USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 904 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 30 ASN : amide:sc= 1.53 K(o=2.7,f=-3.4!) USER MOD Set 1.2: A 32 SER OG : rot -46:sc= 1.15 USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.0613 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 54:sc= 0.784 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -4.4! C(o=-4.4!,f=-3.8!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -3.58 K(o=-3.6,f=-8.3!) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -141:sc= 0.157 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 44:sc= 0.797 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 TYR OH : rot 130:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 HIS : no HD1:sc= -7.4! C(o=-7.4!,f=-6.2!) USER MOD Single : A 62 GLN : amide:sc= -0.171 K(o=-0.17,f=-2!) USER MOD Single : A 63 SER OG : rot 180:sc= -0.132 USER MOD Single : A 67 SER OG : rot 30:sc= 0.966 USER MOD Single : A 68 LYS NZ :NH3+ 154:sc= -0.0103 (180deg=-0.628) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 77 ASN : amide:sc= -0.212 K(o=-0.21,f=-1.6) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0259 K(o=-0.026,f=-1.7!) USER MOD Single : A 88 HIS : no HD1:sc= -1.6 K(o=-1.6,f=-2.6!) USER MOD Single : A 89 ASN : amide:sc= -0.329 K(o=-0.33,f=-1.3!) USER MOD Single : A 91 THR OG1 : rot 37:sc= 0.128 USER MOD Single : A 92 CYS SG : rot 40:sc= 0.712 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 150:sc= -0.88 USER MOD Single : A 108 SER OG : rot -81:sc= 0.25 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -0.219 X(o=-0.22,f=0) USER MOD Single : A 119 SER OG : rot -85:sc= 0.104 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -50.480 23.670 14.738 1.00 0.00 N ATOM 2 CA GLY A 1 -49.054 23.827 14.518 1.00 0.00 C ATOM 3 C GLY A 1 -48.724 24.171 13.079 1.00 0.00 C ATOM 4 O GLY A 1 -49.598 24.582 12.316 1.00 0.00 O ATOM 0 H1 GLY A 1 -50.794 24.338 15.471 1.00 0.00 H new ATOM 0 H2 GLY A 1 -50.991 23.862 13.853 1.00 0.00 H new ATOM 0 H3 GLY A 1 -50.678 22.697 15.048 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -48.673 24.611 15.172 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -48.543 22.905 14.794 1.00 0.00 H new ATOM 8 N SER A 2 -47.458 24.004 12.708 1.00 0.00 N ATOM 9 CA SER A 2 -47.014 24.305 11.352 1.00 0.00 C ATOM 10 C SER A 2 -46.023 23.255 10.859 1.00 0.00 C ATOM 11 O SER A 2 -45.477 22.483 11.647 1.00 0.00 O ATOM 12 CB SER A 2 -46.371 25.693 11.300 1.00 0.00 C ATOM 13 OG SER A 2 -45.243 25.765 12.155 1.00 0.00 O ATOM 0 H SER A 2 -46.723 23.662 13.327 1.00 0.00 H new ATOM 0 HA SER A 2 -47.887 24.291 10.699 1.00 0.00 H new ATOM 0 HB2 SER A 2 -46.071 25.920 10.277 1.00 0.00 H new ATOM 0 HB3 SER A 2 -47.102 26.447 11.593 1.00 0.00 H new ATOM 0 HG SER A 2 -44.849 26.661 12.102 1.00 0.00 H new ATOM 19 N SER A 3 -45.798 23.231 9.549 1.00 0.00 N ATOM 20 CA SER A 3 -44.877 22.274 8.949 1.00 0.00 C ATOM 21 C SER A 3 -44.107 22.910 7.795 1.00 0.00 C ATOM 22 O SER A 3 -44.521 23.929 7.246 1.00 0.00 O ATOM 23 CB SER A 3 -45.639 21.044 8.452 1.00 0.00 C ATOM 24 OG SER A 3 -46.498 21.377 7.376 1.00 0.00 O ATOM 0 H SER A 3 -46.241 23.864 8.883 1.00 0.00 H new ATOM 0 HA SER A 3 -44.163 21.966 9.713 1.00 0.00 H new ATOM 0 HB2 SER A 3 -44.932 20.278 8.133 1.00 0.00 H new ATOM 0 HB3 SER A 3 -46.222 20.619 9.269 1.00 0.00 H new ATOM 0 HG SER A 3 -46.972 20.574 7.075 1.00 0.00 H new ATOM 30 N GLY A 4 -42.983 22.298 7.434 1.00 0.00 N ATOM 31 CA GLY A 4 -42.172 22.818 6.348 1.00 0.00 C ATOM 32 C GLY A 4 -40.953 21.960 6.073 1.00 0.00 C ATOM 33 O GLY A 4 -39.849 22.278 6.514 1.00 0.00 O ATOM 0 H GLY A 4 -42.620 21.452 7.874 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -42.778 22.883 5.445 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -41.852 23.831 6.590 1.00 0.00 H new ATOM 37 N SER A 5 -41.154 20.868 5.342 1.00 0.00 N ATOM 38 CA SER A 5 -40.063 19.958 5.013 1.00 0.00 C ATOM 39 C SER A 5 -38.937 20.696 4.294 1.00 0.00 C ATOM 40 O SER A 5 -39.095 21.848 3.889 1.00 0.00 O ATOM 41 CB SER A 5 -40.574 18.810 4.140 1.00 0.00 C ATOM 42 OG SER A 5 -41.431 17.953 4.874 1.00 0.00 O ATOM 0 H SER A 5 -42.061 20.592 4.967 1.00 0.00 H new ATOM 0 HA SER A 5 -39.670 19.550 5.944 1.00 0.00 H new ATOM 0 HB2 SER A 5 -41.108 19.213 3.280 1.00 0.00 H new ATOM 0 HB3 SER A 5 -39.730 18.240 3.753 1.00 0.00 H new ATOM 0 HG SER A 5 -41.745 17.229 4.293 1.00 0.00 H new ATOM 48 N SER A 6 -37.801 20.024 4.140 1.00 0.00 N ATOM 49 CA SER A 6 -36.647 20.616 3.474 1.00 0.00 C ATOM 50 C SER A 6 -36.323 19.871 2.183 1.00 0.00 C ATOM 51 O SER A 6 -36.372 20.443 1.095 1.00 0.00 O ATOM 52 CB SER A 6 -35.432 20.601 4.404 1.00 0.00 C ATOM 53 OG SER A 6 -34.275 21.077 3.738 1.00 0.00 O ATOM 0 H SER A 6 -37.655 19.069 4.467 1.00 0.00 H new ATOM 0 HA SER A 6 -36.892 21.648 3.225 1.00 0.00 H new ATOM 0 HB2 SER A 6 -35.632 21.219 5.279 1.00 0.00 H new ATOM 0 HB3 SER A 6 -35.257 19.587 4.763 1.00 0.00 H new ATOM 0 HG SER A 6 -33.513 21.059 4.354 1.00 0.00 H new ATOM 59 N GLY A 7 -35.993 18.590 2.313 1.00 0.00 N ATOM 60 CA GLY A 7 -35.666 17.787 1.149 1.00 0.00 C ATOM 61 C GLY A 7 -35.044 16.455 1.521 1.00 0.00 C ATOM 62 O GLY A 7 -35.201 15.981 2.646 1.00 0.00 O ATOM 0 H GLY A 7 -35.946 18.094 3.203 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -36.570 17.612 0.566 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -34.977 18.341 0.511 1.00 0.00 H new ATOM 66 N TRP A 8 -34.337 15.850 0.573 1.00 0.00 N ATOM 67 CA TRP A 8 -33.691 14.563 0.806 1.00 0.00 C ATOM 68 C TRP A 8 -32.216 14.618 0.424 1.00 0.00 C ATOM 69 O TRP A 8 -31.834 14.204 -0.671 1.00 0.00 O ATOM 70 CB TRP A 8 -34.396 13.463 0.011 1.00 0.00 C ATOM 71 CG TRP A 8 -35.782 13.172 0.501 1.00 0.00 C ATOM 72 CD1 TRP A 8 -36.944 13.740 0.061 1.00 0.00 C ATOM 73 CD2 TRP A 8 -36.152 12.242 1.525 1.00 0.00 C ATOM 74 NE1 TRP A 8 -38.012 13.220 0.750 1.00 0.00 N ATOM 75 CE2 TRP A 8 -37.553 12.299 1.654 1.00 0.00 C ATOM 76 CE3 TRP A 8 -35.435 11.367 2.345 1.00 0.00 C ATOM 77 CZ2 TRP A 8 -38.249 11.514 2.570 1.00 0.00 C ATOM 78 CZ3 TRP A 8 -36.127 10.588 3.254 1.00 0.00 C ATOM 79 CH2 TRP A 8 -37.522 10.666 3.360 1.00 0.00 C ATOM 0 H TRP A 8 -34.197 16.229 -0.363 1.00 0.00 H new ATOM 0 HA TRP A 8 -33.764 14.335 1.869 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -34.443 13.756 -1.038 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -33.802 12.551 0.061 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -37.013 14.488 -0.715 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -38.989 13.478 0.611 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -34.360 11.300 2.270 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -39.324 11.573 2.654 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -35.583 9.908 3.893 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -38.034 10.044 4.080 1.00 0.00 H new ATOM 90 N ILE A 9 -31.393 15.130 1.332 1.00 0.00 N ATOM 91 CA ILE A 9 -29.959 15.237 1.088 1.00 0.00 C ATOM 92 C ILE A 9 -29.210 14.053 1.689 1.00 0.00 C ATOM 93 O ILE A 9 -29.405 13.707 2.855 1.00 0.00 O ATOM 94 CB ILE A 9 -29.385 16.542 1.671 1.00 0.00 C ATOM 95 CG1 ILE A 9 -30.088 17.754 1.056 1.00 0.00 C ATOM 96 CG2 ILE A 9 -27.885 16.615 1.431 1.00 0.00 C ATOM 97 CD1 ILE A 9 -30.013 18.997 1.915 1.00 0.00 C ATOM 0 H ILE A 9 -31.693 15.477 2.243 1.00 0.00 H new ATOM 0 HA ILE A 9 -29.822 15.240 0.007 1.00 0.00 H new ATOM 0 HB ILE A 9 -29.562 16.550 2.747 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -29.644 17.967 0.084 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -31.135 17.506 0.881 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -27.494 17.543 1.849 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -27.398 15.767 1.912 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -27.686 16.587 0.360 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -30.532 19.816 1.417 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -30.484 18.802 2.879 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -28.969 19.270 2.070 1.00 0.00 H new ATOM 109 N LEU A 10 -28.350 13.435 0.886 1.00 0.00 N ATOM 110 CA LEU A 10 -27.569 12.289 1.338 1.00 0.00 C ATOM 111 C LEU A 10 -26.085 12.494 1.049 1.00 0.00 C ATOM 112 O LEU A 10 -25.661 12.488 -0.106 1.00 0.00 O ATOM 113 CB LEU A 10 -28.061 11.011 0.658 1.00 0.00 C ATOM 114 CG LEU A 10 -27.213 9.759 0.887 1.00 0.00 C ATOM 115 CD1 LEU A 10 -27.644 9.048 2.161 1.00 0.00 C ATOM 116 CD2 LEU A 10 -27.311 8.822 -0.308 1.00 0.00 C ATOM 0 H LEU A 10 -28.176 13.709 -0.081 1.00 0.00 H new ATOM 0 HA LEU A 10 -27.701 12.193 2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -29.075 10.807 1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -28.120 11.194 -0.415 1.00 0.00 H new ATOM 0 HG LEU A 10 -26.173 10.064 1.000 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -27.030 8.160 2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -27.521 9.719 3.011 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -28.691 8.756 2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -26.701 7.937 -0.127 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -28.349 8.524 -0.453 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -26.953 9.333 -1.201 1.00 0.00 H new ATOM 128 N ALA A 11 -25.301 12.672 2.107 1.00 0.00 N ATOM 129 CA ALA A 11 -23.864 12.874 1.966 1.00 0.00 C ATOM 130 C ALA A 11 -23.122 12.434 3.224 1.00 0.00 C ATOM 131 O ALA A 11 -23.657 12.512 4.330 1.00 0.00 O ATOM 132 CB ALA A 11 -23.564 14.334 1.658 1.00 0.00 C ATOM 0 H ALA A 11 -25.636 12.680 3.070 1.00 0.00 H new ATOM 0 HA ALA A 11 -23.515 12.260 1.136 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -22.487 14.470 1.555 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -24.056 14.618 0.728 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -23.933 14.960 2.470 1.00 0.00 H new ATOM 138 N SER A 12 -21.889 11.971 3.047 1.00 0.00 N ATOM 139 CA SER A 12 -21.076 11.513 4.168 1.00 0.00 C ATOM 140 C SER A 12 -19.881 12.436 4.384 1.00 0.00 C ATOM 141 O SER A 12 -18.771 12.151 3.933 1.00 0.00 O ATOM 142 CB SER A 12 -20.592 10.082 3.924 1.00 0.00 C ATOM 143 OG SER A 12 -19.805 10.004 2.748 1.00 0.00 O ATOM 0 H SER A 12 -21.431 11.903 2.138 1.00 0.00 H new ATOM 0 HA SER A 12 -21.695 11.531 5.065 1.00 0.00 H new ATOM 0 HB2 SER A 12 -20.008 9.741 4.779 1.00 0.00 H new ATOM 0 HB3 SER A 12 -21.449 9.415 3.837 1.00 0.00 H new ATOM 0 HG SER A 12 -19.074 10.655 2.799 1.00 0.00 H new ATOM 149 N THR A 13 -20.116 13.546 5.078 1.00 0.00 N ATOM 150 CA THR A 13 -19.060 14.512 5.354 1.00 0.00 C ATOM 151 C THR A 13 -18.137 14.017 6.461 1.00 0.00 C ATOM 152 O THR A 13 -16.917 14.166 6.380 1.00 0.00 O ATOM 153 CB THR A 13 -19.643 15.879 5.760 1.00 0.00 C ATOM 154 OG1 THR A 13 -18.583 16.813 5.996 1.00 0.00 O ATOM 155 CG2 THR A 13 -20.502 15.752 7.009 1.00 0.00 C ATOM 0 H THR A 13 -21.028 13.798 5.459 1.00 0.00 H new ATOM 0 HA THR A 13 -18.488 14.627 4.433 1.00 0.00 H new ATOM 0 HB THR A 13 -20.269 16.239 4.944 1.00 0.00 H new ATOM 0 HG1 THR A 13 -18.962 17.680 6.252 1.00 0.00 H new ATOM 0 HG21 THR A 13 -20.902 16.730 7.276 1.00 0.00 H new ATOM 0 HG22 THR A 13 -21.325 15.063 6.816 1.00 0.00 H new ATOM 0 HG23 THR A 13 -19.895 15.372 7.831 1.00 0.00 H new ATOM 163 N THR A 14 -18.726 13.427 7.496 1.00 0.00 N ATOM 164 CA THR A 14 -17.955 12.910 8.621 1.00 0.00 C ATOM 165 C THR A 14 -18.468 11.541 9.055 1.00 0.00 C ATOM 166 O THR A 14 -19.675 11.319 9.140 1.00 0.00 O ATOM 167 CB THR A 14 -18.005 13.870 9.824 1.00 0.00 C ATOM 168 OG1 THR A 14 -17.641 15.192 9.412 1.00 0.00 O ATOM 169 CG2 THR A 14 -17.069 13.402 10.928 1.00 0.00 C ATOM 0 H THR A 14 -19.734 13.295 7.579 1.00 0.00 H new ATOM 0 HA THR A 14 -16.923 12.818 8.282 1.00 0.00 H new ATOM 0 HB THR A 14 -19.024 13.879 10.212 1.00 0.00 H new ATOM 0 HG1 THR A 14 -17.677 15.796 10.183 1.00 0.00 H new ATOM 0 HG21 THR A 14 -17.121 14.095 11.767 1.00 0.00 H new ATOM 0 HG22 THR A 14 -17.367 12.407 11.260 1.00 0.00 H new ATOM 0 HG23 THR A 14 -16.048 13.367 10.549 1.00 0.00 H new ATOM 177 N GLU A 15 -17.542 10.628 9.329 1.00 0.00 N ATOM 178 CA GLU A 15 -17.902 9.280 9.755 1.00 0.00 C ATOM 179 C GLU A 15 -16.766 8.638 10.546 1.00 0.00 C ATOM 180 O GLU A 15 -15.680 9.204 10.665 1.00 0.00 O ATOM 181 CB GLU A 15 -18.249 8.414 8.543 1.00 0.00 C ATOM 182 CG GLU A 15 -17.076 8.184 7.604 1.00 0.00 C ATOM 183 CD GLU A 15 -17.453 7.352 6.393 1.00 0.00 C ATOM 184 OE1 GLU A 15 -17.473 6.109 6.512 1.00 0.00 O ATOM 185 OE2 GLU A 15 -17.726 7.944 5.328 1.00 0.00 O ATOM 0 H GLU A 15 -16.538 10.796 9.264 1.00 0.00 H new ATOM 0 HA GLU A 15 -18.776 9.352 10.402 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.620 7.450 8.890 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -19.060 8.887 7.989 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.687 9.147 7.272 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.273 7.686 8.147 1.00 0.00 H new ATOM 192 N GLY A 16 -17.025 7.450 11.084 1.00 0.00 N ATOM 193 CA GLY A 16 -16.016 6.749 11.857 1.00 0.00 C ATOM 194 C GLY A 16 -14.981 6.073 10.980 1.00 0.00 C ATOM 195 O GLY A 16 -14.970 4.849 10.854 1.00 0.00 O ATOM 0 H GLY A 16 -17.916 6.960 10.998 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -15.519 7.454 12.524 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -16.499 6.001 12.486 1.00 0.00 H new ATOM 199 N ALA A 17 -14.109 6.871 10.372 1.00 0.00 N ATOM 200 CA ALA A 17 -13.066 6.341 9.503 1.00 0.00 C ATOM 201 C ALA A 17 -11.829 7.233 9.524 1.00 0.00 C ATOM 202 O ALA A 17 -11.902 8.430 9.803 1.00 0.00 O ATOM 203 CB ALA A 17 -13.588 6.193 8.081 1.00 0.00 C ATOM 0 H ALA A 17 -14.104 7.887 10.465 1.00 0.00 H new ATOM 0 HA ALA A 17 -12.780 5.358 9.877 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.798 5.796 7.443 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -14.437 5.510 8.074 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -13.903 7.167 7.706 1.00 0.00 H new ATOM 209 N PRO A 18 -10.665 6.639 9.224 1.00 0.00 N ATOM 210 CA PRO A 18 -9.389 7.361 9.202 1.00 0.00 C ATOM 211 C PRO A 18 -9.300 8.344 8.040 1.00 0.00 C ATOM 212 O PRO A 18 -8.839 7.995 6.953 1.00 0.00 O ATOM 213 CB PRO A 18 -8.353 6.246 9.040 1.00 0.00 C ATOM 214 CG PRO A 18 -9.091 5.137 8.374 1.00 0.00 C ATOM 215 CD PRO A 18 -10.504 5.215 8.881 1.00 0.00 C ATOM 0 HA PRO A 18 -9.247 7.966 10.098 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.507 6.576 8.437 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -7.954 5.933 10.005 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.059 5.243 7.290 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.644 4.172 8.613 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.221 4.901 8.123 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -10.656 4.573 9.749 1.00 0.00 H new ATOM 223 N SER A 19 -9.743 9.575 8.276 1.00 0.00 N ATOM 224 CA SER A 19 -9.716 10.608 7.247 1.00 0.00 C ATOM 225 C SER A 19 -8.315 11.196 7.105 1.00 0.00 C ATOM 226 O SER A 19 -8.148 12.411 6.996 1.00 0.00 O ATOM 227 CB SER A 19 -10.715 11.717 7.582 1.00 0.00 C ATOM 228 OG SER A 19 -12.049 11.248 7.484 1.00 0.00 O ATOM 0 H SER A 19 -10.125 9.881 9.171 1.00 0.00 H new ATOM 0 HA SER A 19 -9.997 10.150 6.299 1.00 0.00 H new ATOM 0 HB2 SER A 19 -10.529 12.086 8.591 1.00 0.00 H new ATOM 0 HB3 SER A 19 -10.571 12.558 6.903 1.00 0.00 H new ATOM 0 HG SER A 19 -12.668 11.975 7.704 1.00 0.00 H new ATOM 234 N VAL A 20 -7.312 10.324 7.107 1.00 0.00 N ATOM 235 CA VAL A 20 -5.925 10.755 6.977 1.00 0.00 C ATOM 236 C VAL A 20 -5.054 9.642 6.405 1.00 0.00 C ATOM 237 O VAL A 20 -5.519 8.521 6.200 1.00 0.00 O ATOM 238 CB VAL A 20 -5.346 11.200 8.333 1.00 0.00 C ATOM 239 CG1 VAL A 20 -6.088 12.420 8.856 1.00 0.00 C ATOM 240 CG2 VAL A 20 -5.404 10.059 9.337 1.00 0.00 C ATOM 0 H VAL A 20 -7.434 9.315 7.197 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.920 11.603 6.292 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.301 11.474 8.190 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -5.665 12.720 9.815 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.989 13.239 8.144 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.143 12.177 8.985 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -4.991 10.391 10.289 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.440 9.751 9.478 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.823 9.216 8.964 1.00 0.00 H new ATOM 250 N ALA A 21 -3.789 9.958 6.151 1.00 0.00 N ATOM 251 CA ALA A 21 -2.852 8.984 5.606 1.00 0.00 C ATOM 252 C ALA A 21 -1.564 8.946 6.420 1.00 0.00 C ATOM 253 O ALA A 21 -1.272 9.846 7.209 1.00 0.00 O ATOM 254 CB ALA A 21 -2.549 9.301 4.149 1.00 0.00 C ATOM 0 H ALA A 21 -3.389 10.882 6.314 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.316 7.999 5.663 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.848 8.565 3.755 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.472 9.269 3.570 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -2.110 10.296 4.077 1.00 0.00 H new ATOM 260 N PRO A 22 -0.772 7.880 6.228 1.00 0.00 N ATOM 261 CA PRO A 22 0.498 7.699 6.936 1.00 0.00 C ATOM 262 C PRO A 22 1.562 8.694 6.482 1.00 0.00 C ATOM 263 O PRO A 22 1.525 9.184 5.353 1.00 0.00 O ATOM 264 CB PRO A 22 0.910 6.271 6.568 1.00 0.00 C ATOM 265 CG PRO A 22 0.239 6.008 5.264 1.00 0.00 C ATOM 266 CD PRO A 22 -1.057 6.769 5.304 1.00 0.00 C ATOM 0 HA PRO A 22 0.393 7.864 8.008 1.00 0.00 H new ATOM 0 HB2 PRO A 22 1.993 6.181 6.481 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.591 5.558 7.328 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.860 6.339 4.432 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.061 4.942 5.125 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -1.341 7.131 4.316 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -1.877 6.147 5.664 1.00 0.00 H new ATOM 274 N LEU A 23 2.508 8.987 7.367 1.00 0.00 N ATOM 275 CA LEU A 23 3.583 9.923 7.057 1.00 0.00 C ATOM 276 C LEU A 23 4.887 9.182 6.779 1.00 0.00 C ATOM 277 O LEU A 23 4.918 7.952 6.743 1.00 0.00 O ATOM 278 CB LEU A 23 3.778 10.907 8.211 1.00 0.00 C ATOM 279 CG LEU A 23 2.530 11.234 9.033 1.00 0.00 C ATOM 280 CD1 LEU A 23 2.399 10.277 10.208 1.00 0.00 C ATOM 281 CD2 LEU A 23 2.575 12.675 9.519 1.00 0.00 C ATOM 0 H LEU A 23 2.553 8.590 8.305 1.00 0.00 H new ATOM 0 HA LEU A 23 3.303 10.476 6.160 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.535 10.503 8.883 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.176 11.837 7.805 1.00 0.00 H new ATOM 0 HG LEU A 23 1.655 11.114 8.394 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.506 10.525 10.781 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.321 9.255 9.838 1.00 0.00 H new ATOM 0 HD13 LEU A 23 3.277 10.365 10.848 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.680 12.890 10.102 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.457 12.822 10.142 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.620 13.347 8.662 1.00 0.00 H new ATOM 293 N ASN A 24 5.962 9.939 6.584 1.00 0.00 N ATOM 294 CA ASN A 24 7.269 9.354 6.311 1.00 0.00 C ATOM 295 C ASN A 24 7.158 8.223 5.293 1.00 0.00 C ATOM 296 O ASN A 24 7.880 7.229 5.370 1.00 0.00 O ATOM 297 CB ASN A 24 7.897 8.830 7.605 1.00 0.00 C ATOM 298 CG ASN A 24 8.752 9.873 8.296 1.00 0.00 C ATOM 299 OD1 ASN A 24 9.877 9.594 8.712 1.00 0.00 O ATOM 300 ND2 ASN A 24 8.221 11.084 8.423 1.00 0.00 N ATOM 0 H ASN A 24 5.953 10.959 6.610 1.00 0.00 H new ATOM 0 HA ASN A 24 7.907 10.133 5.894 1.00 0.00 H new ATOM 0 HB2 ASN A 24 7.108 8.504 8.283 1.00 0.00 H new ATOM 0 HB3 ASN A 24 8.507 7.955 7.381 1.00 0.00 H new ATOM 0 HD21 ASN A 24 8.749 11.827 8.880 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.285 11.271 8.063 1.00 0.00 H new ATOM 307 N VAL A 25 6.247 8.383 4.337 1.00 0.00 N ATOM 308 CA VAL A 25 6.041 7.377 3.302 1.00 0.00 C ATOM 309 C VAL A 25 7.193 7.373 2.303 1.00 0.00 C ATOM 310 O VAL A 25 7.344 8.302 1.509 1.00 0.00 O ATOM 311 CB VAL A 25 4.721 7.612 2.545 1.00 0.00 C ATOM 312 CG1 VAL A 25 4.568 6.609 1.412 1.00 0.00 C ATOM 313 CG2 VAL A 25 3.539 7.535 3.500 1.00 0.00 C ATOM 0 H VAL A 25 5.641 9.199 4.258 1.00 0.00 H new ATOM 0 HA VAL A 25 5.996 6.411 3.805 1.00 0.00 H new ATOM 0 HB VAL A 25 4.744 8.612 2.111 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.629 6.791 0.889 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.399 6.718 0.715 1.00 0.00 H new ATOM 0 HG13 VAL A 25 4.566 5.598 1.819 1.00 0.00 H new ATOM 0 HG21 VAL A 25 2.614 7.703 2.948 1.00 0.00 H new ATOM 0 HG22 VAL A 25 3.510 6.549 3.965 1.00 0.00 H new ATOM 0 HG23 VAL A 25 3.645 8.297 4.272 1.00 0.00 H new ATOM 323 N THR A 26 8.004 6.321 2.348 1.00 0.00 N ATOM 324 CA THR A 26 9.144 6.195 1.447 1.00 0.00 C ATOM 325 C THR A 26 9.169 4.825 0.780 1.00 0.00 C ATOM 326 O THR A 26 8.462 3.907 1.197 1.00 0.00 O ATOM 327 CB THR A 26 10.474 6.417 2.191 1.00 0.00 C ATOM 328 OG1 THR A 26 10.526 5.591 3.359 1.00 0.00 O ATOM 329 CG2 THR A 26 10.636 7.876 2.588 1.00 0.00 C ATOM 0 H THR A 26 7.893 5.543 2.999 1.00 0.00 H new ATOM 0 HA THR A 26 9.031 6.965 0.683 1.00 0.00 H new ATOM 0 HB THR A 26 11.289 6.148 1.519 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.376 5.737 3.825 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.583 8.008 3.112 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.626 8.500 1.694 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.815 8.168 3.243 1.00 0.00 H new ATOM 337 N VAL A 27 9.989 4.692 -0.258 1.00 0.00 N ATOM 338 CA VAL A 27 10.108 3.432 -0.981 1.00 0.00 C ATOM 339 C VAL A 27 11.561 3.135 -1.332 1.00 0.00 C ATOM 340 O VAL A 27 12.173 3.837 -2.138 1.00 0.00 O ATOM 341 CB VAL A 27 9.272 3.447 -2.275 1.00 0.00 C ATOM 342 CG1 VAL A 27 9.390 2.116 -3.003 1.00 0.00 C ATOM 343 CG2 VAL A 27 7.817 3.767 -1.965 1.00 0.00 C ATOM 0 H VAL A 27 10.580 5.442 -0.617 1.00 0.00 H new ATOM 0 HA VAL A 27 9.730 2.651 -0.321 1.00 0.00 H new ATOM 0 HB VAL A 27 9.661 4.227 -2.929 1.00 0.00 H new ATOM 0 HG11 VAL A 27 8.793 2.146 -3.914 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.434 1.932 -3.259 1.00 0.00 H new ATOM 0 HG13 VAL A 27 9.028 1.315 -2.358 1.00 0.00 H new ATOM 0 HG21 VAL A 27 7.241 3.774 -2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.414 3.011 -1.292 1.00 0.00 H new ATOM 0 HG23 VAL A 27 7.753 4.746 -1.491 1.00 0.00 H new ATOM 353 N PHE A 28 12.110 2.089 -0.722 1.00 0.00 N ATOM 354 CA PHE A 28 13.492 1.698 -0.970 1.00 0.00 C ATOM 355 C PHE A 28 13.561 0.537 -1.957 1.00 0.00 C ATOM 356 O PHE A 28 12.961 -0.516 -1.738 1.00 0.00 O ATOM 357 CB PHE A 28 14.177 1.308 0.342 1.00 0.00 C ATOM 358 CG PHE A 28 14.744 2.479 1.094 1.00 0.00 C ATOM 359 CD1 PHE A 28 13.930 3.532 1.479 1.00 0.00 C ATOM 360 CD2 PHE A 28 16.091 2.526 1.414 1.00 0.00 C ATOM 361 CE1 PHE A 28 14.448 4.610 2.171 1.00 0.00 C ATOM 362 CE2 PHE A 28 16.615 3.602 2.106 1.00 0.00 C ATOM 363 CZ PHE A 28 15.793 4.645 2.484 1.00 0.00 C ATOM 0 H PHE A 28 11.618 1.497 -0.052 1.00 0.00 H new ATOM 0 HA PHE A 28 14.012 2.552 -1.404 1.00 0.00 H new ATOM 0 HB2 PHE A 28 13.458 0.791 0.978 1.00 0.00 H new ATOM 0 HB3 PHE A 28 14.979 0.601 0.128 1.00 0.00 H new ATOM 0 HD1 PHE A 28 12.878 3.510 1.235 1.00 0.00 H new ATOM 0 HD2 PHE A 28 16.739 1.713 1.120 1.00 0.00 H new ATOM 0 HE1 PHE A 28 13.802 5.424 2.467 1.00 0.00 H new ATOM 0 HE2 PHE A 28 17.667 3.627 2.351 1.00 0.00 H new ATOM 0 HZ PHE A 28 16.201 5.487 3.024 1.00 0.00 H new ATOM 373 N LEU A 29 14.297 0.736 -3.045 1.00 0.00 N ATOM 374 CA LEU A 29 14.445 -0.293 -4.068 1.00 0.00 C ATOM 375 C LEU A 29 15.755 -1.053 -3.890 1.00 0.00 C ATOM 376 O LEU A 29 16.837 -0.496 -4.072 1.00 0.00 O ATOM 377 CB LEU A 29 14.391 0.334 -5.462 1.00 0.00 C ATOM 378 CG LEU A 29 14.970 -0.509 -6.599 1.00 0.00 C ATOM 379 CD1 LEU A 29 14.166 -1.787 -6.779 1.00 0.00 C ATOM 380 CD2 LEU A 29 15.000 0.291 -7.894 1.00 0.00 C ATOM 0 H LEU A 29 14.801 1.601 -3.241 1.00 0.00 H new ATOM 0 HA LEU A 29 13.620 -0.998 -3.961 1.00 0.00 H new ATOM 0 HB2 LEU A 29 13.351 0.560 -5.697 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.925 1.284 -5.432 1.00 0.00 H new ATOM 0 HG LEU A 29 15.993 -0.781 -6.339 1.00 0.00 H new ATOM 0 HD11 LEU A 29 14.593 -2.374 -7.592 1.00 0.00 H new ATOM 0 HD12 LEU A 29 14.196 -2.368 -5.858 1.00 0.00 H new ATOM 0 HD13 LEU A 29 13.132 -1.536 -7.016 1.00 0.00 H new ATOM 0 HD21 LEU A 29 15.415 -0.324 -8.692 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.987 0.593 -8.158 1.00 0.00 H new ATOM 0 HD23 LEU A 29 15.620 1.177 -7.760 1.00 0.00 H new ATOM 392 N ASN A 30 15.650 -2.330 -3.535 1.00 0.00 N ATOM 393 CA ASN A 30 16.827 -3.167 -3.334 1.00 0.00 C ATOM 394 C ASN A 30 17.402 -3.627 -4.670 1.00 0.00 C ATOM 395 O ASN A 30 16.697 -4.214 -5.491 1.00 0.00 O ATOM 396 CB ASN A 30 16.473 -4.382 -2.473 1.00 0.00 C ATOM 397 CG ASN A 30 17.685 -4.968 -1.775 1.00 0.00 C ATOM 398 OD1 ASN A 30 18.699 -5.261 -2.409 1.00 0.00 O ATOM 399 ND2 ASN A 30 17.585 -5.144 -0.463 1.00 0.00 N ATOM 0 H ASN A 30 14.762 -2.807 -3.381 1.00 0.00 H new ATOM 0 HA ASN A 30 17.582 -2.572 -2.819 1.00 0.00 H new ATOM 0 HB2 ASN A 30 15.732 -4.092 -1.728 1.00 0.00 H new ATOM 0 HB3 ASN A 30 16.013 -5.146 -3.099 1.00 0.00 H new ATOM 0 HD21 ASN A 30 18.368 -5.536 0.060 1.00 0.00 H new ATOM 0 HD22 ASN A 30 16.725 -4.887 0.022 1.00 0.00 H new ATOM 406 N GLU A 31 18.686 -3.357 -4.880 1.00 0.00 N ATOM 407 CA GLU A 31 19.355 -3.743 -6.117 1.00 0.00 C ATOM 408 C GLU A 31 19.813 -5.197 -6.057 1.00 0.00 C ATOM 409 O GLU A 31 19.629 -5.957 -7.008 1.00 0.00 O ATOM 410 CB GLU A 31 20.555 -2.829 -6.380 1.00 0.00 C ATOM 411 CG GLU A 31 20.170 -1.391 -6.682 1.00 0.00 C ATOM 412 CD GLU A 31 19.940 -1.146 -8.161 1.00 0.00 C ATOM 413 OE1 GLU A 31 20.936 -1.041 -8.907 1.00 0.00 O ATOM 414 OE2 GLU A 31 18.764 -1.060 -8.572 1.00 0.00 O ATOM 0 H GLU A 31 19.284 -2.873 -4.210 1.00 0.00 H new ATOM 0 HA GLU A 31 18.641 -3.639 -6.934 1.00 0.00 H new ATOM 0 HB2 GLU A 31 21.211 -2.845 -5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 31 21.127 -3.227 -7.218 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.264 -1.138 -6.131 1.00 0.00 H new ATOM 0 HG3 GLU A 31 20.957 -0.726 -6.326 1.00 0.00 H new ATOM 421 N SER A 32 20.411 -5.577 -4.932 1.00 0.00 N ATOM 422 CA SER A 32 20.900 -6.939 -4.748 1.00 0.00 C ATOM 423 C SER A 32 19.749 -7.939 -4.794 1.00 0.00 C ATOM 424 O SER A 32 19.891 -9.041 -5.325 1.00 0.00 O ATOM 425 CB SER A 32 21.644 -7.061 -3.417 1.00 0.00 C ATOM 426 OG SER A 32 20.737 -7.150 -2.332 1.00 0.00 O ATOM 0 H SER A 32 20.569 -4.961 -4.134 1.00 0.00 H new ATOM 0 HA SER A 32 21.588 -7.165 -5.562 1.00 0.00 H new ATOM 0 HB2 SER A 32 22.283 -7.944 -3.434 1.00 0.00 H new ATOM 0 HB3 SER A 32 22.296 -6.198 -3.281 1.00 0.00 H new ATOM 0 HG SER A 32 20.041 -6.467 -2.431 1.00 0.00 H new ATOM 432 N SER A 33 18.610 -7.547 -4.234 1.00 0.00 N ATOM 433 CA SER A 33 17.434 -8.411 -4.207 1.00 0.00 C ATOM 434 C SER A 33 16.300 -7.810 -5.031 1.00 0.00 C ATOM 435 O SER A 33 16.091 -6.596 -5.029 1.00 0.00 O ATOM 436 CB SER A 33 16.972 -8.632 -2.765 1.00 0.00 C ATOM 437 OG SER A 33 16.335 -9.890 -2.622 1.00 0.00 O ATOM 0 H SER A 33 18.475 -6.637 -3.793 1.00 0.00 H new ATOM 0 HA SER A 33 17.707 -9.371 -4.645 1.00 0.00 H new ATOM 0 HB2 SER A 33 17.828 -8.576 -2.093 1.00 0.00 H new ATOM 0 HB3 SER A 33 16.285 -7.837 -2.474 1.00 0.00 H new ATOM 0 HG SER A 33 16.050 -10.009 -1.692 1.00 0.00 H new ATOM 443 N ASP A 34 15.570 -8.668 -5.734 1.00 0.00 N ATOM 444 CA ASP A 34 14.455 -8.223 -6.563 1.00 0.00 C ATOM 445 C ASP A 34 13.224 -7.937 -5.709 1.00 0.00 C ATOM 446 O ASP A 34 12.162 -8.524 -5.916 1.00 0.00 O ATOM 447 CB ASP A 34 14.124 -9.279 -7.619 1.00 0.00 C ATOM 448 CG ASP A 34 15.291 -9.555 -8.547 1.00 0.00 C ATOM 449 OD1 ASP A 34 16.441 -9.584 -8.062 1.00 0.00 O ATOM 450 OD2 ASP A 34 15.053 -9.743 -9.758 1.00 0.00 O ATOM 0 H ASP A 34 15.730 -9.675 -5.747 1.00 0.00 H new ATOM 0 HA ASP A 34 14.751 -7.301 -7.063 1.00 0.00 H new ATOM 0 HB2 ASP A 34 13.831 -10.205 -7.124 1.00 0.00 H new ATOM 0 HB3 ASP A 34 13.268 -8.946 -8.206 1.00 0.00 H new ATOM 455 N ASN A 35 13.374 -7.031 -4.748 1.00 0.00 N ATOM 456 CA ASN A 35 12.274 -6.668 -3.861 1.00 0.00 C ATOM 457 C ASN A 35 12.270 -5.167 -3.586 1.00 0.00 C ATOM 458 O ASN A 35 13.286 -4.492 -3.753 1.00 0.00 O ATOM 459 CB ASN A 35 12.378 -7.439 -2.544 1.00 0.00 C ATOM 460 CG ASN A 35 13.557 -6.990 -1.702 1.00 0.00 C ATOM 461 OD1 ASN A 35 14.288 -6.073 -2.078 1.00 0.00 O ATOM 462 ND2 ASN A 35 13.747 -7.635 -0.557 1.00 0.00 N ATOM 0 H ASN A 35 14.246 -6.535 -4.564 1.00 0.00 H new ATOM 0 HA ASN A 35 11.339 -6.931 -4.355 1.00 0.00 H new ATOM 0 HB2 ASN A 35 11.458 -7.307 -1.975 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.471 -8.504 -2.756 1.00 0.00 H new ATOM 0 HD21 ASN A 35 14.524 -7.377 0.051 1.00 0.00 H new ATOM 0 HD22 ASN A 35 13.116 -8.389 -0.286 1.00 0.00 H new ATOM 469 N VAL A 36 11.120 -4.652 -3.163 1.00 0.00 N ATOM 470 CA VAL A 36 10.984 -3.232 -2.863 1.00 0.00 C ATOM 471 C VAL A 36 10.513 -3.016 -1.429 1.00 0.00 C ATOM 472 O VAL A 36 9.412 -3.424 -1.058 1.00 0.00 O ATOM 473 CB VAL A 36 9.994 -2.548 -3.824 1.00 0.00 C ATOM 474 CG1 VAL A 36 9.944 -1.050 -3.563 1.00 0.00 C ATOM 475 CG2 VAL A 36 10.373 -2.833 -5.270 1.00 0.00 C ATOM 0 H VAL A 36 10.270 -5.197 -3.020 1.00 0.00 H new ATOM 0 HA VAL A 36 11.970 -2.786 -2.990 1.00 0.00 H new ATOM 0 HB VAL A 36 9.000 -2.957 -3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 36 9.239 -0.584 -4.252 1.00 0.00 H new ATOM 0 HG12 VAL A 36 9.622 -0.870 -2.537 1.00 0.00 H new ATOM 0 HG13 VAL A 36 10.935 -0.621 -3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 36 9.663 -2.342 -5.936 1.00 0.00 H new ATOM 0 HG22 VAL A 36 11.376 -2.453 -5.465 1.00 0.00 H new ATOM 0 HG23 VAL A 36 10.352 -3.908 -5.446 1.00 0.00 H new ATOM 485 N ASP A 37 11.354 -2.372 -0.627 1.00 0.00 N ATOM 486 CA ASP A 37 11.023 -2.100 0.768 1.00 0.00 C ATOM 487 C ASP A 37 10.170 -0.842 0.888 1.00 0.00 C ATOM 488 O ASP A 37 10.306 0.090 0.095 1.00 0.00 O ATOM 489 CB ASP A 37 12.300 -1.948 1.596 1.00 0.00 C ATOM 490 CG ASP A 37 12.844 -3.280 2.073 1.00 0.00 C ATOM 491 OD1 ASP A 37 12.044 -4.106 2.560 1.00 0.00 O ATOM 492 OD2 ASP A 37 14.069 -3.496 1.960 1.00 0.00 O ATOM 0 H ASP A 37 12.269 -2.029 -0.918 1.00 0.00 H new ATOM 0 HA ASP A 37 10.449 -2.943 1.152 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.059 -1.442 0.999 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.097 -1.312 2.458 1.00 0.00 H new ATOM 497 N ILE A 38 9.291 -0.822 1.885 1.00 0.00 N ATOM 498 CA ILE A 38 8.417 0.322 2.109 1.00 0.00 C ATOM 499 C ILE A 38 8.248 0.602 3.598 1.00 0.00 C ATOM 500 O ILE A 38 7.888 -0.287 4.370 1.00 0.00 O ATOM 501 CB ILE A 38 7.029 0.101 1.479 1.00 0.00 C ATOM 502 CG1 ILE A 38 7.171 -0.362 0.028 1.00 0.00 C ATOM 503 CG2 ILE A 38 6.203 1.377 1.556 1.00 0.00 C ATOM 504 CD1 ILE A 38 7.359 -1.856 -0.115 1.00 0.00 C ATOM 0 H ILE A 38 9.166 -1.585 2.550 1.00 0.00 H new ATOM 0 HA ILE A 38 8.892 1.180 1.632 1.00 0.00 H new ATOM 0 HB ILE A 38 6.512 -0.678 2.040 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.284 -0.061 -0.529 1.00 0.00 H new ATOM 0 HG13 ILE A 38 8.021 0.148 -0.426 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.225 1.205 1.107 1.00 0.00 H new ATOM 0 HG22 ILE A 38 6.077 1.667 2.599 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.714 2.175 1.017 1.00 0.00 H new ATOM 0 HD11 ILE A 38 7.453 -2.112 -1.170 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.262 -2.161 0.414 1.00 0.00 H new ATOM 0 HD13 ILE A 38 6.498 -2.373 0.309 1.00 0.00 H new ATOM 516 N ARG A 39 8.509 1.843 3.995 1.00 0.00 N ATOM 517 CA ARG A 39 8.385 2.241 5.392 1.00 0.00 C ATOM 518 C ARG A 39 7.536 3.502 5.525 1.00 0.00 C ATOM 519 O ARG A 39 7.562 4.374 4.657 1.00 0.00 O ATOM 520 CB ARG A 39 9.769 2.479 6.001 1.00 0.00 C ATOM 521 CG ARG A 39 10.358 1.248 6.671 1.00 0.00 C ATOM 522 CD ARG A 39 9.916 1.140 8.123 1.00 0.00 C ATOM 523 NE ARG A 39 10.926 0.492 8.955 1.00 0.00 N ATOM 524 CZ ARG A 39 12.076 1.064 9.295 1.00 0.00 C ATOM 525 NH1 ARG A 39 12.360 2.290 8.876 1.00 0.00 N ATOM 526 NH2 ARG A 39 12.945 0.410 10.055 1.00 0.00 N ATOM 0 H ARG A 39 8.808 2.591 3.369 1.00 0.00 H new ATOM 0 HA ARG A 39 7.891 1.433 5.932 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.448 2.817 5.218 1.00 0.00 H new ATOM 0 HB3 ARG A 39 9.701 3.284 6.733 1.00 0.00 H new ATOM 0 HG2 ARG A 39 10.050 0.354 6.128 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.446 1.291 6.623 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.709 2.136 8.514 1.00 0.00 H new ATOM 0 HD3 ARG A 39 8.985 0.576 8.178 1.00 0.00 H new ATOM 0 HE ARG A 39 10.738 -0.452 9.294 1.00 0.00 H new ATOM 0 HH11 ARG A 39 11.695 2.796 8.291 1.00 0.00 H new ATOM 0 HH12 ARG A 39 13.244 2.727 9.139 1.00 0.00 H new ATOM 0 HH21 ARG A 39 12.731 -0.533 10.379 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.827 0.850 10.315 1.00 0.00 H new ATOM 540 N TRP A 40 6.784 3.589 6.616 1.00 0.00 N ATOM 541 CA TRP A 40 5.926 4.743 6.863 1.00 0.00 C ATOM 542 C TRP A 40 5.844 5.052 8.354 1.00 0.00 C ATOM 543 O TRP A 40 6.490 4.394 9.169 1.00 0.00 O ATOM 544 CB TRP A 40 4.525 4.491 6.304 1.00 0.00 C ATOM 545 CG TRP A 40 3.894 3.236 6.826 1.00 0.00 C ATOM 546 CD1 TRP A 40 3.074 3.121 7.912 1.00 0.00 C ATOM 547 CD2 TRP A 40 4.034 1.917 6.286 1.00 0.00 C ATOM 548 NE1 TRP A 40 2.695 1.811 8.079 1.00 0.00 N ATOM 549 CE2 TRP A 40 3.270 1.052 7.094 1.00 0.00 C ATOM 550 CE3 TRP A 40 4.728 1.383 5.197 1.00 0.00 C ATOM 551 CZ2 TRP A 40 3.184 -0.315 6.846 1.00 0.00 C ATOM 552 CZ3 TRP A 40 4.642 0.026 4.952 1.00 0.00 C ATOM 553 CH2 TRP A 40 3.874 -0.811 5.773 1.00 0.00 C ATOM 0 H TRP A 40 6.751 2.875 7.344 1.00 0.00 H new ATOM 0 HA TRP A 40 6.363 5.604 6.357 1.00 0.00 H new ATOM 0 HB2 TRP A 40 3.886 5.339 6.549 1.00 0.00 H new ATOM 0 HB3 TRP A 40 4.580 4.437 5.217 1.00 0.00 H new ATOM 0 HD1 TRP A 40 2.768 3.940 8.547 1.00 0.00 H new ATOM 0 HE1 TRP A 40 2.084 1.460 8.817 1.00 0.00 H new ATOM 0 HE3 TRP A 40 5.321 2.020 4.558 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 2.593 -0.962 7.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 5.176 -0.397 4.114 1.00 0.00 H new ATOM 0 HH2 TRP A 40 3.826 -1.868 5.555 1.00 0.00 H new ATOM 564 N MET A 41 5.047 6.056 8.703 1.00 0.00 N ATOM 565 CA MET A 41 4.881 6.450 10.097 1.00 0.00 C ATOM 566 C MET A 41 3.411 6.404 10.503 1.00 0.00 C ATOM 567 O MET A 41 2.520 6.439 9.654 1.00 0.00 O ATOM 568 CB MET A 41 5.441 7.856 10.322 1.00 0.00 C ATOM 569 CG MET A 41 6.910 7.870 10.712 1.00 0.00 C ATOM 570 SD MET A 41 7.546 9.537 10.967 1.00 0.00 S ATOM 571 CE MET A 41 7.807 9.532 12.739 1.00 0.00 C ATOM 0 H MET A 41 4.506 6.611 8.040 1.00 0.00 H new ATOM 0 HA MET A 41 5.433 5.744 10.717 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.310 8.440 9.411 1.00 0.00 H new ATOM 0 HB3 MET A 41 4.862 8.348 11.103 1.00 0.00 H new ATOM 0 HG2 MET A 41 7.045 7.290 11.625 1.00 0.00 H new ATOM 0 HG3 MET A 41 7.493 7.378 9.933 1.00 0.00 H new ATOM 0 HE1 MET A 41 8.200 10.499 13.052 1.00 0.00 H new ATOM 0 HE2 MET A 41 6.860 9.344 13.246 1.00 0.00 H new ATOM 0 HE3 MET A 41 8.519 8.749 13.000 1.00 0.00 H new ATOM 581 N LYS A 42 3.164 6.326 11.806 1.00 0.00 N ATOM 582 CA LYS A 42 1.803 6.277 12.326 1.00 0.00 C ATOM 583 C LYS A 42 1.175 7.667 12.340 1.00 0.00 C ATOM 584 O LYS A 42 1.777 8.642 12.790 1.00 0.00 O ATOM 585 CB LYS A 42 1.796 5.688 13.739 1.00 0.00 C ATOM 586 CG LYS A 42 0.488 5.008 14.107 1.00 0.00 C ATOM 587 CD LYS A 42 -0.511 5.997 14.683 1.00 0.00 C ATOM 588 CE LYS A 42 -1.490 5.315 15.627 1.00 0.00 C ATOM 589 NZ LYS A 42 -2.031 6.260 16.643 1.00 0.00 N ATOM 0 H LYS A 42 3.890 6.295 12.522 1.00 0.00 H new ATOM 0 HA LYS A 42 1.213 5.638 11.669 1.00 0.00 H new ATOM 0 HB2 LYS A 42 2.608 4.967 13.827 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.997 6.484 14.456 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.063 4.533 13.223 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.679 4.218 14.833 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.021 6.785 15.216 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.060 6.476 13.872 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -2.313 4.890 15.052 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.992 4.487 16.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.109 5.776 17.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -1.391 7.075 16.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -2.971 6.590 16.344 1.00 0.00 H new ATOM 603 N PRO A 43 -0.064 7.762 11.837 1.00 0.00 N ATOM 604 CA PRO A 43 -0.801 9.028 11.783 1.00 0.00 C ATOM 605 C PRO A 43 -1.219 9.516 13.166 1.00 0.00 C ATOM 606 O PRO A 43 -1.201 8.770 14.145 1.00 0.00 O ATOM 607 CB PRO A 43 -2.033 8.686 10.941 1.00 0.00 C ATOM 608 CG PRO A 43 -2.222 7.219 11.125 1.00 0.00 C ATOM 609 CD PRO A 43 -0.842 6.641 11.283 1.00 0.00 C ATOM 0 HA PRO A 43 -0.195 9.834 11.369 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -2.908 9.243 11.275 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -1.877 8.937 9.892 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -2.835 7.011 12.002 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -2.733 6.781 10.268 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -0.841 5.781 11.953 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -0.436 6.303 10.329 1.00 0.00 H new ATOM 617 N PRO A 44 -1.607 10.797 13.251 1.00 0.00 N ATOM 618 CA PRO A 44 -2.038 11.412 14.510 1.00 0.00 C ATOM 619 C PRO A 44 -3.381 10.872 14.988 1.00 0.00 C ATOM 620 O PRO A 44 -3.934 11.343 15.983 1.00 0.00 O ATOM 621 CB PRO A 44 -2.153 12.897 14.158 1.00 0.00 C ATOM 622 CG PRO A 44 -2.402 12.920 12.689 1.00 0.00 C ATOM 623 CD PRO A 44 -1.654 11.744 12.124 1.00 0.00 C ATOM 0 HA PRO A 44 -1.343 11.206 15.324 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -2.968 13.372 14.705 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -1.241 13.436 14.413 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -3.468 12.845 12.473 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.052 13.853 12.248 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.167 11.318 11.262 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -0.654 12.025 11.793 1.00 0.00 H new ATOM 631 N THR A 45 -3.903 9.879 14.274 1.00 0.00 N ATOM 632 CA THR A 45 -5.182 9.275 14.626 1.00 0.00 C ATOM 633 C THR A 45 -5.067 8.446 15.899 1.00 0.00 C ATOM 634 O THR A 45 -4.989 7.218 15.848 1.00 0.00 O ATOM 635 CB THR A 45 -5.712 8.380 13.490 1.00 0.00 C ATOM 636 OG1 THR A 45 -4.831 7.270 13.289 1.00 0.00 O ATOM 637 CG2 THR A 45 -5.845 9.170 12.196 1.00 0.00 C ATOM 0 H THR A 45 -3.459 9.476 13.449 1.00 0.00 H new ATOM 0 HA THR A 45 -5.883 10.093 14.791 1.00 0.00 H new ATOM 0 HB THR A 45 -6.698 8.013 13.776 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.567 6.900 14.157 1.00 0.00 H new ATOM 0 HG21 THR A 45 -6.221 8.517 11.408 1.00 0.00 H new ATOM 0 HG22 THR A 45 -6.540 9.997 12.344 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.870 9.563 11.907 1.00 0.00 H new ATOM 645 N LYS A 46 -5.057 9.123 17.042 1.00 0.00 N ATOM 646 CA LYS A 46 -4.954 8.449 18.331 1.00 0.00 C ATOM 647 C LYS A 46 -6.293 8.461 19.061 1.00 0.00 C ATOM 648 O LYS A 46 -6.639 7.507 19.756 1.00 0.00 O ATOM 649 CB LYS A 46 -3.883 9.119 19.196 1.00 0.00 C ATOM 650 CG LYS A 46 -4.065 10.620 19.335 1.00 0.00 C ATOM 651 CD LYS A 46 -3.371 11.154 20.576 1.00 0.00 C ATOM 652 CE LYS A 46 -1.920 11.512 20.293 1.00 0.00 C ATOM 653 NZ LYS A 46 -1.237 12.053 21.500 1.00 0.00 N ATOM 0 H LYS A 46 -5.119 10.139 17.102 1.00 0.00 H new ATOM 0 HA LYS A 46 -4.670 7.413 18.149 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.894 8.667 20.188 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.902 8.919 18.765 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.667 11.119 18.451 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -5.128 10.856 19.382 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -3.900 12.035 20.939 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -3.415 10.407 21.368 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.389 10.627 19.942 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.877 12.249 19.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.251 12.285 21.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.728 12.912 21.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.255 11.341 22.258 1.00 0.00 H new ATOM 667 N GLN A 47 -7.041 9.548 18.897 1.00 0.00 N ATOM 668 CA GLN A 47 -8.343 9.683 19.540 1.00 0.00 C ATOM 669 C GLN A 47 -9.438 9.923 18.507 1.00 0.00 C ATOM 670 O GLN A 47 -10.622 9.737 18.789 1.00 0.00 O ATOM 671 CB GLN A 47 -8.319 10.830 20.551 1.00 0.00 C ATOM 672 CG GLN A 47 -7.864 12.154 19.959 1.00 0.00 C ATOM 673 CD GLN A 47 -7.997 13.306 20.935 1.00 0.00 C ATOM 674 OE1 GLN A 47 -8.521 13.143 22.038 1.00 0.00 O ATOM 675 NE2 GLN A 47 -7.522 14.480 20.535 1.00 0.00 N ATOM 0 H GLN A 47 -6.768 10.347 18.325 1.00 0.00 H new ATOM 0 HA GLN A 47 -8.560 8.752 20.063 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -9.317 10.953 20.971 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -7.657 10.563 21.375 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -6.824 12.068 19.644 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -8.451 12.369 19.066 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -7.096 14.570 19.613 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -7.584 15.291 21.150 1.00 0.00 H new ATOM 684 N GLN A 48 -9.036 10.337 17.310 1.00 0.00 N ATOM 685 CA GLN A 48 -9.984 10.604 16.235 1.00 0.00 C ATOM 686 C GLN A 48 -10.721 9.331 15.831 1.00 0.00 C ATOM 687 O GLN A 48 -11.951 9.305 15.779 1.00 0.00 O ATOM 688 CB GLN A 48 -9.261 11.195 15.023 1.00 0.00 C ATOM 689 CG GLN A 48 -10.192 11.873 14.031 1.00 0.00 C ATOM 690 CD GLN A 48 -9.449 12.731 13.026 1.00 0.00 C ATOM 691 OE1 GLN A 48 -9.214 12.315 11.891 1.00 0.00 O ATOM 692 NE2 GLN A 48 -9.075 13.936 13.438 1.00 0.00 N ATOM 0 H GLN A 48 -8.060 10.495 17.060 1.00 0.00 H new ATOM 0 HA GLN A 48 -10.715 11.325 16.600 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.522 11.918 15.368 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.716 10.401 14.513 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.767 11.114 13.500 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -10.906 12.492 14.574 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -9.291 14.240 14.387 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -8.572 14.558 12.805 1.00 0.00 H new ATOM 701 N ASP A 49 -9.962 8.279 15.546 1.00 0.00 N ATOM 702 CA ASP A 49 -10.543 7.003 15.147 1.00 0.00 C ATOM 703 C ASP A 49 -10.555 6.022 16.316 1.00 0.00 C ATOM 704 O ASP A 49 -11.582 5.417 16.622 1.00 0.00 O ATOM 705 CB ASP A 49 -9.764 6.407 13.974 1.00 0.00 C ATOM 706 CG ASP A 49 -10.599 5.445 13.152 1.00 0.00 C ATOM 707 OD1 ASP A 49 -11.512 4.815 13.725 1.00 0.00 O ATOM 708 OD2 ASP A 49 -10.339 5.322 11.937 1.00 0.00 O ATOM 0 H ASP A 49 -8.943 8.285 15.584 1.00 0.00 H new ATOM 0 HA ASP A 49 -11.572 7.183 14.835 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -9.407 7.213 13.333 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -8.884 5.887 14.353 1.00 0.00 H new ATOM 713 N GLY A 50 -9.405 5.870 16.966 1.00 0.00 N ATOM 714 CA GLY A 50 -9.304 4.961 18.092 1.00 0.00 C ATOM 715 C GLY A 50 -7.983 4.219 18.123 1.00 0.00 C ATOM 716 O GLY A 50 -7.040 4.646 18.789 1.00 0.00 O ATOM 0 H GLY A 50 -8.542 6.360 16.732 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -9.424 5.522 19.019 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -10.121 4.240 18.047 1.00 0.00 H new ATOM 720 N GLU A 51 -7.914 3.105 17.401 1.00 0.00 N ATOM 721 CA GLU A 51 -6.698 2.302 17.351 1.00 0.00 C ATOM 722 C GLU A 51 -6.528 1.657 15.978 1.00 0.00 C ATOM 723 O GLU A 51 -7.417 0.954 15.496 1.00 0.00 O ATOM 724 CB GLU A 51 -6.728 1.222 18.434 1.00 0.00 C ATOM 725 CG GLU A 51 -7.803 0.170 18.215 1.00 0.00 C ATOM 726 CD GLU A 51 -7.874 -0.835 19.347 1.00 0.00 C ATOM 727 OE1 GLU A 51 -8.572 -0.558 20.345 1.00 0.00 O ATOM 728 OE2 GLU A 51 -7.232 -1.901 19.235 1.00 0.00 O ATOM 0 H GLU A 51 -8.685 2.738 16.843 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.850 2.962 17.531 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.755 0.732 18.474 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.887 1.695 19.403 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.770 0.661 18.109 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.607 -0.355 17.280 1.00 0.00 H new ATOM 735 N LEU A 52 -5.381 1.901 15.354 1.00 0.00 N ATOM 736 CA LEU A 52 -5.093 1.344 14.037 1.00 0.00 C ATOM 737 C LEU A 52 -4.796 -0.149 14.129 1.00 0.00 C ATOM 738 O LEU A 52 -3.986 -0.582 14.949 1.00 0.00 O ATOM 739 CB LEU A 52 -3.908 2.073 13.401 1.00 0.00 C ATOM 740 CG LEU A 52 -3.315 1.426 12.149 1.00 0.00 C ATOM 741 CD1 LEU A 52 -2.728 2.484 11.228 1.00 0.00 C ATOM 742 CD2 LEU A 52 -2.257 0.400 12.529 1.00 0.00 C ATOM 0 H LEU A 52 -4.635 2.481 15.739 1.00 0.00 H new ATOM 0 HA LEU A 52 -5.975 1.482 13.412 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.223 3.085 13.148 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -3.119 2.162 14.148 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.115 0.913 11.615 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.311 2.005 10.343 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -3.511 3.181 10.929 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.941 3.026 11.752 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.846 -0.050 11.626 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.458 0.890 13.086 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -2.708 -0.376 13.148 1.00 0.00 H new ATOM 754 N VAL A 53 -5.455 -0.932 13.281 1.00 0.00 N ATOM 755 CA VAL A 53 -5.259 -2.377 13.265 1.00 0.00 C ATOM 756 C VAL A 53 -4.318 -2.791 12.139 1.00 0.00 C ATOM 757 O VAL A 53 -3.830 -3.920 12.108 1.00 0.00 O ATOM 758 CB VAL A 53 -6.597 -3.123 13.102 1.00 0.00 C ATOM 759 CG1 VAL A 53 -7.485 -2.899 14.316 1.00 0.00 C ATOM 760 CG2 VAL A 53 -7.301 -2.681 11.827 1.00 0.00 C ATOM 0 H VAL A 53 -6.129 -0.590 12.596 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.815 -2.647 14.223 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.391 -4.191 13.025 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -8.425 -3.434 14.182 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -6.981 -3.269 15.209 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.686 -1.834 14.428 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.244 -3.218 11.727 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.496 -1.610 11.872 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.667 -2.899 10.967 1.00 0.00 H new ATOM 770 N GLY A 54 -4.068 -1.869 11.215 1.00 0.00 N ATOM 771 CA GLY A 54 -3.185 -2.157 10.099 1.00 0.00 C ATOM 772 C GLY A 54 -3.157 -1.037 9.078 1.00 0.00 C ATOM 773 O GLY A 54 -3.594 0.080 9.359 1.00 0.00 O ATOM 0 H GLY A 54 -4.461 -0.928 11.219 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -2.176 -2.329 10.473 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.506 -3.079 9.614 1.00 0.00 H new ATOM 777 N TYR A 55 -2.639 -1.333 7.891 1.00 0.00 N ATOM 778 CA TYR A 55 -2.552 -0.342 6.826 1.00 0.00 C ATOM 779 C TYR A 55 -3.022 -0.926 5.498 1.00 0.00 C ATOM 780 O TYR A 55 -3.363 -2.106 5.411 1.00 0.00 O ATOM 781 CB TYR A 55 -1.115 0.168 6.692 1.00 0.00 C ATOM 782 CG TYR A 55 -0.603 0.866 7.932 1.00 0.00 C ATOM 783 CD1 TYR A 55 -0.053 0.142 8.983 1.00 0.00 C ATOM 784 CD2 TYR A 55 -0.668 2.249 8.052 1.00 0.00 C ATOM 785 CE1 TYR A 55 0.416 0.776 10.118 1.00 0.00 C ATOM 786 CE2 TYR A 55 -0.200 2.890 9.182 1.00 0.00 C ATOM 787 CZ TYR A 55 0.341 2.150 10.212 1.00 0.00 C ATOM 788 OH TYR A 55 0.807 2.785 11.340 1.00 0.00 O ATOM 0 H TYR A 55 -2.273 -2.252 7.642 1.00 0.00 H new ATOM 0 HA TYR A 55 -3.204 0.492 7.086 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -0.460 -0.672 6.461 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -1.060 0.856 5.849 1.00 0.00 H new ATOM 0 HD1 TYR A 55 0.009 -0.934 8.912 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -1.092 2.832 7.248 1.00 0.00 H new ATOM 0 HE1 TYR A 55 0.839 0.199 10.927 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -0.257 3.966 9.259 1.00 0.00 H new ATOM 0 HH TYR A 55 1.407 3.515 11.080 1.00 0.00 H new ATOM 798 N ARG A 56 -3.036 -0.091 4.464 1.00 0.00 N ATOM 799 CA ARG A 56 -3.465 -0.523 3.139 1.00 0.00 C ATOM 800 C ARG A 56 -2.476 -0.064 2.071 1.00 0.00 C ATOM 801 O ARG A 56 -2.425 1.116 1.724 1.00 0.00 O ATOM 802 CB ARG A 56 -4.859 0.025 2.827 1.00 0.00 C ATOM 803 CG ARG A 56 -5.986 -0.900 3.255 1.00 0.00 C ATOM 804 CD ARG A 56 -6.374 -1.859 2.141 1.00 0.00 C ATOM 805 NE ARG A 56 -7.277 -1.239 1.175 1.00 0.00 N ATOM 806 CZ ARG A 56 -7.603 -1.794 0.013 1.00 0.00 C ATOM 807 NH1 ARG A 56 -7.104 -2.975 -0.325 1.00 0.00 N ATOM 808 NH2 ARG A 56 -8.431 -1.168 -0.814 1.00 0.00 N ATOM 0 H ARG A 56 -2.755 0.888 4.518 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.500 -1.612 3.133 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -4.982 0.987 3.324 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.937 0.207 1.755 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.679 -1.467 4.134 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.854 -0.308 3.545 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -5.475 -2.202 1.629 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.852 -2.739 2.571 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.679 -0.330 1.405 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -6.468 -3.460 0.308 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -7.356 -3.399 -1.218 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.818 -0.260 -0.558 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -8.681 -1.595 -1.706 1.00 0.00 H new ATOM 822 N ILE A 57 -1.692 -1.004 1.555 1.00 0.00 N ATOM 823 CA ILE A 57 -0.705 -0.697 0.528 1.00 0.00 C ATOM 824 C ILE A 57 -1.178 -1.161 -0.846 1.00 0.00 C ATOM 825 O ILE A 57 -1.592 -2.308 -1.016 1.00 0.00 O ATOM 826 CB ILE A 57 0.654 -1.351 0.838 1.00 0.00 C ATOM 827 CG1 ILE A 57 1.129 -0.953 2.237 1.00 0.00 C ATOM 828 CG2 ILE A 57 1.684 -0.955 -0.210 1.00 0.00 C ATOM 829 CD1 ILE A 57 2.257 -1.814 2.760 1.00 0.00 C ATOM 0 H ILE A 57 -1.721 -1.985 1.832 1.00 0.00 H new ATOM 0 HA ILE A 57 -0.584 0.386 0.522 1.00 0.00 H new ATOM 0 HB ILE A 57 0.534 -2.434 0.810 1.00 0.00 H new ATOM 0 HG12 ILE A 57 1.455 0.087 2.219 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.288 -1.011 2.928 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.639 -1.425 0.023 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.348 -1.284 -1.193 1.00 0.00 H new ATOM 0 HG23 ILE A 57 1.804 0.128 -0.211 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.542 -1.475 3.756 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.929 -2.852 2.811 1.00 0.00 H new ATOM 0 HD13 ILE A 57 3.114 -1.737 2.091 1.00 0.00 H new ATOM 841 N SER A 58 -1.113 -0.263 -1.823 1.00 0.00 N ATOM 842 CA SER A 58 -1.537 -0.579 -3.182 1.00 0.00 C ATOM 843 C SER A 58 -0.402 -0.343 -4.174 1.00 0.00 C ATOM 844 O SER A 58 -0.062 0.798 -4.486 1.00 0.00 O ATOM 845 CB SER A 58 -2.752 0.266 -3.570 1.00 0.00 C ATOM 846 OG SER A 58 -2.983 0.216 -4.967 1.00 0.00 O ATOM 0 H SER A 58 -0.771 0.690 -1.699 1.00 0.00 H new ATOM 0 HA SER A 58 -1.812 -1.633 -3.214 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.634 -0.094 -3.039 1.00 0.00 H new ATOM 0 HB3 SER A 58 -2.594 1.299 -3.261 1.00 0.00 H new ATOM 0 HG SER A 58 -3.765 0.763 -5.189 1.00 0.00 H new ATOM 852 N HIS A 59 0.181 -1.432 -4.666 1.00 0.00 N ATOM 853 CA HIS A 59 1.278 -1.345 -5.623 1.00 0.00 C ATOM 854 C HIS A 59 0.837 -1.829 -7.001 1.00 0.00 C ATOM 855 O HIS A 59 0.504 -3.001 -7.181 1.00 0.00 O ATOM 856 CB HIS A 59 2.472 -2.169 -5.139 1.00 0.00 C ATOM 857 CG HIS A 59 2.118 -3.577 -4.770 1.00 0.00 C ATOM 858 ND1 HIS A 59 2.647 -4.678 -5.409 1.00 0.00 N ATOM 859 CD2 HIS A 59 1.285 -4.059 -3.819 1.00 0.00 C ATOM 860 CE1 HIS A 59 2.152 -5.777 -4.869 1.00 0.00 C ATOM 861 NE2 HIS A 59 1.323 -5.430 -3.901 1.00 0.00 N ATOM 0 H HIS A 59 -0.088 -2.384 -4.418 1.00 0.00 H new ATOM 0 HA HIS A 59 1.576 -0.299 -5.702 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.231 -2.187 -5.921 1.00 0.00 H new ATOM 0 HB3 HIS A 59 2.916 -1.676 -4.274 1.00 0.00 H new ATOM 0 HD2 HIS A 59 0.699 -3.475 -3.125 1.00 0.00 H new ATOM 0 HE1 HIS A 59 2.386 -6.788 -5.168 1.00 0.00 H new ATOM 0 HE2 HIS A 59 0.797 -6.075 -3.311 1.00 0.00 H new ATOM 870 N VAL A 60 0.835 -0.919 -7.970 1.00 0.00 N ATOM 871 CA VAL A 60 0.434 -1.253 -9.331 1.00 0.00 C ATOM 872 C VAL A 60 1.615 -1.156 -10.291 1.00 0.00 C ATOM 873 O VAL A 60 2.518 -0.342 -10.100 1.00 0.00 O ATOM 874 CB VAL A 60 -0.694 -0.329 -9.827 1.00 0.00 C ATOM 875 CG1 VAL A 60 -1.074 -0.671 -11.260 1.00 0.00 C ATOM 876 CG2 VAL A 60 -1.903 -0.424 -8.909 1.00 0.00 C ATOM 0 H VAL A 60 1.107 0.055 -7.837 1.00 0.00 H new ATOM 0 HA VAL A 60 0.069 -2.280 -9.311 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.332 0.699 -9.808 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -1.872 -0.008 -11.593 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.205 -0.546 -11.906 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.417 -1.704 -11.309 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.690 0.235 -9.275 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.268 -1.451 -8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -1.618 -0.125 -7.900 1.00 0.00 H new ATOM 886 N TRP A 61 1.600 -1.992 -11.323 1.00 0.00 N ATOM 887 CA TRP A 61 2.671 -2.000 -12.314 1.00 0.00 C ATOM 888 C TRP A 61 2.126 -1.699 -13.706 1.00 0.00 C ATOM 889 O TRP A 61 1.275 -2.425 -14.219 1.00 0.00 O ATOM 890 CB TRP A 61 3.384 -3.353 -12.314 1.00 0.00 C ATOM 891 CG TRP A 61 3.865 -3.770 -10.957 1.00 0.00 C ATOM 892 CD1 TRP A 61 3.097 -4.183 -9.906 1.00 0.00 C ATOM 893 CD2 TRP A 61 5.223 -3.812 -10.505 1.00 0.00 C ATOM 894 NE1 TRP A 61 3.896 -4.479 -8.828 1.00 0.00 N ATOM 895 CE2 TRP A 61 5.204 -4.261 -9.170 1.00 0.00 C ATOM 896 CE3 TRP A 61 6.453 -3.517 -11.099 1.00 0.00 C ATOM 897 CZ2 TRP A 61 6.367 -4.420 -8.422 1.00 0.00 C ATOM 898 CZ3 TRP A 61 7.607 -3.674 -10.354 1.00 0.00 C ATOM 899 CH2 TRP A 61 7.558 -4.123 -9.028 1.00 0.00 C ATOM 0 H TRP A 61 0.860 -2.672 -11.496 1.00 0.00 H new ATOM 0 HA TRP A 61 3.385 -1.221 -12.047 1.00 0.00 H new ATOM 0 HB2 TRP A 61 2.705 -4.113 -12.701 1.00 0.00 H new ATOM 0 HB3 TRP A 61 4.234 -3.308 -12.995 1.00 0.00 H new ATOM 0 HD1 TRP A 61 2.020 -4.265 -9.920 1.00 0.00 H new ATOM 0 HE1 TRP A 61 3.568 -4.808 -7.920 1.00 0.00 H new ATOM 0 HE3 TRP A 61 6.501 -3.173 -12.121 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 6.331 -4.766 -7.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 8.563 -3.447 -10.802 1.00 0.00 H new ATOM 0 HH2 TRP A 61 8.478 -4.237 -8.473 1.00 0.00 H new ATOM 910 N GLN A 62 2.621 -0.624 -14.312 1.00 0.00 N ATOM 911 CA GLN A 62 2.183 -0.229 -15.645 1.00 0.00 C ATOM 912 C GLN A 62 3.362 -0.165 -16.610 1.00 0.00 C ATOM 913 O GLN A 62 4.148 0.782 -16.583 1.00 0.00 O ATOM 914 CB GLN A 62 1.479 1.128 -15.591 1.00 0.00 C ATOM 915 CG GLN A 62 -0.017 1.028 -15.340 1.00 0.00 C ATOM 916 CD GLN A 62 -0.774 2.246 -15.831 1.00 0.00 C ATOM 917 OE1 GLN A 62 -0.263 3.027 -16.635 1.00 0.00 O ATOM 918 NE2 GLN A 62 -2.000 2.416 -15.349 1.00 0.00 N ATOM 0 H GLN A 62 3.325 -0.012 -13.901 1.00 0.00 H new ATOM 0 HA GLN A 62 1.482 -0.981 -16.007 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.931 1.732 -14.804 1.00 0.00 H new ATOM 0 HB3 GLN A 62 1.647 1.653 -16.532 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.406 0.139 -15.836 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -0.195 0.901 -14.272 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -2.384 1.744 -14.685 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -2.557 3.218 -15.643 1.00 0.00 H new ATOM 927 N SER A 63 3.480 -1.180 -17.460 1.00 0.00 N ATOM 928 CA SER A 63 4.566 -1.241 -18.431 1.00 0.00 C ATOM 929 C SER A 63 4.049 -0.978 -19.842 1.00 0.00 C ATOM 930 O SER A 63 2.855 -1.104 -20.111 1.00 0.00 O ATOM 931 CB SER A 63 5.252 -2.607 -18.374 1.00 0.00 C ATOM 932 OG SER A 63 5.810 -2.951 -19.630 1.00 0.00 O ATOM 0 H SER A 63 2.837 -1.971 -17.496 1.00 0.00 H new ATOM 0 HA SER A 63 5.290 -0.467 -18.178 1.00 0.00 H new ATOM 0 HB2 SER A 63 6.036 -2.592 -17.616 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.531 -3.367 -18.073 1.00 0.00 H new ATOM 0 HG SER A 63 6.244 -3.827 -19.566 1.00 0.00 H new ATOM 938 N ALA A 64 4.958 -0.610 -20.739 1.00 0.00 N ATOM 939 CA ALA A 64 4.596 -0.331 -22.123 1.00 0.00 C ATOM 940 C ALA A 64 4.049 -1.577 -22.810 1.00 0.00 C ATOM 941 O ALA A 64 4.808 -2.444 -23.242 1.00 0.00 O ATOM 942 CB ALA A 64 5.797 0.210 -22.884 1.00 0.00 C ATOM 0 H ALA A 64 5.950 -0.498 -20.532 1.00 0.00 H new ATOM 0 HA ALA A 64 3.810 0.425 -22.121 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.512 0.414 -23.916 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.141 1.131 -22.414 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.600 -0.527 -22.868 1.00 0.00 H new ATOM 948 N GLY A 65 2.726 -1.662 -22.907 1.00 0.00 N ATOM 949 CA GLY A 65 2.100 -2.807 -23.542 1.00 0.00 C ATOM 950 C GLY A 65 1.434 -3.732 -22.543 1.00 0.00 C ATOM 951 O GLY A 65 0.595 -4.555 -22.912 1.00 0.00 O ATOM 0 H GLY A 65 2.076 -0.958 -22.557 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.358 -2.459 -24.261 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.851 -3.363 -24.103 1.00 0.00 H new ATOM 955 N ILE A 66 1.809 -3.600 -21.275 1.00 0.00 N ATOM 956 CA ILE A 66 1.242 -4.431 -20.220 1.00 0.00 C ATOM 957 C ILE A 66 0.896 -3.599 -18.991 1.00 0.00 C ATOM 958 O ILE A 66 1.710 -2.808 -18.514 1.00 0.00 O ATOM 959 CB ILE A 66 2.210 -5.556 -19.809 1.00 0.00 C ATOM 960 CG1 ILE A 66 2.481 -6.485 -20.995 1.00 0.00 C ATOM 961 CG2 ILE A 66 1.643 -6.339 -18.634 1.00 0.00 C ATOM 962 CD1 ILE A 66 1.293 -7.341 -21.375 1.00 0.00 C ATOM 0 H ILE A 66 2.503 -2.925 -20.953 1.00 0.00 H new ATOM 0 HA ILE A 66 0.332 -4.875 -20.623 1.00 0.00 H new ATOM 0 HB ILE A 66 3.154 -5.108 -19.500 1.00 0.00 H new ATOM 0 HG12 ILE A 66 2.777 -5.885 -21.856 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.323 -7.133 -20.753 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.338 -7.131 -18.355 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.497 -5.669 -17.787 1.00 0.00 H new ATOM 0 HG23 ILE A 66 0.687 -6.779 -18.917 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.557 -7.974 -22.222 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.010 -7.967 -20.529 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.455 -6.700 -21.648 1.00 0.00 H new ATOM 974 N SER A 67 -0.317 -3.784 -18.480 1.00 0.00 N ATOM 975 CA SER A 67 -0.773 -3.048 -17.306 1.00 0.00 C ATOM 976 C SER A 67 -1.359 -3.997 -16.265 1.00 0.00 C ATOM 977 O SER A 67 -2.479 -4.485 -16.413 1.00 0.00 O ATOM 978 CB SER A 67 -1.816 -2.004 -17.706 1.00 0.00 C ATOM 979 OG SER A 67 -2.972 -2.619 -18.247 1.00 0.00 O ATOM 0 H SER A 67 -1.002 -4.437 -18.860 1.00 0.00 H new ATOM 0 HA SER A 67 0.087 -2.542 -16.868 1.00 0.00 H new ATOM 0 HB2 SER A 67 -2.091 -1.408 -16.836 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.388 -1.320 -18.438 1.00 0.00 H new ATOM 0 HG SER A 67 -3.095 -3.501 -17.839 1.00 0.00 H new ATOM 985 N LYS A 68 -0.593 -4.253 -15.210 1.00 0.00 N ATOM 986 CA LYS A 68 -1.034 -5.141 -14.141 1.00 0.00 C ATOM 987 C LYS A 68 -1.106 -4.398 -12.811 1.00 0.00 C ATOM 988 O LYS A 68 -0.344 -3.463 -12.570 1.00 0.00 O ATOM 989 CB LYS A 68 -0.085 -6.336 -14.019 1.00 0.00 C ATOM 990 CG LYS A 68 0.168 -7.049 -15.336 1.00 0.00 C ATOM 991 CD LYS A 68 0.474 -8.522 -15.123 1.00 0.00 C ATOM 992 CE LYS A 68 1.946 -8.746 -14.811 1.00 0.00 C ATOM 993 NZ LYS A 68 2.263 -8.443 -13.388 1.00 0.00 N ATOM 0 H LYS A 68 0.337 -3.858 -15.072 1.00 0.00 H new ATOM 0 HA LYS A 68 -2.032 -5.501 -14.390 1.00 0.00 H new ATOM 0 HB2 LYS A 68 0.867 -5.993 -13.612 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -0.500 -7.047 -13.304 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.706 -6.947 -15.979 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.002 -6.574 -15.853 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.135 -8.907 -14.305 1.00 0.00 H new ATOM 0 HD3 LYS A 68 0.201 -9.084 -16.016 1.00 0.00 H new ATOM 0 HE2 LYS A 68 2.210 -9.781 -15.030 1.00 0.00 H new ATOM 0 HE3 LYS A 68 2.555 -8.117 -15.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 3.096 -8.992 -13.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 2.464 -7.428 -13.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 1.451 -8.698 -12.790 1.00 0.00 H new ATOM 1007 N GLU A 69 -2.026 -4.823 -11.950 1.00 0.00 N ATOM 1008 CA GLU A 69 -2.196 -4.197 -10.644 1.00 0.00 C ATOM 1009 C GLU A 69 -2.245 -5.248 -9.539 1.00 0.00 C ATOM 1010 O GLU A 69 -2.816 -6.325 -9.716 1.00 0.00 O ATOM 1011 CB GLU A 69 -3.474 -3.356 -10.620 1.00 0.00 C ATOM 1012 CG GLU A 69 -3.878 -2.902 -9.227 1.00 0.00 C ATOM 1013 CD GLU A 69 -4.737 -3.923 -8.506 1.00 0.00 C ATOM 1014 OE1 GLU A 69 -4.788 -5.083 -8.965 1.00 0.00 O ATOM 1015 OE2 GLU A 69 -5.358 -3.561 -7.485 1.00 0.00 O ATOM 0 H GLU A 69 -2.664 -5.597 -12.133 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.339 -3.548 -10.466 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.334 -2.479 -11.252 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.288 -3.936 -11.055 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -2.982 -2.707 -8.638 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.423 -1.961 -9.300 1.00 0.00 H new ATOM 1022 N LEU A 70 -1.642 -4.928 -8.400 1.00 0.00 N ATOM 1023 CA LEU A 70 -1.615 -5.844 -7.265 1.00 0.00 C ATOM 1024 C LEU A 70 -1.952 -5.115 -5.968 1.00 0.00 C ATOM 1025 O LEU A 70 -1.808 -3.895 -5.874 1.00 0.00 O ATOM 1026 CB LEU A 70 -0.240 -6.504 -7.149 1.00 0.00 C ATOM 1027 CG LEU A 70 0.235 -7.285 -8.376 1.00 0.00 C ATOM 1028 CD1 LEU A 70 1.754 -7.338 -8.419 1.00 0.00 C ATOM 1029 CD2 LEU A 70 -0.350 -8.690 -8.373 1.00 0.00 C ATOM 0 H LEU A 70 -1.165 -4.041 -8.237 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.368 -6.614 -7.434 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.495 -5.730 -6.929 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.255 -7.181 -6.295 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.116 -6.769 -9.270 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.074 -7.897 -9.298 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.152 -6.325 -8.469 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.126 -7.830 -7.521 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.002 -9.231 -9.253 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -0.030 -9.216 -7.473 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.438 -8.631 -8.391 1.00 0.00 H new ATOM 1041 N LEU A 71 -2.399 -5.869 -4.970 1.00 0.00 N ATOM 1042 CA LEU A 71 -2.754 -5.295 -3.677 1.00 0.00 C ATOM 1043 C LEU A 71 -2.126 -6.090 -2.537 1.00 0.00 C ATOM 1044 O LEU A 71 -2.275 -7.309 -2.462 1.00 0.00 O ATOM 1045 CB LEU A 71 -4.275 -5.261 -3.513 1.00 0.00 C ATOM 1046 CG LEU A 71 -4.821 -4.223 -2.532 1.00 0.00 C ATOM 1047 CD1 LEU A 71 -4.150 -4.367 -1.174 1.00 0.00 C ATOM 1048 CD2 LEU A 71 -4.625 -2.817 -3.080 1.00 0.00 C ATOM 0 H LEU A 71 -2.524 -6.879 -5.031 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.367 -4.277 -3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.722 -5.078 -4.490 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -4.608 -6.247 -3.190 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.890 -4.396 -2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.551 -3.620 -0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.342 -5.364 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -3.075 -4.220 -1.282 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.019 -2.091 -2.369 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.562 -2.632 -3.236 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.153 -2.719 -4.029 1.00 0.00 H new ATOM 1060 N GLU A 72 -1.424 -5.391 -1.651 1.00 0.00 N ATOM 1061 CA GLU A 72 -0.774 -6.032 -0.514 1.00 0.00 C ATOM 1062 C GLU A 72 -1.589 -5.835 0.761 1.00 0.00 C ATOM 1063 O GLU A 72 -2.387 -4.904 0.861 1.00 0.00 O ATOM 1064 CB GLU A 72 0.637 -5.472 -0.322 1.00 0.00 C ATOM 1065 CG GLU A 72 1.606 -6.464 0.299 1.00 0.00 C ATOM 1066 CD GLU A 72 2.298 -7.330 -0.735 1.00 0.00 C ATOM 1067 OE1 GLU A 72 3.377 -6.927 -1.219 1.00 0.00 O ATOM 1068 OE2 GLU A 72 1.762 -8.409 -1.062 1.00 0.00 O ATOM 0 H GLU A 72 -1.291 -4.381 -1.699 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.708 -7.100 -0.721 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.027 -5.153 -1.289 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.584 -4.585 0.309 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.357 -5.921 0.874 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.067 -7.102 1.000 1.00 0.00 H new ATOM 1075 N GLU A 73 -1.382 -6.719 1.732 1.00 0.00 N ATOM 1076 CA GLU A 73 -2.098 -6.643 2.999 1.00 0.00 C ATOM 1077 C GLU A 73 -1.124 -6.613 4.174 1.00 0.00 C ATOM 1078 O GLU A 73 -0.255 -7.476 4.296 1.00 0.00 O ATOM 1079 CB GLU A 73 -3.052 -7.831 3.144 1.00 0.00 C ATOM 1080 CG GLU A 73 -3.997 -7.999 1.966 1.00 0.00 C ATOM 1081 CD GLU A 73 -5.040 -9.073 2.204 1.00 0.00 C ATOM 1082 OE1 GLU A 73 -5.462 -9.243 3.368 1.00 0.00 O ATOM 1083 OE2 GLU A 73 -5.435 -9.744 1.228 1.00 0.00 O ATOM 0 H GLU A 73 -0.724 -7.496 1.665 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.676 -5.719 3.005 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -2.468 -8.743 3.263 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.638 -7.707 4.055 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.496 -7.051 1.767 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.421 -8.249 1.075 1.00 0.00 H new ATOM 1090 N VAL A 74 -1.277 -5.612 5.036 1.00 0.00 N ATOM 1091 CA VAL A 74 -0.412 -5.469 6.201 1.00 0.00 C ATOM 1092 C VAL A 74 -1.225 -5.167 7.455 1.00 0.00 C ATOM 1093 O VAL A 74 -2.245 -4.482 7.396 1.00 0.00 O ATOM 1094 CB VAL A 74 0.627 -4.350 5.995 1.00 0.00 C ATOM 1095 CG1 VAL A 74 1.873 -4.897 5.316 1.00 0.00 C ATOM 1096 CG2 VAL A 74 0.027 -3.209 5.186 1.00 0.00 C ATOM 0 H VAL A 74 -1.991 -4.889 4.949 1.00 0.00 H new ATOM 0 HA VAL A 74 0.108 -6.419 6.328 1.00 0.00 H new ATOM 0 HB VAL A 74 0.915 -3.961 6.972 1.00 0.00 H new ATOM 0 HG11 VAL A 74 2.595 -4.092 5.179 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.313 -5.678 5.937 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.605 -5.314 4.345 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.774 -2.427 5.050 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -0.290 -3.581 4.212 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.833 -2.800 5.716 1.00 0.00 H new ATOM 1106 N GLY A 75 -0.766 -5.684 8.590 1.00 0.00 N ATOM 1107 CA GLY A 75 -1.462 -5.459 9.843 1.00 0.00 C ATOM 1108 C GLY A 75 -0.854 -4.329 10.650 1.00 0.00 C ATOM 1109 O GLY A 75 0.069 -3.658 10.190 1.00 0.00 O ATOM 0 H GLY A 75 0.076 -6.255 8.664 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.508 -5.233 9.638 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.444 -6.374 10.435 1.00 0.00 H new ATOM 1113 N GLN A 76 -1.374 -4.117 11.854 1.00 0.00 N ATOM 1114 CA GLN A 76 -0.877 -3.058 12.725 1.00 0.00 C ATOM 1115 C GLN A 76 0.613 -3.234 13.000 1.00 0.00 C ATOM 1116 O GLN A 76 1.331 -2.260 13.222 1.00 0.00 O ATOM 1117 CB GLN A 76 -1.653 -3.047 14.043 1.00 0.00 C ATOM 1118 CG GLN A 76 -1.643 -4.384 14.767 1.00 0.00 C ATOM 1119 CD GLN A 76 -2.677 -4.457 15.873 1.00 0.00 C ATOM 1120 OE1 GLN A 76 -2.947 -3.466 16.553 1.00 0.00 O ATOM 1121 NE2 GLN A 76 -3.264 -5.634 16.058 1.00 0.00 N ATOM 0 H GLN A 76 -2.139 -4.664 12.249 1.00 0.00 H new ATOM 0 HA GLN A 76 -1.024 -2.105 12.217 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -1.229 -2.286 14.698 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.685 -2.758 13.845 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -1.828 -5.183 14.049 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.653 -4.557 15.189 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.010 -6.429 15.471 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.969 -5.743 16.787 1.00 0.00 H new ATOM 1130 N ASN A 77 1.069 -4.482 12.983 1.00 0.00 N ATOM 1131 CA ASN A 77 2.474 -4.785 13.232 1.00 0.00 C ATOM 1132 C ASN A 77 3.224 -5.002 11.921 1.00 0.00 C ATOM 1133 O ASN A 77 3.872 -6.030 11.727 1.00 0.00 O ATOM 1134 CB ASN A 77 2.601 -6.026 14.117 1.00 0.00 C ATOM 1135 CG ASN A 77 4.019 -6.244 14.609 1.00 0.00 C ATOM 1136 OD1 ASN A 77 4.886 -5.387 14.436 1.00 0.00 O ATOM 1137 ND2 ASN A 77 4.261 -7.394 15.225 1.00 0.00 N ATOM 0 H ASN A 77 0.487 -5.299 12.800 1.00 0.00 H new ATOM 0 HA ASN A 77 2.918 -3.933 13.747 1.00 0.00 H new ATOM 0 HB2 ASN A 77 1.934 -5.928 14.973 1.00 0.00 H new ATOM 0 HB3 ASN A 77 2.275 -6.903 13.557 1.00 0.00 H new ATOM 0 HD21 ASN A 77 5.196 -7.597 15.577 1.00 0.00 H new ATOM 0 HD22 ASN A 77 3.512 -8.075 15.346 1.00 0.00 H new ATOM 1144 N GLY A 78 3.131 -4.025 11.023 1.00 0.00 N ATOM 1145 CA GLY A 78 3.806 -4.128 9.743 1.00 0.00 C ATOM 1146 C GLY A 78 4.367 -2.801 9.274 1.00 0.00 C ATOM 1147 O GLY A 78 4.192 -2.418 8.118 1.00 0.00 O ATOM 0 H GLY A 78 2.600 -3.165 11.160 1.00 0.00 H new ATOM 0 HA2 GLY A 78 4.615 -4.854 9.820 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.108 -4.507 8.997 1.00 0.00 H new ATOM 1151 N SER A 79 5.043 -2.095 10.176 1.00 0.00 N ATOM 1152 CA SER A 79 5.628 -0.799 9.850 1.00 0.00 C ATOM 1153 C SER A 79 6.499 -0.895 8.601 1.00 0.00 C ATOM 1154 O SER A 79 6.794 0.113 7.958 1.00 0.00 O ATOM 1155 CB SER A 79 6.458 -0.281 11.026 1.00 0.00 C ATOM 1156 OG SER A 79 7.464 -1.210 11.389 1.00 0.00 O ATOM 0 H SER A 79 5.199 -2.399 11.137 1.00 0.00 H new ATOM 0 HA SER A 79 4.815 -0.100 9.652 1.00 0.00 H new ATOM 0 HB2 SER A 79 6.917 0.671 10.760 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.807 -0.093 11.880 1.00 0.00 H new ATOM 0 HG SER A 79 7.981 -0.855 12.142 1.00 0.00 H new ATOM 1162 N ARG A 80 6.906 -2.114 8.263 1.00 0.00 N ATOM 1163 CA ARG A 80 7.744 -2.342 7.092 1.00 0.00 C ATOM 1164 C ARG A 80 7.109 -3.371 6.161 1.00 0.00 C ATOM 1165 O ARG A 80 6.605 -4.400 6.609 1.00 0.00 O ATOM 1166 CB ARG A 80 9.136 -2.814 7.518 1.00 0.00 C ATOM 1167 CG ARG A 80 10.198 -2.620 6.449 1.00 0.00 C ATOM 1168 CD ARG A 80 11.406 -3.510 6.697 1.00 0.00 C ATOM 1169 NE ARG A 80 12.600 -3.016 6.016 1.00 0.00 N ATOM 1170 CZ ARG A 80 13.384 -2.062 6.506 1.00 0.00 C ATOM 1171 NH1 ARG A 80 13.102 -1.504 7.675 1.00 0.00 N ATOM 1172 NH2 ARG A 80 14.453 -1.666 5.827 1.00 0.00 N ATOM 0 H ARG A 80 6.669 -2.959 8.783 1.00 0.00 H new ATOM 0 HA ARG A 80 7.837 -1.399 6.554 1.00 0.00 H new ATOM 0 HB2 ARG A 80 9.434 -2.274 8.417 1.00 0.00 H new ATOM 0 HB3 ARG A 80 9.087 -3.870 7.782 1.00 0.00 H new ATOM 0 HG2 ARG A 80 9.775 -2.843 5.469 1.00 0.00 H new ATOM 0 HG3 ARG A 80 10.511 -1.576 6.431 1.00 0.00 H new ATOM 0 HD2 ARG A 80 11.598 -3.569 7.768 1.00 0.00 H new ATOM 0 HD3 ARG A 80 11.187 -4.522 6.356 1.00 0.00 H new ATOM 0 HE ARG A 80 12.845 -3.426 5.115 1.00 0.00 H new ATOM 0 HH11 ARG A 80 12.282 -1.807 8.200 1.00 0.00 H new ATOM 0 HH12 ARG A 80 13.705 -0.772 8.049 1.00 0.00 H new ATOM 0 HH21 ARG A 80 14.674 -2.094 4.928 1.00 0.00 H new ATOM 0 HH22 ARG A 80 15.054 -0.933 6.204 1.00 0.00 H new ATOM 1186 N ALA A 81 7.138 -3.084 4.864 1.00 0.00 N ATOM 1187 CA ALA A 81 6.567 -3.985 3.870 1.00 0.00 C ATOM 1188 C ALA A 81 7.529 -4.200 2.707 1.00 0.00 C ATOM 1189 O ALA A 81 8.349 -3.335 2.400 1.00 0.00 O ATOM 1190 CB ALA A 81 5.238 -3.440 3.366 1.00 0.00 C ATOM 0 H ALA A 81 7.551 -2.235 4.477 1.00 0.00 H new ATOM 0 HA ALA A 81 6.394 -4.950 4.346 1.00 0.00 H new ATOM 0 HB1 ALA A 81 4.823 -4.122 2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.544 -3.345 4.201 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.395 -2.462 2.911 1.00 0.00 H new ATOM 1196 N ARG A 82 7.423 -5.358 2.063 1.00 0.00 N ATOM 1197 CA ARG A 82 8.285 -5.686 0.934 1.00 0.00 C ATOM 1198 C ARG A 82 7.494 -6.381 -0.170 1.00 0.00 C ATOM 1199 O ARG A 82 6.579 -7.158 0.103 1.00 0.00 O ATOM 1200 CB ARG A 82 9.438 -6.582 1.390 1.00 0.00 C ATOM 1201 CG ARG A 82 10.259 -7.148 0.243 1.00 0.00 C ATOM 1202 CD ARG A 82 9.625 -8.408 -0.326 1.00 0.00 C ATOM 1203 NE ARG A 82 10.623 -9.325 -0.871 1.00 0.00 N ATOM 1204 CZ ARG A 82 10.377 -10.601 -1.144 1.00 0.00 C ATOM 1205 NH1 ARG A 82 9.173 -11.109 -0.923 1.00 0.00 N ATOM 1206 NH2 ARG A 82 11.338 -11.372 -1.638 1.00 0.00 N ATOM 0 H ARG A 82 6.749 -6.084 2.304 1.00 0.00 H new ATOM 0 HA ARG A 82 8.691 -4.756 0.536 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.093 -6.010 2.047 1.00 0.00 H new ATOM 0 HB3 ARG A 82 9.036 -7.406 1.979 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.352 -6.399 -0.543 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.267 -7.372 0.591 1.00 0.00 H new ATOM 0 HD2 ARG A 82 9.057 -8.913 0.456 1.00 0.00 H new ATOM 0 HD3 ARG A 82 8.917 -8.136 -1.109 1.00 0.00 H new ATOM 0 HE ARG A 82 11.560 -8.965 -1.052 1.00 0.00 H new ATOM 0 HH11 ARG A 82 8.433 -10.519 -0.542 1.00 0.00 H new ATOM 0 HH12 ARG A 82 8.987 -12.089 -1.134 1.00 0.00 H new ATOM 0 HH21 ARG A 82 12.266 -10.984 -1.808 1.00 0.00 H new ATOM 0 HH22 ARG A 82 11.148 -12.352 -1.847 1.00 0.00 H new ATOM 1220 N ILE A 83 7.852 -6.094 -1.417 1.00 0.00 N ATOM 1221 CA ILE A 83 7.176 -6.692 -2.562 1.00 0.00 C ATOM 1222 C ILE A 83 8.181 -7.255 -3.561 1.00 0.00 C ATOM 1223 O ILE A 83 9.182 -6.614 -3.879 1.00 0.00 O ATOM 1224 CB ILE A 83 6.274 -5.670 -3.279 1.00 0.00 C ATOM 1225 CG1 ILE A 83 5.748 -4.634 -2.283 1.00 0.00 C ATOM 1226 CG2 ILE A 83 5.120 -6.378 -3.974 1.00 0.00 C ATOM 1227 CD1 ILE A 83 5.068 -3.454 -2.942 1.00 0.00 C ATOM 0 H ILE A 83 8.606 -5.451 -1.660 1.00 0.00 H new ATOM 0 HA ILE A 83 6.558 -7.503 -2.176 1.00 0.00 H new ATOM 0 HB ILE A 83 6.865 -5.153 -4.034 1.00 0.00 H new ATOM 0 HG12 ILE A 83 5.044 -5.117 -1.606 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.577 -4.272 -1.675 1.00 0.00 H new ATOM 0 HG21 ILE A 83 4.491 -5.643 -4.476 1.00 0.00 H new ATOM 0 HG22 ILE A 83 5.514 -7.081 -4.708 1.00 0.00 H new ATOM 0 HG23 ILE A 83 4.527 -6.918 -3.236 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.720 -2.760 -2.176 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.775 -2.946 -3.598 1.00 0.00 H new ATOM 0 HD13 ILE A 83 4.218 -3.804 -3.527 1.00 0.00 H new ATOM 1239 N SER A 84 7.905 -8.458 -4.054 1.00 0.00 N ATOM 1240 CA SER A 84 8.786 -9.110 -5.017 1.00 0.00 C ATOM 1241 C SER A 84 8.547 -8.571 -6.424 1.00 0.00 C ATOM 1242 O SER A 84 7.540 -8.884 -7.058 1.00 0.00 O ATOM 1243 CB SER A 84 8.569 -10.624 -4.995 1.00 0.00 C ATOM 1244 OG SER A 84 9.360 -11.267 -5.980 1.00 0.00 O ATOM 0 H SER A 84 7.079 -9.001 -3.803 1.00 0.00 H new ATOM 0 HA SER A 84 9.816 -8.894 -4.734 1.00 0.00 H new ATOM 0 HB2 SER A 84 8.820 -11.016 -4.009 1.00 0.00 H new ATOM 0 HB3 SER A 84 7.516 -10.846 -5.168 1.00 0.00 H new ATOM 0 HG SER A 84 9.204 -12.234 -5.944 1.00 0.00 H new ATOM 1250 N VAL A 85 9.481 -7.758 -6.906 1.00 0.00 N ATOM 1251 CA VAL A 85 9.374 -7.175 -8.238 1.00 0.00 C ATOM 1252 C VAL A 85 8.752 -8.160 -9.221 1.00 0.00 C ATOM 1253 O VAL A 85 9.349 -9.186 -9.547 1.00 0.00 O ATOM 1254 CB VAL A 85 10.751 -6.735 -8.771 1.00 0.00 C ATOM 1255 CG1 VAL A 85 10.623 -6.164 -10.175 1.00 0.00 C ATOM 1256 CG2 VAL A 85 11.387 -5.723 -7.831 1.00 0.00 C ATOM 0 H VAL A 85 10.321 -7.488 -6.394 1.00 0.00 H new ATOM 0 HA VAL A 85 8.731 -6.300 -8.149 1.00 0.00 H new ATOM 0 HB VAL A 85 11.399 -7.610 -8.819 1.00 0.00 H new ATOM 0 HG11 VAL A 85 11.606 -5.859 -10.535 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.213 -6.923 -10.841 1.00 0.00 H new ATOM 0 HG13 VAL A 85 9.959 -5.300 -10.157 1.00 0.00 H new ATOM 0 HG21 VAL A 85 12.359 -5.423 -8.223 1.00 0.00 H new ATOM 0 HG22 VAL A 85 10.743 -4.847 -7.749 1.00 0.00 H new ATOM 0 HG23 VAL A 85 11.516 -6.172 -6.846 1.00 0.00 H new ATOM 1266 N GLN A 86 7.550 -7.842 -9.689 1.00 0.00 N ATOM 1267 CA GLN A 86 6.846 -8.700 -10.635 1.00 0.00 C ATOM 1268 C GLN A 86 7.202 -8.333 -12.072 1.00 0.00 C ATOM 1269 O GLN A 86 7.335 -9.204 -12.931 1.00 0.00 O ATOM 1270 CB GLN A 86 5.335 -8.592 -10.428 1.00 0.00 C ATOM 1271 CG GLN A 86 4.899 -8.825 -8.990 1.00 0.00 C ATOM 1272 CD GLN A 86 4.842 -10.296 -8.628 1.00 0.00 C ATOM 1273 OE1 GLN A 86 4.924 -11.165 -9.498 1.00 0.00 O ATOM 1274 NE2 GLN A 86 4.701 -10.585 -7.340 1.00 0.00 N ATOM 0 H GLN A 86 7.043 -6.996 -9.429 1.00 0.00 H new ATOM 0 HA GLN A 86 7.157 -9.729 -10.454 1.00 0.00 H new ATOM 0 HB2 GLN A 86 5.003 -7.603 -10.744 1.00 0.00 H new ATOM 0 HB3 GLN A 86 4.836 -9.316 -11.072 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.590 -8.316 -8.318 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.917 -8.378 -8.835 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.637 -9.834 -6.653 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.657 -11.558 -7.038 1.00 0.00 H new ATOM 1283 N VAL A 87 7.355 -7.037 -12.326 1.00 0.00 N ATOM 1284 CA VAL A 87 7.696 -6.554 -13.658 1.00 0.00 C ATOM 1285 C VAL A 87 8.884 -5.600 -13.610 1.00 0.00 C ATOM 1286 O VAL A 87 9.042 -4.836 -12.657 1.00 0.00 O ATOM 1287 CB VAL A 87 6.503 -5.838 -14.318 1.00 0.00 C ATOM 1288 CG1 VAL A 87 6.969 -5.003 -15.501 1.00 0.00 C ATOM 1289 CG2 VAL A 87 5.449 -6.847 -14.749 1.00 0.00 C ATOM 0 H VAL A 87 7.248 -6.303 -11.626 1.00 0.00 H new ATOM 0 HA VAL A 87 7.960 -7.428 -14.253 1.00 0.00 H new ATOM 0 HB VAL A 87 6.053 -5.167 -13.586 1.00 0.00 H new ATOM 0 HG11 VAL A 87 6.112 -4.505 -15.955 1.00 0.00 H new ATOM 0 HG12 VAL A 87 7.685 -4.255 -15.159 1.00 0.00 H new ATOM 0 HG13 VAL A 87 7.444 -5.650 -16.238 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.613 -6.324 -15.213 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.884 -7.544 -15.465 1.00 0.00 H new ATOM 0 HG23 VAL A 87 5.094 -7.397 -13.877 1.00 0.00 H new ATOM 1299 N HIS A 88 9.717 -5.648 -14.644 1.00 0.00 N ATOM 1300 CA HIS A 88 10.892 -4.786 -14.721 1.00 0.00 C ATOM 1301 C HIS A 88 10.776 -3.812 -15.889 1.00 0.00 C ATOM 1302 O HIS A 88 10.083 -4.083 -16.869 1.00 0.00 O ATOM 1303 CB HIS A 88 12.159 -5.628 -14.867 1.00 0.00 C ATOM 1304 CG HIS A 88 12.602 -6.272 -13.590 1.00 0.00 C ATOM 1305 ND1 HIS A 88 12.330 -7.587 -13.276 1.00 0.00 N ATOM 1306 CD2 HIS A 88 13.303 -5.775 -12.544 1.00 0.00 C ATOM 1307 CE1 HIS A 88 12.843 -7.870 -12.092 1.00 0.00 C ATOM 1308 NE2 HIS A 88 13.440 -6.788 -11.627 1.00 0.00 N ATOM 0 H HIS A 88 9.601 -6.274 -15.441 1.00 0.00 H new ATOM 0 HA HIS A 88 10.952 -4.211 -13.797 1.00 0.00 H new ATOM 0 HB2 HIS A 88 11.986 -6.403 -15.614 1.00 0.00 H new ATOM 0 HB3 HIS A 88 12.963 -4.996 -15.244 1.00 0.00 H new ATOM 0 HD2 HIS A 88 13.684 -4.769 -12.448 1.00 0.00 H new ATOM 0 HE1 HIS A 88 12.784 -8.824 -11.590 1.00 0.00 H new ATOM 0 HE2 HIS A 88 13.924 -6.716 -10.732 1.00 0.00 H new ATOM 1317 N ASN A 89 11.458 -2.677 -15.777 1.00 0.00 N ATOM 1318 CA ASN A 89 11.430 -1.662 -16.823 1.00 0.00 C ATOM 1319 C ASN A 89 10.031 -1.069 -16.969 1.00 0.00 C ATOM 1320 O ASN A 89 9.605 -0.722 -18.070 1.00 0.00 O ATOM 1321 CB ASN A 89 11.883 -2.261 -18.156 1.00 0.00 C ATOM 1322 CG ASN A 89 12.382 -1.206 -19.124 1.00 0.00 C ATOM 1323 OD1 ASN A 89 11.951 -0.054 -19.081 1.00 0.00 O ATOM 1324 ND2 ASN A 89 13.297 -1.596 -20.005 1.00 0.00 N ATOM 0 H ASN A 89 12.037 -2.437 -14.972 1.00 0.00 H new ATOM 0 HA ASN A 89 12.116 -0.864 -16.538 1.00 0.00 H new ATOM 0 HB2 ASN A 89 12.675 -2.987 -17.974 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.052 -2.802 -18.609 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.670 -0.930 -20.681 1.00 0.00 H new ATOM 0 HD22 ASN A 89 13.626 -2.561 -20.005 1.00 0.00 H new ATOM 1331 N ALA A 90 9.323 -0.955 -15.850 1.00 0.00 N ATOM 1332 CA ALA A 90 7.975 -0.401 -15.852 1.00 0.00 C ATOM 1333 C ALA A 90 7.815 0.659 -14.769 1.00 0.00 C ATOM 1334 O ALA A 90 8.708 0.861 -13.945 1.00 0.00 O ATOM 1335 CB ALA A 90 6.950 -1.510 -15.664 1.00 0.00 C ATOM 0 H ALA A 90 9.661 -1.239 -14.930 1.00 0.00 H new ATOM 0 HA ALA A 90 7.806 0.076 -16.817 1.00 0.00 H new ATOM 0 HB1 ALA A 90 5.947 -1.083 -15.667 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.040 -2.231 -16.477 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.127 -2.012 -14.713 1.00 0.00 H new ATOM 1341 N THR A 91 6.671 1.336 -14.774 1.00 0.00 N ATOM 1342 CA THR A 91 6.394 2.378 -13.792 1.00 0.00 C ATOM 1343 C THR A 91 5.438 1.879 -12.716 1.00 0.00 C ATOM 1344 O THR A 91 4.269 1.602 -12.990 1.00 0.00 O ATOM 1345 CB THR A 91 5.793 3.630 -14.457 1.00 0.00 C ATOM 1346 OG1 THR A 91 4.821 3.247 -15.436 1.00 0.00 O ATOM 1347 CG2 THR A 91 6.879 4.469 -15.114 1.00 0.00 C ATOM 0 H THR A 91 5.921 1.181 -15.447 1.00 0.00 H new ATOM 0 HA THR A 91 7.347 2.642 -13.333 1.00 0.00 H new ATOM 0 HB THR A 91 5.312 4.229 -13.684 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.329 2.461 -15.119 1.00 0.00 H new ATOM 0 HG21 THR A 91 6.430 5.348 -15.577 1.00 0.00 H new ATOM 0 HG22 THR A 91 7.601 4.785 -14.361 1.00 0.00 H new ATOM 0 HG23 THR A 91 7.386 3.877 -15.876 1.00 0.00 H new ATOM 1355 N CYS A 92 5.939 1.767 -11.491 1.00 0.00 N ATOM 1356 CA CYS A 92 5.128 1.301 -10.372 1.00 0.00 C ATOM 1357 C CYS A 92 4.765 2.456 -9.445 1.00 0.00 C ATOM 1358 O CYS A 92 5.590 3.327 -9.167 1.00 0.00 O ATOM 1359 CB CYS A 92 5.874 0.219 -9.590 1.00 0.00 C ATOM 1360 SG CYS A 92 4.921 -0.501 -8.232 1.00 0.00 S ATOM 0 H CYS A 92 6.903 1.993 -11.247 1.00 0.00 H new ATOM 0 HA CYS A 92 4.207 0.879 -10.774 1.00 0.00 H new ATOM 0 HB2 CYS A 92 6.164 -0.576 -10.277 1.00 0.00 H new ATOM 0 HB3 CYS A 92 6.794 0.645 -9.188 1.00 0.00 H new ATOM 0 HG CYS A 92 3.686 -0.659 -8.605 1.00 0.00 H new ATOM 1366 N THR A 93 3.523 2.459 -8.970 1.00 0.00 N ATOM 1367 CA THR A 93 3.049 3.509 -8.077 1.00 0.00 C ATOM 1368 C THR A 93 2.697 2.946 -6.705 1.00 0.00 C ATOM 1369 O THR A 93 1.800 2.112 -6.576 1.00 0.00 O ATOM 1370 CB THR A 93 1.815 4.225 -8.658 1.00 0.00 C ATOM 1371 OG1 THR A 93 1.978 4.418 -10.067 1.00 0.00 O ATOM 1372 CG2 THR A 93 1.601 5.570 -7.979 1.00 0.00 C ATOM 0 H THR A 93 2.827 1.746 -9.189 1.00 0.00 H new ATOM 0 HA THR A 93 3.862 4.228 -7.974 1.00 0.00 H new ATOM 0 HB THR A 93 0.941 3.600 -8.476 1.00 0.00 H new ATOM 0 HG1 THR A 93 1.188 4.872 -10.428 1.00 0.00 H new ATOM 0 HG21 THR A 93 0.724 6.057 -8.405 1.00 0.00 H new ATOM 0 HG22 THR A 93 1.448 5.418 -6.911 1.00 0.00 H new ATOM 0 HG23 THR A 93 2.477 6.199 -8.134 1.00 0.00 H new ATOM 1380 N VAL A 94 3.407 3.408 -5.681 1.00 0.00 N ATOM 1381 CA VAL A 94 3.168 2.951 -4.317 1.00 0.00 C ATOM 1382 C VAL A 94 2.216 3.889 -3.583 1.00 0.00 C ATOM 1383 O VAL A 94 2.275 5.107 -3.752 1.00 0.00 O ATOM 1384 CB VAL A 94 4.483 2.846 -3.522 1.00 0.00 C ATOM 1385 CG1 VAL A 94 4.244 2.165 -2.183 1.00 0.00 C ATOM 1386 CG2 VAL A 94 5.535 2.101 -4.329 1.00 0.00 C ATOM 0 H VAL A 94 4.152 4.098 -5.770 1.00 0.00 H new ATOM 0 HA VAL A 94 2.716 1.962 -4.388 1.00 0.00 H new ATOM 0 HB VAL A 94 4.853 3.853 -3.329 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.184 2.100 -1.635 1.00 0.00 H new ATOM 0 HG12 VAL A 94 3.526 2.745 -1.603 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.851 1.162 -2.350 1.00 0.00 H new ATOM 0 HG21 VAL A 94 6.458 2.036 -3.752 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.177 1.097 -4.555 1.00 0.00 H new ATOM 0 HG23 VAL A 94 5.726 2.636 -5.260 1.00 0.00 H new ATOM 1396 N ARG A 95 1.340 3.313 -2.766 1.00 0.00 N ATOM 1397 CA ARG A 95 0.374 4.097 -2.006 1.00 0.00 C ATOM 1398 C ARG A 95 -0.028 3.371 -0.726 1.00 0.00 C ATOM 1399 O ARG A 95 -0.507 2.237 -0.768 1.00 0.00 O ATOM 1400 CB ARG A 95 -0.866 4.380 -2.855 1.00 0.00 C ATOM 1401 CG ARG A 95 -0.569 5.157 -4.128 1.00 0.00 C ATOM 1402 CD ARG A 95 -1.846 5.552 -4.851 1.00 0.00 C ATOM 1403 NE ARG A 95 -2.560 6.621 -4.157 1.00 0.00 N ATOM 1404 CZ ARG A 95 -3.627 7.236 -4.655 1.00 0.00 C ATOM 1405 NH1 ARG A 95 -4.101 6.890 -5.843 1.00 0.00 N ATOM 1406 NH2 ARG A 95 -4.221 8.200 -3.963 1.00 0.00 N ATOM 0 H ARG A 95 1.279 2.306 -2.614 1.00 0.00 H new ATOM 0 HA ARG A 95 0.844 5.042 -1.735 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.339 3.434 -3.119 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.585 4.940 -2.257 1.00 0.00 H new ATOM 0 HG2 ARG A 95 0.004 6.052 -3.884 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.052 4.552 -4.788 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.604 5.876 -5.863 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -2.496 4.681 -4.941 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.221 6.911 -3.240 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.646 6.150 -6.378 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -4.920 7.364 -6.223 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -3.858 8.469 -3.048 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -5.040 8.672 -4.346 1.00 0.00 H new ATOM 1420 N ILE A 96 0.170 4.031 0.410 1.00 0.00 N ATOM 1421 CA ILE A 96 -0.173 3.449 1.701 1.00 0.00 C ATOM 1422 C ILE A 96 -1.232 4.281 2.416 1.00 0.00 C ATOM 1423 O ILE A 96 -1.264 5.505 2.289 1.00 0.00 O ATOM 1424 CB ILE A 96 1.065 3.325 2.609 1.00 0.00 C ATOM 1425 CG1 ILE A 96 2.268 2.830 1.803 1.00 0.00 C ATOM 1426 CG2 ILE A 96 0.778 2.386 3.772 1.00 0.00 C ATOM 1427 CD1 ILE A 96 3.540 2.729 2.616 1.00 0.00 C ATOM 0 H ILE A 96 0.566 4.969 0.462 1.00 0.00 H new ATOM 0 HA ILE A 96 -0.570 2.453 1.502 1.00 0.00 H new ATOM 0 HB ILE A 96 1.301 4.310 3.012 1.00 0.00 H new ATOM 0 HG12 ILE A 96 2.036 1.851 1.383 1.00 0.00 H new ATOM 0 HG13 ILE A 96 2.435 3.505 0.964 1.00 0.00 H new ATOM 0 HG21 ILE A 96 1.663 2.309 4.404 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -0.054 2.776 4.358 1.00 0.00 H new ATOM 0 HG23 ILE A 96 0.520 1.399 3.388 1.00 0.00 H new ATOM 0 HD11 ILE A 96 4.351 2.372 1.981 1.00 0.00 H new ATOM 0 HD12 ILE A 96 3.796 3.711 3.014 1.00 0.00 H new ATOM 0 HD13 ILE A 96 3.391 2.031 3.440 1.00 0.00 H new ATOM 1439 N ALA A 97 -2.097 3.608 3.169 1.00 0.00 N ATOM 1440 CA ALA A 97 -3.155 4.286 3.907 1.00 0.00 C ATOM 1441 C ALA A 97 -3.364 3.648 5.277 1.00 0.00 C ATOM 1442 O ALA A 97 -2.835 2.573 5.558 1.00 0.00 O ATOM 1443 CB ALA A 97 -4.451 4.266 3.110 1.00 0.00 C ATOM 0 H ALA A 97 -2.085 2.595 3.283 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.852 5.322 4.060 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.232 4.776 3.673 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -4.300 4.774 2.157 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.750 3.234 2.927 1.00 0.00 H new ATOM 1449 N ALA A 98 -4.138 4.317 6.124 1.00 0.00 N ATOM 1450 CA ALA A 98 -4.418 3.815 7.464 1.00 0.00 C ATOM 1451 C ALA A 98 -5.658 2.927 7.469 1.00 0.00 C ATOM 1452 O ALA A 98 -6.648 3.222 6.800 1.00 0.00 O ATOM 1453 CB ALA A 98 -4.591 4.972 8.436 1.00 0.00 C ATOM 0 H ALA A 98 -4.583 5.209 5.906 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.569 3.211 7.784 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -4.800 4.582 9.432 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -3.677 5.565 8.462 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.421 5.599 8.111 1.00 0.00 H new ATOM 1459 N VAL A 99 -5.596 1.837 8.227 1.00 0.00 N ATOM 1460 CA VAL A 99 -6.714 0.906 8.320 1.00 0.00 C ATOM 1461 C VAL A 99 -7.208 0.781 9.756 1.00 0.00 C ATOM 1462 O VAL A 99 -6.428 0.519 10.673 1.00 0.00 O ATOM 1463 CB VAL A 99 -6.326 -0.491 7.798 1.00 0.00 C ATOM 1464 CG1 VAL A 99 -7.417 -1.502 8.117 1.00 0.00 C ATOM 1465 CG2 VAL A 99 -6.051 -0.444 6.303 1.00 0.00 C ATOM 0 H VAL A 99 -4.783 1.577 8.786 1.00 0.00 H new ATOM 0 HA VAL A 99 -7.514 1.309 7.698 1.00 0.00 H new ATOM 0 HB VAL A 99 -5.413 -0.807 8.302 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -7.126 -2.483 7.741 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -7.560 -1.555 9.196 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -8.349 -1.194 7.643 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.778 -1.439 5.952 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.945 -0.106 5.779 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.232 0.247 6.105 1.00 0.00 H new ATOM 1475 N THR A 100 -8.510 0.969 9.948 1.00 0.00 N ATOM 1476 CA THR A 100 -9.109 0.878 11.273 1.00 0.00 C ATOM 1477 C THR A 100 -10.298 -0.076 11.275 1.00 0.00 C ATOM 1478 O THR A 100 -10.652 -0.643 10.241 1.00 0.00 O ATOM 1479 CB THR A 100 -9.572 2.259 11.776 1.00 0.00 C ATOM 1480 OG1 THR A 100 -10.681 2.717 10.996 1.00 0.00 O ATOM 1481 CG2 THR A 100 -8.439 3.270 11.700 1.00 0.00 C ATOM 0 H THR A 100 -9.170 1.185 9.201 1.00 0.00 H new ATOM 0 HA THR A 100 -8.339 0.495 11.942 1.00 0.00 H new ATOM 0 HB THR A 100 -9.878 2.159 12.817 1.00 0.00 H new ATOM 0 HG1 THR A 100 -11.257 3.286 11.549 1.00 0.00 H new ATOM 0 HG21 THR A 100 -8.790 4.237 12.060 1.00 0.00 H new ATOM 0 HG22 THR A 100 -7.608 2.932 12.319 1.00 0.00 H new ATOM 0 HG23 THR A 100 -8.106 3.367 10.667 1.00 0.00 H new ATOM 1489 N ARG A 101 -10.911 -0.248 12.442 1.00 0.00 N ATOM 1490 CA ARG A 101 -12.060 -1.134 12.577 1.00 0.00 C ATOM 1491 C ARG A 101 -13.349 -0.417 12.185 1.00 0.00 C ATOM 1492 O ARG A 101 -14.447 -0.890 12.474 1.00 0.00 O ATOM 1493 CB ARG A 101 -12.167 -1.649 14.014 1.00 0.00 C ATOM 1494 CG ARG A 101 -11.310 -2.874 14.287 1.00 0.00 C ATOM 1495 CD ARG A 101 -11.334 -3.253 15.760 1.00 0.00 C ATOM 1496 NE ARG A 101 -12.545 -3.989 16.116 1.00 0.00 N ATOM 1497 CZ ARG A 101 -13.694 -3.403 16.435 1.00 0.00 C ATOM 1498 NH1 ARG A 101 -13.788 -2.080 16.441 1.00 0.00 N ATOM 1499 NH2 ARG A 101 -14.752 -4.140 16.747 1.00 0.00 N ATOM 0 H ARG A 101 -10.631 0.215 13.307 1.00 0.00 H new ATOM 0 HA ARG A 101 -11.916 -1.980 11.904 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -11.876 -0.853 14.699 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -13.208 -1.889 14.228 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -11.669 -3.711 13.689 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -10.284 -2.678 13.977 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -10.459 -3.860 15.992 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -11.266 -2.351 16.368 1.00 0.00 H new ATOM 0 HE ARG A 101 -12.506 -5.008 16.120 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -12.977 -1.510 16.200 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -14.671 -1.633 16.686 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -14.684 -5.158 16.742 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -15.634 -3.689 16.992 1.00 0.00 H new ATOM 1513 N GLY A 102 -13.206 0.728 11.526 1.00 0.00 N ATOM 1514 CA GLY A 102 -14.366 1.492 11.105 1.00 0.00 C ATOM 1515 C GLY A 102 -14.434 1.662 9.601 1.00 0.00 C ATOM 1516 O GLY A 102 -15.518 1.760 9.029 1.00 0.00 O ATOM 0 H GLY A 102 -12.307 1.141 11.276 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -15.271 0.994 11.452 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.341 2.474 11.578 1.00 0.00 H new ATOM 1520 N GLY A 103 -13.271 1.700 8.957 1.00 0.00 N ATOM 1521 CA GLY A 103 -13.225 1.862 7.516 1.00 0.00 C ATOM 1522 C GLY A 103 -11.838 2.211 7.015 1.00 0.00 C ATOM 1523 O GLY A 103 -10.980 2.637 7.788 1.00 0.00 O ATOM 0 H GLY A 103 -12.360 1.621 9.408 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.559 0.940 7.039 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -13.923 2.645 7.219 1.00 0.00 H new ATOM 1527 N VAL A 104 -11.615 2.028 5.718 1.00 0.00 N ATOM 1528 CA VAL A 104 -10.322 2.325 5.114 1.00 0.00 C ATOM 1529 C VAL A 104 -10.226 3.794 4.716 1.00 0.00 C ATOM 1530 O VAL A 104 -11.090 4.315 4.013 1.00 0.00 O ATOM 1531 CB VAL A 104 -10.067 1.451 3.872 1.00 0.00 C ATOM 1532 CG1 VAL A 104 -11.092 1.749 2.789 1.00 0.00 C ATOM 1533 CG2 VAL A 104 -8.653 1.663 3.353 1.00 0.00 C ATOM 0 H VAL A 104 -12.314 1.675 5.064 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.564 2.104 5.866 1.00 0.00 H new ATOM 0 HB VAL A 104 -10.171 0.404 4.158 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.895 1.122 1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -12.093 1.541 3.168 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -11.024 2.798 2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.490 1.038 2.475 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.518 2.710 3.083 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.936 1.393 4.129 1.00 0.00 H new ATOM 1543 N GLY A 105 -9.167 4.457 5.172 1.00 0.00 N ATOM 1544 CA GLY A 105 -8.977 5.860 4.853 1.00 0.00 C ATOM 1545 C GLY A 105 -8.299 6.063 3.512 1.00 0.00 C ATOM 1546 O GLY A 105 -7.920 5.109 2.834 1.00 0.00 O ATOM 0 H GLY A 105 -8.438 4.048 5.756 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -9.944 6.362 4.847 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -8.379 6.329 5.634 1.00 0.00 H new ATOM 1550 N PRO A 106 -8.140 7.333 3.112 1.00 0.00 N ATOM 1551 CA PRO A 106 -7.504 7.688 1.840 1.00 0.00 C ATOM 1552 C PRO A 106 -6.008 7.398 1.839 1.00 0.00 C ATOM 1553 O PRO A 106 -5.328 7.586 2.848 1.00 0.00 O ATOM 1554 CB PRO A 106 -7.757 9.194 1.725 1.00 0.00 C ATOM 1555 CG PRO A 106 -7.921 9.659 3.131 1.00 0.00 C ATOM 1556 CD PRO A 106 -8.569 8.521 3.870 1.00 0.00 C ATOM 0 HA PRO A 106 -7.906 7.109 1.008 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.924 9.699 1.236 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -8.648 9.402 1.133 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.958 9.913 3.573 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -8.539 10.556 3.176 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -8.239 8.476 4.908 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -9.655 8.618 3.885 1.00 0.00 H new ATOM 1564 N PHE A 107 -5.499 6.938 0.700 1.00 0.00 N ATOM 1565 CA PHE A 107 -4.082 6.621 0.569 1.00 0.00 C ATOM 1566 C PHE A 107 -3.246 7.894 0.480 1.00 0.00 C ATOM 1567 O PHE A 107 -3.746 8.954 0.102 1.00 0.00 O ATOM 1568 CB PHE A 107 -3.844 5.754 -0.669 1.00 0.00 C ATOM 1569 CG PHE A 107 -4.320 4.338 -0.510 1.00 0.00 C ATOM 1570 CD1 PHE A 107 -5.645 4.068 -0.210 1.00 0.00 C ATOM 1571 CD2 PHE A 107 -3.442 3.277 -0.661 1.00 0.00 C ATOM 1572 CE1 PHE A 107 -6.085 2.767 -0.062 1.00 0.00 C ATOM 1573 CE2 PHE A 107 -3.876 1.973 -0.515 1.00 0.00 C ATOM 1574 CZ PHE A 107 -5.200 1.718 -0.216 1.00 0.00 C ATOM 0 H PHE A 107 -6.047 6.777 -0.145 1.00 0.00 H new ATOM 0 HA PHE A 107 -3.776 6.067 1.456 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.351 6.206 -1.522 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -2.778 5.747 -0.898 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -6.342 4.884 -0.090 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -2.406 3.471 -0.896 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -7.120 2.570 0.174 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -3.181 1.155 -0.635 1.00 0.00 H new ATOM 0 HZ PHE A 107 -5.543 0.700 -0.103 1.00 0.00 H new ATOM 1584 N SER A 108 -1.969 7.782 0.832 1.00 0.00 N ATOM 1585 CA SER A 108 -1.063 8.924 0.796 1.00 0.00 C ATOM 1586 C SER A 108 -0.723 9.304 -0.642 1.00 0.00 C ATOM 1587 O SER A 108 -1.233 8.707 -1.590 1.00 0.00 O ATOM 1588 CB SER A 108 0.219 8.609 1.570 1.00 0.00 C ATOM 1589 OG SER A 108 0.805 7.402 1.115 1.00 0.00 O ATOM 0 H SER A 108 -1.539 6.912 1.145 1.00 0.00 H new ATOM 0 HA SER A 108 -1.565 9.769 1.267 1.00 0.00 H new ATOM 0 HB2 SER A 108 0.929 9.428 1.453 1.00 0.00 H new ATOM 0 HB3 SER A 108 -0.005 8.530 2.634 1.00 0.00 H new ATOM 0 HG SER A 108 0.345 6.640 1.525 1.00 0.00 H new ATOM 1595 N ASP A 109 0.143 10.300 -0.795 1.00 0.00 N ATOM 1596 CA ASP A 109 0.553 10.759 -2.117 1.00 0.00 C ATOM 1597 C ASP A 109 1.191 9.625 -2.913 1.00 0.00 C ATOM 1598 O ASP A 109 2.019 8.868 -2.406 1.00 0.00 O ATOM 1599 CB ASP A 109 1.534 11.927 -1.993 1.00 0.00 C ATOM 1600 CG ASP A 109 2.514 11.740 -0.851 1.00 0.00 C ATOM 1601 OD1 ASP A 109 2.182 12.136 0.286 1.00 0.00 O ATOM 1602 OD2 ASP A 109 3.613 11.200 -1.095 1.00 0.00 O ATOM 0 H ASP A 109 0.574 10.805 -0.021 1.00 0.00 H new ATOM 0 HA ASP A 109 -0.336 11.096 -2.649 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.085 12.036 -2.927 1.00 0.00 H new ATOM 0 HB3 ASP A 109 0.977 12.852 -1.842 1.00 0.00 H new ATOM 1607 N PRO A 110 0.798 9.503 -4.189 1.00 0.00 N ATOM 1608 CA PRO A 110 1.319 8.464 -5.082 1.00 0.00 C ATOM 1609 C PRO A 110 2.780 8.696 -5.452 1.00 0.00 C ATOM 1610 O PRO A 110 3.188 9.823 -5.733 1.00 0.00 O ATOM 1611 CB PRO A 110 0.428 8.583 -6.322 1.00 0.00 C ATOM 1612 CG PRO A 110 -0.054 9.992 -6.309 1.00 0.00 C ATOM 1613 CD PRO A 110 -0.185 10.372 -4.859 1.00 0.00 C ATOM 0 HA PRO A 110 1.297 7.478 -4.617 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.986 8.364 -7.233 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.404 7.880 -6.281 1.00 0.00 H new ATOM 0 HG2 PRO A 110 0.648 10.649 -6.823 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -1.010 10.082 -6.824 1.00 0.00 H new ATOM 0 HD2 PRO A 110 0.036 11.427 -4.698 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.195 10.198 -4.487 1.00 0.00 H new ATOM 1621 N VAL A 111 3.564 7.622 -5.450 1.00 0.00 N ATOM 1622 CA VAL A 111 4.980 7.709 -5.787 1.00 0.00 C ATOM 1623 C VAL A 111 5.313 6.832 -6.989 1.00 0.00 C ATOM 1624 O VAL A 111 5.208 5.607 -6.926 1.00 0.00 O ATOM 1625 CB VAL A 111 5.866 7.291 -4.599 1.00 0.00 C ATOM 1626 CG1 VAL A 111 5.922 5.776 -4.481 1.00 0.00 C ATOM 1627 CG2 VAL A 111 7.263 7.875 -4.746 1.00 0.00 C ATOM 0 H VAL A 111 3.242 6.682 -5.219 1.00 0.00 H new ATOM 0 HA VAL A 111 5.184 8.751 -6.033 1.00 0.00 H new ATOM 0 HB VAL A 111 5.426 7.686 -3.683 1.00 0.00 H new ATOM 0 HG11 VAL A 111 6.553 5.500 -3.636 1.00 0.00 H new ATOM 0 HG12 VAL A 111 4.916 5.386 -4.326 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.337 5.355 -5.397 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.876 7.570 -3.898 1.00 0.00 H new ATOM 0 HG22 VAL A 111 7.714 7.511 -5.669 1.00 0.00 H new ATOM 0 HG23 VAL A 111 7.201 8.963 -4.776 1.00 0.00 H new ATOM 1637 N LYS A 112 5.717 7.467 -8.084 1.00 0.00 N ATOM 1638 CA LYS A 112 6.069 6.746 -9.301 1.00 0.00 C ATOM 1639 C LYS A 112 7.553 6.396 -9.317 1.00 0.00 C ATOM 1640 O LYS A 112 8.403 7.266 -9.508 1.00 0.00 O ATOM 1641 CB LYS A 112 5.718 7.583 -10.534 1.00 0.00 C ATOM 1642 CG LYS A 112 6.247 7.003 -11.834 1.00 0.00 C ATOM 1643 CD LYS A 112 5.996 7.937 -13.005 1.00 0.00 C ATOM 1644 CE LYS A 112 4.548 7.874 -13.468 1.00 0.00 C ATOM 1645 NZ LYS A 112 4.231 8.949 -14.448 1.00 0.00 N ATOM 0 H LYS A 112 5.809 8.480 -8.153 1.00 0.00 H new ATOM 0 HA LYS A 112 5.495 5.819 -9.323 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.634 7.677 -10.602 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.118 8.589 -10.406 1.00 0.00 H new ATOM 0 HG2 LYS A 112 7.317 6.815 -11.741 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.770 6.042 -12.025 1.00 0.00 H new ATOM 0 HD2 LYS A 112 6.243 8.959 -12.716 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.655 7.671 -13.831 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.354 6.902 -13.920 1.00 0.00 H new ATOM 0 HE3 LYS A 112 3.887 7.962 -12.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 3.235 8.871 -14.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 4.392 9.878 -14.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 4.844 8.850 -15.282 1.00 0.00 H new ATOM 1659 N ILE A 113 7.857 5.118 -9.116 1.00 0.00 N ATOM 1660 CA ILE A 113 9.239 4.654 -9.110 1.00 0.00 C ATOM 1661 C ILE A 113 9.568 3.891 -10.388 1.00 0.00 C ATOM 1662 O ILE A 113 8.829 2.994 -10.796 1.00 0.00 O ATOM 1663 CB ILE A 113 9.523 3.749 -7.896 1.00 0.00 C ATOM 1664 CG1 ILE A 113 10.886 3.071 -8.047 1.00 0.00 C ATOM 1665 CG2 ILE A 113 8.423 2.711 -7.741 1.00 0.00 C ATOM 1666 CD1 ILE A 113 11.547 2.742 -6.727 1.00 0.00 C ATOM 0 H ILE A 113 7.165 4.386 -8.955 1.00 0.00 H new ATOM 0 HA ILE A 113 9.870 5.541 -9.047 1.00 0.00 H new ATOM 0 HB ILE A 113 9.542 4.366 -6.997 1.00 0.00 H new ATOM 0 HG12 ILE A 113 10.764 2.153 -8.622 1.00 0.00 H new ATOM 0 HG13 ILE A 113 11.545 3.722 -8.622 1.00 0.00 H new ATOM 0 HG21 ILE A 113 8.638 2.079 -6.879 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.467 3.213 -7.593 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.375 2.095 -8.639 1.00 0.00 H new ATOM 0 HD11 ILE A 113 12.509 2.263 -6.911 1.00 0.00 H new ATOM 0 HD12 ILE A 113 11.701 3.659 -6.159 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.908 2.066 -6.159 1.00 0.00 H new ATOM 1678 N PHE A 114 10.683 4.250 -11.015 1.00 0.00 N ATOM 1679 CA PHE A 114 11.112 3.598 -12.247 1.00 0.00 C ATOM 1680 C PHE A 114 11.865 2.306 -11.945 1.00 0.00 C ATOM 1681 O PHE A 114 12.941 2.328 -11.347 1.00 0.00 O ATOM 1682 CB PHE A 114 11.999 4.539 -13.065 1.00 0.00 C ATOM 1683 CG PHE A 114 12.792 3.839 -14.131 1.00 0.00 C ATOM 1684 CD1 PHE A 114 13.998 3.228 -13.828 1.00 0.00 C ATOM 1685 CD2 PHE A 114 12.331 3.793 -15.437 1.00 0.00 C ATOM 1686 CE1 PHE A 114 14.730 2.583 -14.807 1.00 0.00 C ATOM 1687 CE2 PHE A 114 13.059 3.149 -16.420 1.00 0.00 C ATOM 1688 CZ PHE A 114 14.260 2.544 -16.105 1.00 0.00 C ATOM 0 H PHE A 114 11.306 4.989 -10.690 1.00 0.00 H new ATOM 0 HA PHE A 114 10.222 3.352 -12.827 1.00 0.00 H new ATOM 0 HB2 PHE A 114 11.374 5.302 -13.530 1.00 0.00 H new ATOM 0 HB3 PHE A 114 12.685 5.055 -12.393 1.00 0.00 H new ATOM 0 HD1 PHE A 114 14.371 3.256 -12.815 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.393 4.265 -15.690 1.00 0.00 H new ATOM 0 HE1 PHE A 114 15.668 2.110 -14.557 1.00 0.00 H new ATOM 0 HE2 PHE A 114 12.689 3.119 -17.434 1.00 0.00 H new ATOM 0 HZ PHE A 114 14.830 2.041 -16.872 1.00 0.00 H new ATOM 1698 N ILE A 115 11.291 1.182 -12.362 1.00 0.00 N ATOM 1699 CA ILE A 115 11.908 -0.119 -12.137 1.00 0.00 C ATOM 1700 C ILE A 115 12.980 -0.408 -13.182 1.00 0.00 C ATOM 1701 O ILE A 115 12.694 -0.602 -14.363 1.00 0.00 O ATOM 1702 CB ILE A 115 10.862 -1.250 -12.164 1.00 0.00 C ATOM 1703 CG1 ILE A 115 9.583 -0.809 -11.449 1.00 0.00 C ATOM 1704 CG2 ILE A 115 11.427 -2.509 -11.523 1.00 0.00 C ATOM 1705 CD1 ILE A 115 9.785 -0.506 -9.981 1.00 0.00 C ATOM 0 H ILE A 115 10.400 1.147 -12.857 1.00 0.00 H new ATOM 0 HA ILE A 115 12.368 -0.083 -11.149 1.00 0.00 H new ATOM 0 HB ILE A 115 10.616 -1.473 -13.202 1.00 0.00 H new ATOM 0 HG12 ILE A 115 9.187 0.078 -11.944 1.00 0.00 H new ATOM 0 HG13 ILE A 115 8.832 -1.592 -11.550 1.00 0.00 H new ATOM 0 HG21 ILE A 115 10.677 -3.299 -11.550 1.00 0.00 H new ATOM 0 HG22 ILE A 115 12.312 -2.831 -12.072 1.00 0.00 H new ATOM 0 HG23 ILE A 115 11.698 -2.300 -10.488 1.00 0.00 H new ATOM 0 HD11 ILE A 115 8.837 -0.200 -9.539 1.00 0.00 H new ATOM 0 HD12 ILE A 115 10.151 -1.398 -9.472 1.00 0.00 H new ATOM 0 HD13 ILE A 115 10.513 0.298 -9.872 1.00 0.00 H new ATOM 1717 N PRO A 116 14.245 -0.438 -12.739 1.00 0.00 N ATOM 1718 CA PRO A 116 15.386 -0.705 -13.619 1.00 0.00 C ATOM 1719 C PRO A 116 15.418 -2.150 -14.105 1.00 0.00 C ATOM 1720 O PRO A 116 15.387 -3.084 -13.305 1.00 0.00 O ATOM 1721 CB PRO A 116 16.597 -0.413 -12.729 1.00 0.00 C ATOM 1722 CG PRO A 116 16.106 -0.627 -11.339 1.00 0.00 C ATOM 1723 CD PRO A 116 14.660 -0.215 -11.343 1.00 0.00 C ATOM 0 HA PRO A 116 15.351 -0.101 -14.526 1.00 0.00 H new ATOM 0 HB2 PRO A 116 17.429 -1.078 -12.962 1.00 0.00 H new ATOM 0 HB3 PRO A 116 16.955 0.607 -12.870 1.00 0.00 H new ATOM 0 HG2 PRO A 116 16.214 -1.671 -11.043 1.00 0.00 H new ATOM 0 HG3 PRO A 116 16.679 -0.033 -10.627 1.00 0.00 H new ATOM 0 HD2 PRO A 116 14.070 -0.813 -10.648 1.00 0.00 H new ATOM 0 HD3 PRO A 116 14.538 0.828 -11.049 1.00 0.00 H new ATOM 1731 N ALA A 117 15.481 -2.326 -15.421 1.00 0.00 N ATOM 1732 CA ALA A 117 15.520 -3.657 -16.012 1.00 0.00 C ATOM 1733 C ALA A 117 16.374 -4.605 -15.177 1.00 0.00 C ATOM 1734 O ALA A 117 15.905 -5.653 -14.734 1.00 0.00 O ATOM 1735 CB ALA A 117 16.047 -3.586 -17.438 1.00 0.00 C ATOM 0 H ALA A 117 15.506 -1.563 -16.098 1.00 0.00 H new ATOM 0 HA ALA A 117 14.503 -4.049 -16.031 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.071 -4.588 -17.867 1.00 0.00 H new ATOM 0 HB2 ALA A 117 15.394 -2.950 -18.036 1.00 0.00 H new ATOM 0 HB3 ALA A 117 17.054 -3.169 -17.433 1.00 0.00 H new ATOM 1741 N HIS A 118 17.632 -4.229 -14.966 1.00 0.00 N ATOM 1742 CA HIS A 118 18.553 -5.046 -14.184 1.00 0.00 C ATOM 1743 C HIS A 118 19.196 -4.225 -13.071 1.00 0.00 C ATOM 1744 O HIS A 118 18.953 -3.024 -12.952 1.00 0.00 O ATOM 1745 CB HIS A 118 19.635 -5.640 -15.086 1.00 0.00 C ATOM 1746 CG HIS A 118 19.238 -6.935 -15.725 1.00 0.00 C ATOM 1747 ND1 HIS A 118 20.096 -8.007 -15.848 1.00 0.00 N ATOM 1748 CD2 HIS A 118 18.066 -7.328 -16.276 1.00 0.00 C ATOM 1749 CE1 HIS A 118 19.470 -9.003 -16.449 1.00 0.00 C ATOM 1750 NE2 HIS A 118 18.236 -8.617 -16.719 1.00 0.00 N ATOM 0 H HIS A 118 18.036 -3.364 -15.326 1.00 0.00 H new ATOM 0 HA HIS A 118 17.984 -5.858 -13.731 1.00 0.00 H new ATOM 0 HB2 HIS A 118 19.882 -4.920 -15.866 1.00 0.00 H new ATOM 0 HB3 HIS A 118 20.540 -5.796 -14.499 1.00 0.00 H new ATOM 0 HD2 HIS A 118 17.165 -6.738 -16.353 1.00 0.00 H new ATOM 0 HE1 HIS A 118 19.895 -9.969 -16.680 1.00 0.00 H new ATOM 0 HE2 HIS A 118 17.525 -9.184 -17.181 1.00 0.00 H new ATOM 1759 N SER A 119 20.017 -4.881 -12.257 1.00 0.00 N ATOM 1760 CA SER A 119 20.692 -4.212 -11.150 1.00 0.00 C ATOM 1761 C SER A 119 22.125 -4.716 -11.004 1.00 0.00 C ATOM 1762 O SER A 119 22.406 -5.894 -11.221 1.00 0.00 O ATOM 1763 CB SER A 119 19.924 -4.437 -9.846 1.00 0.00 C ATOM 1764 OG SER A 119 18.672 -3.774 -9.871 1.00 0.00 O ATOM 0 H SER A 119 20.231 -5.875 -12.343 1.00 0.00 H new ATOM 0 HA SER A 119 20.721 -3.144 -11.366 1.00 0.00 H new ATOM 0 HB2 SER A 119 19.771 -5.505 -9.690 1.00 0.00 H new ATOM 0 HB3 SER A 119 20.515 -4.074 -9.005 1.00 0.00 H new ATOM 0 HG SER A 119 18.788 -2.844 -9.584 1.00 0.00 H new ATOM 1770 N GLY A 120 23.028 -3.813 -10.632 1.00 0.00 N ATOM 1771 CA GLY A 120 24.420 -4.184 -10.463 1.00 0.00 C ATOM 1772 C GLY A 120 25.221 -3.117 -9.741 1.00 0.00 C ATOM 1773 O GLY A 120 24.760 -1.993 -9.545 1.00 0.00 O ATOM 0 H GLY A 120 22.820 -2.832 -10.445 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.479 -5.118 -9.904 1.00 0.00 H new ATOM 0 HA3 GLY A 120 24.865 -4.369 -11.441 1.00 0.00 H new ATOM 1777 N PRO A 121 26.448 -3.469 -9.332 1.00 0.00 N ATOM 1778 CA PRO A 121 27.340 -2.548 -8.621 1.00 0.00 C ATOM 1779 C PRO A 121 27.853 -1.428 -9.520 1.00 0.00 C ATOM 1780 O PRO A 121 28.836 -1.600 -10.240 1.00 0.00 O ATOM 1781 CB PRO A 121 28.495 -3.447 -8.173 1.00 0.00 C ATOM 1782 CG PRO A 121 28.499 -4.573 -9.148 1.00 0.00 C ATOM 1783 CD PRO A 121 27.062 -4.793 -9.532 1.00 0.00 C ATOM 0 HA PRO A 121 26.833 -2.042 -7.799 1.00 0.00 H new ATOM 0 HB2 PRO A 121 29.443 -2.909 -8.186 1.00 0.00 H new ATOM 0 HB3 PRO A 121 28.345 -3.806 -7.155 1.00 0.00 H new ATOM 0 HG2 PRO A 121 29.104 -4.330 -10.022 1.00 0.00 H new ATOM 0 HG3 PRO A 121 28.926 -5.472 -8.704 1.00 0.00 H new ATOM 0 HD2 PRO A 121 26.969 -5.127 -10.565 1.00 0.00 H new ATOM 0 HD3 PRO A 121 26.591 -5.553 -8.908 1.00 0.00 H new ATOM 1791 N SER A 122 27.182 -0.282 -9.472 1.00 0.00 N ATOM 1792 CA SER A 122 27.569 0.865 -10.285 1.00 0.00 C ATOM 1793 C SER A 122 29.012 1.270 -10.000 1.00 0.00 C ATOM 1794 O SER A 122 29.280 2.054 -9.089 1.00 0.00 O ATOM 1795 CB SER A 122 26.634 2.046 -10.017 1.00 0.00 C ATOM 1796 OG SER A 122 25.350 1.815 -10.571 1.00 0.00 O ATOM 0 H SER A 122 26.368 -0.123 -8.879 1.00 0.00 H new ATOM 0 HA SER A 122 27.490 0.579 -11.334 1.00 0.00 H new ATOM 0 HB2 SER A 122 26.546 2.208 -8.943 1.00 0.00 H new ATOM 0 HB3 SER A 122 27.059 2.955 -10.443 1.00 0.00 H new ATOM 0 HG SER A 122 24.770 2.583 -10.385 1.00 0.00 H new ATOM 1802 N SER A 123 29.938 0.731 -10.787 1.00 0.00 N ATOM 1803 CA SER A 123 31.354 1.032 -10.618 1.00 0.00 C ATOM 1804 C SER A 123 31.785 0.825 -9.169 1.00 0.00 C ATOM 1805 O SER A 123 32.412 1.695 -8.566 1.00 0.00 O ATOM 1806 CB SER A 123 31.646 2.471 -11.048 1.00 0.00 C ATOM 1807 OG SER A 123 31.956 2.538 -12.430 1.00 0.00 O ATOM 0 H SER A 123 29.732 0.084 -11.548 1.00 0.00 H new ATOM 0 HA SER A 123 31.923 0.349 -11.249 1.00 0.00 H new ATOM 0 HB2 SER A 123 30.782 3.100 -10.835 1.00 0.00 H new ATOM 0 HB3 SER A 123 32.479 2.866 -10.466 1.00 0.00 H new ATOM 0 HG SER A 123 32.137 3.468 -12.680 1.00 0.00 H new ATOM 1813 N GLY A 124 31.444 -0.335 -8.617 1.00 0.00 N ATOM 1814 CA GLY A 124 31.802 -0.637 -7.243 1.00 0.00 C ATOM 1815 C GLY A 124 33.303 -0.662 -7.028 1.00 0.00 C ATOM 1816 O GLY A 124 33.895 -1.728 -6.865 1.00 0.00 O ATOM 0 H GLY A 124 30.926 -1.071 -9.097 1.00 0.00 H new ATOM 0 HA2 GLY A 124 31.356 0.106 -6.582 1.00 0.00 H new ATOM 0 HA3 GLY A 124 31.382 -1.604 -6.965 1.00 0.00 H new TER 1820 GLY A 124