USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 679 TYR OH : rot 52:sc= -5.42! USER MOD Set 1.2: A 685 THR OG1 : rot -112:sc= 1.24 USER MOD Set 1.3: A 712 SER OG : rot -24:sc= 1.68 USER MOD Set 2.1: A 663 SER OG : rot -103:sc= 1.18 USER MOD Set 2.2: A 672 THR OG1 : rot -120:sc= 0 USER MOD Set 3.1: A 644 GLN : amide:sc= 0.192 K(o=0.8,f=-0.33) USER MOD Set 3.2: A 714 TYR OH : rot -15:sc= 0.611 USER MOD Set 4.1: A 640 SER OG : rot -30:sc= 0 USER MOD Set 4.2: A 654 ASN : amide:sc= 0.846 K(o=0.85,f=-6.5!) USER MOD Set 5.1: A 587 THR OG1 : rot 129:sc= 1.45 USER MOD Set 5.2: A 598 GLN : amide:sc= -2.38! K(o=-0.92!,f=1.1) USER MOD Single : A 585 SER OG : rot 45:sc= 0.394 USER MOD Single : A 591 ASN : amide:sc= -0.211 K(o=-0.21,f=-2.3!) USER MOD Single : A 593 THR OG1 : rot -69:sc= 0.29 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 606 THR OG1 : rot 180:sc= 0 USER MOD Single : A 609 THR OG1 : rot 180:sc= -0.381 USER MOD Single : A 610 LYS NZ :NH3+ -151:sc= -1.36 (180deg=-2.88!) USER MOD Single : A 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 TYR OH : rot -40:sc= -0.438 USER MOD Single : A 615 LYS NZ :NH3+ -164:sc= 0.233 (180deg=0.103) USER MOD Single : A 618 THR OG1 : rot -49:sc= 2.04 USER MOD Single : A 620 LYS NZ :NH3+ 168:sc= -0.0215 (180deg=-0.181) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : no HD1:sc= 1.22 K(o=1.2,f=-4.8!) USER MOD Single : A 626 ASN : amide:sc= 0.668 K(o=0.67,f=-8.7!) USER MOD Single : A 632 SER OG : rot 123:sc= 1.27 USER MOD Single : A 646 SER OG : rot 170:sc= 2.14 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 652 SER OG : rot 180:sc= 0 USER MOD Single : A 658 SER OG : rot 83:sc= -0.413 USER MOD Single : A 659 ASN : amide:sc= -1.12 K(o=-1.1,f=-6.6!) USER MOD Single : A 661 LYS NZ :NH3+ -168:sc= 1.21 (180deg=1.04) USER MOD Single : A 664 TYR OH : rot 180:sc= 0.322 USER MOD Single : A 665 TYR OH : rot -153:sc= 0.303! USER MOD Single : A 668 MET CE :methyl 167:sc= -0.184 (180deg=-0.455) USER MOD Single : A 670 GLN : amide:sc= -3.54! K(o=-3.5!,f=-0.99) USER MOD Single : A 673 TYR OH : rot 165:sc= 1.26 USER MOD Single : A 677 THR OG1 : rot -150:sc= -0.375 USER MOD Single : A 680 ASN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 681 ASN : amide:sc= -1.51! C(o=-1.5!,f=-9.9!) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot -115:sc= -2.86! USER MOD Single : A 692 THR OG1 : rot 180:sc= 0 USER MOD Single : A 706 TYR OH : rot -149:sc= 1.28 USER MOD Single : A 707 GLN : amide:sc= -1.24! C(o=-1.2!,f=-10!) USER MOD Single : A 711 ASN : amide:sc= -0.0365 K(o=-0.036,f=-1.8!) USER MOD Single : A 713 THR OG1 : rot 180:sc= 0 USER MOD Single : A 715 ASN : amide:sc= -1.15 K(o=-1.2,f=-3.3!) USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 720 THR OG1 : rot 35:sc= 0.55 USER MOD Single : A 721 SER OG : rot -160:sc= 0.791 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 -4.181 -15.393 14.633 1.00 65.32 N ATOM 2 CA GLU A 578 -4.483 -16.381 15.664 1.00 10.24 C ATOM 3 C GLU A 578 -3.871 -15.962 16.991 1.00 13.42 C ATOM 4 O GLU A 578 -4.576 -15.518 17.892 1.00 51.03 O ATOM 5 CB GLU A 578 -4.017 -17.804 15.263 1.00 2.42 C ATOM 6 CG GLU A 578 -4.737 -18.411 14.048 1.00 74.44 C ATOM 7 CD GLU A 578 -4.553 -17.621 12.776 1.00 50.30 C ATOM 8 OE1 GLU A 578 -5.303 -16.653 12.561 1.00 0.41 O ATOM 9 OE2 GLU A 578 -3.660 -17.951 11.984 1.00 73.24 O ATOM 0 HA GLU A 578 -5.567 -16.422 15.774 1.00 10.24 H new ATOM 0 HB2 GLU A 578 -2.948 -17.773 15.053 1.00 2.42 H new ATOM 0 HB3 GLU A 578 -4.155 -18.468 16.116 1.00 2.42 H new ATOM 0 HG2 GLU A 578 -4.372 -19.426 13.891 1.00 74.44 H new ATOM 0 HG3 GLU A 578 -5.802 -18.486 14.268 1.00 74.44 H new ATOM 18 N ALA A 579 -2.568 -16.060 17.103 1.00 0.54 N ATOM 19 CA ALA A 579 -1.888 -15.679 18.311 1.00 23.20 C ATOM 20 C ALA A 579 -1.196 -14.357 18.108 1.00 21.44 C ATOM 21 O ALA A 579 -0.708 -14.063 17.010 1.00 22.51 O ATOM 22 CB ALA A 579 -0.892 -16.739 18.719 1.00 44.00 C ATOM 0 H ALA A 579 -1.956 -16.404 16.363 1.00 0.54 H new ATOM 0 HA ALA A 579 -2.621 -15.578 19.111 1.00 23.20 H new ATOM 0 HB1 ALA A 579 -0.388 -16.431 19.635 1.00 44.00 H new ATOM 0 HB2 ALA A 579 -1.413 -17.681 18.890 1.00 44.00 H new ATOM 0 HB3 ALA A 579 -0.155 -16.870 17.926 1.00 44.00 H new ATOM 28 N GLU A 580 -1.178 -13.560 19.128 1.00 34.53 N ATOM 29 CA GLU A 580 -0.553 -12.269 19.088 1.00 44.11 C ATOM 30 C GLU A 580 0.470 -12.170 20.200 1.00 23.20 C ATOM 31 O GLU A 580 0.117 -12.132 21.389 1.00 40.00 O ATOM 32 CB GLU A 580 -1.614 -11.181 19.206 1.00 54.01 C ATOM 33 CG GLU A 580 -2.617 -11.209 18.063 1.00 3.34 C ATOM 34 CD GLU A 580 -3.710 -10.209 18.215 1.00 62.12 C ATOM 35 OE1 GLU A 580 -3.446 -9.007 18.083 1.00 52.43 O ATOM 36 OE2 GLU A 580 -4.867 -10.605 18.497 1.00 11.24 O ATOM 0 H GLU A 580 -1.602 -13.787 20.027 1.00 34.53 H new ATOM 0 HA GLU A 580 -0.037 -12.133 18.138 1.00 44.11 H new ATOM 0 HB2 GLU A 580 -2.144 -11.298 20.151 1.00 54.01 H new ATOM 0 HB3 GLU A 580 -1.127 -10.206 19.232 1.00 54.01 H new ATOM 0 HG2 GLU A 580 -2.094 -11.025 17.125 1.00 3.34 H new ATOM 0 HG3 GLU A 580 -3.053 -12.206 17.995 1.00 3.34 H new ATOM 43 N ALA A 581 1.723 -12.180 19.829 1.00 71.25 N ATOM 44 CA ALA A 581 2.800 -12.138 20.778 1.00 33.02 C ATOM 45 C ALA A 581 3.956 -11.356 20.215 1.00 11.03 C ATOM 46 O ALA A 581 4.158 -11.327 19.000 1.00 62.55 O ATOM 47 CB ALA A 581 3.250 -13.557 21.110 1.00 15.42 C ATOM 0 H ALA A 581 2.025 -12.218 18.855 1.00 71.25 H new ATOM 0 HA ALA A 581 2.451 -11.648 21.687 1.00 33.02 H new ATOM 0 HB1 ALA A 581 4.067 -13.520 21.830 1.00 15.42 H new ATOM 0 HB2 ALA A 581 2.415 -14.113 21.536 1.00 15.42 H new ATOM 0 HB3 ALA A 581 3.590 -14.053 20.201 1.00 15.42 H new ATOM 53 N GLU A 582 4.709 -10.718 21.081 1.00 32.44 N ATOM 54 CA GLU A 582 5.875 -9.991 20.662 1.00 32.40 C ATOM 55 C GLU A 582 7.052 -10.940 20.524 1.00 4.50 C ATOM 56 O GLU A 582 7.593 -11.452 21.516 1.00 54.54 O ATOM 57 CB GLU A 582 6.202 -8.761 21.566 1.00 22.22 C ATOM 58 CG GLU A 582 6.382 -9.029 23.070 1.00 22.44 C ATOM 59 CD GLU A 582 5.108 -9.436 23.764 1.00 70.11 C ATOM 60 OE1 GLU A 582 4.375 -8.558 24.237 1.00 51.41 O ATOM 61 OE2 GLU A 582 4.811 -10.642 23.834 1.00 23.04 O ATOM 0 H GLU A 582 4.530 -10.691 22.085 1.00 32.44 H new ATOM 0 HA GLU A 582 5.658 -9.561 19.684 1.00 32.40 H new ATOM 0 HB2 GLU A 582 7.116 -8.299 21.192 1.00 22.22 H new ATOM 0 HB3 GLU A 582 5.403 -8.030 21.445 1.00 22.22 H new ATOM 0 HG2 GLU A 582 7.127 -9.814 23.205 1.00 22.44 H new ATOM 0 HG3 GLU A 582 6.775 -8.131 23.547 1.00 22.44 H new ATOM 68 N PHE A 583 7.413 -11.201 19.305 1.00 25.52 N ATOM 69 CA PHE A 583 8.469 -12.114 18.980 1.00 24.11 C ATOM 70 C PHE A 583 9.161 -11.561 17.756 1.00 75.21 C ATOM 71 O PHE A 583 8.498 -11.112 16.825 1.00 21.24 O ATOM 72 CB PHE A 583 7.858 -13.502 18.685 1.00 42.24 C ATOM 73 CG PHE A 583 8.847 -14.611 18.449 1.00 53.04 C ATOM 74 CD1 PHE A 583 9.319 -14.887 17.177 1.00 73.15 C ATOM 75 CD2 PHE A 583 9.294 -15.390 19.506 1.00 75.24 C ATOM 76 CE1 PHE A 583 10.215 -15.913 16.962 1.00 13.01 C ATOM 77 CE2 PHE A 583 10.191 -16.417 19.297 1.00 55.35 C ATOM 78 CZ PHE A 583 10.652 -16.678 18.021 1.00 22.44 C ATOM 0 H PHE A 583 6.972 -10.776 18.489 1.00 25.52 H new ATOM 0 HA PHE A 583 9.181 -12.224 19.798 1.00 24.11 H new ATOM 0 HB2 PHE A 583 7.218 -13.782 19.521 1.00 42.24 H new ATOM 0 HB3 PHE A 583 7.217 -13.418 17.807 1.00 42.24 H new ATOM 0 HD1 PHE A 583 8.981 -14.291 16.342 1.00 73.15 H new ATOM 0 HD2 PHE A 583 8.935 -15.190 20.505 1.00 75.24 H new ATOM 0 HE1 PHE A 583 10.574 -16.117 15.964 1.00 13.01 H new ATOM 0 HE2 PHE A 583 10.532 -17.016 20.129 1.00 55.35 H new ATOM 0 HZ PHE A 583 11.354 -17.481 17.854 1.00 22.44 H new ATOM 88 N LEU A 584 10.460 -11.565 17.749 1.00 71.11 N ATOM 89 CA LEU A 584 11.186 -10.993 16.644 1.00 30.44 C ATOM 90 C LEU A 584 11.286 -11.947 15.480 1.00 50.42 C ATOM 91 O LEU A 584 12.220 -12.742 15.383 1.00 13.12 O ATOM 92 CB LEU A 584 12.563 -10.484 17.068 1.00 52.20 C ATOM 93 CG LEU A 584 12.569 -9.378 18.124 1.00 22.13 C ATOM 94 CD1 LEU A 584 13.993 -9.013 18.505 1.00 55.44 C ATOM 95 CD2 LEU A 584 11.819 -8.146 17.626 1.00 20.13 C ATOM 0 H LEU A 584 11.041 -11.955 18.491 1.00 71.11 H new ATOM 0 HA LEU A 584 10.612 -10.130 16.306 1.00 30.44 H new ATOM 0 HB2 LEU A 584 13.139 -11.327 17.449 1.00 52.20 H new ATOM 0 HB3 LEU A 584 13.082 -10.117 16.182 1.00 52.20 H new ATOM 0 HG LEU A 584 12.057 -9.753 19.010 1.00 22.13 H new ATOM 0 HD11 LEU A 584 13.978 -8.224 19.257 1.00 55.44 H new ATOM 0 HD12 LEU A 584 14.498 -9.890 18.909 1.00 55.44 H new ATOM 0 HD13 LEU A 584 14.527 -8.662 17.622 1.00 55.44 H new ATOM 0 HD21 LEU A 584 11.837 -7.373 18.395 1.00 20.13 H new ATOM 0 HD22 LEU A 584 12.297 -7.770 16.722 1.00 20.13 H new ATOM 0 HD23 LEU A 584 10.786 -8.414 17.405 1.00 20.13 H new ATOM 103 N SER A 585 10.291 -11.914 14.648 1.00 43.20 N ATOM 104 CA SER A 585 10.277 -12.686 13.443 1.00 42.30 C ATOM 105 C SER A 585 9.613 -11.905 12.320 1.00 23.24 C ATOM 106 O SER A 585 8.390 -11.895 12.190 1.00 13.43 O ATOM 107 CB SER A 585 9.602 -14.048 13.660 1.00 42.33 C ATOM 108 OG SER A 585 8.273 -13.897 14.155 1.00 62.42 O ATOM 0 H SER A 585 9.457 -11.344 14.788 1.00 43.20 H new ATOM 0 HA SER A 585 11.309 -12.884 13.152 1.00 42.30 H new ATOM 0 HB2 SER A 585 9.581 -14.599 12.720 1.00 42.33 H new ATOM 0 HB3 SER A 585 10.189 -14.639 14.363 1.00 42.33 H new ATOM 0 HG SER A 585 7.811 -13.200 13.644 1.00 62.42 H new ATOM 114 N ARG A 586 10.415 -11.186 11.590 1.00 40.55 N ATOM 115 CA ARG A 586 9.963 -10.439 10.445 1.00 24.42 C ATOM 116 C ARG A 586 10.756 -10.857 9.246 1.00 74.53 C ATOM 117 O ARG A 586 11.963 -10.609 9.171 1.00 73.21 O ATOM 118 CB ARG A 586 10.110 -8.923 10.695 1.00 4.32 C ATOM 119 CG ARG A 586 9.933 -8.030 9.474 1.00 50.03 C ATOM 120 CD ARG A 586 10.131 -6.574 9.864 1.00 0.32 C ATOM 121 NE ARG A 586 10.151 -5.664 8.709 1.00 62.45 N ATOM 122 CZ ARG A 586 9.825 -4.363 8.764 1.00 52.31 C ATOM 123 NH1 ARG A 586 9.322 -3.852 9.884 1.00 11.52 N ATOM 124 NH2 ARG A 586 9.989 -3.592 7.687 1.00 14.20 N ATOM 0 H ARG A 586 11.415 -11.099 11.773 1.00 40.55 H new ATOM 0 HA ARG A 586 8.907 -10.646 10.269 1.00 24.42 H new ATOM 0 HB2 ARG A 586 9.380 -8.626 11.448 1.00 4.32 H new ATOM 0 HB3 ARG A 586 11.098 -8.738 11.117 1.00 4.32 H new ATOM 0 HG2 ARG A 586 10.650 -8.309 8.702 1.00 50.03 H new ATOM 0 HG3 ARG A 586 8.938 -8.170 9.051 1.00 50.03 H new ATOM 0 HD2 ARG A 586 9.332 -6.274 10.541 1.00 0.32 H new ATOM 0 HD3 ARG A 586 11.068 -6.475 10.413 1.00 0.32 H new ATOM 0 HE ARG A 586 10.431 -6.047 7.806 1.00 62.45 H new ATOM 0 HH11 ARG A 586 9.184 -4.448 10.700 1.00 11.52 H new ATOM 0 HH12 ARG A 586 9.074 -2.864 9.927 1.00 11.52 H new ATOM 0 HH21 ARG A 586 10.361 -3.992 6.825 1.00 14.20 H new ATOM 0 HH22 ARG A 586 9.742 -2.603 7.725 1.00 14.20 H new ATOM 136 N THR A 587 10.121 -11.498 8.338 1.00 71.53 N ATOM 137 CA THR A 587 10.760 -11.864 7.128 1.00 0.43 C ATOM 138 C THR A 587 10.227 -10.964 6.028 1.00 35.44 C ATOM 139 O THR A 587 9.018 -10.713 5.954 1.00 13.52 O ATOM 140 CB THR A 587 10.508 -13.343 6.786 1.00 52.04 C ATOM 141 OG1 THR A 587 10.820 -14.159 7.935 1.00 15.14 O ATOM 142 CG2 THR A 587 11.419 -13.759 5.653 1.00 21.33 C ATOM 0 H THR A 587 9.145 -11.784 8.410 1.00 71.53 H new ATOM 0 HA THR A 587 11.838 -11.741 7.231 1.00 0.43 H new ATOM 0 HB THR A 587 9.464 -13.471 6.500 1.00 52.04 H new ATOM 0 HG1 THR A 587 10.068 -14.758 8.124 1.00 15.14 H new ATOM 0 HG21 THR A 587 11.242 -14.807 5.409 1.00 21.33 H new ATOM 0 HG22 THR A 587 11.215 -13.143 4.777 1.00 21.33 H new ATOM 0 HG23 THR A 587 12.458 -13.627 5.955 1.00 21.33 H new ATOM 148 N GLU A 588 11.107 -10.432 5.228 1.00 21.12 N ATOM 149 CA GLU A 588 10.707 -9.545 4.181 1.00 71.31 C ATOM 150 C GLU A 588 10.987 -10.156 2.836 1.00 12.13 C ATOM 151 O GLU A 588 12.009 -10.813 2.639 1.00 3.03 O ATOM 152 CB GLU A 588 11.426 -8.210 4.317 1.00 34.01 C ATOM 153 CG GLU A 588 11.217 -7.558 5.667 1.00 72.20 C ATOM 154 CD GLU A 588 11.885 -6.231 5.781 1.00 1.21 C ATOM 155 OE1 GLU A 588 13.106 -6.189 5.933 1.00 33.21 O ATOM 156 OE2 GLU A 588 11.180 -5.205 5.764 1.00 3.04 O ATOM 0 H GLU A 588 12.111 -10.601 5.284 1.00 21.12 H new ATOM 0 HA GLU A 588 9.634 -9.373 4.264 1.00 71.31 H new ATOM 0 HB2 GLU A 588 12.493 -8.361 4.154 1.00 34.01 H new ATOM 0 HB3 GLU A 588 11.077 -7.535 3.536 1.00 34.01 H new ATOM 0 HG2 GLU A 588 10.148 -7.437 5.845 1.00 72.20 H new ATOM 0 HG3 GLU A 588 11.597 -8.218 6.446 1.00 72.20 H new ATOM 163 N GLY A 589 10.081 -9.969 1.933 1.00 52.43 N ATOM 164 CA GLY A 589 10.258 -10.443 0.606 1.00 35.01 C ATOM 165 C GLY A 589 10.658 -9.316 -0.289 1.00 71.03 C ATOM 166 O GLY A 589 11.037 -8.245 0.193 1.00 60.14 O ATOM 0 H GLY A 589 9.199 -9.483 2.097 1.00 52.43 H new ATOM 0 HA2 GLY A 589 11.021 -11.221 0.588 1.00 35.01 H new ATOM 0 HA3 GLY A 589 9.333 -10.894 0.246 1.00 35.01 H new ATOM 170 N ASP A 590 10.572 -9.526 -1.561 1.00 52.13 N ATOM 171 CA ASP A 590 10.936 -8.526 -2.528 1.00 54.33 C ATOM 172 C ASP A 590 10.132 -8.713 -3.772 1.00 33.31 C ATOM 173 O ASP A 590 9.764 -9.836 -4.103 1.00 41.32 O ATOM 174 CB ASP A 590 12.438 -8.577 -2.845 1.00 4.43 C ATOM 175 CG ASP A 590 12.853 -7.592 -3.921 1.00 13.14 C ATOM 176 OD1 ASP A 590 12.781 -6.369 -3.691 1.00 64.45 O ATOM 177 OD2 ASP A 590 13.232 -8.034 -5.022 1.00 13.34 O ATOM 0 H ASP A 590 10.245 -10.402 -1.969 1.00 52.13 H new ATOM 0 HA ASP A 590 10.722 -7.544 -2.106 1.00 54.33 H new ATOM 0 HB2 ASP A 590 13.002 -8.371 -1.935 1.00 4.43 H new ATOM 0 HB3 ASP A 590 12.702 -9.586 -3.163 1.00 4.43 H new ATOM 182 N ASN A 591 9.841 -7.618 -4.430 1.00 14.42 N ATOM 183 CA ASN A 591 9.078 -7.589 -5.667 1.00 50.45 C ATOM 184 C ASN A 591 7.631 -8.034 -5.434 1.00 45.13 C ATOM 185 O ASN A 591 7.219 -9.111 -5.839 1.00 42.35 O ATOM 186 CB ASN A 591 9.762 -8.402 -6.801 1.00 61.33 C ATOM 187 CG ASN A 591 9.160 -8.191 -8.194 1.00 33.53 C ATOM 188 OD1 ASN A 591 7.971 -7.895 -8.365 1.00 53.21 O ATOM 189 ND2 ASN A 591 9.983 -8.340 -9.198 1.00 20.34 N ATOM 0 H ASN A 591 10.134 -6.693 -4.116 1.00 14.42 H new ATOM 0 HA ASN A 591 9.053 -6.554 -6.006 1.00 50.45 H new ATOM 0 HB2 ASN A 591 10.819 -8.137 -6.833 1.00 61.33 H new ATOM 0 HB3 ASN A 591 9.707 -9.462 -6.553 1.00 61.33 H new ATOM 0 HD21 ASN A 591 9.650 -8.212 -10.154 1.00 20.34 H new ATOM 0 HD22 ASN A 591 10.958 -8.584 -9.026 1.00 20.34 H new ATOM 195 N CYS A 592 6.934 -7.238 -4.630 1.00 41.30 N ATOM 196 CA CYS A 592 5.480 -7.320 -4.419 1.00 32.14 C ATOM 197 C CYS A 592 5.050 -8.661 -3.780 1.00 3.15 C ATOM 198 O CYS A 592 3.861 -9.021 -3.775 1.00 60.12 O ATOM 199 CB CYS A 592 4.769 -7.095 -5.767 1.00 22.01 C ATOM 200 SG CYS A 592 2.994 -6.732 -5.651 1.00 0.21 S ATOM 0 H CYS A 592 7.372 -6.493 -4.088 1.00 41.30 H new ATOM 0 HA CYS A 592 5.190 -6.543 -3.712 1.00 32.14 H new ATOM 0 HB2 CYS A 592 5.259 -6.271 -6.285 1.00 22.01 H new ATOM 0 HB3 CYS A 592 4.903 -7.984 -6.383 1.00 22.01 H new ATOM 205 N THR A 593 5.994 -9.361 -3.190 1.00 62.22 N ATOM 206 CA THR A 593 5.731 -10.652 -2.622 1.00 32.12 C ATOM 207 C THR A 593 6.500 -10.817 -1.328 1.00 40.23 C ATOM 208 O THR A 593 7.523 -10.152 -1.110 1.00 75.31 O ATOM 209 CB THR A 593 6.114 -11.798 -3.611 1.00 45.11 C ATOM 210 OG1 THR A 593 7.457 -11.613 -4.067 1.00 73.21 O ATOM 211 CG2 THR A 593 5.178 -11.852 -4.810 1.00 14.41 C ATOM 0 H THR A 593 6.960 -9.047 -3.094 1.00 62.22 H new ATOM 0 HA THR A 593 4.661 -10.717 -2.422 1.00 32.12 H new ATOM 0 HB THR A 593 6.024 -12.741 -3.072 1.00 45.11 H new ATOM 0 HG1 THR A 593 7.499 -10.828 -4.652 1.00 73.21 H new ATOM 0 HG21 THR A 593 5.481 -12.663 -5.472 1.00 14.41 H new ATOM 0 HG22 THR A 593 4.158 -12.025 -4.468 1.00 14.41 H new ATOM 0 HG23 THR A 593 5.224 -10.907 -5.350 1.00 14.41 H new ATOM 217 N VAL A 594 5.997 -11.654 -0.473 1.00 11.34 N ATOM 218 CA VAL A 594 6.638 -11.974 0.772 1.00 25.20 C ATOM 219 C VAL A 594 6.671 -13.463 0.987 1.00 54.20 C ATOM 220 O VAL A 594 5.671 -14.148 0.822 1.00 75.32 O ATOM 221 CB VAL A 594 6.028 -11.220 2.008 1.00 64.54 C ATOM 222 CG1 VAL A 594 4.520 -11.295 1.997 1.00 34.32 C ATOM 223 CG2 VAL A 594 6.551 -11.825 3.314 1.00 0.13 C ATOM 0 H VAL A 594 5.115 -12.144 -0.621 1.00 11.34 H new ATOM 0 HA VAL A 594 7.663 -11.612 0.693 1.00 25.20 H new ATOM 0 HB VAL A 594 6.332 -10.175 1.942 1.00 64.54 H new ATOM 0 HG11 VAL A 594 4.123 -10.765 2.863 1.00 34.32 H new ATOM 0 HG12 VAL A 594 4.139 -10.835 1.085 1.00 34.32 H new ATOM 0 HG13 VAL A 594 4.207 -12.338 2.035 1.00 34.32 H new ATOM 0 HG21 VAL A 594 6.119 -11.292 4.161 1.00 0.13 H new ATOM 0 HG22 VAL A 594 6.270 -12.877 3.366 1.00 0.13 H new ATOM 0 HG23 VAL A 594 7.637 -11.738 3.346 1.00 0.13 H new ATOM 229 N PHE A 595 7.822 -13.948 1.324 1.00 31.34 N ATOM 230 CA PHE A 595 8.029 -15.327 1.580 1.00 15.03 C ATOM 231 C PHE A 595 8.856 -15.461 2.837 1.00 1.33 C ATOM 232 O PHE A 595 9.798 -14.686 3.054 1.00 22.12 O ATOM 233 CB PHE A 595 8.684 -16.015 0.369 1.00 63.24 C ATOM 234 CG PHE A 595 10.008 -15.420 -0.070 1.00 53.31 C ATOM 235 CD1 PHE A 595 10.043 -14.308 -0.899 1.00 22.44 C ATOM 236 CD2 PHE A 595 11.207 -15.975 0.342 1.00 0.41 C ATOM 237 CE1 PHE A 595 11.242 -13.763 -1.303 1.00 64.23 C ATOM 238 CE2 PHE A 595 12.411 -15.433 -0.061 1.00 20.34 C ATOM 239 CZ PHE A 595 12.427 -14.326 -0.884 1.00 64.25 C ATOM 0 H PHE A 595 8.661 -13.378 1.430 1.00 31.34 H new ATOM 0 HA PHE A 595 7.075 -15.831 1.736 1.00 15.03 H new ATOM 0 HB2 PHE A 595 8.838 -17.067 0.608 1.00 63.24 H new ATOM 0 HB3 PHE A 595 7.990 -15.977 -0.471 1.00 63.24 H new ATOM 0 HD1 PHE A 595 9.117 -13.863 -1.232 1.00 22.44 H new ATOM 0 HD2 PHE A 595 11.201 -16.842 0.986 1.00 0.41 H new ATOM 0 HE1 PHE A 595 11.253 -12.896 -1.947 1.00 64.23 H new ATOM 0 HE2 PHE A 595 13.340 -15.875 0.268 1.00 20.34 H new ATOM 0 HZ PHE A 595 13.368 -13.901 -1.200 1.00 64.25 H new ATOM 249 N ASP A 596 8.497 -16.401 3.661 1.00 13.43 N ATOM 250 CA ASP A 596 9.141 -16.592 4.944 1.00 52.35 C ATOM 251 C ASP A 596 10.104 -17.758 4.868 1.00 64.45 C ATOM 252 O ASP A 596 9.719 -18.859 4.480 1.00 2.23 O ATOM 253 CB ASP A 596 8.090 -16.850 6.023 1.00 12.32 C ATOM 254 CG ASP A 596 8.701 -16.911 7.393 1.00 74.11 C ATOM 255 OD1 ASP A 596 9.241 -17.962 7.763 1.00 22.11 O ATOM 256 OD2 ASP A 596 8.676 -15.897 8.111 1.00 31.34 O ATOM 0 H ASP A 596 7.746 -17.064 3.469 1.00 13.43 H new ATOM 0 HA ASP A 596 9.696 -15.690 5.201 1.00 52.35 H new ATOM 0 HB2 ASP A 596 7.339 -16.061 5.995 1.00 12.32 H new ATOM 0 HB3 ASP A 596 7.575 -17.788 5.812 1.00 12.32 H new ATOM 261 N SER A 597 11.352 -17.513 5.227 1.00 70.10 N ATOM 262 CA SER A 597 12.402 -18.510 5.149 1.00 64.20 C ATOM 263 C SER A 597 12.231 -19.668 6.156 1.00 54.55 C ATOM 264 O SER A 597 12.454 -20.832 5.806 1.00 73.44 O ATOM 265 CB SER A 597 13.762 -17.840 5.302 1.00 72.14 C ATOM 266 OG SER A 597 13.925 -16.819 4.322 1.00 34.42 O ATOM 0 H SER A 597 11.666 -16.610 5.583 1.00 70.10 H new ATOM 0 HA SER A 597 12.332 -18.971 4.164 1.00 64.20 H new ATOM 0 HB2 SER A 597 13.854 -17.413 6.301 1.00 72.14 H new ATOM 0 HB3 SER A 597 14.554 -18.582 5.199 1.00 72.14 H new ATOM 0 HG SER A 597 14.802 -16.396 4.433 1.00 34.42 H new ATOM 272 N GLN A 598 11.840 -19.368 7.386 1.00 51.35 N ATOM 273 CA GLN A 598 11.706 -20.417 8.383 1.00 34.01 C ATOM 274 C GLN A 598 10.419 -21.218 8.289 1.00 44.12 C ATOM 275 O GLN A 598 10.445 -22.443 8.425 1.00 42.10 O ATOM 276 CB GLN A 598 12.026 -20.000 9.848 1.00 44.53 C ATOM 277 CG GLN A 598 11.318 -18.762 10.426 1.00 44.41 C ATOM 278 CD GLN A 598 11.912 -17.452 9.944 1.00 14.31 C ATOM 279 OE1 GLN A 598 12.841 -16.935 10.552 1.00 33.13 O ATOM 280 NE2 GLN A 598 11.356 -16.873 8.927 1.00 50.13 N ATOM 0 H GLN A 598 11.615 -18.428 7.712 1.00 51.35 H new ATOM 0 HA GLN A 598 12.511 -21.095 8.100 1.00 34.01 H new ATOM 0 HB2 GLN A 598 11.793 -20.847 10.493 1.00 44.53 H new ATOM 0 HB3 GLN A 598 13.101 -19.831 9.918 1.00 44.53 H new ATOM 0 HG2 GLN A 598 10.263 -18.796 10.155 1.00 44.41 H new ATOM 0 HG3 GLN A 598 11.369 -18.798 11.514 1.00 44.41 H new ATOM 0 HE21 GLN A 598 10.584 -17.328 8.440 1.00 50.13 H new ATOM 0 HE22 GLN A 598 11.691 -15.962 8.613 1.00 50.13 H new ATOM 288 N ALA A 599 9.316 -20.564 8.056 1.00 2.13 N ATOM 289 CA ALA A 599 8.038 -21.256 7.997 1.00 73.21 C ATOM 290 C ALA A 599 7.726 -21.761 6.596 1.00 23.21 C ATOM 291 O ALA A 599 6.912 -22.672 6.429 1.00 51.32 O ATOM 292 CB ALA A 599 6.924 -20.338 8.482 1.00 40.23 C ATOM 0 H ALA A 599 9.265 -19.557 7.903 1.00 2.13 H new ATOM 0 HA ALA A 599 8.105 -22.125 8.651 1.00 73.21 H new ATOM 0 HB1 ALA A 599 5.971 -20.865 8.434 1.00 40.23 H new ATOM 0 HB2 ALA A 599 7.122 -20.039 9.511 1.00 40.23 H new ATOM 0 HB3 ALA A 599 6.881 -19.452 7.848 1.00 40.23 H new ATOM 298 N GLY A 600 8.405 -21.212 5.603 1.00 24.31 N ATOM 299 CA GLY A 600 8.156 -21.606 4.229 1.00 74.22 C ATOM 300 C GLY A 600 6.754 -21.243 3.794 1.00 70.12 C ATOM 301 O GLY A 600 5.979 -22.101 3.364 1.00 73.53 O ATOM 0 H GLY A 600 9.125 -20.500 5.721 1.00 24.31 H new ATOM 0 HA2 GLY A 600 8.879 -21.120 3.573 1.00 74.22 H new ATOM 0 HA3 GLY A 600 8.303 -22.681 4.125 1.00 74.22 H new ATOM 305 N PHE A 601 6.429 -19.986 3.908 1.00 62.13 N ATOM 306 CA PHE A 601 5.106 -19.511 3.591 1.00 31.24 C ATOM 307 C PHE A 601 5.230 -18.313 2.656 1.00 45.42 C ATOM 308 O PHE A 601 6.223 -17.595 2.717 1.00 42.22 O ATOM 309 CB PHE A 601 4.392 -19.117 4.888 1.00 21.20 C ATOM 310 CG PHE A 601 2.957 -18.785 4.695 1.00 14.43 C ATOM 311 CD1 PHE A 601 1.999 -19.784 4.769 1.00 3.52 C ATOM 312 CD2 PHE A 601 2.554 -17.489 4.424 1.00 11.43 C ATOM 313 CE1 PHE A 601 0.672 -19.504 4.580 1.00 3.13 C ATOM 314 CE2 PHE A 601 1.227 -17.216 4.230 1.00 31.21 C ATOM 315 CZ PHE A 601 0.283 -18.218 4.308 1.00 13.13 C ATOM 0 H PHE A 601 7.072 -19.259 4.223 1.00 62.13 H new ATOM 0 HA PHE A 601 4.524 -20.289 3.097 1.00 31.24 H new ATOM 0 HB2 PHE A 601 4.475 -19.936 5.603 1.00 21.20 H new ATOM 0 HB3 PHE A 601 4.900 -18.258 5.327 1.00 21.20 H new ATOM 0 HD1 PHE A 601 2.304 -20.799 4.979 1.00 3.52 H new ATOM 0 HD2 PHE A 601 3.284 -16.696 4.366 1.00 11.43 H new ATOM 0 HE1 PHE A 601 -0.064 -20.292 4.645 1.00 3.13 H new ATOM 0 HE2 PHE A 601 0.916 -16.205 4.013 1.00 31.21 H new ATOM 0 HZ PHE A 601 -0.761 -17.990 4.155 1.00 13.13 H new ATOM 325 N SER A 602 4.246 -18.093 1.792 1.00 22.21 N ATOM 326 CA SER A 602 4.327 -17.003 0.842 1.00 41.15 C ATOM 327 C SER A 602 2.994 -16.227 0.717 1.00 43.14 C ATOM 328 O SER A 602 1.916 -16.789 0.865 1.00 55.04 O ATOM 329 CB SER A 602 4.700 -17.568 -0.527 1.00 75.32 C ATOM 330 OG SER A 602 5.863 -18.381 -0.458 1.00 50.44 O ATOM 0 H SER A 602 3.394 -18.651 1.733 1.00 22.21 H new ATOM 0 HA SER A 602 5.083 -16.305 1.203 1.00 41.15 H new ATOM 0 HB2 SER A 602 3.868 -18.154 -0.918 1.00 75.32 H new ATOM 0 HB3 SER A 602 4.869 -16.749 -1.226 1.00 75.32 H new ATOM 0 HG SER A 602 6.073 -18.728 -1.350 1.00 50.44 H new ATOM 336 N PHE A 603 3.106 -14.943 0.466 1.00 43.03 N ATOM 337 CA PHE A 603 1.973 -14.073 0.135 1.00 73.24 C ATOM 338 C PHE A 603 2.364 -13.172 -1.011 1.00 54.23 C ATOM 339 O PHE A 603 3.532 -12.764 -1.119 1.00 40.01 O ATOM 340 CB PHE A 603 1.520 -13.133 1.281 1.00 24.13 C ATOM 341 CG PHE A 603 0.758 -13.704 2.444 1.00 21.32 C ATOM 342 CD1 PHE A 603 -0.531 -14.181 2.275 1.00 4.00 C ATOM 343 CD2 PHE A 603 1.297 -13.687 3.718 1.00 52.33 C ATOM 344 CE1 PHE A 603 -1.268 -14.635 3.353 1.00 14.41 C ATOM 345 CE2 PHE A 603 0.570 -14.148 4.801 1.00 32.12 C ATOM 346 CZ PHE A 603 -0.718 -14.620 4.618 1.00 54.00 C ATOM 0 H PHE A 603 4.000 -14.453 0.484 1.00 43.03 H new ATOM 0 HA PHE A 603 1.151 -14.751 -0.094 1.00 73.24 H new ATOM 0 HB2 PHE A 603 2.412 -12.649 1.680 1.00 24.13 H new ATOM 0 HB3 PHE A 603 0.904 -12.350 0.838 1.00 24.13 H new ATOM 0 HD1 PHE A 603 -0.967 -14.199 1.287 1.00 4.00 H new ATOM 0 HD2 PHE A 603 2.297 -13.309 3.869 1.00 52.33 H new ATOM 0 HE1 PHE A 603 -2.273 -15.001 3.205 1.00 14.41 H new ATOM 0 HE2 PHE A 603 1.007 -14.140 5.788 1.00 32.12 H new ATOM 0 HZ PHE A 603 -1.290 -14.975 5.462 1.00 54.00 H new ATOM 356 N ASP A 604 1.425 -12.872 -1.855 1.00 74.34 N ATOM 357 CA ASP A 604 1.625 -11.898 -2.903 1.00 54.50 C ATOM 358 C ASP A 604 0.519 -10.884 -2.799 1.00 10.23 C ATOM 359 O ASP A 604 -0.629 -11.235 -2.491 1.00 22.02 O ATOM 360 CB ASP A 604 1.643 -12.519 -4.325 1.00 34.12 C ATOM 361 CG ASP A 604 0.309 -13.076 -4.785 1.00 14.25 C ATOM 362 OD1 ASP A 604 -0.519 -12.309 -5.333 1.00 35.40 O ATOM 363 OD2 ASP A 604 0.070 -14.296 -4.621 1.00 62.15 O ATOM 0 H ASP A 604 0.495 -13.291 -1.843 1.00 74.34 H new ATOM 0 HA ASP A 604 2.606 -11.443 -2.764 1.00 54.50 H new ATOM 0 HB2 ASP A 604 1.970 -11.759 -5.035 1.00 34.12 H new ATOM 0 HB3 ASP A 604 2.384 -13.318 -4.349 1.00 34.12 H new ATOM 368 N LEU A 605 0.840 -9.641 -3.004 1.00 21.20 N ATOM 369 CA LEU A 605 -0.169 -8.609 -2.963 1.00 51.23 C ATOM 370 C LEU A 605 -0.242 -7.937 -4.310 1.00 14.44 C ATOM 371 O LEU A 605 -0.561 -6.765 -4.427 1.00 53.41 O ATOM 372 CB LEU A 605 0.093 -7.593 -1.833 1.00 53.23 C ATOM 373 CG LEU A 605 0.136 -8.167 -0.402 1.00 52.23 C ATOM 374 CD1 LEU A 605 0.396 -7.066 0.598 1.00 15.25 C ATOM 375 CD2 LEU A 605 -1.159 -8.895 -0.056 1.00 23.24 C ATOM 0 H LEU A 605 1.785 -9.312 -3.201 1.00 21.20 H new ATOM 0 HA LEU A 605 -1.133 -9.067 -2.741 1.00 51.23 H new ATOM 0 HB2 LEU A 605 1.042 -7.096 -2.032 1.00 53.23 H new ATOM 0 HB3 LEU A 605 -0.682 -6.828 -1.873 1.00 53.23 H new ATOM 0 HG LEU A 605 0.951 -8.889 -0.357 1.00 52.23 H new ATOM 0 HD11 LEU A 605 0.424 -7.487 1.603 1.00 15.25 H new ATOM 0 HD12 LEU A 605 1.352 -6.592 0.377 1.00 15.25 H new ATOM 0 HD13 LEU A 605 -0.400 -6.324 0.537 1.00 15.25 H new ATOM 0 HD21 LEU A 605 -1.096 -9.287 0.959 1.00 23.24 H new ATOM 0 HD22 LEU A 605 -1.996 -8.201 -0.125 1.00 23.24 H new ATOM 0 HD23 LEU A 605 -1.312 -9.718 -0.754 1.00 23.24 H new ATOM 383 N THR A 606 0.000 -8.717 -5.335 1.00 32.44 N ATOM 384 CA THR A 606 -0.088 -8.269 -6.679 1.00 15.43 C ATOM 385 C THR A 606 -1.517 -7.687 -7.030 1.00 61.55 C ATOM 386 O THR A 606 -1.600 -6.652 -7.693 1.00 34.55 O ATOM 387 CB THR A 606 0.319 -9.399 -7.633 1.00 55.45 C ATOM 388 OG1 THR A 606 1.652 -9.844 -7.290 1.00 42.44 O ATOM 389 CG2 THR A 606 0.306 -8.922 -9.061 1.00 2.11 C ATOM 0 H THR A 606 0.268 -9.697 -5.243 1.00 32.44 H new ATOM 0 HA THR A 606 0.609 -7.440 -6.804 1.00 15.43 H new ATOM 0 HB THR A 606 -0.393 -10.219 -7.535 1.00 55.45 H new ATOM 0 HG1 THR A 606 1.921 -10.568 -7.894 1.00 42.44 H new ATOM 0 HG21 THR A 606 0.598 -9.739 -9.720 1.00 2.11 H new ATOM 0 HG22 THR A 606 -0.697 -8.585 -9.323 1.00 2.11 H new ATOM 0 HG23 THR A 606 1.008 -8.096 -9.175 1.00 2.11 H new ATOM 395 N PRO A 607 -2.669 -8.321 -6.576 1.00 64.31 N ATOM 396 CA PRO A 607 -4.027 -7.753 -6.803 1.00 64.33 C ATOM 397 C PRO A 607 -4.199 -6.373 -6.139 1.00 75.24 C ATOM 398 O PRO A 607 -5.112 -5.614 -6.467 1.00 20.44 O ATOM 399 CB PRO A 607 -4.958 -8.769 -6.129 1.00 52.13 C ATOM 400 CG PRO A 607 -4.177 -10.033 -6.095 1.00 63.14 C ATOM 401 CD PRO A 607 -2.759 -9.629 -5.875 1.00 23.20 C ATOM 0 HA PRO A 607 -4.227 -7.599 -7.863 1.00 64.33 H new ATOM 0 HB2 PRO A 607 -5.234 -8.447 -5.125 1.00 52.13 H new ATOM 0 HB3 PRO A 607 -5.884 -8.891 -6.691 1.00 52.13 H new ATOM 0 HG2 PRO A 607 -4.526 -10.687 -5.296 1.00 63.14 H new ATOM 0 HG3 PRO A 607 -4.286 -10.585 -7.029 1.00 63.14 H new ATOM 0 HD2 PRO A 607 -2.527 -9.535 -4.814 1.00 23.20 H new ATOM 0 HD3 PRO A 607 -2.063 -10.358 -6.290 1.00 23.20 H new ATOM 409 N LEU A 608 -3.304 -6.064 -5.213 1.00 73.33 N ATOM 410 CA LEU A 608 -3.295 -4.796 -4.510 1.00 34.43 C ATOM 411 C LEU A 608 -2.691 -3.699 -5.384 1.00 31.30 C ATOM 412 O LEU A 608 -2.826 -2.529 -5.089 1.00 4.41 O ATOM 413 CB LEU A 608 -2.480 -4.896 -3.212 1.00 55.23 C ATOM 414 CG LEU A 608 -3.067 -5.613 -1.969 1.00 55.24 C ATOM 415 CD1 LEU A 608 -4.201 -4.848 -1.409 1.00 12.30 C ATOM 416 CD2 LEU A 608 -3.496 -7.033 -2.236 1.00 53.32 C ATOM 0 H LEU A 608 -2.556 -6.696 -4.927 1.00 73.33 H new ATOM 0 HA LEU A 608 -4.329 -4.547 -4.272 1.00 34.43 H new ATOM 0 HB2 LEU A 608 -1.542 -5.394 -3.458 1.00 55.23 H new ATOM 0 HB3 LEU A 608 -2.231 -3.879 -2.909 1.00 55.23 H new ATOM 0 HG LEU A 608 -2.254 -5.659 -1.244 1.00 55.24 H new ATOM 0 HD11 LEU A 608 -4.597 -5.370 -0.538 1.00 12.30 H new ATOM 0 HD12 LEU A 608 -3.860 -3.856 -1.114 1.00 12.30 H new ATOM 0 HD13 LEU A 608 -4.983 -4.754 -2.162 1.00 12.30 H new ATOM 0 HD21 LEU A 608 -3.896 -7.470 -1.321 1.00 53.32 H new ATOM 0 HD22 LEU A 608 -4.265 -7.042 -3.009 1.00 53.32 H new ATOM 0 HD23 LEU A 608 -2.638 -7.615 -2.571 1.00 53.32 H new ATOM 424 N THR A 609 -1.998 -4.091 -6.428 1.00 33.42 N ATOM 425 CA THR A 609 -1.405 -3.141 -7.335 1.00 31.44 C ATOM 426 C THR A 609 -2.495 -2.570 -8.250 1.00 15.23 C ATOM 427 O THR A 609 -3.122 -3.313 -9.025 1.00 32.23 O ATOM 428 CB THR A 609 -0.319 -3.822 -8.175 1.00 11.31 C ATOM 429 OG1 THR A 609 0.593 -4.509 -7.292 1.00 43.42 O ATOM 430 CG2 THR A 609 0.454 -2.794 -8.986 1.00 13.20 C ATOM 0 H THR A 609 -1.831 -5.068 -6.669 1.00 33.42 H new ATOM 0 HA THR A 609 -0.947 -2.332 -6.765 1.00 31.44 H new ATOM 0 HB THR A 609 -0.791 -4.527 -8.860 1.00 11.31 H new ATOM 0 HG1 THR A 609 1.291 -4.949 -7.821 1.00 43.42 H new ATOM 0 HG21 THR A 609 1.220 -3.297 -9.576 1.00 13.20 H new ATOM 0 HG22 THR A 609 -0.229 -2.268 -9.653 1.00 13.20 H new ATOM 0 HG23 THR A 609 0.926 -2.079 -8.312 1.00 13.20 H new ATOM 436 N LYS A 610 -2.745 -1.281 -8.146 1.00 60.15 N ATOM 437 CA LYS A 610 -3.781 -0.653 -8.942 1.00 11.41 C ATOM 438 C LYS A 610 -3.176 0.488 -9.753 1.00 74.04 C ATOM 439 O LYS A 610 -2.242 1.145 -9.286 1.00 22.00 O ATOM 440 CB LYS A 610 -4.889 -0.098 -8.029 1.00 30.43 C ATOM 441 CG LYS A 610 -5.403 -1.088 -6.986 1.00 73.41 C ATOM 442 CD LYS A 610 -6.634 -0.588 -6.203 1.00 63.32 C ATOM 443 CE LYS A 610 -7.957 -0.619 -6.987 1.00 60.32 C ATOM 444 NZ LYS A 610 -8.004 0.295 -8.150 1.00 71.04 N ATOM 0 H LYS A 610 -2.247 -0.648 -7.520 1.00 60.15 H new ATOM 0 HA LYS A 610 -4.212 -1.396 -9.613 1.00 11.41 H new ATOM 0 HB2 LYS A 610 -4.511 0.787 -7.517 1.00 30.43 H new ATOM 0 HB3 LYS A 610 -5.726 0.225 -8.649 1.00 30.43 H new ATOM 0 HG2 LYS A 610 -5.656 -2.025 -7.482 1.00 73.41 H new ATOM 0 HG3 LYS A 610 -4.601 -1.307 -6.281 1.00 73.41 H new ATOM 0 HD2 LYS A 610 -6.746 -1.195 -5.305 1.00 63.32 H new ATOM 0 HD3 LYS A 610 -6.447 0.434 -5.875 1.00 63.32 H new ATOM 0 HE2 LYS A 610 -8.135 -1.637 -7.334 1.00 60.32 H new ATOM 0 HE3 LYS A 610 -8.772 -0.366 -6.309 1.00 60.32 H new ATOM 0 HZ1 LYS A 610 -8.986 0.593 -8.318 1.00 71.04 H new ATOM 0 HZ2 LYS A 610 -7.416 1.131 -7.958 1.00 71.04 H new ATOM 0 HZ3 LYS A 610 -7.643 -0.196 -8.992 1.00 71.04 H new ATOM 458 N LYS A 611 -3.701 0.731 -10.950 1.00 20.40 N ATOM 459 CA LYS A 611 -3.210 1.824 -11.797 1.00 40.13 C ATOM 460 C LYS A 611 -3.619 3.171 -11.203 1.00 3.14 C ATOM 461 O LYS A 611 -2.924 4.174 -11.357 1.00 3.34 O ATOM 462 CB LYS A 611 -3.740 1.708 -13.253 1.00 70.20 C ATOM 463 CG LYS A 611 -5.256 1.827 -13.380 1.00 43.21 C ATOM 464 CD LYS A 611 -5.736 1.776 -14.818 1.00 60.33 C ATOM 465 CE LYS A 611 -7.253 1.917 -14.880 1.00 41.51 C ATOM 466 NZ LYS A 611 -7.774 1.835 -16.258 1.00 13.15 N ATOM 0 H LYS A 611 -4.464 0.191 -11.358 1.00 20.40 H new ATOM 0 HA LYS A 611 -2.123 1.752 -11.830 1.00 40.13 H new ATOM 0 HB2 LYS A 611 -3.274 2.484 -13.860 1.00 70.20 H new ATOM 0 HB3 LYS A 611 -3.426 0.749 -13.666 1.00 70.20 H new ATOM 0 HG2 LYS A 611 -5.727 1.021 -12.817 1.00 43.21 H new ATOM 0 HG3 LYS A 611 -5.581 2.764 -12.927 1.00 43.21 H new ATOM 0 HD2 LYS A 611 -5.267 2.575 -15.393 1.00 60.33 H new ATOM 0 HD3 LYS A 611 -5.433 0.834 -15.275 1.00 60.33 H new ATOM 0 HE2 LYS A 611 -7.712 1.135 -14.275 1.00 41.51 H new ATOM 0 HE3 LYS A 611 -7.544 2.872 -14.442 1.00 41.51 H new ATOM 0 HZ1 LYS A 611 -8.809 1.937 -16.244 1.00 13.15 H new ATOM 0 HZ2 LYS A 611 -7.359 2.596 -16.832 1.00 13.15 H new ATOM 0 HZ3 LYS A 611 -7.522 0.914 -16.670 1.00 13.15 H new ATOM 480 N ASP A 612 -4.751 3.178 -10.513 1.00 2.43 N ATOM 481 CA ASP A 612 -5.291 4.394 -9.895 1.00 42.14 C ATOM 482 C ASP A 612 -4.681 4.619 -8.550 1.00 75.43 C ATOM 483 O ASP A 612 -4.729 5.727 -8.020 1.00 24.14 O ATOM 484 CB ASP A 612 -6.816 4.314 -9.724 1.00 73.43 C ATOM 485 CG ASP A 612 -7.572 4.233 -11.017 1.00 23.45 C ATOM 486 OD1 ASP A 612 -7.833 5.278 -11.622 1.00 53.41 O ATOM 487 OD2 ASP A 612 -7.936 3.112 -11.435 1.00 43.11 O ATOM 0 H ASP A 612 -5.324 2.347 -10.363 1.00 2.43 H new ATOM 0 HA ASP A 612 -5.047 5.220 -10.563 1.00 42.14 H new ATOM 0 HB2 ASP A 612 -7.058 3.441 -9.118 1.00 73.43 H new ATOM 0 HB3 ASP A 612 -7.156 5.190 -9.171 1.00 73.43 H new ATOM 492 N ALA A 613 -4.092 3.556 -8.005 1.00 12.23 N ATOM 493 CA ALA A 613 -3.533 3.545 -6.661 1.00 42.22 C ATOM 494 C ALA A 613 -4.642 3.724 -5.619 1.00 1.54 C ATOM 495 O ALA A 613 -5.827 3.747 -5.952 1.00 3.54 O ATOM 496 CB ALA A 613 -2.430 4.603 -6.499 1.00 33.13 C ATOM 0 H ALA A 613 -3.990 2.667 -8.495 1.00 12.23 H new ATOM 0 HA ALA A 613 -3.067 2.574 -6.496 1.00 42.22 H new ATOM 0 HB1 ALA A 613 -2.036 4.565 -5.483 1.00 33.13 H new ATOM 0 HB2 ALA A 613 -1.626 4.402 -7.207 1.00 33.13 H new ATOM 0 HB3 ALA A 613 -2.844 5.593 -6.691 1.00 33.13 H new ATOM 502 N TYR A 614 -4.260 3.797 -4.397 1.00 4.40 N ATOM 503 CA TYR A 614 -5.195 3.985 -3.299 1.00 60.32 C ATOM 504 C TYR A 614 -5.128 5.394 -2.797 1.00 62.12 C ATOM 505 O TYR A 614 -4.059 6.011 -2.799 1.00 21.14 O ATOM 506 CB TYR A 614 -4.884 3.023 -2.151 1.00 11.20 C ATOM 507 CG TYR A 614 -5.069 1.580 -2.510 1.00 74.02 C ATOM 508 CD1 TYR A 614 -4.132 0.922 -3.280 1.00 62.02 C ATOM 509 CD2 TYR A 614 -6.184 0.873 -2.085 1.00 64.24 C ATOM 510 CE1 TYR A 614 -4.287 -0.386 -3.617 1.00 12.44 C ATOM 511 CE2 TYR A 614 -6.348 -0.454 -2.420 1.00 23.10 C ATOM 512 CZ TYR A 614 -5.394 -1.078 -3.187 1.00 33.52 C ATOM 513 OH TYR A 614 -5.539 -2.395 -3.531 1.00 5.23 O ATOM 0 H TYR A 614 -3.285 3.730 -4.106 1.00 4.40 H new ATOM 0 HA TYR A 614 -6.198 3.779 -3.672 1.00 60.32 H new ATOM 0 HB2 TYR A 614 -3.855 3.179 -1.826 1.00 11.20 H new ATOM 0 HB3 TYR A 614 -5.526 3.263 -1.303 1.00 11.20 H new ATOM 0 HD1 TYR A 614 -3.258 1.457 -3.622 1.00 62.02 H new ATOM 0 HD2 TYR A 614 -6.933 1.368 -1.484 1.00 64.24 H new ATOM 0 HE1 TYR A 614 -3.541 -0.881 -4.222 1.00 12.44 H new ATOM 0 HE2 TYR A 614 -7.218 -0.998 -2.083 1.00 23.10 H new ATOM 0 HH TYR A 614 -5.254 -2.524 -4.460 1.00 5.23 H new ATOM 523 N LYS A 615 -6.244 5.901 -2.371 1.00 44.22 N ATOM 524 CA LYS A 615 -6.309 7.228 -1.849 1.00 63.53 C ATOM 525 C LYS A 615 -6.845 7.222 -0.439 1.00 51.42 C ATOM 526 O LYS A 615 -7.839 6.577 -0.146 1.00 73.33 O ATOM 527 CB LYS A 615 -7.115 8.139 -2.793 1.00 42.12 C ATOM 528 CG LYS A 615 -8.558 7.713 -3.052 1.00 31.54 C ATOM 529 CD LYS A 615 -9.573 8.339 -2.091 1.00 10.12 C ATOM 530 CE LYS A 615 -9.616 9.852 -2.239 1.00 43.51 C ATOM 531 NZ LYS A 615 -10.772 10.452 -1.546 1.00 22.33 N ATOM 0 H LYS A 615 -7.135 5.405 -2.376 1.00 44.22 H new ATOM 0 HA LYS A 615 -5.302 7.641 -1.796 1.00 63.53 H new ATOM 0 HB2 LYS A 615 -7.122 9.147 -2.377 1.00 42.12 H new ATOM 0 HB3 LYS A 615 -6.594 8.192 -3.749 1.00 42.12 H new ATOM 0 HG2 LYS A 615 -8.827 7.980 -4.074 1.00 31.54 H new ATOM 0 HG3 LYS A 615 -8.625 6.628 -2.978 1.00 31.54 H new ATOM 0 HD2 LYS A 615 -10.563 7.925 -2.284 1.00 10.12 H new ATOM 0 HD3 LYS A 615 -9.313 8.079 -1.065 1.00 10.12 H new ATOM 0 HE2 LYS A 615 -8.696 10.280 -1.842 1.00 43.51 H new ATOM 0 HE3 LYS A 615 -9.656 10.110 -3.297 1.00 43.51 H new ATOM 0 HZ1 LYS A 615 -10.917 11.423 -1.889 1.00 22.33 H new ATOM 0 HZ2 LYS A 615 -11.624 9.887 -1.738 1.00 22.33 H new ATOM 0 HZ3 LYS A 615 -10.592 10.470 -0.522 1.00 22.33 H new ATOM 545 N VAL A 616 -6.153 7.888 0.420 1.00 33.42 N ATOM 546 CA VAL A 616 -6.531 8.025 1.803 1.00 43.32 C ATOM 547 C VAL A 616 -6.726 9.493 2.039 1.00 72.00 C ATOM 548 O VAL A 616 -6.004 10.306 1.457 1.00 73.30 O ATOM 549 CB VAL A 616 -5.407 7.524 2.751 1.00 53.40 C ATOM 550 CG1 VAL A 616 -5.863 7.523 4.201 1.00 45.04 C ATOM 551 CG2 VAL A 616 -4.895 6.161 2.340 1.00 15.12 C ATOM 0 H VAL A 616 -5.285 8.368 0.184 1.00 33.42 H new ATOM 0 HA VAL A 616 -7.427 7.438 2.005 1.00 43.32 H new ATOM 0 HB VAL A 616 -4.577 8.225 2.664 1.00 53.40 H new ATOM 0 HG11 VAL A 616 -5.053 7.167 4.837 1.00 45.04 H new ATOM 0 HG12 VAL A 616 -6.138 8.535 4.497 1.00 45.04 H new ATOM 0 HG13 VAL A 616 -6.726 6.866 4.311 1.00 45.04 H new ATOM 0 HG21 VAL A 616 -4.110 5.845 3.027 1.00 15.12 H new ATOM 0 HG22 VAL A 616 -5.713 5.441 2.368 1.00 15.12 H new ATOM 0 HG23 VAL A 616 -4.492 6.213 1.328 1.00 15.12 H new ATOM 557 N GLU A 617 -7.666 9.856 2.839 1.00 23.52 N ATOM 558 CA GLU A 617 -7.892 11.238 3.078 1.00 22.22 C ATOM 559 C GLU A 617 -8.004 11.547 4.541 1.00 31.34 C ATOM 560 O GLU A 617 -8.420 10.708 5.348 1.00 51.44 O ATOM 561 CB GLU A 617 -9.119 11.749 2.323 1.00 42.01 C ATOM 562 CG GLU A 617 -10.412 11.042 2.675 1.00 13.25 C ATOM 563 CD GLU A 617 -11.578 11.631 1.949 1.00 72.21 C ATOM 564 OE1 GLU A 617 -11.847 11.215 0.802 1.00 53.33 O ATOM 565 OE2 GLU A 617 -12.239 12.536 2.500 1.00 33.34 O ATOM 0 H GLU A 617 -8.288 9.219 3.337 1.00 23.52 H new ATOM 0 HA GLU A 617 -7.017 11.765 2.696 1.00 22.22 H new ATOM 0 HB2 GLU A 617 -9.236 12.814 2.523 1.00 42.01 H new ATOM 0 HB3 GLU A 617 -8.942 11.643 1.253 1.00 42.01 H new ATOM 0 HG2 GLU A 617 -10.327 9.984 2.429 1.00 13.25 H new ATOM 0 HG3 GLU A 617 -10.582 11.107 3.750 1.00 13.25 H new ATOM 572 N THR A 618 -7.582 12.722 4.868 1.00 52.32 N ATOM 573 CA THR A 618 -7.726 13.302 6.163 1.00 60.42 C ATOM 574 C THR A 618 -8.033 14.753 5.906 1.00 34.35 C ATOM 575 O THR A 618 -8.016 15.178 4.742 1.00 2.22 O ATOM 576 CB THR A 618 -6.416 13.197 7.013 1.00 75.10 C ATOM 577 OG1 THR A 618 -5.307 13.766 6.295 1.00 75.20 O ATOM 578 CG2 THR A 618 -6.099 11.762 7.398 1.00 33.33 C ATOM 0 H THR A 618 -7.104 13.335 4.208 1.00 52.32 H new ATOM 0 HA THR A 618 -8.501 12.784 6.728 1.00 60.42 H new ATOM 0 HB THR A 618 -6.582 13.759 7.932 1.00 75.10 H new ATOM 0 HG1 THR A 618 -5.291 13.410 5.382 1.00 75.20 H new ATOM 0 HG21 THR A 618 -5.182 11.737 7.987 1.00 33.33 H new ATOM 0 HG22 THR A 618 -6.920 11.354 7.988 1.00 33.33 H new ATOM 0 HG23 THR A 618 -5.967 11.164 6.496 1.00 33.33 H new ATOM 584 N ASP A 619 -8.310 15.515 6.924 1.00 41.24 N ATOM 585 CA ASP A 619 -8.517 16.953 6.742 1.00 74.44 C ATOM 586 C ASP A 619 -7.192 17.633 6.479 1.00 21.22 C ATOM 587 O ASP A 619 -7.134 18.736 5.940 1.00 64.33 O ATOM 588 CB ASP A 619 -9.220 17.601 7.935 1.00 45.25 C ATOM 589 CG ASP A 619 -10.625 17.104 8.127 1.00 51.52 C ATOM 590 OD1 ASP A 619 -11.501 17.442 7.301 1.00 4.45 O ATOM 591 OD2 ASP A 619 -10.878 16.365 9.106 1.00 55.45 O ATOM 0 H ASP A 619 -8.401 15.186 7.885 1.00 41.24 H new ATOM 0 HA ASP A 619 -9.174 17.081 5.881 1.00 74.44 H new ATOM 0 HB2 ASP A 619 -8.644 17.405 8.840 1.00 45.25 H new ATOM 0 HB3 ASP A 619 -9.238 18.682 7.796 1.00 45.25 H new ATOM 596 N LYS A 620 -6.137 16.949 6.855 1.00 61.12 N ATOM 597 CA LYS A 620 -4.787 17.443 6.746 1.00 52.51 C ATOM 598 C LYS A 620 -4.231 17.208 5.334 1.00 52.34 C ATOM 599 O LYS A 620 -3.935 18.158 4.591 1.00 54.21 O ATOM 600 CB LYS A 620 -3.912 16.695 7.758 1.00 22.24 C ATOM 601 CG LYS A 620 -4.401 16.790 9.194 1.00 73.23 C ATOM 602 CD LYS A 620 -3.587 15.910 10.144 1.00 33.01 C ATOM 603 CE LYS A 620 -2.130 16.342 10.238 1.00 61.13 C ATOM 604 NZ LYS A 620 -1.991 17.726 10.734 1.00 10.22 N ATOM 0 H LYS A 620 -6.196 16.012 7.254 1.00 61.12 H new ATOM 0 HA LYS A 620 -4.783 18.514 6.946 1.00 52.51 H new ATOM 0 HB2 LYS A 620 -3.862 15.644 7.472 1.00 22.24 H new ATOM 0 HB3 LYS A 620 -2.897 17.089 7.705 1.00 22.24 H new ATOM 0 HG2 LYS A 620 -4.346 17.827 9.526 1.00 73.23 H new ATOM 0 HG3 LYS A 620 -5.450 16.496 9.239 1.00 73.23 H new ATOM 0 HD2 LYS A 620 -4.036 15.941 11.137 1.00 33.01 H new ATOM 0 HD3 LYS A 620 -3.634 14.875 9.805 1.00 33.01 H new ATOM 0 HE2 LYS A 620 -1.594 15.664 10.902 1.00 61.13 H new ATOM 0 HE3 LYS A 620 -1.664 16.261 9.256 1.00 61.13 H new ATOM 0 HZ1 LYS A 620 -0.996 17.910 10.975 1.00 10.22 H new ATOM 0 HZ2 LYS A 620 -2.297 18.392 9.996 1.00 10.22 H new ATOM 0 HZ3 LYS A 620 -2.581 17.852 11.581 1.00 10.22 H new ATOM 618 N TYR A 621 -4.108 15.944 4.954 1.00 23.32 N ATOM 619 CA TYR A 621 -3.497 15.593 3.685 1.00 11.43 C ATOM 620 C TYR A 621 -4.302 14.505 2.998 1.00 30.15 C ATOM 621 O TYR A 621 -5.107 13.807 3.637 1.00 23.21 O ATOM 622 CB TYR A 621 -2.081 15.018 3.912 1.00 1.13 C ATOM 623 CG TYR A 621 -1.145 15.852 4.763 1.00 63.20 C ATOM 624 CD1 TYR A 621 -0.419 16.894 4.222 1.00 3.24 C ATOM 625 CD2 TYR A 621 -0.981 15.575 6.113 1.00 44.21 C ATOM 626 CE1 TYR A 621 0.440 17.641 5.002 1.00 63.34 C ATOM 627 CE2 TYR A 621 -0.124 16.315 6.893 1.00 13.34 C ATOM 628 CZ TYR A 621 0.582 17.349 6.329 1.00 4.52 C ATOM 629 OH TYR A 621 1.455 18.090 7.102 1.00 32.31 O ATOM 0 H TYR A 621 -4.424 15.147 5.507 1.00 23.32 H new ATOM 0 HA TYR A 621 -3.460 16.498 3.078 1.00 11.43 H new ATOM 0 HB2 TYR A 621 -2.181 14.036 4.375 1.00 1.13 H new ATOM 0 HB3 TYR A 621 -1.614 14.865 2.939 1.00 1.13 H new ATOM 0 HD1 TYR A 621 -0.525 17.128 3.173 1.00 3.24 H new ATOM 0 HD2 TYR A 621 -1.537 14.763 6.559 1.00 44.21 H new ATOM 0 HE1 TYR A 621 0.999 18.455 4.564 1.00 63.34 H new ATOM 0 HE2 TYR A 621 -0.007 16.085 7.942 1.00 13.34 H new ATOM 0 HH TYR A 621 1.439 17.757 8.024 1.00 32.31 H new ATOM 639 N GLU A 622 -4.103 14.372 1.720 1.00 23.02 N ATOM 640 CA GLU A 622 -4.623 13.258 0.984 1.00 33.04 C ATOM 641 C GLU A 622 -3.429 12.401 0.597 1.00 72.01 C ATOM 642 O GLU A 622 -2.427 12.910 0.086 1.00 30.23 O ATOM 643 CB GLU A 622 -5.414 13.699 -0.260 1.00 41.03 C ATOM 644 CG GLU A 622 -4.612 14.501 -1.264 1.00 71.52 C ATOM 645 CD GLU A 622 -5.383 14.820 -2.501 1.00 53.03 C ATOM 646 OE1 GLU A 622 -5.432 13.960 -3.413 1.00 71.24 O ATOM 647 OE2 GLU A 622 -5.953 15.922 -2.597 1.00 4.44 O ATOM 0 H GLU A 622 -3.573 15.036 1.156 1.00 23.02 H new ATOM 0 HA GLU A 622 -5.331 12.700 1.597 1.00 33.04 H new ATOM 0 HB2 GLU A 622 -5.810 12.813 -0.756 1.00 41.03 H new ATOM 0 HB3 GLU A 622 -6.269 14.294 0.061 1.00 41.03 H new ATOM 0 HG2 GLU A 622 -4.281 15.429 -0.799 1.00 71.52 H new ATOM 0 HG3 GLU A 622 -3.716 13.943 -1.534 1.00 71.52 H new ATOM 654 N PHE A 623 -3.510 11.143 0.845 1.00 11.21 N ATOM 655 CA PHE A 623 -2.391 10.272 0.613 1.00 44.31 C ATOM 656 C PHE A 623 -2.714 9.342 -0.517 1.00 4.14 C ATOM 657 O PHE A 623 -3.813 8.812 -0.582 1.00 33.21 O ATOM 658 CB PHE A 623 -2.096 9.440 1.868 1.00 41.22 C ATOM 659 CG PHE A 623 -1.908 10.245 3.125 1.00 45.22 C ATOM 660 CD1 PHE A 623 -2.995 10.565 3.931 1.00 42.30 C ATOM 661 CD2 PHE A 623 -0.656 10.679 3.502 1.00 52.44 C ATOM 662 CE1 PHE A 623 -2.827 11.302 5.083 1.00 50.51 C ATOM 663 CE2 PHE A 623 -0.484 11.416 4.655 1.00 33.30 C ATOM 664 CZ PHE A 623 -1.570 11.729 5.445 1.00 64.01 C ATOM 0 H PHE A 623 -4.342 10.681 1.212 1.00 11.21 H new ATOM 0 HA PHE A 623 -1.518 10.878 0.368 1.00 44.31 H new ATOM 0 HB2 PHE A 623 -2.914 8.737 2.022 1.00 41.22 H new ATOM 0 HB3 PHE A 623 -1.197 8.849 1.693 1.00 41.22 H new ATOM 0 HD1 PHE A 623 -3.983 10.232 3.651 1.00 42.30 H new ATOM 0 HD2 PHE A 623 0.200 10.440 2.888 1.00 52.44 H new ATOM 0 HE1 PHE A 623 -3.680 11.544 5.700 1.00 50.51 H new ATOM 0 HE2 PHE A 623 0.503 11.749 4.940 1.00 33.30 H new ATOM 0 HZ PHE A 623 -1.434 12.308 6.346 1.00 64.01 H new ATOM 674 N HIS A 624 -1.799 9.169 -1.419 1.00 34.51 N ATOM 675 CA HIS A 624 -1.978 8.209 -2.467 1.00 72.45 C ATOM 676 C HIS A 624 -0.912 7.165 -2.320 1.00 12.21 C ATOM 677 O HIS A 624 0.283 7.478 -2.372 1.00 1.13 O ATOM 678 CB HIS A 624 -1.967 8.864 -3.859 1.00 62.23 C ATOM 679 CG HIS A 624 -3.103 9.839 -4.073 1.00 62.40 C ATOM 680 ND1 HIS A 624 -4.260 9.516 -4.739 1.00 30.43 N ATOM 681 CD2 HIS A 624 -3.243 11.141 -3.702 1.00 31.03 C ATOM 682 CE1 HIS A 624 -5.061 10.563 -4.767 1.00 54.31 C ATOM 683 NE2 HIS A 624 -4.465 11.561 -4.144 1.00 21.34 N ATOM 0 H HIS A 624 -0.917 9.681 -1.452 1.00 34.51 H new ATOM 0 HA HIS A 624 -2.960 7.744 -2.379 1.00 72.45 H new ATOM 0 HB2 HIS A 624 -1.020 9.385 -4.000 1.00 62.23 H new ATOM 0 HB3 HIS A 624 -2.019 8.085 -4.619 1.00 62.23 H new ATOM 0 HD2 HIS A 624 -2.521 11.733 -3.159 1.00 31.03 H new ATOM 0 HE1 HIS A 624 -6.039 10.597 -5.223 1.00 54.31 H new ATOM 0 HE2 HIS A 624 -4.854 12.495 -4.013 1.00 21.34 H new ATOM 692 N ILE A 625 -1.338 5.943 -2.114 1.00 72.43 N ATOM 693 CA ILE A 625 -0.442 4.841 -1.803 1.00 11.03 C ATOM 694 C ILE A 625 -0.741 3.684 -2.740 1.00 62.25 C ATOM 695 O ILE A 625 -1.835 3.590 -3.282 1.00 52.02 O ATOM 696 CB ILE A 625 -0.683 4.348 -0.336 1.00 50.43 C ATOM 697 CG1 ILE A 625 -0.655 5.522 0.638 1.00 32.24 C ATOM 698 CG2 ILE A 625 0.365 3.307 0.082 1.00 61.22 C ATOM 699 CD1 ILE A 625 -0.930 5.125 2.060 1.00 53.41 C ATOM 0 H ILE A 625 -2.322 5.677 -2.156 1.00 72.43 H new ATOM 0 HA ILE A 625 0.588 5.180 -1.916 1.00 11.03 H new ATOM 0 HB ILE A 625 -1.667 3.880 -0.306 1.00 50.43 H new ATOM 0 HG12 ILE A 625 0.321 6.004 0.586 1.00 32.24 H new ATOM 0 HG13 ILE A 625 -1.393 6.261 0.326 1.00 32.24 H new ATOM 0 HG21 ILE A 625 0.170 2.985 1.105 1.00 61.22 H new ATOM 0 HG22 ILE A 625 0.310 2.447 -0.586 1.00 61.22 H new ATOM 0 HG23 ILE A 625 1.360 3.749 0.024 1.00 61.22 H new ATOM 0 HD11 ILE A 625 -0.894 6.008 2.698 1.00 53.41 H new ATOM 0 HD12 ILE A 625 -1.918 4.669 2.126 1.00 53.41 H new ATOM 0 HD13 ILE A 625 -0.177 4.409 2.390 1.00 53.41 H new ATOM 706 N ASN A 626 0.212 2.842 -2.939 1.00 1.04 N ATOM 707 CA ASN A 626 0.053 1.668 -3.737 1.00 32.31 C ATOM 708 C ASN A 626 0.822 0.605 -3.012 1.00 21.55 C ATOM 709 O ASN A 626 1.662 0.938 -2.217 1.00 63.13 O ATOM 710 CB ASN A 626 0.605 1.877 -5.145 1.00 21.21 C ATOM 711 CG ASN A 626 -0.008 0.938 -6.165 1.00 4.31 C ATOM 712 OD1 ASN A 626 -0.400 -0.191 -5.864 1.00 50.21 O ATOM 713 ND2 ASN A 626 -0.110 1.416 -7.377 1.00 70.20 N ATOM 0 H ASN A 626 1.146 2.949 -2.544 1.00 1.04 H new ATOM 0 HA ASN A 626 -0.996 1.402 -3.865 1.00 32.31 H new ATOM 0 HB2 ASN A 626 0.423 2.907 -5.452 1.00 21.21 H new ATOM 0 HB3 ASN A 626 1.686 1.735 -5.131 1.00 21.21 H new ATOM 0 HD21 ASN A 626 -0.527 0.849 -8.115 1.00 70.20 H new ATOM 0 HD22 ASN A 626 0.227 2.356 -7.585 1.00 70.20 H new ATOM 719 N VAL A 627 0.481 -0.637 -3.182 1.00 34.22 N ATOM 720 CA VAL A 627 1.195 -1.693 -2.472 1.00 54.04 C ATOM 721 C VAL A 627 2.505 -2.065 -3.175 1.00 52.24 C ATOM 722 O VAL A 627 3.498 -2.419 -2.554 1.00 32.34 O ATOM 723 CB VAL A 627 0.297 -2.930 -2.244 1.00 12.10 C ATOM 724 CG1 VAL A 627 1.067 -4.085 -1.615 1.00 44.50 C ATOM 725 CG2 VAL A 627 -0.868 -2.545 -1.355 1.00 50.12 C ATOM 0 H VAL A 627 -0.272 -0.956 -3.792 1.00 34.22 H new ATOM 0 HA VAL A 627 1.460 -1.300 -1.491 1.00 54.04 H new ATOM 0 HB VAL A 627 -0.065 -3.268 -3.215 1.00 12.10 H new ATOM 0 HG11 VAL A 627 0.398 -4.934 -1.472 1.00 44.50 H new ATOM 0 HG12 VAL A 627 1.887 -4.376 -2.272 1.00 44.50 H new ATOM 0 HG13 VAL A 627 1.468 -3.773 -0.651 1.00 44.50 H new ATOM 0 HG21 VAL A 627 -1.504 -3.415 -1.192 1.00 50.12 H new ATOM 0 HG22 VAL A 627 -0.492 -2.186 -0.397 1.00 50.12 H new ATOM 0 HG23 VAL A 627 -1.448 -1.757 -1.836 1.00 50.12 H new ATOM 731 N CYS A 628 2.509 -1.925 -4.439 1.00 52.05 N ATOM 732 CA CYS A 628 3.638 -2.289 -5.247 1.00 31.52 C ATOM 733 C CYS A 628 3.714 -1.305 -6.397 1.00 14.15 C ATOM 734 O CYS A 628 2.667 -0.864 -6.901 1.00 10.01 O ATOM 735 CB CYS A 628 3.451 -3.711 -5.817 1.00 24.51 C ATOM 736 SG CYS A 628 2.973 -5.000 -4.594 1.00 23.21 S ATOM 0 H CYS A 628 1.722 -1.549 -4.968 1.00 52.05 H new ATOM 0 HA CYS A 628 4.548 -2.269 -4.647 1.00 31.52 H new ATOM 0 HB2 CYS A 628 2.689 -3.674 -6.596 1.00 24.51 H new ATOM 0 HB3 CYS A 628 4.381 -4.017 -6.296 1.00 24.51 H new ATOM 741 N GLY A 629 4.908 -0.952 -6.809 1.00 31.45 N ATOM 742 CA GLY A 629 5.057 -0.050 -7.924 1.00 72.14 C ATOM 743 C GLY A 629 4.777 1.395 -7.539 1.00 0.24 C ATOM 744 O GLY A 629 4.848 1.755 -6.362 1.00 55.04 O ATOM 0 H GLY A 629 5.783 -1.272 -6.393 1.00 31.45 H new ATOM 0 HA2 GLY A 629 6.070 -0.129 -8.319 1.00 72.14 H new ATOM 0 HA3 GLY A 629 4.379 -0.349 -8.723 1.00 72.14 H new ATOM 748 N PRO A 630 4.492 2.263 -8.509 1.00 31.14 N ATOM 749 CA PRO A 630 4.216 3.656 -8.250 1.00 21.24 C ATOM 750 C PRO A 630 2.723 3.967 -8.086 1.00 25.41 C ATOM 751 O PRO A 630 1.852 3.118 -8.326 1.00 51.24 O ATOM 752 CB PRO A 630 4.760 4.354 -9.507 1.00 61.41 C ATOM 753 CG PRO A 630 4.930 3.270 -10.550 1.00 43.35 C ATOM 754 CD PRO A 630 4.451 1.977 -9.941 1.00 23.42 C ATOM 0 HA PRO A 630 4.667 3.981 -7.312 1.00 21.24 H new ATOM 0 HB2 PRO A 630 4.071 5.124 -9.854 1.00 61.41 H new ATOM 0 HB3 PRO A 630 5.710 4.847 -9.299 1.00 61.41 H new ATOM 0 HG2 PRO A 630 4.357 3.507 -11.446 1.00 43.35 H new ATOM 0 HG3 PRO A 630 5.974 3.188 -10.851 1.00 43.35 H new ATOM 0 HD2 PRO A 630 3.445 1.720 -10.274 1.00 23.42 H new ATOM 0 HD3 PRO A 630 5.098 1.140 -10.206 1.00 23.42 H new ATOM 762 N VAL A 631 2.448 5.188 -7.693 1.00 52.51 N ATOM 763 CA VAL A 631 1.092 5.689 -7.587 1.00 64.05 C ATOM 764 C VAL A 631 0.857 6.669 -8.691 1.00 55.43 C ATOM 765 O VAL A 631 1.821 7.217 -9.256 1.00 44.45 O ATOM 766 CB VAL A 631 0.827 6.432 -6.242 1.00 44.32 C ATOM 767 CG1 VAL A 631 0.946 5.503 -5.091 1.00 43.04 C ATOM 768 CG2 VAL A 631 1.764 7.627 -6.055 1.00 43.02 C ATOM 0 H VAL A 631 3.162 5.869 -7.435 1.00 52.51 H new ATOM 0 HA VAL A 631 0.426 4.828 -7.643 1.00 64.05 H new ATOM 0 HB VAL A 631 -0.194 6.812 -6.284 1.00 44.32 H new ATOM 0 HG11 VAL A 631 0.757 6.045 -4.165 1.00 43.04 H new ATOM 0 HG12 VAL A 631 0.218 4.699 -5.196 1.00 43.04 H new ATOM 0 HG13 VAL A 631 1.951 5.082 -5.066 1.00 43.04 H new ATOM 0 HG21 VAL A 631 1.545 8.116 -5.106 1.00 43.02 H new ATOM 0 HG22 VAL A 631 2.798 7.282 -6.056 1.00 43.02 H new ATOM 0 HG23 VAL A 631 1.617 8.336 -6.870 1.00 43.02 H new ATOM 774 N SER A 632 -0.375 6.883 -9.037 1.00 21.21 N ATOM 775 CA SER A 632 -0.652 7.845 -10.063 1.00 74.14 C ATOM 776 C SER A 632 -1.317 9.077 -9.465 1.00 72.54 C ATOM 777 O SER A 632 -2.352 8.973 -8.797 1.00 63.32 O ATOM 778 CB SER A 632 -1.544 7.200 -11.111 1.00 4.12 C ATOM 779 OG SER A 632 -0.934 6.003 -11.611 1.00 53.03 O ATOM 0 H SER A 632 -1.189 6.418 -8.636 1.00 21.21 H new ATOM 0 HA SER A 632 0.278 8.166 -10.532 1.00 74.14 H new ATOM 0 HB2 SER A 632 -2.517 6.968 -10.678 1.00 4.12 H new ATOM 0 HB3 SER A 632 -1.718 7.898 -11.930 1.00 4.12 H new ATOM 0 HG SER A 632 -1.540 5.245 -11.475 1.00 53.03 H new ATOM 785 N VAL A 633 -0.720 10.237 -9.710 1.00 74.41 N ATOM 786 CA VAL A 633 -1.227 11.534 -9.266 1.00 61.43 C ATOM 787 C VAL A 633 -0.687 12.570 -10.254 1.00 4.45 C ATOM 788 O VAL A 633 0.438 12.414 -10.739 1.00 53.50 O ATOM 789 CB VAL A 633 -0.717 11.937 -7.821 1.00 61.45 C ATOM 790 CG1 VAL A 633 -1.373 13.228 -7.336 1.00 5.11 C ATOM 791 CG2 VAL A 633 -0.909 10.831 -6.790 1.00 63.54 C ATOM 0 H VAL A 633 0.151 10.306 -10.236 1.00 74.41 H new ATOM 0 HA VAL A 633 -2.315 11.487 -9.226 1.00 61.43 H new ATOM 0 HB VAL A 633 0.356 12.102 -7.921 1.00 61.45 H new ATOM 0 HG11 VAL A 633 -1.000 13.474 -6.342 1.00 5.11 H new ATOM 0 HG12 VAL A 633 -1.134 14.039 -8.024 1.00 5.11 H new ATOM 0 HG13 VAL A 633 -2.454 13.094 -7.295 1.00 5.11 H new ATOM 0 HG21 VAL A 633 -0.540 11.169 -5.821 1.00 63.54 H new ATOM 0 HG22 VAL A 633 -1.969 10.588 -6.710 1.00 63.54 H new ATOM 0 HG23 VAL A 633 -0.356 9.945 -7.100 1.00 63.54 H new ATOM 797 N GLY A 634 -1.444 13.616 -10.532 1.00 63.43 N ATOM 798 CA GLY A 634 -0.988 14.642 -11.466 1.00 4.30 C ATOM 799 C GLY A 634 -0.106 15.696 -10.797 1.00 12.01 C ATOM 800 O GLY A 634 0.122 16.775 -11.352 1.00 3.32 O ATOM 0 H GLY A 634 -2.368 13.781 -10.132 1.00 63.43 H new ATOM 0 HA2 GLY A 634 -0.432 14.170 -12.276 1.00 4.30 H new ATOM 0 HA3 GLY A 634 -1.853 15.130 -11.915 1.00 4.30 H new ATOM 804 N ALA A 635 0.381 15.381 -9.614 1.00 40.12 N ATOM 805 CA ALA A 635 1.232 16.283 -8.856 1.00 35.41 C ATOM 806 C ALA A 635 2.368 15.513 -8.190 1.00 11.25 C ATOM 807 O ALA A 635 3.076 16.042 -7.335 1.00 11.32 O ATOM 808 CB ALA A 635 0.404 17.020 -7.808 1.00 53.32 C ATOM 0 H ALA A 635 0.199 14.492 -9.148 1.00 40.12 H new ATOM 0 HA ALA A 635 1.667 17.012 -9.539 1.00 35.41 H new ATOM 0 HB1 ALA A 635 1.048 17.694 -7.244 1.00 53.32 H new ATOM 0 HB2 ALA A 635 -0.379 17.595 -8.302 1.00 53.32 H new ATOM 0 HB3 ALA A 635 -0.049 16.298 -7.129 1.00 53.32 H new ATOM 814 N CYS A 636 2.565 14.280 -8.610 1.00 45.25 N ATOM 815 CA CYS A 636 3.577 13.442 -8.033 1.00 65.24 C ATOM 816 C CYS A 636 4.306 12.723 -9.155 1.00 12.43 C ATOM 817 O CYS A 636 3.709 12.466 -10.205 1.00 64.52 O ATOM 818 CB CYS A 636 2.940 12.407 -7.083 1.00 42.31 C ATOM 819 SG CYS A 636 1.951 13.125 -5.721 1.00 33.44 S ATOM 0 H CYS A 636 2.028 13.840 -9.357 1.00 45.25 H new ATOM 0 HA CYS A 636 4.274 14.054 -7.460 1.00 65.24 H new ATOM 0 HB2 CYS A 636 2.302 11.743 -7.666 1.00 42.31 H new ATOM 0 HB3 CYS A 636 3.731 11.792 -6.654 1.00 42.31 H new ATOM 824 N PRO A 637 5.595 12.412 -8.982 1.00 61.23 N ATOM 825 CA PRO A 637 6.367 11.680 -9.985 1.00 72.13 C ATOM 826 C PRO A 637 5.820 10.253 -10.169 1.00 3.45 C ATOM 827 O PRO A 637 5.304 9.646 -9.215 1.00 42.43 O ATOM 828 CB PRO A 637 7.787 11.615 -9.393 1.00 44.54 C ATOM 829 CG PRO A 637 7.808 12.612 -8.290 1.00 3.51 C ATOM 830 CD PRO A 637 6.398 12.741 -7.802 1.00 43.23 C ATOM 0 HA PRO A 637 6.327 12.162 -10.962 1.00 72.13 H new ATOM 0 HB2 PRO A 637 8.011 10.615 -9.021 1.00 44.54 H new ATOM 0 HB3 PRO A 637 8.537 11.850 -10.148 1.00 44.54 H new ATOM 0 HG2 PRO A 637 8.468 12.286 -7.486 1.00 3.51 H new ATOM 0 HG3 PRO A 637 8.185 13.572 -8.643 1.00 3.51 H new ATOM 0 HD2 PRO A 637 6.195 12.059 -6.976 1.00 43.23 H new ATOM 0 HD3 PRO A 637 6.189 13.748 -7.442 1.00 43.23 H new ATOM 838 N PRO A 638 5.930 9.685 -11.377 1.00 15.15 N ATOM 839 CA PRO A 638 5.437 8.325 -11.678 1.00 63.30 C ATOM 840 C PRO A 638 6.432 7.246 -11.210 1.00 64.04 C ATOM 841 O PRO A 638 6.428 6.115 -11.695 1.00 32.50 O ATOM 842 CB PRO A 638 5.348 8.338 -13.205 1.00 15.33 C ATOM 843 CG PRO A 638 6.447 9.251 -13.632 1.00 50.15 C ATOM 844 CD PRO A 638 6.542 10.321 -12.573 1.00 31.30 C ATOM 0 HA PRO A 638 4.497 8.092 -11.177 1.00 63.30 H new ATOM 0 HB2 PRO A 638 5.478 7.338 -13.619 1.00 15.33 H new ATOM 0 HB3 PRO A 638 4.377 8.699 -13.544 1.00 15.33 H new ATOM 0 HG2 PRO A 638 7.389 8.710 -13.724 1.00 50.15 H new ATOM 0 HG3 PRO A 638 6.233 9.687 -14.608 1.00 50.15 H new ATOM 0 HD2 PRO A 638 7.576 10.611 -12.388 1.00 31.30 H new ATOM 0 HD3 PRO A 638 6.006 11.224 -12.866 1.00 31.30 H new ATOM 852 N ASP A 639 7.254 7.615 -10.257 1.00 63.22 N ATOM 853 CA ASP A 639 8.285 6.744 -9.711 1.00 72.13 C ATOM 854 C ASP A 639 8.144 6.668 -8.180 1.00 64.44 C ATOM 855 O ASP A 639 8.902 5.985 -7.477 1.00 12.41 O ATOM 856 CB ASP A 639 9.657 7.299 -10.128 1.00 61.12 C ATOM 857 CG ASP A 639 10.832 6.491 -9.646 1.00 25.42 C ATOM 858 OD1 ASP A 639 11.067 5.388 -10.171 1.00 53.51 O ATOM 859 OD2 ASP A 639 11.571 6.973 -8.769 1.00 51.42 O ATOM 0 H ASP A 639 7.231 8.540 -9.828 1.00 63.22 H new ATOM 0 HA ASP A 639 8.182 5.731 -10.099 1.00 72.13 H new ATOM 0 HB2 ASP A 639 9.695 7.358 -11.216 1.00 61.12 H new ATOM 0 HB3 ASP A 639 9.753 8.317 -9.750 1.00 61.12 H new ATOM 864 N SER A 640 7.148 7.367 -7.672 1.00 12.43 N ATOM 865 CA SER A 640 6.886 7.409 -6.255 1.00 53.03 C ATOM 866 C SER A 640 5.769 6.420 -5.928 1.00 64.03 C ATOM 867 O SER A 640 4.787 6.331 -6.673 1.00 2.34 O ATOM 868 CB SER A 640 6.457 8.813 -5.892 1.00 63.32 C ATOM 869 OG SER A 640 7.404 9.741 -6.383 1.00 3.34 O ATOM 0 H SER A 640 6.500 7.920 -8.233 1.00 12.43 H new ATOM 0 HA SER A 640 7.778 7.140 -5.689 1.00 53.03 H new ATOM 0 HB2 SER A 640 5.474 9.024 -6.313 1.00 63.32 H new ATOM 0 HB3 SER A 640 6.367 8.908 -4.810 1.00 63.32 H new ATOM 0 HG SER A 640 8.291 9.324 -6.402 1.00 3.34 H new ATOM 875 N GLY A 641 5.909 5.692 -4.836 1.00 53.12 N ATOM 876 CA GLY A 641 4.916 4.692 -4.493 1.00 14.20 C ATOM 877 C GLY A 641 4.000 5.148 -3.375 1.00 43.24 C ATOM 878 O GLY A 641 3.010 4.496 -3.061 1.00 24.34 O ATOM 0 H GLY A 641 6.687 5.772 -4.181 1.00 53.12 H new ATOM 0 HA2 GLY A 641 4.320 4.458 -5.375 1.00 14.20 H new ATOM 0 HA3 GLY A 641 5.419 3.772 -4.195 1.00 14.20 H new ATOM 882 N ALA A 642 4.349 6.258 -2.766 1.00 51.51 N ATOM 883 CA ALA A 642 3.511 6.907 -1.780 1.00 1.41 C ATOM 884 C ALA A 642 3.700 8.418 -1.897 1.00 30.32 C ATOM 885 O ALA A 642 4.832 8.912 -1.832 1.00 35.23 O ATOM 886 CB ALA A 642 3.862 6.424 -0.380 1.00 63.51 C ATOM 0 H ALA A 642 5.230 6.741 -2.942 1.00 51.51 H new ATOM 0 HA ALA A 642 2.466 6.656 -1.962 1.00 1.41 H new ATOM 0 HB1 ALA A 642 3.222 6.923 0.348 1.00 63.51 H new ATOM 0 HB2 ALA A 642 3.711 5.346 -0.318 1.00 63.51 H new ATOM 0 HB3 ALA A 642 4.905 6.657 -0.166 1.00 63.51 H new ATOM 892 N CYS A 643 2.621 9.146 -2.089 1.00 15.44 N ATOM 893 CA CYS A 643 2.696 10.601 -2.253 1.00 23.30 C ATOM 894 C CYS A 643 1.485 11.274 -1.611 1.00 61.11 C ATOM 895 O CYS A 643 0.356 10.793 -1.752 1.00 54.51 O ATOM 896 CB CYS A 643 2.785 10.968 -3.733 1.00 52.43 C ATOM 897 SG CYS A 643 3.052 12.750 -4.058 1.00 32.34 S ATOM 0 H CYS A 643 1.676 8.764 -2.137 1.00 15.44 H new ATOM 0 HA CYS A 643 3.596 10.958 -1.753 1.00 23.30 H new ATOM 0 HB2 CYS A 643 3.599 10.403 -4.186 1.00 52.43 H new ATOM 0 HB3 CYS A 643 1.866 10.655 -4.228 1.00 52.43 H new ATOM 902 N GLN A 644 1.721 12.357 -0.890 1.00 30.23 N ATOM 903 CA GLN A 644 0.660 13.067 -0.203 1.00 62.23 C ATOM 904 C GLN A 644 0.521 14.468 -0.730 1.00 72.14 C ATOM 905 O GLN A 644 1.515 15.135 -1.035 1.00 61.41 O ATOM 906 CB GLN A 644 0.883 13.121 1.322 1.00 50.52 C ATOM 907 CG GLN A 644 2.160 13.824 1.762 1.00 20.40 C ATOM 908 CD GLN A 644 2.299 13.891 3.268 1.00 11.03 C ATOM 909 OE1 GLN A 644 1.324 13.936 3.988 1.00 25.03 O ATOM 910 NE2 GLN A 644 3.510 13.910 3.747 1.00 70.03 N ATOM 0 H GLN A 644 2.647 12.765 -0.766 1.00 30.23 H new ATOM 0 HA GLN A 644 -0.256 12.509 -0.395 1.00 62.23 H new ATOM 0 HB2 GLN A 644 0.032 13.625 1.781 1.00 50.52 H new ATOM 0 HB3 GLN A 644 0.896 12.102 1.708 1.00 50.52 H new ATOM 0 HG2 GLN A 644 3.020 13.301 1.344 1.00 20.40 H new ATOM 0 HG3 GLN A 644 2.173 14.835 1.354 1.00 20.40 H new ATOM 0 HE21 GLN A 644 4.309 13.871 3.115 1.00 70.03 H new ATOM 0 HE22 GLN A 644 3.659 13.964 4.755 1.00 70.03 H new ATOM 918 N VAL A 645 -0.693 14.901 -0.840 1.00 13.12 N ATOM 919 CA VAL A 645 -0.995 16.237 -1.243 1.00 3.23 C ATOM 920 C VAL A 645 -1.718 16.911 -0.090 1.00 53.35 C ATOM 921 O VAL A 645 -2.741 16.415 0.389 1.00 60.32 O ATOM 922 CB VAL A 645 -1.870 16.278 -2.533 1.00 33.50 C ATOM 923 CG1 VAL A 645 -2.172 17.714 -2.950 1.00 43.41 C ATOM 924 CG2 VAL A 645 -1.183 15.530 -3.673 1.00 20.40 C ATOM 0 H VAL A 645 -1.515 14.328 -0.650 1.00 13.12 H new ATOM 0 HA VAL A 645 -0.069 16.759 -1.483 1.00 3.23 H new ATOM 0 HB VAL A 645 -2.815 15.784 -2.309 1.00 33.50 H new ATOM 0 HG11 VAL A 645 -2.784 17.710 -3.852 1.00 43.41 H new ATOM 0 HG12 VAL A 645 -2.711 18.220 -2.149 1.00 43.41 H new ATOM 0 HG13 VAL A 645 -1.238 18.240 -3.147 1.00 43.41 H new ATOM 0 HG21 VAL A 645 -1.809 15.570 -4.564 1.00 20.40 H new ATOM 0 HG22 VAL A 645 -0.220 15.995 -3.885 1.00 20.40 H new ATOM 0 HG23 VAL A 645 -1.028 14.490 -3.385 1.00 20.40 H new ATOM 930 N SER A 646 -1.181 18.000 0.374 1.00 23.54 N ATOM 931 CA SER A 646 -1.751 18.706 1.487 1.00 21.24 C ATOM 932 C SER A 646 -3.016 19.398 1.065 1.00 24.34 C ATOM 933 O SER A 646 -3.100 19.946 -0.035 1.00 33.23 O ATOM 934 CB SER A 646 -0.759 19.728 2.050 1.00 42.21 C ATOM 935 OG SER A 646 -1.307 20.432 3.161 1.00 70.43 O ATOM 0 H SER A 646 -0.336 18.425 -0.007 1.00 23.54 H new ATOM 0 HA SER A 646 -1.981 17.983 2.269 1.00 21.24 H new ATOM 0 HB2 SER A 646 0.155 19.219 2.356 1.00 42.21 H new ATOM 0 HB3 SER A 646 -0.483 20.437 1.269 1.00 42.21 H new ATOM 0 HG SER A 646 -0.602 20.956 3.596 1.00 70.43 H new ATOM 941 N ARG A 647 -3.985 19.375 1.923 1.00 75.33 N ATOM 942 CA ARG A 647 -5.228 20.028 1.658 1.00 74.12 C ATOM 943 C ARG A 647 -5.161 21.423 2.249 1.00 5.21 C ATOM 944 O ARG A 647 -5.802 22.346 1.781 1.00 14.43 O ATOM 945 CB ARG A 647 -6.376 19.221 2.254 1.00 43.32 C ATOM 946 CG ARG A 647 -6.392 17.777 1.763 1.00 4.33 C ATOM 947 CD ARG A 647 -7.557 16.996 2.321 1.00 12.33 C ATOM 948 NE ARG A 647 -8.847 17.495 1.850 1.00 54.35 N ATOM 949 CZ ARG A 647 -10.033 17.036 2.252 1.00 4.14 C ATOM 950 NH1 ARG A 647 -10.111 16.130 3.220 1.00 55.43 N ATOM 951 NH2 ARG A 647 -11.137 17.499 1.701 1.00 53.31 N ATOM 0 H ARG A 647 -3.938 18.904 2.826 1.00 75.33 H new ATOM 0 HA ARG A 647 -5.407 20.102 0.585 1.00 74.12 H new ATOM 0 HB2 ARG A 647 -6.297 19.231 3.341 1.00 43.32 H new ATOM 0 HB3 ARG A 647 -7.322 19.698 1.999 1.00 43.32 H new ATOM 0 HG2 ARG A 647 -6.438 17.766 0.674 1.00 4.33 H new ATOM 0 HG3 ARG A 647 -5.460 17.288 2.047 1.00 4.33 H new ATOM 0 HD2 ARG A 647 -7.454 15.948 2.042 1.00 12.33 H new ATOM 0 HD3 ARG A 647 -7.531 17.040 3.410 1.00 12.33 H new ATOM 0 HE ARG A 647 -8.840 18.249 1.164 1.00 54.35 H new ATOM 0 HH11 ARG A 647 -9.260 15.781 3.661 1.00 55.43 H new ATOM 0 HH12 ARG A 647 -11.022 15.784 3.522 1.00 55.43 H new ATOM 0 HH21 ARG A 647 -11.083 18.207 0.969 1.00 53.31 H new ATOM 0 HH22 ARG A 647 -12.045 17.149 2.007 1.00 53.31 H new ATOM 963 N SER A 648 -4.352 21.558 3.282 1.00 72.34 N ATOM 964 CA SER A 648 -4.142 22.824 3.933 1.00 42.14 C ATOM 965 C SER A 648 -3.081 23.672 3.194 1.00 13.32 C ATOM 966 O SER A 648 -3.243 24.877 3.025 1.00 12.35 O ATOM 967 CB SER A 648 -3.707 22.567 5.368 1.00 43.13 C ATOM 968 OG SER A 648 -4.647 21.731 6.028 1.00 14.42 O ATOM 0 H SER A 648 -3.823 20.787 3.690 1.00 72.34 H new ATOM 0 HA SER A 648 -5.074 23.389 3.918 1.00 42.14 H new ATOM 0 HB2 SER A 648 -2.723 22.098 5.378 1.00 43.13 H new ATOM 0 HB3 SER A 648 -3.614 23.513 5.902 1.00 43.13 H new ATOM 0 HG SER A 648 -4.354 21.573 6.950 1.00 14.42 H new ATOM 974 N ASP A 649 -2.015 23.034 2.735 1.00 62.01 N ATOM 975 CA ASP A 649 -0.909 23.770 2.093 1.00 14.34 C ATOM 976 C ASP A 649 -0.984 23.673 0.588 1.00 22.21 C ATOM 977 O ASP A 649 -0.277 24.382 -0.111 1.00 34.04 O ATOM 978 CB ASP A 649 0.456 23.175 2.504 1.00 71.52 C ATOM 979 CG ASP A 649 0.712 23.139 3.983 1.00 75.44 C ATOM 980 OD1 ASP A 649 0.354 22.122 4.629 1.00 42.32 O ATOM 981 OD2 ASP A 649 1.306 24.096 4.518 1.00 74.32 O ATOM 0 H ASP A 649 -1.882 22.024 2.788 1.00 62.01 H new ATOM 0 HA ASP A 649 -1.001 24.807 2.416 1.00 14.34 H new ATOM 0 HB2 ASP A 649 0.525 22.160 2.113 1.00 71.52 H new ATOM 0 HB3 ASP A 649 1.247 23.755 2.027 1.00 71.52 H new ATOM 986 N ARG A 650 -1.852 22.788 0.089 1.00 21.51 N ATOM 987 CA ARG A 650 -1.978 22.504 -1.369 1.00 72.03 C ATOM 988 C ARG A 650 -0.627 22.068 -1.986 1.00 2.04 C ATOM 989 O ARG A 650 -0.416 22.161 -3.200 1.00 21.14 O ATOM 990 CB ARG A 650 -2.563 23.707 -2.159 1.00 50.55 C ATOM 991 CG ARG A 650 -4.038 24.027 -1.895 1.00 24.13 C ATOM 992 CD ARG A 650 -4.308 24.570 -0.495 1.00 42.20 C ATOM 993 NE ARG A 650 -5.731 24.897 -0.296 1.00 34.42 N ATOM 994 CZ ARG A 650 -6.245 25.502 0.795 1.00 64.33 C ATOM 995 NH1 ARG A 650 -5.459 25.867 1.798 1.00 61.02 N ATOM 996 NH2 ARG A 650 -7.545 25.738 0.876 1.00 62.11 N ATOM 0 H ARG A 650 -2.490 22.244 0.669 1.00 21.51 H new ATOM 0 HA ARG A 650 -2.682 21.676 -1.455 1.00 72.03 H new ATOM 0 HB2 ARG A 650 -1.972 24.592 -1.925 1.00 50.55 H new ATOM 0 HB3 ARG A 650 -2.438 23.512 -3.224 1.00 50.55 H new ATOM 0 HG2 ARG A 650 -4.379 24.756 -2.630 1.00 24.13 H new ATOM 0 HG3 ARG A 650 -4.629 23.123 -2.045 1.00 24.13 H new ATOM 0 HD2 ARG A 650 -3.998 23.833 0.246 1.00 42.20 H new ATOM 0 HD3 ARG A 650 -3.704 25.462 -0.329 1.00 42.20 H new ATOM 0 HE ARG A 650 -6.379 24.646 -1.043 1.00 34.42 H new ATOM 0 HH11 ARG A 650 -4.455 25.691 1.750 1.00 61.02 H new ATOM 0 HH12 ARG A 650 -5.858 26.324 2.618 1.00 61.02 H new ATOM 0 HH21 ARG A 650 -8.162 25.462 0.112 1.00 62.11 H new ATOM 0 HH22 ARG A 650 -7.930 26.196 1.702 1.00 62.11 H new ATOM 1008 N LYS A 651 0.240 21.540 -1.151 1.00 20.24 N ATOM 1009 CA LYS A 651 1.568 21.067 -1.572 1.00 41.43 C ATOM 1010 C LYS A 651 1.561 19.575 -1.741 1.00 24.21 C ATOM 1011 O LYS A 651 0.580 18.927 -1.423 1.00 34.21 O ATOM 1012 CB LYS A 651 2.642 21.419 -0.542 1.00 71.24 C ATOM 1013 CG LYS A 651 2.904 22.889 -0.359 1.00 13.42 C ATOM 1014 CD LYS A 651 3.956 23.104 0.714 1.00 73.51 C ATOM 1015 CE LYS A 651 4.261 24.571 0.921 1.00 41.33 C ATOM 1016 NZ LYS A 651 5.276 24.776 1.975 1.00 2.43 N ATOM 0 H LYS A 651 0.057 21.420 -0.155 1.00 20.24 H new ATOM 0 HA LYS A 651 1.797 21.560 -2.517 1.00 41.43 H new ATOM 0 HB2 LYS A 651 2.351 20.997 0.420 1.00 71.24 H new ATOM 0 HB3 LYS A 651 3.574 20.935 -0.834 1.00 71.24 H new ATOM 0 HG2 LYS A 651 3.239 23.326 -1.300 1.00 13.42 H new ATOM 0 HG3 LYS A 651 1.981 23.399 -0.081 1.00 13.42 H new ATOM 0 HD2 LYS A 651 3.611 22.669 1.652 1.00 73.51 H new ATOM 0 HD3 LYS A 651 4.870 22.579 0.436 1.00 73.51 H new ATOM 0 HE2 LYS A 651 4.615 25.004 -0.014 1.00 41.33 H new ATOM 0 HE3 LYS A 651 3.346 25.098 1.190 1.00 41.33 H new ATOM 0 HZ1 LYS A 651 5.459 25.794 2.088 1.00 2.43 H new ATOM 0 HZ2 LYS A 651 4.927 24.385 2.873 1.00 2.43 H new ATOM 0 HZ3 LYS A 651 6.158 24.294 1.707 1.00 2.43 H new ATOM 1030 N SER A 652 2.652 19.045 -2.199 1.00 13.23 N ATOM 1031 CA SER A 652 2.787 17.623 -2.391 1.00 71.23 C ATOM 1032 C SER A 652 4.165 17.147 -1.919 1.00 52.52 C ATOM 1033 O SER A 652 5.165 17.845 -2.107 1.00 54.32 O ATOM 1034 CB SER A 652 2.564 17.293 -3.872 1.00 60.14 C ATOM 1035 OG SER A 652 3.407 18.095 -4.701 1.00 21.11 O ATOM 0 H SER A 652 3.481 19.583 -2.453 1.00 13.23 H new ATOM 0 HA SER A 652 2.038 17.100 -1.796 1.00 71.23 H new ATOM 0 HB2 SER A 652 2.769 16.237 -4.049 1.00 60.14 H new ATOM 0 HB3 SER A 652 1.520 17.463 -4.134 1.00 60.14 H new ATOM 0 HG SER A 652 3.251 17.869 -5.642 1.00 21.11 H new ATOM 1041 N TRP A 653 4.214 15.983 -1.311 1.00 35.51 N ATOM 1042 CA TRP A 653 5.466 15.402 -0.828 1.00 60.54 C ATOM 1043 C TRP A 653 5.471 13.948 -1.080 1.00 11.45 C ATOM 1044 O TRP A 653 4.426 13.304 -1.163 1.00 1.40 O ATOM 1045 CB TRP A 653 5.677 15.602 0.668 1.00 33.25 C ATOM 1046 CG TRP A 653 5.764 16.999 1.153 1.00 75.32 C ATOM 1047 CD1 TRP A 653 6.862 17.800 1.174 1.00 63.12 C ATOM 1048 CD2 TRP A 653 4.712 17.742 1.730 1.00 11.31 C ATOM 1049 NE1 TRP A 653 6.545 19.007 1.732 1.00 13.24 N ATOM 1050 CE2 TRP A 653 5.219 18.999 2.078 1.00 70.35 C ATOM 1051 CE3 TRP A 653 3.385 17.459 1.973 1.00 34.02 C ATOM 1052 CZ2 TRP A 653 4.429 19.979 2.672 1.00 41.42 C ATOM 1053 CZ3 TRP A 653 2.603 18.402 2.552 1.00 41.54 C ATOM 1054 CH2 TRP A 653 3.115 19.661 2.901 1.00 24.23 C ATOM 0 H TRP A 653 3.392 15.405 -1.133 1.00 35.51 H new ATOM 0 HA TRP A 653 6.265 15.913 -1.365 1.00 60.54 H new ATOM 0 HB2 TRP A 653 4.859 15.111 1.194 1.00 33.25 H new ATOM 0 HB3 TRP A 653 6.594 15.087 0.953 1.00 33.25 H new ATOM 0 HD1 TRP A 653 7.839 17.524 0.805 1.00 63.12 H new ATOM 0 HE1 TRP A 653 7.190 19.786 1.868 1.00 13.24 H new ATOM 0 HE3 TRP A 653 2.973 16.497 1.705 1.00 34.02 H new ATOM 0 HZ2 TRP A 653 4.832 20.944 2.940 1.00 41.42 H new ATOM 0 HZ3 TRP A 653 1.565 18.180 2.749 1.00 41.54 H new ATOM 0 HH2 TRP A 653 2.463 20.391 3.357 1.00 24.23 H new ATOM 1065 N ASN A 654 6.639 13.432 -1.146 1.00 54.13 N ATOM 1066 CA ASN A 654 6.859 12.070 -1.426 1.00 15.12 C ATOM 1067 C ASN A 654 7.053 11.347 -0.102 1.00 34.13 C ATOM 1068 O ASN A 654 7.738 11.865 0.810 1.00 43.10 O ATOM 1069 CB ASN A 654 8.110 12.009 -2.272 1.00 33.51 C ATOM 1070 CG ASN A 654 8.363 10.709 -2.937 1.00 52.32 C ATOM 1071 OD1 ASN A 654 8.031 9.641 -2.442 1.00 45.30 O ATOM 1072 ND2 ASN A 654 8.923 10.811 -4.089 1.00 21.12 N ATOM 0 H ASN A 654 7.496 13.966 -1.001 1.00 54.13 H new ATOM 0 HA ASN A 654 6.029 11.601 -1.955 1.00 15.12 H new ATOM 0 HB2 ASN A 654 8.050 12.784 -3.036 1.00 33.51 H new ATOM 0 HB3 ASN A 654 8.967 12.249 -1.642 1.00 33.51 H new ATOM 0 HD21 ASN A 654 9.112 9.974 -4.640 1.00 21.12 H new ATOM 0 HD22 ASN A 654 9.179 11.729 -4.452 1.00 21.12 H new ATOM 1078 N LEU A 655 6.433 10.204 0.043 1.00 44.21 N ATOM 1079 CA LEU A 655 6.547 9.440 1.268 1.00 42.12 C ATOM 1080 C LEU A 655 7.379 8.217 1.055 1.00 73.55 C ATOM 1081 O LEU A 655 7.610 7.439 1.987 1.00 33.32 O ATOM 1082 CB LEU A 655 5.198 9.019 1.836 1.00 52.40 C ATOM 1083 CG LEU A 655 4.201 10.097 2.213 1.00 34.50 C ATOM 1084 CD1 LEU A 655 3.459 10.597 1.056 1.00 51.24 C ATOM 1085 CD2 LEU A 655 3.292 9.659 3.316 1.00 22.32 C ATOM 0 H LEU A 655 5.842 9.778 -0.671 1.00 44.21 H new ATOM 0 HA LEU A 655 7.024 10.104 1.989 1.00 42.12 H new ATOM 0 HB2 LEU A 655 4.720 8.367 1.105 1.00 52.40 H new ATOM 0 HB3 LEU A 655 5.386 8.417 2.725 1.00 52.40 H new ATOM 0 HG LEU A 655 4.781 10.937 2.596 1.00 34.50 H new ATOM 0 HD11 LEU A 655 2.758 11.367 1.378 1.00 51.24 H new ATOM 0 HD12 LEU A 655 4.156 11.020 0.332 1.00 51.24 H new ATOM 0 HD13 LEU A 655 2.910 9.777 0.594 1.00 51.24 H new ATOM 0 HD21 LEU A 655 2.595 10.462 3.553 1.00 22.32 H new ATOM 0 HD22 LEU A 655 2.735 8.777 3.000 1.00 22.32 H new ATOM 0 HD23 LEU A 655 3.882 9.418 4.200 1.00 22.32 H new ATOM 1093 N GLY A 656 7.818 8.035 -0.152 1.00 50.24 N ATOM 1094 CA GLY A 656 8.623 6.923 -0.445 1.00 53.35 C ATOM 1095 C GLY A 656 8.593 6.553 -1.891 1.00 12.02 C ATOM 1096 O GLY A 656 7.518 6.358 -2.496 1.00 1.22 O ATOM 0 H GLY A 656 7.624 8.651 -0.941 1.00 50.24 H new ATOM 0 HA2 GLY A 656 9.651 7.136 -0.150 1.00 53.35 H new ATOM 0 HA3 GLY A 656 8.291 6.072 0.150 1.00 53.35 H new ATOM 1100 N ARG A 657 9.756 6.481 -2.454 1.00 44.43 N ATOM 1101 CA ARG A 657 9.945 6.054 -3.799 1.00 61.03 C ATOM 1102 C ARG A 657 9.646 4.564 -3.890 1.00 23.42 C ATOM 1103 O ARG A 657 10.020 3.801 -2.986 1.00 1.24 O ATOM 1104 CB ARG A 657 11.358 6.440 -4.242 1.00 53.03 C ATOM 1105 CG ARG A 657 11.881 5.791 -5.493 1.00 53.30 C ATOM 1106 CD ARG A 657 13.167 6.464 -5.945 1.00 71.24 C ATOM 1107 NE ARG A 657 12.920 7.771 -6.589 1.00 2.11 N ATOM 1108 CZ ARG A 657 13.516 8.943 -6.278 1.00 53.21 C ATOM 1109 NH1 ARG A 657 14.238 9.069 -5.181 1.00 61.32 N ATOM 1110 NH2 ARG A 657 13.336 10.000 -7.054 1.00 1.13 N ATOM 0 H ARG A 657 10.623 6.725 -1.976 1.00 44.43 H new ATOM 0 HA ARG A 657 9.258 6.547 -4.487 1.00 61.03 H new ATOM 0 HB2 ARG A 657 11.386 7.520 -4.384 1.00 53.03 H new ATOM 0 HB3 ARG A 657 12.044 6.208 -3.427 1.00 53.03 H new ATOM 0 HG2 ARG A 657 12.063 4.732 -5.311 1.00 53.30 H new ATOM 0 HG3 ARG A 657 11.133 5.855 -6.283 1.00 53.30 H new ATOM 0 HD2 ARG A 657 13.823 6.603 -5.086 1.00 71.24 H new ATOM 0 HD3 ARG A 657 13.690 5.811 -6.643 1.00 71.24 H new ATOM 0 HE ARG A 657 12.232 7.790 -7.342 1.00 2.11 H new ATOM 0 HH11 ARG A 657 14.353 8.274 -4.552 1.00 61.32 H new ATOM 0 HH12 ARG A 657 14.681 9.961 -4.962 1.00 61.32 H new ATOM 0 HH21 ARG A 657 12.748 9.929 -7.885 1.00 1.13 H new ATOM 0 HH22 ARG A 657 13.785 10.886 -6.821 1.00 1.13 H new ATOM 1122 N SER A 658 8.953 4.177 -4.961 1.00 43.12 N ATOM 1123 CA SER A 658 8.430 2.832 -5.154 1.00 3.33 C ATOM 1124 C SER A 658 9.395 1.717 -4.775 1.00 14.51 C ATOM 1125 O SER A 658 10.533 1.640 -5.249 1.00 14.14 O ATOM 1126 CB SER A 658 7.946 2.672 -6.568 1.00 4.13 C ATOM 1127 OG SER A 658 6.945 3.617 -6.846 1.00 5.21 O ATOM 0 H SER A 658 8.737 4.807 -5.734 1.00 43.12 H new ATOM 0 HA SER A 658 7.597 2.726 -4.459 1.00 3.33 H new ATOM 0 HB2 SER A 658 8.778 2.797 -7.261 1.00 4.13 H new ATOM 0 HB3 SER A 658 7.557 1.665 -6.715 1.00 4.13 H new ATOM 0 HG SER A 658 7.360 4.470 -7.093 1.00 5.21 H new ATOM 1133 N ASN A 659 8.909 0.886 -3.912 1.00 3.23 N ATOM 1134 CA ASN A 659 9.584 -0.221 -3.378 1.00 4.12 C ATOM 1135 C ASN A 659 8.566 -1.335 -3.320 1.00 23.43 C ATOM 1136 O ASN A 659 7.371 -1.069 -3.258 1.00 41.01 O ATOM 1137 CB ASN A 659 10.003 0.157 -1.979 1.00 73.13 C ATOM 1138 CG ASN A 659 10.703 -0.912 -1.235 1.00 53.44 C ATOM 1139 OD1 ASN A 659 11.420 -1.731 -1.800 1.00 72.41 O ATOM 1140 ND2 ASN A 659 10.472 -0.944 0.030 1.00 71.02 N ATOM 0 H ASN A 659 7.962 0.982 -3.545 1.00 3.23 H new ATOM 0 HA ASN A 659 10.456 -0.521 -3.959 1.00 4.12 H new ATOM 0 HB2 ASN A 659 10.653 1.030 -2.032 1.00 73.13 H new ATOM 0 HB3 ASN A 659 9.118 0.453 -1.416 1.00 73.13 H new ATOM 0 HD21 ASN A 659 10.893 -1.672 0.607 1.00 71.02 H new ATOM 0 HD22 ASN A 659 9.868 -0.241 0.456 1.00 71.02 H new ATOM 1146 N ALA A 660 8.994 -2.542 -3.370 1.00 51.10 N ATOM 1147 CA ALA A 660 8.064 -3.637 -3.332 1.00 54.22 C ATOM 1148 C ALA A 660 8.469 -4.676 -2.287 1.00 43.21 C ATOM 1149 O ALA A 660 8.083 -5.849 -2.371 1.00 30.11 O ATOM 1150 CB ALA A 660 7.899 -4.232 -4.720 1.00 42.13 C ATOM 0 H ALA A 660 9.976 -2.809 -3.437 1.00 51.10 H new ATOM 0 HA ALA A 660 7.089 -3.261 -3.021 1.00 54.22 H new ATOM 0 HB1 ALA A 660 7.192 -5.061 -4.679 1.00 42.13 H new ATOM 0 HB2 ALA A 660 7.524 -3.468 -5.401 1.00 42.13 H new ATOM 0 HB3 ALA A 660 8.863 -4.595 -5.077 1.00 42.13 H new ATOM 1156 N LYS A 661 9.230 -4.229 -1.293 1.00 12.10 N ATOM 1157 CA LYS A 661 9.634 -5.073 -0.168 1.00 14.43 C ATOM 1158 C LYS A 661 8.457 -5.254 0.797 1.00 64.34 C ATOM 1159 O LYS A 661 8.092 -4.318 1.524 1.00 43.23 O ATOM 1160 CB LYS A 661 10.792 -4.428 0.620 1.00 15.04 C ATOM 1161 CG LYS A 661 12.124 -4.256 -0.104 1.00 1.44 C ATOM 1162 CD LYS A 661 12.783 -5.579 -0.412 1.00 60.45 C ATOM 1163 CE LYS A 661 14.181 -5.380 -0.989 1.00 2.31 C ATOM 1164 NZ LYS A 661 14.168 -4.635 -2.266 1.00 42.14 N ATOM 0 H LYS A 661 9.585 -3.274 -1.242 1.00 12.10 H new ATOM 0 HA LYS A 661 9.955 -6.032 -0.575 1.00 14.43 H new ATOM 0 HB2 LYS A 661 10.463 -3.445 0.958 1.00 15.04 H new ATOM 0 HB3 LYS A 661 10.969 -5.029 1.512 1.00 15.04 H new ATOM 0 HG2 LYS A 661 11.962 -3.708 -1.032 1.00 1.44 H new ATOM 0 HG3 LYS A 661 12.793 -3.653 0.510 1.00 1.44 H new ATOM 0 HD2 LYS A 661 12.844 -6.178 0.497 1.00 60.45 H new ATOM 0 HD3 LYS A 661 12.171 -6.137 -1.121 1.00 60.45 H new ATOM 0 HE2 LYS A 661 14.796 -4.844 -0.266 1.00 2.31 H new ATOM 0 HE3 LYS A 661 14.648 -6.353 -1.145 1.00 2.31 H new ATOM 0 HZ1 LYS A 661 15.103 -4.701 -2.716 1.00 42.14 H new ATOM 0 HZ2 LYS A 661 13.450 -5.042 -2.898 1.00 42.14 H new ATOM 0 HZ3 LYS A 661 13.942 -3.636 -2.083 1.00 42.14 H new ATOM 1178 N LEU A 662 7.854 -6.417 0.789 1.00 4.04 N ATOM 1179 CA LEU A 662 6.780 -6.709 1.721 1.00 62.03 C ATOM 1180 C LEU A 662 7.355 -7.354 2.966 1.00 11.11 C ATOM 1181 O LEU A 662 8.166 -8.271 2.872 1.00 42.34 O ATOM 1182 CB LEU A 662 5.721 -7.645 1.108 1.00 72.14 C ATOM 1183 CG LEU A 662 4.907 -7.125 -0.071 1.00 64.12 C ATOM 1184 CD1 LEU A 662 3.873 -8.158 -0.478 1.00 23.53 C ATOM 1185 CD2 LEU A 662 4.236 -5.808 0.265 1.00 52.51 C ATOM 0 H LEU A 662 8.084 -7.179 0.151 1.00 4.04 H new ATOM 0 HA LEU A 662 6.291 -5.767 1.968 1.00 62.03 H new ATOM 0 HB2 LEU A 662 6.225 -8.558 0.790 1.00 72.14 H new ATOM 0 HB3 LEU A 662 5.024 -7.925 1.898 1.00 72.14 H new ATOM 0 HG LEU A 662 5.585 -6.949 -0.906 1.00 64.12 H new ATOM 0 HD11 LEU A 662 3.294 -7.781 -1.321 1.00 23.53 H new ATOM 0 HD12 LEU A 662 4.375 -9.081 -0.767 1.00 23.53 H new ATOM 0 HD13 LEU A 662 3.206 -8.355 0.361 1.00 23.53 H new ATOM 0 HD21 LEU A 662 3.663 -5.462 -0.595 1.00 52.51 H new ATOM 0 HD22 LEU A 662 3.568 -5.947 1.115 1.00 52.51 H new ATOM 0 HD23 LEU A 662 4.995 -5.067 0.517 1.00 52.51 H new ATOM 1193 N SER A 663 6.943 -6.892 4.102 1.00 2.54 N ATOM 1194 CA SER A 663 7.415 -7.407 5.357 1.00 5.43 C ATOM 1195 C SER A 663 6.295 -8.198 6.002 1.00 14.43 C ATOM 1196 O SER A 663 5.137 -7.865 5.834 1.00 1.12 O ATOM 1197 CB SER A 663 7.774 -6.232 6.260 1.00 32.34 C ATOM 1198 OG SER A 663 8.583 -5.288 5.565 1.00 21.10 O ATOM 0 H SER A 663 6.262 -6.138 4.191 1.00 2.54 H new ATOM 0 HA SER A 663 8.287 -8.043 5.206 1.00 5.43 H new ATOM 0 HB2 SER A 663 6.864 -5.747 6.613 1.00 32.34 H new ATOM 0 HB3 SER A 663 8.305 -6.593 7.141 1.00 32.34 H new ATOM 0 HG SER A 663 9.516 -5.386 5.848 1.00 21.10 H new ATOM 1204 N TYR A 664 6.615 -9.238 6.693 1.00 53.35 N ATOM 1205 CA TYR A 664 5.603 -9.997 7.373 1.00 74.21 C ATOM 1206 C TYR A 664 6.036 -10.266 8.779 1.00 55.35 C ATOM 1207 O TYR A 664 7.176 -10.651 9.009 1.00 20.20 O ATOM 1208 CB TYR A 664 5.342 -11.285 6.612 1.00 12.12 C ATOM 1209 CG TYR A 664 4.251 -12.185 7.148 1.00 13.13 C ATOM 1210 CD1 TYR A 664 2.919 -11.766 7.191 1.00 65.21 C ATOM 1211 CD2 TYR A 664 4.543 -13.469 7.569 1.00 40.24 C ATOM 1212 CE1 TYR A 664 1.941 -12.574 7.624 1.00 22.24 C ATOM 1213 CE2 TYR A 664 3.551 -14.315 8.010 1.00 32.24 C ATOM 1214 CZ TYR A 664 2.248 -13.872 8.035 1.00 2.53 C ATOM 1215 OH TYR A 664 1.247 -14.713 8.489 1.00 4.25 O ATOM 0 H TYR A 664 7.566 -9.588 6.807 1.00 53.35 H new ATOM 0 HA TYR A 664 4.672 -9.431 7.412 1.00 74.21 H new ATOM 0 HB2 TYR A 664 5.094 -11.027 5.582 1.00 12.12 H new ATOM 0 HB3 TYR A 664 6.270 -11.856 6.583 1.00 12.12 H new ATOM 0 HD1 TYR A 664 2.671 -10.766 6.867 1.00 65.21 H new ATOM 0 HD2 TYR A 664 5.566 -13.814 7.552 1.00 40.24 H new ATOM 0 HE1 TYR A 664 0.920 -12.222 7.655 1.00 22.24 H new ATOM 0 HE2 TYR A 664 3.793 -15.317 8.333 1.00 32.24 H new ATOM 0 HH TYR A 664 1.634 -15.580 8.734 1.00 4.25 H new ATOM 1225 N TYR A 665 5.159 -10.021 9.716 1.00 34.13 N ATOM 1226 CA TYR A 665 5.451 -10.290 11.096 1.00 53.11 C ATOM 1227 C TYR A 665 4.785 -11.595 11.460 1.00 63.11 C ATOM 1228 O TYR A 665 5.424 -12.624 11.615 1.00 61.11 O ATOM 1229 CB TYR A 665 4.937 -9.121 11.957 1.00 13.33 C ATOM 1230 CG TYR A 665 5.139 -9.271 13.444 1.00 73.23 C ATOM 1231 CD1 TYR A 665 6.392 -9.120 14.010 1.00 55.23 C ATOM 1232 CD2 TYR A 665 4.069 -9.556 14.283 1.00 44.13 C ATOM 1233 CE1 TYR A 665 6.574 -9.250 15.366 1.00 63.13 C ATOM 1234 CE2 TYR A 665 4.242 -9.683 15.640 1.00 71.40 C ATOM 1235 CZ TYR A 665 5.494 -9.528 16.179 1.00 64.31 C ATOM 1236 OH TYR A 665 5.673 -9.649 17.540 1.00 33.34 O ATOM 0 H TYR A 665 4.231 -9.633 9.545 1.00 34.13 H new ATOM 0 HA TYR A 665 6.523 -10.380 11.272 1.00 53.11 H new ATOM 0 HB2 TYR A 665 5.434 -8.207 11.631 1.00 13.33 H new ATOM 0 HB3 TYR A 665 3.872 -8.991 11.764 1.00 13.33 H new ATOM 0 HD1 TYR A 665 7.239 -8.897 13.378 1.00 55.23 H new ATOM 0 HD2 TYR A 665 3.083 -9.680 13.861 1.00 44.13 H new ATOM 0 HE1 TYR A 665 7.559 -9.135 15.794 1.00 63.13 H new ATOM 0 HE2 TYR A 665 3.399 -9.903 16.278 1.00 71.40 H new ATOM 0 HH TYR A 665 4.984 -10.240 17.909 1.00 33.34 H new ATOM 1246 N ASP A 666 3.502 -11.527 11.530 1.00 31.34 N ATOM 1247 CA ASP A 666 2.630 -12.654 11.749 1.00 43.51 C ATOM 1248 C ASP A 666 1.271 -12.153 11.474 1.00 31.34 C ATOM 1249 O ASP A 666 0.770 -11.328 12.216 1.00 12.12 O ATOM 1250 CB ASP A 666 2.684 -13.187 13.183 1.00 60.51 C ATOM 1251 CG ASP A 666 1.763 -14.381 13.354 1.00 0.05 C ATOM 1252 OD1 ASP A 666 0.554 -14.189 13.646 1.00 42.32 O ATOM 1253 OD2 ASP A 666 2.216 -15.515 13.163 1.00 22.31 O ATOM 0 H ASP A 666 2.996 -10.647 11.433 1.00 31.34 H new ATOM 0 HA ASP A 666 2.932 -13.482 11.108 1.00 43.51 H new ATOM 0 HB2 ASP A 666 3.706 -13.473 13.430 1.00 60.51 H new ATOM 0 HB3 ASP A 666 2.397 -12.399 13.879 1.00 60.51 H new ATOM 1258 N GLY A 667 0.699 -12.574 10.385 1.00 11.35 N ATOM 1259 CA GLY A 667 -0.587 -12.079 9.971 1.00 1.43 C ATOM 1260 C GLY A 667 -0.507 -10.690 9.383 1.00 51.41 C ATOM 1261 O GLY A 667 -0.977 -10.445 8.272 1.00 51.31 O ATOM 0 H GLY A 667 1.106 -13.268 9.758 1.00 11.35 H new ATOM 0 HA2 GLY A 667 -1.015 -12.759 9.234 1.00 1.43 H new ATOM 0 HA3 GLY A 667 -1.263 -12.070 10.826 1.00 1.43 H new ATOM 1265 N MET A 668 0.097 -9.785 10.125 1.00 74.42 N ATOM 1266 CA MET A 668 0.238 -8.447 9.701 1.00 11.31 C ATOM 1267 C MET A 668 1.361 -8.334 8.738 1.00 70.20 C ATOM 1268 O MET A 668 2.548 -8.445 9.104 1.00 73.12 O ATOM 1269 CB MET A 668 0.418 -7.438 10.860 1.00 24.15 C ATOM 1270 CG MET A 668 -0.794 -7.267 11.789 1.00 23.52 C ATOM 1271 SD MET A 668 -1.133 -8.692 12.852 1.00 41.25 S ATOM 1272 CE MET A 668 0.334 -8.705 13.891 1.00 34.53 C ATOM 0 H MET A 668 0.499 -9.979 11.042 1.00 74.42 H new ATOM 0 HA MET A 668 -0.700 -8.180 9.215 1.00 11.31 H new ATOM 0 HB2 MET A 668 1.272 -7.751 11.461 1.00 24.15 H new ATOM 0 HB3 MET A 668 0.667 -6.466 10.435 1.00 24.15 H new ATOM 0 HG2 MET A 668 -0.633 -6.391 12.418 1.00 23.52 H new ATOM 0 HG3 MET A 668 -1.676 -7.065 11.181 1.00 23.52 H new ATOM 0 HE1 MET A 668 0.174 -9.371 14.739 1.00 34.53 H new ATOM 0 HE2 MET A 668 1.188 -9.055 13.311 1.00 34.53 H new ATOM 0 HE3 MET A 668 0.531 -7.696 14.254 1.00 34.53 H new ATOM 1282 N ILE A 669 0.991 -8.211 7.518 1.00 2.21 N ATOM 1283 CA ILE A 669 1.891 -7.926 6.471 1.00 32.31 C ATOM 1284 C ILE A 669 2.118 -6.442 6.515 1.00 53.21 C ATOM 1285 O ILE A 669 1.198 -5.686 6.791 1.00 72.03 O ATOM 1286 CB ILE A 669 1.292 -8.333 5.118 1.00 15.30 C ATOM 1287 CG1 ILE A 669 1.162 -9.817 5.048 1.00 64.21 C ATOM 1288 CG2 ILE A 669 2.138 -7.834 3.949 1.00 71.43 C ATOM 1289 CD1 ILE A 669 0.402 -10.314 3.836 1.00 45.44 C ATOM 0 H ILE A 669 0.022 -8.309 7.214 1.00 2.21 H new ATOM 0 HA ILE A 669 2.823 -8.479 6.587 1.00 32.31 H new ATOM 0 HB ILE A 669 0.308 -7.870 5.039 1.00 15.30 H new ATOM 0 HG12 ILE A 669 2.159 -10.259 5.045 1.00 64.21 H new ATOM 0 HG13 ILE A 669 0.660 -10.170 5.949 1.00 64.21 H new ATOM 0 HG21 ILE A 669 1.679 -8.143 3.010 1.00 71.43 H new ATOM 0 HG22 ILE A 669 2.199 -6.746 3.982 1.00 71.43 H new ATOM 0 HG23 ILE A 669 3.141 -8.256 4.019 1.00 71.43 H new ATOM 0 HD11 ILE A 669 0.352 -11.403 3.859 1.00 45.44 H new ATOM 0 HD12 ILE A 669 -0.608 -9.904 3.846 1.00 45.44 H new ATOM 0 HD13 ILE A 669 0.914 -9.994 2.929 1.00 45.44 H new ATOM 1296 N GLN A 670 3.300 -6.029 6.316 1.00 52.10 N ATOM 1297 CA GLN A 670 3.603 -4.648 6.382 1.00 2.12 C ATOM 1298 C GLN A 670 4.301 -4.204 5.108 1.00 45.50 C ATOM 1299 O GLN A 670 5.032 -4.971 4.490 1.00 52.11 O ATOM 1300 CB GLN A 670 4.410 -4.327 7.652 1.00 43.14 C ATOM 1301 CG GLN A 670 3.698 -4.793 8.937 1.00 14.42 C ATOM 1302 CD GLN A 670 4.405 -4.411 10.216 1.00 13.32 C ATOM 1303 OE1 GLN A 670 4.333 -5.121 11.218 1.00 22.53 O ATOM 1304 NE2 GLN A 670 5.042 -3.284 10.213 1.00 23.14 N ATOM 0 H GLN A 670 4.094 -6.633 6.102 1.00 52.10 H new ATOM 0 HA GLN A 670 2.677 -4.077 6.454 1.00 2.12 H new ATOM 0 HB2 GLN A 670 5.387 -4.805 7.588 1.00 43.14 H new ATOM 0 HB3 GLN A 670 4.584 -3.252 7.706 1.00 43.14 H new ATOM 0 HG2 GLN A 670 2.692 -4.373 8.953 1.00 14.42 H new ATOM 0 HG3 GLN A 670 3.591 -5.877 8.905 1.00 14.42 H new ATOM 0 HE21 GLN A 670 5.080 -2.722 9.363 1.00 23.14 H new ATOM 0 HE22 GLN A 670 5.506 -2.958 11.061 1.00 23.14 H new ATOM 1312 N LEU A 671 4.062 -2.989 4.724 1.00 21.55 N ATOM 1313 CA LEU A 671 4.597 -2.437 3.483 1.00 41.55 C ATOM 1314 C LEU A 671 5.403 -1.249 3.837 1.00 70.30 C ATOM 1315 O LEU A 671 4.884 -0.309 4.447 1.00 72.30 O ATOM 1316 CB LEU A 671 3.464 -2.032 2.539 1.00 75.21 C ATOM 1317 CG LEU A 671 3.842 -1.353 1.206 1.00 41.33 C ATOM 1318 CD1 LEU A 671 4.635 -2.270 0.295 1.00 65.12 C ATOM 1319 CD2 LEU A 671 2.602 -0.874 0.504 1.00 41.33 C ATOM 0 H LEU A 671 3.488 -2.334 5.255 1.00 21.55 H new ATOM 0 HA LEU A 671 5.205 -3.184 2.972 1.00 41.55 H new ATOM 0 HB2 LEU A 671 2.887 -2.927 2.306 1.00 75.21 H new ATOM 0 HB3 LEU A 671 2.802 -1.358 3.082 1.00 75.21 H new ATOM 0 HG LEU A 671 4.482 -0.503 1.444 1.00 41.33 H new ATOM 0 HD11 LEU A 671 4.876 -1.745 -0.629 1.00 65.12 H new ATOM 0 HD12 LEU A 671 5.557 -2.569 0.793 1.00 65.12 H new ATOM 0 HD13 LEU A 671 4.043 -3.156 0.065 1.00 65.12 H new ATOM 0 HD21 LEU A 671 2.878 -0.396 -0.436 1.00 41.33 H new ATOM 0 HD22 LEU A 671 1.948 -1.722 0.302 1.00 41.33 H new ATOM 0 HD23 LEU A 671 2.080 -0.156 1.137 1.00 41.33 H new ATOM 1327 N THR A 672 6.631 -1.268 3.477 1.00 43.45 N ATOM 1328 CA THR A 672 7.515 -0.223 3.890 1.00 42.21 C ATOM 1329 C THR A 672 7.982 0.619 2.709 1.00 72.55 C ATOM 1330 O THR A 672 8.623 0.125 1.783 1.00 64.13 O ATOM 1331 CB THR A 672 8.741 -0.800 4.633 1.00 14.32 C ATOM 1332 OG1 THR A 672 8.304 -1.748 5.634 1.00 63.25 O ATOM 1333 CG2 THR A 672 9.506 0.312 5.327 1.00 50.51 C ATOM 0 H THR A 672 7.056 -1.992 2.897 1.00 43.45 H new ATOM 0 HA THR A 672 6.954 0.419 4.569 1.00 42.21 H new ATOM 0 HB THR A 672 9.386 -1.291 3.904 1.00 14.32 H new ATOM 0 HG1 THR A 672 8.598 -1.448 6.519 1.00 63.25 H new ATOM 0 HG21 THR A 672 10.367 -0.108 5.847 1.00 50.51 H new ATOM 0 HG22 THR A 672 9.847 1.036 4.587 1.00 50.51 H new ATOM 0 HG23 THR A 672 8.854 0.808 6.047 1.00 50.51 H new ATOM 1339 N TYR A 673 7.636 1.872 2.734 1.00 11.33 N ATOM 1340 CA TYR A 673 8.131 2.805 1.767 1.00 25.11 C ATOM 1341 C TYR A 673 9.101 3.753 2.401 1.00 11.21 C ATOM 1342 O TYR A 673 8.810 4.365 3.423 1.00 20.01 O ATOM 1343 CB TYR A 673 7.037 3.570 1.028 1.00 11.44 C ATOM 1344 CG TYR A 673 6.270 2.761 0.028 1.00 62.44 C ATOM 1345 CD1 TYR A 673 6.935 1.944 -0.851 1.00 71.24 C ATOM 1346 CD2 TYR A 673 4.899 2.859 -0.081 1.00 51.34 C ATOM 1347 CE1 TYR A 673 6.269 1.238 -1.810 1.00 33.33 C ATOM 1348 CE2 TYR A 673 4.216 2.141 -1.044 1.00 65.40 C ATOM 1349 CZ TYR A 673 4.922 1.327 -1.911 1.00 31.13 C ATOM 1350 OH TYR A 673 4.272 0.620 -2.898 1.00 42.52 O ATOM 0 H TYR A 673 7.003 2.275 3.425 1.00 11.33 H new ATOM 0 HA TYR A 673 8.642 2.210 1.010 1.00 25.11 H new ATOM 0 HB2 TYR A 673 6.338 3.974 1.760 1.00 11.44 H new ATOM 0 HB3 TYR A 673 7.489 4.420 0.517 1.00 11.44 H new ATOM 0 HD1 TYR A 673 8.009 1.858 -0.782 1.00 71.24 H new ATOM 0 HD2 TYR A 673 4.354 3.503 0.593 1.00 51.34 H new ATOM 0 HE1 TYR A 673 6.819 0.606 -2.491 1.00 33.33 H new ATOM 0 HE2 TYR A 673 3.141 2.215 -1.119 1.00 65.40 H new ATOM 0 HH TYR A 673 3.313 0.590 -2.701 1.00 42.52 H new ATOM 1360 N ARG A 674 10.245 3.853 1.796 1.00 24.31 N ATOM 1361 CA ARG A 674 11.319 4.686 2.259 1.00 72.52 C ATOM 1362 C ARG A 674 11.833 5.506 1.102 1.00 63.22 C ATOM 1363 O ARG A 674 11.302 5.387 -0.010 1.00 32.20 O ATOM 1364 CB ARG A 674 12.435 3.825 2.872 1.00 72.44 C ATOM 1365 CG ARG A 674 12.012 3.109 4.145 1.00 4.24 C ATOM 1366 CD ARG A 674 13.071 2.151 4.647 1.00 63.40 C ATOM 1367 NE ARG A 674 12.682 1.544 5.929 1.00 22.34 N ATOM 1368 CZ ARG A 674 12.968 0.294 6.329 1.00 60.50 C ATOM 1369 NH1 ARG A 674 13.581 -0.547 5.512 1.00 72.32 N ATOM 1370 NH2 ARG A 674 12.616 -0.111 7.548 1.00 24.23 N ATOM 0 H ARG A 674 10.466 3.343 0.941 1.00 24.31 H new ATOM 0 HA ARG A 674 10.960 5.359 3.038 1.00 72.52 H new ATOM 0 HB2 ARG A 674 12.759 3.087 2.139 1.00 72.44 H new ATOM 0 HB3 ARG A 674 13.295 4.458 3.088 1.00 72.44 H new ATOM 0 HG2 ARG A 674 11.796 3.846 4.919 1.00 4.24 H new ATOM 0 HG3 ARG A 674 11.088 2.561 3.961 1.00 4.24 H new ATOM 0 HD2 ARG A 674 13.235 1.368 3.907 1.00 63.40 H new ATOM 0 HD3 ARG A 674 14.016 2.681 4.766 1.00 63.40 H new ATOM 0 HE ARG A 674 12.146 2.125 6.573 1.00 22.34 H new ATOM 0 HH11 ARG A 674 13.839 -0.248 4.572 1.00 72.32 H new ATOM 0 HH12 ARG A 674 13.795 -1.495 5.822 1.00 72.32 H new ATOM 0 HH21 ARG A 674 12.130 0.528 8.177 1.00 24.23 H new ATOM 0 HH22 ARG A 674 12.833 -1.060 7.853 1.00 24.23 H new ATOM 1382 N ASP A 675 12.842 6.347 1.370 1.00 40.51 N ATOM 1383 CA ASP A 675 13.474 7.246 0.365 1.00 60.53 C ATOM 1384 C ASP A 675 12.598 8.496 0.151 1.00 33.51 C ATOM 1385 O ASP A 675 12.816 9.297 -0.753 1.00 4.35 O ATOM 1386 CB ASP A 675 13.778 6.488 -0.978 1.00 31.54 C ATOM 1387 CG ASP A 675 14.538 7.303 -2.000 1.00 32.44 C ATOM 1388 OD1 ASP A 675 15.750 7.532 -1.805 1.00 61.32 O ATOM 1389 OD2 ASP A 675 13.959 7.686 -3.013 1.00 63.31 O ATOM 0 H ASP A 675 13.255 6.431 2.299 1.00 40.51 H new ATOM 0 HA ASP A 675 14.439 7.578 0.749 1.00 60.53 H new ATOM 0 HB2 ASP A 675 14.350 5.588 -0.751 1.00 31.54 H new ATOM 0 HB3 ASP A 675 12.835 6.164 -1.419 1.00 31.54 H new ATOM 1394 N GLY A 676 11.633 8.676 1.051 1.00 3.02 N ATOM 1395 CA GLY A 676 10.706 9.795 0.979 1.00 13.11 C ATOM 1396 C GLY A 676 11.361 11.150 1.232 1.00 52.40 C ATOM 1397 O GLY A 676 12.551 11.233 1.542 1.00 71.03 O ATOM 0 H GLY A 676 11.475 8.053 1.843 1.00 3.02 H new ATOM 0 HA2 GLY A 676 10.238 9.805 -0.005 1.00 13.11 H new ATOM 0 HA3 GLY A 676 9.910 9.644 1.708 1.00 13.11 H new ATOM 1401 N THR A 677 10.574 12.197 1.128 1.00 23.13 N ATOM 1402 CA THR A 677 11.060 13.560 1.285 1.00 13.40 C ATOM 1403 C THR A 677 11.373 13.841 2.772 1.00 61.04 C ATOM 1404 O THR A 677 10.572 13.518 3.648 1.00 22.30 O ATOM 1405 CB THR A 677 9.984 14.559 0.781 1.00 43.44 C ATOM 1406 OG1 THR A 677 9.535 14.174 -0.524 1.00 15.42 O ATOM 1407 CG2 THR A 677 10.514 15.980 0.715 1.00 10.23 C ATOM 0 H THR A 677 9.575 12.133 0.932 1.00 23.13 H new ATOM 0 HA THR A 677 11.971 13.683 0.700 1.00 13.40 H new ATOM 0 HB THR A 677 9.159 14.532 1.493 1.00 43.44 H new ATOM 0 HG1 THR A 677 9.263 14.971 -1.025 1.00 15.42 H new ATOM 0 HG21 THR A 677 9.728 16.645 0.357 1.00 10.23 H new ATOM 0 HG22 THR A 677 10.833 16.296 1.708 1.00 10.23 H new ATOM 0 HG23 THR A 677 11.362 16.021 0.032 1.00 10.23 H new ATOM 1413 N PRO A 678 12.548 14.413 3.063 1.00 1.35 N ATOM 1414 CA PRO A 678 12.964 14.706 4.426 1.00 3.44 C ATOM 1415 C PRO A 678 12.272 15.918 5.047 1.00 12.14 C ATOM 1416 O PRO A 678 11.840 16.856 4.342 1.00 74.25 O ATOM 1417 CB PRO A 678 14.466 14.956 4.294 1.00 2.25 C ATOM 1418 CG PRO A 678 14.636 15.481 2.916 1.00 2.43 C ATOM 1419 CD PRO A 678 13.585 14.804 2.077 1.00 61.25 C ATOM 0 HA PRO A 678 12.700 13.887 5.095 1.00 3.44 H new ATOM 0 HB2 PRO A 678 14.816 15.672 5.037 1.00 2.25 H new ATOM 0 HB3 PRO A 678 15.036 14.039 4.442 1.00 2.25 H new ATOM 0 HG2 PRO A 678 14.514 16.564 2.894 1.00 2.43 H new ATOM 0 HG3 PRO A 678 15.635 15.265 2.537 1.00 2.43 H new ATOM 0 HD2 PRO A 678 13.184 15.476 1.319 1.00 61.25 H new ATOM 0 HD3 PRO A 678 13.987 13.937 1.554 1.00 61.25 H new ATOM 1427 N TYR A 679 12.143 15.870 6.357 1.00 13.31 N ATOM 1428 CA TYR A 679 11.593 16.951 7.143 1.00 62.01 C ATOM 1429 C TYR A 679 12.200 16.986 8.545 1.00 42.15 C ATOM 1430 O TYR A 679 13.261 16.357 8.779 1.00 53.11 O ATOM 1431 CB TYR A 679 10.071 16.912 7.172 1.00 22.32 C ATOM 1432 CG TYR A 679 9.470 15.602 7.534 1.00 55.11 C ATOM 1433 CD1 TYR A 679 9.403 15.150 8.838 1.00 72.25 C ATOM 1434 CD2 TYR A 679 8.936 14.841 6.560 1.00 4.42 C ATOM 1435 CE1 TYR A 679 8.798 13.951 9.128 1.00 43.10 C ATOM 1436 CE2 TYR A 679 8.339 13.652 6.834 1.00 20.44 C ATOM 1437 CZ TYR A 679 8.266 13.212 8.097 1.00 14.53 C ATOM 1438 OH TYR A 679 7.657 12.031 8.335 1.00 72.21 O ATOM 0 H TYR A 679 12.423 15.063 6.914 1.00 13.31 H new ATOM 0 HA TYR A 679 11.869 17.885 6.654 1.00 62.01 H new ATOM 0 HB2 TYR A 679 9.719 17.661 7.881 1.00 22.32 H new ATOM 0 HB3 TYR A 679 9.699 17.203 6.190 1.00 22.32 H new ATOM 0 HD1 TYR A 679 9.829 15.743 9.634 1.00 72.25 H new ATOM 0 HD2 TYR A 679 8.983 15.184 5.537 1.00 4.42 H new ATOM 0 HE1 TYR A 679 8.741 13.595 10.146 1.00 43.10 H new ATOM 0 HE2 TYR A 679 7.923 13.060 6.032 1.00 20.44 H new ATOM 0 HH TYR A 679 6.975 12.149 9.029 1.00 72.21 H new ATOM 1448 N ASN A 680 11.524 17.720 9.460 1.00 50.03 N ATOM 1449 CA ASN A 680 11.981 17.990 10.840 1.00 50.43 C ATOM 1450 C ASN A 680 12.683 16.838 11.541 1.00 23.10 C ATOM 1451 O ASN A 680 12.078 15.824 11.917 1.00 62.33 O ATOM 1452 CB ASN A 680 10.859 18.551 11.724 1.00 3.12 C ATOM 1453 CG ASN A 680 11.307 18.775 13.170 1.00 32.15 C ATOM 1454 OD1 ASN A 680 11.151 17.902 14.030 1.00 35.02 O ATOM 1455 ND2 ASN A 680 11.886 19.921 13.440 1.00 42.44 N ATOM 0 H ASN A 680 10.623 18.151 9.252 1.00 50.03 H new ATOM 0 HA ASN A 680 12.748 18.752 10.702 1.00 50.43 H new ATOM 0 HB2 ASN A 680 10.509 19.495 11.305 1.00 3.12 H new ATOM 0 HB3 ASN A 680 10.013 17.863 11.712 1.00 3.12 H new ATOM 0 HD21 ASN A 680 12.223 20.112 14.384 1.00 42.44 H new ATOM 0 HD22 ASN A 680 11.999 20.621 12.706 1.00 42.44 H new ATOM 1461 N ASN A 681 13.968 17.041 11.683 1.00 40.00 N ATOM 1462 CA ASN A 681 14.909 16.193 12.382 1.00 73.14 C ATOM 1463 C ASN A 681 16.233 16.888 12.241 1.00 14.51 C ATOM 1464 O ASN A 681 16.514 17.459 11.179 1.00 34.55 O ATOM 1465 CB ASN A 681 14.940 14.749 11.787 1.00 52.41 C ATOM 1466 CG ASN A 681 15.939 13.770 12.446 1.00 14.51 C ATOM 1467 OD1 ASN A 681 17.027 14.141 12.887 1.00 4.13 O ATOM 1468 ND2 ASN A 681 15.554 12.521 12.554 1.00 51.23 N ATOM 0 H ASN A 681 14.421 17.864 11.285 1.00 40.00 H new ATOM 0 HA ASN A 681 14.635 16.057 13.428 1.00 73.14 H new ATOM 0 HB2 ASN A 681 13.939 14.323 11.864 1.00 52.41 H new ATOM 0 HB3 ASN A 681 15.176 14.819 10.725 1.00 52.41 H new ATOM 0 HD21 ASN A 681 16.160 11.838 13.010 1.00 51.23 H new ATOM 0 HD22 ASN A 681 14.649 12.232 12.182 1.00 51.23 H new ATOM 1474 N GLU A 682 17.021 16.891 13.287 1.00 72.14 N ATOM 1475 CA GLU A 682 18.299 17.582 13.292 1.00 5.14 C ATOM 1476 C GLU A 682 19.230 17.040 12.183 1.00 62.23 C ATOM 1477 O GLU A 682 19.971 17.788 11.555 1.00 22.42 O ATOM 1478 CB GLU A 682 18.936 17.458 14.679 1.00 41.13 C ATOM 1479 CG GLU A 682 20.220 18.237 14.872 1.00 14.43 C ATOM 1480 CD GLU A 682 20.740 18.116 16.279 1.00 5.40 C ATOM 1481 OE1 GLU A 682 21.505 17.168 16.563 1.00 51.23 O ATOM 1482 OE2 GLU A 682 20.387 18.958 17.129 1.00 70.20 O ATOM 0 H GLU A 682 16.800 16.416 14.162 1.00 72.14 H new ATOM 0 HA GLU A 682 18.138 18.638 13.077 1.00 5.14 H new ATOM 0 HB2 GLU A 682 18.213 17.790 15.424 1.00 41.13 H new ATOM 0 HB3 GLU A 682 19.136 16.405 14.876 1.00 41.13 H new ATOM 0 HG2 GLU A 682 20.974 17.874 14.173 1.00 14.43 H new ATOM 0 HG3 GLU A 682 20.047 19.287 14.637 1.00 14.43 H new ATOM 1489 N LYS A 683 19.145 15.749 11.939 1.00 25.14 N ATOM 1490 CA LYS A 683 19.952 15.091 10.915 1.00 0.24 C ATOM 1491 C LYS A 683 19.165 14.920 9.602 1.00 2.41 C ATOM 1492 O LYS A 683 19.668 14.333 8.651 1.00 42.12 O ATOM 1493 CB LYS A 683 20.406 13.726 11.429 1.00 23.55 C ATOM 1494 CG LYS A 683 21.188 13.801 12.726 1.00 4.03 C ATOM 1495 CD LYS A 683 21.576 12.427 13.233 1.00 1.24 C ATOM 1496 CE LYS A 683 22.315 12.538 14.552 1.00 73.33 C ATOM 1497 NZ LYS A 683 22.678 11.217 15.116 1.00 41.53 N ATOM 0 H LYS A 683 18.517 15.121 12.441 1.00 25.14 H new ATOM 0 HA LYS A 683 20.819 15.718 10.705 1.00 0.24 H new ATOM 0 HB2 LYS A 683 19.531 13.092 11.577 1.00 23.55 H new ATOM 0 HB3 LYS A 683 21.023 13.246 10.669 1.00 23.55 H new ATOM 0 HG2 LYS A 683 22.087 14.399 12.574 1.00 4.03 H new ATOM 0 HG3 LYS A 683 20.590 14.311 13.481 1.00 4.03 H new ATOM 0 HD2 LYS A 683 20.684 11.814 13.360 1.00 1.24 H new ATOM 0 HD3 LYS A 683 22.205 11.926 12.498 1.00 1.24 H new ATOM 0 HE2 LYS A 683 23.220 13.128 14.408 1.00 73.33 H new ATOM 0 HE3 LYS A 683 21.694 13.076 15.268 1.00 73.33 H new ATOM 0 HZ1 LYS A 683 23.181 11.350 16.017 1.00 41.53 H new ATOM 0 HZ2 LYS A 683 21.815 10.661 15.280 1.00 41.53 H new ATOM 0 HZ3 LYS A 683 23.294 10.711 14.448 1.00 41.53 H new ATOM 1511 N ARG A 684 17.932 15.467 9.568 1.00 23.45 N ATOM 1512 CA ARG A 684 16.985 15.330 8.441 1.00 13.21 C ATOM 1513 C ARG A 684 16.504 13.907 8.302 1.00 61.41 C ATOM 1514 O ARG A 684 17.286 12.979 8.067 1.00 53.44 O ATOM 1515 CB ARG A 684 17.480 15.859 7.056 1.00 4.11 C ATOM 1516 CG ARG A 684 17.732 17.371 6.938 1.00 24.34 C ATOM 1517 CD ARG A 684 18.979 17.800 7.672 1.00 45.43 C ATOM 1518 NE ARG A 684 20.161 17.110 7.142 1.00 24.10 N ATOM 1519 CZ ARG A 684 21.371 17.126 7.691 1.00 62.23 C ATOM 1520 NH1 ARG A 684 21.606 17.850 8.789 1.00 0.12 N ATOM 1521 NH2 ARG A 684 22.353 16.419 7.141 1.00 3.33 N ATOM 0 H ARG A 684 17.560 16.026 10.336 1.00 23.45 H new ATOM 0 HA ARG A 684 16.163 15.990 8.719 1.00 13.21 H new ATOM 0 HB2 ARG A 684 18.406 15.340 6.806 1.00 4.11 H new ATOM 0 HB3 ARG A 684 16.744 15.578 6.303 1.00 4.11 H new ATOM 0 HG2 ARG A 684 17.820 17.642 5.886 1.00 24.34 H new ATOM 0 HG3 ARG A 684 16.874 17.913 7.336 1.00 24.34 H new ATOM 0 HD2 ARG A 684 19.109 18.878 7.577 1.00 45.43 H new ATOM 0 HD3 ARG A 684 18.873 17.584 8.735 1.00 45.43 H new ATOM 0 HE ARG A 684 20.044 16.574 6.282 1.00 24.10 H new ATOM 0 HH11 ARG A 684 20.854 18.395 9.211 1.00 0.12 H new ATOM 0 HH12 ARG A 684 22.537 17.858 9.205 1.00 0.12 H new ATOM 0 HH21 ARG A 684 22.176 15.868 6.301 1.00 3.33 H new ATOM 0 HH22 ARG A 684 23.284 16.428 7.559 1.00 3.33 H new ATOM 1533 N THR A 685 15.245 13.726 8.468 1.00 40.54 N ATOM 1534 CA THR A 685 14.680 12.423 8.349 1.00 5.14 C ATOM 1535 C THR A 685 13.841 12.310 7.069 1.00 23.31 C ATOM 1536 O THR A 685 12.898 13.086 6.863 1.00 24.55 O ATOM 1537 CB THR A 685 13.834 12.047 9.602 1.00 53.22 C ATOM 1538 OG1 THR A 685 13.356 10.712 9.494 1.00 2.04 O ATOM 1539 CG2 THR A 685 12.659 12.994 9.793 1.00 0.03 C ATOM 0 H THR A 685 14.578 14.466 8.688 1.00 40.54 H new ATOM 0 HA THR A 685 15.503 11.711 8.285 1.00 5.14 H new ATOM 0 HB THR A 685 14.486 12.133 10.472 1.00 53.22 H new ATOM 0 HG1 THR A 685 12.382 10.721 9.383 1.00 2.04 H new ATOM 0 HG21 THR A 685 12.094 12.699 10.677 1.00 0.03 H new ATOM 0 HG22 THR A 685 13.029 14.011 9.922 1.00 0.03 H new ATOM 0 HG23 THR A 685 12.011 12.952 8.917 1.00 0.03 H new ATOM 1545 N PRO A 686 14.207 11.402 6.159 1.00 22.44 N ATOM 1546 CA PRO A 686 13.412 11.132 4.988 1.00 20.14 C ATOM 1547 C PRO A 686 12.147 10.398 5.389 1.00 45.42 C ATOM 1548 O PRO A 686 12.195 9.397 6.131 1.00 52.22 O ATOM 1549 CB PRO A 686 14.305 10.248 4.104 1.00 12.50 C ATOM 1550 CG PRO A 686 15.654 10.281 4.744 1.00 64.14 C ATOM 1551 CD PRO A 686 15.416 10.583 6.197 1.00 4.22 C ATOM 0 HA PRO A 686 13.102 12.038 4.467 1.00 20.14 H new ATOM 0 HB2 PRO A 686 13.920 9.230 4.051 1.00 12.50 H new ATOM 0 HB3 PRO A 686 14.345 10.627 3.083 1.00 12.50 H new ATOM 0 HG2 PRO A 686 16.167 9.327 4.623 1.00 64.14 H new ATOM 0 HG3 PRO A 686 16.285 11.042 4.285 1.00 64.14 H new ATOM 0 HD2 PRO A 686 15.272 9.674 6.781 1.00 4.22 H new ATOM 0 HD3 PRO A 686 16.254 11.119 6.642 1.00 4.22 H new ATOM 1559 N ARG A 687 11.037 10.913 4.941 1.00 21.13 N ATOM 1560 CA ARG A 687 9.734 10.391 5.238 1.00 63.02 C ATOM 1561 C ARG A 687 9.620 8.910 4.875 1.00 22.43 C ATOM 1562 O ARG A 687 10.132 8.472 3.838 1.00 5.11 O ATOM 1563 CB ARG A 687 8.714 11.208 4.474 1.00 21.01 C ATOM 1564 CG ARG A 687 7.284 10.852 4.757 1.00 3.00 C ATOM 1565 CD ARG A 687 6.332 11.798 4.047 1.00 72.05 C ATOM 1566 NE ARG A 687 6.372 13.171 4.569 1.00 51.33 N ATOM 1567 CZ ARG A 687 6.830 14.244 3.914 1.00 11.54 C ATOM 1568 NH1 ARG A 687 7.444 14.106 2.750 1.00 34.44 N ATOM 1569 NH2 ARG A 687 6.694 15.452 4.448 1.00 41.21 N ATOM 0 H ARG A 687 11.014 11.736 4.339 1.00 21.13 H new ATOM 0 HA ARG A 687 9.553 10.464 6.310 1.00 63.02 H new ATOM 0 HB2 ARG A 687 8.865 12.262 4.708 1.00 21.01 H new ATOM 0 HB3 ARG A 687 8.899 11.089 3.407 1.00 21.01 H new ATOM 0 HG2 ARG A 687 7.091 9.829 4.436 1.00 3.00 H new ATOM 0 HG3 ARG A 687 7.103 10.888 5.831 1.00 3.00 H new ATOM 0 HD2 ARG A 687 6.574 11.815 2.984 1.00 72.05 H new ATOM 0 HD3 ARG A 687 5.316 11.413 4.136 1.00 72.05 H new ATOM 0 HE ARG A 687 6.019 13.319 5.515 1.00 51.33 H new ATOM 0 HH11 ARG A 687 7.570 13.178 2.347 1.00 34.44 H new ATOM 0 HH12 ARG A 687 7.791 14.928 2.256 1.00 34.44 H new ATOM 0 HH21 ARG A 687 6.241 15.560 5.356 1.00 41.21 H new ATOM 0 HH22 ARG A 687 7.042 16.272 3.951 1.00 41.21 H new ATOM 1581 N ALA A 688 8.987 8.158 5.739 1.00 52.01 N ATOM 1582 CA ALA A 688 8.779 6.751 5.531 1.00 42.14 C ATOM 1583 C ALA A 688 7.323 6.414 5.772 1.00 63.22 C ATOM 1584 O ALA A 688 6.670 7.029 6.622 1.00 75.54 O ATOM 1585 CB ALA A 688 9.676 5.935 6.454 1.00 22.41 C ATOM 0 H ALA A 688 8.599 8.510 6.614 1.00 52.01 H new ATOM 0 HA ALA A 688 9.038 6.501 4.502 1.00 42.14 H new ATOM 0 HB1 ALA A 688 9.504 4.872 6.282 1.00 22.41 H new ATOM 0 HB2 ALA A 688 10.720 6.172 6.249 1.00 22.41 H new ATOM 0 HB3 ALA A 688 9.446 6.176 7.492 1.00 22.41 H new ATOM 1591 N THR A 689 6.821 5.474 5.029 1.00 41.53 N ATOM 1592 CA THR A 689 5.442 5.047 5.132 1.00 1.13 C ATOM 1593 C THR A 689 5.393 3.562 5.436 1.00 70.04 C ATOM 1594 O THR A 689 6.128 2.779 4.825 1.00 73.42 O ATOM 1595 CB THR A 689 4.736 5.289 3.799 1.00 21.12 C ATOM 1596 OG1 THR A 689 4.937 6.627 3.427 1.00 4.43 O ATOM 1597 CG2 THR A 689 3.249 5.017 3.894 1.00 11.23 C ATOM 0 H THR A 689 7.358 4.970 4.323 1.00 41.53 H new ATOM 0 HA THR A 689 4.952 5.609 5.927 1.00 1.13 H new ATOM 0 HB THR A 689 5.153 4.608 3.057 1.00 21.12 H new ATOM 0 HG1 THR A 689 4.078 7.098 3.423 1.00 4.43 H new ATOM 0 HG21 THR A 689 2.783 5.201 2.926 1.00 11.23 H new ATOM 0 HG22 THR A 689 3.087 3.979 4.184 1.00 11.23 H new ATOM 0 HG23 THR A 689 2.806 5.676 4.641 1.00 11.23 H new ATOM 1603 N LEU A 690 4.557 3.169 6.360 1.00 63.15 N ATOM 1604 CA LEU A 690 4.427 1.812 6.685 1.00 14.11 C ATOM 1605 C LEU A 690 2.961 1.413 6.748 1.00 31.35 C ATOM 1606 O LEU A 690 2.202 1.907 7.587 1.00 61.20 O ATOM 1607 CB LEU A 690 5.075 1.532 8.011 1.00 72.21 C ATOM 1608 CG LEU A 690 5.041 0.089 8.437 1.00 11.23 C ATOM 1609 CD1 LEU A 690 5.841 -0.754 7.487 1.00 62.30 C ATOM 1610 CD2 LEU A 690 5.541 -0.052 9.818 1.00 51.24 C ATOM 0 H LEU A 690 3.957 3.796 6.896 1.00 63.15 H new ATOM 0 HA LEU A 690 4.921 1.229 5.908 1.00 14.11 H new ATOM 0 HB2 LEU A 690 6.114 1.859 7.968 1.00 72.21 H new ATOM 0 HB3 LEU A 690 4.582 2.134 8.775 1.00 72.21 H new ATOM 0 HG LEU A 690 4.008 -0.259 8.414 1.00 11.23 H new ATOM 0 HD11 LEU A 690 5.807 -1.795 7.808 1.00 62.30 H new ATOM 0 HD12 LEU A 690 5.422 -0.669 6.484 1.00 62.30 H new ATOM 0 HD13 LEU A 690 6.875 -0.410 7.478 1.00 62.30 H new ATOM 0 HD21 LEU A 690 5.510 -1.101 10.111 1.00 51.24 H new ATOM 0 HD22 LEU A 690 6.568 0.309 9.872 1.00 51.24 H new ATOM 0 HD23 LEU A 690 4.915 0.532 10.493 1.00 51.24 H new ATOM 1618 N ILE A 691 2.576 0.533 5.881 1.00 43.23 N ATOM 1619 CA ILE A 691 1.232 0.014 5.868 1.00 73.13 C ATOM 1620 C ILE A 691 1.237 -1.265 6.668 1.00 63.45 C ATOM 1621 O ILE A 691 2.162 -2.052 6.554 1.00 30.34 O ATOM 1622 CB ILE A 691 0.690 -0.337 4.437 1.00 25.42 C ATOM 1623 CG1 ILE A 691 0.638 0.850 3.456 1.00 51.03 C ATOM 1624 CG2 ILE A 691 -0.681 -0.961 4.537 1.00 70.41 C ATOM 1625 CD1 ILE A 691 1.980 1.475 3.106 1.00 53.50 C ATOM 0 H ILE A 691 3.181 0.148 5.156 1.00 43.23 H new ATOM 0 HA ILE A 691 0.586 0.792 6.275 1.00 73.13 H new ATOM 0 HB ILE A 691 1.413 -1.040 4.024 1.00 25.42 H new ATOM 0 HG12 ILE A 691 0.162 0.515 2.534 1.00 51.03 H new ATOM 0 HG13 ILE A 691 -0.002 1.623 3.883 1.00 51.03 H new ATOM 0 HG21 ILE A 691 -1.046 -1.200 3.538 1.00 70.41 H new ATOM 0 HG22 ILE A 691 -0.623 -1.874 5.130 1.00 70.41 H new ATOM 0 HG23 ILE A 691 -1.366 -0.261 5.015 1.00 70.41 H new ATOM 0 HD11 ILE A 691 1.827 2.300 2.410 1.00 53.50 H new ATOM 0 HD12 ILE A 691 2.455 1.849 4.013 1.00 53.50 H new ATOM 0 HD13 ILE A 691 2.621 0.725 2.644 1.00 53.50 H new ATOM 1632 N THR A 692 0.270 -1.443 7.491 1.00 13.25 N ATOM 1633 CA THR A 692 0.133 -2.650 8.232 1.00 22.32 C ATOM 1634 C THR A 692 -1.214 -3.297 7.827 1.00 2.01 C ATOM 1635 O THR A 692 -2.287 -2.730 8.087 1.00 75.22 O ATOM 1636 CB THR A 692 0.195 -2.306 9.736 1.00 23.22 C ATOM 1637 OG1 THR A 692 1.382 -1.528 9.964 1.00 41.05 O ATOM 1638 CG2 THR A 692 0.263 -3.540 10.605 1.00 24.33 C ATOM 0 H THR A 692 -0.457 -0.751 7.674 1.00 13.25 H new ATOM 0 HA THR A 692 0.932 -3.361 8.023 1.00 22.32 H new ATOM 0 HB THR A 692 -0.712 -1.762 9.998 1.00 23.22 H new ATOM 0 HG1 THR A 692 1.443 -1.295 10.914 1.00 41.05 H new ATOM 0 HG21 THR A 692 0.305 -3.245 11.653 1.00 24.33 H new ATOM 0 HG22 THR A 692 -0.622 -4.153 10.436 1.00 24.33 H new ATOM 0 HG23 THR A 692 1.155 -4.113 10.354 1.00 24.33 H new ATOM 1644 N PHE A 693 -1.138 -4.447 7.154 1.00 13.03 N ATOM 1645 CA PHE A 693 -2.310 -5.133 6.615 1.00 63.43 C ATOM 1646 C PHE A 693 -2.889 -6.083 7.639 1.00 50.22 C ATOM 1647 O PHE A 693 -2.226 -7.029 8.075 1.00 20.11 O ATOM 1648 CB PHE A 693 -1.956 -5.960 5.338 1.00 52.10 C ATOM 1649 CG PHE A 693 -1.316 -5.185 4.212 1.00 42.15 C ATOM 1650 CD1 PHE A 693 -2.081 -4.488 3.289 1.00 71.32 C ATOM 1651 CD2 PHE A 693 0.055 -5.143 4.096 1.00 15.12 C ATOM 1652 CE1 PHE A 693 -1.470 -3.762 2.274 1.00 54.32 C ATOM 1653 CE2 PHE A 693 0.664 -4.420 3.094 1.00 25.40 C ATOM 1654 CZ PHE A 693 -0.099 -3.728 2.185 1.00 14.41 C ATOM 0 H PHE A 693 -0.258 -4.929 6.968 1.00 13.03 H new ATOM 0 HA PHE A 693 -3.035 -4.361 6.358 1.00 63.43 H new ATOM 0 HB2 PHE A 693 -1.284 -6.768 5.626 1.00 52.10 H new ATOM 0 HB3 PHE A 693 -2.869 -6.423 4.963 1.00 52.10 H new ATOM 0 HD1 PHE A 693 -3.158 -4.510 3.360 1.00 71.32 H new ATOM 0 HD2 PHE A 693 0.664 -5.687 4.803 1.00 15.12 H new ATOM 0 HE1 PHE A 693 -2.072 -3.225 1.556 1.00 54.32 H new ATOM 0 HE2 PHE A 693 1.741 -4.397 3.023 1.00 25.40 H new ATOM 0 HZ PHE A 693 0.378 -3.158 1.401 1.00 14.41 H new ATOM 1664 N LEU A 694 -4.095 -5.813 8.039 1.00 32.13 N ATOM 1665 CA LEU A 694 -4.830 -6.679 8.922 1.00 32.51 C ATOM 1666 C LEU A 694 -5.949 -7.297 8.137 1.00 11.52 C ATOM 1667 O LEU A 694 -6.441 -6.697 7.181 1.00 1.24 O ATOM 1668 CB LEU A 694 -5.387 -5.942 10.167 1.00 34.44 C ATOM 1669 CG LEU A 694 -4.373 -5.462 11.233 1.00 50.44 C ATOM 1670 CD1 LEU A 694 -3.411 -4.428 10.688 1.00 23.14 C ATOM 1671 CD2 LEU A 694 -5.097 -4.917 12.444 1.00 25.31 C ATOM 0 H LEU A 694 -4.606 -4.975 7.760 1.00 32.13 H new ATOM 0 HA LEU A 694 -4.150 -7.440 9.304 1.00 32.51 H new ATOM 0 HB2 LEU A 694 -5.945 -5.073 9.820 1.00 34.44 H new ATOM 0 HB3 LEU A 694 -6.101 -6.604 10.657 1.00 34.44 H new ATOM 0 HG LEU A 694 -3.783 -6.330 11.527 1.00 50.44 H new ATOM 0 HD11 LEU A 694 -2.720 -4.123 11.474 1.00 23.14 H new ATOM 0 HD12 LEU A 694 -2.849 -4.856 9.857 1.00 23.14 H new ATOM 0 HD13 LEU A 694 -3.970 -3.559 10.339 1.00 23.14 H new ATOM 0 HD21 LEU A 694 -4.369 -4.584 13.184 1.00 25.31 H new ATOM 0 HD22 LEU A 694 -5.722 -4.076 12.146 1.00 25.31 H new ATOM 0 HD23 LEU A 694 -5.722 -5.698 12.876 1.00 25.31 H new ATOM 1679 N CYS A 695 -6.351 -8.465 8.521 1.00 32.42 N ATOM 1680 CA CYS A 695 -7.365 -9.194 7.794 1.00 12.53 C ATOM 1681 C CYS A 695 -8.675 -9.177 8.578 1.00 73.21 C ATOM 1682 O CYS A 695 -9.493 -10.100 8.495 1.00 13.01 O ATOM 1683 CB CYS A 695 -6.877 -10.626 7.555 1.00 32.25 C ATOM 1684 SG CYS A 695 -7.928 -11.628 6.460 1.00 74.04 S ATOM 0 H CYS A 695 -5.993 -8.949 9.345 1.00 32.42 H new ATOM 0 HA CYS A 695 -7.547 -8.723 6.828 1.00 12.53 H new ATOM 0 HB2 CYS A 695 -5.873 -10.585 7.132 1.00 32.25 H new ATOM 0 HB3 CYS A 695 -6.797 -11.131 8.518 1.00 32.25 H new ATOM 1689 N ASP A 696 -8.877 -8.106 9.319 1.00 34.44 N ATOM 1690 CA ASP A 696 -10.102 -7.924 10.077 1.00 12.03 C ATOM 1691 C ASP A 696 -11.261 -7.696 9.137 1.00 30.55 C ATOM 1692 O ASP A 696 -11.289 -6.698 8.395 1.00 54.22 O ATOM 1693 CB ASP A 696 -9.984 -6.759 11.051 1.00 45.32 C ATOM 1694 CG ASP A 696 -11.272 -6.505 11.808 1.00 73.02 C ATOM 1695 OD1 ASP A 696 -11.552 -7.238 12.792 1.00 62.41 O ATOM 1696 OD2 ASP A 696 -12.014 -5.565 11.452 1.00 23.42 O ATOM 0 H ASP A 696 -8.206 -7.344 9.414 1.00 34.44 H new ATOM 0 HA ASP A 696 -10.278 -8.830 10.656 1.00 12.03 H new ATOM 0 HB2 ASP A 696 -9.183 -6.963 11.761 1.00 45.32 H new ATOM 0 HB3 ASP A 696 -9.704 -5.859 10.504 1.00 45.32 H new ATOM 1701 N ARG A 697 -12.203 -8.638 9.160 1.00 64.54 N ATOM 1702 CA ARG A 697 -13.389 -8.620 8.325 1.00 31.22 C ATOM 1703 C ARG A 697 -13.011 -8.745 6.848 1.00 24.42 C ATOM 1704 O ARG A 697 -11.870 -9.095 6.513 1.00 31.22 O ATOM 1705 CB ARG A 697 -14.234 -7.362 8.613 1.00 45.24 C ATOM 1706 CG ARG A 697 -14.686 -7.283 10.062 1.00 43.45 C ATOM 1707 CD ARG A 697 -15.478 -6.030 10.368 1.00 72.23 C ATOM 1708 NE ARG A 697 -15.837 -5.984 11.791 1.00 62.20 N ATOM 1709 CZ ARG A 697 -16.459 -4.979 12.414 1.00 61.52 C ATOM 1710 NH1 ARG A 697 -16.845 -3.898 11.738 1.00 2.43 N ATOM 1711 NH2 ARG A 697 -16.692 -5.068 13.723 1.00 3.40 N ATOM 0 H ARG A 697 -12.156 -9.450 9.775 1.00 64.54 H new ATOM 0 HA ARG A 697 -14.008 -9.484 8.568 1.00 31.22 H new ATOM 0 HB2 ARG A 697 -13.652 -6.474 8.369 1.00 45.24 H new ATOM 0 HB3 ARG A 697 -15.109 -7.359 7.962 1.00 45.24 H new ATOM 0 HG2 ARG A 697 -15.295 -8.157 10.295 1.00 43.45 H new ATOM 0 HG3 ARG A 697 -13.812 -7.321 10.712 1.00 43.45 H new ATOM 0 HD2 ARG A 697 -14.892 -5.149 10.106 1.00 72.23 H new ATOM 0 HD3 ARG A 697 -16.381 -6.005 9.758 1.00 72.23 H new ATOM 0 HE ARG A 697 -15.588 -6.795 12.357 1.00 62.20 H new ATOM 0 HH11 ARG A 697 -16.666 -3.832 10.736 1.00 2.43 H new ATOM 0 HH12 ARG A 697 -17.319 -3.136 12.222 1.00 2.43 H new ATOM 0 HH21 ARG A 697 -16.396 -5.897 14.238 1.00 3.40 H new ATOM 0 HH22 ARG A 697 -17.166 -4.307 14.210 1.00 3.40 H new ATOM 1723 N ASP A 698 -13.953 -8.519 5.977 1.00 30.11 N ATOM 1724 CA ASP A 698 -13.689 -8.595 4.559 1.00 12.14 C ATOM 1725 C ASP A 698 -13.814 -7.230 3.949 1.00 51.34 C ATOM 1726 O ASP A 698 -14.756 -6.490 4.241 1.00 71.42 O ATOM 1727 CB ASP A 698 -14.618 -9.600 3.850 1.00 44.22 C ATOM 1728 CG ASP A 698 -16.082 -9.231 3.924 1.00 43.31 C ATOM 1729 OD1 ASP A 698 -16.698 -9.418 4.995 1.00 52.12 O ATOM 1730 OD2 ASP A 698 -16.638 -8.750 2.917 1.00 60.20 O ATOM 0 H ASP A 698 -14.914 -8.280 6.220 1.00 30.11 H new ATOM 0 HA ASP A 698 -12.670 -8.959 4.424 1.00 12.14 H new ATOM 0 HB2 ASP A 698 -14.324 -9.677 2.803 1.00 44.22 H new ATOM 0 HB3 ASP A 698 -14.478 -10.586 4.293 1.00 44.22 H new ATOM 1735 N ALA A 699 -12.856 -6.878 3.139 1.00 52.05 N ATOM 1736 CA ALA A 699 -12.840 -5.578 2.496 1.00 13.12 C ATOM 1737 C ALA A 699 -12.260 -5.686 1.098 1.00 62.15 C ATOM 1738 O ALA A 699 -11.970 -4.668 0.452 1.00 5.00 O ATOM 1739 CB ALA A 699 -12.019 -4.604 3.324 1.00 32.31 C ATOM 0 H ALA A 699 -12.064 -7.475 2.901 1.00 52.05 H new ATOM 0 HA ALA A 699 -13.864 -5.211 2.421 1.00 13.12 H new ATOM 0 HB1 ALA A 699 -12.010 -3.629 2.836 1.00 32.31 H new ATOM 0 HB2 ALA A 699 -12.459 -4.509 4.317 1.00 32.31 H new ATOM 0 HB3 ALA A 699 -10.998 -4.974 3.414 1.00 32.31 H new ATOM 1745 N GLY A 700 -12.098 -6.911 0.628 1.00 64.51 N ATOM 1746 CA GLY A 700 -11.509 -7.132 -0.672 1.00 14.23 C ATOM 1747 C GLY A 700 -10.076 -6.696 -0.669 1.00 3.30 C ATOM 1748 O GLY A 700 -9.281 -7.189 0.140 1.00 40.44 O ATOM 0 H GLY A 700 -12.366 -7.760 1.127 1.00 64.51 H new ATOM 0 HA2 GLY A 700 -11.575 -8.188 -0.935 1.00 14.23 H new ATOM 0 HA3 GLY A 700 -12.064 -6.579 -1.430 1.00 14.23 H new ATOM 1752 N VAL A 701 -9.745 -5.749 -1.533 1.00 43.10 N ATOM 1753 CA VAL A 701 -8.415 -5.182 -1.590 1.00 1.24 C ATOM 1754 C VAL A 701 -8.081 -4.426 -0.303 1.00 31.45 C ATOM 1755 O VAL A 701 -6.937 -4.371 0.124 1.00 53.53 O ATOM 1756 CB VAL A 701 -8.240 -4.256 -2.811 1.00 41.12 C ATOM 1757 CG1 VAL A 701 -8.318 -5.049 -4.107 1.00 50.41 C ATOM 1758 CG2 VAL A 701 -9.278 -3.132 -2.820 1.00 23.41 C ATOM 0 H VAL A 701 -10.395 -5.354 -2.213 1.00 43.10 H new ATOM 0 HA VAL A 701 -7.719 -6.014 -1.696 1.00 1.24 H new ATOM 0 HB VAL A 701 -7.252 -3.802 -2.734 1.00 41.12 H new ATOM 0 HG11 VAL A 701 -8.192 -4.375 -4.954 1.00 50.41 H new ATOM 0 HG12 VAL A 701 -7.529 -5.801 -4.121 1.00 50.41 H new ATOM 0 HG13 VAL A 701 -9.289 -5.540 -4.175 1.00 50.41 H new ATOM 0 HG21 VAL A 701 -9.123 -2.500 -3.695 1.00 23.41 H new ATOM 0 HG22 VAL A 701 -10.279 -3.562 -2.855 1.00 23.41 H new ATOM 0 HG23 VAL A 701 -9.172 -2.532 -1.916 1.00 23.41 H new ATOM 1764 N GLY A 702 -9.092 -3.894 0.315 1.00 31.14 N ATOM 1765 CA GLY A 702 -8.937 -3.182 1.545 1.00 21.55 C ATOM 1766 C GLY A 702 -8.752 -1.706 1.349 1.00 40.43 C ATOM 1767 O GLY A 702 -8.372 -1.253 0.265 1.00 43.05 O ATOM 0 H GLY A 702 -10.053 -3.943 -0.023 1.00 31.14 H new ATOM 0 HA2 GLY A 702 -9.813 -3.353 2.170 1.00 21.55 H new ATOM 0 HA3 GLY A 702 -8.078 -3.582 2.084 1.00 21.55 H new ATOM 1771 N PHE A 703 -9.051 -0.949 2.372 1.00 54.34 N ATOM 1772 CA PHE A 703 -8.868 0.477 2.326 1.00 13.23 C ATOM 1773 C PHE A 703 -7.862 0.901 3.391 1.00 51.43 C ATOM 1774 O PHE A 703 -8.027 0.557 4.573 1.00 44.41 O ATOM 1775 CB PHE A 703 -10.206 1.209 2.518 1.00 24.43 C ATOM 1776 CG PHE A 703 -10.116 2.697 2.332 1.00 71.55 C ATOM 1777 CD1 PHE A 703 -10.086 3.233 1.060 1.00 65.44 C ATOM 1778 CD2 PHE A 703 -10.062 3.558 3.418 1.00 24.31 C ATOM 1779 CE1 PHE A 703 -10.001 4.587 0.866 1.00 30.30 C ATOM 1780 CE2 PHE A 703 -9.977 4.926 3.226 1.00 42.15 C ATOM 1781 CZ PHE A 703 -9.947 5.437 1.943 1.00 31.42 C ATOM 0 H PHE A 703 -9.425 -1.300 3.253 1.00 54.34 H new ATOM 0 HA PHE A 703 -8.480 0.749 1.344 1.00 13.23 H new ATOM 0 HB2 PHE A 703 -10.933 0.808 1.812 1.00 24.43 H new ATOM 0 HB3 PHE A 703 -10.584 1.000 3.519 1.00 24.43 H new ATOM 0 HD1 PHE A 703 -10.130 2.575 0.205 1.00 65.44 H new ATOM 0 HD2 PHE A 703 -10.086 3.158 4.421 1.00 24.31 H new ATOM 0 HE1 PHE A 703 -9.976 4.987 -0.137 1.00 30.30 H new ATOM 0 HE2 PHE A 703 -9.934 5.591 4.076 1.00 42.15 H new ATOM 0 HZ PHE A 703 -9.881 6.504 1.787 1.00 31.42 H new ATOM 1791 N PRO A 704 -6.796 1.603 2.998 1.00 72.42 N ATOM 1792 CA PRO A 704 -5.813 2.110 3.945 1.00 23.05 C ATOM 1793 C PRO A 704 -6.312 3.358 4.669 1.00 53.15 C ATOM 1794 O PRO A 704 -6.903 4.246 4.062 1.00 24.14 O ATOM 1795 CB PRO A 704 -4.609 2.463 3.071 1.00 71.30 C ATOM 1796 CG PRO A 704 -5.145 2.654 1.683 1.00 52.14 C ATOM 1797 CD PRO A 704 -6.465 1.938 1.601 1.00 55.33 C ATOM 0 HA PRO A 704 -5.590 1.381 4.724 1.00 23.05 H new ATOM 0 HB2 PRO A 704 -4.120 3.369 3.428 1.00 71.30 H new ATOM 0 HB3 PRO A 704 -3.863 1.668 3.095 1.00 71.30 H new ATOM 0 HG2 PRO A 704 -5.271 3.714 1.464 1.00 52.14 H new ATOM 0 HG3 PRO A 704 -4.448 2.257 0.946 1.00 52.14 H new ATOM 0 HD2 PRO A 704 -7.231 2.570 1.153 1.00 55.33 H new ATOM 0 HD3 PRO A 704 -6.392 1.041 0.985 1.00 55.33 H new ATOM 1805 N GLU A 705 -6.073 3.410 5.950 1.00 33.13 N ATOM 1806 CA GLU A 705 -6.455 4.534 6.765 1.00 15.14 C ATOM 1807 C GLU A 705 -5.229 5.095 7.481 1.00 55.32 C ATOM 1808 O GLU A 705 -4.336 4.335 7.876 1.00 5.13 O ATOM 1809 CB GLU A 705 -7.533 4.103 7.751 1.00 75.05 C ATOM 1810 CG GLU A 705 -8.839 3.687 7.068 1.00 32.21 C ATOM 1811 CD GLU A 705 -9.936 3.319 8.042 1.00 62.52 C ATOM 1812 OE1 GLU A 705 -10.034 2.131 8.433 1.00 24.41 O ATOM 1813 OE2 GLU A 705 -10.728 4.212 8.420 1.00 31.23 O ATOM 0 H GLU A 705 -5.602 2.666 6.465 1.00 33.13 H new ATOM 0 HA GLU A 705 -6.865 5.326 6.139 1.00 15.14 H new ATOM 0 HB2 GLU A 705 -7.160 3.270 8.347 1.00 75.05 H new ATOM 0 HB3 GLU A 705 -7.735 4.923 8.440 1.00 75.05 H new ATOM 0 HG2 GLU A 705 -9.185 4.504 6.434 1.00 32.21 H new ATOM 0 HG3 GLU A 705 -8.644 2.837 6.414 1.00 32.21 H new ATOM 1820 N TYR A 706 -5.179 6.406 7.653 1.00 34.34 N ATOM 1821 CA TYR A 706 -4.006 7.052 8.224 1.00 51.41 C ATOM 1822 C TYR A 706 -3.937 6.833 9.724 1.00 42.15 C ATOM 1823 O TYR A 706 -4.918 7.017 10.445 1.00 32.13 O ATOM 1824 CB TYR A 706 -3.986 8.551 7.869 1.00 40.43 C ATOM 1825 CG TYR A 706 -2.727 9.313 8.281 1.00 50.41 C ATOM 1826 CD1 TYR A 706 -1.468 8.877 7.887 1.00 13.35 C ATOM 1827 CD2 TYR A 706 -2.802 10.478 9.038 1.00 3.53 C ATOM 1828 CE1 TYR A 706 -0.328 9.569 8.229 1.00 35.22 C ATOM 1829 CE2 TYR A 706 -1.658 11.185 9.377 1.00 54.03 C ATOM 1830 CZ TYR A 706 -0.424 10.722 8.970 1.00 21.15 C ATOM 1831 OH TYR A 706 0.724 11.425 9.284 1.00 54.53 O ATOM 0 H TYR A 706 -5.936 7.044 7.406 1.00 34.34 H new ATOM 0 HA TYR A 706 -3.117 6.594 7.789 1.00 51.41 H new ATOM 0 HB2 TYR A 706 -4.113 8.652 6.791 1.00 40.43 H new ATOM 0 HB3 TYR A 706 -4.847 9.028 8.338 1.00 40.43 H new ATOM 0 HD1 TYR A 706 -1.382 7.975 7.299 1.00 13.35 H new ATOM 0 HD2 TYR A 706 -3.766 10.837 9.367 1.00 3.53 H new ATOM 0 HE1 TYR A 706 0.640 9.206 7.915 1.00 35.22 H new ATOM 0 HE2 TYR A 706 -1.733 12.093 9.957 1.00 54.03 H new ATOM 0 HH TYR A 706 0.605 11.879 10.145 1.00 54.53 H new ATOM 1841 N GLN A 707 -2.786 6.409 10.174 1.00 74.32 N ATOM 1842 CA GLN A 707 -2.549 6.115 11.566 1.00 55.24 C ATOM 1843 C GLN A 707 -1.475 7.020 12.171 1.00 53.55 C ATOM 1844 O GLN A 707 -1.746 7.731 13.140 1.00 51.35 O ATOM 1845 CB GLN A 707 -2.185 4.630 11.717 1.00 2.42 C ATOM 1846 CG GLN A 707 -1.733 4.226 13.099 1.00 1.15 C ATOM 1847 CD GLN A 707 -1.623 2.739 13.255 1.00 45.03 C ATOM 1848 OE1 GLN A 707 -2.596 2.073 13.597 1.00 42.23 O ATOM 1849 NE2 GLN A 707 -0.450 2.211 13.060 1.00 11.42 N ATOM 0 H GLN A 707 -1.974 6.255 9.577 1.00 74.32 H new ATOM 0 HA GLN A 707 -3.464 6.317 12.123 1.00 55.24 H new ATOM 0 HB2 GLN A 707 -3.052 4.028 11.443 1.00 2.42 H new ATOM 0 HB3 GLN A 707 -1.394 4.390 11.007 1.00 2.42 H new ATOM 0 HG2 GLN A 707 -0.766 4.683 13.309 1.00 1.15 H new ATOM 0 HG3 GLN A 707 -2.436 4.614 13.836 1.00 1.15 H new ATOM 0 HE21 GLN A 707 0.333 2.799 12.776 1.00 11.42 H new ATOM 0 HE22 GLN A 707 -0.314 1.209 13.191 1.00 11.42 H new ATOM 1857 N GLU A 708 -0.271 6.994 11.570 1.00 21.30 N ATOM 1858 CA GLU A 708 0.912 7.759 12.043 1.00 23.21 C ATOM 1859 C GLU A 708 1.314 7.349 13.477 1.00 2.32 C ATOM 1860 O GLU A 708 0.701 7.786 14.452 1.00 44.11 O ATOM 1861 CB GLU A 708 0.672 9.274 12.014 1.00 33.35 C ATOM 1862 CG GLU A 708 1.897 10.092 12.414 1.00 50.21 C ATOM 1863 CD GLU A 708 1.584 11.546 12.651 1.00 4.45 C ATOM 1864 OE1 GLU A 708 1.321 12.276 11.684 1.00 51.41 O ATOM 1865 OE2 GLU A 708 1.606 11.982 13.834 1.00 43.34 O ATOM 0 H GLU A 708 -0.084 6.439 10.735 1.00 21.30 H new ATOM 0 HA GLU A 708 1.720 7.517 11.353 1.00 23.21 H new ATOM 0 HB2 GLU A 708 0.362 9.566 11.011 1.00 33.35 H new ATOM 0 HB3 GLU A 708 -0.152 9.516 12.685 1.00 33.35 H new ATOM 0 HG2 GLU A 708 2.330 9.667 13.320 1.00 50.21 H new ATOM 0 HG3 GLU A 708 2.652 10.012 11.632 1.00 50.21 H new ATOM 1872 N GLU A 709 2.315 6.514 13.607 1.00 10.13 N ATOM 1873 CA GLU A 709 2.756 6.094 14.932 1.00 14.32 C ATOM 1874 C GLU A 709 4.002 6.890 15.337 1.00 54.10 C ATOM 1875 O GLU A 709 4.302 7.071 16.525 1.00 70.42 O ATOM 1876 CB GLU A 709 3.020 4.589 14.939 1.00 35.51 C ATOM 1877 CG GLU A 709 3.403 4.006 16.278 1.00 11.50 C ATOM 1878 CD GLU A 709 3.609 2.521 16.196 1.00 11.32 C ATOM 1879 OE1 GLU A 709 4.746 2.088 15.926 1.00 21.21 O ATOM 1880 OE2 GLU A 709 2.638 1.767 16.385 1.00 53.21 O ATOM 0 H GLU A 709 2.839 6.112 12.830 1.00 10.13 H new ATOM 0 HA GLU A 709 1.974 6.297 15.664 1.00 14.32 H new ATOM 0 HB2 GLU A 709 2.126 4.079 14.582 1.00 35.51 H new ATOM 0 HB3 GLU A 709 3.816 4.373 14.226 1.00 35.51 H new ATOM 0 HG2 GLU A 709 4.317 4.481 16.634 1.00 11.50 H new ATOM 0 HG3 GLU A 709 2.624 4.226 17.008 1.00 11.50 H new ATOM 1887 N ASP A 710 4.703 7.378 14.345 1.00 14.32 N ATOM 1888 CA ASP A 710 5.885 8.195 14.541 1.00 32.32 C ATOM 1889 C ASP A 710 5.799 9.362 13.590 1.00 21.52 C ATOM 1890 O ASP A 710 5.179 9.238 12.535 1.00 62.51 O ATOM 1891 CB ASP A 710 7.165 7.376 14.278 1.00 1.04 C ATOM 1892 CG ASP A 710 8.440 8.192 14.412 1.00 14.43 C ATOM 1893 OD1 ASP A 710 8.992 8.283 15.532 1.00 11.01 O ATOM 1894 OD2 ASP A 710 8.900 8.762 13.405 1.00 54.01 O ATOM 0 H ASP A 710 4.470 7.220 13.365 1.00 14.32 H new ATOM 0 HA ASP A 710 5.931 8.548 15.571 1.00 32.32 H new ATOM 0 HB2 ASP A 710 7.202 6.540 14.976 1.00 1.04 H new ATOM 0 HB3 ASP A 710 7.117 6.952 13.275 1.00 1.04 H new ATOM 1899 N ASN A 711 6.401 10.481 13.945 1.00 40.02 N ATOM 1900 CA ASN A 711 6.360 11.692 13.115 1.00 24.13 C ATOM 1901 C ASN A 711 6.937 11.457 11.737 1.00 40.43 C ATOM 1902 O ASN A 711 6.484 12.059 10.758 1.00 51.24 O ATOM 1903 CB ASN A 711 7.101 12.866 13.778 1.00 73.24 C ATOM 1904 CG ASN A 711 6.439 13.374 15.044 1.00 34.13 C ATOM 1905 OD1 ASN A 711 5.775 12.630 15.770 1.00 2.51 O ATOM 1906 ND2 ASN A 711 6.612 14.637 15.321 1.00 45.44 N ATOM 0 H ASN A 711 6.932 10.587 14.810 1.00 40.02 H new ATOM 0 HA ASN A 711 5.305 11.949 13.015 1.00 24.13 H new ATOM 0 HB2 ASN A 711 8.119 12.555 14.012 1.00 73.24 H new ATOM 0 HB3 ASN A 711 7.175 13.686 13.064 1.00 73.24 H new ATOM 0 HD21 ASN A 711 6.192 15.037 16.160 1.00 45.44 H new ATOM 0 HD22 ASN A 711 7.167 15.224 14.699 1.00 45.44 H new ATOM 1912 N SER A 712 7.912 10.579 11.647 1.00 32.41 N ATOM 1913 CA SER A 712 8.555 10.323 10.402 1.00 50.03 C ATOM 1914 C SER A 712 8.131 8.981 9.795 1.00 51.22 C ATOM 1915 O SER A 712 8.619 8.588 8.724 1.00 3.21 O ATOM 1916 CB SER A 712 10.076 10.458 10.536 1.00 71.45 C ATOM 1917 OG SER A 712 10.735 10.250 9.294 1.00 22.44 O ATOM 0 H SER A 712 8.269 10.034 12.432 1.00 32.41 H new ATOM 0 HA SER A 712 8.224 11.083 9.695 1.00 50.03 H new ATOM 0 HB2 SER A 712 10.321 11.450 10.916 1.00 71.45 H new ATOM 0 HB3 SER A 712 10.442 9.737 11.267 1.00 71.45 H new ATOM 0 HG SER A 712 10.167 9.706 8.709 1.00 22.44 H new ATOM 1923 N THR A 713 7.225 8.292 10.450 1.00 13.11 N ATOM 1924 CA THR A 713 6.744 7.033 9.948 1.00 24.25 C ATOM 1925 C THR A 713 5.222 7.061 9.822 1.00 1.35 C ATOM 1926 O THR A 713 4.479 6.976 10.824 1.00 63.54 O ATOM 1927 CB THR A 713 7.193 5.869 10.837 1.00 64.44 C ATOM 1928 OG1 THR A 713 8.614 5.974 11.025 1.00 52.24 O ATOM 1929 CG2 THR A 713 6.885 4.533 10.166 1.00 20.03 C ATOM 0 H THR A 713 6.808 8.586 11.333 1.00 13.11 H new ATOM 0 HA THR A 713 7.175 6.877 8.959 1.00 24.25 H new ATOM 0 HB THR A 713 6.664 5.914 11.789 1.00 64.44 H new ATOM 0 HG1 THR A 713 8.924 5.239 11.594 1.00 52.24 H new ATOM 0 HG21 THR A 713 7.211 3.718 10.812 1.00 20.03 H new ATOM 0 HG22 THR A 713 5.812 4.452 9.992 1.00 20.03 H new ATOM 0 HG23 THR A 713 7.412 4.474 9.214 1.00 20.03 H new ATOM 1935 N TYR A 714 4.765 7.207 8.609 1.00 1.02 N ATOM 1936 CA TYR A 714 3.364 7.275 8.324 1.00 63.05 C ATOM 1937 C TYR A 714 2.767 5.891 8.328 1.00 35.15 C ATOM 1938 O TYR A 714 2.839 5.166 7.346 1.00 20.35 O ATOM 1939 CB TYR A 714 3.088 7.984 6.981 1.00 72.15 C ATOM 1940 CG TYR A 714 3.432 9.470 6.937 1.00 1.22 C ATOM 1941 CD1 TYR A 714 4.672 9.935 7.331 1.00 41.55 C ATOM 1942 CD2 TYR A 714 2.510 10.404 6.467 1.00 1.53 C ATOM 1943 CE1 TYR A 714 4.985 11.265 7.263 1.00 14.12 C ATOM 1944 CE2 TYR A 714 2.823 11.744 6.404 1.00 71.12 C ATOM 1945 CZ TYR A 714 4.063 12.166 6.803 1.00 42.44 C ATOM 1946 OH TYR A 714 4.399 13.498 6.720 1.00 74.14 O ATOM 0 H TYR A 714 5.362 7.282 7.785 1.00 1.02 H new ATOM 0 HA TYR A 714 2.891 7.868 9.107 1.00 63.05 H new ATOM 0 HB2 TYR A 714 3.652 7.475 6.199 1.00 72.15 H new ATOM 0 HB3 TYR A 714 2.032 7.867 6.739 1.00 72.15 H new ATOM 0 HD1 TYR A 714 5.408 9.236 7.699 1.00 41.55 H new ATOM 0 HD2 TYR A 714 1.534 10.071 6.147 1.00 1.53 H new ATOM 0 HE1 TYR A 714 5.962 11.605 7.573 1.00 14.12 H new ATOM 0 HE2 TYR A 714 2.096 12.456 6.043 1.00 71.12 H new ATOM 0 HH TYR A 714 5.214 13.663 7.239 1.00 74.14 H new ATOM 1956 N ASN A 715 2.275 5.500 9.468 1.00 34.40 N ATOM 1957 CA ASN A 715 1.589 4.241 9.604 1.00 71.02 C ATOM 1958 C ASN A 715 0.233 4.303 9.015 1.00 22.34 C ATOM 1959 O ASN A 715 -0.481 5.300 9.177 1.00 10.32 O ATOM 1960 CB ASN A 715 1.519 3.782 11.050 1.00 35.23 C ATOM 1961 CG ASN A 715 2.827 3.227 11.551 1.00 3.33 C ATOM 1962 OD1 ASN A 715 3.684 3.974 12.008 1.00 65.55 O ATOM 1963 ND2 ASN A 715 2.963 1.907 11.513 1.00 0.55 N ATOM 0 H ASN A 715 2.336 6.042 10.330 1.00 34.40 H new ATOM 0 HA ASN A 715 2.173 3.504 9.052 1.00 71.02 H new ATOM 0 HB2 ASN A 715 1.221 4.621 11.679 1.00 35.23 H new ATOM 0 HB3 ASN A 715 0.745 3.020 11.147 1.00 35.23 H new ATOM 0 HD21 ASN A 715 3.811 1.471 11.875 1.00 0.55 H new ATOM 0 HD22 ASN A 715 2.219 1.329 11.122 1.00 0.55 H new ATOM 1969 N PHE A 716 -0.108 3.278 8.308 1.00 72.43 N ATOM 1970 CA PHE A 716 -1.395 3.128 7.715 1.00 14.20 C ATOM 1971 C PHE A 716 -2.016 1.835 8.139 1.00 22.23 C ATOM 1972 O PHE A 716 -1.403 0.763 8.028 1.00 61.52 O ATOM 1973 CB PHE A 716 -1.332 3.254 6.191 1.00 54.11 C ATOM 1974 CG PHE A 716 -1.150 4.670 5.725 1.00 74.13 C ATOM 1975 CD1 PHE A 716 0.109 5.218 5.582 1.00 70.30 C ATOM 1976 CD2 PHE A 716 -2.252 5.460 5.443 1.00 65.50 C ATOM 1977 CE1 PHE A 716 0.267 6.526 5.165 1.00 43.21 C ATOM 1978 CE2 PHE A 716 -2.100 6.766 5.028 1.00 44.31 C ATOM 1979 CZ PHE A 716 -0.839 7.298 4.889 1.00 74.21 C ATOM 0 H PHE A 716 0.521 2.497 8.121 1.00 72.43 H new ATOM 0 HA PHE A 716 -2.030 3.940 8.070 1.00 14.20 H new ATOM 0 HB2 PHE A 716 -0.509 2.645 5.816 1.00 54.11 H new ATOM 0 HB3 PHE A 716 -2.249 2.851 5.761 1.00 54.11 H new ATOM 0 HD1 PHE A 716 0.980 4.618 5.798 1.00 70.30 H new ATOM 0 HD2 PHE A 716 -3.244 5.047 5.550 1.00 65.50 H new ATOM 0 HE1 PHE A 716 1.257 6.942 5.056 1.00 43.21 H new ATOM 0 HE2 PHE A 716 -2.969 7.370 4.813 1.00 44.31 H new ATOM 0 HZ PHE A 716 -0.717 8.321 4.564 1.00 74.21 H new ATOM 1989 N ARG A 717 -3.209 1.932 8.637 1.00 1.12 N ATOM 1990 CA ARG A 717 -3.939 0.798 9.088 1.00 73.41 C ATOM 1991 C ARG A 717 -4.822 0.360 7.937 1.00 71.44 C ATOM 1992 O ARG A 717 -5.725 1.077 7.524 1.00 52.32 O ATOM 1993 CB ARG A 717 -4.769 1.167 10.329 1.00 15.23 C ATOM 1994 CG ARG A 717 -5.466 -0.010 11.002 1.00 34.22 C ATOM 1995 CD ARG A 717 -4.472 -1.034 11.564 1.00 54.20 C ATOM 1996 NE ARG A 717 -3.596 -0.465 12.604 1.00 63.32 N ATOM 1997 CZ ARG A 717 -2.804 -1.170 13.440 1.00 71.25 C ATOM 1998 NH1 ARG A 717 -2.772 -2.497 13.385 1.00 31.10 N ATOM 1999 NH2 ARG A 717 -2.062 -0.533 14.337 1.00 71.40 N ATOM 0 H ARG A 717 -3.707 2.816 8.741 1.00 1.12 H new ATOM 0 HA ARG A 717 -3.276 -0.016 9.381 1.00 73.41 H new ATOM 0 HB2 ARG A 717 -4.116 1.649 11.056 1.00 15.23 H new ATOM 0 HB3 ARG A 717 -5.522 1.901 10.041 1.00 15.23 H new ATOM 0 HG2 ARG A 717 -6.099 0.359 11.809 1.00 34.22 H new ATOM 0 HG3 ARG A 717 -6.121 -0.501 10.282 1.00 34.22 H new ATOM 0 HD2 ARG A 717 -5.022 -1.878 11.980 1.00 54.20 H new ATOM 0 HD3 ARG A 717 -3.859 -1.423 10.751 1.00 54.20 H new ATOM 0 HE ARG A 717 -3.587 0.550 12.701 1.00 63.32 H new ATOM 0 HH11 ARG A 717 -3.349 -2.993 12.706 1.00 31.10 H new ATOM 0 HH12 ARG A 717 -2.170 -3.019 14.021 1.00 31.10 H new ATOM 0 HH21 ARG A 717 -2.091 0.485 14.393 1.00 71.40 H new ATOM 0 HH22 ARG A 717 -1.462 -1.061 14.971 1.00 71.40 H new ATOM 2011 N TRP A 718 -4.518 -0.770 7.405 1.00 20.24 N ATOM 2012 CA TRP A 718 -5.173 -1.282 6.235 1.00 34.32 C ATOM 2013 C TRP A 718 -5.888 -2.574 6.607 1.00 60.33 C ATOM 2014 O TRP A 718 -5.298 -3.457 7.239 1.00 73.52 O ATOM 2015 CB TRP A 718 -4.084 -1.558 5.178 1.00 61.40 C ATOM 2016 CG TRP A 718 -4.549 -1.879 3.778 1.00 51.30 C ATOM 2017 CD1 TRP A 718 -5.492 -2.785 3.397 1.00 45.22 C ATOM 2018 CD2 TRP A 718 -4.023 -1.324 2.561 1.00 30.15 C ATOM 2019 NE1 TRP A 718 -5.602 -2.800 2.032 1.00 74.34 N ATOM 2020 CE2 TRP A 718 -4.715 -1.922 1.501 1.00 34.53 C ATOM 2021 CE3 TRP A 718 -3.039 -0.369 2.266 1.00 11.21 C ATOM 2022 CZ2 TRP A 718 -4.464 -1.606 0.182 1.00 33.43 C ATOM 2023 CZ3 TRP A 718 -2.790 -0.061 0.950 1.00 41.32 C ATOM 2024 CH2 TRP A 718 -3.500 -0.676 -0.074 1.00 20.02 C ATOM 0 H TRP A 718 -3.792 -1.385 7.773 1.00 20.24 H new ATOM 0 HA TRP A 718 -5.903 -0.575 5.841 1.00 34.32 H new ATOM 0 HB2 TRP A 718 -3.434 -0.685 5.126 1.00 61.40 H new ATOM 0 HB3 TRP A 718 -3.474 -2.389 5.531 1.00 61.40 H new ATOM 0 HD1 TRP A 718 -6.068 -3.401 4.072 1.00 45.22 H new ATOM 0 HE1 TRP A 718 -6.249 -3.380 1.498 1.00 74.34 H new ATOM 0 HE3 TRP A 718 -2.487 0.115 3.058 1.00 11.21 H new ATOM 0 HZ2 TRP A 718 -5.012 -2.079 -0.620 1.00 33.43 H new ATOM 0 HZ3 TRP A 718 -2.032 0.669 0.708 1.00 41.32 H new ATOM 0 HH2 TRP A 718 -3.283 -0.411 -1.098 1.00 20.02 H new ATOM 2035 N TYR A 719 -7.138 -2.671 6.254 1.00 52.11 N ATOM 2036 CA TYR A 719 -7.903 -3.878 6.487 1.00 44.21 C ATOM 2037 C TYR A 719 -8.213 -4.506 5.151 1.00 33.34 C ATOM 2038 O TYR A 719 -8.969 -3.950 4.368 1.00 23.14 O ATOM 2039 CB TYR A 719 -9.192 -3.571 7.249 1.00 33.04 C ATOM 2040 CG TYR A 719 -8.962 -2.921 8.594 1.00 63.45 C ATOM 2041 CD1 TYR A 719 -8.580 -3.673 9.690 1.00 51.33 C ATOM 2042 CD2 TYR A 719 -9.119 -1.553 8.761 1.00 75.43 C ATOM 2043 CE1 TYR A 719 -8.362 -3.085 10.919 1.00 13.21 C ATOM 2044 CE2 TYR A 719 -8.904 -0.956 9.983 1.00 72.23 C ATOM 2045 CZ TYR A 719 -8.528 -1.726 11.060 1.00 34.44 C ATOM 2046 OH TYR A 719 -8.311 -1.130 12.282 1.00 0.45 O ATOM 0 H TYR A 719 -7.660 -1.923 5.798 1.00 52.11 H new ATOM 0 HA TYR A 719 -7.322 -4.568 7.099 1.00 44.21 H new ATOM 0 HB2 TYR A 719 -9.816 -2.916 6.641 1.00 33.04 H new ATOM 0 HB3 TYR A 719 -9.748 -4.497 7.393 1.00 33.04 H new ATOM 0 HD1 TYR A 719 -8.450 -4.740 9.582 1.00 51.33 H new ATOM 0 HD2 TYR A 719 -9.415 -0.946 7.918 1.00 75.43 H new ATOM 0 HE1 TYR A 719 -8.063 -3.687 11.764 1.00 13.21 H new ATOM 0 HE2 TYR A 719 -9.030 0.111 10.096 1.00 72.23 H new ATOM 0 HH TYR A 719 -8.471 -0.166 12.209 1.00 0.45 H new ATOM 2056 N THR A 720 -7.602 -5.628 4.878 1.00 11.03 N ATOM 2057 CA THR A 720 -7.743 -6.287 3.607 1.00 45.05 C ATOM 2058 C THR A 720 -7.994 -7.773 3.768 1.00 54.41 C ATOM 2059 O THR A 720 -7.445 -8.418 4.668 1.00 72.23 O ATOM 2060 CB THR A 720 -6.512 -6.045 2.685 1.00 74.41 C ATOM 2061 OG1 THR A 720 -6.654 -6.753 1.453 1.00 45.02 O ATOM 2062 CG2 THR A 720 -5.227 -6.461 3.348 1.00 72.34 C ATOM 0 H THR A 720 -6.990 -6.113 5.534 1.00 11.03 H new ATOM 0 HA THR A 720 -8.616 -5.844 3.127 1.00 45.05 H new ATOM 0 HB THR A 720 -6.470 -4.974 2.489 1.00 74.41 H new ATOM 0 HG1 THR A 720 -7.598 -6.769 1.192 1.00 45.02 H new ATOM 0 HG21 THR A 720 -4.392 -6.276 2.672 1.00 72.34 H new ATOM 0 HG22 THR A 720 -5.087 -5.886 4.263 1.00 72.34 H new ATOM 0 HG23 THR A 720 -5.270 -7.523 3.590 1.00 72.34 H new ATOM 2068 N SER A 721 -8.826 -8.310 2.897 1.00 72.41 N ATOM 2069 CA SER A 721 -9.139 -9.716 2.889 1.00 12.33 C ATOM 2070 C SER A 721 -7.905 -10.530 2.453 1.00 40.11 C ATOM 2071 O SER A 721 -7.741 -11.698 2.833 1.00 42.44 O ATOM 2072 CB SER A 721 -10.301 -9.969 1.929 1.00 2.20 C ATOM 2073 OG SER A 721 -11.458 -9.223 2.307 1.00 24.21 O ATOM 0 H SER A 721 -9.304 -7.775 2.172 1.00 72.41 H new ATOM 0 HA SER A 721 -9.425 -10.029 3.893 1.00 12.33 H new ATOM 0 HB2 SER A 721 -10.005 -9.696 0.916 1.00 2.20 H new ATOM 0 HB3 SER A 721 -10.540 -11.032 1.916 1.00 2.20 H new ATOM 0 HG SER A 721 -12.253 -9.623 1.898 1.00 24.21 H new ATOM 2079 N TYR A 722 -7.023 -9.883 1.685 1.00 51.15 N ATOM 2080 CA TYR A 722 -5.820 -10.522 1.149 1.00 73.42 C ATOM 2081 C TYR A 722 -4.768 -10.810 2.206 1.00 64.15 C ATOM 2082 O TYR A 722 -3.796 -11.521 1.940 1.00 34.21 O ATOM 2083 CB TYR A 722 -5.216 -9.713 0.001 1.00 15.20 C ATOM 2084 CG TYR A 722 -6.041 -9.728 -1.262 1.00 20.35 C ATOM 2085 CD1 TYR A 722 -7.021 -8.779 -1.499 1.00 11.12 C ATOM 2086 CD2 TYR A 722 -5.826 -10.701 -2.220 1.00 2.00 C ATOM 2087 CE1 TYR A 722 -7.766 -8.803 -2.664 1.00 20.30 C ATOM 2088 CE2 TYR A 722 -6.560 -10.731 -3.380 1.00 73.25 C ATOM 2089 CZ TYR A 722 -7.528 -9.784 -3.600 1.00 61.11 C ATOM 2090 OH TYR A 722 -8.260 -9.816 -4.769 1.00 21.14 O ATOM 0 H TYR A 722 -7.124 -8.904 1.419 1.00 51.15 H new ATOM 0 HA TYR A 722 -6.150 -11.486 0.762 1.00 73.42 H new ATOM 0 HB2 TYR A 722 -5.087 -8.681 0.326 1.00 15.20 H new ATOM 0 HB3 TYR A 722 -4.223 -10.103 -0.222 1.00 15.20 H new ATOM 0 HD1 TYR A 722 -7.206 -8.010 -0.764 1.00 11.12 H new ATOM 0 HD2 TYR A 722 -5.067 -11.451 -2.053 1.00 2.00 H new ATOM 0 HE1 TYR A 722 -8.528 -8.058 -2.838 1.00 20.30 H new ATOM 0 HE2 TYR A 722 -6.376 -11.498 -4.117 1.00 73.25 H new ATOM 0 HH TYR A 722 -7.965 -10.571 -5.319 1.00 21.14 H new ATOM 2100 N ALA A 723 -4.944 -10.259 3.395 1.00 5.11 N ATOM 2101 CA ALA A 723 -4.017 -10.512 4.483 1.00 14.23 C ATOM 2102 C ALA A 723 -4.238 -11.917 5.108 1.00 44.24 C ATOM 2103 O ALA A 723 -3.529 -12.316 6.033 1.00 73.25 O ATOM 2104 CB ALA A 723 -4.096 -9.405 5.520 1.00 52.42 C ATOM 0 H ALA A 723 -5.717 -9.636 3.630 1.00 5.11 H new ATOM 0 HA ALA A 723 -3.006 -10.510 4.076 1.00 14.23 H new ATOM 0 HB1 ALA A 723 -3.394 -9.612 6.328 1.00 52.42 H new ATOM 0 HB2 ALA A 723 -3.843 -8.452 5.055 1.00 52.42 H new ATOM 0 HB3 ALA A 723 -5.108 -9.355 5.923 1.00 52.42 H new ATOM 2110 N CYS A 724 -5.234 -12.639 4.611 1.00 41.01 N ATOM 2111 CA CYS A 724 -5.460 -14.024 4.998 1.00 2.01 C ATOM 2112 C CYS A 724 -5.125 -14.934 3.817 1.00 45.32 C ATOM 2113 O CYS A 724 -5.192 -14.489 2.668 1.00 72.31 O ATOM 2114 CB CYS A 724 -6.921 -14.275 5.421 1.00 53.03 C ATOM 2115 SG CYS A 724 -7.430 -13.504 6.984 1.00 3.40 S ATOM 0 H CYS A 724 -5.905 -12.282 3.931 1.00 41.01 H new ATOM 0 HA CYS A 724 -4.819 -14.240 5.853 1.00 2.01 H new ATOM 0 HB2 CYS A 724 -7.577 -13.914 4.628 1.00 53.03 H new ATOM 0 HB3 CYS A 724 -7.078 -15.351 5.500 1.00 53.03 H new ATOM 2120 N PRO A 725 -4.732 -16.196 4.061 1.00 41.13 N ATOM 2121 CA PRO A 725 -4.485 -17.153 2.992 1.00 61.00 C ATOM 2122 C PRO A 725 -5.807 -17.704 2.451 1.00 55.11 C ATOM 2123 O PRO A 725 -6.336 -17.149 1.483 1.00 38.10 O ATOM 2124 CB PRO A 725 -3.668 -18.275 3.675 1.00 3.23 C ATOM 2125 CG PRO A 725 -3.415 -17.797 5.074 1.00 32.01 C ATOM 2126 CD PRO A 725 -4.477 -16.787 5.372 1.00 33.22 C ATOM 2127 OXT PRO A 725 -6.339 -18.683 3.031 1.00 38.10 O ATOM 0 HA PRO A 725 -3.964 -16.711 2.143 1.00 61.00 H new ATOM 0 HB2 PRO A 725 -4.219 -19.216 3.676 1.00 3.23 H new ATOM 0 HB3 PRO A 725 -2.731 -18.455 3.147 1.00 3.23 H new ATOM 0 HG2 PRO A 725 -3.457 -18.625 5.781 1.00 32.01 H new ATOM 0 HG3 PRO A 725 -2.423 -17.354 5.160 1.00 32.01 H new ATOM 0 HD2 PRO A 725 -5.371 -17.250 5.789 1.00 33.22 H new ATOM 0 HD3 PRO A 725 -4.138 -16.043 6.093 1.00 33.22 H new TER 2135 PRO A 725