 ARG A 609 5.289 -9.443 10.860 1.00 31.21 H new ATOM 0 HE ARG A 609 5.316 -10.568 13.648 1.00 33.03 H new ATOM 0 HH11 ARG A 609 5.778 -7.853 11.402 1.00 33.20 H new ATOM 0 HH12 ARG A 609 6.163 -6.713 12.695 1.00 33.20 H new ATOM 0 HH21 ARG A 609 5.776 -9.050 15.276 1.00 34.32 H new ATOM 0 HH22 ARG A 609 6.161 -7.380 14.849 1.00 34.32 H new ATOM 438 N SER A 610 0.602 -12.461 11.784 1.00 33.32 N ATOM 439 CA SER A 610 0.273 -13.703 12.411 1.00 61.04 C ATOM 440 C SER A 610 1.555 -14.421 12.796 1.00 22.34 C ATOM 441 O SER A 610 2.379 -14.750 11.932 1.00 23.22 O ATOM 442 CB SER A 610 -0.545 -14.548 11.447 1.00 62.43 C ATOM 443 OG SER A 610 -1.694 -13.843 11.031 1.00 72.24 O ATOM 0 H SER A 610 0.534 -12.471 10.766 1.00 33.32 H new ATOM 0 HA SER A 610 -0.316 -13.528 13.311 1.00 61.04 H new ATOM 0 HB2 SER A 610 0.061 -14.813 10.581 1.00 62.43 H new ATOM 0 HB3 SER A 610 -0.837 -15.481 11.929 1.00 62.43 H new ATOM 0 HG SER A 610 -2.358 -14.475 10.684 1.00 72.24 H new ATOM 449 N LYS A 611 1.746 -14.648 14.076 1.00 33.41 N ATOM 450 CA LYS A 611 2.954 -15.298 14.545 1.00 24.45 C ATOM 451 C LYS A 611 2.887 -16.795 14.309 1.00 12.41 C ATOM 452 O LYS A 611 3.858 -17.410 13.884 1.00 45.13 O ATOM 453 CB LYS A 611 3.217 -15.013 16.023 1.00 24.41 C ATOM 454 CG LYS A 611 3.347 -13.535 16.370 1.00 12.20 C ATOM 455 CD LYS A 611 3.777 -13.334 17.823 1.00 62.42 C ATOM 456 CE LYS A 611 5.170 -13.922 18.067 1.00 0.45 C ATOM 457 NZ LYS A 611 5.641 -13.719 19.448 1.00 62.10 N ATOM 0 H LYS A 611 1.085 -14.394 14.810 1.00 33.41 H new ATOM 0 HA LYS A 611 3.783 -14.884 13.971 1.00 24.45 H new ATOM 0 HB2 LYS A 611 2.406 -15.441 16.612 1.00 24.41 H new ATOM 0 HB3 LYS A 611 4.132 -15.525 16.321 1.00 24.41 H new ATOM 0 HG2 LYS A 611 4.075 -13.068 15.707 1.00 12.20 H new ATOM 0 HG3 LYS A 611 2.393 -13.035 16.200 1.00 12.20 H new ATOM 0 HD2 LYS A 611 3.780 -12.270 18.062 1.00 62.42 H new ATOM 0 HD3 LYS A 611 3.056 -13.808 18.489 1.00 62.42 H new ATOM 0 HE2 LYS A 611 5.152 -14.989 17.847 1.00 0.45 H new ATOM 0 HE3 LYS A 611 5.878 -13.466 17.376 1.00 0.45 H new ATOM 0 HZ1 LYS A 611 6.523 -14.250 19.596 1.00 62.10 H new ATOM 0 HZ2 LYS A 611 5.815 -12.707 19.610 1.00 62.10 H new ATOM 0 HZ3 LYS A 611 4.918 -14.057 20.115 1.00 62.10 H new ATOM 471 N GLU A 612 1.727 -17.364 14.547 1.00 51.31 N ATOM 472 CA GLU A 612 1.537 -18.787 14.387 1.00 44.44 C ATOM 473 C GLU A 612 1.503 -19.149 12.918 1.00 24.42 C ATOM 474 O GLU A 612 2.121 -20.114 12.493 1.00 53.12 O ATOM 475 CB GLU A 612 0.255 -19.237 15.087 1.00 1.11 C ATOM 476 CG GLU A 612 -0.026 -20.724 14.976 1.00 42.41 C ATOM 477 CD GLU A 612 -1.267 -21.128 15.715 1.00 3.12 C ATOM 478 OE1 GLU A 612 -2.371 -21.072 15.130 1.00 11.32 O ATOM 479 OE2 GLU A 612 -1.162 -21.504 16.903 1.00 74.42 O ATOM 0 H GLU A 612 0.896 -16.859 14.854 1.00 51.31 H new ATOM 0 HA GLU A 612 2.376 -19.306 14.849 1.00 44.44 H new ATOM 0 HB2 GLU A 612 0.317 -18.968 16.142 1.00 1.11 H new ATOM 0 HB3 GLU A 612 -0.587 -18.687 14.667 1.00 1.11 H new ATOM 0 HG2 GLU A 612 -0.128 -20.994 13.925 1.00 42.41 H new ATOM 0 HG3 GLU A 612 0.825 -21.282 15.367 1.00 42.41 H new ATOM 486 N ASN A 613 0.809 -18.348 12.141 1.00 74.23 N ATOM 487 CA ASN A 613 0.696 -18.594 10.703 1.00 23.32 C ATOM 488 C ASN A 613 1.974 -18.136 9.979 1.00 0.20 C ATOM 489 O ASN A 613 2.214 -18.477 8.812 1.00 62.13 O ATOM 490 CB ASN A 613 -0.563 -17.906 10.144 1.00 61.33 C ATOM 491 CG ASN A 613 -0.842 -18.236 8.691 1.00 61.44 C ATOM 492 OD1 ASN A 613 -0.411 -17.530 7.783 1.00 21.40 O ATOM 493 ND2 ASN A 613 -1.543 -19.318 8.469 1.00 52.44 N ATOM 0 H ASN A 613 0.312 -17.520 12.470 1.00 74.23 H new ATOM 0 HA ASN A 613 0.590 -19.665 10.528 1.00 23.32 H new ATOM 0 HB2 ASN A 613 -1.424 -18.198 10.746 1.00 61.33 H new ATOM 0 HB3 ASN A 613 -0.453 -16.827 10.248 1.00 61.33 H new ATOM 0 HD21 ASN A 613 -1.751 -19.604 7.512 1.00 52.44 H new ATOM 0 HD22 ASN A 613 -1.882 -19.876 9.253 1.00 52.44 H new ATOM 500 N HIS A 614 2.796 -17.361 10.708 1.00 42.44 N ATOM 501 CA HIS A 614 4.113 -16.870 10.241 1.00 22.14 C ATOM 502 C HIS A 614 4.017 -15.962 9.022 1.00 33.51 C ATOM 503 O HIS A 614 5.003 -15.748 8.320 1.00 35.10 O ATOM 504 CB HIS A 614 5.094 -18.030 9.991 1.00 63.22 C ATOM 505 CG HIS A 614 5.504 -18.757 11.238 1.00 32.14 C ATOM 506 ND1 HIS A 614 5.047 -20.011 11.573 1.00 40.45 N ATOM 507 CD2 HIS A 614 6.350 -18.397 12.227 1.00 24.24 C ATOM 508 CE1 HIS A 614 5.596 -20.389 12.708 1.00 13.23 C ATOM 509 NE2 HIS A 614 6.391 -19.429 13.127 1.00 53.44 N ATOM 0 H HIS A 614 2.565 -17.051 11.652 1.00 42.44 H new ATOM 0 HA HIS A 614 4.508 -16.258 11.052 1.00 22.14 H new ATOM 0 HB2 HIS A 614 4.635 -18.739 9.303 1.00 63.22 H new ATOM 0 HB3 HIS A 614 5.985 -17.640 9.499 1.00 63.22 H new ATOM 0 HD2 HIS A 614 6.894 -17.467 12.296 1.00 24.24 H new ATOM 0 HE1 HIS A 614 5.423 -21.329 13.210 1.00 13.23 H new ATOM 0 HE2 HIS A 614 6.947 -19.449 13.982 1.00 53.44 H new ATOM 518 N ALA A 615 2.862 -15.389 8.816 1.00 64.22 N ATOM 519 CA ALA A 615 2.629 -14.509 7.700 1.00 24.11 C ATOM 520 C ALA A 615 2.099 -13.197 8.208 1.00 63.50 C ATOM 521 O ALA A 615 1.493 -13.146 9.280 1.00 33.20 O ATOM 522 CB ALA A 615 1.633 -15.131 6.744 1.00 32.53 C ATOM 0 H ALA A 615 2.051 -15.519 9.420 1.00 64.22 H new ATOM 0 HA ALA A 615 3.566 -14.344 7.168 1.00 24.11 H new ATOM 0 HB1 ALA A 615 1.465 -14.457 5.904 1.00 32.53 H new ATOM 0 HB2 ALA A 615 2.026 -16.079 6.375 1.00 32.53 H new ATOM 0 HB3 ALA A 615 0.691 -15.306 7.263 1.00 32.53 H new ATOM 528 N ASP A 616 2.324 -12.148 7.474 1.00 75.25 N ATOM 529 CA ASP A 616 1.816 -10.863 7.859 1.00 73.40 C ATOM 530 C ASP A 616 0.424 -10.732 7.313 1.00 11.05 C ATOM 531 O ASP A 616 0.092 -11.339 6.293 1.00 24.24 O ATOM 532 CB ASP A 616 2.682 -9.709 7.326 1.00 10.44 C ATOM 533 CG ASP A 616 2.574 -9.500 5.825 1.00 20.44 C ATOM 534 OD1 ASP A 616 3.268 -10.201 5.061 1.00 71.44 O ATOM 535 OD2 ASP A 616 1.791 -8.630 5.394 1.00 65.45 O ATOM 0 H ASP A 616 2.857 -12.156 6.604 1.00 75.25 H new ATOM 0 HA ASP A 616 1.827 -10.798 8.947 1.00 73.40 H new ATOM 0 HB2 ASP A 616 2.394 -8.788 7.833 1.00 10.44 H new ATOM 0 HB3 ASP A 616 3.724 -9.901 7.582 1.00 10.44 H new ATOM 540 N LEU A 617 -0.392 -9.983 7.983 1.00 50.21 N ATOM 541 CA LEU A 617 -1.730 -9.759 7.523 1.00 43.43 C ATOM 542 C LEU A 617 -1.816 -8.403 6.860 1.00 22.44 C ATOM 543 O LEU A 617 -2.830 -8.049 6.259 1.00 34.55 O ATOM 544 CB LEU A 617 -2.732 -9.891 8.674 1.00 21.53 C ATOM 545 CG LEU A 617 -2.761 -11.253 9.375 1.00 61.01 C ATOM 546 CD1 LEU A 617 -3.838 -11.283 10.440 1.00 31.40 C ATOM 547 CD2 LEU A 617 -2.965 -12.386 8.372 1.00 54.55 C ATOM 0 H LEU A 617 -0.156 -9.512 8.856 1.00 50.21 H new ATOM 0 HA LEU A 617 -1.989 -10.519 6.786 1.00 43.43 H new ATOM 0 HB2 LEU A 617 -2.508 -9.125 9.417 1.00 21.53 H new ATOM 0 HB3 LEU A 617 -3.730 -9.679 8.289 1.00 21.53 H new ATOM 0 HG LEU A 617 -1.795 -11.402 9.857 1.00 61.01 H new ATOM 0 HD11 LEU A 617 -3.842 -12.259 10.926 1.00 31.40 H new ATOM 0 HD12 LEU A 617 -3.638 -10.509 11.181 1.00 31.40 H new ATOM 0 HD13 LEU A 617 -4.810 -11.103 9.980 1.00 31.40 H new ATOM 0 HD21 LEU A 617 -2.981 -13.340 8.899 1.00 54.55 H new ATOM 0 HD22 LEU A 617 -3.911 -12.244 7.850 1.00 54.55 H new ATOM 0 HD23 LEU A 617 -2.148 -12.384 7.650 1.00 54.55 H new ATOM 559 N GLY A 618 -0.730 -7.677 6.926 1.00 63.31 N ATOM 560 CA GLY A 618 -0.670 -6.367 6.326 1.00 54.22 C ATOM 561 C GLY A 618 -0.778 -5.257 7.341 1.00 34.53 C ATOM 562 O GLY A 618 -0.743 -5.503 8.558 1.00 24.42 O ATOM 0 H GLY A 618 0.129 -7.971 7.391 1.00 63.31 H new ATOM 0 HA2 GLY A 618 0.268 -6.265 5.780 1.00 54.22 H new ATOM 0 HA3 GLY A 618 -1.475 -6.268 5.598 1.00 54.22 H new ATOM 566 N ILE A 619 -0.885 -4.045 6.858 1.00 11.22 N ATOM 567 CA ILE A 619 -1.034 -2.879 7.701 1.00 12.45 C ATOM 568 C ILE A 619 -2.520 -2.534 7.806 1.00 35.21 C ATOM 569 O ILE A 619 -3.231 -2.551 6.811 1.00 52.22 O ATOM 570 CB ILE A 619 -0.248 -1.663 7.114 1.00 15.15 C ATOM 571 CG1 ILE A 619 1.242 -2.006 6.928 1.00 71.33 C ATOM 572 CG2 ILE A 619 -0.385 -0.440 8.006 1.00 44.24 C ATOM 573 CD1 ILE A 619 1.968 -2.389 8.203 1.00 61.44 C ATOM 0 H ILE A 619 -0.871 -3.835 5.860 1.00 11.22 H new ATOM 0 HA ILE A 619 -0.628 -3.099 8.689 1.00 12.45 H new ATOM 0 HB ILE A 619 -0.681 -1.436 6.140 1.00 15.15 H new ATOM 0 HG12 ILE A 619 1.326 -2.828 6.217 1.00 71.33 H new ATOM 0 HG13 ILE A 619 1.746 -1.148 6.483 1.00 71.33 H new ATOM 0 HG21 ILE A 619 0.172 0.391 7.573 1.00 44.24 H new ATOM 0 HG22 ILE A 619 -1.437 -0.167 8.090 1.00 44.24 H new ATOM 0 HG23 ILE A 619 0.011 -0.666 8.996 1.00 44.24 H new ATOM 0 HD11 ILE A 619 3.010 -2.613 7.975 1.00 61.44 H new ATOM 0 HD12 ILE A 619 1.922 -1.561 8.911 1.00 61.44 H new ATOM 0 HD13 ILE A 619 1.495 -3.268 8.641 1.00 61.44 H new ATOM 585 N PHE A 620 -2.976 -2.254 8.997 1.00 64.34 N ATOM 586 CA PHE A 620 -4.371 -1.947 9.245 1.00 71.14 C ATOM 587 C PHE A 620 -4.478 -0.671 10.041 1.00 2.33 C ATOM 588 O PHE A 620 -3.588 -0.367 10.847 1.00 22.32 O ATOM 589 CB PHE A 620 -5.026 -3.053 10.079 1.00 51.05 C ATOM 590 CG PHE A 620 -5.019 -4.425 9.477 1.00 44.21 C ATOM 591 CD1 PHE A 620 -3.930 -5.270 9.651 1.00 42.22 C ATOM 592 CD2 PHE A 620 -6.117 -4.890 8.761 1.00 53.03 C ATOM 593 CE1 PHE A 620 -3.944 -6.541 9.126 1.00 52.42 C ATOM 594 CE2 PHE A 620 -6.125 -6.161 8.232 1.00 3.23 C ATOM 595 CZ PHE A 620 -5.041 -6.988 8.416 1.00 51.21 C ATOM 0 H PHE A 620 -2.391 -2.231 9.832 1.00 64.34 H new ATOM 0 HA PHE A 620 -4.868 -1.853 8.279 1.00 71.14 H new ATOM 0 HB2 PHE A 620 -4.521 -3.099 11.044 1.00 51.05 H new ATOM 0 HB3 PHE A 620 -6.060 -2.769 10.273 1.00 51.05 H new ATOM 0 HD1 PHE A 620 -3.067 -4.927 10.202 1.00 42.22 H new ATOM 0 HD2 PHE A 620 -6.973 -4.247 8.618 1.00 53.03 H new ATOM 0 HE1 PHE A 620 -3.094 -7.192 9.269 1.00 52.42 H new ATOM 0 HE2 PHE A 620 -6.981 -6.509 7.673 1.00 3.23 H new ATOM 0 HZ PHE A 620 -5.048 -7.987 8.005 1.00 51.21 H new ATOM 605 N VAL A 621 -5.528 0.078 9.818 1.00 24.02 N ATOM 606 CA VAL A 621 -5.798 1.244 10.638 1.00 74.54 C ATOM 607 C VAL A 621 -6.141 0.816 12.060 1.00 70.22 C ATOM 608 O VAL A 621 -7.006 -0.024 12.281 1.00 31.13 O ATOM 609 CB VAL A 621 -6.936 2.114 10.062 1.00 14.43 C ATOM 610 CG1 VAL A 621 -7.274 3.255 11.001 1.00 74.33 C ATOM 611 CG2 VAL A 621 -6.539 2.665 8.715 1.00 2.12 C ATOM 0 H VAL A 621 -6.211 -0.093 9.080 1.00 24.02 H new ATOM 0 HA VAL A 621 -4.893 1.852 10.644 1.00 74.54 H new ATOM 0 HB VAL A 621 -7.819 1.484 9.949 1.00 14.43 H new ATOM 0 HG11 VAL A 621 -8.078 3.853 10.572 1.00 74.33 H new ATOM 0 HG12 VAL A 621 -7.594 2.853 11.962 1.00 74.33 H new ATOM 0 HG13 VAL A 621 -6.393 3.881 11.144 1.00 74.33 H new ATOM 0 HG21 VAL A 621 -7.350 3.277 8.319 1.00 2.12 H new ATOM 0 HG22 VAL A 621 -5.642 3.275 8.822 1.00 2.12 H new ATOM 0 HG23 VAL A 621 -6.338 1.841 8.030 1.00 2.12 H new ATOM 621 N LYS A 622 -5.451 1.367 13.008 1.00 23.12 N ATOM 622 CA LYS A 622 -5.687 1.051 14.399 1.00 75.32 C ATOM 623 C LYS A 622 -6.573 2.100 15.051 1.00 41.51 C ATOM 624 O LYS A 622 -7.493 1.772 15.788 1.00 52.03 O ATOM 625 CB LYS A 622 -4.363 0.938 15.165 1.00 53.24 C ATOM 626 CG LYS A 622 -3.464 2.114 14.911 1.00 12.32 C ATOM 627 CD LYS A 622 -2.262 2.185 15.789 1.00 53.22 C ATOM 628 CE LYS A 622 -2.682 2.483 17.250 1.00 44.23 C ATOM 629 NZ LYS A 622 -1.542 2.759 18.161 1.00 41.20 N ATOM 0 H LYS A 622 -4.708 2.048 12.850 1.00 23.12 H new ATOM 0 HA LYS A 622 -6.198 0.089 14.438 1.00 75.32 H new ATOM 0 HB2 LYS A 622 -4.567 0.862 16.233 1.00 53.24 H new ATOM 0 HB3 LYS A 622 -3.852 0.021 14.872 1.00 53.24 H new ATOM 0 HG2 LYS A 622 -3.136 2.084 13.872 1.00 12.32 H new ATOM 0 HG3 LYS A 622 -4.043 3.029 15.037 1.00 12.32 H new ATOM 0 HD2 LYS A 622 -1.715 1.243 15.745 1.00 53.22 H new ATOM 0 HD3 LYS A 622 -1.587 2.963 15.431 1.00 53.22 H new ATOM 0 HE2 LYS A 622 -3.355 3.341 17.256 1.00 44.23 H new ATOM 0 HE3 LYS A 622 -3.245 1.633 17.636 1.00 44.23 H new ATOM 0 HZ1 LYS A 622 -1.838 3.436 18.893 1.00 41.20 H new ATOM 0 HZ2 LYS A 622 -1.236 1.873 18.612 1.00 41.20 H new ATOM 0 HZ3 LYS A 622 -0.752 3.161 17.617 1.00 41.20 H new ATOM 643 N SER A 623 -6.280 3.353 14.783 1.00 32.52 N ATOM 644 CA SER A 623 -6.981 4.449 15.383 1.00 12.41 C ATOM 645 C SER A 623 -6.981 5.627 14.417 1.00 2.23 C ATOM 646 O SER A 623 -6.030 5.805 13.644 1.00 62.21 O ATOM 647 CB SER A 623 -6.299 4.816 16.720 1.00 3.53 C ATOM 648 OG SER A 623 -6.965 5.868 17.400 1.00 14.54 O ATOM 0 H SER A 623 -5.542 3.634 14.137 1.00 32.52 H new ATOM 0 HA SER A 623 -8.015 4.176 15.591 1.00 12.41 H new ATOM 0 HB2 SER A 623 -6.268 3.936 17.362 1.00 3.53 H new ATOM 0 HB3 SER A 623 -5.266 5.108 16.529 1.00 3.53 H new ATOM 0 HG SER A 623 -6.498 6.062 18.239 1.00 14.54 H new ATOM 654 N ILE A 624 -8.037 6.388 14.434 1.00 62.21 N ATOM 655 CA ILE A 624 -8.161 7.556 13.615 1.00 43.11 C ATOM 656 C ILE A 624 -7.847 8.789 14.449 1.00 1.03 C ATOM 657 O ILE A 624 -8.355 8.938 15.562 1.00 2.45 O ATOM 658 CB ILE A 624 -9.599 7.674 12.984 1.00 2.13 C ATOM 659 CG1 ILE A 624 -9.857 6.585 11.922 1.00 12.12 C ATOM 660 CG2 ILE A 624 -9.840 9.045 12.384 1.00 5.45 C ATOM 661 CD1 ILE A 624 -9.897 5.161 12.420 1.00 24.02 C ATOM 0 H ILE A 624 -8.848 6.211 15.027 1.00 62.21 H new ATOM 0 HA ILE A 624 -7.451 7.476 12.792 1.00 43.11 H new ATOM 0 HB ILE A 624 -10.303 7.526 13.803 1.00 2.13 H new ATOM 0 HG12 ILE A 624 -10.806 6.803 11.432 1.00 12.12 H new ATOM 0 HG13 ILE A 624 -9.081 6.659 11.160 1.00 12.12 H new ATOM 0 HG21 ILE A 624 -10.843 9.085 11.959 1.00 5.45 H new ATOM 0 HG22 ILE A 624 -9.744 9.804 13.160 1.00 5.45 H new ATOM 0 HG23 ILE A 624 -9.106 9.233 11.600 1.00 5.45 H new ATOM 0 HD11 ILE A 624 -10.085 4.488 11.583 1.00 24.02 H new ATOM 0 HD12 ILE A 624 -8.942 4.910 12.880 1.00 24.02 H new ATOM 0 HD13 ILE A 624 -10.694 5.055 13.156 1.00 24.02 H new ATOM 673 N ILE A 625 -7.016 9.655 13.927 1.00 64.44 N ATOM 674 CA ILE A 625 -6.642 10.861 14.644 1.00 74.22 C ATOM 675 C ILE A 625 -7.638 11.968 14.354 1.00 22.52 C ATOM 676 O ILE A 625 -7.850 12.351 13.191 1.00 42.43 O ATOM 677 CB ILE A 625 -5.185 11.332 14.314 1.00 42.54 C ATOM 678 CG1 ILE A 625 -4.180 10.263 14.761 1.00 61.13 C ATOM 679 CG2 ILE A 625 -4.871 12.674 14.982 1.00 24.00 C ATOM 680 CD1 ILE A 625 -2.742 10.605 14.439 1.00 24.31 C ATOM 0 H ILE A 625 -6.583 9.553 13.009 1.00 64.44 H new ATOM 0 HA ILE A 625 -6.661 10.624 15.708 1.00 74.22 H new ATOM 0 HB ILE A 625 -5.105 11.472 13.236 1.00 42.54 H new ATOM 0 HG12 ILE A 625 -4.276 10.114 15.836 1.00 61.13 H new ATOM 0 HG13 ILE A 625 -4.434 9.316 14.284 1.00 61.13 H new ATOM 0 HG21 ILE A 625 -3.853 12.974 14.734 1.00 24.00 H new ATOM 0 HG22 ILE A 625 -5.570 13.431 14.625 1.00 24.00 H new ATOM 0 HG23 ILE A 625 -4.967 12.573 16.063 1.00 24.00 H new ATOM 0 HD11 ILE A 625 -2.091 9.802 14.785 1.00 24.31 H new ATOM 0 HD12 ILE A 625 -2.629 10.725 13.362 1.00 24.31 H new ATOM 0 HD13 ILE A 625 -2.469 11.535 14.938 1.00 24.31 H new ATOM 692 N ASN A 626 -8.254 12.455 15.400 1.00 21.04 N ATOM 693 CA ASN A 626 -9.232 13.515 15.305 1.00 34.53 C ATOM 694 C ASN A 626 -8.533 14.790 14.863 1.00 2.13 C ATOM 695 O ASN A 626 -7.634 15.290 15.549 1.00 35.23 O ATOM 696 CB ASN A 626 -9.917 13.714 16.668 1.00 71.45 C ATOM 697 CG ASN A 626 -11.091 14.693 16.645 1.00 13.13 C ATOM 698 OD1 ASN A 626 -11.138 15.649 15.866 1.00 33.22 O ATOM 699 ND2 ASN A 626 -12.048 14.457 17.501 1.00 52.02 N ATOM 0 H ASN A 626 -8.091 12.126 16.352 1.00 21.04 H new ATOM 0 HA ASN A 626 -9.997 13.255 14.574 1.00 34.53 H new ATOM 0 HB2 ASN A 626 -10.272 12.748 17.028 1.00 71.45 H new ATOM 0 HB3 ASN A 626 -9.177 14.069 17.385 1.00 71.45 H new ATOM 0 HD21 ASN A 626 -12.862 15.071 17.538 1.00 52.02 H new ATOM 0 HD22 ASN A 626 -11.982 13.659 18.133 1.00 52.02 H new ATOM 706 N GLY A 627 -8.924 15.290 13.721 1.00 34.11 N ATOM 707 CA GLY A 627 -8.306 16.468 13.186 1.00 12.24 C ATOM 708 C GLY A 627 -7.396 16.143 12.024 1.00 74.45 C ATOM 709 O GLY A 627 -6.694 17.022 11.504 1.00 65.11 O ATOM 0 H GLY A 627 -9.669 14.898 13.145 1.00 34.11 H new ATOM 0 HA2 GLY A 627 -9.076 17.167 12.861 1.00 12.24 H new ATOM 0 HA3 GLY A 627 -7.733 16.966 13.968 1.00 12.24 H new ATOM 713 N GLY A 628 -7.391 14.883 11.617 1.00 51.50 N ATOM 714 CA GLY A 628 -6.588 14.479 10.494 1.00 11.33 C ATOM 715 C GLY A 628 -7.319 14.699 9.187 1.00 54.10 C ATOM 716 O GLY A 628 -8.548 14.600 9.135 1.00 53.32 O ATOM 0 H GLY A 628 -7.932 14.134 12.049 1.00 51.50 H new ATOM 0 HA2 GLY A 628 -5.655 15.042 10.490 1.00 11.33 H new ATOM 0 HA3 GLY A 628 -6.324 13.426 10.593 1.00 11.33 H new ATOM 720 N ALA A 629 -6.599 14.984 8.137 1.00 55.31 N ATOM 721 CA ALA A 629 -7.222 15.216 6.835 1.00 62.24 C ATOM 722 C ALA A 629 -7.875 13.952 6.315 1.00 41.42 C ATOM 723 O ALA A 629 -8.960 13.991 5.753 1.00 72.44 O ATOM 724 CB ALA A 629 -6.219 15.776 5.849 1.00 70.11 C ATOM 0 H ALA A 629 -5.582 15.064 8.143 1.00 55.31 H new ATOM 0 HA ALA A 629 -8.008 15.961 6.959 1.00 62.24 H new ATOM 0 HB1 ALA A 629 -6.706 15.940 4.888 1.00 70.11 H new ATOM 0 HB2 ALA A 629 -5.829 16.722 6.224 1.00 70.11 H new ATOM 0 HB3 ALA A 629 -5.398 15.070 5.724 1.00 70.11 H new ATOM 730 N ALA A 630 -7.236 12.831 6.544 1.00 25.10 N ATOM 731 CA ALA A 630 -7.774 11.554 6.129 1.00 1.31 C ATOM 732 C ALA A 630 -9.037 11.231 6.869 1.00 12.12 C ATOM 733 O ALA A 630 -9.879 10.504 6.370 1.00 71.13 O ATOM 734 CB ALA A 630 -6.762 10.450 6.294 1.00 54.40 C ATOM 0 H ALA A 630 -6.335 12.775 7.019 1.00 25.10 H new ATOM 0 HA ALA A 630 -8.014 11.632 5.069 1.00 1.31 H new ATOM 0 HB1 ALA A 630 -7.199 9.505 5.973 1.00 54.40 H new ATOM 0 HB2 ALA A 630 -5.883 10.668 5.687 1.00 54.40 H new ATOM 0 HB3 ALA A 630 -6.470 10.378 7.342 1.00 54.40 H new ATOM 740 N SER A 631 -9.182 11.779 8.041 1.00 13.13 N ATOM 741 CA SER A 631 -10.363 11.487 8.820 1.00 2.00 C ATOM 742 C SER A 631 -11.574 12.231 8.255 1.00 1.41 C ATOM 743 O SER A 631 -12.630 11.631 8.044 1.00 25.34 O ATOM 744 CB SER A 631 -10.179 11.753 10.339 1.00 70.41 C ATOM 745 OG SER A 631 -9.991 13.120 10.650 1.00 44.32 O ATOM 0 H SER A 631 -8.516 12.418 8.476 1.00 13.13 H new ATOM 0 HA SER A 631 -10.543 10.415 8.733 1.00 2.00 H new ATOM 0 HB2 SER A 631 -11.054 11.383 10.874 1.00 70.41 H new ATOM 0 HB3 SER A 631 -9.321 11.185 10.699 1.00 70.41 H new ATOM 0 HG SER A 631 -9.627 13.586 9.869 1.00 44.32 H new ATOM 751 N LYS A 632 -11.416 13.531 7.999 1.00 44.45 N ATOM 752 CA LYS A 632 -12.478 14.325 7.506 1.00 62.33 C ATOM 753 C LYS A 632 -12.728 14.091 6.009 1.00 20.14 C ATOM 754 O LYS A 632 -13.851 13.820 5.588 1.00 71.22 O ATOM 755 CB LYS A 632 -12.182 15.782 7.813 1.00 34.22 C ATOM 756 CG LYS A 632 -13.180 16.728 7.240 1.00 0.43 C ATOM 757 CD LYS A 632 -12.882 18.183 7.612 1.00 22.21 C ATOM 758 CE LYS A 632 -12.942 18.405 9.120 1.00 10.30 C ATOM 759 NZ LYS A 632 -12.657 19.809 9.490 1.00 24.35 N ATOM 0 H LYS A 632 -10.541 14.036 8.136 1.00 44.45 H new ATOM 0 HA LYS A 632 -13.402 14.035 8.006 1.00 62.33 H new ATOM 0 HB2 LYS A 632 -12.146 15.916 8.894 1.00 34.22 H new ATOM 0 HB3 LYS A 632 -11.194 16.032 7.427 1.00 34.22 H new ATOM 0 HG2 LYS A 632 -13.191 16.628 6.155 1.00 0.43 H new ATOM 0 HG3 LYS A 632 -14.176 16.461 7.595 1.00 0.43 H new ATOM 0 HD2 LYS A 632 -11.894 18.458 7.243 1.00 22.21 H new ATOM 0 HD3 LYS A 632 -13.600 18.839 7.119 1.00 22.21 H new ATOM 0 HE2 LYS A 632 -13.930 18.128 9.487 1.00 10.30 H new ATOM 0 HE3 LYS A 632 -12.224 17.749 9.611 1.00 10.30 H new ATOM 0 HZ1 LYS A 632 -12.709 19.913 10.523 1.00 24.35 H new ATOM 0 HZ2 LYS A 632 -11.704 20.068 9.163 1.00 24.35 H new ATOM 0 HZ3 LYS A 632 -13.358 20.435 9.044 1.00 24.35 H new ATOM 773 N ASP A 633 -11.670 14.172 5.226 1.00 12.11 N ATOM 774 CA ASP A 633 -11.768 14.062 3.778 1.00 61.12 C ATOM 775 C ASP A 633 -11.925 12.625 3.314 1.00 10.15 C ATOM 776 O ASP A 633 -12.834 12.306 2.548 1.00 64.34 O ATOM 777 CB ASP A 633 -10.562 14.724 3.078 1.00 71.35 C ATOM 778 CG ASP A 633 -10.524 16.242 3.213 1.00 4.32 C ATOM 779 OD1 ASP A 633 -9.952 16.765 4.195 1.00 60.40 O ATOM 780 OD2 ASP A 633 -11.058 16.939 2.319 1.00 73.34 O ATOM 0 H ASP A 633 -10.721 14.315 5.571 1.00 12.11 H new ATOM 0 HA ASP A 633 -12.673 14.599 3.492 1.00 61.12 H new ATOM 0 HB2 ASP A 633 -9.643 14.310 3.491 1.00 71.35 H new ATOM 0 HB3 ASP A 633 -10.581 14.464 2.020 1.00 71.35 H new ATOM 785 N GLY A 634 -11.056 11.753 3.783 1.00 51.33 N ATOM 786 CA GLY A 634 -11.080 10.388 3.300 1.00 44.20 C ATOM 787 C GLY A 634 -12.128 9.526 3.973 1.00 13.31 C ATOM 788 O GLY A 634 -12.854 8.815 3.297 1.00 41.42 O ATOM 0 H GLY A 634 -10.341 11.957 4.481 1.00 51.33 H new ATOM 0 HA2 GLY A 634 -11.262 10.395 2.225 1.00 44.20 H new ATOM 0 HA3 GLY A 634 -10.099 9.939 3.454 1.00 44.20 H new ATOM 792 N ARG A 635 -12.239 9.642 5.295 1.00 45.40 N ATOM 793 CA ARG A 635 -13.184 8.839 6.090 1.00 11.44 C ATOM 794 C ARG A 635 -12.891 7.358 5.996 1.00 23.23 C ATOM 795 O ARG A 635 -13.523 6.616 5.240 1.00 12.55 O ATOM 796 CB ARG A 635 -14.626 9.131 5.729 1.00 34.31 C ATOM 797 CG ARG A 635 -15.090 10.500 6.127 1.00 24.01 C ATOM 798 CD ARG A 635 -16.114 10.979 5.167 1.00 2.21 C ATOM 799 NE ARG A 635 -15.494 11.130 3.859 1.00 11.02 N ATOM 800 CZ ARG A 635 -16.129 11.450 2.738 1.00 42.34 C ATOM 801 NH1 ARG A 635 -17.457 11.509 2.710 1.00 32.23 N ATOM 802 NH2 ARG A 635 -15.433 11.704 1.642 1.00 5.21 N ATOM 0 H ARG A 635 -11.681 10.291 5.850 1.00 45.40 H new ATOM 0 HA ARG A 635 -13.040 9.137 7.128 1.00 11.44 H new ATOM 0 HB2 ARG A 635 -14.751 9.015 4.652 1.00 34.31 H new ATOM 0 HB3 ARG A 635 -15.266 8.389 6.206 1.00 34.31 H new ATOM 0 HG2 ARG A 635 -15.505 10.475 7.134 1.00 24.01 H new ATOM 0 HG3 ARG A 635 -14.246 11.189 6.147 1.00 24.01 H new ATOM 0 HD2 ARG A 635 -16.942 10.272 5.113 1.00 2.21 H new ATOM 0 HD3 ARG A 635 -16.529 11.930 5.500 1.00 2.21 H new ATOM 0 HE ARG A 635 -14.487 10.977 3.799 1.00 11.02 H new ATOM 0 HH11 ARG A 635 -17.994 11.308 3.553 1.00 32.23 H new ATOM 0 HH12 ARG A 635 -17.938 11.756 1.845 1.00 32.23 H new ATOM 0 HH21 ARG A 635 -14.414 11.653 1.661 1.00 5.21 H new ATOM 0 HH22 ARG A 635 -15.915 11.950 0.777 1.00 5.21 H new ATOM 816 N LEU A 636 -11.887 6.961 6.702 1.00 62.01 N ATOM 817 CA LEU A 636 -11.506 5.555 6.787 1.00 53.25 C ATOM 818 C LEU A 636 -12.109 4.938 8.028 1.00 3.14 C ATOM 819 O LEU A 636 -12.932 5.563 8.701 1.00 43.20 O ATOM 820 CB LEU A 636 -9.970 5.335 6.757 1.00 62.22 C ATOM 821 CG LEU A 636 -9.234 5.685 5.450 1.00 65.54 C ATOM 822 CD1 LEU A 636 -9.189 7.171 5.208 1.00 5.33 C ATOM 823 CD2 LEU A 636 -7.846 5.078 5.426 1.00 50.22 C ATOM 0 H LEU A 636 -11.294 7.588 7.245 1.00 62.01 H new ATOM 0 HA LEU A 636 -11.900 5.061 5.899 1.00 53.25 H new ATOM 0 HB2 LEU A 636 -9.529 5.924 7.561 1.00 62.22 H new ATOM 0 HB3 LEU A 636 -9.774 4.287 6.985 1.00 62.22 H new ATOM 0 HG LEU A 636 -9.805 5.248 4.631 1.00 65.54 H new ATOM 0 HD11 LEU A 636 -8.661 7.372 4.276 1.00 5.33 H new ATOM 0 HD12 LEU A 636 -10.205 7.560 5.140 1.00 5.33 H new ATOM 0 HD13 LEU A 636 -8.668 7.658 6.032 1.00 5.33 H new ATOM 0 HD21 LEU A 636 -7.350 5.341 4.492 1.00 50.22 H new ATOM 0 HD22 LEU A 636 -7.266 5.462 6.266 1.00 50.22 H new ATOM 0 HD23 LEU A 636 -7.922 3.993 5.503 1.00 50.22 H new ATOM 835 N ARG A 637 -11.715 3.750 8.341 1.00 3.14 N ATOM 836 CA ARG A 637 -12.290 3.037 9.459 1.00 3.44 C ATOM 837 C ARG A 637 -11.205 2.368 10.260 1.00 12.21 C ATOM 838 O ARG A 637 -10.069 2.347 9.873 1.00 43.42 O ATOM 839 CB ARG A 637 -13.265 1.962 8.956 1.00 20.45 C ATOM 840 CG ARG A 637 -12.606 0.947 8.067 1.00 23.35 C ATOM 841 CD ARG A 637 -13.539 -0.155 7.639 1.00 50.43 C ATOM 842 NE ARG A 637 -12.815 -1.125 6.817 1.00 32.20 N ATOM 843 CZ ARG A 637 -12.614 -2.406 7.154 1.00 1.32 C ATOM 844 NH1 ARG A 637 -13.243 -2.933 8.192 1.00 1.24 N ATOM 845 NH2 ARG A 637 -11.786 -3.158 6.442 1.00 74.32 N ATOM 0 H ARG A 637 -10.990 3.237 7.839 1.00 3.14 H new ATOM 0 HA ARG A 637 -12.822 3.753 10.085 1.00 3.44 H new ATOM 0 HB2 ARG A 637 -13.711 1.454 9.811 1.00 20.45 H new ATOM 0 HB3 ARG A 637 -14.078 2.442 8.411 1.00 20.45 H new ATOM 0 HG2 ARG A 637 -12.214 1.448 7.182 1.00 23.35 H new ATOM 0 HG3 ARG A 637 -11.755 0.512 8.591 1.00 23.35 H new ATOM 0 HD2 ARG A 637 -13.960 -0.649 8.515 1.00 50.43 H new ATOM 0 HD3 ARG A 637 -14.374 0.261 7.076 1.00 50.43 H new ATOM 0 HE ARG A 637 -12.437 -0.804 5.926 1.00 32.20 H new ATOM 0 HH11 ARG A 637 -13.886 -2.363 8.742 1.00 1.24 H new ATOM 0 HH12 ARG A 637 -13.085 -3.909 8.442 1.00 1.24 H new ATOM 0 HH21 ARG A 637 -11.301 -2.761 5.637 1.00 74.32 H new ATOM 0 HH22 ARG A 637 -11.634 -4.133 6.699 1.00 74.32 H new ATOM 859 N VAL A 638 -11.563 1.841 11.385 1.00 2.33 N ATOM 860 CA VAL A 638 -10.634 1.054 12.144 1.00 34.02 C ATOM 861 C VAL A 638 -10.575 -0.350 11.524 1.00 24.23 C ATOM 862 O VAL A 638 -11.606 -0.881 11.080 1.00 11.35 O ATOM 863 CB VAL A 638 -11.047 0.953 13.640 1.00 21.20 C ATOM 864 CG1 VAL A 638 -10.041 0.130 14.438 1.00 53.21 C ATOM 865 CG2 VAL A 638 -11.211 2.332 14.255 1.00 72.24 C ATOM 0 H VAL A 638 -12.489 1.938 11.802 1.00 2.33 H new ATOM 0 HA VAL A 638 -9.656 1.535 12.111 1.00 34.02 H new ATOM 0 HB VAL A 638 -12.009 0.443 13.680 1.00 21.20 H new ATOM 0 HG11 VAL A 638 -10.358 0.078 15.480 1.00 53.21 H new ATOM 0 HG12 VAL A 638 -9.986 -0.877 14.025 1.00 53.21 H new ATOM 0 HG13 VAL A 638 -9.059 0.600 14.381 1.00 53.21 H new ATOM 0 HG21 VAL A 638 -11.500 2.232 15.301 1.00 72.24 H new ATOM 0 HG22 VAL A 638 -10.268 2.874 14.189 1.00 72.24 H new ATOM 0 HG23 VAL A 638 -11.983 2.881 13.716 1.00 72.24 H new ATOM 875 N ASN A 639 -9.378 -0.897 11.448 1.00 44.30 N ATOM 876 CA ASN A 639 -9.104 -2.258 10.966 1.00 1.10 C ATOM 877 C ASN A 639 -9.160 -2.373 9.428 1.00 72.20 C ATOM 878 O ASN A 639 -9.131 -3.477 8.874 1.00 3.31 O ATOM 879 CB ASN A 639 -9.977 -3.332 11.719 1.00 53.13 C ATOM 880 CG ASN A 639 -9.660 -4.804 11.368 1.00 52.44 C ATOM 881 OD1 ASN A 639 -10.282 -5.405 10.482 1.00 61.05 O ATOM 882 ND2 ASN A 639 -8.696 -5.388 12.052 1.00 13.22 N ATOM 0 H ASN A 639 -8.533 -0.398 11.727 1.00 44.30 H new ATOM 0 HA ASN A 639 -8.069 -2.485 11.220 1.00 1.10 H new ATOM 0 HB2 ASN A 639 -9.846 -3.195 12.792 1.00 53.13 H new ATOM 0 HB3 ASN A 639 -11.027 -3.141 11.499 1.00 53.13 H new ATOM 0 HD21 ASN A 639 -8.447 -6.358 11.856 1.00 13.22 H new ATOM 0 HD22 ASN A 639 -8.199 -4.870 12.777 1.00 13.22 H new ATOM 889 N ASP A 640 -9.195 -1.243 8.712 1.00 51.21 N ATOM 890 CA ASP A 640 -9.092 -1.371 7.266 1.00 32.21 C ATOM 891 C ASP A 640 -7.663 -1.688 6.884 1.00 32.23 C ATOM 892 O ASP A 640 -6.719 -1.208 7.519 1.00 32.03 O ATOM 893 CB ASP A 640 -9.689 -0.216 6.416 1.00 52.04 C ATOM 894 CG ASP A 640 -9.102 1.155 6.615 1.00 55.14 C ATOM 895 OD1 ASP A 640 -7.948 1.354 6.272 1.00 21.12 O ATOM 896 OD2 ASP A 640 -9.845 2.047 7.092 1.00 1.15 O ATOM 0 H ASP A 640 -9.287 -0.297 9.081 1.00 51.21 H new ATOM 0 HA ASP A 640 -9.747 -2.203 7.007 1.00 32.21 H new ATOM 0 HB2 ASP A 640 -9.583 -0.480 5.364 1.00 52.04 H new ATOM 0 HB3 ASP A 640 -10.757 -0.160 6.624 1.00 52.04 H new ATOM 901 N GLN A 641 -7.502 -2.542 5.908 1.00 32.14 N ATOM 902 CA GLN A 641 -6.194 -3.009 5.520 1.00 33.30 C ATOM 903 C GLN A 641 -5.680 -2.126 4.383 1.00 22.11 C ATOM 904 O GLN A 641 -6.309 -2.037 3.322 1.00 1.14 O ATOM 905 CB GLN A 641 -6.311 -4.503 5.101 1.00 64.53 C ATOM 906 CG GLN A 641 -5.005 -5.337 5.072 1.00 71.50 C ATOM 907 CD GLN A 641 -3.966 -4.896 4.076 1.00 43.32 C ATOM 908 OE1 GLN A 641 -3.950 -5.341 2.945 1.00 14.43 O ATOM 909 NE2 GLN A 641 -3.081 -4.055 4.494 1.00 12.31 N ATOM 0 H GLN A 641 -8.269 -2.933 5.361 1.00 32.14 H new ATOM 0 HA GLN A 641 -5.481 -2.944 6.342 1.00 33.30 H new ATOM 0 HB2 GLN A 641 -7.008 -4.991 5.782 1.00 64.53 H new ATOM 0 HB3 GLN A 641 -6.758 -4.541 4.107 1.00 64.53 H new ATOM 0 HG2 GLN A 641 -4.560 -5.314 6.067 1.00 71.50 H new ATOM 0 HG3 GLN A 641 -5.264 -6.375 4.863 1.00 71.50 H new ATOM 0 HE21 GLN A 641 -3.125 -3.702 5.450 1.00 12.31 H new ATOM 0 HE22 GLN A 641 -2.338 -3.744 3.869 1.00 12.31 H new ATOM 918 N LEU A 642 -4.563 -1.466 4.631 1.00 63.41 N ATOM 919 CA LEU A 642 -3.928 -0.567 3.679 1.00 23.40 C ATOM 920 C LEU A 642 -3.266 -1.350 2.539 1.00 2.11 C ATOM 921 O LEU A 642 -2.243 -2.022 2.719 1.00 11.41 O ATOM 922 CB LEU A 642 -2.923 0.400 4.376 1.00 53.04 C ATOM 923 CG LEU A 642 -3.490 1.507 5.286 1.00 53.30 C ATOM 924 CD1 LEU A 642 -4.236 0.935 6.474 1.00 24.53 C ATOM 925 CD2 LEU A 642 -2.369 2.408 5.763 1.00 5.23 C ATOM 0 H LEU A 642 -4.061 -1.540 5.516 1.00 63.41 H new ATOM 0 HA LEU A 642 -4.710 0.054 3.242 1.00 23.40 H new ATOM 0 HB2 LEU A 642 -2.239 -0.204 4.973 1.00 53.04 H new ATOM 0 HB3 LEU A 642 -2.329 0.880 3.598 1.00 53.04 H new ATOM 0 HG LEU A 642 -4.202 2.087 4.698 1.00 53.30 H new ATOM 0 HD11 LEU A 642 -4.619 1.749 7.089 1.00 24.53 H new ATOM 0 HD12 LEU A 642 -5.067 0.324 6.122 1.00 24.53 H new ATOM 0 HD13 LEU A 642 -3.559 0.320 7.067 1.00 24.53 H new ATOM 0 HD21 LEU A 642 -2.777 3.188 6.406 1.00 5.23 H new ATOM 0 HD22 LEU A 642 -1.643 1.819 6.324 1.00 5.23 H new ATOM 0 HD23 LEU A 642 -1.879 2.866 4.903 1.00 5.23 H new ATOM 937 N ILE A 643 -3.859 -1.237 1.384 1.00 4.15 N ATOM 938 CA ILE A 643 -3.470 -1.974 0.197 1.00 44.12 C ATOM 939 C ILE A 643 -2.393 -1.231 -0.559 1.00 44.10 C ATOM 940 O ILE A 643 -1.312 -1.773 -0.852 1.00 52.24 O ATOM 941 CB ILE A 643 -4.703 -2.123 -0.741 1.00 51.31 C ATOM 942 CG1 ILE A 643 -5.843 -2.809 -0.002 1.00 72.51 C ATOM 943 CG2 ILE A 643 -4.356 -2.891 -2.009 1.00 75.12 C ATOM 944 CD1 ILE A 643 -5.529 -4.219 0.444 1.00 51.13 C ATOM 0 H ILE A 643 -4.651 -0.613 1.230 1.00 4.15 H new ATOM 0 HA ILE A 643 -3.095 -2.950 0.504 1.00 44.12 H new ATOM 0 HB ILE A 643 -5.018 -1.123 -1.038 1.00 51.31 H new ATOM 0 HG12 ILE A 643 -6.106 -2.213 0.872 1.00 72.51 H new ATOM 0 HG13 ILE A 643 -6.720 -2.831 -0.649 1.00 72.51 H new ATOM 0 HG21 ILE A 643 -5.242 -2.974 -2.638 1.00 75.12 H new ATOM 0 HG22 ILE A 643 -3.574 -2.361 -2.553 1.00 75.12 H new ATOM 0 HG23 ILE A 643 -4.003 -3.888 -1.745 1.00 75.12 H new ATOM 0 HD11 ILE A 643 -6.392 -4.637 0.962 1.00 51.13 H new ATOM 0 HD12 ILE A 643 -5.296 -4.833 -0.426 1.00 51.13 H new ATOM 0 HD13 ILE A 643 -4.672 -4.205 1.118 1.00 51.13 H new ATOM 956 N ALA A 644 -2.687 -0.003 -0.883 1.00 74.54 N ATOM 957 CA ALA A 644 -1.793 0.801 -1.659 1.00 62.32 C ATOM 958 C ALA A 644 -1.841 2.238 -1.203 1.00 4.15 C ATOM 959 O ALA A 644 -2.829 2.676 -0.606 1.00 61.34 O ATOM 960 CB ALA A 644 -2.143 0.692 -3.140 1.00 44.33 C ATOM 0 H ALA A 644 -3.553 0.466 -0.616 1.00 74.54 H new ATOM 0 HA ALA A 644 -0.777 0.435 -1.514 1.00 62.32 H new ATOM 0 HB1 ALA A 644 -1.457 1.307 -3.722 1.00 44.33 H new ATOM 0 HB2 ALA A 644 -2.058 -0.347 -3.458 1.00 44.33 H new ATOM 0 HB3 ALA A 644 -3.164 1.038 -3.299 1.00 44.33 H new ATOM 966 N VAL A 645 -0.791 2.961 -1.480 1.00 70.12 N ATOM 967 CA VAL A 645 -0.691 4.344 -1.111 1.00 43.43 C ATOM 968 C VAL A 645 -0.075 5.124 -2.275 1.00 31.13 C ATOM 969 O VAL A 645 0.913 4.691 -2.862 1.00 60.52 O ATOM 970 CB VAL A 645 0.142 4.528 0.195 1.00 74.04 C ATOM 971 CG1 VAL A 645 1.589 4.083 0.031 1.00 3.14 C ATOM 972 CG2 VAL A 645 0.058 5.947 0.706 1.00 63.21 C ATOM 0 H VAL A 645 0.027 2.602 -1.973 1.00 70.12 H new ATOM 0 HA VAL A 645 -1.689 4.731 -0.903 1.00 43.43 H new ATOM 0 HB VAL A 645 -0.304 3.874 0.945 1.00 74.04 H new ATOM 0 HG11 VAL A 645 2.124 4.232 0.969 1.00 3.14 H new ATOM 0 HG12 VAL A 645 1.617 3.027 -0.238 1.00 3.14 H new ATOM 0 HG13 VAL A 645 2.064 4.671 -0.755 1.00 3.14 H new ATOM 0 HG21 VAL A 645 0.649 6.041 1.617 1.00 63.21 H new ATOM 0 HG22 VAL A 645 0.445 6.630 -0.050 1.00 63.21 H new ATOM 0 HG23 VAL A 645 -0.981 6.195 0.921 1.00 63.21 H new ATOM 982 N ASN A 646 -0.688 6.253 -2.625 1.00 13.25 N ATOM 983 CA ASN A 646 -0.270 7.079 -3.784 1.00 55.34 C ATOM 984 C ASN A 646 -0.154 6.293 -5.088 1.00 34.34 C ATOM 985 O ASN A 646 0.512 6.715 -6.029 1.00 2.40 O ATOM 986 CB ASN A 646 0.994 7.883 -3.467 1.00 32.11 C ATOM 987 CG ASN A 646 0.675 9.082 -2.606 1.00 25.41 C ATOM 988 OD1 ASN A 646 -0.406 9.649 -2.721 1.00 25.42 O ATOM 989 ND2 ASN A 646 1.575 9.475 -1.741 1.00 62.52 N ATOM 0 H ASN A 646 -1.490 6.631 -2.121 1.00 13.25 H new ATOM 0 HA ASN A 646 -1.077 7.791 -3.959 1.00 55.34 H new ATOM 0 HB2 ASN A 646 1.715 7.246 -2.955 1.00 32.11 H new ATOM 0 HB3 ASN A 646 1.462 8.212 -4.395 1.00 32.11 H new ATOM 0 HD21 ASN A 646 1.387 10.275 -1.137 1.00 62.52 H new ATOM 0 HD22 ASN A 646 2.465 8.981 -1.671 1.00 62.52 H new ATOM 996 N GLY A 647 -0.874 5.184 -5.157 1.00 40.21 N ATOM 997 CA GLY A 647 -0.838 4.334 -6.327 1.00 52.44 C ATOM 998 C GLY A 647 0.114 3.147 -6.188 1.00 23.14 C ATOM 999 O GLY A 647 0.019 2.176 -6.947 1.00 65.13 O ATOM 0 H GLY A 647 -1.490 4.855 -4.413 1.00 40.21 H new ATOM 0 HA2 GLY A 647 -1.843 3.962 -6.528 1.00 52.44 H new ATOM 0 HA3 GLY A 647 -0.540 4.929 -7.190 1.00 52.44 H new ATOM 1003 N GLU A 648 1.026 3.208 -5.230 1.00 11.12 N ATOM 1004 CA GLU A 648 1.986 2.143 -5.029 1.00 34.25 C ATOM 1005 C GLU A 648 1.420 1.106 -4.072 1.00 74.55 C ATOM 1006 O GLU A 648 0.914 1.446 -3.012 1.00 14.52 O ATOM 1007 CB GLU A 648 3.312 2.703 -4.504 1.00 61.20 C ATOM 1008 CG GLU A 648 4.385 1.658 -4.295 1.00 73.04 C ATOM 1009 CD GLU A 648 4.718 0.902 -5.565 1.00 12.32 C ATOM 1010 OE1 GLU A 648 4.070 -0.119 -5.842 1.00 43.22 O ATOM 1011 OE2 GLU A 648 5.635 1.316 -6.297 1.00 51.23 O ATOM 0 H GLU A 648 1.118 3.988 -4.579 1.00 11.12 H new ATOM 0 HA GLU A 648 2.181 1.661 -5.987 1.00 34.25 H new ATOM 0 HB2 GLU A 648 3.681 3.452 -5.205 1.00 61.20 H new ATOM 0 HB3 GLU A 648 3.129 3.214 -3.559 1.00 61.20 H new ATOM 0 HG2 GLU A 648 5.287 2.139 -3.916 1.00 73.04 H new ATOM 0 HG3 GLU A 648 4.056 0.952 -3.532 1.00 73.04 H new ATOM 1018 N SER A 649 1.518 -0.140 -4.451 1.00 33.32 N ATOM 1019 CA SER A 649 0.956 -1.233 -3.702 1.00 33.22 C ATOM 1020 C SER A 649 1.975 -1.854 -2.733 1.00 60.11 C ATOM 1021 O SER A 649 3.192 -1.790 -2.959 1.00 65.53 O ATOM 1022 CB SER A 649 0.390 -2.259 -4.678 1.00 42.52 C ATOM 1023 OG SER A 649 1.345 -2.588 -5.678 1.00 62.52 O ATOM 0 H SER A 649 1.998 -0.429 -5.303 1.00 33.32 H new ATOM 0 HA SER A 649 0.148 -0.857 -3.074 1.00 33.22 H new ATOM 0 HB2 SER A 649 0.099 -3.159 -4.137 1.00 42.52 H new ATOM 0 HB3 SER A 649 -0.511 -1.863 -5.146 1.00 42.52 H new ATOM 0 HG SER A 649 0.961 -3.249 -6.292 1.00 62.52 H new ATOM 1029 N LEU A 650 1.475 -2.428 -1.645 1.00 71.20 N ATOM 1030 CA LEU A 650 2.324 -3.022 -0.615 1.00 54.43 C ATOM 1031 C LEU A 650 2.000 -4.493 -0.422 1.00 30.23 C ATOM 1032 O LEU A 650 2.374 -5.095 0.596 1.00 42.25 O ATOM 1033 CB LEU A 650 2.129 -2.318 0.744 1.00 33.12 C ATOM 1034 CG LEU A 650 2.456 -0.808 0.856 1.00 33.23 C ATOM 1035 CD1 LEU A 650 1.491 0.072 0.081 1.00 74.43 C ATOM 1036 CD2 LEU A 650 2.488 -0.392 2.294 1.00 65.42 C ATOM 0 H LEU A 650 0.476 -2.496 -1.451 1.00 71.20 H new ATOM 0 HA LEU A 650 3.353 -2.904 -0.954 1.00 54.43 H new ATOM 0 HB2 LEU A 650 1.089 -2.453 1.039 1.00 33.12 H new ATOM 0 HB3 LEU A 650 2.740 -2.843 1.478 1.00 33.12 H new ATOM 0 HG LEU A 650 3.439 -0.668 0.406 1.00 33.23 H new ATOM 0 HD11 LEU A 650 1.775 1.117 0.201 1.00 74.43 H new ATOM 0 HD12 LEU A 650 1.524 -0.194 -0.975 1.00 74.43 H new ATOM 0 HD13 LEU A 650 0.480 -0.075 0.461 1.00 74.43 H new ATOM 0 HD21 LEU A 650 2.719 0.671 2.360 1.00 65.42 H new ATOM 0 HD22 LEU A 650 1.516 -0.581 2.749 1.00 65.42 H new ATOM 0 HD23 LEU A 650 3.253 -0.963 2.821 1.00 65.42 H new ATOM 1048 N LEU A 651 1.349 -5.084 -1.387 1.00 41.44 N ATOM 1049 CA LEU A 651 0.932 -6.462 -1.256 1.00 44.45 C ATOM 1050 C LEU A 651 2.096 -7.381 -1.526 1.00 23.35 C ATOM 1051 O LEU A 651 2.515 -7.550 -2.682 1.00 24.32 O ATOM 1052 CB LEU A 651 -0.242 -6.827 -2.197 1.00 72.44 C ATOM 1053 CG LEU A 651 -1.551 -6.034 -2.074 1.00 21.24 C ATOM 1054 CD1 LEU A 651 -2.072 -6.005 -0.643 1.00 52.23 C ATOM 1055 CD2 LEU A 651 -1.412 -4.646 -2.665 1.00 12.44 C ATOM 0 H LEU A 651 1.095 -4.640 -2.269 1.00 41.44 H new ATOM 0 HA LEU A 651 0.579 -6.588 -0.232 1.00 44.45 H new ATOM 0 HB2 LEU A 651 0.112 -6.727 -3.223 1.00 72.44 H new ATOM 0 HB3 LEU A 651 -0.476 -7.880 -2.042 1.00 72.44 H new ATOM 0 HG LEU A 651 -2.305 -6.558 -2.661 1.00 21.24 H new ATOM 0 HD11 LEU A 651 -2.999 -5.433 -0.605 1.00 52.23 H new ATOM 0 HD12 LEU A 651 -2.260 -7.024 -0.303 1.00 52.23 H new ATOM 0 HD13 LEU A 651 -1.330 -5.537 0.005 1.00 52.23 H new ATOM 0 HD21 LEU A 651 -2.356 -4.111 -2.562 1.00 12.44 H new ATOM 0 HD22 LEU A 651 -0.627 -4.103 -2.138 1.00 12.44 H new ATOM 0 HD23 LEU A 651 -1.153 -4.724 -3.721 1.00 12.44 H new ATOM 1067 N GLY A 652 2.657 -7.917 -0.483 1.00 1.51 N ATOM 1068 CA GLY A 652 3.729 -8.862 -0.638 1.00 51.05 C ATOM 1069 C GLY A 652 4.868 -8.589 0.295 1.00 1.03 C ATOM 1070 O GLY A 652 5.571 -9.509 0.714 1.00 54.24 O ATOM 0 H GLY A 652 2.393 -7.719 0.482 1.00 1.51 H new ATOM 0 HA2 GLY A 652 3.351 -9.869 -0.461 1.00 51.05 H new ATOM 0 HA3 GLY A 652 4.090 -8.833 -1.666 1.00 51.05 H new ATOM 1074 N LYS A 653 5.065 -7.336 0.634 1.00 42.32 N ATOM 1075 CA LYS A 653 6.141 -6.970 1.519 1.00 34.33 C ATOM 1076 C LYS A 653 5.697 -7.072 2.976 1.00 1.42 C ATOM 1077 O LYS A 653 4.502 -6.995 3.269 1.00 62.41 O ATOM 1078 CB LYS A 653 6.695 -5.573 1.185 1.00 21.21 C ATOM 1079 CG LYS A 653 5.730 -4.407 1.377 1.00 10.41 C ATOM 1080 CD LYS A 653 6.392 -3.082 0.991 1.00 33.53 C ATOM 1081 CE LYS A 653 6.647 -2.976 -0.511 1.00 11.12 C ATOM 1082 NZ LYS A 653 7.454 -1.791 -0.872 1.00 31.32 N ATOM 0 H LYS A 653 4.494 -6.556 0.310 1.00 42.32 H new ATOM 0 HA LYS A 653 6.958 -7.677 1.371 1.00 34.33 H new ATOM 0 HB2 LYS A 653 7.575 -5.396 1.803 1.00 21.21 H new ATOM 0 HB3 LYS A 653 7.029 -5.575 0.147 1.00 21.21 H new ATOM 0 HG2 LYS A 653 4.839 -4.563 0.770 1.00 10.41 H new ATOM 0 HG3 LYS A 653 5.404 -4.366 2.416 1.00 10.41 H new ATOM 0 HD2 LYS A 653 5.757 -2.255 1.308 1.00 33.53 H new ATOM 0 HD3 LYS A 653 7.337 -2.981 1.525 1.00 33.53 H new ATOM 0 HE2 LYS A 653 7.158 -3.876 -0.853 1.00 11.12 H new ATOM 0 HE3 LYS A 653 5.692 -2.933 -1.035 1.00 11.12 H new ATOM 0 HZ1 LYS A 653 6.994 -1.283 -1.654 1.00 31.32 H new ATOM 0 HZ2 LYS A 653 7.533 -1.161 -0.048 1.00 31.32 H new ATOM 0 HZ3 LYS A 653 8.404 -2.095 -1.168 1.00 31.32 H new ATOM 1096 N ALA A 654 6.653 -7.258 3.872 1.00 61.33 N ATOM 1097 CA ALA A 654 6.372 -7.420 5.303 1.00 5.04 C ATOM 1098 C ALA A 654 5.882 -6.116 5.943 1.00 22.20 C ATOM 1099 O ALA A 654 5.984 -5.051 5.338 1.00 30.43 O ATOM 1100 CB ALA A 654 7.600 -7.951 6.023 1.00 13.03 C ATOM 0 H ALA A 654 7.644 -7.302 3.636 1.00 61.33 H new ATOM 0 HA ALA A 654 5.565 -8.146 5.403 1.00 5.04 H new ATOM 0 HB1 ALA A 654 7.378 -8.067 7.084 1.00 13.03 H new ATOM 0 HB2 ALA A 654 7.878 -8.918 5.603 1.00 13.03 H new ATOM 0 HB3 ALA A 654 8.426 -7.250 5.899 1.00 13.03 H new ATOM 1106 N ASN A 655 5.393 -6.210 7.185 1.00 21.32 N ATOM 1107 CA ASN A 655 4.787 -5.063 7.911 1.00 50.51 C ATOM 1108 C ASN A 655 5.759 -3.898 8.015 1.00 73.32 C ATOM 1109 O ASN A 655 5.405 -2.745 7.744 1.00 32.23 O ATOM 1110 CB ASN A 655 4.361 -5.465 9.336 1.00 15.30 C ATOM 1111 CG ASN A 655 3.440 -6.667 9.391 1.00 71.40 C ATOM 1112 OD1 ASN A 655 3.896 -7.791 9.514 1.00 2.43 O ATOM 1113 ND2 ASN A 655 2.153 -6.447 9.289 1.00 2.01 N ATOM 0 H ASN A 655 5.401 -7.077 7.723 1.00 21.32 H new ATOM 0 HA ASN A 655 3.911 -4.760 7.337 1.00 50.51 H new ATOM 0 HB2 ASN A 655 5.254 -5.678 9.924 1.00 15.30 H new ATOM 0 HB3 ASN A 655 3.863 -4.618 9.807 1.00 15.30 H new ATOM 0 HD21 ASN A 655 1.499 -7.229 9.311 1.00 2.01 H new ATOM 0 HD22 ASN A 655 1.805 -5.494 9.187 1.00 2.01 H new ATOM 1120 N GLN A 656 6.990 -4.199 8.398 1.00 44.22 N ATOM 1121 CA GLN A 656 8.008 -3.173 8.561 1.00 43.34 C ATOM 1122 C GLN A 656 8.399 -2.565 7.226 1.00 11.44 C ATOM 1123 O GLN A 656 8.738 -1.383 7.144 1.00 52.15 O ATOM 1124 CB GLN A 656 9.239 -3.730 9.256 1.00 1.30 C ATOM 1125 CG GLN A 656 8.978 -4.261 10.650 1.00 15.00 C ATOM 1126 CD GLN A 656 10.236 -4.759 11.310 1.00 2.25 C ATOM 1127 OE1 GLN A 656 10.933 -4.007 11.982 1.00 2.40 O ATOM 1128 NE2 GLN A 656 10.546 -6.011 11.116 1.00 53.22 N ATOM 0 H GLN A 656 7.308 -5.146 8.602 1.00 44.22 H new ATOM 0 HA GLN A 656 7.578 -2.389 9.185 1.00 43.34 H new ATOM 0 HB2 GLN A 656 9.655 -4.532 8.646 1.00 1.30 H new ATOM 0 HB3 GLN A 656 9.995 -2.947 9.313 1.00 1.30 H new ATOM 0 HG2 GLN A 656 8.536 -3.474 11.261 1.00 15.00 H new ATOM 0 HG3 GLN A 656 8.251 -5.071 10.599 1.00 15.00 H new ATOM 0 HE21 GLN A 656 9.940 -6.605 10.550 1.00 53.22 H new ATOM 0 HE22 GLN A 656 11.395 -6.396 11.530 1.00 53.22 H new ATOM 1137 N GLU A 657 8.335 -3.364 6.186 1.00 2.21 N ATOM 1138 CA GLU A 657 8.695 -2.906 4.855 1.00 0.53 C ATOM 1139 C GLU A 657 7.595 -2.008 4.339 1.00 71.21 C ATOM 1140 O GLU A 657 7.844 -0.985 3.694 1.00 24.13 O ATOM 1141 CB GLU A 657 8.858 -4.096 3.922 1.00 1.15 C ATOM 1142 CG GLU A 657 9.797 -5.165 4.456 1.00 1.32 C ATOM 1143 CD GLU A 657 11.168 -4.641 4.776 1.00 24.43 C ATOM 1144 OE1 GLU A 657 11.386 -4.190 5.904 1.00 4.25 O ATOM 1145 OE2 GLU A 657 12.054 -4.688 3.913 1.00 61.00 O ATOM 0 H GLU A 657 8.037 -4.338 6.232 1.00 2.21 H new ATOM 0 HA GLU A 657 9.637 -2.360 4.897 1.00 0.53 H new ATOM 0 HB2 GLU A 657 7.880 -4.541 3.741 1.00 1.15 H new ATOM 0 HB3 GLU A 657 9.231 -3.744 2.960 1.00 1.15 H new ATOM 0 HG2 GLU A 657 9.364 -5.604 5.355 1.00 1.32 H new ATOM 0 HG3 GLU A 657 9.883 -5.965 3.720 1.00 1.32 H new ATOM 1152 N ALA A 658 6.375 -2.404 4.650 1.00 51.31 N ATOM 1153 CA ALA A 658 5.191 -1.679 4.284 1.00 41.34 C ATOM 1154 C ALA A 658 5.218 -0.274 4.874 1.00 50.33 C ATOM 1155 O ALA A 658 4.890 0.694 4.201 1.00 20.12 O ATOM 1156 CB ALA A 658 3.965 -2.442 4.752 1.00 54.22 C ATOM 0 H ALA A 658 6.184 -3.257 5.175 1.00 51.31 H new ATOM 0 HA ALA A 658 5.151 -1.581 3.199 1.00 41.34 H new ATOM 0 HB1 ALA A 658 3.066 -1.892 4.474 1.00 54.22 H new ATOM 0 HB2 ALA A 658 3.948 -3.426 4.283 1.00 54.22 H new ATOM 0 HB3 ALA A 658 4.000 -2.557 5.835 1.00 54.22 H new ATOM 1162 N MET A 659 5.640 -0.165 6.117 1.00 24.42 N ATOM 1163 CA MET A 659 5.730 1.136 6.763 1.00 2.10 C ATOM 1164 C MET A 659 6.767 2.029 6.138 1.00 33.23 C ATOM 1165 O MET A 659 6.542 3.232 6.013 1.00 73.14 O ATOM 1166 CB MET A 659 5.924 1.025 8.254 1.00 24.33 C ATOM 1167 CG MET A 659 4.698 0.497 8.959 1.00 64.31 C ATOM 1168 SD MET A 659 4.888 0.381 10.737 1.00 31.42 S ATOM 1169 CE MET A 659 3.199 0.010 11.179 1.00 62.51 C ATOM 0 H MET A 659 5.925 -0.952 6.699 1.00 24.42 H new ATOM 0 HA MET A 659 4.764 1.614 6.597 1.00 2.10 H new ATOM 0 HB2 MET A 659 6.769 0.367 8.459 1.00 24.33 H new ATOM 0 HB3 MET A 659 6.178 2.005 8.658 1.00 24.33 H new ATOM 0 HG2 MET A 659 3.852 1.146 8.734 1.00 64.31 H new ATOM 0 HG3 MET A 659 4.457 -0.489 8.562 1.00 64.31 H new ATOM 0 HE1 MET A 659 2.960 0.484 12.131 1.00 62.51 H new ATOM 0 HE2 MET A 659 2.529 0.389 10.407 1.00 62.51 H new ATOM 0 HE3 MET A 659 3.075 -1.069 11.269 1.00 62.51 H new ATOM 1179 N GLU A 660 7.895 1.454 5.718 1.00 10.21 N ATOM 1180 CA GLU A 660 8.910 2.214 5.053 1.00 43.13 C ATOM 1181 C GLU A 660 8.346 2.729 3.724 1.00 11.43 C ATOM 1182 O GLU A 660 8.600 3.865 3.327 1.00 51.31 O ATOM 1183 CB GLU A 660 10.160 1.359 4.826 1.00 13.10 C ATOM 1184 CG GLU A 660 11.289 2.140 4.212 1.00 31.15 C ATOM 1185 CD GLU A 660 12.536 1.325 3.950 1.00 24.01 C ATOM 1186 OE1 GLU A 660 13.374 1.179 4.864 1.00 74.02 O ATOM 1187 OE2 GLU A 660 12.716 0.842 2.814 1.00 61.31 O ATOM 0 H GLU A 660 8.112 0.464 5.835 1.00 10.21 H new ATOM 0 HA GLU A 660 9.203 3.061 5.673 1.00 43.13 H new ATOM 0 HB2 GLU A 660 10.488 0.940 5.778 1.00 13.10 H new ATOM 0 HB3 GLU A 660 9.909 0.519 4.178 1.00 13.10 H new ATOM 0 HG2 GLU A 660 10.947 2.573 3.272 1.00 31.15 H new ATOM 0 HG3 GLU A 660 11.543 2.970 4.872 1.00 31.15 H new ATOM 1194 N THR A 661 7.546 1.883 3.072 1.00 52.11 N ATOM 1195 CA THR A 661 6.886 2.244 1.841 1.00 30.21 C ATOM 1196 C THR A 661 5.921 3.411 2.082 1.00 24.24 C ATOM 1197 O THR A 661 5.985 4.429 1.398 1.00 11.54 O ATOM 1198 CB THR A 661 6.109 1.043 1.285 1.00 33.00 C ATOM 1199 OG1 THR A 661 7.025 -0.037 1.104 1.00 51.23 O ATOM 1200 CG2 THR A 661 5.454 1.376 -0.057 1.00 2.30 C ATOM 0 H THR A 661 7.346 0.935 3.391 1.00 52.11 H new ATOM 0 HA THR A 661 7.643 2.547 1.118 1.00 30.21 H new ATOM 0 HB THR A 661 5.320 0.776 1.988 1.00 33.00 H new ATOM 0 HG1 THR A 661 7.278 -0.401 1.978 1.00 51.23 H new ATOM 0 HG21 THR A 661 4.912 0.504 -0.423 1.00 2.30 H new ATOM 0 HG22 THR A 661 4.760 2.207 0.073 1.00 2.30 H new ATOM 0 HG23 THR A 661 6.223 1.654 -0.778 1.00 2.30 H new ATOM 1208 N LEU A 662 5.057 3.257 3.097 1.00 1.00 N ATOM 1209 CA LEU A 662 4.059 4.272 3.447 1.00 52.04 C ATOM 1210 C LEU A 662 4.703 5.605 3.728 1.00 11.45 C ATOM 1211 O LEU A 662 4.363 6.601 3.090 1.00 2.31 O ATOM 1212 CB LEU A 662 3.232 3.849 4.674 1.00 14.12 C ATOM 1213 CG LEU A 662 2.369 2.592 4.547 1.00 43.33 C ATOM 1214 CD1 LEU A 662 1.724 2.265 5.883 1.00 43.00 C ATOM 1215 CD2 LEU A 662 1.293 2.786 3.491 1.00 3.42 C ATOM 0 H LEU A 662 5.032 2.430 3.693 1.00 1.00 H new ATOM 0 HA LEU A 662 3.399 4.368 2.585 1.00 52.04 H new ATOM 0 HB2 LEU A 662 3.919 3.702 5.508 1.00 14.12 H new ATOM 0 HB3 LEU A 662 2.579 4.680 4.941 1.00 14.12 H new ATOM 0 HG LEU A 662 3.010 1.764 4.245 1.00 43.33 H new ATOM 0 HD11 LEU A 662 1.112 1.369 5.782 1.00 43.00 H new ATOM 0 HD12 LEU A 662 2.500 2.092 6.629 1.00 43.00 H new ATOM 0 HD13 LEU A 662 1.097 3.099 6.198 1.00 43.00 H new ATOM 0 HD21 LEU A 662 0.690 1.881 3.416 1.00 3.42 H new ATOM 0 HD22 LEU A 662 0.656 3.625 3.771 1.00 3.42 H new ATOM 0 HD23 LEU A 662 1.761 2.991 2.528 1.00 3.42 H new ATOM 1227 N ARG A 663 5.647 5.624 4.661 1.00 41.04 N ATOM 1228 CA ARG A 663 6.294 6.870 5.057 1.00 54.25 C ATOM 1229 C ARG A 663 6.967 7.546 3.859 1.00 4.42 C ATOM 1230 O ARG A 663 6.859 8.766 3.672 1.00 60.42 O ATOM 1231 CB ARG A 663 7.315 6.634 6.163 1.00 73.31 C ATOM 1232 CG ARG A 663 6.720 6.070 7.439 1.00 75.42 C ATOM 1233 CD ARG A 663 7.779 5.877 8.503 1.00 23.54 C ATOM 1234 NE ARG A 663 8.383 7.146 8.923 1.00 64.50 N ATOM 1235 CZ ARG A 663 9.498 7.262 9.649 1.00 12.11 C ATOM 1236 NH1 ARG A 663 10.207 6.183 9.968 1.00 74.53 N ATOM 1237 NH2 ARG A 663 9.916 8.456 10.039 1.00 61.32 N ATOM 0 H ARG A 663 5.980 4.796 5.155 1.00 41.04 H new ATOM 0 HA ARG A 663 5.517 7.532 5.439 1.00 54.25 H new ATOM 0 HB2 ARG A 663 8.080 5.950 5.797 1.00 73.31 H new ATOM 0 HB3 ARG A 663 7.813 7.576 6.391 1.00 73.31 H new ATOM 0 HG2 ARG A 663 5.947 6.743 7.810 1.00 75.42 H new ATOM 0 HG3 ARG A 663 6.237 5.116 7.227 1.00 75.42 H new ATOM 0 HD2 ARG A 663 7.336 5.384 9.368 1.00 23.54 H new ATOM 0 HD3 ARG A 663 8.557 5.215 8.123 1.00 23.54 H new ATOM 0 HE ARG A 663 7.915 8.007 8.639 1.00 64.50 H new ATOM 0 HH11 ARG A 663 9.900 5.261 9.658 1.00 74.53 H new ATOM 0 HH12 ARG A 663 11.058 6.277 10.523 1.00 74.53 H new ATOM 0 HH21 ARG A 663 9.386 9.290 9.785 1.00 61.32 H new ATOM 0 HH22 ARG A 663 10.768 8.542 10.593 1.00 61.32 H new ATOM 1251 N ARG A 664 7.627 6.735 3.027 1.00 21.42 N ATOM 1252 CA ARG A 664 8.322 7.232 1.847 1.00 3.24 C ATOM 1253 C ARG A 664 7.336 7.839 0.875 1.00 54.41 C ATOM 1254 O ARG A 664 7.546 8.924 0.384 1.00 11.21 O ATOM 1255 CB ARG A 664 9.095 6.112 1.148 1.00 51.11 C ATOM 1256 CG ARG A 664 9.917 6.590 -0.036 1.00 13.11 C ATOM 1257 CD ARG A 664 10.533 5.440 -0.809 1.00 61.41 C ATOM 1258 NE ARG A 664 11.399 4.584 0.008 1.00 25.11 N ATOM 1259 CZ ARG A 664 11.922 3.428 -0.425 1.00 61.21 C ATOM 1260 NH1 ARG A 664 11.698 3.014 -1.676 1.00 0.13 N ATOM 1261 NH2 ARG A 664 12.667 2.690 0.382 1.00 14.14 N ATOM 0 H ARG A 664 7.692 5.725 3.155 1.00 21.42 H new ATOM 0 HA ARG A 664 9.029 7.993 2.176 1.00 3.24 H new ATOM 0 HB2 ARG A 664 9.757 5.633 1.870 1.00 51.11 H new ATOM 0 HB3 ARG A 664 8.391 5.353 0.808 1.00 51.11 H new ATOM 0 HG2 ARG A 664 9.284 7.175 -0.703 1.00 13.11 H new ATOM 0 HG3 ARG A 664 10.707 7.253 0.317 1.00 13.11 H new ATOM 0 HD2 ARG A 664 9.736 4.833 -1.238 1.00 61.41 H new ATOM 0 HD3 ARG A 664 11.112 5.841 -1.641 1.00 61.41 H new ATOM 0 HE ARG A 664 11.615 4.885 0.958 1.00 25.11 H new ATOM 0 HH11 ARG A 664 11.127 3.578 -2.305 1.00 0.13 H new ATOM 0 HH12 ARG A 664 12.098 2.134 -2.001 1.00 0.13 H new ATOM 0 HH21 ARG A 664 12.845 3.000 1.337 1.00 14.14 H new ATOM 0 HH22 ARG A 664 13.063 1.811 0.049 1.00 14.14 H new ATOM 1275 N SER A 665 6.253 7.159 0.632 1.00 50.12 N ATOM 1276 CA SER A 665 5.280 7.622 -0.313 1.00 12.11 C ATOM 1277 C SER A 665 4.578 8.873 0.190 1.00 3.43 C ATOM 1278 O SER A 665 4.221 9.734 -0.595 1.00 4.22 O ATOM 1279 CB SER A 665 4.277 6.521 -0.631 1.00 54.03 C ATOM 1280 OG SER A 665 4.931 5.395 -1.180 1.00 40.33 O ATOM 0 H SER A 665 6.021 6.273 1.081 1.00 50.12 H new ATOM 0 HA SER A 665 5.800 7.885 -1.234 1.00 12.11 H new ATOM 0 HB2 SER A 665 3.745 6.233 0.276 1.00 54.03 H new ATOM 0 HB3 SER A 665 3.531 6.893 -1.333 1.00 54.03 H new ATOM 0 HG SER A 665 5.378 4.896 -0.465 1.00 40.33 H new ATOM 1286 N MET A 666 4.400 8.984 1.489 1.00 2.24 N ATOM 1287 CA MET A 666 3.744 10.162 2.046 1.00 23.45 C ATOM 1288 C MET A 666 4.656 11.358 1.958 1.00 60.23 C ATOM 1289 O MET A 666 4.231 12.445 1.602 1.00 21.12 O ATOM 1290 CB MET A 666 3.361 9.959 3.500 1.00 25.13 C ATOM 1291 CG MET A 666 2.401 8.832 3.760 1.00 31.15 C ATOM 1292 SD MET A 666 2.019 8.669 5.490 1.00 50.44 S ATOM 1293 CE MET A 666 1.258 10.250 5.830 1.00 5.23 C ATOM 0 H MET A 666 4.693 8.288 2.175 1.00 2.24 H new ATOM 0 HA MET A 666 2.839 10.328 1.462 1.00 23.45 H new ATOM 0 HB2 MET A 666 4.269 9.781 4.076 1.00 25.13 H new ATOM 0 HB3 MET A 666 2.921 10.883 3.875 1.00 25.13 H new ATOM 0 HG2 MET A 666 1.481 9.002 3.200 1.00 31.15 H new ATOM 0 HG3 MET A 666 2.829 7.899 3.394 1.00 31.15 H new ATOM 0 HE1 MET A 666 0.702 10.193 6.766 1.00 5.23 H new ATOM 0 HE2 MET A 666 2.030 11.015 5.912 1.00 5.23 H new ATOM 0 HE3 MET A 666 0.577 10.508 5.019 1.00 5.23 H new ATOM 1303 N SER A 667 5.904 11.145 2.259 1.00 2.15 N ATOM 1304 CA SER A 667 6.867 12.201 2.219 1.00 51.03 C ATOM 1305 C SER A 667 7.201 12.547 0.769 1.00 25.15 C ATOM 1306 O SER A 667 7.007 13.688 0.333 1.00 32.21 O ATOM 1307 CB SER A 667 8.130 11.789 3.004 1.00 2.42 C ATOM 1308 OG SER A 667 9.108 12.823 3.026 1.00 62.54 O ATOM 0 H SER A 667 6.279 10.238 2.537 1.00 2.15 H new ATOM 0 HA SER A 667 6.451 13.092 2.690 1.00 51.03 H new ATOM 0 HB2 SER A 667 7.853 11.531 4.026 1.00 2.42 H new ATOM 0 HB3 SER A 667 8.560 10.894 2.555 1.00 2.42 H new ATOM 0 HG SER A 667 9.890 12.523 3.534 1.00 62.54 H new ATOM 1314 N THR A 668 7.630 11.553 0.014 1.00 44.31 N ATOM 1315 CA THR A 668 8.082 11.764 -1.336 1.00 64.22 C ATOM 1316 C THR A 668 6.943 12.117 -2.284 1.00 73.23 C ATOM 1317 O THR A 668 6.988 13.136 -2.977 1.00 60.44 O ATOM 1318 CB THR A 668 8.833 10.522 -1.844 1.00 62.30 C ATOM 1319 OG1 THR A 668 9.947 10.255 -0.966 1.00 10.34 O ATOM 1320 CG2 THR A 668 9.340 10.710 -3.271 1.00 53.22 C ATOM 0 H THR A 668 7.672 10.582 0.324 1.00 44.31 H new ATOM 0 HA THR A 668 8.759 12.618 -1.319 1.00 64.22 H new ATOM 0 HB THR A 668 8.139 9.681 -1.848 1.00 62.30 H new ATOM 0 HG1 THR A 668 9.636 9.748 -0.187 1.00 10.34 H new ATOM 0 HG21 THR A 668 9.865 9.810 -3.592 1.00 53.22 H new ATOM 0 HG22 THR A 668 8.496 10.895 -3.936 1.00 53.22 H new ATOM 0 HG23 THR A 668 10.022 11.560 -3.306 1.00 53.22 H new ATOM 1328 N GLU A 669 5.917 11.313 -2.294 1.00 70.31 N ATOM 1329 CA GLU A 669 4.870 11.493 -3.249 1.00 43.24 C ATOM 1330 C GLU A 669 3.672 12.302 -2.710 1.00 4.03 C ATOM 1331 O GLU A 669 2.866 12.838 -3.481 1.00 25.40 O ATOM 1332 CB GLU A 669 4.499 10.151 -3.869 1.00 24.24 C ATOM 1333 CG GLU A 669 3.406 10.230 -4.887 1.00 61.14 C ATOM 1334 CD GLU A 669 3.450 9.110 -5.888 1.00 60.35 C ATOM 1335 OE1 GLU A 669 3.392 7.949 -5.504 1.00 63.21 O ATOM 1336 OE2 GLU A 669 3.587 9.394 -7.111 1.00 10.10 O ATOM 0 H GLU A 669 5.787 10.531 -1.653 1.00 70.31 H new ATOM 0 HA GLU A 669 5.247 12.126 -4.052 1.00 43.24 H new ATOM 0 HB2 GLU A 669 5.385 9.721 -4.336 1.00 24.24 H new ATOM 0 HB3 GLU A 669 4.194 9.468 -3.076 1.00 24.24 H new ATOM 0 HG2 GLU A 669 2.442 10.217 -4.378 1.00 61.14 H new ATOM 0 HG3 GLU A 669 3.476 11.182 -5.413 1.00 61.14 H new ATOM 1343 N GLY A 670 3.573 12.427 -1.408 1.00 14.22 N ATOM 1344 CA GLY A 670 2.520 13.245 -0.834 1.00 63.31 C ATOM 1345 C GLY A 670 2.712 14.699 -1.215 1.00 43.41 C ATOM 1346 O GLY A 670 1.769 15.386 -1.620 1.00 10.13 O ATOM 0 H GLY A 670 4.195 11.983 -0.732 1.00 14.22 H new ATOM 0 HA2 GLY A 670 1.548 12.896 -1.184 1.00 63.31 H new ATOM 0 HA3 GLY A 670 2.523 13.144 0.251 1.00 63.31 H new ATOM 1350 N ASN A 671 3.957 15.147 -1.150 1.00 54.33 N ATOM 1351 CA ASN A 671 4.307 16.528 -1.501 1.00 21.44 C ATOM 1352 C ASN A 671 4.462 16.689 -3.007 1.00 2.51 C ATOM 1353 O ASN A 671 4.855 17.745 -3.496 1.00 12.52 O ATOM 1354 CB ASN A 671 5.589 16.992 -0.785 1.00 30.13 C ATOM 1355 CG ASN A 671 5.442 17.050 0.723 1.00 50.32 C ATOM 1356 OD1 ASN A 671 5.011 18.062 1.271 1.00 71.43 O ATOM 1357 ND2 ASN A 671 5.826 15.999 1.399 1.00 64.54 N ATOM 0 H ASN A 671 4.750 14.576 -0.857 1.00 54.33 H new ATOM 0 HA ASN A 671 3.485 17.159 -1.164 1.00 21.44 H new ATOM 0 HB2 ASN A 671 6.405 16.315 -1.038 1.00 30.13 H new ATOM 0 HB3 ASN A 671 5.867 17.979 -1.155 1.00 30.13 H new ATOM 0 HD21 ASN A 671 5.773 16.001 2.418 1.00 64.54 H new ATOM 0 HD22 ASN A 671 6.178 15.177 0.908 1.00 64.54 H new ATOM 1364 N LYS A 672 4.153 15.640 -3.729 1.00 31.34 N ATOM 1365 CA LYS A 672 4.192 15.644 -5.177 1.00 55.34 C ATOM 1366 C LYS A 672 2.869 16.174 -5.713 1.00 1.53 C ATOM 1367 O LYS A 672 2.836 17.096 -6.516 1.00 64.51 O ATOM 1368 CB LYS A 672 4.439 14.217 -5.678 1.00 43.24 C ATOM 1369 CG LYS A 672 4.377 14.011 -7.181 1.00 44.32 C ATOM 1370 CD LYS A 672 4.563 12.540 -7.506 1.00 13.14 C ATOM 1371 CE LYS A 672 4.459 12.244 -8.984 1.00 1.32 C ATOM 1372 NZ LYS A 672 4.671 10.804 -9.259 1.00 53.52 N ATOM 0 H LYS A 672 3.864 14.748 -3.327 1.00 31.34 H new ATOM 0 HA LYS A 672 4.998 16.287 -5.529 1.00 55.34 H new ATOM 0 HB2 LYS A 672 5.421 13.897 -5.329 1.00 43.24 H new ATOM 0 HB3 LYS A 672 3.705 13.559 -5.212 1.00 43.24 H new ATOM 0 HG2 LYS A 672 3.419 14.360 -7.566 1.00 44.32 H new ATOM 0 HG3 LYS A 672 5.151 14.602 -7.671 1.00 44.32 H new ATOM 0 HD2 LYS A 672 5.538 12.214 -7.144 1.00 13.14 H new ATOM 0 HD3 LYS A 672 3.813 11.958 -6.971 1.00 13.14 H new ATOM 0 HE2 LYS A 672 3.478 12.546 -9.350 1.00 1.32 H new ATOM 0 HE3 LYS A 672 5.197 12.833 -9.528 1.00 1.32 H new ATOM 0 HZ1 LYS A 672 4.288 10.570 -10.197 1.00 53.52 H new ATOM 0 HZ2 LYS A 672 5.689 10.593 -9.239 1.00 53.52 H new ATOM 0 HZ3 LYS A 672 4.185 10.237 -8.535 1.00 53.52 H new ATOM 1386 N ARG A 673 1.780 15.598 -5.241 1.00 13.41 N ATOM 1387 CA ARG A 673 0.453 15.998 -5.699 1.00 15.33 C ATOM 1388 C ARG A 673 -0.141 17.070 -4.796 1.00 71.54 C ATOM 1389 O ARG A 673 -1.019 17.821 -5.206 1.00 74.44 O ATOM 1390 CB ARG A 673 -0.502 14.795 -5.722 1.00 41.50 C ATOM 1391 CG ARG A 673 -0.086 13.643 -6.624 1.00 74.51 C ATOM 1392 CD ARG A 673 0.031 14.071 -8.076 1.00 5.13 C ATOM 1393 NE ARG A 673 0.345 12.938 -8.949 1.00 13.40 N ATOM 1394 CZ ARG A 673 0.824 13.034 -10.193 1.00 72.44 C ATOM 1395 NH1 ARG A 673 1.080 14.225 -10.726 1.00 5.40 N ATOM 1396 NH2 ARG A 673 1.050 11.936 -10.896 1.00 11.22 N ATOM 0 H ARG A 673 1.782 14.854 -4.543 1.00 13.41 H new ATOM 0 HA ARG A 673 0.569 16.397 -6.707 1.00 15.33 H new ATOM 0 HB2 ARG A 673 -0.606 14.417 -4.705 1.00 41.50 H new ATOM 0 HB3 ARG A 673 -1.487 15.141 -6.036 1.00 41.50 H new ATOM 0 HG2 ARG A 673 0.870 13.245 -6.285 1.00 74.51 H new ATOM 0 HG3 ARG A 673 -0.815 12.837 -6.541 1.00 74.51 H new ATOM 0 HD2 ARG A 673 -0.904 14.530 -8.397 1.00 5.13 H new ATOM 0 HD3 ARG A 673 0.808 14.830 -8.171 1.00 5.13 H new ATOM 0 HE ARG A 673 0.185 12.001 -8.578 1.00 13.40 H new ATOM 0 HH11 ARG A 673 0.911 15.073 -10.185 1.00 5.40 H new ATOM 0 HH12 ARG A 673 1.445 14.291 -11.676 1.00 5.40 H new ATOM 0 HH21 ARG A 673 0.859 11.021 -10.488 1.00 11.22 H new ATOM 0 HH22 ARG A 673 1.416 12.005 -11.846 1.00 11.22 H new ATOM 1410 N GLY A 674 0.324 17.122 -3.560 1.00 13.23 N ATOM 1411 CA GLY A 674 -0.253 18.043 -2.589 1.00 0.14 C ATOM 1412 C GLY A 674 -1.355 17.347 -1.824 1.00 0.12 C ATOM 1413 O GLY A 674 -1.978 17.906 -0.910 1.00 60.13 O ATOM 0 H GLY A 674 1.089 16.547 -3.206 1.00 13.23 H new ATOM 0 HA2 GLY A 674 0.517 18.392 -1.901 1.00 0.14 H new ATOM 0 HA3 GLY A 674 -0.648 18.923 -3.097 1.00 0.14 H new ATOM 1417 N MET A 675 -1.570 16.125 -2.210 1.00 64.21 N ATOM 1418 CA MET A 675 -2.535 15.246 -1.645 1.00 53.43 C ATOM 1419 C MET A 675 -1.983 13.869 -1.760 1.00 15.33 C ATOM 1420 O MET A 675 -0.980 13.656 -2.449 1.00 11.05 O ATOM 1421 CB MET A 675 -3.890 15.329 -2.373 1.00 23.30 C ATOM 1422 CG MET A 675 -3.826 15.006 -3.839 1.00 65.40 C ATOM 1423 SD MET A 675 -5.430 15.152 -4.644 1.00 10.44 S ATOM 1424 CE MET A 675 -4.982 14.776 -6.332 1.00 32.23 C ATOM 0 H MET A 675 -1.044 15.696 -2.971 1.00 64.21 H new ATOM 0 HA MET A 675 -2.721 15.524 -0.608 1.00 53.43 H new ATOM 0 HB2 MET A 675 -4.590 14.645 -1.893 1.00 23.30 H new ATOM 0 HB3 MET A 675 -4.293 16.334 -2.252 1.00 23.30 H new ATOM 0 HG2 MET A 675 -3.116 15.675 -4.325 1.00 65.40 H new ATOM 0 HG3 MET A 675 -3.448 13.992 -3.969 1.00 65.40 H new ATOM 0 HE1 MET A 675 -5.869 14.824 -6.963 1.00 32.23 H new ATOM 0 HE2 MET A 675 -4.247 15.500 -6.683 1.00 32.23 H new ATOM 0 HE3 MET A 675 -4.556 13.774 -6.381 1.00 32.23 H new ATOM 1434 N ILE A 676 -2.609 12.968 -1.126 1.00 13.11 N ATOM 1435 CA ILE A 676 -2.186 11.621 -1.096 1.00 61.20 C ATOM 1436 C ILE A 676 -3.367 10.681 -1.345 1.00 74.24 C ATOM 1437 O ILE A 676 -4.491 10.959 -0.946 1.00 73.41 O ATOM 1438 CB ILE A 676 -1.484 11.316 0.254 1.00 71.10 C ATOM 1439 CG1 ILE A 676 -1.209 9.822 0.393 1.00 70.33 C ATOM 1440 CG2 ILE A 676 -2.295 11.854 1.396 1.00 20.40 C ATOM 1441 CD1 ILE A 676 -0.426 9.414 1.600 1.00 62.35 C ATOM 0 H ILE A 676 -3.460 13.146 -0.593 1.00 13.11 H new ATOM 0 HA ILE A 676 -1.464 11.454 -1.896 1.00 61.20 H new ATOM 0 HB ILE A 676 -0.518 11.820 0.275 1.00 71.10 H new ATOM 0 HG12 ILE A 676 -2.164 9.296 0.407 1.00 70.33 H new ATOM 0 HG13 ILE A 676 -0.673 9.486 -0.495 1.00 70.33 H new ATOM 0 HG21 ILE A 676 -1.791 11.633 2.337 1.00 20.40 H new ATOM 0 HG22 ILE A 676 -2.404 12.933 1.288 1.00 20.40 H new ATOM 0 HG23 ILE A 676 -3.280 11.387 1.394 1.00 20.40 H new ATOM 0 HD11 ILE A 676 -0.290 8.333 1.597 1.00 62.35 H new ATOM 0 HD12 ILE A 676 0.548 9.903 1.584 1.00 62.35 H new ATOM 0 HD13 ILE A 676 -0.965 9.709 2.500 1.00 62.35 H new ATOM 1453 N GLN A 677 -3.104 9.609 -2.030 1.00 1.14 N ATOM 1454 CA GLN A 677 -4.113 8.625 -2.346 1.00 21.54 C ATOM 1455 C GLN A 677 -3.926 7.395 -1.469 1.00 44.52 C ATOM 1456 O GLN A 677 -2.809 6.960 -1.247 1.00 33.44 O ATOM 1457 CB GLN A 677 -4.013 8.226 -3.817 1.00 14.04 C ATOM 1458 CG GLN A 677 -5.039 7.197 -4.235 1.00 63.23 C ATOM 1459 CD GLN A 677 -4.964 6.814 -5.700 1.00 31.52 C ATOM 1460 OE1 GLN A 677 -5.273 5.692 -6.067 1.00 34.11 O ATOM 1461 NE2 GLN A 677 -4.581 7.736 -6.543 1.00 43.44 N ATOM 0 H GLN A 677 -2.177 9.384 -2.392 1.00 1.14 H new ATOM 0 HA GLN A 677 -5.097 9.055 -2.159 1.00 21.54 H new ATOM 0 HB2 GLN A 677 -4.130 9.116 -4.435 1.00 14.04 H new ATOM 0 HB3 GLN A 677 -3.015 7.832 -4.011 1.00 14.04 H new ATOM 0 HG2 GLN A 677 -4.908 6.301 -3.628 1.00 63.23 H new ATOM 0 HG3 GLN A 677 -6.035 7.584 -4.021 1.00 63.23 H new ATOM 0 HE21 GLN A 677 -4.329 8.664 -6.204 1.00 43.44 H new ATOM 0 HE22 GLN A 677 -4.534 7.527 -7.540 1.00 43.44 H new ATOM 1470 N LEU A 678 -5.001 6.861 -0.963 1.00 41.31 N ATOM 1471 CA LEU A 678 -4.949 5.671 -0.146 1.00 23.10 C ATOM 1472 C LEU A 678 -5.909 4.650 -0.695 1.00 22.41 C ATOM 1473 O LEU A 678 -7.034 4.986 -1.059 1.00 1.11 O ATOM 1474 CB LEU A 678 -5.338 5.940 1.333 1.00 62.54 C ATOM 1475 CG LEU A 678 -4.537 6.971 2.133 1.00 35.34 C ATOM 1476 CD1 LEU A 678 -3.074 6.642 2.095 1.00 0.05 C ATOM 1477 CD2 LEU A 678 -4.810 8.397 1.671 1.00 63.53 C ATOM 0 H LEU A 678 -5.940 7.234 -1.102 1.00 41.31 H new ATOM 0 HA LEU A 678 -3.919 5.316 -0.171 1.00 23.10 H new ATOM 0 HB2 LEU A 678 -6.383 6.251 1.348 1.00 62.54 H new ATOM 0 HB3 LEU A 678 -5.280 4.991 1.867 1.00 62.54 H new ATOM 0 HG LEU A 678 -4.870 6.918 3.170 1.00 35.34 H new ATOM 0 HD11 LEU A 678 -2.519 7.385 2.668 1.00 0.05 H new ATOM 0 HD12 LEU A 678 -2.912 5.655 2.527 1.00 0.05 H new ATOM 0 HD13 LEU A 678 -2.727 6.648 1.062 1.00 0.05 H new ATOM 0 HD21 LEU A 678 -4.219 9.092 2.268 1.00 63.53 H new ATOM 0 HD22 LEU A 678 -4.537 8.498 0.621 1.00 63.53 H new ATOM 0 HD23 LEU A 678 -5.869 8.623 1.794 1.00 63.53 H new ATOM 1489 N ILE A 679 -5.474 3.438 -0.780 1.00 44.11 N ATOM 1490 CA ILE A 679 -6.316 2.353 -1.192 1.00 40.24 C ATOM 1491 C ILE A 679 -6.350 1.365 -0.089 1.00 25.13 C ATOM 1492 O ILE A 679 -5.328 0.787 0.272 1.00 32.34 O ATOM 1493 CB ILE A 679 -5.808 1.689 -2.486 1.00 20.10 C ATOM 1494 CG1 ILE A 679 -5.833 2.721 -3.594 1.00 60.22 C ATOM 1495 CG2 ILE A 679 -6.694 0.481 -2.858 1.00 55.01 C ATOM 1496 CD1 ILE A 679 -5.108 2.327 -4.857 1.00 63.23 C ATOM 0 H ILE A 679 -4.515 3.164 -0.564 1.00 44.11 H new ATOM 0 HA ILE A 679 -7.314 2.734 -1.406 1.00 40.24 H new ATOM 0 HB ILE A 679 -4.791 1.325 -2.339 1.00 20.10 H new ATOM 0 HG12 ILE A 679 -6.872 2.938 -3.843 1.00 60.22 H new ATOM 0 HG13 ILE A 679 -5.396 3.646 -3.217 1.00 60.22 H new ATOM 0 HG21 ILE A 679 -6.320 0.024 -3.775 1.00 55.01 H new ATOM 0 HG22 ILE A 679 -6.668 -0.251 -2.051 1.00 55.01 H new ATOM 0 HG23 ILE A 679 -7.720 0.816 -3.012 1.00 55.01 H new ATOM 0 HD11 ILE A 679 -5.185 3.133 -5.587 1.00 63.23 H new ATOM 0 HD12 ILE A 679 -4.058 2.141 -4.631 1.00 63.23 H new ATOM 0 HD13 ILE A 679 -5.557 1.422 -5.267 1.00 63.23 H new ATOM 1508 N VAL A 680 -7.488 1.197 0.457 1.00 34.31 N ATOM 1509 CA VAL A 680 -7.679 0.295 1.559 1.00 31.21 C ATOM 1510 C VAL A 680 -8.754 -0.716 1.214 1.00 70.04 C ATOM 1511 O VAL A 680 -9.605 -0.465 0.340 1.00 42.31 O ATOM 1512 CB VAL A 680 -8.040 1.049 2.879 1.00 61.31 C ATOM 1513 CG1 VAL A 680 -6.918 1.992 3.284 1.00 63.13 C ATOM 1514 CG2 VAL A 680 -9.346 1.822 2.747 1.00 51.51 C ATOM 0 H VAL A 680 -8.336 1.680 0.160 1.00 34.31 H new ATOM 0 HA VAL A 680 -6.736 -0.223 1.734 1.00 31.21 H new ATOM 0 HB VAL A 680 -8.170 0.296 3.656 1.00 61.31 H new ATOM 0 HG11 VAL A 680 -7.190 2.507 4.205 1.00 63.13 H new ATOM 0 HG12 VAL A 680 -6.003 1.421 3.444 1.00 63.13 H new ATOM 0 HG13 VAL A 680 -6.755 2.725 2.494 1.00 63.13 H new ATOM 0 HG21 VAL A 680 -9.563 2.333 3.685 1.00 51.51 H new ATOM 0 HG22 VAL A 680 -9.255 2.556 1.947 1.00 51.51 H new ATOM 0 HG23 VAL A 680 -10.156 1.131 2.515 1.00 51.51 H new ATOM 1524 N ALA A 681 -8.720 -1.840 1.864 1.00 53.11 N ATOM 1525 CA ALA A 681 -9.682 -2.871 1.612 1.00 40.42 C ATOM 1526 C ALA A 681 -10.599 -3.034 2.794 1.00 24.23 C ATOM 1527 O ALA A 681 -10.185 -2.898 3.962 1.00 14.33 O ATOM 1528 CB ALA A 681 -8.993 -4.190 1.309 1.00 13.25 C ATOM 0 H ALA A 681 -8.030 -2.068 2.579 1.00 53.11 H new ATOM 0 HA ALA A 681 -10.271 -2.578 0.743 1.00 40.42 H new ATOM 0 HB1 ALA A 681 -9.744 -4.958 1.121 1.00 13.25 H new ATOM 0 HB2 ALA A 681 -8.361 -4.077 0.428 1.00 13.25 H new ATOM 0 HB3 ALA A 681 -8.379 -4.484 2.160 1.00 13.25 H new ATOM 1534 N ARG A 682 -11.832 -3.301 2.517 1.00 75.55 N ATOM 1535 CA ARG A 682 -12.787 -3.551 3.547 1.00 50.01 C ATOM 1536 C ARG A 682 -13.583 -4.758 3.197 1.00 64.21 C ATOM 1537 O ARG A 682 -13.841 -5.013 2.024 1.00 71.43 O ATOM 1538 CB ARG A 682 -13.761 -2.384 3.753 1.00 3.51 C ATOM 1539 CG ARG A 682 -14.599 -2.085 2.534 1.00 20.43 C ATOM 1540 CD ARG A 682 -15.894 -1.410 2.895 1.00 54.10 C ATOM 1541 NE ARG A 682 -15.739 -0.100 3.520 1.00 55.21 N ATOM 1542 CZ ARG A 682 -16.751 0.763 3.679 1.00 22.10 C ATOM 1543 NH1 ARG A 682 -17.977 0.439 3.258 1.00 51.14 N ATOM 1544 NH2 ARG A 682 -16.537 1.935 4.251 1.00 45.42 N ATOM 0 H ARG A 682 -12.207 -3.352 1.570 1.00 75.55 H new ATOM 0 HA ARG A 682 -12.225 -3.691 4.471 1.00 50.01 H new ATOM 0 HB2 ARG A 682 -14.419 -2.613 4.591 1.00 3.51 H new ATOM 0 HB3 ARG A 682 -13.197 -1.492 4.025 1.00 3.51 H new ATOM 0 HG2 ARG A 682 -14.035 -1.448 1.853 1.00 20.43 H new ATOM 0 HG3 ARG A 682 -14.809 -3.013 2.002 1.00 20.43 H new ATOM 0 HD2 ARG A 682 -16.495 -1.299 1.993 1.00 54.10 H new ATOM 0 HD3 ARG A 682 -16.451 -2.058 3.572 1.00 54.10 H new ATOM 0 HE ARG A 682 -14.814 0.172 3.852 1.00 55.21 H new ATOM 0 HH11 ARG A 682 -18.142 -0.465 2.816 1.00 51.14 H new ATOM 0 HH12 ARG A 682 -18.748 1.096 3.379 1.00 51.14 H new ATOM 0 HH21 ARG A 682 -15.601 2.183 4.572 1.00 45.42 H new ATOM 0 HH22 ARG A 682 -17.308 2.592 4.372 1.00 45.42 H new ATOM 1558 N ARG A 683 -13.964 -5.498 4.179 1.00 24.04 N ATOM 1559 CA ARG A 683 -14.857 -6.585 3.961 1.00 12.45 C ATOM 1560 C ARG A 683 -16.256 -6.031 4.064 1.00 54.33 C ATOM 1561 O ARG A 683 -16.490 -5.099 4.845 1.00 32.10 O ATOM 1562 CB ARG A 683 -14.633 -7.724 4.967 1.00 32.11 C ATOM 1563 CG ARG A 683 -14.856 -7.349 6.420 1.00 55.53 C ATOM 1564 CD ARG A 683 -14.685 -8.555 7.321 1.00 61.51 C ATOM 1565 NE ARG A 683 -14.923 -8.227 8.727 1.00 11.14 N ATOM 1566 CZ ARG A 683 -15.326 -9.104 9.656 1.00 54.50 C ATOM 1567 NH1 ARG A 683 -15.506 -10.383 9.347 1.00 73.23 N ATOM 1568 NH2 ARG A 683 -15.521 -8.697 10.894 1.00 10.02 N ATOM 0 H ARG A 683 -13.670 -5.370 5.147 1.00 24.04 H new ATOM 0 HA ARG A 683 -14.684 -7.022 2.978 1.00 12.45 H new ATOM 0 HB2 ARG A 683 -15.299 -8.549 4.714 1.00 32.11 H new ATOM 0 HB3 ARG A 683 -13.613 -8.092 4.855 1.00 32.11 H new ATOM 0 HG2 ARG A 683 -14.152 -6.570 6.711 1.00 55.53 H new ATOM 0 HG3 ARG A 683 -15.857 -6.936 6.544 1.00 55.53 H new ATOM 0 HD2 ARG A 683 -15.374 -9.340 7.010 1.00 61.51 H new ATOM 0 HD3 ARG A 683 -13.676 -8.953 7.207 1.00 61.51 H new ATOM 0 HE ARG A 683 -14.771 -7.262 9.021 1.00 11.14 H new ATOM 0 HH11 ARG A 683 -15.337 -10.706 8.394 1.00 73.23 H new ATOM 0 HH12 ARG A 683 -15.813 -11.042 10.062 1.00 73.23 H new ATOM 0 HH21 ARG A 683 -15.365 -7.719 11.140 1.00 10.02 H new ATOM 0 HH22 ARG A 683 -15.828 -9.359 11.606 1.00 10.02 H new ATOM 1582 N ILE A 684 -17.165 -6.532 3.275 1.00 21.52 N ATOM 1583 CA ILE A 684 -18.521 -6.033 3.325 1.00 11.45 C ATOM 1584 C ILE A 684 -19.232 -6.602 4.545 1.00 24.33 C ATOM 1585 O ILE A 684 -19.758 -7.714 4.523 1.00 41.35 O ATOM 1586 CB ILE A 684 -19.367 -6.282 2.010 1.00 54.01 C ATOM 1587 CG1 ILE A 684 -18.776 -5.588 0.778 1.00 74.30 C ATOM 1588 CG2 ILE A 684 -20.780 -5.828 2.170 1.00 20.31 C ATOM 1589 CD1 ILE A 684 -17.549 -6.221 0.249 1.00 65.12 C ATOM 0 H ILE A 684 -17.001 -7.276 2.596 1.00 21.52 H new ATOM 0 HA ILE A 684 -18.442 -4.949 3.404 1.00 11.45 H new ATOM 0 HB ILE A 684 -19.336 -7.360 1.852 1.00 54.01 H new ATOM 0 HG12 ILE A 684 -19.529 -5.570 -0.010 1.00 74.30 H new ATOM 0 HG13 ILE A 684 -18.555 -4.551 1.031 1.00 74.30 H new ATOM 0 HG21 ILE A 684 -21.329 -6.015 1.247 1.00 20.31 H new ATOM 0 HG22 ILE A 684 -21.248 -6.376 2.988 1.00 20.31 H new ATOM 0 HG23 ILE A 684 -20.796 -4.761 2.392 1.00 20.31 H new ATOM 0 HD11 ILE A 684 -17.199 -5.666 -0.621 1.00 65.12 H new ATOM 0 HD12 ILE A 684 -16.776 -6.215 1.018 1.00 65.12 H new ATOM 0 HD13 ILE A 684 -17.766 -7.249 -0.040 1.00 65.12 H new ATOM 1601 N SER A 685 -19.149 -5.876 5.619 1.00 24.41 N ATOM 1602 CA SER A 685 -19.776 -6.228 6.855 1.00 23.33 C ATOM 1603 C SER A 685 -20.071 -4.952 7.613 1.00 24.44 C ATOM 1604 O SER A 685 -19.148 -4.241 8.023 1.00 32.32 O ATOM 1605 CB SER A 685 -18.840 -7.133 7.678 1.00 33.22 C ATOM 1606 OG SER A 685 -18.481 -8.294 6.936 1.00 50.32 O ATOM 0 H SER A 685 -18.629 -4.999 5.660 1.00 24.41 H new ATOM 0 HA SER A 685 -20.701 -6.773 6.669 1.00 23.33 H new ATOM 0 HB2 SER A 685 -17.942 -6.580 7.954 1.00 33.22 H new ATOM 0 HB3 SER A 685 -19.332 -7.426 8.605 1.00 33.22 H new ATOM 0 HG SER A 685 -17.885 -8.855 7.475 1.00 50.32 H new ATOM 1612 N ARG A 686 -21.339 -4.631 7.759 1.00 74.42 N ATOM 1613 CA ARG A 686 -21.730 -3.432 8.475 1.00 23.21 C ATOM 1614 C ARG A 686 -21.579 -3.692 9.967 1.00 63.04 C ATOM 1615 O ARG A 686 -21.329 -2.781 10.763 1.00 44.41 O ATOM 1616 CB ARG A 686 -23.165 -3.037 8.113 1.00 42.32 C ATOM 1617 CG ARG A 686 -23.636 -1.733 8.740 1.00 33.00 C ATOM 1618 CD ARG A 686 -25.040 -1.383 8.284 1.00 2.32 C ATOM 1619 NE ARG A 686 -25.121 -1.211 6.824 1.00 32.24 N ATOM 1620 CZ ARG A 686 -26.258 -1.157 6.123 1.00 20.01 C ATOM 1621 NH1 ARG A 686 -27.427 -1.260 6.731 1.00 2.23 N ATOM 1622 NH2 ARG A 686 -26.216 -1.002 4.809 1.00 54.44 N ATOM 0 H ARG A 686 -22.116 -5.181 7.393 1.00 74.42 H new ATOM 0 HA ARG A 686 -21.089 -2.597 8.193 1.00 23.21 H new ATOM 0 HB2 ARG A 686 -23.243 -2.954 7.029 1.00 42.32 H new ATOM 0 HB3 ARG A 686 -23.838 -3.838 8.421 1.00 42.32 H new ATOM 0 HG2 ARG A 686 -23.614 -1.820 9.826 1.00 33.00 H new ATOM 0 HG3 ARG A 686 -22.952 -0.928 8.471 1.00 33.00 H new ATOM 0 HD2 ARG A 686 -25.728 -2.169 8.595 1.00 2.32 H new ATOM 0 HD3 ARG A 686 -25.362 -0.465 8.775 1.00 2.32 H new ATOM 0 HE ARG A 686 -24.244 -1.127 6.309 1.00 32.24 H new ATOM 0 HH11 ARG A 686 -27.467 -1.382 7.743 1.00 2.23 H new ATOM 0 HH12 ARG A 686 -28.290 -1.218 6.188 1.00 2.23 H new ATOM 0 HH21 ARG A 686 -25.317 -0.924 4.333 1.00 54.44 H new ATOM 0 HH22 ARG A 686 -27.082 -0.961 4.272 1.00 54.44 H new ATOM 1636 N CYS A 687 -21.719 -4.946 10.321 1.00 53.44 N ATOM 1637 CA CYS A 687 -21.509 -5.396 11.657 1.00 51.43 C ATOM 1638 C CYS A 687 -20.160 -6.098 11.704 1.00 40.43 C ATOM 1639 O CYS A 687 -20.024 -7.246 11.269 1.00 4.44 O ATOM 1640 CB CYS A 687 -22.637 -6.350 12.095 1.00 42.33 C ATOM 1641 SG CYS A 687 -22.513 -6.942 13.803 1.00 70.02 S ATOM 0 H CYS A 687 -21.986 -5.686 9.672 1.00 53.44 H new ATOM 0 HA CYS A 687 -21.517 -4.550 12.345 1.00 51.43 H new ATOM 0 HB2 CYS A 687 -23.593 -5.841 11.971 1.00 42.33 H new ATOM 0 HB3 CYS A 687 -22.645 -7.211 11.427 1.00 42.33 H new ATOM 0 HG CYS A 687 -23.512 -7.733 14.062 1.00 70.02 H new ATOM 1647 N ASN A 688 -19.160 -5.391 12.144 1.00 20.51 N ATOM 1648 CA ASN A 688 -17.827 -5.941 12.251 1.00 61.44 C ATOM 1649 C ASN A 688 -17.591 -6.381 13.680 1.00 32.14 C ATOM 1650 O ASN A 688 -17.437 -7.580 13.953 1.00 43.11 O ATOM 1651 CB ASN A 688 -16.776 -4.903 11.817 1.00 51.00 C ATOM 1652 CG ASN A 688 -15.356 -5.445 11.859 1.00 35.44 C ATOM 1653 OD1 ASN A 688 -14.871 -6.013 10.880 1.00 32.31 O ATOM 1654 ND2 ASN A 688 -14.683 -5.274 12.964 1.00 70.21 N ATOM 0 H ASN A 688 -19.238 -4.418 12.440 1.00 20.51 H new ATOM 0 HA ASN A 688 -17.733 -6.801 11.589 1.00 61.44 H new ATOM 0 HB2 ASN A 688 -17.001 -4.567 10.805 1.00 51.00 H new ATOM 0 HB3 ASN A 688 -16.846 -4.030 12.466 1.00 51.00 H new ATOM 0 HD21 ASN A 688 -13.724 -5.615 13.035 1.00 70.21 H new ATOM 0 HD22 ASN A 688 -15.116 -4.799 13.756 1.00 70.21 H new ATOM 1661 N GLU A 689 -17.582 -5.400 14.581 1.00 73.02 N ATOM 1662 CA GLU A 689 -17.432 -5.603 16.028 1.00 11.21 C ATOM 1663 C GLU A 689 -16.200 -6.443 16.383 1.00 4.23 C ATOM 1664 O GLU A 689 -15.155 -6.350 15.715 1.00 2.52 O ATOM 1665 CB GLU A 689 -18.705 -6.207 16.609 1.00 53.00 C ATOM 1666 CG GLU A 689 -18.673 -6.390 18.105 1.00 34.02 C ATOM 1667 CD GLU A 689 -19.976 -6.899 18.634 1.00 61.45 C ATOM 1668 OE1 GLU A 689 -20.171 -8.125 18.677 1.00 33.40 O ATOM 1669 OE2 GLU A 689 -20.830 -6.072 19.014 1.00 33.12 O ATOM 0 H GLU A 689 -17.681 -4.418 14.323 1.00 73.02 H new ATOM 0 HA GLU A 689 -17.270 -4.624 16.480 1.00 11.21 H new ATOM 0 HB2 GLU A 689 -19.549 -5.567 16.350 1.00 53.00 H new ATOM 0 HB3 GLU A 689 -18.882 -7.174 16.139 1.00 53.00 H new ATOM 0 HG2 GLU A 689 -17.877 -7.087 18.368 1.00 34.02 H new ATOM 0 HG3 GLU A 689 -18.434 -5.439 18.582 1.00 34.02 H new TER 1676 GLU A 689 ATOM 1677 N MET B 769 -3.120 -4.335 34.448 1.00 74.30 N ATOM 1678 CA MET B 769 -3.874 -5.329 35.193 1.00 45.24 C ATOM 1679 C MET B 769 -4.010 -6.577 34.356 1.00 60.41 C ATOM 1680 O MET B 769 -4.827 -6.616 33.438 1.00 42.40 O ATOM 1681 CB MET B 769 -5.273 -4.804 35.593 1.00 15.53 C ATOM 1682 CG MET B 769 -5.291 -3.629 36.586 1.00 63.43 C ATOM 1683 SD MET B 769 -4.470 -2.112 35.996 1.00 50.00 S ATOM 1684 CE MET B 769 -5.434 -1.741 34.528 1.00 24.32 C ATOM 0 HA MET B 769 -3.333 -5.552 36.113 1.00 45.24 H new ATOM 0 HB2 MET B 769 -5.797 -4.498 34.688 1.00 15.53 H new ATOM 0 HB3 MET B 769 -5.839 -5.629 36.026 1.00 15.53 H new ATOM 0 HG2 MET B 769 -6.327 -3.393 36.828 1.00 63.43 H new ATOM 0 HG3 MET B 769 -4.812 -3.947 37.512 1.00 63.43 H new ATOM 0 HE1 MET B 769 -5.208 -0.730 34.190 1.00 24.32 H new ATOM 0 HE2 MET B 769 -5.185 -2.451 33.740 1.00 24.32 H new ATOM 0 HE3 MET B 769 -6.496 -1.816 34.762 1.00 24.32 H new ATOM 1694 N LEU B 770 -3.173 -7.573 34.666 1.00 53.21 N ATOM 1695 CA LEU B 770 -3.091 -8.837 33.922 1.00 65.31 C ATOM 1696 C LEU B 770 -2.668 -8.546 32.483 1.00 23.21 C ATOM 1697 O LEU B 770 -3.509 -8.312 31.610 1.00 63.12 O ATOM 1698 CB LEU B 770 -4.430 -9.619 33.942 1.00 62.24 C ATOM 1699 CG LEU B 770 -5.048 -9.912 35.321 1.00 5.14 C ATOM 1700 CD1 LEU B 770 -6.344 -10.689 35.167 1.00 70.41 C ATOM 1701 CD2 LEU B 770 -4.081 -10.667 36.218 1.00 41.32 C ATOM 0 H LEU B 770 -2.524 -7.524 35.451 1.00 53.21 H new ATOM 0 HA LEU B 770 -2.349 -9.469 34.410 1.00 65.31 H new ATOM 0 HB2 LEU B 770 -5.159 -9.058 33.357 1.00 62.24 H new ATOM 0 HB3 LEU B 770 -4.275 -10.569 33.432 1.00 62.24 H new ATOM 0 HG LEU B 770 -5.264 -8.955 35.797 1.00 5.14 H new ATOM 0 HD11 LEU B 770 -6.768 -10.888 36.151 1.00 70.41 H new ATOM 0 HD12 LEU B 770 -7.051 -10.104 34.579 1.00 70.41 H new ATOM 0 HD13 LEU B 770 -6.144 -11.633 34.660 1.00 70.41 H new ATOM 0 HD21 LEU B 770 -4.552 -10.856 37.183 1.00 41.32 H new ATOM 0 HD22 LEU B 770 -3.817 -11.616 35.751 1.00 41.32 H new ATOM 0 HD23 LEU B 770 -3.180 -10.071 36.365 1.00 41.32 H new ATOM 1713 N ALA B 771 -1.381 -8.499 32.242 1.00 51.34 N ATOM 1714 CA ALA B 771 -0.891 -8.127 30.935 1.00 42.00 C ATOM 1715 C ALA B 771 -0.021 -9.201 30.307 1.00 11.23 C ATOM 1716 O ALA B 771 1.204 -9.227 30.494 1.00 12.45 O ATOM 1717 CB ALA B 771 -0.170 -6.783 30.975 1.00 65.13 C ATOM 0 H ALA B 771 -0.657 -8.712 32.928 1.00 51.34 H new ATOM 0 HA ALA B 771 -1.766 -8.023 30.294 1.00 42.00 H new ATOM 0 HB1 ALA B 771 0.187 -6.532 29.976 1.00 65.13 H new ATOM 0 HB2 ALA B 771 -0.858 -6.011 31.320 1.00 65.13 H new ATOM 0 HB3 ALA B 771 0.677 -6.845 31.658 1.00 65.13 H new ATOM 1723 N GLU B 772 -0.659 -10.108 29.620 1.00 70.01 N ATOM 1724 CA GLU B 772 0.014 -11.138 28.871 1.00 54.10 C ATOM 1725 C GLU B 772 -0.339 -10.929 27.420 1.00 4.23 C ATOM 1726 O GLU B 772 -1.520 -10.892 27.070 1.00 2.21 O ATOM 1727 CB GLU B 772 -0.424 -12.567 29.296 1.00 54.04 C ATOM 1728 CG GLU B 772 -0.096 -13.003 30.731 1.00 71.24 C ATOM 1729 CD GLU B 772 -0.754 -12.172 31.803 1.00 52.14 C ATOM 1730 OE1 GLU B 772 -1.995 -12.223 31.943 1.00 34.13 O ATOM 1731 OE2 GLU B 772 -0.036 -11.489 32.550 1.00 13.53 O ATOM 0 H GLU B 772 -1.676 -10.155 29.563 1.00 70.01 H new ATOM 0 HA GLU B 772 1.086 -11.066 29.055 1.00 54.10 H new ATOM 0 HB2 GLU B 772 -1.502 -12.645 29.157 1.00 54.04 H new ATOM 0 HB3 GLU B 772 0.038 -13.279 28.612 1.00 54.04 H new ATOM 0 HG2 GLU B 772 -0.397 -14.043 30.859 1.00 71.24 H new ATOM 0 HG3 GLU B 772 0.984 -12.964 30.871 1.00 71.24 H new ATOM 1738 N LEU B 773 0.643 -10.752 26.591 1.00 25.53 N ATOM 1739 CA LEU B 773 0.395 -10.535 25.185 1.00 2.12 C ATOM 1740 C LEU B 773 0.477 -11.839 24.424 1.00 35.32 C ATOM 1741 O LEU B 773 1.479 -12.548 24.510 1.00 52.31 O ATOM 1742 CB LEU B 773 1.419 -9.552 24.609 1.00 41.40 C ATOM 1743 CG LEU B 773 1.466 -8.164 25.247 1.00 0.22 C ATOM 1744 CD1 LEU B 773 2.546 -7.322 24.594 1.00 21.41 C ATOM 1745 CD2 LEU B 773 0.115 -7.473 25.142 1.00 42.04 C ATOM 0 H LEU B 773 1.628 -10.752 26.857 1.00 25.53 H new ATOM 0 HA LEU B 773 -0.607 -10.119 25.079 1.00 2.12 H new ATOM 0 HB2 LEU B 773 2.409 -10.001 24.695 1.00 41.40 H new ATOM 0 HB3 LEU B 773 1.215 -9.432 23.545 1.00 41.40 H new ATOM 0 HG LEU B 773 1.705 -8.281 26.304 1.00 0.22 H new ATOM 0 HD11 LEU B 773 2.569 -6.336 25.058 1.00 21.41 H new ATOM 0 HD12 LEU B 773 3.514 -7.807 24.724 1.00 21.41 H new ATOM 0 HD13 LEU B 773 2.333 -7.218 23.530 1.00 21.41 H new ATOM 0 HD21 LEU B 773 0.174 -6.487 25.603 1.00 42.04 H new ATOM 0 HD22 LEU B 773 -0.159 -7.367 24.092 1.00 42.04 H new ATOM 0 HD23 LEU B 773 -0.639 -8.069 25.655 1.00 42.04 H new ATOM 1757 N TYR B 774 -0.559 -12.157 23.666 1.00 31.23 N ATOM 1758 CA TYR B 774 -0.529 -13.347 22.846 1.00 60.10 C ATOM 1759 C TYR B 774 0.287 -12.988 21.655 1.00 34.55 C ATOM 1760 O TYR B 774 1.066 -13.775 21.128 1.00 21.44 O ATOM 1761 CB TYR B 774 -1.942 -13.777 22.419 1.00 34.12 C ATOM 1762 CG TYR B 774 -1.966 -15.017 21.534 1.00 61.45 C ATOM 1763 CD1 TYR B 774 -1.854 -14.915 20.147 1.00 12.45 C ATOM 1764 CD2 TYR B 774 -2.087 -16.285 22.083 1.00 21.41 C ATOM 1765 CE1 TYR B 774 -1.870 -16.032 19.344 1.00 41.15 C ATOM 1766 CE2 TYR B 774 -2.101 -17.411 21.279 1.00 64.31 C ATOM 1767 CZ TYR B 774 -1.992 -17.276 19.912 1.00 52.22 C ATOM 1768 OH TYR B 774 -2.003 -18.393 19.108 1.00 73.14 O ATOM 0 H TYR B 774 -1.419 -11.613 23.604 1.00 31.23 H new ATOM 0 HA TYR B 774 -0.109 -14.190 23.395 1.00 60.10 H new ATOM 0 HB2 TYR B 774 -2.539 -13.967 23.311 1.00 34.12 H new ATOM 0 HB3 TYR B 774 -2.417 -12.953 21.887 1.00 34.12 H new ATOM 0 HD1 TYR B 774 -1.753 -13.940 19.695 1.00 12.45 H new ATOM 0 HD2 TYR B 774 -2.172 -16.395 23.154 1.00 21.41 H new ATOM 0 HE1 TYR B 774 -1.787 -15.931 18.272 1.00 41.15 H new ATOM 0 HE2 TYR B 774 -2.197 -18.392 21.721 1.00 64.31 H new ATOM 0 HH TYR B 774 -2.095 -19.195 19.664 1.00 73.14 H new ATOM 1778 N GLY B 775 0.115 -11.764 21.267 1.00 53.34 N ATOM 1779 CA GLY B 775 0.852 -11.197 20.234 1.00 25.20 C ATOM 1780 C GLY B 775 2.043 -10.481 20.796 1.00 64.25 C ATOM 1781 O GLY B 775 2.077 -9.251 20.832 1.00 3.13 O ATOM 0 H GLY B 775 -0.567 -11.131 21.686 1.00 53.34 H new ATOM 0 HA2 GLY B 775 1.176 -11.971 19.538 1.00 25.20 H new ATOM 0 HA3 GLY B 775 0.230 -10.502 19.670 1.00 25.20 H new ATOM 1785 N SER B 776 2.998 -11.239 21.298 1.00 74.44 N ATOM 1786 CA SER B 776 4.201 -10.663 21.824 1.00 44.41 C ATOM 1787 C SER B 776 5.095 -10.239 20.672 1.00 55.51 C ATOM 1788 O SER B 776 5.873 -11.040 20.134 1.00 73.23 O ATOM 1789 CB SER B 776 4.927 -11.641 22.742 1.00 63.21 C ATOM 1790 OG SER B 776 4.093 -12.051 23.817 1.00 12.11 O ATOM 0 H SER B 776 2.956 -12.257 21.349 1.00 74.44 H new ATOM 0 HA SER B 776 3.943 -9.790 22.423 1.00 44.41 H new ATOM 0 HB2 SER B 776 5.244 -12.514 22.171 1.00 63.21 H new ATOM 0 HB3 SER B 776 5.829 -11.173 23.136 1.00 63.21 H new ATOM 0 HG SER B 776 3.188 -12.220 23.482 1.00 12.11 H new ATOM 1796 N ASP B 777 4.921 -9.027 20.259 1.00 11.00 N ATOM 1797 CA ASP B 777 5.655 -8.461 19.159 1.00 32.10 C ATOM 1798 C ASP B 777 6.203 -7.138 19.589 1.00 4.33 C ATOM 1799 O ASP B 777 5.733 -6.577 20.585 1.00 5.11 O ATOM 1800 CB ASP B 777 4.721 -8.222 17.947 1.00 51.41 C ATOM 1801 CG ASP B 777 4.156 -9.476 17.340 1.00 21.31 C ATOM 1802 OD1 ASP B 777 3.069 -9.912 17.762 1.00 61.44 O ATOM 1803 OD2 ASP B 777 4.778 -10.022 16.410 1.00 70.13 O ATOM 0 H ASP B 777 4.252 -8.383 20.681 1.00 11.00 H new ATOM 0 HA ASP B 777 6.450 -9.149 18.872 1.00 32.10 H new ATOM 0 HB2 ASP B 777 3.897 -7.581 18.260 1.00 51.41 H new ATOM 0 HB3 ASP B 777 5.273 -7.679 17.180 1.00 51.41 H new ATOM 1808 N PRO B 778 7.212 -6.607 18.871 1.00 3.42 N ATOM 1809 CA PRO B 778 7.722 -5.245 19.107 1.00 3.40 C ATOM 1810 C PRO B 778 6.628 -4.192 18.850 1.00 35.42 C ATOM 1811 O PRO B 778 6.760 -3.028 19.238 1.00 70.05 O ATOM 1812 CB PRO B 778 8.864 -5.102 18.093 1.00 13.20 C ATOM 1813 CG PRO B 778 8.632 -6.179 17.083 1.00 31.45 C ATOM 1814 CD PRO B 778 7.979 -7.300 17.812 1.00 74.42 C ATOM 0 HA PRO B 778 8.047 -5.091 20.136 1.00 3.40 H new ATOM 0 HB2 PRO B 778 8.855 -4.117 17.627 1.00 13.20 H new ATOM 0 HB3 PRO B 778 9.835 -5.217 18.575 1.00 13.20 H new ATOM 0 HG2 PRO B 778 7.998 -5.821 16.271 1.00 31.45 H new ATOM 0 HG3 PRO B 778 9.572 -6.501 16.635 1.00 31.45 H new ATOM 0 HD2 PRO B 778 7.329 -7.882 17.159 1.00 74.42 H new ATOM 0 HD3 PRO B 778 8.711 -7.990 18.230 1.00 74.42 H new ATOM 1822 N GLN B 779 5.560 -4.646 18.189 1.00 64.42 N ATOM 1823 CA GLN B 779 4.360 -3.880 17.899 1.00 1.31 C ATOM 1824 C GLN B 779 4.615 -2.791 16.879 1.00 2.54 C ATOM 1825 O GLN B 779 5.066 -1.688 17.209 1.00 52.33 O ATOM 1826 CB GLN B 779 3.690 -3.332 19.177 1.00 64.21 C ATOM 1827 CG GLN B 779 2.412 -2.545 18.929 1.00 54.03 C ATOM 1828 CD GLN B 779 1.771 -2.063 20.213 1.00 32.03 C ATOM 1829 OE1 GLN B 779 0.942 -2.751 20.802 1.00 63.41 O ATOM 1830 NE2 GLN B 779 2.126 -0.887 20.645 1.00 73.22 N ATOM 0 H GLN B 779 5.513 -5.599 17.829 1.00 64.42 H new ATOM 0 HA GLN B 779 3.649 -4.574 17.450 1.00 1.31 H new ATOM 0 HB2 GLN B 779 3.465 -4.167 19.841 1.00 64.21 H new ATOM 0 HB3 GLN B 779 4.401 -2.692 19.699 1.00 64.21 H new ATOM 0 HG2 GLN B 779 2.634 -1.688 18.293 1.00 54.03 H new ATOM 0 HG3 GLN B 779 1.704 -3.170 18.385 1.00 54.03 H new ATOM 0 HE21 GLN B 779 2.818 -0.342 20.130 1.00 73.22 H new ATOM 0 HE22 GLN B 779 1.712 -0.511 21.498 1.00 73.22 H new ATOM 1839 N GLU B 780 4.365 -3.116 15.645 1.00 44.32 N ATOM 1840 CA GLU B 780 4.537 -2.183 14.576 1.00 25.41 C ATOM 1841 C GLU B 780 3.326 -1.314 14.417 1.00 13.43 C ATOM 1842 O GLU B 780 2.292 -1.750 13.903 1.00 2.15 O ATOM 1843 CB GLU B 780 4.892 -2.861 13.244 1.00 22.53 C ATOM 1844 CG GLU B 780 6.317 -3.402 13.148 1.00 73.51 C ATOM 1845 CD GLU B 780 6.651 -4.448 14.179 1.00 63.10 C ATOM 1846 OE1 GLU B 780 6.197 -5.596 14.034 1.00 41.52 O ATOM 1847 OE2 GLU B 780 7.378 -4.136 15.125 1.00 14.24 O ATOM 0 H GLU B 780 4.036 -4.036 15.353 1.00 44.32 H new ATOM 0 HA GLU B 780 5.386 -1.557 14.850 1.00 25.41 H new ATOM 0 HB2 GLU B 780 4.196 -3.683 13.077 1.00 22.53 H new ATOM 0 HB3 GLU B 780 4.738 -2.144 12.438 1.00 22.53 H new ATOM 0 HG2 GLU B 780 6.467 -3.826 12.155 1.00 73.51 H new ATOM 0 HG3 GLU B 780 7.016 -2.572 13.249 1.00 73.51 H new ATOM 1854 N GLU B 781 3.449 -0.110 14.888 1.00 30.13 N ATOM 1855 CA GLU B 781 2.435 0.901 14.747 1.00 15.12 C ATOM 1856 C GLU B 781 3.048 2.181 14.315 1.00 52.32 C ATOM 1857 O GLU B 781 4.061 2.612 14.853 1.00 61.32 O ATOM 1858 CB GLU B 781 1.583 1.080 15.995 1.00 64.53 C ATOM 1859 CG GLU B 781 0.628 -0.031 16.221 1.00 11.20 C ATOM 1860 CD GLU B 781 -0.176 0.104 17.462 1.00 23.32 C ATOM 1861 OE1 GLU B 781 0.284 0.707 18.433 1.00 55.43 O ATOM 1862 OE2 GLU B 781 -1.319 -0.339 17.464 1.00 42.34 O ATOM 0 H GLU B 781 4.276 0.208 15.394 1.00 30.13 H new ATOM 0 HA GLU B 781 1.747 0.559 13.974 1.00 15.12 H new ATOM 0 HB2 GLU B 781 2.237 1.169 16.862 1.00 64.53 H new ATOM 0 HB3 GLU B 781 1.029 2.015 15.916 1.00 64.53 H new ATOM 0 HG2 GLU B 781 -0.048 -0.094 15.368 1.00 11.20 H new ATOM 0 HG3 GLU B 781 1.181 -0.969 16.260 1.00 11.20 H new ATOM 1869 N LEU B 782 2.444 2.765 13.341 1.00 72.44 N ATOM 1870 CA LEU B 782 2.916 3.934 12.736 1.00 51.21 C ATOM 1871 C LEU B 782 1.826 4.978 12.702 1.00 34.10 C ATOM 1872 O LEU B 782 0.692 4.688 12.341 1.00 41.15 O ATOM 1873 CB LEU B 782 3.324 3.566 11.319 1.00 0.22 C ATOM 1874 CG LEU B 782 3.694 4.684 10.386 1.00 71.45 C ATOM 1875 CD1 LEU B 782 4.915 5.420 10.874 1.00 21.04 C ATOM 1876 CD2 LEU B 782 3.889 4.148 8.993 1.00 1.52 C ATOM 0 H LEU B 782 1.574 2.418 12.937 1.00 72.44 H new ATOM 0 HA LEU B 782 3.758 4.346 13.292 1.00 51.21 H new ATOM 0 HB2 LEU B 782 4.173 2.886 11.381 1.00 0.22 H new ATOM 0 HB3 LEU B 782 2.502 3.010 10.867 1.00 0.22 H new ATOM 0 HG LEU B 782 2.877 5.405 10.363 1.00 71.45 H new ATOM 0 HD11 LEU B 782 5.158 6.223 10.178 1.00 21.04 H new ATOM 0 HD12 LEU B 782 4.716 5.841 11.859 1.00 21.04 H new ATOM 0 HD13 LEU B 782 5.755 4.729 10.938 1.00 21.04 H new ATOM 0 HD21 LEU B 782 4.157 4.965 8.323 1.00 1.52 H new ATOM 0 HD22 LEU B 782 4.687 3.406 8.997 1.00 1.52 H new ATOM 0 HD23 LEU B 782 2.964 3.685 8.649 1.00 1.52 H new ATOM 1888 N ILE B 783 2.146 6.158 13.112 1.00 61.42 N ATOM 1889 CA ILE B 783 1.234 7.260 12.957 1.00 10.43 C ATOM 1890 C ILE B 783 1.594 7.985 11.688 1.00 72.42 C ATOM 1891 O ILE B 783 2.729 8.459 11.525 1.00 71.11 O ATOM 1892 CB ILE B 783 1.215 8.265 14.167 1.00 31.22 C ATOM 1893 CG1 ILE B 783 0.624 7.629 15.453 1.00 51.23 C ATOM 1894 CG2 ILE B 783 0.452 9.549 13.806 1.00 73.25 C ATOM 1895 CD1 ILE B 783 1.463 6.530 16.085 1.00 53.03 C ATOM 0 H ILE B 783 3.032 6.393 13.559 1.00 61.42 H new ATOM 0 HA ILE B 783 0.227 6.845 12.917 1.00 10.43 H new ATOM 0 HB ILE B 783 2.253 8.521 14.377 1.00 31.22 H new ATOM 0 HG12 ILE B 783 0.474 8.417 16.191 1.00 51.23 H new ATOM 0 HG13 ILE B 783 -0.359 7.221 15.217 1.00 51.23 H new ATOM 0 HG21 ILE B 783 0.454 10.226 14.660 1.00 73.25 H new ATOM 0 HG22 ILE B 783 0.936 10.033 12.958 1.00 73.25 H new ATOM 0 HG23 ILE B 783 -0.576 9.300 13.544 1.00 73.25 H new ATOM 0 HD11 ILE B 783 0.960 6.155 16.976 1.00 53.03 H new ATOM 0 HD12 ILE B 783 1.593 5.716 15.372 1.00 53.03 H new ATOM 0 HD13 ILE B 783 2.439 6.930 16.361 1.00 53.03 H new ATOM 1907 N ILE B 784 0.664 8.054 10.792 1.00 70.22 N ATOM 1908 CA ILE B 784 0.897 8.678 9.544 1.00 15.13 C ATOM 1909 C ILE B 784 0.385 10.092 9.544 1.00 12.14 C ATOM 1910 O ILE B 784 1.211 11.005 9.727 1.00 37.18 O ATOM 1911 CB ILE B 784 0.410 7.843 8.325 1.00 3.12 C ATOM 1912 CG1 ILE B 784 -1.011 7.296 8.531 1.00 74.25 C ATOM 1913 CG2 ILE B 784 1.400 6.716 8.006 1.00 35.31 C ATOM 1914 CD1 ILE B 784 -1.535 6.517 7.350 1.00 63.44 C ATOM 1915 OXT ILE B 784 -0.834 10.309 9.383 1.00 37.18 O ATOM 0 H ILE B 784 -0.276 7.677 10.911 1.00 70.22 H new ATOM 0 HA ILE B 784 1.978 8.728 9.414 1.00 15.13 H new ATOM 0 HB ILE B 784 0.369 8.513 7.467 1.00 3.12 H new ATOM 0 HG12 ILE B 784 -1.020 6.654 9.412 1.00 74.25 H new ATOM 0 HG13 ILE B 784 -1.685 8.128 8.735 1.00 74.25 H new ATOM 0 HG21 ILE B 784 1.039 6.146 7.150 1.00 35.31 H new ATOM 0 HG22 ILE B 784 2.375 7.144 7.772 1.00 35.31 H new ATOM 0 HG23 ILE B 784 1.491 6.057 8.869 1.00 35.31 H new ATOM 0 HD11 ILE B 784 -2.542 6.162 7.567 1.00 63.44 H new ATOM 0 HD12 ILE B 784 -1.559 7.161 6.471 1.00 63.44 H new ATOM 0 HD13 ILE B 784 -0.883 5.665 7.158 1.00 63.44 H new TER 1927 ILE B 784