USER MOD reduce.3.24.130724 H: found=0, std=0, add=811, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 805 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 693 HIS : no HE2:sc= 0.34 K(o=0.84,f=-0.59) USER MOD Set 1.2: A 695 HIS : no HE2:sc= 0.501 K(o=0.84,f=-3.9!) USER MOD Set 2.1: A 623 LYS NZ :NH3+ 170:sc= 0.446 (180deg=0) USER MOD Set 2.2: A 624 GLN : amide:sc= 0.637 K(o=1.1,f=-0.76) USER MOD Set 3.1: A 609 GLN : amide:sc= -1.81 K(o=-1.8,f=-2.6!) USER MOD Set 3.2: A 620 ASN : amide:sc= -0.0257 X(o=-1.8,f=-2) USER MOD Single : A 595 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 596 GLN : amide:sc= 0.902 K(o=0.9,f=-5.4!) USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 605 LYS NZ :NH3+ 179:sc= 1.77 (180deg=1.75) USER MOD Single : A 610 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 615 ASN : amide:sc= 0.598 K(o=0.6,f=-0.26) USER MOD Single : A 616 SER OG : rot 76:sc= 0.702 USER MOD Single : A 618 LYS NZ :NH3+ -148:sc= 2.27 (180deg=0.0645) USER MOD Single : A 629 SER OG : rot 180:sc= -0.258 USER MOD Single : A 633 HIS : no HE2:sc= 0.112 K(o=0.11,f=-3.4!) USER MOD Single : A 634 TYR OH : rot 94:sc= 1.25 USER MOD Single : A 638 TYR OH : rot 49:sc= 0.896 USER MOD Single : A 642 SER OG : rot 80:sc= 0.784 USER MOD Single : A 643 SER OG : rot 180:sc= 0 USER MOD Single : A 646 LYS NZ :NH3+ 165:sc= 1.28 (180deg=1.25) USER MOD Single : A 653 SER OG : rot 180:sc= 0 USER MOD Single : A 655 SER OG : rot -75:sc= 0.695 USER MOD Single : A 657 HIS : no HD1:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 659 MET CE :methyl 167:sc= -0.585 (180deg=-0.956) USER MOD Single : A 661 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 662 SER OG : rot -61:sc= 0.041 USER MOD Single : A 666 ASN : amide:sc= 0.415 K(o=0.41,f=-3.3!) USER MOD Single : A 669 TYR OH : rot -15:sc= -0.0452 USER MOD Single : A 672 TYR OH : rot 180:sc= 0 USER MOD Single : A 677 ASN : amide:sc= 0.73 K(o=0.73,f=-8.5!) USER MOD Single : A 678 GLN : amide:sc= 0.598 K(o=0.6,f=-6.1!) USER MOD Single : A 679 GLN : amide:sc= -0.839 K(o=-0.84,f=-1.9) USER MOD Single : A 681 LYS NZ :NH3+ -164:sc= 1.01 (180deg=0.902) USER MOD Single : A 682 SER OG : rot 83:sc= 1.19 USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 686 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 691 THR OG1 : rot -112:sc= 0.271 USER MOD Single : A 692 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 694 HIS : no HD1:sc=-0.00508 X(o=-0.0051,f=-0.0051) USER MOD Single : A 696 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.15) USER MOD Single : A 697 HIS : no HE2:sc= -0.978! C(o=-0.98!,f=-4.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 595 4.206 -0.213 -0.146 1.00 25.00 N ATOM 2 CA MET A 595 3.511 -0.283 -1.465 1.00 25.00 C ATOM 3 C MET A 595 3.364 -1.731 -1.945 1.00 25.00 C ATOM 4 O MET A 595 2.853 -1.968 -3.016 1.00 25.00 O ATOM 5 CB MET A 595 4.275 0.546 -2.516 1.00 25.00 C ATOM 6 CG MET A 595 5.808 0.484 -2.414 1.00 25.00 C ATOM 7 SD MET A 595 6.486 -1.190 -2.497 1.00 25.00 S ATOM 8 CE MET A 595 6.220 -1.618 -4.254 1.00 25.00 C ATOM 0 HA MET A 595 2.512 0.133 -1.336 1.00 25.00 H new ATOM 0 HB2 MET A 595 3.979 0.205 -3.508 1.00 25.00 H new ATOM 0 HB3 MET A 595 3.963 1.587 -2.430 1.00 25.00 H new ATOM 0 HG2 MET A 595 6.239 1.079 -3.219 1.00 25.00 H new ATOM 0 HG3 MET A 595 6.118 0.944 -1.476 1.00 25.00 H new ATOM 0 HE1 MET A 595 6.592 -2.625 -4.444 1.00 25.00 H new ATOM 0 HE2 MET A 595 5.155 -1.576 -4.481 1.00 25.00 H new ATOM 0 HE3 MET A 595 6.754 -0.909 -4.886 1.00 25.00 H new ATOM 20 N GLN A 596 3.799 -2.703 -1.153 1.00 25.00 N ATOM 21 CA GLN A 596 3.757 -4.112 -1.558 1.00 25.00 C ATOM 22 C GLN A 596 2.386 -4.683 -2.000 1.00 25.00 C ATOM 23 O GLN A 596 2.339 -5.449 -2.953 1.00 25.00 O ATOM 24 CB GLN A 596 4.313 -4.984 -0.420 1.00 25.00 C ATOM 25 CG GLN A 596 5.743 -4.621 0.017 1.00 25.00 C ATOM 26 CD GLN A 596 5.778 -3.701 1.233 1.00 25.00 C ATOM 27 OE1 GLN A 596 5.235 -2.593 1.211 1.00 25.00 O ATOM 28 NE2 GLN A 596 6.399 -4.150 2.288 1.00 25.00 N ATOM 0 H GLN A 596 4.187 -2.546 -0.223 1.00 25.00 H new ATOM 0 HA GLN A 596 4.368 -4.143 -2.460 1.00 25.00 H new ATOM 0 HB2 GLN A 596 3.651 -4.901 0.442 1.00 25.00 H new ATOM 0 HB3 GLN A 596 4.296 -6.027 -0.736 1.00 25.00 H new ATOM 0 HG2 GLN A 596 6.291 -5.535 0.244 1.00 25.00 H new ATOM 0 HG3 GLN A 596 6.259 -4.138 -0.813 1.00 25.00 H new ATOM 0 HE21 GLN A 596 6.836 -5.071 2.269 1.00 25.00 H new ATOM 0 HE22 GLN A 596 6.448 -3.580 3.132 1.00 25.00 H new ATOM 37 N PRO A 597 1.266 -4.334 -1.321 1.00 25.00 N ATOM 38 CA PRO A 597 0.039 -4.973 -1.821 1.00 25.00 C ATOM 39 C PRO A 597 -0.578 -4.356 -3.086 1.00 25.00 C ATOM 40 O PRO A 597 -1.561 -4.883 -3.603 1.00 25.00 O ATOM 41 CB PRO A 597 -0.920 -4.805 -0.642 1.00 25.00 C ATOM 42 CG PRO A 597 -0.542 -3.505 -0.069 1.00 25.00 C ATOM 43 CD PRO A 597 0.968 -3.478 -0.150 1.00 25.00 C ATOM 0 HA PRO A 597 0.249 -5.996 -2.132 1.00 25.00 H new ATOM 0 HB2 PRO A 597 -1.960 -4.812 -0.968 1.00 25.00 H new ATOM 0 HB3 PRO A 597 -0.808 -5.611 0.084 1.00 25.00 H new ATOM 0 HG2 PRO A 597 -0.984 -2.681 -0.629 1.00 25.00 H new ATOM 0 HG3 PRO A 597 -0.886 -3.411 0.961 1.00 25.00 H new ATOM 0 HD2 PRO A 597 1.345 -2.464 -0.287 1.00 25.00 H new ATOM 0 HD3 PRO A 597 1.426 -3.868 0.759 1.00 25.00 H new ATOM 51 N VAL A 598 -0.030 -3.252 -3.581 1.00 25.00 N ATOM 52 CA VAL A 598 -0.601 -2.583 -4.752 1.00 25.00 C ATOM 53 C VAL A 598 0.298 -2.796 -5.967 1.00 25.00 C ATOM 54 O VAL A 598 1.504 -2.569 -5.925 1.00 25.00 O ATOM 55 CB VAL A 598 -0.900 -1.048 -4.491 1.00 25.00 C ATOM 56 CG1 VAL A 598 -0.076 -0.486 -3.326 1.00 25.00 C ATOM 57 CG2 VAL A 598 -0.668 -0.194 -5.755 1.00 25.00 C ATOM 0 H VAL A 598 0.801 -2.802 -3.197 1.00 25.00 H new ATOM 0 HA VAL A 598 -1.569 -3.039 -4.958 1.00 25.00 H new ATOM 0 HB VAL A 598 -1.954 -0.990 -4.221 1.00 25.00 H new ATOM 0 HG11 VAL A 598 -0.316 0.568 -3.186 1.00 25.00 H new ATOM 0 HG12 VAL A 598 -0.312 -1.036 -2.415 1.00 25.00 H new ATOM 0 HG13 VAL A 598 0.986 -0.590 -3.548 1.00 25.00 H new ATOM 0 HG21 VAL A 598 -0.884 0.851 -5.533 1.00 25.00 H new ATOM 0 HG22 VAL A 598 0.370 -0.290 -6.074 1.00 25.00 H new ATOM 0 HG23 VAL A 598 -1.326 -0.539 -6.553 1.00 25.00 H new ATOM 67 N ARG A 599 -0.322 -3.250 -7.050 1.00 25.00 N ATOM 68 CA ARG A 599 0.368 -3.485 -8.316 1.00 25.00 C ATOM 69 C ARG A 599 0.266 -2.227 -9.177 1.00 25.00 C ATOM 70 O ARG A 599 -0.613 -1.387 -8.953 1.00 25.00 O ATOM 71 CB ARG A 599 -0.277 -4.673 -9.046 1.00 25.00 C ATOM 72 CG ARG A 599 -1.695 -4.376 -9.531 1.00 25.00 C ATOM 73 CD ARG A 599 -2.435 -5.614 -10.002 1.00 25.00 C ATOM 74 NE ARG A 599 -3.055 -6.323 -8.867 1.00 25.00 N ATOM 75 CZ ARG A 599 -4.133 -7.097 -8.941 1.00 25.00 C ATOM 76 NH1 ARG A 599 -4.762 -7.320 -10.069 1.00 25.00 N ATOM 77 NH2 ARG A 599 -4.592 -7.652 -7.853 1.00 25.00 N ATOM 0 H ARG A 599 -1.318 -3.466 -7.077 1.00 25.00 H new ATOM 0 HA ARG A 599 1.417 -3.716 -8.128 1.00 25.00 H new ATOM 0 HB2 ARG A 599 0.343 -4.948 -9.899 1.00 25.00 H new ATOM 0 HB3 ARG A 599 -0.300 -5.534 -8.378 1.00 25.00 H new ATOM 0 HG2 ARG A 599 -2.258 -3.909 -8.723 1.00 25.00 H new ATOM 0 HG3 ARG A 599 -1.650 -3.655 -10.347 1.00 25.00 H new ATOM 0 HD2 ARG A 599 -3.203 -5.331 -10.722 1.00 25.00 H new ATOM 0 HD3 ARG A 599 -1.744 -6.281 -10.518 1.00 25.00 H new ATOM 0 HE ARG A 599 -2.621 -6.210 -7.951 1.00 25.00 H new ATOM 0 HH11 ARG A 599 -4.427 -6.893 -10.933 1.00 25.00 H new ATOM 0 HH12 ARG A 599 -5.586 -7.921 -10.083 1.00 25.00 H new ATOM 0 HH21 ARG A 599 -4.124 -7.489 -6.961 1.00 25.00 H new ATOM 0 HH22 ARG A 599 -5.418 -8.248 -7.894 1.00 25.00 H new ATOM 91 N GLU A 600 1.147 -2.114 -10.158 1.00 25.00 N ATOM 92 CA GLU A 600 1.142 -0.972 -11.073 1.00 25.00 C ATOM 93 C GLU A 600 -0.138 -0.984 -11.921 1.00 25.00 C ATOM 94 O GLU A 600 -0.720 -2.051 -12.160 1.00 25.00 O ATOM 95 CB GLU A 600 2.365 -1.034 -12.002 1.00 25.00 C ATOM 96 CG GLU A 600 3.706 -0.880 -11.301 1.00 25.00 C ATOM 97 CD GLU A 600 3.969 0.555 -10.888 1.00 25.00 C ATOM 98 OE1 GLU A 600 3.326 1.021 -9.922 1.00 25.00 O ATOM 99 OE2 GLU A 600 4.809 1.225 -11.533 1.00 25.00 O ATOM 0 H GLU A 600 1.879 -2.799 -10.346 1.00 25.00 H new ATOM 0 HA GLU A 600 1.180 -0.055 -10.485 1.00 25.00 H new ATOM 0 HB2 GLU A 600 2.354 -1.987 -12.531 1.00 25.00 H new ATOM 0 HB3 GLU A 600 2.272 -0.251 -12.755 1.00 25.00 H new ATOM 0 HG2 GLU A 600 3.730 -1.521 -10.420 1.00 25.00 H new ATOM 0 HG3 GLU A 600 4.503 -1.218 -11.964 1.00 25.00 H new ATOM 106 N PRO A 601 -0.602 0.195 -12.377 1.00 25.00 N ATOM 107 CA PRO A 601 -1.819 0.205 -13.200 1.00 25.00 C ATOM 108 C PRO A 601 -1.657 -0.415 -14.591 1.00 25.00 C ATOM 109 O PRO A 601 -0.573 -0.451 -15.174 1.00 25.00 O ATOM 110 CB PRO A 601 -2.144 1.697 -13.310 1.00 25.00 C ATOM 111 CG PRO A 601 -0.839 2.373 -13.161 1.00 25.00 C ATOM 112 CD PRO A 601 -0.076 1.559 -12.171 1.00 25.00 C ATOM 0 HA PRO A 601 -2.600 -0.404 -12.746 1.00 25.00 H new ATOM 0 HB2 PRO A 601 -2.606 1.933 -14.269 1.00 25.00 H new ATOM 0 HB3 PRO A 601 -2.843 2.009 -12.534 1.00 25.00 H new ATOM 0 HG2 PRO A 601 -0.313 2.424 -14.114 1.00 25.00 H new ATOM 0 HG3 PRO A 601 -0.966 3.398 -12.811 1.00 25.00 H new ATOM 0 HD2 PRO A 601 0.998 1.608 -12.352 1.00 25.00 H new ATOM 0 HD3 PRO A 601 -0.243 1.905 -11.151 1.00 25.00 H new ATOM 120 N SER A 602 -2.772 -0.895 -15.111 1.00 25.00 N ATOM 121 CA SER A 602 -2.853 -1.486 -16.439 1.00 25.00 C ATOM 122 C SER A 602 -2.802 -0.378 -17.484 1.00 25.00 C ATOM 123 O SER A 602 -3.129 0.774 -17.199 1.00 25.00 O ATOM 124 CB SER A 602 -4.141 -2.297 -16.586 1.00 25.00 C ATOM 125 OG SER A 602 -4.146 -3.030 -17.802 1.00 25.00 O ATOM 0 H SER A 602 -3.664 -0.886 -14.615 1.00 25.00 H new ATOM 0 HA SER A 602 -2.010 -2.161 -16.585 1.00 25.00 H new ATOM 0 HB2 SER A 602 -4.241 -2.982 -15.744 1.00 25.00 H new ATOM 0 HB3 SER A 602 -5.001 -1.628 -16.557 1.00 25.00 H new ATOM 0 HG SER A 602 -4.979 -3.542 -17.872 1.00 25.00 H new ATOM 131 N ALA A 603 -2.366 -0.727 -18.687 1.00 25.00 N ATOM 132 CA ALA A 603 -2.252 0.237 -19.777 1.00 25.00 C ATOM 133 C ALA A 603 -3.607 0.923 -20.045 1.00 25.00 C ATOM 134 O ALA A 603 -4.671 0.296 -19.909 1.00 25.00 O ATOM 135 CB ALA A 603 -1.765 -0.481 -21.049 1.00 25.00 C ATOM 0 H ALA A 603 -2.084 -1.675 -18.935 1.00 25.00 H new ATOM 0 HA ALA A 603 -1.532 1.004 -19.492 1.00 25.00 H new ATOM 0 HB1 ALA A 603 -1.680 0.239 -21.863 1.00 25.00 H new ATOM 0 HB2 ALA A 603 -0.791 -0.933 -20.861 1.00 25.00 H new ATOM 0 HB3 ALA A 603 -2.479 -1.257 -21.324 1.00 25.00 H new ATOM 141 N PRO A 604 -3.586 2.211 -20.436 1.00 25.00 N ATOM 142 CA PRO A 604 -4.861 2.869 -20.729 1.00 25.00 C ATOM 143 C PRO A 604 -5.555 2.284 -21.950 1.00 25.00 C ATOM 144 O PRO A 604 -4.933 1.652 -22.803 1.00 25.00 O ATOM 145 CB PRO A 604 -4.453 4.328 -20.949 1.00 25.00 C ATOM 146 CG PRO A 604 -3.078 4.248 -21.414 1.00 25.00 C ATOM 147 CD PRO A 604 -2.455 3.132 -20.651 1.00 25.00 C ATOM 0 HA PRO A 604 -5.591 2.741 -19.929 1.00 25.00 H new ATOM 0 HB2 PRO A 604 -5.094 4.814 -21.684 1.00 25.00 H new ATOM 0 HB3 PRO A 604 -4.529 4.906 -20.028 1.00 25.00 H new ATOM 0 HG2 PRO A 604 -3.039 4.058 -22.487 1.00 25.00 H new ATOM 0 HG3 PRO A 604 -2.550 5.185 -21.237 1.00 25.00 H new ATOM 0 HD2 PRO A 604 -1.649 2.659 -21.212 1.00 25.00 H new ATOM 0 HD3 PRO A 604 -2.028 3.475 -19.709 1.00 25.00 H new ATOM 155 N LYS A 605 -6.860 2.492 -22.004 1.00 25.00 N ATOM 156 CA LYS A 605 -7.697 1.955 -23.076 1.00 25.00 C ATOM 157 C LYS A 605 -7.664 2.936 -24.234 1.00 25.00 C ATOM 158 O LYS A 605 -7.233 4.068 -24.063 1.00 25.00 O ATOM 159 CB LYS A 605 -9.128 1.764 -22.550 1.00 25.00 C ATOM 160 CG LYS A 605 -9.455 0.323 -22.077 1.00 25.00 C ATOM 161 CD LYS A 605 -8.450 -0.278 -21.054 1.00 25.00 C ATOM 162 CE LYS A 605 -8.437 0.443 -19.698 1.00 25.00 C ATOM 163 NZ LYS A 605 -7.347 -0.124 -18.832 1.00 25.00 N ATOM 0 H LYS A 605 -7.373 3.036 -21.310 1.00 25.00 H new ATOM 0 HA LYS A 605 -7.330 0.987 -23.416 1.00 25.00 H new ATOM 0 HB2 LYS A 605 -9.290 2.451 -21.719 1.00 25.00 H new ATOM 0 HB3 LYS A 605 -9.830 2.043 -23.336 1.00 25.00 H new ATOM 0 HG2 LYS A 605 -10.449 0.320 -21.631 1.00 25.00 H new ATOM 0 HG3 LYS A 605 -9.495 -0.329 -22.950 1.00 25.00 H new ATOM 0 HD2 LYS A 605 -8.694 -1.328 -20.894 1.00 25.00 H new ATOM 0 HD3 LYS A 605 -7.448 -0.245 -21.482 1.00 25.00 H new ATOM 0 HE2 LYS A 605 -8.279 1.511 -19.845 1.00 25.00 H new ATOM 0 HE3 LYS A 605 -9.403 0.329 -19.205 1.00 25.00 H new ATOM 0 HZ1 LYS A 605 -7.331 0.378 -17.921 1.00 25.00 H new ATOM 0 HZ2 LYS A 605 -7.526 -1.135 -18.667 1.00 25.00 H new ATOM 0 HZ3 LYS A 605 -6.430 -0.008 -19.308 1.00 25.00 H new ATOM 177 N LEU A 606 -8.108 2.508 -25.403 1.00 25.00 N ATOM 178 CA LEU A 606 -8.138 3.373 -26.572 1.00 25.00 C ATOM 179 C LEU A 606 -9.181 2.828 -27.522 1.00 25.00 C ATOM 180 O LEU A 606 -9.029 1.734 -28.040 1.00 25.00 O ATOM 181 CB LEU A 606 -6.762 3.405 -27.267 1.00 25.00 C ATOM 182 CG LEU A 606 -6.586 4.317 -28.502 1.00 25.00 C ATOM 183 CD1 LEU A 606 -7.068 3.668 -29.808 1.00 25.00 C ATOM 184 CD2 LEU A 606 -7.283 5.660 -28.308 1.00 25.00 C ATOM 0 H LEU A 606 -8.454 1.563 -25.569 1.00 25.00 H new ATOM 0 HA LEU A 606 -8.382 4.392 -26.272 1.00 25.00 H new ATOM 0 HB2 LEU A 606 -6.022 3.704 -26.525 1.00 25.00 H new ATOM 0 HB3 LEU A 606 -6.518 2.386 -27.568 1.00 25.00 H new ATOM 0 HG LEU A 606 -5.512 4.478 -28.594 1.00 25.00 H new ATOM 0 HD11 LEU A 606 -6.916 4.361 -30.636 1.00 25.00 H new ATOM 0 HD12 LEU A 606 -6.502 2.754 -29.991 1.00 25.00 H new ATOM 0 HD13 LEU A 606 -8.128 3.428 -29.725 1.00 25.00 H new ATOM 0 HD21 LEU A 606 -7.139 6.276 -29.195 1.00 25.00 H new ATOM 0 HD22 LEU A 606 -8.349 5.497 -28.149 1.00 25.00 H new ATOM 0 HD23 LEU A 606 -6.860 6.168 -27.441 1.00 25.00 H new ATOM 196 N GLU A 607 -10.230 3.603 -27.756 1.00 25.00 N ATOM 197 CA GLU A 607 -11.294 3.177 -28.661 1.00 25.00 C ATOM 198 C GLU A 607 -11.392 4.114 -29.887 1.00 25.00 C ATOM 199 O GLU A 607 -12.240 3.931 -30.748 1.00 25.00 O ATOM 200 CB GLU A 607 -12.625 3.080 -27.903 1.00 25.00 C ATOM 201 CG GLU A 607 -12.529 2.498 -26.470 1.00 25.00 C ATOM 202 CD GLU A 607 -11.808 1.156 -26.381 1.00 25.00 C ATOM 203 OE1 GLU A 607 -10.857 1.052 -25.562 1.00 25.00 O ATOM 204 OE2 GLU A 607 -12.186 0.214 -27.105 1.00 25.00 O ATOM 0 H GLU A 607 -10.369 4.523 -27.337 1.00 25.00 H new ATOM 0 HA GLU A 607 -11.054 2.185 -29.042 1.00 25.00 H new ATOM 0 HB2 GLU A 607 -13.064 4.076 -27.844 1.00 25.00 H new ATOM 0 HB3 GLU A 607 -13.311 2.463 -28.483 1.00 25.00 H new ATOM 0 HG2 GLU A 607 -12.013 3.217 -25.833 1.00 25.00 H new ATOM 0 HG3 GLU A 607 -13.536 2.383 -26.070 1.00 25.00 H new ATOM 211 N GLY A 608 -10.498 5.102 -29.957 1.00 25.00 N ATOM 212 CA GLY A 608 -10.378 5.967 -31.136 1.00 25.00 C ATOM 213 C GLY A 608 -11.589 6.768 -31.605 1.00 25.00 C ATOM 214 O GLY A 608 -11.964 6.677 -32.770 1.00 25.00 O ATOM 0 H GLY A 608 -9.843 5.325 -29.208 1.00 25.00 H new ATOM 0 HA2 GLY A 608 -9.573 6.676 -30.941 1.00 25.00 H new ATOM 0 HA3 GLY A 608 -10.057 5.342 -31.969 1.00 25.00 H new ATOM 218 N GLN A 609 -12.206 7.562 -30.740 1.00 25.00 N ATOM 219 CA GLN A 609 -13.383 8.336 -31.148 1.00 25.00 C ATOM 220 C GLN A 609 -12.917 9.577 -31.889 1.00 25.00 C ATOM 221 O GLN A 609 -12.357 10.486 -31.287 1.00 25.00 O ATOM 222 CB GLN A 609 -14.187 8.775 -29.922 1.00 25.00 C ATOM 223 CG GLN A 609 -15.069 7.689 -29.318 1.00 25.00 C ATOM 224 CD GLN A 609 -14.289 6.470 -28.895 1.00 25.00 C ATOM 225 OE1 GLN A 609 -13.331 6.556 -28.127 1.00 25.00 O ATOM 226 NE2 GLN A 609 -14.682 5.332 -29.401 1.00 25.00 N ATOM 0 H GLN A 609 -11.923 7.690 -29.769 1.00 25.00 H new ATOM 0 HA GLN A 609 -14.012 7.715 -31.785 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -13.495 9.129 -29.158 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -14.815 9.621 -30.200 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -15.597 8.094 -28.455 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -15.826 7.396 -30.045 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -15.481 5.304 -30.034 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -14.190 4.471 -29.163 1.00 25.00 H new ATOM 235 N MET A 610 -13.166 9.618 -33.191 1.00 25.00 N ATOM 236 CA MET A 610 -12.746 10.746 -34.019 1.00 25.00 C ATOM 237 C MET A 610 -13.426 12.037 -33.583 1.00 25.00 C ATOM 238 O MET A 610 -14.513 12.014 -33.006 1.00 25.00 O ATOM 239 CB MET A 610 -13.059 10.469 -35.494 1.00 25.00 C ATOM 240 CG MET A 610 -14.546 10.487 -35.840 1.00 25.00 C ATOM 241 SD MET A 610 -14.815 10.171 -37.591 1.00 25.00 S ATOM 242 CE MET A 610 -16.579 10.529 -37.731 1.00 25.00 C ATOM 0 H MET A 610 -13.657 8.883 -33.699 1.00 25.00 H new ATOM 0 HA MET A 610 -11.670 10.866 -33.894 1.00 25.00 H new ATOM 0 HB2 MET A 610 -12.547 11.211 -36.106 1.00 25.00 H new ATOM 0 HB3 MET A 610 -12.648 9.496 -35.763 1.00 25.00 H new ATOM 0 HG2 MET A 610 -15.068 9.735 -35.248 1.00 25.00 H new ATOM 0 HG3 MET A 610 -14.972 11.454 -35.573 1.00 25.00 H new ATOM 0 HE1 MET A 610 -16.900 10.379 -38.762 1.00 25.00 H new ATOM 0 HE2 MET A 610 -17.139 9.862 -37.076 1.00 25.00 H new ATOM 0 HE3 MET A 610 -16.765 11.563 -37.440 1.00 25.00 H new ATOM 252 N GLY A 611 -12.789 13.161 -33.870 1.00 25.00 N ATOM 253 CA GLY A 611 -13.366 14.454 -33.557 1.00 25.00 C ATOM 254 C GLY A 611 -13.963 15.066 -34.805 1.00 25.00 C ATOM 255 O GLY A 611 -13.232 15.438 -35.725 1.00 25.00 O ATOM 0 H GLY A 611 -11.874 13.202 -34.318 1.00 25.00 H new ATOM 0 HA2 GLY A 611 -14.135 14.344 -32.792 1.00 25.00 H new ATOM 0 HA3 GLY A 611 -12.601 15.114 -33.148 1.00 25.00 H new ATOM 259 N GLU A 612 -15.282 15.185 -34.844 1.00 25.00 N ATOM 260 CA GLU A 612 -15.981 15.794 -35.980 1.00 25.00 C ATOM 261 C GLU A 612 -15.797 17.307 -35.898 1.00 25.00 C ATOM 262 O GLU A 612 -16.096 18.038 -36.835 1.00 25.00 O ATOM 263 CB GLU A 612 -17.474 15.413 -35.998 1.00 25.00 C ATOM 264 CG GLU A 612 -18.290 15.811 -34.757 1.00 25.00 C ATOM 265 CD GLU A 612 -18.226 14.757 -33.659 1.00 25.00 C ATOM 266 OE1 GLU A 612 -17.221 14.735 -32.915 1.00 25.00 O ATOM 267 OE2 GLU A 612 -19.162 13.943 -33.535 1.00 25.00 O ATOM 0 H GLU A 612 -15.900 14.866 -34.097 1.00 25.00 H new ATOM 0 HA GLU A 612 -15.557 15.419 -36.912 1.00 25.00 H new ATOM 0 HB2 GLU A 612 -17.934 15.872 -36.873 1.00 25.00 H new ATOM 0 HB3 GLU A 612 -17.551 14.333 -36.127 1.00 25.00 H new ATOM 0 HG2 GLU A 612 -17.918 16.759 -34.369 1.00 25.00 H new ATOM 0 HG3 GLU A 612 -19.329 15.970 -35.044 1.00 25.00 H new ATOM 274 N ASP A 613 -15.267 17.746 -34.764 1.00 25.00 N ATOM 275 CA ASP A 613 -14.907 19.142 -34.521 1.00 25.00 C ATOM 276 C ASP A 613 -13.816 19.560 -35.498 1.00 25.00 C ATOM 277 O ASP A 613 -13.644 20.738 -35.812 1.00 25.00 O ATOM 278 CB ASP A 613 -14.315 19.302 -33.105 1.00 25.00 C ATOM 279 CG ASP A 613 -14.875 18.302 -32.100 1.00 25.00 C ATOM 280 OD1 ASP A 613 -14.498 17.102 -32.176 1.00 25.00 O ATOM 281 OD2 ASP A 613 -15.668 18.703 -31.228 1.00 25.00 O ATOM 0 H ASP A 613 -15.071 17.134 -33.972 1.00 25.00 H new ATOM 0 HA ASP A 613 -15.805 19.749 -34.637 1.00 25.00 H new ATOM 0 HB2 ASP A 613 -13.232 19.187 -33.156 1.00 25.00 H new ATOM 0 HB3 ASP A 613 -14.512 20.313 -32.749 1.00 25.00 H new ATOM 286 N GLY A 614 -13.062 18.567 -35.953 1.00 25.00 N ATOM 287 CA GLY A 614 -11.915 18.803 -36.806 1.00 25.00 C ATOM 288 C GLY A 614 -10.732 19.222 -35.954 1.00 25.00 C ATOM 289 O GLY A 614 -10.902 19.772 -34.863 1.00 25.00 O ATOM 0 H GLY A 614 -13.231 17.584 -35.740 1.00 25.00 H new ATOM 0 HA2 GLY A 614 -11.672 17.900 -37.366 1.00 25.00 H new ATOM 0 HA3 GLY A 614 -12.144 19.579 -37.536 1.00 25.00 H new ATOM 293 N ASN A 615 -9.523 18.948 -36.441 1.00 25.00 N ATOM 294 CA ASN A 615 -8.279 19.315 -35.746 1.00 25.00 C ATOM 295 C ASN A 615 -8.217 18.751 -34.305 1.00 25.00 C ATOM 296 O ASN A 615 -7.433 19.238 -33.481 1.00 25.00 O ATOM 297 CB ASN A 615 -8.164 20.858 -35.744 1.00 25.00 C ATOM 298 CG ASN A 615 -6.756 21.348 -35.958 1.00 25.00 C ATOM 299 OD1 ASN A 615 -6.463 22.011 -36.935 1.00 25.00 O ATOM 300 ND2 ASN A 615 -5.890 21.038 -35.051 1.00 25.00 N ATOM 0 H ASN A 615 -9.373 18.466 -37.327 1.00 25.00 H new ATOM 0 HA ASN A 615 -7.436 18.872 -36.276 1.00 25.00 H new ATOM 0 HB2 ASN A 615 -8.806 21.265 -36.525 1.00 25.00 H new ATOM 0 HB3 ASN A 615 -8.535 21.242 -34.794 1.00 25.00 H new ATOM 0 HD21 ASN A 615 -4.923 21.351 -35.141 1.00 25.00 H new ATOM 0 HD22 ASN A 615 -6.173 20.480 -34.245 1.00 25.00 H new ATOM 307 N SER A 616 -9.053 17.753 -34.008 1.00 25.00 N ATOM 308 CA SER A 616 -9.193 17.196 -32.658 1.00 25.00 C ATOM 309 C SER A 616 -9.585 15.708 -32.648 1.00 25.00 C ATOM 310 O SER A 616 -10.055 15.185 -33.657 1.00 25.00 O ATOM 311 CB SER A 616 -10.298 17.967 -31.930 1.00 25.00 C ATOM 312 OG SER A 616 -10.164 19.369 -32.112 1.00 25.00 O ATOM 0 H SER A 616 -9.655 17.306 -34.699 1.00 25.00 H new ATOM 0 HA SER A 616 -8.221 17.289 -32.174 1.00 25.00 H new ATOM 0 HB2 SER A 616 -11.272 17.643 -32.298 1.00 25.00 H new ATOM 0 HB3 SER A 616 -10.265 17.733 -30.866 1.00 25.00 H new ATOM 0 HG SER A 616 -10.458 19.611 -33.015 1.00 25.00 H new ATOM 318 N ILE A 617 -9.410 15.043 -31.506 1.00 25.00 N ATOM 319 CA ILE A 617 -9.822 13.637 -31.323 1.00 25.00 C ATOM 320 C ILE A 617 -10.035 13.337 -29.836 1.00 25.00 C ATOM 321 O ILE A 617 -9.470 14.021 -28.981 1.00 25.00 O ATOM 322 CB ILE A 617 -8.753 12.650 -31.900 1.00 25.00 C ATOM 323 CG1 ILE A 617 -9.342 11.232 -32.008 1.00 25.00 C ATOM 324 CG2 ILE A 617 -7.453 12.641 -31.046 1.00 25.00 C ATOM 325 CD1 ILE A 617 -8.788 10.390 -33.120 1.00 25.00 C ATOM 0 H ILE A 617 -8.980 15.456 -30.679 1.00 25.00 H new ATOM 0 HA ILE A 617 -10.756 13.494 -31.866 1.00 25.00 H new ATOM 0 HB ILE A 617 -8.483 12.999 -32.897 1.00 25.00 H new ATOM 0 HG12 ILE A 617 -9.174 10.714 -31.064 1.00 25.00 H new ATOM 0 HG13 ILE A 617 -10.421 11.314 -32.139 1.00 25.00 H new ATOM 0 HG21 ILE A 617 -6.737 11.943 -31.480 1.00 25.00 H new ATOM 0 HG22 ILE A 617 -7.021 13.642 -31.031 1.00 25.00 H new ATOM 0 HG23 ILE A 617 -7.689 12.332 -30.028 1.00 25.00 H new ATOM 0 HD11 ILE A 617 -9.268 9.411 -33.109 1.00 25.00 H new ATOM 0 HD12 ILE A 617 -8.980 10.878 -34.076 1.00 25.00 H new ATOM 0 HD13 ILE A 617 -7.713 10.269 -32.984 1.00 25.00 H new ATOM 337 N LYS A 618 -10.829 12.316 -29.523 1.00 25.00 N ATOM 338 CA LYS A 618 -11.053 11.896 -28.139 1.00 25.00 C ATOM 339 C LYS A 618 -10.469 10.498 -27.986 1.00 25.00 C ATOM 340 O LYS A 618 -10.680 9.631 -28.834 1.00 25.00 O ATOM 341 CB LYS A 618 -12.547 11.843 -27.790 1.00 25.00 C ATOM 342 CG LYS A 618 -13.377 13.053 -28.225 1.00 25.00 C ATOM 343 CD LYS A 618 -14.038 12.829 -29.598 1.00 25.00 C ATOM 344 CE LYS A 618 -15.270 13.711 -29.782 1.00 25.00 C ATOM 345 NZ LYS A 618 -16.075 13.259 -30.957 1.00 25.00 N ATOM 0 H LYS A 618 -11.332 11.759 -30.214 1.00 25.00 H new ATOM 0 HA LYS A 618 -10.581 12.616 -27.471 1.00 25.00 H new ATOM 0 HB2 LYS A 618 -12.975 10.950 -28.245 1.00 25.00 H new ATOM 0 HB3 LYS A 618 -12.645 11.729 -26.710 1.00 25.00 H new ATOM 0 HG2 LYS A 618 -14.147 13.253 -27.479 1.00 25.00 H new ATOM 0 HG3 LYS A 618 -12.738 13.935 -28.269 1.00 25.00 H new ATOM 0 HD2 LYS A 618 -13.317 13.041 -30.388 1.00 25.00 H new ATOM 0 HD3 LYS A 618 -14.322 11.781 -29.699 1.00 25.00 H new ATOM 0 HE2 LYS A 618 -15.883 13.679 -28.881 1.00 25.00 H new ATOM 0 HE3 LYS A 618 -14.963 14.747 -29.923 1.00 25.00 H new ATOM 0 HZ1 LYS A 618 -16.537 14.080 -31.398 1.00 25.00 H new ATOM 0 HZ2 LYS A 618 -15.450 12.800 -31.650 1.00 25.00 H new ATOM 0 HZ3 LYS A 618 -16.799 12.582 -30.642 1.00 25.00 H new ATOM 359 N VAL A 619 -9.747 10.272 -26.905 1.00 25.00 N ATOM 360 CA VAL A 619 -9.173 8.957 -26.620 1.00 25.00 C ATOM 361 C VAL A 619 -9.703 8.553 -25.243 1.00 25.00 C ATOM 362 O VAL A 619 -9.805 9.388 -24.341 1.00 25.00 O ATOM 363 CB VAL A 619 -7.588 8.951 -26.750 1.00 25.00 C ATOM 364 CG1 VAL A 619 -7.033 10.366 -27.035 1.00 25.00 C ATOM 365 CG2 VAL A 619 -6.894 8.347 -25.511 1.00 25.00 C ATOM 0 H VAL A 619 -9.539 10.982 -26.202 1.00 25.00 H new ATOM 0 HA VAL A 619 -9.477 8.212 -27.356 1.00 25.00 H new ATOM 0 HB VAL A 619 -7.359 8.310 -27.601 1.00 25.00 H new ATOM 0 HG11 VAL A 619 -5.947 10.321 -27.117 1.00 25.00 H new ATOM 0 HG12 VAL A 619 -7.452 10.740 -27.969 1.00 25.00 H new ATOM 0 HG13 VAL A 619 -7.308 11.036 -26.220 1.00 25.00 H new ATOM 0 HG21 VAL A 619 -5.813 8.368 -25.653 1.00 25.00 H new ATOM 0 HG22 VAL A 619 -7.155 8.930 -24.628 1.00 25.00 H new ATOM 0 HG23 VAL A 619 -7.223 7.316 -25.376 1.00 25.00 H new ATOM 375 N ASN A 620 -10.074 7.285 -25.106 1.00 25.00 N ATOM 376 CA ASN A 620 -10.655 6.767 -23.865 1.00 25.00 C ATOM 377 C ASN A 620 -9.623 6.730 -22.753 1.00 25.00 C ATOM 378 O ASN A 620 -8.455 6.471 -22.991 1.00 25.00 O ATOM 379 CB ASN A 620 -11.194 5.353 -24.077 1.00 25.00 C ATOM 380 CG ASN A 620 -12.694 5.311 -24.140 1.00 25.00 C ATOM 381 OD1 ASN A 620 -13.352 4.934 -23.192 1.00 25.00 O ATOM 382 ND2 ASN A 620 -13.241 5.709 -25.254 1.00 25.00 N ATOM 0 H ASN A 620 -9.983 6.588 -25.845 1.00 25.00 H new ATOM 0 HA ASN A 620 -11.467 7.436 -23.581 1.00 25.00 H new ATOM 0 HB2 ASN A 620 -10.784 4.946 -25.001 1.00 25.00 H new ATOM 0 HB3 ASN A 620 -10.850 4.711 -23.266 1.00 25.00 H new ATOM 0 HD21 ASN A 620 -14.256 5.711 -25.351 1.00 25.00 H new ATOM 0 HD22 ASN A 620 -12.654 6.019 -26.028 1.00 25.00 H new ATOM 389 N LEU A 621 -10.065 7.020 -21.545 1.00 25.00 N ATOM 390 CA LEU A 621 -9.194 7.061 -20.387 1.00 25.00 C ATOM 391 C LEU A 621 -9.694 6.154 -19.278 1.00 25.00 C ATOM 392 O LEU A 621 -10.879 5.858 -19.181 1.00 25.00 O ATOM 393 CB LEU A 621 -8.980 8.491 -19.936 1.00 25.00 C ATOM 394 CG LEU A 621 -7.586 8.867 -19.413 1.00 25.00 C ATOM 395 CD1 LEU A 621 -6.459 8.503 -20.391 1.00 25.00 C ATOM 396 CD2 LEU A 621 -7.590 10.375 -19.190 1.00 25.00 C ATOM 0 H LEU A 621 -11.041 7.234 -21.338 1.00 25.00 H new ATOM 0 HA LEU A 621 -8.218 6.668 -20.671 1.00 25.00 H new ATOM 0 HB2 LEU A 621 -9.213 9.147 -20.775 1.00 25.00 H new ATOM 0 HB3 LEU A 621 -9.704 8.708 -19.151 1.00 25.00 H new ATOM 0 HG LEU A 621 -7.391 8.308 -18.498 1.00 25.00 H new ATOM 0 HD11 LEU A 621 -5.499 8.794 -19.964 1.00 25.00 H new ATOM 0 HD12 LEU A 621 -6.466 7.428 -20.570 1.00 25.00 H new ATOM 0 HD13 LEU A 621 -6.611 9.029 -21.334 1.00 25.00 H new ATOM 0 HD21 LEU A 621 -6.616 10.690 -18.817 1.00 25.00 H new ATOM 0 HD22 LEU A 621 -7.799 10.882 -20.132 1.00 25.00 H new ATOM 0 HD23 LEU A 621 -8.359 10.633 -18.461 1.00 25.00 H new ATOM 408 N ILE A 622 -8.773 5.680 -18.468 1.00 25.00 N ATOM 409 CA ILE A 622 -9.094 4.813 -17.341 1.00 25.00 C ATOM 410 C ILE A 622 -10.055 5.541 -16.396 1.00 25.00 C ATOM 411 O ILE A 622 -9.824 6.682 -16.033 1.00 25.00 O ATOM 412 CB ILE A 622 -7.801 4.497 -16.569 1.00 25.00 C ATOM 413 CG1 ILE A 622 -6.843 3.680 -17.442 1.00 25.00 C ATOM 414 CG2 ILE A 622 -8.082 3.753 -15.292 1.00 25.00 C ATOM 415 CD1 ILE A 622 -5.423 4.124 -17.307 1.00 25.00 C ATOM 0 H ILE A 622 -7.778 5.881 -18.567 1.00 25.00 H new ATOM 0 HA ILE A 622 -9.554 3.895 -17.708 1.00 25.00 H new ATOM 0 HB ILE A 622 -7.336 5.449 -16.311 1.00 25.00 H new ATOM 0 HG12 ILE A 622 -6.918 2.627 -17.170 1.00 25.00 H new ATOM 0 HG13 ILE A 622 -7.148 3.762 -18.485 1.00 25.00 H new ATOM 0 HG21 ILE A 622 -7.144 3.549 -14.776 1.00 25.00 H new ATOM 0 HG22 ILE A 622 -8.724 4.358 -14.652 1.00 25.00 H new ATOM 0 HG23 ILE A 622 -8.582 2.812 -15.522 1.00 25.00 H new ATOM 0 HD11 ILE A 622 -4.788 3.511 -17.947 1.00 25.00 H new ATOM 0 HD12 ILE A 622 -5.339 5.169 -17.605 1.00 25.00 H new ATOM 0 HD13 ILE A 622 -5.105 4.016 -16.270 1.00 25.00 H new ATOM 427 N LYS A 623 -11.134 4.875 -16.003 1.00 25.00 N ATOM 428 CA LYS A 623 -12.103 5.454 -15.060 1.00 25.00 C ATOM 429 C LYS A 623 -12.301 4.612 -13.791 1.00 25.00 C ATOM 430 O LYS A 623 -13.246 4.819 -13.042 1.00 25.00 O ATOM 431 CB LYS A 623 -13.426 5.798 -15.775 1.00 25.00 C ATOM 432 CG LYS A 623 -14.047 4.703 -16.648 1.00 25.00 C ATOM 433 CD LYS A 623 -14.731 3.630 -15.837 1.00 25.00 C ATOM 434 CE LYS A 623 -15.352 2.615 -16.764 1.00 25.00 C ATOM 435 NZ LYS A 623 -15.808 1.415 -15.996 1.00 25.00 N ATOM 0 H LYS A 623 -11.366 3.933 -16.319 1.00 25.00 H new ATOM 0 HA LYS A 623 -11.677 6.389 -14.698 1.00 25.00 H new ATOM 0 HB2 LYS A 623 -14.156 6.083 -15.018 1.00 25.00 H new ATOM 0 HB3 LYS A 623 -13.256 6.675 -16.400 1.00 25.00 H new ATOM 0 HG2 LYS A 623 -14.769 5.153 -17.330 1.00 25.00 H new ATOM 0 HG3 LYS A 623 -13.269 4.249 -17.262 1.00 25.00 H new ATOM 0 HD2 LYS A 623 -14.012 3.144 -15.178 1.00 25.00 H new ATOM 0 HD3 LYS A 623 -15.497 4.073 -15.201 1.00 25.00 H new ATOM 0 HE2 LYS A 623 -16.197 3.061 -17.288 1.00 25.00 H new ATOM 0 HE3 LYS A 623 -14.629 2.316 -17.522 1.00 25.00 H new ATOM 0 HZ1 LYS A 623 -16.381 0.805 -16.613 1.00 25.00 H new ATOM 0 HZ2 LYS A 623 -14.980 0.885 -15.657 1.00 25.00 H new ATOM 0 HZ3 LYS A 623 -16.381 1.720 -15.183 1.00 25.00 H new ATOM 449 N GLN A 624 -11.418 3.652 -13.559 1.00 25.00 N ATOM 450 CA GLN A 624 -11.494 2.794 -12.368 1.00 25.00 C ATOM 451 C GLN A 624 -10.080 2.485 -11.880 1.00 25.00 C ATOM 452 O GLN A 624 -9.113 2.853 -12.534 1.00 25.00 O ATOM 453 CB GLN A 624 -12.271 1.492 -12.656 1.00 25.00 C ATOM 454 CG GLN A 624 -11.598 0.518 -13.633 1.00 25.00 C ATOM 455 CD GLN A 624 -11.832 0.885 -15.080 1.00 25.00 C ATOM 456 OE1 GLN A 624 -12.944 0.802 -15.586 1.00 25.00 O ATOM 457 NE2 GLN A 624 -10.795 1.295 -15.750 1.00 25.00 N ATOM 0 H GLN A 624 -10.635 3.441 -14.178 1.00 25.00 H new ATOM 0 HA GLN A 624 -12.039 3.326 -11.588 1.00 25.00 H new ATOM 0 HB2 GLN A 624 -12.438 0.974 -11.712 1.00 25.00 H new ATOM 0 HB3 GLN A 624 -13.252 1.756 -13.052 1.00 25.00 H new ATOM 0 HG2 GLN A 624 -10.526 0.497 -13.437 1.00 25.00 H new ATOM 0 HG3 GLN A 624 -11.975 -0.489 -13.453 1.00 25.00 H new ATOM 0 HE21 GLN A 624 -9.884 1.351 -15.295 1.00 25.00 H new ATOM 0 HE22 GLN A 624 -10.893 1.560 -16.730 1.00 25.00 H new ATOM 466 N ASP A 625 -9.948 1.809 -10.751 1.00 25.00 N ATOM 467 CA ASP A 625 -8.635 1.407 -10.261 1.00 25.00 C ATOM 468 C ASP A 625 -8.196 0.177 -11.062 1.00 25.00 C ATOM 469 O ASP A 625 -8.728 -0.911 -10.926 1.00 25.00 O ATOM 470 CB ASP A 625 -8.647 1.139 -8.745 1.00 25.00 C ATOM 471 CG ASP A 625 -9.692 0.112 -8.319 1.00 25.00 C ATOM 472 OD1 ASP A 625 -10.898 0.305 -8.615 1.00 25.00 O ATOM 473 OD2 ASP A 625 -9.303 -0.876 -7.667 1.00 25.00 O ATOM 0 H ASP A 625 -10.728 1.527 -10.157 1.00 25.00 H new ATOM 0 HA ASP A 625 -7.918 2.215 -10.406 1.00 25.00 H new ATOM 0 HB2 ASP A 625 -7.661 0.792 -8.437 1.00 25.00 H new ATOM 0 HB3 ASP A 625 -8.834 2.076 -8.220 1.00 25.00 H new ATOM 478 N ASP A 626 -7.217 0.384 -11.926 1.00 25.00 N ATOM 479 CA ASP A 626 -6.735 -0.661 -12.837 1.00 25.00 C ATOM 480 C ASP A 626 -5.809 -1.693 -12.196 1.00 25.00 C ATOM 481 O ASP A 626 -5.161 -2.480 -12.893 1.00 25.00 O ATOM 482 CB ASP A 626 -6.000 -0.004 -14.001 1.00 25.00 C ATOM 483 CG ASP A 626 -6.919 0.321 -15.167 1.00 25.00 C ATOM 484 OD1 ASP A 626 -6.403 0.410 -16.294 1.00 25.00 O ATOM 485 OD2 ASP A 626 -8.142 0.472 -14.983 1.00 25.00 O ATOM 0 H ASP A 626 -6.730 1.275 -12.022 1.00 25.00 H new ATOM 0 HA ASP A 626 -7.622 -1.206 -13.161 1.00 25.00 H new ATOM 0 HB2 ASP A 626 -5.523 0.912 -13.653 1.00 25.00 H new ATOM 0 HB3 ASP A 626 -5.205 -0.667 -14.344 1.00 25.00 H new ATOM 490 N GLY A 627 -5.719 -1.704 -10.878 1.00 25.00 N ATOM 491 CA GLY A 627 -4.854 -2.670 -10.235 1.00 25.00 C ATOM 492 C GLY A 627 -4.856 -2.649 -8.729 1.00 25.00 C ATOM 493 O GLY A 627 -5.645 -3.327 -8.091 1.00 25.00 O ATOM 0 H GLY A 627 -6.219 -1.075 -10.250 1.00 25.00 H new ATOM 0 HA2 GLY A 627 -5.144 -3.667 -10.566 1.00 25.00 H new ATOM 0 HA3 GLY A 627 -3.834 -2.503 -10.581 1.00 25.00 H new ATOM 497 N GLY A 628 -3.930 -1.894 -8.162 1.00 25.00 N ATOM 498 CA GLY A 628 -3.794 -1.841 -6.712 1.00 25.00 C ATOM 499 C GLY A 628 -4.290 -0.586 -6.022 1.00 25.00 C ATOM 500 O GLY A 628 -4.582 -0.602 -4.832 1.00 25.00 O ATOM 0 H GLY A 628 -3.266 -1.314 -8.675 1.00 25.00 H new ATOM 0 HA2 GLY A 628 -4.327 -2.693 -6.290 1.00 25.00 H new ATOM 0 HA3 GLY A 628 -2.740 -1.970 -6.465 1.00 25.00 H new ATOM 504 N SER A 629 -4.356 0.512 -6.756 1.00 25.00 N ATOM 505 CA SER A 629 -4.750 1.802 -6.195 1.00 25.00 C ATOM 506 C SER A 629 -5.250 2.628 -7.369 1.00 25.00 C ATOM 507 O SER A 629 -4.784 2.415 -8.502 1.00 25.00 O ATOM 508 CB SER A 629 -3.531 2.476 -5.540 1.00 25.00 C ATOM 509 OG SER A 629 -3.876 3.683 -4.882 1.00 25.00 O ATOM 0 H SER A 629 -4.140 0.539 -7.753 1.00 25.00 H new ATOM 0 HA SER A 629 -5.518 1.699 -5.429 1.00 25.00 H new ATOM 0 HB2 SER A 629 -3.080 1.790 -4.823 1.00 25.00 H new ATOM 0 HB3 SER A 629 -2.779 2.682 -6.302 1.00 25.00 H new ATOM 0 HG SER A 629 -3.074 4.077 -4.479 1.00 25.00 H new ATOM 515 N PRO A 630 -6.194 3.563 -7.142 1.00 25.00 N ATOM 516 CA PRO A 630 -6.637 4.346 -8.299 1.00 25.00 C ATOM 517 C PRO A 630 -5.544 5.234 -8.871 1.00 25.00 C ATOM 518 O PRO A 630 -4.576 5.604 -8.194 1.00 25.00 O ATOM 519 CB PRO A 630 -7.791 5.178 -7.730 1.00 25.00 C ATOM 520 CG PRO A 630 -7.459 5.326 -6.299 1.00 25.00 C ATOM 521 CD PRO A 630 -6.912 3.979 -5.920 1.00 25.00 C ATOM 0 HA PRO A 630 -6.924 3.712 -9.138 1.00 25.00 H new ATOM 0 HB2 PRO A 630 -7.865 6.147 -8.224 1.00 25.00 H new ATOM 0 HB3 PRO A 630 -8.749 4.676 -7.867 1.00 25.00 H new ATOM 0 HG2 PRO A 630 -6.726 6.116 -6.138 1.00 25.00 H new ATOM 0 HG3 PRO A 630 -8.338 5.582 -5.708 1.00 25.00 H new ATOM 0 HD2 PRO A 630 -6.245 4.040 -5.060 1.00 25.00 H new ATOM 0 HD3 PRO A 630 -7.706 3.279 -5.659 1.00 25.00 H new ATOM 529 N ILE A 631 -5.707 5.560 -10.139 1.00 25.00 N ATOM 530 CA ILE A 631 -4.759 6.390 -10.859 1.00 25.00 C ATOM 531 C ILE A 631 -4.867 7.801 -10.278 1.00 25.00 C ATOM 532 O ILE A 631 -5.955 8.244 -9.943 1.00 25.00 O ATOM 533 CB ILE A 631 -5.065 6.382 -12.395 1.00 25.00 C ATOM 534 CG1 ILE A 631 -4.642 5.048 -13.061 1.00 25.00 C ATOM 535 CG2 ILE A 631 -4.280 7.477 -13.096 1.00 25.00 C ATOM 536 CD1 ILE A 631 -5.398 3.806 -12.666 1.00 25.00 C ATOM 0 H ILE A 631 -6.502 5.256 -10.701 1.00 25.00 H new ATOM 0 HA ILE A 631 -3.744 6.009 -10.743 1.00 25.00 H new ATOM 0 HB ILE A 631 -6.141 6.529 -12.493 1.00 25.00 H new ATOM 0 HG12 ILE A 631 -4.731 5.167 -14.141 1.00 25.00 H new ATOM 0 HG13 ILE A 631 -3.587 4.883 -12.844 1.00 25.00 H new ATOM 0 HG21 ILE A 631 -4.503 7.459 -14.163 1.00 25.00 H new ATOM 0 HG22 ILE A 631 -4.560 8.446 -12.683 1.00 25.00 H new ATOM 0 HG23 ILE A 631 -3.213 7.313 -12.946 1.00 25.00 H new ATOM 0 HD11 ILE A 631 -4.998 2.949 -13.207 1.00 25.00 H new ATOM 0 HD12 ILE A 631 -5.291 3.640 -11.594 1.00 25.00 H new ATOM 0 HD13 ILE A 631 -6.453 3.929 -12.910 1.00 25.00 H new ATOM 548 N ARG A 632 -3.742 8.495 -10.151 1.00 25.00 N ATOM 549 CA ARG A 632 -3.722 9.867 -9.647 1.00 25.00 C ATOM 550 C ARG A 632 -3.841 10.841 -10.816 1.00 25.00 C ATOM 551 O ARG A 632 -4.650 11.770 -10.779 1.00 25.00 O ATOM 552 CB ARG A 632 -2.394 10.169 -8.942 1.00 25.00 C ATOM 553 CG ARG A 632 -2.286 9.764 -7.463 1.00 25.00 C ATOM 554 CD ARG A 632 -0.937 10.254 -6.921 1.00 25.00 C ATOM 555 NE ARG A 632 -0.807 11.719 -6.998 1.00 25.00 N ATOM 556 CZ ARG A 632 -1.130 12.578 -6.040 1.00 25.00 C ATOM 557 NH1 ARG A 632 -1.604 12.205 -4.875 1.00 25.00 N ATOM 558 NH2 ARG A 632 -0.970 13.851 -6.267 1.00 25.00 N ATOM 0 H ARG A 632 -2.822 8.127 -10.392 1.00 25.00 H new ATOM 0 HA ARG A 632 -4.552 9.978 -8.949 1.00 25.00 H new ATOM 0 HB2 ARG A 632 -1.597 9.668 -9.490 1.00 25.00 H new ATOM 0 HB3 ARG A 632 -2.207 11.240 -9.015 1.00 25.00 H new ATOM 0 HG2 ARG A 632 -3.105 10.199 -6.890 1.00 25.00 H new ATOM 0 HG3 ARG A 632 -2.365 8.682 -7.360 1.00 25.00 H new ATOM 0 HD2 ARG A 632 -0.826 9.935 -5.885 1.00 25.00 H new ATOM 0 HD3 ARG A 632 -0.129 9.789 -7.486 1.00 25.00 H new ATOM 0 HE ARG A 632 -0.436 12.108 -7.865 1.00 25.00 H new ATOM 0 HH11 ARG A 632 -1.739 11.214 -4.673 1.00 25.00 H new ATOM 0 HH12 ARG A 632 -1.837 12.906 -4.171 1.00 25.00 H new ATOM 0 HH21 ARG A 632 -0.604 14.167 -7.165 1.00 25.00 H new ATOM 0 HH22 ARG A 632 -1.211 14.532 -5.547 1.00 25.00 H new ATOM 572 N HIS A 633 -3.013 10.634 -11.834 1.00 25.00 N ATOM 573 CA HIS A 633 -2.942 11.530 -12.988 1.00 25.00 C ATOM 574 C HIS A 633 -2.742 10.760 -14.292 1.00 25.00 C ATOM 575 O HIS A 633 -2.340 9.602 -14.287 1.00 25.00 O ATOM 576 CB HIS A 633 -1.746 12.490 -12.841 1.00 25.00 C ATOM 577 CG HIS A 633 -1.640 13.130 -11.491 1.00 25.00 C ATOM 578 ND1 HIS A 633 -2.585 13.960 -10.948 1.00 25.00 N ATOM 579 CD2 HIS A 633 -0.657 13.050 -10.548 1.00 25.00 C ATOM 580 CE1 HIS A 633 -2.170 14.339 -9.745 1.00 25.00 C ATOM 581 NE2 HIS A 633 -1.001 13.809 -9.441 1.00 25.00 N ATOM 0 H HIS A 633 -2.372 9.842 -11.885 1.00 25.00 H new ATOM 0 HA HIS A 633 -3.887 12.073 -13.022 1.00 25.00 H new ATOM 0 HB2 HIS A 633 -0.826 11.942 -13.045 1.00 25.00 H new ATOM 0 HB3 HIS A 633 -1.826 13.271 -13.597 1.00 25.00 H new ATOM 0 HD1 HIS A 633 -3.459 14.240 -11.393 1.00 25.00 H new ATOM 0 HD2 HIS A 633 0.254 12.479 -10.649 1.00 25.00 H new ATOM 0 HE1 HIS A 633 -2.722 15.001 -9.094 1.00 25.00 H new ATOM 589 N TYR A 634 -2.999 11.424 -15.406 1.00 25.00 N ATOM 590 CA TYR A 634 -2.757 10.865 -16.730 1.00 25.00 C ATOM 591 C TYR A 634 -1.792 11.771 -17.445 1.00 25.00 C ATOM 592 O TYR A 634 -1.827 12.990 -17.259 1.00 25.00 O ATOM 593 CB TYR A 634 -4.055 10.769 -17.517 1.00 25.00 C ATOM 594 CG TYR A 634 -5.038 9.892 -16.816 1.00 25.00 C ATOM 595 CD1 TYR A 634 -6.155 10.439 -16.155 1.00 25.00 C ATOM 596 CD2 TYR A 634 -4.854 8.499 -16.790 1.00 25.00 C ATOM 597 CE1 TYR A 634 -7.057 9.598 -15.452 1.00 25.00 C ATOM 598 CE2 TYR A 634 -5.746 7.672 -16.089 1.00 25.00 C ATOM 599 CZ TYR A 634 -6.826 8.229 -15.411 1.00 25.00 C ATOM 600 OH TYR A 634 -7.647 7.409 -14.694 1.00 25.00 O ATOM 0 H TYR A 634 -3.383 12.369 -15.420 1.00 25.00 H new ATOM 0 HA TYR A 634 -2.345 9.860 -16.638 1.00 25.00 H new ATOM 0 HB2 TYR A 634 -4.479 11.764 -17.650 1.00 25.00 H new ATOM 0 HB3 TYR A 634 -3.853 10.373 -18.512 1.00 25.00 H new ATOM 0 HD1 TYR A 634 -6.326 11.505 -16.183 1.00 25.00 H new ATOM 0 HD2 TYR A 634 -4.018 8.060 -17.315 1.00 25.00 H new ATOM 0 HE1 TYR A 634 -7.917 10.020 -14.953 1.00 25.00 H new ATOM 0 HE2 TYR A 634 -5.594 6.603 -16.076 1.00 25.00 H new ATOM 0 HH TYR A 634 -8.343 7.048 -15.282 1.00 25.00 H new ATOM 610 N LEU A 635 -0.926 11.174 -18.247 1.00 25.00 N ATOM 611 CA LEU A 635 0.081 11.919 -18.986 1.00 25.00 C ATOM 612 C LEU A 635 -0.005 11.483 -20.446 1.00 25.00 C ATOM 613 O LEU A 635 0.077 10.289 -20.745 1.00 25.00 O ATOM 614 CB LEU A 635 1.474 11.632 -18.403 1.00 25.00 C ATOM 615 CG LEU A 635 1.641 11.869 -16.885 1.00 25.00 C ATOM 616 CD1 LEU A 635 2.898 11.159 -16.374 1.00 25.00 C ATOM 617 CD2 LEU A 635 1.706 13.357 -16.555 1.00 25.00 C ATOM 0 H LEU A 635 -0.900 10.166 -18.404 1.00 25.00 H new ATOM 0 HA LEU A 635 -0.091 12.993 -18.910 1.00 25.00 H new ATOM 0 HB2 LEU A 635 1.728 10.594 -18.618 1.00 25.00 H new ATOM 0 HB3 LEU A 635 2.200 12.253 -18.928 1.00 25.00 H new ATOM 0 HG LEU A 635 0.766 11.454 -16.384 1.00 25.00 H new ATOM 0 HD11 LEU A 635 3.005 11.334 -15.303 1.00 25.00 H new ATOM 0 HD12 LEU A 635 2.812 10.088 -16.560 1.00 25.00 H new ATOM 0 HD13 LEU A 635 3.773 11.549 -16.894 1.00 25.00 H new ATOM 0 HD21 LEU A 635 1.824 13.486 -15.479 1.00 25.00 H new ATOM 0 HD22 LEU A 635 2.555 13.807 -17.069 1.00 25.00 H new ATOM 0 HD23 LEU A 635 0.786 13.842 -16.880 1.00 25.00 H new ATOM 629 N VAL A 636 -0.181 12.436 -21.346 1.00 25.00 N ATOM 630 CA VAL A 636 -0.283 12.146 -22.782 1.00 25.00 C ATOM 631 C VAL A 636 0.829 12.883 -23.519 1.00 25.00 C ATOM 632 O VAL A 636 1.190 13.995 -23.142 1.00 25.00 O ATOM 633 CB VAL A 636 -1.666 12.596 -23.359 1.00 25.00 C ATOM 634 CG1 VAL A 636 -1.955 11.915 -24.696 1.00 25.00 C ATOM 635 CG2 VAL A 636 -2.803 12.281 -22.364 1.00 25.00 C ATOM 0 H VAL A 636 -0.258 13.426 -21.114 1.00 25.00 H new ATOM 0 HA VAL A 636 -0.189 11.069 -22.922 1.00 25.00 H new ATOM 0 HB VAL A 636 -1.618 13.673 -23.518 1.00 25.00 H new ATOM 0 HG11 VAL A 636 -2.923 12.247 -25.072 1.00 25.00 H new ATOM 0 HG12 VAL A 636 -1.177 12.177 -25.413 1.00 25.00 H new ATOM 0 HG13 VAL A 636 -1.971 10.834 -24.558 1.00 25.00 H new ATOM 0 HG21 VAL A 636 -3.755 12.602 -22.786 1.00 25.00 H new ATOM 0 HG22 VAL A 636 -2.834 11.208 -22.174 1.00 25.00 H new ATOM 0 HG23 VAL A 636 -2.624 12.810 -21.428 1.00 25.00 H new ATOM 645 N ARG A 637 1.363 12.268 -24.566 1.00 25.00 N ATOM 646 CA ARG A 637 2.416 12.859 -25.388 1.00 25.00 C ATOM 647 C ARG A 637 2.050 12.516 -26.819 1.00 25.00 C ATOM 648 O ARG A 637 1.749 11.370 -27.102 1.00 25.00 O ATOM 649 CB ARG A 637 3.771 12.254 -24.999 1.00 25.00 C ATOM 650 CG ARG A 637 4.914 12.662 -25.908 1.00 25.00 C ATOM 651 CD ARG A 637 6.276 12.441 -25.279 1.00 25.00 C ATOM 652 NE ARG A 637 6.505 13.348 -24.140 1.00 25.00 N ATOM 653 CZ ARG A 637 7.639 13.455 -23.459 1.00 25.00 C ATOM 654 NH1 ARG A 637 8.704 12.749 -23.752 1.00 25.00 N ATOM 655 NH2 ARG A 637 7.697 14.293 -22.464 1.00 25.00 N ATOM 0 H ARG A 637 1.077 11.338 -24.873 1.00 25.00 H new ATOM 0 HA ARG A 637 2.499 13.938 -25.254 1.00 25.00 H new ATOM 0 HB2 ARG A 637 4.010 12.550 -23.978 1.00 25.00 H new ATOM 0 HB3 ARG A 637 3.687 11.167 -25.004 1.00 25.00 H new ATOM 0 HG2 ARG A 637 4.852 12.096 -26.837 1.00 25.00 H new ATOM 0 HG3 ARG A 637 4.806 13.715 -26.169 1.00 25.00 H new ATOM 0 HD2 ARG A 637 6.358 11.407 -24.943 1.00 25.00 H new ATOM 0 HD3 ARG A 637 7.052 12.595 -26.029 1.00 25.00 H new ATOM 0 HE ARG A 637 5.728 13.942 -23.851 1.00 25.00 H new ATOM 0 HH11 ARG A 637 8.680 12.088 -24.528 1.00 25.00 H new ATOM 0 HH12 ARG A 637 9.557 12.861 -23.204 1.00 25.00 H new ATOM 0 HH21 ARG A 637 6.880 14.853 -22.220 1.00 25.00 H new ATOM 0 HH22 ARG A 637 8.560 14.390 -21.928 1.00 25.00 H new ATOM 669 N TYR A 638 2.050 13.484 -27.718 1.00 25.00 N ATOM 670 CA TYR A 638 1.644 13.220 -29.097 1.00 25.00 C ATOM 671 C TYR A 638 2.438 14.080 -30.059 1.00 25.00 C ATOM 672 O TYR A 638 2.973 15.111 -29.664 1.00 25.00 O ATOM 673 CB TYR A 638 0.132 13.450 -29.273 1.00 25.00 C ATOM 674 CG TYR A 638 -0.333 14.886 -29.127 1.00 25.00 C ATOM 675 CD1 TYR A 638 -0.720 15.634 -30.260 1.00 25.00 C ATOM 676 CD2 TYR A 638 -0.407 15.504 -27.859 1.00 25.00 C ATOM 677 CE1 TYR A 638 -1.183 16.971 -30.128 1.00 25.00 C ATOM 678 CE2 TYR A 638 -0.858 16.843 -27.731 1.00 25.00 C ATOM 679 CZ TYR A 638 -1.248 17.559 -28.865 1.00 25.00 C ATOM 680 OH TYR A 638 -1.693 18.847 -28.728 1.00 25.00 O ATOM 0 H TYR A 638 2.322 14.449 -27.528 1.00 25.00 H new ATOM 0 HA TYR A 638 1.854 12.175 -29.323 1.00 25.00 H new ATOM 0 HB2 TYR A 638 -0.160 13.091 -30.260 1.00 25.00 H new ATOM 0 HB3 TYR A 638 -0.398 12.839 -28.542 1.00 25.00 H new ATOM 0 HD1 TYR A 638 -0.663 15.184 -31.240 1.00 25.00 H new ATOM 0 HD2 TYR A 638 -0.117 14.951 -26.978 1.00 25.00 H new ATOM 0 HE1 TYR A 638 -1.483 17.530 -31.002 1.00 25.00 H new ATOM 0 HE2 TYR A 638 -0.900 17.308 -26.757 1.00 25.00 H new ATOM 0 HH TYR A 638 -2.536 18.956 -29.216 1.00 25.00 H new ATOM 690 N ARG A 639 2.523 13.642 -31.306 1.00 25.00 N ATOM 691 CA ARG A 639 3.294 14.334 -32.341 1.00 25.00 C ATOM 692 C ARG A 639 2.562 14.139 -33.653 1.00 25.00 C ATOM 693 O ARG A 639 1.996 13.081 -33.884 1.00 25.00 O ATOM 694 CB ARG A 639 4.710 13.734 -32.397 1.00 25.00 C ATOM 695 CG ARG A 639 5.525 14.042 -33.627 1.00 25.00 C ATOM 696 CD ARG A 639 5.567 12.844 -34.550 1.00 25.00 C ATOM 697 NE ARG A 639 5.919 13.243 -35.917 1.00 25.00 N ATOM 698 CZ ARG A 639 6.149 12.410 -36.921 1.00 25.00 C ATOM 699 NH1 ARG A 639 6.078 11.106 -36.786 1.00 25.00 N ATOM 700 NH2 ARG A 639 6.455 12.903 -38.089 1.00 25.00 N ATOM 0 H ARG A 639 2.060 12.795 -31.635 1.00 25.00 H new ATOM 0 HA ARG A 639 3.390 15.399 -32.131 1.00 25.00 H new ATOM 0 HB2 ARG A 639 5.263 14.084 -31.525 1.00 25.00 H new ATOM 0 HB3 ARG A 639 4.625 12.651 -32.307 1.00 25.00 H new ATOM 0 HG2 ARG A 639 5.096 14.896 -34.150 1.00 25.00 H new ATOM 0 HG3 ARG A 639 6.538 14.321 -33.338 1.00 25.00 H new ATOM 0 HD2 ARG A 639 6.294 12.121 -34.180 1.00 25.00 H new ATOM 0 HD3 ARG A 639 4.597 12.348 -34.551 1.00 25.00 H new ATOM 0 HE ARG A 639 5.993 14.242 -36.110 1.00 25.00 H new ATOM 0 HH11 ARG A 639 5.838 10.699 -35.882 1.00 25.00 H new ATOM 0 HH12 ARG A 639 6.263 10.500 -37.585 1.00 25.00 H new ATOM 0 HH21 ARG A 639 6.514 13.913 -38.217 1.00 25.00 H new ATOM 0 HH22 ARG A 639 6.636 12.278 -38.875 1.00 25.00 H new ATOM 714 N ALA A 640 2.565 15.157 -34.496 1.00 25.00 N ATOM 715 CA ALA A 640 1.895 15.095 -35.787 1.00 25.00 C ATOM 716 C ALA A 640 2.947 15.109 -36.884 1.00 25.00 C ATOM 717 O ALA A 640 4.096 15.437 -36.617 1.00 25.00 O ATOM 718 CB ALA A 640 0.931 16.268 -35.927 1.00 25.00 C ATOM 0 H ALA A 640 3.029 16.046 -34.308 1.00 25.00 H new ATOM 0 HA ALA A 640 1.313 14.177 -35.869 1.00 25.00 H new ATOM 0 HB1 ALA A 640 0.433 16.216 -36.895 1.00 25.00 H new ATOM 0 HB2 ALA A 640 0.186 16.223 -35.133 1.00 25.00 H new ATOM 0 HB3 ALA A 640 1.484 17.204 -35.854 1.00 25.00 H new ATOM 724 N LEU A 641 2.568 14.773 -38.109 1.00 25.00 N ATOM 725 CA LEU A 641 3.516 14.768 -39.222 1.00 25.00 C ATOM 726 C LEU A 641 4.160 16.148 -39.363 1.00 25.00 C ATOM 727 O LEU A 641 5.359 16.264 -39.606 1.00 25.00 O ATOM 728 CB LEU A 641 2.793 14.384 -40.522 1.00 25.00 C ATOM 729 CG LEU A 641 3.667 14.236 -41.780 1.00 25.00 C ATOM 730 CD1 LEU A 641 4.693 13.106 -41.629 1.00 25.00 C ATOM 731 CD2 LEU A 641 2.776 13.962 -42.989 1.00 25.00 C ATOM 0 H LEU A 641 1.617 14.501 -38.360 1.00 25.00 H new ATOM 0 HA LEU A 641 4.297 14.034 -39.024 1.00 25.00 H new ATOM 0 HB2 LEU A 641 2.272 13.441 -40.356 1.00 25.00 H new ATOM 0 HB3 LEU A 641 2.031 15.137 -40.723 1.00 25.00 H new ATOM 0 HG LEU A 641 4.215 15.168 -41.921 1.00 25.00 H new ATOM 0 HD11 LEU A 641 5.291 13.033 -42.538 1.00 25.00 H new ATOM 0 HD12 LEU A 641 5.345 13.318 -40.782 1.00 25.00 H new ATOM 0 HD13 LEU A 641 4.173 12.163 -41.460 1.00 25.00 H new ATOM 0 HD21 LEU A 641 3.394 13.857 -43.880 1.00 25.00 H new ATOM 0 HD22 LEU A 641 2.215 13.042 -42.826 1.00 25.00 H new ATOM 0 HD23 LEU A 641 2.082 14.791 -43.125 1.00 25.00 H new ATOM 743 N SER A 642 3.344 17.177 -39.189 1.00 25.00 N ATOM 744 CA SER A 642 3.780 18.567 -39.289 1.00 25.00 C ATOM 745 C SER A 642 4.208 19.206 -37.962 1.00 25.00 C ATOM 746 O SER A 642 4.434 20.413 -37.909 1.00 25.00 O ATOM 747 CB SER A 642 2.626 19.394 -39.864 1.00 25.00 C ATOM 748 OG SER A 642 1.972 18.675 -40.897 1.00 25.00 O ATOM 0 H SER A 642 2.353 17.073 -38.973 1.00 25.00 H new ATOM 0 HA SER A 642 4.664 18.562 -39.927 1.00 25.00 H new ATOM 0 HB2 SER A 642 1.915 19.637 -39.074 1.00 25.00 H new ATOM 0 HB3 SER A 642 3.005 20.339 -40.253 1.00 25.00 H new ATOM 0 HG SER A 642 1.361 18.018 -40.502 1.00 25.00 H new ATOM 754 N SER A 643 4.296 18.435 -36.882 1.00 25.00 N ATOM 755 CA SER A 643 4.582 19.014 -35.559 1.00 25.00 C ATOM 756 C SER A 643 5.540 18.216 -34.676 1.00 25.00 C ATOM 757 O SER A 643 5.829 17.056 -34.917 1.00 25.00 O ATOM 758 CB SER A 643 3.272 19.191 -34.793 1.00 25.00 C ATOM 759 OG SER A 643 2.368 19.989 -35.532 1.00 25.00 O ATOM 0 H SER A 643 4.177 17.422 -36.888 1.00 25.00 H new ATOM 0 HA SER A 643 5.083 19.958 -35.772 1.00 25.00 H new ATOM 0 HB2 SER A 643 2.826 18.216 -34.594 1.00 25.00 H new ATOM 0 HB3 SER A 643 3.469 19.655 -33.827 1.00 25.00 H new ATOM 0 HG SER A 643 1.534 20.091 -35.028 1.00 25.00 H new ATOM 765 N GLU A 644 6.014 18.877 -33.631 1.00 25.00 N ATOM 766 CA GLU A 644 6.900 18.278 -32.633 1.00 25.00 C ATOM 767 C GLU A 644 6.135 17.380 -31.652 1.00 25.00 C ATOM 768 O GLU A 644 4.901 17.427 -31.572 1.00 25.00 O ATOM 769 CB GLU A 644 7.546 19.411 -31.815 1.00 25.00 C ATOM 770 CG GLU A 644 6.523 20.159 -30.935 1.00 25.00 C ATOM 771 CD GLU A 644 7.109 21.307 -30.140 1.00 25.00 C ATOM 772 OE1 GLU A 644 8.306 21.608 -30.269 1.00 25.00 O ATOM 773 OE2 GLU A 644 6.326 21.924 -29.373 1.00 25.00 O ATOM 0 H GLU A 644 5.794 19.856 -33.446 1.00 25.00 H new ATOM 0 HA GLU A 644 7.639 17.674 -33.160 1.00 25.00 H new ATOM 0 HB2 GLU A 644 8.331 18.997 -31.182 1.00 25.00 H new ATOM 0 HB3 GLU A 644 8.023 20.118 -32.493 1.00 25.00 H new ATOM 0 HG2 GLU A 644 5.725 20.542 -31.571 1.00 25.00 H new ATOM 0 HG3 GLU A 644 6.067 19.449 -30.245 1.00 25.00 H new ATOM 780 N TRP A 645 6.875 16.600 -30.873 1.00 25.00 N ATOM 781 CA TRP A 645 6.308 15.876 -29.740 1.00 25.00 C ATOM 782 C TRP A 645 5.910 16.881 -28.670 1.00 25.00 C ATOM 783 O TRP A 645 6.766 17.502 -28.043 1.00 25.00 O ATOM 784 CB TRP A 645 7.335 14.916 -29.136 1.00 25.00 C ATOM 785 CG TRP A 645 7.538 13.666 -29.927 1.00 25.00 C ATOM 786 CD1 TRP A 645 8.577 13.361 -30.748 1.00 25.00 C ATOM 787 CD2 TRP A 645 6.670 12.519 -29.969 1.00 25.00 C ATOM 788 NE1 TRP A 645 8.436 12.120 -31.296 1.00 25.00 N ATOM 789 CE2 TRP A 645 7.276 11.562 -30.835 1.00 25.00 C ATOM 790 CE3 TRP A 645 5.434 12.206 -29.372 1.00 25.00 C ATOM 791 CZ2 TRP A 645 6.690 10.312 -31.102 1.00 25.00 C ATOM 792 CZ3 TRP A 645 4.842 10.948 -29.633 1.00 25.00 C ATOM 793 CH2 TRP A 645 5.484 10.013 -30.495 1.00 25.00 C ATOM 0 H TRP A 645 7.875 16.452 -31.006 1.00 25.00 H new ATOM 0 HA TRP A 645 5.447 15.305 -30.087 1.00 25.00 H new ATOM 0 HB2 TRP A 645 8.290 15.434 -29.043 1.00 25.00 H new ATOM 0 HB3 TRP A 645 7.018 14.648 -28.128 1.00 25.00 H new ATOM 0 HD1 TRP A 645 9.411 14.019 -30.942 1.00 25.00 H new ATOM 0 HE1 TRP A 645 9.089 11.680 -31.944 1.00 25.00 H new ATOM 0 HE3 TRP A 645 4.944 12.917 -28.723 1.00 25.00 H new ATOM 0 HZ2 TRP A 645 7.169 9.605 -31.763 1.00 25.00 H new ATOM 0 HZ3 TRP A 645 3.897 10.695 -29.176 1.00 25.00 H new ATOM 0 HH2 TRP A 645 5.021 9.054 -30.678 1.00 25.00 H new ATOM 804 N LYS A 646 4.615 17.039 -28.448 1.00 25.00 N ATOM 805 CA LYS A 646 4.141 17.944 -27.408 1.00 25.00 C ATOM 806 C LYS A 646 4.542 17.281 -26.090 1.00 25.00 C ATOM 807 O LYS A 646 4.425 16.063 -25.952 1.00 25.00 O ATOM 808 CB LYS A 646 2.629 18.174 -27.515 1.00 25.00 C ATOM 809 CG LYS A 646 2.146 18.642 -28.919 1.00 25.00 C ATOM 810 CD LYS A 646 2.930 19.829 -29.524 1.00 25.00 C ATOM 811 CE LYS A 646 2.776 21.121 -28.723 1.00 25.00 C ATOM 812 NZ LYS A 646 3.559 22.236 -29.362 1.00 25.00 N ATOM 0 H LYS A 646 3.879 16.559 -28.966 1.00 25.00 H new ATOM 0 HA LYS A 646 4.579 18.938 -27.495 1.00 25.00 H new ATOM 0 HB2 LYS A 646 2.114 17.248 -27.257 1.00 25.00 H new ATOM 0 HB3 LYS A 646 2.334 18.919 -26.776 1.00 25.00 H new ATOM 0 HG2 LYS A 646 2.208 17.798 -29.606 1.00 25.00 H new ATOM 0 HG3 LYS A 646 1.094 18.920 -28.850 1.00 25.00 H new ATOM 0 HD2 LYS A 646 3.987 19.567 -29.580 1.00 25.00 H new ATOM 0 HD3 LYS A 646 2.589 19.999 -30.545 1.00 25.00 H new ATOM 0 HE2 LYS A 646 1.723 21.396 -28.665 1.00 25.00 H new ATOM 0 HE3 LYS A 646 3.122 20.965 -27.701 1.00 25.00 H new ATOM 0 HZ1 LYS A 646 3.250 23.147 -28.968 1.00 25.00 H new ATOM 0 HZ2 LYS A 646 4.573 22.102 -29.171 1.00 25.00 H new ATOM 0 HZ3 LYS A 646 3.396 22.230 -30.389 1.00 25.00 H new ATOM 826 N PRO A 647 5.053 18.058 -25.123 1.00 25.00 N ATOM 827 CA PRO A 647 5.668 17.383 -23.972 1.00 25.00 C ATOM 828 C PRO A 647 4.750 16.629 -23.010 1.00 25.00 C ATOM 829 O PRO A 647 5.088 15.518 -22.595 1.00 25.00 O ATOM 830 CB PRO A 647 6.382 18.531 -23.250 1.00 25.00 C ATOM 831 CG PRO A 647 5.580 19.742 -23.591 1.00 25.00 C ATOM 832 CD PRO A 647 5.183 19.525 -25.029 1.00 25.00 C ATOM 0 HA PRO A 647 6.297 16.569 -24.333 1.00 25.00 H new ATOM 0 HB2 PRO A 647 6.412 18.365 -22.173 1.00 25.00 H new ATOM 0 HB3 PRO A 647 7.414 18.631 -23.586 1.00 25.00 H new ATOM 0 HG2 PRO A 647 4.706 19.837 -22.946 1.00 25.00 H new ATOM 0 HG3 PRO A 647 6.165 20.654 -23.472 1.00 25.00 H new ATOM 0 HD2 PRO A 647 4.247 20.029 -25.269 1.00 25.00 H new ATOM 0 HD3 PRO A 647 5.937 19.908 -25.717 1.00 25.00 H new ATOM 840 N GLU A 648 3.623 17.213 -22.635 1.00 25.00 N ATOM 841 CA GLU A 648 2.735 16.602 -21.649 1.00 25.00 C ATOM 842 C GLU A 648 1.339 17.178 -21.780 1.00 25.00 C ATOM 843 O GLU A 648 1.191 18.384 -21.973 1.00 25.00 O ATOM 844 CB GLU A 648 3.288 16.910 -20.234 1.00 25.00 C ATOM 845 CG GLU A 648 2.262 16.945 -19.065 1.00 25.00 C ATOM 846 CD GLU A 648 1.802 18.380 -18.705 1.00 25.00 C ATOM 847 OE1 GLU A 648 2.648 19.196 -18.285 1.00 25.00 O ATOM 848 OE2 GLU A 648 0.592 18.689 -18.824 1.00 25.00 O ATOM 0 H GLU A 648 3.298 18.110 -22.997 1.00 25.00 H new ATOM 0 HA GLU A 648 2.688 15.525 -21.813 1.00 25.00 H new ATOM 0 HB2 GLU A 648 4.046 16.163 -19.997 1.00 25.00 H new ATOM 0 HB3 GLU A 648 3.792 17.876 -20.271 1.00 25.00 H new ATOM 0 HG2 GLU A 648 1.391 16.348 -19.335 1.00 25.00 H new ATOM 0 HG3 GLU A 648 2.707 16.481 -18.185 1.00 25.00 H new ATOM 855 N ILE A 649 0.325 16.331 -21.636 1.00 25.00 N ATOM 856 CA ILE A 649 -1.023 16.792 -21.424 1.00 25.00 C ATOM 857 C ILE A 649 -1.391 16.062 -20.133 1.00 25.00 C ATOM 858 O ILE A 649 -1.484 14.837 -20.087 1.00 25.00 O ATOM 859 CB ILE A 649 -1.995 16.415 -22.575 1.00 25.00 C ATOM 860 CG1 ILE A 649 -1.461 16.896 -23.945 1.00 25.00 C ATOM 861 CG2 ILE A 649 -3.402 16.973 -22.295 1.00 25.00 C ATOM 862 CD1 ILE A 649 -1.432 18.426 -24.149 1.00 25.00 C ATOM 0 H ILE A 649 0.423 15.316 -21.664 1.00 25.00 H new ATOM 0 HA ILE A 649 -1.095 17.879 -21.379 1.00 25.00 H new ATOM 0 HB ILE A 649 -2.063 15.328 -22.620 1.00 25.00 H new ATOM 0 HG12 ILE A 649 -0.450 16.511 -24.076 1.00 25.00 H new ATOM 0 HG13 ILE A 649 -2.075 16.454 -24.730 1.00 25.00 H new ATOM 0 HG21 ILE A 649 -4.071 16.700 -23.111 1.00 25.00 H new ATOM 0 HG22 ILE A 649 -3.780 16.556 -21.361 1.00 25.00 H new ATOM 0 HG23 ILE A 649 -3.353 18.059 -22.214 1.00 25.00 H new ATOM 0 HD11 ILE A 649 -1.041 18.653 -25.141 1.00 25.00 H new ATOM 0 HD12 ILE A 649 -2.442 18.825 -24.057 1.00 25.00 H new ATOM 0 HD13 ILE A 649 -0.792 18.882 -23.394 1.00 25.00 H new ATOM 874 N ARG A 650 -1.577 16.861 -19.106 1.00 25.00 N ATOM 875 CA ARG A 650 -1.994 16.459 -17.763 1.00 25.00 C ATOM 876 C ARG A 650 -3.429 16.119 -17.769 1.00 25.00 C ATOM 877 O ARG A 650 -4.135 16.782 -18.461 1.00 25.00 O ATOM 878 CB ARG A 650 -1.874 17.650 -16.813 1.00 25.00 C ATOM 879 CG ARG A 650 -2.798 18.871 -17.236 1.00 25.00 C ATOM 880 CD ARG A 650 -2.292 20.161 -16.606 1.00 25.00 C ATOM 881 NE ARG A 650 -0.896 20.392 -17.038 1.00 25.00 N ATOM 882 CZ ARG A 650 -0.107 21.381 -16.650 1.00 25.00 C ATOM 883 NH1 ARG A 650 -0.511 22.318 -15.826 1.00 25.00 N ATOM 884 NH2 ARG A 650 1.117 21.418 -17.092 1.00 25.00 N ATOM 0 H ARG A 650 -1.436 17.868 -19.181 1.00 25.00 H new ATOM 0 HA ARG A 650 -1.372 15.618 -17.456 1.00 25.00 H new ATOM 0 HB2 ARG A 650 -2.139 17.332 -15.804 1.00 25.00 H new ATOM 0 HB3 ARG A 650 -0.836 17.980 -16.781 1.00 25.00 H new ATOM 0 HG2 ARG A 650 -2.809 18.969 -18.322 1.00 25.00 H new ATOM 0 HG3 ARG A 650 -3.825 18.684 -16.923 1.00 25.00 H new ATOM 0 HD2 ARG A 650 -2.922 20.999 -16.905 1.00 25.00 H new ATOM 0 HD3 ARG A 650 -2.344 20.095 -15.519 1.00 25.00 H new ATOM 0 HE ARG A 650 -0.503 19.723 -17.700 1.00 25.00 H new ATOM 0 HH11 ARG A 650 -1.463 22.300 -15.461 1.00 25.00 H new ATOM 0 HH12 ARG A 650 0.127 23.064 -15.550 1.00 25.00 H new ATOM 0 HH21 ARG A 650 1.452 20.693 -17.726 1.00 25.00 H new ATOM 0 HH22 ARG A 650 1.740 22.172 -16.804 1.00 25.00 H new ATOM 898 N LEU A 651 -3.881 15.133 -17.017 1.00 25.00 N ATOM 899 CA LEU A 651 -5.311 15.075 -16.678 1.00 25.00 C ATOM 900 C LEU A 651 -5.509 14.416 -15.311 1.00 25.00 C ATOM 901 O LEU A 651 -4.673 13.622 -14.889 1.00 25.00 O ATOM 902 CB LEU A 651 -6.156 14.438 -17.795 1.00 25.00 C ATOM 903 CG LEU A 651 -6.880 15.410 -18.782 1.00 25.00 C ATOM 904 CD1 LEU A 651 -7.125 16.917 -18.246 1.00 25.00 C ATOM 905 CD2 LEU A 651 -6.159 15.481 -20.150 1.00 25.00 C ATOM 0 H LEU A 651 -3.310 14.379 -16.635 1.00 25.00 H new ATOM 0 HA LEU A 651 -5.684 16.096 -16.598 1.00 25.00 H new ATOM 0 HB2 LEU A 651 -5.508 13.784 -18.379 1.00 25.00 H new ATOM 0 HB3 LEU A 651 -6.911 13.805 -17.329 1.00 25.00 H new ATOM 0 HG LEU A 651 -7.867 14.959 -18.882 1.00 25.00 H new ATOM 0 HD11 LEU A 651 -7.634 17.498 -19.015 1.00 25.00 H new ATOM 0 HD12 LEU A 651 -7.740 16.888 -17.347 1.00 25.00 H new ATOM 0 HD13 LEU A 651 -6.166 17.381 -18.015 1.00 25.00 H new ATOM 0 HD21 LEU A 651 -6.693 16.167 -20.808 1.00 25.00 H new ATOM 0 HD22 LEU A 651 -5.139 15.837 -20.006 1.00 25.00 H new ATOM 0 HD23 LEU A 651 -6.137 14.489 -20.601 1.00 25.00 H new ATOM 917 N PRO A 652 -6.596 14.765 -14.585 1.00 25.00 N ATOM 918 CA PRO A 652 -6.799 14.220 -13.237 1.00 25.00 C ATOM 919 C PRO A 652 -7.372 12.821 -13.262 1.00 25.00 C ATOM 920 O PRO A 652 -7.751 12.337 -14.300 1.00 25.00 O ATOM 921 CB PRO A 652 -7.849 15.169 -12.656 1.00 25.00 C ATOM 922 CG PRO A 652 -8.694 15.494 -13.827 1.00 25.00 C ATOM 923 CD PRO A 652 -7.699 15.685 -14.941 1.00 25.00 C ATOM 0 HA PRO A 652 -5.866 14.153 -12.678 1.00 25.00 H new ATOM 0 HB2 PRO A 652 -8.426 14.694 -11.862 1.00 25.00 H new ATOM 0 HB3 PRO A 652 -7.393 16.062 -12.228 1.00 25.00 H new ATOM 0 HG2 PRO A 652 -9.396 14.690 -14.050 1.00 25.00 H new ATOM 0 HG3 PRO A 652 -9.284 16.395 -13.658 1.00 25.00 H new ATOM 0 HD2 PRO A 652 -8.131 15.437 -15.911 1.00 25.00 H new ATOM 0 HD3 PRO A 652 -7.356 16.718 -14.999 1.00 25.00 H new ATOM 931 N SER A 653 -7.465 12.192 -12.100 1.00 25.00 N ATOM 932 CA SER A 653 -8.088 10.878 -11.983 1.00 25.00 C ATOM 933 C SER A 653 -9.541 10.915 -12.459 1.00 25.00 C ATOM 934 O SER A 653 -10.068 9.936 -12.975 1.00 25.00 O ATOM 935 CB SER A 653 -8.057 10.454 -10.520 1.00 25.00 C ATOM 936 OG SER A 653 -8.636 11.458 -9.696 1.00 25.00 O ATOM 0 H SER A 653 -7.116 12.571 -11.220 1.00 25.00 H new ATOM 0 HA SER A 653 -7.539 10.171 -12.605 1.00 25.00 H new ATOM 0 HB2 SER A 653 -8.599 9.517 -10.396 1.00 25.00 H new ATOM 0 HB3 SER A 653 -7.028 10.271 -10.211 1.00 25.00 H new ATOM 0 HG SER A 653 -8.609 11.169 -8.760 1.00 25.00 H new ATOM 942 N GLY A 654 -10.173 12.069 -12.283 1.00 25.00 N ATOM 943 CA GLY A 654 -11.566 12.262 -12.659 1.00 25.00 C ATOM 944 C GLY A 654 -11.785 12.702 -14.098 1.00 25.00 C ATOM 945 O GLY A 654 -12.475 13.686 -14.346 1.00 25.00 O ATOM 0 H GLY A 654 -9.734 12.895 -11.876 1.00 25.00 H new ATOM 0 HA2 GLY A 654 -12.105 11.329 -12.494 1.00 25.00 H new ATOM 0 HA3 GLY A 654 -12.007 13.006 -11.996 1.00 25.00 H new ATOM 949 N SER A 655 -11.206 11.983 -15.045 1.00 25.00 N ATOM 950 CA SER A 655 -11.416 12.255 -16.468 1.00 25.00 C ATOM 951 C SER A 655 -11.587 10.916 -17.194 1.00 25.00 C ATOM 952 O SER A 655 -10.627 10.180 -17.359 1.00 25.00 O ATOM 953 CB SER A 655 -10.243 13.053 -17.058 1.00 25.00 C ATOM 954 OG SER A 655 -9.013 12.380 -16.854 1.00 25.00 O ATOM 0 H SER A 655 -10.581 11.199 -14.858 1.00 25.00 H new ATOM 0 HA SER A 655 -12.311 12.863 -16.597 1.00 25.00 H new ATOM 0 HB2 SER A 655 -10.404 13.207 -18.125 1.00 25.00 H new ATOM 0 HB3 SER A 655 -10.202 14.040 -16.596 1.00 25.00 H new ATOM 0 HG SER A 655 -8.738 12.477 -15.918 1.00 25.00 H new ATOM 960 N ASP A 656 -12.807 10.609 -17.610 1.00 25.00 N ATOM 961 CA ASP A 656 -13.126 9.331 -18.277 1.00 25.00 C ATOM 962 C ASP A 656 -12.570 9.254 -19.701 1.00 25.00 C ATOM 963 O ASP A 656 -12.472 8.182 -20.298 1.00 25.00 O ATOM 964 CB ASP A 656 -14.646 9.137 -18.361 1.00 25.00 C ATOM 965 CG ASP A 656 -15.301 8.996 -16.998 1.00 25.00 C ATOM 966 OD1 ASP A 656 -15.334 9.998 -16.251 1.00 25.00 O ATOM 967 OD2 ASP A 656 -15.792 7.891 -16.674 1.00 25.00 O ATOM 0 H ASP A 656 -13.610 11.229 -17.501 1.00 25.00 H new ATOM 0 HA ASP A 656 -12.661 8.552 -17.674 1.00 25.00 H new ATOM 0 HB2 ASP A 656 -15.087 9.986 -18.884 1.00 25.00 H new ATOM 0 HB3 ASP A 656 -14.861 8.249 -18.955 1.00 25.00 H new ATOM 972 N HIS A 657 -12.207 10.398 -20.253 1.00 25.00 N ATOM 973 CA HIS A 657 -11.631 10.464 -21.585 1.00 25.00 C ATOM 974 C HIS A 657 -10.783 11.721 -21.650 1.00 25.00 C ATOM 975 O HIS A 657 -10.914 12.609 -20.806 1.00 25.00 O ATOM 976 CB HIS A 657 -12.725 10.485 -22.661 1.00 25.00 C ATOM 977 CG HIS A 657 -13.609 11.691 -22.606 1.00 25.00 C ATOM 978 ND1 HIS A 657 -13.384 12.852 -23.304 1.00 25.00 N ATOM 979 CD2 HIS A 657 -14.763 11.912 -21.916 1.00 25.00 C ATOM 980 CE1 HIS A 657 -14.366 13.703 -23.023 1.00 25.00 C ATOM 981 NE2 HIS A 657 -15.239 13.180 -22.185 1.00 25.00 N ATOM 0 H HIS A 657 -12.302 11.304 -19.794 1.00 25.00 H new ATOM 0 HA HIS A 657 -11.021 9.581 -21.777 1.00 25.00 H new ATOM 0 HB2 HIS A 657 -12.255 10.436 -23.643 1.00 25.00 H new ATOM 0 HB3 HIS A 657 -13.340 9.591 -22.557 1.00 25.00 H new ATOM 0 HD2 HIS A 657 -15.236 11.200 -21.256 1.00 25.00 H new ATOM 0 HE1 HIS A 657 -14.440 14.700 -23.431 1.00 25.00 H new ATOM 0 HE2 HIS A 657 -16.083 13.617 -21.815 1.00 25.00 H new ATOM 989 N VAL A 658 -9.926 11.801 -22.654 1.00 25.00 N ATOM 990 CA VAL A 658 -9.087 12.974 -22.868 1.00 25.00 C ATOM 991 C VAL A 658 -9.293 13.404 -24.305 1.00 25.00 C ATOM 992 O VAL A 658 -9.268 12.584 -25.223 1.00 25.00 O ATOM 993 CB VAL A 658 -7.566 12.687 -22.562 1.00 25.00 C ATOM 994 CG1 VAL A 658 -7.161 11.276 -22.994 1.00 25.00 C ATOM 995 CG2 VAL A 658 -6.648 13.718 -23.255 1.00 25.00 C ATOM 0 H VAL A 658 -9.791 11.060 -23.342 1.00 25.00 H new ATOM 0 HA VAL A 658 -9.373 13.769 -22.179 1.00 25.00 H new ATOM 0 HB VAL A 658 -7.443 12.772 -21.482 1.00 25.00 H new ATOM 0 HG11 VAL A 658 -6.107 11.115 -22.768 1.00 25.00 H new ATOM 0 HG12 VAL A 658 -7.764 10.544 -22.457 1.00 25.00 H new ATOM 0 HG13 VAL A 658 -7.323 11.163 -24.066 1.00 25.00 H new ATOM 0 HG21 VAL A 658 -5.607 13.492 -23.024 1.00 25.00 H new ATOM 0 HG22 VAL A 658 -6.798 13.672 -24.334 1.00 25.00 H new ATOM 0 HG23 VAL A 658 -6.890 14.719 -22.897 1.00 25.00 H new ATOM 1005 N MET A 659 -9.510 14.694 -24.501 1.00 25.00 N ATOM 1006 CA MET A 659 -9.659 15.242 -25.837 1.00 25.00 C ATOM 1007 C MET A 659 -8.375 15.973 -26.182 1.00 25.00 C ATOM 1008 O MET A 659 -7.896 16.805 -25.412 1.00 25.00 O ATOM 1009 CB MET A 659 -10.850 16.194 -25.921 1.00 25.00 C ATOM 1010 CG MET A 659 -11.071 16.721 -27.326 1.00 25.00 C ATOM 1011 SD MET A 659 -12.794 16.680 -27.786 1.00 25.00 S ATOM 1012 CE MET A 659 -12.644 16.636 -29.575 1.00 25.00 C ATOM 0 H MET A 659 -9.587 15.381 -23.751 1.00 25.00 H new ATOM 0 HA MET A 659 -9.846 14.435 -26.545 1.00 25.00 H new ATOM 0 HB2 MET A 659 -11.749 15.678 -25.584 1.00 25.00 H new ATOM 0 HB3 MET A 659 -10.690 17.032 -25.242 1.00 25.00 H new ATOM 0 HG2 MET A 659 -10.701 17.744 -27.393 1.00 25.00 H new ATOM 0 HG3 MET A 659 -10.492 16.126 -28.032 1.00 25.00 H new ATOM 0 HE1 MET A 659 -13.607 16.377 -30.015 1.00 25.00 H new ATOM 0 HE2 MET A 659 -12.331 17.615 -29.938 1.00 25.00 H new ATOM 0 HE3 MET A 659 -11.903 15.889 -29.860 1.00 25.00 H new ATOM 1022 N LEU A 660 -7.825 15.653 -27.339 1.00 25.00 N ATOM 1023 CA LEU A 660 -6.608 16.281 -27.826 1.00 25.00 C ATOM 1024 C LEU A 660 -6.996 17.105 -29.025 1.00 25.00 C ATOM 1025 O LEU A 660 -7.960 16.782 -29.713 1.00 25.00 O ATOM 1026 CB LEU A 660 -5.583 15.230 -28.249 1.00 25.00 C ATOM 1027 CG LEU A 660 -5.057 14.301 -27.149 1.00 25.00 C ATOM 1028 CD1 LEU A 660 -4.142 13.280 -27.792 1.00 25.00 C ATOM 1029 CD2 LEU A 660 -4.296 15.074 -26.069 1.00 25.00 C ATOM 0 H LEU A 660 -8.209 14.949 -27.969 1.00 25.00 H new ATOM 0 HA LEU A 660 -6.157 16.889 -27.042 1.00 25.00 H new ATOM 0 HB2 LEU A 660 -6.029 14.614 -29.030 1.00 25.00 H new ATOM 0 HB3 LEU A 660 -4.732 15.745 -28.696 1.00 25.00 H new ATOM 0 HG LEU A 660 -5.902 13.814 -26.662 1.00 25.00 H new ATOM 0 HD11 LEU A 660 -3.754 12.606 -27.028 1.00 25.00 H new ATOM 0 HD12 LEU A 660 -4.700 12.706 -28.532 1.00 25.00 H new ATOM 0 HD13 LEU A 660 -3.312 13.791 -28.280 1.00 25.00 H new ATOM 0 HD21 LEU A 660 -3.939 14.380 -25.308 1.00 25.00 H new ATOM 0 HD22 LEU A 660 -3.446 15.587 -26.519 1.00 25.00 H new ATOM 0 HD23 LEU A 660 -4.960 15.806 -25.610 1.00 25.00 H new ATOM 1041 N LYS A 661 -6.241 18.158 -29.280 1.00 25.00 N ATOM 1042 CA LYS A 661 -6.475 19.035 -30.419 1.00 25.00 C ATOM 1043 C LYS A 661 -5.145 19.677 -30.721 1.00 25.00 C ATOM 1044 O LYS A 661 -4.172 19.366 -30.041 1.00 25.00 O ATOM 1045 CB LYS A 661 -7.587 20.052 -30.129 1.00 25.00 C ATOM 1046 CG LYS A 661 -7.379 20.952 -28.927 1.00 25.00 C ATOM 1047 CD LYS A 661 -8.627 21.773 -28.715 1.00 25.00 C ATOM 1048 CE LYS A 661 -8.468 22.655 -27.509 1.00 25.00 C ATOM 1049 NZ LYS A 661 -9.738 23.419 -27.238 1.00 25.00 N ATOM 0 H LYS A 661 -5.446 18.432 -28.703 1.00 25.00 H new ATOM 0 HA LYS A 661 -6.834 18.486 -31.289 1.00 25.00 H new ATOM 0 HB2 LYS A 661 -7.713 20.682 -31.010 1.00 25.00 H new ATOM 0 HB3 LYS A 661 -8.521 19.507 -29.991 1.00 25.00 H new ATOM 0 HG2 LYS A 661 -7.165 20.355 -28.041 1.00 25.00 H new ATOM 0 HG3 LYS A 661 -6.520 21.604 -29.087 1.00 25.00 H new ATOM 0 HD2 LYS A 661 -8.825 22.382 -29.597 1.00 25.00 H new ATOM 0 HD3 LYS A 661 -9.486 21.115 -28.583 1.00 25.00 H new ATOM 0 HE2 LYS A 661 -8.210 22.049 -26.641 1.00 25.00 H new ATOM 0 HE3 LYS A 661 -7.645 23.352 -27.668 1.00 25.00 H new ATOM 0 HZ1 LYS A 661 -9.608 24.023 -26.401 1.00 25.00 H new ATOM 0 HZ2 LYS A 661 -9.968 24.012 -28.060 1.00 25.00 H new ATOM 0 HZ3 LYS A 661 -10.515 22.750 -27.065 1.00 25.00 H new ATOM 1063 N SER A 662 -5.100 20.543 -31.728 1.00 25.00 N ATOM 1064 CA SER A 662 -3.845 21.155 -32.200 1.00 25.00 C ATOM 1065 C SER A 662 -2.964 20.015 -32.710 1.00 25.00 C ATOM 1066 O SER A 662 -1.814 19.852 -32.309 1.00 25.00 O ATOM 1067 CB SER A 662 -3.142 21.975 -31.105 1.00 25.00 C ATOM 1068 OG SER A 662 -2.056 22.707 -31.644 1.00 25.00 O ATOM 0 H SER A 662 -5.926 20.845 -32.245 1.00 25.00 H new ATOM 0 HA SER A 662 -4.052 21.870 -32.996 1.00 25.00 H new ATOM 0 HB2 SER A 662 -3.854 22.659 -30.643 1.00 25.00 H new ATOM 0 HB3 SER A 662 -2.784 21.310 -30.320 1.00 25.00 H new ATOM 0 HG SER A 662 -1.400 22.086 -32.026 1.00 25.00 H new ATOM 1074 N LEU A 663 -3.559 19.228 -33.596 1.00 25.00 N ATOM 1075 CA LEU A 663 -2.942 18.055 -34.196 1.00 25.00 C ATOM 1076 C LEU A 663 -3.340 18.071 -35.667 1.00 25.00 C ATOM 1077 O LEU A 663 -4.299 18.753 -36.034 1.00 25.00 O ATOM 1078 CB LEU A 663 -3.448 16.782 -33.490 1.00 25.00 C ATOM 1079 CG LEU A 663 -4.974 16.624 -33.263 1.00 25.00 C ATOM 1080 CD1 LEU A 663 -5.728 16.125 -34.485 1.00 25.00 C ATOM 1081 CD2 LEU A 663 -5.189 15.655 -32.106 1.00 25.00 C ATOM 0 H LEU A 663 -4.510 19.393 -33.926 1.00 25.00 H new ATOM 0 HA LEU A 663 -1.857 18.065 -34.095 1.00 25.00 H new ATOM 0 HB2 LEU A 663 -3.107 15.923 -34.069 1.00 25.00 H new ATOM 0 HB3 LEU A 663 -2.960 16.725 -32.517 1.00 25.00 H new ATOM 0 HG LEU A 663 -5.373 17.614 -33.043 1.00 25.00 H new ATOM 0 HD11 LEU A 663 -6.789 16.040 -34.248 1.00 25.00 H new ATOM 0 HD12 LEU A 663 -5.595 16.828 -35.307 1.00 25.00 H new ATOM 0 HD13 LEU A 663 -5.342 15.148 -34.777 1.00 25.00 H new ATOM 0 HD21 LEU A 663 -6.257 15.530 -31.930 1.00 25.00 H new ATOM 0 HD22 LEU A 663 -4.746 14.690 -32.353 1.00 25.00 H new ATOM 0 HD23 LEU A 663 -4.717 16.051 -31.207 1.00 25.00 H new ATOM 1093 N ASP A 664 -2.617 17.348 -36.503 1.00 25.00 N ATOM 1094 CA ASP A 664 -2.924 17.319 -37.933 1.00 25.00 C ATOM 1095 C ASP A 664 -4.221 16.556 -38.152 1.00 25.00 C ATOM 1096 O ASP A 664 -4.472 15.550 -37.509 1.00 25.00 O ATOM 1097 CB ASP A 664 -1.820 16.619 -38.728 1.00 25.00 C ATOM 1098 CG ASP A 664 -0.545 17.443 -38.824 1.00 25.00 C ATOM 1099 OD1 ASP A 664 -0.560 18.636 -38.478 1.00 25.00 O ATOM 1100 OD2 ASP A 664 0.491 16.879 -39.245 1.00 25.00 O ATOM 0 H ASP A 664 -1.819 16.776 -36.226 1.00 25.00 H new ATOM 0 HA ASP A 664 -3.010 18.350 -38.277 1.00 25.00 H new ATOM 0 HB2 ASP A 664 -1.593 15.662 -38.259 1.00 25.00 H new ATOM 0 HB3 ASP A 664 -2.184 16.404 -39.733 1.00 25.00 H new ATOM 1105 N TRP A 665 -5.055 17.038 -39.056 1.00 25.00 N ATOM 1106 CA TRP A 665 -6.305 16.354 -39.386 1.00 25.00 C ATOM 1107 C TRP A 665 -6.259 15.833 -40.813 1.00 25.00 C ATOM 1108 O TRP A 665 -6.845 14.808 -41.132 1.00 25.00 O ATOM 1109 CB TRP A 665 -7.491 17.295 -39.175 1.00 25.00 C ATOM 1110 CG TRP A 665 -7.249 18.679 -39.706 1.00 25.00 C ATOM 1111 CD1 TRP A 665 -6.621 19.702 -39.073 1.00 25.00 C ATOM 1112 CD2 TRP A 665 -7.627 19.205 -40.994 1.00 25.00 C ATOM 1113 NE1 TRP A 665 -6.567 20.818 -39.848 1.00 25.00 N ATOM 1114 CE2 TRP A 665 -7.169 20.556 -41.045 1.00 25.00 C ATOM 1115 CE3 TRP A 665 -8.305 18.676 -42.111 1.00 25.00 C ATOM 1116 CZ2 TRP A 665 -7.360 21.376 -42.176 1.00 25.00 C ATOM 1117 CZ3 TRP A 665 -8.500 19.500 -43.253 1.00 25.00 C ATOM 1118 CH2 TRP A 665 -8.017 20.842 -43.270 1.00 25.00 C ATOM 0 H TRP A 665 -4.895 17.900 -39.578 1.00 25.00 H new ATOM 0 HA TRP A 665 -6.431 15.499 -38.722 1.00 25.00 H new ATOM 0 HB2 TRP A 665 -8.371 16.875 -39.662 1.00 25.00 H new ATOM 0 HB3 TRP A 665 -7.714 17.355 -38.110 1.00 25.00 H new ATOM 0 HD1 TRP A 665 -6.214 19.638 -38.075 1.00 25.00 H new ATOM 0 HE1 TRP A 665 -6.145 21.707 -39.579 1.00 25.00 H new ATOM 0 HE3 TRP A 665 -8.671 17.660 -42.099 1.00 25.00 H new ATOM 0 HZ2 TRP A 665 -7.002 22.395 -42.188 1.00 25.00 H new ATOM 0 HZ3 TRP A 665 -9.018 19.107 -44.115 1.00 25.00 H new ATOM 0 HH2 TRP A 665 -8.166 21.450 -44.150 1.00 25.00 H new ATOM 1129 N ASN A 666 -5.542 16.549 -41.668 1.00 25.00 N ATOM 1130 CA ASN A 666 -5.378 16.190 -43.076 1.00 25.00 C ATOM 1131 C ASN A 666 -4.108 15.371 -43.273 1.00 25.00 C ATOM 1132 O ASN A 666 -3.704 15.100 -44.404 1.00 25.00 O ATOM 1133 CB ASN A 666 -5.279 17.464 -43.921 1.00 25.00 C ATOM 1134 CG ASN A 666 -4.066 18.289 -43.571 1.00 25.00 C ATOM 1135 OD1 ASN A 666 -3.902 18.720 -42.438 1.00 25.00 O ATOM 1136 ND2 ASN A 666 -3.214 18.505 -44.530 1.00 25.00 N ATOM 0 H ASN A 666 -5.052 17.404 -41.405 1.00 25.00 H new ATOM 0 HA ASN A 666 -6.240 15.598 -43.385 1.00 25.00 H new ATOM 0 HB2 ASN A 666 -5.241 17.195 -44.977 1.00 25.00 H new ATOM 0 HB3 ASN A 666 -6.178 18.064 -43.777 1.00 25.00 H new ATOM 0 HD21 ASN A 666 -2.372 19.052 -44.350 1.00 25.00 H new ATOM 0 HD22 ASN A 666 -3.388 18.128 -45.461 1.00 25.00 H new ATOM 1143 N ALA A 667 -3.486 14.996 -42.169 1.00 25.00 N ATOM 1144 CA ALA A 667 -2.261 14.210 -42.180 1.00 25.00 C ATOM 1145 C ALA A 667 -2.276 13.400 -40.891 1.00 25.00 C ATOM 1146 O ALA A 667 -3.039 13.709 -39.977 1.00 25.00 O ATOM 1147 CB ALA A 667 -1.025 15.119 -42.255 1.00 25.00 C ATOM 0 H ALA A 667 -3.817 15.229 -41.233 1.00 25.00 H new ATOM 0 HA ALA A 667 -2.210 13.560 -43.053 1.00 25.00 H new ATOM 0 HB1 ALA A 667 -0.123 14.507 -42.262 1.00 25.00 H new ATOM 0 HB2 ALA A 667 -1.066 15.715 -43.167 1.00 25.00 H new ATOM 0 HB3 ALA A 667 -1.007 15.781 -41.390 1.00 25.00 H new ATOM 1153 N GLU A 668 -1.459 12.366 -40.837 1.00 25.00 N ATOM 1154 CA GLU A 668 -1.425 11.457 -39.692 1.00 25.00 C ATOM 1155 C GLU A 668 -0.580 11.949 -38.529 1.00 25.00 C ATOM 1156 O GLU A 668 0.415 12.658 -38.692 1.00 25.00 O ATOM 1157 CB GLU A 668 -0.988 10.039 -40.121 1.00 25.00 C ATOM 1158 CG GLU A 668 -0.117 9.942 -41.391 1.00 25.00 C ATOM 1159 CD GLU A 668 -0.900 10.170 -42.693 1.00 25.00 C ATOM 1160 OE1 GLU A 668 -0.698 11.233 -43.321 1.00 25.00 O ATOM 1161 OE2 GLU A 668 -1.716 9.307 -43.082 1.00 25.00 O ATOM 0 H GLU A 668 -0.800 12.127 -41.578 1.00 25.00 H new ATOM 0 HA GLU A 668 -2.449 11.423 -39.321 1.00 25.00 H new ATOM 0 HB2 GLU A 668 -0.439 9.587 -39.295 1.00 25.00 H new ATOM 0 HB3 GLU A 668 -1.884 9.438 -40.275 1.00 25.00 H new ATOM 0 HG2 GLU A 668 0.687 10.676 -41.327 1.00 25.00 H new ATOM 0 HG3 GLU A 668 0.351 8.958 -41.426 1.00 25.00 H new ATOM 1168 N TYR A 669 -1.003 11.549 -37.340 1.00 25.00 N ATOM 1169 CA TYR A 669 -0.325 11.896 -36.103 1.00 25.00 C ATOM 1170 C TYR A 669 -0.374 10.688 -35.190 1.00 25.00 C ATOM 1171 O TYR A 669 -1.222 9.811 -35.364 1.00 25.00 O ATOM 1172 CB TYR A 669 -1.015 13.091 -35.438 1.00 25.00 C ATOM 1173 CG TYR A 669 -2.461 12.852 -35.111 1.00 25.00 C ATOM 1174 CD1 TYR A 669 -3.458 13.098 -36.069 1.00 25.00 C ATOM 1175 CD2 TYR A 669 -2.848 12.377 -33.843 1.00 25.00 C ATOM 1176 CE1 TYR A 669 -4.815 12.890 -35.770 1.00 25.00 C ATOM 1177 CE2 TYR A 669 -4.214 12.167 -33.539 1.00 25.00 C ATOM 1178 CZ TYR A 669 -5.180 12.434 -34.510 1.00 25.00 C ATOM 1179 OH TYR A 669 -6.498 12.261 -34.232 1.00 25.00 O ATOM 0 H TYR A 669 -1.832 10.970 -37.206 1.00 25.00 H new ATOM 0 HA TYR A 669 0.709 12.175 -36.305 1.00 25.00 H new ATOM 0 HB2 TYR A 669 -0.482 13.342 -34.521 1.00 25.00 H new ATOM 0 HB3 TYR A 669 -0.940 13.955 -36.098 1.00 25.00 H new ATOM 0 HD1 TYR A 669 -3.178 13.452 -37.050 1.00 25.00 H new ATOM 0 HD2 TYR A 669 -2.096 12.171 -33.096 1.00 25.00 H new ATOM 0 HE1 TYR A 669 -5.571 13.084 -36.517 1.00 25.00 H new ATOM 0 HE2 TYR A 669 -4.506 11.804 -32.565 1.00 25.00 H new ATOM 0 HH TYR A 669 -7.038 12.718 -34.910 1.00 25.00 H new ATOM 1189 N GLU A 670 0.537 10.640 -34.232 1.00 25.00 N ATOM 1190 CA GLU A 670 0.643 9.525 -33.299 1.00 25.00 C ATOM 1191 C GLU A 670 0.463 10.044 -31.876 1.00 25.00 C ATOM 1192 O GLU A 670 0.891 11.155 -31.544 1.00 25.00 O ATOM 1193 CB GLU A 670 2.003 8.826 -33.467 1.00 25.00 C ATOM 1194 CG GLU A 670 3.216 9.724 -33.217 1.00 25.00 C ATOM 1195 CD GLU A 670 4.526 9.050 -33.595 1.00 25.00 C ATOM 1196 OE1 GLU A 670 4.826 7.966 -33.048 1.00 25.00 O ATOM 1197 OE2 GLU A 670 5.265 9.613 -34.441 1.00 25.00 O ATOM 0 H GLU A 670 1.227 11.375 -34.077 1.00 25.00 H new ATOM 0 HA GLU A 670 -0.137 8.793 -33.506 1.00 25.00 H new ATOM 0 HB2 GLU A 670 2.048 7.978 -32.783 1.00 25.00 H new ATOM 0 HB3 GLU A 670 2.067 8.424 -34.478 1.00 25.00 H new ATOM 0 HG2 GLU A 670 3.106 10.645 -33.789 1.00 25.00 H new ATOM 0 HG3 GLU A 670 3.246 10.005 -32.164 1.00 25.00 H new ATOM 1204 N VAL A 671 -0.188 9.247 -31.042 1.00 25.00 N ATOM 1205 CA VAL A 671 -0.483 9.622 -29.659 1.00 25.00 C ATOM 1206 C VAL A 671 -0.049 8.515 -28.717 1.00 25.00 C ATOM 1207 O VAL A 671 -0.368 7.363 -28.957 1.00 25.00 O ATOM 1208 CB VAL A 671 -2.019 9.809 -29.468 1.00 25.00 C ATOM 1209 CG1 VAL A 671 -2.360 10.185 -28.018 1.00 25.00 C ATOM 1210 CG2 VAL A 671 -2.569 10.872 -30.431 1.00 25.00 C ATOM 0 H VAL A 671 -0.529 8.321 -31.301 1.00 25.00 H new ATOM 0 HA VAL A 671 0.049 10.548 -29.443 1.00 25.00 H new ATOM 0 HB VAL A 671 -2.493 8.854 -29.695 1.00 25.00 H new ATOM 0 HG11 VAL A 671 -3.438 10.308 -27.918 1.00 25.00 H new ATOM 0 HG12 VAL A 671 -2.021 9.395 -27.348 1.00 25.00 H new ATOM 0 HG13 VAL A 671 -1.862 11.119 -27.758 1.00 25.00 H new ATOM 0 HG21 VAL A 671 -3.642 10.982 -30.277 1.00 25.00 H new ATOM 0 HG22 VAL A 671 -2.075 11.825 -30.241 1.00 25.00 H new ATOM 0 HG23 VAL A 671 -2.380 10.564 -31.459 1.00 25.00 H new ATOM 1220 N TYR A 672 0.647 8.872 -27.645 1.00 25.00 N ATOM 1221 CA TYR A 672 1.041 7.937 -26.589 1.00 25.00 C ATOM 1222 C TYR A 672 0.421 8.430 -25.298 1.00 25.00 C ATOM 1223 O TYR A 672 0.386 9.631 -25.045 1.00 25.00 O ATOM 1224 CB TYR A 672 2.558 7.898 -26.422 1.00 25.00 C ATOM 1225 CG TYR A 672 3.228 7.044 -27.455 1.00 25.00 C ATOM 1226 CD1 TYR A 672 3.663 5.741 -27.137 1.00 25.00 C ATOM 1227 CD2 TYR A 672 3.419 7.518 -28.761 1.00 25.00 C ATOM 1228 CE1 TYR A 672 4.266 4.917 -28.119 1.00 25.00 C ATOM 1229 CE2 TYR A 672 4.033 6.704 -29.751 1.00 25.00 C ATOM 1230 CZ TYR A 672 4.451 5.410 -29.420 1.00 25.00 C ATOM 1231 OH TYR A 672 5.033 4.625 -30.379 1.00 25.00 O ATOM 0 H TYR A 672 0.959 9.829 -27.479 1.00 25.00 H new ATOM 0 HA TYR A 672 0.704 6.933 -26.846 1.00 25.00 H new ATOM 0 HB2 TYR A 672 2.953 8.912 -26.482 1.00 25.00 H new ATOM 0 HB3 TYR A 672 2.801 7.520 -25.429 1.00 25.00 H new ATOM 0 HD1 TYR A 672 3.535 5.366 -26.132 1.00 25.00 H new ATOM 0 HD2 TYR A 672 3.095 8.516 -29.018 1.00 25.00 H new ATOM 0 HE1 TYR A 672 4.582 3.915 -27.868 1.00 25.00 H new ATOM 0 HE2 TYR A 672 4.176 7.082 -30.753 1.00 25.00 H new ATOM 0 HH TYR A 672 5.083 5.122 -31.222 1.00 25.00 H new ATOM 1241 N VAL A 673 -0.076 7.517 -24.484 1.00 25.00 N ATOM 1242 CA VAL A 673 -0.730 7.878 -23.233 1.00 25.00 C ATOM 1243 C VAL A 673 -0.333 6.861 -22.166 1.00 25.00 C ATOM 1244 O VAL A 673 -0.215 5.660 -22.450 1.00 25.00 O ATOM 1245 CB VAL A 673 -2.291 7.955 -23.443 1.00 25.00 C ATOM 1246 CG1 VAL A 673 -2.824 6.700 -24.159 1.00 25.00 C ATOM 1247 CG2 VAL A 673 -3.030 8.198 -22.117 1.00 25.00 C ATOM 0 H VAL A 673 -0.040 6.514 -24.665 1.00 25.00 H new ATOM 0 HA VAL A 673 -0.409 8.865 -22.899 1.00 25.00 H new ATOM 0 HB VAL A 673 -2.489 8.812 -24.087 1.00 25.00 H new ATOM 0 HG11 VAL A 673 -3.903 6.785 -24.288 1.00 25.00 H new ATOM 0 HG12 VAL A 673 -2.348 6.608 -25.135 1.00 25.00 H new ATOM 0 HG13 VAL A 673 -2.599 5.817 -23.561 1.00 25.00 H new ATOM 0 HG21 VAL A 673 -4.103 8.245 -22.302 1.00 25.00 H new ATOM 0 HG22 VAL A 673 -2.816 7.382 -21.426 1.00 25.00 H new ATOM 0 HG23 VAL A 673 -2.695 9.139 -21.681 1.00 25.00 H new ATOM 1257 N VAL A 674 -0.114 7.344 -20.950 1.00 25.00 N ATOM 1258 CA VAL A 674 0.220 6.494 -19.806 1.00 25.00 C ATOM 1259 C VAL A 674 -0.582 6.961 -18.596 1.00 25.00 C ATOM 1260 O VAL A 674 -1.056 8.103 -18.545 1.00 25.00 O ATOM 1261 CB VAL A 674 1.750 6.541 -19.444 1.00 25.00 C ATOM 1262 CG1 VAL A 674 2.592 5.960 -20.573 1.00 25.00 C ATOM 1263 CG2 VAL A 674 2.212 7.967 -19.142 1.00 25.00 C ATOM 0 H VAL A 674 -0.162 8.338 -20.725 1.00 25.00 H new ATOM 0 HA VAL A 674 -0.025 5.467 -20.077 1.00 25.00 H new ATOM 0 HB VAL A 674 1.887 5.937 -18.547 1.00 25.00 H new ATOM 0 HG11 VAL A 674 3.646 6.003 -20.300 1.00 25.00 H new ATOM 0 HG12 VAL A 674 2.304 4.923 -20.745 1.00 25.00 H new ATOM 0 HG13 VAL A 674 2.429 6.538 -21.483 1.00 25.00 H new ATOM 0 HG21 VAL A 674 3.274 7.961 -18.896 1.00 25.00 H new ATOM 0 HG22 VAL A 674 2.046 8.596 -20.016 1.00 25.00 H new ATOM 0 HG23 VAL A 674 1.646 8.362 -18.298 1.00 25.00 H new ATOM 1273 N ALA A 675 -0.715 6.078 -17.620 1.00 25.00 N ATOM 1274 CA ALA A 675 -1.397 6.379 -16.373 1.00 25.00 C ATOM 1275 C ALA A 675 -0.318 6.531 -15.309 1.00 25.00 C ATOM 1276 O ALA A 675 0.722 5.876 -15.384 1.00 25.00 O ATOM 1277 CB ALA A 675 -2.344 5.249 -16.010 1.00 25.00 C ATOM 0 H ALA A 675 -0.351 5.127 -17.671 1.00 25.00 H new ATOM 0 HA ALA A 675 -1.990 7.290 -16.458 1.00 25.00 H new ATOM 0 HB1 ALA A 675 -2.850 5.485 -15.074 1.00 25.00 H new ATOM 0 HB2 ALA A 675 -3.084 5.126 -16.801 1.00 25.00 H new ATOM 0 HB3 ALA A 675 -1.779 4.324 -15.894 1.00 25.00 H new ATOM 1283 N GLU A 676 -0.572 7.372 -14.325 1.00 25.00 N ATOM 1284 CA GLU A 676 0.348 7.582 -13.216 1.00 25.00 C ATOM 1285 C GLU A 676 -0.469 7.424 -11.939 1.00 25.00 C ATOM 1286 O GLU A 676 -1.314 8.261 -11.636 1.00 25.00 O ATOM 1287 CB GLU A 676 0.942 8.992 -13.317 1.00 25.00 C ATOM 1288 CG GLU A 676 2.077 9.257 -12.359 1.00 25.00 C ATOM 1289 CD GLU A 676 2.609 10.667 -12.487 1.00 25.00 C ATOM 1290 OE1 GLU A 676 1.889 11.628 -12.151 1.00 25.00 O ATOM 1291 OE2 GLU A 676 3.768 10.810 -12.945 1.00 25.00 O ATOM 0 H GLU A 676 -1.423 7.932 -14.269 1.00 25.00 H new ATOM 0 HA GLU A 676 1.174 6.871 -13.227 1.00 25.00 H new ATOM 0 HB2 GLU A 676 1.296 9.152 -14.335 1.00 25.00 H new ATOM 0 HB3 GLU A 676 0.152 9.721 -13.136 1.00 25.00 H new ATOM 0 HG2 GLU A 676 1.736 9.090 -11.337 1.00 25.00 H new ATOM 0 HG3 GLU A 676 2.883 8.547 -12.546 1.00 25.00 H new ATOM 1298 N ASN A 677 -0.241 6.358 -11.188 1.00 25.00 N ATOM 1299 CA ASN A 677 -1.013 6.127 -9.971 1.00 25.00 C ATOM 1300 C ASN A 677 -0.156 6.550 -8.787 1.00 25.00 C ATOM 1301 O ASN A 677 0.916 7.107 -8.963 1.00 25.00 O ATOM 1302 CB ASN A 677 -1.591 4.689 -9.896 1.00 25.00 C ATOM 1303 CG ASN A 677 -0.673 3.696 -9.246 1.00 25.00 C ATOM 1304 OD1 ASN A 677 0.522 3.832 -9.270 1.00 25.00 O ATOM 1305 ND2 ASN A 677 -1.246 2.690 -8.649 1.00 25.00 N ATOM 0 H ASN A 677 0.461 5.647 -11.393 1.00 25.00 H new ATOM 0 HA ASN A 677 -1.914 6.741 -9.962 1.00 25.00 H new ATOM 0 HB2 ASN A 677 -2.531 4.714 -9.345 1.00 25.00 H new ATOM 0 HB3 ASN A 677 -1.822 4.348 -10.905 1.00 25.00 H new ATOM 0 HD21 ASN A 677 -0.678 1.984 -8.181 1.00 25.00 H new ATOM 0 HD22 ASN A 677 -2.263 2.608 -8.650 1.00 25.00 H new ATOM 1312 N GLN A 678 -0.636 6.323 -7.581 1.00 25.00 N ATOM 1313 CA GLN A 678 0.062 6.794 -6.395 1.00 25.00 C ATOM 1314 C GLN A 678 1.310 5.964 -6.016 1.00 25.00 C ATOM 1315 O GLN A 678 1.968 6.240 -5.012 1.00 25.00 O ATOM 1316 CB GLN A 678 -0.969 6.906 -5.269 1.00 25.00 C ATOM 1317 CG GLN A 678 -0.548 7.803 -4.111 1.00 25.00 C ATOM 1318 CD GLN A 678 -1.731 8.435 -3.417 1.00 25.00 C ATOM 1319 OE1 GLN A 678 -2.117 9.553 -3.733 1.00 25.00 O ATOM 1320 NE2 GLN A 678 -2.315 7.732 -2.482 1.00 25.00 N ATOM 0 H GLN A 678 -1.502 5.818 -7.393 1.00 25.00 H new ATOM 0 HA GLN A 678 0.493 7.774 -6.601 1.00 25.00 H new ATOM 0 HB2 GLN A 678 -1.902 7.286 -5.685 1.00 25.00 H new ATOM 0 HB3 GLN A 678 -1.175 5.908 -4.882 1.00 25.00 H new ATOM 0 HG2 GLN A 678 0.023 7.218 -3.390 1.00 25.00 H new ATOM 0 HG3 GLN A 678 0.113 8.586 -4.482 1.00 25.00 H new ATOM 0 HE21 GLN A 678 -1.963 6.804 -2.247 1.00 25.00 H new ATOM 0 HE22 GLN A 678 -3.122 8.112 -1.987 1.00 25.00 H new ATOM 1329 N GLN A 679 1.631 4.954 -6.816 1.00 25.00 N ATOM 1330 CA GLN A 679 2.813 4.112 -6.592 1.00 25.00 C ATOM 1331 C GLN A 679 3.796 4.130 -7.768 1.00 25.00 C ATOM 1332 O GLN A 679 5.007 4.093 -7.560 1.00 25.00 O ATOM 1333 CB GLN A 679 2.374 2.669 -6.340 1.00 25.00 C ATOM 1334 CG GLN A 679 1.975 2.393 -4.916 1.00 25.00 C ATOM 1335 CD GLN A 679 0.707 3.104 -4.505 1.00 25.00 C ATOM 1336 OE1 GLN A 679 -0.301 3.081 -5.186 1.00 25.00 O ATOM 1337 NE2 GLN A 679 0.758 3.729 -3.374 1.00 25.00 N ATOM 0 H GLN A 679 1.085 4.692 -7.637 1.00 25.00 H new ATOM 0 HA GLN A 679 3.330 4.524 -5.725 1.00 25.00 H new ATOM 0 HB2 GLN A 679 1.534 2.436 -6.994 1.00 25.00 H new ATOM 0 HB3 GLN A 679 3.188 1.999 -6.615 1.00 25.00 H new ATOM 0 HG2 GLN A 679 1.841 1.319 -4.785 1.00 25.00 H new ATOM 0 HG3 GLN A 679 2.785 2.696 -4.253 1.00 25.00 H new ATOM 0 HE21 GLN A 679 1.620 3.727 -2.829 1.00 25.00 H new ATOM 0 HE22 GLN A 679 -0.064 4.223 -3.027 1.00 25.00 H new ATOM 1346 N GLY A 680 3.277 4.180 -8.985 1.00 25.00 N ATOM 1347 CA GLY A 680 4.106 4.141 -10.175 1.00 25.00 C ATOM 1348 C GLY A 680 3.310 4.424 -11.434 1.00 25.00 C ATOM 1349 O GLY A 680 2.360 5.210 -11.403 1.00 25.00 O ATOM 0 H GLY A 680 2.277 4.248 -9.173 1.00 25.00 H new ATOM 0 HA2 GLY A 680 4.908 4.873 -10.082 1.00 25.00 H new ATOM 0 HA3 GLY A 680 4.576 3.161 -10.257 1.00 25.00 H new ATOM 1353 N LYS A 681 3.687 3.816 -12.554 1.00 25.00 N ATOM 1354 CA LYS A 681 3.042 4.102 -13.845 1.00 25.00 C ATOM 1355 C LYS A 681 2.604 2.881 -14.627 1.00 25.00 C ATOM 1356 O LYS A 681 2.990 1.761 -14.334 1.00 25.00 O ATOM 1357 CB LYS A 681 3.972 4.935 -14.718 1.00 25.00 C ATOM 1358 CG LYS A 681 4.178 6.332 -14.174 1.00 25.00 C ATOM 1359 CD LYS A 681 4.074 7.380 -15.264 1.00 25.00 C ATOM 1360 CE LYS A 681 5.347 8.156 -15.364 1.00 25.00 C ATOM 1361 NZ LYS A 681 5.550 9.074 -14.180 1.00 25.00 N ATOM 0 H LYS A 681 4.434 3.123 -12.601 1.00 25.00 H new ATOM 0 HA LYS A 681 2.132 4.646 -13.591 1.00 25.00 H new ATOM 0 HB2 LYS A 681 4.936 4.434 -14.798 1.00 25.00 H new ATOM 0 HB3 LYS A 681 3.561 4.998 -15.725 1.00 25.00 H new ATOM 0 HG2 LYS A 681 3.436 6.535 -13.402 1.00 25.00 H new ATOM 0 HG3 LYS A 681 5.157 6.397 -13.699 1.00 25.00 H new ATOM 0 HD2 LYS A 681 3.857 6.901 -16.219 1.00 25.00 H new ATOM 0 HD3 LYS A 681 3.245 8.055 -15.050 1.00 25.00 H new ATOM 0 HE2 LYS A 681 6.187 7.465 -15.434 1.00 25.00 H new ATOM 0 HE3 LYS A 681 5.341 8.745 -16.281 1.00 25.00 H new ATOM 0 HZ1 LYS A 681 6.281 9.777 -14.408 1.00 25.00 H new ATOM 0 HZ2 LYS A 681 4.657 9.561 -13.961 1.00 25.00 H new ATOM 0 HZ3 LYS A 681 5.851 8.516 -13.356 1.00 25.00 H new ATOM 1375 N SER A 682 1.787 3.128 -15.638 1.00 25.00 N ATOM 1376 CA SER A 682 1.252 2.057 -16.476 1.00 25.00 C ATOM 1377 C SER A 682 2.093 1.856 -17.719 1.00 25.00 C ATOM 1378 O SER A 682 2.943 2.683 -18.054 1.00 25.00 O ATOM 1379 CB SER A 682 -0.171 2.395 -16.922 1.00 25.00 C ATOM 1380 OG SER A 682 -0.159 3.296 -18.020 1.00 25.00 O ATOM 0 H SER A 682 1.476 4.063 -15.902 1.00 25.00 H new ATOM 0 HA SER A 682 1.262 1.146 -15.878 1.00 25.00 H new ATOM 0 HB2 SER A 682 -0.695 1.481 -17.202 1.00 25.00 H new ATOM 0 HB3 SER A 682 -0.722 2.836 -16.091 1.00 25.00 H new ATOM 0 HG SER A 682 -0.023 2.796 -18.852 1.00 25.00 H new ATOM 1386 N LYS A 683 1.830 0.770 -18.434 1.00 25.00 N ATOM 1387 CA LYS A 683 2.483 0.550 -19.724 1.00 25.00 C ATOM 1388 C LYS A 683 1.852 1.564 -20.674 1.00 25.00 C ATOM 1389 O LYS A 683 0.677 1.892 -20.525 1.00 25.00 O ATOM 1390 CB LYS A 683 2.220 -0.864 -20.247 1.00 25.00 C ATOM 1391 CG LYS A 683 3.199 -1.309 -21.345 1.00 25.00 C ATOM 1392 CD LYS A 683 2.660 -2.483 -22.166 1.00 25.00 C ATOM 1393 CE LYS A 683 1.587 -2.006 -23.149 1.00 25.00 C ATOM 1394 NZ LYS A 683 1.081 -3.094 -24.049 1.00 25.00 N ATOM 0 H LYS A 683 1.180 0.036 -18.151 1.00 25.00 H new ATOM 0 HA LYS A 683 3.564 0.664 -19.638 1.00 25.00 H new ATOM 0 HB2 LYS A 683 2.277 -1.566 -19.415 1.00 25.00 H new ATOM 0 HB3 LYS A 683 1.203 -0.914 -20.637 1.00 25.00 H new ATOM 0 HG2 LYS A 683 3.403 -0.469 -22.008 1.00 25.00 H new ATOM 0 HG3 LYS A 683 4.147 -1.593 -20.889 1.00 25.00 H new ATOM 0 HD2 LYS A 683 3.476 -2.957 -22.712 1.00 25.00 H new ATOM 0 HD3 LYS A 683 2.241 -3.238 -21.500 1.00 25.00 H new ATOM 0 HE2 LYS A 683 0.750 -1.589 -22.589 1.00 25.00 H new ATOM 0 HE3 LYS A 683 1.995 -1.200 -23.759 1.00 25.00 H new ATOM 0 HZ1 LYS A 683 0.358 -2.707 -24.689 1.00 25.00 H new ATOM 0 HZ2 LYS A 683 1.870 -3.477 -24.608 1.00 25.00 H new ATOM 0 HZ3 LYS A 683 0.663 -3.854 -23.474 1.00 25.00 H new ATOM 1408 N ALA A 684 2.610 2.046 -21.643 1.00 25.00 N ATOM 1409 CA ALA A 684 2.081 2.980 -22.628 1.00 25.00 C ATOM 1410 C ALA A 684 1.143 2.279 -23.605 1.00 25.00 C ATOM 1411 O ALA A 684 1.278 1.081 -23.867 1.00 25.00 O ATOM 1412 CB ALA A 684 3.244 3.625 -23.403 1.00 25.00 C ATOM 0 H ALA A 684 3.594 1.808 -21.771 1.00 25.00 H new ATOM 0 HA ALA A 684 1.514 3.747 -22.101 1.00 25.00 H new ATOM 0 HB1 ALA A 684 2.847 4.324 -24.140 1.00 25.00 H new ATOM 0 HB2 ALA A 684 3.892 4.159 -22.708 1.00 25.00 H new ATOM 0 HB3 ALA A 684 3.817 2.849 -23.911 1.00 25.00 H new ATOM 1418 N ALA A 685 0.225 3.050 -24.161 1.00 25.00 N ATOM 1419 CA ALA A 685 -0.641 2.594 -25.237 1.00 25.00 C ATOM 1420 C ALA A 685 -0.510 3.695 -26.280 1.00 25.00 C ATOM 1421 O ALA A 685 -0.323 4.859 -25.916 1.00 25.00 O ATOM 1422 CB ALA A 685 -2.087 2.443 -24.760 1.00 25.00 C ATOM 0 H ALA A 685 0.058 4.016 -23.878 1.00 25.00 H new ATOM 0 HA ALA A 685 -0.365 1.612 -25.621 1.00 25.00 H new ATOM 0 HB1 ALA A 685 -2.709 2.101 -25.587 1.00 25.00 H new ATOM 0 HB2 ALA A 685 -2.129 1.715 -23.949 1.00 25.00 H new ATOM 0 HB3 ALA A 685 -2.455 3.405 -24.403 1.00 25.00 H new ATOM 1428 N HIS A 686 -0.582 3.335 -27.552 1.00 25.00 N ATOM 1429 CA HIS A 686 -0.420 4.294 -28.635 1.00 25.00 C ATOM 1430 C HIS A 686 -1.324 4.009 -29.823 1.00 25.00 C ATOM 1431 O HIS A 686 -1.639 2.854 -30.103 1.00 25.00 O ATOM 1432 CB HIS A 686 1.029 4.301 -29.100 1.00 25.00 C ATOM 1433 CG HIS A 686 1.573 2.939 -29.404 1.00 25.00 C ATOM 1434 ND1 HIS A 686 1.442 2.300 -30.612 1.00 25.00 N ATOM 1435 CD2 HIS A 686 2.272 2.071 -28.621 1.00 25.00 C ATOM 1436 CE1 HIS A 686 2.038 1.114 -30.521 1.00 25.00 C ATOM 1437 NE2 HIS A 686 2.555 0.918 -29.325 1.00 25.00 N ATOM 0 H HIS A 686 -0.753 2.378 -27.862 1.00 25.00 H new ATOM 0 HA HIS A 686 -0.705 5.268 -28.238 1.00 25.00 H new ATOM 0 HB2 HIS A 686 1.112 4.922 -29.992 1.00 25.00 H new ATOM 0 HB3 HIS A 686 1.646 4.765 -28.330 1.00 25.00 H new ATOM 0 HD2 HIS A 686 2.563 2.258 -27.598 1.00 25.00 H new ATOM 0 HE1 HIS A 686 2.092 0.399 -31.329 1.00 25.00 H new ATOM 0 HE2 HIS A 686 3.055 0.094 -28.992 1.00 25.00 H new ATOM 1445 N PHE A 687 -1.731 5.063 -30.521 1.00 25.00 N ATOM 1446 CA PHE A 687 -2.555 4.920 -31.720 1.00 25.00 C ATOM 1447 C PHE A 687 -2.242 6.028 -32.720 1.00 25.00 C ATOM 1448 O PHE A 687 -1.718 7.080 -32.347 1.00 25.00 O ATOM 1449 CB PHE A 687 -4.050 4.867 -31.370 1.00 25.00 C ATOM 1450 CG PHE A 687 -4.727 6.216 -31.267 1.00 25.00 C ATOM 1451 CD1 PHE A 687 -4.505 7.061 -30.163 1.00 25.00 C ATOM 1452 CD2 PHE A 687 -5.620 6.633 -32.275 1.00 25.00 C ATOM 1453 CE1 PHE A 687 -5.183 8.313 -30.060 1.00 25.00 C ATOM 1454 CE2 PHE A 687 -6.293 7.873 -32.182 1.00 25.00 C ATOM 1455 CZ PHE A 687 -6.078 8.715 -31.077 1.00 25.00 C ATOM 0 H PHE A 687 -1.505 6.028 -30.279 1.00 25.00 H new ATOM 0 HA PHE A 687 -2.309 3.969 -32.192 1.00 25.00 H new ATOM 0 HB2 PHE A 687 -4.565 4.275 -32.127 1.00 25.00 H new ATOM 0 HB3 PHE A 687 -4.168 4.344 -30.421 1.00 25.00 H new ATOM 0 HD1 PHE A 687 -3.816 6.760 -29.388 1.00 25.00 H new ATOM 0 HD2 PHE A 687 -5.792 5.996 -33.130 1.00 25.00 H new ATOM 0 HE1 PHE A 687 -5.012 8.952 -29.206 1.00 25.00 H new ATOM 0 HE2 PHE A 687 -6.975 8.175 -32.963 1.00 25.00 H new ATOM 0 HZ PHE A 687 -6.593 9.662 -31.006 1.00 25.00 H new ATOM 1465 N VAL A 688 -2.543 5.764 -33.985 1.00 25.00 N ATOM 1466 CA VAL A 688 -2.270 6.687 -35.088 1.00 25.00 C ATOM 1467 C VAL A 688 -3.600 6.921 -35.796 1.00 25.00 C ATOM 1468 O VAL A 688 -4.370 5.977 -35.973 1.00 25.00 O ATOM 1469 CB VAL A 688 -1.231 6.064 -36.083 1.00 25.00 C ATOM 1470 CG1 VAL A 688 -0.952 6.997 -37.277 1.00 25.00 C ATOM 1471 CG2 VAL A 688 0.090 5.756 -35.354 1.00 25.00 C ATOM 0 H VAL A 688 -2.988 4.895 -34.281 1.00 25.00 H new ATOM 0 HA VAL A 688 -1.847 7.621 -34.719 1.00 25.00 H new ATOM 0 HB VAL A 688 -1.664 5.140 -36.466 1.00 25.00 H new ATOM 0 HG11 VAL A 688 -0.227 6.529 -37.943 1.00 25.00 H new ATOM 0 HG12 VAL A 688 -1.879 7.180 -37.820 1.00 25.00 H new ATOM 0 HG13 VAL A 688 -0.552 7.944 -36.913 1.00 25.00 H new ATOM 0 HG21 VAL A 688 0.802 5.324 -36.058 1.00 25.00 H new ATOM 0 HG22 VAL A 688 0.501 6.677 -34.942 1.00 25.00 H new ATOM 0 HG23 VAL A 688 -0.097 5.048 -34.546 1.00 25.00 H new ATOM 1481 N PHE A 689 -3.883 8.157 -36.186 1.00 25.00 N ATOM 1482 CA PHE A 689 -5.153 8.485 -36.837 1.00 25.00 C ATOM 1483 C PHE A 689 -5.003 9.675 -37.783 1.00 25.00 C ATOM 1484 O PHE A 689 -4.106 10.491 -37.612 1.00 25.00 O ATOM 1485 CB PHE A 689 -6.188 8.829 -35.751 1.00 25.00 C ATOM 1486 CG PHE A 689 -7.561 9.156 -36.290 1.00 25.00 C ATOM 1487 CD1 PHE A 689 -7.928 10.493 -36.555 1.00 25.00 C ATOM 1488 CD2 PHE A 689 -8.493 8.133 -36.541 1.00 25.00 C ATOM 1489 CE1 PHE A 689 -9.206 10.807 -37.071 1.00 25.00 C ATOM 1490 CE2 PHE A 689 -9.778 8.436 -37.060 1.00 25.00 C ATOM 1491 CZ PHE A 689 -10.130 9.777 -37.329 1.00 25.00 C ATOM 0 H PHE A 689 -3.254 8.951 -36.065 1.00 25.00 H new ATOM 0 HA PHE A 689 -5.477 7.625 -37.423 1.00 25.00 H new ATOM 0 HB2 PHE A 689 -6.270 7.988 -35.063 1.00 25.00 H new ATOM 0 HB3 PHE A 689 -5.824 9.679 -35.173 1.00 25.00 H new ATOM 0 HD1 PHE A 689 -7.222 11.287 -36.361 1.00 25.00 H new ATOM 0 HD2 PHE A 689 -8.228 7.106 -36.337 1.00 25.00 H new ATOM 0 HE1 PHE A 689 -9.473 11.835 -37.267 1.00 25.00 H new ATOM 0 HE2 PHE A 689 -10.486 7.643 -37.249 1.00 25.00 H new ATOM 0 HZ PHE A 689 -11.105 10.011 -37.731 1.00 25.00 H new ATOM 1501 N ARG A 690 -5.907 9.768 -38.756 1.00 25.00 N ATOM 1502 CA ARG A 690 -6.054 10.941 -39.625 1.00 25.00 C ATOM 1503 C ARG A 690 -7.438 10.879 -40.233 1.00 25.00 C ATOM 1504 O ARG A 690 -8.069 9.828 -40.226 1.00 25.00 O ATOM 1505 CB ARG A 690 -4.979 11.020 -40.710 1.00 25.00 C ATOM 1506 CG ARG A 690 -4.728 9.774 -41.568 1.00 25.00 C ATOM 1507 CD ARG A 690 -5.639 9.641 -42.800 1.00 25.00 C ATOM 1508 NE ARG A 690 -5.839 10.914 -43.518 1.00 25.00 N ATOM 1509 CZ ARG A 690 -4.931 11.559 -44.243 1.00 25.00 C ATOM 1510 NH1 ARG A 690 -3.696 11.144 -44.392 1.00 25.00 N ATOM 1511 NH2 ARG A 690 -5.290 12.667 -44.822 1.00 25.00 N ATOM 0 H ARG A 690 -6.569 9.022 -38.969 1.00 25.00 H new ATOM 0 HA ARG A 690 -5.926 11.845 -39.030 1.00 25.00 H new ATOM 0 HB2 ARG A 690 -5.240 11.839 -41.380 1.00 25.00 H new ATOM 0 HB3 ARG A 690 -4.039 11.289 -40.229 1.00 25.00 H new ATOM 0 HG2 ARG A 690 -3.690 9.783 -41.901 1.00 25.00 H new ATOM 0 HG3 ARG A 690 -4.854 8.889 -40.944 1.00 25.00 H new ATOM 0 HD2 ARG A 690 -5.209 8.910 -43.484 1.00 25.00 H new ATOM 0 HD3 ARG A 690 -6.608 9.253 -42.486 1.00 25.00 H new ATOM 0 HE ARG A 690 -6.763 11.340 -43.452 1.00 25.00 H new ATOM 0 HH11 ARG A 690 -3.389 10.284 -43.939 1.00 25.00 H new ATOM 0 HH12 ARG A 690 -3.042 11.682 -44.961 1.00 25.00 H new ATOM 0 HH21 ARG A 690 -6.243 13.015 -44.712 1.00 25.00 H new ATOM 0 HH22 ARG A 690 -4.619 13.188 -45.386 1.00 25.00 H new ATOM 1525 N THR A 691 -7.907 12.001 -40.746 1.00 25.00 N ATOM 1526 CA THR A 691 -9.238 12.106 -41.337 1.00 25.00 C ATOM 1527 C THR A 691 -9.038 12.860 -42.653 1.00 25.00 C ATOM 1528 O THR A 691 -7.912 12.911 -43.148 1.00 25.00 O ATOM 1529 CB THR A 691 -10.227 12.810 -40.342 1.00 25.00 C ATOM 1530 OG1 THR A 691 -11.544 12.855 -40.903 1.00 25.00 O ATOM 1531 CG2 THR A 691 -9.784 14.230 -39.992 1.00 25.00 C ATOM 0 H THR A 691 -7.377 12.872 -40.767 1.00 25.00 H new ATOM 0 HA THR A 691 -9.697 11.138 -41.536 1.00 25.00 H new ATOM 0 HB THR A 691 -10.227 12.221 -39.425 1.00 25.00 H new ATOM 0 HG1 THR A 691 -11.782 13.784 -41.104 1.00 25.00 H new ATOM 0 HG21 THR A 691 -10.500 14.675 -39.301 1.00 25.00 H new ATOM 0 HG22 THR A 691 -8.800 14.199 -39.524 1.00 25.00 H new ATOM 0 HG23 THR A 691 -9.735 14.830 -40.901 1.00 25.00 H new ATOM 1539 N HIS A 692 -10.102 13.421 -43.220 1.00 25.00 N ATOM 1540 CA HIS A 692 -10.022 14.201 -44.463 1.00 25.00 C ATOM 1541 C HIS A 692 -9.292 13.421 -45.566 1.00 25.00 C ATOM 1542 O HIS A 692 -8.257 13.842 -46.084 1.00 25.00 O ATOM 1543 CB HIS A 692 -9.347 15.553 -44.190 1.00 25.00 C ATOM 1544 CG HIS A 692 -9.601 16.579 -45.251 1.00 25.00 C ATOM 1545 ND1 HIS A 692 -10.714 17.381 -45.304 1.00 25.00 N ATOM 1546 CD2 HIS A 692 -8.856 16.938 -46.332 1.00 25.00 C ATOM 1547 CE1 HIS A 692 -10.607 18.172 -46.368 1.00 25.00 C ATOM 1548 NE2 HIS A 692 -9.489 17.948 -47.029 1.00 25.00 N ATOM 0 H HIS A 692 -11.044 13.351 -42.836 1.00 25.00 H new ATOM 0 HA HIS A 692 -11.034 14.387 -44.822 1.00 25.00 H new ATOM 0 HB2 HIS A 692 -9.699 15.938 -43.233 1.00 25.00 H new ATOM 0 HB3 HIS A 692 -8.272 15.400 -44.096 1.00 25.00 H new ATOM 0 HD2 HIS A 692 -7.908 16.497 -46.605 1.00 25.00 H new ATOM 0 HE1 HIS A 692 -11.345 18.907 -46.655 1.00 25.00 H new ATOM 0 HE2 HIS A 692 -9.162 18.419 -47.873 1.00 25.00 H new ATOM 1556 N HIS A 693 -9.837 12.264 -45.908 1.00 25.00 N ATOM 1557 CA HIS A 693 -9.260 11.444 -46.965 1.00 25.00 C ATOM 1558 C HIS A 693 -9.495 12.137 -48.306 1.00 25.00 C ATOM 1559 O HIS A 693 -10.388 12.975 -48.431 1.00 25.00 O ATOM 1560 CB HIS A 693 -9.901 10.048 -46.994 1.00 25.00 C ATOM 1561 CG HIS A 693 -11.256 10.019 -47.636 1.00 25.00 C ATOM 1562 ND1 HIS A 693 -12.441 10.225 -46.973 1.00 25.00 N ATOM 1563 CD2 HIS A 693 -11.613 9.800 -48.934 1.00 25.00 C ATOM 1564 CE1 HIS A 693 -13.432 10.139 -47.857 1.00 25.00 C ATOM 1565 NE2 HIS A 693 -12.984 9.885 -49.069 1.00 25.00 N ATOM 0 H HIS A 693 -10.672 11.872 -45.473 1.00 25.00 H new ATOM 0 HA HIS A 693 -8.193 11.325 -46.776 1.00 25.00 H new ATOM 0 HB2 HIS A 693 -9.241 9.366 -47.529 1.00 25.00 H new ATOM 0 HB3 HIS A 693 -9.985 9.675 -45.973 1.00 25.00 H new ATOM 0 HD1 HIS A 693 -12.544 10.412 -45.975 1.00 25.00 H new ATOM 0 HD2 HIS A 693 -10.924 9.591 -49.739 1.00 25.00 H new ATOM 0 HE1 HIS A 693 -14.476 10.262 -47.611 1.00 25.00 H new ATOM 1573 N HIS A 694 -8.711 11.769 -49.305 1.00 25.00 N ATOM 1574 CA HIS A 694 -8.875 12.302 -50.648 1.00 25.00 C ATOM 1575 C HIS A 694 -9.307 11.145 -51.537 1.00 25.00 C ATOM 1576 O HIS A 694 -8.886 10.010 -51.323 1.00 25.00 O ATOM 1577 CB HIS A 694 -7.560 12.903 -51.150 1.00 25.00 C ATOM 1578 CG HIS A 694 -7.647 13.467 -52.534 1.00 25.00 C ATOM 1579 ND1 HIS A 694 -8.383 14.575 -52.875 1.00 25.00 N ATOM 1580 CD2 HIS A 694 -7.080 13.049 -53.699 1.00 25.00 C ATOM 1581 CE1 HIS A 694 -8.248 14.777 -54.183 1.00 25.00 C ATOM 1582 NE2 HIS A 694 -7.457 13.880 -54.735 1.00 25.00 N ATOM 0 H HIS A 694 -7.949 11.098 -49.210 1.00 25.00 H new ATOM 0 HA HIS A 694 -9.620 13.097 -50.660 1.00 25.00 H new ATOM 0 HB2 HIS A 694 -7.246 13.691 -50.465 1.00 25.00 H new ATOM 0 HB3 HIS A 694 -6.787 12.134 -51.128 1.00 25.00 H new ATOM 0 HD2 HIS A 694 -6.430 12.192 -53.798 1.00 25.00 H new ATOM 0 HE1 HIS A 694 -8.728 15.578 -54.726 1.00 25.00 H new ATOM 0 HE2 HIS A 694 -7.183 13.814 -55.715 1.00 25.00 H new ATOM 1590 N HIS A 695 -10.136 11.434 -52.524 1.00 25.00 N ATOM 1591 CA HIS A 695 -10.610 10.439 -53.472 1.00 25.00 C ATOM 1592 C HIS A 695 -10.598 11.119 -54.829 1.00 25.00 C ATOM 1593 O HIS A 695 -10.596 12.348 -54.905 1.00 25.00 O ATOM 1594 CB HIS A 695 -12.024 9.971 -53.107 1.00 25.00 C ATOM 1595 CG HIS A 695 -12.996 11.094 -52.911 1.00 25.00 C ATOM 1596 ND1 HIS A 695 -13.439 11.525 -51.687 1.00 25.00 N ATOM 1597 CD2 HIS A 695 -13.629 11.892 -53.817 1.00 25.00 C ATOM 1598 CE1 HIS A 695 -14.279 12.536 -51.879 1.00 25.00 C ATOM 1599 NE2 HIS A 695 -14.431 12.806 -53.160 1.00 25.00 N ATOM 0 H HIS A 695 -10.502 12.371 -52.692 1.00 25.00 H new ATOM 0 HA HIS A 695 -9.978 9.551 -53.468 1.00 25.00 H new ATOM 0 HB2 HIS A 695 -12.395 9.314 -53.894 1.00 25.00 H new ATOM 0 HB3 HIS A 695 -11.977 9.379 -52.193 1.00 25.00 H new ATOM 0 HD1 HIS A 695 -13.170 11.136 -50.783 1.00 25.00 H new ATOM 0 HD2 HIS A 695 -13.520 11.821 -54.889 1.00 25.00 H new ATOM 0 HE1 HIS A 695 -14.776 13.071 -51.083 1.00 25.00 H new ATOM 1607 N HIS A 696 -10.580 10.338 -55.895 1.00 25.00 N ATOM 1608 CA HIS A 696 -10.563 10.906 -57.234 1.00 25.00 C ATOM 1609 C HIS A 696 -11.958 11.418 -57.576 1.00 25.00 C ATOM 1610 O HIS A 696 -12.955 10.824 -57.175 1.00 25.00 O ATOM 1611 CB HIS A 696 -10.117 9.857 -58.255 1.00 25.00 C ATOM 1612 CG HIS A 696 -9.578 10.449 -59.520 1.00 25.00 C ATOM 1613 ND1 HIS A 696 -8.298 10.921 -59.664 1.00 25.00 N ATOM 1614 CD2 HIS A 696 -10.170 10.657 -60.729 1.00 25.00 C ATOM 1615 CE1 HIS A 696 -8.159 11.382 -60.903 1.00 25.00 C ATOM 1616 NE2 HIS A 696 -9.272 11.256 -61.597 1.00 25.00 N ATOM 0 H HIS A 696 -10.577 9.319 -55.862 1.00 25.00 H new ATOM 0 HA HIS A 696 -9.854 11.733 -57.266 1.00 25.00 H new ATOM 0 HB2 HIS A 696 -9.352 9.224 -57.804 1.00 25.00 H new ATOM 0 HB3 HIS A 696 -10.963 9.213 -58.496 1.00 25.00 H new ATOM 0 HD2 HIS A 696 -11.188 10.394 -60.974 1.00 25.00 H new ATOM 0 HE1 HIS A 696 -7.246 11.807 -61.293 1.00 25.00 H new ATOM 0 HE2 HIS A 696 -9.437 11.538 -62.563 1.00 25.00 H new ATOM 1624 N HIS A 697 -12.012 12.524 -58.306 1.00 25.00 N ATOM 1625 CA HIS A 697 -13.279 13.111 -58.743 1.00 25.00 C ATOM 1626 C HIS A 697 -13.884 12.307 -59.893 1.00 25.00 C ATOM 1627 O HIS A 697 -15.062 12.524 -60.208 1.00 25.00 O ATOM 1628 CB HIS A 697 -13.049 14.563 -59.198 1.00 25.00 C ATOM 1629 CG HIS A 697 -11.996 14.710 -60.261 1.00 25.00 C ATOM 1630 ND1 HIS A 697 -11.726 13.737 -61.229 1.00 25.00 N ATOM 1631 CD2 HIS A 697 -11.114 15.710 -60.529 1.00 25.00 C ATOM 1632 CE1 HIS A 697 -10.741 14.163 -62.005 1.00 25.00 C ATOM 1633 NE2 HIS A 697 -10.360 15.345 -61.603 1.00 25.00 N ATOM 1634 OXT HIS A 697 -13.140 11.491 -60.485 1.00 25.00 O ATOM 0 H HIS A 697 -11.187 13.039 -58.612 1.00 25.00 H new ATOM 0 HA HIS A 697 -13.973 13.093 -57.903 1.00 25.00 H new ATOM 0 HB2 HIS A 697 -13.989 14.969 -59.573 1.00 25.00 H new ATOM 0 HB3 HIS A 697 -12.765 15.163 -58.334 1.00 25.00 H new ATOM 0 HD1 HIS A 697 -12.210 12.844 -61.322 1.00 25.00 H new ATOM 0 HD2 HIS A 697 -11.026 16.637 -59.982 1.00 25.00 H new ATOM 0 HE1 HIS A 697 -10.320 13.619 -62.838 1.00 25.00 H new TER 1642 HIS A 697