USER MOD reduce.3.24.130724 H: found=0, std=0, add=1283, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1280 hydrogens (30 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 NoAdj-H: A 93 HIS HE2 : A 93 HIS NE2 : A 154 HEMFE :(H bumps) USER MOD Set 1.1: A 24 HIS : no HE2:sc= -3.23! C(o=-3.1!,f=-16!) USER MOD Set 1.2: A 119 HIS : no HD1:sc= 0.087 K(o=-3.1,f=-15!) USER MOD Set 2.1: A 113 HIS : no HD1:sc= -0.445 K(o=0.23,f=-1.7) USER MOD Set 2.2: A 117 SER OG : rot 74:sc= 0.671 USER MOD Set 3.1: A 92 SER OG : rot -80:sc= 0.842 USER MOD Set 3.2: A 97 HIS : no HD1:sc= 2.02 K(o=2.9,f=-3.3!) USER MOD Set 4.1: A 63 LYS NZ :NH3+ 179:sc= 0.988 (180deg=0) USER MOD Set 4.2: A 67 THR OG1 : rot 81:sc= 1.92 USER MOD Set 5.1: A 26 GLN : amide:sc= 0.47 X(o=0.32,f=-0.18) USER MOD Set 5.2: A 62 LYS NZ :NH3+ -119:sc= -0.155 (180deg=-0.0164) USER MOD Single : A 1 VAL N :NH3+ -177:sc= -0.503 (180deg=-0.524) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0828 USER MOD Single : A 8 GLN : amide:sc= 0.383 K(o=0.38,f=-0.18) USER MOD Single : A 12 HIS : +bothHN:sc= 1.91 K(o=1.9,f=-6.2!) USER MOD Single : A 16 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0477) USER MOD Single : A 34 LYS NZ :NH3+ -147:sc= 0.804 (180deg=-0.0282) USER MOD Single : A 35 SER OG : rot 81:sc= 2.12 USER MOD Single : A 36 HIS : no HD1:sc= -0.119 X(o=-0.12,f=0) USER MOD Single : A 39 THR OG1 : rot -73:sc= 1.18 USER MOD Single : A 42 LYS NZ :NH3+ -164:sc= 0.859 (180deg=0.672) USER MOD Single : A 47 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0391) USER MOD Single : A 48 HIS : no HE2:sc= 0.696 K(o=0.7,f=-2.8!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.0155 USER MOD Single : A 55 MET CE :methyl 157:sc=-0.00273 (180deg=-0.131) USER MOD Single : A 56 LYS NZ :NH3+ 146:sc= -0.167 (180deg=-0.926) USER MOD Single : A 58 SER OG : rot -35:sc= 0.712 USER MOD Single : A 64 HIS : no HD1:sc= -0.207 K(o=-0.21,f=-3!) USER MOD Single : A 70 THR OG1 : rot 77:sc= 1.25 USER MOD Single : A 77 LYS NZ :NH3+ 138:sc= -0.137 (180deg=-1.08) USER MOD Single : A 78 LYS NZ :NH3+ 178:sc= 0.804 (180deg=0.791) USER MOD Single : A 79 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0838) USER MOD Single : A 81 HIS : no HD1:sc= -0.0183 X(o=-0.018,f=0) USER MOD Single : A 82 HIS : no HE2:sc= -0.942 K(o=-0.94,f=-2.1) USER MOD Single : A 87 LYS NZ :NH3+ 161:sc= 1.27 (180deg=0.566) USER MOD Single : A 91 GLN : amide:sc= 0.986 K(o=0.99,f=-1) USER MOD Single : A 95 THR OG1 : rot -66:sc= 1.02 USER MOD Single : A 96 LYS NZ :NH3+ 167:sc=-0.00691 (180deg=-0.171) USER MOD Single : A 98 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0072) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 TYR OH : rot -157:sc= 0.787 USER MOD Single : A 108 SER OG : rot -75:sc= 0.799 USER MOD Single : A 116 HIS : no HE2:sc= -0.572 K(o=-0.57,f=-3.9!) USER MOD Single : A 128 GLN : amide:sc= -0.0206 X(o=-0.021,f=0) USER MOD Single : A 131 MET CE :methyl 170:sc= -0.0235 (180deg=-0.204) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 LYS NZ :NH3+ -168:sc= 0.621 (180deg=0.535) USER MOD Single : A 140 LYS NZ :NH3+ -173:sc= -0.33 (180deg=-0.436) USER MOD Single : A 145 LYS NZ :NH3+ -167:sc= -0.0105 (180deg=-0.164) USER MOD Single : A 146 TYR OH : rot -159:sc= 1.18 USER MOD Single : A 147 LYS NZ :NH3+ -167:sc= 1.09 (180deg=0.962) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 154 HEM CMA :methyl 150:sc= -0.637 (180deg=-0.637) USER MOD Single : A 154 HEM CMB :methyl 150:sc= -0.0526 (180deg=-0.0526) USER MOD Single : A 154 HEM CMC :methyl 150:sc= -3.37! (180deg=-3.37!) USER MOD Single : A 154 HEM CMD :methyl 150:sc= -1.92 (180deg=-1.92) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 18.293 2.364 3.401 1.00 0.00 N ATOM 2 CA VAL A 1 18.410 1.642 2.146 1.00 0.00 C ATOM 3 C VAL A 1 18.275 0.145 2.429 1.00 0.00 C ATOM 4 O VAL A 1 18.352 -0.274 3.588 1.00 0.00 O ATOM 5 CB VAL A 1 19.735 1.983 1.440 1.00 0.00 C ATOM 6 CG1 VAL A 1 19.747 3.457 1.019 1.00 0.00 C ATOM 7 CG2 VAL A 1 20.958 1.683 2.320 1.00 0.00 C ATOM 0 H1 VAL A 1 18.332 3.387 3.218 1.00 0.00 H new ATOM 0 H2 VAL A 1 17.387 2.128 3.854 1.00 0.00 H new ATOM 0 H3 VAL A 1 19.076 2.095 4.031 1.00 0.00 H new ATOM 0 HA VAL A 1 17.613 1.942 1.466 1.00 0.00 H new ATOM 0 HB VAL A 1 19.801 1.347 0.557 1.00 0.00 H new ATOM 0 HG11 VAL A 1 20.689 3.685 0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 1 18.920 3.647 0.335 1.00 0.00 H new ATOM 0 HG13 VAL A 1 19.641 4.088 1.901 1.00 0.00 H new ATOM 0 HG21 VAL A 1 21.868 1.940 1.778 1.00 0.00 H new ATOM 0 HG22 VAL A 1 20.902 2.273 3.235 1.00 0.00 H new ATOM 0 HG23 VAL A 1 20.973 0.623 2.572 1.00 0.00 H new ATOM 19 N LEU A 2 18.066 -0.654 1.379 1.00 0.00 N ATOM 20 CA LEU A 2 17.934 -2.093 1.481 1.00 0.00 C ATOM 21 C LEU A 2 19.055 -2.738 0.676 1.00 0.00 C ATOM 22 O LEU A 2 19.297 -2.341 -0.462 1.00 0.00 O ATOM 23 CB LEU A 2 16.587 -2.558 0.916 1.00 0.00 C ATOM 24 CG LEU A 2 15.393 -2.393 1.863 1.00 0.00 C ATOM 25 CD1 LEU A 2 14.858 -0.955 1.874 1.00 0.00 C ATOM 26 CD2 LEU A 2 14.272 -3.326 1.394 1.00 0.00 C ATOM 0 H LEU A 2 17.984 -0.305 0.424 1.00 0.00 H new ATOM 0 HA LEU A 2 17.990 -2.382 2.530 1.00 0.00 H new ATOM 0 HB2 LEU A 2 16.384 -2.003 0.000 1.00 0.00 H new ATOM 0 HB3 LEU A 2 16.670 -3.609 0.640 1.00 0.00 H new ATOM 0 HG LEU A 2 15.725 -2.636 2.872 1.00 0.00 H new ATOM 0 HD11 LEU A 2 14.013 -0.886 2.559 1.00 0.00 H new ATOM 0 HD12 LEU A 2 15.646 -0.276 2.201 1.00 0.00 H new ATOM 0 HD13 LEU A 2 14.535 -0.679 0.870 1.00 0.00 H new ATOM 0 HD21 LEU A 2 13.412 -3.223 2.056 1.00 0.00 H new ATOM 0 HD22 LEU A 2 13.981 -3.062 0.377 1.00 0.00 H new ATOM 0 HD23 LEU A 2 14.624 -4.357 1.415 1.00 0.00 H new ATOM 38 N SER A 3 19.719 -3.744 1.248 1.00 0.00 N ATOM 39 CA SER A 3 20.771 -4.475 0.570 1.00 0.00 C ATOM 40 C SER A 3 20.157 -5.480 -0.407 1.00 0.00 C ATOM 41 O SER A 3 18.958 -5.768 -0.362 1.00 0.00 O ATOM 42 CB SER A 3 21.637 -5.156 1.633 1.00 0.00 C ATOM 43 OG SER A 3 20.804 -5.786 2.588 1.00 0.00 O ATOM 0 H SER A 3 19.536 -4.069 2.197 1.00 0.00 H new ATOM 0 HA SER A 3 21.400 -3.806 -0.017 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.294 -5.891 1.167 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.277 -4.421 2.121 1.00 0.00 H new ATOM 0 HG SER A 3 21.358 -6.223 3.268 1.00 0.00 H new ATOM 49 N GLU A 4 20.992 -6.011 -1.303 1.00 0.00 N ATOM 50 CA GLU A 4 20.598 -6.987 -2.308 1.00 0.00 C ATOM 51 C GLU A 4 19.879 -8.176 -1.665 1.00 0.00 C ATOM 52 O GLU A 4 18.890 -8.662 -2.204 1.00 0.00 O ATOM 53 CB GLU A 4 21.828 -7.455 -3.101 1.00 0.00 C ATOM 54 CG GLU A 4 22.429 -6.375 -4.023 1.00 0.00 C ATOM 55 CD GLU A 4 23.113 -5.213 -3.301 1.00 0.00 C ATOM 56 OE1 GLU A 4 23.544 -5.424 -2.145 1.00 0.00 O ATOM 57 OE2 GLU A 4 23.181 -4.127 -3.915 1.00 0.00 O ATOM 0 H GLU A 4 21.981 -5.766 -1.347 1.00 0.00 H new ATOM 0 HA GLU A 4 19.900 -6.511 -2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 4 22.594 -7.787 -2.400 1.00 0.00 H new ATOM 0 HB3 GLU A 4 21.551 -8.320 -3.704 1.00 0.00 H new ATOM 0 HG2 GLU A 4 23.154 -6.848 -4.686 1.00 0.00 H new ATOM 0 HG3 GLU A 4 21.635 -5.974 -4.653 1.00 0.00 H new ATOM 64 N GLY A 5 20.375 -8.640 -0.514 1.00 0.00 N ATOM 65 CA GLY A 5 19.781 -9.743 0.227 1.00 0.00 C ATOM 66 C GLY A 5 18.321 -9.439 0.565 1.00 0.00 C ATOM 67 O GLY A 5 17.427 -10.244 0.301 1.00 0.00 O ATOM 0 H GLY A 5 21.208 -8.253 -0.071 1.00 0.00 H new ATOM 0 HA2 GLY A 5 19.841 -10.658 -0.362 1.00 0.00 H new ATOM 0 HA3 GLY A 5 20.344 -9.917 1.144 1.00 0.00 H new ATOM 71 N GLU A 6 18.088 -8.255 1.132 1.00 0.00 N ATOM 72 CA GLU A 6 16.761 -7.800 1.506 1.00 0.00 C ATOM 73 C GLU A 6 15.895 -7.642 0.253 1.00 0.00 C ATOM 74 O GLU A 6 14.728 -8.035 0.256 1.00 0.00 O ATOM 75 CB GLU A 6 16.875 -6.495 2.302 1.00 0.00 C ATOM 76 CG GLU A 6 17.694 -6.652 3.592 1.00 0.00 C ATOM 77 CD GLU A 6 17.033 -7.594 4.593 1.00 0.00 C ATOM 78 OE1 GLU A 6 16.164 -7.100 5.343 1.00 0.00 O ATOM 79 OE2 GLU A 6 17.404 -8.788 4.586 1.00 0.00 O ATOM 0 H GLU A 6 18.826 -7.583 1.344 1.00 0.00 H new ATOM 0 HA GLU A 6 16.275 -8.537 2.146 1.00 0.00 H new ATOM 0 HB2 GLU A 6 17.336 -5.732 1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 6 15.876 -6.140 2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 6 18.687 -7.028 3.345 1.00 0.00 H new ATOM 0 HG3 GLU A 6 17.830 -5.674 4.054 1.00 0.00 H new ATOM 86 N TRP A 7 16.441 -7.051 -0.813 1.00 0.00 N ATOM 87 CA TRP A 7 15.685 -6.932 -2.046 1.00 0.00 C ATOM 88 C TRP A 7 15.269 -8.286 -2.602 1.00 0.00 C ATOM 89 O TRP A 7 14.093 -8.469 -2.915 1.00 0.00 O ATOM 90 CB TRP A 7 16.401 -6.070 -3.087 1.00 0.00 C ATOM 91 CG TRP A 7 16.264 -4.599 -2.854 1.00 0.00 C ATOM 92 CD1 TRP A 7 17.279 -3.716 -2.747 1.00 0.00 C ATOM 93 CD2 TRP A 7 15.037 -3.818 -2.723 1.00 0.00 C ATOM 94 NE1 TRP A 7 16.769 -2.455 -2.536 1.00 0.00 N ATOM 95 CE2 TRP A 7 15.392 -2.462 -2.480 1.00 0.00 C ATOM 96 CE3 TRP A 7 13.659 -4.118 -2.786 1.00 0.00 C ATOM 97 CZ2 TRP A 7 14.434 -1.459 -2.270 1.00 0.00 C ATOM 98 CZ3 TRP A 7 12.689 -3.124 -2.569 1.00 0.00 C ATOM 99 CH2 TRP A 7 13.071 -1.797 -2.307 1.00 0.00 C ATOM 0 H TRP A 7 17.382 -6.658 -0.842 1.00 0.00 H new ATOM 0 HA TRP A 7 14.764 -6.407 -1.793 1.00 0.00 H new ATOM 0 HB2 TRP A 7 17.460 -6.330 -3.093 1.00 0.00 H new ATOM 0 HB3 TRP A 7 16.008 -6.310 -4.075 1.00 0.00 H new ATOM 0 HD1 TRP A 7 18.329 -3.961 -2.816 1.00 0.00 H new ATOM 0 HE1 TRP A 7 17.341 -1.617 -2.433 1.00 0.00 H new ATOM 0 HE3 TRP A 7 13.345 -5.128 -3.005 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 14.740 -0.440 -2.082 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 11.641 -3.382 -2.604 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.320 -1.040 -2.135 1.00 0.00 H new ATOM 110 N GLN A 8 16.183 -9.253 -2.708 1.00 0.00 N ATOM 111 CA GLN A 8 15.786 -10.541 -3.256 1.00 0.00 C ATOM 112 C GLN A 8 14.740 -11.197 -2.344 1.00 0.00 C ATOM 113 O GLN A 8 13.797 -11.798 -2.853 1.00 0.00 O ATOM 114 CB GLN A 8 16.979 -11.407 -3.684 1.00 0.00 C ATOM 115 CG GLN A 8 17.929 -11.897 -2.589 1.00 0.00 C ATOM 116 CD GLN A 8 17.391 -13.092 -1.812 1.00 0.00 C ATOM 117 OE1 GLN A 8 17.142 -14.150 -2.378 1.00 0.00 O ATOM 118 NE2 GLN A 8 17.209 -12.937 -0.509 1.00 0.00 N ATOM 0 H GLN A 8 17.162 -9.172 -2.433 1.00 0.00 H new ATOM 0 HA GLN A 8 15.278 -10.395 -4.209 1.00 0.00 H new ATOM 0 HB2 GLN A 8 16.589 -12.281 -4.206 1.00 0.00 H new ATOM 0 HB3 GLN A 8 17.564 -10.839 -4.407 1.00 0.00 H new ATOM 0 HG2 GLN A 8 18.884 -12.167 -3.040 1.00 0.00 H new ATOM 0 HG3 GLN A 8 18.124 -11.080 -1.895 1.00 0.00 H new ATOM 0 HE21 GLN A 8 17.426 -12.044 -0.066 1.00 0.00 H new ATOM 0 HE22 GLN A 8 16.852 -13.711 0.052 1.00 0.00 H new ATOM 127 N LEU A 9 14.845 -11.026 -1.012 1.00 0.00 N ATOM 128 CA LEU A 9 13.801 -11.511 -0.111 1.00 0.00 C ATOM 129 C LEU A 9 12.476 -10.871 -0.523 1.00 0.00 C ATOM 130 O LEU A 9 11.555 -11.586 -0.903 1.00 0.00 O ATOM 131 CB LEU A 9 14.077 -11.210 1.374 1.00 0.00 C ATOM 132 CG LEU A 9 15.149 -12.082 2.044 1.00 0.00 C ATOM 133 CD1 LEU A 9 15.320 -11.632 3.496 1.00 0.00 C ATOM 134 CD2 LEU A 9 14.792 -13.574 2.029 1.00 0.00 C ATOM 0 H LEU A 9 15.629 -10.564 -0.550 1.00 0.00 H new ATOM 0 HA LEU A 9 13.771 -12.597 -0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.376 -10.166 1.464 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.145 -11.323 1.928 1.00 0.00 H new ATOM 0 HG LEU A 9 16.072 -11.957 1.477 1.00 0.00 H new ATOM 0 HD11 LEU A 9 16.080 -12.246 3.980 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.629 -10.587 3.519 1.00 0.00 H new ATOM 0 HD13 LEU A 9 14.373 -11.742 4.025 1.00 0.00 H new ATOM 0 HD21 LEU A 9 15.585 -14.143 2.515 1.00 0.00 H new ATOM 0 HD22 LEU A 9 13.854 -13.729 2.562 1.00 0.00 H new ATOM 0 HD23 LEU A 9 14.683 -13.912 0.998 1.00 0.00 H new ATOM 146 N VAL A 10 12.413 -9.536 -0.556 1.00 0.00 N ATOM 147 CA VAL A 10 11.205 -8.795 -0.902 1.00 0.00 C ATOM 148 C VAL A 10 10.603 -9.285 -2.220 1.00 0.00 C ATOM 149 O VAL A 10 9.441 -9.675 -2.272 1.00 0.00 O ATOM 150 CB VAL A 10 11.525 -7.290 -0.927 1.00 0.00 C ATOM 151 CG1 VAL A 10 10.485 -6.432 -1.654 1.00 0.00 C ATOM 152 CG2 VAL A 10 11.651 -6.783 0.509 1.00 0.00 C ATOM 0 H VAL A 10 13.210 -8.937 -0.340 1.00 0.00 H new ATOM 0 HA VAL A 10 10.444 -8.972 -0.143 1.00 0.00 H new ATOM 0 HB VAL A 10 12.456 -7.190 -1.484 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.790 -5.386 -1.623 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.407 -6.757 -2.692 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.517 -6.542 -1.165 1.00 0.00 H new ATOM 0 HG21 VAL A 10 11.878 -5.717 0.500 1.00 0.00 H new ATOM 0 HG22 VAL A 10 10.712 -6.950 1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.453 -7.320 1.015 1.00 0.00 H new ATOM 162 N LEU A 11 11.388 -9.283 -3.295 1.00 0.00 N ATOM 163 CA LEU A 11 10.910 -9.738 -4.594 1.00 0.00 C ATOM 164 C LEU A 11 10.383 -11.174 -4.507 1.00 0.00 C ATOM 165 O LEU A 11 9.330 -11.480 -5.069 1.00 0.00 O ATOM 166 CB LEU A 11 12.017 -9.587 -5.642 1.00 0.00 C ATOM 167 CG LEU A 11 12.517 -8.136 -5.793 1.00 0.00 C ATOM 168 CD1 LEU A 11 13.733 -8.124 -6.725 1.00 0.00 C ATOM 169 CD2 LEU A 11 11.436 -7.197 -6.341 1.00 0.00 C ATOM 0 H LEU A 11 12.359 -8.970 -3.290 1.00 0.00 H new ATOM 0 HA LEU A 11 10.073 -9.114 -4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 11 12.856 -10.227 -5.369 1.00 0.00 H new ATOM 0 HB3 LEU A 11 11.647 -9.939 -6.605 1.00 0.00 H new ATOM 0 HG LEU A 11 12.786 -7.770 -4.802 1.00 0.00 H new ATOM 0 HD11 LEU A 11 14.094 -7.102 -6.838 1.00 0.00 H new ATOM 0 HD12 LEU A 11 14.523 -8.743 -6.300 1.00 0.00 H new ATOM 0 HD13 LEU A 11 13.448 -8.518 -7.700 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.840 -6.188 -6.428 1.00 0.00 H new ATOM 0 HD22 LEU A 11 11.115 -7.545 -7.323 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.583 -7.189 -5.662 1.00 0.00 H new ATOM 181 N HIS A 12 11.077 -12.059 -3.782 1.00 0.00 N ATOM 182 CA HIS A 12 10.586 -13.424 -3.633 1.00 0.00 C ATOM 183 C HIS A 12 9.256 -13.437 -2.867 1.00 0.00 C ATOM 184 O HIS A 12 8.337 -14.141 -3.275 1.00 0.00 O ATOM 185 CB HIS A 12 11.665 -14.386 -3.103 1.00 0.00 C ATOM 186 CG HIS A 12 11.364 -15.013 -1.768 1.00 0.00 C ATOM 187 ND1 HIS A 12 11.381 -14.357 -0.554 1.00 0.00 N ATOM 188 CD2 HIS A 12 10.881 -16.275 -1.565 1.00 0.00 C ATOM 189 CE1 HIS A 12 10.912 -15.205 0.378 1.00 0.00 C ATOM 190 NE2 HIS A 12 10.616 -16.379 -0.214 1.00 0.00 N ATOM 0 H HIS A 12 11.955 -11.859 -3.303 1.00 0.00 H new ATOM 0 HA HIS A 12 10.358 -13.827 -4.620 1.00 0.00 H new ATOM 0 HB2 HIS A 12 11.812 -15.180 -3.835 1.00 0.00 H new ATOM 0 HB3 HIS A 12 12.607 -13.844 -3.028 1.00 0.00 H new ATOM 0 HD1 HIS A 12 11.694 -13.400 -0.393 1.00 0.00 H new ATOM 0 HD2 HIS A 12 10.735 -17.040 -2.313 1.00 0.00 H new ATOM 0 HE1 HIS A 12 10.792 -14.982 1.428 1.00 0.00 H new ATOM 0 HE2 HIS A 12 10.255 -17.208 0.258 1.00 0.00 H new ATOM 199 N VAL A 13 9.126 -12.663 -1.781 1.00 0.00 N ATOM 200 CA VAL A 13 7.857 -12.546 -1.064 1.00 0.00 C ATOM 201 C VAL A 13 6.794 -12.051 -2.045 1.00 0.00 C ATOM 202 O VAL A 13 5.701 -12.602 -2.128 1.00 0.00 O ATOM 203 CB VAL A 13 7.967 -11.633 0.173 1.00 0.00 C ATOM 204 CG1 VAL A 13 6.610 -11.497 0.876 1.00 0.00 C ATOM 205 CG2 VAL A 13 8.960 -12.184 1.200 1.00 0.00 C ATOM 0 H VAL A 13 9.886 -12.111 -1.383 1.00 0.00 H new ATOM 0 HA VAL A 13 7.571 -13.525 -0.678 1.00 0.00 H new ATOM 0 HB VAL A 13 8.311 -10.666 -0.193 1.00 0.00 H new ATOM 0 HG11 VAL A 13 6.714 -10.848 1.746 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.884 -11.066 0.186 1.00 0.00 H new ATOM 0 HG13 VAL A 13 6.266 -12.480 1.196 1.00 0.00 H new ATOM 0 HG21 VAL A 13 9.008 -11.512 2.056 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.632 -13.170 1.531 1.00 0.00 H new ATOM 0 HG23 VAL A 13 9.947 -12.264 0.745 1.00 0.00 H new ATOM 215 N TRP A 14 7.150 -11.103 -2.911 1.00 0.00 N ATOM 216 CA TRP A 14 6.182 -10.533 -3.828 1.00 0.00 C ATOM 217 C TRP A 14 5.722 -11.533 -4.872 1.00 0.00 C ATOM 218 O TRP A 14 4.572 -11.511 -5.312 1.00 0.00 O ATOM 219 CB TRP A 14 6.727 -9.265 -4.484 1.00 0.00 C ATOM 220 CG TRP A 14 5.610 -8.386 -4.910 1.00 0.00 C ATOM 221 CD1 TRP A 14 5.119 -8.251 -6.162 1.00 0.00 C ATOM 222 CD2 TRP A 14 4.710 -7.655 -4.037 1.00 0.00 C ATOM 223 NE1 TRP A 14 4.041 -7.385 -6.135 1.00 0.00 N ATOM 224 CE2 TRP A 14 3.751 -6.983 -4.843 1.00 0.00 C ATOM 225 CE3 TRP A 14 4.602 -7.513 -2.636 1.00 0.00 C ATOM 226 CZ2 TRP A 14 2.770 -6.159 -4.280 1.00 0.00 C ATOM 227 CZ3 TRP A 14 3.632 -6.669 -2.068 1.00 0.00 C ATOM 228 CH2 TRP A 14 2.747 -5.955 -2.893 1.00 0.00 C ATOM 0 H TRP A 14 8.092 -10.721 -2.992 1.00 0.00 H new ATOM 0 HA TRP A 14 5.306 -10.263 -3.239 1.00 0.00 H new ATOM 0 HB2 TRP A 14 7.371 -8.733 -3.784 1.00 0.00 H new ATOM 0 HB3 TRP A 14 7.341 -9.528 -5.345 1.00 0.00 H new ATOM 0 HD1 TRP A 14 5.507 -8.741 -7.043 1.00 0.00 H new ATOM 0 HE1 TRP A 14 3.526 -7.082 -6.961 1.00 0.00 H new ATOM 0 HE3 TRP A 14 5.274 -8.061 -1.992 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 2.034 -5.683 -4.911 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 3.567 -6.569 -0.995 1.00 0.00 H new ATOM 0 HH2 TRP A 14 2.051 -5.251 -2.460 1.00 0.00 H new ATOM 239 N ALA A 15 6.613 -12.436 -5.271 1.00 0.00 N ATOM 240 CA ALA A 15 6.183 -13.517 -6.129 1.00 0.00 C ATOM 241 C ALA A 15 5.256 -14.392 -5.281 1.00 0.00 C ATOM 242 O ALA A 15 4.153 -14.725 -5.708 1.00 0.00 O ATOM 243 CB ALA A 15 7.383 -14.311 -6.655 1.00 0.00 C ATOM 0 H ALA A 15 7.602 -12.438 -5.021 1.00 0.00 H new ATOM 0 HA ALA A 15 5.662 -13.142 -7.010 1.00 0.00 H new ATOM 0 HB1 ALA A 15 7.032 -15.118 -7.298 1.00 0.00 H new ATOM 0 HB2 ALA A 15 8.035 -13.650 -7.226 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.938 -14.731 -5.816 1.00 0.00 H new ATOM 249 N LYS A 16 5.710 -14.748 -4.073 1.00 0.00 N ATOM 250 CA LYS A 16 5.009 -15.638 -3.156 1.00 0.00 C ATOM 251 C LYS A 16 3.656 -15.161 -2.664 1.00 0.00 C ATOM 252 O LYS A 16 2.826 -16.013 -2.352 1.00 0.00 O ATOM 253 CB LYS A 16 5.895 -16.036 -1.972 1.00 0.00 C ATOM 254 CG LYS A 16 7.123 -16.867 -2.367 1.00 0.00 C ATOM 255 CD LYS A 16 6.759 -18.344 -2.557 1.00 0.00 C ATOM 256 CE LYS A 16 8.015 -19.200 -2.753 1.00 0.00 C ATOM 257 NZ LYS A 16 8.765 -18.809 -3.960 1.00 0.00 N ATOM 0 H LYS A 16 6.599 -14.413 -3.702 1.00 0.00 H new ATOM 0 HA LYS A 16 4.789 -16.511 -3.771 1.00 0.00 H new ATOM 0 HB2 LYS A 16 6.229 -15.133 -1.461 1.00 0.00 H new ATOM 0 HB3 LYS A 16 5.298 -16.604 -1.259 1.00 0.00 H new ATOM 0 HG2 LYS A 16 7.549 -16.474 -3.290 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.890 -16.775 -1.598 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.204 -18.700 -1.689 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.103 -18.452 -3.421 1.00 0.00 H new ATOM 0 HE2 LYS A 16 8.659 -19.105 -1.879 1.00 0.00 H new ATOM 0 HE3 LYS A 16 7.731 -20.250 -2.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 9.549 -19.475 -4.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 8.130 -18.826 -4.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 9.146 -17.849 -3.836 1.00 0.00 H new ATOM 271 N VAL A 17 3.383 -13.849 -2.711 1.00 0.00 N ATOM 272 CA VAL A 17 2.034 -13.294 -2.496 1.00 0.00 C ATOM 273 C VAL A 17 1.085 -14.109 -3.412 1.00 0.00 C ATOM 274 O VAL A 17 -0.116 -14.214 -3.169 1.00 0.00 O ATOM 275 CB VAL A 17 2.022 -11.772 -2.825 1.00 0.00 C ATOM 276 CG1 VAL A 17 0.802 -11.187 -3.549 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.479 -10.903 -1.655 1.00 0.00 C ATOM 0 H VAL A 17 4.091 -13.140 -2.899 1.00 0.00 H new ATOM 0 HA VAL A 17 1.711 -13.376 -1.458 1.00 0.00 H new ATOM 0 HB VAL A 17 2.779 -11.730 -3.609 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.949 -10.118 -3.704 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.680 -11.680 -4.514 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.091 -11.347 -2.945 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.448 -9.853 -1.948 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.817 -11.062 -0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.498 -11.173 -1.378 1.00 0.00 H new ATOM 287 N GLU A 18 1.675 -14.664 -4.487 1.00 0.00 N ATOM 288 CA GLU A 18 1.209 -15.647 -5.458 1.00 0.00 C ATOM 289 C GLU A 18 0.888 -14.940 -6.749 1.00 0.00 C ATOM 290 O GLU A 18 -0.118 -15.221 -7.396 1.00 0.00 O ATOM 291 CB GLU A 18 0.088 -16.488 -4.849 1.00 0.00 C ATOM 292 CG GLU A 18 -0.067 -17.871 -5.495 1.00 0.00 C ATOM 293 CD GLU A 18 1.119 -18.780 -5.190 1.00 0.00 C ATOM 294 OE1 GLU A 18 1.172 -19.273 -4.043 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.952 -18.962 -6.105 1.00 0.00 O ATOM 0 H GLU A 18 2.628 -14.385 -4.718 1.00 0.00 H new ATOM 0 HA GLU A 18 1.979 -16.375 -5.713 1.00 0.00 H new ATOM 0 HB2 GLU A 18 0.279 -16.614 -3.783 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.853 -15.946 -4.943 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -0.984 -18.338 -5.136 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.169 -17.758 -6.574 1.00 0.00 H new ATOM 302 N ALA A 19 1.738 -13.949 -7.042 1.00 0.00 N ATOM 303 CA ALA A 19 1.519 -12.986 -8.120 1.00 0.00 C ATOM 304 C ALA A 19 0.056 -12.489 -8.104 1.00 0.00 C ATOM 305 O ALA A 19 -0.541 -12.213 -9.147 1.00 0.00 O ATOM 306 CB ALA A 19 1.904 -13.611 -9.465 1.00 0.00 C ATOM 0 H ALA A 19 2.606 -13.794 -6.530 1.00 0.00 H new ATOM 0 HA ALA A 19 2.157 -12.115 -7.968 1.00 0.00 H new ATOM 0 HB1 ALA A 19 1.738 -12.888 -10.263 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.956 -13.896 -9.446 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.292 -14.495 -9.644 1.00 0.00 H new ATOM 312 N ASP A 20 -0.587 -12.536 -6.928 1.00 0.00 N ATOM 313 CA ASP A 20 -2.000 -12.260 -6.790 1.00 0.00 C ATOM 314 C ASP A 20 -2.219 -10.784 -6.524 1.00 0.00 C ATOM 315 O ASP A 20 -2.817 -10.390 -5.528 1.00 0.00 O ATOM 316 CB ASP A 20 -2.596 -13.171 -5.710 1.00 0.00 C ATOM 317 CG ASP A 20 -4.067 -12.871 -5.450 1.00 0.00 C ATOM 318 OD1 ASP A 20 -4.795 -12.657 -6.444 1.00 0.00 O ATOM 319 OD2 ASP A 20 -4.426 -12.817 -4.252 1.00 0.00 O ATOM 0 H ASP A 20 -0.126 -12.769 -6.048 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.525 -12.484 -7.718 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.488 -14.212 -6.015 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.033 -13.050 -4.784 1.00 0.00 H new ATOM 324 N VAL A 21 -1.731 -9.972 -7.455 1.00 0.00 N ATOM 325 CA VAL A 21 -1.764 -8.527 -7.354 1.00 0.00 C ATOM 326 C VAL A 21 -3.193 -8.023 -7.082 1.00 0.00 C ATOM 327 O VAL A 21 -3.436 -7.296 -6.121 1.00 0.00 O ATOM 328 CB VAL A 21 -1.051 -7.956 -8.597 1.00 0.00 C ATOM 329 CG1 VAL A 21 -1.784 -8.238 -9.916 1.00 0.00 C ATOM 330 CG2 VAL A 21 -0.787 -6.455 -8.473 1.00 0.00 C ATOM 0 H VAL A 21 -1.295 -10.310 -8.313 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.215 -8.156 -6.489 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.100 -8.487 -8.631 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -1.222 -7.806 -10.744 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.872 -9.315 -10.060 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -2.779 -7.794 -9.882 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.284 -6.099 -9.372 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.734 -5.928 -8.354 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.155 -6.267 -7.605 1.00 0.00 H new ATOM 340 N ALA A 22 -4.160 -8.438 -7.904 1.00 0.00 N ATOM 341 CA ALA A 22 -5.556 -8.055 -7.747 1.00 0.00 C ATOM 342 C ALA A 22 -6.136 -8.487 -6.398 1.00 0.00 C ATOM 343 O ALA A 22 -6.708 -7.674 -5.674 1.00 0.00 O ATOM 344 CB ALA A 22 -6.387 -8.669 -8.882 1.00 0.00 C ATOM 0 H ALA A 22 -3.990 -9.053 -8.700 1.00 0.00 H new ATOM 0 HA ALA A 22 -5.600 -6.967 -7.786 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.432 -8.382 -8.764 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.017 -8.306 -9.841 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.303 -9.755 -8.848 1.00 0.00 H new ATOM 350 N GLY A 23 -6.018 -9.779 -6.077 1.00 0.00 N ATOM 351 CA GLY A 23 -6.605 -10.346 -4.873 1.00 0.00 C ATOM 352 C GLY A 23 -6.001 -9.687 -3.644 1.00 0.00 C ATOM 353 O GLY A 23 -6.724 -9.099 -2.839 1.00 0.00 O ATOM 0 H GLY A 23 -5.512 -10.456 -6.648 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.685 -10.200 -4.881 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.429 -11.421 -4.844 1.00 0.00 H new ATOM 357 N HIS A 24 -4.664 -9.646 -3.573 1.00 0.00 N ATOM 358 CA HIS A 24 -3.991 -9.016 -2.451 1.00 0.00 C ATOM 359 C HIS A 24 -4.421 -7.559 -2.404 1.00 0.00 C ATOM 360 O HIS A 24 -4.805 -7.067 -1.358 1.00 0.00 O ATOM 361 CB HIS A 24 -2.463 -9.203 -2.503 1.00 0.00 C ATOM 362 CG HIS A 24 -2.083 -10.582 -2.034 1.00 0.00 C ATOM 363 ND1 HIS A 24 -2.829 -11.720 -2.248 1.00 0.00 N ATOM 364 CD2 HIS A 24 -1.108 -10.889 -1.119 1.00 0.00 C ATOM 365 CE1 HIS A 24 -2.351 -12.676 -1.440 1.00 0.00 C ATOM 366 NE2 HIS A 24 -1.315 -12.213 -0.721 1.00 0.00 N ATOM 0 H HIS A 24 -4.040 -10.040 -4.277 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.286 -9.500 -1.520 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.106 -9.048 -3.521 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -1.978 -8.454 -1.878 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -3.605 -11.817 -2.903 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.326 -10.230 -0.771 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -2.744 -13.680 -1.376 1.00 0.00 H new ATOM 374 N GLY A 25 -4.432 -6.875 -3.545 1.00 0.00 N ATOM 375 CA GLY A 25 -4.856 -5.486 -3.622 1.00 0.00 C ATOM 376 C GLY A 25 -6.230 -5.288 -2.979 1.00 0.00 C ATOM 377 O GLY A 25 -6.386 -4.458 -2.083 1.00 0.00 O ATOM 0 H GLY A 25 -4.147 -7.271 -4.441 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.124 -4.852 -3.123 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -4.891 -5.172 -4.665 1.00 0.00 H new ATOM 381 N GLN A 26 -7.214 -6.108 -3.367 1.00 0.00 N ATOM 382 CA GLN A 26 -8.548 -6.008 -2.797 1.00 0.00 C ATOM 383 C GLN A 26 -8.440 -6.267 -1.290 1.00 0.00 C ATOM 384 O GLN A 26 -8.707 -5.367 -0.498 1.00 0.00 O ATOM 385 CB GLN A 26 -9.535 -6.961 -3.501 1.00 0.00 C ATOM 386 CG GLN A 26 -10.828 -7.115 -2.688 1.00 0.00 C ATOM 387 CD GLN A 26 -11.981 -7.722 -3.482 1.00 0.00 C ATOM 388 OE1 GLN A 26 -12.217 -8.924 -3.423 1.00 0.00 O ATOM 389 NE2 GLN A 26 -12.718 -6.901 -4.225 1.00 0.00 N ATOM 0 H GLN A 26 -7.106 -6.841 -4.068 1.00 0.00 H new ATOM 0 HA GLN A 26 -8.954 -5.009 -2.954 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.769 -6.578 -4.494 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.069 -7.937 -3.637 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -10.628 -7.741 -1.818 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.131 -6.137 -2.314 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -12.499 -5.905 -4.255 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -13.502 -7.267 -4.764 1.00 0.00 H new ATOM 398 N ASP A 27 -7.995 -7.472 -0.904 1.00 0.00 N ATOM 399 CA ASP A 27 -7.840 -7.897 0.484 1.00 0.00 C ATOM 400 C ASP A 27 -7.169 -6.832 1.353 1.00 0.00 C ATOM 401 O ASP A 27 -7.656 -6.512 2.430 1.00 0.00 O ATOM 402 CB ASP A 27 -7.079 -9.228 0.558 1.00 0.00 C ATOM 403 CG ASP A 27 -6.986 -9.739 1.994 1.00 0.00 C ATOM 404 OD1 ASP A 27 -8.006 -9.651 2.712 1.00 0.00 O ATOM 405 OD2 ASP A 27 -5.891 -10.222 2.349 1.00 0.00 O ATOM 0 H ASP A 27 -7.727 -8.194 -1.573 1.00 0.00 H new ATOM 0 HA ASP A 27 -8.842 -8.042 0.888 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.581 -9.971 -0.062 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -6.076 -9.098 0.151 1.00 0.00 H new ATOM 410 N ILE A 28 -6.118 -6.186 0.853 1.00 0.00 N ATOM 411 CA ILE A 28 -5.375 -5.178 1.590 1.00 0.00 C ATOM 412 C ILE A 28 -6.287 -3.982 1.874 1.00 0.00 C ATOM 413 O ILE A 28 -6.348 -3.497 3.003 1.00 0.00 O ATOM 414 CB ILE A 28 -4.086 -4.793 0.828 1.00 0.00 C ATOM 415 CG1 ILE A 28 -3.080 -5.957 0.934 1.00 0.00 C ATOM 416 CG2 ILE A 28 -3.460 -3.512 1.401 1.00 0.00 C ATOM 417 CD1 ILE A 28 -1.918 -5.826 -0.045 1.00 0.00 C ATOM 0 H ILE A 28 -5.758 -6.353 -0.087 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.052 -5.576 2.552 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.338 -4.603 -0.215 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.689 -6.002 1.951 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.599 -6.898 0.750 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.556 -3.268 0.844 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.171 -2.690 1.316 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.209 -3.668 2.450 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.243 -6.673 0.076 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.302 -5.810 -1.065 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.377 -4.901 0.154 1.00 0.00 H new ATOM 429 N LEU A 29 -7.010 -3.495 0.863 1.00 0.00 N ATOM 430 CA LEU A 29 -7.903 -2.387 0.996 1.00 0.00 C ATOM 431 C LEU A 29 -9.076 -2.783 1.893 1.00 0.00 C ATOM 432 O LEU A 29 -9.416 -2.055 2.818 1.00 0.00 O ATOM 433 CB LEU A 29 -8.302 -1.981 -0.421 1.00 0.00 C ATOM 434 CG LEU A 29 -7.204 -1.247 -1.221 1.00 0.00 C ATOM 435 CD1 LEU A 29 -7.757 -0.744 -2.557 1.00 0.00 C ATOM 436 CD2 LEU A 29 -6.622 -0.046 -0.464 1.00 0.00 C ATOM 0 H LEU A 29 -6.977 -3.881 -0.081 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.450 -1.524 1.484 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -8.595 -2.876 -0.971 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.181 -1.339 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.410 -1.976 -1.380 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -6.969 -0.229 -3.107 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.116 -1.590 -3.144 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -8.581 -0.054 -2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -5.855 0.432 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.416 0.670 -0.253 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.181 -0.386 0.473 1.00 0.00 H new ATOM 448 N ILE A 30 -9.639 -3.981 1.716 1.00 0.00 N ATOM 449 CA ILE A 30 -10.709 -4.490 2.537 1.00 0.00 C ATOM 450 C ILE A 30 -10.255 -4.494 3.998 1.00 0.00 C ATOM 451 O ILE A 30 -10.973 -4.033 4.878 1.00 0.00 O ATOM 452 CB ILE A 30 -11.105 -5.871 1.965 1.00 0.00 C ATOM 453 CG1 ILE A 30 -12.479 -5.730 1.319 1.00 0.00 C ATOM 454 CG2 ILE A 30 -10.997 -7.018 2.959 1.00 0.00 C ATOM 455 CD1 ILE A 30 -12.919 -6.987 0.572 1.00 0.00 C ATOM 0 H ILE A 30 -9.349 -4.626 0.981 1.00 0.00 H new ATOM 0 HA ILE A 30 -11.605 -3.869 2.519 1.00 0.00 H new ATOM 0 HB ILE A 30 -10.379 -6.164 1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -13.214 -5.496 2.089 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -12.464 -4.889 0.626 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -11.293 -7.948 2.475 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -9.968 -7.102 3.307 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.653 -6.826 3.808 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -13.904 -6.824 0.135 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -12.203 -7.210 -0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -12.965 -7.826 1.267 1.00 0.00 H new ATOM 467 N ARG A 31 -9.037 -4.980 4.241 1.00 0.00 N ATOM 468 CA ARG A 31 -8.443 -5.039 5.569 1.00 0.00 C ATOM 469 C ARG A 31 -8.299 -3.636 6.143 1.00 0.00 C ATOM 470 O ARG A 31 -8.725 -3.375 7.266 1.00 0.00 O ATOM 471 CB ARG A 31 -7.084 -5.758 5.522 1.00 0.00 C ATOM 472 CG ARG A 31 -7.249 -7.282 5.599 1.00 0.00 C ATOM 473 CD ARG A 31 -7.030 -7.792 7.032 1.00 0.00 C ATOM 474 NE ARG A 31 -7.808 -7.044 8.032 1.00 0.00 N ATOM 475 CZ ARG A 31 -9.101 -7.241 8.324 1.00 0.00 C ATOM 476 NH1 ARG A 31 -9.815 -8.153 7.656 1.00 0.00 N ATOM 477 NH2 ARG A 31 -9.672 -6.503 9.280 1.00 0.00 N ATOM 0 H ARG A 31 -8.430 -5.348 3.508 1.00 0.00 H new ATOM 0 HA ARG A 31 -9.102 -5.610 6.223 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -6.563 -5.494 4.602 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.462 -5.416 6.349 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -8.247 -7.560 5.259 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -6.538 -7.762 4.927 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -7.302 -8.846 7.082 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.970 -7.724 7.278 1.00 0.00 H new ATOM 0 HE ARG A 31 -7.321 -6.312 8.548 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -9.376 -8.704 6.919 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -10.799 -8.297 7.884 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -9.125 -5.800 9.777 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -10.655 -6.642 9.513 1.00 0.00 H new ATOM 491 N LEU A 32 -7.731 -2.717 5.364 1.00 0.00 N ATOM 492 CA LEU A 32 -7.519 -1.340 5.725 1.00 0.00 C ATOM 493 C LEU A 32 -8.857 -0.706 6.141 1.00 0.00 C ATOM 494 O LEU A 32 -8.939 -0.007 7.153 1.00 0.00 O ATOM 495 CB LEU A 32 -6.869 -0.719 4.479 1.00 0.00 C ATOM 496 CG LEU A 32 -6.590 0.770 4.543 1.00 0.00 C ATOM 497 CD1 LEU A 32 -5.489 1.058 5.561 1.00 0.00 C ATOM 498 CD2 LEU A 32 -6.196 1.278 3.152 1.00 0.00 C ATOM 0 H LEU A 32 -7.396 -2.934 4.425 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.871 -1.187 6.588 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.929 -1.236 4.289 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.516 -0.910 3.623 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.490 1.294 4.864 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.298 2.131 5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.804 0.712 6.545 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.577 0.537 5.268 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.996 2.348 3.199 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -5.301 0.756 2.814 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.011 1.092 2.452 1.00 0.00 H new ATOM 510 N PHE A 33 -9.900 -0.914 5.336 1.00 0.00 N ATOM 511 CA PHE A 33 -11.224 -0.389 5.603 1.00 0.00 C ATOM 512 C PHE A 33 -11.850 -1.015 6.842 1.00 0.00 C ATOM 513 O PHE A 33 -12.307 -0.299 7.730 1.00 0.00 O ATOM 514 CB PHE A 33 -12.131 -0.570 4.368 1.00 0.00 C ATOM 515 CG PHE A 33 -11.626 0.033 3.061 1.00 0.00 C ATOM 516 CD1 PHE A 33 -10.597 0.989 3.075 1.00 0.00 C ATOM 517 CD2 PHE A 33 -12.134 -0.405 1.822 1.00 0.00 C ATOM 518 CE1 PHE A 33 -10.041 1.454 1.880 1.00 0.00 C ATOM 519 CE2 PHE A 33 -11.607 0.107 0.617 1.00 0.00 C ATOM 520 CZ PHE A 33 -10.557 1.044 0.644 1.00 0.00 C ATOM 0 H PHE A 33 -9.841 -1.457 4.475 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.122 0.677 5.808 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.288 -1.637 4.213 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.104 -0.133 4.592 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -10.232 1.368 4.018 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -12.929 -1.135 1.794 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -9.205 2.137 1.910 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -12.011 -0.221 -0.329 1.00 0.00 H new ATOM 0 HZ PHE A 33 -10.155 1.442 -0.276 1.00 0.00 H new ATOM 530 N LYS A 34 -11.920 -2.344 6.878 1.00 0.00 N ATOM 531 CA LYS A 34 -12.536 -3.091 7.964 1.00 0.00 C ATOM 532 C LYS A 34 -11.852 -2.775 9.298 1.00 0.00 C ATOM 533 O LYS A 34 -12.517 -2.660 10.324 1.00 0.00 O ATOM 534 CB LYS A 34 -12.489 -4.593 7.627 1.00 0.00 C ATOM 535 CG LYS A 34 -13.287 -5.493 8.581 1.00 0.00 C ATOM 536 CD LYS A 34 -14.797 -5.229 8.483 1.00 0.00 C ATOM 537 CE LYS A 34 -15.623 -6.281 9.235 1.00 0.00 C ATOM 538 NZ LYS A 34 -15.459 -7.629 8.660 1.00 0.00 N ATOM 0 H LYS A 34 -11.543 -2.938 6.140 1.00 0.00 H new ATOM 0 HA LYS A 34 -13.579 -2.795 8.074 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.867 -4.736 6.615 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.449 -4.919 7.628 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -13.085 -6.539 8.349 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -12.954 -5.324 9.605 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -15.018 -4.241 8.887 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -15.094 -5.219 7.434 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -15.324 -6.295 10.283 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -16.676 -6.001 9.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -16.347 -8.160 8.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -15.217 -7.549 7.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -14.697 -8.129 9.160 1.00 0.00 H new ATOM 552 N SER A 35 -10.520 -2.676 9.290 1.00 0.00 N ATOM 553 CA SER A 35 -9.739 -2.407 10.489 1.00 0.00 C ATOM 554 C SER A 35 -9.788 -0.922 10.866 1.00 0.00 C ATOM 555 O SER A 35 -9.964 -0.593 12.038 1.00 0.00 O ATOM 556 CB SER A 35 -8.296 -2.881 10.295 1.00 0.00 C ATOM 557 OG SER A 35 -8.279 -4.210 9.810 1.00 0.00 O ATOM 0 H SER A 35 -9.956 -2.781 8.447 1.00 0.00 H new ATOM 0 HA SER A 35 -10.178 -2.964 11.316 1.00 0.00 H new ATOM 0 HB2 SER A 35 -7.781 -2.224 9.594 1.00 0.00 H new ATOM 0 HB3 SER A 35 -7.757 -2.824 11.241 1.00 0.00 H new ATOM 0 HG SER A 35 -8.429 -4.207 8.842 1.00 0.00 H new ATOM 563 N HIS A 36 -9.618 -0.023 9.888 1.00 0.00 N ATOM 564 CA HIS A 36 -9.603 1.412 10.129 1.00 0.00 C ATOM 565 C HIS A 36 -10.660 2.104 9.261 1.00 0.00 C ATOM 566 O HIS A 36 -10.312 2.609 8.197 1.00 0.00 O ATOM 567 CB HIS A 36 -8.196 1.970 9.839 1.00 0.00 C ATOM 568 CG HIS A 36 -7.089 1.252 10.562 1.00 0.00 C ATOM 569 ND1 HIS A 36 -6.658 1.501 11.849 1.00 0.00 N ATOM 570 CD2 HIS A 36 -6.346 0.224 10.053 1.00 0.00 C ATOM 571 CE1 HIS A 36 -5.674 0.625 12.123 1.00 0.00 C ATOM 572 NE2 HIS A 36 -5.473 -0.161 11.047 1.00 0.00 N ATOM 0 H HIS A 36 -9.487 -0.278 8.909 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.845 1.608 11.174 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -8.010 1.916 8.766 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -8.171 3.024 10.114 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -6.427 -0.203 9.064 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -5.132 0.562 13.055 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -4.789 -0.915 10.980 1.00 0.00 H new ATOM 581 N PRO A 37 -11.939 2.174 9.663 1.00 0.00 N ATOM 582 CA PRO A 37 -12.977 2.816 8.855 1.00 0.00 C ATOM 583 C PRO A 37 -12.661 4.272 8.476 1.00 0.00 C ATOM 584 O PRO A 37 -13.235 4.808 7.525 1.00 0.00 O ATOM 585 CB PRO A 37 -14.274 2.678 9.662 1.00 0.00 C ATOM 586 CG PRO A 37 -13.802 2.414 11.093 1.00 0.00 C ATOM 587 CD PRO A 37 -12.502 1.638 10.891 1.00 0.00 C ATOM 0 HA PRO A 37 -13.058 2.327 7.884 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -14.878 3.584 9.603 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -14.890 1.860 9.289 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.637 3.342 11.641 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -14.533 1.836 11.658 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -11.823 1.778 11.732 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -12.689 0.567 10.807 1.00 0.00 H new ATOM 595 N GLU A 38 -11.790 4.944 9.233 1.00 0.00 N ATOM 596 CA GLU A 38 -11.370 6.293 8.901 1.00 0.00 C ATOM 597 C GLU A 38 -10.706 6.350 7.516 1.00 0.00 C ATOM 598 O GLU A 38 -10.763 7.381 6.844 1.00 0.00 O ATOM 599 CB GLU A 38 -10.457 6.890 9.987 1.00 0.00 C ATOM 600 CG GLU A 38 -10.797 6.494 11.432 1.00 0.00 C ATOM 601 CD GLU A 38 -10.036 5.242 11.863 1.00 0.00 C ATOM 602 OE1 GLU A 38 -10.570 4.141 11.608 1.00 0.00 O ATOM 603 OE2 GLU A 38 -8.918 5.404 12.399 1.00 0.00 O ATOM 0 H GLU A 38 -11.365 4.568 10.081 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.268 6.909 8.860 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.430 6.589 9.779 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.493 7.977 9.909 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.554 7.318 12.103 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.869 6.318 11.519 1.00 0.00 H new ATOM 610 N THR A 39 -10.078 5.256 7.075 1.00 0.00 N ATOM 611 CA THR A 39 -9.455 5.206 5.762 1.00 0.00 C ATOM 612 C THR A 39 -10.543 5.262 4.696 1.00 0.00 C ATOM 613 O THR A 39 -10.479 6.049 3.752 1.00 0.00 O ATOM 614 CB THR A 39 -8.597 3.939 5.621 1.00 0.00 C ATOM 615 OG1 THR A 39 -9.367 2.767 5.753 1.00 0.00 O ATOM 616 CG2 THR A 39 -7.459 3.924 6.643 1.00 0.00 C ATOM 0 H THR A 39 -9.991 4.395 7.614 1.00 0.00 H new ATOM 0 HA THR A 39 -8.792 6.062 5.635 1.00 0.00 H new ATOM 0 HB THR A 39 -8.172 3.959 4.617 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.626 2.649 6.691 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.870 3.015 6.518 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.821 4.794 6.490 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.874 3.952 7.650 1.00 0.00 H new ATOM 624 N LEU A 40 -11.515 4.363 4.821 1.00 0.00 N ATOM 625 CA LEU A 40 -12.635 4.263 3.909 1.00 0.00 C ATOM 626 C LEU A 40 -13.419 5.560 3.879 1.00 0.00 C ATOM 627 O LEU A 40 -13.856 5.977 2.811 1.00 0.00 O ATOM 628 CB LEU A 40 -13.503 3.057 4.284 1.00 0.00 C ATOM 629 CG LEU A 40 -14.682 2.830 3.326 1.00 0.00 C ATOM 630 CD1 LEU A 40 -14.219 2.691 1.873 1.00 0.00 C ATOM 631 CD2 LEU A 40 -15.435 1.561 3.725 1.00 0.00 C ATOM 0 H LEU A 40 -11.541 3.675 5.574 1.00 0.00 H new ATOM 0 HA LEU A 40 -12.268 4.100 2.896 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -12.881 2.162 4.300 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -13.888 3.196 5.294 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.333 3.701 3.398 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.084 2.532 1.229 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -13.702 3.600 1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -13.541 1.842 1.787 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -16.270 1.404 3.043 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -14.760 0.707 3.675 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -15.812 1.666 4.742 1.00 0.00 H new ATOM 643 N GLU A 41 -13.580 6.206 5.036 1.00 0.00 N ATOM 644 CA GLU A 41 -14.219 7.510 5.084 1.00 0.00 C ATOM 645 C GLU A 41 -13.509 8.449 4.093 1.00 0.00 C ATOM 646 O GLU A 41 -14.162 9.175 3.349 1.00 0.00 O ATOM 647 CB GLU A 41 -14.189 8.037 6.524 1.00 0.00 C ATOM 648 CG GLU A 41 -15.058 9.288 6.693 1.00 0.00 C ATOM 649 CD GLU A 41 -15.109 9.719 8.155 1.00 0.00 C ATOM 650 OE1 GLU A 41 -14.158 10.411 8.577 1.00 0.00 O ATOM 651 OE2 GLU A 41 -16.088 9.329 8.827 1.00 0.00 O ATOM 0 H GLU A 41 -13.278 5.846 5.941 1.00 0.00 H new ATOM 0 HA GLU A 41 -15.266 7.446 4.786 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -14.537 7.259 7.203 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.161 8.268 6.805 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -14.658 10.099 6.084 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -16.067 9.087 6.333 1.00 0.00 H new ATOM 658 N LYS A 42 -12.175 8.343 3.990 1.00 0.00 N ATOM 659 CA LYS A 42 -11.398 9.215 3.119 1.00 0.00 C ATOM 660 C LYS A 42 -11.523 8.826 1.636 1.00 0.00 C ATOM 661 O LYS A 42 -11.473 9.697 0.768 1.00 0.00 O ATOM 662 CB LYS A 42 -9.930 9.242 3.578 1.00 0.00 C ATOM 663 CG LYS A 42 -9.232 10.508 3.050 1.00 0.00 C ATOM 664 CD LYS A 42 -7.785 10.674 3.533 1.00 0.00 C ATOM 665 CE LYS A 42 -6.798 9.837 2.717 1.00 0.00 C ATOM 666 NZ LYS A 42 -5.407 10.126 3.114 1.00 0.00 N ATOM 0 H LYS A 42 -11.619 7.659 4.503 1.00 0.00 H new ATOM 0 HA LYS A 42 -11.808 10.222 3.201 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.881 9.218 4.667 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -9.412 8.354 3.216 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -9.240 10.486 1.960 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -9.808 11.382 3.355 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -7.503 11.725 3.472 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -7.720 10.387 4.582 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.008 8.777 2.861 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -6.928 10.047 1.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -4.757 9.767 2.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.281 11.153 3.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.201 9.661 4.021 1.00 0.00 H new ATOM 680 N PHE A 43 -11.671 7.531 1.320 1.00 0.00 N ATOM 681 CA PHE A 43 -11.798 7.089 -0.070 1.00 0.00 C ATOM 682 C PHE A 43 -13.082 7.618 -0.704 1.00 0.00 C ATOM 683 O PHE A 43 -14.110 6.962 -0.608 1.00 0.00 O ATOM 684 CB PHE A 43 -11.776 5.557 -0.213 1.00 0.00 C ATOM 685 CG PHE A 43 -10.404 4.936 -0.336 1.00 0.00 C ATOM 686 CD1 PHE A 43 -9.654 4.642 0.811 1.00 0.00 C ATOM 687 CD2 PHE A 43 -9.827 4.748 -1.606 1.00 0.00 C ATOM 688 CE1 PHE A 43 -8.380 4.070 0.689 1.00 0.00 C ATOM 689 CE2 PHE A 43 -8.576 4.125 -1.724 1.00 0.00 C ATOM 690 CZ PHE A 43 -7.901 3.693 -0.569 1.00 0.00 C ATOM 0 H PHE A 43 -11.705 6.778 2.007 1.00 0.00 H new ATOM 0 HA PHE A 43 -10.930 7.496 -0.588 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -12.277 5.121 0.652 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -12.360 5.283 -1.091 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -10.058 4.856 1.789 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.348 5.084 -2.490 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -7.769 3.921 1.567 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.133 3.978 -2.698 1.00 0.00 H new ATOM 0 HZ PHE A 43 -7.019 3.075 -0.653 1.00 0.00 H new ATOM 700 N ASP A 44 -13.020 8.731 -1.436 1.00 0.00 N ATOM 701 CA ASP A 44 -14.191 9.340 -2.060 1.00 0.00 C ATOM 702 C ASP A 44 -15.056 8.320 -2.811 1.00 0.00 C ATOM 703 O ASP A 44 -16.274 8.307 -2.641 1.00 0.00 O ATOM 704 CB ASP A 44 -13.766 10.454 -3.027 1.00 0.00 C ATOM 705 CG ASP A 44 -12.955 11.543 -2.334 1.00 0.00 C ATOM 706 OD1 ASP A 44 -11.733 11.329 -2.185 1.00 0.00 O ATOM 707 OD2 ASP A 44 -13.573 12.565 -1.965 1.00 0.00 O ATOM 0 H ASP A 44 -12.152 9.236 -1.612 1.00 0.00 H new ATOM 0 HA ASP A 44 -14.792 9.756 -1.252 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.176 10.024 -3.836 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -14.653 10.897 -3.480 1.00 0.00 H new ATOM 712 N ARG A 45 -14.448 7.470 -3.647 1.00 0.00 N ATOM 713 CA ARG A 45 -15.212 6.516 -4.447 1.00 0.00 C ATOM 714 C ARG A 45 -15.727 5.342 -3.611 1.00 0.00 C ATOM 715 O ARG A 45 -16.799 4.800 -3.905 1.00 0.00 O ATOM 716 CB ARG A 45 -14.393 5.985 -5.639 1.00 0.00 C ATOM 717 CG ARG A 45 -14.374 6.944 -6.842 1.00 0.00 C ATOM 718 CD ARG A 45 -13.396 8.103 -6.647 1.00 0.00 C ATOM 719 NE ARG A 45 -13.474 9.079 -7.739 1.00 0.00 N ATOM 720 CZ ARG A 45 -12.743 10.203 -7.775 1.00 0.00 C ATOM 721 NH1 ARG A 45 -11.835 10.453 -6.824 1.00 0.00 N ATOM 722 NH2 ARG A 45 -12.933 11.076 -8.769 1.00 0.00 N ATOM 0 H ARG A 45 -13.438 7.426 -3.784 1.00 0.00 H new ATOM 0 HA ARG A 45 -16.072 7.065 -4.830 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -13.369 5.801 -5.314 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.804 5.026 -5.955 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -14.102 6.390 -7.741 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -15.376 7.341 -7.003 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -13.608 8.601 -5.701 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -12.380 7.713 -6.582 1.00 0.00 H new ATOM 0 HE ARG A 45 -14.116 8.894 -8.510 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -11.695 9.786 -6.065 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.283 11.310 -6.859 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -13.628 10.884 -9.490 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -12.383 11.934 -8.806 1.00 0.00 H new ATOM 736 N PHE A 46 -14.929 4.847 -2.659 1.00 0.00 N ATOM 737 CA PHE A 46 -15.321 3.675 -1.899 1.00 0.00 C ATOM 738 C PHE A 46 -16.174 3.946 -0.666 1.00 0.00 C ATOM 739 O PHE A 46 -16.889 3.047 -0.237 1.00 0.00 O ATOM 740 CB PHE A 46 -14.120 2.754 -1.631 1.00 0.00 C ATOM 741 CG PHE A 46 -13.396 2.316 -2.887 1.00 0.00 C ATOM 742 CD1 PHE A 46 -14.108 1.824 -3.998 1.00 0.00 C ATOM 743 CD2 PHE A 46 -12.002 2.478 -2.975 1.00 0.00 C ATOM 744 CE1 PHE A 46 -13.439 1.565 -5.204 1.00 0.00 C ATOM 745 CE2 PHE A 46 -11.338 2.249 -4.190 1.00 0.00 C ATOM 746 CZ PHE A 46 -12.067 1.837 -5.317 1.00 0.00 C ATOM 0 H PHE A 46 -14.022 5.239 -2.405 1.00 0.00 H new ATOM 0 HA PHE A 46 -16.011 3.132 -2.545 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -13.416 3.270 -0.978 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -14.464 1.870 -1.094 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -15.170 1.646 -3.922 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.440 2.780 -2.104 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.980 1.156 -6.045 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -10.269 2.389 -4.258 1.00 0.00 H new ATOM 0 HZ PHE A 46 -11.572 1.729 -6.271 1.00 0.00 H new ATOM 756 N LYS A 47 -16.113 5.147 -0.093 1.00 0.00 N ATOM 757 CA LYS A 47 -16.863 5.551 1.092 1.00 0.00 C ATOM 758 C LYS A 47 -18.317 5.066 1.062 1.00 0.00 C ATOM 759 O LYS A 47 -18.857 4.642 2.081 1.00 0.00 O ATOM 760 CB LYS A 47 -16.762 7.079 1.235 1.00 0.00 C ATOM 761 CG LYS A 47 -17.356 7.645 2.532 1.00 0.00 C ATOM 762 CD LYS A 47 -18.840 8.027 2.401 1.00 0.00 C ATOM 763 CE LYS A 47 -19.319 8.804 3.632 1.00 0.00 C ATOM 764 NZ LYS A 47 -19.211 8.001 4.863 1.00 0.00 N ATOM 0 H LYS A 47 -15.518 5.892 -0.456 1.00 0.00 H new ATOM 0 HA LYS A 47 -16.425 5.075 1.969 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -15.712 7.367 1.177 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -17.267 7.543 0.388 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -17.246 6.907 3.327 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -16.786 8.524 2.832 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -18.986 8.632 1.506 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.441 7.126 2.279 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.729 9.714 3.739 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -20.355 9.110 3.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -19.622 8.529 5.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -19.725 7.105 4.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -18.210 7.801 5.061 1.00 0.00 H new ATOM 778 N HIS A 48 -18.967 5.151 -0.104 1.00 0.00 N ATOM 779 CA HIS A 48 -20.367 4.774 -0.256 1.00 0.00 C ATOM 780 C HIS A 48 -20.629 3.267 -0.100 1.00 0.00 C ATOM 781 O HIS A 48 -21.765 2.866 0.152 1.00 0.00 O ATOM 782 CB HIS A 48 -20.916 5.327 -1.579 1.00 0.00 C ATOM 783 CG HIS A 48 -20.661 4.470 -2.795 1.00 0.00 C ATOM 784 ND1 HIS A 48 -19.452 4.237 -3.432 1.00 0.00 N ATOM 785 CD2 HIS A 48 -21.637 3.811 -3.488 1.00 0.00 C ATOM 786 CE1 HIS A 48 -19.704 3.461 -4.502 1.00 0.00 C ATOM 787 NE2 HIS A 48 -21.021 3.187 -4.551 1.00 0.00 N ATOM 0 H HIS A 48 -18.533 5.483 -0.965 1.00 0.00 H new ATOM 0 HA HIS A 48 -20.912 5.230 0.571 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -21.992 5.469 -1.475 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -20.479 6.311 -1.751 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -18.539 4.589 -3.143 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -22.690 3.784 -3.248 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -18.966 3.113 -5.210 1.00 0.00 H new ATOM 796 N LEU A 49 -19.606 2.425 -0.269 1.00 0.00 N ATOM 797 CA LEU A 49 -19.717 0.981 -0.124 1.00 0.00 C ATOM 798 C LEU A 49 -19.561 0.679 1.365 1.00 0.00 C ATOM 799 O LEU A 49 -18.451 0.681 1.886 1.00 0.00 O ATOM 800 CB LEU A 49 -18.652 0.274 -0.984 1.00 0.00 C ATOM 801 CG LEU A 49 -18.651 0.738 -2.451 1.00 0.00 C ATOM 802 CD1 LEU A 49 -17.393 0.218 -3.136 1.00 0.00 C ATOM 803 CD2 LEU A 49 -19.875 0.240 -3.234 1.00 0.00 C ATOM 0 H LEU A 49 -18.666 2.737 -0.514 1.00 0.00 H new ATOM 0 HA LEU A 49 -20.680 0.610 -0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -17.668 0.454 -0.552 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -18.823 -0.802 -0.950 1.00 0.00 H new ATOM 0 HG LEU A 49 -18.683 1.828 -2.444 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -17.385 0.543 -4.177 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -16.513 0.610 -2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -17.380 -0.871 -3.096 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -19.820 0.598 -4.262 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -19.891 -0.850 -3.230 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -20.784 0.618 -2.766 1.00 0.00 H new ATOM 815 N LYS A 50 -20.680 0.486 2.067 1.00 0.00 N ATOM 816 CA LYS A 50 -20.675 0.314 3.512 1.00 0.00 C ATOM 817 C LYS A 50 -20.198 -1.065 3.978 1.00 0.00 C ATOM 818 O LYS A 50 -19.184 -1.157 4.667 1.00 0.00 O ATOM 819 CB LYS A 50 -22.048 0.690 4.086 1.00 0.00 C ATOM 820 CG LYS A 50 -22.406 2.141 3.726 1.00 0.00 C ATOM 821 CD LYS A 50 -23.737 2.597 4.337 1.00 0.00 C ATOM 822 CE LYS A 50 -23.652 2.786 5.856 1.00 0.00 C ATOM 823 NZ LYS A 50 -24.882 3.400 6.384 1.00 0.00 N ATOM 0 H LYS A 50 -21.609 0.445 1.647 1.00 0.00 H new ATOM 0 HA LYS A 50 -19.928 0.998 3.913 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -22.809 0.014 3.695 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -22.041 0.570 5.169 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -21.610 2.802 4.068 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -22.457 2.239 2.642 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -24.043 3.535 3.874 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -24.509 1.862 4.108 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -23.488 1.822 6.337 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -22.795 3.414 6.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -24.797 3.516 7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -25.024 4.330 5.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -25.695 2.788 6.170 1.00 0.00 H new ATOM 837 N THR A 51 -20.917 -2.139 3.635 1.00 0.00 N ATOM 838 CA THR A 51 -20.550 -3.471 4.107 1.00 0.00 C ATOM 839 C THR A 51 -19.462 -4.113 3.244 1.00 0.00 C ATOM 840 O THR A 51 -19.324 -3.817 2.054 1.00 0.00 O ATOM 841 CB THR A 51 -21.778 -4.372 4.324 1.00 0.00 C ATOM 842 OG1 THR A 51 -21.357 -5.572 4.939 1.00 0.00 O ATOM 843 CG2 THR A 51 -22.539 -4.719 3.044 1.00 0.00 C ATOM 0 H THR A 51 -21.745 -2.110 3.040 1.00 0.00 H new ATOM 0 HA THR A 51 -20.103 -3.348 5.093 1.00 0.00 H new ATOM 0 HB THR A 51 -22.468 -3.806 4.950 1.00 0.00 H new ATOM 0 HG1 THR A 51 -22.132 -6.154 5.084 1.00 0.00 H new ATOM 0 HG21 THR A 51 -23.389 -5.357 3.287 1.00 0.00 H new ATOM 0 HG22 THR A 51 -22.896 -3.803 2.573 1.00 0.00 H new ATOM 0 HG23 THR A 51 -21.876 -5.245 2.358 1.00 0.00 H new ATOM 851 N GLU A 52 -18.705 -5.024 3.865 1.00 0.00 N ATOM 852 CA GLU A 52 -17.606 -5.766 3.264 1.00 0.00 C ATOM 853 C GLU A 52 -17.991 -6.322 1.888 1.00 0.00 C ATOM 854 O GLU A 52 -17.218 -6.245 0.937 1.00 0.00 O ATOM 855 CB GLU A 52 -17.131 -6.862 4.227 1.00 0.00 C ATOM 856 CG GLU A 52 -15.774 -7.432 3.790 1.00 0.00 C ATOM 857 CD GLU A 52 -15.216 -8.389 4.836 1.00 0.00 C ATOM 858 OE1 GLU A 52 -14.710 -7.877 5.859 1.00 0.00 O ATOM 859 OE2 GLU A 52 -15.321 -9.612 4.605 1.00 0.00 O ATOM 0 H GLU A 52 -18.853 -5.271 4.844 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.771 -5.086 3.093 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -17.050 -6.455 5.235 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.870 -7.662 4.265 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -15.885 -7.953 2.839 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -15.070 -6.616 3.627 1.00 0.00 H new ATOM 866 N ALA A 53 -19.203 -6.867 1.779 1.00 0.00 N ATOM 867 CA ALA A 53 -19.708 -7.431 0.537 1.00 0.00 C ATOM 868 C ALA A 53 -19.717 -6.422 -0.617 1.00 0.00 C ATOM 869 O ALA A 53 -19.435 -6.796 -1.755 1.00 0.00 O ATOM 870 CB ALA A 53 -21.114 -7.979 0.768 1.00 0.00 C ATOM 0 H ALA A 53 -19.861 -6.928 2.556 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.031 -8.233 0.242 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -21.496 -8.403 -0.161 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -21.081 -8.754 1.534 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -21.770 -7.172 1.096 1.00 0.00 H new ATOM 876 N GLU A 54 -20.028 -5.148 -0.342 1.00 0.00 N ATOM 877 CA GLU A 54 -20.089 -4.123 -1.369 1.00 0.00 C ATOM 878 C GLU A 54 -18.676 -3.876 -1.870 1.00 0.00 C ATOM 879 O GLU A 54 -18.392 -4.019 -3.056 1.00 0.00 O ATOM 880 CB GLU A 54 -20.703 -2.830 -0.812 1.00 0.00 C ATOM 881 CG GLU A 54 -22.152 -3.009 -0.356 1.00 0.00 C ATOM 882 CD GLU A 54 -22.678 -1.708 0.243 1.00 0.00 C ATOM 883 OE1 GLU A 54 -23.061 -0.827 -0.556 1.00 0.00 O ATOM 884 OE2 GLU A 54 -22.653 -1.603 1.488 1.00 0.00 O ATOM 0 H GLU A 54 -20.242 -4.810 0.596 1.00 0.00 H new ATOM 0 HA GLU A 54 -20.724 -4.454 -2.190 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -20.103 -2.481 0.029 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -20.661 -2.055 -1.577 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -22.773 -3.307 -1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -22.213 -3.809 0.382 1.00 0.00 H new ATOM 891 N MET A 55 -17.767 -3.587 -0.937 1.00 0.00 N ATOM 892 CA MET A 55 -16.396 -3.285 -1.314 1.00 0.00 C ATOM 893 C MET A 55 -15.792 -4.482 -2.068 1.00 0.00 C ATOM 894 O MET A 55 -15.268 -4.327 -3.169 1.00 0.00 O ATOM 895 CB MET A 55 -15.580 -2.741 -0.130 1.00 0.00 C ATOM 896 CG MET A 55 -15.591 -3.648 1.102 1.00 0.00 C ATOM 897 SD MET A 55 -14.964 -2.936 2.646 1.00 0.00 S ATOM 898 CE MET A 55 -16.344 -1.839 3.054 1.00 0.00 C ATOM 0 H MET A 55 -17.955 -3.557 0.065 1.00 0.00 H new ATOM 0 HA MET A 55 -16.370 -2.456 -2.021 1.00 0.00 H new ATOM 0 HB2 MET A 55 -14.549 -2.593 -0.450 1.00 0.00 H new ATOM 0 HB3 MET A 55 -15.971 -1.762 0.148 1.00 0.00 H new ATOM 0 HG2 MET A 55 -16.616 -3.978 1.272 1.00 0.00 H new ATOM 0 HG3 MET A 55 -15.003 -4.537 0.875 1.00 0.00 H new ATOM 0 HE1 MET A 55 -16.342 -1.635 4.125 1.00 0.00 H new ATOM 0 HE2 MET A 55 -16.239 -0.903 2.506 1.00 0.00 H new ATOM 0 HE3 MET A 55 -17.283 -2.318 2.778 1.00 0.00 H new ATOM 908 N LYS A 56 -16.015 -5.696 -1.552 1.00 0.00 N ATOM 909 CA LYS A 56 -15.586 -6.941 -2.179 1.00 0.00 C ATOM 910 C LYS A 56 -16.133 -7.067 -3.608 1.00 0.00 C ATOM 911 O LYS A 56 -15.417 -7.495 -4.518 1.00 0.00 O ATOM 912 CB LYS A 56 -16.012 -8.118 -1.282 1.00 0.00 C ATOM 913 CG LYS A 56 -15.471 -9.489 -1.717 1.00 0.00 C ATOM 914 CD LYS A 56 -16.285 -10.253 -2.776 1.00 0.00 C ATOM 915 CE LYS A 56 -17.716 -10.597 -2.334 1.00 0.00 C ATOM 916 NZ LYS A 56 -18.697 -9.578 -2.752 1.00 0.00 N ATOM 0 H LYS A 56 -16.508 -5.838 -0.671 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.500 -6.949 -2.275 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.680 -7.919 -0.263 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -17.101 -8.163 -1.259 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -14.461 -9.349 -2.101 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -15.391 -10.119 -0.831 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.330 -9.655 -3.686 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.761 -11.175 -3.027 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -18.000 -11.563 -2.752 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.743 -10.699 -1.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -19.603 -10.038 -2.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -18.835 -8.892 -1.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -18.346 -9.084 -3.597 1.00 0.00 H new ATOM 930 N ALA A 57 -17.420 -6.763 -3.801 1.00 0.00 N ATOM 931 CA ALA A 57 -18.048 -6.855 -5.108 1.00 0.00 C ATOM 932 C ALA A 57 -17.632 -5.736 -6.060 1.00 0.00 C ATOM 933 O ALA A 57 -17.788 -5.890 -7.273 1.00 0.00 O ATOM 934 CB ALA A 57 -19.572 -6.891 -4.958 1.00 0.00 C ATOM 0 H ALA A 57 -18.045 -6.450 -3.058 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.699 -7.784 -5.558 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -20.033 -6.960 -5.943 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -19.859 -7.757 -4.362 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.910 -5.981 -4.462 1.00 0.00 H new ATOM 940 N SER A 58 -17.241 -4.568 -5.545 1.00 0.00 N ATOM 941 CA SER A 58 -16.890 -3.472 -6.425 1.00 0.00 C ATOM 942 C SER A 58 -15.625 -3.744 -7.255 1.00 0.00 C ATOM 943 O SER A 58 -14.493 -3.707 -6.776 1.00 0.00 O ATOM 944 CB SER A 58 -16.893 -2.139 -5.679 1.00 0.00 C ATOM 945 OG SER A 58 -15.907 -2.104 -4.677 1.00 0.00 O ATOM 0 H SER A 58 -17.163 -4.367 -4.548 1.00 0.00 H new ATOM 0 HA SER A 58 -17.674 -3.390 -7.178 1.00 0.00 H new ATOM 0 HB2 SER A 58 -16.724 -1.326 -6.385 1.00 0.00 H new ATOM 0 HB3 SER A 58 -17.873 -1.974 -5.232 1.00 0.00 H new ATOM 0 HG SER A 58 -15.810 -2.996 -4.282 1.00 0.00 H new ATOM 951 N GLU A 59 -15.854 -4.019 -8.535 1.00 0.00 N ATOM 952 CA GLU A 59 -14.867 -4.230 -9.573 1.00 0.00 C ATOM 953 C GLU A 59 -13.755 -3.200 -9.496 1.00 0.00 C ATOM 954 O GLU A 59 -12.574 -3.516 -9.546 1.00 0.00 O ATOM 955 CB GLU A 59 -15.574 -4.179 -10.934 1.00 0.00 C ATOM 956 CG GLU A 59 -16.237 -2.867 -11.408 1.00 0.00 C ATOM 957 CD GLU A 59 -17.316 -2.342 -10.466 1.00 0.00 C ATOM 958 OE1 GLU A 59 -18.460 -2.832 -10.568 1.00 0.00 O ATOM 959 OE2 GLU A 59 -16.957 -1.491 -9.622 1.00 0.00 O ATOM 0 H GLU A 59 -16.805 -4.105 -8.894 1.00 0.00 H new ATOM 0 HA GLU A 59 -14.401 -5.206 -9.437 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -14.843 -4.465 -11.690 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -16.345 -4.949 -10.928 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -15.467 -2.104 -11.523 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -16.676 -3.029 -12.393 1.00 0.00 H new ATOM 966 N ASP A 60 -14.187 -1.956 -9.371 1.00 0.00 N ATOM 967 CA ASP A 60 -13.363 -0.769 -9.261 1.00 0.00 C ATOM 968 C ASP A 60 -12.453 -0.863 -8.042 1.00 0.00 C ATOM 969 O ASP A 60 -11.298 -0.457 -8.112 1.00 0.00 O ATOM 970 CB ASP A 60 -14.244 0.483 -9.194 1.00 0.00 C ATOM 971 CG ASP A 60 -13.408 1.759 -9.124 1.00 0.00 C ATOM 972 OD1 ASP A 60 -12.494 1.889 -9.967 1.00 0.00 O ATOM 973 OD2 ASP A 60 -13.708 2.583 -8.236 1.00 0.00 O ATOM 0 H ASP A 60 -15.183 -1.737 -9.342 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.732 -0.695 -10.147 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -14.891 0.520 -10.070 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.893 0.425 -8.320 1.00 0.00 H new ATOM 978 N LEU A 61 -12.937 -1.432 -6.933 1.00 0.00 N ATOM 979 CA LEU A 61 -12.089 -1.619 -5.759 1.00 0.00 C ATOM 980 C LEU A 61 -11.031 -2.659 -6.111 1.00 0.00 C ATOM 981 O LEU A 61 -9.840 -2.423 -5.921 1.00 0.00 O ATOM 982 CB LEU A 61 -12.935 -1.949 -4.523 1.00 0.00 C ATOM 983 CG LEU A 61 -12.205 -2.151 -3.188 1.00 0.00 C ATOM 984 CD1 LEU A 61 -11.736 -3.590 -3.010 1.00 0.00 C ATOM 985 CD2 LEU A 61 -11.034 -1.208 -2.936 1.00 0.00 C ATOM 0 H LEU A 61 -13.895 -1.765 -6.827 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.566 -0.702 -5.486 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.660 -1.146 -4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -13.500 -2.857 -4.736 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.964 -1.906 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.224 -3.690 -2.053 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.597 -4.259 -3.033 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -11.051 -3.852 -3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -10.587 -1.433 -1.968 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.287 -1.338 -3.719 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -11.389 -0.177 -2.941 1.00 0.00 H new ATOM 997 N LYS A 62 -11.429 -3.737 -6.793 1.00 0.00 N ATOM 998 CA LYS A 62 -10.454 -4.754 -7.187 1.00 0.00 C ATOM 999 C LYS A 62 -9.391 -4.137 -8.119 1.00 0.00 C ATOM 1000 O LYS A 62 -8.185 -4.314 -7.931 1.00 0.00 O ATOM 1001 CB LYS A 62 -11.163 -5.977 -7.792 1.00 0.00 C ATOM 1002 CG LYS A 62 -10.248 -7.209 -7.777 1.00 0.00 C ATOM 1003 CD LYS A 62 -10.863 -8.407 -8.519 1.00 0.00 C ATOM 1004 CE LYS A 62 -12.199 -8.889 -7.936 1.00 0.00 C ATOM 1005 NZ LYS A 62 -12.080 -9.293 -6.524 1.00 0.00 N ATOM 0 H LYS A 62 -12.391 -3.924 -7.076 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.924 -5.117 -6.306 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -12.073 -6.189 -7.230 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.465 -5.757 -8.816 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -9.292 -6.954 -8.235 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -10.041 -7.492 -6.745 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.012 -8.135 -9.564 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.153 -9.234 -8.503 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.939 -8.093 -8.023 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.566 -9.731 -8.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -12.332 -10.297 -6.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -11.101 -9.150 -6.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.722 -8.717 -5.943 1.00 0.00 H new ATOM 1019 N LYS A 63 -9.852 -3.366 -9.106 1.00 0.00 N ATOM 1020 CA LYS A 63 -9.037 -2.629 -10.064 1.00 0.00 C ATOM 1021 C LYS A 63 -8.130 -1.662 -9.297 1.00 0.00 C ATOM 1022 O LYS A 63 -6.988 -1.407 -9.695 1.00 0.00 O ATOM 1023 CB LYS A 63 -9.981 -1.901 -11.040 1.00 0.00 C ATOM 1024 CG LYS A 63 -9.402 -1.519 -12.414 1.00 0.00 C ATOM 1025 CD LYS A 63 -8.325 -0.424 -12.429 1.00 0.00 C ATOM 1026 CE LYS A 63 -8.755 0.869 -11.721 1.00 0.00 C ATOM 1027 NZ LYS A 63 -7.724 1.914 -11.848 1.00 0.00 N ATOM 0 H LYS A 63 -10.851 -3.235 -9.263 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.395 -3.292 -10.645 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -10.853 -2.534 -11.203 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.334 -0.991 -10.555 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.981 -2.416 -12.867 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.225 -1.196 -13.052 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -7.423 -0.807 -11.952 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -8.067 -0.194 -13.463 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.693 1.226 -12.147 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.942 0.665 -10.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -8.049 2.781 -11.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -6.842 1.587 -11.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -7.553 2.112 -12.854 1.00 0.00 H new ATOM 1041 N HIS A 64 -8.650 -1.038 -8.235 1.00 0.00 N ATOM 1042 CA HIS A 64 -7.800 -0.187 -7.445 1.00 0.00 C ATOM 1043 C HIS A 64 -6.703 -1.002 -6.824 1.00 0.00 C ATOM 1044 O HIS A 64 -5.551 -0.630 -6.957 1.00 0.00 O ATOM 1045 CB HIS A 64 -8.507 0.593 -6.338 1.00 0.00 C ATOM 1046 CG HIS A 64 -7.917 1.962 -6.210 1.00 0.00 C ATOM 1047 ND1 HIS A 64 -7.464 2.736 -7.252 1.00 0.00 N ATOM 1048 CD2 HIS A 64 -7.599 2.597 -5.045 1.00 0.00 C ATOM 1049 CE1 HIS A 64 -6.860 3.807 -6.725 1.00 0.00 C ATOM 1050 NE2 HIS A 64 -6.940 3.781 -5.384 1.00 0.00 N ATOM 0 H HIS A 64 -9.618 -1.110 -7.923 1.00 0.00 H new ATOM 0 HA HIS A 64 -7.416 0.555 -8.146 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -9.572 0.668 -6.559 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -8.415 0.060 -5.392 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -7.816 2.249 -4.046 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -6.376 4.584 -7.298 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -6.588 4.488 -4.739 1.00 0.00 H new ATOM 1058 N GLY A 65 -7.053 -2.113 -6.183 1.00 0.00 N ATOM 1059 CA GLY A 65 -6.087 -2.998 -5.572 1.00 0.00 C ATOM 1060 C GLY A 65 -4.959 -3.296 -6.570 1.00 0.00 C ATOM 1061 O GLY A 65 -3.783 -3.174 -6.235 1.00 0.00 O ATOM 0 H GLY A 65 -8.020 -2.419 -6.076 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.678 -2.540 -4.671 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.571 -3.926 -5.267 1.00 0.00 H new ATOM 1065 N VAL A 66 -5.320 -3.558 -7.834 1.00 0.00 N ATOM 1066 CA VAL A 66 -4.363 -3.809 -8.910 1.00 0.00 C ATOM 1067 C VAL A 66 -3.495 -2.559 -9.075 1.00 0.00 C ATOM 1068 O VAL A 66 -2.280 -2.637 -8.948 1.00 0.00 O ATOM 1069 CB VAL A 66 -5.062 -4.180 -10.237 1.00 0.00 C ATOM 1070 CG1 VAL A 66 -4.054 -4.279 -11.393 1.00 0.00 C ATOM 1071 CG2 VAL A 66 -5.787 -5.521 -10.139 1.00 0.00 C ATOM 0 H VAL A 66 -6.293 -3.601 -8.136 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.744 -4.666 -8.646 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.781 -3.384 -10.431 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.579 -4.542 -12.312 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.553 -3.319 -11.522 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.314 -5.046 -11.166 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.266 -5.746 -11.092 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.070 -6.306 -9.899 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.544 -5.469 -9.356 1.00 0.00 H new ATOM 1081 N THR A 67 -4.116 -1.399 -9.306 1.00 0.00 N ATOM 1082 CA THR A 67 -3.439 -0.111 -9.475 1.00 0.00 C ATOM 1083 C THR A 67 -2.414 0.139 -8.356 1.00 0.00 C ATOM 1084 O THR A 67 -1.235 0.403 -8.593 1.00 0.00 O ATOM 1085 CB THR A 67 -4.516 0.994 -9.536 1.00 0.00 C ATOM 1086 OG1 THR A 67 -5.432 0.722 -10.578 1.00 0.00 O ATOM 1087 CG2 THR A 67 -3.984 2.417 -9.715 1.00 0.00 C ATOM 0 H THR A 67 -5.131 -1.328 -9.383 1.00 0.00 H new ATOM 0 HA THR A 67 -2.869 -0.110 -10.404 1.00 0.00 H new ATOM 0 HB THR A 67 -4.994 0.967 -8.557 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.089 0.062 -10.272 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.819 3.117 -9.746 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.330 2.669 -8.880 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.423 2.481 -10.647 1.00 0.00 H new ATOM 1095 N VAL A 68 -2.888 0.006 -7.126 1.00 0.00 N ATOM 1096 CA VAL A 68 -2.186 0.245 -5.877 1.00 0.00 C ATOM 1097 C VAL A 68 -1.000 -0.709 -5.750 1.00 0.00 C ATOM 1098 O VAL A 68 0.146 -0.275 -5.615 1.00 0.00 O ATOM 1099 CB VAL A 68 -3.274 0.181 -4.784 1.00 0.00 C ATOM 1100 CG1 VAL A 68 -2.873 -0.002 -3.326 1.00 0.00 C ATOM 1101 CG2 VAL A 68 -4.062 1.490 -4.850 1.00 0.00 C ATOM 0 H VAL A 68 -3.849 -0.296 -6.965 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.703 1.219 -5.797 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.809 -0.737 -5.027 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.767 -0.024 -2.703 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.329 -0.940 -3.213 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.236 0.827 -3.017 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.843 1.483 -4.090 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.389 2.329 -4.671 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.516 1.592 -5.836 1.00 0.00 H new ATOM 1111 N LEU A 69 -1.248 -2.014 -5.846 1.00 0.00 N ATOM 1112 CA LEU A 69 -0.172 -2.986 -5.767 1.00 0.00 C ATOM 1113 C LEU A 69 0.775 -2.890 -6.954 1.00 0.00 C ATOM 1114 O LEU A 69 1.956 -3.161 -6.790 1.00 0.00 O ATOM 1115 CB LEU A 69 -0.715 -4.403 -5.597 1.00 0.00 C ATOM 1116 CG LEU A 69 -1.396 -4.657 -4.245 1.00 0.00 C ATOM 1117 CD1 LEU A 69 -1.199 -6.134 -3.880 1.00 0.00 C ATOM 1118 CD2 LEU A 69 -0.917 -3.793 -3.070 1.00 0.00 C ATOM 0 H LEU A 69 -2.177 -2.415 -5.977 1.00 0.00 H new ATOM 0 HA LEU A 69 0.411 -2.746 -4.878 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.430 -4.604 -6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.105 -5.111 -5.717 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.440 -4.380 -4.390 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.675 -6.339 -2.921 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.648 -6.762 -4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.133 -6.352 -3.810 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.470 -4.063 -2.170 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.147 -3.960 -2.906 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -1.088 -2.741 -3.299 1.00 0.00 H new ATOM 1130 N THR A 70 0.308 -2.496 -8.138 1.00 0.00 N ATOM 1131 CA THR A 70 1.186 -2.335 -9.291 1.00 0.00 C ATOM 1132 C THR A 70 2.110 -1.142 -9.030 1.00 0.00 C ATOM 1133 O THR A 70 3.282 -1.172 -9.404 1.00 0.00 O ATOM 1134 CB THR A 70 0.373 -2.185 -10.585 1.00 0.00 C ATOM 1135 OG1 THR A 70 -0.422 -3.339 -10.761 1.00 0.00 O ATOM 1136 CG2 THR A 70 1.281 -2.082 -11.814 1.00 0.00 C ATOM 0 H THR A 70 -0.673 -2.283 -8.322 1.00 0.00 H new ATOM 0 HA THR A 70 1.800 -3.225 -9.429 1.00 0.00 H new ATOM 0 HB THR A 70 -0.225 -1.278 -10.495 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.198 -3.295 -10.165 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.670 -1.977 -12.710 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.931 -1.213 -11.714 1.00 0.00 H new ATOM 0 HG23 THR A 70 1.889 -2.983 -11.893 1.00 0.00 H new ATOM 1144 N ALA A 71 1.593 -0.073 -8.417 1.00 0.00 N ATOM 1145 CA ALA A 71 2.423 1.067 -8.079 1.00 0.00 C ATOM 1146 C ALA A 71 3.466 0.682 -7.031 1.00 0.00 C ATOM 1147 O ALA A 71 4.665 0.806 -7.286 1.00 0.00 O ATOM 1148 CB ALA A 71 1.559 2.253 -7.650 1.00 0.00 C ATOM 0 H ALA A 71 0.613 0.019 -8.150 1.00 0.00 H new ATOM 0 HA ALA A 71 2.973 1.384 -8.965 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.200 3.099 -7.400 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.892 2.531 -8.466 1.00 0.00 H new ATOM 0 HB3 ALA A 71 0.968 1.976 -6.777 1.00 0.00 H new ATOM 1154 N LEU A 72 3.025 0.214 -5.860 1.00 0.00 N ATOM 1155 CA LEU A 72 3.960 -0.212 -4.824 1.00 0.00 C ATOM 1156 C LEU A 72 4.922 -1.268 -5.390 1.00 0.00 C ATOM 1157 O LEU A 72 6.137 -1.185 -5.230 1.00 0.00 O ATOM 1158 CB LEU A 72 3.189 -0.732 -3.604 1.00 0.00 C ATOM 1159 CG LEU A 72 4.104 -1.209 -2.462 1.00 0.00 C ATOM 1160 CD1 LEU A 72 4.991 -0.086 -1.913 1.00 0.00 C ATOM 1161 CD2 LEU A 72 3.245 -1.777 -1.328 1.00 0.00 C ATOM 0 H LEU A 72 2.040 0.122 -5.611 1.00 0.00 H new ATOM 0 HA LEU A 72 4.559 0.638 -4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.537 0.058 -3.232 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.546 -1.556 -3.914 1.00 0.00 H new ATOM 0 HG LEU A 72 4.763 -1.976 -2.869 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.616 -0.476 -1.110 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.625 0.300 -2.711 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.364 0.717 -1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.890 -2.116 -0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.573 -1.003 -0.958 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.659 -2.617 -1.701 1.00 0.00 H new ATOM 1173 N GLY A 73 4.372 -2.238 -6.118 1.00 0.00 N ATOM 1174 CA GLY A 73 5.091 -3.319 -6.768 1.00 0.00 C ATOM 1175 C GLY A 73 6.165 -2.757 -7.690 1.00 0.00 C ATOM 1176 O GLY A 73 7.293 -3.225 -7.663 1.00 0.00 O ATOM 0 H GLY A 73 3.365 -2.289 -6.275 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.547 -3.965 -6.018 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.397 -3.935 -7.340 1.00 0.00 H new ATOM 1180 N ALA A 74 5.847 -1.745 -8.498 1.00 0.00 N ATOM 1181 CA ALA A 74 6.818 -1.103 -9.374 1.00 0.00 C ATOM 1182 C ALA A 74 7.943 -0.486 -8.539 1.00 0.00 C ATOM 1183 O ALA A 74 9.119 -0.606 -8.885 1.00 0.00 O ATOM 1184 CB ALA A 74 6.134 -0.052 -10.253 1.00 0.00 C ATOM 0 H ALA A 74 4.909 -1.350 -8.561 1.00 0.00 H new ATOM 0 HA ALA A 74 7.255 -1.852 -10.035 1.00 0.00 H new ATOM 0 HB1 ALA A 74 6.874 0.418 -10.901 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.369 -0.531 -10.864 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.672 0.706 -9.621 1.00 0.00 H new ATOM 1190 N ILE A 75 7.590 0.119 -7.398 1.00 0.00 N ATOM 1191 CA ILE A 75 8.587 0.697 -6.500 1.00 0.00 C ATOM 1192 C ILE A 75 9.525 -0.430 -6.048 1.00 0.00 C ATOM 1193 O ILE A 75 10.743 -0.332 -6.209 1.00 0.00 O ATOM 1194 CB ILE A 75 7.919 1.502 -5.353 1.00 0.00 C ATOM 1195 CG1 ILE A 75 7.940 3.010 -5.662 1.00 0.00 C ATOM 1196 CG2 ILE A 75 8.567 1.276 -3.980 1.00 0.00 C ATOM 1197 CD1 ILE A 75 7.095 3.372 -6.887 1.00 0.00 C ATOM 0 H ILE A 75 6.626 0.219 -7.080 1.00 0.00 H new ATOM 0 HA ILE A 75 9.198 1.442 -7.010 1.00 0.00 H new ATOM 0 HB ILE A 75 6.895 1.131 -5.300 1.00 0.00 H new ATOM 0 HG12 ILE A 75 7.572 3.560 -4.796 1.00 0.00 H new ATOM 0 HG13 ILE A 75 8.969 3.329 -5.828 1.00 0.00 H new ATOM 0 HG21 ILE A 75 8.047 1.871 -3.230 1.00 0.00 H new ATOM 0 HG22 ILE A 75 8.501 0.221 -3.716 1.00 0.00 H new ATOM 0 HG23 ILE A 75 9.614 1.576 -4.018 1.00 0.00 H new ATOM 0 HD11 ILE A 75 7.146 4.447 -7.059 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.478 2.846 -7.762 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.059 3.081 -6.713 1.00 0.00 H new ATOM 1209 N LEU A 76 8.942 -1.506 -5.510 1.00 0.00 N ATOM 1210 CA LEU A 76 9.659 -2.687 -5.051 1.00 0.00 C ATOM 1211 C LEU A 76 10.556 -3.247 -6.163 1.00 0.00 C ATOM 1212 O LEU A 76 11.734 -3.523 -5.944 1.00 0.00 O ATOM 1213 CB LEU A 76 8.657 -3.763 -4.584 1.00 0.00 C ATOM 1214 CG LEU A 76 7.784 -3.409 -3.364 1.00 0.00 C ATOM 1215 CD1 LEU A 76 6.889 -4.606 -3.010 1.00 0.00 C ATOM 1216 CD2 LEU A 76 8.599 -3.008 -2.132 1.00 0.00 C ATOM 0 H LEU A 76 7.933 -1.576 -5.381 1.00 0.00 H new ATOM 0 HA LEU A 76 10.293 -2.401 -4.212 1.00 0.00 H new ATOM 0 HB2 LEU A 76 7.997 -3.999 -5.419 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.215 -4.670 -4.352 1.00 0.00 H new ATOM 0 HG LEU A 76 7.186 -2.543 -3.647 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.272 -4.356 -2.147 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.248 -4.844 -3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.512 -5.468 -2.773 1.00 0.00 H new ATOM 0 HD21 LEU A 76 7.923 -2.772 -1.310 1.00 0.00 H new ATOM 0 HD22 LEU A 76 9.249 -3.833 -1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.206 -2.133 -2.366 1.00 0.00 H new ATOM 1228 N LYS A 77 9.991 -3.412 -7.360 1.00 0.00 N ATOM 1229 CA LYS A 77 10.642 -3.968 -8.539 1.00 0.00 C ATOM 1230 C LYS A 77 11.904 -3.183 -8.875 1.00 0.00 C ATOM 1231 O LYS A 77 12.942 -3.778 -9.158 1.00 0.00 O ATOM 1232 CB LYS A 77 9.638 -4.029 -9.702 1.00 0.00 C ATOM 1233 CG LYS A 77 10.202 -4.720 -10.951 1.00 0.00 C ATOM 1234 CD LYS A 77 9.243 -4.657 -12.152 1.00 0.00 C ATOM 1235 CE LYS A 77 7.887 -5.338 -11.910 1.00 0.00 C ATOM 1236 NZ LYS A 77 6.901 -4.435 -11.285 1.00 0.00 N ATOM 0 H LYS A 77 9.022 -3.148 -7.538 1.00 0.00 H new ATOM 0 HA LYS A 77 10.966 -4.989 -8.339 1.00 0.00 H new ATOM 0 HB2 LYS A 77 8.744 -4.559 -9.374 1.00 0.00 H new ATOM 0 HB3 LYS A 77 9.331 -3.016 -9.962 1.00 0.00 H new ATOM 0 HG2 LYS A 77 11.148 -4.253 -11.223 1.00 0.00 H new ATOM 0 HG3 LYS A 77 10.417 -5.763 -10.718 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.071 -3.612 -12.411 1.00 0.00 H new ATOM 0 HD3 LYS A 77 9.724 -5.124 -13.012 1.00 0.00 H new ATOM 0 HE2 LYS A 77 7.492 -5.700 -12.859 1.00 0.00 H new ATOM 0 HE3 LYS A 77 8.031 -6.210 -11.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.974 -4.568 -11.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.826 -4.651 -10.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 7.207 -3.449 -11.407 1.00 0.00 H new ATOM 1250 N LYS A 78 11.835 -1.851 -8.838 1.00 0.00 N ATOM 1251 CA LYS A 78 13.010 -1.034 -9.108 1.00 0.00 C ATOM 1252 C LYS A 78 14.032 -1.057 -7.958 1.00 0.00 C ATOM 1253 O LYS A 78 15.056 -0.384 -8.052 1.00 0.00 O ATOM 1254 CB LYS A 78 12.592 0.382 -9.509 1.00 0.00 C ATOM 1255 CG LYS A 78 11.838 0.361 -10.845 1.00 0.00 C ATOM 1256 CD LYS A 78 11.804 1.765 -11.461 1.00 0.00 C ATOM 1257 CE LYS A 78 11.093 1.775 -12.818 1.00 0.00 C ATOM 1258 NZ LYS A 78 9.658 1.468 -12.680 1.00 0.00 N ATOM 0 H LYS A 78 10.988 -1.324 -8.626 1.00 0.00 H new ATOM 0 HA LYS A 78 13.535 -1.476 -9.955 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.959 0.814 -8.734 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.473 1.018 -9.592 1.00 0.00 H new ATOM 0 HG2 LYS A 78 12.322 -0.333 -11.532 1.00 0.00 H new ATOM 0 HG3 LYS A 78 10.821 -0.000 -10.691 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.297 2.448 -10.780 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.823 2.133 -11.582 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.213 2.752 -13.285 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.560 1.045 -13.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 9.201 1.517 -13.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.544 0.512 -12.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 9.215 2.159 -12.041 1.00 0.00 H new ATOM 1272 N LYS A 79 13.803 -1.857 -6.909 1.00 0.00 N ATOM 1273 CA LYS A 79 14.694 -2.099 -5.785 1.00 0.00 C ATOM 1274 C LYS A 79 15.494 -0.878 -5.317 1.00 0.00 C ATOM 1275 O LYS A 79 16.717 -0.923 -5.206 1.00 0.00 O ATOM 1276 CB LYS A 79 15.548 -3.351 -6.052 1.00 0.00 C ATOM 1277 CG LYS A 79 16.260 -3.362 -7.408 1.00 0.00 C ATOM 1278 CD LYS A 79 17.260 -4.527 -7.446 1.00 0.00 C ATOM 1279 CE LYS A 79 17.966 -4.631 -8.803 1.00 0.00 C ATOM 1280 NZ LYS A 79 17.031 -5.000 -9.881 1.00 0.00 N ATOM 0 H LYS A 79 12.933 -2.382 -6.825 1.00 0.00 H new ATOM 0 HA LYS A 79 14.066 -2.301 -4.918 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.295 -3.439 -5.264 1.00 0.00 H new ATOM 0 HB3 LYS A 79 14.909 -4.231 -5.985 1.00 0.00 H new ATOM 0 HG2 LYS A 79 15.532 -3.466 -8.213 1.00 0.00 H new ATOM 0 HG3 LYS A 79 16.779 -2.417 -7.567 1.00 0.00 H new ATOM 0 HD2 LYS A 79 18.003 -4.393 -6.660 1.00 0.00 H new ATOM 0 HD3 LYS A 79 16.738 -5.460 -7.236 1.00 0.00 H new ATOM 0 HE2 LYS A 79 18.437 -3.677 -9.041 1.00 0.00 H new ATOM 0 HE3 LYS A 79 18.762 -5.373 -8.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.566 -5.209 -10.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 16.489 -5.841 -9.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 16.378 -4.211 -10.059 1.00 0.00 H new ATOM 1294 N GLY A 80 14.783 0.203 -4.985 1.00 0.00 N ATOM 1295 CA GLY A 80 15.386 1.417 -4.445 1.00 0.00 C ATOM 1296 C GLY A 80 15.902 2.370 -5.517 1.00 0.00 C ATOM 1297 O GLY A 80 16.466 3.414 -5.182 1.00 0.00 O ATOM 0 H GLY A 80 13.769 0.257 -5.085 1.00 0.00 H new ATOM 0 HA2 GLY A 80 14.650 1.937 -3.832 1.00 0.00 H new ATOM 0 HA3 GLY A 80 16.211 1.142 -3.788 1.00 0.00 H new ATOM 1301 N HIS A 81 15.742 2.028 -6.800 1.00 0.00 N ATOM 1302 CA HIS A 81 16.240 2.849 -7.872 1.00 0.00 C ATOM 1303 C HIS A 81 15.055 3.318 -8.707 1.00 0.00 C ATOM 1304 O HIS A 81 14.973 3.036 -9.904 1.00 0.00 O ATOM 1305 CB HIS A 81 17.269 2.049 -8.683 1.00 0.00 C ATOM 1306 CG HIS A 81 18.268 1.313 -7.819 1.00 0.00 C ATOM 1307 ND1 HIS A 81 18.472 -0.053 -7.823 1.00 0.00 N ATOM 1308 CD2 HIS A 81 18.974 1.842 -6.773 1.00 0.00 C ATOM 1309 CE1 HIS A 81 19.310 -0.347 -6.810 1.00 0.00 C ATOM 1310 NE2 HIS A 81 19.626 0.789 -6.161 1.00 0.00 N ATOM 0 H HIS A 81 15.266 1.180 -7.107 1.00 0.00 H new ATOM 0 HA HIS A 81 16.753 3.735 -7.497 1.00 0.00 H new ATOM 0 HB2 HIS A 81 16.745 1.331 -9.314 1.00 0.00 H new ATOM 0 HB3 HIS A 81 17.804 2.727 -9.348 1.00 0.00 H new ATOM 0 HD2 HIS A 81 19.014 2.881 -6.482 1.00 0.00 H new ATOM 0 HE1 HIS A 81 19.670 -1.334 -6.559 1.00 0.00 H new ATOM 0 HE2 HIS A 81 20.244 0.860 -5.352 1.00 0.00 H new ATOM 1319 N HIS A 82 14.096 3.982 -8.053 1.00 0.00 N ATOM 1320 CA HIS A 82 12.923 4.486 -8.720 1.00 0.00 C ATOM 1321 C HIS A 82 13.116 5.997 -8.828 1.00 0.00 C ATOM 1322 O HIS A 82 13.832 6.457 -9.712 1.00 0.00 O ATOM 1323 CB HIS A 82 11.629 3.975 -8.044 1.00 0.00 C ATOM 1324 CG HIS A 82 11.778 3.494 -6.618 1.00 0.00 C ATOM 1325 ND1 HIS A 82 11.903 2.183 -6.207 1.00 0.00 N ATOM 1326 CD2 HIS A 82 11.888 4.284 -5.507 1.00 0.00 C ATOM 1327 CE1 HIS A 82 12.065 2.196 -4.873 1.00 0.00 C ATOM 1328 NE2 HIS A 82 12.073 3.451 -4.402 1.00 0.00 N ATOM 0 H HIS A 82 14.124 4.177 -7.052 1.00 0.00 H new ATOM 0 HA HIS A 82 12.796 4.108 -9.734 1.00 0.00 H new ATOM 0 HB2 HIS A 82 10.891 4.777 -8.062 1.00 0.00 H new ATOM 0 HB3 HIS A 82 11.227 3.158 -8.643 1.00 0.00 H new ATOM 0 HD1 HIS A 82 11.877 1.357 -6.805 1.00 0.00 H new ATOM 0 HD2 HIS A 82 11.840 5.363 -5.488 1.00 0.00 H new ATOM 0 HE1 HIS A 82 12.174 1.313 -4.262 1.00 0.00 H new ATOM 1336 N GLU A 83 12.493 6.785 -7.949 1.00 0.00 N ATOM 1337 CA GLU A 83 12.612 8.233 -7.789 1.00 0.00 C ATOM 1338 C GLU A 83 11.997 9.033 -8.939 1.00 0.00 C ATOM 1339 O GLU A 83 11.480 10.123 -8.717 1.00 0.00 O ATOM 1340 CB GLU A 83 14.064 8.661 -7.492 1.00 0.00 C ATOM 1341 CG GLU A 83 14.643 8.040 -6.207 1.00 0.00 C ATOM 1342 CD GLU A 83 15.155 6.614 -6.412 1.00 0.00 C ATOM 1343 OE1 GLU A 83 16.182 6.469 -7.108 1.00 0.00 O ATOM 1344 OE2 GLU A 83 14.497 5.690 -5.887 1.00 0.00 O ATOM 0 H GLU A 83 11.837 6.391 -7.274 1.00 0.00 H new ATOM 0 HA GLU A 83 12.012 8.482 -6.913 1.00 0.00 H new ATOM 0 HB2 GLU A 83 14.695 8.382 -8.336 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.103 9.747 -7.410 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.459 8.665 -5.844 1.00 0.00 H new ATOM 0 HG3 GLU A 83 13.875 8.037 -5.433 1.00 0.00 H new ATOM 1351 N ALA A 84 12.030 8.483 -10.151 1.00 0.00 N ATOM 1352 CA ALA A 84 11.514 9.103 -11.367 1.00 0.00 C ATOM 1353 C ALA A 84 10.005 9.285 -11.201 1.00 0.00 C ATOM 1354 O ALA A 84 9.493 10.402 -11.238 1.00 0.00 O ATOM 1355 CB ALA A 84 11.839 8.213 -12.573 1.00 0.00 C ATOM 0 H ALA A 84 12.431 7.560 -10.318 1.00 0.00 H new ATOM 0 HA ALA A 84 11.976 10.075 -11.538 1.00 0.00 H new ATOM 0 HB1 ALA A 84 11.454 8.676 -13.481 1.00 0.00 H new ATOM 0 HB2 ALA A 84 12.919 8.094 -12.657 1.00 0.00 H new ATOM 0 HB3 ALA A 84 11.375 7.236 -12.439 1.00 0.00 H new ATOM 1361 N GLU A 85 9.333 8.165 -10.919 1.00 0.00 N ATOM 1362 CA GLU A 85 7.910 8.093 -10.625 1.00 0.00 C ATOM 1363 C GLU A 85 7.721 8.547 -9.171 1.00 0.00 C ATOM 1364 O GLU A 85 8.540 9.303 -8.652 1.00 0.00 O ATOM 1365 CB GLU A 85 7.398 6.663 -10.896 1.00 0.00 C ATOM 1366 CG GLU A 85 8.003 5.560 -10.007 1.00 0.00 C ATOM 1367 CD GLU A 85 9.268 4.949 -10.601 1.00 0.00 C ATOM 1368 OE1 GLU A 85 10.327 5.608 -10.498 1.00 0.00 O ATOM 1369 OE2 GLU A 85 9.153 3.834 -11.150 1.00 0.00 O ATOM 0 H GLU A 85 9.788 7.253 -10.890 1.00 0.00 H new ATOM 0 HA GLU A 85 7.321 8.748 -11.267 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.315 6.654 -10.769 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.599 6.416 -11.938 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.232 5.976 -9.026 1.00 0.00 H new ATOM 0 HG3 GLU A 85 7.262 4.775 -9.856 1.00 0.00 H new ATOM 1376 N LEU A 86 6.682 8.061 -8.489 1.00 0.00 N ATOM 1377 CA LEU A 86 6.377 8.387 -7.101 1.00 0.00 C ATOM 1378 C LEU A 86 5.872 9.827 -6.963 1.00 0.00 C ATOM 1379 O LEU A 86 4.770 10.025 -6.476 1.00 0.00 O ATOM 1380 CB LEU A 86 7.567 8.112 -6.171 1.00 0.00 C ATOM 1381 CG LEU A 86 7.148 8.055 -4.694 1.00 0.00 C ATOM 1382 CD1 LEU A 86 6.440 6.734 -4.369 1.00 0.00 C ATOM 1383 CD2 LEU A 86 8.394 8.185 -3.818 1.00 0.00 C ATOM 0 H LEU A 86 6.013 7.412 -8.902 1.00 0.00 H new ATOM 0 HA LEU A 86 5.570 7.725 -6.785 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.034 7.168 -6.451 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.318 8.891 -6.304 1.00 0.00 H new ATOM 0 HG LEU A 86 6.455 8.873 -4.499 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.155 6.723 -3.317 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.548 6.638 -4.987 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.113 5.901 -4.572 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.106 8.146 -2.767 1.00 0.00 H new ATOM 0 HD22 LEU A 86 9.080 7.367 -4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 86 8.886 9.136 -4.024 1.00 0.00 H new ATOM 1395 N LYS A 87 6.646 10.829 -7.395 1.00 0.00 N ATOM 1396 CA LYS A 87 6.301 12.249 -7.317 1.00 0.00 C ATOM 1397 C LYS A 87 4.803 12.559 -7.527 1.00 0.00 C ATOM 1398 O LYS A 87 4.184 13.124 -6.623 1.00 0.00 O ATOM 1399 CB LYS A 87 7.191 13.107 -8.235 1.00 0.00 C ATOM 1400 CG LYS A 87 8.698 12.836 -8.120 1.00 0.00 C ATOM 1401 CD LYS A 87 9.455 13.980 -8.809 1.00 0.00 C ATOM 1402 CE LYS A 87 10.962 13.720 -8.916 1.00 0.00 C ATOM 1403 NZ LYS A 87 11.272 12.633 -9.863 1.00 0.00 N ATOM 0 H LYS A 87 7.558 10.667 -7.822 1.00 0.00 H new ATOM 0 HA LYS A 87 6.507 12.528 -6.284 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.886 12.942 -9.268 1.00 0.00 H new ATOM 0 HB3 LYS A 87 7.009 14.158 -8.013 1.00 0.00 H new ATOM 0 HG2 LYS A 87 8.991 12.765 -7.072 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.948 11.883 -8.586 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.046 14.130 -9.808 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.289 14.904 -8.255 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.465 14.633 -9.235 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.356 13.466 -7.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.269 12.698 -10.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.103 11.715 -9.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.663 12.719 -10.702 1.00 0.00 H new ATOM 1417 N PRO A 88 4.183 12.229 -8.678 1.00 0.00 N ATOM 1418 CA PRO A 88 2.772 12.519 -8.902 1.00 0.00 C ATOM 1419 C PRO A 88 1.865 11.740 -7.945 1.00 0.00 C ATOM 1420 O PRO A 88 0.792 12.218 -7.580 1.00 0.00 O ATOM 1421 CB PRO A 88 2.494 12.127 -10.356 1.00 0.00 C ATOM 1422 CG PRO A 88 3.540 11.052 -10.642 1.00 0.00 C ATOM 1423 CD PRO A 88 4.742 11.562 -9.848 1.00 0.00 C ATOM 0 HA PRO A 88 2.560 13.572 -8.715 1.00 0.00 H new ATOM 0 HB2 PRO A 88 1.481 11.745 -10.482 1.00 0.00 H new ATOM 0 HB3 PRO A 88 2.599 12.978 -11.028 1.00 0.00 H new ATOM 0 HG2 PRO A 88 3.216 10.067 -10.305 1.00 0.00 H new ATOM 0 HG3 PRO A 88 3.759 10.969 -11.706 1.00 0.00 H new ATOM 0 HD2 PRO A 88 5.396 10.741 -9.556 1.00 0.00 H new ATOM 0 HD3 PRO A 88 5.342 12.251 -10.443 1.00 0.00 H new ATOM 1431 N LEU A 89 2.259 10.516 -7.589 1.00 0.00 N ATOM 1432 CA LEU A 89 1.503 9.683 -6.673 1.00 0.00 C ATOM 1433 C LEU A 89 1.470 10.375 -5.317 1.00 0.00 C ATOM 1434 O LEU A 89 0.401 10.610 -4.757 1.00 0.00 O ATOM 1435 CB LEU A 89 2.123 8.273 -6.649 1.00 0.00 C ATOM 1436 CG LEU A 89 1.296 7.184 -5.953 1.00 0.00 C ATOM 1437 CD1 LEU A 89 1.696 5.826 -6.541 1.00 0.00 C ATOM 1438 CD2 LEU A 89 1.576 7.138 -4.445 1.00 0.00 C ATOM 0 H LEU A 89 3.115 10.080 -7.933 1.00 0.00 H new ATOM 0 HA LEU A 89 0.468 9.553 -6.988 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.305 7.961 -7.677 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.094 8.333 -6.157 1.00 0.00 H new ATOM 0 HG LEU A 89 0.240 7.406 -6.109 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.119 5.037 -6.059 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.495 5.820 -7.612 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.759 5.654 -6.370 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.972 6.355 -3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.632 6.927 -4.277 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.323 8.100 -3.998 1.00 0.00 H new ATOM 1450 N ALA A 90 2.652 10.724 -4.807 1.00 0.00 N ATOM 1451 CA ALA A 90 2.813 11.459 -3.567 1.00 0.00 C ATOM 1452 C ALA A 90 1.972 12.729 -3.628 1.00 0.00 C ATOM 1453 O ALA A 90 1.131 12.939 -2.763 1.00 0.00 O ATOM 1454 CB ALA A 90 4.289 11.777 -3.339 1.00 0.00 C ATOM 0 H ALA A 90 3.537 10.496 -5.259 1.00 0.00 H new ATOM 0 HA ALA A 90 2.470 10.856 -2.726 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.402 12.329 -2.406 1.00 0.00 H new ATOM 0 HB2 ALA A 90 4.857 10.848 -3.282 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.663 12.381 -4.166 1.00 0.00 H new ATOM 1460 N GLN A 91 2.131 13.537 -4.682 1.00 0.00 N ATOM 1461 CA GLN A 91 1.367 14.770 -4.821 1.00 0.00 C ATOM 1462 C GLN A 91 -0.143 14.496 -4.797 1.00 0.00 C ATOM 1463 O GLN A 91 -0.882 15.236 -4.152 1.00 0.00 O ATOM 1464 CB GLN A 91 1.805 15.539 -6.072 1.00 0.00 C ATOM 1465 CG GLN A 91 3.186 16.196 -5.900 1.00 0.00 C ATOM 1466 CD GLN A 91 3.185 17.401 -4.955 1.00 0.00 C ATOM 1467 OE1 GLN A 91 2.144 17.830 -4.466 1.00 0.00 O ATOM 1468 NE2 GLN A 91 4.363 17.961 -4.690 1.00 0.00 N ATOM 0 H GLN A 91 2.781 13.355 -5.446 1.00 0.00 H new ATOM 0 HA GLN A 91 1.579 15.407 -3.962 1.00 0.00 H new ATOM 0 HB2 GLN A 91 1.832 14.859 -6.923 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.066 16.307 -6.301 1.00 0.00 H new ATOM 0 HG2 GLN A 91 3.888 15.452 -5.523 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.551 16.513 -6.877 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.213 17.584 -5.110 1.00 0.00 H new ATOM 0 HE22 GLN A 91 4.416 18.767 -4.067 1.00 0.00 H new ATOM 1477 N SER A 92 -0.615 13.423 -5.439 1.00 0.00 N ATOM 1478 CA SER A 92 -2.030 13.064 -5.413 1.00 0.00 C ATOM 1479 C SER A 92 -2.458 12.753 -3.971 1.00 0.00 C ATOM 1480 O SER A 92 -3.344 13.412 -3.418 1.00 0.00 O ATOM 1481 CB SER A 92 -2.294 11.891 -6.363 1.00 0.00 C ATOM 1482 OG SER A 92 -3.667 11.820 -6.678 1.00 0.00 O ATOM 0 H SER A 92 -0.032 12.788 -5.984 1.00 0.00 H new ATOM 0 HA SER A 92 -2.632 13.903 -5.763 1.00 0.00 H new ATOM 0 HB2 SER A 92 -1.710 12.013 -7.275 1.00 0.00 H new ATOM 0 HB3 SER A 92 -1.971 10.959 -5.900 1.00 0.00 H new ATOM 0 HG SER A 92 -4.150 11.390 -5.942 1.00 0.00 H new ATOM 1488 N HIS A 93 -1.804 11.765 -3.344 1.00 0.00 N ATOM 1489 CA HIS A 93 -2.057 11.406 -1.950 1.00 0.00 C ATOM 1490 C HIS A 93 -1.921 12.596 -0.996 1.00 0.00 C ATOM 1491 O HIS A 93 -2.546 12.625 0.064 1.00 0.00 O ATOM 1492 CB HIS A 93 -1.209 10.202 -1.527 1.00 0.00 C ATOM 1493 CG HIS A 93 -1.579 8.957 -2.297 1.00 0.00 C ATOM 1494 ND1 HIS A 93 -1.328 8.766 -3.633 1.00 0.00 N ATOM 1495 CD2 HIS A 93 -2.432 7.955 -1.900 1.00 0.00 C ATOM 1496 CE1 HIS A 93 -2.017 7.694 -4.031 1.00 0.00 C ATOM 1497 NE2 HIS A 93 -2.692 7.141 -3.009 1.00 0.00 N ATOM 0 H HIS A 93 -1.086 11.195 -3.792 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.102 11.102 -1.880 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -0.154 10.427 -1.685 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.340 10.022 -0.460 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.722 9.341 -4.218 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -2.832 7.819 -0.906 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -2.030 7.319 -5.044 1.00 0.00 H new ATOM 1505 N ALA A 94 -1.081 13.563 -1.355 1.00 0.00 N ATOM 1506 CA ALA A 94 -0.834 14.756 -0.576 1.00 0.00 C ATOM 1507 C ALA A 94 -1.984 15.756 -0.706 1.00 0.00 C ATOM 1508 O ALA A 94 -2.654 16.071 0.274 1.00 0.00 O ATOM 1509 CB ALA A 94 0.500 15.407 -0.964 1.00 0.00 C ATOM 0 H ALA A 94 -0.542 13.530 -2.221 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.771 14.454 0.469 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.657 16.301 -0.361 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.313 14.703 -0.788 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.478 15.680 -2.019 1.00 0.00 H new ATOM 1515 N THR A 95 -2.154 16.309 -1.906 1.00 0.00 N ATOM 1516 CA THR A 95 -3.074 17.403 -2.177 1.00 0.00 C ATOM 1517 C THR A 95 -4.513 16.977 -2.452 1.00 0.00 C ATOM 1518 O THR A 95 -5.436 17.714 -2.108 1.00 0.00 O ATOM 1519 CB THR A 95 -2.542 18.229 -3.361 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.452 17.452 -4.539 1.00 0.00 O ATOM 1521 CG2 THR A 95 -1.165 18.830 -3.064 1.00 0.00 C ATOM 0 H THR A 95 -1.643 15.999 -2.732 1.00 0.00 H new ATOM 0 HA THR A 95 -3.116 17.995 -1.263 1.00 0.00 H new ATOM 0 HB THR A 95 -3.259 19.036 -3.513 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.776 16.753 -4.419 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.826 19.405 -3.925 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.233 19.484 -2.195 1.00 0.00 H new ATOM 0 HG23 THR A 95 -0.455 18.029 -2.860 1.00 0.00 H new ATOM 1529 N LYS A 96 -4.718 15.836 -3.116 1.00 0.00 N ATOM 1530 CA LYS A 96 -6.048 15.426 -3.539 1.00 0.00 C ATOM 1531 C LYS A 96 -6.707 14.505 -2.527 1.00 0.00 C ATOM 1532 O LYS A 96 -7.831 14.754 -2.099 1.00 0.00 O ATOM 1533 CB LYS A 96 -5.980 14.763 -4.924 1.00 0.00 C ATOM 1534 CG LYS A 96 -5.285 15.673 -5.944 1.00 0.00 C ATOM 1535 CD LYS A 96 -5.310 15.026 -7.334 1.00 0.00 C ATOM 1536 CE LYS A 96 -4.550 15.877 -8.357 1.00 0.00 C ATOM 1537 NZ LYS A 96 -3.109 15.947 -8.053 1.00 0.00 N ATOM 0 H LYS A 96 -3.976 15.184 -3.369 1.00 0.00 H new ATOM 0 HA LYS A 96 -6.668 16.320 -3.605 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.442 13.818 -4.851 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -6.988 14.531 -5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -5.783 16.642 -5.977 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.255 15.855 -5.638 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -4.866 14.032 -7.283 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -6.342 14.898 -7.659 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -4.691 15.458 -9.353 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -4.967 16.884 -8.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -2.600 16.338 -8.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -2.958 16.560 -7.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -2.751 14.993 -7.846 1.00 0.00 H new ATOM 1551 N HIS A 97 -6.029 13.416 -2.164 1.00 0.00 N ATOM 1552 CA HIS A 97 -6.624 12.420 -1.279 1.00 0.00 C ATOM 1553 C HIS A 97 -6.627 12.883 0.176 1.00 0.00 C ATOM 1554 O HIS A 97 -7.492 12.471 0.941 1.00 0.00 O ATOM 1555 CB HIS A 97 -5.977 11.060 -1.522 1.00 0.00 C ATOM 1556 CG HIS A 97 -6.017 10.682 -2.988 1.00 0.00 C ATOM 1557 ND1 HIS A 97 -7.024 11.019 -3.876 1.00 0.00 N ATOM 1558 CD2 HIS A 97 -4.997 10.134 -3.715 1.00 0.00 C ATOM 1559 CE1 HIS A 97 -6.610 10.691 -5.111 1.00 0.00 C ATOM 1560 NE2 HIS A 97 -5.396 10.120 -5.034 1.00 0.00 N ATOM 0 H HIS A 97 -5.078 13.204 -2.466 1.00 0.00 H new ATOM 0 HA HIS A 97 -7.681 12.300 -1.517 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.943 11.081 -1.178 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -6.493 10.300 -0.935 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.054 9.778 -3.328 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.165 10.860 -6.022 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -4.862 9.742 -5.816 1.00 0.00 H new ATOM 1569 N LYS A 98 -5.692 13.777 0.516 1.00 0.00 N ATOM 1570 CA LYS A 98 -5.528 14.474 1.785 1.00 0.00 C ATOM 1571 C LYS A 98 -4.433 13.849 2.661 1.00 0.00 C ATOM 1572 O LYS A 98 -4.659 12.936 3.454 1.00 0.00 O ATOM 1573 CB LYS A 98 -6.853 14.734 2.526 1.00 0.00 C ATOM 1574 CG LYS A 98 -6.757 15.824 3.607 1.00 0.00 C ATOM 1575 CD LYS A 98 -6.329 17.213 3.096 1.00 0.00 C ATOM 1576 CE LYS A 98 -7.112 17.700 1.866 1.00 0.00 C ATOM 1577 NZ LYS A 98 -8.568 17.704 2.096 1.00 0.00 N ATOM 0 H LYS A 98 -4.971 14.051 -0.151 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.167 15.471 1.533 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -7.614 15.021 1.800 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.188 13.806 2.988 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.727 15.916 4.095 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -6.047 15.499 4.367 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -6.451 17.938 3.901 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -5.267 17.186 2.850 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -6.785 18.706 1.605 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -6.883 17.059 1.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -9.051 18.087 1.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -8.895 16.732 2.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -8.787 18.296 2.923 1.00 0.00 H new ATOM 1591 N ILE A 99 -3.238 14.400 2.481 1.00 0.00 N ATOM 1592 CA ILE A 99 -1.962 14.163 3.136 1.00 0.00 C ATOM 1593 C ILE A 99 -1.709 13.003 4.124 1.00 0.00 C ATOM 1594 O ILE A 99 -1.009 12.070 3.735 1.00 0.00 O ATOM 1595 CB ILE A 99 -1.301 15.499 3.587 1.00 0.00 C ATOM 1596 CG1 ILE A 99 -2.326 16.631 3.826 1.00 0.00 C ATOM 1597 CG2 ILE A 99 -0.233 16.007 2.608 1.00 0.00 C ATOM 1598 CD1 ILE A 99 -1.774 17.751 4.712 1.00 0.00 C ATOM 0 H ILE A 99 -3.131 15.125 1.771 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.454 13.689 2.296 1.00 0.00 H new ATOM 0 HB ILE A 99 -0.821 15.248 4.533 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.630 17.049 2.866 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.220 16.214 4.289 1.00 0.00 H new ATOM 0 HG21 ILE A 99 0.188 16.941 2.981 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.559 15.264 2.515 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.686 16.178 1.632 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -2.537 18.518 4.846 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.496 17.343 5.684 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.896 18.191 4.238 1.00 0.00 H new ATOM 1610 N PRO A 100 -2.074 13.106 5.412 1.00 0.00 N ATOM 1611 CA PRO A 100 -1.674 12.196 6.478 1.00 0.00 C ATOM 1612 C PRO A 100 -1.178 10.762 6.199 1.00 0.00 C ATOM 1613 O PRO A 100 -1.944 9.801 6.136 1.00 0.00 O ATOM 1614 CB PRO A 100 -2.797 12.263 7.507 1.00 0.00 C ATOM 1615 CG PRO A 100 -3.183 13.742 7.448 1.00 0.00 C ATOM 1616 CD PRO A 100 -2.883 14.165 6.004 1.00 0.00 C ATOM 0 HA PRO A 100 -0.704 12.564 6.812 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -3.631 11.611 7.246 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -2.460 11.967 8.501 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.235 13.887 7.693 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.606 14.331 8.161 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -3.807 14.305 5.443 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.350 15.116 5.983 1.00 0.00 H new ATOM 1624 N ILE A 101 0.156 10.625 6.211 1.00 0.00 N ATOM 1625 CA ILE A 101 0.949 9.402 6.048 1.00 0.00 C ATOM 1626 C ILE A 101 0.542 8.297 7.019 1.00 0.00 C ATOM 1627 O ILE A 101 0.807 7.122 6.780 1.00 0.00 O ATOM 1628 CB ILE A 101 2.435 9.769 6.247 1.00 0.00 C ATOM 1629 CG1 ILE A 101 2.765 10.840 5.200 1.00 0.00 C ATOM 1630 CG2 ILE A 101 3.367 8.555 6.150 1.00 0.00 C ATOM 1631 CD1 ILE A 101 4.235 10.940 4.777 1.00 0.00 C ATOM 0 H ILE A 101 0.757 11.438 6.347 1.00 0.00 H new ATOM 0 HA ILE A 101 0.772 9.005 5.048 1.00 0.00 H new ATOM 0 HB ILE A 101 2.596 10.151 7.255 1.00 0.00 H new ATOM 0 HG12 ILE A 101 2.165 10.647 4.311 1.00 0.00 H new ATOM 0 HG13 ILE A 101 2.454 11.809 5.591 1.00 0.00 H new ATOM 0 HG21 ILE A 101 4.398 8.875 6.298 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.099 7.828 6.917 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.267 8.097 5.166 1.00 0.00 H new ATOM 0 HD11 ILE A 101 4.347 11.730 4.034 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.849 11.171 5.647 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.556 9.991 4.348 1.00 0.00 H new ATOM 1643 N LYS A 102 -0.107 8.662 8.117 1.00 0.00 N ATOM 1644 CA LYS A 102 -0.609 7.721 9.107 1.00 0.00 C ATOM 1645 C LYS A 102 -1.414 6.617 8.415 1.00 0.00 C ATOM 1646 O LYS A 102 -1.301 5.443 8.756 1.00 0.00 O ATOM 1647 CB LYS A 102 -1.448 8.462 10.154 1.00 0.00 C ATOM 1648 CG LYS A 102 -0.688 9.567 10.910 1.00 0.00 C ATOM 1649 CD LYS A 102 0.548 9.061 11.674 1.00 0.00 C ATOM 1650 CE LYS A 102 1.860 9.275 10.899 1.00 0.00 C ATOM 1651 NZ LYS A 102 3.023 8.788 11.663 1.00 0.00 N ATOM 0 H LYS A 102 -0.302 9.636 8.347 1.00 0.00 H new ATOM 0 HA LYS A 102 0.228 7.251 9.623 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.314 8.905 9.661 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.827 7.739 10.876 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.376 10.332 10.199 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.368 10.046 11.615 1.00 0.00 H new ATOM 0 HD2 LYS A 102 0.611 9.574 12.634 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.427 7.999 11.888 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.808 8.755 9.942 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.985 10.335 10.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.891 8.947 11.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 3.086 9.302 12.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.914 7.771 11.851 1.00 0.00 H new ATOM 1665 N TYR A 103 -2.203 6.980 7.406 1.00 0.00 N ATOM 1666 CA TYR A 103 -2.951 5.982 6.665 1.00 0.00 C ATOM 1667 C TYR A 103 -2.024 5.051 5.870 1.00 0.00 C ATOM 1668 O TYR A 103 -2.325 3.865 5.731 1.00 0.00 O ATOM 1669 CB TYR A 103 -3.998 6.668 5.797 1.00 0.00 C ATOM 1670 CG TYR A 103 -5.137 7.380 6.509 1.00 0.00 C ATOM 1671 CD1 TYR A 103 -5.335 7.305 7.906 1.00 0.00 C ATOM 1672 CD2 TYR A 103 -6.175 7.856 5.699 1.00 0.00 C ATOM 1673 CE1 TYR A 103 -6.565 7.692 8.469 1.00 0.00 C ATOM 1674 CE2 TYR A 103 -7.409 8.210 6.257 1.00 0.00 C ATOM 1675 CZ TYR A 103 -7.598 8.157 7.643 1.00 0.00 C ATOM 1676 OH TYR A 103 -8.767 8.592 8.184 1.00 0.00 O ATOM 0 H TYR A 103 -2.336 7.941 7.091 1.00 0.00 H new ATOM 0 HA TYR A 103 -3.477 5.335 7.367 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -3.488 7.395 5.165 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -4.431 5.918 5.135 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -4.539 6.949 8.544 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -6.022 7.951 4.634 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -6.713 7.631 9.537 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -8.219 8.525 5.616 1.00 0.00 H new ATOM 0 HH TYR A 103 -9.481 8.529 7.515 1.00 0.00 H new ATOM 1686 N LEU A 104 -0.867 5.536 5.408 1.00 0.00 N ATOM 1687 CA LEU A 104 0.107 4.655 4.769 1.00 0.00 C ATOM 1688 C LEU A 104 0.668 3.681 5.820 1.00 0.00 C ATOM 1689 O LEU A 104 0.955 2.526 5.503 1.00 0.00 O ATOM 1690 CB LEU A 104 1.205 5.434 4.026 1.00 0.00 C ATOM 1691 CG LEU A 104 0.667 6.298 2.868 1.00 0.00 C ATOM 1692 CD1 LEU A 104 1.687 7.373 2.473 1.00 0.00 C ATOM 1693 CD2 LEU A 104 0.345 5.501 1.601 1.00 0.00 C ATOM 0 H LEU A 104 -0.588 6.516 5.464 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.394 4.075 3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.728 6.075 4.735 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.938 4.729 3.633 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.255 6.734 3.251 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.287 7.971 1.654 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.887 8.017 3.329 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.614 6.896 2.154 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.028 6.177 0.831 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.248 5.006 1.243 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -0.414 4.752 1.825 1.00 0.00 H new ATOM 1705 N GLU A 105 0.739 4.091 7.094 1.00 0.00 N ATOM 1706 CA GLU A 105 1.119 3.175 8.167 1.00 0.00 C ATOM 1707 C GLU A 105 0.045 2.083 8.274 1.00 0.00 C ATOM 1708 O GLU A 105 0.340 0.914 8.530 1.00 0.00 O ATOM 1709 CB GLU A 105 1.316 3.891 9.514 1.00 0.00 C ATOM 1710 CG GLU A 105 2.244 5.109 9.427 1.00 0.00 C ATOM 1711 CD GLU A 105 3.635 4.739 8.933 1.00 0.00 C ATOM 1712 OE1 GLU A 105 4.464 4.348 9.784 1.00 0.00 O ATOM 1713 OE2 GLU A 105 3.856 4.864 7.710 1.00 0.00 O ATOM 0 H GLU A 105 0.539 5.043 7.400 1.00 0.00 H new ATOM 0 HA GLU A 105 2.084 2.732 7.922 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.345 4.210 9.893 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.724 3.184 10.237 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.807 5.849 8.756 1.00 0.00 H new ATOM 0 HG3 GLU A 105 2.321 5.575 10.409 1.00 0.00 H new ATOM 1720 N PHE A 106 -1.225 2.474 8.136 1.00 0.00 N ATOM 1721 CA PHE A 106 -2.293 1.500 8.150 1.00 0.00 C ATOM 1722 C PHE A 106 -2.210 0.538 6.958 1.00 0.00 C ATOM 1723 O PHE A 106 -2.383 -0.665 7.154 1.00 0.00 O ATOM 1724 CB PHE A 106 -3.668 2.177 8.267 1.00 0.00 C ATOM 1725 CG PHE A 106 -3.953 3.027 9.504 1.00 0.00 C ATOM 1726 CD1 PHE A 106 -3.379 2.709 10.751 1.00 0.00 C ATOM 1727 CD2 PHE A 106 -4.939 4.035 9.442 1.00 0.00 C ATOM 1728 CE1 PHE A 106 -3.769 3.402 11.913 1.00 0.00 C ATOM 1729 CE2 PHE A 106 -5.315 4.741 10.600 1.00 0.00 C ATOM 1730 CZ PHE A 106 -4.739 4.415 11.839 1.00 0.00 C ATOM 0 H PHE A 106 -1.524 3.442 8.016 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.165 0.888 9.043 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.803 2.810 7.390 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.428 1.397 8.217 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -2.635 1.929 10.816 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.409 4.267 8.498 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -3.321 3.154 12.864 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -6.046 5.533 10.536 1.00 0.00 H new ATOM 0 HZ PHE A 106 -5.041 4.942 12.732 1.00 0.00 H new ATOM 1740 N ILE A 107 -1.977 1.015 5.728 1.00 0.00 N ATOM 1741 CA ILE A 107 -1.884 0.073 4.610 1.00 0.00 C ATOM 1742 C ILE A 107 -0.618 -0.782 4.685 1.00 0.00 C ATOM 1743 O ILE A 107 -0.643 -1.938 4.268 1.00 0.00 O ATOM 1744 CB ILE A 107 -2.092 0.715 3.227 1.00 0.00 C ATOM 1745 CG1 ILE A 107 -2.597 -0.340 2.232 1.00 0.00 C ATOM 1746 CG2 ILE A 107 -0.784 1.311 2.699 1.00 0.00 C ATOM 1747 CD1 ILE A 107 -2.976 0.253 0.869 1.00 0.00 C ATOM 0 H ILE A 107 -1.855 1.999 5.489 1.00 0.00 H new ATOM 0 HA ILE A 107 -2.732 -0.602 4.727 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.828 1.512 3.332 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.825 -1.097 2.091 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.465 -0.845 2.656 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.957 1.759 1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.427 2.075 3.390 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -0.035 0.524 2.611 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -3.325 -0.542 0.211 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -3.769 0.989 1.000 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -2.104 0.734 0.426 1.00 0.00 H new ATOM 1759 N SER A 108 0.497 -0.242 5.184 1.00 0.00 N ATOM 1760 CA SER A 108 1.698 -1.055 5.329 1.00 0.00 C ATOM 1761 C SER A 108 1.403 -2.149 6.355 1.00 0.00 C ATOM 1762 O SER A 108 1.713 -3.315 6.113 1.00 0.00 O ATOM 1763 CB SER A 108 2.928 -0.214 5.672 1.00 0.00 C ATOM 1764 OG SER A 108 2.650 0.691 6.707 1.00 0.00 O ATOM 0 H SER A 108 0.590 0.728 5.486 1.00 0.00 H new ATOM 0 HA SER A 108 1.952 -1.523 4.378 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.748 -0.868 5.968 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.258 0.331 4.787 1.00 0.00 H new ATOM 0 HG SER A 108 2.115 1.434 6.357 1.00 0.00 H new ATOM 1770 N GLU A 109 0.771 -1.786 7.478 1.00 0.00 N ATOM 1771 CA GLU A 109 0.344 -2.770 8.461 1.00 0.00 C ATOM 1772 C GLU A 109 -0.551 -3.811 7.778 1.00 0.00 C ATOM 1773 O GLU A 109 -0.337 -5.009 7.946 1.00 0.00 O ATOM 1774 CB GLU A 109 -0.342 -2.080 9.650 1.00 0.00 C ATOM 1775 CG GLU A 109 -0.809 -3.076 10.722 1.00 0.00 C ATOM 1776 CD GLU A 109 0.333 -3.937 11.260 1.00 0.00 C ATOM 1777 OE1 GLU A 109 1.247 -3.344 11.873 1.00 0.00 O ATOM 1778 OE2 GLU A 109 0.274 -5.167 11.044 1.00 0.00 O ATOM 0 H GLU A 109 0.548 -0.821 7.721 1.00 0.00 H new ATOM 0 HA GLU A 109 1.209 -3.294 8.868 1.00 0.00 H new ATOM 0 HB2 GLU A 109 0.349 -1.366 10.099 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -1.199 -1.511 9.290 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -1.267 -2.529 11.546 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -1.580 -3.722 10.302 1.00 0.00 H new ATOM 1785 N ALA A 110 -1.540 -3.373 6.991 1.00 0.00 N ATOM 1786 CA ALA A 110 -2.398 -4.291 6.251 1.00 0.00 C ATOM 1787 C ALA A 110 -1.550 -5.256 5.413 1.00 0.00 C ATOM 1788 O ALA A 110 -1.633 -6.464 5.616 1.00 0.00 O ATOM 1789 CB ALA A 110 -3.436 -3.530 5.420 1.00 0.00 C ATOM 0 H ALA A 110 -1.762 -2.387 6.853 1.00 0.00 H new ATOM 0 HA ALA A 110 -2.963 -4.897 6.959 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -4.061 -4.241 4.879 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.060 -2.927 6.080 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.927 -2.880 4.708 1.00 0.00 H new ATOM 1795 N ILE A 111 -0.648 -4.744 4.567 1.00 0.00 N ATOM 1796 CA ILE A 111 0.243 -5.561 3.740 1.00 0.00 C ATOM 1797 C ILE A 111 0.960 -6.599 4.612 1.00 0.00 C ATOM 1798 O ILE A 111 0.847 -7.803 4.375 1.00 0.00 O ATOM 1799 CB ILE A 111 1.244 -4.659 2.983 1.00 0.00 C ATOM 1800 CG1 ILE A 111 0.527 -3.930 1.836 1.00 0.00 C ATOM 1801 CG2 ILE A 111 2.415 -5.475 2.406 1.00 0.00 C ATOM 1802 CD1 ILE A 111 1.224 -2.636 1.410 1.00 0.00 C ATOM 0 H ILE A 111 -0.516 -3.741 4.437 1.00 0.00 H new ATOM 0 HA ILE A 111 -0.344 -6.099 2.995 1.00 0.00 H new ATOM 0 HB ILE A 111 1.643 -3.937 3.696 1.00 0.00 H new ATOM 0 HG12 ILE A 111 0.459 -4.598 0.977 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -0.494 -3.701 2.143 1.00 0.00 H new ATOM 0 HG21 ILE A 111 3.099 -4.808 1.881 1.00 0.00 H new ATOM 0 HG22 ILE A 111 2.946 -5.973 3.217 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.031 -6.222 1.711 1.00 0.00 H new ATOM 0 HD11 ILE A 111 0.665 -2.173 0.597 1.00 0.00 H new ATOM 0 HD12 ILE A 111 1.268 -1.951 2.257 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.236 -2.862 1.073 1.00 0.00 H new ATOM 1814 N ILE A 112 1.648 -6.147 5.667 1.00 0.00 N ATOM 1815 CA ILE A 112 2.381 -7.046 6.552 1.00 0.00 C ATOM 1816 C ILE A 112 1.425 -8.108 7.107 1.00 0.00 C ATOM 1817 O ILE A 112 1.758 -9.293 7.153 1.00 0.00 O ATOM 1818 CB ILE A 112 3.102 -6.245 7.659 1.00 0.00 C ATOM 1819 CG1 ILE A 112 4.185 -5.300 7.096 1.00 0.00 C ATOM 1820 CG2 ILE A 112 3.703 -7.171 8.726 1.00 0.00 C ATOM 1821 CD1 ILE A 112 5.440 -5.991 6.550 1.00 0.00 C ATOM 0 H ILE A 112 1.710 -5.162 5.925 1.00 0.00 H new ATOM 0 HA ILE A 112 3.159 -7.568 5.995 1.00 0.00 H new ATOM 0 HB ILE A 112 2.339 -5.625 8.129 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.743 -4.703 6.298 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.485 -4.608 7.883 1.00 0.00 H new ATOM 0 HG21 ILE A 112 4.202 -6.572 9.488 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.909 -7.758 9.188 1.00 0.00 H new ATOM 0 HG23 ILE A 112 4.426 -7.841 8.261 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.137 -5.239 6.179 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.915 -6.565 7.346 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.162 -6.661 5.736 1.00 0.00 H new ATOM 1833 N HIS A 113 0.218 -7.703 7.513 1.00 0.00 N ATOM 1834 CA HIS A 113 -0.761 -8.628 8.044 1.00 0.00 C ATOM 1835 C HIS A 113 -1.202 -9.651 6.992 1.00 0.00 C ATOM 1836 O HIS A 113 -1.295 -10.837 7.311 1.00 0.00 O ATOM 1837 CB HIS A 113 -1.949 -7.917 8.706 1.00 0.00 C ATOM 1838 CG HIS A 113 -2.691 -8.900 9.573 1.00 0.00 C ATOM 1839 ND1 HIS A 113 -2.134 -9.532 10.674 1.00 0.00 N ATOM 1840 CD2 HIS A 113 -3.761 -9.644 9.162 1.00 0.00 C ATOM 1841 CE1 HIS A 113 -2.847 -10.644 10.919 1.00 0.00 C ATOM 1842 NE2 HIS A 113 -3.855 -10.715 10.030 1.00 0.00 N ATOM 0 H HIS A 113 -0.096 -6.733 7.480 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.267 -9.184 8.841 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.598 -7.077 9.306 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -2.615 -7.509 7.945 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -4.407 -9.436 8.322 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -2.645 -11.362 11.700 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -4.571 -11.441 10.002 1.00 0.00 H new ATOM 1851 N VAL A 114 -1.460 -9.240 5.742 1.00 0.00 N ATOM 1852 CA VAL A 114 -1.832 -10.199 4.698 1.00 0.00 C ATOM 1853 C VAL A 114 -0.689 -11.200 4.546 1.00 0.00 C ATOM 1854 O VAL A 114 -0.931 -12.401 4.581 1.00 0.00 O ATOM 1855 CB VAL A 114 -2.224 -9.554 3.351 1.00 0.00 C ATOM 1856 CG1 VAL A 114 -2.689 -10.645 2.379 1.00 0.00 C ATOM 1857 CG2 VAL A 114 -3.395 -8.587 3.559 1.00 0.00 C ATOM 0 H VAL A 114 -1.419 -8.268 5.435 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.744 -10.706 5.014 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.359 -9.024 2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.966 -10.191 1.428 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.880 -11.358 2.219 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -3.552 -11.163 2.799 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.667 -8.135 2.605 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.250 -9.132 3.960 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.102 -7.806 4.260 1.00 0.00 H new ATOM 1867 N LEU A 115 0.554 -10.720 4.457 1.00 0.00 N ATOM 1868 CA LEU A 115 1.720 -11.593 4.340 1.00 0.00 C ATOM 1869 C LEU A 115 1.763 -12.591 5.502 1.00 0.00 C ATOM 1870 O LEU A 115 1.868 -13.799 5.291 1.00 0.00 O ATOM 1871 CB LEU A 115 3.001 -10.764 4.207 1.00 0.00 C ATOM 1872 CG LEU A 115 2.986 -9.842 2.976 1.00 0.00 C ATOM 1873 CD1 LEU A 115 4.216 -8.937 3.000 1.00 0.00 C ATOM 1874 CD2 LEU A 115 2.971 -10.626 1.661 1.00 0.00 C ATOM 0 H LEU A 115 0.777 -9.725 4.464 1.00 0.00 H new ATOM 0 HA LEU A 115 1.639 -12.184 3.428 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.134 -10.161 5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.858 -11.435 4.143 1.00 0.00 H new ATOM 0 HG LEU A 115 2.071 -9.252 3.025 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.204 -8.284 2.127 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.205 -8.332 3.906 1.00 0.00 H new ATOM 0 HD13 LEU A 115 5.118 -9.549 2.984 1.00 0.00 H new ATOM 0 HD21 LEU A 115 2.961 -9.930 0.822 1.00 0.00 H new ATOM 0 HD22 LEU A 115 3.861 -11.253 1.601 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.081 -11.254 1.622 1.00 0.00 H new ATOM 1886 N HIS A 116 1.618 -12.091 6.732 1.00 0.00 N ATOM 1887 CA HIS A 116 1.543 -12.904 7.939 1.00 0.00 C ATOM 1888 C HIS A 116 0.432 -13.956 7.821 1.00 0.00 C ATOM 1889 O HIS A 116 0.638 -15.112 8.186 1.00 0.00 O ATOM 1890 CB HIS A 116 1.323 -11.963 9.139 1.00 0.00 C ATOM 1891 CG HIS A 116 1.005 -12.587 10.479 1.00 0.00 C ATOM 1892 ND1 HIS A 116 0.659 -13.906 10.728 1.00 0.00 N ATOM 1893 CD2 HIS A 116 0.817 -11.882 11.639 1.00 0.00 C ATOM 1894 CE1 HIS A 116 0.277 -13.998 12.015 1.00 0.00 C ATOM 1895 NE2 HIS A 116 0.373 -12.783 12.590 1.00 0.00 N ATOM 0 H HIS A 116 1.549 -11.090 6.915 1.00 0.00 H new ATOM 0 HA HIS A 116 2.472 -13.455 8.083 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.221 -11.357 9.257 1.00 0.00 H new ATOM 0 HB3 HIS A 116 0.510 -11.283 8.886 1.00 0.00 H new ATOM 0 HD1 HIS A 116 0.689 -14.672 10.055 1.00 0.00 H new ATOM 0 HD2 HIS A 116 0.984 -10.825 11.783 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -0.053 -14.900 12.508 1.00 0.00 H new ATOM 1904 N SER A 117 -0.747 -13.566 7.340 1.00 0.00 N ATOM 1905 CA SER A 117 -1.915 -14.439 7.295 1.00 0.00 C ATOM 1906 C SER A 117 -1.866 -15.488 6.179 1.00 0.00 C ATOM 1907 O SER A 117 -2.247 -16.637 6.390 1.00 0.00 O ATOM 1908 CB SER A 117 -3.173 -13.587 7.116 1.00 0.00 C ATOM 1909 OG SER A 117 -3.257 -12.626 8.143 1.00 0.00 O ATOM 0 H SER A 117 -0.918 -12.631 6.969 1.00 0.00 H new ATOM 0 HA SER A 117 -1.927 -14.984 8.239 1.00 0.00 H new ATOM 0 HB2 SER A 117 -3.151 -13.092 6.145 1.00 0.00 H new ATOM 0 HB3 SER A 117 -4.058 -14.224 7.130 1.00 0.00 H new ATOM 0 HG SER A 117 -2.604 -11.914 7.979 1.00 0.00 H new ATOM 1915 N ARG A 118 -1.429 -15.084 4.983 1.00 0.00 N ATOM 1916 CA ARG A 118 -1.505 -15.862 3.745 1.00 0.00 C ATOM 1917 C ARG A 118 -0.182 -16.474 3.297 1.00 0.00 C ATOM 1918 O ARG A 118 -0.198 -17.484 2.587 1.00 0.00 O ATOM 1919 CB ARG A 118 -2.110 -14.986 2.639 1.00 0.00 C ATOM 1920 CG ARG A 118 -3.434 -14.311 3.034 1.00 0.00 C ATOM 1921 CD ARG A 118 -4.415 -15.198 3.817 1.00 0.00 C ATOM 1922 NE ARG A 118 -4.734 -16.449 3.113 1.00 0.00 N ATOM 1923 CZ ARG A 118 -4.739 -17.685 3.643 1.00 0.00 C ATOM 1924 NH1 ARG A 118 -4.224 -17.948 4.853 1.00 0.00 N ATOM 1925 NH2 ARG A 118 -5.271 -18.684 2.930 1.00 0.00 N ATOM 0 H ARG A 118 -0.996 -14.171 4.846 1.00 0.00 H new ATOM 0 HA ARG A 118 -2.147 -16.718 3.951 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -1.389 -14.216 2.363 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -2.276 -15.599 1.753 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -3.209 -13.429 3.634 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -3.929 -13.962 2.128 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -3.987 -15.433 4.792 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -5.335 -14.643 3.998 1.00 0.00 H new ATOM 0 HE ARG A 118 -4.975 -16.372 2.125 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -3.810 -17.197 5.405 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -4.247 -18.899 5.221 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -5.661 -18.500 2.006 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -5.286 -19.630 3.311 1.00 0.00 H new ATOM 1939 N HIS A 119 0.965 -15.923 3.718 1.00 0.00 N ATOM 1940 CA HIS A 119 2.243 -16.461 3.302 1.00 0.00 C ATOM 1941 C HIS A 119 3.183 -16.761 4.480 1.00 0.00 C ATOM 1942 O HIS A 119 4.377 -16.502 4.353 1.00 0.00 O ATOM 1943 CB HIS A 119 2.865 -15.515 2.251 1.00 0.00 C ATOM 1944 CG HIS A 119 1.921 -15.214 1.105 1.00 0.00 C ATOM 1945 ND1 HIS A 119 1.490 -16.144 0.171 1.00 0.00 N ATOM 1946 CD2 HIS A 119 1.056 -14.151 1.057 1.00 0.00 C ATOM 1947 CE1 HIS A 119 0.381 -15.660 -0.423 1.00 0.00 C ATOM 1948 NE2 HIS A 119 0.097 -14.455 0.107 1.00 0.00 N ATOM 0 H HIS A 119 1.022 -15.115 4.338 1.00 0.00 H new ATOM 0 HA HIS A 119 2.081 -17.435 2.841 1.00 0.00 H new ATOM 0 HB2 HIS A 119 3.153 -14.581 2.734 1.00 0.00 H new ATOM 0 HB3 HIS A 119 3.776 -15.965 1.857 1.00 0.00 H new ATOM 0 HD2 HIS A 119 1.112 -13.249 1.648 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -0.186 -16.157 -1.196 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -0.694 -13.864 -0.149 1.00 0.00 H new ATOM 1957 N PRO A 120 2.712 -17.297 5.625 1.00 0.00 N ATOM 1958 CA PRO A 120 3.578 -17.584 6.762 1.00 0.00 C ATOM 1959 C PRO A 120 4.581 -18.687 6.416 1.00 0.00 C ATOM 1960 O PRO A 120 4.432 -19.388 5.415 1.00 0.00 O ATOM 1961 CB PRO A 120 2.646 -17.999 7.903 1.00 0.00 C ATOM 1962 CG PRO A 120 1.446 -18.588 7.167 1.00 0.00 C ATOM 1963 CD PRO A 120 1.348 -17.701 5.927 1.00 0.00 C ATOM 0 HA PRO A 120 4.175 -16.717 7.046 1.00 0.00 H new ATOM 0 HB2 PRO A 120 3.115 -18.730 8.562 1.00 0.00 H new ATOM 0 HB3 PRO A 120 2.362 -17.148 8.522 1.00 0.00 H new ATOM 0 HG2 PRO A 120 1.604 -19.634 6.906 1.00 0.00 H new ATOM 0 HG3 PRO A 120 0.539 -18.544 7.770 1.00 0.00 H new ATOM 0 HD2 PRO A 120 0.906 -18.243 5.091 1.00 0.00 H new ATOM 0 HD3 PRO A 120 0.715 -16.834 6.115 1.00 0.00 H new ATOM 1971 N GLY A 121 5.640 -18.823 7.222 1.00 0.00 N ATOM 1972 CA GLY A 121 6.698 -19.801 6.986 1.00 0.00 C ATOM 1973 C GLY A 121 7.648 -19.256 5.923 1.00 0.00 C ATOM 1974 O GLY A 121 8.856 -19.160 6.136 1.00 0.00 O ATOM 0 H GLY A 121 5.784 -18.255 8.057 1.00 0.00 H new ATOM 0 HA2 GLY A 121 7.241 -19.999 7.910 1.00 0.00 H new ATOM 0 HA3 GLY A 121 6.269 -20.748 6.658 1.00 0.00 H new ATOM 1978 N ASP A 122 7.099 -18.903 4.760 1.00 0.00 N ATOM 1979 CA ASP A 122 7.873 -18.220 3.749 1.00 0.00 C ATOM 1980 C ASP A 122 8.105 -16.789 4.231 1.00 0.00 C ATOM 1981 O ASP A 122 9.205 -16.242 4.120 1.00 0.00 O ATOM 1982 CB ASP A 122 7.143 -18.285 2.403 1.00 0.00 C ATOM 1983 CG ASP A 122 7.924 -17.553 1.324 1.00 0.00 C ATOM 1984 OD1 ASP A 122 8.791 -18.214 0.712 1.00 0.00 O ATOM 1985 OD2 ASP A 122 7.653 -16.348 1.134 1.00 0.00 O ATOM 0 H ASP A 122 6.128 -19.082 4.505 1.00 0.00 H new ATOM 0 HA ASP A 122 8.842 -18.695 3.595 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.002 -19.326 2.112 1.00 0.00 H new ATOM 0 HB3 ASP A 122 6.151 -17.844 2.502 1.00 0.00 H new ATOM 1990 N PHE A 123 7.047 -16.159 4.742 1.00 0.00 N ATOM 1991 CA PHE A 123 7.153 -14.845 5.322 1.00 0.00 C ATOM 1992 C PHE A 123 7.659 -14.991 6.757 1.00 0.00 C ATOM 1993 O PHE A 123 6.899 -14.868 7.718 1.00 0.00 O ATOM 1994 CB PHE A 123 5.817 -14.094 5.210 1.00 0.00 C ATOM 1995 CG PHE A 123 5.872 -12.649 5.653 1.00 0.00 C ATOM 1996 CD1 PHE A 123 6.535 -11.698 4.858 1.00 0.00 C ATOM 1997 CD2 PHE A 123 5.197 -12.242 6.819 1.00 0.00 C ATOM 1998 CE1 PHE A 123 6.480 -10.340 5.205 1.00 0.00 C ATOM 1999 CE2 PHE A 123 5.144 -10.883 7.166 1.00 0.00 C ATOM 2000 CZ PHE A 123 5.764 -9.932 6.341 1.00 0.00 C ATOM 0 H PHE A 123 6.106 -16.552 4.760 1.00 0.00 H new ATOM 0 HA PHE A 123 7.873 -14.234 4.777 1.00 0.00 H new ATOM 0 HB2 PHE A 123 5.479 -14.131 4.174 1.00 0.00 H new ATOM 0 HB3 PHE A 123 5.070 -14.616 5.808 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.085 -12.012 3.983 1.00 0.00 H new ATOM 0 HD2 PHE A 123 4.718 -12.978 7.449 1.00 0.00 H new ATOM 0 HE1 PHE A 123 6.990 -9.607 4.597 1.00 0.00 H new ATOM 0 HE2 PHE A 123 4.629 -10.571 8.063 1.00 0.00 H new ATOM 0 HZ PHE A 123 5.690 -8.882 6.581 1.00 0.00 H new ATOM 2010 N GLY A 124 8.942 -15.335 6.892 1.00 0.00 N ATOM 2011 CA GLY A 124 9.575 -15.474 8.190 1.00 0.00 C ATOM 2012 C GLY A 124 10.079 -14.117 8.686 1.00 0.00 C ATOM 2013 O GLY A 124 9.910 -13.099 8.017 1.00 0.00 O ATOM 0 H GLY A 124 9.562 -15.523 6.104 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.865 -15.889 8.905 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.407 -16.176 8.123 1.00 0.00 H new ATOM 2017 N ALA A 125 10.732 -14.095 9.852 1.00 0.00 N ATOM 2018 CA ALA A 125 11.217 -12.864 10.475 1.00 0.00 C ATOM 2019 C ALA A 125 12.050 -12.026 9.498 1.00 0.00 C ATOM 2020 O ALA A 125 11.813 -10.833 9.333 1.00 0.00 O ATOM 2021 CB ALA A 125 12.027 -13.209 11.729 1.00 0.00 C ATOM 0 H ALA A 125 10.939 -14.936 10.391 1.00 0.00 H new ATOM 0 HA ALA A 125 10.356 -12.259 10.760 1.00 0.00 H new ATOM 0 HB1 ALA A 125 12.388 -12.291 12.193 1.00 0.00 H new ATOM 0 HB2 ALA A 125 11.394 -13.747 12.434 1.00 0.00 H new ATOM 0 HB3 ALA A 125 12.876 -13.834 11.453 1.00 0.00 H new ATOM 2027 N ASP A 126 13.004 -12.664 8.812 1.00 0.00 N ATOM 2028 CA ASP A 126 13.885 -11.998 7.856 1.00 0.00 C ATOM 2029 C ASP A 126 13.051 -11.292 6.786 1.00 0.00 C ATOM 2030 O ASP A 126 13.265 -10.122 6.478 1.00 0.00 O ATOM 2031 CB ASP A 126 14.818 -13.023 7.192 1.00 0.00 C ATOM 2032 CG ASP A 126 15.669 -13.771 8.211 1.00 0.00 C ATOM 2033 OD1 ASP A 126 15.079 -14.629 8.904 1.00 0.00 O ATOM 2034 OD2 ASP A 126 16.880 -13.471 8.284 1.00 0.00 O ATOM 0 H ASP A 126 13.185 -13.663 8.907 1.00 0.00 H new ATOM 0 HA ASP A 126 14.488 -11.262 8.387 1.00 0.00 H new ATOM 0 HB2 ASP A 126 14.224 -13.738 6.623 1.00 0.00 H new ATOM 0 HB3 ASP A 126 15.469 -12.513 6.482 1.00 0.00 H new ATOM 2039 N ALA A 127 12.099 -12.034 6.212 1.00 0.00 N ATOM 2040 CA ALA A 127 11.201 -11.526 5.192 1.00 0.00 C ATOM 2041 C ALA A 127 10.441 -10.324 5.750 1.00 0.00 C ATOM 2042 O ALA A 127 10.443 -9.261 5.141 1.00 0.00 O ATOM 2043 CB ALA A 127 10.253 -12.639 4.743 1.00 0.00 C ATOM 0 H ALA A 127 11.935 -13.012 6.450 1.00 0.00 H new ATOM 0 HA ALA A 127 11.763 -11.198 4.318 1.00 0.00 H new ATOM 0 HB1 ALA A 127 9.579 -12.256 3.977 1.00 0.00 H new ATOM 0 HB2 ALA A 127 10.832 -13.468 4.336 1.00 0.00 H new ATOM 0 HB3 ALA A 127 9.671 -12.988 5.596 1.00 0.00 H new ATOM 2049 N GLN A 128 9.857 -10.476 6.942 1.00 0.00 N ATOM 2050 CA GLN A 128 9.140 -9.414 7.634 1.00 0.00 C ATOM 2051 C GLN A 128 9.998 -8.150 7.721 1.00 0.00 C ATOM 2052 O GLN A 128 9.561 -7.072 7.324 1.00 0.00 O ATOM 2053 CB GLN A 128 8.700 -9.911 9.017 1.00 0.00 C ATOM 2054 CG GLN A 128 7.576 -9.050 9.600 1.00 0.00 C ATOM 2055 CD GLN A 128 6.990 -9.685 10.857 1.00 0.00 C ATOM 2056 OE1 GLN A 128 7.057 -9.114 11.939 1.00 0.00 O ATOM 2057 NE2 GLN A 128 6.413 -10.877 10.724 1.00 0.00 N ATOM 0 H GLN A 128 9.872 -11.356 7.457 1.00 0.00 H new ATOM 0 HA GLN A 128 8.246 -9.149 7.070 1.00 0.00 H new ATOM 0 HB2 GLN A 128 8.364 -10.945 8.941 1.00 0.00 H new ATOM 0 HB3 GLN A 128 9.554 -9.902 9.695 1.00 0.00 H new ATOM 0 HG2 GLN A 128 7.960 -8.057 9.836 1.00 0.00 H new ATOM 0 HG3 GLN A 128 6.791 -8.920 8.855 1.00 0.00 H new ATOM 0 HE21 GLN A 128 6.374 -11.325 9.809 1.00 0.00 H new ATOM 0 HE22 GLN A 128 6.010 -11.342 11.537 1.00 0.00 H new ATOM 2066 N GLY A 129 11.238 -8.293 8.193 1.00 0.00 N ATOM 2067 CA GLY A 129 12.178 -7.191 8.278 1.00 0.00 C ATOM 2068 C GLY A 129 12.420 -6.544 6.916 1.00 0.00 C ATOM 2069 O GLY A 129 12.381 -5.322 6.788 1.00 0.00 O ATOM 0 H GLY A 129 11.612 -9.181 8.526 1.00 0.00 H new ATOM 0 HA2 GLY A 129 11.798 -6.442 8.973 1.00 0.00 H new ATOM 0 HA3 GLY A 129 13.124 -7.551 8.682 1.00 0.00 H new ATOM 2073 N ALA A 130 12.691 -7.355 5.892 1.00 0.00 N ATOM 2074 CA ALA A 130 12.951 -6.855 4.551 1.00 0.00 C ATOM 2075 C ALA A 130 11.742 -6.092 3.990 1.00 0.00 C ATOM 2076 O ALA A 130 11.890 -5.026 3.388 1.00 0.00 O ATOM 2077 CB ALA A 130 13.372 -8.020 3.651 1.00 0.00 C ATOM 0 H ALA A 130 12.735 -8.371 5.973 1.00 0.00 H new ATOM 0 HA ALA A 130 13.769 -6.136 4.588 1.00 0.00 H new ATOM 0 HB1 ALA A 130 13.568 -7.650 2.645 1.00 0.00 H new ATOM 0 HB2 ALA A 130 14.276 -8.480 4.051 1.00 0.00 H new ATOM 0 HB3 ALA A 130 12.573 -8.760 3.616 1.00 0.00 H new ATOM 2083 N MET A 131 10.542 -6.658 4.125 1.00 0.00 N ATOM 2084 CA MET A 131 9.330 -6.014 3.661 1.00 0.00 C ATOM 2085 C MET A 131 9.079 -4.727 4.437 1.00 0.00 C ATOM 2086 O MET A 131 8.797 -3.691 3.835 1.00 0.00 O ATOM 2087 CB MET A 131 8.156 -6.994 3.752 1.00 0.00 C ATOM 2088 CG MET A 131 6.917 -6.462 3.022 1.00 0.00 C ATOM 2089 SD MET A 131 7.079 -6.149 1.242 1.00 0.00 S ATOM 2090 CE MET A 131 7.536 -7.796 0.660 1.00 0.00 C ATOM 0 H MET A 131 10.392 -7.570 4.557 1.00 0.00 H new ATOM 0 HA MET A 131 9.441 -5.732 2.614 1.00 0.00 H new ATOM 0 HB2 MET A 131 8.448 -7.953 3.323 1.00 0.00 H new ATOM 0 HB3 MET A 131 7.912 -7.174 4.799 1.00 0.00 H new ATOM 0 HG2 MET A 131 6.106 -7.175 3.168 1.00 0.00 H new ATOM 0 HG3 MET A 131 6.614 -5.532 3.503 1.00 0.00 H new ATOM 0 HE1 MET A 131 7.500 -7.820 -0.429 1.00 0.00 H new ATOM 0 HE2 MET A 131 8.546 -8.033 0.995 1.00 0.00 H new ATOM 0 HE3 MET A 131 6.838 -8.531 1.062 1.00 0.00 H new ATOM 2100 N ASN A 132 9.184 -4.778 5.767 1.00 0.00 N ATOM 2101 CA ASN A 132 9.020 -3.591 6.595 1.00 0.00 C ATOM 2102 C ASN A 132 9.993 -2.520 6.114 1.00 0.00 C ATOM 2103 O ASN A 132 9.599 -1.373 5.928 1.00 0.00 O ATOM 2104 CB ASN A 132 9.241 -3.894 8.083 1.00 0.00 C ATOM 2105 CG ASN A 132 9.291 -2.591 8.881 1.00 0.00 C ATOM 2106 OD1 ASN A 132 10.347 -2.189 9.355 1.00 0.00 O ATOM 2107 ND2 ASN A 132 8.157 -1.912 9.023 1.00 0.00 N ATOM 0 H ASN A 132 9.382 -5.631 6.290 1.00 0.00 H new ATOM 0 HA ASN A 132 7.994 -3.236 6.497 1.00 0.00 H new ATOM 0 HB2 ASN A 132 8.437 -4.528 8.457 1.00 0.00 H new ATOM 0 HB3 ASN A 132 10.171 -4.447 8.216 1.00 0.00 H new ATOM 0 HD21 ASN A 132 8.151 -1.031 9.538 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.293 -2.272 8.617 1.00 0.00 H new ATOM 2114 N LYS A 133 11.267 -2.875 5.947 1.00 0.00 N ATOM 2115 CA LYS A 133 12.259 -1.961 5.414 1.00 0.00 C ATOM 2116 C LYS A 133 11.754 -1.345 4.106 1.00 0.00 C ATOM 2117 O LYS A 133 11.718 -0.123 3.979 1.00 0.00 O ATOM 2118 CB LYS A 133 13.589 -2.698 5.225 1.00 0.00 C ATOM 2119 CG LYS A 133 14.384 -2.850 6.529 1.00 0.00 C ATOM 2120 CD LYS A 133 15.232 -1.611 6.869 1.00 0.00 C ATOM 2121 CE LYS A 133 16.339 -1.367 5.831 1.00 0.00 C ATOM 2122 NZ LYS A 133 17.324 -0.378 6.295 1.00 0.00 N ATOM 0 H LYS A 133 11.632 -3.799 6.178 1.00 0.00 H new ATOM 0 HA LYS A 133 12.427 -1.145 6.116 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.394 -3.686 4.808 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.196 -2.159 4.497 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.692 -3.045 7.348 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.037 -3.719 6.450 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.587 -0.734 6.923 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.681 -1.738 7.854 1.00 0.00 H new ATOM 0 HE2 LYS A 133 16.845 -2.308 5.613 1.00 0.00 H new ATOM 0 HE3 LYS A 133 15.892 -1.023 4.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 17.930 -0.092 5.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 16.828 0.456 6.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 17.911 -0.798 7.044 1.00 0.00 H new ATOM 2136 N ALA A 134 11.310 -2.165 3.150 1.00 0.00 N ATOM 2137 CA ALA A 134 10.795 -1.658 1.882 1.00 0.00 C ATOM 2138 C ALA A 134 9.645 -0.661 2.084 1.00 0.00 C ATOM 2139 O ALA A 134 9.636 0.411 1.477 1.00 0.00 O ATOM 2140 CB ALA A 134 10.386 -2.814 0.969 1.00 0.00 C ATOM 0 H ALA A 134 11.298 -3.182 3.233 1.00 0.00 H new ATOM 0 HA ALA A 134 11.599 -1.108 1.394 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.004 -2.417 0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 134 11.252 -3.446 0.772 1.00 0.00 H new ATOM 0 HB3 ALA A 134 9.609 -3.404 1.455 1.00 0.00 H new ATOM 2146 N LEU A 135 8.655 -1.003 2.915 1.00 0.00 N ATOM 2147 CA LEU A 135 7.543 -0.093 3.181 1.00 0.00 C ATOM 2148 C LEU A 135 8.042 1.191 3.851 1.00 0.00 C ATOM 2149 O LEU A 135 7.630 2.285 3.468 1.00 0.00 O ATOM 2150 CB LEU A 135 6.414 -0.763 3.988 1.00 0.00 C ATOM 2151 CG LEU A 135 5.344 -1.460 3.124 1.00 0.00 C ATOM 2152 CD1 LEU A 135 4.581 -0.478 2.221 1.00 0.00 C ATOM 2153 CD2 LEU A 135 5.919 -2.600 2.280 1.00 0.00 C ATOM 0 H LEU A 135 8.603 -1.894 3.409 1.00 0.00 H new ATOM 0 HA LEU A 135 7.106 0.178 2.220 1.00 0.00 H new ATOM 0 HB2 LEU A 135 6.853 -1.497 4.664 1.00 0.00 H new ATOM 0 HB3 LEU A 135 5.929 -0.009 4.608 1.00 0.00 H new ATOM 0 HG LEU A 135 4.638 -1.886 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 135 3.841 -1.023 1.635 1.00 0.00 H new ATOM 0 HD12 LEU A 135 4.079 0.268 2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.282 0.018 1.549 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.122 -3.055 1.692 1.00 0.00 H new ATOM 0 HD22 LEU A 135 6.685 -2.207 1.611 1.00 0.00 H new ATOM 0 HD23 LEU A 135 6.360 -3.351 2.935 1.00 0.00 H new ATOM 2165 N GLU A 136 8.985 1.077 4.790 1.00 0.00 N ATOM 2166 CA GLU A 136 9.557 2.215 5.501 1.00 0.00 C ATOM 2167 C GLU A 136 10.213 3.135 4.470 1.00 0.00 C ATOM 2168 O GLU A 136 9.982 4.341 4.478 1.00 0.00 O ATOM 2169 CB GLU A 136 10.585 1.746 6.543 1.00 0.00 C ATOM 2170 CG GLU A 136 9.954 1.039 7.755 1.00 0.00 C ATOM 2171 CD GLU A 136 9.409 1.986 8.816 1.00 0.00 C ATOM 2172 OE1 GLU A 136 10.002 3.074 8.990 1.00 0.00 O ATOM 2173 OE2 GLU A 136 8.395 1.614 9.444 1.00 0.00 O ATOM 0 H GLU A 136 9.375 0.180 5.079 1.00 0.00 H new ATOM 0 HA GLU A 136 8.774 2.752 6.037 1.00 0.00 H new ATOM 0 HB2 GLU A 136 11.292 1.068 6.064 1.00 0.00 H new ATOM 0 HB3 GLU A 136 11.156 2.607 6.891 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.145 0.397 7.406 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.701 0.390 8.212 1.00 0.00 H new ATOM 2180 N LEU A 137 11.011 2.558 3.565 1.00 0.00 N ATOM 2181 CA LEU A 137 11.663 3.286 2.488 1.00 0.00 C ATOM 2182 C LEU A 137 10.600 3.960 1.615 1.00 0.00 C ATOM 2183 O LEU A 137 10.661 5.168 1.399 1.00 0.00 O ATOM 2184 CB LEU A 137 12.619 2.356 1.717 1.00 0.00 C ATOM 2185 CG LEU A 137 13.231 3.023 0.469 1.00 0.00 C ATOM 2186 CD1 LEU A 137 14.725 2.704 0.356 1.00 0.00 C ATOM 2187 CD2 LEU A 137 12.532 2.539 -0.809 1.00 0.00 C ATOM 0 H LEU A 137 11.220 1.560 3.566 1.00 0.00 H new ATOM 0 HA LEU A 137 12.290 4.084 2.884 1.00 0.00 H new ATOM 0 HB2 LEU A 137 13.421 2.037 2.382 1.00 0.00 H new ATOM 0 HB3 LEU A 137 12.079 1.459 1.415 1.00 0.00 H new ATOM 0 HG LEU A 137 13.093 4.099 0.578 1.00 0.00 H new ATOM 0 HD11 LEU A 137 15.134 3.186 -0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 137 15.244 3.074 1.241 1.00 0.00 H new ATOM 0 HD13 LEU A 137 14.862 1.625 0.279 1.00 0.00 H new ATOM 0 HD21 LEU A 137 12.982 3.024 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 137 12.645 1.459 -0.899 1.00 0.00 H new ATOM 0 HD23 LEU A 137 11.472 2.790 -0.762 1.00 0.00 H new ATOM 2199 N PHE A 138 9.541 3.236 1.231 1.00 0.00 N ATOM 2200 CA PHE A 138 8.505 3.812 0.382 1.00 0.00 C ATOM 2201 C PHE A 138 7.899 5.043 1.070 1.00 0.00 C ATOM 2202 O PHE A 138 7.901 6.147 0.520 1.00 0.00 O ATOM 2203 CB PHE A 138 7.467 2.729 0.037 1.00 0.00 C ATOM 2204 CG PHE A 138 6.100 3.242 -0.375 1.00 0.00 C ATOM 2205 CD1 PHE A 138 5.849 3.647 -1.697 1.00 0.00 C ATOM 2206 CD2 PHE A 138 5.115 3.429 0.609 1.00 0.00 C ATOM 2207 CE1 PHE A 138 4.594 4.169 -2.052 1.00 0.00 C ATOM 2208 CE2 PHE A 138 3.883 4.017 0.272 1.00 0.00 C ATOM 2209 CZ PHE A 138 3.608 4.362 -1.065 1.00 0.00 C ATOM 0 H PHE A 138 9.385 2.263 1.494 1.00 0.00 H new ATOM 0 HA PHE A 138 8.925 4.159 -0.562 1.00 0.00 H new ATOM 0 HB2 PHE A 138 7.864 2.114 -0.771 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.346 2.078 0.903 1.00 0.00 H new ATOM 0 HD1 PHE A 138 6.624 3.557 -2.443 1.00 0.00 H new ATOM 0 HD2 PHE A 138 5.304 3.120 1.627 1.00 0.00 H new ATOM 0 HE1 PHE A 138 4.385 4.422 -3.081 1.00 0.00 H new ATOM 0 HE2 PHE A 138 3.147 4.204 1.040 1.00 0.00 H new ATOM 0 HZ PHE A 138 2.646 4.773 -1.332 1.00 0.00 H new ATOM 2219 N ARG A 139 7.421 4.864 2.303 1.00 0.00 N ATOM 2220 CA ARG A 139 6.826 5.942 3.073 1.00 0.00 C ATOM 2221 C ARG A 139 7.817 7.097 3.240 1.00 0.00 C ATOM 2222 O ARG A 139 7.460 8.256 3.055 1.00 0.00 O ATOM 2223 CB ARG A 139 6.321 5.396 4.412 1.00 0.00 C ATOM 2224 CG ARG A 139 5.739 6.523 5.273 1.00 0.00 C ATOM 2225 CD ARG A 139 6.678 6.871 6.431 1.00 0.00 C ATOM 2226 NE ARG A 139 6.551 5.856 7.483 1.00 0.00 N ATOM 2227 CZ ARG A 139 7.512 5.088 8.012 1.00 0.00 C ATOM 2228 NH1 ARG A 139 8.766 5.105 7.547 1.00 0.00 N ATOM 2229 NH2 ARG A 139 7.186 4.284 9.028 1.00 0.00 N ATOM 0 H ARG A 139 7.438 3.967 2.789 1.00 0.00 H new ATOM 0 HA ARG A 139 5.968 6.348 2.538 1.00 0.00 H new ATOM 0 HB2 ARG A 139 5.560 4.636 4.236 1.00 0.00 H new ATOM 0 HB3 ARG A 139 7.139 4.911 4.944 1.00 0.00 H new ATOM 0 HG2 ARG A 139 5.573 7.407 4.657 1.00 0.00 H new ATOM 0 HG3 ARG A 139 4.768 6.221 5.666 1.00 0.00 H new ATOM 0 HD2 ARG A 139 7.708 6.917 6.077 1.00 0.00 H new ATOM 0 HD3 ARG A 139 6.433 7.856 6.829 1.00 0.00 H new ATOM 0 HE ARG A 139 5.613 5.718 7.859 1.00 0.00 H new ATOM 0 HH11 ARG A 139 9.013 5.715 6.768 1.00 0.00 H new ATOM 0 HH12 ARG A 139 9.476 4.508 7.972 1.00 0.00 H new ATOM 0 HH21 ARG A 139 6.228 4.268 9.378 1.00 0.00 H new ATOM 0 HH22 ARG A 139 7.895 3.686 9.453 1.00 0.00 H new ATOM 2243 N LYS A 140 9.075 6.793 3.555 1.00 0.00 N ATOM 2244 CA LYS A 140 10.115 7.798 3.706 1.00 0.00 C ATOM 2245 C LYS A 140 10.284 8.587 2.404 1.00 0.00 C ATOM 2246 O LYS A 140 10.480 9.803 2.444 1.00 0.00 O ATOM 2247 CB LYS A 140 11.426 7.116 4.122 1.00 0.00 C ATOM 2248 CG LYS A 140 12.566 8.115 4.381 1.00 0.00 C ATOM 2249 CD LYS A 140 13.926 7.413 4.517 1.00 0.00 C ATOM 2250 CE LYS A 140 14.693 7.325 3.186 1.00 0.00 C ATOM 2251 NZ LYS A 140 13.971 6.559 2.154 1.00 0.00 N ATOM 0 H LYS A 140 9.398 5.838 3.712 1.00 0.00 H new ATOM 0 HA LYS A 140 9.831 8.506 4.485 1.00 0.00 H new ATOM 0 HB2 LYS A 140 11.253 6.528 5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 140 11.731 6.420 3.341 1.00 0.00 H new ATOM 0 HG2 LYS A 140 12.610 8.835 3.564 1.00 0.00 H new ATOM 0 HG3 LYS A 140 12.356 8.677 5.291 1.00 0.00 H new ATOM 0 HD2 LYS A 140 14.534 7.949 5.246 1.00 0.00 H new ATOM 0 HD3 LYS A 140 13.772 6.407 4.908 1.00 0.00 H new ATOM 0 HE2 LYS A 140 14.884 8.332 2.816 1.00 0.00 H new ATOM 0 HE3 LYS A 140 15.663 6.861 3.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 14.584 6.433 1.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 13.707 5.628 2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 13.112 7.075 1.875 1.00 0.00 H new ATOM 2265 N ASP A 141 10.188 7.929 1.243 1.00 0.00 N ATOM 2266 CA ASP A 141 10.354 8.629 -0.017 1.00 0.00 C ATOM 2267 C ASP A 141 9.192 9.600 -0.132 1.00 0.00 C ATOM 2268 O ASP A 141 9.382 10.792 -0.358 1.00 0.00 O ATOM 2269 CB ASP A 141 10.419 7.650 -1.199 1.00 0.00 C ATOM 2270 CG ASP A 141 11.568 6.647 -1.096 1.00 0.00 C ATOM 2271 OD1 ASP A 141 12.644 7.048 -0.600 1.00 0.00 O ATOM 2272 OD2 ASP A 141 11.351 5.499 -1.535 1.00 0.00 O ATOM 0 H ASP A 141 9.999 6.930 1.159 1.00 0.00 H new ATOM 0 HA ASP A 141 11.299 9.171 -0.043 1.00 0.00 H new ATOM 0 HB2 ASP A 141 9.477 7.106 -1.262 1.00 0.00 H new ATOM 0 HB3 ASP A 141 10.523 8.216 -2.125 1.00 0.00 H new ATOM 2277 N ILE A 142 7.979 9.098 0.091 1.00 0.00 N ATOM 2278 CA ILE A 142 6.784 9.923 0.021 1.00 0.00 C ATOM 2279 C ILE A 142 6.851 11.084 1.018 1.00 0.00 C ATOM 2280 O ILE A 142 6.459 12.195 0.688 1.00 0.00 O ATOM 2281 CB ILE A 142 5.527 9.049 0.134 1.00 0.00 C ATOM 2282 CG1 ILE A 142 5.552 8.122 -1.089 1.00 0.00 C ATOM 2283 CG2 ILE A 142 4.289 9.941 0.198 1.00 0.00 C ATOM 2284 CD1 ILE A 142 4.189 7.490 -1.369 1.00 0.00 C ATOM 0 H ILE A 142 7.802 8.120 0.322 1.00 0.00 H new ATOM 0 HA ILE A 142 6.725 10.402 -0.956 1.00 0.00 H new ATOM 0 HB ILE A 142 5.500 8.447 1.042 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.874 8.687 -1.964 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.289 7.335 -0.930 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.397 9.320 0.278 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.356 10.594 1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.230 10.546 -0.707 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.260 6.844 -2.244 1.00 0.00 H new ATOM 0 HD12 ILE A 142 3.877 6.901 -0.507 1.00 0.00 H new ATOM 0 HD13 ILE A 142 3.456 8.274 -1.557 1.00 0.00 H new ATOM 2296 N ALA A 143 7.388 10.863 2.216 1.00 0.00 N ATOM 2297 CA ALA A 143 7.561 11.897 3.231 1.00 0.00 C ATOM 2298 C ALA A 143 8.428 13.023 2.664 1.00 0.00 C ATOM 2299 O ALA A 143 8.139 14.206 2.860 1.00 0.00 O ATOM 2300 CB ALA A 143 8.166 11.304 4.506 1.00 0.00 C ATOM 0 H ALA A 143 7.720 9.945 2.512 1.00 0.00 H new ATOM 0 HA ALA A 143 6.589 12.312 3.500 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.287 12.090 5.251 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.504 10.532 4.898 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.138 10.867 4.278 1.00 0.00 H new ATOM 2306 N ALA A 144 9.473 12.655 1.919 1.00 0.00 N ATOM 2307 CA ALA A 144 10.291 13.639 1.240 1.00 0.00 C ATOM 2308 C ALA A 144 9.455 14.321 0.153 1.00 0.00 C ATOM 2309 O ALA A 144 9.436 15.545 0.073 1.00 0.00 O ATOM 2310 CB ALA A 144 11.557 12.988 0.675 1.00 0.00 C ATOM 0 H ALA A 144 9.764 11.688 1.777 1.00 0.00 H new ATOM 0 HA ALA A 144 10.620 14.402 1.946 1.00 0.00 H new ATOM 0 HB1 ALA A 144 12.159 13.742 0.168 1.00 0.00 H new ATOM 0 HB2 ALA A 144 12.135 12.549 1.489 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.280 12.209 -0.035 1.00 0.00 H new ATOM 2316 N LYS A 145 8.724 13.559 -0.670 1.00 0.00 N ATOM 2317 CA LYS A 145 7.913 14.163 -1.734 1.00 0.00 C ATOM 2318 C LYS A 145 6.813 15.088 -1.205 1.00 0.00 C ATOM 2319 O LYS A 145 6.566 16.157 -1.761 1.00 0.00 O ATOM 2320 CB LYS A 145 7.355 13.119 -2.704 1.00 0.00 C ATOM 2321 CG LYS A 145 8.388 12.165 -3.321 1.00 0.00 C ATOM 2322 CD LYS A 145 9.592 12.886 -3.943 1.00 0.00 C ATOM 2323 CE LYS A 145 10.584 11.881 -4.542 1.00 0.00 C ATOM 2324 NZ LYS A 145 11.212 11.047 -3.499 1.00 0.00 N ATOM 0 H LYS A 145 8.677 12.541 -0.622 1.00 0.00 H new ATOM 0 HA LYS A 145 8.598 14.796 -2.298 1.00 0.00 H new ATOM 0 HB2 LYS A 145 6.607 12.525 -2.179 1.00 0.00 H new ATOM 0 HB3 LYS A 145 6.840 13.639 -3.512 1.00 0.00 H new ATOM 0 HG2 LYS A 145 8.743 11.479 -2.552 1.00 0.00 H new ATOM 0 HG3 LYS A 145 7.901 11.561 -4.086 1.00 0.00 H new ATOM 0 HD2 LYS A 145 9.250 13.571 -4.719 1.00 0.00 H new ATOM 0 HD3 LYS A 145 10.092 13.488 -3.184 1.00 0.00 H new ATOM 0 HE2 LYS A 145 10.067 11.241 -5.257 1.00 0.00 H new ATOM 0 HE3 LYS A 145 11.356 12.417 -5.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 12.025 10.540 -3.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 11.535 11.653 -2.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 10.519 10.360 -3.140 1.00 0.00 H new ATOM 2338 N TYR A 146 6.319 14.798 -0.002 1.00 0.00 N ATOM 2339 CA TYR A 146 5.370 15.631 0.724 1.00 0.00 C ATOM 2340 C TYR A 146 6.022 16.944 1.152 1.00 0.00 C ATOM 2341 O TYR A 146 5.420 17.709 1.887 1.00 0.00 O ATOM 2342 CB TYR A 146 4.941 14.902 1.989 1.00 0.00 C ATOM 2343 CG TYR A 146 3.810 13.895 1.857 1.00 0.00 C ATOM 2344 CD1 TYR A 146 3.490 13.318 0.606 1.00 0.00 C ATOM 2345 CD2 TYR A 146 2.940 13.687 2.953 1.00 0.00 C ATOM 2346 CE1 TYR A 146 2.330 12.536 0.463 1.00 0.00 C ATOM 2347 CE2 TYR A 146 1.804 12.889 2.802 1.00 0.00 C ATOM 2348 CZ TYR A 146 1.476 12.335 1.555 1.00 0.00 C ATOM 2349 OH TYR A 146 0.354 11.576 1.406 1.00 0.00 O ATOM 0 H TYR A 146 6.577 13.952 0.506 1.00 0.00 H new ATOM 0 HA TYR A 146 4.521 15.835 0.071 1.00 0.00 H new ATOM 0 HB2 TYR A 146 5.811 14.383 2.392 1.00 0.00 H new ATOM 0 HB3 TYR A 146 4.645 15.649 2.726 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.139 13.479 -0.242 1.00 0.00 H new ATOM 0 HD2 TYR A 146 3.155 14.146 3.907 1.00 0.00 H new ATOM 0 HE1 TYR A 146 2.097 12.089 -0.492 1.00 0.00 H new ATOM 0 HE2 TYR A 146 1.170 12.696 3.655 1.00 0.00 H new ATOM 0 HH TYR A 146 -0.286 11.796 2.115 1.00 0.00 H new ATOM 2359 N LYS A 147 7.265 17.195 0.752 1.00 0.00 N ATOM 2360 CA LYS A 147 8.135 18.298 1.127 1.00 0.00 C ATOM 2361 C LYS A 147 8.151 18.399 2.639 1.00 0.00 C ATOM 2362 O LYS A 147 8.168 19.489 3.204 1.00 0.00 O ATOM 2363 CB LYS A 147 8.006 19.582 0.299 1.00 0.00 C ATOM 2364 CG LYS A 147 9.370 20.132 -0.144 1.00 0.00 C ATOM 2365 CD LYS A 147 9.177 21.437 -0.924 1.00 0.00 C ATOM 2366 CE LYS A 147 10.530 21.979 -1.396 1.00 0.00 C ATOM 2367 NZ LYS A 147 10.365 23.241 -2.137 1.00 0.00 N ATOM 0 H LYS A 147 7.730 16.569 0.094 1.00 0.00 H new ATOM 0 HA LYS A 147 9.158 18.077 0.823 1.00 0.00 H new ATOM 0 HB2 LYS A 147 7.394 19.384 -0.581 1.00 0.00 H new ATOM 0 HB3 LYS A 147 7.485 20.339 0.886 1.00 0.00 H new ATOM 0 HG2 LYS A 147 10.001 20.309 0.727 1.00 0.00 H new ATOM 0 HG3 LYS A 147 9.883 19.399 -0.766 1.00 0.00 H new ATOM 0 HD2 LYS A 147 8.528 21.263 -1.782 1.00 0.00 H new ATOM 0 HD3 LYS A 147 8.681 22.176 -0.294 1.00 0.00 H new ATOM 0 HE2 LYS A 147 11.181 22.140 -0.537 1.00 0.00 H new ATOM 0 HE3 LYS A 147 11.019 21.241 -2.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 11.251 23.472 -2.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 9.598 23.138 -2.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 10.129 24.005 -1.473 1.00 0.00 H new ATOM 2381 N GLU A 148 8.194 17.210 3.253 1.00 0.00 N ATOM 2382 CA GLU A 148 8.068 16.992 4.678 1.00 0.00 C ATOM 2383 C GLU A 148 6.871 17.814 5.171 1.00 0.00 C ATOM 2384 O GLU A 148 7.003 18.774 5.925 1.00 0.00 O ATOM 2385 CB GLU A 148 9.393 17.310 5.349 1.00 0.00 C ATOM 2386 CG GLU A 148 10.521 16.343 4.948 1.00 0.00 C ATOM 2387 CD GLU A 148 10.260 14.891 5.353 1.00 0.00 C ATOM 2388 OE1 GLU A 148 9.560 14.688 6.370 1.00 0.00 O ATOM 2389 OE2 GLU A 148 10.778 14.002 4.643 1.00 0.00 O ATOM 0 H GLU A 148 8.324 16.341 2.735 1.00 0.00 H new ATOM 0 HA GLU A 148 7.861 15.953 4.935 1.00 0.00 H new ATOM 0 HB2 GLU A 148 9.688 18.328 5.094 1.00 0.00 H new ATOM 0 HB3 GLU A 148 9.262 17.278 6.431 1.00 0.00 H new ATOM 0 HG2 GLU A 148 10.661 16.390 3.868 1.00 0.00 H new ATOM 0 HG3 GLU A 148 11.453 16.676 5.405 1.00 0.00 H new ATOM 2396 N LEU A 149 5.710 17.485 4.596 1.00 0.00 N ATOM 2397 CA LEU A 149 4.429 18.127 4.786 1.00 0.00 C ATOM 2398 C LEU A 149 4.427 19.606 4.364 1.00 0.00 C ATOM 2399 O LEU A 149 3.656 20.420 4.864 1.00 0.00 O ATOM 2400 CB LEU A 149 3.917 17.804 6.183 1.00 0.00 C ATOM 2401 CG LEU A 149 3.353 16.376 6.295 1.00 0.00 C ATOM 2402 CD1 LEU A 149 3.320 15.951 7.768 1.00 0.00 C ATOM 2403 CD2 LEU A 149 1.942 16.274 5.705 1.00 0.00 C ATOM 0 H LEU A 149 5.649 16.706 3.941 1.00 0.00 H new ATOM 0 HA LEU A 149 3.691 17.716 4.097 1.00 0.00 H new ATOM 0 HB2 LEU A 149 4.729 17.927 6.900 1.00 0.00 H new ATOM 0 HB3 LEU A 149 3.141 18.519 6.455 1.00 0.00 H new ATOM 0 HG LEU A 149 4.005 15.714 5.725 1.00 0.00 H new ATOM 0 HD11 LEU A 149 2.920 14.940 7.846 1.00 0.00 H new ATOM 0 HD12 LEU A 149 4.330 15.974 8.176 1.00 0.00 H new ATOM 0 HD13 LEU A 149 2.686 16.636 8.330 1.00 0.00 H new ATOM 0 HD21 LEU A 149 1.580 15.251 5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 149 1.274 16.949 6.241 1.00 0.00 H new ATOM 0 HD23 LEU A 149 1.968 16.550 4.651 1.00 0.00 H new ATOM 2415 N GLY A 150 5.254 19.903 3.360 1.00 0.00 N ATOM 2416 CA GLY A 150 5.373 21.151 2.634 1.00 0.00 C ATOM 2417 C GLY A 150 4.676 20.921 1.293 1.00 0.00 C ATOM 2418 O GLY A 150 3.706 21.623 1.016 1.00 0.00 O ATOM 0 H GLY A 150 5.913 19.208 3.010 1.00 0.00 H new ATOM 0 HA2 GLY A 150 4.905 21.969 3.183 1.00 0.00 H new ATOM 0 HA3 GLY A 150 6.419 21.421 2.490 1.00 0.00 H new ATOM 2422 N TYR A 151 5.126 19.928 0.495 1.00 0.00 N ATOM 2423 CA TYR A 151 4.493 19.438 -0.742 1.00 0.00 C ATOM 2424 C TYR A 151 4.244 20.442 -1.871 1.00 0.00 C ATOM 2425 O TYR A 151 4.693 20.214 -2.993 1.00 0.00 O ATOM 2426 CB TYR A 151 3.233 18.594 -0.434 1.00 0.00 C ATOM 2427 CG TYR A 151 2.128 19.239 0.384 1.00 0.00 C ATOM 2428 CD1 TYR A 151 2.101 19.100 1.789 1.00 0.00 C ATOM 2429 CD2 TYR A 151 1.063 19.881 -0.270 1.00 0.00 C ATOM 2430 CE1 TYR A 151 1.036 19.636 2.528 1.00 0.00 C ATOM 2431 CE2 TYR A 151 -0.002 20.418 0.474 1.00 0.00 C ATOM 2432 CZ TYR A 151 -0.015 20.296 1.872 1.00 0.00 C ATOM 2433 OH TYR A 151 -1.054 20.809 2.588 1.00 0.00 O ATOM 0 H TYR A 151 5.985 19.423 0.710 1.00 0.00 H new ATOM 0 HA TYR A 151 5.272 18.808 -1.171 1.00 0.00 H new ATOM 0 HB2 TYR A 151 2.803 18.276 -1.384 1.00 0.00 H new ATOM 0 HB3 TYR A 151 3.554 17.693 0.089 1.00 0.00 H new ATOM 0 HD1 TYR A 151 2.901 18.580 2.295 1.00 0.00 H new ATOM 0 HD2 TYR A 151 1.063 19.962 -1.347 1.00 0.00 H new ATOM 0 HE1 TYR A 151 1.025 19.541 3.604 1.00 0.00 H new ATOM 0 HE2 TYR A 151 -0.811 20.925 -0.031 1.00 0.00 H new ATOM 0 HH TYR A 151 -1.693 21.233 1.978 1.00 0.00 H new ATOM 2443 N GLN A 152 3.469 21.493 -1.616 1.00 0.00 N ATOM 2444 CA GLN A 152 3.065 22.492 -2.593 1.00 0.00 C ATOM 2445 C GLN A 152 4.266 23.195 -3.234 1.00 0.00 C ATOM 2446 O GLN A 152 4.264 23.473 -4.431 1.00 0.00 O ATOM 2447 CB GLN A 152 2.071 23.460 -1.933 1.00 0.00 C ATOM 2448 CG GLN A 152 2.651 24.249 -0.747 1.00 0.00 C ATOM 2449 CD GLN A 152 1.618 24.415 0.363 1.00 0.00 C ATOM 2450 OE1 GLN A 152 0.854 25.373 0.374 1.00 0.00 O ATOM 2451 NE2 GLN A 152 1.590 23.478 1.308 1.00 0.00 N ATOM 0 H GLN A 152 3.092 21.676 -0.686 1.00 0.00 H new ATOM 0 HA GLN A 152 2.560 22.002 -3.425 1.00 0.00 H new ATOM 0 HB2 GLN A 152 1.715 24.165 -2.684 1.00 0.00 H new ATOM 0 HB3 GLN A 152 1.204 22.895 -1.590 1.00 0.00 H new ATOM 0 HG2 GLN A 152 3.528 23.732 -0.357 1.00 0.00 H new ATOM 0 HG3 GLN A 152 2.984 25.230 -1.087 1.00 0.00 H new ATOM 0 HE21 GLN A 152 2.241 22.694 1.268 1.00 0.00 H new ATOM 0 HE22 GLN A 152 0.918 23.544 2.072 1.00 0.00 H new ATOM 2460 N GLY A 153 5.315 23.459 -2.450 1.00 0.00 N ATOM 2461 CA GLY A 153 6.517 24.104 -2.953 1.00 0.00 C ATOM 2462 C GLY A 153 7.118 23.309 -4.111 1.00 0.00 C ATOM 2463 O GLY A 153 8.249 22.834 -4.013 1.00 0.00 O ATOM 0 H GLY A 153 5.349 23.231 -1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 153 6.280 25.115 -3.285 1.00 0.00 H new ATOM 0 HA3 GLY A 153 7.249 24.195 -2.150 1.00 0.00 H new TER 2467 GLY A 153 HETATM 2468 FE HEM A 154 -3.831 5.472 -3.043 1.00 0.00 FE HETATM 2469 CHA HEM A 154 -5.504 6.652 -5.792 1.00 0.00 C HETATM 2470 CHB HEM A 154 -1.430 4.063 -5.098 1.00 0.00 C HETATM 2471 CHC HEM A 154 -2.236 4.186 -0.335 1.00 0.00 C HETATM 2472 CHD HEM A 154 -6.368 6.585 -1.039 1.00 0.00 C HETATM 2473 NA HEM A 154 -3.585 5.284 -5.043 1.00 0.00 N HETATM 2474 C1A HEM A 154 -4.321 5.940 -6.017 1.00 0.00 C HETATM 2475 C2A HEM A 154 -3.678 5.773 -7.308 1.00 0.00 C HETATM 2476 C3A HEM A 154 -2.608 4.962 -7.121 1.00 0.00 C HETATM 2477 C4A HEM A 154 -2.518 4.693 -5.706 1.00 0.00 C HETATM 2478 CMA HEM A 154 -1.569 4.557 -8.135 1.00 0.00 C HETATM 2479 CAA HEM A 154 -4.064 6.481 -8.583 1.00 0.00 C HETATM 2480 CBA HEM A 154 -3.201 7.716 -8.866 1.00 0.00 C HETATM 2481 CGA HEM A 154 -3.138 8.663 -7.672 1.00 0.00 C HETATM 2482 O1A HEM A 154 -2.010 8.876 -7.179 1.00 0.00 O HETATM 2483 O2A HEM A 154 -4.179 9.293 -7.384 1.00 0.00 O HETATM 2484 NB HEM A 154 -2.136 4.390 -2.770 1.00 0.00 N HETATM 2485 C1B HEM A 154 -1.252 3.917 -3.727 1.00 0.00 C HETATM 2486 C2B HEM A 154 -0.168 3.194 -3.087 1.00 0.00 C HETATM 2487 C3B HEM A 154 -0.474 3.117 -1.767 1.00 0.00 C HETATM 2488 C4B HEM A 154 -1.664 3.915 -1.568 1.00 0.00 C HETATM 2489 CMB HEM A 154 1.034 2.615 -3.781 1.00 0.00 C HETATM 2490 CAB HEM A 154 0.314 2.448 -0.673 1.00 0.00 C HETATM 2491 CBB HEM A 154 0.535 1.127 -0.722 1.00 0.00 C HETATM 2492 NC HEM A 154 -4.127 5.567 -1.060 1.00 0.00 N HETATM 2493 C1C HEM A 154 -3.342 4.996 -0.083 1.00 0.00 C HETATM 2494 C2C HEM A 154 -3.931 5.220 1.221 1.00 0.00 C HETATM 2495 C3C HEM A 154 -5.168 5.752 1.010 1.00 0.00 C HETATM 2496 C4C HEM A 154 -5.274 5.990 -0.414 1.00 0.00 C HETATM 2497 CMC HEM A 154 -3.281 4.836 2.522 1.00 0.00 C HETATM 2498 CAC HEM A 154 -6.269 6.086 1.994 1.00 0.00 C HETATM 2499 CBC HEM A 154 -6.378 5.517 3.199 1.00 0.00 C HETATM 2500 ND HEM A 154 -5.538 6.508 -3.349 1.00 0.00 N HETATM 2501 C1D HEM A 154 -6.452 6.895 -2.390 1.00 0.00 C HETATM 2502 C2D HEM A 154 -7.565 7.576 -3.005 1.00 0.00 C HETATM 2503 C3D HEM A 154 -7.463 7.374 -4.341 1.00 0.00 C HETATM 2504 C4D HEM A 154 -6.132 6.815 -4.560 1.00 0.00 C HETATM 2505 CMD HEM A 154 -8.686 8.235 -2.258 1.00 0.00 C HETATM 2506 CAD HEM A 154 -8.505 7.688 -5.392 1.00 0.00 C HETATM 2507 CBD HEM A 154 -9.844 6.939 -5.223 1.00 0.00 C HETATM 2508 CGD HEM A 154 -10.879 7.686 -4.378 1.00 0.00 C HETATM 2509 O1D HEM A 154 -11.089 8.872 -4.707 1.00 0.00 O HETATM 2510 O2D HEM A 154 -11.704 6.983 -3.753 1.00 0.00 O HETATM 0 HMA1 HEM A 154 -2.050 4.377 -9.097 1.00 0.00 H new HETATM 0 HMA2 HEM A 154 -1.072 3.646 -7.802 1.00 0.00 H new HETATM 0 HMA3 HEM A 154 -0.833 5.354 -8.240 1.00 0.00 H new HETATM 0 HMB1 HEM A 154 1.884 2.617 -3.099 1.00 0.00 H new HETATM 0 HMB2 HEM A 154 1.272 3.216 -4.659 1.00 0.00 H new HETATM 0 HMB3 HEM A 154 0.819 1.592 -4.089 1.00 0.00 H new HETATM 0 HMC1 HEM A 154 -3.598 5.525 3.305 1.00 0.00 H new HETATM 0 HMC2 HEM A 154 -2.197 4.882 2.415 1.00 0.00 H new HETATM 0 HMC3 HEM A 154 -3.576 3.822 2.791 1.00 0.00 H new HETATM 0 HMD1 HEM A 154 -9.067 9.075 -2.840 1.00 0.00 H new HETATM 0 HMD2 HEM A 154 -8.320 8.596 -1.297 1.00 0.00 H new HETATM 0 HMD3 HEM A 154 -9.487 7.514 -2.094 1.00 0.00 H new HETATM 0 HBB1 HEM A 154 1.105 0.640 0.069 1.00 0.00 H new HETATM 0 HBB2 HEM A 154 0.144 0.540 -1.553 1.00 0.00 H new HETATM 0 HBC1 HEM A 154 -7.194 5.800 3.864 1.00 0.00 H new HETATM 0 HBC2 HEM A 154 -5.650 4.770 3.517 1.00 0.00 H new HETATM 0 HBA1 HEM A 154 -3.603 8.248 -9.728 1.00 0.00 H new HETATM 0 HBA2 HEM A 154 -2.192 7.399 -9.129 1.00 0.00 H new HETATM 0 HAA1 HEM A 154 -5.110 6.781 -8.523 1.00 0.00 H new HETATM 0 HAA2 HEM A 154 -3.979 5.786 -9.418 1.00 0.00 H new HETATM 0 HBD1 HEM A 154 -9.650 5.969 -4.765 1.00 0.00 H new HETATM 0 HBD2 HEM A 154 -10.267 6.747 -6.209 1.00 0.00 H new HETATM 0 HAD1 HEM A 154 -8.094 7.450 -6.373 1.00 0.00 H new HETATM 0 HAD2 HEM A 154 -8.701 8.760 -5.380 1.00 0.00 H new HETATM 0 HHA HEM A 154 -5.971 7.116 -6.648 1.00 0.00 H new HETATM 0 HHB HEM A 154 -0.666 3.657 -5.744 1.00 0.00 H new HETATM 0 HHC HEM A 154 -1.775 3.719 0.523 1.00 0.00 H new HETATM 0 HHD HEM A 154 -7.221 6.825 -0.422 1.00 0.00 H new HETATM 0 HAB HEM A 154 0.704 3.037 0.157 1.00 0.00 H new HETATM 0 HAC HEM A 154 -7.012 6.829 1.705 1.00 0.00 H new HETATM 2541 C CMO A 155 -4.815 4.045 -2.918 1.00 0.00 C HETATM 2542 O CMO A 155 -5.469 3.151 -2.766 1.00 0.00 O