USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 898 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0169 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.234 X(o=-0.23,f=0) USER MOD Single : A 10 ASN : amide:sc= -0.166 K(o=-0.17,f=-1.7) USER MOD Single : A 11 SER OG : rot 170:sc= -0.877 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot -130:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -3.89! C(o=-3.9!,f=-4.2!) USER MOD Single : A 27 SER OG : rot 82:sc= 0.664 USER MOD Single : A 31 THR OG1 : rot -140:sc= -0.276 USER MOD Single : A 35 GLN : amide:sc= -7.49! C(o=-7.5!,f=-7!) USER MOD Single : A 46 ASN : amide:sc= -0.0597 X(o=-0.06,f=-0.06) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 51 TYR OH : rot 100:sc= -0.286 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.123 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.0097 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= -0.0616 X(o=-0.062,f=-0.26) USER MOD Single : A 85 ASN : amide:sc= -0.176 K(o=-0.18,f=-0.95) USER MOD Single : A 86 GLN : amide:sc= -0.21 K(o=-0.21,f=-0.99) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 MET CE :methyl -152:sc= -0.26 (180deg=-0.584) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 143:sc= 0.0487 USER MOD Single : A 104 LYS NZ :NH3+ -115:sc= 0.00958 (180deg=-0.0706) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -0.0408 X(o=-0.041,f=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 ASN : amide:sc= -0.175 X(o=-0.18,f=-0.0079) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.020 21.377 7.414 1.00 0.00 N ATOM 2 CA GLY A 1 -9.818 20.778 7.964 1.00 0.00 C ATOM 3 C GLY A 1 -8.985 21.768 8.754 1.00 0.00 C ATOM 4 O GLY A 1 -8.114 22.438 8.199 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.554 20.659 6.883 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.609 21.745 8.188 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.759 22.156 6.776 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.094 19.944 8.609 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.216 20.368 7.153 1.00 0.00 H new ATOM 8 N SER A 2 -9.255 21.863 10.052 1.00 0.00 N ATOM 9 CA SER A 2 -8.528 22.783 10.918 1.00 0.00 C ATOM 10 C SER A 2 -7.095 22.308 11.135 1.00 0.00 C ATOM 11 O SER A 2 -6.828 21.107 11.181 1.00 0.00 O ATOM 12 CB SER A 2 -9.241 22.920 12.265 1.00 0.00 C ATOM 13 OG SER A 2 -9.181 21.710 12.999 1.00 0.00 O ATOM 0 H SER A 2 -9.972 21.314 10.527 1.00 0.00 H new ATOM 0 HA SER A 2 -8.499 23.757 10.429 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.782 23.723 12.843 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.282 23.199 12.102 1.00 0.00 H new ATOM 0 HG SER A 2 -9.642 21.824 13.856 1.00 0.00 H new ATOM 19 N SER A 3 -6.176 23.259 11.267 1.00 0.00 N ATOM 20 CA SER A 3 -4.768 22.938 11.475 1.00 0.00 C ATOM 21 C SER A 3 -4.080 24.024 12.297 1.00 0.00 C ATOM 22 O SER A 3 -4.331 25.213 12.110 1.00 0.00 O ATOM 23 CB SER A 3 -4.057 22.773 10.131 1.00 0.00 C ATOM 24 OG SER A 3 -4.222 23.924 9.321 1.00 0.00 O ATOM 0 H SER A 3 -6.381 24.258 11.234 1.00 0.00 H new ATOM 0 HA SER A 3 -4.712 21.999 12.025 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.995 22.591 10.298 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.452 21.900 9.612 1.00 0.00 H new ATOM 0 HG SER A 3 -3.757 23.794 8.468 1.00 0.00 H new ATOM 30 N GLY A 4 -3.209 23.604 13.210 1.00 0.00 N ATOM 31 CA GLY A 4 -2.498 24.551 14.048 1.00 0.00 C ATOM 32 C GLY A 4 -2.132 23.969 15.399 1.00 0.00 C ATOM 33 O GLY A 4 -1.173 23.206 15.515 1.00 0.00 O ATOM 0 H GLY A 4 -2.983 22.625 13.384 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.591 24.874 13.537 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.115 25.438 14.193 1.00 0.00 H new ATOM 37 N SER A 5 -2.897 24.332 16.424 1.00 0.00 N ATOM 38 CA SER A 5 -2.645 23.845 17.776 1.00 0.00 C ATOM 39 C SER A 5 -2.156 22.400 17.750 1.00 0.00 C ATOM 40 O SER A 5 -1.193 22.046 18.431 1.00 0.00 O ATOM 41 CB SER A 5 -3.913 23.951 18.624 1.00 0.00 C ATOM 42 OG SER A 5 -4.971 23.197 18.057 1.00 0.00 O ATOM 0 H SER A 5 -3.696 24.961 16.344 1.00 0.00 H new ATOM 0 HA SER A 5 -1.867 24.466 18.220 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.709 23.595 19.634 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.212 24.996 18.708 1.00 0.00 H new ATOM 0 HG SER A 5 -5.770 23.280 18.619 1.00 0.00 H new ATOM 48 N SER A 6 -2.827 21.569 16.960 1.00 0.00 N ATOM 49 CA SER A 6 -2.465 20.160 16.848 1.00 0.00 C ATOM 50 C SER A 6 -0.955 19.998 16.700 1.00 0.00 C ATOM 51 O SER A 6 -0.324 19.252 17.448 1.00 0.00 O ATOM 52 CB SER A 6 -3.177 19.523 15.653 1.00 0.00 C ATOM 53 OG SER A 6 -2.892 18.137 15.570 1.00 0.00 O ATOM 0 H SER A 6 -3.624 21.846 16.388 1.00 0.00 H new ATOM 0 HA SER A 6 -2.780 19.655 17.761 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.253 19.672 15.745 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.865 20.018 14.733 1.00 0.00 H new ATOM 0 HG SER A 6 -3.360 17.752 14.799 1.00 0.00 H new ATOM 59 N GLY A 7 -0.382 20.703 15.730 1.00 0.00 N ATOM 60 CA GLY A 7 1.049 20.624 15.501 1.00 0.00 C ATOM 61 C GLY A 7 1.395 19.801 14.276 1.00 0.00 C ATOM 62 O GLY A 7 1.982 18.726 14.388 1.00 0.00 O ATOM 0 H GLY A 7 -0.883 21.328 15.098 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.451 21.630 15.384 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.530 20.188 16.376 1.00 0.00 H new ATOM 66 N ASN A 8 1.029 20.306 13.103 1.00 0.00 N ATOM 67 CA ASN A 8 1.303 19.609 11.851 1.00 0.00 C ATOM 68 C ASN A 8 2.500 20.227 11.135 1.00 0.00 C ATOM 69 O ASN A 8 2.499 21.416 10.815 1.00 0.00 O ATOM 70 CB ASN A 8 0.074 19.649 10.941 1.00 0.00 C ATOM 71 CG ASN A 8 0.436 19.524 9.474 1.00 0.00 C ATOM 72 OD1 ASN A 8 0.546 18.419 8.942 1.00 0.00 O ATOM 73 ND2 ASN A 8 0.623 20.660 8.812 1.00 0.00 N ATOM 0 H ASN A 8 0.542 21.195 12.993 1.00 0.00 H new ATOM 0 HA ASN A 8 1.539 18.571 12.086 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -0.604 18.841 11.215 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -0.463 20.584 11.101 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.868 20.639 7.822 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.521 21.553 9.293 1.00 0.00 H new ATOM 80 N ASP A 9 3.519 19.412 10.886 1.00 0.00 N ATOM 81 CA ASP A 9 4.722 19.877 10.205 1.00 0.00 C ATOM 82 C ASP A 9 4.477 20.023 8.707 1.00 0.00 C ATOM 83 O ASP A 9 3.393 19.716 8.212 1.00 0.00 O ATOM 84 CB ASP A 9 5.880 18.910 10.454 1.00 0.00 C ATOM 85 CG ASP A 9 6.303 18.876 11.909 1.00 0.00 C ATOM 86 OD1 ASP A 9 7.178 19.681 12.293 1.00 0.00 O ATOM 87 OD2 ASP A 9 5.759 18.044 12.665 1.00 0.00 O ATOM 0 H ASP A 9 3.536 18.426 11.146 1.00 0.00 H new ATOM 0 HA ASP A 9 4.983 20.855 10.608 1.00 0.00 H new ATOM 0 HB2 ASP A 9 5.587 17.908 10.140 1.00 0.00 H new ATOM 0 HB3 ASP A 9 6.731 19.200 9.838 1.00 0.00 H new ATOM 92 N ASN A 10 5.492 20.493 7.989 1.00 0.00 N ATOM 93 CA ASN A 10 5.386 20.681 6.547 1.00 0.00 C ATOM 94 C ASN A 10 6.270 19.685 5.802 1.00 0.00 C ATOM 95 O ASN A 10 6.987 20.051 4.871 1.00 0.00 O ATOM 96 CB ASN A 10 5.778 22.111 6.167 1.00 0.00 C ATOM 97 CG ASN A 10 5.315 22.486 4.773 1.00 0.00 C ATOM 98 OD1 ASN A 10 4.260 22.045 4.318 1.00 0.00 O ATOM 99 ND2 ASN A 10 6.105 23.305 4.088 1.00 0.00 N ATOM 0 H ASN A 10 6.397 20.751 8.382 1.00 0.00 H new ATOM 0 HA ASN A 10 4.349 20.507 6.259 1.00 0.00 H new ATOM 0 HB2 ASN A 10 5.349 22.806 6.889 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.861 22.216 6.228 1.00 0.00 H new ATOM 0 HD21 ASN A 10 5.846 23.593 3.144 1.00 0.00 H new ATOM 0 HD22 ASN A 10 6.971 23.646 4.506 1.00 0.00 H new ATOM 106 N SER A 11 6.212 18.424 6.219 1.00 0.00 N ATOM 107 CA SER A 11 7.010 17.375 5.594 1.00 0.00 C ATOM 108 C SER A 11 6.113 16.325 4.946 1.00 0.00 C ATOM 109 O SER A 11 4.958 16.136 5.328 1.00 0.00 O ATOM 110 CB SER A 11 7.923 16.715 6.629 1.00 0.00 C ATOM 111 OG SER A 11 9.007 17.562 6.968 1.00 0.00 O ATOM 0 H SER A 11 5.621 18.104 6.986 1.00 0.00 H new ATOM 0 HA SER A 11 7.624 17.832 4.818 1.00 0.00 H new ATOM 0 HB2 SER A 11 7.350 16.477 7.525 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.303 15.773 6.234 1.00 0.00 H new ATOM 0 HG SER A 11 9.482 17.192 7.741 1.00 0.00 H new ATOM 117 N PRO A 12 6.657 15.623 3.940 1.00 0.00 N ATOM 118 CA PRO A 12 5.925 14.580 3.217 1.00 0.00 C ATOM 119 C PRO A 12 5.678 13.344 4.075 1.00 0.00 C ATOM 120 O PRO A 12 6.619 12.664 4.487 1.00 0.00 O ATOM 121 CB PRO A 12 6.853 14.241 2.048 1.00 0.00 C ATOM 122 CG PRO A 12 8.215 14.610 2.526 1.00 0.00 C ATOM 123 CD PRO A 12 8.029 15.795 3.433 1.00 0.00 C ATOM 0 HA PRO A 12 4.935 14.916 2.910 1.00 0.00 H new ATOM 0 HB2 PRO A 12 6.797 13.183 1.792 1.00 0.00 H new ATOM 0 HB3 PRO A 12 6.583 14.801 1.153 1.00 0.00 H new ATOM 0 HG2 PRO A 12 8.680 13.780 3.059 1.00 0.00 H new ATOM 0 HG3 PRO A 12 8.868 14.858 1.689 1.00 0.00 H new ATOM 0 HD2 PRO A 12 8.759 15.800 4.242 1.00 0.00 H new ATOM 0 HD3 PRO A 12 8.144 16.736 2.894 1.00 0.00 H new ATOM 131 N ARG A 13 4.408 13.058 4.341 1.00 0.00 N ATOM 132 CA ARG A 13 4.038 11.904 5.152 1.00 0.00 C ATOM 133 C ARG A 13 3.032 11.023 4.416 1.00 0.00 C ATOM 134 O ARG A 13 2.211 11.514 3.641 1.00 0.00 O ATOM 135 CB ARG A 13 3.450 12.360 6.488 1.00 0.00 C ATOM 136 CG ARG A 13 3.406 11.264 7.540 1.00 0.00 C ATOM 137 CD ARG A 13 4.664 11.262 8.396 1.00 0.00 C ATOM 138 NE ARG A 13 4.518 10.423 9.582 1.00 0.00 N ATOM 139 CZ ARG A 13 5.194 10.619 10.708 1.00 0.00 C ATOM 140 NH1 ARG A 13 6.057 11.621 10.802 1.00 0.00 N ATOM 141 NH2 ARG A 13 5.006 9.811 11.745 1.00 0.00 N ATOM 0 H ARG A 13 3.618 13.609 4.007 1.00 0.00 H new ATOM 0 HA ARG A 13 4.939 11.320 5.340 1.00 0.00 H new ATOM 0 HB2 ARG A 13 4.039 13.194 6.869 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.439 12.733 6.322 1.00 0.00 H new ATOM 0 HG2 ARG A 13 2.532 11.404 8.176 1.00 0.00 H new ATOM 0 HG3 ARG A 13 3.294 10.295 7.053 1.00 0.00 H new ATOM 0 HD2 ARG A 13 5.506 10.906 7.802 1.00 0.00 H new ATOM 0 HD3 ARG A 13 4.897 12.282 8.700 1.00 0.00 H new ATOM 0 HE ARG A 13 3.861 9.644 9.544 1.00 0.00 H new ATOM 0 HH11 ARG A 13 6.203 12.244 10.008 1.00 0.00 H new ATOM 0 HH12 ARG A 13 6.575 11.769 11.668 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.342 9.040 11.677 1.00 0.00 H new ATOM 0 HH22 ARG A 13 5.525 9.962 12.610 1.00 0.00 H new ATOM 155 N PHE A 14 3.103 9.719 4.664 1.00 0.00 N ATOM 156 CA PHE A 14 2.201 8.769 4.024 1.00 0.00 C ATOM 157 C PHE A 14 0.812 8.830 4.653 1.00 0.00 C ATOM 158 O PHE A 14 0.658 9.242 5.802 1.00 0.00 O ATOM 159 CB PHE A 14 2.761 7.349 4.133 1.00 0.00 C ATOM 160 CG PHE A 14 3.892 7.077 3.183 1.00 0.00 C ATOM 161 CD1 PHE A 14 3.639 6.692 1.876 1.00 0.00 C ATOM 162 CD2 PHE A 14 5.208 7.205 3.597 1.00 0.00 C ATOM 163 CE1 PHE A 14 4.678 6.440 1.000 1.00 0.00 C ATOM 164 CE2 PHE A 14 6.251 6.955 2.725 1.00 0.00 C ATOM 165 CZ PHE A 14 5.986 6.572 1.425 1.00 0.00 C ATOM 0 H PHE A 14 3.776 9.296 5.304 1.00 0.00 H new ATOM 0 HA PHE A 14 2.116 9.039 2.971 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.105 7.180 5.153 1.00 0.00 H new ATOM 0 HB3 PHE A 14 1.959 6.635 3.945 1.00 0.00 H new ATOM 0 HD1 PHE A 14 2.619 6.588 1.538 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.421 7.504 4.613 1.00 0.00 H new ATOM 0 HE1 PHE A 14 4.468 6.140 -0.016 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.272 7.059 3.060 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.799 6.376 0.742 1.00 0.00 H new ATOM 175 N GLU A 15 -0.195 8.417 3.890 1.00 0.00 N ATOM 176 CA GLU A 15 -1.571 8.426 4.372 1.00 0.00 C ATOM 177 C GLU A 15 -1.728 7.516 5.587 1.00 0.00 C ATOM 178 O GLU A 15 -2.426 7.853 6.544 1.00 0.00 O ATOM 179 CB GLU A 15 -2.527 7.982 3.263 1.00 0.00 C ATOM 180 CG GLU A 15 -2.486 8.873 2.032 1.00 0.00 C ATOM 181 CD GLU A 15 -3.819 8.934 1.312 1.00 0.00 C ATOM 182 OE1 GLU A 15 -4.651 9.791 1.677 1.00 0.00 O ATOM 183 OE2 GLU A 15 -4.031 8.126 0.385 1.00 0.00 O ATOM 0 H GLU A 15 -0.084 8.072 2.936 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.818 9.446 4.668 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.282 6.961 2.971 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.544 7.966 3.656 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.190 9.880 2.326 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -1.723 8.504 1.346 1.00 0.00 H new ATOM 190 N LYS A 16 -1.074 6.360 5.542 1.00 0.00 N ATOM 191 CA LYS A 16 -1.139 5.400 6.638 1.00 0.00 C ATOM 192 C LYS A 16 0.259 5.064 7.150 1.00 0.00 C ATOM 193 O LYS A 16 1.183 4.851 6.365 1.00 0.00 O ATOM 194 CB LYS A 16 -1.847 4.122 6.182 1.00 0.00 C ATOM 195 CG LYS A 16 -3.172 4.377 5.485 1.00 0.00 C ATOM 196 CD LYS A 16 -3.690 3.125 4.797 1.00 0.00 C ATOM 197 CE LYS A 16 -3.053 2.937 3.429 1.00 0.00 C ATOM 198 NZ LYS A 16 -3.591 1.740 2.726 1.00 0.00 N ATOM 0 H LYS A 16 -0.492 6.065 4.758 1.00 0.00 H new ATOM 0 HA LYS A 16 -1.706 5.852 7.451 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.190 3.574 5.506 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.019 3.483 7.048 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.906 4.724 6.212 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -3.051 5.173 4.750 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.482 2.254 5.419 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.773 3.189 4.690 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -3.229 3.825 2.821 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.973 2.837 3.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -3.132 1.647 1.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.401 0.889 3.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.617 1.846 2.595 1.00 0.00 H new ATOM 212 N SER A 17 0.405 5.018 8.470 1.00 0.00 N ATOM 213 CA SER A 17 1.690 4.710 9.086 1.00 0.00 C ATOM 214 C SER A 17 2.239 3.386 8.566 1.00 0.00 C ATOM 215 O SER A 17 3.409 3.288 8.195 1.00 0.00 O ATOM 216 CB SER A 17 1.549 4.654 10.609 1.00 0.00 C ATOM 217 OG SER A 17 2.696 4.075 11.206 1.00 0.00 O ATOM 0 H SER A 17 -0.350 5.190 9.133 1.00 0.00 H new ATOM 0 HA SER A 17 2.391 5.502 8.822 1.00 0.00 H new ATOM 0 HB2 SER A 17 1.400 5.660 11.001 1.00 0.00 H new ATOM 0 HB3 SER A 17 0.665 4.074 10.875 1.00 0.00 H new ATOM 0 HG SER A 17 2.582 4.052 12.179 1.00 0.00 H new ATOM 223 N VAL A 18 1.385 2.367 8.540 1.00 0.00 N ATOM 224 CA VAL A 18 1.782 1.048 8.065 1.00 0.00 C ATOM 225 C VAL A 18 0.787 0.509 7.043 1.00 0.00 C ATOM 226 O VAL A 18 -0.310 0.077 7.397 1.00 0.00 O ATOM 227 CB VAL A 18 1.901 0.044 9.227 1.00 0.00 C ATOM 228 CG1 VAL A 18 2.297 -1.330 8.708 1.00 0.00 C ATOM 229 CG2 VAL A 18 2.901 0.542 10.260 1.00 0.00 C ATOM 0 H VAL A 18 0.413 2.431 8.843 1.00 0.00 H new ATOM 0 HA VAL A 18 2.758 1.163 7.593 1.00 0.00 H new ATOM 0 HB VAL A 18 0.928 -0.044 9.710 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.376 -2.026 9.543 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.541 -1.687 8.009 1.00 0.00 H new ATOM 0 HG13 VAL A 18 3.259 -1.263 8.199 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.973 -0.179 11.074 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.879 0.660 9.793 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.569 1.502 10.654 1.00 0.00 H new ATOM 239 N TYR A 19 1.177 0.539 5.773 1.00 0.00 N ATOM 240 CA TYR A 19 0.319 0.055 4.698 1.00 0.00 C ATOM 241 C TYR A 19 0.146 -1.458 4.778 1.00 0.00 C ATOM 242 O TYR A 19 1.044 -2.215 4.410 1.00 0.00 O ATOM 243 CB TYR A 19 0.901 0.443 3.338 1.00 0.00 C ATOM 244 CG TYR A 19 0.633 1.881 2.953 1.00 0.00 C ATOM 245 CD1 TYR A 19 0.891 2.919 3.839 1.00 0.00 C ATOM 246 CD2 TYR A 19 0.123 2.201 1.700 1.00 0.00 C ATOM 247 CE1 TYR A 19 0.647 4.233 3.491 1.00 0.00 C ATOM 248 CE2 TYR A 19 -0.123 3.512 1.343 1.00 0.00 C ATOM 249 CZ TYR A 19 0.141 4.525 2.242 1.00 0.00 C ATOM 250 OH TYR A 19 -0.102 5.833 1.891 1.00 0.00 O ATOM 0 H TYR A 19 2.082 0.893 5.463 1.00 0.00 H new ATOM 0 HA TYR A 19 -0.660 0.520 4.812 1.00 0.00 H new ATOM 0 HB2 TYR A 19 1.978 0.274 3.351 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.485 -0.213 2.573 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.289 2.695 4.817 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.084 1.411 0.994 1.00 0.00 H new ATOM 0 HE1 TYR A 19 0.851 5.028 4.193 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -0.520 3.743 0.366 1.00 0.00 H new ATOM 0 HH TYR A 19 -1.009 5.911 1.528 1.00 0.00 H new ATOM 260 N GLU A 20 -1.014 -1.891 5.260 1.00 0.00 N ATOM 261 CA GLU A 20 -1.305 -3.314 5.387 1.00 0.00 C ATOM 262 C GLU A 20 -2.211 -3.789 4.255 1.00 0.00 C ATOM 263 O GLU A 20 -3.406 -3.494 4.237 1.00 0.00 O ATOM 264 CB GLU A 20 -1.963 -3.604 6.738 1.00 0.00 C ATOM 265 CG GLU A 20 -1.882 -5.063 7.155 1.00 0.00 C ATOM 266 CD GLU A 20 -2.464 -5.310 8.533 1.00 0.00 C ATOM 267 OE1 GLU A 20 -3.429 -4.609 8.904 1.00 0.00 O ATOM 268 OE2 GLU A 20 -1.955 -6.204 9.240 1.00 0.00 O ATOM 0 H GLU A 20 -1.768 -1.277 5.569 1.00 0.00 H new ATOM 0 HA GLU A 20 -0.362 -3.858 5.326 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -1.488 -2.990 7.503 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -3.010 -3.305 6.694 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -2.413 -5.675 6.426 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -0.840 -5.383 7.142 1.00 0.00 H new ATOM 275 N ALA A 21 -1.633 -4.524 3.311 1.00 0.00 N ATOM 276 CA ALA A 21 -2.387 -5.040 2.176 1.00 0.00 C ATOM 277 C ALA A 21 -2.255 -6.556 2.073 1.00 0.00 C ATOM 278 O ALA A 21 -1.409 -7.161 2.731 1.00 0.00 O ATOM 279 CB ALA A 21 -1.921 -4.379 0.887 1.00 0.00 C ATOM 0 H ALA A 21 -0.644 -4.775 3.310 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.439 -4.803 2.333 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -2.493 -4.774 0.048 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.073 -3.302 0.955 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.862 -4.587 0.734 1.00 0.00 H new ATOM 285 N ASP A 22 -3.097 -7.163 1.244 1.00 0.00 N ATOM 286 CA ASP A 22 -3.074 -8.609 1.054 1.00 0.00 C ATOM 287 C ASP A 22 -2.628 -8.965 -0.361 1.00 0.00 C ATOM 288 O ASP A 22 -3.383 -8.802 -1.320 1.00 0.00 O ATOM 289 CB ASP A 22 -4.456 -9.203 1.331 1.00 0.00 C ATOM 290 CG ASP A 22 -5.486 -8.778 0.302 1.00 0.00 C ATOM 291 OD1 ASP A 22 -5.591 -7.562 0.035 1.00 0.00 O ATOM 292 OD2 ASP A 22 -6.185 -9.661 -0.236 1.00 0.00 O ATOM 0 H ASP A 22 -3.804 -6.676 0.693 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.357 -9.032 1.758 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -4.385 -10.291 1.342 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -4.789 -8.895 2.322 1.00 0.00 H new ATOM 297 N LEU A 23 -1.397 -9.450 -0.483 1.00 0.00 N ATOM 298 CA LEU A 23 -0.849 -9.828 -1.781 1.00 0.00 C ATOM 299 C LEU A 23 -1.066 -11.313 -2.052 1.00 0.00 C ATOM 300 O LEU A 23 -0.803 -12.155 -1.195 1.00 0.00 O ATOM 301 CB LEU A 23 0.643 -9.499 -1.842 1.00 0.00 C ATOM 302 CG LEU A 23 1.252 -9.397 -3.241 1.00 0.00 C ATOM 303 CD1 LEU A 23 1.499 -10.782 -3.818 1.00 0.00 C ATOM 304 CD2 LEU A 23 0.346 -8.589 -4.159 1.00 0.00 C ATOM 0 H LEU A 23 -0.760 -9.591 0.301 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.372 -9.258 -2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.807 -8.553 -1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 23 1.186 -10.263 -1.286 1.00 0.00 H new ATOM 0 HG LEU A 23 2.210 -8.882 -3.163 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.933 -10.689 -4.814 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.187 -11.328 -3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.555 -11.323 -3.882 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.795 -8.527 -5.150 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.627 -9.076 -4.231 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.220 -7.585 -3.754 1.00 0.00 H new ATOM 316 N ALA A 24 -1.546 -11.627 -3.251 1.00 0.00 N ATOM 317 CA ALA A 24 -1.794 -13.010 -3.637 1.00 0.00 C ATOM 318 C ALA A 24 -0.513 -13.686 -4.112 1.00 0.00 C ATOM 319 O ALA A 24 0.034 -13.335 -5.157 1.00 0.00 O ATOM 320 CB ALA A 24 -2.860 -13.073 -4.721 1.00 0.00 C ATOM 0 H ALA A 24 -1.771 -10.941 -3.972 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.153 -13.547 -2.759 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.035 -14.112 -4.999 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.786 -12.637 -4.346 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.524 -12.515 -5.595 1.00 0.00 H new ATOM 326 N GLU A 25 -0.038 -14.656 -3.336 1.00 0.00 N ATOM 327 CA GLU A 25 1.181 -15.379 -3.679 1.00 0.00 C ATOM 328 C GLU A 25 1.267 -15.619 -5.183 1.00 0.00 C ATOM 329 O GLU A 25 2.347 -15.571 -5.769 1.00 0.00 O ATOM 330 CB GLU A 25 1.234 -16.715 -2.934 1.00 0.00 C ATOM 331 CG GLU A 25 0.361 -17.793 -3.555 1.00 0.00 C ATOM 332 CD GLU A 25 1.100 -18.618 -4.590 1.00 0.00 C ATOM 333 OE1 GLU A 25 1.321 -18.106 -5.708 1.00 0.00 O ATOM 334 OE2 GLU A 25 1.458 -19.774 -4.283 1.00 0.00 O ATOM 0 H GLU A 25 -0.478 -14.959 -2.467 1.00 0.00 H new ATOM 0 HA GLU A 25 2.032 -14.768 -3.377 1.00 0.00 H new ATOM 0 HB2 GLU A 25 2.266 -17.066 -2.907 1.00 0.00 H new ATOM 0 HB3 GLU A 25 0.923 -16.558 -1.901 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -0.011 -18.451 -2.770 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -0.508 -17.328 -4.020 1.00 0.00 H new ATOM 341 N ASN A 26 0.119 -15.880 -5.801 1.00 0.00 N ATOM 342 CA ASN A 26 0.064 -16.129 -7.237 1.00 0.00 C ATOM 343 C ASN A 26 -0.144 -14.828 -8.008 1.00 0.00 C ATOM 344 O ASN A 26 -0.972 -14.759 -8.916 1.00 0.00 O ATOM 345 CB ASN A 26 -1.061 -17.113 -7.562 1.00 0.00 C ATOM 346 CG ASN A 26 -0.694 -18.545 -7.222 1.00 0.00 C ATOM 347 OD1 ASN A 26 -1.359 -19.192 -6.414 1.00 0.00 O ATOM 348 ND2 ASN A 26 0.370 -19.045 -7.840 1.00 0.00 N ATOM 0 H ASN A 26 -0.785 -15.924 -5.330 1.00 0.00 H new ATOM 0 HA ASN A 26 1.016 -16.563 -7.542 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -1.958 -16.830 -7.011 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.304 -17.045 -8.622 1.00 0.00 H new ATOM 0 HD21 ASN A 26 0.666 -20.003 -7.652 1.00 0.00 H new ATOM 0 HD22 ASN A 26 0.891 -18.471 -8.503 1.00 0.00 H new ATOM 355 N SER A 27 0.613 -13.800 -7.638 1.00 0.00 N ATOM 356 CA SER A 27 0.510 -12.501 -8.291 1.00 0.00 C ATOM 357 C SER A 27 1.495 -12.397 -9.452 1.00 0.00 C ATOM 358 O SER A 27 2.674 -12.717 -9.310 1.00 0.00 O ATOM 359 CB SER A 27 0.769 -11.378 -7.285 1.00 0.00 C ATOM 360 OG SER A 27 -0.424 -11.009 -6.615 1.00 0.00 O ATOM 0 H SER A 27 1.304 -13.842 -6.889 1.00 0.00 H new ATOM 0 HA SER A 27 -0.501 -12.399 -8.685 1.00 0.00 H new ATOM 0 HB2 SER A 27 1.513 -11.702 -6.557 1.00 0.00 H new ATOM 0 HB3 SER A 27 1.183 -10.512 -7.801 1.00 0.00 H new ATOM 0 HG SER A 27 -0.589 -11.630 -5.876 1.00 0.00 H new ATOM 366 N ALA A 28 1.001 -11.946 -10.600 1.00 0.00 N ATOM 367 CA ALA A 28 1.836 -11.797 -11.785 1.00 0.00 C ATOM 368 C ALA A 28 2.983 -10.824 -11.530 1.00 0.00 C ATOM 369 O ALA A 28 3.001 -10.095 -10.538 1.00 0.00 O ATOM 370 CB ALA A 28 0.999 -11.330 -12.967 1.00 0.00 C ATOM 0 H ALA A 28 0.026 -11.677 -10.734 1.00 0.00 H new ATOM 0 HA ALA A 28 2.265 -12.771 -12.020 1.00 0.00 H new ATOM 0 HB1 ALA A 28 1.636 -11.223 -13.845 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.219 -12.063 -13.172 1.00 0.00 H new ATOM 0 HB3 ALA A 28 0.542 -10.369 -12.732 1.00 0.00 H new ATOM 376 N PRO A 29 3.964 -10.812 -12.444 1.00 0.00 N ATOM 377 CA PRO A 29 5.132 -9.933 -12.340 1.00 0.00 C ATOM 378 C PRO A 29 4.776 -8.466 -12.558 1.00 0.00 C ATOM 379 O PRO A 29 5.654 -7.627 -12.758 1.00 0.00 O ATOM 380 CB PRO A 29 6.053 -10.432 -13.456 1.00 0.00 C ATOM 381 CG PRO A 29 5.137 -11.062 -14.448 1.00 0.00 C ATOM 382 CD PRO A 29 4.008 -11.654 -13.652 1.00 0.00 C ATOM 0 HA PRO A 29 5.583 -9.971 -11.348 1.00 0.00 H new ATOM 0 HB2 PRO A 29 6.616 -9.612 -13.902 1.00 0.00 H new ATOM 0 HB3 PRO A 29 6.781 -11.150 -13.078 1.00 0.00 H new ATOM 0 HG2 PRO A 29 4.767 -10.325 -15.161 1.00 0.00 H new ATOM 0 HG3 PRO A 29 5.654 -11.830 -15.023 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.067 -11.618 -14.201 1.00 0.00 H new ATOM 0 HD3 PRO A 29 4.194 -12.700 -13.407 1.00 0.00 H new ATOM 390 N GLY A 30 3.482 -8.164 -12.518 1.00 0.00 N ATOM 391 CA GLY A 30 3.033 -6.798 -12.714 1.00 0.00 C ATOM 392 C GLY A 30 1.701 -6.523 -12.043 1.00 0.00 C ATOM 393 O GLY A 30 0.901 -5.727 -12.536 1.00 0.00 O ATOM 0 H GLY A 30 2.737 -8.841 -12.353 1.00 0.00 H new ATOM 0 HA2 GLY A 30 3.783 -6.112 -12.320 1.00 0.00 H new ATOM 0 HA3 GLY A 30 2.947 -6.597 -13.782 1.00 0.00 H new ATOM 397 N THR A 31 1.460 -7.186 -10.916 1.00 0.00 N ATOM 398 CA THR A 31 0.215 -7.013 -10.179 1.00 0.00 C ATOM 399 C THR A 31 0.298 -5.820 -9.233 1.00 0.00 C ATOM 400 O THR A 31 1.251 -5.668 -8.469 1.00 0.00 O ATOM 401 CB THR A 31 -0.138 -8.273 -9.367 1.00 0.00 C ATOM 402 OG1 THR A 31 -0.107 -9.427 -10.215 1.00 0.00 O ATOM 403 CG2 THR A 31 -1.514 -8.141 -8.733 1.00 0.00 C ATOM 0 H THR A 31 2.111 -7.848 -10.494 1.00 0.00 H new ATOM 0 HA THR A 31 -0.567 -6.835 -10.917 1.00 0.00 H new ATOM 0 HB THR A 31 0.601 -8.385 -8.573 1.00 0.00 H new ATOM 0 HG1 THR A 31 -0.852 -10.021 -9.986 1.00 0.00 H new ATOM 0 HG21 THR A 31 -1.741 -9.043 -8.165 1.00 0.00 H new ATOM 0 HG22 THR A 31 -1.526 -7.279 -8.066 1.00 0.00 H new ATOM 0 HG23 THR A 31 -2.263 -8.006 -9.513 1.00 0.00 H new ATOM 411 N PRO A 32 -0.724 -4.952 -9.283 1.00 0.00 N ATOM 412 CA PRO A 32 -0.790 -3.758 -8.435 1.00 0.00 C ATOM 413 C PRO A 32 -1.024 -4.100 -6.968 1.00 0.00 C ATOM 414 O PRO A 32 -1.977 -4.802 -6.629 1.00 0.00 O ATOM 415 CB PRO A 32 -1.985 -2.987 -9.001 1.00 0.00 C ATOM 416 CG PRO A 32 -2.839 -4.028 -9.641 1.00 0.00 C ATOM 417 CD PRO A 32 -1.894 -5.071 -10.169 1.00 0.00 C ATOM 0 HA PRO A 32 0.144 -3.196 -8.450 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -2.525 -2.461 -8.214 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -1.666 -2.237 -9.725 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -3.534 -4.460 -8.921 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.438 -3.601 -10.445 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -2.331 -6.068 -10.125 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -1.630 -4.884 -11.210 1.00 0.00 H new ATOM 425 N ILE A 33 -0.148 -3.601 -6.102 1.00 0.00 N ATOM 426 CA ILE A 33 -0.261 -3.853 -4.671 1.00 0.00 C ATOM 427 C ILE A 33 -1.001 -2.719 -3.970 1.00 0.00 C ATOM 428 O ILE A 33 -2.111 -2.904 -3.468 1.00 0.00 O ATOM 429 CB ILE A 33 1.123 -4.028 -4.019 1.00 0.00 C ATOM 430 CG1 ILE A 33 1.867 -5.202 -4.658 1.00 0.00 C ATOM 431 CG2 ILE A 33 0.980 -4.238 -2.519 1.00 0.00 C ATOM 432 CD1 ILE A 33 3.348 -5.219 -4.350 1.00 0.00 C ATOM 0 H ILE A 33 0.648 -3.020 -6.367 1.00 0.00 H new ATOM 0 HA ILE A 33 -0.827 -4.778 -4.557 1.00 0.00 H new ATOM 0 HB ILE A 33 1.703 -3.120 -4.185 1.00 0.00 H new ATOM 0 HG12 ILE A 33 1.422 -6.135 -4.313 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.729 -5.164 -5.739 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.967 -4.360 -2.073 1.00 0.00 H new ATOM 0 HG22 ILE A 33 0.486 -3.373 -2.076 1.00 0.00 H new ATOM 0 HG23 ILE A 33 0.384 -5.131 -2.332 1.00 0.00 H new ATOM 0 HD11 ILE A 33 3.811 -6.078 -4.835 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.807 -4.302 -4.720 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.495 -5.289 -3.272 1.00 0.00 H new ATOM 444 N LEU A 34 -0.381 -1.545 -3.939 1.00 0.00 N ATOM 445 CA LEU A 34 -0.981 -0.379 -3.301 1.00 0.00 C ATOM 446 C LEU A 34 -0.390 0.912 -3.858 1.00 0.00 C ATOM 447 O LEU A 34 0.780 0.956 -4.238 1.00 0.00 O ATOM 448 CB LEU A 34 -0.771 -0.437 -1.786 1.00 0.00 C ATOM 449 CG LEU A 34 0.655 -0.727 -1.317 1.00 0.00 C ATOM 450 CD1 LEU A 34 1.418 0.570 -1.096 1.00 0.00 C ATOM 451 CD2 LEU A 34 0.639 -1.562 -0.045 1.00 0.00 C ATOM 0 H LEU A 34 0.538 -1.375 -4.349 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.050 -0.389 -3.515 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.086 0.515 -1.359 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.430 -1.203 -1.377 1.00 0.00 H new ATOM 0 HG LEU A 34 1.164 -1.296 -2.095 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.431 0.344 -0.762 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.460 1.131 -2.030 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.911 1.166 -0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.663 -1.759 0.274 1.00 0.00 H new ATOM 0 HD22 LEU A 34 0.112 -1.019 0.740 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.131 -2.507 -0.237 1.00 0.00 H new ATOM 463 N GLN A 35 -1.206 1.960 -3.902 1.00 0.00 N ATOM 464 CA GLN A 35 -0.763 3.252 -4.411 1.00 0.00 C ATOM 465 C GLN A 35 -0.244 4.134 -3.281 1.00 0.00 C ATOM 466 O GLN A 35 -1.014 4.602 -2.441 1.00 0.00 O ATOM 467 CB GLN A 35 -1.908 3.957 -5.140 1.00 0.00 C ATOM 468 CG GLN A 35 -1.620 5.416 -5.458 1.00 0.00 C ATOM 469 CD GLN A 35 -2.449 5.934 -6.617 1.00 0.00 C ATOM 470 OE1 GLN A 35 -3.666 5.755 -6.655 1.00 0.00 O ATOM 471 NE2 GLN A 35 -1.791 6.583 -7.572 1.00 0.00 N ATOM 0 H GLN A 35 -2.177 1.940 -3.591 1.00 0.00 H new ATOM 0 HA GLN A 35 0.052 3.077 -5.113 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -2.118 3.426 -6.068 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -2.808 3.898 -4.528 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -1.818 6.023 -4.574 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -0.562 5.531 -5.693 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -0.781 6.709 -7.500 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -2.296 6.955 -8.376 1.00 0.00 H new ATOM 480 N LEU A 36 1.065 4.358 -3.264 1.00 0.00 N ATOM 481 CA LEU A 36 1.688 5.184 -2.236 1.00 0.00 C ATOM 482 C LEU A 36 1.290 6.648 -2.399 1.00 0.00 C ATOM 483 O LEU A 36 1.716 7.316 -3.341 1.00 0.00 O ATOM 484 CB LEU A 36 3.210 5.048 -2.297 1.00 0.00 C ATOM 485 CG LEU A 36 3.797 3.783 -1.667 1.00 0.00 C ATOM 486 CD1 LEU A 36 3.248 3.582 -0.263 1.00 0.00 C ATOM 487 CD2 LEU A 36 3.502 2.569 -2.536 1.00 0.00 C ATOM 0 H LEU A 36 1.716 3.979 -3.951 1.00 0.00 H new ATOM 0 HA LEU A 36 1.337 4.837 -1.264 1.00 0.00 H new ATOM 0 HB2 LEU A 36 3.516 5.085 -3.342 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.652 5.914 -1.804 1.00 0.00 H new ATOM 0 HG LEU A 36 4.878 3.902 -1.598 1.00 0.00 H new ATOM 0 HD11 LEU A 36 3.676 2.678 0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.510 4.440 0.356 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.163 3.484 -0.307 1.00 0.00 H new ATOM 0 HD21 LEU A 36 3.927 1.678 -2.073 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.424 2.447 -2.636 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.944 2.711 -3.522 1.00 0.00 H new ATOM 499 N ARG A 37 0.474 7.140 -1.473 1.00 0.00 N ATOM 500 CA ARG A 37 0.019 8.525 -1.514 1.00 0.00 C ATOM 501 C ARG A 37 0.471 9.282 -0.268 1.00 0.00 C ATOM 502 O ARG A 37 0.388 8.767 0.847 1.00 0.00 O ATOM 503 CB ARG A 37 -1.505 8.580 -1.633 1.00 0.00 C ATOM 504 CG ARG A 37 -2.003 8.621 -3.068 1.00 0.00 C ATOM 505 CD ARG A 37 -1.674 9.947 -3.735 1.00 0.00 C ATOM 506 NE ARG A 37 -2.636 10.989 -3.385 1.00 0.00 N ATOM 507 CZ ARG A 37 -3.855 11.068 -3.907 1.00 0.00 C ATOM 508 NH1 ARG A 37 -4.259 10.171 -4.796 1.00 0.00 N ATOM 509 NH2 ARG A 37 -4.674 12.045 -3.538 1.00 0.00 N ATOM 0 H ARG A 37 0.114 6.601 -0.685 1.00 0.00 H new ATOM 0 HA ARG A 37 0.462 9.002 -2.389 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -1.931 7.710 -1.134 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -1.871 9.461 -1.105 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -1.552 7.806 -3.634 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.081 8.462 -3.085 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.674 10.263 -3.439 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -1.660 9.815 -4.817 1.00 0.00 H new ATOM 0 HE ARG A 37 -2.357 11.694 -2.703 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -3.633 9.418 -5.081 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -5.196 10.234 -5.195 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -4.368 12.736 -2.853 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.610 12.105 -3.939 1.00 0.00 H new ATOM 523 N ALA A 38 0.949 10.506 -0.467 1.00 0.00 N ATOM 524 CA ALA A 38 1.412 11.334 0.640 1.00 0.00 C ATOM 525 C ALA A 38 0.579 12.606 0.760 1.00 0.00 C ATOM 526 O ALA A 38 1.115 13.690 0.990 1.00 0.00 O ATOM 527 CB ALA A 38 2.883 11.678 0.462 1.00 0.00 C ATOM 0 H ALA A 38 1.026 10.946 -1.384 1.00 0.00 H new ATOM 0 HA ALA A 38 1.293 10.765 1.562 1.00 0.00 H new ATOM 0 HB1 ALA A 38 3.215 12.297 1.296 1.00 0.00 H new ATOM 0 HB2 ALA A 38 3.470 10.760 0.434 1.00 0.00 H new ATOM 0 HB3 ALA A 38 3.019 12.224 -0.472 1.00 0.00 H new ATOM 533 N ALA A 39 -0.733 12.466 0.601 1.00 0.00 N ATOM 534 CA ALA A 39 -1.639 13.604 0.693 1.00 0.00 C ATOM 535 C ALA A 39 -1.476 14.329 2.025 1.00 0.00 C ATOM 536 O ALA A 39 -0.579 14.016 2.807 1.00 0.00 O ATOM 537 CB ALA A 39 -3.079 13.148 0.510 1.00 0.00 C ATOM 0 H ALA A 39 -1.192 11.576 0.408 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.387 14.303 -0.104 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -3.745 14.008 0.581 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.191 12.682 -0.469 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.334 12.427 1.287 1.00 0.00 H new ATOM 543 N ASP A 40 -2.349 15.299 2.275 1.00 0.00 N ATOM 544 CA ASP A 40 -2.302 16.069 3.513 1.00 0.00 C ATOM 545 C ASP A 40 -0.919 16.677 3.722 1.00 0.00 C ATOM 546 O ASP A 40 -0.289 16.470 4.760 1.00 0.00 O ATOM 547 CB ASP A 40 -2.669 15.182 4.704 1.00 0.00 C ATOM 548 CG ASP A 40 -3.611 14.058 4.321 1.00 0.00 C ATOM 549 OD1 ASP A 40 -3.133 13.048 3.764 1.00 0.00 O ATOM 550 OD2 ASP A 40 -4.827 14.189 4.577 1.00 0.00 O ATOM 0 H ASP A 40 -3.097 15.571 1.637 1.00 0.00 H new ATOM 0 HA ASP A 40 -3.027 16.879 3.437 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -1.760 14.760 5.133 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -3.133 15.793 5.479 1.00 0.00 H new ATOM 555 N LEU A 41 -0.452 17.428 2.731 1.00 0.00 N ATOM 556 CA LEU A 41 0.858 18.066 2.805 1.00 0.00 C ATOM 557 C LEU A 41 0.719 19.581 2.919 1.00 0.00 C ATOM 558 O LEU A 41 0.988 20.162 3.970 1.00 0.00 O ATOM 559 CB LEU A 41 1.692 17.709 1.574 1.00 0.00 C ATOM 560 CG LEU A 41 1.696 16.234 1.170 1.00 0.00 C ATOM 561 CD1 LEU A 41 1.986 16.088 -0.315 1.00 0.00 C ATOM 562 CD2 LEU A 41 2.716 15.460 1.993 1.00 0.00 C ATOM 0 H LEU A 41 -0.961 17.610 1.866 1.00 0.00 H new ATOM 0 HA LEU A 41 1.365 17.698 3.697 1.00 0.00 H new ATOM 0 HB2 LEU A 41 1.327 18.295 0.730 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.721 18.018 1.755 1.00 0.00 H new ATOM 0 HG LEU A 41 0.708 15.819 1.368 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.985 15.032 -0.584 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.219 16.609 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 41 2.962 16.518 -0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.706 14.412 1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.710 15.876 1.826 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.464 15.537 3.051 1.00 0.00 H new ATOM 574 N ASP A 42 0.296 20.214 1.830 1.00 0.00 N ATOM 575 CA ASP A 42 0.119 21.661 1.808 1.00 0.00 C ATOM 576 C ASP A 42 -1.278 22.030 1.319 1.00 0.00 C ATOM 577 O ASP A 42 -1.433 22.815 0.383 1.00 0.00 O ATOM 578 CB ASP A 42 1.174 22.313 0.913 1.00 0.00 C ATOM 579 CG ASP A 42 2.573 22.189 1.484 1.00 0.00 C ATOM 580 OD1 ASP A 42 3.004 21.049 1.756 1.00 0.00 O ATOM 581 OD2 ASP A 42 3.237 23.232 1.659 1.00 0.00 O ATOM 0 H ASP A 42 0.069 19.748 0.952 1.00 0.00 H new ATOM 0 HA ASP A 42 0.239 22.032 2.826 1.00 0.00 H new ATOM 0 HB2 ASP A 42 1.145 21.851 -0.074 1.00 0.00 H new ATOM 0 HB3 ASP A 42 0.931 23.367 0.779 1.00 0.00 H new ATOM 586 N VAL A 43 -2.294 21.458 1.958 1.00 0.00 N ATOM 587 CA VAL A 43 -3.679 21.726 1.588 1.00 0.00 C ATOM 588 C VAL A 43 -3.941 21.353 0.133 1.00 0.00 C ATOM 589 O VAL A 43 -4.469 22.153 -0.637 1.00 0.00 O ATOM 590 CB VAL A 43 -4.039 23.208 1.800 1.00 0.00 C ATOM 591 CG1 VAL A 43 -5.543 23.411 1.701 1.00 0.00 C ATOM 592 CG2 VAL A 43 -3.514 23.697 3.142 1.00 0.00 C ATOM 0 H VAL A 43 -2.184 20.806 2.735 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.305 21.112 2.235 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.564 23.796 1.014 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -5.779 24.464 1.853 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.888 23.101 0.715 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.042 22.813 2.464 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -3.777 24.746 3.275 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.958 23.107 3.943 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.430 23.589 3.170 1.00 0.00 H new ATOM 602 N GLY A 44 -3.568 20.132 -0.236 1.00 0.00 N ATOM 603 CA GLY A 44 -3.771 19.674 -1.598 1.00 0.00 C ATOM 604 C GLY A 44 -2.799 20.307 -2.574 1.00 0.00 C ATOM 605 O GLY A 44 -2.929 21.482 -2.916 1.00 0.00 O ATOM 0 H GLY A 44 -3.129 19.451 0.384 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.662 18.590 -1.633 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.791 19.902 -1.906 1.00 0.00 H new ATOM 609 N VAL A 45 -1.820 19.527 -3.022 1.00 0.00 N ATOM 610 CA VAL A 45 -0.822 20.019 -3.963 1.00 0.00 C ATOM 611 C VAL A 45 -0.956 19.330 -5.317 1.00 0.00 C ATOM 612 O VAL A 45 -1.770 18.423 -5.484 1.00 0.00 O ATOM 613 CB VAL A 45 0.607 19.804 -3.430 1.00 0.00 C ATOM 614 CG1 VAL A 45 0.826 20.601 -2.153 1.00 0.00 C ATOM 615 CG2 VAL A 45 0.871 18.324 -3.196 1.00 0.00 C ATOM 0 H VAL A 45 -1.697 18.552 -2.748 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.000 21.088 -4.083 1.00 0.00 H new ATOM 0 HB VAL A 45 1.313 20.162 -4.179 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.841 20.437 -1.791 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.681 21.662 -2.357 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.113 20.276 -1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 45 1.885 18.190 -2.820 1.00 0.00 H new ATOM 0 HG22 VAL A 45 0.159 17.938 -2.466 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.758 17.781 -4.135 1.00 0.00 H new ATOM 625 N ASN A 46 -0.152 19.767 -6.280 1.00 0.00 N ATOM 626 CA ASN A 46 -0.181 19.193 -7.620 1.00 0.00 C ATOM 627 C ASN A 46 0.188 17.713 -7.585 1.00 0.00 C ATOM 628 O ASN A 46 -0.413 16.895 -8.281 1.00 0.00 O ATOM 629 CB ASN A 46 0.778 19.948 -8.542 1.00 0.00 C ATOM 630 CG ASN A 46 0.532 21.444 -8.533 1.00 0.00 C ATOM 631 OD1 ASN A 46 1.379 22.221 -8.092 1.00 0.00 O ATOM 632 ND2 ASN A 46 -0.633 21.855 -9.020 1.00 0.00 N ATOM 0 H ASN A 46 0.528 20.517 -6.157 1.00 0.00 H new ATOM 0 HA ASN A 46 -1.196 19.288 -8.007 1.00 0.00 H new ATOM 0 HB2 ASN A 46 1.805 19.750 -8.234 1.00 0.00 H new ATOM 0 HB3 ASN A 46 0.672 19.571 -9.559 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -0.855 22.850 -9.039 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -1.306 21.175 -9.375 1.00 0.00 H new ATOM 639 N GLY A 47 1.183 17.375 -6.769 1.00 0.00 N ATOM 640 CA GLY A 47 1.615 15.995 -6.658 1.00 0.00 C ATOM 641 C GLY A 47 3.083 15.818 -6.991 1.00 0.00 C ATOM 642 O GLY A 47 3.427 15.300 -8.053 1.00 0.00 O ATOM 0 H GLY A 47 1.697 18.033 -6.183 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.430 15.640 -5.644 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.017 15.375 -7.326 1.00 0.00 H new ATOM 646 N GLN A 48 3.951 16.252 -6.083 1.00 0.00 N ATOM 647 CA GLN A 48 5.390 16.141 -6.287 1.00 0.00 C ATOM 648 C GLN A 48 6.051 15.413 -5.122 1.00 0.00 C ATOM 649 O GLN A 48 6.576 16.041 -4.202 1.00 0.00 O ATOM 650 CB GLN A 48 6.011 17.529 -6.455 1.00 0.00 C ATOM 651 CG GLN A 48 5.423 18.324 -7.610 1.00 0.00 C ATOM 652 CD GLN A 48 6.253 19.542 -7.962 1.00 0.00 C ATOM 653 OE1 GLN A 48 7.427 19.426 -8.316 1.00 0.00 O ATOM 654 NE2 GLN A 48 5.647 20.719 -7.869 1.00 0.00 N ATOM 0 H GLN A 48 3.683 16.684 -5.199 1.00 0.00 H new ATOM 0 HA GLN A 48 5.559 15.563 -7.195 1.00 0.00 H new ATOM 0 HB2 GLN A 48 5.876 18.092 -5.532 1.00 0.00 H new ATOM 0 HB3 GLN A 48 7.085 17.421 -6.609 1.00 0.00 H new ATOM 0 HG2 GLN A 48 5.341 17.680 -8.485 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.412 18.640 -7.351 1.00 0.00 H new ATOM 0 HE21 GLN A 48 4.673 20.769 -7.571 1.00 0.00 H new ATOM 0 HE22 GLN A 48 6.156 21.574 -8.095 1.00 0.00 H new ATOM 663 N ILE A 49 6.022 14.085 -5.168 1.00 0.00 N ATOM 664 CA ILE A 49 6.619 13.272 -4.116 1.00 0.00 C ATOM 665 C ILE A 49 7.279 12.024 -4.694 1.00 0.00 C ATOM 666 O ILE A 49 6.605 11.150 -5.239 1.00 0.00 O ATOM 667 CB ILE A 49 5.572 12.847 -3.069 1.00 0.00 C ATOM 668 CG1 ILE A 49 4.871 14.077 -2.490 1.00 0.00 C ATOM 669 CG2 ILE A 49 6.228 12.034 -1.963 1.00 0.00 C ATOM 670 CD1 ILE A 49 5.773 14.940 -1.635 1.00 0.00 C ATOM 0 H ILE A 49 5.592 13.550 -5.922 1.00 0.00 H new ATOM 0 HA ILE A 49 7.375 13.889 -3.631 1.00 0.00 H new ATOM 0 HB ILE A 49 4.824 12.222 -3.557 1.00 0.00 H new ATOM 0 HG12 ILE A 49 4.475 14.678 -3.308 1.00 0.00 H new ATOM 0 HG13 ILE A 49 4.019 13.752 -1.892 1.00 0.00 H new ATOM 0 HG21 ILE A 49 5.475 11.741 -1.231 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.685 11.141 -2.390 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.994 12.636 -1.474 1.00 0.00 H new ATOM 0 HD11 ILE A 49 5.209 15.794 -1.258 1.00 0.00 H new ATOM 0 HD12 ILE A 49 6.149 14.354 -0.796 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.612 15.295 -2.234 1.00 0.00 H new ATOM 682 N GLU A 50 8.600 11.947 -4.568 1.00 0.00 N ATOM 683 CA GLU A 50 9.350 10.805 -5.077 1.00 0.00 C ATOM 684 C GLU A 50 9.308 9.643 -4.090 1.00 0.00 C ATOM 685 O GLU A 50 9.852 9.730 -2.988 1.00 0.00 O ATOM 686 CB GLU A 50 10.802 11.203 -5.353 1.00 0.00 C ATOM 687 CG GLU A 50 11.443 10.419 -6.486 1.00 0.00 C ATOM 688 CD GLU A 50 12.724 11.057 -6.985 1.00 0.00 C ATOM 689 OE1 GLU A 50 13.203 12.011 -6.336 1.00 0.00 O ATOM 690 OE2 GLU A 50 13.248 10.604 -8.024 1.00 0.00 O ATOM 0 H GLU A 50 9.172 12.661 -4.118 1.00 0.00 H new ATOM 0 HA GLU A 50 8.885 10.484 -6.009 1.00 0.00 H new ATOM 0 HB2 GLU A 50 10.840 12.266 -5.591 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.388 11.059 -4.445 1.00 0.00 H new ATOM 0 HG2 GLU A 50 11.655 9.405 -6.147 1.00 0.00 H new ATOM 0 HG3 GLU A 50 10.736 10.338 -7.312 1.00 0.00 H new ATOM 697 N TYR A 51 8.659 8.556 -4.492 1.00 0.00 N ATOM 698 CA TYR A 51 8.543 7.377 -3.642 1.00 0.00 C ATOM 699 C TYR A 51 9.540 6.302 -4.063 1.00 0.00 C ATOM 700 O TYR A 51 9.451 5.751 -5.161 1.00 0.00 O ATOM 701 CB TYR A 51 7.120 6.819 -3.700 1.00 0.00 C ATOM 702 CG TYR A 51 6.049 7.869 -3.508 1.00 0.00 C ATOM 703 CD1 TYR A 51 5.598 8.633 -4.578 1.00 0.00 C ATOM 704 CD2 TYR A 51 5.490 8.099 -2.258 1.00 0.00 C ATOM 705 CE1 TYR A 51 4.621 9.594 -4.407 1.00 0.00 C ATOM 706 CE2 TYR A 51 4.511 9.057 -2.078 1.00 0.00 C ATOM 707 CZ TYR A 51 4.080 9.802 -3.155 1.00 0.00 C ATOM 708 OH TYR A 51 3.106 10.758 -2.980 1.00 0.00 O ATOM 0 H TYR A 51 8.205 8.467 -5.401 1.00 0.00 H new ATOM 0 HA TYR A 51 8.768 7.675 -2.618 1.00 0.00 H new ATOM 0 HB2 TYR A 51 6.969 6.330 -4.663 1.00 0.00 H new ATOM 0 HB3 TYR A 51 7.008 6.053 -2.933 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.019 8.472 -5.560 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.826 7.519 -1.412 1.00 0.00 H new ATOM 0 HE1 TYR A 51 4.282 10.180 -5.249 1.00 0.00 H new ATOM 0 HE2 TYR A 51 4.086 9.221 -1.099 1.00 0.00 H new ATOM 0 HH TYR A 51 2.226 10.328 -2.957 1.00 0.00 H new ATOM 718 N VAL A 52 10.490 6.007 -3.181 1.00 0.00 N ATOM 719 CA VAL A 52 11.505 4.997 -3.459 1.00 0.00 C ATOM 720 C VAL A 52 11.592 3.981 -2.325 1.00 0.00 C ATOM 721 O VAL A 52 11.021 4.180 -1.253 1.00 0.00 O ATOM 722 CB VAL A 52 12.890 5.636 -3.669 1.00 0.00 C ATOM 723 CG1 VAL A 52 12.888 6.521 -4.907 1.00 0.00 C ATOM 724 CG2 VAL A 52 13.304 6.428 -2.438 1.00 0.00 C ATOM 0 H VAL A 52 10.578 6.453 -2.268 1.00 0.00 H new ATOM 0 HA VAL A 52 11.205 4.490 -4.376 1.00 0.00 H new ATOM 0 HB VAL A 52 13.618 4.840 -3.822 1.00 0.00 H new ATOM 0 HG11 VAL A 52 13.875 6.964 -5.039 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.639 5.921 -5.783 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.148 7.313 -4.787 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.285 6.873 -2.604 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.575 7.217 -2.251 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.348 5.763 -1.576 1.00 0.00 H new ATOM 734 N PHE A 53 12.312 2.891 -2.570 1.00 0.00 N ATOM 735 CA PHE A 53 12.475 1.843 -1.570 1.00 0.00 C ATOM 736 C PHE A 53 13.433 2.286 -0.468 1.00 0.00 C ATOM 737 O PHE A 53 14.648 2.141 -0.591 1.00 0.00 O ATOM 738 CB PHE A 53 12.992 0.560 -2.225 1.00 0.00 C ATOM 739 CG PHE A 53 11.899 -0.339 -2.728 1.00 0.00 C ATOM 740 CD1 PHE A 53 10.961 -0.866 -1.855 1.00 0.00 C ATOM 741 CD2 PHE A 53 11.811 -0.657 -4.074 1.00 0.00 C ATOM 742 CE1 PHE A 53 9.954 -1.693 -2.315 1.00 0.00 C ATOM 743 CE2 PHE A 53 10.805 -1.483 -4.539 1.00 0.00 C ATOM 744 CZ PHE A 53 9.876 -2.003 -3.659 1.00 0.00 C ATOM 0 H PHE A 53 12.791 2.711 -3.452 1.00 0.00 H new ATOM 0 HA PHE A 53 11.500 1.648 -1.123 1.00 0.00 H new ATOM 0 HB2 PHE A 53 13.646 0.824 -3.056 1.00 0.00 H new ATOM 0 HB3 PHE A 53 13.599 0.012 -1.504 1.00 0.00 H new ATOM 0 HD1 PHE A 53 11.018 -0.628 -0.803 1.00 0.00 H new ATOM 0 HD2 PHE A 53 12.536 -0.255 -4.767 1.00 0.00 H new ATOM 0 HE1 PHE A 53 9.228 -2.097 -1.624 1.00 0.00 H new ATOM 0 HE2 PHE A 53 10.745 -1.722 -5.591 1.00 0.00 H new ATOM 0 HZ PHE A 53 9.091 -2.650 -4.021 1.00 0.00 H new ATOM 754 N GLY A 54 12.875 2.828 0.611 1.00 0.00 N ATOM 755 CA GLY A 54 13.692 3.285 1.719 1.00 0.00 C ATOM 756 C GLY A 54 14.526 2.172 2.322 1.00 0.00 C ATOM 757 O GLY A 54 15.628 1.889 1.852 1.00 0.00 O ATOM 0 H GLY A 54 11.871 2.958 0.737 1.00 0.00 H new ATOM 0 HA2 GLY A 54 14.350 4.083 1.376 1.00 0.00 H new ATOM 0 HA3 GLY A 54 13.049 3.711 2.489 1.00 0.00 H new ATOM 761 N ALA A 55 14.001 1.541 3.367 1.00 0.00 N ATOM 762 CA ALA A 55 14.704 0.453 4.035 1.00 0.00 C ATOM 763 C ALA A 55 14.200 -0.903 3.554 1.00 0.00 C ATOM 764 O ALA A 55 13.447 -1.579 4.254 1.00 0.00 O ATOM 765 CB ALA A 55 14.549 0.572 5.544 1.00 0.00 C ATOM 0 H ALA A 55 13.091 1.765 3.769 1.00 0.00 H new ATOM 0 HA ALA A 55 15.762 0.528 3.783 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.079 -0.247 6.030 1.00 0.00 H new ATOM 0 HB2 ALA A 55 14.965 1.522 5.879 1.00 0.00 H new ATOM 0 HB3 ALA A 55 13.492 0.526 5.806 1.00 0.00 H new ATOM 771 N ALA A 56 14.620 -1.295 2.356 1.00 0.00 N ATOM 772 CA ALA A 56 14.212 -2.571 1.783 1.00 0.00 C ATOM 773 C ALA A 56 15.424 -3.410 1.391 1.00 0.00 C ATOM 774 O ALA A 56 16.558 -2.931 1.415 1.00 0.00 O ATOM 775 CB ALA A 56 13.312 -2.345 0.576 1.00 0.00 C ATOM 0 H ALA A 56 15.243 -0.747 1.763 1.00 0.00 H new ATOM 0 HA ALA A 56 13.653 -3.119 2.542 1.00 0.00 H new ATOM 0 HB1 ALA A 56 13.015 -3.307 0.158 1.00 0.00 H new ATOM 0 HB2 ALA A 56 12.424 -1.793 0.883 1.00 0.00 H new ATOM 0 HB3 ALA A 56 13.852 -1.773 -0.179 1.00 0.00 H new ATOM 781 N THR A 57 15.177 -4.666 1.031 1.00 0.00 N ATOM 782 CA THR A 57 16.248 -5.572 0.636 1.00 0.00 C ATOM 783 C THR A 57 16.338 -5.689 -0.881 1.00 0.00 C ATOM 784 O THR A 57 15.346 -5.509 -1.586 1.00 0.00 O ATOM 785 CB THR A 57 16.046 -6.976 1.236 1.00 0.00 C ATOM 786 OG1 THR A 57 16.864 -7.927 0.545 1.00 0.00 O ATOM 787 CG2 THR A 57 14.587 -7.397 1.150 1.00 0.00 C ATOM 0 H THR A 57 14.244 -5.078 1.005 1.00 0.00 H new ATOM 0 HA THR A 57 17.176 -5.150 1.021 1.00 0.00 H new ATOM 0 HB THR A 57 16.337 -6.943 2.286 1.00 0.00 H new ATOM 0 HG1 THR A 57 16.731 -8.817 0.934 1.00 0.00 H new ATOM 0 HG21 THR A 57 14.469 -8.392 1.580 1.00 0.00 H new ATOM 0 HG22 THR A 57 13.970 -6.688 1.702 1.00 0.00 H new ATOM 0 HG23 THR A 57 14.274 -7.414 0.106 1.00 0.00 H new ATOM 795 N GLU A 58 17.534 -5.991 -1.377 1.00 0.00 N ATOM 796 CA GLU A 58 17.752 -6.131 -2.812 1.00 0.00 C ATOM 797 C GLU A 58 16.793 -7.156 -3.410 1.00 0.00 C ATOM 798 O GLU A 58 16.556 -7.168 -4.618 1.00 0.00 O ATOM 799 CB GLU A 58 19.198 -6.545 -3.092 1.00 0.00 C ATOM 800 CG GLU A 58 19.568 -7.898 -2.507 1.00 0.00 C ATOM 801 CD GLU A 58 20.938 -8.371 -2.953 1.00 0.00 C ATOM 802 OE1 GLU A 58 21.794 -7.514 -3.254 1.00 0.00 O ATOM 803 OE2 GLU A 58 21.154 -9.601 -3.000 1.00 0.00 O ATOM 0 H GLU A 58 18.366 -6.143 -0.807 1.00 0.00 H new ATOM 0 HA GLU A 58 17.561 -5.165 -3.279 1.00 0.00 H new ATOM 0 HB2 GLU A 58 19.358 -6.569 -4.170 1.00 0.00 H new ATOM 0 HB3 GLU A 58 19.869 -5.788 -2.687 1.00 0.00 H new ATOM 0 HG2 GLU A 58 19.545 -7.838 -1.419 1.00 0.00 H new ATOM 0 HG3 GLU A 58 18.820 -8.634 -2.802 1.00 0.00 H new ATOM 810 N SER A 59 16.245 -8.014 -2.556 1.00 0.00 N ATOM 811 CA SER A 59 15.315 -9.046 -3.000 1.00 0.00 C ATOM 812 C SER A 59 13.917 -8.468 -3.199 1.00 0.00 C ATOM 813 O SER A 59 13.136 -8.967 -4.009 1.00 0.00 O ATOM 814 CB SER A 59 15.266 -10.190 -1.985 1.00 0.00 C ATOM 815 OG SER A 59 16.558 -10.729 -1.763 1.00 0.00 O ATOM 0 H SER A 59 16.429 -8.015 -1.553 1.00 0.00 H new ATOM 0 HA SER A 59 15.669 -9.433 -3.956 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.853 -9.828 -1.044 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.599 -10.973 -2.346 1.00 0.00 H new ATOM 0 HG SER A 59 16.501 -11.457 -1.110 1.00 0.00 H new ATOM 821 N VAL A 60 13.608 -7.412 -2.453 1.00 0.00 N ATOM 822 CA VAL A 60 12.306 -6.764 -2.547 1.00 0.00 C ATOM 823 C VAL A 60 12.221 -5.876 -3.783 1.00 0.00 C ATOM 824 O VAL A 60 11.171 -5.776 -4.418 1.00 0.00 O ATOM 825 CB VAL A 60 12.010 -5.914 -1.297 1.00 0.00 C ATOM 826 CG1 VAL A 60 10.767 -5.064 -1.510 1.00 0.00 C ATOM 827 CG2 VAL A 60 11.854 -6.804 -0.073 1.00 0.00 C ATOM 0 H VAL A 60 14.242 -6.987 -1.777 1.00 0.00 H new ATOM 0 HA VAL A 60 11.563 -7.558 -2.622 1.00 0.00 H new ATOM 0 HB VAL A 60 12.853 -5.244 -1.127 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.574 -4.471 -0.616 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.922 -4.400 -2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.913 -5.712 -1.707 1.00 0.00 H new ATOM 0 HG21 VAL A 60 11.645 -6.187 0.801 1.00 0.00 H new ATOM 0 HG22 VAL A 60 11.030 -7.500 -0.232 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.775 -7.364 0.090 1.00 0.00 H new ATOM 837 N ARG A 61 13.334 -5.232 -4.119 1.00 0.00 N ATOM 838 CA ARG A 61 13.386 -4.351 -5.280 1.00 0.00 C ATOM 839 C ARG A 61 13.319 -5.154 -6.576 1.00 0.00 C ATOM 840 O ARG A 61 12.753 -4.701 -7.570 1.00 0.00 O ATOM 841 CB ARG A 61 14.665 -3.512 -5.253 1.00 0.00 C ATOM 842 CG ARG A 61 15.919 -4.302 -5.588 1.00 0.00 C ATOM 843 CD ARG A 61 17.052 -3.389 -6.030 1.00 0.00 C ATOM 844 NE ARG A 61 18.355 -4.037 -5.912 1.00 0.00 N ATOM 845 CZ ARG A 61 19.417 -3.687 -6.630 1.00 0.00 C ATOM 846 NH1 ARG A 61 19.330 -2.700 -7.511 1.00 0.00 N ATOM 847 NH2 ARG A 61 20.569 -4.325 -6.466 1.00 0.00 N ATOM 0 H ARG A 61 14.212 -5.304 -3.604 1.00 0.00 H new ATOM 0 HA ARG A 61 12.523 -3.687 -5.240 1.00 0.00 H new ATOM 0 HB2 ARG A 61 14.564 -2.689 -5.961 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.778 -3.069 -4.263 1.00 0.00 H new ATOM 0 HG2 ARG A 61 16.232 -4.876 -4.716 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.698 -5.019 -6.379 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.890 -3.086 -7.064 1.00 0.00 H new ATOM 0 HD3 ARG A 61 17.043 -2.481 -5.426 1.00 0.00 H new ATOM 0 HE ARG A 61 18.456 -4.800 -5.242 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.446 -2.207 -7.639 1.00 0.00 H new ATOM 0 HH12 ARG A 61 20.147 -2.434 -8.061 1.00 0.00 H new ATOM 0 HH21 ARG A 61 20.640 -5.084 -5.789 1.00 0.00 H new ATOM 0 HH22 ARG A 61 21.384 -4.056 -7.017 1.00 0.00 H new ATOM 861 N ARG A 62 13.902 -6.349 -6.556 1.00 0.00 N ATOM 862 CA ARG A 62 13.911 -7.214 -7.730 1.00 0.00 C ATOM 863 C ARG A 62 12.588 -7.963 -7.862 1.00 0.00 C ATOM 864 O ARG A 62 12.041 -8.090 -8.958 1.00 0.00 O ATOM 865 CB ARG A 62 15.067 -8.211 -7.646 1.00 0.00 C ATOM 866 CG ARG A 62 14.834 -9.333 -6.647 1.00 0.00 C ATOM 867 CD ARG A 62 15.977 -10.335 -6.657 1.00 0.00 C ATOM 868 NE ARG A 62 15.687 -11.505 -5.832 1.00 0.00 N ATOM 869 CZ ARG A 62 16.253 -12.693 -6.017 1.00 0.00 C ATOM 870 NH1 ARG A 62 17.135 -12.866 -6.991 1.00 0.00 N ATOM 871 NH2 ARG A 62 15.937 -13.709 -5.225 1.00 0.00 N ATOM 0 H ARG A 62 14.374 -6.740 -5.740 1.00 0.00 H new ATOM 0 HA ARG A 62 14.044 -6.587 -8.612 1.00 0.00 H new ATOM 0 HB2 ARG A 62 15.235 -8.644 -8.632 1.00 0.00 H new ATOM 0 HB3 ARG A 62 15.977 -7.677 -7.373 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.725 -8.914 -5.647 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.900 -9.843 -6.882 1.00 0.00 H new ATOM 0 HD2 ARG A 62 16.171 -10.653 -7.681 1.00 0.00 H new ATOM 0 HD3 ARG A 62 16.885 -9.853 -6.295 1.00 0.00 H new ATOM 0 HE ARG A 62 15.013 -11.405 -5.073 1.00 0.00 H new ATOM 0 HH11 ARG A 62 17.381 -12.086 -7.601 1.00 0.00 H new ATOM 0 HH12 ARG A 62 17.568 -13.779 -7.131 1.00 0.00 H new ATOM 0 HH21 ARG A 62 15.259 -13.579 -4.474 1.00 0.00 H new ATOM 0 HH22 ARG A 62 16.372 -14.621 -5.367 1.00 0.00 H new ATOM 885 N LEU A 63 12.079 -8.457 -6.739 1.00 0.00 N ATOM 886 CA LEU A 63 10.820 -9.195 -6.729 1.00 0.00 C ATOM 887 C LEU A 63 9.631 -8.242 -6.789 1.00 0.00 C ATOM 888 O LEU A 63 8.579 -8.578 -7.336 1.00 0.00 O ATOM 889 CB LEU A 63 10.727 -10.066 -5.475 1.00 0.00 C ATOM 890 CG LEU A 63 9.356 -10.677 -5.183 1.00 0.00 C ATOM 891 CD1 LEU A 63 9.013 -11.739 -6.217 1.00 0.00 C ATOM 892 CD2 LEU A 63 9.323 -11.266 -3.780 1.00 0.00 C ATOM 0 H LEU A 63 12.518 -8.360 -5.824 1.00 0.00 H new ATOM 0 HA LEU A 63 10.795 -9.835 -7.611 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.452 -10.875 -5.564 1.00 0.00 H new ATOM 0 HB3 LEU A 63 11.025 -9.465 -4.616 1.00 0.00 H new ATOM 0 HG LEU A 63 8.607 -9.887 -5.242 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.034 -12.162 -5.993 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.995 -11.288 -7.209 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.764 -12.528 -6.191 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.340 -11.696 -3.589 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.082 -12.043 -3.694 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.523 -10.481 -3.051 1.00 0.00 H new ATOM 904 N LEU A 64 9.804 -7.051 -6.226 1.00 0.00 N ATOM 905 CA LEU A 64 8.745 -6.047 -6.217 1.00 0.00 C ATOM 906 C LEU A 64 9.249 -4.720 -6.776 1.00 0.00 C ATOM 907 O LEU A 64 10.369 -4.298 -6.486 1.00 0.00 O ATOM 908 CB LEU A 64 8.216 -5.848 -4.796 1.00 0.00 C ATOM 909 CG LEU A 64 7.652 -7.092 -4.109 1.00 0.00 C ATOM 910 CD1 LEU A 64 7.875 -7.019 -2.606 1.00 0.00 C ATOM 911 CD2 LEU A 64 6.172 -7.250 -4.423 1.00 0.00 C ATOM 0 H LEU A 64 10.668 -6.757 -5.770 1.00 0.00 H new ATOM 0 HA LEU A 64 7.934 -6.403 -6.853 1.00 0.00 H new ATOM 0 HB2 LEU A 64 9.025 -5.453 -4.181 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.436 -5.087 -4.824 1.00 0.00 H new ATOM 0 HG LEU A 64 8.179 -7.966 -4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.467 -7.913 -2.134 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.943 -6.955 -2.399 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.375 -6.137 -2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 64 5.788 -8.141 -3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 64 5.629 -6.374 -4.069 1.00 0.00 H new ATOM 0 HD23 LEU A 64 6.037 -7.349 -5.500 1.00 0.00 H new ATOM 923 N ARG A 65 8.413 -4.066 -7.576 1.00 0.00 N ATOM 924 CA ARG A 65 8.773 -2.786 -8.174 1.00 0.00 C ATOM 925 C ARG A 65 7.925 -1.657 -7.594 1.00 0.00 C ATOM 926 O ARG A 65 6.725 -1.820 -7.370 1.00 0.00 O ATOM 927 CB ARG A 65 8.598 -2.841 -9.693 1.00 0.00 C ATOM 928 CG ARG A 65 9.242 -1.674 -10.423 1.00 0.00 C ATOM 929 CD ARG A 65 10.702 -1.955 -10.744 1.00 0.00 C ATOM 930 NE ARG A 65 11.444 -0.731 -11.034 1.00 0.00 N ATOM 931 CZ ARG A 65 11.351 -0.069 -12.182 1.00 0.00 C ATOM 932 NH1 ARG A 65 10.551 -0.511 -13.143 1.00 0.00 N ATOM 933 NH2 ARG A 65 12.058 1.038 -12.371 1.00 0.00 N ATOM 0 H ARG A 65 7.482 -4.401 -7.825 1.00 0.00 H new ATOM 0 HA ARG A 65 9.819 -2.587 -7.943 1.00 0.00 H new ATOM 0 HB2 ARG A 65 9.025 -3.772 -10.066 1.00 0.00 H new ATOM 0 HB3 ARG A 65 7.534 -2.862 -9.927 1.00 0.00 H new ATOM 0 HG2 ARG A 65 8.697 -1.475 -11.346 1.00 0.00 H new ATOM 0 HG3 ARG A 65 9.169 -0.775 -9.810 1.00 0.00 H new ATOM 0 HD2 ARG A 65 11.166 -2.469 -9.902 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.762 -2.627 -11.600 1.00 0.00 H new ATOM 0 HE ARG A 65 12.068 -0.364 -10.315 1.00 0.00 H new ATOM 0 HH11 ARG A 65 10.005 -1.361 -13.002 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.481 -0.001 -14.024 1.00 0.00 H new ATOM 0 HH21 ARG A 65 12.674 1.382 -11.634 1.00 0.00 H new ATOM 0 HH22 ARG A 65 11.985 1.545 -13.253 1.00 0.00 H new ATOM 947 N LEU A 66 8.557 -0.514 -7.354 1.00 0.00 N ATOM 948 CA LEU A 66 7.861 0.643 -6.800 1.00 0.00 C ATOM 949 C LEU A 66 8.047 1.868 -7.689 1.00 0.00 C ATOM 950 O LEU A 66 9.099 2.047 -8.305 1.00 0.00 O ATOM 951 CB LEU A 66 8.370 0.941 -5.389 1.00 0.00 C ATOM 952 CG LEU A 66 8.083 2.345 -4.854 1.00 0.00 C ATOM 953 CD1 LEU A 66 6.589 2.548 -4.662 1.00 0.00 C ATOM 954 CD2 LEU A 66 8.828 2.581 -3.549 1.00 0.00 C ATOM 0 H LEU A 66 9.550 -0.363 -7.534 1.00 0.00 H new ATOM 0 HA LEU A 66 6.797 0.409 -6.754 1.00 0.00 H new ATOM 0 HB2 LEU A 66 7.929 0.216 -4.705 1.00 0.00 H new ATOM 0 HB3 LEU A 66 9.448 0.781 -5.372 1.00 0.00 H new ATOM 0 HG LEU A 66 8.436 3.071 -5.586 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.404 3.552 -4.281 1.00 0.00 H new ATOM 0 HD12 LEU A 66 6.079 2.423 -5.617 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.211 1.815 -3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.612 3.585 -3.183 1.00 0.00 H new ATOM 0 HD22 LEU A 66 8.507 1.848 -2.809 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.900 2.479 -3.719 1.00 0.00 H new ATOM 966 N ASP A 67 7.021 2.709 -7.751 1.00 0.00 N ATOM 967 CA ASP A 67 7.073 3.920 -8.562 1.00 0.00 C ATOM 968 C ASP A 67 7.199 5.159 -7.682 1.00 0.00 C ATOM 969 O ASP A 67 6.955 5.103 -6.477 1.00 0.00 O ATOM 970 CB ASP A 67 5.823 4.026 -9.438 1.00 0.00 C ATOM 971 CG ASP A 67 5.884 3.114 -10.647 1.00 0.00 C ATOM 972 OD1 ASP A 67 7.005 2.815 -11.109 1.00 0.00 O ATOM 973 OD2 ASP A 67 4.811 2.698 -11.130 1.00 0.00 O ATOM 0 H ASP A 67 6.143 2.575 -7.249 1.00 0.00 H new ATOM 0 HA ASP A 67 7.953 3.861 -9.203 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.944 3.778 -8.843 1.00 0.00 H new ATOM 0 HB3 ASP A 67 5.702 5.057 -9.770 1.00 0.00 H new ATOM 978 N GLU A 68 7.583 6.276 -8.292 1.00 0.00 N ATOM 979 CA GLU A 68 7.743 7.528 -7.562 1.00 0.00 C ATOM 980 C GLU A 68 6.953 8.651 -8.228 1.00 0.00 C ATOM 981 O GLU A 68 6.310 9.458 -7.556 1.00 0.00 O ATOM 982 CB GLU A 68 9.222 7.910 -7.479 1.00 0.00 C ATOM 983 CG GLU A 68 10.007 7.585 -8.739 1.00 0.00 C ATOM 984 CD GLU A 68 10.496 6.150 -8.767 1.00 0.00 C ATOM 985 OE1 GLU A 68 10.738 5.584 -7.681 1.00 0.00 O ATOM 986 OE2 GLU A 68 10.638 5.594 -9.877 1.00 0.00 O ATOM 0 H GLU A 68 7.789 6.339 -9.289 1.00 0.00 H new ATOM 0 HA GLU A 68 7.355 7.383 -6.554 1.00 0.00 H new ATOM 0 HB2 GLU A 68 9.302 8.978 -7.277 1.00 0.00 H new ATOM 0 HB3 GLU A 68 9.676 7.391 -6.635 1.00 0.00 H new ATOM 0 HG2 GLU A 68 9.379 7.768 -9.611 1.00 0.00 H new ATOM 0 HG3 GLU A 68 10.861 8.258 -8.814 1.00 0.00 H new ATOM 993 N THR A 69 7.007 8.698 -9.556 1.00 0.00 N ATOM 994 CA THR A 69 6.299 9.722 -10.314 1.00 0.00 C ATOM 995 C THR A 69 4.791 9.514 -10.243 1.00 0.00 C ATOM 996 O THR A 69 4.020 10.473 -10.277 1.00 0.00 O ATOM 997 CB THR A 69 6.736 9.730 -11.791 1.00 0.00 C ATOM 998 OG1 THR A 69 8.153 9.913 -11.882 1.00 0.00 O ATOM 999 CG2 THR A 69 6.027 10.834 -12.559 1.00 0.00 C ATOM 0 H THR A 69 7.534 8.038 -10.128 1.00 0.00 H new ATOM 0 HA THR A 69 6.552 10.681 -9.863 1.00 0.00 H new ATOM 0 HB THR A 69 6.465 8.771 -12.232 1.00 0.00 H new ATOM 0 HG1 THR A 69 8.423 9.915 -12.824 1.00 0.00 H new ATOM 0 HG21 THR A 69 6.352 10.820 -13.599 1.00 0.00 H new ATOM 0 HG22 THR A 69 4.950 10.675 -12.513 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.271 11.800 -12.116 1.00 0.00 H new ATOM 1007 N SER A 70 4.375 8.255 -10.144 1.00 0.00 N ATOM 1008 CA SER A 70 2.957 7.922 -10.071 1.00 0.00 C ATOM 1009 C SER A 70 2.569 7.508 -8.655 1.00 0.00 C ATOM 1010 O SER A 70 1.461 7.784 -8.198 1.00 0.00 O ATOM 1011 CB SER A 70 2.626 6.796 -11.053 1.00 0.00 C ATOM 1012 OG SER A 70 3.531 5.715 -10.914 1.00 0.00 O ATOM 0 H SER A 70 5.000 7.449 -10.113 1.00 0.00 H new ATOM 0 HA SER A 70 2.385 8.810 -10.341 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.608 6.446 -10.880 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.664 7.177 -12.074 1.00 0.00 H new ATOM 0 HG SER A 70 3.297 5.008 -11.551 1.00 0.00 H new ATOM 1018 N GLY A 71 3.490 6.842 -7.966 1.00 0.00 N ATOM 1019 CA GLY A 71 3.226 6.400 -6.609 1.00 0.00 C ATOM 1020 C GLY A 71 2.481 5.081 -6.564 1.00 0.00 C ATOM 1021 O GLY A 71 1.802 4.777 -5.583 1.00 0.00 O ATOM 0 H GLY A 71 4.414 6.600 -8.323 1.00 0.00 H new ATOM 0 HA2 GLY A 71 4.170 6.299 -6.073 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.644 7.161 -6.089 1.00 0.00 H new ATOM 1025 N TRP A 72 2.606 4.296 -7.628 1.00 0.00 N ATOM 1026 CA TRP A 72 1.937 3.002 -7.706 1.00 0.00 C ATOM 1027 C TRP A 72 2.938 1.862 -7.551 1.00 0.00 C ATOM 1028 O TRP A 72 3.928 1.788 -8.280 1.00 0.00 O ATOM 1029 CB TRP A 72 1.195 2.868 -9.037 1.00 0.00 C ATOM 1030 CG TRP A 72 -0.201 3.412 -8.996 1.00 0.00 C ATOM 1031 CD1 TRP A 72 -0.636 4.594 -9.524 1.00 0.00 C ATOM 1032 CD2 TRP A 72 -1.343 2.795 -8.392 1.00 0.00 C ATOM 1033 NE1 TRP A 72 -1.980 4.749 -9.285 1.00 0.00 N ATOM 1034 CE2 TRP A 72 -2.438 3.658 -8.593 1.00 0.00 C ATOM 1035 CE3 TRP A 72 -1.549 1.597 -7.704 1.00 0.00 C ATOM 1036 CZ2 TRP A 72 -3.716 3.360 -8.129 1.00 0.00 C ATOM 1037 CZ3 TRP A 72 -2.818 1.302 -7.243 1.00 0.00 C ATOM 1038 CH2 TRP A 72 -3.888 2.180 -7.458 1.00 0.00 C ATOM 0 H TRP A 72 3.164 4.533 -8.448 1.00 0.00 H new ATOM 0 HA TRP A 72 1.217 2.943 -6.889 1.00 0.00 H new ATOM 0 HB2 TRP A 72 1.757 3.388 -9.812 1.00 0.00 H new ATOM 0 HB3 TRP A 72 1.159 1.816 -9.321 1.00 0.00 H new ATOM 0 HD1 TRP A 72 -0.015 5.303 -10.052 1.00 0.00 H new ATOM 0 HE1 TRP A 72 -2.545 5.547 -9.575 1.00 0.00 H new ATOM 0 HE3 TRP A 72 -0.731 0.913 -7.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 -4.542 4.036 -8.293 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 -2.988 0.379 -6.708 1.00 0.00 H new ATOM 0 HH2 TRP A 72 -4.868 1.920 -7.087 1.00 0.00 H new ATOM 1049 N LEU A 73 2.673 0.975 -6.598 1.00 0.00 N ATOM 1050 CA LEU A 73 3.551 -0.163 -6.348 1.00 0.00 C ATOM 1051 C LEU A 73 2.932 -1.455 -6.871 1.00 0.00 C ATOM 1052 O LEU A 73 1.738 -1.698 -6.695 1.00 0.00 O ATOM 1053 CB LEU A 73 3.838 -0.292 -4.851 1.00 0.00 C ATOM 1054 CG LEU A 73 5.198 -0.880 -4.476 1.00 0.00 C ATOM 1055 CD1 LEU A 73 5.594 -0.456 -3.070 1.00 0.00 C ATOM 1056 CD2 LEU A 73 5.173 -2.397 -4.590 1.00 0.00 C ATOM 0 H LEU A 73 1.858 1.022 -5.986 1.00 0.00 H new ATOM 0 HA LEU A 73 4.487 0.010 -6.878 1.00 0.00 H new ATOM 0 HB2 LEU A 73 3.755 0.696 -4.399 1.00 0.00 H new ATOM 0 HB3 LEU A 73 3.061 -0.913 -4.405 1.00 0.00 H new ATOM 0 HG LEU A 73 5.943 -0.495 -5.173 1.00 0.00 H new ATOM 0 HD11 LEU A 73 6.565 -0.884 -2.821 1.00 0.00 H new ATOM 0 HD12 LEU A 73 5.654 0.631 -3.021 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.848 -0.811 -2.359 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.150 -2.798 -4.319 1.00 0.00 H new ATOM 0 HD22 LEU A 73 4.416 -2.800 -3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 73 4.936 -2.681 -5.615 1.00 0.00 H new ATOM 1068 N SER A 74 3.751 -2.280 -7.514 1.00 0.00 N ATOM 1069 CA SER A 74 3.283 -3.547 -8.065 1.00 0.00 C ATOM 1070 C SER A 74 4.402 -4.584 -8.069 1.00 0.00 C ATOM 1071 O SER A 74 5.548 -4.279 -7.739 1.00 0.00 O ATOM 1072 CB SER A 74 2.755 -3.345 -9.487 1.00 0.00 C ATOM 1073 OG SER A 74 3.812 -3.068 -10.389 1.00 0.00 O ATOM 0 H SER A 74 4.742 -2.094 -7.667 1.00 0.00 H new ATOM 0 HA SER A 74 2.474 -3.913 -7.433 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.222 -4.239 -9.811 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.038 -2.524 -9.499 1.00 0.00 H new ATOM 0 HG SER A 74 3.449 -2.945 -11.291 1.00 0.00 H new ATOM 1079 N VAL A 75 4.060 -5.812 -8.444 1.00 0.00 N ATOM 1080 CA VAL A 75 5.035 -6.896 -8.492 1.00 0.00 C ATOM 1081 C VAL A 75 5.869 -6.828 -9.766 1.00 0.00 C ATOM 1082 O VAL A 75 5.425 -6.298 -10.785 1.00 0.00 O ATOM 1083 CB VAL A 75 4.348 -8.272 -8.415 1.00 0.00 C ATOM 1084 CG1 VAL A 75 5.382 -9.388 -8.439 1.00 0.00 C ATOM 1085 CG2 VAL A 75 3.481 -8.365 -7.168 1.00 0.00 C ATOM 0 H VAL A 75 3.116 -6.082 -8.719 1.00 0.00 H new ATOM 0 HA VAL A 75 5.687 -6.774 -7.627 1.00 0.00 H new ATOM 0 HB VAL A 75 3.705 -8.387 -9.287 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.878 -10.353 -8.384 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.957 -9.332 -9.363 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.053 -9.280 -7.587 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.003 -9.344 -7.129 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.102 -8.229 -6.282 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.716 -7.589 -7.198 1.00 0.00 H new ATOM 1095 N LEU A 76 7.081 -7.369 -9.702 1.00 0.00 N ATOM 1096 CA LEU A 76 7.980 -7.371 -10.851 1.00 0.00 C ATOM 1097 C LEU A 76 8.253 -8.794 -11.327 1.00 0.00 C ATOM 1098 O LEU A 76 8.334 -9.054 -12.528 1.00 0.00 O ATOM 1099 CB LEU A 76 9.296 -6.679 -10.495 1.00 0.00 C ATOM 1100 CG LEU A 76 10.217 -6.343 -11.669 1.00 0.00 C ATOM 1101 CD1 LEU A 76 9.607 -5.250 -12.531 1.00 0.00 C ATOM 1102 CD2 LEU A 76 11.591 -5.924 -11.166 1.00 0.00 C ATOM 0 H LEU A 76 7.464 -7.812 -8.867 1.00 0.00 H new ATOM 0 HA LEU A 76 7.496 -6.824 -11.660 1.00 0.00 H new ATOM 0 HB2 LEU A 76 9.066 -5.755 -9.964 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.843 -7.317 -9.801 1.00 0.00 H new ATOM 0 HG LEU A 76 10.333 -7.237 -12.282 1.00 0.00 H new ATOM 0 HD11 LEU A 76 10.277 -5.025 -13.361 1.00 0.00 H new ATOM 0 HD12 LEU A 76 8.647 -5.588 -12.921 1.00 0.00 H new ATOM 0 HD13 LEU A 76 9.459 -4.353 -11.930 1.00 0.00 H new ATOM 0 HD21 LEU A 76 12.233 -5.689 -12.015 1.00 0.00 H new ATOM 0 HD22 LEU A 76 11.493 -5.044 -10.530 1.00 0.00 H new ATOM 0 HD23 LEU A 76 12.032 -6.739 -10.592 1.00 0.00 H new ATOM 1114 N HIS A 77 8.392 -9.714 -10.376 1.00 0.00 N ATOM 1115 CA HIS A 77 8.653 -11.112 -10.698 1.00 0.00 C ATOM 1116 C HIS A 77 7.696 -12.031 -9.945 1.00 0.00 C ATOM 1117 O HIS A 77 7.241 -11.705 -8.848 1.00 0.00 O ATOM 1118 CB HIS A 77 10.099 -11.474 -10.358 1.00 0.00 C ATOM 1119 CG HIS A 77 11.091 -10.999 -11.375 1.00 0.00 C ATOM 1120 ND1 HIS A 77 10.884 -11.104 -12.735 1.00 0.00 N ATOM 1121 CD2 HIS A 77 12.301 -10.411 -11.225 1.00 0.00 C ATOM 1122 CE1 HIS A 77 11.924 -10.603 -13.376 1.00 0.00 C ATOM 1123 NE2 HIS A 77 12.798 -10.176 -12.483 1.00 0.00 N ATOM 0 H HIS A 77 8.328 -9.516 -9.377 1.00 0.00 H new ATOM 0 HA HIS A 77 8.494 -11.249 -11.768 1.00 0.00 H new ATOM 0 HB2 HIS A 77 10.353 -11.047 -9.388 1.00 0.00 H new ATOM 0 HB3 HIS A 77 10.181 -12.557 -10.261 1.00 0.00 H new ATOM 0 HD2 HIS A 77 12.785 -10.171 -10.290 1.00 0.00 H new ATOM 0 HE1 HIS A 77 12.040 -10.551 -14.448 1.00 0.00 H new ATOM 0 HE2 HIS A 77 13.697 -9.742 -12.694 1.00 0.00 H new ATOM 1132 N ARG A 78 7.394 -13.180 -10.541 1.00 0.00 N ATOM 1133 CA ARG A 78 6.489 -14.144 -9.927 1.00 0.00 C ATOM 1134 C ARG A 78 6.856 -14.380 -8.465 1.00 0.00 C ATOM 1135 O ARG A 78 8.032 -14.370 -8.101 1.00 0.00 O ATOM 1136 CB ARG A 78 6.525 -15.468 -10.693 1.00 0.00 C ATOM 1137 CG ARG A 78 5.771 -15.430 -12.012 1.00 0.00 C ATOM 1138 CD ARG A 78 6.232 -16.534 -12.950 1.00 0.00 C ATOM 1139 NE ARG A 78 6.119 -17.855 -12.337 1.00 0.00 N ATOM 1140 CZ ARG A 78 5.999 -18.980 -13.033 1.00 0.00 C ATOM 1141 NH1 ARG A 78 5.977 -18.945 -14.358 1.00 0.00 N ATOM 1142 NH2 ARG A 78 5.901 -20.144 -12.403 1.00 0.00 N ATOM 0 H ARG A 78 7.763 -13.466 -11.448 1.00 0.00 H new ATOM 0 HA ARG A 78 5.480 -13.735 -9.969 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.563 -15.738 -10.886 1.00 0.00 H new ATOM 0 HB3 ARG A 78 6.102 -16.253 -10.065 1.00 0.00 H new ATOM 0 HG2 ARG A 78 4.702 -15.533 -11.824 1.00 0.00 H new ATOM 0 HG3 ARG A 78 5.919 -14.461 -12.489 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.637 -16.506 -13.863 1.00 0.00 H new ATOM 0 HD3 ARG A 78 7.268 -16.356 -13.239 1.00 0.00 H new ATOM 0 HE ARG A 78 6.133 -17.917 -11.319 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.052 -18.052 -14.846 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.885 -19.811 -14.890 1.00 0.00 H new ATOM 0 HH21 ARG A 78 5.918 -20.175 -11.384 1.00 0.00 H new ATOM 0 HH22 ARG A 78 5.809 -21.007 -12.938 1.00 0.00 H new ATOM 1156 N ILE A 79 5.842 -14.590 -7.632 1.00 0.00 N ATOM 1157 CA ILE A 79 6.058 -14.828 -6.211 1.00 0.00 C ATOM 1158 C ILE A 79 5.524 -16.194 -5.795 1.00 0.00 C ATOM 1159 O ILE A 79 4.479 -16.636 -6.274 1.00 0.00 O ATOM 1160 CB ILE A 79 5.386 -13.743 -5.349 1.00 0.00 C ATOM 1161 CG1 ILE A 79 5.905 -12.357 -5.740 1.00 0.00 C ATOM 1162 CG2 ILE A 79 5.635 -14.010 -3.872 1.00 0.00 C ATOM 1163 CD1 ILE A 79 4.981 -11.230 -5.336 1.00 0.00 C ATOM 0 H ILE A 79 4.863 -14.600 -7.917 1.00 0.00 H new ATOM 0 HA ILE A 79 7.135 -14.796 -6.047 1.00 0.00 H new ATOM 0 HB ILE A 79 4.311 -13.772 -5.527 1.00 0.00 H new ATOM 0 HG12 ILE A 79 6.880 -12.200 -5.279 1.00 0.00 H new ATOM 0 HG13 ILE A 79 6.054 -12.325 -6.819 1.00 0.00 H new ATOM 0 HG21 ILE A 79 5.154 -13.235 -3.276 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.223 -14.983 -3.603 1.00 0.00 H new ATOM 0 HG23 ILE A 79 6.707 -14.004 -3.677 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.412 -10.278 -5.645 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.012 -11.363 -5.818 1.00 0.00 H new ATOM 0 HD13 ILE A 79 4.851 -11.236 -4.254 1.00 0.00 H new ATOM 1175 N ASP A 80 6.246 -16.858 -4.899 1.00 0.00 N ATOM 1176 CA ASP A 80 5.844 -18.174 -4.416 1.00 0.00 C ATOM 1177 C ASP A 80 5.675 -18.167 -2.900 1.00 0.00 C ATOM 1178 O ASP A 80 6.624 -17.902 -2.161 1.00 0.00 O ATOM 1179 CB ASP A 80 6.875 -19.228 -4.822 1.00 0.00 C ATOM 1180 CG ASP A 80 6.278 -20.618 -4.911 1.00 0.00 C ATOM 1181 OD1 ASP A 80 5.886 -21.165 -3.858 1.00 0.00 O ATOM 1182 OD2 ASP A 80 6.202 -21.160 -6.033 1.00 0.00 O ATOM 0 H ASP A 80 7.113 -16.506 -4.492 1.00 0.00 H new ATOM 0 HA ASP A 80 4.885 -18.423 -4.870 1.00 0.00 H new ATOM 0 HB2 ASP A 80 7.305 -18.958 -5.786 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.691 -19.232 -4.099 1.00 0.00 H new ATOM 1187 N ARG A 81 4.462 -18.460 -2.443 1.00 0.00 N ATOM 1188 CA ARG A 81 4.168 -18.485 -1.015 1.00 0.00 C ATOM 1189 C ARG A 81 5.214 -19.300 -0.260 1.00 0.00 C ATOM 1190 O ARG A 81 5.491 -19.038 0.910 1.00 0.00 O ATOM 1191 CB ARG A 81 2.776 -19.070 -0.769 1.00 0.00 C ATOM 1192 CG ARG A 81 2.327 -18.984 0.680 1.00 0.00 C ATOM 1193 CD ARG A 81 1.409 -20.139 1.048 1.00 0.00 C ATOM 1194 NE ARG A 81 1.358 -20.359 2.491 1.00 0.00 N ATOM 1195 CZ ARG A 81 0.334 -20.935 3.111 1.00 0.00 C ATOM 1196 NH1 ARG A 81 -0.718 -21.348 2.417 1.00 0.00 N ATOM 1197 NH2 ARG A 81 0.361 -21.101 4.427 1.00 0.00 N ATOM 0 H ARG A 81 3.667 -18.683 -3.041 1.00 0.00 H new ATOM 0 HA ARG A 81 4.194 -17.460 -0.646 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.055 -18.546 -1.396 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.770 -20.114 -1.081 1.00 0.00 H new ATOM 0 HG2 ARG A 81 3.199 -18.989 1.333 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.809 -18.039 0.846 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.405 -19.936 0.676 1.00 0.00 H new ATOM 0 HD3 ARG A 81 1.754 -21.048 0.555 1.00 0.00 H new ATOM 0 HE ARG A 81 2.152 -20.054 3.054 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -0.742 -21.224 1.405 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -1.503 -21.790 2.895 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.169 -20.786 4.964 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -0.426 -21.543 4.901 1.00 0.00 H new ATOM 1211 N GLU A 82 5.791 -20.287 -0.938 1.00 0.00 N ATOM 1212 CA GLU A 82 6.805 -21.140 -0.329 1.00 0.00 C ATOM 1213 C GLU A 82 8.082 -20.353 -0.050 1.00 0.00 C ATOM 1214 O GLU A 82 8.571 -20.325 1.079 1.00 0.00 O ATOM 1215 CB GLU A 82 7.116 -22.330 -1.239 1.00 0.00 C ATOM 1216 CG GLU A 82 8.419 -23.034 -0.898 1.00 0.00 C ATOM 1217 CD GLU A 82 8.388 -24.512 -1.233 1.00 0.00 C ATOM 1218 OE1 GLU A 82 7.361 -25.163 -0.950 1.00 0.00 O ATOM 1219 OE2 GLU A 82 9.391 -25.018 -1.778 1.00 0.00 O ATOM 0 H GLU A 82 5.574 -20.516 -1.908 1.00 0.00 H new ATOM 0 HA GLU A 82 6.411 -21.509 0.618 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.298 -23.048 -1.176 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.159 -21.985 -2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.237 -22.559 -1.440 1.00 0.00 H new ATOM 0 HG3 GLU A 82 8.627 -22.910 0.165 1.00 0.00 H new ATOM 1226 N GLU A 83 8.616 -19.715 -1.087 1.00 0.00 N ATOM 1227 CA GLU A 83 9.837 -18.928 -0.953 1.00 0.00 C ATOM 1228 C GLU A 83 9.620 -17.744 -0.016 1.00 0.00 C ATOM 1229 O GLU A 83 10.527 -17.342 0.714 1.00 0.00 O ATOM 1230 CB GLU A 83 10.302 -18.430 -2.323 1.00 0.00 C ATOM 1231 CG GLU A 83 9.476 -17.274 -2.863 1.00 0.00 C ATOM 1232 CD GLU A 83 10.159 -16.556 -4.011 1.00 0.00 C ATOM 1233 OE1 GLU A 83 10.580 -17.237 -4.969 1.00 0.00 O ATOM 1234 OE2 GLU A 83 10.273 -15.314 -3.951 1.00 0.00 O ATOM 0 H GLU A 83 8.223 -19.728 -2.028 1.00 0.00 H new ATOM 0 HA GLU A 83 10.608 -19.570 -0.527 1.00 0.00 H new ATOM 0 HB2 GLU A 83 11.344 -18.119 -2.253 1.00 0.00 H new ATOM 0 HB3 GLU A 83 10.263 -19.256 -3.033 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.509 -17.649 -3.198 1.00 0.00 H new ATOM 0 HG3 GLU A 83 9.282 -16.564 -2.059 1.00 0.00 H new ATOM 1241 N VAL A 84 8.413 -17.188 -0.042 1.00 0.00 N ATOM 1242 CA VAL A 84 8.076 -16.050 0.804 1.00 0.00 C ATOM 1243 C VAL A 84 6.681 -16.202 1.400 1.00 0.00 C ATOM 1244 O VAL A 84 5.740 -16.589 0.710 1.00 0.00 O ATOM 1245 CB VAL A 84 8.146 -14.726 0.020 1.00 0.00 C ATOM 1246 CG1 VAL A 84 9.590 -14.365 -0.293 1.00 0.00 C ATOM 1247 CG2 VAL A 84 7.324 -14.821 -1.257 1.00 0.00 C ATOM 0 H VAL A 84 7.652 -17.508 -0.641 1.00 0.00 H new ATOM 0 HA VAL A 84 8.811 -16.026 1.608 1.00 0.00 H new ATOM 0 HB VAL A 84 7.725 -13.934 0.640 1.00 0.00 H new ATOM 0 HG11 VAL A 84 9.619 -13.427 -0.847 1.00 0.00 H new ATOM 0 HG12 VAL A 84 10.147 -14.254 0.637 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.041 -15.155 -0.894 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.384 -13.877 -1.799 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.714 -15.624 -1.882 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.284 -15.030 -1.006 1.00 0.00 H new ATOM 1257 N ASN A 85 6.557 -15.894 2.687 1.00 0.00 N ATOM 1258 CA ASN A 85 5.276 -15.996 3.377 1.00 0.00 C ATOM 1259 C ASN A 85 4.758 -14.616 3.770 1.00 0.00 C ATOM 1260 O ASN A 85 3.552 -14.409 3.898 1.00 0.00 O ATOM 1261 CB ASN A 85 5.413 -16.875 4.622 1.00 0.00 C ATOM 1262 CG ASN A 85 4.451 -16.472 5.723 1.00 0.00 C ATOM 1263 OD1 ASN A 85 4.702 -15.521 6.464 1.00 0.00 O ATOM 1264 ND2 ASN A 85 3.344 -17.196 5.836 1.00 0.00 N ATOM 0 H ASN A 85 7.327 -15.572 3.273 1.00 0.00 H new ATOM 0 HA ASN A 85 4.559 -16.453 2.694 1.00 0.00 H new ATOM 0 HB2 ASN A 85 5.235 -17.915 4.350 1.00 0.00 H new ATOM 0 HB3 ASN A 85 6.435 -16.814 4.996 1.00 0.00 H new ATOM 0 HD21 ASN A 85 2.660 -16.973 6.559 1.00 0.00 H new ATOM 0 HD22 ASN A 85 3.177 -17.976 5.200 1.00 0.00 H new ATOM 1271 N GLN A 86 5.679 -13.676 3.959 1.00 0.00 N ATOM 1272 CA GLN A 86 5.314 -12.316 4.338 1.00 0.00 C ATOM 1273 C GLN A 86 6.378 -11.322 3.885 1.00 0.00 C ATOM 1274 O GLN A 86 7.549 -11.439 4.251 1.00 0.00 O ATOM 1275 CB GLN A 86 5.120 -12.220 5.852 1.00 0.00 C ATOM 1276 CG GLN A 86 4.605 -10.866 6.315 1.00 0.00 C ATOM 1277 CD GLN A 86 4.291 -10.838 7.797 1.00 0.00 C ATOM 1278 OE1 GLN A 86 3.998 -11.870 8.402 1.00 0.00 O ATOM 1279 NE2 GLN A 86 4.349 -9.652 8.392 1.00 0.00 N ATOM 0 H GLN A 86 6.682 -13.831 3.856 1.00 0.00 H new ATOM 0 HA GLN A 86 4.375 -12.067 3.843 1.00 0.00 H new ATOM 0 HB2 GLN A 86 4.421 -12.993 6.170 1.00 0.00 H new ATOM 0 HB3 GLN A 86 6.070 -12.426 6.345 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.349 -10.102 6.091 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.707 -10.611 5.752 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.596 -8.822 7.853 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.147 -9.571 9.388 1.00 0.00 H new ATOM 1288 N LEU A 87 5.966 -10.343 3.088 1.00 0.00 N ATOM 1289 CA LEU A 87 6.884 -9.327 2.584 1.00 0.00 C ATOM 1290 C LEU A 87 6.766 -8.039 3.392 1.00 0.00 C ATOM 1291 O LEU A 87 5.711 -7.405 3.419 1.00 0.00 O ATOM 1292 CB LEU A 87 6.603 -9.044 1.108 1.00 0.00 C ATOM 1293 CG LEU A 87 7.071 -10.112 0.118 1.00 0.00 C ATOM 1294 CD1 LEU A 87 6.432 -9.894 -1.244 1.00 0.00 C ATOM 1295 CD2 LEU A 87 8.589 -10.104 0.005 1.00 0.00 C ATOM 0 H LEU A 87 5.001 -10.231 2.776 1.00 0.00 H new ATOM 0 HA LEU A 87 7.900 -9.707 2.687 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.529 -8.907 0.983 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.077 -8.099 0.843 1.00 0.00 H new ATOM 0 HG LEU A 87 6.759 -11.088 0.490 1.00 0.00 H new ATOM 0 HD11 LEU A 87 6.777 -10.663 -1.935 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.347 -9.950 -1.150 1.00 0.00 H new ATOM 0 HD13 LEU A 87 6.713 -8.912 -1.625 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.905 -10.870 -0.703 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.923 -9.127 -0.344 1.00 0.00 H new ATOM 0 HD23 LEU A 87 9.028 -10.310 0.981 1.00 0.00 H new ATOM 1307 N ARG A 88 7.857 -7.655 4.047 1.00 0.00 N ATOM 1308 CA ARG A 88 7.877 -6.442 4.855 1.00 0.00 C ATOM 1309 C ARG A 88 9.025 -5.528 4.436 1.00 0.00 C ATOM 1310 O ARG A 88 10.196 -5.878 4.584 1.00 0.00 O ATOM 1311 CB ARG A 88 8.006 -6.793 6.338 1.00 0.00 C ATOM 1312 CG ARG A 88 6.670 -6.920 7.052 1.00 0.00 C ATOM 1313 CD ARG A 88 6.850 -7.362 8.496 1.00 0.00 C ATOM 1314 NE ARG A 88 7.252 -8.762 8.595 1.00 0.00 N ATOM 1315 CZ ARG A 88 7.237 -9.453 9.729 1.00 0.00 C ATOM 1316 NH1 ARG A 88 6.841 -8.876 10.855 1.00 0.00 N ATOM 1317 NH2 ARG A 88 7.618 -10.724 9.738 1.00 0.00 N ATOM 0 H ARG A 88 8.739 -8.167 4.034 1.00 0.00 H new ATOM 0 HA ARG A 88 6.937 -5.914 4.694 1.00 0.00 H new ATOM 0 HB2 ARG A 88 8.551 -7.732 6.434 1.00 0.00 H new ATOM 0 HB3 ARG A 88 8.602 -6.027 6.834 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.150 -5.963 7.026 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.042 -7.639 6.526 1.00 0.00 H new ATOM 0 HD2 ARG A 88 7.601 -6.735 8.976 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.917 -7.214 9.039 1.00 0.00 H new ATOM 0 HE ARG A 88 7.561 -9.236 7.746 1.00 0.00 H new ATOM 0 HH11 ARG A 88 6.547 -7.899 10.852 1.00 0.00 H new ATOM 0 HH12 ARG A 88 6.830 -9.409 11.725 1.00 0.00 H new ATOM 0 HH21 ARG A 88 7.923 -11.171 8.873 1.00 0.00 H new ATOM 0 HH22 ARG A 88 7.606 -11.254 10.610 1.00 0.00 H new ATOM 1331 N PHE A 89 8.681 -4.357 3.911 1.00 0.00 N ATOM 1332 CA PHE A 89 9.682 -3.394 3.469 1.00 0.00 C ATOM 1333 C PHE A 89 9.213 -1.965 3.725 1.00 0.00 C ATOM 1334 O PHE A 89 8.013 -1.693 3.781 1.00 0.00 O ATOM 1335 CB PHE A 89 9.982 -3.585 1.980 1.00 0.00 C ATOM 1336 CG PHE A 89 8.766 -3.478 1.106 1.00 0.00 C ATOM 1337 CD1 PHE A 89 8.272 -2.239 0.730 1.00 0.00 C ATOM 1338 CD2 PHE A 89 8.116 -4.618 0.659 1.00 0.00 C ATOM 1339 CE1 PHE A 89 7.154 -2.138 -0.076 1.00 0.00 C ATOM 1340 CE2 PHE A 89 6.997 -4.523 -0.147 1.00 0.00 C ATOM 1341 CZ PHE A 89 6.514 -3.281 -0.514 1.00 0.00 C ATOM 0 H PHE A 89 7.716 -4.052 3.781 1.00 0.00 H new ATOM 0 HA PHE A 89 10.593 -3.567 4.042 1.00 0.00 H new ATOM 0 HB2 PHE A 89 10.712 -2.839 1.666 1.00 0.00 H new ATOM 0 HB3 PHE A 89 10.441 -4.563 1.832 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.767 -1.342 1.071 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.488 -5.591 0.944 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.781 -1.166 -0.363 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.500 -5.419 -0.490 1.00 0.00 H new ATOM 0 HZ PHE A 89 5.638 -3.204 -1.142 1.00 0.00 H new ATOM 1351 N THR A 90 10.168 -1.053 3.881 1.00 0.00 N ATOM 1352 CA THR A 90 9.854 0.347 4.134 1.00 0.00 C ATOM 1353 C THR A 90 9.993 1.180 2.864 1.00 0.00 C ATOM 1354 O THR A 90 10.839 0.898 2.015 1.00 0.00 O ATOM 1355 CB THR A 90 10.766 0.940 5.225 1.00 0.00 C ATOM 1356 OG1 THR A 90 10.924 0.000 6.294 1.00 0.00 O ATOM 1357 CG2 THR A 90 10.188 2.239 5.766 1.00 0.00 C ATOM 0 H THR A 90 11.166 -1.260 3.836 1.00 0.00 H new ATOM 0 HA THR A 90 8.820 0.381 4.477 1.00 0.00 H new ATOM 0 HB THR A 90 11.738 1.151 4.780 1.00 0.00 H new ATOM 0 HG1 THR A 90 11.506 0.383 6.983 1.00 0.00 H new ATOM 0 HG21 THR A 90 10.849 2.639 6.535 1.00 0.00 H new ATOM 0 HG22 THR A 90 10.095 2.962 4.955 1.00 0.00 H new ATOM 0 HG23 THR A 90 9.205 2.048 6.196 1.00 0.00 H new ATOM 1365 N VAL A 91 9.159 2.207 2.741 1.00 0.00 N ATOM 1366 CA VAL A 91 9.191 3.082 1.575 1.00 0.00 C ATOM 1367 C VAL A 91 9.445 4.530 1.981 1.00 0.00 C ATOM 1368 O VAL A 91 8.931 5.000 2.996 1.00 0.00 O ATOM 1369 CB VAL A 91 7.874 3.007 0.781 1.00 0.00 C ATOM 1370 CG1 VAL A 91 7.684 1.617 0.193 1.00 0.00 C ATOM 1371 CG2 VAL A 91 6.696 3.386 1.665 1.00 0.00 C ATOM 0 H VAL A 91 8.453 2.454 3.434 1.00 0.00 H new ATOM 0 HA VAL A 91 10.008 2.736 0.942 1.00 0.00 H new ATOM 0 HB VAL A 91 7.925 3.720 -0.042 1.00 0.00 H new ATOM 0 HG11 VAL A 91 6.748 1.583 -0.365 1.00 0.00 H new ATOM 0 HG12 VAL A 91 8.514 1.388 -0.476 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.654 0.882 0.998 1.00 0.00 H new ATOM 0 HG21 VAL A 91 5.774 3.327 1.087 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.639 2.699 2.510 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.830 4.403 2.033 1.00 0.00 H new ATOM 1381 N MET A 92 10.241 5.232 1.181 1.00 0.00 N ATOM 1382 CA MET A 92 10.561 6.628 1.457 1.00 0.00 C ATOM 1383 C MET A 92 9.856 7.553 0.470 1.00 0.00 C ATOM 1384 O MET A 92 9.565 7.163 -0.661 1.00 0.00 O ATOM 1385 CB MET A 92 12.074 6.849 1.389 1.00 0.00 C ATOM 1386 CG MET A 92 12.772 6.689 2.730 1.00 0.00 C ATOM 1387 SD MET A 92 14.309 7.627 2.829 1.00 0.00 S ATOM 1388 CE MET A 92 15.073 7.190 1.270 1.00 0.00 C ATOM 0 H MET A 92 10.676 4.858 0.338 1.00 0.00 H new ATOM 0 HA MET A 92 10.211 6.863 2.462 1.00 0.00 H new ATOM 0 HB2 MET A 92 12.504 6.144 0.678 1.00 0.00 H new ATOM 0 HB3 MET A 92 12.270 7.850 1.004 1.00 0.00 H new ATOM 0 HG2 MET A 92 12.101 7.013 3.525 1.00 0.00 H new ATOM 0 HG3 MET A 92 12.983 5.634 2.902 1.00 0.00 H new ATOM 0 HE1 MET A 92 16.157 7.248 1.367 1.00 0.00 H new ATOM 0 HE2 MET A 92 14.787 6.174 0.997 1.00 0.00 H new ATOM 0 HE3 MET A 92 14.741 7.881 0.496 1.00 0.00 H new ATOM 1398 N ALA A 93 9.584 8.778 0.905 1.00 0.00 N ATOM 1399 CA ALA A 93 8.915 9.759 0.059 1.00 0.00 C ATOM 1400 C ALA A 93 9.652 11.093 0.075 1.00 0.00 C ATOM 1401 O ALA A 93 9.463 11.907 0.980 1.00 0.00 O ATOM 1402 CB ALA A 93 7.473 9.945 0.507 1.00 0.00 C ATOM 0 H ALA A 93 9.817 9.116 1.839 1.00 0.00 H new ATOM 0 HA ALA A 93 8.921 9.384 -0.964 1.00 0.00 H new ATOM 0 HB1 ALA A 93 6.985 10.680 -0.133 1.00 0.00 H new ATOM 0 HB2 ALA A 93 6.944 8.994 0.436 1.00 0.00 H new ATOM 0 HB3 ALA A 93 7.455 10.294 1.539 1.00 0.00 H new ATOM 1408 N ARG A 94 10.494 11.311 -0.930 1.00 0.00 N ATOM 1409 CA ARG A 94 11.262 12.546 -1.030 1.00 0.00 C ATOM 1410 C ARG A 94 10.374 13.703 -1.477 1.00 0.00 C ATOM 1411 O ARG A 94 9.264 13.494 -1.966 1.00 0.00 O ATOM 1412 CB ARG A 94 12.424 12.372 -2.010 1.00 0.00 C ATOM 1413 CG ARG A 94 13.295 11.163 -1.712 1.00 0.00 C ATOM 1414 CD ARG A 94 14.644 11.264 -2.407 1.00 0.00 C ATOM 1415 NE ARG A 94 14.575 10.836 -3.802 1.00 0.00 N ATOM 1416 CZ ARG A 94 15.620 10.380 -4.483 1.00 0.00 C ATOM 1417 NH1 ARG A 94 16.808 10.294 -3.902 1.00 0.00 N ATOM 1418 NH2 ARG A 94 15.477 10.009 -5.749 1.00 0.00 N ATOM 0 H ARG A 94 10.662 10.648 -1.687 1.00 0.00 H new ATOM 0 HA ARG A 94 11.661 12.777 -0.042 1.00 0.00 H new ATOM 0 HB2 ARG A 94 12.026 12.282 -3.021 1.00 0.00 H new ATOM 0 HB3 ARG A 94 13.043 13.269 -1.990 1.00 0.00 H new ATOM 0 HG2 ARG A 94 13.444 11.077 -0.636 1.00 0.00 H new ATOM 0 HG3 ARG A 94 12.784 10.256 -2.036 1.00 0.00 H new ATOM 0 HD2 ARG A 94 14.999 12.293 -2.361 1.00 0.00 H new ATOM 0 HD3 ARG A 94 15.372 10.651 -1.876 1.00 0.00 H new ATOM 0 HE ARG A 94 13.675 10.890 -4.279 1.00 0.00 H new ATOM 0 HH11 ARG A 94 16.922 10.578 -2.929 1.00 0.00 H new ATOM 0 HH12 ARG A 94 17.609 9.943 -4.428 1.00 0.00 H new ATOM 0 HH21 ARG A 94 14.564 10.074 -6.199 1.00 0.00 H new ATOM 0 HH22 ARG A 94 16.280 9.659 -6.272 1.00 0.00 H new ATOM 1432 N ASP A 95 10.870 14.923 -1.305 1.00 0.00 N ATOM 1433 CA ASP A 95 10.123 16.114 -1.692 1.00 0.00 C ATOM 1434 C ASP A 95 11.006 17.079 -2.477 1.00 0.00 C ATOM 1435 O ASP A 95 12.221 16.898 -2.559 1.00 0.00 O ATOM 1436 CB ASP A 95 9.559 16.813 -0.453 1.00 0.00 C ATOM 1437 CG ASP A 95 8.685 18.001 -0.806 1.00 0.00 C ATOM 1438 OD1 ASP A 95 7.648 17.798 -1.471 1.00 0.00 O ATOM 1439 OD2 ASP A 95 9.039 19.133 -0.416 1.00 0.00 O ATOM 0 H ASP A 95 11.787 15.113 -0.900 1.00 0.00 H new ATOM 0 HA ASP A 95 9.298 15.803 -2.332 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.978 16.099 0.131 1.00 0.00 H new ATOM 0 HB3 ASP A 95 10.382 17.146 0.179 1.00 0.00 H new ATOM 1444 N ARG A 96 10.386 18.104 -3.054 1.00 0.00 N ATOM 1445 CA ARG A 96 11.116 19.096 -3.835 1.00 0.00 C ATOM 1446 C ARG A 96 11.681 20.190 -2.933 1.00 0.00 C ATOM 1447 O ARG A 96 11.174 21.310 -2.907 1.00 0.00 O ATOM 1448 CB ARG A 96 10.202 19.715 -4.894 1.00 0.00 C ATOM 1449 CG ARG A 96 8.911 20.285 -4.327 1.00 0.00 C ATOM 1450 CD ARG A 96 8.414 21.464 -5.149 1.00 0.00 C ATOM 1451 NE ARG A 96 7.435 22.265 -4.420 1.00 0.00 N ATOM 1452 CZ ARG A 96 7.196 23.546 -4.677 1.00 0.00 C ATOM 1453 NH1 ARG A 96 7.863 24.168 -5.640 1.00 0.00 N ATOM 1454 NH2 ARG A 96 6.289 24.208 -3.970 1.00 0.00 N ATOM 0 H ARG A 96 9.381 18.269 -2.995 1.00 0.00 H new ATOM 0 HA ARG A 96 11.946 18.593 -4.330 1.00 0.00 H new ATOM 0 HB2 ARG A 96 10.743 20.508 -5.410 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.958 18.958 -5.639 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.147 19.508 -4.305 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.073 20.601 -3.297 1.00 0.00 H new ATOM 0 HD2 ARG A 96 9.259 22.092 -5.430 1.00 0.00 H new ATOM 0 HD3 ARG A 96 7.967 21.099 -6.074 1.00 0.00 H new ATOM 0 HE ARG A 96 6.906 21.816 -3.672 1.00 0.00 H new ATOM 0 HH11 ARG A 96 8.561 23.663 -6.185 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.678 25.152 -5.835 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.774 23.733 -3.228 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.106 25.192 -4.168 1.00 0.00 H new ATOM 1468 N GLY A 97 12.734 19.855 -2.193 1.00 0.00 N ATOM 1469 CA GLY A 97 13.350 20.818 -1.300 1.00 0.00 C ATOM 1470 C GLY A 97 14.703 20.359 -0.796 1.00 0.00 C ATOM 1471 O GLY A 97 15.109 19.222 -1.036 1.00 0.00 O ATOM 0 H GLY A 97 13.171 18.933 -2.196 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.463 21.770 -1.819 1.00 0.00 H new ATOM 0 HA3 GLY A 97 12.690 20.995 -0.451 1.00 0.00 H new ATOM 1475 N GLN A 98 15.404 21.245 -0.095 1.00 0.00 N ATOM 1476 CA GLN A 98 16.721 20.924 0.442 1.00 0.00 C ATOM 1477 C GLN A 98 16.946 21.617 1.781 1.00 0.00 C ATOM 1478 O GLN A 98 16.871 22.841 1.895 1.00 0.00 O ATOM 1479 CB GLN A 98 17.813 21.334 -0.548 1.00 0.00 C ATOM 1480 CG GLN A 98 18.235 20.215 -1.487 1.00 0.00 C ATOM 1481 CD GLN A 98 18.816 20.732 -2.787 1.00 0.00 C ATOM 1482 OE1 GLN A 98 19.356 21.837 -2.843 1.00 0.00 O ATOM 1483 NE2 GLN A 98 18.709 19.934 -3.843 1.00 0.00 N ATOM 0 H GLN A 98 15.082 22.190 0.114 1.00 0.00 H new ATOM 0 HA GLN A 98 16.769 19.846 0.599 1.00 0.00 H new ATOM 0 HB2 GLN A 98 17.458 22.178 -1.139 1.00 0.00 H new ATOM 0 HB3 GLN A 98 18.685 21.679 0.008 1.00 0.00 H new ATOM 0 HG2 GLN A 98 18.973 19.586 -0.988 1.00 0.00 H new ATOM 0 HG3 GLN A 98 17.373 19.584 -1.704 1.00 0.00 H new ATOM 0 HE21 GLN A 98 18.254 19.026 -3.752 1.00 0.00 H new ATOM 0 HE22 GLN A 98 19.082 20.229 -4.745 1.00 0.00 H new ATOM 1492 N PRO A 99 17.229 20.819 2.821 1.00 0.00 N ATOM 1493 CA PRO A 99 17.320 19.361 2.698 1.00 0.00 C ATOM 1494 C PRO A 99 15.963 18.714 2.445 1.00 0.00 C ATOM 1495 O PRO A 99 14.957 19.063 3.063 1.00 0.00 O ATOM 1496 CB PRO A 99 17.876 18.924 4.056 1.00 0.00 C ATOM 1497 CG PRO A 99 17.467 20.004 4.997 1.00 0.00 C ATOM 1498 CD PRO A 99 17.481 21.277 4.198 1.00 0.00 C ATOM 0 HA PRO A 99 17.939 19.062 1.852 1.00 0.00 H new ATOM 0 HB2 PRO A 99 17.469 17.959 4.359 1.00 0.00 H new ATOM 0 HB3 PRO A 99 18.960 18.816 4.024 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.475 19.811 5.405 1.00 0.00 H new ATOM 0 HG3 PRO A 99 18.153 20.066 5.842 1.00 0.00 H new ATOM 0 HD2 PRO A 99 16.713 21.972 4.537 1.00 0.00 H new ATOM 0 HD3 PRO A 99 18.438 21.793 4.281 1.00 0.00 H new ATOM 1506 N PRO A 100 15.931 17.748 1.514 1.00 0.00 N ATOM 1507 CA PRO A 100 14.703 17.032 1.159 1.00 0.00 C ATOM 1508 C PRO A 100 14.227 16.108 2.275 1.00 0.00 C ATOM 1509 O PRO A 100 14.947 15.203 2.696 1.00 0.00 O ATOM 1510 CB PRO A 100 15.110 16.218 -0.072 1.00 0.00 C ATOM 1511 CG PRO A 100 16.583 16.037 0.064 1.00 0.00 C ATOM 1512 CD PRO A 100 17.092 17.281 0.738 1.00 0.00 C ATOM 0 HA PRO A 100 13.871 17.714 0.980 1.00 0.00 H new ATOM 0 HB2 PRO A 100 14.594 15.258 -0.100 1.00 0.00 H new ATOM 0 HB3 PRO A 100 14.859 16.742 -0.994 1.00 0.00 H new ATOM 0 HG2 PRO A 100 16.814 15.151 0.655 1.00 0.00 H new ATOM 0 HG3 PRO A 100 17.051 15.902 -0.911 1.00 0.00 H new ATOM 0 HD2 PRO A 100 17.946 17.069 1.381 1.00 0.00 H new ATOM 0 HD3 PRO A 100 17.417 18.027 0.013 1.00 0.00 H new ATOM 1520 N LYS A 101 13.008 16.342 2.750 1.00 0.00 N ATOM 1521 CA LYS A 101 12.434 15.530 3.817 1.00 0.00 C ATOM 1522 C LYS A 101 11.970 14.179 3.282 1.00 0.00 C ATOM 1523 O LYS A 101 11.393 14.093 2.197 1.00 0.00 O ATOM 1524 CB LYS A 101 11.259 16.263 4.468 1.00 0.00 C ATOM 1525 CG LYS A 101 11.684 17.339 5.452 1.00 0.00 C ATOM 1526 CD LYS A 101 12.255 16.736 6.725 1.00 0.00 C ATOM 1527 CE LYS A 101 13.107 17.741 7.484 1.00 0.00 C ATOM 1528 NZ LYS A 101 13.826 17.109 8.625 1.00 0.00 N ATOM 0 H LYS A 101 12.399 17.087 2.413 1.00 0.00 H new ATOM 0 HA LYS A 101 13.207 15.359 4.566 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.647 16.717 3.688 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.630 15.538 4.985 1.00 0.00 H new ATOM 0 HG2 LYS A 101 12.430 17.984 4.988 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.828 17.967 5.698 1.00 0.00 H new ATOM 0 HD2 LYS A 101 11.441 16.392 7.363 1.00 0.00 H new ATOM 0 HD3 LYS A 101 12.856 15.862 6.477 1.00 0.00 H new ATOM 0 HE2 LYS A 101 13.830 18.191 6.804 1.00 0.00 H new ATOM 0 HE3 LYS A 101 12.474 18.547 7.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 14.396 17.827 9.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 13.136 16.701 9.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 14.450 16.357 8.269 1.00 0.00 H new ATOM 1542 N THR A 102 12.224 13.124 4.051 1.00 0.00 N ATOM 1543 CA THR A 102 11.832 11.777 3.655 1.00 0.00 C ATOM 1544 C THR A 102 11.142 11.046 4.800 1.00 0.00 C ATOM 1545 O THR A 102 11.627 11.048 5.932 1.00 0.00 O ATOM 1546 CB THR A 102 13.048 10.952 3.192 1.00 0.00 C ATOM 1547 OG1 THR A 102 13.981 10.808 4.269 1.00 0.00 O ATOM 1548 CG2 THR A 102 13.732 11.614 2.006 1.00 0.00 C ATOM 0 H THR A 102 12.700 13.177 4.952 1.00 0.00 H new ATOM 0 HA THR A 102 11.135 11.882 2.823 1.00 0.00 H new ATOM 0 HB THR A 102 12.695 9.968 2.884 1.00 0.00 H new ATOM 0 HG1 THR A 102 14.376 9.911 4.242 1.00 0.00 H new ATOM 0 HG21 THR A 102 14.587 11.013 1.697 1.00 0.00 H new ATOM 0 HG22 THR A 102 13.028 11.695 1.178 1.00 0.00 H new ATOM 0 HG23 THR A 102 14.072 12.610 2.291 1.00 0.00 H new ATOM 1556 N ASP A 103 10.009 10.421 4.500 1.00 0.00 N ATOM 1557 CA ASP A 103 9.253 9.684 5.505 1.00 0.00 C ATOM 1558 C ASP A 103 9.292 8.185 5.223 1.00 0.00 C ATOM 1559 O ASP A 103 9.066 7.748 4.094 1.00 0.00 O ATOM 1560 CB ASP A 103 7.803 10.170 5.542 1.00 0.00 C ATOM 1561 CG ASP A 103 7.004 9.524 6.656 1.00 0.00 C ATOM 1562 OD1 ASP A 103 7.364 9.720 7.835 1.00 0.00 O ATOM 1563 OD2 ASP A 103 6.018 8.821 6.349 1.00 0.00 O ATOM 0 H ASP A 103 9.594 10.410 3.568 1.00 0.00 H new ATOM 0 HA ASP A 103 9.714 9.866 6.476 1.00 0.00 H new ATOM 0 HB2 ASP A 103 7.789 11.252 5.669 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.326 9.955 4.585 1.00 0.00 H new ATOM 1568 N LYS A 104 9.581 7.401 6.256 1.00 0.00 N ATOM 1569 CA LYS A 104 9.651 5.951 6.122 1.00 0.00 C ATOM 1570 C LYS A 104 8.344 5.300 6.566 1.00 0.00 C ATOM 1571 O LYS A 104 7.925 5.449 7.714 1.00 0.00 O ATOM 1572 CB LYS A 104 10.815 5.397 6.946 1.00 0.00 C ATOM 1573 CG LYS A 104 12.142 5.407 6.207 1.00 0.00 C ATOM 1574 CD LYS A 104 13.316 5.439 7.171 1.00 0.00 C ATOM 1575 CE LYS A 104 14.508 6.172 6.573 1.00 0.00 C ATOM 1576 NZ LYS A 104 14.295 7.646 6.544 1.00 0.00 N ATOM 0 H LYS A 104 9.771 7.746 7.197 1.00 0.00 H new ATOM 0 HA LYS A 104 9.815 5.716 5.070 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.913 5.983 7.860 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.583 4.375 7.246 1.00 0.00 H new ATOM 0 HG2 LYS A 104 12.214 4.523 5.574 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.187 6.275 5.549 1.00 0.00 H new ATOM 0 HD2 LYS A 104 13.014 5.928 8.097 1.00 0.00 H new ATOM 0 HD3 LYS A 104 13.605 4.420 7.428 1.00 0.00 H new ATOM 0 HE2 LYS A 104 15.402 5.946 7.154 1.00 0.00 H new ATOM 0 HE3 LYS A 104 14.686 5.811 5.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 14.255 7.972 5.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 13.400 7.877 7.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 15.081 8.120 7.034 1.00 0.00 H new ATOM 1590 N ALA A 105 7.707 4.579 5.650 1.00 0.00 N ATOM 1591 CA ALA A 105 6.451 3.902 5.950 1.00 0.00 C ATOM 1592 C ALA A 105 6.606 2.388 5.857 1.00 0.00 C ATOM 1593 O ALA A 105 7.214 1.872 4.919 1.00 0.00 O ATOM 1594 CB ALA A 105 5.356 4.381 5.007 1.00 0.00 C ATOM 0 H ALA A 105 8.039 4.448 4.695 1.00 0.00 H new ATOM 0 HA ALA A 105 6.169 4.149 6.974 1.00 0.00 H new ATOM 0 HB1 ALA A 105 4.423 3.868 5.242 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.218 5.456 5.125 1.00 0.00 H new ATOM 0 HB3 ALA A 105 5.641 4.163 3.978 1.00 0.00 H new ATOM 1600 N THR A 106 6.055 1.680 6.838 1.00 0.00 N ATOM 1601 CA THR A 106 6.134 0.225 6.868 1.00 0.00 C ATOM 1602 C THR A 106 5.043 -0.403 6.009 1.00 0.00 C ATOM 1603 O THR A 106 3.859 -0.112 6.180 1.00 0.00 O ATOM 1604 CB THR A 106 6.014 -0.314 8.306 1.00 0.00 C ATOM 1605 OG1 THR A 106 6.936 0.368 9.164 1.00 0.00 O ATOM 1606 CG2 THR A 106 6.286 -1.810 8.347 1.00 0.00 C ATOM 0 H THR A 106 5.549 2.091 7.622 1.00 0.00 H new ATOM 0 HA THR A 106 7.110 -0.047 6.466 1.00 0.00 H new ATOM 0 HB THR A 106 4.996 -0.136 8.654 1.00 0.00 H new ATOM 0 HG1 THR A 106 6.852 0.021 10.076 1.00 0.00 H new ATOM 0 HG21 THR A 106 6.196 -2.168 9.372 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.564 -2.329 7.716 1.00 0.00 H new ATOM 0 HG23 THR A 106 7.294 -2.007 7.981 1.00 0.00 H new ATOM 1614 N VAL A 107 5.448 -1.267 5.084 1.00 0.00 N ATOM 1615 CA VAL A 107 4.504 -1.939 4.199 1.00 0.00 C ATOM 1616 C VAL A 107 4.422 -3.429 4.512 1.00 0.00 C ATOM 1617 O VAL A 107 5.316 -4.198 4.161 1.00 0.00 O ATOM 1618 CB VAL A 107 4.895 -1.757 2.720 1.00 0.00 C ATOM 1619 CG1 VAL A 107 3.964 -2.554 1.820 1.00 0.00 C ATOM 1620 CG2 VAL A 107 4.882 -0.283 2.344 1.00 0.00 C ATOM 0 H VAL A 107 6.424 -1.518 4.928 1.00 0.00 H new ATOM 0 HA VAL A 107 3.530 -1.481 4.369 1.00 0.00 H new ATOM 0 HB VAL A 107 5.908 -2.135 2.580 1.00 0.00 H new ATOM 0 HG11 VAL A 107 4.255 -2.413 0.779 1.00 0.00 H new ATOM 0 HG12 VAL A 107 4.029 -3.612 2.075 1.00 0.00 H new ATOM 0 HG13 VAL A 107 2.939 -2.209 1.960 1.00 0.00 H new ATOM 0 HG21 VAL A 107 5.161 -0.172 1.296 1.00 0.00 H new ATOM 0 HG22 VAL A 107 3.882 0.123 2.499 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.594 0.258 2.968 1.00 0.00 H new ATOM 1630 N VAL A 108 3.341 -3.829 5.175 1.00 0.00 N ATOM 1631 CA VAL A 108 3.140 -5.228 5.534 1.00 0.00 C ATOM 1632 C VAL A 108 2.207 -5.920 4.547 1.00 0.00 C ATOM 1633 O VAL A 108 1.014 -5.619 4.489 1.00 0.00 O ATOM 1634 CB VAL A 108 2.560 -5.365 6.955 1.00 0.00 C ATOM 1635 CG1 VAL A 108 2.352 -6.829 7.308 1.00 0.00 C ATOM 1636 CG2 VAL A 108 3.470 -4.687 7.968 1.00 0.00 C ATOM 0 H VAL A 108 2.592 -3.205 5.474 1.00 0.00 H new ATOM 0 HA VAL A 108 4.119 -5.707 5.501 1.00 0.00 H new ATOM 0 HB VAL A 108 1.590 -4.869 6.983 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.942 -6.906 8.315 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.658 -7.279 6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 108 3.307 -7.353 7.264 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.046 -4.793 8.966 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.455 -5.153 7.941 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.562 -3.629 7.723 1.00 0.00 H new ATOM 1646 N LEU A 109 2.757 -6.849 3.773 1.00 0.00 N ATOM 1647 CA LEU A 109 1.973 -7.586 2.788 1.00 0.00 C ATOM 1648 C LEU A 109 1.788 -9.038 3.215 1.00 0.00 C ATOM 1649 O LEU A 109 2.760 -9.766 3.416 1.00 0.00 O ATOM 1650 CB LEU A 109 2.654 -7.528 1.419 1.00 0.00 C ATOM 1651 CG LEU A 109 2.964 -6.130 0.882 1.00 0.00 C ATOM 1652 CD1 LEU A 109 3.704 -6.220 -0.443 1.00 0.00 C ATOM 1653 CD2 LEU A 109 1.683 -5.323 0.726 1.00 0.00 C ATOM 0 H LEU A 109 3.742 -7.110 3.808 1.00 0.00 H new ATOM 0 HA LEU A 109 0.990 -7.119 2.719 1.00 0.00 H new ATOM 0 HB2 LEU A 109 3.587 -8.089 1.476 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.018 -8.040 0.697 1.00 0.00 H new ATOM 0 HG LEU A 109 3.606 -5.620 1.600 1.00 0.00 H new ATOM 0 HD11 LEU A 109 3.916 -5.216 -0.810 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.640 -6.760 -0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.087 -6.749 -1.169 1.00 0.00 H new ATOM 0 HD21 LEU A 109 1.922 -4.331 0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.016 -5.830 0.029 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.192 -5.229 1.695 1.00 0.00 H new ATOM 1665 N ASN A 110 0.533 -9.454 3.351 1.00 0.00 N ATOM 1666 CA ASN A 110 0.220 -10.821 3.753 1.00 0.00 C ATOM 1667 C ASN A 110 0.080 -11.728 2.534 1.00 0.00 C ATOM 1668 O ASN A 110 -0.834 -11.562 1.726 1.00 0.00 O ATOM 1669 CB ASN A 110 -1.071 -10.850 4.575 1.00 0.00 C ATOM 1670 CG ASN A 110 -0.843 -10.455 6.021 1.00 0.00 C ATOM 1671 OD1 ASN A 110 -0.969 -11.278 6.928 1.00 0.00 O ATOM 1672 ND2 ASN A 110 -0.508 -9.189 6.243 1.00 0.00 N ATOM 0 H ASN A 110 -0.284 -8.865 3.189 1.00 0.00 H new ATOM 0 HA ASN A 110 1.042 -11.190 4.366 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -1.799 -10.174 4.127 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -1.500 -11.851 4.538 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -0.344 -8.864 7.196 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -0.415 -8.541 5.461 1.00 0.00 H new ATOM 1679 N ILE A 111 0.991 -12.687 2.410 1.00 0.00 N ATOM 1680 CA ILE A 111 0.968 -13.621 1.291 1.00 0.00 C ATOM 1681 C ILE A 111 -0.240 -14.547 1.373 1.00 0.00 C ATOM 1682 O ILE A 111 -0.219 -15.552 2.084 1.00 0.00 O ATOM 1683 CB ILE A 111 2.251 -14.472 1.242 1.00 0.00 C ATOM 1684 CG1 ILE A 111 3.481 -13.572 1.111 1.00 0.00 C ATOM 1685 CG2 ILE A 111 2.186 -15.461 0.088 1.00 0.00 C ATOM 1686 CD1 ILE A 111 3.476 -12.719 -0.138 1.00 0.00 C ATOM 0 H ILE A 111 1.754 -12.838 3.070 1.00 0.00 H new ATOM 0 HA ILE A 111 0.903 -13.023 0.382 1.00 0.00 H new ATOM 0 HB ILE A 111 2.333 -15.034 2.172 1.00 0.00 H new ATOM 0 HG12 ILE A 111 3.540 -12.923 1.984 1.00 0.00 H new ATOM 0 HG13 ILE A 111 4.377 -14.193 1.114 1.00 0.00 H new ATOM 0 HG21 ILE A 111 3.100 -16.055 0.066 1.00 0.00 H new ATOM 0 HG22 ILE A 111 1.328 -16.120 0.221 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.084 -14.918 -0.851 1.00 0.00 H new ATOM 0 HD11 ILE A 111 4.378 -12.107 -0.164 1.00 0.00 H new ATOM 0 HD12 ILE A 111 3.448 -13.362 -1.018 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.599 -12.072 -0.133 1.00 0.00 H new ATOM 1698 N LYS A 112 -1.293 -14.204 0.639 1.00 0.00 N ATOM 1699 CA LYS A 112 -2.511 -15.005 0.625 1.00 0.00 C ATOM 1700 C LYS A 112 -2.391 -16.161 -0.364 1.00 0.00 C ATOM 1701 O LYS A 112 -1.437 -16.230 -1.139 1.00 0.00 O ATOM 1702 CB LYS A 112 -3.716 -14.134 0.263 1.00 0.00 C ATOM 1703 CG LYS A 112 -3.975 -13.013 1.254 1.00 0.00 C ATOM 1704 CD LYS A 112 -4.722 -13.513 2.479 1.00 0.00 C ATOM 1705 CE LYS A 112 -6.229 -13.422 2.289 1.00 0.00 C ATOM 1706 NZ LYS A 112 -6.961 -13.581 3.576 1.00 0.00 N ATOM 0 H LYS A 112 -1.327 -13.375 0.045 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.656 -15.417 1.624 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -3.559 -13.704 -0.726 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -4.603 -14.764 0.200 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.027 -12.571 1.560 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -4.553 -12.225 0.771 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.441 -14.547 2.681 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.428 -12.927 3.350 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.481 -12.459 1.844 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.554 -14.192 1.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -7.984 -13.513 3.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.740 -14.510 3.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.670 -12.831 4.236 1.00 0.00 H new ATOM 1720 N ASP A 113 -3.364 -17.064 -0.332 1.00 0.00 N ATOM 1721 CA ASP A 113 -3.368 -18.216 -1.227 1.00 0.00 C ATOM 1722 C ASP A 113 -4.492 -18.103 -2.252 1.00 0.00 C ATOM 1723 O ASP A 113 -5.670 -18.194 -1.908 1.00 0.00 O ATOM 1724 CB ASP A 113 -3.519 -19.510 -0.427 1.00 0.00 C ATOM 1725 CG ASP A 113 -4.563 -19.397 0.666 1.00 0.00 C ATOM 1726 OD1 ASP A 113 -5.483 -18.565 0.524 1.00 0.00 O ATOM 1727 OD2 ASP A 113 -4.459 -20.141 1.664 1.00 0.00 O ATOM 0 H ASP A 113 -4.160 -17.021 0.304 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.416 -18.236 -1.758 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -3.791 -20.321 -1.102 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -2.559 -19.773 0.017 1.00 0.00 H new ATOM 1732 N GLU A 114 -4.119 -17.903 -3.513 1.00 0.00 N ATOM 1733 CA GLU A 114 -5.097 -17.775 -4.587 1.00 0.00 C ATOM 1734 C GLU A 114 -5.524 -19.148 -5.099 1.00 0.00 C ATOM 1735 O GLU A 114 -6.714 -19.443 -5.195 1.00 0.00 O ATOM 1736 CB GLU A 114 -4.520 -16.946 -5.736 1.00 0.00 C ATOM 1737 CG GLU A 114 -5.481 -16.766 -6.899 1.00 0.00 C ATOM 1738 CD GLU A 114 -6.509 -15.681 -6.644 1.00 0.00 C ATOM 1739 OE1 GLU A 114 -7.376 -15.879 -5.768 1.00 0.00 O ATOM 1740 OE2 GLU A 114 -6.445 -14.633 -7.321 1.00 0.00 O ATOM 0 H GLU A 114 -3.148 -17.826 -3.815 1.00 0.00 H new ATOM 0 HA GLU A 114 -5.974 -17.266 -4.187 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -4.234 -15.965 -5.357 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -3.611 -17.426 -6.098 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.915 -16.521 -7.798 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -5.993 -17.709 -7.091 1.00 0.00 H new ATOM 1747 N ASN A 115 -4.543 -19.981 -5.428 1.00 0.00 N ATOM 1748 CA ASN A 115 -4.816 -21.322 -5.932 1.00 0.00 C ATOM 1749 C ASN A 115 -5.519 -22.168 -4.875 1.00 0.00 C ATOM 1750 O ASN A 115 -6.507 -22.845 -5.163 1.00 0.00 O ATOM 1751 CB ASN A 115 -3.515 -22.003 -6.363 1.00 0.00 C ATOM 1752 CG ASN A 115 -3.759 -23.213 -7.244 1.00 0.00 C ATOM 1753 OD1 ASN A 115 -3.662 -24.354 -6.792 1.00 0.00 O ATOM 1754 ND2 ASN A 115 -4.079 -22.968 -8.510 1.00 0.00 N ATOM 0 H ASN A 115 -3.552 -19.752 -5.355 1.00 0.00 H new ATOM 0 HA ASN A 115 -5.474 -21.231 -6.796 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.893 -21.286 -6.899 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.958 -22.308 -5.478 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -4.256 -23.742 -9.150 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -4.148 -22.006 -8.842 1.00 0.00 H new ATOM 1761 N ASP A 116 -5.004 -22.124 -3.652 1.00 0.00 N ATOM 1762 CA ASP A 116 -5.583 -22.885 -2.550 1.00 0.00 C ATOM 1763 C ASP A 116 -7.094 -22.686 -2.488 1.00 0.00 C ATOM 1764 O ASP A 116 -7.853 -23.650 -2.391 1.00 0.00 O ATOM 1765 CB ASP A 116 -4.946 -22.467 -1.224 1.00 0.00 C ATOM 1766 CG ASP A 116 -5.107 -23.522 -0.147 1.00 0.00 C ATOM 1767 OD1 ASP A 116 -6.261 -23.902 0.143 1.00 0.00 O ATOM 1768 OD2 ASP A 116 -4.080 -23.968 0.406 1.00 0.00 O ATOM 0 H ASP A 116 -4.186 -21.570 -3.398 1.00 0.00 H new ATOM 0 HA ASP A 116 -5.381 -23.942 -2.724 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -3.885 -22.270 -1.380 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.397 -21.534 -0.885 1.00 0.00 H new ATOM 1773 N ASN A 117 -7.524 -21.430 -2.544 1.00 0.00 N ATOM 1774 CA ASN A 117 -8.944 -21.105 -2.492 1.00 0.00 C ATOM 1775 C ASN A 117 -9.519 -20.953 -3.897 1.00 0.00 C ATOM 1776 O ASN A 117 -9.338 -19.923 -4.546 1.00 0.00 O ATOM 1777 CB ASN A 117 -9.165 -19.816 -1.697 1.00 0.00 C ATOM 1778 CG ASN A 117 -9.282 -20.069 -0.207 1.00 0.00 C ATOM 1779 OD1 ASN A 117 -8.522 -19.517 0.589 1.00 0.00 O ATOM 1780 ND2 ASN A 117 -10.236 -20.909 0.178 1.00 0.00 N ATOM 0 H ASN A 117 -6.909 -20.620 -2.625 1.00 0.00 H new ATOM 0 HA ASN A 117 -9.461 -21.925 -1.993 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -8.337 -19.131 -1.883 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -10.071 -19.324 -2.052 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -10.361 -21.119 1.168 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -10.843 -21.344 -0.517 1.00 0.00 H new ATOM 1787 N VAL A 118 -10.214 -21.988 -4.361 1.00 0.00 N ATOM 1788 CA VAL A 118 -10.817 -21.970 -5.688 1.00 0.00 C ATOM 1789 C VAL A 118 -12.252 -22.483 -5.647 1.00 0.00 C ATOM 1790 O VAL A 118 -12.525 -23.603 -5.214 1.00 0.00 O ATOM 1791 CB VAL A 118 -10.008 -22.822 -6.684 1.00 0.00 C ATOM 1792 CG1 VAL A 118 -10.752 -22.951 -8.004 1.00 0.00 C ATOM 1793 CG2 VAL A 118 -8.626 -22.222 -6.898 1.00 0.00 C ATOM 0 H VAL A 118 -10.373 -22.849 -3.837 1.00 0.00 H new ATOM 0 HA VAL A 118 -10.814 -20.933 -6.022 1.00 0.00 H new ATOM 0 HB VAL A 118 -9.885 -23.821 -6.265 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -10.165 -23.556 -8.695 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -11.717 -23.429 -7.833 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -10.908 -21.961 -8.432 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.068 -22.837 -7.604 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -8.725 -21.212 -7.295 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -8.093 -22.187 -5.948 1.00 0.00 H new ATOM 1803 N PRO A 119 -13.193 -21.645 -6.107 1.00 0.00 N ATOM 1804 CA PRO A 119 -14.617 -21.993 -6.134 1.00 0.00 C ATOM 1805 C PRO A 119 -14.932 -23.070 -7.166 1.00 0.00 C ATOM 1806 O PRO A 119 -16.094 -23.409 -7.389 1.00 0.00 O ATOM 1807 CB PRO A 119 -15.297 -20.674 -6.513 1.00 0.00 C ATOM 1808 CG PRO A 119 -14.255 -19.911 -7.256 1.00 0.00 C ATOM 1809 CD PRO A 119 -12.940 -20.295 -6.637 1.00 0.00 C ATOM 0 HA PRO A 119 -14.954 -22.405 -5.183 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -16.178 -20.846 -7.131 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -15.630 -20.131 -5.628 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -14.273 -20.158 -8.318 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -14.426 -18.837 -7.175 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -12.135 -20.296 -7.372 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -12.650 -19.601 -5.848 1.00 0.00 H new TER 1817 PRO A 119