USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 126 THR OG1 : rot 180:sc= -0.0488 USER MOD Set 1.2: A 170 NDP O2D : rot 11:sc= -1.24! USER MOD Set 2.1: A 112 THR OG1 : rot 180:sc= 0.0572 USER MOD Set 2.2: A 159 GLN : amide:sc= 0.0567 X(o=0.11,f=0) USER MOD Set 3.1: A 46 TYR OH : rot 93:sc= 1.44 USER MOD Set 3.2: A 68 TYR OH : rot 146:sc= 0.693 USER MOD Set 4.1: A 63 THR OG1 : rot 41:sc= 0.553 USER MOD Set 4.2: A 65 GLN : amide:sc= 0.825 K(o=1.4,f=0.57) USER MOD Set 5.1: A 58 THR OG1 : rot 89:sc= 0.356 USER MOD Set 5.2: A 92 GLN : amide:sc= -0.109 X(o=0.25,f=0.35) USER MOD Set 6.1: A 15 LYS NZ :NH3+ -178:sc= 0.451 (180deg=-0.00132) USER MOD Set 6.2: A 18 HIS :FLIP no HE2:sc= -3.98! F(o=-5.2,f=-3.5!) USER MOD Single : A 1 THR N :NH3+ 177:sc= -1 (180deg=-1.07!) USER MOD Single : A 1 THR OG1 : rot -160:sc= -0.996 USER MOD Single : A 7 GLN :FLIP amide:sc= -4.67! C(o=-8.8!,f=-4.7!) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0514 X(o=-0.051,f=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0242 X(o=-0.024,f=0) USER MOD Single : A 34 THR OG1 : rot -74:sc= 0.608 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -141:sc= -3.7! (180deg=-5.49!) USER MOD Single : A 45 THR OG1 : rot -27:sc= -1.25 USER MOD Single : A 48 SER OG : rot -84:sc= -1.05 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -5.84 X(o=-5.8,f=-5.7!) USER MOD Single : A 64 HIS : no HE2:sc= -2.69 X(o=-2.7,f=-2.6!) USER MOD Single : A 69 GLN : amide:sc= 0.627 K(o=0.63,f=-0.4) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.596 F(o=-1.3,f=-0.6) USER MOD Single : A 77 HIS : no HD1:sc= -4.06 K(o=-4.1,f=-5.1!) USER MOD Single : A 85 TYR OH : rot 180:sc= -2.74! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.089) USER MOD Single : A 89 HIS : no HD1:sc= -0.589 K(o=-0.59,f=-1.4) USER MOD Single : A 101 GLN :FLIP amide:sc=-0.00682 F(o=-1.3!,f=-0.0068) USER MOD Single : A 104 THR OG1 : rot 68:sc= -4.73! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -45:sc= -1.29! USER MOD Single : A 121 SER OG : rot 180:sc= -0.322 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -147:sc= -1.52 (180deg=-5.4!) USER MOD Single : A 132 ASN : amide:sc= -0.393 X(o=-0.39,f=0) USER MOD Single : A 137 THR OG1 : rot 60:sc= -0.434 USER MOD Single : A 138 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.104) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 21:sc= 0.362! USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0569 USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 152 THR OG1 : rot 95:sc= 0.0778 USER MOD Single : A 153 HIS :FLIP no HD1:sc= -6.46! C(o=-7!,f=-6.5!) USER MOD Single : A 154 THR OG1 : rot 180:sc= -2.06! USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O3B : rot 159:sc= -0.0952 USER MOD Single : A 170 NDP O3D : rot -42:sc= 0.0116 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -4.921 8.440 4.712 1.00 0.00 N ATOM 2 CA THR A 1 -4.257 8.998 3.505 1.00 0.00 C ATOM 3 C THR A 1 -2.759 8.709 3.520 1.00 0.00 C ATOM 4 O THR A 1 -1.939 9.616 3.374 1.00 0.00 O ATOM 5 CB THR A 1 -4.507 10.507 3.465 1.00 0.00 C ATOM 6 OG1 THR A 1 -4.157 11.106 4.699 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.948 10.867 3.172 1.00 0.00 C ATOM 0 H1 THR A 1 -5.929 8.694 4.702 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.825 7.404 4.714 1.00 0.00 H new ATOM 0 H3 THR A 1 -4.474 8.830 5.566 1.00 0.00 H new ATOM 0 HA THR A 1 -4.673 8.527 2.615 1.00 0.00 H new ATOM 0 HB THR A 1 -3.883 10.882 2.653 1.00 0.00 H new ATOM 0 HG1 THR A 1 -4.602 11.976 4.778 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.056 11.951 3.158 1.00 0.00 H new ATOM 0 HG22 THR A 1 -6.234 10.461 2.202 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.592 10.448 3.945 1.00 0.00 H new ATOM 17 N ALA A 2 -2.409 7.440 3.701 1.00 0.00 N ATOM 18 CA ALA A 2 -1.011 7.029 3.739 1.00 0.00 C ATOM 19 C ALA A 2 -0.770 5.809 2.858 1.00 0.00 C ATOM 20 O ALA A 2 -1.587 4.889 2.820 1.00 0.00 O ATOM 21 CB ALA A 2 -0.587 6.736 5.170 1.00 0.00 C ATOM 0 H ALA A 2 -3.076 6.678 3.824 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.408 7.850 3.350 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.459 6.430 5.184 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.711 7.633 5.777 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.205 5.935 5.576 1.00 0.00 H new ATOM 27 N PHE A 3 0.358 5.805 2.153 1.00 0.00 N ATOM 28 CA PHE A 3 0.705 4.691 1.275 1.00 0.00 C ATOM 29 C PHE A 3 1.774 3.811 1.914 1.00 0.00 C ATOM 30 O PHE A 3 2.830 4.295 2.312 1.00 0.00 O ATOM 31 CB PHE A 3 1.212 5.209 -0.073 1.00 0.00 C ATOM 32 CG PHE A 3 0.203 6.003 -0.860 1.00 0.00 C ATOM 33 CD1 PHE A 3 -1.121 6.090 -0.453 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.587 6.665 -2.016 1.00 0.00 C ATOM 35 CE1 PHE A 3 -2.038 6.821 -1.184 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.325 7.396 -2.750 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.639 7.474 -2.334 1.00 0.00 C ATOM 0 H PHE A 3 1.046 6.558 2.172 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.195 4.097 1.117 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.090 5.831 0.099 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.536 4.360 -0.675 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.438 5.581 0.445 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.614 6.608 -2.347 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -3.065 6.882 -0.857 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -0.011 7.906 -3.649 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.354 8.045 -2.907 1.00 0.00 H new ATOM 47 N LEU A 4 1.496 2.515 2.009 1.00 0.00 N ATOM 48 CA LEU A 4 2.443 1.577 2.599 1.00 0.00 C ATOM 49 C LEU A 4 2.687 0.389 1.674 1.00 0.00 C ATOM 50 O LEU A 4 1.785 -0.411 1.426 1.00 0.00 O ATOM 51 CB LEU A 4 1.924 1.085 3.950 1.00 0.00 C ATOM 52 CG LEU A 4 2.837 0.096 4.672 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.199 0.721 4.935 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.195 -0.358 5.973 1.00 0.00 C ATOM 0 H LEU A 4 0.626 2.092 1.686 1.00 0.00 H new ATOM 0 HA LEU A 4 3.389 2.099 2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.765 1.948 4.597 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.952 0.615 3.800 1.00 0.00 H new ATOM 0 HG LEU A 4 2.980 -0.776 4.034 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.836 0.002 5.450 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.660 1.001 3.988 1.00 0.00 H new ATOM 0 HD13 LEU A 4 4.078 1.609 5.556 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.856 -1.063 6.478 1.00 0.00 H new ATOM 0 HD22 LEU A 4 2.026 0.506 6.616 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.243 -0.843 5.759 1.00 0.00 H new ATOM 66 N TRP A 5 3.912 0.277 1.168 1.00 0.00 N ATOM 67 CA TRP A 5 4.268 -0.819 0.274 1.00 0.00 C ATOM 68 C TRP A 5 5.782 -1.018 0.222 1.00 0.00 C ATOM 69 O TRP A 5 6.549 -0.124 0.583 1.00 0.00 O ATOM 70 CB TRP A 5 3.715 -0.559 -1.133 1.00 0.00 C ATOM 71 CG TRP A 5 4.566 0.357 -1.964 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.523 -0.010 -2.865 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.538 1.790 -1.968 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.091 1.105 -3.431 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.505 2.222 -2.897 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.791 2.750 -1.280 1.00 0.00 C ATOM 77 CZ2 TRP A 5 5.743 3.570 -3.152 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.028 4.088 -1.535 1.00 0.00 C ATOM 79 CH2 TRP A 5 4.997 4.487 -2.464 1.00 0.00 C ATOM 0 H TRP A 5 4.672 0.929 1.361 1.00 0.00 H new ATOM 0 HA TRP A 5 3.821 -1.733 0.665 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.610 -1.511 -1.653 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.716 -0.131 -1.046 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.794 -1.029 -3.099 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.829 1.102 -4.135 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.042 2.452 -0.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.490 3.880 -3.868 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.456 4.838 -1.009 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.159 5.540 -2.641 1.00 0.00 H new ATOM 90 N ALA A 6 6.204 -2.191 -0.237 1.00 0.00 N ATOM 91 CA ALA A 6 7.625 -2.504 -0.347 1.00 0.00 C ATOM 92 C ALA A 6 8.089 -2.392 -1.794 1.00 0.00 C ATOM 93 O ALA A 6 7.328 -2.673 -2.720 1.00 0.00 O ATOM 94 CB ALA A 6 7.904 -3.896 0.198 1.00 0.00 C ATOM 0 H ALA A 6 5.583 -2.941 -0.539 1.00 0.00 H new ATOM 0 HA ALA A 6 8.185 -1.781 0.247 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.968 -4.115 0.109 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.611 -3.942 1.247 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.334 -4.630 -0.371 1.00 0.00 H new ATOM 100 N GLN A 7 9.337 -1.972 -1.990 1.00 0.00 N ATOM 101 CA GLN A 7 9.879 -1.820 -3.336 1.00 0.00 C ATOM 102 C GLN A 7 11.375 -2.116 -3.373 1.00 0.00 C ATOM 103 O GLN A 7 12.066 -2.010 -2.360 1.00 0.00 O ATOM 104 CB GLN A 7 9.619 -0.402 -3.849 1.00 0.00 C ATOM 105 CG GLN A 7 9.936 0.680 -2.829 1.00 0.00 C ATOM 106 CD GLN A 7 8.707 1.461 -2.403 1.00 0.00 C ATOM 107 OE1 GLN A 7 7.927 0.890 -1.492 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.462 2.566 -2.886 1.00 0.00 N flip ATOM 0 H GLN A 7 9.986 -1.733 -1.240 1.00 0.00 H new ATOM 0 HA GLN A 7 9.376 -2.540 -3.981 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.217 -0.233 -4.744 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.573 -0.317 -4.144 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.394 0.223 -1.951 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.670 1.367 -3.250 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.088 2.968 -3.584 1.00 0.00 H new ATOM 0 HE22 GLN A 7 7.633 3.080 -2.589 1.00 0.00 H new ATOM 117 N ASP A 8 11.869 -2.484 -4.553 1.00 0.00 N ATOM 118 CA ASP A 8 13.283 -2.791 -4.733 1.00 0.00 C ATOM 119 C ASP A 8 14.047 -1.554 -5.203 1.00 0.00 C ATOM 120 O ASP A 8 13.523 -0.441 -5.166 1.00 0.00 O ATOM 121 CB ASP A 8 13.452 -3.933 -5.742 1.00 0.00 C ATOM 122 CG ASP A 8 13.046 -3.539 -7.152 1.00 0.00 C ATOM 123 OD1 ASP A 8 12.683 -2.363 -7.362 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.092 -4.409 -8.046 1.00 0.00 O ATOM 0 H ASP A 8 11.308 -2.577 -5.400 1.00 0.00 H new ATOM 0 HA ASP A 8 13.693 -3.105 -3.773 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.493 -4.257 -5.746 1.00 0.00 H new ATOM 0 HB3 ASP A 8 12.854 -4.786 -5.422 1.00 0.00 H new ATOM 129 N ARG A 9 15.283 -1.755 -5.650 1.00 0.00 N ATOM 130 CA ARG A 9 16.107 -0.651 -6.131 1.00 0.00 C ATOM 131 C ARG A 9 15.594 -0.134 -7.474 1.00 0.00 C ATOM 132 O ARG A 9 15.810 1.025 -7.828 1.00 0.00 O ATOM 133 CB ARG A 9 17.565 -1.095 -6.267 1.00 0.00 C ATOM 134 CG ARG A 9 18.304 -1.171 -4.941 1.00 0.00 C ATOM 135 CD ARG A 9 19.765 -0.777 -5.093 1.00 0.00 C ATOM 136 NE ARG A 9 19.932 0.670 -5.223 1.00 0.00 N ATOM 137 CZ ARG A 9 20.077 1.306 -6.385 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.075 0.633 -7.530 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.222 2.624 -6.402 1.00 0.00 N ATOM 0 H ARG A 9 15.735 -2.669 -5.689 1.00 0.00 H new ATOM 0 HA ARG A 9 16.047 0.158 -5.402 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.595 -2.073 -6.747 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.088 -0.401 -6.925 1.00 0.00 H new ATOM 0 HG2 ARG A 9 17.822 -0.514 -4.217 1.00 0.00 H new ATOM 0 HG3 ARG A 9 18.239 -2.184 -4.545 1.00 0.00 H new ATOM 0 HD2 ARG A 9 20.328 -1.131 -4.229 1.00 0.00 H new ATOM 0 HD3 ARG A 9 20.184 -1.270 -5.970 1.00 0.00 H new ATOM 0 HE ARG A 9 19.938 1.228 -4.369 1.00 0.00 H new ATOM 0 HH11 ARG A 9 19.962 -0.381 -7.526 1.00 0.00 H new ATOM 0 HH12 ARG A 9 20.187 1.130 -8.414 1.00 0.00 H new ATOM 0 HH21 ARG A 9 20.222 3.148 -5.527 1.00 0.00 H new ATOM 0 HH22 ARG A 9 20.333 3.113 -7.290 1.00 0.00 H new ATOM 153 N ASP A 10 14.913 -1.003 -8.216 1.00 0.00 N ATOM 154 CA ASP A 10 14.365 -0.641 -9.521 1.00 0.00 C ATOM 155 C ASP A 10 12.969 -0.029 -9.391 1.00 0.00 C ATOM 156 O ASP A 10 12.338 0.313 -10.391 1.00 0.00 O ATOM 157 CB ASP A 10 14.314 -1.870 -10.432 1.00 0.00 C ATOM 158 CG ASP A 10 15.429 -1.876 -11.459 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.605 -1.736 -11.061 1.00 0.00 O ATOM 160 OD2 ASP A 10 15.127 -2.021 -12.663 1.00 0.00 O ATOM 0 H ASP A 10 14.727 -1.966 -7.935 1.00 0.00 H new ATOM 0 HA ASP A 10 15.022 0.108 -9.962 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.379 -2.772 -9.824 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.352 -1.899 -10.944 1.00 0.00 H new ATOM 165 N GLY A 11 12.489 0.106 -8.156 1.00 0.00 N ATOM 166 CA GLY A 11 11.172 0.675 -7.932 1.00 0.00 C ATOM 167 C GLY A 11 10.072 -0.372 -7.932 1.00 0.00 C ATOM 168 O GLY A 11 8.927 -0.077 -7.589 1.00 0.00 O ATOM 0 H GLY A 11 12.988 -0.168 -7.310 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.166 1.202 -6.978 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.964 1.414 -8.706 1.00 0.00 H new ATOM 172 N LEU A 12 10.421 -1.599 -8.315 1.00 0.00 N ATOM 173 CA LEU A 12 9.463 -2.702 -8.357 1.00 0.00 C ATOM 174 C LEU A 12 8.604 -2.731 -7.097 1.00 0.00 C ATOM 175 O LEU A 12 8.917 -2.076 -6.103 1.00 0.00 O ATOM 176 CB LEU A 12 10.212 -4.032 -8.503 1.00 0.00 C ATOM 177 CG LEU A 12 9.384 -5.226 -8.999 1.00 0.00 C ATOM 178 CD1 LEU A 12 8.886 -4.983 -10.416 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.218 -6.496 -8.936 1.00 0.00 C ATOM 0 H LEU A 12 11.366 -1.855 -8.602 1.00 0.00 H new ATOM 0 HA LEU A 12 8.807 -2.553 -9.215 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.044 -3.883 -9.191 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.641 -4.291 -7.535 1.00 0.00 H new ATOM 0 HG LEU A 12 8.515 -5.343 -8.351 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.302 -5.841 -10.748 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.262 -4.090 -10.434 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.738 -4.844 -11.082 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.624 -7.339 -9.289 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.100 -6.384 -9.567 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.528 -6.677 -7.907 1.00 0.00 H new ATOM 191 N ILE A 13 7.540 -3.519 -7.140 1.00 0.00 N ATOM 192 CA ILE A 13 6.645 -3.677 -6.003 1.00 0.00 C ATOM 193 C ILE A 13 5.990 -5.052 -6.050 1.00 0.00 C ATOM 194 O ILE A 13 5.714 -5.660 -5.019 1.00 0.00 O ATOM 195 CB ILE A 13 5.560 -2.575 -5.944 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.560 -2.700 -7.099 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.204 -1.198 -5.954 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.119 -2.537 -6.662 1.00 0.00 C ATOM 0 H ILE A 13 7.273 -4.064 -7.960 1.00 0.00 H new ATOM 0 HA ILE A 13 7.247 -3.582 -5.100 1.00 0.00 H new ATOM 0 HB ILE A 13 5.009 -2.706 -5.013 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.791 -1.948 -7.854 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.681 -3.675 -7.572 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.428 -0.433 -5.912 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.860 -1.097 -5.090 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.786 -1.075 -6.868 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.463 -2.636 -7.527 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.872 -3.305 -5.929 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.983 -1.552 -6.215 1.00 0.00 H new ATOM 210 N GLY A 14 5.748 -5.542 -7.262 1.00 0.00 N ATOM 211 CA GLY A 14 5.131 -6.836 -7.421 1.00 0.00 C ATOM 212 C GLY A 14 5.661 -7.601 -8.617 1.00 0.00 C ATOM 213 O GLY A 14 6.500 -7.104 -9.368 1.00 0.00 O ATOM 0 H GLY A 14 5.970 -5.062 -8.134 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.295 -7.424 -6.518 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.054 -6.708 -7.526 1.00 0.00 H new ATOM 217 N LYS A 15 5.154 -8.813 -8.791 1.00 0.00 N ATOM 218 CA LYS A 15 5.549 -9.673 -9.900 1.00 0.00 C ATOM 219 C LYS A 15 4.312 -10.159 -10.654 1.00 0.00 C ATOM 220 O LYS A 15 4.172 -11.349 -10.940 1.00 0.00 O ATOM 221 CB LYS A 15 6.360 -10.868 -9.382 1.00 0.00 C ATOM 222 CG LYS A 15 5.522 -11.925 -8.671 1.00 0.00 C ATOM 223 CD LYS A 15 5.911 -12.067 -7.209 1.00 0.00 C ATOM 224 CE LYS A 15 4.771 -12.642 -6.384 1.00 0.00 C ATOM 225 NZ LYS A 15 4.436 -14.035 -6.792 1.00 0.00 N ATOM 0 H LYS A 15 4.459 -9.228 -8.170 1.00 0.00 H new ATOM 0 HA LYS A 15 6.174 -9.099 -10.585 1.00 0.00 H new ATOM 0 HB2 LYS A 15 6.878 -11.333 -10.221 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.126 -10.505 -8.697 1.00 0.00 H new ATOM 0 HG2 LYS A 15 4.467 -11.660 -8.742 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.644 -12.884 -9.174 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.785 -12.713 -7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 15 6.195 -11.093 -6.810 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.044 -12.629 -5.329 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.890 -12.010 -6.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.632 -14.378 -6.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 4.183 -14.050 -7.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 5.259 -14.651 -6.632 1.00 0.00 H new ATOM 239 N ASP A 16 3.409 -9.228 -10.953 1.00 0.00 N ATOM 240 CA ASP A 16 2.164 -9.545 -11.653 1.00 0.00 C ATOM 241 C ASP A 16 1.147 -10.133 -10.678 1.00 0.00 C ATOM 242 O ASP A 16 0.296 -10.938 -11.056 1.00 0.00 O ATOM 243 CB ASP A 16 2.411 -10.521 -12.809 1.00 0.00 C ATOM 244 CG ASP A 16 3.660 -10.179 -13.599 1.00 0.00 C ATOM 245 OD1 ASP A 16 4.134 -9.029 -13.492 1.00 0.00 O ATOM 246 OD2 ASP A 16 4.163 -11.063 -14.325 1.00 0.00 O ATOM 0 H ASP A 16 3.517 -8.241 -10.720 1.00 0.00 H new ATOM 0 HA ASP A 16 1.766 -8.620 -12.070 1.00 0.00 H new ATOM 0 HB2 ASP A 16 2.500 -11.533 -12.414 1.00 0.00 H new ATOM 0 HB3 ASP A 16 1.549 -10.515 -13.476 1.00 0.00 H new ATOM 251 N GLY A 17 1.250 -9.718 -9.418 1.00 0.00 N ATOM 252 CA GLY A 17 0.347 -10.197 -8.388 1.00 0.00 C ATOM 253 C GLY A 17 0.675 -9.609 -7.027 1.00 0.00 C ATOM 254 O GLY A 17 -0.215 -9.159 -6.304 1.00 0.00 O ATOM 0 H GLY A 17 1.950 -9.052 -9.091 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.678 -9.941 -8.656 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.400 -11.284 -8.336 1.00 0.00 H new ATOM 258 N HIS A 18 1.960 -9.612 -6.683 1.00 0.00 N ATOM 259 CA HIS A 18 2.422 -9.075 -5.407 1.00 0.00 C ATOM 260 C HIS A 18 3.946 -9.078 -5.348 1.00 0.00 C ATOM 261 O HIS A 18 4.610 -9.378 -6.340 1.00 0.00 O ATOM 262 CB HIS A 18 1.846 -9.888 -4.245 1.00 0.00 C ATOM 263 CG HIS A 18 2.329 -11.304 -4.203 1.00 0.00 C ATOM 264 ND1 HIS A 18 3.344 -11.875 -3.511 1.00 0.00 N flip ATOM 265 CD2 HIS A 18 1.748 -12.320 -4.934 1.00 0.00 C flip ATOM 266 CE1 HIS A 18 3.356 -13.210 -3.832 1.00 0.00 C flip ATOM 267 NE2 HIS A 18 2.384 -13.453 -4.691 1.00 0.00 N flip ATOM 0 H HIS A 18 2.704 -9.983 -7.274 1.00 0.00 H new ATOM 0 HA HIS A 18 2.072 -8.046 -5.320 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.105 -9.397 -3.307 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.758 -9.887 -4.316 1.00 0.00 H new ATOM 0 HD1 HIS A 18 3.981 -11.401 -2.871 1.00 0.00 H new ATOM 0 HD2 HIS A 18 0.906 -12.207 -5.600 1.00 0.00 H new ATOM 0 HE1 HIS A 18 4.049 -13.942 -3.444 1.00 0.00 H new ATOM 276 N LEU A 19 4.498 -8.738 -4.187 1.00 0.00 N ATOM 277 CA LEU A 19 5.947 -8.694 -4.018 1.00 0.00 C ATOM 278 C LEU A 19 6.563 -10.087 -4.169 1.00 0.00 C ATOM 279 O LEU A 19 6.126 -11.041 -3.525 1.00 0.00 O ATOM 280 CB LEU A 19 6.307 -8.110 -2.649 1.00 0.00 C ATOM 281 CG LEU A 19 5.568 -8.729 -1.460 1.00 0.00 C ATOM 282 CD1 LEU A 19 6.454 -9.737 -0.745 1.00 0.00 C ATOM 283 CD2 LEU A 19 5.109 -7.644 -0.496 1.00 0.00 C ATOM 0 H LEU A 19 3.967 -8.490 -3.352 1.00 0.00 H new ATOM 0 HA LEU A 19 6.355 -8.052 -4.799 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.379 -8.229 -2.492 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.104 -7.039 -2.664 1.00 0.00 H new ATOM 0 HG LEU A 19 4.689 -9.252 -1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.911 -10.166 0.097 1.00 0.00 H new ATOM 0 HD12 LEU A 19 6.735 -10.530 -1.438 1.00 0.00 H new ATOM 0 HD13 LEU A 19 7.352 -9.238 -0.381 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.585 -8.101 0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.975 -7.094 -0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.437 -6.959 -1.013 1.00 0.00 H new ATOM 295 N PRO A 20 7.590 -10.223 -5.032 1.00 0.00 N ATOM 296 CA PRO A 20 8.264 -11.502 -5.273 1.00 0.00 C ATOM 297 C PRO A 20 9.300 -11.840 -4.204 1.00 0.00 C ATOM 298 O PRO A 20 9.828 -12.952 -4.171 1.00 0.00 O ATOM 299 CB PRO A 20 8.953 -11.272 -6.616 1.00 0.00 C ATOM 300 CG PRO A 20 9.274 -9.818 -6.622 1.00 0.00 C ATOM 301 CD PRO A 20 8.172 -9.138 -5.849 1.00 0.00 C ATOM 0 HA PRO A 20 7.565 -12.338 -5.257 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.854 -11.878 -6.710 1.00 0.00 H new ATOM 0 HB3 PRO A 20 8.301 -11.539 -7.448 1.00 0.00 H new ATOM 0 HG2 PRO A 20 10.244 -9.632 -6.161 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.327 -9.436 -7.641 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.560 -8.332 -5.226 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.430 -8.697 -6.515 1.00 0.00 H new ATOM 309 N TRP A 21 9.596 -10.877 -3.339 1.00 0.00 N ATOM 310 CA TRP A 21 10.579 -11.080 -2.281 1.00 0.00 C ATOM 311 C TRP A 21 9.911 -11.546 -0.993 1.00 0.00 C ATOM 312 O TRP A 21 8.842 -11.059 -0.624 1.00 0.00 O ATOM 313 CB TRP A 21 11.355 -9.787 -2.027 1.00 0.00 C ATOM 314 CG TRP A 21 10.478 -8.576 -1.944 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.585 -8.280 -0.956 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.402 -7.504 -2.889 1.00 0.00 C ATOM 317 NE1 TRP A 21 8.964 -7.084 -1.223 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.447 -6.588 -2.406 1.00 0.00 C ATOM 319 CE3 TRP A 21 11.051 -7.226 -4.096 1.00 0.00 C ATOM 320 CZ2 TRP A 21 9.127 -5.418 -3.088 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.731 -6.064 -4.772 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.777 -5.172 -4.267 1.00 0.00 C ATOM 0 H TRP A 21 9.171 -9.950 -3.349 1.00 0.00 H new ATOM 0 HA TRP A 21 11.271 -11.856 -2.608 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.916 -9.885 -1.098 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.083 -9.646 -2.826 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.394 -8.896 -0.090 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.259 -6.638 -0.637 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.789 -7.907 -4.493 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.392 -4.728 -2.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.225 -5.840 -5.706 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.550 -4.272 -4.819 1.00 0.00 H new ATOM 333 N HIS A 22 10.552 -12.487 -0.309 1.00 0.00 N ATOM 334 CA HIS A 22 10.023 -13.014 0.942 1.00 0.00 C ATOM 335 C HIS A 22 10.414 -12.111 2.106 1.00 0.00 C ATOM 336 O HIS A 22 11.441 -12.322 2.752 1.00 0.00 O ATOM 337 CB HIS A 22 10.537 -14.436 1.180 1.00 0.00 C ATOM 338 CG HIS A 22 9.450 -15.465 1.220 1.00 0.00 C ATOM 339 ND1 HIS A 22 8.947 -15.984 2.395 1.00 0.00 N ATOM 340 CD2 HIS A 22 8.767 -16.072 0.220 1.00 0.00 C ATOM 341 CE1 HIS A 22 8.003 -16.866 2.116 1.00 0.00 C ATOM 342 NE2 HIS A 22 7.875 -16.937 0.804 1.00 0.00 N ATOM 0 H HIS A 22 11.438 -12.900 -0.600 1.00 0.00 H new ATOM 0 HA HIS A 22 8.936 -13.043 0.873 1.00 0.00 H new ATOM 0 HB2 HIS A 22 11.243 -14.695 0.391 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.086 -14.463 2.121 1.00 0.00 H new ATOM 0 HD2 HIS A 22 8.899 -15.906 -0.839 1.00 0.00 H new ATOM 0 HE1 HIS A 22 7.433 -17.432 2.838 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.219 -17.538 0.305 1.00 0.00 H new ATOM 351 N LEU A 23 9.593 -11.098 2.360 1.00 0.00 N ATOM 352 CA LEU A 23 9.855 -10.154 3.439 1.00 0.00 C ATOM 353 C LEU A 23 8.948 -10.423 4.639 1.00 0.00 C ATOM 354 O LEU A 23 7.861 -9.856 4.745 1.00 0.00 O ATOM 355 CB LEU A 23 9.657 -8.720 2.942 1.00 0.00 C ATOM 356 CG LEU A 23 10.947 -7.960 2.633 1.00 0.00 C ATOM 357 CD1 LEU A 23 11.643 -8.554 1.416 1.00 0.00 C ATOM 358 CD2 LEU A 23 10.654 -6.482 2.416 1.00 0.00 C ATOM 0 H LEU A 23 8.740 -10.910 1.833 1.00 0.00 H new ATOM 0 HA LEU A 23 10.889 -10.284 3.759 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.043 -8.745 2.042 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.097 -8.165 3.694 1.00 0.00 H new ATOM 0 HG LEU A 23 11.616 -8.057 3.488 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.559 -7.999 1.213 1.00 0.00 H new ATOM 0 HD12 LEU A 23 11.888 -9.598 1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 23 10.982 -8.491 0.552 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.583 -5.955 2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 23 9.965 -6.367 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.204 -6.064 3.316 1.00 0.00 H new ATOM 370 N PRO A 24 9.388 -11.294 5.564 1.00 0.00 N ATOM 371 CA PRO A 24 8.612 -11.631 6.761 1.00 0.00 C ATOM 372 C PRO A 24 8.508 -10.459 7.732 1.00 0.00 C ATOM 373 O PRO A 24 7.550 -10.357 8.499 1.00 0.00 O ATOM 374 CB PRO A 24 9.406 -12.778 7.392 1.00 0.00 C ATOM 375 CG PRO A 24 10.799 -12.594 6.899 1.00 0.00 C ATOM 376 CD PRO A 24 10.676 -12.012 5.518 1.00 0.00 C ATOM 0 HA PRO A 24 7.582 -11.893 6.517 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.363 -12.737 8.480 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.006 -13.747 7.094 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.360 -11.928 7.555 1.00 0.00 H new ATOM 0 HG3 PRO A 24 11.334 -13.544 6.876 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.503 -11.340 5.290 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.676 -12.788 4.753 1.00 0.00 H new ATOM 384 N ASP A 25 9.502 -9.578 7.693 1.00 0.00 N ATOM 385 CA ASP A 25 9.533 -8.415 8.563 1.00 0.00 C ATOM 386 C ASP A 25 8.453 -7.408 8.178 1.00 0.00 C ATOM 387 O ASP A 25 7.949 -6.671 9.026 1.00 0.00 O ATOM 388 CB ASP A 25 10.909 -7.757 8.495 1.00 0.00 C ATOM 389 CG ASP A 25 11.386 -7.548 7.070 1.00 0.00 C ATOM 390 OD1 ASP A 25 11.457 -8.541 6.316 1.00 0.00 O ATOM 391 OD2 ASP A 25 11.689 -6.392 6.709 1.00 0.00 O ATOM 0 H ASP A 25 10.300 -9.651 7.063 1.00 0.00 H new ATOM 0 HA ASP A 25 9.337 -8.746 9.583 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.874 -6.795 9.007 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.630 -8.376 9.029 1.00 0.00 H new ATOM 396 N ASP A 26 8.103 -7.379 6.896 1.00 0.00 N ATOM 397 CA ASP A 26 7.085 -6.457 6.405 1.00 0.00 C ATOM 398 C ASP A 26 5.685 -6.943 6.767 1.00 0.00 C ATOM 399 O ASP A 26 4.858 -6.171 7.253 1.00 0.00 O ATOM 400 CB ASP A 26 7.204 -6.290 4.890 1.00 0.00 C ATOM 401 CG ASP A 26 8.159 -5.177 4.506 1.00 0.00 C ATOM 402 OD1 ASP A 26 9.357 -5.278 4.846 1.00 0.00 O ATOM 403 OD2 ASP A 26 7.708 -4.205 3.865 1.00 0.00 O ATOM 0 H ASP A 26 8.508 -7.982 6.180 1.00 0.00 H new ATOM 0 HA ASP A 26 7.248 -5.491 6.884 1.00 0.00 H new ATOM 0 HB2 ASP A 26 7.546 -7.227 4.449 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.219 -6.081 4.471 1.00 0.00 H new ATOM 408 N LEU A 27 5.426 -8.226 6.532 1.00 0.00 N ATOM 409 CA LEU A 27 4.125 -8.812 6.839 1.00 0.00 C ATOM 410 C LEU A 27 3.797 -8.655 8.319 1.00 0.00 C ATOM 411 O LEU A 27 2.786 -8.054 8.682 1.00 0.00 O ATOM 412 CB LEU A 27 4.103 -10.293 6.458 1.00 0.00 C ATOM 413 CG LEU A 27 4.672 -10.619 5.075 1.00 0.00 C ATOM 414 CD1 LEU A 27 5.466 -11.916 5.116 1.00 0.00 C ATOM 415 CD2 LEU A 27 3.554 -10.707 4.049 1.00 0.00 C ATOM 0 H LEU A 27 6.099 -8.879 6.130 1.00 0.00 H new ATOM 0 HA LEU A 27 3.371 -8.283 6.256 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.665 -10.852 7.206 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.073 -10.648 6.502 1.00 0.00 H new ATOM 0 HG LEU A 27 5.347 -9.815 4.781 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.863 -12.131 4.124 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.290 -11.816 5.822 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.815 -12.731 5.431 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.975 -10.939 3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.855 -11.492 4.339 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.029 -9.753 4.000 1.00 0.00 H new ATOM 427 N HIS A 28 4.661 -9.200 9.170 1.00 0.00 N ATOM 428 CA HIS A 28 4.467 -9.123 10.615 1.00 0.00 C ATOM 429 C HIS A 28 4.248 -7.680 11.064 1.00 0.00 C ATOM 430 O HIS A 28 3.395 -7.404 11.908 1.00 0.00 O ATOM 431 CB HIS A 28 5.675 -9.714 11.344 1.00 0.00 C ATOM 432 CG HIS A 28 5.377 -10.143 12.747 1.00 0.00 C ATOM 433 ND1 HIS A 28 6.309 -10.747 13.565 1.00 0.00 N ATOM 434 CD2 HIS A 28 4.241 -10.051 13.480 1.00 0.00 C ATOM 435 CE1 HIS A 28 5.760 -11.009 14.738 1.00 0.00 C ATOM 436 NE2 HIS A 28 4.507 -10.596 14.712 1.00 0.00 N ATOM 0 H HIS A 28 5.503 -9.700 8.884 1.00 0.00 H new ATOM 0 HA HIS A 28 3.577 -9.701 10.865 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.045 -10.571 10.781 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.476 -8.975 11.361 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.302 -9.628 13.156 1.00 0.00 H new ATOM 0 HE1 HIS A 28 6.253 -11.481 15.575 1.00 0.00 H new ATOM 0 HE2 HIS A 28 3.843 -10.670 15.483 1.00 0.00 H new ATOM 445 N TYR A 29 5.023 -6.764 10.493 1.00 0.00 N ATOM 446 CA TYR A 29 4.913 -5.351 10.834 1.00 0.00 C ATOM 447 C TYR A 29 3.628 -4.754 10.270 1.00 0.00 C ATOM 448 O TYR A 29 2.998 -3.905 10.901 1.00 0.00 O ATOM 449 CB TYR A 29 6.123 -4.580 10.302 1.00 0.00 C ATOM 450 CG TYR A 29 6.184 -3.146 10.775 1.00 0.00 C ATOM 451 CD1 TYR A 29 6.011 -2.828 12.116 1.00 0.00 C ATOM 452 CD2 TYR A 29 6.417 -2.109 9.880 1.00 0.00 C ATOM 453 CE1 TYR A 29 6.068 -1.518 12.552 1.00 0.00 C ATOM 454 CE2 TYR A 29 6.475 -0.796 10.308 1.00 0.00 C ATOM 455 CZ TYR A 29 6.300 -0.506 11.645 1.00 0.00 C ATOM 456 OH TYR A 29 6.357 0.801 12.075 1.00 0.00 O ATOM 0 H TYR A 29 5.734 -6.975 9.792 1.00 0.00 H new ATOM 0 HA TYR A 29 4.886 -5.266 11.920 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.034 -5.094 10.609 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.101 -4.594 9.212 1.00 0.00 H new ATOM 0 HD1 TYR A 29 5.829 -3.618 12.830 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.555 -2.333 8.832 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.931 -1.288 13.598 1.00 0.00 H new ATOM 0 HE2 TYR A 29 6.656 -0.001 9.599 1.00 0.00 H new ATOM 0 HH TYR A 29 6.529 1.390 11.311 1.00 0.00 H new ATOM 466 N PHE A 30 3.243 -5.205 9.081 1.00 0.00 N ATOM 467 CA PHE A 30 2.031 -4.715 8.434 1.00 0.00 C ATOM 468 C PHE A 30 0.804 -4.992 9.297 1.00 0.00 C ATOM 469 O PHE A 30 0.049 -4.080 9.632 1.00 0.00 O ATOM 470 CB PHE A 30 1.861 -5.369 7.061 1.00 0.00 C ATOM 471 CG PHE A 30 1.020 -4.564 6.111 1.00 0.00 C ATOM 472 CD1 PHE A 30 1.562 -3.488 5.427 1.00 0.00 C ATOM 473 CD2 PHE A 30 -0.312 -4.884 5.904 1.00 0.00 C ATOM 474 CE1 PHE A 30 0.791 -2.745 4.553 1.00 0.00 C ATOM 475 CE2 PHE A 30 -1.088 -4.145 5.031 1.00 0.00 C ATOM 476 CZ PHE A 30 -0.536 -3.074 4.355 1.00 0.00 C ATOM 0 H PHE A 30 3.752 -5.909 8.546 1.00 0.00 H new ATOM 0 HA PHE A 30 2.127 -3.637 8.306 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.845 -5.526 6.618 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.409 -6.352 7.190 1.00 0.00 H new ATOM 0 HD1 PHE A 30 2.599 -3.227 5.578 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.749 -5.720 6.430 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.225 -1.909 4.026 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.125 -4.405 4.877 1.00 0.00 H new ATOM 0 HZ PHE A 30 -1.141 -2.495 3.673 1.00 0.00 H new ATOM 486 N ARG A 31 0.611 -6.258 9.650 1.00 0.00 N ATOM 487 CA ARG A 31 -0.524 -6.661 10.471 1.00 0.00 C ATOM 488 C ARG A 31 -0.482 -5.988 11.840 1.00 0.00 C ATOM 489 O ARG A 31 -1.514 -5.815 12.488 1.00 0.00 O ATOM 490 CB ARG A 31 -0.539 -8.182 10.640 1.00 0.00 C ATOM 491 CG ARG A 31 -1.839 -8.719 11.217 1.00 0.00 C ATOM 492 CD ARG A 31 -2.911 -8.863 10.148 1.00 0.00 C ATOM 493 NE ARG A 31 -2.509 -9.782 9.085 1.00 0.00 N ATOM 494 CZ ARG A 31 -1.955 -9.399 7.934 1.00 0.00 C ATOM 495 NH1 ARG A 31 -1.718 -8.115 7.693 1.00 0.00 N ATOM 496 NH2 ARG A 31 -1.633 -10.306 7.022 1.00 0.00 N ATOM 0 H ARG A 31 1.228 -7.024 9.380 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.435 -6.345 9.963 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.362 -8.648 9.671 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.285 -8.475 11.290 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.658 -9.687 11.683 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.194 -8.049 12.000 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.833 -9.221 10.606 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.127 -7.885 9.718 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.662 -10.780 9.233 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.960 -7.412 8.391 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -1.294 -7.832 6.810 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.809 -11.295 7.201 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.209 -10.015 6.141 1.00 0.00 H new ATOM 510 N ALA A 32 0.716 -5.614 12.278 1.00 0.00 N ATOM 511 CA ALA A 32 0.888 -4.966 13.573 1.00 0.00 C ATOM 512 C ALA A 32 0.445 -3.506 13.528 1.00 0.00 C ATOM 513 O ALA A 32 -0.145 -2.997 14.481 1.00 0.00 O ATOM 514 CB ALA A 32 2.339 -5.063 14.019 1.00 0.00 C ATOM 0 H ALA A 32 1.582 -5.749 11.755 1.00 0.00 H new ATOM 0 HA ALA A 32 0.257 -5.484 14.295 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.455 -4.576 14.987 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.624 -6.112 14.104 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.979 -4.571 13.286 1.00 0.00 H new ATOM 520 N GLN A 33 0.737 -2.836 12.418 1.00 0.00 N ATOM 521 CA GLN A 33 0.372 -1.434 12.254 1.00 0.00 C ATOM 522 C GLN A 33 -1.057 -1.289 11.735 1.00 0.00 C ATOM 523 O GLN A 33 -1.711 -0.274 11.971 1.00 0.00 O ATOM 524 CB GLN A 33 1.349 -0.741 11.300 1.00 0.00 C ATOM 525 CG GLN A 33 2.198 0.327 11.969 1.00 0.00 C ATOM 526 CD GLN A 33 2.456 1.516 11.065 1.00 0.00 C ATOM 527 OE1 GLN A 33 2.313 2.668 11.478 1.00 0.00 O ATOM 528 NE2 GLN A 33 2.839 1.243 9.823 1.00 0.00 N ATOM 0 H GLN A 33 1.225 -3.241 11.619 1.00 0.00 H new ATOM 0 HA GLN A 33 0.426 -0.957 13.233 1.00 0.00 H new ATOM 0 HB2 GLN A 33 2.005 -1.491 10.858 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.787 -0.288 10.484 1.00 0.00 H new ATOM 0 HG2 GLN A 33 1.699 0.667 12.877 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.150 -0.108 12.272 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.945 0.274 9.523 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.027 2.003 9.169 1.00 0.00 H new ATOM 537 N THR A 34 -1.537 -2.306 11.026 1.00 0.00 N ATOM 538 CA THR A 34 -2.887 -2.280 10.473 1.00 0.00 C ATOM 539 C THR A 34 -3.896 -2.903 11.435 1.00 0.00 C ATOM 540 O THR A 34 -4.872 -3.520 11.008 1.00 0.00 O ATOM 541 CB THR A 34 -2.925 -3.016 9.134 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.546 -4.372 9.296 1.00 0.00 O ATOM 543 CG2 THR A 34 -2.015 -2.407 8.089 1.00 0.00 C ATOM 0 H THR A 34 -1.013 -3.157 10.821 1.00 0.00 H new ATOM 0 HA THR A 34 -3.163 -1.237 10.320 1.00 0.00 H new ATOM 0 HB THR A 34 -3.955 -2.932 8.788 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.577 -4.427 9.433 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.091 -2.978 7.164 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.313 -1.375 7.904 1.00 0.00 H new ATOM 0 HG23 THR A 34 -0.985 -2.429 8.446 1.00 0.00 H new ATOM 551 N VAL A 35 -3.662 -2.736 12.733 1.00 0.00 N ATOM 552 CA VAL A 35 -4.559 -3.283 13.745 1.00 0.00 C ATOM 553 C VAL A 35 -5.638 -2.275 14.122 1.00 0.00 C ATOM 554 O VAL A 35 -5.351 -1.232 14.709 1.00 0.00 O ATOM 555 CB VAL A 35 -3.794 -3.698 15.015 1.00 0.00 C ATOM 556 CG1 VAL A 35 -4.704 -4.471 15.957 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.566 -4.520 14.655 1.00 0.00 C ATOM 0 H VAL A 35 -2.861 -2.228 13.108 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.024 -4.167 13.309 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.461 -2.795 15.527 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.146 -4.756 16.849 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.549 -3.844 16.242 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.070 -5.367 15.456 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.038 -4.804 15.566 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.874 -5.418 14.119 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.905 -3.928 14.022 1.00 0.00 H new ATOM 567 N GLY A 36 -6.882 -2.594 13.780 1.00 0.00 N ATOM 568 CA GLY A 36 -7.987 -1.706 14.090 1.00 0.00 C ATOM 569 C GLY A 36 -8.070 -0.526 13.139 1.00 0.00 C ATOM 570 O GLY A 36 -8.715 0.478 13.443 1.00 0.00 O ATOM 0 H GLY A 36 -7.145 -3.451 13.294 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.921 -2.266 14.051 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.878 -1.339 15.111 1.00 0.00 H new ATOM 574 N LYS A 37 -7.419 -0.645 11.986 1.00 0.00 N ATOM 575 CA LYS A 37 -7.426 0.422 10.991 1.00 0.00 C ATOM 576 C LYS A 37 -8.133 -0.030 9.717 1.00 0.00 C ATOM 577 O LYS A 37 -8.745 -1.097 9.682 1.00 0.00 O ATOM 578 CB LYS A 37 -5.995 0.858 10.670 1.00 0.00 C ATOM 579 CG LYS A 37 -5.169 1.193 11.901 1.00 0.00 C ATOM 580 CD LYS A 37 -3.872 1.892 11.529 1.00 0.00 C ATOM 581 CE LYS A 37 -3.104 2.336 12.764 1.00 0.00 C ATOM 582 NZ LYS A 37 -2.266 3.537 12.495 1.00 0.00 N ATOM 0 H LYS A 37 -6.880 -1.469 11.718 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.970 1.270 11.406 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.498 0.062 10.115 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.028 1.730 10.017 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.749 1.831 12.567 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -4.946 0.278 12.450 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.252 1.219 10.936 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.090 2.758 10.904 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.806 2.556 13.568 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -2.469 1.520 13.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.759 3.808 13.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.579 3.320 11.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.874 4.324 12.190 1.00 0.00 H new ATOM 596 N ILE A 38 -8.041 0.786 8.672 1.00 0.00 N ATOM 597 CA ILE A 38 -8.670 0.464 7.394 1.00 0.00 C ATOM 598 C ILE A 38 -7.648 0.495 6.263 1.00 0.00 C ATOM 599 O ILE A 38 -7.044 1.531 5.986 1.00 0.00 O ATOM 600 CB ILE A 38 -9.835 1.427 7.042 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.081 2.455 8.153 1.00 0.00 C ATOM 602 CG2 ILE A 38 -11.109 0.637 6.770 1.00 0.00 C ATOM 603 CD1 ILE A 38 -10.676 3.754 7.650 1.00 0.00 C ATOM 0 H ILE A 38 -7.538 1.673 8.684 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.079 -0.541 7.503 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.549 1.972 6.143 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.750 2.022 8.897 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.138 2.667 8.657 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.918 1.325 6.524 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.944 -0.043 5.934 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.377 0.063 7.657 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -10.824 4.435 8.488 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -9.998 4.209 6.928 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.635 3.554 7.172 1.00 0.00 H new ATOM 615 N MET A 39 -7.460 -0.648 5.612 1.00 0.00 N ATOM 616 CA MET A 39 -6.510 -0.750 4.510 1.00 0.00 C ATOM 617 C MET A 39 -7.233 -0.860 3.171 1.00 0.00 C ATOM 618 O MET A 39 -8.071 -1.742 2.976 1.00 0.00 O ATOM 619 CB MET A 39 -5.592 -1.959 4.706 1.00 0.00 C ATOM 620 CG MET A 39 -4.551 -2.120 3.609 1.00 0.00 C ATOM 621 SD MET A 39 -5.175 -3.038 2.187 1.00 0.00 S ATOM 622 CE MET A 39 -5.738 -4.544 2.975 1.00 0.00 C ATOM 0 H MET A 39 -7.952 -1.515 5.828 1.00 0.00 H new ATOM 0 HA MET A 39 -5.907 0.158 4.503 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.084 -1.867 5.666 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.200 -2.862 4.753 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.218 -1.135 3.283 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.679 -2.634 4.014 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.501 -5.398 2.340 1.00 0.00 H new ATOM 0 HE2 MET A 39 -5.240 -4.659 3.938 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.816 -4.494 3.128 1.00 0.00 H new ATOM 632 N VAL A 40 -6.896 0.035 2.248 1.00 0.00 N ATOM 633 CA VAL A 40 -7.502 0.034 0.922 1.00 0.00 C ATOM 634 C VAL A 40 -6.711 -0.859 -0.027 1.00 0.00 C ATOM 635 O VAL A 40 -5.482 -0.792 -0.075 1.00 0.00 O ATOM 636 CB VAL A 40 -7.575 1.456 0.333 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.345 1.454 -0.977 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.206 2.416 1.330 1.00 0.00 C ATOM 0 H VAL A 40 -6.205 0.771 2.395 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.516 -0.352 1.031 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.560 1.796 0.129 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.385 2.467 -1.377 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.844 0.801 -1.692 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.358 1.092 -0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.249 3.415 0.896 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.215 2.081 1.569 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.607 2.441 2.240 1.00 0.00 H new ATOM 648 N VAL A 41 -7.417 -1.701 -0.773 1.00 0.00 N ATOM 649 CA VAL A 41 -6.770 -2.613 -1.709 1.00 0.00 C ATOM 650 C VAL A 41 -7.376 -2.500 -3.110 1.00 0.00 C ATOM 651 O VAL A 41 -8.586 -2.337 -3.261 1.00 0.00 O ATOM 652 CB VAL A 41 -6.859 -4.074 -1.202 1.00 0.00 C ATOM 653 CG1 VAL A 41 -7.996 -4.836 -1.873 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.531 -4.792 -1.399 1.00 0.00 C ATOM 0 H VAL A 41 -8.434 -1.771 -0.748 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.720 -2.327 -1.772 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.078 -4.040 -0.135 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -8.025 -5.856 -1.491 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.943 -4.341 -1.658 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.834 -4.857 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.614 -5.817 -1.037 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.276 -4.801 -2.459 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.751 -4.273 -0.843 1.00 0.00 H new ATOM 664 N GLY A 42 -6.524 -2.592 -4.128 1.00 0.00 N ATOM 665 CA GLY A 42 -6.992 -2.501 -5.501 1.00 0.00 C ATOM 666 C GLY A 42 -7.715 -3.757 -5.949 1.00 0.00 C ATOM 667 O GLY A 42 -7.664 -4.783 -5.270 1.00 0.00 O ATOM 0 H GLY A 42 -5.518 -2.728 -4.027 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.661 -1.646 -5.598 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.143 -2.319 -6.160 1.00 0.00 H new ATOM 671 N ARG A 43 -8.395 -3.679 -7.091 1.00 0.00 N ATOM 672 CA ARG A 43 -9.133 -4.820 -7.618 1.00 0.00 C ATOM 673 C ARG A 43 -8.237 -6.053 -7.736 1.00 0.00 C ATOM 674 O ARG A 43 -8.478 -7.077 -7.092 1.00 0.00 O ATOM 675 CB ARG A 43 -9.738 -4.484 -8.983 1.00 0.00 C ATOM 676 CG ARG A 43 -8.933 -3.478 -9.792 1.00 0.00 C ATOM 677 CD ARG A 43 -8.964 -3.807 -11.274 1.00 0.00 C ATOM 678 NE ARG A 43 -10.327 -3.816 -11.791 1.00 0.00 N ATOM 679 CZ ARG A 43 -10.664 -4.280 -12.992 1.00 0.00 C ATOM 680 NH1 ARG A 43 -9.738 -4.777 -13.802 1.00 0.00 N ATOM 681 NH2 ARG A 43 -11.931 -4.249 -13.383 1.00 0.00 N ATOM 0 H ARG A 43 -8.449 -2.839 -7.667 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.937 -5.046 -6.917 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -9.835 -5.403 -9.561 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.744 -4.092 -8.835 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.333 -2.477 -9.632 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -7.901 -3.469 -9.441 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.371 -3.076 -11.823 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.504 -4.781 -11.441 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.067 -3.444 -11.196 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -8.763 -4.805 -13.505 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.002 -5.131 -14.721 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.647 -3.870 -12.763 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.190 -4.605 -14.303 1.00 0.00 H new ATOM 695 N ARG A 44 -7.198 -5.947 -8.554 1.00 0.00 N ATOM 696 CA ARG A 44 -6.267 -7.050 -8.744 1.00 0.00 C ATOM 697 C ARG A 44 -5.541 -7.374 -7.442 1.00 0.00 C ATOM 698 O ARG A 44 -4.954 -8.445 -7.299 1.00 0.00 O ATOM 699 CB ARG A 44 -5.252 -6.706 -9.836 1.00 0.00 C ATOM 700 CG ARG A 44 -5.877 -6.524 -11.210 1.00 0.00 C ATOM 701 CD ARG A 44 -6.684 -7.744 -11.622 1.00 0.00 C ATOM 702 NE ARG A 44 -8.071 -7.660 -11.171 1.00 0.00 N ATOM 703 CZ ARG A 44 -9.063 -8.385 -11.684 1.00 0.00 C ATOM 704 NH1 ARG A 44 -8.825 -9.249 -12.664 1.00 0.00 N ATOM 705 NH2 ARG A 44 -10.296 -8.247 -11.216 1.00 0.00 N ATOM 0 H ARG A 44 -6.980 -5.110 -9.095 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.836 -7.927 -9.052 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.729 -5.790 -9.559 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.504 -7.497 -9.888 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.522 -5.645 -11.204 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.094 -6.339 -11.945 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.661 -7.844 -12.707 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.222 -8.641 -11.209 1.00 0.00 H new ATOM 0 HE ARG A 44 -8.293 -7.008 -10.419 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.878 -9.360 -13.027 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -9.589 -9.802 -13.053 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -10.485 -7.585 -10.463 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -11.056 -8.802 -11.609 1.00 0.00 H new ATOM 719 N THR A 45 -5.581 -6.439 -6.496 1.00 0.00 N ATOM 720 CA THR A 45 -4.925 -6.623 -5.210 1.00 0.00 C ATOM 721 C THR A 45 -5.709 -7.582 -4.317 1.00 0.00 C ATOM 722 O THR A 45 -5.154 -8.553 -3.802 1.00 0.00 O ATOM 723 CB THR A 45 -4.754 -5.275 -4.509 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.788 -4.214 -5.447 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.458 -5.164 -3.737 1.00 0.00 C ATOM 0 H THR A 45 -6.062 -5.546 -6.599 1.00 0.00 H new ATOM 0 HA THR A 45 -3.944 -7.061 -5.394 1.00 0.00 H new ATOM 0 HB THR A 45 -5.584 -5.207 -3.806 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.489 -4.541 -6.321 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.399 -4.184 -3.264 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.423 -5.939 -2.972 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.617 -5.289 -4.419 1.00 0.00 H new ATOM 733 N TYR A 46 -7.001 -7.307 -4.129 1.00 0.00 N ATOM 734 CA TYR A 46 -7.838 -8.158 -3.288 1.00 0.00 C ATOM 735 C TYR A 46 -7.763 -9.615 -3.743 1.00 0.00 C ATOM 736 O TYR A 46 -7.664 -10.525 -2.921 1.00 0.00 O ATOM 737 CB TYR A 46 -9.296 -7.660 -3.273 1.00 0.00 C ATOM 738 CG TYR A 46 -10.062 -7.893 -4.561 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.368 -9.178 -4.990 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.484 -6.826 -5.347 1.00 0.00 C ATOM 741 CE1 TYR A 46 -11.062 -9.395 -6.161 1.00 0.00 C ATOM 742 CE2 TYR A 46 -11.182 -7.038 -6.521 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.466 -8.323 -6.924 1.00 0.00 C ATOM 744 OH TYR A 46 -12.160 -8.536 -8.093 1.00 0.00 O ATOM 0 H TYR A 46 -7.484 -6.510 -4.544 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.456 -8.102 -2.269 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -9.825 -8.154 -2.458 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.298 -6.592 -3.054 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.056 -10.023 -4.395 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.263 -5.816 -5.035 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.288 -10.402 -6.479 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.503 -6.199 -7.120 1.00 0.00 H new ATOM 0 HH TYR A 46 -13.123 -8.504 -7.912 1.00 0.00 H new ATOM 754 N GLU A 47 -7.808 -9.829 -5.056 1.00 0.00 N ATOM 755 CA GLU A 47 -7.743 -11.175 -5.613 1.00 0.00 C ATOM 756 C GLU A 47 -6.315 -11.705 -5.596 1.00 0.00 C ATOM 757 O GLU A 47 -6.091 -12.916 -5.583 1.00 0.00 O ATOM 758 CB GLU A 47 -8.283 -11.181 -7.043 1.00 0.00 C ATOM 759 CG GLU A 47 -9.536 -12.018 -7.205 1.00 0.00 C ATOM 760 CD GLU A 47 -10.353 -11.623 -8.419 1.00 0.00 C ATOM 761 OE1 GLU A 47 -10.146 -10.506 -8.937 1.00 0.00 O ATOM 762 OE2 GLU A 47 -11.202 -12.431 -8.852 1.00 0.00 O ATOM 0 H GLU A 47 -7.889 -9.088 -5.752 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.359 -11.827 -4.994 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.496 -10.157 -7.348 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.512 -11.559 -7.714 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.258 -13.069 -7.286 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.151 -11.920 -6.311 1.00 0.00 H new ATOM 769 N SER A 48 -5.353 -10.792 -5.599 1.00 0.00 N ATOM 770 CA SER A 48 -3.943 -11.171 -5.587 1.00 0.00 C ATOM 771 C SER A 48 -3.331 -11.011 -4.196 1.00 0.00 C ATOM 772 O SER A 48 -2.110 -10.946 -4.053 1.00 0.00 O ATOM 773 CB SER A 48 -3.157 -10.336 -6.599 1.00 0.00 C ATOM 774 OG SER A 48 -1.888 -10.910 -6.858 1.00 0.00 O ATOM 0 H SER A 48 -5.521 -9.786 -5.610 1.00 0.00 H new ATOM 0 HA SER A 48 -3.884 -12.223 -5.865 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.721 -10.259 -7.528 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.030 -9.322 -6.219 1.00 0.00 H new ATOM 0 HG SER A 48 -1.254 -10.627 -6.167 1.00 0.00 H new ATOM 780 N PHE A 49 -4.179 -10.954 -3.173 1.00 0.00 N ATOM 781 CA PHE A 49 -3.705 -10.809 -1.801 1.00 0.00 C ATOM 782 C PHE A 49 -3.549 -12.177 -1.136 1.00 0.00 C ATOM 783 O PHE A 49 -4.362 -13.076 -1.353 1.00 0.00 O ATOM 784 CB PHE A 49 -4.667 -9.937 -0.993 1.00 0.00 C ATOM 785 CG PHE A 49 -3.982 -9.093 0.045 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.134 -8.062 -0.328 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.187 -9.332 1.394 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.504 -7.285 0.626 1.00 0.00 C ATOM 789 CE2 PHE A 49 -3.559 -8.559 2.352 1.00 0.00 C ATOM 790 CZ PHE A 49 -2.716 -7.534 1.968 1.00 0.00 C ATOM 0 H PHE A 49 -5.193 -11.006 -3.268 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.729 -10.324 -1.827 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.215 -9.287 -1.675 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.401 -10.577 -0.503 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.964 -7.864 -1.376 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.845 -10.132 1.701 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -1.847 -6.484 0.322 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.727 -8.756 3.400 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.224 -6.929 2.715 1.00 0.00 H new ATOM 800 N PRO A 50 -2.494 -12.356 -0.319 1.00 0.00 N ATOM 801 CA PRO A 50 -2.233 -13.625 0.368 1.00 0.00 C ATOM 802 C PRO A 50 -3.145 -13.845 1.572 1.00 0.00 C ATOM 803 O PRO A 50 -3.424 -14.983 1.949 1.00 0.00 O ATOM 804 CB PRO A 50 -0.781 -13.480 0.820 1.00 0.00 C ATOM 805 CG PRO A 50 -0.595 -12.015 1.014 1.00 0.00 C ATOM 806 CD PRO A 50 -1.468 -11.340 -0.010 1.00 0.00 C ATOM 0 HA PRO A 50 -2.417 -14.482 -0.279 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.596 -14.029 1.743 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.092 -13.872 0.072 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.878 -11.717 2.024 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.450 -11.734 0.880 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.914 -10.427 0.384 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -0.901 -11.060 -0.898 1.00 0.00 H new ATOM 814 N LYS A 51 -3.603 -12.752 2.174 1.00 0.00 N ATOM 815 CA LYS A 51 -4.479 -12.833 3.338 1.00 0.00 C ATOM 816 C LYS A 51 -5.724 -11.973 3.146 1.00 0.00 C ATOM 817 O LYS A 51 -5.812 -10.865 3.674 1.00 0.00 O ATOM 818 CB LYS A 51 -3.731 -12.394 4.598 1.00 0.00 C ATOM 819 CG LYS A 51 -4.391 -12.852 5.889 1.00 0.00 C ATOM 820 CD LYS A 51 -4.148 -14.332 6.147 1.00 0.00 C ATOM 821 CE LYS A 51 -3.111 -14.546 7.238 1.00 0.00 C ATOM 822 NZ LYS A 51 -2.985 -15.982 7.611 1.00 0.00 N ATOM 0 H LYS A 51 -3.383 -11.802 1.876 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.792 -13.871 3.452 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.714 -12.785 4.561 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -3.655 -11.307 4.605 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.003 -12.268 6.724 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.463 -12.662 5.838 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -5.084 -14.810 6.435 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.814 -14.812 5.227 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.145 -14.173 6.898 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -3.385 -13.965 8.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -2.268 -16.085 8.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.900 -16.332 7.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -2.698 -16.533 6.777 1.00 0.00 H new ATOM 836 N ARG A 52 -6.684 -12.492 2.388 1.00 0.00 N ATOM 837 CA ARG A 52 -7.924 -11.771 2.128 1.00 0.00 C ATOM 838 C ARG A 52 -9.134 -12.575 2.611 1.00 0.00 C ATOM 839 O ARG A 52 -9.368 -13.687 2.138 1.00 0.00 O ATOM 840 CB ARG A 52 -8.062 -11.477 0.633 1.00 0.00 C ATOM 841 CG ARG A 52 -7.798 -12.687 -0.250 1.00 0.00 C ATOM 842 CD ARG A 52 -8.919 -12.904 -1.255 1.00 0.00 C ATOM 843 NE ARG A 52 -10.223 -13.019 -0.606 1.00 0.00 N ATOM 844 CZ ARG A 52 -11.384 -12.929 -1.253 1.00 0.00 C ATOM 845 NH1 ARG A 52 -11.407 -12.724 -2.564 1.00 0.00 N ATOM 846 NH2 ARG A 52 -12.524 -13.045 -0.586 1.00 0.00 N ATOM 0 H ARG A 52 -6.627 -13.408 1.943 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.890 -10.830 2.677 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.067 -11.105 0.435 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.369 -10.681 0.362 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.855 -12.552 -0.780 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.690 -13.575 0.372 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -8.938 -12.074 -1.961 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -8.720 -13.808 -1.830 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.246 -13.177 0.401 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -10.533 -12.635 -3.082 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.299 -12.656 -3.054 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.512 -13.203 0.422 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -13.413 -12.976 -1.080 1.00 0.00 H new ATOM 860 N PRO A 53 -9.924 -12.031 3.559 1.00 0.00 N ATOM 861 CA PRO A 53 -9.703 -10.716 4.162 1.00 0.00 C ATOM 862 C PRO A 53 -8.690 -10.768 5.302 1.00 0.00 C ATOM 863 O PRO A 53 -8.280 -11.846 5.733 1.00 0.00 O ATOM 864 CB PRO A 53 -11.091 -10.325 4.703 1.00 0.00 C ATOM 865 CG PRO A 53 -11.998 -11.484 4.413 1.00 0.00 C ATOM 866 CD PRO A 53 -11.116 -12.664 4.120 1.00 0.00 C ATOM 0 HA PRO A 53 -9.296 -10.005 3.443 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.048 -10.123 5.773 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.454 -9.417 4.222 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.647 -11.689 5.264 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.645 -11.265 3.564 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.888 -13.234 5.020 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.580 -13.353 3.415 1.00 0.00 H new ATOM 874 N LEU A 54 -8.295 -9.596 5.792 1.00 0.00 N ATOM 875 CA LEU A 54 -7.336 -9.509 6.888 1.00 0.00 C ATOM 876 C LEU A 54 -8.053 -9.544 8.240 1.00 0.00 C ATOM 877 O LEU A 54 -8.976 -8.765 8.479 1.00 0.00 O ATOM 878 CB LEU A 54 -6.512 -8.226 6.768 1.00 0.00 C ATOM 879 CG LEU A 54 -5.530 -8.195 5.594 1.00 0.00 C ATOM 880 CD1 LEU A 54 -5.659 -6.892 4.821 1.00 0.00 C ATOM 881 CD2 LEU A 54 -4.102 -8.385 6.087 1.00 0.00 C ATOM 0 H LEU A 54 -8.624 -8.694 5.447 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.669 -10.369 6.827 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.194 -7.381 6.674 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.954 -8.083 7.693 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.774 -9.017 4.921 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.953 -6.890 3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.674 -6.797 4.434 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.443 -6.053 5.483 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.418 -8.360 5.239 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.848 -7.585 6.782 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.017 -9.346 6.594 1.00 0.00 H new ATOM 893 N PRO A 55 -7.649 -10.458 9.145 1.00 0.00 N ATOM 894 CA PRO A 55 -8.271 -10.590 10.467 1.00 0.00 C ATOM 895 C PRO A 55 -7.936 -9.432 11.407 1.00 0.00 C ATOM 896 O PRO A 55 -6.898 -8.783 11.272 1.00 0.00 O ATOM 897 CB PRO A 55 -7.691 -11.902 11.022 1.00 0.00 C ATOM 898 CG PRO A 55 -6.984 -12.551 9.878 1.00 0.00 C ATOM 899 CD PRO A 55 -6.574 -11.441 8.957 1.00 0.00 C ATOM 0 HA PRO A 55 -9.358 -10.584 10.388 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.005 -11.708 11.846 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.481 -12.546 11.409 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -6.115 -13.111 10.224 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -7.637 -13.259 9.368 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.599 -11.032 9.223 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.507 -11.776 7.922 1.00 0.00 H new ATOM 907 N GLU A 56 -8.825 -9.199 12.369 1.00 0.00 N ATOM 908 CA GLU A 56 -8.652 -8.141 13.363 1.00 0.00 C ATOM 909 C GLU A 56 -8.340 -6.789 12.725 1.00 0.00 C ATOM 910 O GLU A 56 -7.689 -5.944 13.339 1.00 0.00 O ATOM 911 CB GLU A 56 -7.537 -8.518 14.340 1.00 0.00 C ATOM 912 CG GLU A 56 -8.009 -9.383 15.498 1.00 0.00 C ATOM 913 CD GLU A 56 -7.194 -10.653 15.650 1.00 0.00 C ATOM 914 OE1 GLU A 56 -6.182 -10.625 16.381 1.00 0.00 O ATOM 915 OE2 GLU A 56 -7.569 -11.676 15.038 1.00 0.00 O ATOM 0 H GLU A 56 -9.684 -9.737 12.482 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.598 -8.043 13.896 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.754 -9.048 13.798 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.090 -7.607 14.737 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.953 -8.808 16.422 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.057 -9.644 15.348 1.00 0.00 H new ATOM 922 N ARG A 57 -8.818 -6.577 11.504 1.00 0.00 N ATOM 923 CA ARG A 57 -8.594 -5.310 10.815 1.00 0.00 C ATOM 924 C ARG A 57 -9.733 -5.012 9.841 1.00 0.00 C ATOM 925 O ARG A 57 -10.442 -5.921 9.408 1.00 0.00 O ATOM 926 CB ARG A 57 -7.237 -5.323 10.098 1.00 0.00 C ATOM 927 CG ARG A 57 -7.245 -6.021 8.744 1.00 0.00 C ATOM 928 CD ARG A 57 -7.719 -5.098 7.629 1.00 0.00 C ATOM 929 NE ARG A 57 -7.332 -3.706 7.852 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.125 -3.218 7.577 1.00 0.00 C ATOM 931 NH1 ARG A 57 -5.189 -3.997 7.051 1.00 0.00 N ATOM 932 NH2 ARG A 57 -5.855 -1.944 7.827 1.00 0.00 N ATOM 0 H ARG A 57 -9.359 -7.260 10.974 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.577 -4.511 11.556 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.903 -4.295 9.961 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.505 -5.813 10.741 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.242 -6.380 8.515 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.894 -6.896 8.791 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.306 -5.439 6.679 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.804 -5.161 7.546 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.029 -3.071 8.242 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.392 -4.977 6.855 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.266 -3.616 6.843 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.572 -1.340 8.229 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.930 -1.568 7.617 1.00 0.00 H new ATOM 946 N THR A 58 -9.908 -3.737 9.500 1.00 0.00 N ATOM 947 CA THR A 58 -10.967 -3.336 8.579 1.00 0.00 C ATOM 948 C THR A 58 -10.523 -3.526 7.134 1.00 0.00 C ATOM 949 O THR A 58 -9.509 -2.974 6.707 1.00 0.00 O ATOM 950 CB THR A 58 -11.368 -1.880 8.820 1.00 0.00 C ATOM 951 OG1 THR A 58 -11.479 -1.614 10.207 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.685 -1.509 8.173 1.00 0.00 C ATOM 0 H THR A 58 -9.333 -2.968 9.846 1.00 0.00 H new ATOM 0 HA THR A 58 -11.834 -3.971 8.763 1.00 0.00 H new ATOM 0 HB THR A 58 -10.578 -1.282 8.366 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.609 -1.326 10.556 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.911 -0.463 8.382 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.615 -1.657 7.095 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.478 -2.139 8.575 1.00 0.00 H new ATOM 960 N ASN A 59 -11.281 -4.323 6.391 1.00 0.00 N ATOM 961 CA ASN A 59 -10.959 -4.603 4.998 1.00 0.00 C ATOM 962 C ASN A 59 -11.677 -3.644 4.055 1.00 0.00 C ATOM 963 O ASN A 59 -12.875 -3.399 4.192 1.00 0.00 O ATOM 964 CB ASN A 59 -11.333 -6.046 4.655 1.00 0.00 C ATOM 965 CG ASN A 59 -10.830 -7.035 5.687 1.00 0.00 C ATOM 966 OD1 ASN A 59 -11.529 -7.980 6.051 1.00 0.00 O ATOM 967 ND2 ASN A 59 -9.611 -6.821 6.164 1.00 0.00 N ATOM 0 H ASN A 59 -12.124 -4.787 6.730 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.886 -4.463 4.868 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -12.417 -6.128 4.575 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -10.921 -6.303 3.679 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.218 -7.453 6.861 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -9.067 -6.024 5.833 1.00 0.00 H new ATOM 974 N VAL A 60 -10.933 -3.113 3.090 1.00 0.00 N ATOM 975 CA VAL A 60 -11.490 -2.189 2.111 1.00 0.00 C ATOM 976 C VAL A 60 -10.996 -2.533 0.710 1.00 0.00 C ATOM 977 O VAL A 60 -9.798 -2.715 0.493 1.00 0.00 O ATOM 978 CB VAL A 60 -11.124 -0.728 2.442 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.681 0.223 1.391 1.00 0.00 C ATOM 980 CG2 VAL A 60 -11.633 -0.358 3.827 1.00 0.00 C ATOM 0 H VAL A 60 -9.940 -3.308 2.966 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.575 -2.290 2.148 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.038 -0.636 2.435 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.410 1.247 1.647 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.266 -0.030 0.415 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.767 0.133 1.358 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.368 0.676 4.048 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.717 -0.469 3.858 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.180 -1.015 4.569 1.00 0.00 H new ATOM 990 N VAL A 61 -11.926 -2.639 -0.235 1.00 0.00 N ATOM 991 CA VAL A 61 -11.574 -2.982 -1.609 1.00 0.00 C ATOM 992 C VAL A 61 -12.053 -1.931 -2.609 1.00 0.00 C ATOM 993 O VAL A 61 -13.164 -1.410 -2.502 1.00 0.00 O ATOM 994 CB VAL A 61 -12.164 -4.351 -2.002 1.00 0.00 C ATOM 995 CG1 VAL A 61 -11.751 -4.732 -3.416 1.00 0.00 C ATOM 996 CG2 VAL A 61 -11.734 -5.420 -1.010 1.00 0.00 C ATOM 0 H VAL A 61 -12.923 -2.493 -0.076 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.485 -3.023 -1.646 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.251 -4.275 -1.977 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.179 -5.701 -3.671 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.114 -3.979 -4.116 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.664 -4.788 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.159 -6.380 -1.302 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.646 -5.492 -1.002 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.088 -5.155 -0.014 1.00 0.00 H new ATOM 1006 N LEU A 62 -11.205 -1.645 -3.595 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.527 -0.679 -4.640 1.00 0.00 C ATOM 1008 C LEU A 62 -11.379 -1.332 -6.012 1.00 0.00 C ATOM 1009 O LEU A 62 -10.265 -1.587 -6.471 1.00 0.00 O ATOM 1010 CB LEU A 62 -10.618 0.553 -4.540 1.00 0.00 C ATOM 1011 CG LEU A 62 -11.045 1.754 -5.395 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -12.072 2.599 -4.660 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -9.840 2.604 -5.769 1.00 0.00 C ATOM 0 H LEU A 62 -10.284 -2.073 -3.691 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.559 -0.354 -4.507 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -10.574 0.868 -3.497 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.608 0.263 -4.829 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.499 1.372 -6.309 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.361 3.445 -5.284 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.951 1.993 -4.440 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.642 2.966 -3.728 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.165 3.450 -6.375 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.358 2.971 -4.863 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.132 2.001 -6.338 1.00 0.00 H new ATOM 1025 N THR A 63 -12.507 -1.602 -6.661 1.00 0.00 N ATOM 1026 CA THR A 63 -12.502 -2.229 -7.978 1.00 0.00 C ATOM 1027 C THR A 63 -13.376 -1.451 -8.958 1.00 0.00 C ATOM 1028 O THR A 63 -14.324 -0.775 -8.558 1.00 0.00 O ATOM 1029 CB THR A 63 -12.991 -3.675 -7.879 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.234 -4.211 -9.168 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.264 -3.823 -7.073 1.00 0.00 C ATOM 0 H THR A 63 -13.437 -1.396 -6.296 1.00 0.00 H new ATOM 0 HA THR A 63 -11.478 -2.222 -8.350 1.00 0.00 H new ATOM 0 HB THR A 63 -12.193 -4.216 -7.370 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.525 -3.924 -9.781 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.555 -4.873 -7.043 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.096 -3.464 -6.058 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.059 -3.239 -7.538 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.048 -1.552 -10.242 1.00 0.00 N ATOM 1040 CA HIS A 64 -13.798 -0.860 -11.284 1.00 0.00 C ATOM 1041 C HIS A 64 -15.155 -1.519 -11.516 1.00 0.00 C ATOM 1042 O HIS A 64 -16.137 -0.847 -11.830 1.00 0.00 O ATOM 1043 CB HIS A 64 -12.996 -0.844 -12.587 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.709 0.534 -13.094 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -12.449 0.809 -14.419 1.00 0.00 N ATOM 1046 CD2 HIS A 64 -12.639 1.720 -12.445 1.00 0.00 C ATOM 1047 CE1 HIS A 64 -12.231 2.104 -14.562 1.00 0.00 C ATOM 1048 NE2 HIS A 64 -12.342 2.679 -13.380 1.00 0.00 N ATOM 0 H HIS A 64 -12.265 -2.108 -10.587 1.00 0.00 H new ATOM 0 HA HIS A 64 -13.969 0.165 -10.953 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -12.053 -1.369 -12.431 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -13.546 -1.396 -13.349 1.00 0.00 H new ATOM 0 HD1 HIS A 64 -12.428 0.121 -15.171 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -12.789 1.881 -11.388 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -12.001 2.607 -15.490 1.00 0.00 H new ATOM 1057 N GLN A 65 -15.201 -2.840 -11.366 1.00 0.00 N ATOM 1058 CA GLN A 65 -16.435 -3.591 -11.564 1.00 0.00 C ATOM 1059 C GLN A 65 -17.560 -3.024 -10.707 1.00 0.00 C ATOM 1060 O GLN A 65 -17.407 -2.853 -9.499 1.00 0.00 O ATOM 1061 CB GLN A 65 -16.217 -5.068 -11.236 1.00 0.00 C ATOM 1062 CG GLN A 65 -15.411 -5.814 -12.288 1.00 0.00 C ATOM 1063 CD GLN A 65 -14.466 -6.833 -11.685 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -14.518 -8.018 -12.015 1.00 0.00 O ATOM 1065 NE2 GLN A 65 -13.593 -6.376 -10.794 1.00 0.00 N ATOM 0 H GLN A 65 -14.397 -3.412 -11.108 1.00 0.00 H new ATOM 0 HA GLN A 65 -16.723 -3.500 -12.611 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.706 -5.147 -10.276 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.186 -5.553 -11.122 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.093 -6.318 -12.973 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -14.839 -5.098 -12.877 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -13.585 -5.386 -10.550 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -12.931 -7.015 -10.354 1.00 0.00 H new ATOM 1074 N GLU A 66 -18.690 -2.739 -11.342 1.00 0.00 N ATOM 1075 CA GLU A 66 -19.846 -2.195 -10.641 1.00 0.00 C ATOM 1076 C GLU A 66 -20.673 -3.303 -9.997 1.00 0.00 C ATOM 1077 O GLU A 66 -21.295 -3.101 -8.954 1.00 0.00 O ATOM 1078 CB GLU A 66 -20.718 -1.388 -11.604 1.00 0.00 C ATOM 1079 CG GLU A 66 -21.339 -2.226 -12.710 1.00 0.00 C ATOM 1080 CD GLU A 66 -21.261 -1.553 -14.066 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -22.050 -0.616 -14.311 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -20.410 -1.962 -14.884 1.00 0.00 O ATOM 0 H GLU A 66 -18.831 -2.876 -12.343 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.480 -1.539 -9.851 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.513 -0.900 -11.039 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -20.115 -0.599 -12.053 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -20.833 -3.190 -12.758 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.383 -2.425 -12.467 1.00 0.00 H new ATOM 1089 N ASP A 67 -20.691 -4.469 -10.637 1.00 0.00 N ATOM 1090 CA ASP A 67 -21.462 -5.601 -10.136 1.00 0.00 C ATOM 1091 C ASP A 67 -20.595 -6.594 -9.367 1.00 0.00 C ATOM 1092 O ASP A 67 -20.992 -7.742 -9.168 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.159 -6.315 -11.296 1.00 0.00 C ATOM 1094 CG ASP A 67 -23.447 -6.990 -10.869 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -23.376 -8.109 -10.319 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -24.526 -6.400 -11.085 1.00 0.00 O ATOM 0 H ASP A 67 -20.182 -4.654 -11.501 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.205 -5.206 -9.443 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -22.374 -5.595 -12.086 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -21.484 -7.060 -11.719 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.419 -6.159 -8.921 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.535 -7.040 -8.166 1.00 0.00 C ATOM 1103 C TYR A 68 -18.852 -6.972 -6.676 1.00 0.00 C ATOM 1104 O TYR A 68 -19.168 -5.907 -6.147 1.00 0.00 O ATOM 1105 CB TYR A 68 -17.070 -6.678 -8.403 1.00 0.00 C ATOM 1106 CG TYR A 68 -16.108 -7.724 -7.886 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -15.695 -8.774 -8.696 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.621 -7.667 -6.586 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -14.824 -9.738 -8.226 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.748 -8.626 -6.109 1.00 0.00 C ATOM 1111 CZ TYR A 68 -14.353 -9.659 -6.932 1.00 0.00 C ATOM 1112 OH TYR A 68 -13.487 -10.618 -6.460 1.00 0.00 O ATOM 0 H TYR A 68 -19.061 -5.215 -9.067 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.702 -8.059 -8.516 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -16.905 -6.538 -9.471 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -16.855 -5.725 -7.920 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -16.061 -8.838 -9.710 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -15.930 -6.860 -5.938 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.514 -10.549 -8.868 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.377 -8.567 -5.096 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.856 -10.208 -5.832 1.00 0.00 H new ATOM 1122 N GLN A 69 -18.767 -8.117 -6.005 1.00 0.00 N ATOM 1123 CA GLN A 69 -19.049 -8.187 -4.577 1.00 0.00 C ATOM 1124 C GLN A 69 -17.881 -8.806 -3.815 1.00 0.00 C ATOM 1125 O GLN A 69 -17.539 -9.970 -4.023 1.00 0.00 O ATOM 1126 CB GLN A 69 -20.320 -9.000 -4.327 1.00 0.00 C ATOM 1127 CG GLN A 69 -21.582 -8.333 -4.850 1.00 0.00 C ATOM 1128 CD GLN A 69 -21.869 -7.012 -4.164 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -22.501 -6.972 -3.108 1.00 0.00 O ATOM 1130 NE2 GLN A 69 -21.404 -5.922 -4.762 1.00 0.00 N ATOM 0 H GLN A 69 -18.505 -9.008 -6.428 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.195 -7.170 -4.214 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.214 -9.978 -4.797 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.427 -9.171 -3.256 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.483 -8.167 -5.923 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.429 -9.004 -4.708 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -20.885 -6.002 -5.636 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -21.566 -5.004 -4.347 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.281 -8.022 -2.925 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.160 -8.495 -2.123 1.00 0.00 C ATOM 1141 C ALA A 70 -16.619 -8.838 -0.712 1.00 0.00 C ATOM 1142 O ALA A 70 -16.779 -7.957 0.134 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.052 -7.453 -2.084 1.00 0.00 C ATOM 0 H ALA A 70 -17.553 -7.056 -2.741 1.00 0.00 H new ATOM 0 HA ALA A 70 -15.765 -9.399 -2.586 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.224 -7.825 -1.480 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -14.702 -7.256 -3.097 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.435 -6.531 -1.646 1.00 0.00 H new ATOM 1149 N GLN A 71 -16.834 -10.123 -0.469 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.281 -10.593 0.832 1.00 0.00 C ATOM 1151 C GLN A 71 -16.192 -10.407 1.874 1.00 0.00 C ATOM 1152 O GLN A 71 -15.027 -10.730 1.639 1.00 0.00 O ATOM 1153 CB GLN A 71 -17.688 -12.066 0.760 1.00 0.00 C ATOM 1154 CG GLN A 71 -18.975 -12.306 -0.012 1.00 0.00 C ATOM 1155 CD GLN A 71 -20.098 -11.382 0.417 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -20.114 -10.176 -0.138 1.00 0.00 O flip ATOM 1157 NE2 GLN A 71 -20.941 -11.747 1.236 1.00 0.00 N flip ATOM 0 H GLN A 71 -16.705 -10.861 -1.161 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.149 -10.002 1.125 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -16.883 -12.634 0.293 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -17.805 -12.452 1.773 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -18.785 -12.170 -1.077 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -19.289 -13.341 0.126 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -20.890 -12.683 1.637 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -21.691 -11.113 1.513 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.580 -9.884 3.025 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.629 -9.662 4.090 1.00 0.00 C ATOM 1168 C GLY A 72 -15.129 -8.233 4.139 1.00 0.00 C ATOM 1169 O GLY A 72 -14.825 -7.720 5.216 1.00 0.00 O ATOM 0 H GLY A 72 -17.538 -9.609 3.241 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.093 -9.913 5.044 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.781 -10.335 3.961 1.00 0.00 H new ATOM 1173 N ALA A 73 -15.031 -7.581 2.980 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.551 -6.204 2.928 1.00 0.00 C ATOM 1175 C ALA A 73 -15.525 -5.304 2.174 1.00 0.00 C ATOM 1176 O ALA A 73 -16.434 -5.787 1.499 1.00 0.00 O ATOM 1177 CB ALA A 73 -13.183 -6.161 2.269 1.00 0.00 C ATOM 0 H ALA A 73 -15.275 -7.981 2.074 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.474 -5.832 3.950 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.829 -5.131 2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.482 -6.765 2.845 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.255 -6.556 1.256 1.00 0.00 H new ATOM 1183 N VAL A 74 -15.326 -3.991 2.286 1.00 0.00 N ATOM 1184 CA VAL A 74 -16.179 -3.033 1.611 1.00 0.00 C ATOM 1185 C VAL A 74 -15.722 -2.834 0.173 1.00 0.00 C ATOM 1186 O VAL A 74 -14.526 -2.878 -0.117 1.00 0.00 O ATOM 1187 CB VAL A 74 -16.186 -1.673 2.333 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -17.129 -1.699 3.525 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -14.784 -1.265 2.761 1.00 0.00 C ATOM 0 H VAL A 74 -14.579 -3.573 2.840 1.00 0.00 H new ATOM 0 HA VAL A 74 -17.191 -3.437 1.623 1.00 0.00 H new ATOM 0 HB VAL A 74 -16.548 -0.925 1.627 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -17.117 -0.728 4.019 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -18.140 -1.921 3.184 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -16.806 -2.468 4.227 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.824 -0.301 3.268 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -14.378 -2.015 3.440 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.144 -1.187 1.882 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.674 -2.624 -0.727 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.356 -2.429 -2.135 1.00 0.00 C ATOM 1201 C VAL A 75 -16.884 -1.099 -2.651 1.00 0.00 C ATOM 1202 O VAL A 75 -17.974 -0.663 -2.283 1.00 0.00 O ATOM 1203 CB VAL A 75 -16.933 -3.560 -3.003 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -16.426 -3.451 -4.433 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -16.586 -4.914 -2.409 1.00 0.00 C ATOM 0 H VAL A 75 -17.669 -2.584 -0.508 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.268 -2.435 -2.208 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.018 -3.462 -3.021 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -16.846 -4.260 -5.031 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -16.730 -2.493 -4.855 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -15.338 -3.522 -4.440 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.002 -5.703 -3.035 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -15.503 -5.023 -2.360 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.004 -4.989 -1.405 1.00 0.00 H new ATOM 1215 N VAL A 76 -16.105 -0.466 -3.519 1.00 0.00 N ATOM 1216 CA VAL A 76 -16.493 0.807 -4.107 1.00 0.00 C ATOM 1217 C VAL A 76 -15.842 0.998 -5.466 1.00 0.00 C ATOM 1218 O VAL A 76 -14.707 0.578 -5.691 1.00 0.00 O ATOM 1219 CB VAL A 76 -16.110 1.999 -3.211 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -17.122 2.182 -2.093 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -14.704 1.827 -2.655 1.00 0.00 C ATOM 0 H VAL A 76 -15.199 -0.815 -3.831 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.578 0.778 -4.212 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.121 2.901 -3.822 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -16.830 3.030 -1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -18.107 2.367 -2.521 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -17.156 1.280 -1.482 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.455 2.681 -2.025 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.656 0.913 -2.063 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.992 1.764 -3.478 1.00 0.00 H new ATOM 1231 N HIS A 77 -16.566 1.645 -6.366 1.00 0.00 N ATOM 1232 CA HIS A 77 -16.063 1.910 -7.704 1.00 0.00 C ATOM 1233 C HIS A 77 -16.143 3.403 -7.994 1.00 0.00 C ATOM 1234 O HIS A 77 -16.759 3.827 -8.973 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.855 1.116 -8.755 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.803 0.110 -8.175 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.391 -1.093 -7.640 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -19.152 0.133 -8.049 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.444 -1.766 -7.212 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.524 -1.044 -7.447 1.00 0.00 N ATOM 0 H HIS A 77 -17.507 1.997 -6.193 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.022 1.590 -7.757 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -17.417 1.814 -9.375 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.153 0.602 -9.411 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.811 0.928 -8.363 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.425 -2.741 -6.749 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -20.480 -1.316 -7.218 1.00 0.00 H new ATOM 1249 N ASP A 78 -15.487 4.197 -7.154 1.00 0.00 N ATOM 1250 CA ASP A 78 -15.453 5.637 -7.336 1.00 0.00 C ATOM 1251 C ASP A 78 -14.402 6.255 -6.424 1.00 0.00 C ATOM 1252 O ASP A 78 -14.200 5.792 -5.301 1.00 0.00 O ATOM 1253 CB ASP A 78 -16.830 6.246 -7.061 1.00 0.00 C ATOM 1254 CG ASP A 78 -17.558 6.626 -8.335 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -17.348 7.755 -8.825 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -18.339 5.794 -8.842 1.00 0.00 O ATOM 0 H ASP A 78 -14.972 3.863 -6.340 1.00 0.00 H new ATOM 0 HA ASP A 78 -15.187 5.852 -8.371 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.434 5.533 -6.499 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.715 7.130 -6.434 1.00 0.00 H new ATOM 1261 N VAL A 79 -13.744 7.307 -6.893 1.00 0.00 N ATOM 1262 CA VAL A 79 -12.734 7.972 -6.083 1.00 0.00 C ATOM 1263 C VAL A 79 -13.396 8.672 -4.907 1.00 0.00 C ATOM 1264 O VAL A 79 -13.033 8.459 -3.748 1.00 0.00 O ATOM 1265 CB VAL A 79 -11.895 8.989 -6.891 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -10.590 8.354 -7.348 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -12.670 9.541 -8.082 1.00 0.00 C ATOM 0 H VAL A 79 -13.889 7.713 -7.817 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.050 7.201 -5.727 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.668 9.828 -6.233 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.010 9.082 -7.915 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.017 8.033 -6.478 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.806 7.492 -7.978 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.046 10.252 -8.624 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.948 8.723 -8.746 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.570 10.044 -7.729 1.00 0.00 H new ATOM 1277 N ALA A 80 -14.385 9.493 -5.219 1.00 0.00 N ATOM 1278 CA ALA A 80 -15.126 10.218 -4.200 1.00 0.00 C ATOM 1279 C ALA A 80 -15.949 9.258 -3.349 1.00 0.00 C ATOM 1280 O ALA A 80 -16.262 9.551 -2.195 1.00 0.00 O ATOM 1281 CB ALA A 80 -16.024 11.264 -4.842 1.00 0.00 C ATOM 0 H ALA A 80 -14.694 9.675 -6.174 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.412 10.725 -3.551 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.572 11.798 -4.066 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.415 11.969 -5.407 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.730 10.775 -5.514 1.00 0.00 H new ATOM 1287 N ALA A 81 -16.296 8.104 -3.922 1.00 0.00 N ATOM 1288 CA ALA A 81 -17.077 7.108 -3.201 1.00 0.00 C ATOM 1289 C ALA A 81 -16.350 6.686 -1.934 1.00 0.00 C ATOM 1290 O ALA A 81 -16.766 7.021 -0.824 1.00 0.00 O ATOM 1291 CB ALA A 81 -17.348 5.902 -4.087 1.00 0.00 C ATOM 0 H ALA A 81 -16.049 7.841 -4.876 1.00 0.00 H new ATOM 0 HA ALA A 81 -18.033 7.550 -2.922 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -17.932 5.167 -3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -17.904 6.217 -4.970 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.402 5.456 -4.394 1.00 0.00 H new ATOM 1297 N VAL A 82 -15.257 5.950 -2.106 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.463 5.482 -0.979 1.00 0.00 C ATOM 1299 C VAL A 82 -14.184 6.614 0.011 1.00 0.00 C ATOM 1300 O VAL A 82 -14.176 6.405 1.222 1.00 0.00 O ATOM 1301 CB VAL A 82 -13.130 4.865 -1.463 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -12.132 5.944 -1.854 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.541 3.948 -0.403 1.00 0.00 C ATOM 0 H VAL A 82 -14.901 5.665 -3.018 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.042 4.713 -0.468 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.344 4.270 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.205 5.478 -2.190 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.547 6.549 -2.660 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.927 6.580 -0.992 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.604 3.526 -0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.353 4.517 0.507 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.243 3.142 -0.189 1.00 0.00 H new ATOM 1313 N PHE A 83 -13.967 7.819 -0.508 1.00 0.00 N ATOM 1314 CA PHE A 83 -13.698 8.969 0.348 1.00 0.00 C ATOM 1315 C PHE A 83 -14.846 9.193 1.325 1.00 0.00 C ATOM 1316 O PHE A 83 -14.627 9.554 2.481 1.00 0.00 O ATOM 1317 CB PHE A 83 -13.467 10.224 -0.494 1.00 0.00 C ATOM 1318 CG PHE A 83 -12.020 10.476 -0.808 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -11.086 10.581 0.209 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -11.595 10.604 -2.121 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -9.753 10.811 -0.076 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -10.264 10.834 -2.412 1.00 0.00 C ATOM 1323 CZ PHE A 83 -9.342 10.937 -1.389 1.00 0.00 C ATOM 0 H PHE A 83 -13.972 8.023 -1.507 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.793 8.763 0.919 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -14.023 10.133 -1.427 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.871 11.087 0.035 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.403 10.482 1.237 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.312 10.523 -2.925 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -9.034 10.892 0.726 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.945 10.933 -3.439 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.301 11.116 -1.615 1.00 0.00 H new ATOM 1333 N ALA A 84 -16.069 8.960 0.861 1.00 0.00 N ATOM 1334 CA ALA A 84 -17.240 9.123 1.711 1.00 0.00 C ATOM 1335 C ALA A 84 -17.197 8.115 2.845 1.00 0.00 C ATOM 1336 O ALA A 84 -17.593 8.411 3.972 1.00 0.00 O ATOM 1337 CB ALA A 84 -18.518 8.971 0.900 1.00 0.00 C ATOM 0 H ALA A 84 -16.273 8.660 -0.092 1.00 0.00 H new ATOM 0 HA ALA A 84 -17.231 10.127 2.135 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.381 9.096 1.554 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.544 9.728 0.116 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.546 7.980 0.448 1.00 0.00 H new ATOM 1343 N TYR A 85 -16.679 6.928 2.545 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.549 5.892 3.555 1.00 0.00 C ATOM 1345 C TYR A 85 -15.632 6.407 4.661 1.00 0.00 C ATOM 1346 O TYR A 85 -16.035 6.502 5.819 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.029 4.582 2.929 1.00 0.00 C ATOM 1348 CG TYR A 85 -14.682 4.113 3.442 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -14.528 3.653 4.744 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -13.564 4.134 2.619 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.297 3.231 5.209 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.333 3.712 3.075 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.204 3.263 4.370 1.00 0.00 C ATOM 1354 OH TYR A 85 -10.977 2.846 4.825 1.00 0.00 O ATOM 0 H TYR A 85 -16.346 6.664 1.618 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.523 5.661 3.987 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.762 3.796 3.109 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -15.963 4.715 1.849 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.383 3.625 5.403 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.660 4.487 1.603 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.192 2.878 6.224 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.475 3.734 2.420 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.315 2.932 4.107 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.389 6.727 4.293 1.00 0.00 N ATOM 1365 CA ALA A 86 -13.406 7.224 5.253 1.00 0.00 C ATOM 1366 C ALA A 86 -14.027 8.226 6.225 1.00 0.00 C ATOM 1367 O ALA A 86 -13.734 8.199 7.420 1.00 0.00 O ATOM 1368 CB ALA A 86 -12.229 7.852 4.523 1.00 0.00 C ATOM 0 H ALA A 86 -14.042 6.650 3.337 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.050 6.375 5.837 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.504 8.218 5.250 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.757 7.106 3.884 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.581 8.683 3.912 1.00 0.00 H new ATOM 1374 N LYS A 87 -14.905 9.093 5.721 1.00 0.00 N ATOM 1375 CA LYS A 87 -15.571 10.068 6.579 1.00 0.00 C ATOM 1376 C LYS A 87 -16.415 9.336 7.617 1.00 0.00 C ATOM 1377 O LYS A 87 -16.378 9.647 8.808 1.00 0.00 O ATOM 1378 CB LYS A 87 -16.451 11.005 5.748 1.00 0.00 C ATOM 1379 CG LYS A 87 -16.474 12.434 6.265 1.00 0.00 C ATOM 1380 CD LYS A 87 -15.164 13.152 5.980 1.00 0.00 C ATOM 1381 CE LYS A 87 -15.297 14.118 4.813 1.00 0.00 C ATOM 1382 NZ LYS A 87 -14.140 14.026 3.881 1.00 0.00 N ATOM 0 H LYS A 87 -15.168 9.139 4.737 1.00 0.00 H new ATOM 0 HA LYS A 87 -14.816 10.670 7.085 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.095 11.006 4.718 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.469 10.616 5.733 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.296 12.977 5.799 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -16.662 12.430 7.339 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.846 13.696 6.869 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.387 12.419 5.760 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.218 13.907 4.270 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.377 15.137 5.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.269 14.700 3.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.263 14.253 4.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.078 13.061 3.499 1.00 0.00 H new ATOM 1396 N GLN A 88 -17.171 8.354 7.138 1.00 0.00 N ATOM 1397 CA GLN A 88 -18.033 7.551 7.998 1.00 0.00 C ATOM 1398 C GLN A 88 -17.215 6.863 9.091 1.00 0.00 C ATOM 1399 O GLN A 88 -17.759 6.430 10.107 1.00 0.00 O ATOM 1400 CB GLN A 88 -18.782 6.505 7.171 1.00 0.00 C ATOM 1401 CG GLN A 88 -20.196 6.238 7.662 1.00 0.00 C ATOM 1402 CD GLN A 88 -21.135 7.398 7.396 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -21.798 7.896 8.306 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -21.199 7.833 6.143 1.00 0.00 N ATOM 0 H GLN A 88 -17.204 8.094 6.152 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.757 8.215 8.471 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -18.823 6.836 6.133 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.219 5.572 7.186 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.583 5.343 7.174 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -20.172 6.033 8.732 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -20.632 7.391 5.420 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -21.816 8.609 5.904 1.00 0.00 H new ATOM 1413 N HIS A 89 -15.904 6.776 8.876 1.00 0.00 N ATOM 1414 CA HIS A 89 -15.001 6.155 9.837 1.00 0.00 C ATOM 1415 C HIS A 89 -13.973 7.172 10.335 1.00 0.00 C ATOM 1416 O HIS A 89 -12.842 7.209 9.850 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.288 4.972 9.186 1.00 0.00 C ATOM 1418 CG HIS A 89 -14.995 3.666 9.373 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.471 3.233 10.592 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.306 2.695 8.483 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -16.043 2.051 10.445 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -15.956 1.703 9.174 1.00 0.00 N ATOM 0 H HIS A 89 -15.443 7.131 8.038 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.583 5.801 10.688 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.180 5.167 8.119 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.282 4.893 9.599 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.084 2.700 7.426 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.503 1.469 11.230 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.314 0.837 8.771 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.356 8.026 11.302 1.00 0.00 N ATOM 1432 CA PRO A 90 -13.467 9.057 11.850 1.00 0.00 C ATOM 1433 C PRO A 90 -12.345 8.483 12.712 1.00 0.00 C ATOM 1434 O PRO A 90 -11.194 8.906 12.607 1.00 0.00 O ATOM 1435 CB PRO A 90 -14.398 9.932 12.708 1.00 0.00 C ATOM 1436 CG PRO A 90 -15.787 9.502 12.365 1.00 0.00 C ATOM 1437 CD PRO A 90 -15.684 8.072 11.927 1.00 0.00 C ATOM 0 HA PRO A 90 -12.960 9.600 11.053 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.196 9.793 13.770 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.251 10.990 12.491 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.449 9.599 13.226 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.203 10.123 11.572 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.761 7.383 12.768 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.473 7.805 11.224 1.00 0.00 H new ATOM 1445 N ASP A 91 -12.686 7.529 13.573 1.00 0.00 N ATOM 1446 CA ASP A 91 -11.704 6.914 14.461 1.00 0.00 C ATOM 1447 C ASP A 91 -10.736 6.007 13.702 1.00 0.00 C ATOM 1448 O ASP A 91 -9.745 5.542 14.266 1.00 0.00 O ATOM 1449 CB ASP A 91 -12.413 6.114 15.555 1.00 0.00 C ATOM 1450 CG ASP A 91 -13.293 6.985 16.430 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -12.973 8.182 16.589 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -14.301 6.471 16.957 1.00 0.00 O ATOM 0 H ASP A 91 -13.633 7.165 13.675 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.122 7.718 14.912 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.020 5.334 15.095 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.669 5.614 16.176 1.00 0.00 H new ATOM 1457 N GLN A 92 -11.021 5.753 12.428 1.00 0.00 N ATOM 1458 CA GLN A 92 -10.163 4.895 11.617 1.00 0.00 C ATOM 1459 C GLN A 92 -9.313 5.721 10.655 1.00 0.00 C ATOM 1460 O GLN A 92 -9.692 6.827 10.268 1.00 0.00 O ATOM 1461 CB GLN A 92 -11.003 3.885 10.832 1.00 0.00 C ATOM 1462 CG GLN A 92 -12.154 3.291 11.628 1.00 0.00 C ATOM 1463 CD GLN A 92 -11.723 2.120 12.489 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -11.859 2.150 13.712 1.00 0.00 O ATOM 1465 NE2 GLN A 92 -11.199 1.079 11.852 1.00 0.00 N ATOM 0 H GLN A 92 -11.834 6.126 11.938 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.497 4.357 12.291 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.402 4.373 9.943 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.356 3.077 10.489 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -12.589 4.063 12.262 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -12.935 2.965 10.942 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -11.105 1.097 10.836 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -10.891 0.262 12.378 1.00 0.00 H new ATOM 1474 N GLU A 93 -8.162 5.174 10.273 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.256 5.856 9.354 1.00 0.00 C ATOM 1476 C GLU A 93 -7.219 5.147 8.003 1.00 0.00 C ATOM 1477 O GLU A 93 -7.568 3.972 7.899 1.00 0.00 O ATOM 1478 CB GLU A 93 -5.847 5.923 9.948 1.00 0.00 C ATOM 1479 CG GLU A 93 -4.989 7.029 9.354 1.00 0.00 C ATOM 1480 CD GLU A 93 -4.401 7.945 10.410 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -3.964 7.433 11.462 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -4.379 9.173 10.186 1.00 0.00 O ATOM 0 H GLU A 93 -7.835 4.260 10.586 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.626 6.870 9.203 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.922 6.072 11.025 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.350 4.965 9.792 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.181 6.584 8.774 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -5.591 7.618 8.662 1.00 0.00 H new ATOM 1489 N LEU A 94 -6.798 5.868 6.970 1.00 0.00 N ATOM 1490 CA LEU A 94 -6.724 5.308 5.628 1.00 0.00 C ATOM 1491 C LEU A 94 -5.291 4.924 5.270 1.00 0.00 C ATOM 1492 O LEU A 94 -4.369 5.727 5.414 1.00 0.00 O ATOM 1493 CB LEU A 94 -7.262 6.314 4.613 1.00 0.00 C ATOM 1494 CG LEU A 94 -8.774 6.265 4.391 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -9.491 7.101 5.440 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -9.122 6.747 2.991 1.00 0.00 C ATOM 0 H LEU A 94 -6.503 6.842 7.037 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.335 4.406 5.602 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.991 7.318 4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.764 6.145 3.658 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.106 5.231 4.489 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.566 7.056 5.268 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.265 6.711 6.433 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.156 8.136 5.372 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -10.202 6.706 2.850 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.779 7.774 2.864 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.635 6.108 2.255 1.00 0.00 H new ATOM 1508 N VAL A 95 -5.114 3.693 4.803 1.00 0.00 N ATOM 1509 CA VAL A 95 -3.795 3.201 4.422 1.00 0.00 C ATOM 1510 C VAL A 95 -3.856 2.411 3.119 1.00 0.00 C ATOM 1511 O VAL A 95 -4.429 1.322 3.068 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.189 2.309 5.522 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -1.743 1.969 5.198 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.295 2.988 6.879 1.00 0.00 C ATOM 0 H VAL A 95 -5.868 3.017 4.679 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.160 4.076 4.283 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.755 1.379 5.563 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.332 1.338 5.986 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.698 1.437 4.248 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.160 2.887 5.127 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.862 2.343 7.643 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.756 3.935 6.855 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.344 3.173 7.112 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.263 2.965 2.067 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.249 2.311 0.763 1.00 0.00 C ATOM 1526 C ILE A 96 -2.098 1.316 0.663 1.00 0.00 C ATOM 1527 O ILE A 96 -0.959 1.633 1.007 1.00 0.00 O ATOM 1528 CB ILE A 96 -3.128 3.336 -0.381 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -4.104 4.496 -0.166 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.381 2.665 -1.723 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.542 4.056 -0.004 1.00 0.00 C ATOM 0 H ILE A 96 -2.785 3.866 2.092 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.196 1.781 0.664 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.114 3.737 -0.382 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.802 5.054 0.720 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.035 5.179 -1.012 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.292 3.402 -2.521 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.648 1.873 -1.877 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.384 2.239 -1.733 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.176 4.930 0.144 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.863 3.523 -0.899 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.626 3.397 0.860 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.400 0.109 0.195 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.387 -0.932 0.057 1.00 0.00 C ATOM 1545 C ALA A 97 -1.165 -1.308 -1.406 1.00 0.00 C ATOM 1546 O ALA A 97 -0.067 -1.709 -1.792 1.00 0.00 O ATOM 1547 CB ALA A 97 -1.783 -2.160 0.863 1.00 0.00 C ATOM 0 H ALA A 97 -3.337 -0.172 -0.095 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.448 -0.537 0.445 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.019 -2.930 0.752 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.876 -1.890 1.915 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.738 -2.541 0.500 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.212 -1.179 -2.216 1.00 0.00 N ATOM 1554 CA GLY A 98 -2.104 -1.515 -3.625 1.00 0.00 C ATOM 1555 C GLY A 98 -3.421 -1.353 -4.367 1.00 0.00 C ATOM 1556 O GLY A 98 -4.448 -1.075 -3.748 1.00 0.00 O ATOM 0 H GLY A 98 -3.131 -0.849 -1.923 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.349 -0.880 -4.089 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.760 -2.544 -3.724 1.00 0.00 H new ATOM 1560 N GLY A 99 -3.392 -1.449 -5.704 1.00 0.00 N ATOM 1561 CA GLY A 99 -2.152 -1.698 -6.427 1.00 0.00 C ATOM 1562 C GLY A 99 -1.477 -0.420 -6.889 1.00 0.00 C ATOM 1563 O GLY A 99 -1.697 0.648 -6.319 1.00 0.00 O ATOM 0 H GLY A 99 -4.215 -1.357 -6.299 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.468 -2.254 -5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -2.361 -2.327 -7.292 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.651 -0.535 -7.925 1.00 0.00 N ATOM 1568 CA ALA A 100 0.065 0.614 -8.468 1.00 0.00 C ATOM 1569 C ALA A 100 -0.897 1.661 -9.018 1.00 0.00 C ATOM 1570 O ALA A 100 -0.603 2.857 -8.996 1.00 0.00 O ATOM 1571 CB ALA A 100 1.033 0.165 -9.553 1.00 0.00 C ATOM 0 H ALA A 100 -0.461 -1.414 -8.406 1.00 0.00 H new ATOM 0 HA ALA A 100 0.628 1.073 -7.655 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.561 1.032 -9.951 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.753 -0.537 -9.131 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.479 -0.322 -10.356 1.00 0.00 H new ATOM 1577 N GLN A 101 -2.046 1.210 -9.511 1.00 0.00 N ATOM 1578 CA GLN A 101 -3.043 2.119 -10.064 1.00 0.00 C ATOM 1579 C GLN A 101 -3.795 2.836 -8.948 1.00 0.00 C ATOM 1580 O GLN A 101 -4.183 3.995 -9.094 1.00 0.00 O ATOM 1581 CB GLN A 101 -4.023 1.358 -10.958 1.00 0.00 C ATOM 1582 CG GLN A 101 -3.977 1.788 -12.415 1.00 0.00 C ATOM 1583 CD GLN A 101 -4.511 3.191 -12.625 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -5.807 3.373 -12.394 1.00 0.00 O flip ATOM 1585 NE2 GLN A 101 -3.769 4.102 -12.992 1.00 0.00 N flip ATOM 0 H GLN A 101 -2.309 0.225 -9.539 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.527 2.865 -10.668 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.806 0.292 -10.896 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.035 1.500 -10.578 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.949 1.737 -12.773 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.558 1.088 -13.015 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.780 3.918 -13.158 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -4.144 5.041 -13.130 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.991 2.143 -7.831 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.689 2.722 -6.691 1.00 0.00 C ATOM 1596 C ILE A 102 -3.871 3.858 -6.088 1.00 0.00 C ATOM 1597 O ILE A 102 -4.422 4.844 -5.600 1.00 0.00 O ATOM 1598 CB ILE A 102 -4.975 1.665 -5.604 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -5.748 0.489 -6.203 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -5.750 2.280 -4.446 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -7.119 0.868 -6.720 1.00 0.00 C ATOM 0 H ILE A 102 -3.677 1.183 -7.692 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.641 3.109 -7.055 1.00 0.00 H new ATOM 0 HB ILE A 102 -4.024 1.298 -5.219 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.166 0.060 -7.019 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.856 -0.288 -5.446 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.941 1.518 -3.691 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.166 3.088 -4.006 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.698 2.675 -4.811 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.610 -0.014 -7.130 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.718 1.269 -5.902 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.018 1.623 -7.500 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.551 3.715 -6.135 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.655 4.732 -5.602 1.00 0.00 C ATOM 1615 C PHE A 103 -1.640 5.957 -6.509 1.00 0.00 C ATOM 1616 O PHE A 103 -1.515 7.089 -6.042 1.00 0.00 O ATOM 1617 CB PHE A 103 -0.239 4.171 -5.460 1.00 0.00 C ATOM 1618 CG PHE A 103 -0.087 3.199 -4.325 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -0.308 3.601 -3.017 1.00 0.00 C ATOM 1620 CD2 PHE A 103 0.278 1.885 -4.565 1.00 0.00 C ATOM 1621 CE1 PHE A 103 -0.167 2.710 -1.971 1.00 0.00 C ATOM 1622 CE2 PHE A 103 0.421 0.989 -3.522 1.00 0.00 C ATOM 1623 CZ PHE A 103 0.198 1.402 -2.224 1.00 0.00 C ATOM 0 H PHE A 103 -2.079 2.905 -6.537 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.018 5.028 -4.618 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.042 3.677 -6.390 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.457 4.997 -5.315 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.594 4.622 -2.813 1.00 0.00 H new ATOM 0 HD2 PHE A 103 0.453 1.556 -5.579 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.342 3.036 -0.956 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.707 -0.033 -3.723 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.309 0.704 -1.408 1.00 0.00 H new ATOM 1633 N THR A 104 -1.766 5.720 -7.812 1.00 0.00 N ATOM 1634 CA THR A 104 -1.766 6.799 -8.792 1.00 0.00 C ATOM 1635 C THR A 104 -2.888 7.796 -8.519 1.00 0.00 C ATOM 1636 O THR A 104 -2.647 8.997 -8.413 1.00 0.00 O ATOM 1637 CB THR A 104 -1.909 6.232 -10.205 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.864 5.318 -10.488 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.892 7.298 -11.278 1.00 0.00 C ATOM 0 H THR A 104 -1.870 4.788 -8.213 1.00 0.00 H new ATOM 0 HA THR A 104 -0.814 7.324 -8.709 1.00 0.00 H new ATOM 0 HB THR A 104 -2.879 5.736 -10.222 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.969 4.519 -9.931 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.997 6.831 -12.257 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.718 7.991 -11.116 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.948 7.842 -11.235 1.00 0.00 H new ATOM 1647 N ALA A 105 -4.116 7.298 -8.414 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.262 8.163 -8.160 1.00 0.00 C ATOM 1649 C ALA A 105 -5.072 8.964 -6.883 1.00 0.00 C ATOM 1650 O ALA A 105 -5.090 10.195 -6.907 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.541 7.342 -8.088 1.00 0.00 C ATOM 0 H ALA A 105 -4.342 6.307 -8.500 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.344 8.866 -8.989 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.387 8.002 -7.898 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.693 6.821 -9.033 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.461 6.614 -7.281 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.893 8.271 -5.767 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.704 8.932 -4.487 1.00 0.00 C ATOM 1659 C PHE A 106 -3.378 9.693 -4.443 1.00 0.00 C ATOM 1660 O PHE A 106 -3.157 10.502 -3.547 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.755 7.905 -3.352 1.00 0.00 C ATOM 1662 CG PHE A 106 -6.116 7.301 -3.134 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.637 6.377 -4.029 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -6.872 7.651 -2.026 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -7.885 5.817 -3.824 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -8.119 7.092 -1.816 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.625 6.175 -2.716 1.00 0.00 C ATOM 0 H PHE A 106 -4.875 7.252 -5.724 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.512 9.653 -4.359 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.044 7.107 -3.566 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.429 8.383 -2.428 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.061 6.092 -4.897 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.483 8.368 -1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.279 5.101 -4.530 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.697 7.373 -0.948 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.599 5.738 -2.553 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.490 9.426 -5.405 1.00 0.00 N ATOM 1678 CA LYS A 107 -1.187 10.094 -5.449 1.00 0.00 C ATOM 1679 C LYS A 107 -1.324 11.594 -5.188 1.00 0.00 C ATOM 1680 O LYS A 107 -0.514 12.188 -4.477 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.502 9.848 -6.801 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.829 10.885 -7.869 1.00 0.00 C ATOM 1683 CD LYS A 107 -0.443 10.399 -9.258 1.00 0.00 C ATOM 1684 CE LYS A 107 0.757 11.158 -9.806 1.00 0.00 C ATOM 1685 NZ LYS A 107 0.413 11.925 -11.036 1.00 0.00 N ATOM 0 H LYS A 107 -2.648 8.757 -6.158 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.567 9.670 -4.659 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.577 9.828 -6.650 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.791 8.863 -7.167 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.895 11.109 -7.845 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.303 11.814 -7.649 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.214 9.334 -9.220 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -1.290 10.519 -9.934 1.00 0.00 H new ATOM 0 HE2 LYS A 107 1.133 11.842 -9.045 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.560 10.456 -10.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 1.256 12.428 -11.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.078 11.270 -11.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -0.336 12.613 -10.818 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.358 12.195 -5.766 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.609 13.620 -5.594 1.00 0.00 C ATOM 1701 C ASP A 108 -3.443 13.873 -4.343 1.00 0.00 C ATOM 1702 O ASP A 108 -3.258 14.875 -3.653 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.324 14.185 -6.823 1.00 0.00 C ATOM 1704 CG ASP A 108 -2.833 15.571 -7.191 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -2.881 16.468 -6.323 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -2.403 15.761 -8.348 1.00 0.00 O ATOM 0 H ASP A 108 -3.036 11.716 -6.358 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.650 14.124 -5.479 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -3.174 13.513 -7.668 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.396 14.221 -6.631 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.368 12.960 -4.063 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.240 13.086 -2.897 1.00 0.00 C ATOM 1713 C ASP A 109 -4.601 12.490 -1.638 1.00 0.00 C ATOM 1714 O ASP A 109 -5.258 12.360 -0.605 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.583 12.405 -3.170 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.761 13.260 -2.746 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -7.592 14.090 -1.828 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.852 13.100 -3.332 1.00 0.00 O ATOM 0 H ASP A 109 -4.534 12.126 -4.626 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.397 14.150 -2.718 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.664 12.181 -4.234 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.619 11.453 -2.640 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.327 12.114 -1.731 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.620 11.518 -0.601 1.00 0.00 C ATOM 1725 C VAL A 110 -2.013 12.582 0.312 1.00 0.00 C ATOM 1726 O VAL A 110 -1.817 13.727 -0.095 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.504 10.571 -1.085 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.446 11.337 -1.866 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.880 9.830 0.089 1.00 0.00 C ATOM 0 H VAL A 110 -2.764 12.212 -2.576 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.357 10.950 -0.033 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.949 9.834 -1.753 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.331 10.648 -2.197 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.906 11.810 -2.734 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.005 12.102 -1.227 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.095 9.167 -0.275 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.453 10.549 0.788 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.645 9.242 0.596 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.722 12.191 1.551 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.140 13.106 2.528 1.00 0.00 C ATOM 1741 C ASP A 111 0.122 12.519 3.159 1.00 0.00 C ATOM 1742 O ASP A 111 1.083 13.240 3.427 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.161 13.433 3.620 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.919 14.715 3.336 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -2.275 15.783 3.272 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -4.156 14.650 3.178 1.00 0.00 O ATOM 0 H ASP A 111 -1.880 11.246 1.901 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.864 14.021 2.003 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.868 12.608 3.711 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.649 13.521 4.578 1.00 0.00 H new ATOM 1751 N THR A 112 0.115 11.209 3.399 1.00 0.00 N ATOM 1752 CA THR A 112 1.263 10.538 4.003 1.00 0.00 C ATOM 1753 C THR A 112 1.882 9.535 3.033 1.00 0.00 C ATOM 1754 O THR A 112 1.226 9.067 2.101 1.00 0.00 O ATOM 1755 CB THR A 112 0.855 9.832 5.297 1.00 0.00 C ATOM 1756 OG1 THR A 112 0.300 10.755 6.218 1.00 0.00 O ATOM 1757 CG2 THR A 112 2.008 9.130 5.988 1.00 0.00 C ATOM 0 H THR A 112 -0.670 10.594 3.185 1.00 0.00 H new ATOM 0 HA THR A 112 2.009 11.298 4.237 1.00 0.00 H new ATOM 0 HB THR A 112 0.122 9.083 4.998 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.044 10.284 7.039 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.649 8.650 6.899 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.427 8.376 5.322 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.778 9.858 6.241 1.00 0.00 H new ATOM 1765 N LEU A 113 3.149 9.205 3.263 1.00 0.00 N ATOM 1766 CA LEU A 113 3.855 8.259 2.413 1.00 0.00 C ATOM 1767 C LEU A 113 4.753 7.337 3.234 1.00 0.00 C ATOM 1768 O LEU A 113 5.550 7.793 4.054 1.00 0.00 O ATOM 1769 CB LEU A 113 4.687 9.012 1.375 1.00 0.00 C ATOM 1770 CG LEU A 113 4.394 8.657 -0.083 1.00 0.00 C ATOM 1771 CD1 LEU A 113 2.897 8.688 -0.355 1.00 0.00 C ATOM 1772 CD2 LEU A 113 5.124 9.616 -1.006 1.00 0.00 C ATOM 0 H LEU A 113 3.706 9.580 4.031 1.00 0.00 H new ATOM 0 HA LEU A 113 3.114 7.642 1.905 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.525 10.081 1.511 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.742 8.822 1.573 1.00 0.00 H new ATOM 0 HG LEU A 113 4.750 7.645 -0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.711 8.432 -1.398 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.395 7.967 0.290 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.511 9.687 -0.152 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.910 9.357 -2.043 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.789 10.635 -0.810 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.197 9.546 -0.828 1.00 0.00 H new ATOM 1784 N LEU A 114 4.617 6.039 2.995 1.00 0.00 N ATOM 1785 CA LEU A 114 5.411 5.034 3.693 1.00 0.00 C ATOM 1786 C LEU A 114 5.896 3.978 2.707 1.00 0.00 C ATOM 1787 O LEU A 114 5.091 3.305 2.063 1.00 0.00 O ATOM 1788 CB LEU A 114 4.586 4.379 4.802 1.00 0.00 C ATOM 1789 CG LEU A 114 4.064 5.339 5.871 1.00 0.00 C ATOM 1790 CD1 LEU A 114 2.769 4.814 6.472 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.111 5.545 6.955 1.00 0.00 C ATOM 0 H LEU A 114 3.959 5.654 2.317 1.00 0.00 H new ATOM 0 HA LEU A 114 6.275 5.522 4.145 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.737 3.867 4.349 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.196 3.617 5.286 1.00 0.00 H new ATOM 0 HG LEU A 114 3.859 6.301 5.402 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.412 5.510 7.231 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.018 4.715 5.688 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.948 3.840 6.928 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.724 6.231 7.709 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.345 4.588 7.421 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.015 5.964 6.513 1.00 0.00 H new ATOM 1803 N VAL A 115 7.211 3.845 2.574 1.00 0.00 N ATOM 1804 CA VAL A 115 7.773 2.877 1.642 1.00 0.00 C ATOM 1805 C VAL A 115 8.963 2.128 2.231 1.00 0.00 C ATOM 1806 O VAL A 115 9.689 2.649 3.076 1.00 0.00 O ATOM 1807 CB VAL A 115 8.217 3.563 0.337 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.038 4.244 -0.335 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.331 4.563 0.601 1.00 0.00 C ATOM 0 H VAL A 115 7.900 4.389 3.093 1.00 0.00 H new ATOM 0 HA VAL A 115 6.980 2.159 1.435 1.00 0.00 H new ATOM 0 HB VAL A 115 8.602 2.796 -0.335 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.371 4.723 -1.256 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.274 3.502 -0.568 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.622 4.996 0.335 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.627 5.034 -0.336 1.00 0.00 H new ATOM 0 HG22 VAL A 115 8.978 5.326 1.295 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.188 4.047 1.034 1.00 0.00 H new ATOM 1819 N THR A 116 9.159 0.903 1.753 1.00 0.00 N ATOM 1820 CA THR A 116 10.266 0.067 2.197 1.00 0.00 C ATOM 1821 C THR A 116 11.222 -0.179 1.035 1.00 0.00 C ATOM 1822 O THR A 116 10.974 -1.035 0.186 1.00 0.00 O ATOM 1823 CB THR A 116 9.740 -1.265 2.744 1.00 0.00 C ATOM 1824 OG1 THR A 116 9.028 -1.066 3.952 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.830 -2.281 3.014 1.00 0.00 C ATOM 0 H THR A 116 8.560 0.466 1.053 1.00 0.00 H new ATOM 0 HA THR A 116 10.802 0.580 2.996 1.00 0.00 H new ATOM 0 HB THR A 116 9.090 -1.658 1.962 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.528 -0.452 4.529 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.385 -3.198 3.399 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.363 -2.497 2.088 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.527 -1.880 3.749 1.00 0.00 H new ATOM 1833 N ARG A 117 12.306 0.586 0.994 1.00 0.00 N ATOM 1834 CA ARG A 117 13.286 0.460 -0.076 1.00 0.00 C ATOM 1835 C ARG A 117 14.223 -0.719 0.162 1.00 0.00 C ATOM 1836 O ARG A 117 15.098 -0.667 1.028 1.00 0.00 O ATOM 1837 CB ARG A 117 14.095 1.752 -0.207 1.00 0.00 C ATOM 1838 CG ARG A 117 14.401 2.135 -1.647 1.00 0.00 C ATOM 1839 CD ARG A 117 15.859 1.882 -1.998 1.00 0.00 C ATOM 1840 NE ARG A 117 16.739 2.920 -1.463 1.00 0.00 N ATOM 1841 CZ ARG A 117 17.457 2.792 -0.347 1.00 0.00 C ATOM 1842 NH1 ARG A 117 17.409 1.672 0.365 1.00 0.00 N ATOM 1843 NH2 ARG A 117 18.228 3.792 0.059 1.00 0.00 N ATOM 0 H ARG A 117 12.528 1.299 1.689 1.00 0.00 H new ATOM 0 HA ARG A 117 12.744 0.278 -1.004 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.545 2.565 0.267 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.033 1.641 0.338 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.760 1.564 -2.319 1.00 0.00 H new ATOM 0 HG3 ARG A 117 14.167 3.188 -1.801 1.00 0.00 H new ATOM 0 HD2 ARG A 117 16.163 0.911 -1.606 1.00 0.00 H new ATOM 0 HD3 ARG A 117 15.969 1.837 -3.082 1.00 0.00 H new ATOM 0 HE ARG A 117 16.808 3.799 -1.977 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.818 0.898 0.060 1.00 0.00 H new ATOM 0 HH12 ARG A 117 17.963 1.585 1.217 1.00 0.00 H new ATOM 0 HH21 ARG A 117 18.270 4.656 -0.482 1.00 0.00 H new ATOM 0 HH22 ARG A 117 18.779 3.697 0.912 1.00 0.00 H new ATOM 1857 N LEU A 118 14.033 -1.780 -0.616 1.00 0.00 N ATOM 1858 CA LEU A 118 14.859 -2.976 -0.501 1.00 0.00 C ATOM 1859 C LEU A 118 16.259 -2.720 -1.051 1.00 0.00 C ATOM 1860 O LEU A 118 16.451 -1.859 -1.909 1.00 0.00 O ATOM 1861 CB LEU A 118 14.208 -4.142 -1.252 1.00 0.00 C ATOM 1862 CG LEU A 118 13.638 -5.248 -0.363 1.00 0.00 C ATOM 1863 CD1 LEU A 118 12.355 -4.786 0.311 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.394 -6.512 -1.175 1.00 0.00 C ATOM 0 H LEU A 118 13.312 -1.835 -1.335 1.00 0.00 H new ATOM 0 HA LEU A 118 14.943 -3.234 0.555 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.405 -3.749 -1.876 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.947 -4.581 -1.922 1.00 0.00 H new ATOM 0 HG LEU A 118 14.368 -5.475 0.414 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.965 -5.587 0.939 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.562 -3.911 0.926 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.617 -4.529 -0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.988 -7.288 -0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.684 -6.300 -1.974 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.335 -6.854 -1.607 1.00 0.00 H new ATOM 1876 N ALA A 119 17.234 -3.474 -0.554 1.00 0.00 N ATOM 1877 CA ALA A 119 18.614 -3.329 -1.000 1.00 0.00 C ATOM 1878 C ALA A 119 18.831 -4.030 -2.335 1.00 0.00 C ATOM 1879 O ALA A 119 19.474 -3.492 -3.236 1.00 0.00 O ATOM 1880 CB ALA A 119 19.570 -3.882 0.046 1.00 0.00 C ATOM 0 H ALA A 119 17.094 -4.191 0.158 1.00 0.00 H new ATOM 0 HA ALA A 119 18.816 -2.267 -1.135 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.596 -3.766 -0.302 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.440 -3.338 0.981 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.359 -4.939 0.209 1.00 0.00 H new ATOM 1886 N GLY A 120 18.293 -5.238 -2.452 1.00 0.00 N ATOM 1887 CA GLY A 120 18.439 -5.999 -3.676 1.00 0.00 C ATOM 1888 C GLY A 120 17.695 -5.381 -4.843 1.00 0.00 C ATOM 1889 O GLY A 120 16.641 -4.768 -4.666 1.00 0.00 O ATOM 0 H GLY A 120 17.758 -5.704 -1.719 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.497 -6.077 -3.926 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.074 -7.013 -3.514 1.00 0.00 H new ATOM 1893 N SER A 121 18.245 -5.547 -6.040 1.00 0.00 N ATOM 1894 CA SER A 121 17.629 -5.008 -7.246 1.00 0.00 C ATOM 1895 C SER A 121 16.862 -6.098 -7.987 1.00 0.00 C ATOM 1896 O SER A 121 17.453 -7.044 -8.507 1.00 0.00 O ATOM 1897 CB SER A 121 18.693 -4.403 -8.163 1.00 0.00 C ATOM 1898 OG SER A 121 19.428 -3.393 -7.494 1.00 0.00 O ATOM 0 H SER A 121 19.117 -6.051 -6.201 1.00 0.00 H new ATOM 0 HA SER A 121 16.930 -4.225 -6.953 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.371 -5.185 -8.504 1.00 0.00 H new ATOM 0 HB3 SER A 121 18.218 -3.984 -9.050 1.00 0.00 H new ATOM 0 HG SER A 121 20.103 -3.023 -8.101 1.00 0.00 H new ATOM 1904 N PHE A 122 15.541 -5.961 -8.026 1.00 0.00 N ATOM 1905 CA PHE A 122 14.690 -6.936 -8.697 1.00 0.00 C ATOM 1906 C PHE A 122 14.085 -6.352 -9.970 1.00 0.00 C ATOM 1907 O PHE A 122 14.086 -5.137 -10.170 1.00 0.00 O ATOM 1908 CB PHE A 122 13.581 -7.407 -7.756 1.00 0.00 C ATOM 1909 CG PHE A 122 14.096 -8.035 -6.492 1.00 0.00 C ATOM 1910 CD1 PHE A 122 14.733 -7.266 -5.531 1.00 0.00 C ATOM 1911 CD2 PHE A 122 13.945 -9.394 -6.266 1.00 0.00 C ATOM 1912 CE1 PHE A 122 15.210 -7.840 -4.368 1.00 0.00 C ATOM 1913 CE2 PHE A 122 14.421 -9.974 -5.104 1.00 0.00 C ATOM 1914 CZ PHE A 122 15.054 -9.196 -4.155 1.00 0.00 C ATOM 0 H PHE A 122 15.036 -5.183 -7.600 1.00 0.00 H new ATOM 0 HA PHE A 122 15.308 -7.790 -8.974 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.948 -6.558 -7.499 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.952 -8.126 -8.280 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.858 -6.206 -5.693 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.450 -10.007 -7.005 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.704 -7.229 -3.627 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.298 -11.034 -4.939 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.427 -9.647 -3.247 1.00 0.00 H new ATOM 1924 N GLU A 123 13.568 -7.226 -10.826 1.00 0.00 N ATOM 1925 CA GLU A 123 12.957 -6.799 -12.078 1.00 0.00 C ATOM 1926 C GLU A 123 11.622 -7.504 -12.295 1.00 0.00 C ATOM 1927 O GLU A 123 11.506 -8.712 -12.086 1.00 0.00 O ATOM 1928 CB GLU A 123 13.896 -7.078 -13.254 1.00 0.00 C ATOM 1929 CG GLU A 123 14.157 -8.557 -13.488 1.00 0.00 C ATOM 1930 CD GLU A 123 15.629 -8.868 -13.674 1.00 0.00 C ATOM 1931 OE1 GLU A 123 16.319 -9.101 -12.659 1.00 0.00 O ATOM 1932 OE2 GLU A 123 16.092 -8.877 -14.834 1.00 0.00 O ATOM 0 H GLU A 123 13.560 -8.235 -10.675 1.00 0.00 H new ATOM 0 HA GLU A 123 12.777 -5.726 -12.019 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.469 -6.645 -14.159 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.846 -6.574 -13.077 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.773 -9.128 -12.643 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.606 -8.884 -14.370 1.00 0.00 H new ATOM 1939 N GLY A 124 10.617 -6.743 -12.714 1.00 0.00 N ATOM 1940 CA GLY A 124 9.304 -7.314 -12.950 1.00 0.00 C ATOM 1941 C GLY A 124 8.484 -6.498 -13.930 1.00 0.00 C ATOM 1942 O GLY A 124 9.002 -6.033 -14.946 1.00 0.00 O ATOM 0 H GLY A 124 10.688 -5.742 -12.894 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.416 -8.329 -13.331 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.767 -7.386 -12.004 1.00 0.00 H new ATOM 1946 N ASP A 125 7.202 -6.325 -13.626 1.00 0.00 N ATOM 1947 CA ASP A 125 6.309 -5.561 -14.489 1.00 0.00 C ATOM 1948 C ASP A 125 5.370 -4.684 -13.665 1.00 0.00 C ATOM 1949 O ASP A 125 4.250 -4.393 -14.084 1.00 0.00 O ATOM 1950 CB ASP A 125 5.497 -6.505 -15.378 1.00 0.00 C ATOM 1951 CG ASP A 125 5.304 -5.957 -16.779 1.00 0.00 C ATOM 1952 OD1 ASP A 125 6.302 -5.518 -17.387 1.00 0.00 O ATOM 1953 OD2 ASP A 125 4.154 -5.968 -17.267 1.00 0.00 O ATOM 0 H ASP A 125 6.758 -6.703 -12.789 1.00 0.00 H new ATOM 0 HA ASP A 125 6.919 -4.913 -15.119 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.001 -7.470 -15.434 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.523 -6.681 -14.922 1.00 0.00 H new ATOM 1958 N THR A 126 5.835 -4.264 -12.492 1.00 0.00 N ATOM 1959 CA THR A 126 5.035 -3.418 -11.613 1.00 0.00 C ATOM 1960 C THR A 126 5.915 -2.412 -10.880 1.00 0.00 C ATOM 1961 O THR A 126 6.630 -2.765 -9.942 1.00 0.00 O ATOM 1962 CB THR A 126 4.270 -4.275 -10.604 1.00 0.00 C ATOM 1963 OG1 THR A 126 3.795 -5.463 -11.213 1.00 0.00 O ATOM 1964 CG2 THR A 126 3.080 -3.564 -9.996 1.00 0.00 C ATOM 0 H THR A 126 6.760 -4.495 -12.129 1.00 0.00 H new ATOM 0 HA THR A 126 4.321 -2.869 -12.227 1.00 0.00 H new ATOM 0 HB THR A 126 4.985 -4.496 -9.812 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.310 -5.998 -10.551 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.582 -4.228 -9.289 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.418 -2.668 -9.476 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.382 -3.284 -10.785 1.00 0.00 H new ATOM 1972 N LYS A 127 5.856 -1.157 -11.315 1.00 0.00 N ATOM 1973 CA LYS A 127 6.647 -0.094 -10.704 1.00 0.00 C ATOM 1974 C LYS A 127 5.747 0.985 -10.111 1.00 0.00 C ATOM 1975 O LYS A 127 4.571 1.089 -10.461 1.00 0.00 O ATOM 1976 CB LYS A 127 7.589 0.525 -11.739 1.00 0.00 C ATOM 1977 CG LYS A 127 8.576 1.520 -11.149 1.00 0.00 C ATOM 1978 CD LYS A 127 9.491 2.097 -12.217 1.00 0.00 C ATOM 1979 CE LYS A 127 10.577 1.109 -12.616 1.00 0.00 C ATOM 1980 NZ LYS A 127 10.323 0.519 -13.959 1.00 0.00 N ATOM 0 H LYS A 127 5.267 -0.851 -12.090 1.00 0.00 H new ATOM 0 HA LYS A 127 7.236 -0.531 -9.898 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.143 -0.272 -12.236 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.996 1.026 -12.504 1.00 0.00 H new ATOM 0 HG2 LYS A 127 8.032 2.328 -10.660 1.00 0.00 H new ATOM 0 HG3 LYS A 127 9.175 1.029 -10.382 1.00 0.00 H new ATOM 0 HD2 LYS A 127 8.903 2.366 -13.094 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.950 3.014 -11.847 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.544 1.613 -12.617 1.00 0.00 H new ATOM 0 HE3 LYS A 127 10.634 0.312 -11.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 11.085 -0.149 -14.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 9.412 0.017 -13.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 10.294 1.276 -14.671 1.00 0.00 H new ATOM 1994 N MET A 128 6.307 1.786 -9.211 1.00 0.00 N ATOM 1995 CA MET A 128 5.557 2.859 -8.566 1.00 0.00 C ATOM 1996 C MET A 128 5.387 4.050 -9.505 1.00 0.00 C ATOM 1997 O MET A 128 6.149 4.217 -10.457 1.00 0.00 O ATOM 1998 CB MET A 128 6.264 3.302 -7.284 1.00 0.00 C ATOM 1999 CG MET A 128 5.456 4.283 -6.450 1.00 0.00 C ATOM 2000 SD MET A 128 3.946 3.553 -5.787 1.00 0.00 S ATOM 2001 CE MET A 128 3.192 4.982 -5.013 1.00 0.00 C ATOM 0 H MET A 128 7.279 1.713 -8.911 1.00 0.00 H new ATOM 0 HA MET A 128 4.568 2.476 -8.315 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.487 2.423 -6.680 1.00 0.00 H new ATOM 0 HB3 MET A 128 7.218 3.760 -7.545 1.00 0.00 H new ATOM 0 HG2 MET A 128 6.071 4.646 -5.627 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.199 5.148 -7.062 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.641 4.667 -4.127 1.00 0.00 H new ATOM 0 HE2 MET A 128 3.968 5.691 -4.725 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.508 5.458 -5.716 1.00 0.00 H new ATOM 2011 N ILE A 129 4.383 4.877 -9.227 1.00 0.00 N ATOM 2012 CA ILE A 129 4.111 6.056 -10.042 1.00 0.00 C ATOM 2013 C ILE A 129 4.837 7.284 -9.492 1.00 0.00 C ATOM 2014 O ILE A 129 5.135 7.355 -8.299 1.00 0.00 O ATOM 2015 CB ILE A 129 2.598 6.350 -10.117 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.029 6.592 -8.716 1.00 0.00 C ATOM 2017 CG2 ILE A 129 1.864 5.204 -10.800 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.914 8.056 -8.359 1.00 0.00 C ATOM 0 H ILE A 129 3.744 4.752 -8.442 1.00 0.00 H new ATOM 0 HA ILE A 129 4.479 5.842 -11.045 1.00 0.00 H new ATOM 0 HB ILE A 129 2.452 7.253 -10.709 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.044 6.131 -8.647 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.665 6.096 -7.983 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.798 5.429 -10.844 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.250 5.076 -11.811 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.018 4.285 -10.234 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.504 8.154 -7.354 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.901 8.518 -8.395 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.254 8.553 -9.070 1.00 0.00 H new ATOM 2030 N PRO A 130 5.135 8.271 -10.358 1.00 0.00 N ATOM 2031 CA PRO A 130 5.832 9.500 -9.953 1.00 0.00 C ATOM 2032 C PRO A 130 5.083 10.264 -8.866 1.00 0.00 C ATOM 2033 O PRO A 130 3.860 10.184 -8.769 1.00 0.00 O ATOM 2034 CB PRO A 130 5.896 10.329 -11.243 1.00 0.00 C ATOM 2035 CG PRO A 130 4.873 9.727 -12.146 1.00 0.00 C ATOM 2036 CD PRO A 130 4.820 8.270 -11.794 1.00 0.00 C ATOM 0 HA PRO A 130 6.811 9.283 -9.525 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.679 11.379 -11.047 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.889 10.286 -11.690 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.901 10.199 -12.004 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.145 9.866 -13.192 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.838 7.841 -11.992 1.00 0.00 H new ATOM 0 HD3 PRO A 130 5.543 7.689 -12.366 1.00 0.00 H new ATOM 2044 N LEU A 131 5.827 11.003 -8.047 1.00 0.00 N ATOM 2045 CA LEU A 131 5.230 11.777 -6.961 1.00 0.00 C ATOM 2046 C LEU A 131 5.973 13.093 -6.748 1.00 0.00 C ATOM 2047 O LEU A 131 7.167 13.196 -7.028 1.00 0.00 O ATOM 2048 CB LEU A 131 5.240 10.972 -5.653 1.00 0.00 C ATOM 2049 CG LEU A 131 5.356 9.450 -5.803 1.00 0.00 C ATOM 2050 CD1 LEU A 131 6.188 8.864 -4.672 1.00 0.00 C ATOM 2051 CD2 LEU A 131 3.975 8.814 -5.832 1.00 0.00 C ATOM 0 H LEU A 131 6.842 11.082 -8.114 1.00 0.00 H new ATOM 0 HA LEU A 131 4.200 11.996 -7.244 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.071 11.322 -5.040 1.00 0.00 H new ATOM 0 HB3 LEU A 131 4.324 11.195 -5.105 1.00 0.00 H new ATOM 0 HG LEU A 131 5.857 9.233 -6.746 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.259 7.783 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.187 9.298 -4.693 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.714 9.090 -3.717 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.074 7.734 -5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.451 9.040 -4.904 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.409 9.212 -6.674 1.00 0.00 H new ATOM 2063 N ASN A 132 5.261 14.091 -6.229 1.00 0.00 N ATOM 2064 CA ASN A 132 5.857 15.394 -5.954 1.00 0.00 C ATOM 2065 C ASN A 132 6.612 15.345 -4.631 1.00 0.00 C ATOM 2066 O ASN A 132 6.106 15.778 -3.595 1.00 0.00 O ATOM 2067 CB ASN A 132 4.780 16.479 -5.906 1.00 0.00 C ATOM 2068 CG ASN A 132 5.262 17.797 -6.479 1.00 0.00 C ATOM 2069 OD1 ASN A 132 4.604 18.396 -7.329 1.00 0.00 O ATOM 2070 ND2 ASN A 132 6.419 18.257 -6.015 1.00 0.00 N ATOM 0 H ASN A 132 4.272 14.021 -5.991 1.00 0.00 H new ATOM 0 HA ASN A 132 6.554 15.638 -6.756 1.00 0.00 H new ATOM 0 HB2 ASN A 132 3.904 16.143 -6.461 1.00 0.00 H new ATOM 0 HB3 ASN A 132 4.464 16.628 -4.873 1.00 0.00 H new ATOM 0 HD21 ASN A 132 6.794 19.139 -6.364 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.932 17.728 -5.310 1.00 0.00 H new ATOM 2077 N TRP A 133 7.816 14.790 -4.673 1.00 0.00 N ATOM 2078 CA TRP A 133 8.643 14.647 -3.483 1.00 0.00 C ATOM 2079 C TRP A 133 8.895 15.982 -2.788 1.00 0.00 C ATOM 2080 O TRP A 133 8.885 16.051 -1.558 1.00 0.00 O ATOM 2081 CB TRP A 133 9.966 13.973 -3.845 1.00 0.00 C ATOM 2082 CG TRP A 133 9.779 12.585 -4.379 1.00 0.00 C ATOM 2083 CD1 TRP A 133 9.467 12.236 -5.662 1.00 0.00 C ATOM 2084 CD2 TRP A 133 9.882 11.361 -3.643 1.00 0.00 C ATOM 2085 NE1 TRP A 133 9.371 10.869 -5.768 1.00 0.00 N ATOM 2086 CE2 TRP A 133 9.622 10.310 -4.543 1.00 0.00 C ATOM 2087 CE3 TRP A 133 10.169 11.051 -2.311 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 9.642 8.973 -4.153 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 10.189 9.724 -1.925 1.00 0.00 C ATOM 2090 CH2 TRP A 133 9.927 8.700 -2.843 1.00 0.00 C ATOM 0 H TRP A 133 8.244 14.429 -5.526 1.00 0.00 H new ATOM 0 HA TRP A 133 8.098 14.020 -2.778 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.486 14.577 -4.588 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.604 13.936 -2.962 1.00 0.00 H new ATOM 0 HD1 TRP A 133 9.318 12.932 -6.474 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.149 10.354 -6.620 1.00 0.00 H new ATOM 0 HE3 TRP A 133 10.372 11.834 -1.596 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 9.440 8.181 -4.859 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 10.410 9.473 -0.898 1.00 0.00 H new ATOM 0 HH2 TRP A 133 9.950 7.673 -2.510 1.00 0.00 H new ATOM 2101 N ASP A 134 9.120 17.044 -3.558 1.00 0.00 N ATOM 2102 CA ASP A 134 9.369 18.359 -2.974 1.00 0.00 C ATOM 2103 C ASP A 134 8.224 18.770 -2.053 1.00 0.00 C ATOM 2104 O ASP A 134 8.447 19.311 -0.970 1.00 0.00 O ATOM 2105 CB ASP A 134 9.556 19.404 -4.078 1.00 0.00 C ATOM 2106 CG ASP A 134 10.964 19.967 -4.108 1.00 0.00 C ATOM 2107 OD1 ASP A 134 11.892 19.270 -3.645 1.00 0.00 O ATOM 2108 OD2 ASP A 134 11.139 21.104 -4.594 1.00 0.00 O ATOM 0 H ASP A 134 9.135 17.021 -4.578 1.00 0.00 H new ATOM 0 HA ASP A 134 10.283 18.301 -2.383 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.327 18.953 -5.044 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.845 20.217 -3.929 1.00 0.00 H new ATOM 2113 N ASP A 135 6.996 18.514 -2.496 1.00 0.00 N ATOM 2114 CA ASP A 135 5.812 18.861 -1.717 1.00 0.00 C ATOM 2115 C ASP A 135 5.636 17.931 -0.515 1.00 0.00 C ATOM 2116 O ASP A 135 4.689 18.081 0.257 1.00 0.00 O ATOM 2117 CB ASP A 135 4.565 18.811 -2.603 1.00 0.00 C ATOM 2118 CG ASP A 135 4.037 20.192 -2.938 1.00 0.00 C ATOM 2119 OD1 ASP A 135 3.264 20.745 -2.127 1.00 0.00 O ATOM 2120 OD2 ASP A 135 4.396 20.722 -4.010 1.00 0.00 O ATOM 0 H ASP A 135 6.795 18.067 -3.391 1.00 0.00 H new ATOM 0 HA ASP A 135 5.949 19.874 -1.340 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.800 18.281 -3.526 1.00 0.00 H new ATOM 0 HB3 ASP A 135 3.786 18.240 -2.097 1.00 0.00 H new ATOM 2125 N PHE A 136 6.549 16.975 -0.354 1.00 0.00 N ATOM 2126 CA PHE A 136 6.481 16.038 0.760 1.00 0.00 C ATOM 2127 C PHE A 136 7.768 16.073 1.576 1.00 0.00 C ATOM 2128 O PHE A 136 8.869 16.052 1.026 1.00 0.00 O ATOM 2129 CB PHE A 136 6.229 14.621 0.245 1.00 0.00 C ATOM 2130 CG PHE A 136 4.830 14.407 -0.255 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.754 14.468 0.615 1.00 0.00 C ATOM 2132 CD2 PHE A 136 4.592 14.147 -1.595 1.00 0.00 C ATOM 2133 CE1 PHE A 136 2.465 14.273 0.158 1.00 0.00 C ATOM 2134 CE2 PHE A 136 3.305 13.952 -2.058 1.00 0.00 C ATOM 2135 CZ PHE A 136 2.239 14.014 -1.180 1.00 0.00 C ATOM 0 H PHE A 136 7.341 16.831 -0.980 1.00 0.00 H new ATOM 0 HA PHE A 136 5.654 16.335 1.405 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.931 14.405 -0.560 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.433 13.910 1.046 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.925 14.670 1.662 1.00 0.00 H new ATOM 0 HD2 PHE A 136 5.421 14.096 -2.285 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.634 14.323 0.846 1.00 0.00 H new ATOM 0 HE2 PHE A 136 3.132 13.751 -3.105 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.232 13.860 -1.539 1.00 0.00 H new ATOM 2145 N THR A 137 7.616 16.142 2.893 1.00 0.00 N ATOM 2146 CA THR A 137 8.760 16.197 3.794 1.00 0.00 C ATOM 2147 C THR A 137 8.841 14.936 4.646 1.00 0.00 C ATOM 2148 O THR A 137 7.855 14.517 5.252 1.00 0.00 O ATOM 2149 CB THR A 137 8.664 17.434 4.692 1.00 0.00 C ATOM 2150 OG1 THR A 137 8.795 18.619 3.927 1.00 0.00 O ATOM 2151 CG2 THR A 137 9.714 17.473 5.782 1.00 0.00 C ATOM 0 H THR A 137 6.710 16.161 3.361 1.00 0.00 H new ATOM 0 HA THR A 137 9.667 16.263 3.193 1.00 0.00 H new ATOM 0 HB THR A 137 7.683 17.371 5.162 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.081 18.656 3.257 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.586 18.376 6.379 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.607 16.597 6.422 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.706 17.474 5.331 1.00 0.00 H new ATOM 2159 N LYS A 138 10.026 14.335 4.683 1.00 0.00 N ATOM 2160 CA LYS A 138 10.240 13.121 5.452 1.00 0.00 C ATOM 2161 C LYS A 138 9.983 13.363 6.930 1.00 0.00 C ATOM 2162 O LYS A 138 10.651 14.181 7.563 1.00 0.00 O ATOM 2163 CB LYS A 138 11.661 12.599 5.251 1.00 0.00 C ATOM 2164 CG LYS A 138 11.895 11.245 5.897 1.00 0.00 C ATOM 2165 CD LYS A 138 12.671 10.313 4.982 1.00 0.00 C ATOM 2166 CE LYS A 138 14.038 10.880 4.637 1.00 0.00 C ATOM 2167 NZ LYS A 138 15.082 9.819 4.581 1.00 0.00 N ATOM 0 H LYS A 138 10.852 14.672 4.188 1.00 0.00 H new ATOM 0 HA LYS A 138 9.535 12.371 5.094 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.867 12.526 4.183 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.368 13.319 5.664 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.442 11.377 6.831 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.936 10.792 6.150 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.790 9.343 5.465 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.104 10.146 4.066 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.987 11.390 3.675 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.319 11.627 5.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.935 10.195 4.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 15.318 9.513 5.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.723 9.007 4.038 1.00 0.00 H new ATOM 2181 N VAL A 139 9.018 12.639 7.477 1.00 0.00 N ATOM 2182 CA VAL A 139 8.681 12.769 8.888 1.00 0.00 C ATOM 2183 C VAL A 139 9.449 11.746 9.712 1.00 0.00 C ATOM 2184 O VAL A 139 9.786 11.994 10.870 1.00 0.00 O ATOM 2185 CB VAL A 139 7.164 12.614 9.158 1.00 0.00 C ATOM 2186 CG1 VAL A 139 6.511 13.979 9.312 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.479 11.816 8.056 1.00 0.00 C ATOM 0 H VAL A 139 8.456 11.957 6.968 1.00 0.00 H new ATOM 0 HA VAL A 139 8.966 13.778 9.184 1.00 0.00 H new ATOM 0 HB VAL A 139 7.046 12.060 10.089 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.445 13.853 9.501 1.00 0.00 H new ATOM 0 HG12 VAL A 139 6.968 14.509 10.148 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.652 14.555 8.397 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.416 11.727 8.278 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.609 12.327 7.102 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.922 10.822 7.998 1.00 0.00 H new ATOM 2197 N SER A 140 9.728 10.593 9.109 1.00 0.00 N ATOM 2198 CA SER A 140 10.463 9.539 9.799 1.00 0.00 C ATOM 2199 C SER A 140 11.332 8.750 8.825 1.00 0.00 C ATOM 2200 O SER A 140 11.011 8.635 7.643 1.00 0.00 O ATOM 2201 CB SER A 140 9.493 8.600 10.521 1.00 0.00 C ATOM 2202 OG SER A 140 9.736 8.591 11.917 1.00 0.00 O ATOM 0 H SER A 140 9.458 10.367 8.152 1.00 0.00 H new ATOM 0 HA SER A 140 11.116 10.008 10.535 1.00 0.00 H new ATOM 0 HB2 SER A 140 8.467 8.914 10.329 1.00 0.00 H new ATOM 0 HB3 SER A 140 9.596 7.590 10.124 1.00 0.00 H new ATOM 0 HG SER A 140 9.103 7.985 12.355 1.00 0.00 H new ATOM 2208 N SER A 141 12.437 8.210 9.330 1.00 0.00 N ATOM 2209 CA SER A 141 13.353 7.433 8.503 1.00 0.00 C ATOM 2210 C SER A 141 14.148 6.444 9.351 1.00 0.00 C ATOM 2211 O SER A 141 14.817 6.829 10.310 1.00 0.00 O ATOM 2212 CB SER A 141 14.308 8.362 7.753 1.00 0.00 C ATOM 2213 OG SER A 141 15.283 8.906 8.625 1.00 0.00 O ATOM 0 H SER A 141 12.719 8.296 10.306 1.00 0.00 H new ATOM 0 HA SER A 141 12.762 6.870 7.781 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.800 7.812 6.951 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.743 9.169 7.286 1.00 0.00 H new ATOM 0 HG SER A 141 15.356 8.345 9.425 1.00 0.00 H new ATOM 2219 N ARG A 142 14.069 5.167 8.989 1.00 0.00 N ATOM 2220 CA ARG A 142 14.781 4.121 9.714 1.00 0.00 C ATOM 2221 C ARG A 142 15.295 3.053 8.755 1.00 0.00 C ATOM 2222 O ARG A 142 14.617 2.691 7.793 1.00 0.00 O ATOM 2223 CB ARG A 142 13.867 3.484 10.762 1.00 0.00 C ATOM 2224 CG ARG A 142 14.599 2.574 11.736 1.00 0.00 C ATOM 2225 CD ARG A 142 15.468 3.367 12.700 1.00 0.00 C ATOM 2226 NE ARG A 142 16.889 3.088 12.512 1.00 0.00 N ATOM 2227 CZ ARG A 142 17.850 3.569 13.298 1.00 0.00 C ATOM 2228 NH1 ARG A 142 17.547 4.351 14.326 1.00 0.00 N ATOM 2229 NH2 ARG A 142 19.118 3.265 13.056 1.00 0.00 N ATOM 0 H ARG A 142 13.519 4.832 8.198 1.00 0.00 H new ATOM 0 HA ARG A 142 15.634 4.577 10.217 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.365 4.273 11.322 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.091 2.910 10.255 1.00 0.00 H new ATOM 0 HG2 ARG A 142 13.875 1.985 12.299 1.00 0.00 H new ATOM 0 HG3 ARG A 142 15.219 1.870 11.181 1.00 0.00 H new ATOM 0 HD2 ARG A 142 15.286 4.432 12.559 1.00 0.00 H new ATOM 0 HD3 ARG A 142 15.184 3.128 13.725 1.00 0.00 H new ATOM 0 HE ARG A 142 17.161 2.489 11.732 1.00 0.00 H new ATOM 0 HH11 ARG A 142 16.573 4.587 14.518 1.00 0.00 H new ATOM 0 HH12 ARG A 142 18.288 4.716 14.925 1.00 0.00 H new ATOM 0 HH21 ARG A 142 19.357 2.663 12.268 1.00 0.00 H new ATOM 0 HH22 ARG A 142 19.855 3.633 13.658 1.00 0.00 H new ATOM 2243 N THR A 143 16.496 2.552 9.021 1.00 0.00 N ATOM 2244 CA THR A 143 17.099 1.526 8.178 1.00 0.00 C ATOM 2245 C THR A 143 17.139 0.181 8.895 1.00 0.00 C ATOM 2246 O THR A 143 17.865 0.009 9.874 1.00 0.00 O ATOM 2247 CB THR A 143 18.513 1.940 7.768 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.618 3.350 7.680 1.00 0.00 O ATOM 2249 CG2 THR A 143 18.941 1.364 6.435 1.00 0.00 C ATOM 0 H THR A 143 17.071 2.839 9.813 1.00 0.00 H new ATOM 0 HA THR A 143 16.484 1.421 7.285 1.00 0.00 H new ATOM 0 HB THR A 143 19.167 1.544 8.545 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.530 3.594 7.418 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.953 1.696 6.203 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.919 0.275 6.485 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.260 1.705 5.656 1.00 0.00 H new ATOM 2257 N VAL A 144 16.359 -0.771 8.395 1.00 0.00 N ATOM 2258 CA VAL A 144 16.308 -2.104 8.982 1.00 0.00 C ATOM 2259 C VAL A 144 17.125 -3.092 8.156 1.00 0.00 C ATOM 2260 O VAL A 144 16.936 -3.208 6.945 1.00 0.00 O ATOM 2261 CB VAL A 144 14.860 -2.618 9.091 1.00 0.00 C ATOM 2262 CG1 VAL A 144 14.812 -3.921 9.873 1.00 0.00 C ATOM 2263 CG2 VAL A 144 13.968 -1.567 9.734 1.00 0.00 C ATOM 0 H VAL A 144 15.753 -0.644 7.584 1.00 0.00 H new ATOM 0 HA VAL A 144 16.731 -2.027 9.983 1.00 0.00 H new ATOM 0 HB VAL A 144 14.486 -2.813 8.086 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.781 -4.268 9.939 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.416 -4.673 9.365 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.205 -3.758 10.877 1.00 0.00 H new ATOM 0 HG21 VAL A 144 12.949 -1.947 9.803 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.338 -1.338 10.733 1.00 0.00 H new ATOM 0 HG23 VAL A 144 13.977 -0.662 9.127 1.00 0.00 H new ATOM 2273 N GLU A 145 18.035 -3.800 8.816 1.00 0.00 N ATOM 2274 CA GLU A 145 18.881 -4.775 8.138 1.00 0.00 C ATOM 2275 C GLU A 145 18.718 -6.163 8.746 1.00 0.00 C ATOM 2276 O GLU A 145 18.524 -6.306 9.953 1.00 0.00 O ATOM 2277 CB GLU A 145 20.349 -4.346 8.205 1.00 0.00 C ATOM 2278 CG GLU A 145 20.758 -3.783 9.555 1.00 0.00 C ATOM 2279 CD GLU A 145 22.236 -3.967 9.840 1.00 0.00 C ATOM 2280 OE1 GLU A 145 23.040 -3.875 8.888 1.00 0.00 O ATOM 2281 OE2 GLU A 145 22.589 -4.203 11.014 1.00 0.00 O ATOM 0 H GLU A 145 18.206 -3.717 9.818 1.00 0.00 H new ATOM 0 HA GLU A 145 18.569 -4.819 7.095 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.980 -5.204 7.972 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.535 -3.596 7.437 1.00 0.00 H new ATOM 0 HG2 GLU A 145 20.514 -2.721 9.591 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.177 -4.270 10.339 1.00 0.00 H new ATOM 2288 N ASP A 146 18.802 -7.181 7.899 1.00 0.00 N ATOM 2289 CA ASP A 146 18.669 -8.564 8.341 1.00 0.00 C ATOM 2290 C ASP A 146 19.986 -9.313 8.158 1.00 0.00 C ATOM 2291 O ASP A 146 21.009 -8.712 7.829 1.00 0.00 O ATOM 2292 CB ASP A 146 17.554 -9.261 7.558 1.00 0.00 C ATOM 2293 CG ASP A 146 16.174 -8.790 7.974 1.00 0.00 C ATOM 2294 OD1 ASP A 146 15.745 -7.717 7.500 1.00 0.00 O ATOM 2295 OD2 ASP A 146 15.523 -9.493 8.775 1.00 0.00 O ATOM 0 H ASP A 146 18.962 -7.074 6.897 1.00 0.00 H new ATOM 0 HA ASP A 146 18.413 -8.567 9.401 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.692 -9.077 6.493 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.628 -10.338 7.707 1.00 0.00 H new ATOM 2300 N THR A 147 19.957 -10.625 8.369 1.00 0.00 N ATOM 2301 CA THR A 147 21.154 -11.445 8.220 1.00 0.00 C ATOM 2302 C THR A 147 21.708 -11.331 6.804 1.00 0.00 C ATOM 2303 O THR A 147 22.918 -11.231 6.604 1.00 0.00 O ATOM 2304 CB THR A 147 20.841 -12.906 8.544 1.00 0.00 C ATOM 2305 OG1 THR A 147 19.496 -13.213 8.223 1.00 0.00 O ATOM 2306 CG2 THR A 147 21.058 -13.257 10.000 1.00 0.00 C ATOM 0 H THR A 147 19.121 -11.142 8.643 1.00 0.00 H new ATOM 0 HA THR A 147 21.907 -11.082 8.919 1.00 0.00 H new ATOM 0 HB THR A 147 21.535 -13.491 7.940 1.00 0.00 H new ATOM 0 HG1 THR A 147 19.315 -14.152 8.436 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.817 -14.308 10.161 1.00 0.00 H new ATOM 0 HG22 THR A 147 22.100 -13.078 10.266 1.00 0.00 H new ATOM 0 HG23 THR A 147 20.413 -12.638 10.624 1.00 0.00 H new ATOM 2314 N ASN A 148 20.810 -11.343 5.825 1.00 0.00 N ATOM 2315 CA ASN A 148 21.203 -11.236 4.425 1.00 0.00 C ATOM 2316 C ASN A 148 21.318 -9.770 4.007 1.00 0.00 C ATOM 2317 O ASN A 148 20.473 -8.950 4.366 1.00 0.00 O ATOM 2318 CB ASN A 148 20.189 -11.954 3.533 1.00 0.00 C ATOM 2319 CG ASN A 148 20.446 -13.446 3.449 1.00 0.00 C ATOM 2320 OD1 ASN A 148 21.484 -13.882 2.949 1.00 0.00 O ATOM 2321 ND2 ASN A 148 19.499 -14.238 3.938 1.00 0.00 N ATOM 0 H ASN A 148 19.805 -11.426 5.975 1.00 0.00 H new ATOM 0 HA ASN A 148 22.178 -11.709 4.307 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.184 -11.783 3.919 1.00 0.00 H new ATOM 0 HB3 ASN A 148 20.223 -11.525 2.531 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.616 -15.251 3.908 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.655 -13.834 4.343 1.00 0.00 H new ATOM 2328 N PRO A 149 22.365 -9.416 3.239 1.00 0.00 N ATOM 2329 CA PRO A 149 22.574 -8.039 2.777 1.00 0.00 C ATOM 2330 C PRO A 149 21.459 -7.572 1.852 1.00 0.00 C ATOM 2331 O PRO A 149 21.174 -6.378 1.753 1.00 0.00 O ATOM 2332 CB PRO A 149 23.903 -8.101 2.012 1.00 0.00 C ATOM 2333 CG PRO A 149 24.543 -9.378 2.437 1.00 0.00 C ATOM 2334 CD PRO A 149 23.421 -10.320 2.757 1.00 0.00 C ATOM 0 HA PRO A 149 22.583 -7.333 3.608 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.738 -8.083 0.935 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.535 -7.246 2.252 1.00 0.00 H new ATOM 0 HG2 PRO A 149 25.175 -9.780 1.645 1.00 0.00 H new ATOM 0 HG3 PRO A 149 25.182 -9.223 3.307 1.00 0.00 H new ATOM 0 HD2 PRO A 149 23.102 -10.883 1.880 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.708 -11.048 3.516 1.00 0.00 H new ATOM 2342 N ALA A 150 20.833 -8.525 1.174 1.00 0.00 N ATOM 2343 CA ALA A 150 19.747 -8.222 0.250 1.00 0.00 C ATOM 2344 C ALA A 150 18.428 -8.006 0.989 1.00 0.00 C ATOM 2345 O ALA A 150 17.508 -7.382 0.460 1.00 0.00 O ATOM 2346 CB ALA A 150 19.600 -9.337 -0.774 1.00 0.00 C ATOM 0 H ALA A 150 21.059 -9.517 1.247 1.00 0.00 H new ATOM 0 HA ALA A 150 19.997 -7.295 -0.266 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.786 -9.098 -1.458 1.00 0.00 H new ATOM 0 HB2 ALA A 150 20.528 -9.439 -1.337 1.00 0.00 H new ATOM 0 HB3 ALA A 150 19.381 -10.274 -0.262 1.00 0.00 H new ATOM 2352 N LEU A 151 18.338 -8.528 2.210 1.00 0.00 N ATOM 2353 CA LEU A 151 17.125 -8.391 3.009 1.00 0.00 C ATOM 2354 C LEU A 151 17.118 -7.086 3.806 1.00 0.00 C ATOM 2355 O LEU A 151 16.244 -6.870 4.645 1.00 0.00 O ATOM 2356 CB LEU A 151 16.974 -9.583 3.958 1.00 0.00 C ATOM 2357 CG LEU A 151 16.584 -10.906 3.290 1.00 0.00 C ATOM 2358 CD1 LEU A 151 16.169 -11.928 4.337 1.00 0.00 C ATOM 2359 CD2 LEU A 151 15.462 -10.693 2.283 1.00 0.00 C ATOM 0 H LEU A 151 19.088 -9.048 2.666 1.00 0.00 H new ATOM 0 HA LEU A 151 16.280 -8.369 2.321 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.916 -9.726 4.488 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.221 -9.337 4.707 1.00 0.00 H new ATOM 0 HG LEU A 151 17.454 -11.288 2.756 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.895 -12.862 3.846 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.000 -12.107 5.020 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.314 -11.549 4.897 1.00 0.00 H new ATOM 0 HD21 LEU A 151 15.202 -11.646 1.821 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.588 -10.286 2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 151 15.791 -9.995 1.513 1.00 0.00 H new ATOM 2371 N THR A 152 18.091 -6.218 3.545 1.00 0.00 N ATOM 2372 CA THR A 152 18.174 -4.941 4.245 1.00 0.00 C ATOM 2373 C THR A 152 17.249 -3.915 3.598 1.00 0.00 C ATOM 2374 O THR A 152 17.384 -3.604 2.415 1.00 0.00 O ATOM 2375 CB THR A 152 19.613 -4.423 4.243 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.507 -5.423 4.702 1.00 0.00 O ATOM 2377 CG2 THR A 152 19.810 -3.198 5.110 1.00 0.00 C ATOM 0 H THR A 152 18.829 -6.374 2.858 1.00 0.00 H new ATOM 0 HA THR A 152 17.858 -5.096 5.277 1.00 0.00 H new ATOM 0 HB THR A 152 19.821 -4.152 3.208 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.881 -5.905 3.935 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.852 -2.883 5.063 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.171 -2.391 4.751 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.549 -3.436 6.141 1.00 0.00 H new ATOM 2385 N HIS A 153 16.309 -3.393 4.380 1.00 0.00 N ATOM 2386 CA HIS A 153 15.359 -2.404 3.878 1.00 0.00 C ATOM 2387 C HIS A 153 15.354 -1.159 4.758 1.00 0.00 C ATOM 2388 O HIS A 153 15.882 -1.170 5.870 1.00 0.00 O ATOM 2389 CB HIS A 153 13.943 -2.990 3.808 1.00 0.00 C ATOM 2390 CG HIS A 153 13.901 -4.486 3.759 1.00 0.00 C ATOM 2391 ND1 HIS A 153 14.491 -5.363 2.913 1.00 0.00 N flip ATOM 2392 CD2 HIS A 153 13.178 -5.247 4.654 1.00 0.00 C flip ATOM 2393 CE1 HIS A 153 14.116 -6.623 3.307 1.00 0.00 C flip ATOM 2394 NE2 HIS A 153 13.326 -6.526 4.360 1.00 0.00 N flip ATOM 0 H HIS A 153 16.184 -3.637 5.362 1.00 0.00 H new ATOM 0 HA HIS A 153 15.676 -2.125 2.873 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.378 -2.650 4.676 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.441 -2.594 2.925 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.584 -4.858 5.468 1.00 0.00 H new ATOM 0 HE1 HIS A 153 14.418 -7.545 2.832 1.00 0.00 H new ATOM 0 HE2 HIS A 153 12.902 -7.306 4.861 1.00 0.00 H new ATOM 2403 N THR A 154 14.751 -0.089 4.253 1.00 0.00 N ATOM 2404 CA THR A 154 14.672 1.164 4.994 1.00 0.00 C ATOM 2405 C THR A 154 13.249 1.714 4.987 1.00 0.00 C ATOM 2406 O THR A 154 12.652 1.902 3.927 1.00 0.00 O ATOM 2407 CB THR A 154 15.632 2.196 4.399 1.00 0.00 C ATOM 2408 OG1 THR A 154 16.886 1.606 4.109 1.00 0.00 O ATOM 2409 CG2 THR A 154 15.880 3.378 5.310 1.00 0.00 C ATOM 0 H THR A 154 14.310 -0.064 3.334 1.00 0.00 H new ATOM 0 HA THR A 154 14.959 0.963 6.026 1.00 0.00 H new ATOM 0 HB THR A 154 15.145 2.554 3.492 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.485 2.282 3.728 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.569 4.071 4.827 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.937 3.886 5.512 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.313 3.030 6.248 1.00 0.00 H new ATOM 2417 N TYR A 155 12.714 1.974 6.175 1.00 0.00 N ATOM 2418 CA TYR A 155 11.364 2.509 6.306 1.00 0.00 C ATOM 2419 C TYR A 155 11.398 4.033 6.345 1.00 0.00 C ATOM 2420 O TYR A 155 12.077 4.625 7.184 1.00 0.00 O ATOM 2421 CB TYR A 155 10.698 1.968 7.574 1.00 0.00 C ATOM 2422 CG TYR A 155 9.890 0.711 7.346 1.00 0.00 C ATOM 2423 CD1 TYR A 155 8.718 0.741 6.601 1.00 0.00 C ATOM 2424 CD2 TYR A 155 10.299 -0.506 7.876 1.00 0.00 C ATOM 2425 CE1 TYR A 155 7.976 -0.406 6.391 1.00 0.00 C ATOM 2426 CE2 TYR A 155 9.563 -1.658 7.670 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.402 -1.602 6.928 1.00 0.00 C ATOM 2428 OH TYR A 155 7.667 -2.746 6.721 1.00 0.00 O ATOM 0 H TYR A 155 13.195 1.823 7.062 1.00 0.00 H new ATOM 0 HA TYR A 155 10.782 2.193 5.440 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.467 1.765 8.319 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.047 2.738 7.989 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.381 1.676 6.179 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.207 -0.553 8.459 1.00 0.00 H new ATOM 0 HE1 TYR A 155 7.067 -0.365 5.809 1.00 0.00 H new ATOM 0 HE2 TYR A 155 9.895 -2.597 8.088 1.00 0.00 H new ATOM 0 HH TYR A 155 8.105 -3.501 7.166 1.00 0.00 H new ATOM 2438 N GLU A 156 10.674 4.665 5.428 1.00 0.00 N ATOM 2439 CA GLU A 156 10.640 6.121 5.361 1.00 0.00 C ATOM 2440 C GLU A 156 9.214 6.655 5.445 1.00 0.00 C ATOM 2441 O GLU A 156 8.302 6.129 4.810 1.00 0.00 O ATOM 2442 CB GLU A 156 11.295 6.605 4.066 1.00 0.00 C ATOM 2443 CG GLU A 156 12.791 6.343 4.006 1.00 0.00 C ATOM 2444 CD GLU A 156 13.195 5.533 2.790 1.00 0.00 C ATOM 2445 OE1 GLU A 156 13.174 4.287 2.872 1.00 0.00 O ATOM 2446 OE2 GLU A 156 13.531 6.145 1.754 1.00 0.00 O ATOM 0 H GLU A 156 10.105 4.195 4.724 1.00 0.00 H new ATOM 0 HA GLU A 156 11.196 6.503 6.218 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.814 6.114 3.220 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.117 7.675 3.957 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.322 7.295 3.996 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.100 5.815 4.908 1.00 0.00 H new ATOM 2453 N VAL A 157 9.039 7.718 6.224 1.00 0.00 N ATOM 2454 CA VAL A 157 7.735 8.348 6.386 1.00 0.00 C ATOM 2455 C VAL A 157 7.737 9.731 5.741 1.00 0.00 C ATOM 2456 O VAL A 157 8.757 10.423 5.745 1.00 0.00 O ATOM 2457 CB VAL A 157 7.333 8.469 7.871 1.00 0.00 C ATOM 2458 CG1 VAL A 157 5.850 8.791 8.008 1.00 0.00 C ATOM 2459 CG2 VAL A 157 7.675 7.190 8.621 1.00 0.00 C ATOM 0 H VAL A 157 9.788 8.162 6.755 1.00 0.00 H new ATOM 0 HA VAL A 157 7.002 7.711 5.892 1.00 0.00 H new ATOM 0 HB VAL A 157 7.899 9.290 8.311 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.591 8.871 9.064 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.635 9.736 7.509 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.261 7.996 7.549 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.385 7.293 9.667 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.138 6.352 8.176 1.00 0.00 H new ATOM 0 HG23 VAL A 157 8.748 7.007 8.558 1.00 0.00 H new ATOM 2469 N TRP A 158 6.586 10.127 5.207 1.00 0.00 N ATOM 2470 CA TRP A 158 6.449 11.430 4.564 1.00 0.00 C ATOM 2471 C TRP A 158 5.064 12.023 4.784 1.00 0.00 C ATOM 2472 O TRP A 158 4.057 11.324 4.693 1.00 0.00 O ATOM 2473 CB TRP A 158 6.728 11.318 3.065 1.00 0.00 C ATOM 2474 CG TRP A 158 8.021 10.633 2.745 1.00 0.00 C ATOM 2475 CD1 TRP A 158 8.282 9.295 2.826 1.00 0.00 C ATOM 2476 CD2 TRP A 158 9.230 11.252 2.291 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.579 9.044 2.450 1.00 0.00 N ATOM 2478 CE2 TRP A 158 10.182 10.230 2.118 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.599 12.571 2.014 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 11.479 10.487 1.680 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.887 12.825 1.580 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.813 11.787 1.416 1.00 0.00 C ATOM 0 H TRP A 158 5.735 9.565 5.207 1.00 0.00 H new ATOM 0 HA TRP A 158 7.181 12.096 5.021 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.911 10.773 2.592 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.739 12.318 2.630 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.572 8.544 3.140 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.021 8.125 2.422 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.891 13.377 2.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.195 9.689 1.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 11.184 13.841 1.364 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.811 12.018 1.074 1.00 0.00 H new ATOM 2493 N GLN A 159 5.026 13.320 5.069 1.00 0.00 N ATOM 2494 CA GLN A 159 3.769 14.022 5.298 1.00 0.00 C ATOM 2495 C GLN A 159 3.780 15.376 4.597 1.00 0.00 C ATOM 2496 O GLN A 159 4.710 16.165 4.769 1.00 0.00 O ATOM 2497 CB GLN A 159 3.530 14.211 6.797 1.00 0.00 C ATOM 2498 CG GLN A 159 2.870 13.015 7.464 1.00 0.00 C ATOM 2499 CD GLN A 159 1.961 13.415 8.610 1.00 0.00 C ATOM 2500 OE1 GLN A 159 2.380 14.106 9.538 1.00 0.00 O ATOM 2501 NE2 GLN A 159 0.708 12.979 8.551 1.00 0.00 N ATOM 0 H GLN A 159 5.855 13.909 5.147 1.00 0.00 H new ATOM 0 HA GLN A 159 2.959 13.420 4.886 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.484 14.409 7.286 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.905 15.091 6.949 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.292 12.463 6.723 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.641 12.339 7.835 1.00 0.00 H new ATOM 0 HE21 GLN A 159 0.403 12.408 7.762 1.00 0.00 H new ATOM 0 HE22 GLN A 159 0.050 13.215 9.294 1.00 0.00 H new ATOM 2510 N LYS A 160 2.750 15.639 3.798 1.00 0.00 N ATOM 2511 CA LYS A 160 2.654 16.896 3.065 1.00 0.00 C ATOM 2512 C LYS A 160 2.677 18.089 4.013 1.00 0.00 C ATOM 2513 O LYS A 160 2.015 18.086 5.051 1.00 0.00 O ATOM 2514 CB LYS A 160 1.374 16.925 2.229 1.00 0.00 C ATOM 2515 CG LYS A 160 1.438 17.885 1.053 1.00 0.00 C ATOM 2516 CD LYS A 160 0.070 18.083 0.420 1.00 0.00 C ATOM 2517 CE LYS A 160 -0.668 19.258 1.041 1.00 0.00 C ATOM 2518 NZ LYS A 160 -2.032 19.427 0.467 1.00 0.00 N ATOM 0 H LYS A 160 1.971 14.999 3.642 1.00 0.00 H new ATOM 0 HA LYS A 160 3.518 16.965 2.404 1.00 0.00 H new ATOM 0 HB2 LYS A 160 1.170 15.921 1.857 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.537 17.204 2.870 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.828 18.846 1.388 1.00 0.00 H new ATOM 0 HG3 LYS A 160 2.133 17.502 0.306 1.00 0.00 H new ATOM 0 HD2 LYS A 160 0.185 18.249 -0.651 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.522 17.176 0.540 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.744 19.110 2.118 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.093 20.171 0.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -2.500 20.239 0.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.959 19.594 -0.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.590 18.566 0.639 1.00 0.00 H new ATOM 2532 N LYS A 161 3.445 19.108 3.645 1.00 0.00 N ATOM 2533 CA LYS A 161 3.558 20.314 4.457 1.00 0.00 C ATOM 2534 C LYS A 161 2.258 21.112 4.430 1.00 0.00 C ATOM 2535 O LYS A 161 1.561 21.146 3.416 1.00 0.00 O ATOM 2536 CB LYS A 161 4.713 21.185 3.957 1.00 0.00 C ATOM 2537 CG LYS A 161 6.013 20.421 3.765 1.00 0.00 C ATOM 2538 CD LYS A 161 7.202 21.362 3.669 1.00 0.00 C ATOM 2539 CE LYS A 161 7.439 22.097 4.978 1.00 0.00 C ATOM 2540 NZ LYS A 161 8.745 22.812 4.987 1.00 0.00 N ATOM 0 H LYS A 161 3.999 19.123 2.789 1.00 0.00 H new ATOM 0 HA LYS A 161 3.758 20.012 5.485 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.428 21.644 3.010 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.879 21.996 4.666 1.00 0.00 H new ATOM 0 HG2 LYS A 161 6.158 19.733 4.598 1.00 0.00 H new ATOM 0 HG3 LYS A 161 5.951 19.817 2.860 1.00 0.00 H new ATOM 0 HD2 LYS A 161 8.094 20.796 3.402 1.00 0.00 H new ATOM 0 HD3 LYS A 161 7.032 22.084 2.871 1.00 0.00 H new ATOM 0 HE2 LYS A 161 6.633 22.812 5.144 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.409 21.386 5.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 8.867 23.300 5.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 9.517 22.127 4.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 8.765 23.509 4.215 1.00 0.00 H new ATOM 2554 N ALA A 162 1.939 21.751 5.551 1.00 0.00 N ATOM 2555 CA ALA A 162 0.722 22.548 5.655 1.00 0.00 C ATOM 2556 C ALA A 162 -0.518 21.688 5.435 1.00 0.00 C ATOM 2557 O ALA A 162 -0.974 21.594 4.277 1.00 0.00 O ATOM 2558 CB ALA A 162 0.756 23.694 4.655 1.00 0.00 C ATOM 2559 OXT ALA A 162 -1.022 21.116 6.424 1.00 0.00 O ATOM 0 H ALA A 162 2.505 21.733 6.399 1.00 0.00 H new ATOM 0 HA ALA A 162 0.672 22.960 6.663 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.158 24.281 4.743 1.00 0.00 H new ATOM 0 HB2 ALA A 162 1.617 24.330 4.860 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.834 23.293 3.644 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -5.215 -3.147 -9.111 1.00 0.00 P HETATM 2567 O1A NDP A 170 -5.253 -3.918 -7.854 1.00 0.00 O HETATM 2568 O2A NDP A 170 -5.857 -3.745 -10.298 1.00 0.00 O HETATM 2569 O5B NDP A 170 -5.692 -1.644 -8.887 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.840 -0.742 -9.999 1.00 0.00 C HETATM 2571 C4B NDP A 170 -7.208 -0.897 -10.618 1.00 0.00 C HETATM 2572 O4B NDP A 170 -8.223 -0.652 -9.609 1.00 0.00 O HETATM 2573 C3B NDP A 170 -7.542 0.080 -11.733 1.00 0.00 C HETATM 2574 O3B NDP A 170 -7.043 -0.388 -12.990 1.00 0.00 O HETATM 2575 C2B NDP A 170 -9.065 0.088 -11.703 1.00 0.00 C HETATM 2576 O2B NDP A 170 -9.645 -1.011 -12.377 1.00 0.00 O HETATM 2577 C1B NDP A 170 -9.337 -0.004 -10.200 1.00 0.00 C HETATM 2578 N9A NDP A 170 -9.494 1.303 -9.565 1.00 0.00 N HETATM 2579 C8A NDP A 170 -8.507 2.184 -9.196 1.00 0.00 C HETATM 2580 N7A NDP A 170 -8.959 3.287 -8.650 1.00 0.00 N HETATM 2581 C5A NDP A 170 -10.337 3.121 -8.657 1.00 0.00 C HETATM 2582 C6A NDP A 170 -11.395 3.940 -8.214 1.00 0.00 C HETATM 2583 N6A NDP A 170 -11.219 5.139 -7.656 1.00 0.00 N HETATM 2584 N1A NDP A 170 -12.657 3.477 -8.368 1.00 0.00 N HETATM 2585 C2A NDP A 170 -12.834 2.272 -8.929 1.00 0.00 C HETATM 2586 N3A NDP A 170 -11.922 1.412 -9.384 1.00 0.00 N HETATM 2587 C4A NDP A 170 -10.680 1.902 -9.217 1.00 0.00 C HETATM 2588 O3 NDP A 170 -3.639 -2.832 -9.480 1.00 0.00 O HETATM 2589 PN NDP A 170 -2.513 -3.502 -10.481 1.00 0.00 P HETATM 2590 O1N NDP A 170 -3.220 -4.251 -11.538 1.00 0.00 O HETATM 2591 O2N NDP A 170 -1.578 -2.441 -10.904 1.00 0.00 O HETATM 2592 O5D NDP A 170 -1.839 -4.484 -9.423 1.00 0.00 O HETATM 2593 C5D NDP A 170 -0.862 -4.000 -8.482 1.00 0.00 C HETATM 2594 C4D NDP A 170 0.324 -4.933 -8.437 1.00 0.00 C HETATM 2595 O4D NDP A 170 1.337 -4.388 -7.551 1.00 0.00 O HETATM 2596 C3D NDP A 170 0.047 -6.322 -7.885 1.00 0.00 C HETATM 2597 O3D NDP A 170 -0.450 -7.190 -8.908 1.00 0.00 O HETATM 2598 C2D NDP A 170 1.427 -6.757 -7.410 1.00 0.00 C HETATM 2599 O2D NDP A 170 2.262 -7.244 -8.459 1.00 0.00 O HETATM 2600 C1D NDP A 170 1.987 -5.442 -6.861 1.00 0.00 C HETATM 2601 N1N NDP A 170 1.758 -5.258 -5.429 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.625 -5.115 -4.433 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.350 -4.916 -3.183 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.564 -4.761 -2.433 1.00 0.00 C HETATM 2605 O7N NDP A 170 3.155 -4.551 -1.201 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.861 -4.784 -2.829 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.901 -4.841 -2.793 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.093 -4.988 -3.825 1.00 0.00 C HETATM 2609 C6N NDP A 170 0.244 -5.198 -5.152 1.00 0.00 C HETATM 2610 P2B NDP A 170 -9.536 -1.397 -13.999 1.00 0.00 P HETATM 2611 O1X NDP A 170 -8.842 -0.063 -14.484 1.00 0.00 O HETATM 2612 O2X NDP A 170 -8.500 -2.519 -13.946 1.00 0.00 O HETATM 2613 O3X NDP A 170 -11.013 -1.372 -14.388 1.00 0.00 O HETATM 0 HO3N NDP A 170 -1.104 -6.708 -9.456 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -7.530 0.050 -13.719 1.00 0.00 H new HETATM 0 HO2N NDP A 170 1.848 -7.046 -9.325 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.606 -4.654 -2.144 1.00 0.00 H new HETATM 0 H71N NDP A 170 5.092 -4.932 -3.812 1.00 0.00 H new HETATM 0 H62A NDP A 170 -12.026 5.685 -7.355 1.00 0.00 H new HETATM 0 H61A NDP A 170 -10.277 5.510 -7.530 1.00 0.00 H new HETATM 0 H52N NDP A 170 -0.536 -2.999 -8.767 1.00 0.00 H new HETATM 0 H52A NDP A 170 -5.699 0.286 -9.664 1.00 0.00 H new HETATM 0 H51N NDP A 170 -1.309 -3.920 -7.491 1.00 0.00 H new HETATM 0 H51A NDP A 170 -5.071 -0.943 -10.745 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.718 -5.611 -2.044 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.737 -3.879 -2.308 1.00 0.00 H new HETATM 0 H8A NDP A 170 -7.446 1.985 -9.344 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.503 -5.312 -5.938 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.147 -4.932 -3.552 1.00 0.00 H new HETATM 0 H4D NDP A 170 0.623 -5.021 -9.481 1.00 0.00 H new HETATM 0 H4B NDP A 170 -7.194 -1.907 -11.028 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.711 -6.344 -7.102 1.00 0.00 H new HETATM 0 H3B NDP A 170 -7.100 1.068 -11.605 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.681 -5.171 -4.696 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.381 -7.584 -6.701 1.00 0.00 H new HETATM 0 H2B NDP A 170 -9.490 0.958 -12.204 1.00 0.00 H new HETATM 0 H2A NDP A 170 -13.871 1.950 -9.027 1.00 0.00 H new HETATM 0 H1D NDP A 170 3.067 -5.454 -7.009 1.00 0.00 H new HETATM 0 H1B NDP A 170 -10.271 -0.547 -10.057 1.00 0.00 H new