USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 897 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 65 ASN :FLIP amide:sc= -1.25! C(o=-5.8!,f=-4.2!) USER MOD Set 1.2: A 95 HIS : no HD1:sc= -2.93! C(o=-4.2!,f=-9.9!) USER MOD Set 2.1: A 92 LYS NZ :NH3+ -148:sc= 0.169 (180deg=0.271) USER MOD Set 2.2: A 120 GLN : amide:sc= -0.0581 X(o=0.11,f=0.055) USER MOD Set 3.1: A 45 THR OG1 : rot -20:sc= 0.559 USER MOD Set 3.2: A 84 GLN :FLIP amide:sc= 0.0202 F(o=-1.1,f=0.58) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot -60:sc= 0.116 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 8 HIS : no HD1:sc= -0.0153 X(o=-0.015,f=-0.015) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot -18:sc= 0.614 USER MOD Single : A 22 SER OG : rot -23:sc= 0.376 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 70:sc= -0.716 USER MOD Single : A 48 SER OG : rot 14:sc= -0.121 USER MOD Single : A 52 THR OG1 : rot 170:sc= 0 USER MOD Single : A 53 GLN : amide:sc= 0.911 K(o=0.91,f=-0.068) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 HIS :FLIP no HD1:sc= -0.33 F(o=-1.6,f=-0.33) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 43:sc= 0.00432 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot -141:sc= -0.257 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN :FLIP amide:sc= 0 F(o=-0.91,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 174:sc= -0.475! USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 37:sc= 0.0896 USER MOD Single : A 101 TYR OH : rot 180:sc=-0.00711 USER MOD Single : A 108 ASN : amide:sc= -0.967 X(o=-0.97,f=-0.86!) USER MOD Single : A 109 SER OG : rot 31:sc= 1.48 USER MOD Single : A 112 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0412) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.306 USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.716 13.548 14.753 1.00 0.00 N ATOM 2 CA GLY A 1 27.038 14.145 14.699 1.00 0.00 C ATOM 3 C GLY A 1 27.043 15.586 15.168 1.00 0.00 C ATOM 4 O GLY A 1 27.280 16.502 14.381 1.00 0.00 O ATOM 0 H1 GLY A 1 25.766 12.563 14.422 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.366 13.567 15.732 1.00 0.00 H new ATOM 0 H3 GLY A 1 25.067 14.085 14.143 1.00 0.00 H new ATOM 0 HA2 GLY A 1 27.722 13.563 15.317 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.413 14.098 13.677 1.00 0.00 H new ATOM 8 N SER A 2 26.779 15.788 16.455 1.00 0.00 N ATOM 9 CA SER A 2 26.749 17.129 17.028 1.00 0.00 C ATOM 10 C SER A 2 25.831 18.043 16.222 1.00 0.00 C ATOM 11 O SER A 2 26.160 19.202 15.966 1.00 0.00 O ATOM 12 CB SER A 2 28.160 17.718 17.076 1.00 0.00 C ATOM 13 OG SER A 2 28.214 18.845 17.934 1.00 0.00 O ATOM 0 H SER A 2 26.583 15.040 17.121 1.00 0.00 H new ATOM 0 HA SER A 2 26.360 17.055 18.043 1.00 0.00 H new ATOM 0 HB2 SER A 2 28.862 16.960 17.422 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.471 18.006 16.072 1.00 0.00 H new ATOM 0 HG SER A 2 27.603 19.537 17.604 1.00 0.00 H new ATOM 19 N SER A 3 24.679 17.514 15.825 1.00 0.00 N ATOM 20 CA SER A 3 23.714 18.279 15.045 1.00 0.00 C ATOM 21 C SER A 3 22.329 17.643 15.118 1.00 0.00 C ATOM 22 O SER A 3 22.148 16.480 14.760 1.00 0.00 O ATOM 23 CB SER A 3 24.167 18.376 13.587 1.00 0.00 C ATOM 24 OG SER A 3 23.193 19.031 12.793 1.00 0.00 O ATOM 0 H SER A 3 24.391 16.557 16.031 1.00 0.00 H new ATOM 0 HA SER A 3 23.656 19.282 15.468 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.111 18.919 13.531 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.350 17.377 13.193 1.00 0.00 H new ATOM 0 HG SER A 3 23.507 19.082 11.866 1.00 0.00 H new ATOM 30 N GLY A 4 21.353 18.416 15.586 1.00 0.00 N ATOM 31 CA GLY A 4 19.997 17.913 15.698 1.00 0.00 C ATOM 32 C GLY A 4 19.456 18.014 17.110 1.00 0.00 C ATOM 33 O GLY A 4 19.447 17.031 17.851 1.00 0.00 O ATOM 0 H GLY A 4 21.478 19.382 15.889 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.349 18.472 15.023 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.971 16.872 15.376 1.00 0.00 H new ATOM 37 N SER A 5 19.004 19.207 17.485 1.00 0.00 N ATOM 38 CA SER A 5 18.464 19.435 18.820 1.00 0.00 C ATOM 39 C SER A 5 17.176 20.249 18.753 1.00 0.00 C ATOM 40 O SER A 5 17.045 21.159 17.934 1.00 0.00 O ATOM 41 CB SER A 5 19.493 20.157 19.693 1.00 0.00 C ATOM 42 OG SER A 5 20.514 19.271 20.116 1.00 0.00 O ATOM 0 H SER A 5 19.001 20.030 16.883 1.00 0.00 H new ATOM 0 HA SER A 5 18.238 18.466 19.264 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.933 20.983 19.134 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.998 20.588 20.563 1.00 0.00 H new ATOM 0 HG SER A 5 21.160 19.757 20.671 1.00 0.00 H new ATOM 48 N SER A 6 16.226 19.915 19.622 1.00 0.00 N ATOM 49 CA SER A 6 14.946 20.612 19.660 1.00 0.00 C ATOM 50 C SER A 6 14.486 20.825 21.099 1.00 0.00 C ATOM 51 O SER A 6 15.124 20.359 22.042 1.00 0.00 O ATOM 52 CB SER A 6 13.888 19.823 18.886 1.00 0.00 C ATOM 53 OG SER A 6 14.069 19.964 17.487 1.00 0.00 O ATOM 0 H SER A 6 16.319 19.166 20.308 1.00 0.00 H new ATOM 0 HA SER A 6 15.077 21.587 19.191 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.944 18.769 19.159 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.894 20.172 19.164 1.00 0.00 H new ATOM 0 HG SER A 6 13.382 19.449 17.015 1.00 0.00 H new ATOM 59 N GLY A 7 13.372 21.534 21.259 1.00 0.00 N ATOM 60 CA GLY A 7 12.845 21.797 22.585 1.00 0.00 C ATOM 61 C GLY A 7 11.516 22.525 22.546 1.00 0.00 C ATOM 62 O GLY A 7 11.343 23.553 23.201 1.00 0.00 O ATOM 0 H GLY A 7 12.826 21.930 20.494 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.724 20.854 23.118 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.565 22.391 23.148 1.00 0.00 H new ATOM 66 N HIS A 8 10.573 21.992 21.775 1.00 0.00 N ATOM 67 CA HIS A 8 9.252 22.599 21.652 1.00 0.00 C ATOM 68 C HIS A 8 8.212 21.559 21.250 1.00 0.00 C ATOM 69 O HIS A 8 8.553 20.476 20.774 1.00 0.00 O ATOM 70 CB HIS A 8 9.282 23.732 20.625 1.00 0.00 C ATOM 71 CG HIS A 8 8.233 24.776 20.854 1.00 0.00 C ATOM 72 ND1 HIS A 8 7.075 24.855 20.109 1.00 0.00 N ATOM 73 CD2 HIS A 8 8.170 25.786 21.753 1.00 0.00 C ATOM 74 CE1 HIS A 8 6.346 25.870 20.539 1.00 0.00 C ATOM 75 NE2 HIS A 8 6.989 26.451 21.536 1.00 0.00 N ATOM 0 H HIS A 8 10.699 21.141 21.226 1.00 0.00 H new ATOM 0 HA HIS A 8 8.974 23.007 22.624 1.00 0.00 H new ATOM 0 HB2 HIS A 8 10.264 24.205 20.646 1.00 0.00 H new ATOM 0 HB3 HIS A 8 9.152 23.311 19.628 1.00 0.00 H new ATOM 0 HD2 HIS A 8 8.911 26.024 22.502 1.00 0.00 H new ATOM 0 HE1 HIS A 8 5.388 26.173 20.143 1.00 0.00 H new ATOM 0 HE2 HIS A 8 6.661 27.262 22.060 1.00 0.00 H new ATOM 83 N PHE A 9 6.941 21.894 21.445 1.00 0.00 N ATOM 84 CA PHE A 9 5.850 20.988 21.105 1.00 0.00 C ATOM 85 C PHE A 9 4.499 21.683 21.254 1.00 0.00 C ATOM 86 O PHE A 9 4.100 22.092 22.344 1.00 0.00 O ATOM 87 CB PHE A 9 5.896 19.743 21.994 1.00 0.00 C ATOM 88 CG PHE A 9 6.756 18.643 21.440 1.00 0.00 C ATOM 89 CD1 PHE A 9 6.573 18.189 20.144 1.00 0.00 C ATOM 90 CD2 PHE A 9 7.747 18.063 22.216 1.00 0.00 C ATOM 91 CE1 PHE A 9 7.362 17.177 19.631 1.00 0.00 C ATOM 92 CE2 PHE A 9 8.540 17.051 21.708 1.00 0.00 C ATOM 93 CZ PHE A 9 8.346 16.607 20.415 1.00 0.00 C ATOM 0 H PHE A 9 6.641 22.787 21.837 1.00 0.00 H new ATOM 0 HA PHE A 9 5.972 20.688 20.064 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.268 20.023 22.979 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.882 19.367 22.132 1.00 0.00 H new ATOM 0 HD1 PHE A 9 5.805 18.631 19.527 1.00 0.00 H new ATOM 0 HD2 PHE A 9 7.901 18.405 23.229 1.00 0.00 H new ATOM 0 HE1 PHE A 9 7.209 16.832 18.619 1.00 0.00 H new ATOM 0 HE2 PHE A 9 9.310 16.608 22.322 1.00 0.00 H new ATOM 0 HZ PHE A 9 8.963 15.815 20.017 1.00 0.00 H new ATOM 103 N PRO A 10 3.779 21.821 20.131 1.00 0.00 N ATOM 104 CA PRO A 10 2.462 22.465 20.109 1.00 0.00 C ATOM 105 C PRO A 10 1.396 21.629 20.808 1.00 0.00 C ATOM 106 O PRO A 10 1.615 20.459 21.117 1.00 0.00 O ATOM 107 CB PRO A 10 2.152 22.588 18.615 1.00 0.00 C ATOM 108 CG PRO A 10 2.943 21.501 17.974 1.00 0.00 C ATOM 109 CD PRO A 10 4.193 21.357 18.796 1.00 0.00 C ATOM 0 HA PRO A 10 2.466 23.419 20.637 1.00 0.00 H new ATOM 0 HB2 PRO A 10 1.086 22.469 18.421 1.00 0.00 H new ATOM 0 HB3 PRO A 10 2.439 23.567 18.230 1.00 0.00 H new ATOM 0 HG2 PRO A 10 2.380 20.568 17.954 1.00 0.00 H new ATOM 0 HG3 PRO A 10 3.183 21.750 16.940 1.00 0.00 H new ATOM 0 HD2 PRO A 10 4.542 20.325 18.820 1.00 0.00 H new ATOM 0 HD3 PRO A 10 5.009 21.960 18.396 1.00 0.00 H new ATOM 117 N ALA A 11 0.240 22.238 21.053 1.00 0.00 N ATOM 118 CA ALA A 11 -0.861 21.548 21.713 1.00 0.00 C ATOM 119 C ALA A 11 -2.207 22.025 21.178 1.00 0.00 C ATOM 120 O ALA A 11 -2.479 23.226 21.135 1.00 0.00 O ATOM 121 CB ALA A 11 -0.787 21.755 23.219 1.00 0.00 C ATOM 0 H ALA A 11 0.042 23.207 20.804 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.770 20.483 21.498 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -1.615 21.234 23.699 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.157 21.360 23.595 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -0.849 22.820 23.443 1.00 0.00 H new ATOM 127 N ARG A 12 -3.046 21.079 20.770 1.00 0.00 N ATOM 128 CA ARG A 12 -4.363 21.403 20.235 1.00 0.00 C ATOM 129 C ARG A 12 -4.279 22.568 19.253 1.00 0.00 C ATOM 130 O ARG A 12 -4.985 23.566 19.396 1.00 0.00 O ATOM 131 CB ARG A 12 -5.327 21.749 21.372 1.00 0.00 C ATOM 132 CG ARG A 12 -5.546 20.608 22.353 1.00 0.00 C ATOM 133 CD ARG A 12 -6.601 19.635 21.850 1.00 0.00 C ATOM 134 NE ARG A 12 -7.943 20.208 21.904 1.00 0.00 N ATOM 135 CZ ARG A 12 -8.520 20.827 20.880 1.00 0.00 C ATOM 136 NH1 ARG A 12 -7.874 20.953 19.729 1.00 0.00 N ATOM 137 NH2 ARG A 12 -9.745 21.322 21.007 1.00 0.00 N ATOM 0 H ARG A 12 -2.837 20.081 20.800 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.737 20.528 19.703 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -4.942 22.613 21.913 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -6.287 22.041 20.947 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -4.607 20.078 22.512 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -5.852 21.011 23.319 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.370 19.348 20.824 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.571 18.725 22.450 1.00 0.00 H new ATOM 0 HE ARG A 12 -8.466 20.129 22.776 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -6.932 20.574 19.629 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -8.319 21.429 18.944 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -10.244 21.227 21.891 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.187 21.797 20.220 1.00 0.00 H new ATOM 151 N VAL A 13 -3.411 22.433 18.256 1.00 0.00 N ATOM 152 CA VAL A 13 -3.234 23.474 17.250 1.00 0.00 C ATOM 153 C VAL A 13 -3.944 23.108 15.951 1.00 0.00 C ATOM 154 O VAL A 13 -3.871 21.969 15.490 1.00 0.00 O ATOM 155 CB VAL A 13 -1.743 23.723 16.955 1.00 0.00 C ATOM 156 CG1 VAL A 13 -1.107 24.539 18.070 1.00 0.00 C ATOM 157 CG2 VAL A 13 -1.011 22.403 16.764 1.00 0.00 C ATOM 0 H VAL A 13 -2.819 21.613 18.123 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.672 24.385 17.657 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.663 24.294 16.030 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -0.054 24.705 17.844 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.616 25.499 18.154 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.195 23.998 19.012 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.041 22.597 16.556 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.097 21.804 17.671 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.452 21.860 15.928 1.00 0.00 H new ATOM 167 N LYS A 14 -4.631 24.082 15.364 1.00 0.00 N ATOM 168 CA LYS A 14 -5.353 23.865 14.117 1.00 0.00 C ATOM 169 C LYS A 14 -4.620 24.508 12.944 1.00 0.00 C ATOM 170 O LYS A 14 -4.518 25.732 12.858 1.00 0.00 O ATOM 171 CB LYS A 14 -6.771 24.434 14.218 1.00 0.00 C ATOM 172 CG LYS A 14 -7.601 23.803 15.323 1.00 0.00 C ATOM 173 CD LYS A 14 -8.926 24.525 15.506 1.00 0.00 C ATOM 174 CE LYS A 14 -9.731 23.930 16.651 1.00 0.00 C ATOM 175 NZ LYS A 14 -9.286 24.453 17.972 1.00 0.00 N ATOM 0 H LYS A 14 -4.703 25.030 15.733 1.00 0.00 H new ATOM 0 HA LYS A 14 -5.410 22.791 13.943 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.711 25.509 14.388 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.280 24.290 13.265 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.786 22.755 15.087 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -7.041 23.825 16.258 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -8.742 25.582 15.700 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.504 24.466 14.584 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.788 24.156 16.508 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.633 22.845 16.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.859 24.024 18.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -8.284 24.215 18.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.403 25.486 17.994 1.00 0.00 H new ATOM 189 N VAL A 15 -4.111 23.675 12.041 1.00 0.00 N ATOM 190 CA VAL A 15 -3.389 24.162 10.872 1.00 0.00 C ATOM 191 C VAL A 15 -3.843 23.443 9.607 1.00 0.00 C ATOM 192 O VAL A 15 -4.116 22.243 9.628 1.00 0.00 O ATOM 193 CB VAL A 15 -1.868 23.980 11.036 1.00 0.00 C ATOM 194 CG1 VAL A 15 -1.139 24.427 9.778 1.00 0.00 C ATOM 195 CG2 VAL A 15 -1.368 24.745 12.252 1.00 0.00 C ATOM 0 H VAL A 15 -4.186 22.659 12.097 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.612 25.225 10.782 1.00 0.00 H new ATOM 0 HB VAL A 15 -1.660 22.921 11.191 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -0.066 24.291 9.912 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -1.477 23.831 8.930 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -1.351 25.479 9.589 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -0.292 24.605 12.353 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -1.586 25.806 12.129 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -1.867 24.373 13.147 1.00 0.00 H new ATOM 205 N GLU A 16 -3.920 24.185 8.507 1.00 0.00 N ATOM 206 CA GLU A 16 -4.341 23.617 7.231 1.00 0.00 C ATOM 207 C GLU A 16 -3.146 23.061 6.462 1.00 0.00 C ATOM 208 O GLU A 16 -2.015 23.528 6.600 1.00 0.00 O ATOM 209 CB GLU A 16 -5.057 24.674 6.389 1.00 0.00 C ATOM 210 CG GLU A 16 -4.117 25.680 5.746 1.00 0.00 C ATOM 211 CD GLU A 16 -4.767 27.033 5.533 1.00 0.00 C ATOM 212 OE1 GLU A 16 -5.661 27.133 4.667 1.00 0.00 O ATOM 213 OE2 GLU A 16 -4.381 27.993 6.233 1.00 0.00 O ATOM 0 H GLU A 16 -3.697 25.180 8.473 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.031 22.798 7.437 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.632 24.176 5.608 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.770 25.206 7.019 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.235 25.800 6.374 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.775 25.291 4.787 1.00 0.00 H new ATOM 220 N PRO A 17 -3.401 22.039 5.632 1.00 0.00 N ATOM 221 CA PRO A 17 -2.360 21.397 4.824 1.00 0.00 C ATOM 222 C PRO A 17 -1.850 22.304 3.709 1.00 0.00 C ATOM 223 O PRO A 17 -2.627 23.004 3.061 1.00 0.00 O ATOM 224 CB PRO A 17 -3.070 20.175 4.237 1.00 0.00 C ATOM 225 CG PRO A 17 -4.513 20.546 4.221 1.00 0.00 C ATOM 226 CD PRO A 17 -4.725 21.432 5.417 1.00 0.00 C ATOM 0 HA PRO A 17 -1.478 21.151 5.416 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.708 19.951 3.234 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -2.896 19.287 4.844 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.772 21.066 3.299 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -5.145 19.659 4.275 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.487 22.188 5.227 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.051 20.862 6.287 1.00 0.00 H new ATOM 234 N ALA A 18 -0.539 22.285 3.490 1.00 0.00 N ATOM 235 CA ALA A 18 0.074 23.103 2.452 1.00 0.00 C ATOM 236 C ALA A 18 0.641 22.236 1.332 1.00 0.00 C ATOM 237 O ALA A 18 1.490 22.680 0.559 1.00 0.00 O ATOM 238 CB ALA A 18 1.165 23.981 3.046 1.00 0.00 C ATOM 0 H ALA A 18 0.119 21.712 4.018 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.699 23.742 2.025 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.614 24.586 2.259 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.734 24.634 3.805 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.930 23.352 3.501 1.00 0.00 H new ATOM 244 N VAL A 19 0.166 20.997 1.252 1.00 0.00 N ATOM 245 CA VAL A 19 0.625 20.068 0.227 1.00 0.00 C ATOM 246 C VAL A 19 -0.548 19.348 -0.429 1.00 0.00 C ATOM 247 O VAL A 19 -1.620 19.220 0.164 1.00 0.00 O ATOM 248 CB VAL A 19 1.593 19.022 0.811 1.00 0.00 C ATOM 249 CG1 VAL A 19 0.836 18.000 1.645 1.00 0.00 C ATOM 250 CG2 VAL A 19 2.375 18.340 -0.302 1.00 0.00 C ATOM 0 H VAL A 19 -0.536 20.614 1.885 1.00 0.00 H new ATOM 0 HA VAL A 19 1.149 20.659 -0.523 1.00 0.00 H new ATOM 0 HB VAL A 19 2.302 19.533 1.462 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.537 17.269 2.049 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.326 18.506 2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.102 17.492 1.020 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.054 17.604 0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 19 1.683 17.842 -0.980 1.00 0.00 H new ATOM 0 HG23 VAL A 19 2.949 19.085 -0.853 1.00 0.00 H new ATOM 260 N ASP A 20 -0.338 18.880 -1.654 1.00 0.00 N ATOM 261 CA ASP A 20 -1.378 18.171 -2.390 1.00 0.00 C ATOM 262 C ASP A 20 -1.231 16.662 -2.222 1.00 0.00 C ATOM 263 O ASP A 20 -2.221 15.939 -2.104 1.00 0.00 O ATOM 264 CB ASP A 20 -1.324 18.539 -3.874 1.00 0.00 C ATOM 265 CG ASP A 20 -1.383 20.037 -4.101 1.00 0.00 C ATOM 266 OD1 ASP A 20 -2.504 20.577 -4.207 1.00 0.00 O ATOM 267 OD2 ASP A 20 -0.308 20.669 -4.174 1.00 0.00 O ATOM 0 H ASP A 20 0.543 18.979 -2.158 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.344 18.471 -1.984 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.406 18.144 -4.310 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.155 18.063 -4.394 1.00 0.00 H new ATOM 272 N THR A 21 0.012 16.191 -2.213 1.00 0.00 N ATOM 273 CA THR A 21 0.290 14.768 -2.061 1.00 0.00 C ATOM 274 C THR A 21 -0.690 13.928 -2.872 1.00 0.00 C ATOM 275 O THR A 21 -1.046 12.818 -2.476 1.00 0.00 O ATOM 276 CB THR A 21 0.220 14.336 -0.585 1.00 0.00 C ATOM 277 OG1 THR A 21 -1.141 14.334 -0.139 1.00 0.00 O ATOM 278 CG2 THR A 21 1.043 15.268 0.291 1.00 0.00 C ATOM 0 H THR A 21 0.843 16.775 -2.309 1.00 0.00 H new ATOM 0 HA THR A 21 1.301 14.602 -2.432 1.00 0.00 H new ATOM 0 HB THR A 21 0.630 13.329 -0.504 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.688 14.866 -0.754 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.978 14.943 1.329 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.084 15.246 -0.032 1.00 0.00 H new ATOM 0 HG23 THR A 21 0.657 16.284 0.204 1.00 0.00 H new ATOM 286 N SER A 22 -1.124 14.464 -4.008 1.00 0.00 N ATOM 287 CA SER A 22 -2.066 13.764 -4.873 1.00 0.00 C ATOM 288 C SER A 22 -1.365 13.228 -6.118 1.00 0.00 C ATOM 289 O SER A 22 -1.965 12.515 -6.923 1.00 0.00 O ATOM 290 CB SER A 22 -3.209 14.697 -5.279 1.00 0.00 C ATOM 291 OG SER A 22 -4.066 14.074 -6.221 1.00 0.00 O ATOM 0 H SER A 22 -0.838 15.381 -4.351 1.00 0.00 H new ATOM 0 HA SER A 22 -2.475 12.921 -4.316 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.781 14.983 -4.396 1.00 0.00 H new ATOM 0 HB3 SER A 22 -2.801 15.614 -5.705 1.00 0.00 H new ATOM 0 HG SER A 22 -3.580 13.360 -6.684 1.00 0.00 H new ATOM 297 N ARG A 23 -0.092 13.578 -6.270 1.00 0.00 N ATOM 298 CA ARG A 23 0.691 13.134 -7.417 1.00 0.00 C ATOM 299 C ARG A 23 1.579 11.951 -7.044 1.00 0.00 C ATOM 300 O ARG A 23 2.294 11.409 -7.887 1.00 0.00 O ATOM 301 CB ARG A 23 1.550 14.283 -7.950 1.00 0.00 C ATOM 302 CG ARG A 23 0.828 15.620 -7.980 1.00 0.00 C ATOM 303 CD ARG A 23 0.162 15.863 -9.325 1.00 0.00 C ATOM 304 NE ARG A 23 -1.012 15.015 -9.516 1.00 0.00 N ATOM 305 CZ ARG A 23 -1.974 15.278 -10.393 1.00 0.00 C ATOM 306 NH1 ARG A 23 -1.903 16.360 -11.156 1.00 0.00 N ATOM 307 NH2 ARG A 23 -3.011 14.458 -10.508 1.00 0.00 N ATOM 0 H ARG A 23 0.419 14.168 -5.613 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.001 12.815 -8.196 1.00 0.00 H new ATOM 0 HB2 ARG A 23 2.443 14.375 -7.331 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.885 14.038 -8.958 1.00 0.00 H new ATOM 0 HG2 ARG A 23 0.077 15.647 -7.191 1.00 0.00 H new ATOM 0 HG3 ARG A 23 1.537 16.422 -7.773 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -0.131 16.910 -9.400 1.00 0.00 H new ATOM 0 HD3 ARG A 23 0.879 15.674 -10.124 1.00 0.00 H new ATOM 0 HE ARG A 23 -1.098 14.175 -8.944 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -1.108 16.993 -11.070 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -2.643 16.559 -11.829 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -3.070 13.625 -9.923 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -3.749 14.661 -11.182 1.00 0.00 H new ATOM 321 N ILE A 24 1.529 11.557 -5.776 1.00 0.00 N ATOM 322 CA ILE A 24 2.328 10.438 -5.292 1.00 0.00 C ATOM 323 C ILE A 24 1.858 9.122 -5.902 1.00 0.00 C ATOM 324 O ILE A 24 0.686 8.761 -5.799 1.00 0.00 O ATOM 325 CB ILE A 24 2.272 10.329 -3.757 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.925 11.553 -3.112 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.953 9.051 -3.291 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.897 11.526 -1.599 1.00 0.00 C ATOM 0 H ILE A 24 0.944 11.996 -5.065 1.00 0.00 H new ATOM 0 HA ILE A 24 3.357 10.630 -5.597 1.00 0.00 H new ATOM 0 HB ILE A 24 1.227 10.294 -3.449 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.960 11.622 -3.447 1.00 0.00 H new ATOM 0 HG13 ILE A 24 2.417 12.452 -3.461 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.905 8.989 -2.204 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.447 8.189 -3.727 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.996 9.058 -3.608 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.377 12.424 -1.210 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.863 11.489 -1.255 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.430 10.646 -1.241 1.00 0.00 H new ATOM 340 N LYS A 25 2.781 8.408 -6.536 1.00 0.00 N ATOM 341 CA LYS A 25 2.464 7.129 -7.161 1.00 0.00 C ATOM 342 C LYS A 25 3.239 5.993 -6.500 1.00 0.00 C ATOM 343 O LYS A 25 4.329 6.200 -5.966 1.00 0.00 O ATOM 344 CB LYS A 25 2.783 7.176 -8.657 1.00 0.00 C ATOM 345 CG LYS A 25 1.618 7.640 -9.513 1.00 0.00 C ATOM 346 CD LYS A 25 0.756 6.473 -9.963 1.00 0.00 C ATOM 347 CE LYS A 25 -0.346 6.174 -8.959 1.00 0.00 C ATOM 348 NZ LYS A 25 -1.395 5.287 -9.534 1.00 0.00 N ATOM 0 H LYS A 25 3.756 8.693 -6.631 1.00 0.00 H new ATOM 0 HA LYS A 25 1.398 6.943 -7.029 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.630 7.843 -8.819 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.092 6.184 -8.985 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.009 8.346 -8.948 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.996 8.172 -10.386 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.314 6.699 -10.933 1.00 0.00 H new ATOM 0 HD3 LYS A 25 1.379 5.589 -10.095 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.085 5.701 -8.077 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.801 7.108 -8.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -2.128 5.107 -8.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.825 5.748 -10.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.966 4.385 -9.825 1.00 0.00 H new ATOM 362 N VAL A 26 2.670 4.793 -6.540 1.00 0.00 N ATOM 363 CA VAL A 26 3.309 3.624 -5.948 1.00 0.00 C ATOM 364 C VAL A 26 3.293 2.442 -6.911 1.00 0.00 C ATOM 365 O VAL A 26 2.274 2.150 -7.536 1.00 0.00 O ATOM 366 CB VAL A 26 2.617 3.211 -4.635 1.00 0.00 C ATOM 367 CG1 VAL A 26 2.698 4.335 -3.613 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.171 2.819 -4.895 1.00 0.00 C ATOM 0 H VAL A 26 1.767 4.605 -6.976 1.00 0.00 H new ATOM 0 HA VAL A 26 4.341 3.902 -5.735 1.00 0.00 H new ATOM 0 HB VAL A 26 3.136 2.343 -4.228 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.204 4.026 -2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.743 4.563 -3.405 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.205 5.223 -4.009 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.698 2.530 -3.956 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.636 3.666 -5.325 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.141 1.980 -5.590 1.00 0.00 H new ATOM 378 N PHE A 27 4.430 1.763 -7.025 1.00 0.00 N ATOM 379 CA PHE A 27 4.548 0.612 -7.912 1.00 0.00 C ATOM 380 C PHE A 27 5.436 -0.463 -7.292 1.00 0.00 C ATOM 381 O PHE A 27 6.515 -0.173 -6.778 1.00 0.00 O ATOM 382 CB PHE A 27 5.118 1.041 -9.266 1.00 0.00 C ATOM 383 CG PHE A 27 6.362 1.875 -9.156 1.00 0.00 C ATOM 384 CD1 PHE A 27 7.602 1.276 -9.006 1.00 0.00 C ATOM 385 CD2 PHE A 27 6.292 3.258 -9.203 1.00 0.00 C ATOM 386 CE1 PHE A 27 8.749 2.041 -8.904 1.00 0.00 C ATOM 387 CE2 PHE A 27 7.435 4.028 -9.102 1.00 0.00 C ATOM 388 CZ PHE A 27 8.665 3.419 -8.953 1.00 0.00 C ATOM 0 H PHE A 27 5.283 1.990 -6.514 1.00 0.00 H new ATOM 0 HA PHE A 27 3.552 0.195 -8.060 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.338 0.152 -9.857 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.359 1.605 -9.808 1.00 0.00 H new ATOM 0 HD1 PHE A 27 7.674 0.199 -8.968 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.333 3.740 -9.320 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.710 1.562 -8.786 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.366 5.105 -9.140 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.560 4.019 -8.875 1.00 0.00 H new ATOM 398 N GLY A 28 4.971 -1.708 -7.345 1.00 0.00 N ATOM 399 CA GLY A 28 5.734 -2.809 -6.786 1.00 0.00 C ATOM 400 C GLY A 28 4.847 -3.903 -6.225 1.00 0.00 C ATOM 401 O GLY A 28 3.632 -3.744 -6.102 1.00 0.00 O ATOM 0 H GLY A 28 4.080 -1.973 -7.765 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.379 -3.229 -7.558 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.385 -2.432 -5.997 1.00 0.00 H new ATOM 405 N PRO A 29 5.458 -5.044 -5.875 1.00 0.00 N ATOM 406 CA PRO A 29 4.734 -6.192 -5.320 1.00 0.00 C ATOM 407 C PRO A 29 4.215 -5.924 -3.912 1.00 0.00 C ATOM 408 O PRO A 29 3.110 -6.334 -3.558 1.00 0.00 O ATOM 409 CB PRO A 29 5.789 -7.301 -5.299 1.00 0.00 C ATOM 410 CG PRO A 29 7.092 -6.582 -5.227 1.00 0.00 C ATOM 411 CD PRO A 29 6.902 -5.303 -5.994 1.00 0.00 C ATOM 0 HA PRO A 29 3.849 -6.438 -5.907 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.653 -7.961 -4.442 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.728 -7.922 -6.193 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.369 -6.379 -4.193 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.893 -7.181 -5.660 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.492 -4.490 -5.571 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.206 -5.410 -7.035 1.00 0.00 H new ATOM 419 N GLY A 30 5.019 -5.231 -3.111 1.00 0.00 N ATOM 420 CA GLY A 30 4.623 -4.920 -1.750 1.00 0.00 C ATOM 421 C GLY A 30 3.337 -4.120 -1.689 1.00 0.00 C ATOM 422 O GLY A 30 2.670 -4.082 -0.655 1.00 0.00 O ATOM 0 H GLY A 30 5.938 -4.879 -3.381 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.497 -5.847 -1.191 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.420 -4.359 -1.262 1.00 0.00 H new ATOM 426 N ILE A 31 2.989 -3.477 -2.799 1.00 0.00 N ATOM 427 CA ILE A 31 1.775 -2.673 -2.867 1.00 0.00 C ATOM 428 C ILE A 31 0.786 -3.256 -3.870 1.00 0.00 C ATOM 429 O ILE A 31 -0.407 -2.957 -3.825 1.00 0.00 O ATOM 430 CB ILE A 31 2.086 -1.216 -3.256 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.919 -0.303 -2.873 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.378 -1.116 -4.745 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.804 -0.061 -1.385 1.00 0.00 C ATOM 0 H ILE A 31 3.531 -3.497 -3.663 1.00 0.00 H new ATOM 0 HA ILE A 31 1.330 -2.687 -1.872 1.00 0.00 H new ATOM 0 HB ILE A 31 2.972 -0.891 -2.710 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.036 0.655 -3.381 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.010 -0.744 -3.234 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.596 -0.080 -5.004 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.238 -1.740 -4.990 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.510 -1.456 -5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.044 0.594 -1.187 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.656 -1.011 -0.872 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.718 0.409 -1.021 1.00 0.00 H new ATOM 445 N GLU A 32 1.290 -4.090 -4.774 1.00 0.00 N ATOM 446 CA GLU A 32 0.449 -4.715 -5.789 1.00 0.00 C ATOM 447 C GLU A 32 -0.097 -6.051 -5.294 1.00 0.00 C ATOM 448 O GLU A 32 -1.292 -6.324 -5.404 1.00 0.00 O ATOM 449 CB GLU A 32 1.241 -4.922 -7.082 1.00 0.00 C ATOM 450 CG GLU A 32 1.623 -3.626 -7.776 1.00 0.00 C ATOM 451 CD GLU A 32 0.534 -3.117 -8.701 1.00 0.00 C ATOM 452 OE1 GLU A 32 0.259 -3.787 -9.718 1.00 0.00 O ATOM 453 OE2 GLU A 32 -0.043 -2.049 -8.407 1.00 0.00 O ATOM 0 H GLU A 32 2.275 -4.349 -4.825 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.391 -4.050 -5.989 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.147 -5.484 -6.857 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.650 -5.530 -7.767 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.841 -2.867 -7.025 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.538 -3.780 -8.348 1.00 0.00 H new ATOM 460 N GLY A 33 0.787 -6.881 -4.749 1.00 0.00 N ATOM 461 CA GLY A 33 0.375 -8.179 -4.247 1.00 0.00 C ATOM 462 C GLY A 33 0.851 -9.318 -5.126 1.00 0.00 C ATOM 463 O GLY A 33 0.100 -10.253 -5.404 1.00 0.00 O ATOM 0 H GLY A 33 1.781 -6.678 -4.646 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.765 -8.315 -3.238 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.712 -8.209 -4.176 1.00 0.00 H new ATOM 467 N LYS A 34 2.102 -9.241 -5.567 1.00 0.00 N ATOM 468 CA LYS A 34 2.678 -10.273 -6.421 1.00 0.00 C ATOM 469 C LYS A 34 3.421 -11.314 -5.590 1.00 0.00 C ATOM 470 O LYS A 34 2.987 -12.461 -5.482 1.00 0.00 O ATOM 471 CB LYS A 34 3.629 -9.647 -7.443 1.00 0.00 C ATOM 472 CG LYS A 34 3.090 -8.377 -8.078 1.00 0.00 C ATOM 473 CD LYS A 34 1.830 -8.648 -8.884 1.00 0.00 C ATOM 474 CE LYS A 34 2.160 -9.087 -10.302 1.00 0.00 C ATOM 475 NZ LYS A 34 0.965 -9.040 -11.190 1.00 0.00 N ATOM 0 H LYS A 34 2.737 -8.474 -5.347 1.00 0.00 H new ATOM 0 HA LYS A 34 1.863 -10.769 -6.949 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.578 -9.425 -6.955 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.837 -10.375 -8.227 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.875 -7.643 -7.301 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.851 -7.942 -8.726 1.00 0.00 H new ATOM 0 HD2 LYS A 34 1.240 -9.421 -8.391 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.215 -7.748 -8.914 1.00 0.00 H new ATOM 0 HE2 LYS A 34 2.940 -8.444 -10.709 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.560 -10.101 -10.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.232 -9.346 -12.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 0.230 -9.673 -10.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 0.598 -8.068 -11.227 1.00 0.00 H new ATOM 489 N ASP A 35 4.541 -10.907 -5.004 1.00 0.00 N ATOM 490 CA ASP A 35 5.343 -11.804 -4.180 1.00 0.00 C ATOM 491 C ASP A 35 5.123 -11.522 -2.697 1.00 0.00 C ATOM 492 O ASP A 35 6.018 -11.725 -1.876 1.00 0.00 O ATOM 493 CB ASP A 35 6.826 -11.659 -4.525 1.00 0.00 C ATOM 494 CG ASP A 35 7.074 -11.653 -6.021 1.00 0.00 C ATOM 495 OD1 ASP A 35 6.489 -12.505 -6.722 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.855 -10.798 -6.490 1.00 0.00 O ATOM 0 H ASP A 35 4.915 -9.961 -5.084 1.00 0.00 H new ATOM 0 HA ASP A 35 5.028 -12.827 -4.388 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.208 -10.734 -4.093 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.384 -12.478 -4.070 1.00 0.00 H new ATOM 501 N VAL A 36 3.926 -11.052 -2.360 1.00 0.00 N ATOM 502 CA VAL A 36 3.588 -10.742 -0.976 1.00 0.00 C ATOM 503 C VAL A 36 3.073 -11.977 -0.247 1.00 0.00 C ATOM 504 O VAL A 36 2.310 -11.871 0.714 1.00 0.00 O ATOM 505 CB VAL A 36 2.526 -9.629 -0.893 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.423 -9.094 0.526 1.00 0.00 C ATOM 507 CG2 VAL A 36 2.850 -8.510 -1.872 1.00 0.00 C ATOM 0 H VAL A 36 3.174 -10.878 -3.027 1.00 0.00 H new ATOM 0 HA VAL A 36 4.503 -10.396 -0.496 1.00 0.00 H new ATOM 0 HB VAL A 36 1.559 -10.052 -1.167 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.668 -8.309 0.565 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.141 -9.903 1.200 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.386 -8.686 0.832 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.090 -7.732 -1.800 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.825 -8.087 -1.631 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.867 -8.908 -2.887 1.00 0.00 H new ATOM 517 N PHE A 37 3.495 -13.149 -0.708 1.00 0.00 N ATOM 518 CA PHE A 37 3.075 -14.407 -0.100 1.00 0.00 C ATOM 519 C PHE A 37 3.472 -14.457 1.373 1.00 0.00 C ATOM 520 O PHE A 37 4.488 -13.890 1.772 1.00 0.00 O ATOM 521 CB PHE A 37 3.693 -15.590 -0.847 1.00 0.00 C ATOM 522 CG PHE A 37 3.680 -15.430 -2.340 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.482 -15.315 -3.027 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.865 -15.395 -3.057 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.465 -15.167 -4.401 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.855 -15.247 -4.432 1.00 0.00 C ATOM 527 CZ PHE A 37 3.654 -15.134 -5.104 1.00 0.00 C ATOM 0 H PHE A 37 4.128 -13.255 -1.501 1.00 0.00 H new ATOM 0 HA PHE A 37 1.989 -14.471 -0.168 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.722 -15.723 -0.513 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.152 -16.499 -0.582 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.550 -15.341 -2.482 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.807 -15.484 -2.536 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.524 -15.077 -4.924 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.785 -15.220 -4.980 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.644 -15.020 -6.178 1.00 0.00 H new ATOM 537 N ARG A 38 2.661 -15.139 2.174 1.00 0.00 N ATOM 538 CA ARG A 38 2.925 -15.263 3.603 1.00 0.00 C ATOM 539 C ARG A 38 4.385 -15.625 3.856 1.00 0.00 C ATOM 540 O ARG A 38 4.949 -16.480 3.174 1.00 0.00 O ATOM 541 CB ARG A 38 2.010 -16.321 4.223 1.00 0.00 C ATOM 542 CG ARG A 38 1.796 -16.142 5.717 1.00 0.00 C ATOM 543 CD ARG A 38 0.811 -17.162 6.265 1.00 0.00 C ATOM 544 NE ARG A 38 1.090 -17.498 7.658 1.00 0.00 N ATOM 545 CZ ARG A 38 2.012 -18.379 8.031 1.00 0.00 C ATOM 546 NH1 ARG A 38 2.741 -19.007 7.119 1.00 0.00 N ATOM 547 NH2 ARG A 38 2.208 -18.631 9.319 1.00 0.00 N ATOM 0 H ARG A 38 1.816 -15.614 1.858 1.00 0.00 H new ATOM 0 HA ARG A 38 2.722 -14.299 4.070 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.043 -16.293 3.720 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.435 -17.308 4.041 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.749 -16.240 6.236 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.427 -15.136 5.915 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -0.202 -16.768 6.183 1.00 0.00 H new ATOM 0 HD3 ARG A 38 0.851 -18.067 5.659 1.00 0.00 H new ATOM 0 HE ARG A 38 0.548 -17.031 8.385 1.00 0.00 H new ATOM 0 HH11 ARG A 38 2.595 -18.814 6.128 1.00 0.00 H new ATOM 0 HH12 ARG A 38 3.448 -19.683 7.408 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.651 -18.148 10.024 1.00 0.00 H new ATOM 0 HH22 ARG A 38 2.916 -19.308 9.604 1.00 0.00 H new ATOM 561 N GLU A 39 4.990 -14.969 4.842 1.00 0.00 N ATOM 562 CA GLU A 39 6.385 -15.222 5.184 1.00 0.00 C ATOM 563 C GLU A 39 7.302 -14.885 4.012 1.00 0.00 C ATOM 564 O GLU A 39 8.322 -15.541 3.800 1.00 0.00 O ATOM 565 CB GLU A 39 6.576 -16.685 5.591 1.00 0.00 C ATOM 566 CG GLU A 39 5.985 -17.020 6.950 1.00 0.00 C ATOM 567 CD GLU A 39 6.855 -16.547 8.098 1.00 0.00 C ATOM 568 OE1 GLU A 39 7.679 -15.634 7.879 1.00 0.00 O ATOM 569 OE2 GLU A 39 6.712 -17.088 9.214 1.00 0.00 O ATOM 0 H GLU A 39 4.536 -14.259 5.417 1.00 0.00 H new ATOM 0 HA GLU A 39 6.648 -14.581 6.025 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.119 -17.326 4.837 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.641 -16.915 5.601 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.999 -16.564 7.035 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.846 -18.098 7.025 1.00 0.00 H new ATOM 576 N ALA A 40 6.930 -13.859 3.253 1.00 0.00 N ATOM 577 CA ALA A 40 7.719 -13.434 2.103 1.00 0.00 C ATOM 578 C ALA A 40 8.199 -11.996 2.269 1.00 0.00 C ATOM 579 O ALA A 40 7.495 -11.156 2.831 1.00 0.00 O ATOM 580 CB ALA A 40 6.908 -13.579 0.824 1.00 0.00 C ATOM 0 H ALA A 40 6.087 -13.307 3.414 1.00 0.00 H new ATOM 0 HA ALA A 40 8.597 -14.077 2.037 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.509 -13.258 -0.027 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.620 -14.622 0.692 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.013 -12.961 0.889 1.00 0.00 H new ATOM 586 N THR A 41 9.401 -11.718 1.775 1.00 0.00 N ATOM 587 CA THR A 41 9.976 -10.382 1.870 1.00 0.00 C ATOM 588 C THR A 41 9.577 -9.526 0.673 1.00 0.00 C ATOM 589 O THR A 41 10.158 -9.639 -0.407 1.00 0.00 O ATOM 590 CB THR A 41 11.513 -10.436 1.958 1.00 0.00 C ATOM 591 OG1 THR A 41 11.911 -11.253 3.065 1.00 0.00 O ATOM 592 CG2 THR A 41 12.095 -9.040 2.116 1.00 0.00 C ATOM 0 H THR A 41 9.996 -12.401 1.305 1.00 0.00 H new ATOM 0 HA THR A 41 9.583 -9.933 2.782 1.00 0.00 H new ATOM 0 HB THR A 41 11.894 -10.868 1.033 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.889 -11.284 3.114 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.181 -9.103 2.176 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.814 -8.429 1.258 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.707 -8.585 3.028 1.00 0.00 H new ATOM 600 N THR A 42 8.582 -8.667 0.871 1.00 0.00 N ATOM 601 CA THR A 42 8.105 -7.791 -0.192 1.00 0.00 C ATOM 602 C THR A 42 8.282 -6.324 0.183 1.00 0.00 C ATOM 603 O THR A 42 8.194 -5.958 1.355 1.00 0.00 O ATOM 604 CB THR A 42 6.621 -8.052 -0.511 1.00 0.00 C ATOM 605 OG1 THR A 42 6.249 -7.364 -1.710 1.00 0.00 O ATOM 606 CG2 THR A 42 5.732 -7.598 0.637 1.00 0.00 C ATOM 0 H THR A 42 8.091 -8.559 1.758 1.00 0.00 H new ATOM 0 HA THR A 42 8.704 -8.012 -1.076 1.00 0.00 H new ATOM 0 HB THR A 42 6.486 -9.124 -0.651 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.683 -7.789 -2.479 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.689 -7.793 0.388 1.00 0.00 H new ATOM 0 HG22 THR A 42 5.998 -8.145 1.541 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.872 -6.530 0.805 1.00 0.00 H new ATOM 614 N ASP A 43 8.531 -5.489 -0.819 1.00 0.00 N ATOM 615 CA ASP A 43 8.719 -4.060 -0.594 1.00 0.00 C ATOM 616 C ASP A 43 8.288 -3.256 -1.817 1.00 0.00 C ATOM 617 O ASP A 43 8.466 -3.693 -2.954 1.00 0.00 O ATOM 618 CB ASP A 43 10.182 -3.762 -0.262 1.00 0.00 C ATOM 619 CG ASP A 43 11.132 -4.269 -1.329 1.00 0.00 C ATOM 620 OD1 ASP A 43 11.284 -5.503 -1.450 1.00 0.00 O ATOM 621 OD2 ASP A 43 11.723 -3.433 -2.043 1.00 0.00 O ATOM 0 H ASP A 43 8.607 -5.776 -1.795 1.00 0.00 H new ATOM 0 HA ASP A 43 8.096 -3.765 0.250 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.313 -2.686 -0.144 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.435 -4.221 0.694 1.00 0.00 H new ATOM 626 N PHE A 44 7.718 -2.080 -1.575 1.00 0.00 N ATOM 627 CA PHE A 44 7.259 -1.216 -2.656 1.00 0.00 C ATOM 628 C PHE A 44 8.095 0.059 -2.726 1.00 0.00 C ATOM 629 O PHE A 44 8.960 0.295 -1.882 1.00 0.00 O ATOM 630 CB PHE A 44 5.783 -0.862 -2.463 1.00 0.00 C ATOM 631 CG PHE A 44 5.477 -0.287 -1.110 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.458 -1.097 0.014 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.209 1.065 -0.961 1.00 0.00 C ATOM 634 CE1 PHE A 44 5.176 -0.570 1.260 1.00 0.00 C ATOM 635 CE2 PHE A 44 4.926 1.597 0.282 1.00 0.00 C ATOM 636 CZ PHE A 44 4.911 0.778 1.395 1.00 0.00 C ATOM 0 H PHE A 44 7.563 -1.704 -0.640 1.00 0.00 H new ATOM 0 HA PHE A 44 7.376 -1.758 -3.595 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.486 -0.146 -3.229 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.180 -1.758 -2.613 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.666 -2.152 -0.085 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.222 1.710 -1.827 1.00 0.00 H new ATOM 0 HE1 PHE A 44 5.163 -1.213 2.128 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.717 2.652 0.384 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.692 1.192 2.368 1.00 0.00 H new ATOM 646 N THR A 45 7.831 0.878 -3.739 1.00 0.00 N ATOM 647 CA THR A 45 8.559 2.128 -3.921 1.00 0.00 C ATOM 648 C THR A 45 7.602 3.296 -4.128 1.00 0.00 C ATOM 649 O THR A 45 6.683 3.222 -4.944 1.00 0.00 O ATOM 650 CB THR A 45 9.521 2.048 -5.121 1.00 0.00 C ATOM 651 OG1 THR A 45 10.302 0.850 -5.044 1.00 0.00 O ATOM 652 CG2 THR A 45 10.441 3.258 -5.158 1.00 0.00 C ATOM 0 H THR A 45 7.118 0.698 -4.446 1.00 0.00 H new ATOM 0 HA THR A 45 9.137 2.293 -3.012 1.00 0.00 H new ATOM 0 HB THR A 45 8.927 2.035 -6.035 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.292 0.512 -4.124 1.00 0.00 H new ATOM 0 HG21 THR A 45 11.111 3.179 -6.014 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.845 4.166 -5.246 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.028 3.297 -4.240 1.00 0.00 H new ATOM 660 N VAL A 46 7.823 4.376 -3.385 1.00 0.00 N ATOM 661 CA VAL A 46 6.981 5.561 -3.489 1.00 0.00 C ATOM 662 C VAL A 46 7.693 6.676 -4.247 1.00 0.00 C ATOM 663 O VAL A 46 8.673 7.242 -3.763 1.00 0.00 O ATOM 664 CB VAL A 46 6.570 6.082 -2.099 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.764 7.365 -2.225 1.00 0.00 C ATOM 666 CG2 VAL A 46 5.783 5.021 -1.344 1.00 0.00 C ATOM 0 H VAL A 46 8.579 4.454 -2.704 1.00 0.00 H new ATOM 0 HA VAL A 46 6.086 5.266 -4.037 1.00 0.00 H new ATOM 0 HB VAL A 46 7.474 6.304 -1.532 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.483 7.717 -1.232 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.366 8.125 -2.723 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.864 7.174 -2.810 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.501 5.406 -0.364 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.885 4.766 -1.906 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.399 4.130 -1.220 1.00 0.00 H new ATOM 676 N ASP A 47 7.193 6.987 -5.438 1.00 0.00 N ATOM 677 CA ASP A 47 7.780 8.037 -6.263 1.00 0.00 C ATOM 678 C ASP A 47 7.238 9.407 -5.867 1.00 0.00 C ATOM 679 O ASP A 47 6.028 9.593 -5.736 1.00 0.00 O ATOM 680 CB ASP A 47 7.496 7.770 -7.742 1.00 0.00 C ATOM 681 CG ASP A 47 8.589 8.303 -8.647 1.00 0.00 C ATOM 682 OD1 ASP A 47 8.747 9.540 -8.721 1.00 0.00 O ATOM 683 OD2 ASP A 47 9.287 7.484 -9.281 1.00 0.00 O ATOM 0 H ASP A 47 6.383 6.527 -5.854 1.00 0.00 H new ATOM 0 HA ASP A 47 8.858 8.033 -6.101 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.388 6.697 -7.900 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.546 8.229 -8.015 1.00 0.00 H new ATOM 688 N SER A 48 8.142 10.362 -5.675 1.00 0.00 N ATOM 689 CA SER A 48 7.756 11.714 -5.289 1.00 0.00 C ATOM 690 C SER A 48 8.453 12.750 -6.166 1.00 0.00 C ATOM 691 O SER A 48 9.675 12.735 -6.310 1.00 0.00 O ATOM 692 CB SER A 48 8.095 11.963 -3.818 1.00 0.00 C ATOM 693 OG SER A 48 9.421 11.559 -3.525 1.00 0.00 O ATOM 0 H SER A 48 9.147 10.224 -5.780 1.00 0.00 H new ATOM 0 HA SER A 48 6.679 11.812 -5.428 1.00 0.00 H new ATOM 0 HB2 SER A 48 7.975 13.022 -3.588 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.397 11.418 -3.183 1.00 0.00 H new ATOM 0 HG SER A 48 9.911 11.413 -4.361 1.00 0.00 H new ATOM 699 N ARG A 49 7.665 13.647 -6.750 1.00 0.00 N ATOM 700 CA ARG A 49 8.205 14.690 -7.614 1.00 0.00 C ATOM 701 C ARG A 49 7.930 16.074 -7.033 1.00 0.00 C ATOM 702 O ARG A 49 8.830 16.763 -6.553 1.00 0.00 O ATOM 703 CB ARG A 49 7.601 14.584 -9.015 1.00 0.00 C ATOM 704 CG ARG A 49 8.467 13.808 -9.994 1.00 0.00 C ATOM 705 CD ARG A 49 7.638 13.222 -11.127 1.00 0.00 C ATOM 706 NE ARG A 49 7.620 14.093 -12.299 1.00 0.00 N ATOM 707 CZ ARG A 49 8.565 14.089 -13.232 1.00 0.00 C ATOM 708 NH1 ARG A 49 9.598 13.265 -13.131 1.00 0.00 N ATOM 709 NH2 ARG A 49 8.478 14.912 -14.270 1.00 0.00 N ATOM 0 H ARG A 49 6.651 13.672 -6.641 1.00 0.00 H new ATOM 0 HA ARG A 49 9.284 14.550 -7.679 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.625 14.103 -8.945 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.434 15.587 -9.407 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.233 14.466 -10.405 1.00 0.00 H new ATOM 0 HG3 ARG A 49 8.984 13.006 -9.467 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.041 12.248 -11.405 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.617 13.058 -10.782 1.00 0.00 H new ATOM 0 HE ARG A 49 6.839 14.740 -12.407 1.00 0.00 H new ATOM 0 HH11 ARG A 49 9.669 12.631 -12.335 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.322 13.264 -13.849 1.00 0.00 H new ATOM 0 HH21 ARG A 49 7.685 15.548 -14.351 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.204 14.908 -14.986 1.00 0.00 H new ATOM 723 N PRO A 50 6.656 16.492 -7.077 1.00 0.00 N ATOM 724 CA PRO A 50 6.233 17.796 -6.559 1.00 0.00 C ATOM 725 C PRO A 50 6.307 17.869 -5.038 1.00 0.00 C ATOM 726 O PRO A 50 5.889 18.856 -4.432 1.00 0.00 O ATOM 727 CB PRO A 50 4.781 17.910 -7.030 1.00 0.00 C ATOM 728 CG PRO A 50 4.323 16.502 -7.192 1.00 0.00 C ATOM 729 CD PRO A 50 5.531 15.723 -7.634 1.00 0.00 C ATOM 0 HA PRO A 50 6.875 18.602 -6.913 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.170 18.444 -6.302 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.711 18.459 -7.969 1.00 0.00 H new ATOM 0 HG2 PRO A 50 3.927 16.110 -6.255 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.523 16.434 -7.929 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.513 14.703 -7.251 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.590 15.655 -8.720 1.00 0.00 H new ATOM 737 N LEU A 51 6.841 16.817 -4.426 1.00 0.00 N ATOM 738 CA LEU A 51 6.971 16.762 -2.974 1.00 0.00 C ATOM 739 C LEU A 51 8.438 16.770 -2.558 1.00 0.00 C ATOM 740 O LEU A 51 8.801 17.345 -1.531 1.00 0.00 O ATOM 741 CB LEU A 51 6.280 15.510 -2.428 1.00 0.00 C ATOM 742 CG LEU A 51 4.888 15.214 -2.987 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.233 14.081 -2.213 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.020 16.463 -2.944 1.00 0.00 C ATOM 0 H LEU A 51 7.191 15.991 -4.912 1.00 0.00 H new ATOM 0 HA LEU A 51 6.490 17.646 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.920 14.650 -2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.202 15.606 -1.345 1.00 0.00 H new ATOM 0 HG LEU A 51 4.993 14.904 -4.027 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.243 13.884 -2.624 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.845 13.183 -2.295 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.140 14.363 -1.164 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.033 16.234 -3.346 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.922 16.803 -1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.482 17.248 -3.543 1.00 0.00 H new ATOM 756 N THR A 52 9.280 16.128 -3.362 1.00 0.00 N ATOM 757 CA THR A 52 10.708 16.062 -3.079 1.00 0.00 C ATOM 758 C THR A 52 11.488 15.575 -4.294 1.00 0.00 C ATOM 759 O THR A 52 10.954 14.854 -5.137 1.00 0.00 O ATOM 760 CB THR A 52 11.001 15.130 -1.888 1.00 0.00 C ATOM 761 OG1 THR A 52 12.381 15.228 -1.518 1.00 0.00 O ATOM 762 CG2 THR A 52 10.664 13.688 -2.233 1.00 0.00 C ATOM 0 H THR A 52 8.997 15.646 -4.215 1.00 0.00 H new ATOM 0 HA THR A 52 11.028 17.073 -2.828 1.00 0.00 H new ATOM 0 HB THR A 52 10.377 15.441 -1.050 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.526 14.762 -0.668 1.00 0.00 H new ATOM 0 HG21 THR A 52 10.879 13.049 -1.377 1.00 0.00 H new ATOM 0 HG22 THR A 52 9.606 13.612 -2.486 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.264 13.368 -3.085 1.00 0.00 H new ATOM 770 N GLN A 53 12.753 15.974 -4.378 1.00 0.00 N ATOM 771 CA GLN A 53 13.606 15.577 -5.492 1.00 0.00 C ATOM 772 C GLN A 53 14.833 14.820 -4.995 1.00 0.00 C ATOM 773 O GLN A 53 15.371 13.961 -5.694 1.00 0.00 O ATOM 774 CB GLN A 53 14.040 16.806 -6.293 1.00 0.00 C ATOM 775 CG GLN A 53 12.892 17.508 -7.000 1.00 0.00 C ATOM 776 CD GLN A 53 12.249 18.582 -6.146 1.00 0.00 C ATOM 777 OE1 GLN A 53 12.902 19.545 -5.743 1.00 0.00 O ATOM 778 NE2 GLN A 53 10.961 18.423 -5.864 1.00 0.00 N ATOM 0 H GLN A 53 13.210 16.571 -3.689 1.00 0.00 H new ATOM 0 HA GLN A 53 13.031 14.915 -6.139 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.529 17.512 -5.622 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.781 16.504 -7.033 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.259 17.955 -7.924 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.138 16.772 -7.279 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.458 17.610 -6.219 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.475 19.114 -5.293 1.00 0.00 H new ATOM 787 N VAL A 54 15.273 15.145 -3.783 1.00 0.00 N ATOM 788 CA VAL A 54 16.436 14.496 -3.192 1.00 0.00 C ATOM 789 C VAL A 54 16.032 13.592 -2.033 1.00 0.00 C ATOM 790 O VAL A 54 16.759 13.464 -1.049 1.00 0.00 O ATOM 791 CB VAL A 54 17.461 15.530 -2.689 1.00 0.00 C ATOM 792 CG1 VAL A 54 17.911 16.433 -3.827 1.00 0.00 C ATOM 793 CG2 VAL A 54 16.876 16.347 -1.548 1.00 0.00 C ATOM 0 H VAL A 54 14.841 15.855 -3.192 1.00 0.00 H new ATOM 0 HA VAL A 54 16.894 13.893 -3.976 1.00 0.00 H new ATOM 0 HB VAL A 54 18.335 14.997 -2.313 1.00 0.00 H new ATOM 0 HG11 VAL A 54 18.635 17.157 -3.453 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.372 15.830 -4.609 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.049 16.960 -4.236 1.00 0.00 H new ATOM 0 HG21 VAL A 54 17.613 17.073 -1.205 1.00 0.00 H new ATOM 0 HG22 VAL A 54 15.985 16.871 -1.895 1.00 0.00 H new ATOM 0 HG23 VAL A 54 16.609 15.684 -0.725 1.00 0.00 H new ATOM 803 N GLY A 55 14.865 12.967 -2.156 1.00 0.00 N ATOM 804 CA GLY A 55 14.383 12.082 -1.112 1.00 0.00 C ATOM 805 C GLY A 55 14.222 12.790 0.219 1.00 0.00 C ATOM 806 O GLY A 55 14.926 13.758 0.504 1.00 0.00 O ATOM 0 H GLY A 55 14.245 13.058 -2.961 1.00 0.00 H new ATOM 0 HA2 GLY A 55 13.425 11.658 -1.413 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.077 11.250 -0.996 1.00 0.00 H new ATOM 810 N GLY A 56 13.290 12.308 1.036 1.00 0.00 N ATOM 811 CA GLY A 56 13.054 12.914 2.333 1.00 0.00 C ATOM 812 C GLY A 56 12.835 11.885 3.423 1.00 0.00 C ATOM 813 O GLY A 56 13.024 10.688 3.203 1.00 0.00 O ATOM 0 H GLY A 56 12.694 11.508 0.822 1.00 0.00 H new ATOM 0 HA2 GLY A 56 13.904 13.543 2.597 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.182 13.566 2.273 1.00 0.00 H new ATOM 817 N ASP A 57 12.438 12.349 4.603 1.00 0.00 N ATOM 818 CA ASP A 57 12.194 11.460 5.732 1.00 0.00 C ATOM 819 C ASP A 57 10.890 11.821 6.436 1.00 0.00 C ATOM 820 O ASP A 57 10.835 11.897 7.664 1.00 0.00 O ATOM 821 CB ASP A 57 13.358 11.527 6.722 1.00 0.00 C ATOM 822 CG ASP A 57 14.706 11.408 6.040 1.00 0.00 C ATOM 823 OD1 ASP A 57 15.151 10.266 5.799 1.00 0.00 O ATOM 824 OD2 ASP A 57 15.317 12.457 5.746 1.00 0.00 O ATOM 0 H ASP A 57 12.278 13.337 4.802 1.00 0.00 H new ATOM 0 HA ASP A 57 12.110 10.443 5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 57 13.313 12.469 7.268 1.00 0.00 H new ATOM 0 HB3 ASP A 57 13.254 10.728 7.456 1.00 0.00 H new ATOM 829 N HIS A 58 9.841 12.043 5.650 1.00 0.00 N ATOM 830 CA HIS A 58 8.536 12.396 6.198 1.00 0.00 C ATOM 831 C HIS A 58 7.470 11.404 5.745 1.00 0.00 C ATOM 832 O HIS A 58 6.300 11.760 5.598 1.00 0.00 O ATOM 833 CB HIS A 58 8.147 13.812 5.771 1.00 0.00 C ATOM 834 CG HIS A 58 8.637 14.875 6.705 1.00 0.00 C ATOM 835 ND1 HIS A 58 7.818 15.853 7.228 1.00 0.00 N ATOM 836 CD2 HIS A 58 9.871 15.110 7.210 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.527 16.645 8.013 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.776 16.215 8.020 1.00 0.00 N ATOM 0 H HIS A 58 9.869 11.985 4.632 1.00 0.00 H new ATOM 0 HA HIS A 58 8.603 12.358 7.285 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.544 14.004 4.774 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.061 13.876 5.699 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.764 14.535 7.013 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.150 17.499 8.556 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.545 16.635 8.542 1.00 0.00 H new ATOM 846 N ILE A 59 7.881 10.160 5.525 1.00 0.00 N ATOM 847 CA ILE A 59 6.961 9.117 5.089 1.00 0.00 C ATOM 848 C ILE A 59 6.628 8.165 6.232 1.00 0.00 C ATOM 849 O ILE A 59 7.463 7.898 7.097 1.00 0.00 O ATOM 850 CB ILE A 59 7.543 8.308 3.915 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.795 9.221 2.713 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.603 7.173 3.536 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.541 9.876 2.178 1.00 0.00 C ATOM 0 H ILE A 59 8.846 9.850 5.642 1.00 0.00 H new ATOM 0 HA ILE A 59 6.050 9.617 4.759 1.00 0.00 H new ATOM 0 HB ILE A 59 8.495 7.877 4.227 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.506 9.996 2.999 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.260 8.640 1.917 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.028 6.611 2.705 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.469 6.511 4.391 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.638 7.584 3.240 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.795 10.508 1.327 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.836 9.108 1.861 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.087 10.485 2.960 1.00 0.00 H new ATOM 865 N LYS A 60 5.402 7.653 6.230 1.00 0.00 N ATOM 866 CA LYS A 60 4.957 6.727 7.265 1.00 0.00 C ATOM 867 C LYS A 60 3.947 5.730 6.705 1.00 0.00 C ATOM 868 O LYS A 60 3.041 6.102 5.960 1.00 0.00 O ATOM 869 CB LYS A 60 4.336 7.496 8.434 1.00 0.00 C ATOM 870 CG LYS A 60 3.678 6.601 9.469 1.00 0.00 C ATOM 871 CD LYS A 60 3.307 7.377 10.722 1.00 0.00 C ATOM 872 CE LYS A 60 2.973 6.445 11.877 1.00 0.00 C ATOM 873 NZ LYS A 60 2.437 7.187 13.051 1.00 0.00 N ATOM 0 H LYS A 60 4.698 7.864 5.523 1.00 0.00 H new ATOM 0 HA LYS A 60 5.827 6.175 7.622 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.110 8.090 8.919 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.595 8.194 8.046 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.783 6.147 9.043 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.355 5.787 9.731 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.134 8.028 11.006 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.452 8.020 10.513 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.241 5.707 11.548 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.868 5.897 12.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.222 6.517 13.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.145 7.873 13.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.569 7.690 12.777 1.00 0.00 H new ATOM 887 N ALA A 61 4.110 4.462 7.070 1.00 0.00 N ATOM 888 CA ALA A 61 3.210 3.413 6.608 1.00 0.00 C ATOM 889 C ALA A 61 2.776 2.514 7.760 1.00 0.00 C ATOM 890 O ALA A 61 3.503 2.350 8.741 1.00 0.00 O ATOM 891 CB ALA A 61 3.877 2.590 5.516 1.00 0.00 C ATOM 0 H ALA A 61 4.857 4.137 7.684 1.00 0.00 H new ATOM 0 HA ALA A 61 2.319 3.888 6.198 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.194 1.810 5.180 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.130 3.237 4.676 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.785 2.133 5.909 1.00 0.00 H new ATOM 897 N HIS A 62 1.587 1.934 7.637 1.00 0.00 N ATOM 898 CA HIS A 62 1.056 1.051 8.670 1.00 0.00 C ATOM 899 C HIS A 62 0.225 -0.070 8.052 1.00 0.00 C ATOM 900 O HIS A 62 -0.826 0.178 7.459 1.00 0.00 O ATOM 901 CB HIS A 62 0.205 1.845 9.662 1.00 0.00 C ATOM 902 CG HIS A 62 -0.243 1.041 10.843 1.00 0.00 C ATOM 903 ND1 HIS A 62 -0.849 -0.167 10.914 1.00 0.00 N flip ATOM 904 CD2 HIS A 62 -0.085 1.466 12.146 1.00 0.00 C flip ATOM 905 CE1 HIS A 62 -1.043 -0.448 12.244 1.00 0.00 C flip ATOM 906 NE2 HIS A 62 -0.573 0.553 12.966 1.00 0.00 N flip ATOM 0 H HIS A 62 0.973 2.059 6.833 1.00 0.00 H new ATOM 0 HA HIS A 62 1.898 0.606 9.200 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.777 2.704 10.013 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.671 2.236 9.145 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.367 2.399 12.448 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.505 -1.342 12.636 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.585 0.611 13.984 1.00 0.00 H new ATOM 914 N ILE A 63 0.703 -1.302 8.193 1.00 0.00 N ATOM 915 CA ILE A 63 0.004 -2.459 7.649 1.00 0.00 C ATOM 916 C ILE A 63 -1.032 -2.989 8.635 1.00 0.00 C ATOM 917 O ILE A 63 -0.811 -2.983 9.846 1.00 0.00 O ATOM 918 CB ILE A 63 0.984 -3.592 7.293 1.00 0.00 C ATOM 919 CG1 ILE A 63 2.060 -3.083 6.332 1.00 0.00 C ATOM 920 CG2 ILE A 63 0.235 -4.768 6.683 1.00 0.00 C ATOM 921 CD1 ILE A 63 3.344 -3.880 6.385 1.00 0.00 C ATOM 0 H ILE A 63 1.572 -1.524 8.679 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.499 -2.126 6.741 1.00 0.00 H new ATOM 0 HB ILE A 63 1.471 -3.931 8.207 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.668 -3.108 5.315 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.279 -2.041 6.564 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.941 -5.561 6.437 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.497 -5.143 7.398 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.276 -4.443 5.777 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.061 -3.463 5.678 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.759 -3.835 7.392 1.00 0.00 H new ATOM 0 HD13 ILE A 63 3.139 -4.918 6.124 1.00 0.00 H new ATOM 933 N ALA A 64 -2.162 -3.448 8.108 1.00 0.00 N ATOM 934 CA ALA A 64 -3.230 -3.986 8.941 1.00 0.00 C ATOM 935 C ALA A 64 -3.788 -5.277 8.352 1.00 0.00 C ATOM 936 O ALA A 64 -4.399 -5.271 7.285 1.00 0.00 O ATOM 937 CB ALA A 64 -4.339 -2.957 9.106 1.00 0.00 C ATOM 0 H ALA A 64 -2.362 -3.458 7.108 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.812 -4.215 9.921 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.130 -3.372 9.730 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.936 -2.061 9.578 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.746 -2.700 8.128 1.00 0.00 H new ATOM 943 N ASN A 65 -3.573 -6.384 9.056 1.00 0.00 N ATOM 944 CA ASN A 65 -4.054 -7.684 8.602 1.00 0.00 C ATOM 945 C ASN A 65 -5.576 -7.759 8.679 1.00 0.00 C ATOM 946 O ASN A 65 -6.220 -7.032 9.435 1.00 0.00 O ATOM 947 CB ASN A 65 -3.434 -8.802 9.443 1.00 0.00 C ATOM 948 CG ASN A 65 -1.998 -9.093 9.051 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.207 -9.563 10.008 1.00 0.00 O flip ATOM 950 ND2 ASN A 65 -1.605 -8.897 7.900 1.00 0.00 N flip ATOM 0 H ASN A 65 -3.069 -6.407 9.943 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.754 -7.811 7.562 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.471 -8.524 10.496 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -4.029 -9.709 9.332 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -2.248 -8.534 7.196 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.636 -9.097 7.651 1.00 0.00 H new ATOM 957 N PRO A 66 -6.165 -8.659 7.878 1.00 0.00 N ATOM 958 CA PRO A 66 -7.618 -8.851 7.837 1.00 0.00 C ATOM 959 C PRO A 66 -8.154 -9.490 9.114 1.00 0.00 C ATOM 960 O PRO A 66 -9.356 -9.719 9.247 1.00 0.00 O ATOM 961 CB PRO A 66 -7.818 -9.789 6.645 1.00 0.00 C ATOM 962 CG PRO A 66 -6.528 -10.524 6.520 1.00 0.00 C ATOM 963 CD PRO A 66 -5.459 -9.559 6.951 1.00 0.00 C ATOM 0 HA PRO A 66 -8.152 -7.905 7.747 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.649 -10.474 6.815 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.046 -9.231 5.736 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.525 -11.416 7.147 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.365 -10.855 5.494 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.630 -10.070 7.441 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.042 -9.016 6.103 1.00 0.00 H new ATOM 971 N SER A 67 -7.254 -9.775 10.050 1.00 0.00 N ATOM 972 CA SER A 67 -7.637 -10.391 11.315 1.00 0.00 C ATOM 973 C SER A 67 -7.523 -9.391 12.463 1.00 0.00 C ATOM 974 O SER A 67 -8.200 -9.519 13.482 1.00 0.00 O ATOM 975 CB SER A 67 -6.760 -11.612 11.599 1.00 0.00 C ATOM 976 OG SER A 67 -7.048 -12.667 10.698 1.00 0.00 O ATOM 0 H SER A 67 -6.255 -9.589 9.956 1.00 0.00 H new ATOM 0 HA SER A 67 -8.676 -10.710 11.235 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.709 -11.336 11.516 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.921 -11.950 12.623 1.00 0.00 H new ATOM 0 HG SER A 67 -6.473 -13.435 10.899 1.00 0.00 H new ATOM 982 N GLY A 68 -6.661 -8.395 12.288 1.00 0.00 N ATOM 983 CA GLY A 68 -6.473 -7.388 13.315 1.00 0.00 C ATOM 984 C GLY A 68 -5.009 -7.106 13.590 1.00 0.00 C ATOM 985 O GLY A 68 -4.642 -5.988 13.950 1.00 0.00 O ATOM 0 H GLY A 68 -6.089 -8.267 11.453 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.966 -6.465 13.009 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.955 -7.718 14.235 1.00 0.00 H new ATOM 989 N ALA A 69 -4.170 -8.124 13.422 1.00 0.00 N ATOM 990 CA ALA A 69 -2.739 -7.980 13.655 1.00 0.00 C ATOM 991 C ALA A 69 -2.143 -6.897 12.762 1.00 0.00 C ATOM 992 O ALA A 69 -2.765 -6.470 11.789 1.00 0.00 O ATOM 993 CB ALA A 69 -2.030 -9.307 13.421 1.00 0.00 C ATOM 0 H ALA A 69 -4.457 -9.057 13.125 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.594 -7.680 14.693 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.962 -9.185 13.599 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.428 -10.058 14.104 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.192 -9.630 12.393 1.00 0.00 H new ATOM 999 N SER A 70 -0.936 -6.455 13.100 1.00 0.00 N ATOM 1000 CA SER A 70 -0.259 -5.417 12.332 1.00 0.00 C ATOM 1001 C SER A 70 1.143 -5.865 11.932 1.00 0.00 C ATOM 1002 O SER A 70 1.912 -6.355 12.760 1.00 0.00 O ATOM 1003 CB SER A 70 -0.181 -4.121 13.142 1.00 0.00 C ATOM 1004 OG SER A 70 0.325 -4.363 14.443 1.00 0.00 O ATOM 0 H SER A 70 -0.407 -6.800 13.901 1.00 0.00 H new ATOM 0 HA SER A 70 -0.837 -5.236 11.426 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.459 -3.404 12.627 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.172 -3.672 13.211 1.00 0.00 H new ATOM 0 HG SER A 70 1.078 -4.988 14.390 1.00 0.00 H new ATOM 1010 N THR A 71 1.471 -5.694 10.654 1.00 0.00 N ATOM 1011 CA THR A 71 2.779 -6.081 10.142 1.00 0.00 C ATOM 1012 C THR A 71 3.775 -4.932 10.254 1.00 0.00 C ATOM 1013 O THR A 71 3.446 -3.784 9.960 1.00 0.00 O ATOM 1014 CB THR A 71 2.696 -6.532 8.672 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.670 -7.519 8.520 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.027 -7.102 8.205 1.00 0.00 C ATOM 0 H THR A 71 0.848 -5.290 9.955 1.00 0.00 H new ATOM 0 HA THR A 71 3.122 -6.917 10.752 1.00 0.00 H new ATOM 0 HB THR A 71 2.457 -5.662 8.061 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.622 -7.799 7.582 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.944 -7.414 7.164 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.801 -6.340 8.295 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.291 -7.961 8.821 1.00 0.00 H new ATOM 1024 N GLU A 72 4.993 -5.251 10.680 1.00 0.00 N ATOM 1025 CA GLU A 72 6.037 -4.243 10.830 1.00 0.00 C ATOM 1026 C GLU A 72 6.574 -3.810 9.469 1.00 0.00 C ATOM 1027 O GLU A 72 6.868 -4.644 8.612 1.00 0.00 O ATOM 1028 CB GLU A 72 7.179 -4.784 11.693 1.00 0.00 C ATOM 1029 CG GLU A 72 8.048 -3.697 12.304 1.00 0.00 C ATOM 1030 CD GLU A 72 9.101 -4.252 13.243 1.00 0.00 C ATOM 1031 OE1 GLU A 72 8.819 -5.262 13.920 1.00 0.00 O ATOM 1032 OE2 GLU A 72 10.208 -3.676 13.300 1.00 0.00 O ATOM 0 H GLU A 72 5.281 -6.198 10.927 1.00 0.00 H new ATOM 0 HA GLU A 72 5.600 -3.374 11.322 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.761 -5.395 12.493 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.804 -5.438 11.085 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.536 -3.136 11.507 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.416 -2.994 12.847 1.00 0.00 H new ATOM 1039 N CYS A 73 6.700 -2.501 9.279 1.00 0.00 N ATOM 1040 CA CYS A 73 7.201 -1.956 8.022 1.00 0.00 C ATOM 1041 C CYS A 73 8.468 -1.138 8.251 1.00 0.00 C ATOM 1042 O CYS A 73 8.619 -0.483 9.282 1.00 0.00 O ATOM 1043 CB CYS A 73 6.132 -1.088 7.357 1.00 0.00 C ATOM 1044 SG CYS A 73 5.632 0.348 8.336 1.00 0.00 S ATOM 0 H CYS A 73 6.462 -1.798 9.979 1.00 0.00 H new ATOM 0 HA CYS A 73 7.443 -2.790 7.363 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.507 -0.744 6.393 1.00 0.00 H new ATOM 0 HB3 CYS A 73 5.254 -1.702 7.157 1.00 0.00 H new ATOM 0 HG CYS A 73 4.351 0.531 8.215 1.00 0.00 H new ATOM 1050 N PHE A 74 9.377 -1.181 7.282 1.00 0.00 N ATOM 1051 CA PHE A 74 10.632 -0.446 7.379 1.00 0.00 C ATOM 1052 C PHE A 74 10.792 0.514 6.204 1.00 0.00 C ATOM 1053 O PHE A 74 11.012 0.092 5.068 1.00 0.00 O ATOM 1054 CB PHE A 74 11.814 -1.417 7.423 1.00 0.00 C ATOM 1055 CG PHE A 74 11.764 -2.370 8.584 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.756 -3.316 8.677 1.00 0.00 C ATOM 1057 CD2 PHE A 74 12.725 -2.319 9.581 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.707 -4.194 9.743 1.00 0.00 C ATOM 1059 CE2 PHE A 74 12.681 -3.195 10.649 1.00 0.00 C ATOM 1060 CZ PHE A 74 11.671 -4.133 10.731 1.00 0.00 C ATOM 0 H PHE A 74 9.267 -1.717 6.421 1.00 0.00 H new ATOM 0 HA PHE A 74 10.613 0.135 8.301 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.839 -1.988 6.495 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.741 -0.846 7.471 1.00 0.00 H new ATOM 0 HD1 PHE A 74 10.000 -3.368 7.908 1.00 0.00 H new ATOM 0 HD2 PHE A 74 13.517 -1.587 9.523 1.00 0.00 H new ATOM 0 HE1 PHE A 74 9.916 -4.927 9.804 1.00 0.00 H new ATOM 0 HE2 PHE A 74 13.436 -3.146 11.419 1.00 0.00 H new ATOM 0 HZ PHE A 74 11.635 -4.817 11.566 1.00 0.00 H new ATOM 1070 N VAL A 75 10.680 1.808 6.485 1.00 0.00 N ATOM 1071 CA VAL A 75 10.812 2.829 5.453 1.00 0.00 C ATOM 1072 C VAL A 75 12.277 3.169 5.201 1.00 0.00 C ATOM 1073 O VAL A 75 13.050 3.367 6.138 1.00 0.00 O ATOM 1074 CB VAL A 75 10.056 4.116 5.836 1.00 0.00 C ATOM 1075 CG1 VAL A 75 10.246 5.184 4.770 1.00 0.00 C ATOM 1076 CG2 VAL A 75 8.579 3.821 6.050 1.00 0.00 C ATOM 0 H VAL A 75 10.498 2.174 7.419 1.00 0.00 H new ATOM 0 HA VAL A 75 10.375 2.418 4.543 1.00 0.00 H new ATOM 0 HB VAL A 75 10.467 4.494 6.772 1.00 0.00 H new ATOM 0 HG11 VAL A 75 9.705 6.085 5.058 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.307 5.414 4.670 1.00 0.00 H new ATOM 0 HG13 VAL A 75 9.863 4.819 3.817 1.00 0.00 H new ATOM 0 HG21 VAL A 75 8.060 4.741 6.320 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.151 3.419 5.131 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.466 3.092 6.852 1.00 0.00 H new ATOM 1086 N THR A 76 12.652 3.236 3.927 1.00 0.00 N ATOM 1087 CA THR A 76 14.025 3.552 3.551 1.00 0.00 C ATOM 1088 C THR A 76 14.063 4.572 2.419 1.00 0.00 C ATOM 1089 O THR A 76 13.579 4.309 1.317 1.00 0.00 O ATOM 1090 CB THR A 76 14.792 2.289 3.116 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.792 1.327 4.176 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.225 2.632 2.735 1.00 0.00 C ATOM 0 H THR A 76 12.025 3.076 3.139 1.00 0.00 H new ATOM 0 HA THR A 76 14.506 3.974 4.433 1.00 0.00 H new ATOM 0 HB THR A 76 14.291 1.868 2.244 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.280 0.526 3.891 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.748 1.725 2.431 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.222 3.343 1.909 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.733 3.074 3.592 1.00 0.00 H new ATOM 1100 N ASP A 77 14.643 5.735 2.696 1.00 0.00 N ATOM 1101 CA ASP A 77 14.746 6.794 1.699 1.00 0.00 C ATOM 1102 C ASP A 77 15.998 6.616 0.845 1.00 0.00 C ATOM 1103 O ASP A 77 17.115 6.597 1.361 1.00 0.00 O ATOM 1104 CB ASP A 77 14.768 8.163 2.379 1.00 0.00 C ATOM 1105 CG ASP A 77 14.994 9.295 1.396 1.00 0.00 C ATOM 1106 OD1 ASP A 77 14.129 9.500 0.518 1.00 0.00 O ATOM 1107 OD2 ASP A 77 16.035 9.976 1.504 1.00 0.00 O ATOM 0 H ASP A 77 15.049 5.968 3.602 1.00 0.00 H new ATOM 0 HA ASP A 77 13.873 6.734 1.049 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.824 8.322 2.900 1.00 0.00 H new ATOM 0 HB3 ASP A 77 15.555 8.178 3.133 1.00 0.00 H new ATOM 1112 N ASN A 78 15.803 6.485 -0.463 1.00 0.00 N ATOM 1113 CA ASN A 78 16.916 6.307 -1.388 1.00 0.00 C ATOM 1114 C ASN A 78 17.627 7.633 -1.646 1.00 0.00 C ATOM 1115 O ASN A 78 18.632 7.682 -2.353 1.00 0.00 O ATOM 1116 CB ASN A 78 16.419 5.717 -2.709 1.00 0.00 C ATOM 1117 CG ASN A 78 16.013 4.262 -2.576 1.00 0.00 C ATOM 1118 OD1 ASN A 78 14.746 4.029 -2.256 1.00 0.00 O flip ATOM 1119 ND2 ASN A 78 16.829 3.359 -2.760 1.00 0.00 N flip ATOM 0 H ASN A 78 14.884 6.499 -0.906 1.00 0.00 H new ATOM 0 HA ASN A 78 17.626 5.616 -0.934 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.568 6.298 -3.066 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.203 5.805 -3.461 1.00 0.00 H new ATOM 0 HD21 ASN A 78 17.793 3.585 -3.005 1.00 0.00 H new ATOM 0 HD22 ASN A 78 16.541 2.385 -2.668 1.00 0.00 H new ATOM 1126 N ALA A 79 17.097 8.704 -1.065 1.00 0.00 N ATOM 1127 CA ALA A 79 17.681 10.030 -1.229 1.00 0.00 C ATOM 1128 C ALA A 79 17.706 10.441 -2.697 1.00 0.00 C ATOM 1129 O ALA A 79 18.545 11.239 -3.114 1.00 0.00 O ATOM 1130 CB ALA A 79 19.086 10.063 -0.646 1.00 0.00 C ATOM 0 H ALA A 79 16.264 8.680 -0.476 1.00 0.00 H new ATOM 0 HA ALA A 79 17.058 10.744 -0.690 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.510 11.059 -0.775 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.045 9.821 0.416 1.00 0.00 H new ATOM 0 HB3 ALA A 79 19.711 9.333 -1.161 1.00 0.00 H new ATOM 1136 N ASP A 80 16.781 9.891 -3.476 1.00 0.00 N ATOM 1137 CA ASP A 80 16.696 10.201 -4.899 1.00 0.00 C ATOM 1138 C ASP A 80 15.277 10.607 -5.283 1.00 0.00 C ATOM 1139 O ASP A 80 14.872 10.471 -6.437 1.00 0.00 O ATOM 1140 CB ASP A 80 17.139 8.997 -5.732 1.00 0.00 C ATOM 1141 CG ASP A 80 17.674 9.400 -7.092 1.00 0.00 C ATOM 1142 OD1 ASP A 80 18.716 10.087 -7.141 1.00 0.00 O ATOM 1143 OD2 ASP A 80 17.051 9.027 -8.108 1.00 0.00 O ATOM 0 H ASP A 80 16.079 9.228 -3.146 1.00 0.00 H new ATOM 0 HA ASP A 80 17.362 11.039 -5.104 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.909 8.447 -5.190 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.296 8.319 -5.863 1.00 0.00 H new ATOM 1148 N GLY A 81 14.525 11.107 -4.307 1.00 0.00 N ATOM 1149 CA GLY A 81 13.159 11.525 -4.563 1.00 0.00 C ATOM 1150 C GLY A 81 12.183 10.365 -4.530 1.00 0.00 C ATOM 1151 O GLY A 81 11.064 10.471 -5.034 1.00 0.00 O ATOM 0 H GLY A 81 14.837 11.230 -3.344 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.864 12.266 -3.820 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.107 12.012 -5.537 1.00 0.00 H new ATOM 1155 N THR A 82 12.606 9.254 -3.936 1.00 0.00 N ATOM 1156 CA THR A 82 11.763 8.069 -3.842 1.00 0.00 C ATOM 1157 C THR A 82 11.959 7.359 -2.508 1.00 0.00 C ATOM 1158 O THR A 82 13.001 7.497 -1.867 1.00 0.00 O ATOM 1159 CB THR A 82 12.056 7.079 -4.985 1.00 0.00 C ATOM 1160 OG1 THR A 82 13.448 6.743 -4.998 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.660 7.672 -6.329 1.00 0.00 C ATOM 0 H THR A 82 13.528 9.150 -3.513 1.00 0.00 H new ATOM 0 HA THR A 82 10.730 8.409 -3.921 1.00 0.00 H new ATOM 0 HB THR A 82 11.467 6.178 -4.815 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.625 6.112 -5.726 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.876 6.955 -7.121 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.594 7.899 -6.326 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.226 8.587 -6.504 1.00 0.00 H new ATOM 1169 N TYR A 83 10.952 6.598 -2.094 1.00 0.00 N ATOM 1170 CA TYR A 83 11.013 5.867 -0.834 1.00 0.00 C ATOM 1171 C TYR A 83 10.873 4.366 -1.068 1.00 0.00 C ATOM 1172 O TYR A 83 10.354 3.933 -2.096 1.00 0.00 O ATOM 1173 CB TYR A 83 9.915 6.351 0.115 1.00 0.00 C ATOM 1174 CG TYR A 83 9.854 7.856 0.251 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.084 8.621 -0.617 1.00 0.00 C ATOM 1176 CD2 TYR A 83 10.565 8.513 1.247 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.025 9.996 -0.497 1.00 0.00 C ATOM 1178 CE2 TYR A 83 10.511 9.887 1.376 1.00 0.00 C ATOM 1179 CZ TYR A 83 9.740 10.624 0.501 1.00 0.00 C ATOM 1180 OH TYR A 83 9.684 11.994 0.625 1.00 0.00 O ATOM 0 H TYR A 83 10.083 6.471 -2.613 1.00 0.00 H new ATOM 0 HA TYR A 83 11.986 6.057 -0.380 1.00 0.00 H new ATOM 0 HB2 TYR A 83 8.951 5.987 -0.242 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.077 5.912 1.099 1.00 0.00 H new ATOM 0 HD1 TYR A 83 8.522 8.132 -1.399 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.171 7.939 1.933 1.00 0.00 H new ATOM 0 HE1 TYR A 83 8.423 10.576 -1.181 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.069 10.382 2.157 1.00 0.00 H new ATOM 0 HH TYR A 83 10.243 12.277 1.378 1.00 0.00 H new ATOM 1190 N GLN A 84 11.339 3.578 -0.104 1.00 0.00 N ATOM 1191 CA GLN A 84 11.265 2.125 -0.204 1.00 0.00 C ATOM 1192 C GLN A 84 10.879 1.506 1.135 1.00 0.00 C ATOM 1193 O GLN A 84 11.609 1.625 2.120 1.00 0.00 O ATOM 1194 CB GLN A 84 12.606 1.557 -0.674 1.00 0.00 C ATOM 1195 CG GLN A 84 12.533 0.100 -1.102 1.00 0.00 C ATOM 1196 CD GLN A 84 12.217 -0.060 -2.576 1.00 0.00 C ATOM 1197 OE1 GLN A 84 11.111 -0.731 -2.876 1.00 0.00 O flip ATOM 1198 NE2 GLN A 84 12.960 0.414 -3.437 1.00 0.00 N flip ATOM 0 H GLN A 84 11.771 3.921 0.754 1.00 0.00 H new ATOM 0 HA GLN A 84 10.496 1.875 -0.934 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.972 2.155 -1.509 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.335 1.655 0.131 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.483 -0.387 -0.883 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.770 -0.410 -0.513 1.00 0.00 H new ATOM 0 HE21 GLN A 84 13.800 0.923 -3.162 1.00 0.00 H new ATOM 0 HE22 GLN A 84 12.735 0.298 -4.425 1.00 0.00 H new ATOM 1207 N VAL A 85 9.727 0.844 1.165 1.00 0.00 N ATOM 1208 CA VAL A 85 9.243 0.205 2.383 1.00 0.00 C ATOM 1209 C VAL A 85 9.162 -1.308 2.216 1.00 0.00 C ATOM 1210 O VAL A 85 8.573 -1.805 1.257 1.00 0.00 O ATOM 1211 CB VAL A 85 7.857 0.741 2.786 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.395 0.105 4.088 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.886 2.257 2.906 1.00 0.00 C ATOM 0 H VAL A 85 9.111 0.736 0.359 1.00 0.00 H new ATOM 0 HA VAL A 85 9.959 0.443 3.170 1.00 0.00 H new ATOM 0 HB VAL A 85 7.144 0.474 2.006 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.414 0.497 4.356 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.333 -0.976 3.963 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.107 0.338 4.880 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.898 2.618 3.191 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.612 2.548 3.665 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.169 2.693 1.948 1.00 0.00 H new ATOM 1223 N GLU A 86 9.758 -2.035 3.156 1.00 0.00 N ATOM 1224 CA GLU A 86 9.753 -3.492 3.111 1.00 0.00 C ATOM 1225 C GLU A 86 9.046 -4.072 4.333 1.00 0.00 C ATOM 1226 O GLU A 86 9.245 -3.609 5.457 1.00 0.00 O ATOM 1227 CB GLU A 86 11.184 -4.028 3.035 1.00 0.00 C ATOM 1228 CG GLU A 86 11.262 -5.537 2.875 1.00 0.00 C ATOM 1229 CD GLU A 86 12.623 -6.093 3.245 1.00 0.00 C ATOM 1230 OE1 GLU A 86 12.892 -6.248 4.455 1.00 0.00 O ATOM 1231 OE2 GLU A 86 13.420 -6.373 2.325 1.00 0.00 O ATOM 0 H GLU A 86 10.250 -1.639 3.957 1.00 0.00 H new ATOM 0 HA GLU A 86 9.210 -3.800 2.218 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.696 -3.555 2.197 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.720 -3.739 3.939 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.501 -6.005 3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.034 -5.801 1.842 1.00 0.00 H new ATOM 1238 N TYR A 87 8.219 -5.086 4.105 1.00 0.00 N ATOM 1239 CA TYR A 87 7.480 -5.728 5.186 1.00 0.00 C ATOM 1240 C TYR A 87 7.270 -7.211 4.898 1.00 0.00 C ATOM 1241 O TYR A 87 7.250 -7.635 3.741 1.00 0.00 O ATOM 1242 CB TYR A 87 6.129 -5.039 5.387 1.00 0.00 C ATOM 1243 CG TYR A 87 5.138 -5.317 4.279 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.313 -6.434 4.322 1.00 0.00 C ATOM 1245 CD2 TYR A 87 5.025 -4.461 3.191 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.407 -6.692 3.312 1.00 0.00 C ATOM 1247 CE2 TYR A 87 4.121 -4.710 2.177 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.314 -5.827 2.242 1.00 0.00 C ATOM 1249 OH TYR A 87 2.411 -6.079 1.234 1.00 0.00 O ATOM 0 H TYR A 87 8.043 -5.481 3.181 1.00 0.00 H new ATOM 0 HA TYR A 87 8.068 -5.635 6.099 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.702 -5.365 6.336 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.287 -3.963 5.461 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.381 -7.112 5.160 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.655 -3.585 3.137 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.775 -7.566 3.360 1.00 0.00 H new ATOM 0 HE2 TYR A 87 4.046 -4.034 1.338 1.00 0.00 H new ATOM 0 HH TYR A 87 2.403 -5.326 0.606 1.00 0.00 H new ATOM 1259 N THR A 88 7.113 -7.997 5.958 1.00 0.00 N ATOM 1260 CA THR A 88 6.905 -9.433 5.821 1.00 0.00 C ATOM 1261 C THR A 88 5.661 -9.883 6.578 1.00 0.00 C ATOM 1262 O THR A 88 5.674 -10.052 7.798 1.00 0.00 O ATOM 1263 CB THR A 88 8.120 -10.229 6.334 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.333 -9.595 5.912 1.00 0.00 O ATOM 1265 CG2 THR A 88 8.085 -11.660 5.821 1.00 0.00 C ATOM 0 H THR A 88 7.126 -7.663 6.922 1.00 0.00 H new ATOM 0 HA THR A 88 6.772 -9.633 4.758 1.00 0.00 H new ATOM 0 HB THR A 88 8.080 -10.250 7.423 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.101 -10.105 6.243 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.953 -12.202 6.196 1.00 0.00 H new ATOM 0 HG22 THR A 88 7.174 -12.148 6.167 1.00 0.00 H new ATOM 0 HG23 THR A 88 8.103 -11.656 4.731 1.00 0.00 H new ATOM 1273 N PRO A 89 4.558 -10.084 5.841 1.00 0.00 N ATOM 1274 CA PRO A 89 3.285 -10.518 6.423 1.00 0.00 C ATOM 1275 C PRO A 89 3.336 -11.960 6.917 1.00 0.00 C ATOM 1276 O PRO A 89 3.962 -12.819 6.295 1.00 0.00 O ATOM 1277 CB PRO A 89 2.300 -10.386 5.260 1.00 0.00 C ATOM 1278 CG PRO A 89 3.140 -10.511 4.036 1.00 0.00 C ATOM 1279 CD PRO A 89 4.470 -9.902 4.383 1.00 0.00 C ATOM 0 HA PRO A 89 3.014 -9.927 7.298 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.537 -11.163 5.297 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.781 -9.428 5.288 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.253 -11.555 3.745 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.682 -9.993 3.193 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.288 -10.402 3.865 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.514 -8.849 4.106 1.00 0.00 H new ATOM 1287 N PHE A 90 2.673 -12.220 8.040 1.00 0.00 N ATOM 1288 CA PHE A 90 2.644 -13.558 8.618 1.00 0.00 C ATOM 1289 C PHE A 90 1.249 -14.167 8.508 1.00 0.00 C ATOM 1290 O PHE A 90 0.890 -15.063 9.271 1.00 0.00 O ATOM 1291 CB PHE A 90 3.079 -13.514 10.084 1.00 0.00 C ATOM 1292 CG PHE A 90 2.652 -12.263 10.798 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.364 -12.137 11.293 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.539 -11.213 10.974 1.00 0.00 C ATOM 1295 CE1 PHE A 90 0.969 -10.988 11.951 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.149 -10.062 11.631 1.00 0.00 C ATOM 1297 CZ PHE A 90 1.862 -9.948 12.119 1.00 0.00 C ATOM 0 H PHE A 90 2.149 -11.521 8.567 1.00 0.00 H new ATOM 0 HA PHE A 90 3.340 -14.183 8.059 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.666 -14.379 10.604 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.164 -13.600 10.136 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.661 -12.946 11.163 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.546 -11.295 10.593 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.037 -10.903 12.334 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.850 -9.251 11.763 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.555 -9.048 12.631 1.00 0.00 H new ATOM 1307 N GLU A 91 0.467 -13.673 7.553 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.889 -14.167 7.344 1.00 0.00 C ATOM 1309 C GLU A 91 -1.320 -13.977 5.893 1.00 0.00 C ATOM 1310 O GLU A 91 -0.997 -12.969 5.264 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.867 -13.448 8.276 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.863 -13.989 9.696 1.00 0.00 C ATOM 1313 CD GLU A 91 -3.166 -13.723 10.425 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -4.178 -14.373 10.086 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -3.175 -12.866 11.333 1.00 0.00 O ATOM 0 H GLU A 91 0.749 -12.931 6.912 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.898 -15.233 7.571 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.620 -12.387 8.300 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.874 -13.532 7.867 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.677 -15.063 9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -1.041 -13.536 10.251 1.00 0.00 H new ATOM 1322 N LYS A 92 -2.051 -14.954 5.366 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.527 -14.897 3.990 1.00 0.00 C ATOM 1324 C LYS A 92 -3.889 -14.214 3.914 1.00 0.00 C ATOM 1325 O LYS A 92 -4.907 -14.794 4.288 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.619 -16.306 3.401 1.00 0.00 C ATOM 1327 CG LYS A 92 -1.279 -17.018 3.315 1.00 0.00 C ATOM 1328 CD LYS A 92 -1.452 -18.497 3.016 1.00 0.00 C ATOM 1329 CE LYS A 92 -1.571 -19.313 4.294 1.00 0.00 C ATOM 1330 NZ LYS A 92 -1.328 -20.762 4.052 1.00 0.00 N ATOM 0 H LYS A 92 -2.327 -15.795 5.872 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.813 -14.313 3.409 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.299 -16.902 4.010 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -3.054 -16.246 2.403 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.670 -16.557 2.537 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.740 -16.896 4.255 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.342 -18.644 2.405 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.603 -18.853 2.433 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.856 -18.943 5.029 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.565 -19.178 4.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.903 -21.325 4.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -1.590 -20.999 3.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.321 -20.975 4.202 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.900 -12.977 3.424 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.142 -12.236 3.307 1.00 0.00 C ATOM 1346 C GLY A 93 -4.926 -10.814 2.829 1.00 0.00 C ATOM 1347 O GLY A 93 -3.800 -10.418 2.524 1.00 0.00 O ATOM 0 H GLY A 93 -3.071 -12.476 3.106 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.806 -12.752 2.613 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.644 -12.219 4.275 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.006 -10.044 2.760 1.00 0.00 N ATOM 1352 CA LEU A 94 -5.931 -8.658 2.314 1.00 0.00 C ATOM 1353 C LEU A 94 -5.717 -7.716 3.495 1.00 0.00 C ATOM 1354 O LEU A 94 -6.559 -7.623 4.388 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.207 -8.272 1.564 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.445 -6.774 1.370 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.416 -6.190 0.415 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -8.855 -6.520 0.858 1.00 0.00 C ATOM 0 H LEU A 94 -6.945 -10.357 3.008 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.079 -8.566 1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.185 -8.746 0.583 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.060 -8.688 2.100 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.336 -6.280 2.336 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.601 -5.123 0.289 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.416 -6.339 0.822 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.493 -6.688 -0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.007 -5.449 0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.992 -7.027 -0.097 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.578 -6.903 1.578 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.586 -7.018 3.491 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.262 -6.081 4.561 1.00 0.00 C ATOM 1372 C HIS A 95 -4.491 -4.641 4.110 1.00 0.00 C ATOM 1373 O HIS A 95 -4.513 -4.351 2.914 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.811 -6.263 5.006 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.283 -7.646 4.776 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -2.999 -8.785 5.080 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.102 -8.070 4.267 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.281 -9.849 4.769 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.126 -9.443 4.274 1.00 0.00 N ATOM 0 H HIS A 95 -3.879 -7.083 2.759 1.00 0.00 H new ATOM 0 HA HIS A 95 -4.921 -6.289 5.404 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.183 -5.550 4.472 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.732 -6.025 6.067 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.292 -7.445 3.920 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.587 -10.877 4.898 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.374 -10.051 3.950 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.663 -3.744 5.076 1.00 0.00 N ATOM 1388 CA VAL A 96 -4.891 -2.335 4.778 1.00 0.00 C ATOM 1389 C VAL A 96 -3.660 -1.498 5.108 1.00 0.00 C ATOM 1390 O VAL A 96 -3.374 -1.228 6.275 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.098 -1.784 5.560 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.210 -0.278 5.378 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.378 -2.479 5.123 1.00 0.00 C ATOM 0 H VAL A 96 -4.649 -3.968 6.071 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.098 -2.266 3.710 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.945 -1.987 6.620 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.068 0.093 5.938 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.303 0.201 5.745 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.339 -0.048 4.320 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.221 -2.077 5.686 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.539 -2.309 4.058 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.293 -3.549 5.311 1.00 0.00 H new ATOM 1403 N VAL A 97 -2.934 -1.089 4.072 1.00 0.00 N ATOM 1404 CA VAL A 97 -1.734 -0.281 4.251 1.00 0.00 C ATOM 1405 C VAL A 97 -2.042 1.203 4.089 1.00 0.00 C ATOM 1406 O VAL A 97 -2.531 1.635 3.045 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.635 -0.679 3.249 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.596 0.196 3.430 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.280 -2.150 3.403 1.00 0.00 C ATOM 0 H VAL A 97 -3.156 -1.304 3.100 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.376 -0.466 5.264 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.016 -0.524 2.240 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.362 -0.100 2.713 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.328 1.240 3.264 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.981 0.077 4.443 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.498 -2.413 2.687 1.00 0.00 H new ATOM 0 HG22 VAL A 97 0.081 -2.333 4.415 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.165 -2.759 3.218 1.00 0.00 H new ATOM 1419 N GLU A 98 -1.752 1.980 5.128 1.00 0.00 N ATOM 1420 CA GLU A 98 -1.998 3.417 5.100 1.00 0.00 C ATOM 1421 C GLU A 98 -0.714 4.183 4.795 1.00 0.00 C ATOM 1422 O GLU A 98 0.379 3.760 5.171 1.00 0.00 O ATOM 1423 CB GLU A 98 -2.578 3.883 6.436 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.097 3.904 6.466 1.00 0.00 C ATOM 1425 CD GLU A 98 -4.682 5.022 5.624 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.283 5.150 4.448 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.540 5.767 6.143 1.00 0.00 O ATOM 0 H GLU A 98 -1.347 1.638 5.999 1.00 0.00 H new ATOM 0 HA GLU A 98 -2.719 3.621 4.308 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.216 3.227 7.228 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.205 4.883 6.655 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.477 2.947 6.108 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.435 4.015 7.496 1.00 0.00 H new ATOM 1434 N VAL A 99 -0.855 5.314 4.110 1.00 0.00 N ATOM 1435 CA VAL A 99 0.292 6.140 3.755 1.00 0.00 C ATOM 1436 C VAL A 99 -0.035 7.623 3.894 1.00 0.00 C ATOM 1437 O VAL A 99 -0.993 8.118 3.300 1.00 0.00 O ATOM 1438 CB VAL A 99 0.759 5.862 2.313 1.00 0.00 C ATOM 1439 CG1 VAL A 99 2.007 6.670 1.991 1.00 0.00 C ATOM 1440 CG2 VAL A 99 1.010 4.375 2.113 1.00 0.00 C ATOM 0 H VAL A 99 -1.752 5.678 3.790 1.00 0.00 H new ATOM 0 HA VAL A 99 1.095 5.881 4.446 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.031 6.170 1.627 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.322 6.461 0.969 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.789 7.733 2.093 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.806 6.396 2.680 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.339 4.196 1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.782 4.040 2.806 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.089 3.822 2.300 1.00 0.00 H new ATOM 1450 N THR A 100 0.770 8.329 4.683 1.00 0.00 N ATOM 1451 CA THR A 100 0.566 9.755 4.902 1.00 0.00 C ATOM 1452 C THR A 100 1.853 10.537 4.661 1.00 0.00 C ATOM 1453 O THR A 100 2.900 10.216 5.223 1.00 0.00 O ATOM 1454 CB THR A 100 0.066 10.039 6.331 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.947 9.437 7.286 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.344 9.504 6.527 1.00 0.00 C ATOM 0 H THR A 100 1.569 7.936 5.181 1.00 0.00 H new ATOM 0 HA THR A 100 -0.193 10.079 4.189 1.00 0.00 H new ATOM 0 HB THR A 100 0.052 11.119 6.480 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.871 9.507 6.968 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.676 9.716 7.543 1.00 0.00 H new ATOM 0 HG22 THR A 100 -2.018 9.985 5.818 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.351 8.427 6.361 1.00 0.00 H new ATOM 1464 N TYR A 101 1.767 11.564 3.823 1.00 0.00 N ATOM 1465 CA TYR A 101 2.925 12.391 3.506 1.00 0.00 C ATOM 1466 C TYR A 101 2.750 13.805 4.052 1.00 0.00 C ATOM 1467 O TYR A 101 1.855 14.538 3.633 1.00 0.00 O ATOM 1468 CB TYR A 101 3.145 12.440 1.993 1.00 0.00 C ATOM 1469 CG TYR A 101 4.410 13.163 1.589 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.573 14.518 1.852 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.441 12.492 0.942 1.00 0.00 C ATOM 1472 CE1 TYR A 101 5.727 15.183 1.483 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.598 13.149 0.571 1.00 0.00 C ATOM 1474 CZ TYR A 101 6.736 14.494 0.844 1.00 0.00 C ATOM 1475 OH TYR A 101 7.887 15.152 0.474 1.00 0.00 O ATOM 0 H TYR A 101 0.907 11.844 3.351 1.00 0.00 H new ATOM 0 HA TYR A 101 3.799 11.944 3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.179 11.422 1.606 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.291 12.930 1.526 1.00 0.00 H new ATOM 0 HD1 TYR A 101 3.785 15.060 2.353 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.336 11.439 0.726 1.00 0.00 H new ATOM 0 HE1 TYR A 101 5.838 16.236 1.694 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.390 12.613 0.070 1.00 0.00 H new ATOM 0 HH TYR A 101 8.497 14.523 0.036 1.00 0.00 H new ATOM 1485 N ASP A 102 3.613 14.181 4.990 1.00 0.00 N ATOM 1486 CA ASP A 102 3.557 15.507 5.593 1.00 0.00 C ATOM 1487 C ASP A 102 2.239 15.712 6.333 1.00 0.00 C ATOM 1488 O ASP A 102 1.655 16.795 6.292 1.00 0.00 O ATOM 1489 CB ASP A 102 3.728 16.586 4.522 1.00 0.00 C ATOM 1490 CG ASP A 102 5.143 16.646 3.982 1.00 0.00 C ATOM 1491 OD1 ASP A 102 5.873 15.642 4.116 1.00 0.00 O ATOM 1492 OD2 ASP A 102 5.521 17.698 3.425 1.00 0.00 O ATOM 0 H ASP A 102 4.360 13.586 5.349 1.00 0.00 H new ATOM 0 HA ASP A 102 4.373 15.587 6.311 1.00 0.00 H new ATOM 0 HB2 ASP A 102 3.037 16.392 3.702 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.461 17.556 4.942 1.00 0.00 H new ATOM 1497 N ASP A 103 1.776 14.666 7.008 1.00 0.00 N ATOM 1498 CA ASP A 103 0.527 14.730 7.757 1.00 0.00 C ATOM 1499 C ASP A 103 -0.667 14.848 6.814 1.00 0.00 C ATOM 1500 O ASP A 103 -1.692 15.433 7.164 1.00 0.00 O ATOM 1501 CB ASP A 103 0.548 15.916 8.724 1.00 0.00 C ATOM 1502 CG ASP A 103 1.816 15.963 9.553 1.00 0.00 C ATOM 1503 OD1 ASP A 103 2.904 16.140 8.966 1.00 0.00 O ATOM 1504 OD2 ASP A 103 1.720 15.824 10.791 1.00 0.00 O ATOM 0 H ASP A 103 2.248 13.763 7.052 1.00 0.00 H new ATOM 0 HA ASP A 103 0.426 13.807 8.328 1.00 0.00 H new ATOM 0 HB2 ASP A 103 0.452 16.843 8.159 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.315 15.856 9.388 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.526 14.290 5.616 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.592 14.332 4.623 1.00 0.00 C ATOM 1511 C VAL A 104 -1.669 13.024 3.843 1.00 0.00 C ATOM 1512 O VAL A 104 -0.709 12.598 3.201 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.392 15.495 3.633 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.544 15.558 2.642 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -1.249 16.812 4.382 1.00 0.00 C ATOM 0 H VAL A 104 0.317 13.803 5.310 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.524 14.483 5.167 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.473 15.319 3.073 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.385 16.386 1.951 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.595 14.624 2.083 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.479 15.710 3.181 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -1.108 17.623 3.668 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.149 16.997 4.968 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.387 16.761 5.047 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.839 12.370 3.899 1.00 0.00 N ATOM 1526 CA PRO A 105 -3.070 11.101 3.203 1.00 0.00 C ATOM 1527 C PRO A 105 -3.126 11.272 1.689 1.00 0.00 C ATOM 1528 O PRO A 105 -3.605 12.289 1.187 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.429 10.644 3.740 1.00 0.00 C ATOM 1530 CG PRO A 105 -5.112 11.900 4.160 1.00 0.00 C ATOM 1531 CD PRO A 105 -4.026 12.819 4.646 1.00 0.00 C ATOM 0 HA PRO A 105 -2.265 10.388 3.379 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.001 10.119 2.975 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.313 9.957 4.578 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.656 12.345 3.327 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.839 11.704 4.948 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.260 13.863 4.438 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.879 12.733 5.723 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.634 10.271 0.966 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.630 10.311 -0.491 1.00 0.00 C ATOM 1541 C ILE A 106 -3.934 9.760 -1.059 1.00 0.00 C ATOM 1542 O ILE A 106 -4.622 8.954 -0.432 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.450 9.510 -1.073 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.386 8.120 -0.437 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.144 10.259 -0.856 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.393 7.195 -1.106 1.00 0.00 C ATOM 0 H ILE A 106 -2.233 9.423 1.366 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.525 11.357 -0.778 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.604 9.391 -2.145 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.123 8.223 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.376 7.666 -0.475 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.681 9.681 -1.273 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.194 11.229 -1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.018 10.405 0.212 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.401 6.228 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.667 7.062 -2.153 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.606 7.628 -1.045 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.281 10.201 -2.277 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.503 9.764 -2.959 1.00 0.00 C ATOM 1560 C PRO A 107 -5.430 8.306 -3.401 1.00 0.00 C ATOM 1561 O PRO A 107 -6.335 7.803 -4.065 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.581 10.688 -4.176 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.171 11.099 -4.431 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.508 11.162 -3.082 1.00 0.00 C ATOM 0 HA PRO A 107 -6.375 9.821 -2.308 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -6.005 10.173 -5.038 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.215 11.552 -3.977 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.667 10.383 -5.081 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.131 12.067 -4.931 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.455 10.884 -3.138 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.551 12.166 -2.660 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.346 7.633 -3.028 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.155 6.232 -3.386 1.00 0.00 C ATOM 1574 C ASN A 108 -4.424 5.323 -2.191 1.00 0.00 C ATOM 1575 O ASN A 108 -4.641 4.122 -2.348 1.00 0.00 O ATOM 1576 CB ASN A 108 -2.733 6.006 -3.903 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.359 6.974 -5.009 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.380 7.712 -4.898 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.139 6.974 -6.084 1.00 0.00 N ATOM 0 H ASN A 108 -3.587 8.035 -2.478 1.00 0.00 H new ATOM 0 HA ASN A 108 -4.865 5.984 -4.175 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.028 6.111 -3.078 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.642 4.984 -4.272 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.937 7.603 -6.861 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -3.940 6.345 -6.133 1.00 0.00 H new ATOM 1586 N SER A 109 -4.410 5.906 -0.996 1.00 0.00 N ATOM 1587 CA SER A 109 -4.649 5.148 0.226 1.00 0.00 C ATOM 1588 C SER A 109 -6.080 5.346 0.717 1.00 0.00 C ATOM 1589 O SER A 109 -6.765 6.299 0.344 1.00 0.00 O ATOM 1590 CB SER A 109 -3.662 5.571 1.315 1.00 0.00 C ATOM 1591 OG SER A 109 -2.498 4.762 1.291 1.00 0.00 O ATOM 0 H SER A 109 -4.236 6.900 -0.849 1.00 0.00 H new ATOM 0 HA SER A 109 -4.502 4.091 0.003 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.385 6.616 1.174 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.140 5.497 2.292 1.00 0.00 H new ATOM 0 HG SER A 109 -2.320 4.471 0.372 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.544 4.425 1.574 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.738 3.286 2.025 1.00 0.00 C ATOM 1599 C PRO A 110 -5.496 2.272 0.913 1.00 0.00 C ATOM 1600 O PRO A 110 -6.318 2.117 0.009 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.589 2.668 3.137 1.00 0.00 C ATOM 1602 CG PRO A 110 -7.987 3.067 2.811 1.00 0.00 C ATOM 1603 CD PRO A 110 -7.891 4.423 2.169 1.00 0.00 C ATOM 0 HA PRO A 110 -4.744 3.593 2.351 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.482 1.583 3.161 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.290 3.039 4.117 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.451 2.348 2.136 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.602 3.103 3.710 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.664 4.566 1.414 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -8.008 5.223 2.900 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.362 1.582 0.985 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.011 0.582 -0.017 1.00 0.00 C ATOM 1613 C PHE A 111 -4.567 -0.788 0.364 1.00 0.00 C ATOM 1614 O PHE A 111 -4.876 -1.044 1.528 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.492 0.501 -0.178 1.00 0.00 C ATOM 1616 CG PHE A 111 -1.896 1.701 -0.856 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.062 1.896 -2.218 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.170 2.634 -0.133 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -1.515 3.000 -2.846 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -0.622 3.739 -0.755 1.00 0.00 C ATOM 1621 CZ PHE A 111 -0.794 3.922 -2.114 1.00 0.00 C ATOM 0 H PHE A 111 -3.671 1.697 1.726 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.454 0.884 -0.966 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.036 0.386 0.805 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.243 -0.392 -0.752 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -2.625 1.178 -2.795 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.031 2.496 0.929 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.652 3.141 -3.908 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.060 4.459 -0.180 1.00 0.00 H new ATOM 0 HZ PHE A 111 -0.365 4.785 -2.602 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.692 -1.665 -0.626 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.209 -3.009 -0.398 1.00 0.00 C ATOM 1633 C LYS A 112 -4.270 -4.060 -0.980 1.00 0.00 C ATOM 1634 O LYS A 112 -4.174 -4.216 -2.197 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.601 -3.154 -1.018 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.730 -2.788 -0.071 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.002 -2.443 -0.828 1.00 0.00 C ATOM 1638 CE LYS A 112 -10.126 -2.053 0.120 1.00 0.00 C ATOM 1639 NZ LYS A 112 -10.690 -3.236 0.828 1.00 0.00 N ATOM 0 H LYS A 112 -4.442 -1.469 -1.595 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.279 -3.166 0.678 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.662 -2.522 -1.904 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.736 -4.183 -1.350 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.923 -3.620 0.606 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.430 -1.940 0.544 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.805 -1.622 -1.518 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.312 -3.298 -1.430 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.752 -1.336 0.851 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.917 -1.554 -0.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.518 -2.944 1.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.977 -3.953 0.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.969 -3.638 1.461 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.578 -4.780 -0.102 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.648 -5.819 -0.529 1.00 0.00 C ATOM 1655 C VAL A 113 -3.221 -7.208 -0.273 1.00 0.00 C ATOM 1656 O VAL A 113 -3.206 -7.699 0.856 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.295 -5.692 0.196 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.388 -6.860 -0.159 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.630 -4.367 -0.146 1.00 0.00 C ATOM 0 H VAL A 113 -3.644 -4.663 0.909 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.493 -5.685 -1.600 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.474 -5.716 1.271 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.563 -6.753 0.362 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.863 -7.794 0.141 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.213 -6.871 -1.235 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.325 -4.294 0.375 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.462 -4.311 -1.222 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.276 -3.545 0.163 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.724 -7.838 -1.329 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.300 -9.173 -1.220 1.00 0.00 C ATOM 1671 C ALA A 114 -3.232 -10.247 -1.394 1.00 0.00 C ATOM 1672 O ALA A 114 -2.792 -10.525 -2.510 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.407 -9.356 -2.247 1.00 0.00 C ATOM 0 H ALA A 114 -3.744 -7.445 -2.270 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.725 -9.278 -0.222 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.828 -10.357 -2.154 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.189 -8.616 -2.075 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.999 -9.226 -3.249 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.817 -10.848 -0.283 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.800 -11.893 -0.313 1.00 0.00 C ATOM 1681 C VAL A 115 -2.411 -13.245 -0.663 1.00 0.00 C ATOM 1682 O VAL A 115 -3.581 -13.503 -0.378 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.071 -12.005 1.039 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.279 -13.302 1.113 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.164 -10.804 1.257 1.00 0.00 C ATOM 0 H VAL A 115 -3.169 -10.629 0.649 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.081 -11.613 -1.083 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.817 -12.017 1.834 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.229 -13.364 2.075 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.957 -14.149 1.006 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.459 -13.324 0.311 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.343 -10.900 2.217 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.577 -10.758 0.459 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.761 -9.892 1.252 1.00 0.00 H new ATOM 1695 N THR A 116 -1.611 -14.107 -1.282 1.00 0.00 N ATOM 1696 CA THR A 116 -2.073 -15.434 -1.672 1.00 0.00 C ATOM 1697 C THR A 116 -1.051 -16.502 -1.300 1.00 0.00 C ATOM 1698 O THR A 116 0.107 -16.196 -1.020 1.00 0.00 O ATOM 1699 CB THR A 116 -2.351 -15.510 -3.185 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.778 -16.830 -3.539 1.00 0.00 O ATOM 1701 CG2 THR A 116 -1.109 -15.142 -3.983 1.00 0.00 C ATOM 0 H THR A 116 -0.640 -13.910 -1.524 1.00 0.00 H new ATOM 0 HA THR A 116 -3.001 -15.618 -1.130 1.00 0.00 H new ATOM 0 HB THR A 116 -3.141 -14.797 -3.423 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.954 -16.869 -4.502 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.330 -15.203 -5.049 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.804 -14.126 -3.733 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.302 -15.833 -3.740 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.488 -17.758 -1.301 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.610 -18.872 -0.963 1.00 0.00 C ATOM 1711 C GLU A 117 0.547 -18.973 -1.954 1.00 0.00 C ATOM 1712 O GLU A 117 0.342 -19.232 -3.139 1.00 0.00 O ATOM 1713 CB GLU A 117 -1.397 -20.184 -0.947 1.00 0.00 C ATOM 1714 CG GLU A 117 -2.062 -20.478 0.388 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.370 -21.951 0.574 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -2.594 -22.644 -0.441 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -2.388 -22.411 1.735 1.00 0.00 O ATOM 0 H GLU A 117 -2.444 -18.029 -1.532 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.201 -18.690 0.031 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.161 -20.150 -1.724 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.725 -21.005 -1.197 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.412 -20.142 1.196 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.986 -19.905 0.463 1.00 0.00 H new ATOM 1724 N GLY A 118 1.763 -18.764 -1.458 1.00 0.00 N ATOM 1725 CA GLY A 118 2.934 -18.835 -2.312 1.00 0.00 C ATOM 1726 C GLY A 118 3.985 -19.788 -1.777 1.00 0.00 C ATOM 1727 O GLY A 118 3.999 -20.968 -2.129 1.00 0.00 O ATOM 0 H GLY A 118 1.958 -18.547 -0.481 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.633 -19.154 -3.310 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.368 -17.840 -2.412 1.00 0.00 H new ATOM 1731 N CYS A 119 4.867 -19.275 -0.926 1.00 0.00 N ATOM 1732 CA CYS A 119 5.929 -20.088 -0.344 1.00 0.00 C ATOM 1733 C CYS A 119 5.990 -19.900 1.169 1.00 0.00 C ATOM 1734 O CYS A 119 5.559 -18.874 1.693 1.00 0.00 O ATOM 1735 CB CYS A 119 7.277 -19.728 -0.969 1.00 0.00 C ATOM 1736 SG CYS A 119 7.498 -20.348 -2.654 1.00 0.00 S ATOM 0 H CYS A 119 4.868 -18.301 -0.624 1.00 0.00 H new ATOM 0 HA CYS A 119 5.708 -21.134 -0.554 1.00 0.00 H new ATOM 0 HB2 CYS A 119 7.385 -18.643 -0.975 1.00 0.00 H new ATOM 0 HB3 CYS A 119 8.074 -20.124 -0.340 1.00 0.00 H new ATOM 0 HG CYS A 119 8.667 -19.991 -3.098 1.00 0.00 H new ATOM 1742 N GLN A 120 6.526 -20.899 1.863 1.00 0.00 N ATOM 1743 CA GLN A 120 6.641 -20.844 3.315 1.00 0.00 C ATOM 1744 C GLN A 120 8.005 -21.351 3.773 1.00 0.00 C ATOM 1745 O GLN A 120 8.661 -22.141 3.094 1.00 0.00 O ATOM 1746 CB GLN A 120 5.531 -21.670 3.967 1.00 0.00 C ATOM 1747 CG GLN A 120 4.163 -21.009 3.903 1.00 0.00 C ATOM 1748 CD GLN A 120 3.028 -22.000 4.068 1.00 0.00 C ATOM 1749 OE1 GLN A 120 3.164 -23.006 4.765 1.00 0.00 O ATOM 1750 NE2 GLN A 120 1.900 -21.721 3.426 1.00 0.00 N ATOM 0 H GLN A 120 6.887 -21.756 1.443 1.00 0.00 H new ATOM 0 HA GLN A 120 6.539 -19.804 3.623 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.478 -22.643 3.478 1.00 0.00 H new ATOM 0 HB3 GLN A 120 5.789 -21.851 5.010 1.00 0.00 H new ATOM 0 HG2 GLN A 120 4.094 -20.250 4.682 1.00 0.00 H new ATOM 0 HG3 GLN A 120 4.056 -20.496 2.947 1.00 0.00 H new ATOM 0 HE21 GLN A 120 1.831 -20.876 2.859 1.00 0.00 H new ATOM 0 HE22 GLN A 120 1.102 -22.352 3.500 1.00 0.00 H new ATOM 1759 N PRO A 121 8.443 -20.887 4.953 1.00 0.00 N ATOM 1760 CA PRO A 121 9.733 -21.281 5.528 1.00 0.00 C ATOM 1761 C PRO A 121 9.744 -22.736 5.985 1.00 0.00 C ATOM 1762 O PRO A 121 8.783 -23.473 5.765 1.00 0.00 O ATOM 1763 CB PRO A 121 9.887 -20.343 6.728 1.00 0.00 C ATOM 1764 CG PRO A 121 8.493 -19.973 7.102 1.00 0.00 C ATOM 1765 CD PRO A 121 7.714 -19.943 5.816 1.00 0.00 C ATOM 0 HA PRO A 121 10.543 -21.205 4.803 1.00 0.00 H new ATOM 0 HB2 PRO A 121 10.400 -20.837 7.553 1.00 0.00 H new ATOM 0 HB3 PRO A 121 10.474 -19.462 6.469 1.00 0.00 H new ATOM 0 HG2 PRO A 121 8.070 -20.698 7.798 1.00 0.00 H new ATOM 0 HG3 PRO A 121 8.466 -19.002 7.597 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.680 -20.252 5.966 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.688 -18.942 5.385 1.00 0.00 H new ATOM 1773 N SER A 122 10.837 -23.143 6.622 1.00 0.00 N ATOM 1774 CA SER A 122 10.974 -24.511 7.107 1.00 0.00 C ATOM 1775 C SER A 122 10.928 -24.555 8.631 1.00 0.00 C ATOM 1776 O SER A 122 10.907 -23.517 9.292 1.00 0.00 O ATOM 1777 CB SER A 122 12.285 -25.123 6.607 1.00 0.00 C ATOM 1778 OG SER A 122 12.428 -24.950 5.208 1.00 0.00 O ATOM 0 H SER A 122 11.641 -22.545 6.814 1.00 0.00 H new ATOM 0 HA SER A 122 10.138 -25.093 6.719 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.126 -24.659 7.122 1.00 0.00 H new ATOM 0 HB3 SER A 122 12.310 -26.185 6.850 1.00 0.00 H new ATOM 0 HG SER A 122 13.274 -25.348 4.914 1.00 0.00 H new ATOM 1784 N SER A 123 10.912 -25.764 9.182 1.00 0.00 N ATOM 1785 CA SER A 123 10.864 -25.945 10.628 1.00 0.00 C ATOM 1786 C SER A 123 12.184 -26.505 11.150 1.00 0.00 C ATOM 1787 O SER A 123 12.576 -27.620 10.808 1.00 0.00 O ATOM 1788 CB SER A 123 9.714 -26.880 11.009 1.00 0.00 C ATOM 1789 OG SER A 123 9.709 -27.141 12.402 1.00 0.00 O ATOM 0 H SER A 123 10.932 -26.633 8.649 1.00 0.00 H new ATOM 0 HA SER A 123 10.697 -24.970 11.086 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.765 -26.432 10.716 1.00 0.00 H new ATOM 0 HB3 SER A 123 9.806 -27.817 10.461 1.00 0.00 H new ATOM 0 HG SER A 123 8.964 -27.739 12.620 1.00 0.00 H new ATOM 1795 N GLY A 124 12.865 -25.721 11.981 1.00 0.00 N ATOM 1796 CA GLY A 124 14.133 -26.155 12.537 1.00 0.00 C ATOM 1797 C GLY A 124 14.730 -25.134 13.485 1.00 0.00 C ATOM 1798 O GLY A 124 14.092 -24.699 14.444 1.00 0.00 O ATOM 0 H GLY A 124 12.561 -24.794 12.279 1.00 0.00 H new ATOM 0 HA2 GLY A 124 13.991 -27.098 13.066 1.00 0.00 H new ATOM 0 HA3 GLY A 124 14.835 -26.347 11.726 1.00 0.00 H new ATOM 1802 N PRO A 125 15.983 -24.736 13.221 1.00 0.00 N ATOM 1803 CA PRO A 125 16.694 -23.757 14.048 1.00 0.00 C ATOM 1804 C PRO A 125 16.115 -22.353 13.909 1.00 0.00 C ATOM 1805 O PRO A 125 16.626 -21.399 14.497 1.00 0.00 O ATOM 1806 CB PRO A 125 18.123 -23.802 13.503 1.00 0.00 C ATOM 1807 CG PRO A 125 17.978 -24.274 12.097 1.00 0.00 C ATOM 1808 CD PRO A 125 16.804 -25.213 12.095 1.00 0.00 C ATOM 0 HA PRO A 125 16.621 -23.991 15.110 1.00 0.00 H new ATOM 0 HB2 PRO A 125 18.593 -22.820 13.544 1.00 0.00 H new ATOM 0 HB3 PRO A 125 18.748 -24.479 14.085 1.00 0.00 H new ATOM 0 HG2 PRO A 125 17.809 -23.437 11.420 1.00 0.00 H new ATOM 0 HG3 PRO A 125 18.883 -24.780 11.760 1.00 0.00 H new ATOM 0 HD2 PRO A 125 16.257 -25.171 11.153 1.00 0.00 H new ATOM 0 HD3 PRO A 125 17.117 -26.248 12.236 1.00 0.00 H new ATOM 1816 N SER A 126 15.047 -22.232 13.127 1.00 0.00 N ATOM 1817 CA SER A 126 14.401 -20.943 12.908 1.00 0.00 C ATOM 1818 C SER A 126 13.568 -20.540 14.121 1.00 0.00 C ATOM 1819 O SER A 126 12.373 -20.270 14.004 1.00 0.00 O ATOM 1820 CB SER A 126 13.516 -20.998 11.662 1.00 0.00 C ATOM 1821 OG SER A 126 14.296 -20.957 10.479 1.00 0.00 O ATOM 0 H SER A 126 14.611 -23.011 12.634 1.00 0.00 H new ATOM 0 HA SER A 126 15.179 -20.194 12.759 1.00 0.00 H new ATOM 0 HB2 SER A 126 12.919 -21.910 11.676 1.00 0.00 H new ATOM 0 HB3 SER A 126 12.818 -20.160 11.670 1.00 0.00 H new ATOM 0 HG SER A 126 13.707 -20.995 9.697 1.00 0.00 H new ATOM 1827 N SER A 127 14.209 -20.503 15.285 1.00 0.00 N ATOM 1828 CA SER A 127 13.527 -20.137 16.521 1.00 0.00 C ATOM 1829 C SER A 127 12.144 -20.778 16.589 1.00 0.00 C ATOM 1830 O SER A 127 11.160 -20.123 16.932 1.00 0.00 O ATOM 1831 CB SER A 127 13.403 -18.616 16.628 1.00 0.00 C ATOM 1832 OG SER A 127 13.368 -18.202 17.983 1.00 0.00 O ATOM 0 H SER A 127 15.199 -20.722 15.398 1.00 0.00 H new ATOM 0 HA SER A 127 14.120 -20.506 17.358 1.00 0.00 H new ATOM 0 HB2 SER A 127 14.244 -18.143 16.121 1.00 0.00 H new ATOM 0 HB3 SER A 127 12.497 -18.285 16.120 1.00 0.00 H new ATOM 0 HG SER A 127 13.290 -17.226 18.025 1.00 0.00 H new ATOM 1838 N GLY A 128 12.078 -22.064 16.259 1.00 0.00 N ATOM 1839 CA GLY A 128 10.812 -22.773 16.288 1.00 0.00 C ATOM 1840 C GLY A 128 10.984 -24.256 16.550 1.00 0.00 C ATOM 1841 O GLY A 128 10.011 -24.964 16.808 1.00 0.00 O ATOM 0 H GLY A 128 12.878 -22.627 15.972 1.00 0.00 H new ATOM 0 HA2 GLY A 128 10.175 -22.342 17.061 1.00 0.00 H new ATOM 0 HA3 GLY A 128 10.298 -22.632 15.337 1.00 0.00 H new TER 1845 GLY A 128