USER MOD reduce.3.24.130724 H: found=0, std=0, add=1054, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1055 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 TYR OH : rot -172:sc= 0.00397 USER MOD Set 1.2: A 18 MET CE :methyl 160:sc= -0.377 (180deg=-0.404) USER MOD Set 2.1: A 5 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 39 THR OG1 : rot 180:sc= -0.0283 USER MOD Single : A 4 SER OG : rot -3:sc= 0.967 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot -76:sc= -4.75! USER MOD Single : A 13 ASN : amide:sc= 0.767 K(o=0.77,f=-0.18) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.0463 X(o=-0.046,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 167:sc= -0.286 (180deg=-0.642) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HE2:sc= 0.821 K(o=0.82,f=-2.6!) USER MOD Single : A 35 ASN : amide:sc= -0.446 X(o=-0.45,f=-0.062) USER MOD Single : A 37 LYS NZ :NH3+ -147:sc= 0.0432 (180deg=0) USER MOD Single : A 41 THR OG1 : rot -59:sc= 0.0893 USER MOD Single : A 42 GLN :FLIP amide:sc= -0.945 F(o=-2.4!,f=-0.94) USER MOD Single : A 45 ASN : amide:sc= -2.11! C(o=-2.1!,f=-4.9!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -56:sc= 0.211 USER MOD Single : A 53 SER OG : rot -138:sc= 1.38 USER MOD Single : A 57 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.04) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -1.43 X(o=-1.4,f=-1.4) USER MOD Single : A 70 TYR OH : rot 180:sc= -0.0632 USER MOD Single : A 71 ASN : amide:sc= -0.248 K(o=-0.25,f=-6!) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.014 USER MOD Single : A 81 THR OG1 : rot 180:sc=-0.00217 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN :FLIP amide:sc= -1.87 F(o=-2.7,f=-1.9) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot -30:sc= 1.17 USER MOD Single : A 98 ASN : amide:sc= -6.29! C(o=-6.3!,f=-14!) USER MOD Single : A 100 ASN : amide:sc= -2.24 K(o=-2.2,f=-7!) USER MOD Single : A 103 ASN : amide:sc= 0.657 K(o=0.66,f=0) USER MOD Single : A 104 THR OG1 : rot -26:sc= 1.59 USER MOD Single : A 115 GLN : amide:sc= -0.401 X(o=-0.4,f=-0.37) USER MOD Single : A 116 THR OG1 : rot 180:sc= -1.23 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot -96:sc= 0.543 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 2 10.385 -11.210 -11.046 1.00 0.00 N ATOM 14 CA PHE A 2 11.166 -9.974 -10.994 1.00 0.00 C ATOM 15 C PHE A 2 10.932 -9.286 -9.670 1.00 0.00 C ATOM 16 O PHE A 2 10.619 -8.106 -9.663 1.00 0.00 O ATOM 17 CB PHE A 2 10.763 -9.095 -12.207 1.00 0.00 C ATOM 18 CG PHE A 2 11.005 -9.905 -13.489 1.00 0.00 C ATOM 19 CD1 PHE A 2 12.285 -9.946 -14.054 1.00 0.00 C ATOM 20 CD2 PHE A 2 9.964 -10.622 -14.089 1.00 0.00 C ATOM 21 CE1 PHE A 2 12.530 -10.720 -15.191 1.00 0.00 C ATOM 22 CE2 PHE A 2 10.207 -11.397 -15.227 1.00 0.00 C ATOM 23 CZ PHE A 2 11.492 -11.452 -15.774 1.00 0.00 C ATOM 0 HA PHE A 2 12.235 -10.174 -11.061 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.715 -8.804 -12.134 1.00 0.00 H new ATOM 0 HB3 PHE A 2 11.349 -8.176 -12.222 1.00 0.00 H new ATOM 0 HD1 PHE A 2 13.087 -9.376 -13.609 1.00 0.00 H new ATOM 0 HD2 PHE A 2 8.969 -10.577 -13.671 1.00 0.00 H new ATOM 0 HE1 PHE A 2 13.521 -10.753 -15.619 1.00 0.00 H new ATOM 0 HE2 PHE A 2 9.402 -11.953 -15.683 1.00 0.00 H new ATOM 0 HZ PHE A 2 11.683 -12.060 -16.646 1.00 0.00 H new ATOM 33 N ASP A 3 11.085 -10.026 -8.545 1.00 0.00 N ATOM 34 CA ASP A 3 10.800 -9.441 -7.236 1.00 0.00 C ATOM 35 C ASP A 3 11.484 -8.104 -7.090 1.00 0.00 C ATOM 36 O ASP A 3 12.629 -7.990 -7.494 1.00 0.00 O ATOM 37 CB ASP A 3 11.214 -10.356 -6.051 1.00 0.00 C ATOM 38 CG ASP A 3 11.247 -9.605 -4.740 1.00 0.00 C ATOM 39 OD1 ASP A 3 12.267 -8.910 -4.480 1.00 0.00 O ATOM 40 OD2 ASP A 3 10.267 -9.696 -3.954 1.00 0.00 O ATOM 0 H ASP A 3 11.395 -10.998 -8.527 1.00 0.00 H new ATOM 0 HA ASP A 3 9.718 -9.319 -7.194 1.00 0.00 H new ATOM 0 HB2 ASP A 3 10.515 -11.188 -5.974 1.00 0.00 H new ATOM 0 HB3 ASP A 3 12.197 -10.783 -6.249 1.00 0.00 H new ATOM 45 N SER A 4 10.779 -7.099 -6.521 1.00 0.00 N ATOM 46 CA SER A 4 11.313 -5.745 -6.481 1.00 0.00 C ATOM 47 C SER A 4 10.345 -4.864 -5.725 1.00 0.00 C ATOM 48 O SER A 4 9.230 -4.717 -6.202 1.00 0.00 O ATOM 49 CB SER A 4 11.383 -5.168 -7.921 1.00 0.00 C ATOM 50 OG SER A 4 12.361 -5.807 -8.756 1.00 0.00 O ATOM 0 H SER A 4 9.859 -7.209 -6.095 1.00 0.00 H new ATOM 0 HA SER A 4 12.298 -5.770 -6.015 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.403 -5.263 -8.388 1.00 0.00 H new ATOM 0 HB3 SER A 4 11.608 -4.103 -7.865 1.00 0.00 H new ATOM 0 HG SER A 4 12.854 -6.473 -8.232 1.00 0.00 H new ATOM 56 N THR A 5 10.727 -4.253 -4.580 1.00 0.00 N ATOM 57 CA THR A 5 9.872 -3.205 -4.036 1.00 0.00 C ATOM 58 C THR A 5 10.082 -2.089 -5.025 1.00 0.00 C ATOM 59 O THR A 5 11.166 -1.531 -5.033 1.00 0.00 O ATOM 60 CB THR A 5 10.227 -2.780 -2.585 1.00 0.00 C ATOM 61 OG1 THR A 5 10.034 -3.881 -1.677 1.00 0.00 O ATOM 62 CG2 THR A 5 9.312 -1.619 -2.108 1.00 0.00 C ATOM 0 H THR A 5 11.573 -4.459 -4.050 1.00 0.00 H new ATOM 0 HA THR A 5 8.836 -3.526 -3.932 1.00 0.00 H new ATOM 0 HB THR A 5 11.269 -2.462 -2.589 1.00 0.00 H new ATOM 0 HG1 THR A 5 10.263 -3.599 -0.767 1.00 0.00 H new ATOM 0 HG21 THR A 5 9.580 -1.339 -1.089 1.00 0.00 H new ATOM 0 HG22 THR A 5 9.441 -0.760 -2.766 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.271 -1.942 -2.134 1.00 0.00 H new ATOM 70 N TRP A 6 9.093 -1.764 -5.885 1.00 0.00 N ATOM 71 CA TRP A 6 9.284 -0.689 -6.837 1.00 0.00 C ATOM 72 C TRP A 6 8.828 0.607 -6.235 1.00 0.00 C ATOM 73 O TRP A 6 8.247 0.556 -5.167 1.00 0.00 O ATOM 74 CB TRP A 6 8.379 -0.921 -8.056 1.00 0.00 C ATOM 75 CG TRP A 6 8.604 -2.228 -8.752 1.00 0.00 C ATOM 76 CD1 TRP A 6 7.975 -3.418 -8.750 1.00 0.00 C ATOM 77 CD2 TRP A 6 9.773 -2.344 -9.683 1.00 0.00 C ATOM 78 NE1 TRP A 6 8.625 -4.237 -9.540 1.00 0.00 N ATOM 79 CE2 TRP A 6 9.733 -3.663 -10.059 1.00 0.00 C ATOM 80 CE3 TRP A 6 10.732 -1.449 -10.135 1.00 0.00 C ATOM 81 CZ2 TRP A 6 10.775 -4.191 -10.821 1.00 0.00 C ATOM 82 CZ3 TRP A 6 11.833 -2.003 -10.789 1.00 0.00 C ATOM 83 CH2 TRP A 6 11.854 -3.357 -11.129 1.00 0.00 C ATOM 0 H TRP A 6 8.184 -2.226 -5.928 1.00 0.00 H new ATOM 0 HA TRP A 6 10.339 -0.659 -7.110 1.00 0.00 H new ATOM 0 HB2 TRP A 6 7.338 -0.868 -7.736 1.00 0.00 H new ATOM 0 HB3 TRP A 6 8.535 -0.112 -8.769 1.00 0.00 H new ATOM 0 HD1 TRP A 6 7.083 -3.658 -8.190 1.00 0.00 H new ATOM 0 HE1 TRP A 6 8.330 -5.193 -9.739 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.632 -0.384 -9.989 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 10.749 -5.215 -11.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 12.678 -1.377 -11.035 1.00 0.00 H new ATOM 0 HH2 TRP A 6 12.715 -3.766 -11.637 1.00 0.00 H new ATOM 94 N LYS A 7 9.039 1.737 -6.947 1.00 0.00 N ATOM 95 CA LYS A 7 8.460 3.002 -6.510 1.00 0.00 C ATOM 96 C LYS A 7 8.196 3.913 -7.679 1.00 0.00 C ATOM 97 O LYS A 7 8.979 3.837 -8.613 1.00 0.00 O ATOM 98 CB LYS A 7 9.225 3.671 -5.336 1.00 0.00 C ATOM 99 CG LYS A 7 10.755 3.819 -5.562 1.00 0.00 C ATOM 100 CD LYS A 7 11.115 4.741 -6.759 1.00 0.00 C ATOM 101 CE LYS A 7 12.276 5.729 -6.461 1.00 0.00 C ATOM 102 NZ LYS A 7 11.857 6.843 -5.574 1.00 0.00 N ATOM 0 H LYS A 7 9.592 1.788 -7.802 1.00 0.00 H new ATOM 0 HA LYS A 7 7.488 2.773 -6.074 1.00 0.00 H new ATOM 0 HB2 LYS A 7 8.800 4.659 -5.159 1.00 0.00 H new ATOM 0 HB3 LYS A 7 9.060 3.086 -4.431 1.00 0.00 H new ATOM 0 HG2 LYS A 7 11.212 4.217 -4.656 1.00 0.00 H new ATOM 0 HG3 LYS A 7 11.187 2.833 -5.730 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.387 4.122 -7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 7 10.231 5.310 -7.046 1.00 0.00 H new ATOM 0 HE2 LYS A 7 13.100 5.188 -5.996 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.652 6.137 -7.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 12.666 7.475 -5.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 11.089 7.378 -6.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 11.523 6.458 -4.668 1.00 0.00 H new ATOM 116 N VAL A 8 7.127 4.752 -7.682 1.00 0.00 N ATOM 117 CA VAL A 8 6.891 5.578 -8.851 1.00 0.00 C ATOM 118 C VAL A 8 8.128 6.343 -9.218 1.00 0.00 C ATOM 119 O VAL A 8 8.811 6.830 -8.332 1.00 0.00 O ATOM 120 CB VAL A 8 5.788 6.673 -8.745 1.00 0.00 C ATOM 121 CG1 VAL A 8 6.105 7.879 -7.822 1.00 0.00 C ATOM 122 CG2 VAL A 8 5.430 7.187 -10.152 1.00 0.00 C ATOM 0 H VAL A 8 6.457 4.859 -6.920 1.00 0.00 H new ATOM 0 HA VAL A 8 6.568 4.834 -9.579 1.00 0.00 H new ATOM 0 HB VAL A 8 4.948 6.169 -8.267 1.00 0.00 H new ATOM 0 HG11 VAL A 8 5.265 8.573 -7.829 1.00 0.00 H new ATOM 0 HG12 VAL A 8 6.274 7.524 -6.805 1.00 0.00 H new ATOM 0 HG13 VAL A 8 6.999 8.388 -8.182 1.00 0.00 H new ATOM 0 HG21 VAL A 8 4.658 7.953 -10.074 1.00 0.00 H new ATOM 0 HG22 VAL A 8 6.317 7.612 -10.621 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.061 6.360 -10.758 1.00 0.00 H new ATOM 132 N ASP A 9 8.378 6.478 -10.534 1.00 0.00 N ATOM 133 CA ASP A 9 9.391 7.399 -11.009 1.00 0.00 C ATOM 134 C ASP A 9 8.657 8.408 -11.875 1.00 0.00 C ATOM 135 O ASP A 9 8.606 9.565 -11.490 1.00 0.00 O ATOM 136 CB ASP A 9 10.513 6.548 -11.662 1.00 0.00 C ATOM 137 CG ASP A 9 11.791 7.302 -11.938 1.00 0.00 C ATOM 138 OD1 ASP A 9 12.138 8.223 -11.149 1.00 0.00 O ATOM 139 OD2 ASP A 9 12.466 6.978 -12.952 1.00 0.00 O ATOM 0 H ASP A 9 7.892 5.962 -11.268 1.00 0.00 H new ATOM 0 HA ASP A 9 9.913 7.989 -10.256 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.738 5.704 -11.010 1.00 0.00 H new ATOM 0 HB3 ASP A 9 10.140 6.136 -12.599 1.00 0.00 H new ATOM 144 N ARG A 10 8.072 8.005 -13.031 1.00 0.00 N ATOM 145 CA ARG A 10 7.633 8.957 -14.043 1.00 0.00 C ATOM 146 C ARG A 10 6.322 8.547 -14.675 1.00 0.00 C ATOM 147 O ARG A 10 5.836 7.482 -14.340 1.00 0.00 O ATOM 148 CB ARG A 10 8.751 8.931 -15.101 1.00 0.00 C ATOM 149 CG ARG A 10 10.187 9.129 -14.545 1.00 0.00 C ATOM 150 CD ARG A 10 10.485 10.506 -13.875 1.00 0.00 C ATOM 151 NE ARG A 10 9.544 11.555 -14.270 1.00 0.00 N ATOM 152 CZ ARG A 10 9.565 12.151 -15.446 1.00 0.00 C ATOM 153 NH1 ARG A 10 10.446 11.866 -16.380 1.00 0.00 N ATOM 154 NH2 ARG A 10 8.666 13.071 -15.709 1.00 0.00 N ATOM 0 H ARG A 10 7.901 7.028 -13.271 1.00 0.00 H new ATOM 0 HA ARG A 10 7.465 9.944 -13.612 1.00 0.00 H new ATOM 0 HB2 ARG A 10 8.710 7.977 -15.627 1.00 0.00 H new ATOM 0 HB3 ARG A 10 8.552 9.710 -15.837 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.382 8.344 -13.815 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.893 8.987 -15.363 1.00 0.00 H new ATOM 0 HD2 ARG A 10 10.456 10.390 -12.792 1.00 0.00 H new ATOM 0 HD3 ARG A 10 11.497 10.818 -14.135 1.00 0.00 H new ATOM 0 HE ARG A 10 8.832 11.841 -13.598 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.157 11.154 -16.211 1.00 0.00 H new ATOM 0 HH12 ARG A 10 10.419 12.357 -17.274 1.00 0.00 H new ATOM 0 HH21 ARG A 10 7.966 13.315 -15.009 1.00 0.00 H new ATOM 0 HH22 ARG A 10 8.668 13.542 -16.614 1.00 0.00 H new ATOM 168 N SER A 11 5.718 9.383 -15.548 1.00 0.00 N ATOM 169 CA SER A 11 4.404 9.043 -16.102 1.00 0.00 C ATOM 170 C SER A 11 3.988 9.937 -17.232 1.00 0.00 C ATOM 171 O SER A 11 4.689 10.880 -17.561 1.00 0.00 O ATOM 172 CB SER A 11 3.302 9.280 -15.029 1.00 0.00 C ATOM 173 OG SER A 11 2.706 8.093 -14.529 1.00 0.00 O ATOM 0 H SER A 11 6.109 10.268 -15.871 1.00 0.00 H new ATOM 0 HA SER A 11 4.498 8.009 -16.433 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.736 9.833 -14.196 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.523 9.910 -15.459 1.00 0.00 H new ATOM 0 HG SER A 11 2.082 7.735 -15.194 1.00 0.00 H new ATOM 179 N GLU A 12 2.788 9.627 -17.774 1.00 0.00 N ATOM 180 CA GLU A 12 2.107 10.577 -18.646 1.00 0.00 C ATOM 181 C GLU A 12 0.651 10.689 -18.261 1.00 0.00 C ATOM 182 O GLU A 12 0.095 9.702 -17.806 1.00 0.00 O ATOM 183 CB GLU A 12 2.178 10.084 -20.108 1.00 0.00 C ATOM 184 CG GLU A 12 1.434 8.733 -20.258 1.00 0.00 C ATOM 185 CD GLU A 12 1.613 8.238 -21.672 1.00 0.00 C ATOM 186 OE1 GLU A 12 1.117 8.931 -22.601 1.00 0.00 O ATOM 187 OE2 GLU A 12 2.247 7.169 -21.881 1.00 0.00 O ATOM 0 H GLU A 12 2.292 8.749 -17.622 1.00 0.00 H new ATOM 0 HA GLU A 12 2.595 11.546 -18.545 1.00 0.00 H new ATOM 0 HB2 GLU A 12 1.734 10.827 -20.771 1.00 0.00 H new ATOM 0 HB3 GLU A 12 3.219 9.969 -20.410 1.00 0.00 H new ATOM 0 HG2 GLU A 12 1.827 8.004 -19.550 1.00 0.00 H new ATOM 0 HG3 GLU A 12 0.375 8.857 -20.032 1.00 0.00 H new ATOM 194 N ASN A 13 0.029 11.872 -18.475 1.00 0.00 N ATOM 195 CA ASN A 13 -1.421 11.993 -18.455 1.00 0.00 C ATOM 196 C ASN A 13 -2.040 11.227 -17.308 1.00 0.00 C ATOM 197 O ASN A 13 -3.123 10.680 -17.448 1.00 0.00 O ATOM 198 CB ASN A 13 -1.816 11.542 -19.889 1.00 0.00 C ATOM 199 CG ASN A 13 -3.136 12.134 -20.300 1.00 0.00 C ATOM 200 OD1 ASN A 13 -3.191 13.011 -21.149 1.00 0.00 O ATOM 201 ND2 ASN A 13 -4.221 11.652 -19.675 1.00 0.00 N ATOM 0 H ASN A 13 0.520 12.746 -18.662 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.800 12.995 -18.253 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.043 11.845 -20.595 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.874 10.454 -19.928 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -5.145 12.019 -19.902 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -4.122 10.919 -18.973 1.00 0.00 H new ATOM 208 N TYR A 14 -1.327 11.173 -16.160 1.00 0.00 N ATOM 209 CA TYR A 14 -1.739 10.307 -15.060 1.00 0.00 C ATOM 210 C TYR A 14 -2.529 11.056 -14.014 1.00 0.00 C ATOM 211 O TYR A 14 -3.456 10.493 -13.457 1.00 0.00 O ATOM 212 CB TYR A 14 -0.486 9.644 -14.440 1.00 0.00 C ATOM 213 CG TYR A 14 -0.909 8.392 -13.671 1.00 0.00 C ATOM 214 CD1 TYR A 14 -1.422 8.500 -12.375 1.00 0.00 C ATOM 215 CD2 TYR A 14 -0.802 7.135 -14.273 1.00 0.00 C ATOM 216 CE1 TYR A 14 -1.953 7.371 -11.749 1.00 0.00 C ATOM 217 CE2 TYR A 14 -1.341 6.008 -13.653 1.00 0.00 C ATOM 218 CZ TYR A 14 -1.961 6.138 -12.408 1.00 0.00 C ATOM 219 OH TYR A 14 -2.589 5.049 -11.796 1.00 0.00 O ATOM 0 H TYR A 14 -0.480 11.713 -15.984 1.00 0.00 H new ATOM 0 HA TYR A 14 -2.401 9.537 -15.456 1.00 0.00 H new ATOM 0 HB2 TYR A 14 0.226 9.382 -15.222 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.017 10.343 -13.772 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -1.408 9.450 -11.862 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -0.299 7.036 -15.224 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.359 7.450 -10.751 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.280 5.042 -14.132 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.407 4.235 -12.310 1.00 0.00 H new ATOM 229 N ASP A 15 -2.181 12.333 -13.740 1.00 0.00 N ATOM 230 CA ASP A 15 -2.959 13.130 -12.798 1.00 0.00 C ATOM 231 C ASP A 15 -4.197 13.546 -13.553 1.00 0.00 C ATOM 232 O ASP A 15 -5.269 13.581 -12.972 1.00 0.00 O ATOM 233 CB ASP A 15 -2.146 14.347 -12.280 1.00 0.00 C ATOM 234 CG ASP A 15 -1.835 15.319 -13.390 1.00 0.00 C ATOM 235 OD1 ASP A 15 -1.148 14.904 -14.363 1.00 0.00 O ATOM 236 OD2 ASP A 15 -2.275 16.497 -13.305 1.00 0.00 O ATOM 0 H ASP A 15 -1.383 12.815 -14.153 1.00 0.00 H new ATOM 0 HA ASP A 15 -3.219 12.565 -11.903 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.709 14.855 -11.498 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -1.217 13.999 -11.829 1.00 0.00 H new ATOM 241 N LYS A 16 -4.059 13.838 -14.867 1.00 0.00 N ATOM 242 CA LYS A 16 -5.231 14.043 -15.708 1.00 0.00 C ATOM 243 C LYS A 16 -6.135 12.839 -15.572 1.00 0.00 C ATOM 244 O LYS A 16 -7.321 12.966 -15.323 1.00 0.00 O ATOM 245 CB LYS A 16 -4.805 14.130 -17.206 1.00 0.00 C ATOM 246 CG LYS A 16 -5.966 14.605 -18.112 1.00 0.00 C ATOM 247 CD LYS A 16 -6.136 16.150 -18.185 1.00 0.00 C ATOM 248 CE LYS A 16 -5.097 16.807 -19.139 1.00 0.00 C ATOM 249 NZ LYS A 16 -5.316 18.266 -19.266 1.00 0.00 N ATOM 0 H LYS A 16 -3.164 13.932 -15.347 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.731 14.962 -15.402 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.964 14.816 -17.305 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -4.459 13.152 -17.542 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -5.804 14.222 -19.120 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -6.896 14.166 -17.750 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -7.143 16.388 -18.527 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -6.030 16.574 -17.186 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -4.090 16.621 -18.764 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.161 16.342 -20.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.605 18.669 -19.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -6.267 18.442 -19.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.230 18.713 -18.331 1.00 0.00 H new ATOM 263 N PHE A 17 -5.564 11.633 -15.753 1.00 0.00 N ATOM 264 CA PHE A 17 -6.382 10.424 -15.665 1.00 0.00 C ATOM 265 C PHE A 17 -7.071 10.354 -14.320 1.00 0.00 C ATOM 266 O PHE A 17 -8.266 10.102 -14.275 1.00 0.00 O ATOM 267 CB PHE A 17 -5.525 9.158 -15.928 1.00 0.00 C ATOM 268 CG PHE A 17 -6.138 7.851 -15.416 1.00 0.00 C ATOM 269 CD1 PHE A 17 -7.511 7.628 -15.537 1.00 0.00 C ATOM 270 CD2 PHE A 17 -5.338 6.874 -14.808 1.00 0.00 C ATOM 271 CE1 PHE A 17 -8.094 6.549 -14.875 1.00 0.00 C ATOM 272 CE2 PHE A 17 -5.917 5.748 -14.217 1.00 0.00 C ATOM 273 CZ PHE A 17 -7.307 5.607 -14.207 1.00 0.00 C ATOM 0 H PHE A 17 -4.576 11.478 -15.954 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.150 10.466 -16.437 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -5.355 9.068 -17.001 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -4.549 9.293 -15.461 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -8.118 8.288 -16.140 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.265 6.992 -14.796 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -9.168 6.439 -14.878 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -5.292 4.989 -13.769 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.768 4.779 -13.689 1.00 0.00 H new ATOM 283 N MET A 18 -6.344 10.593 -13.208 1.00 0.00 N ATOM 284 CA MET A 18 -7.005 10.623 -11.904 1.00 0.00 C ATOM 285 C MET A 18 -8.140 11.610 -11.990 1.00 0.00 C ATOM 286 O MET A 18 -9.265 11.216 -11.732 1.00 0.00 O ATOM 287 CB MET A 18 -6.005 10.942 -10.759 1.00 0.00 C ATOM 288 CG MET A 18 -5.050 9.756 -10.448 1.00 0.00 C ATOM 289 SD MET A 18 -5.972 8.303 -9.834 1.00 0.00 S ATOM 290 CE MET A 18 -5.898 7.171 -11.262 1.00 0.00 C ATOM 0 H MET A 18 -5.338 10.761 -13.192 1.00 0.00 H new ATOM 0 HA MET A 18 -7.406 9.640 -11.656 1.00 0.00 H new ATOM 0 HB2 MET A 18 -5.414 11.817 -11.031 1.00 0.00 H new ATOM 0 HB3 MET A 18 -6.561 11.201 -9.858 1.00 0.00 H new ATOM 0 HG2 MET A 18 -4.498 9.485 -11.348 1.00 0.00 H new ATOM 0 HG3 MET A 18 -4.315 10.064 -9.704 1.00 0.00 H new ATOM 0 HE1 MET A 18 -6.091 6.151 -10.928 1.00 0.00 H new ATOM 0 HE2 MET A 18 -6.650 7.461 -11.996 1.00 0.00 H new ATOM 0 HE3 MET A 18 -4.909 7.223 -11.716 1.00 0.00 H new ATOM 300 N GLU A 19 -7.919 12.881 -12.380 1.00 0.00 N ATOM 301 CA GLU A 19 -9.051 13.800 -12.484 1.00 0.00 C ATOM 302 C GLU A 19 -10.216 13.123 -13.154 1.00 0.00 C ATOM 303 O GLU A 19 -11.334 13.271 -12.684 1.00 0.00 O ATOM 304 CB GLU A 19 -8.668 15.079 -13.272 1.00 0.00 C ATOM 305 CG GLU A 19 -9.878 16.023 -13.468 1.00 0.00 C ATOM 306 CD GLU A 19 -9.406 17.335 -14.041 1.00 0.00 C ATOM 307 OE1 GLU A 19 -9.059 17.363 -15.254 1.00 0.00 O ATOM 308 OE2 GLU A 19 -9.374 18.345 -13.286 1.00 0.00 O ATOM 0 H GLU A 19 -7.008 13.274 -12.617 1.00 0.00 H new ATOM 0 HA GLU A 19 -9.334 14.091 -11.472 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.877 15.609 -12.741 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -8.266 14.798 -14.245 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -10.606 15.564 -14.136 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -10.380 16.190 -12.515 1.00 0.00 H new ATOM 315 N LYS A 20 -9.956 12.369 -14.245 1.00 0.00 N ATOM 316 CA LYS A 20 -11.030 11.738 -14.991 1.00 0.00 C ATOM 317 C LYS A 20 -11.613 10.458 -14.455 1.00 0.00 C ATOM 318 O LYS A 20 -12.637 10.029 -14.964 1.00 0.00 O ATOM 319 CB LYS A 20 -10.576 11.574 -16.460 1.00 0.00 C ATOM 320 CG LYS A 20 -10.427 12.942 -17.173 1.00 0.00 C ATOM 321 CD LYS A 20 -9.856 12.723 -18.596 1.00 0.00 C ATOM 322 CE LYS A 20 -9.685 14.062 -19.362 1.00 0.00 C ATOM 323 NZ LYS A 20 -9.023 13.855 -20.671 1.00 0.00 N ATOM 0 H LYS A 20 -9.021 12.193 -14.612 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.874 12.420 -14.886 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.624 11.043 -16.489 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.299 10.961 -16.998 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.394 13.441 -17.231 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -9.766 13.593 -16.600 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.892 12.218 -18.527 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.521 12.066 -19.157 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.661 14.523 -19.515 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.096 14.755 -18.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.923 14.769 -21.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.082 13.438 -20.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.598 13.213 -21.253 1.00 0.00 H new ATOM 337 N MET A 21 -11.033 9.872 -13.395 1.00 0.00 N ATOM 338 CA MET A 21 -11.793 8.894 -12.619 1.00 0.00 C ATOM 339 C MET A 21 -12.944 9.592 -11.945 1.00 0.00 C ATOM 340 O MET A 21 -13.835 8.907 -11.467 1.00 0.00 O ATOM 341 CB MET A 21 -10.857 8.208 -11.574 1.00 0.00 C ATOM 342 CG MET A 21 -9.918 7.267 -12.358 1.00 0.00 C ATOM 343 SD MET A 21 -10.875 5.826 -12.953 1.00 0.00 S ATOM 344 CE MET A 21 -10.700 4.655 -11.570 1.00 0.00 C ATOM 0 H MET A 21 -10.083 10.050 -13.070 1.00 0.00 H new ATOM 0 HA MET A 21 -12.190 8.119 -13.274 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.284 8.953 -11.022 1.00 0.00 H new ATOM 0 HB3 MET A 21 -11.440 7.649 -10.842 1.00 0.00 H new ATOM 0 HG2 MET A 21 -9.473 7.796 -13.200 1.00 0.00 H new ATOM 0 HG3 MET A 21 -9.098 6.937 -11.720 1.00 0.00 H new ATOM 0 HE1 MET A 21 -11.236 3.735 -11.802 1.00 0.00 H new ATOM 0 HE2 MET A 21 -9.645 4.431 -11.414 1.00 0.00 H new ATOM 0 HE3 MET A 21 -11.115 5.097 -10.664 1.00 0.00 H new ATOM 354 N GLY A 22 -12.947 10.941 -11.857 1.00 0.00 N ATOM 355 CA GLY A 22 -13.821 11.566 -10.881 1.00 0.00 C ATOM 356 C GLY A 22 -13.366 10.995 -9.583 1.00 0.00 C ATOM 357 O GLY A 22 -14.094 10.428 -8.783 1.00 0.00 O ATOM 0 H GLY A 22 -12.382 11.575 -12.422 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.726 12.652 -10.896 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -14.868 11.335 -11.075 1.00 0.00 H new ATOM 361 N VAL A 23 -12.058 11.264 -9.446 1.00 0.00 N ATOM 362 CA VAL A 23 -11.399 11.192 -8.166 1.00 0.00 C ATOM 363 C VAL A 23 -11.886 12.509 -7.603 1.00 0.00 C ATOM 364 O VAL A 23 -12.946 12.983 -7.987 1.00 0.00 O ATOM 365 CB VAL A 23 -9.917 11.151 -8.658 1.00 0.00 C ATOM 366 CG1 VAL A 23 -9.341 12.562 -8.889 1.00 0.00 C ATOM 367 CG2 VAL A 23 -8.970 10.295 -7.848 1.00 0.00 C ATOM 0 H VAL A 23 -11.449 11.533 -10.219 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.549 10.401 -7.431 1.00 0.00 H new ATOM 0 HB VAL A 23 -9.987 10.637 -9.617 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -8.309 12.482 -9.230 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -9.934 13.078 -9.644 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -9.372 13.125 -7.956 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -7.972 10.344 -8.284 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -8.936 10.661 -6.822 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -9.318 9.262 -7.854 1.00 0.00 H new ATOM 377 N ASN A 24 -11.126 13.182 -6.730 1.00 0.00 N ATOM 378 CA ASN A 24 -11.406 14.590 -6.505 1.00 0.00 C ATOM 379 C ASN A 24 -10.159 15.411 -6.253 1.00 0.00 C ATOM 380 O ASN A 24 -9.113 14.843 -5.996 1.00 0.00 O ATOM 381 CB ASN A 24 -12.478 14.572 -5.397 1.00 0.00 C ATOM 382 CG ASN A 24 -13.192 15.889 -5.327 1.00 0.00 C ATOM 383 OD1 ASN A 24 -13.037 16.631 -4.369 1.00 0.00 O ATOM 384 ND2 ASN A 24 -13.988 16.164 -6.383 1.00 0.00 N ATOM 0 H ASN A 24 -10.351 12.791 -6.195 1.00 0.00 H new ATOM 0 HA ASN A 24 -11.790 15.115 -7.379 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -13.195 13.774 -5.591 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -12.011 14.354 -4.436 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -14.509 17.041 -6.415 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -14.069 15.495 -7.149 1.00 0.00 H new ATOM 391 N ILE A 25 -10.236 16.756 -6.362 1.00 0.00 N ATOM 392 CA ILE A 25 -9.044 17.602 -6.308 1.00 0.00 C ATOM 393 C ILE A 25 -8.107 17.177 -5.208 1.00 0.00 C ATOM 394 O ILE A 25 -6.914 17.040 -5.429 1.00 0.00 O ATOM 395 CB ILE A 25 -9.457 19.085 -6.041 1.00 0.00 C ATOM 396 CG1 ILE A 25 -10.033 19.788 -7.307 1.00 0.00 C ATOM 397 CG2 ILE A 25 -8.306 19.925 -5.429 1.00 0.00 C ATOM 398 CD1 ILE A 25 -8.949 20.253 -8.315 1.00 0.00 C ATOM 0 H ILE A 25 -11.110 17.267 -6.487 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.536 17.504 -7.268 1.00 0.00 H new ATOM 0 HB ILE A 25 -10.257 19.030 -5.302 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -10.715 19.104 -7.812 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -10.620 20.652 -6.996 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -8.649 20.947 -5.264 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -8.001 19.487 -4.479 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.458 19.933 -6.113 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -9.428 20.733 -9.169 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.280 20.963 -7.828 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -8.377 19.391 -8.657 1.00 0.00 H new ATOM 410 N VAL A 26 -8.660 17.011 -3.993 1.00 0.00 N ATOM 411 CA VAL A 26 -7.829 16.843 -2.817 1.00 0.00 C ATOM 412 C VAL A 26 -7.340 15.421 -2.689 1.00 0.00 C ATOM 413 O VAL A 26 -6.417 15.164 -1.934 1.00 0.00 O ATOM 414 CB VAL A 26 -8.604 17.338 -1.572 1.00 0.00 C ATOM 415 CG1 VAL A 26 -9.070 18.816 -1.735 1.00 0.00 C ATOM 416 CG2 VAL A 26 -9.758 16.383 -1.175 1.00 0.00 C ATOM 0 H VAL A 26 -9.664 16.992 -3.814 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.929 17.451 -2.911 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.907 17.322 -0.734 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.610 19.128 -0.841 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -8.201 19.458 -1.876 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.725 18.897 -2.602 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -10.269 16.776 -0.296 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -10.465 16.303 -2.001 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.353 15.397 -0.948 1.00 0.00 H new ATOM 426 N LYS A 27 -7.919 14.464 -3.439 1.00 0.00 N ATOM 427 CA LYS A 27 -7.201 13.215 -3.653 1.00 0.00 C ATOM 428 C LYS A 27 -5.972 13.593 -4.429 1.00 0.00 C ATOM 429 O LYS A 27 -4.871 13.279 -4.012 1.00 0.00 O ATOM 430 CB LYS A 27 -8.042 12.217 -4.478 1.00 0.00 C ATOM 431 CG LYS A 27 -9.206 11.676 -3.611 1.00 0.00 C ATOM 432 CD LYS A 27 -8.706 10.450 -2.801 1.00 0.00 C ATOM 433 CE LYS A 27 -9.028 9.089 -3.479 1.00 0.00 C ATOM 434 NZ LYS A 27 -8.947 8.934 -4.945 1.00 0.00 N ATOM 0 H LYS A 27 -8.835 14.532 -3.882 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.971 12.729 -2.705 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -8.436 12.707 -5.368 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.415 11.393 -4.819 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.565 12.453 -2.935 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.046 11.391 -4.244 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.628 10.532 -2.661 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.159 10.470 -1.810 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -8.359 8.348 -3.042 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.041 8.817 -3.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.978 7.924 -5.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -9.749 9.423 -5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.056 9.346 -5.289 1.00 0.00 H new ATOM 448 N ARG A 28 -6.152 14.279 -5.572 1.00 0.00 N ATOM 449 CA ARG A 28 -5.026 14.569 -6.428 1.00 0.00 C ATOM 450 C ARG A 28 -3.932 15.317 -5.710 1.00 0.00 C ATOM 451 O ARG A 28 -2.782 15.015 -5.987 1.00 0.00 O ATOM 452 CB ARG A 28 -5.368 15.396 -7.699 1.00 0.00 C ATOM 453 CG ARG A 28 -6.613 15.015 -8.560 1.00 0.00 C ATOM 454 CD ARG A 28 -6.901 16.053 -9.686 1.00 0.00 C ATOM 455 NE ARG A 28 -5.971 16.041 -10.815 1.00 0.00 N ATOM 456 CZ ARG A 28 -5.967 16.966 -11.757 1.00 0.00 C ATOM 457 NH1 ARG A 28 -6.819 17.967 -11.786 1.00 0.00 N ATOM 458 NH2 ARG A 28 -5.084 16.885 -12.725 1.00 0.00 N ATOM 0 H ARG A 28 -7.051 14.629 -5.905 1.00 0.00 H new ATOM 0 HA ARG A 28 -4.697 13.575 -6.730 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -5.493 16.433 -7.388 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.497 15.362 -8.354 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -6.455 14.034 -9.007 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -7.487 14.934 -7.913 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -7.907 15.878 -10.067 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -6.895 17.050 -9.245 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.293 15.281 -10.877 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -7.527 18.056 -11.057 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.772 18.655 -12.538 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -4.415 16.116 -12.742 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.067 17.591 -13.461 1.00 0.00 H new ATOM 472 N LYS A 29 -4.221 16.291 -4.814 1.00 0.00 N ATOM 473 CA LYS A 29 -3.089 17.006 -4.212 1.00 0.00 C ATOM 474 C LYS A 29 -2.300 16.055 -3.334 1.00 0.00 C ATOM 475 O LYS A 29 -1.124 16.293 -3.108 1.00 0.00 O ATOM 476 CB LYS A 29 -3.452 18.372 -3.545 1.00 0.00 C ATOM 477 CG LYS A 29 -3.364 18.408 -1.991 1.00 0.00 C ATOM 478 CD LYS A 29 -4.486 17.546 -1.363 1.00 0.00 C ATOM 479 CE LYS A 29 -4.080 16.865 -0.035 1.00 0.00 C ATOM 480 NZ LYS A 29 -3.937 17.834 1.074 1.00 0.00 N ATOM 0 H LYS A 29 -5.153 16.578 -4.515 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.434 17.332 -5.020 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -2.789 19.139 -3.946 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.466 18.641 -3.840 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -2.390 18.040 -1.668 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.448 19.437 -1.640 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.359 18.175 -1.186 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.785 16.779 -2.077 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.829 16.119 0.232 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.138 16.335 -0.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.664 17.330 1.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.204 18.531 0.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.842 18.322 1.227 1.00 0.00 H new ATOM 494 N LEU A 30 -2.930 14.961 -2.848 1.00 0.00 N ATOM 495 CA LEU A 30 -2.241 13.949 -2.068 1.00 0.00 C ATOM 496 C LEU A 30 -1.586 13.007 -3.069 1.00 0.00 C ATOM 497 O LEU A 30 -0.430 12.665 -2.884 1.00 0.00 O ATOM 498 CB LEU A 30 -3.311 13.330 -1.112 1.00 0.00 C ATOM 499 CG LEU A 30 -2.874 11.988 -0.514 1.00 0.00 C ATOM 500 CD1 LEU A 30 -1.577 12.090 0.336 1.00 0.00 C ATOM 501 CD2 LEU A 30 -3.995 11.349 0.344 1.00 0.00 C ATOM 0 H LEU A 30 -3.922 14.771 -2.993 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.435 14.300 -1.424 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -3.518 14.032 -0.304 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -4.243 13.191 -1.660 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.664 11.349 -1.372 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.322 11.106 0.730 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -0.761 12.453 -0.288 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.737 12.782 1.163 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -3.646 10.399 0.750 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.254 12.020 1.163 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -4.875 11.177 -0.276 1.00 0.00 H new ATOM 513 N ALA A 31 -2.260 12.572 -4.158 1.00 0.00 N ATOM 514 CA ALA A 31 -1.596 11.809 -5.211 1.00 0.00 C ATOM 515 C ALA A 31 -0.276 12.435 -5.566 1.00 0.00 C ATOM 516 O ALA A 31 0.737 11.759 -5.599 1.00 0.00 O ATOM 517 CB ALA A 31 -2.390 11.656 -6.534 1.00 0.00 C ATOM 0 H ALA A 31 -3.253 12.740 -4.320 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.491 10.815 -4.776 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.804 11.073 -7.245 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.333 11.146 -6.336 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.592 12.642 -6.953 1.00 0.00 H new ATOM 523 N ALA A 32 -0.288 13.756 -5.828 1.00 0.00 N ATOM 524 CA ALA A 32 0.940 14.448 -6.198 1.00 0.00 C ATOM 525 C ALA A 32 2.035 14.155 -5.191 1.00 0.00 C ATOM 526 O ALA A 32 3.186 14.035 -5.582 1.00 0.00 O ATOM 527 CB ALA A 32 0.643 15.966 -6.275 1.00 0.00 C ATOM 0 H ALA A 32 -1.119 14.346 -5.789 1.00 0.00 H new ATOM 0 HA ALA A 32 1.289 14.099 -7.170 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.552 16.501 -6.551 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.127 16.148 -7.024 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.295 16.318 -5.304 1.00 0.00 H new ATOM 533 N HIS A 33 1.684 14.023 -3.890 1.00 0.00 N ATOM 534 CA HIS A 33 2.683 13.738 -2.859 1.00 0.00 C ATOM 535 C HIS A 33 3.284 12.352 -2.989 1.00 0.00 C ATOM 536 O HIS A 33 4.472 12.237 -2.733 1.00 0.00 O ATOM 537 CB HIS A 33 2.109 13.942 -1.421 1.00 0.00 C ATOM 538 CG HIS A 33 2.036 15.400 -1.031 1.00 0.00 C ATOM 539 ND1 HIS A 33 1.257 16.288 -1.616 1.00 0.00 N ATOM 540 CD2 HIS A 33 2.745 15.983 -0.041 1.00 0.00 C ATOM 541 CE1 HIS A 33 1.413 17.446 -1.056 1.00 0.00 C ATOM 542 NE2 HIS A 33 2.261 17.333 -0.140 1.00 0.00 N ATOM 0 H HIS A 33 0.729 14.110 -3.543 1.00 0.00 H new ATOM 0 HA HIS A 33 3.484 14.460 -3.019 1.00 0.00 H new ATOM 0 HB2 HIS A 33 1.113 13.503 -1.365 1.00 0.00 H new ATOM 0 HB3 HIS A 33 2.733 13.408 -0.705 1.00 0.00 H new ATOM 0 HD1 HIS A 33 0.626 16.093 -2.393 1.00 0.00 H new ATOM 0 HD2 HIS A 33 3.471 15.556 0.635 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.899 18.355 -1.332 1.00 0.00 H new ATOM 551 N ASP A 34 2.517 11.298 -3.359 1.00 0.00 N ATOM 552 CA ASP A 34 3.063 9.928 -3.345 1.00 0.00 C ATOM 553 C ASP A 34 2.763 9.100 -4.580 1.00 0.00 C ATOM 554 O ASP A 34 2.906 7.889 -4.522 1.00 0.00 O ATOM 555 CB ASP A 34 2.366 9.205 -2.163 1.00 0.00 C ATOM 556 CG ASP A 34 3.285 8.256 -1.438 1.00 0.00 C ATOM 557 OD1 ASP A 34 4.077 8.737 -0.584 1.00 0.00 O ATOM 558 OD2 ASP A 34 3.222 7.026 -1.713 1.00 0.00 O ATOM 0 H ASP A 34 1.546 11.370 -3.662 1.00 0.00 H new ATOM 0 HA ASP A 34 4.147 10.017 -3.279 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.989 9.948 -1.460 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.503 8.654 -2.537 1.00 0.00 H new ATOM 563 N ASN A 35 2.306 9.743 -5.669 1.00 0.00 N ATOM 564 CA ASN A 35 1.591 9.052 -6.743 1.00 0.00 C ATOM 565 C ASN A 35 1.372 7.549 -6.684 1.00 0.00 C ATOM 566 O ASN A 35 0.214 7.169 -6.582 1.00 0.00 O ATOM 567 CB ASN A 35 2.056 9.459 -8.159 1.00 0.00 C ATOM 568 CG ASN A 35 2.102 10.965 -8.268 1.00 0.00 C ATOM 569 OD1 ASN A 35 1.138 11.556 -8.731 1.00 0.00 O ATOM 570 ND2 ASN A 35 3.203 11.612 -7.825 1.00 0.00 N ATOM 0 H ASN A 35 2.423 10.744 -5.824 1.00 0.00 H new ATOM 0 HA ASN A 35 0.597 9.442 -6.521 1.00 0.00 H new ATOM 0 HB2 ASN A 35 3.041 9.040 -8.363 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.375 9.051 -8.907 1.00 0.00 H new ATOM 0 HD21 ASN A 35 3.249 12.630 -7.871 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.987 11.082 -7.445 1.00 0.00 H new ATOM 577 N LEU A 36 2.389 6.654 -6.772 1.00 0.00 N ATOM 578 CA LEU A 36 2.063 5.249 -7.017 1.00 0.00 C ATOM 579 C LEU A 36 3.280 4.375 -6.916 1.00 0.00 C ATOM 580 O LEU A 36 4.060 4.268 -7.845 1.00 0.00 O ATOM 581 CB LEU A 36 1.298 4.971 -8.345 1.00 0.00 C ATOM 582 CG LEU A 36 0.592 3.576 -8.364 1.00 0.00 C ATOM 583 CD1 LEU A 36 -0.450 3.403 -7.220 1.00 0.00 C ATOM 584 CD2 LEU A 36 -0.144 3.378 -9.720 1.00 0.00 C ATOM 0 H LEU A 36 3.381 6.872 -6.682 1.00 0.00 H new ATOM 0 HA LEU A 36 1.364 4.991 -6.221 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.552 5.751 -8.498 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.997 5.030 -9.179 1.00 0.00 H new ATOM 0 HG LEU A 36 1.377 2.833 -8.222 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.905 2.415 -7.288 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.047 3.508 -6.256 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.223 4.165 -7.314 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.635 2.405 -9.729 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.891 4.162 -9.847 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.577 3.428 -10.536 1.00 0.00 H new ATOM 596 N LYS A 37 3.459 3.723 -5.757 1.00 0.00 N ATOM 597 CA LYS A 37 4.631 2.897 -5.571 1.00 0.00 C ATOM 598 C LYS A 37 4.130 1.548 -5.302 1.00 0.00 C ATOM 599 O LYS A 37 2.959 1.411 -4.990 1.00 0.00 O ATOM 600 CB LYS A 37 5.399 3.380 -4.342 1.00 0.00 C ATOM 601 CG LYS A 37 6.071 2.284 -3.482 1.00 0.00 C ATOM 602 CD LYS A 37 6.615 2.756 -2.119 1.00 0.00 C ATOM 603 CE LYS A 37 7.739 1.774 -1.677 1.00 0.00 C ATOM 604 NZ LYS A 37 8.230 2.066 -0.313 1.00 0.00 N ATOM 0 H LYS A 37 2.819 3.757 -4.963 1.00 0.00 H new ATOM 0 HA LYS A 37 5.288 2.931 -6.440 1.00 0.00 H new ATOM 0 HB2 LYS A 37 6.169 4.077 -4.672 1.00 0.00 H new ATOM 0 HB3 LYS A 37 4.712 3.940 -3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 37 5.348 1.487 -3.309 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.893 1.851 -4.052 1.00 0.00 H new ATOM 0 HD2 LYS A 37 7.006 3.771 -2.196 1.00 0.00 H new ATOM 0 HD3 LYS A 37 5.816 2.778 -1.378 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.362 0.752 -1.715 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.569 1.834 -2.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.243 1.838 -0.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.089 3.074 -0.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 7.704 1.491 0.376 1.00 0.00 H new ATOM 618 N LEU A 38 5.006 0.544 -5.469 1.00 0.00 N ATOM 619 CA LEU A 38 4.416 -0.750 -5.594 1.00 0.00 C ATOM 620 C LEU A 38 5.424 -1.807 -5.246 1.00 0.00 C ATOM 621 O LEU A 38 6.590 -1.487 -5.090 1.00 0.00 O ATOM 622 CB LEU A 38 3.735 -0.541 -6.973 1.00 0.00 C ATOM 623 CG LEU A 38 3.054 -1.824 -7.452 1.00 0.00 C ATOM 624 CD1 LEU A 38 1.961 -1.593 -8.504 1.00 0.00 C ATOM 625 CD2 LEU A 38 4.187 -2.595 -8.106 1.00 0.00 C ATOM 0 H LEU A 38 6.023 0.608 -5.515 1.00 0.00 H new ATOM 0 HA LEU A 38 3.655 -1.147 -4.923 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.999 0.260 -6.901 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.478 -0.225 -7.705 1.00 0.00 H new ATOM 0 HG LEU A 38 2.558 -2.323 -6.620 1.00 0.00 H new ATOM 0 HD11 LEU A 38 1.526 -2.550 -8.793 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.184 -0.952 -8.087 1.00 0.00 H new ATOM 0 HD13 LEU A 38 2.395 -1.112 -9.381 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.809 -3.543 -8.489 1.00 0.00 H new ATOM 0 HD22 LEU A 38 4.599 -2.009 -8.928 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.968 -2.787 -7.371 1.00 0.00 H new ATOM 637 N THR A 39 4.965 -3.069 -5.114 1.00 0.00 N ATOM 638 CA THR A 39 5.884 -4.166 -4.884 1.00 0.00 C ATOM 639 C THR A 39 5.443 -5.309 -5.737 1.00 0.00 C ATOM 640 O THR A 39 4.246 -5.540 -5.793 1.00 0.00 O ATOM 641 CB THR A 39 5.927 -4.657 -3.418 1.00 0.00 C ATOM 642 OG1 THR A 39 6.436 -3.592 -2.600 1.00 0.00 O ATOM 643 CG2 THR A 39 6.780 -5.949 -3.285 1.00 0.00 C ATOM 0 H THR A 39 3.981 -3.335 -5.164 1.00 0.00 H new ATOM 0 HA THR A 39 6.883 -3.804 -5.125 1.00 0.00 H new ATOM 0 HB THR A 39 4.923 -4.918 -3.082 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.469 -3.885 -1.665 1.00 0.00 H new ATOM 0 HG21 THR A 39 6.792 -6.271 -2.244 1.00 0.00 H new ATOM 0 HG22 THR A 39 6.348 -6.736 -3.903 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.799 -5.748 -3.615 1.00 0.00 H new ATOM 651 N ILE A 40 6.405 -6.029 -6.350 1.00 0.00 N ATOM 652 CA ILE A 40 6.104 -7.341 -6.873 1.00 0.00 C ATOM 653 C ILE A 40 6.919 -8.276 -6.015 1.00 0.00 C ATOM 654 O ILE A 40 8.049 -7.947 -5.688 1.00 0.00 O ATOM 655 CB ILE A 40 6.425 -7.351 -8.391 1.00 0.00 C ATOM 656 CG1 ILE A 40 5.175 -7.729 -9.214 1.00 0.00 C ATOM 657 CG2 ILE A 40 7.663 -8.205 -8.760 1.00 0.00 C ATOM 658 CD1 ILE A 40 4.200 -6.511 -9.274 1.00 0.00 C ATOM 0 H ILE A 40 7.367 -5.719 -6.484 1.00 0.00 H new ATOM 0 HA ILE A 40 5.060 -7.649 -6.821 1.00 0.00 H new ATOM 0 HB ILE A 40 6.705 -6.332 -8.658 1.00 0.00 H new ATOM 0 HG12 ILE A 40 5.466 -8.025 -10.222 1.00 0.00 H new ATOM 0 HG13 ILE A 40 4.675 -8.586 -8.762 1.00 0.00 H new ATOM 0 HG21 ILE A 40 7.825 -8.164 -9.837 1.00 0.00 H new ATOM 0 HG22 ILE A 40 8.541 -7.814 -8.246 1.00 0.00 H new ATOM 0 HG23 ILE A 40 7.495 -9.239 -8.457 1.00 0.00 H new ATOM 0 HD11 ILE A 40 3.318 -6.779 -9.855 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.899 -6.236 -8.263 1.00 0.00 H new ATOM 0 HD13 ILE A 40 4.702 -5.666 -9.745 1.00 0.00 H new ATOM 670 N THR A 41 6.345 -9.431 -5.625 1.00 0.00 N ATOM 671 CA THR A 41 7.070 -10.368 -4.775 1.00 0.00 C ATOM 672 C THR A 41 6.493 -11.694 -5.164 1.00 0.00 C ATOM 673 O THR A 41 5.554 -12.165 -4.538 1.00 0.00 O ATOM 674 CB THR A 41 6.904 -10.053 -3.266 1.00 0.00 C ATOM 675 OG1 THR A 41 7.537 -8.802 -2.948 1.00 0.00 O ATOM 676 CG2 THR A 41 7.483 -11.178 -2.363 1.00 0.00 C ATOM 0 H THR A 41 5.403 -9.724 -5.883 1.00 0.00 H new ATOM 0 HA THR A 41 8.150 -10.325 -4.917 1.00 0.00 H new ATOM 0 HB THR A 41 5.834 -9.987 -3.067 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.488 -8.849 -3.179 1.00 0.00 H new ATOM 0 HG21 THR A 41 7.343 -10.912 -1.315 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.966 -12.114 -2.572 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.547 -11.298 -2.568 1.00 0.00 H new ATOM 684 N GLN A 42 7.033 -12.272 -6.255 1.00 0.00 N ATOM 685 CA GLN A 42 6.452 -13.510 -6.723 1.00 0.00 C ATOM 686 C GLN A 42 6.993 -14.621 -5.867 1.00 0.00 C ATOM 687 O GLN A 42 8.000 -14.460 -5.195 1.00 0.00 O ATOM 688 CB GLN A 42 6.712 -13.824 -8.216 1.00 0.00 C ATOM 689 CG GLN A 42 6.242 -12.681 -9.154 1.00 0.00 C ATOM 690 CD GLN A 42 6.373 -13.079 -10.593 1.00 0.00 C ATOM 691 OE1 GLN A 42 5.502 -14.008 -11.034 1.00 0.00 O flip ATOM 692 NE2 GLN A 42 7.222 -12.559 -11.300 1.00 0.00 N flip ATOM 0 H GLN A 42 7.824 -11.915 -6.791 1.00 0.00 H new ATOM 0 HA GLN A 42 5.370 -13.411 -6.640 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.777 -13.999 -8.367 1.00 0.00 H new ATOM 0 HB3 GLN A 42 6.196 -14.746 -8.485 1.00 0.00 H new ATOM 0 HG2 GLN A 42 5.204 -12.430 -8.935 1.00 0.00 H new ATOM 0 HG3 GLN A 42 6.833 -11.785 -8.966 1.00 0.00 H new ATOM 0 HE21 GLN A 42 7.854 -11.861 -10.908 1.00 0.00 H new ATOM 0 HE22 GLN A 42 7.299 -12.823 -12.282 1.00 0.00 H new ATOM 701 N GLU A 43 6.293 -15.768 -5.928 1.00 0.00 N ATOM 702 CA GLU A 43 6.755 -16.974 -5.244 1.00 0.00 C ATOM 703 C GLU A 43 6.234 -18.133 -6.063 1.00 0.00 C ATOM 704 O GLU A 43 5.967 -17.875 -7.226 1.00 0.00 O ATOM 705 CB GLU A 43 6.413 -16.916 -3.725 1.00 0.00 C ATOM 706 CG GLU A 43 4.898 -16.903 -3.422 1.00 0.00 C ATOM 707 CD GLU A 43 4.626 -16.802 -1.942 1.00 0.00 C ATOM 708 OE1 GLU A 43 5.126 -15.834 -1.307 1.00 0.00 O ATOM 709 OE2 GLU A 43 3.907 -17.686 -1.399 1.00 0.00 O ATOM 0 H GLU A 43 5.417 -15.878 -6.439 1.00 0.00 H new ATOM 0 HA GLU A 43 7.838 -17.092 -5.201 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.865 -17.774 -3.228 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.867 -16.023 -3.295 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.431 -16.063 -3.936 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.440 -17.811 -3.815 1.00 0.00 H new ATOM 716 N GLY A 44 6.091 -19.377 -5.552 1.00 0.00 N ATOM 717 CA GLY A 44 5.656 -20.480 -6.412 1.00 0.00 C ATOM 718 C GLY A 44 4.517 -20.095 -7.333 1.00 0.00 C ATOM 719 O GLY A 44 3.379 -20.181 -6.900 1.00 0.00 O ATOM 0 H GLY A 44 6.266 -19.629 -4.579 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.500 -20.822 -7.010 1.00 0.00 H new ATOM 0 HA3 GLY A 44 5.345 -21.319 -5.789 1.00 0.00 H new ATOM 723 N ASN A 45 4.799 -19.660 -8.591 1.00 0.00 N ATOM 724 CA ASN A 45 3.727 -19.327 -9.535 1.00 0.00 C ATOM 725 C ASN A 45 2.695 -18.410 -8.927 1.00 0.00 C ATOM 726 O ASN A 45 1.543 -18.456 -9.324 1.00 0.00 O ATOM 727 CB ASN A 45 3.176 -20.702 -10.010 1.00 0.00 C ATOM 728 CG ASN A 45 1.930 -20.646 -10.858 1.00 0.00 C ATOM 729 OD1 ASN A 45 2.054 -20.649 -12.073 1.00 0.00 O ATOM 730 ND2 ASN A 45 0.721 -20.605 -10.251 1.00 0.00 N ATOM 0 H ASN A 45 5.743 -19.538 -8.958 1.00 0.00 H new ATOM 0 HA ASN A 45 4.081 -18.748 -10.388 1.00 0.00 H new ATOM 0 HB2 ASN A 45 3.957 -21.210 -10.576 1.00 0.00 H new ATOM 0 HB3 ASN A 45 2.969 -21.314 -9.132 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -0.130 -20.575 -10.812 1.00 0.00 H new ATOM 0 HD22 ASN A 45 0.661 -20.604 -9.233 1.00 0.00 H new ATOM 737 N LYS A 46 3.095 -17.546 -7.970 1.00 0.00 N ATOM 738 CA LYS A 46 2.142 -16.670 -7.301 1.00 0.00 C ATOM 739 C LYS A 46 2.687 -15.274 -7.377 1.00 0.00 C ATOM 740 O LYS A 46 3.887 -15.148 -7.546 1.00 0.00 O ATOM 741 CB LYS A 46 1.943 -17.183 -5.861 1.00 0.00 C ATOM 742 CG LYS A 46 0.878 -16.387 -5.063 1.00 0.00 C ATOM 743 CD LYS A 46 0.727 -16.886 -3.600 1.00 0.00 C ATOM 744 CE LYS A 46 0.354 -18.391 -3.523 1.00 0.00 C ATOM 745 NZ LYS A 46 -0.110 -18.763 -2.166 1.00 0.00 N ATOM 0 H LYS A 46 4.060 -17.445 -7.655 1.00 0.00 H new ATOM 0 HA LYS A 46 1.158 -16.666 -7.771 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.651 -18.233 -5.895 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.894 -17.134 -5.331 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.149 -15.331 -5.056 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.084 -16.466 -5.570 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.661 -16.718 -3.064 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.040 -16.298 -3.096 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.428 -18.612 -4.250 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.220 -18.996 -3.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.352 -19.774 -2.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 0.646 -18.574 -1.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.950 -18.202 -1.920 1.00 0.00 H new ATOM 759 N PHE A 47 1.825 -14.239 -7.287 1.00 0.00 N ATOM 760 CA PHE A 47 2.258 -12.882 -7.498 1.00 0.00 C ATOM 761 C PHE A 47 1.730 -12.085 -6.334 1.00 0.00 C ATOM 762 O PHE A 47 0.647 -11.527 -6.433 1.00 0.00 O ATOM 763 CB PHE A 47 1.584 -12.421 -8.811 1.00 0.00 C ATOM 764 CG PHE A 47 1.907 -13.282 -10.037 1.00 0.00 C ATOM 765 CD1 PHE A 47 1.437 -14.595 -10.131 1.00 0.00 C ATOM 766 CD2 PHE A 47 2.654 -12.764 -11.096 1.00 0.00 C ATOM 767 CE1 PHE A 47 1.825 -15.438 -11.169 1.00 0.00 C ATOM 768 CE2 PHE A 47 2.927 -13.570 -12.204 1.00 0.00 C ATOM 769 CZ PHE A 47 2.552 -14.915 -12.237 1.00 0.00 C ATOM 0 H PHE A 47 0.833 -14.338 -7.070 1.00 0.00 H new ATOM 0 HA PHE A 47 3.340 -12.767 -7.568 1.00 0.00 H new ATOM 0 HB2 PHE A 47 0.504 -12.413 -8.665 1.00 0.00 H new ATOM 0 HB3 PHE A 47 1.886 -11.394 -9.016 1.00 0.00 H new ATOM 0 HD1 PHE A 47 0.756 -14.965 -9.379 1.00 0.00 H new ATOM 0 HD2 PHE A 47 3.018 -11.748 -11.059 1.00 0.00 H new ATOM 0 HE1 PHE A 47 1.565 -16.486 -11.147 1.00 0.00 H new ATOM 0 HE2 PHE A 47 3.439 -13.144 -13.054 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.821 -15.539 -13.076 1.00 0.00 H new ATOM 779 N THR A 48 2.481 -12.030 -5.212 1.00 0.00 N ATOM 780 CA THR A 48 2.008 -11.218 -4.103 1.00 0.00 C ATOM 781 C THR A 48 2.355 -9.813 -4.502 1.00 0.00 C ATOM 782 O THR A 48 3.537 -9.585 -4.712 1.00 0.00 O ATOM 783 CB THR A 48 2.655 -11.583 -2.741 1.00 0.00 C ATOM 784 OG1 THR A 48 2.429 -12.971 -2.441 1.00 0.00 O ATOM 785 CG2 THR A 48 2.118 -10.670 -1.606 1.00 0.00 C ATOM 0 H THR A 48 3.367 -12.514 -5.065 1.00 0.00 H new ATOM 0 HA THR A 48 0.942 -11.374 -3.938 1.00 0.00 H new ATOM 0 HB THR A 48 3.730 -11.417 -2.813 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.843 -13.191 -1.580 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.588 -10.948 -0.663 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.350 -9.630 -1.835 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.038 -10.790 -1.522 1.00 0.00 H new ATOM 793 N VAL A 49 1.368 -8.890 -4.619 1.00 0.00 N ATOM 794 CA VAL A 49 1.694 -7.513 -4.962 1.00 0.00 C ATOM 795 C VAL A 49 1.316 -6.619 -3.812 1.00 0.00 C ATOM 796 O VAL A 49 0.428 -6.972 -3.052 1.00 0.00 O ATOM 797 CB VAL A 49 1.128 -7.037 -6.329 1.00 0.00 C ATOM 798 CG1 VAL A 49 1.591 -8.017 -7.439 1.00 0.00 C ATOM 799 CG2 VAL A 49 -0.418 -6.883 -6.330 1.00 0.00 C ATOM 0 H VAL A 49 0.375 -9.080 -4.483 1.00 0.00 H new ATOM 0 HA VAL A 49 2.771 -7.455 -5.116 1.00 0.00 H new ATOM 0 HB VAL A 49 1.523 -6.040 -6.523 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.197 -7.689 -8.401 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.680 -8.033 -7.479 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.221 -9.018 -7.218 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.750 -6.548 -7.313 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.879 -7.843 -6.099 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.711 -6.149 -5.579 1.00 0.00 H new ATOM 809 N LYS A 50 1.985 -5.454 -3.679 1.00 0.00 N ATOM 810 CA LYS A 50 1.579 -4.469 -2.694 1.00 0.00 C ATOM 811 C LYS A 50 1.551 -3.166 -3.417 1.00 0.00 C ATOM 812 O LYS A 50 2.425 -3.010 -4.252 1.00 0.00 O ATOM 813 CB LYS A 50 2.589 -4.374 -1.524 1.00 0.00 C ATOM 814 CG LYS A 50 1.866 -3.878 -0.248 1.00 0.00 C ATOM 815 CD LYS A 50 2.789 -3.821 0.996 1.00 0.00 C ATOM 816 CE LYS A 50 2.020 -3.249 2.220 1.00 0.00 C ATOM 817 NZ LYS A 50 2.827 -3.317 3.460 1.00 0.00 N ATOM 0 H LYS A 50 2.795 -5.189 -4.239 1.00 0.00 H new ATOM 0 HA LYS A 50 0.615 -4.740 -2.263 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.041 -5.349 -1.341 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.398 -3.691 -1.784 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.456 -2.885 -0.434 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.023 -4.536 -0.037 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.160 -4.820 1.227 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.659 -3.199 0.783 1.00 0.00 H new ATOM 0 HE2 LYS A 50 1.743 -2.213 2.023 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.093 -3.806 2.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.279 -2.926 4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.070 -4.308 3.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 3.700 -2.765 3.337 1.00 0.00 H new ATOM 831 N GLU A 51 0.603 -2.250 -3.142 1.00 0.00 N ATOM 832 CA GLU A 51 0.600 -1.008 -3.889 1.00 0.00 C ATOM 833 C GLU A 51 0.642 0.095 -2.866 1.00 0.00 C ATOM 834 O GLU A 51 0.292 -0.165 -1.728 1.00 0.00 O ATOM 835 CB GLU A 51 -0.616 -1.120 -4.829 1.00 0.00 C ATOM 836 CG GLU A 51 -0.723 0.096 -5.771 1.00 0.00 C ATOM 837 CD GLU A 51 -1.746 -0.157 -6.851 1.00 0.00 C ATOM 838 OE1 GLU A 51 -2.905 -0.505 -6.499 1.00 0.00 O ATOM 839 OE2 GLU A 51 -1.404 -0.014 -8.057 1.00 0.00 O ATOM 0 H GLU A 51 -0.131 -2.349 -2.441 1.00 0.00 H new ATOM 0 HA GLU A 51 1.446 -0.789 -4.541 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.536 -2.032 -5.420 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.527 -1.203 -4.237 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -1.001 0.982 -5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.248 0.299 -6.223 1.00 0.00 H new ATOM 846 N SER A 52 1.109 1.302 -3.238 1.00 0.00 N ATOM 847 CA SER A 52 1.329 2.358 -2.266 1.00 0.00 C ATOM 848 C SER A 52 0.931 3.629 -2.950 1.00 0.00 C ATOM 849 O SER A 52 1.770 4.470 -3.236 1.00 0.00 O ATOM 850 CB SER A 52 2.813 2.278 -1.860 1.00 0.00 C ATOM 851 OG SER A 52 3.227 3.392 -1.054 1.00 0.00 O ATOM 0 H SER A 52 1.336 1.556 -4.199 1.00 0.00 H new ATOM 0 HA SER A 52 0.748 2.284 -1.347 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.986 1.353 -1.310 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.429 2.235 -2.758 1.00 0.00 H new ATOM 0 HG SER A 52 3.034 4.228 -1.528 1.00 0.00 H new ATOM 857 N SER A 53 -0.389 3.737 -3.210 1.00 0.00 N ATOM 858 CA SER A 53 -0.894 4.962 -3.791 1.00 0.00 C ATOM 859 C SER A 53 -0.951 5.912 -2.628 1.00 0.00 C ATOM 860 O SER A 53 -1.182 5.463 -1.514 1.00 0.00 O ATOM 861 CB SER A 53 -2.281 4.787 -4.466 1.00 0.00 C ATOM 862 OG SER A 53 -2.521 5.816 -5.442 1.00 0.00 O ATOM 0 H SER A 53 -1.086 3.014 -3.030 1.00 0.00 H new ATOM 0 HA SER A 53 -0.258 5.320 -4.600 1.00 0.00 H new ATOM 0 HB2 SER A 53 -2.334 3.809 -4.945 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.063 4.813 -3.707 1.00 0.00 H new ATOM 0 HG SER A 53 -3.447 6.127 -5.368 1.00 0.00 H new ATOM 868 N ALA A 54 -0.760 7.224 -2.864 1.00 0.00 N ATOM 869 CA ALA A 54 -0.940 8.184 -1.777 1.00 0.00 C ATOM 870 C ALA A 54 -2.250 7.946 -1.057 1.00 0.00 C ATOM 871 O ALA A 54 -2.345 8.212 0.130 1.00 0.00 O ATOM 872 CB ALA A 54 -0.979 9.610 -2.380 1.00 0.00 C ATOM 0 H ALA A 54 -0.492 7.625 -3.763 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.117 8.070 -1.072 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -1.113 10.339 -1.581 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.043 9.810 -2.901 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -1.809 9.685 -3.083 1.00 0.00 H new ATOM 878 N PHE A 55 -3.265 7.438 -1.791 1.00 0.00 N ATOM 879 CA PHE A 55 -4.586 7.232 -1.212 1.00 0.00 C ATOM 880 C PHE A 55 -4.478 6.246 -0.069 1.00 0.00 C ATOM 881 O PHE A 55 -4.839 6.602 1.043 1.00 0.00 O ATOM 882 CB PHE A 55 -5.567 6.788 -2.338 1.00 0.00 C ATOM 883 CG PHE A 55 -5.409 7.656 -3.603 1.00 0.00 C ATOM 884 CD1 PHE A 55 -5.371 9.052 -3.526 1.00 0.00 C ATOM 885 CD2 PHE A 55 -5.269 7.062 -4.864 1.00 0.00 C ATOM 886 CE1 PHE A 55 -5.268 9.821 -4.686 1.00 0.00 C ATOM 887 CE2 PHE A 55 -5.302 7.827 -6.033 1.00 0.00 C ATOM 888 CZ PHE A 55 -5.327 9.219 -5.944 1.00 0.00 C ATOM 0 H PHE A 55 -3.185 7.170 -2.772 1.00 0.00 H new ATOM 0 HA PHE A 55 -4.989 8.152 -0.790 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -5.386 5.743 -2.588 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -6.593 6.856 -1.975 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -5.422 9.538 -2.563 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -5.133 5.993 -4.934 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -5.142 10.891 -4.610 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.308 7.344 -6.999 1.00 0.00 H new ATOM 0 HZ PHE A 55 -5.391 9.823 -6.837 1.00 0.00 H new ATOM 898 N ARG A 56 -3.966 5.018 -0.315 1.00 0.00 N ATOM 899 CA ARG A 56 -3.817 4.037 0.763 1.00 0.00 C ATOM 900 C ARG A 56 -3.053 2.852 0.222 1.00 0.00 C ATOM 901 O ARG A 56 -3.161 2.613 -0.971 1.00 0.00 O ATOM 902 CB ARG A 56 -5.203 3.563 1.294 1.00 0.00 C ATOM 903 CG ARG A 56 -5.152 2.599 2.517 1.00 0.00 C ATOM 904 CD ARG A 56 -4.604 3.263 3.814 1.00 0.00 C ATOM 905 NE ARG A 56 -4.642 2.355 4.963 1.00 0.00 N ATOM 906 CZ ARG A 56 -4.235 2.694 6.171 1.00 0.00 C ATOM 907 NH1 ARG A 56 -3.760 3.885 6.458 1.00 0.00 N ATOM 908 NH2 ARG A 56 -4.305 1.803 7.135 1.00 0.00 N ATOM 0 H ARG A 56 -3.658 4.696 -1.232 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.282 4.499 1.593 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.788 4.441 1.568 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.734 3.066 0.482 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.155 2.218 2.710 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.528 1.741 2.267 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -3.578 3.590 3.646 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -5.190 4.154 4.039 1.00 0.00 H new ATOM 0 HE ARG A 56 -5.002 1.411 4.821 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.693 4.596 5.730 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.458 4.098 7.409 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.669 0.870 6.942 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -3.995 2.045 8.076 1.00 0.00 H new ATOM 922 N ASN A 57 -2.280 2.108 1.045 1.00 0.00 N ATOM 923 CA ASN A 57 -1.571 0.953 0.503 1.00 0.00 C ATOM 924 C ASN A 57 -2.556 -0.107 0.080 1.00 0.00 C ATOM 925 O ASN A 57 -3.507 -0.287 0.825 1.00 0.00 O ATOM 926 CB ASN A 57 -0.527 0.358 1.483 1.00 0.00 C ATOM 927 CG ASN A 57 -1.210 -0.174 2.722 1.00 0.00 C ATOM 928 OD1 ASN A 57 -1.310 0.557 3.696 1.00 0.00 O ATOM 929 ND2 ASN A 57 -1.700 -1.435 2.717 1.00 0.00 N ATOM 0 H ASN A 57 -2.141 2.283 2.040 1.00 0.00 H new ATOM 0 HA ASN A 57 -1.013 1.307 -0.363 1.00 0.00 H new ATOM 0 HB2 ASN A 57 0.026 -0.443 0.993 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.198 1.123 1.760 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -2.171 -1.803 3.544 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -1.599 -2.018 1.886 1.00 0.00 H new ATOM 936 N ILE A 58 -2.368 -0.798 -1.077 1.00 0.00 N ATOM 937 CA ILE A 58 -3.337 -1.814 -1.496 1.00 0.00 C ATOM 938 C ILE A 58 -2.622 -3.146 -1.540 1.00 0.00 C ATOM 939 O ILE A 58 -2.014 -3.453 -2.553 1.00 0.00 O ATOM 940 CB ILE A 58 -4.042 -1.429 -2.841 1.00 0.00 C ATOM 941 CG1 ILE A 58 -3.995 0.116 -3.056 1.00 0.00 C ATOM 942 CG2 ILE A 58 -5.495 -1.975 -2.852 1.00 0.00 C ATOM 943 CD1 ILE A 58 -5.024 0.690 -4.068 1.00 0.00 C ATOM 0 H ILE A 58 -1.578 -0.668 -1.709 1.00 0.00 H new ATOM 0 HA ILE A 58 -4.154 -1.884 -0.778 1.00 0.00 H new ATOM 0 HB ILE A 58 -3.510 -1.887 -3.674 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.151 0.603 -2.093 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -2.994 0.387 -3.392 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -5.979 -1.703 -3.790 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -5.477 -3.060 -2.754 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.052 -1.545 -2.019 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.901 1.771 -4.138 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -4.860 0.242 -5.048 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -6.034 0.461 -3.729 1.00 0.00 H new ATOM 955 N GLU A 59 -2.672 -3.957 -0.455 1.00 0.00 N ATOM 956 CA GLU A 59 -2.085 -5.292 -0.529 1.00 0.00 C ATOM 957 C GLU A 59 -2.983 -6.098 -1.429 1.00 0.00 C ATOM 958 O GLU A 59 -4.150 -6.201 -1.083 1.00 0.00 O ATOM 959 CB GLU A 59 -1.924 -5.973 0.857 1.00 0.00 C ATOM 960 CG GLU A 59 -1.118 -7.300 0.772 1.00 0.00 C ATOM 961 CD GLU A 59 -1.784 -8.330 -0.106 1.00 0.00 C ATOM 962 OE1 GLU A 59 -2.963 -8.678 0.173 1.00 0.00 O ATOM 963 OE2 GLU A 59 -1.139 -8.803 -1.081 1.00 0.00 O ATOM 0 H GLU A 59 -3.096 -3.713 0.440 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.070 -5.224 -0.921 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.421 -5.288 1.540 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.909 -6.175 1.277 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -0.120 -7.090 0.386 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.993 -7.709 1.774 1.00 0.00 H new ATOM 970 N VAL A 60 -2.486 -6.669 -2.556 1.00 0.00 N ATOM 971 CA VAL A 60 -3.339 -7.513 -3.384 1.00 0.00 C ATOM 972 C VAL A 60 -2.537 -8.702 -3.834 1.00 0.00 C ATOM 973 O VAL A 60 -1.327 -8.580 -3.907 1.00 0.00 O ATOM 974 CB VAL A 60 -4.045 -6.771 -4.557 1.00 0.00 C ATOM 975 CG1 VAL A 60 -5.145 -7.661 -5.209 1.00 0.00 C ATOM 976 CG2 VAL A 60 -4.688 -5.444 -4.070 1.00 0.00 C ATOM 0 H VAL A 60 -1.529 -6.557 -2.892 1.00 0.00 H new ATOM 0 HA VAL A 60 -4.178 -7.846 -2.773 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.280 -6.549 -5.301 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -5.619 -7.115 -6.024 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.692 -8.573 -5.598 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.895 -7.919 -4.461 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -5.174 -4.946 -4.909 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.427 -5.659 -3.298 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -3.915 -4.794 -3.661 1.00 0.00 H new ATOM 986 N VAL A 61 -3.166 -9.861 -4.121 1.00 0.00 N ATOM 987 CA VAL A 61 -2.386 -10.999 -4.581 1.00 0.00 C ATOM 988 C VAL A 61 -3.148 -11.784 -5.593 1.00 0.00 C ATOM 989 O VAL A 61 -4.369 -11.778 -5.571 1.00 0.00 O ATOM 990 CB VAL A 61 -1.967 -11.937 -3.408 1.00 0.00 C ATOM 991 CG1 VAL A 61 -3.166 -12.204 -2.455 1.00 0.00 C ATOM 992 CG2 VAL A 61 -1.397 -13.304 -3.898 1.00 0.00 C ATOM 0 H VAL A 61 -4.171 -10.019 -4.043 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.480 -10.597 -5.034 1.00 0.00 H new ATOM 0 HB VAL A 61 -1.174 -11.412 -2.875 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -2.848 -12.861 -1.645 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.518 -11.260 -2.039 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.974 -12.679 -3.011 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -1.123 -13.914 -3.037 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.154 -13.824 -4.485 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.515 -13.130 -4.515 1.00 0.00 H new ATOM 1002 N PHE A 62 -2.391 -12.463 -6.480 1.00 0.00 N ATOM 1003 CA PHE A 62 -3.047 -13.277 -7.466 1.00 0.00 C ATOM 1004 C PHE A 62 -2.150 -14.418 -7.876 1.00 0.00 C ATOM 1005 O PHE A 62 -0.956 -14.326 -7.646 1.00 0.00 O ATOM 1006 CB PHE A 62 -3.424 -12.277 -8.575 1.00 0.00 C ATOM 1007 CG PHE A 62 -2.265 -11.449 -9.147 1.00 0.00 C ATOM 1008 CD1 PHE A 62 -1.528 -11.892 -10.252 1.00 0.00 C ATOM 1009 CD2 PHE A 62 -1.961 -10.217 -8.563 1.00 0.00 C ATOM 1010 CE1 PHE A 62 -0.495 -11.102 -10.769 1.00 0.00 C ATOM 1011 CE2 PHE A 62 -1.005 -9.387 -9.149 1.00 0.00 C ATOM 1012 CZ PHE A 62 -0.212 -9.858 -10.197 1.00 0.00 C ATOM 0 H PHE A 62 -1.372 -12.453 -6.518 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.947 -13.789 -7.125 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.891 -12.828 -9.392 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -4.176 -11.593 -8.181 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.757 -12.845 -10.706 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -2.465 -9.908 -7.659 1.00 0.00 H new ATOM 0 HE1 PHE A 62 0.084 -11.453 -11.610 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.878 -8.376 -8.791 1.00 0.00 H new ATOM 0 HZ PHE A 62 0.614 -9.266 -10.563 1.00 0.00 H new ATOM 1022 N GLU A 63 -2.735 -15.495 -8.446 1.00 0.00 N ATOM 1023 CA GLU A 63 -1.975 -16.685 -8.798 1.00 0.00 C ATOM 1024 C GLU A 63 -2.241 -17.012 -10.246 1.00 0.00 C ATOM 1025 O GLU A 63 -2.979 -17.945 -10.522 1.00 0.00 O ATOM 1026 CB GLU A 63 -2.323 -17.832 -7.812 1.00 0.00 C ATOM 1027 CG GLU A 63 -1.419 -19.068 -8.023 1.00 0.00 C ATOM 1028 CD GLU A 63 -1.828 -20.189 -7.101 1.00 0.00 C ATOM 1029 OE1 GLU A 63 -2.861 -20.851 -7.395 1.00 0.00 O ATOM 1030 OE2 GLU A 63 -1.127 -20.419 -6.079 1.00 0.00 O ATOM 0 H GLU A 63 -3.729 -15.551 -8.666 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.901 -16.524 -8.701 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.216 -17.475 -6.788 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.366 -18.119 -7.943 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.484 -19.400 -9.059 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.379 -18.800 -7.839 1.00 0.00 H new ATOM 1037 N LEU A 64 -1.619 -16.253 -11.179 1.00 0.00 N ATOM 1038 CA LEU A 64 -1.627 -16.644 -12.586 1.00 0.00 C ATOM 1039 C LEU A 64 -3.047 -16.650 -13.114 1.00 0.00 C ATOM 1040 O LEU A 64 -3.725 -17.663 -13.040 1.00 0.00 O ATOM 1041 CB LEU A 64 -0.827 -17.975 -12.750 1.00 0.00 C ATOM 1042 CG LEU A 64 -1.100 -18.755 -14.068 1.00 0.00 C ATOM 1043 CD1 LEU A 64 -0.972 -17.858 -15.333 1.00 0.00 C ATOM 1044 CD2 LEU A 64 -0.151 -19.979 -14.196 1.00 0.00 C ATOM 0 H LEU A 64 -1.119 -15.387 -10.978 1.00 0.00 H new ATOM 0 HA LEU A 64 -1.110 -15.919 -13.214 1.00 0.00 H new ATOM 0 HB2 LEU A 64 0.238 -17.749 -12.694 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.059 -18.626 -11.907 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.132 -19.100 -14.011 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -1.173 -18.454 -16.223 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.691 -17.041 -15.274 1.00 0.00 H new ATOM 0 HD13 LEU A 64 0.037 -17.450 -15.389 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.362 -20.507 -15.126 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.884 -19.638 -14.199 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.309 -20.651 -13.353 1.00 0.00 H new ATOM 1056 N GLY A 65 -3.513 -15.513 -13.683 1.00 0.00 N ATOM 1057 CA GLY A 65 -4.788 -15.519 -14.393 1.00 0.00 C ATOM 1058 C GLY A 65 -5.895 -15.545 -13.383 1.00 0.00 C ATOM 1059 O GLY A 65 -6.672 -16.487 -13.394 1.00 0.00 O ATOM 0 H GLY A 65 -3.034 -14.613 -13.660 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.873 -14.636 -15.026 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.853 -16.388 -15.048 1.00 0.00 H new ATOM 1063 N VAL A 66 -5.957 -14.520 -12.498 1.00 0.00 N ATOM 1064 CA VAL A 66 -6.887 -14.583 -11.375 1.00 0.00 C ATOM 1065 C VAL A 66 -7.525 -13.235 -11.119 1.00 0.00 C ATOM 1066 O VAL A 66 -6.931 -12.226 -11.476 1.00 0.00 O ATOM 1067 CB VAL A 66 -6.076 -15.142 -10.167 1.00 0.00 C ATOM 1068 CG1 VAL A 66 -6.551 -14.588 -8.799 1.00 0.00 C ATOM 1069 CG2 VAL A 66 -6.073 -16.696 -10.156 1.00 0.00 C ATOM 0 H VAL A 66 -5.390 -13.673 -12.546 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.731 -15.243 -11.575 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.054 -14.790 -10.309 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.944 -15.018 -8.002 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -6.447 -13.503 -8.790 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.597 -14.853 -8.642 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.499 -17.053 -9.301 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -7.097 -17.061 -10.083 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.621 -17.065 -11.076 1.00 0.00 H new ATOM 1079 N THR A 67 -8.742 -13.252 -10.509 1.00 0.00 N ATOM 1080 CA THR A 67 -9.504 -12.032 -10.258 1.00 0.00 C ATOM 1081 C THR A 67 -8.829 -11.159 -9.233 1.00 0.00 C ATOM 1082 O THR A 67 -8.026 -11.645 -8.454 1.00 0.00 O ATOM 1083 CB THR A 67 -10.952 -12.386 -9.801 1.00 0.00 C ATOM 1084 OG1 THR A 67 -11.457 -13.446 -10.632 1.00 0.00 O ATOM 1085 CG2 THR A 67 -11.962 -11.206 -9.793 1.00 0.00 C ATOM 0 H THR A 67 -9.202 -14.104 -10.189 1.00 0.00 H new ATOM 0 HA THR A 67 -9.552 -11.470 -11.191 1.00 0.00 H new ATOM 0 HB THR A 67 -10.864 -12.687 -8.757 1.00 0.00 H new ATOM 0 HG1 THR A 67 -12.367 -13.677 -10.351 1.00 0.00 H new ATOM 0 HG21 THR A 67 -12.936 -11.563 -9.460 1.00 0.00 H new ATOM 0 HG22 THR A 67 -11.609 -10.429 -9.115 1.00 0.00 H new ATOM 0 HG23 THR A 67 -12.051 -10.796 -10.799 1.00 0.00 H new ATOM 1093 N PHE A 68 -9.167 -9.854 -9.252 1.00 0.00 N ATOM 1094 CA PHE A 68 -8.529 -8.870 -8.394 1.00 0.00 C ATOM 1095 C PHE A 68 -9.608 -8.085 -7.691 1.00 0.00 C ATOM 1096 O PHE A 68 -10.705 -8.055 -8.225 1.00 0.00 O ATOM 1097 CB PHE A 68 -7.780 -7.960 -9.389 1.00 0.00 C ATOM 1098 CG PHE A 68 -6.604 -7.255 -8.738 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -5.378 -7.926 -8.663 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -6.729 -5.955 -8.241 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -4.235 -7.229 -8.271 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -5.587 -5.273 -7.818 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.337 -5.876 -7.956 1.00 0.00 C ATOM 0 H PHE A 68 -9.887 -9.468 -9.863 1.00 0.00 H new ATOM 0 HA PHE A 68 -7.871 -9.296 -7.637 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -7.425 -8.556 -10.230 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -8.470 -7.218 -9.792 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -5.317 -8.976 -8.907 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.699 -5.483 -8.185 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -3.282 -7.733 -8.212 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.671 -4.286 -7.387 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.441 -5.289 -7.818 1.00 0.00 H new ATOM 1113 N ASN A 69 -9.340 -7.453 -6.526 1.00 0.00 N ATOM 1114 CA ASN A 69 -10.417 -6.782 -5.803 1.00 0.00 C ATOM 1115 C ASN A 69 -9.911 -5.763 -4.825 1.00 0.00 C ATOM 1116 O ASN A 69 -9.219 -6.178 -3.908 1.00 0.00 O ATOM 1117 CB ASN A 69 -11.269 -7.804 -5.017 1.00 0.00 C ATOM 1118 CG ASN A 69 -12.212 -8.530 -5.941 1.00 0.00 C ATOM 1119 OD1 ASN A 69 -12.010 -9.703 -6.211 1.00 0.00 O ATOM 1120 ND2 ASN A 69 -13.253 -7.832 -6.449 1.00 0.00 N ATOM 0 H ASN A 69 -8.420 -7.399 -6.088 1.00 0.00 H new ATOM 0 HA ASN A 69 -11.014 -6.278 -6.563 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -10.617 -8.521 -4.517 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -11.836 -7.292 -4.239 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -13.908 -8.285 -7.086 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -13.383 -6.853 -6.195 1.00 0.00 H new ATOM 1127 N TYR A 70 -10.261 -4.459 -4.963 1.00 0.00 N ATOM 1128 CA TYR A 70 -9.933 -3.558 -3.866 1.00 0.00 C ATOM 1129 C TYR A 70 -10.800 -2.321 -3.818 1.00 0.00 C ATOM 1130 O TYR A 70 -11.435 -2.009 -4.816 1.00 0.00 O ATOM 1131 CB TYR A 70 -8.439 -3.196 -4.001 1.00 0.00 C ATOM 1132 CG TYR A 70 -8.242 -2.148 -5.098 1.00 0.00 C ATOM 1133 CD1 TYR A 70 -8.456 -0.796 -4.810 1.00 0.00 C ATOM 1134 CD2 TYR A 70 -7.811 -2.501 -6.379 1.00 0.00 C ATOM 1135 CE1 TYR A 70 -8.200 0.185 -5.767 1.00 0.00 C ATOM 1136 CE2 TYR A 70 -7.359 -1.510 -7.256 1.00 0.00 C ATOM 1137 CZ TYR A 70 -7.521 -0.158 -6.940 1.00 0.00 C ATOM 1138 OH TYR A 70 -7.015 0.820 -7.802 1.00 0.00 O ATOM 0 H TYR A 70 -10.735 -4.044 -5.766 1.00 0.00 H new ATOM 0 HA TYR A 70 -10.131 -4.065 -2.922 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -8.064 -2.813 -3.052 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -7.861 -4.090 -4.235 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -8.823 -0.509 -3.836 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -7.827 -3.535 -6.691 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -8.524 1.202 -5.603 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -6.882 -1.791 -8.183 1.00 0.00 H new ATOM 0 HH TYR A 70 -6.574 0.388 -8.564 1.00 0.00 H new ATOM 1148 N ASN A 71 -10.798 -1.626 -2.648 1.00 0.00 N ATOM 1149 CA ASN A 71 -11.530 -0.370 -2.497 1.00 0.00 C ATOM 1150 C ASN A 71 -10.580 0.775 -2.238 1.00 0.00 C ATOM 1151 O ASN A 71 -9.553 0.549 -1.616 1.00 0.00 O ATOM 1152 CB ASN A 71 -12.603 -0.437 -1.379 1.00 0.00 C ATOM 1153 CG ASN A 71 -13.730 -1.372 -1.748 1.00 0.00 C ATOM 1154 OD1 ASN A 71 -13.519 -2.283 -2.533 1.00 0.00 O ATOM 1155 ND2 ASN A 71 -14.946 -1.176 -1.191 1.00 0.00 N ATOM 0 H ASN A 71 -10.297 -1.924 -1.811 1.00 0.00 H new ATOM 0 HA ASN A 71 -12.053 -0.198 -3.438 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -12.141 -0.771 -0.450 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -13.002 0.561 -1.196 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -15.720 -1.799 -1.423 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -15.090 -0.405 -0.538 1.00 0.00 H new ATOM 1162 N LEU A 72 -10.912 1.997 -2.727 1.00 0.00 N ATOM 1163 CA LEU A 72 -9.973 3.121 -2.676 1.00 0.00 C ATOM 1164 C LEU A 72 -10.257 3.949 -1.439 1.00 0.00 C ATOM 1165 O LEU A 72 -11.188 3.631 -0.715 1.00 0.00 O ATOM 1166 CB LEU A 72 -10.105 3.939 -4.004 1.00 0.00 C ATOM 1167 CG LEU A 72 -8.891 4.761 -4.540 1.00 0.00 C ATOM 1168 CD1 LEU A 72 -7.548 4.052 -4.248 1.00 0.00 C ATOM 1169 CD2 LEU A 72 -9.028 5.000 -6.076 1.00 0.00 C ATOM 0 H LEU A 72 -11.812 2.217 -3.153 1.00 0.00 H new ATOM 0 HA LEU A 72 -8.941 2.779 -2.600 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -10.394 3.239 -4.788 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -10.935 4.634 -3.875 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.894 5.719 -4.020 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.727 4.654 -4.636 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.429 3.927 -3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -7.540 3.074 -4.730 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.173 5.575 -6.433 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -9.061 4.040 -6.592 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -9.946 5.552 -6.278 1.00 0.00 H new ATOM 1181 N ALA A 73 -9.467 5.015 -1.180 1.00 0.00 N ATOM 1182 CA ALA A 73 -9.683 5.868 -0.009 1.00 0.00 C ATOM 1183 C ALA A 73 -10.833 6.821 -0.226 1.00 0.00 C ATOM 1184 O ALA A 73 -11.453 7.216 0.750 1.00 0.00 O ATOM 1185 CB ALA A 73 -8.451 6.765 0.269 1.00 0.00 C ATOM 0 H ALA A 73 -8.682 5.297 -1.767 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.879 5.187 0.819 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.643 7.386 1.144 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -7.579 6.138 0.453 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.263 7.403 -0.595 1.00 0.00 H new ATOM 1191 N ASP A 74 -11.128 7.202 -1.492 1.00 0.00 N ATOM 1192 CA ASP A 74 -12.285 8.059 -1.751 1.00 0.00 C ATOM 1193 C ASP A 74 -13.443 7.301 -1.164 1.00 0.00 C ATOM 1194 O ASP A 74 -14.308 7.906 -0.550 1.00 0.00 O ATOM 1195 CB ASP A 74 -12.628 8.294 -3.259 1.00 0.00 C ATOM 1196 CG ASP A 74 -12.445 9.710 -3.752 1.00 0.00 C ATOM 1197 OD1 ASP A 74 -12.715 10.670 -2.979 1.00 0.00 O ATOM 1198 OD2 ASP A 74 -12.035 9.877 -4.933 1.00 0.00 O ATOM 0 H ASP A 74 -10.594 6.934 -2.319 1.00 0.00 H new ATOM 0 HA ASP A 74 -12.077 9.045 -1.335 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -12.005 7.634 -3.863 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -13.664 7.999 -3.429 1.00 0.00 H new ATOM 1203 N GLY A 75 -13.441 5.964 -1.379 1.00 0.00 N ATOM 1204 CA GLY A 75 -14.576 5.158 -0.951 1.00 0.00 C ATOM 1205 C GLY A 75 -15.203 4.716 -2.247 1.00 0.00 C ATOM 1206 O GLY A 75 -16.239 5.219 -2.650 1.00 0.00 O ATOM 0 H GLY A 75 -12.687 5.448 -1.832 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -14.259 4.307 -0.348 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -15.273 5.737 -0.345 1.00 0.00 H new ATOM 1210 N THR A 76 -14.495 3.784 -2.913 1.00 0.00 N ATOM 1211 CA THR A 76 -14.789 3.412 -4.293 1.00 0.00 C ATOM 1212 C THR A 76 -14.495 1.949 -4.390 1.00 0.00 C ATOM 1213 O THR A 76 -13.898 1.431 -3.461 1.00 0.00 O ATOM 1214 CB THR A 76 -13.746 4.173 -5.147 1.00 0.00 C ATOM 1215 OG1 THR A 76 -13.897 5.577 -4.875 1.00 0.00 O ATOM 1216 CG2 THR A 76 -13.783 3.896 -6.666 1.00 0.00 C ATOM 0 H THR A 76 -13.710 3.276 -2.505 1.00 0.00 H new ATOM 0 HA THR A 76 -15.809 3.633 -4.606 1.00 0.00 H new ATOM 0 HB THR A 76 -12.766 3.800 -4.851 1.00 0.00 H new ATOM 0 HG1 THR A 76 -13.246 6.084 -5.403 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.010 4.483 -7.162 1.00 0.00 H new ATOM 0 HG22 THR A 76 -13.606 2.836 -6.847 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.759 4.174 -7.063 1.00 0.00 H new ATOM 1224 N GLU A 77 -14.884 1.284 -5.494 1.00 0.00 N ATOM 1225 CA GLU A 77 -14.518 -0.111 -5.633 1.00 0.00 C ATOM 1226 C GLU A 77 -14.194 -0.408 -7.078 1.00 0.00 C ATOM 1227 O GLU A 77 -15.047 -0.107 -7.898 1.00 0.00 O ATOM 1228 CB GLU A 77 -15.690 -0.992 -5.119 1.00 0.00 C ATOM 1229 CG GLU A 77 -16.708 -0.284 -4.180 1.00 0.00 C ATOM 1230 CD GLU A 77 -17.864 -1.195 -3.846 1.00 0.00 C ATOM 1231 OE1 GLU A 77 -17.635 -2.419 -3.649 1.00 0.00 O ATOM 1232 OE2 GLU A 77 -19.022 -0.696 -3.781 1.00 0.00 O ATOM 0 H GLU A 77 -15.426 1.679 -6.262 1.00 0.00 H new ATOM 0 HA GLU A 77 -13.631 -0.334 -5.040 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -16.231 -1.383 -5.981 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.271 -1.848 -4.590 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.207 0.025 -3.262 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.081 0.621 -4.659 1.00 0.00 H new ATOM 1239 N LEU A 78 -13.027 -1.018 -7.412 1.00 0.00 N ATOM 1240 CA LEU A 78 -12.911 -1.712 -8.695 1.00 0.00 C ATOM 1241 C LEU A 78 -12.337 -3.085 -8.454 1.00 0.00 C ATOM 1242 O LEU A 78 -11.566 -3.267 -7.525 1.00 0.00 O ATOM 1243 CB LEU A 78 -12.209 -1.121 -9.963 1.00 0.00 C ATOM 1244 CG LEU A 78 -11.006 -0.156 -9.848 1.00 0.00 C ATOM 1245 CD1 LEU A 78 -11.468 1.248 -9.406 1.00 0.00 C ATOM 1246 CD2 LEU A 78 -9.803 -0.683 -9.048 1.00 0.00 C ATOM 0 H LEU A 78 -12.191 -1.038 -6.828 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.951 -1.630 -9.009 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.879 -1.968 -10.565 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.977 -0.602 -10.537 1.00 0.00 H new ATOM 0 HG LEU A 78 -10.600 -0.078 -10.856 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.604 1.909 -9.332 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -12.169 1.648 -10.139 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -11.957 1.181 -8.434 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.018 0.073 -9.031 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -10.114 -0.906 -8.027 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.423 -1.590 -9.518 1.00 0.00 H new ATOM 1258 N ARG A 79 -12.730 -4.034 -9.334 1.00 0.00 N ATOM 1259 CA ARG A 79 -12.173 -5.373 -9.314 1.00 0.00 C ATOM 1260 C ARG A 79 -11.242 -5.476 -10.482 1.00 0.00 C ATOM 1261 O ARG A 79 -10.906 -4.433 -11.015 1.00 0.00 O ATOM 1262 CB ARG A 79 -13.336 -6.396 -9.344 1.00 0.00 C ATOM 1263 CG ARG A 79 -14.186 -6.300 -10.642 1.00 0.00 C ATOM 1264 CD ARG A 79 -14.719 -7.697 -11.082 1.00 0.00 C ATOM 1265 NE ARG A 79 -16.024 -7.593 -11.739 1.00 0.00 N ATOM 1266 CZ ARG A 79 -16.543 -8.520 -12.519 1.00 0.00 C ATOM 1267 NH1 ARG A 79 -15.965 -9.677 -12.748 1.00 0.00 N ATOM 1268 NH2 ARG A 79 -17.701 -8.281 -13.095 1.00 0.00 N ATOM 0 H ARG A 79 -13.431 -3.881 -10.059 1.00 0.00 H new ATOM 0 HA ARG A 79 -11.603 -5.589 -8.410 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -12.930 -7.404 -9.254 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -13.980 -6.233 -8.480 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -15.026 -5.624 -10.479 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -13.583 -5.871 -11.442 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -14.005 -8.162 -11.761 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -14.800 -8.347 -10.211 1.00 0.00 H new ATOM 0 HE ARG A 79 -16.569 -6.745 -11.582 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -15.069 -9.894 -12.312 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -16.413 -10.358 -13.361 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -18.177 -7.394 -12.934 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -18.123 -8.983 -13.703 1.00 0.00 H new ATOM 1282 N GLY A 80 -10.814 -6.690 -10.886 1.00 0.00 N ATOM 1283 CA GLY A 80 -9.989 -6.782 -12.073 1.00 0.00 C ATOM 1284 C GLY A 80 -9.399 -8.142 -12.264 1.00 0.00 C ATOM 1285 O GLY A 80 -9.922 -9.089 -11.703 1.00 0.00 O ATOM 0 H GLY A 80 -11.022 -7.574 -10.422 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.588 -6.525 -12.947 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.186 -6.048 -12.009 1.00 0.00 H new ATOM 1289 N THR A 81 -8.317 -8.228 -13.062 1.00 0.00 N ATOM 1290 CA THR A 81 -7.630 -9.497 -13.235 1.00 0.00 C ATOM 1291 C THR A 81 -6.202 -9.203 -13.599 1.00 0.00 C ATOM 1292 O THR A 81 -5.997 -8.165 -14.212 1.00 0.00 O ATOM 1293 CB THR A 81 -8.199 -10.295 -14.444 1.00 0.00 C ATOM 1294 OG1 THR A 81 -7.906 -9.548 -15.642 1.00 0.00 O ATOM 1295 CG2 THR A 81 -9.730 -10.534 -14.369 1.00 0.00 C ATOM 0 H THR A 81 -7.916 -7.447 -13.581 1.00 0.00 H new ATOM 0 HA THR A 81 -7.745 -10.067 -12.313 1.00 0.00 H new ATOM 0 HB THR A 81 -7.730 -11.279 -14.438 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.253 -10.030 -16.421 1.00 0.00 H new ATOM 0 HG21 THR A 81 -10.054 -11.096 -15.245 1.00 0.00 H new ATOM 0 HG22 THR A 81 -9.966 -11.099 -13.468 1.00 0.00 H new ATOM 0 HG23 THR A 81 -10.247 -9.575 -14.342 1.00 0.00 H new ATOM 1303 N TRP A 82 -5.241 -10.099 -13.275 1.00 0.00 N ATOM 1304 CA TRP A 82 -3.946 -10.031 -13.922 1.00 0.00 C ATOM 1305 C TRP A 82 -3.652 -11.358 -14.581 1.00 0.00 C ATOM 1306 O TRP A 82 -4.163 -12.363 -14.102 1.00 0.00 O ATOM 1307 CB TRP A 82 -2.856 -9.862 -12.840 1.00 0.00 C ATOM 1308 CG TRP A 82 -2.626 -8.418 -12.530 1.00 0.00 C ATOM 1309 CD1 TRP A 82 -2.782 -7.756 -11.380 1.00 0.00 C ATOM 1310 CD2 TRP A 82 -2.113 -7.416 -13.518 1.00 0.00 C ATOM 1311 NE1 TRP A 82 -2.373 -6.516 -11.504 1.00 0.00 N ATOM 1312 CE2 TRP A 82 -1.910 -6.298 -12.751 1.00 0.00 C ATOM 1313 CE3 TRP A 82 -1.840 -7.455 -14.872 1.00 0.00 C ATOM 1314 CZ2 TRP A 82 -1.289 -5.204 -13.343 1.00 0.00 C ATOM 1315 CZ3 TRP A 82 -1.147 -6.393 -15.449 1.00 0.00 C ATOM 1316 CH2 TRP A 82 -0.864 -5.274 -14.669 1.00 0.00 C ATOM 0 H TRP A 82 -5.348 -10.848 -12.590 1.00 0.00 H new ATOM 0 HA TRP A 82 -3.953 -9.209 -14.638 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -3.154 -10.389 -11.934 1.00 0.00 H new ATOM 0 HB3 TRP A 82 -1.926 -10.317 -13.182 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -3.188 -8.182 -10.475 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -2.401 -5.816 -10.762 1.00 0.00 H new ATOM 0 HE3 TRP A 82 -2.158 -8.294 -15.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -1.136 -4.298 -12.775 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.835 -6.436 -16.482 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -0.309 -4.452 -15.096 1.00 0.00 H new ATOM 1327 N SER A 83 -2.799 -11.362 -15.637 1.00 0.00 N ATOM 1328 CA SER A 83 -2.333 -12.640 -16.174 1.00 0.00 C ATOM 1329 C SER A 83 -0.973 -12.434 -16.753 1.00 0.00 C ATOM 1330 O SER A 83 -0.857 -11.544 -17.578 1.00 0.00 O ATOM 1331 CB SER A 83 -3.299 -13.152 -17.270 1.00 0.00 C ATOM 1332 OG SER A 83 -2.819 -14.374 -17.854 1.00 0.00 O ATOM 0 H SER A 83 -2.441 -10.530 -16.107 1.00 0.00 H new ATOM 0 HA SER A 83 -2.299 -13.384 -15.378 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.288 -13.314 -16.841 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.409 -12.394 -18.045 1.00 0.00 H new ATOM 0 HG SER A 83 -3.448 -14.677 -18.542 1.00 0.00 H new ATOM 1338 N LEU A 84 0.033 -13.228 -16.319 1.00 0.00 N ATOM 1339 CA LEU A 84 1.374 -13.024 -16.807 1.00 0.00 C ATOM 1340 C LEU A 84 1.470 -13.889 -18.039 1.00 0.00 C ATOM 1341 O LEU A 84 1.230 -15.081 -17.930 1.00 0.00 O ATOM 1342 CB LEU A 84 2.399 -13.120 -15.647 1.00 0.00 C ATOM 1343 CG LEU A 84 3.852 -13.061 -16.236 1.00 0.00 C ATOM 1344 CD1 LEU A 84 5.028 -12.321 -15.505 1.00 0.00 C ATOM 1345 CD2 LEU A 84 4.195 -14.546 -16.274 1.00 0.00 C ATOM 0 H LEU A 84 -0.074 -13.990 -15.650 1.00 0.00 H new ATOM 0 HA LEU A 84 1.639 -12.025 -17.154 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.246 -12.303 -14.942 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.255 -14.049 -15.095 1.00 0.00 H new ATOM 0 HG LEU A 84 3.799 -12.460 -17.144 1.00 0.00 H new ATOM 0 HD11 LEU A 84 5.939 -12.412 -16.097 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.776 -11.267 -15.385 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.186 -12.770 -14.524 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.202 -14.677 -16.671 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.146 -14.957 -15.266 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.483 -15.068 -16.913 1.00 0.00 H new ATOM 1357 N GLU A 85 1.760 -13.299 -19.225 1.00 0.00 N ATOM 1358 CA GLU A 85 1.664 -14.057 -20.468 1.00 0.00 C ATOM 1359 C GLU A 85 2.538 -13.417 -21.520 1.00 0.00 C ATOM 1360 O GLU A 85 2.707 -12.214 -21.433 1.00 0.00 O ATOM 1361 CB GLU A 85 0.172 -14.033 -20.894 1.00 0.00 C ATOM 1362 CG GLU A 85 -0.420 -12.595 -20.925 1.00 0.00 C ATOM 1363 CD GLU A 85 -1.849 -12.654 -21.403 1.00 0.00 C ATOM 1364 OE1 GLU A 85 -2.057 -12.881 -22.626 1.00 0.00 O ATOM 1365 OE2 GLU A 85 -2.776 -12.476 -20.568 1.00 0.00 O ATOM 0 H GLU A 85 2.053 -12.328 -19.333 1.00 0.00 H new ATOM 0 HA GLU A 85 2.004 -15.085 -20.340 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.073 -14.484 -21.882 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.408 -14.646 -20.204 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.375 -12.149 -19.931 1.00 0.00 H new ATOM 0 HG3 GLU A 85 0.171 -11.960 -21.586 1.00 0.00 H new ATOM 1372 N GLY A 86 3.109 -14.152 -22.501 1.00 0.00 N ATOM 1373 CA GLY A 86 3.968 -13.497 -23.491 1.00 0.00 C ATOM 1374 C GLY A 86 4.991 -12.597 -22.833 1.00 0.00 C ATOM 1375 O GLY A 86 5.174 -11.478 -23.285 1.00 0.00 O ATOM 0 H GLY A 86 2.993 -15.158 -22.621 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.478 -14.253 -24.088 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.354 -12.911 -24.175 1.00 0.00 H new ATOM 1379 N ASN A 87 5.662 -13.083 -21.764 1.00 0.00 N ATOM 1380 CA ASN A 87 6.654 -12.275 -21.048 1.00 0.00 C ATOM 1381 C ASN A 87 6.170 -10.892 -20.654 1.00 0.00 C ATOM 1382 O ASN A 87 6.976 -9.976 -20.615 1.00 0.00 O ATOM 1383 CB ASN A 87 8.014 -12.262 -21.801 1.00 0.00 C ATOM 1384 CG ASN A 87 7.919 -11.568 -23.140 1.00 0.00 C ATOM 1385 OD1 ASN A 87 7.594 -12.287 -24.239 1.00 0.00 O flip ATOM 1386 ND2 ASN A 87 8.135 -10.367 -23.196 1.00 0.00 N flip ATOM 0 H ASN A 87 5.531 -14.022 -21.387 1.00 0.00 H new ATOM 0 HA ASN A 87 6.816 -12.770 -20.091 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.763 -11.762 -21.187 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.356 -13.287 -21.948 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.378 -9.852 -22.349 1.00 0.00 H new ATOM 0 HD22 ASN A 87 8.072 -9.879 -24.089 1.00 0.00 H new ATOM 1393 N LYS A 88 4.866 -10.716 -20.334 1.00 0.00 N ATOM 1394 CA LYS A 88 4.370 -9.420 -19.863 1.00 0.00 C ATOM 1395 C LYS A 88 3.012 -9.598 -19.220 1.00 0.00 C ATOM 1396 O LYS A 88 2.193 -10.274 -19.819 1.00 0.00 O ATOM 1397 CB LYS A 88 4.219 -8.454 -21.073 1.00 0.00 C ATOM 1398 CG LYS A 88 3.225 -9.011 -22.129 1.00 0.00 C ATOM 1399 CD LYS A 88 3.348 -8.374 -23.533 1.00 0.00 C ATOM 1400 CE LYS A 88 2.742 -6.946 -23.595 1.00 0.00 C ATOM 1401 NZ LYS A 88 2.841 -6.378 -24.959 1.00 0.00 N ATOM 0 H LYS A 88 4.157 -11.447 -20.395 1.00 0.00 H new ATOM 0 HA LYS A 88 5.075 -9.011 -19.139 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.871 -7.482 -20.722 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.193 -8.296 -21.537 1.00 0.00 H new ATOM 0 HG2 LYS A 88 3.377 -10.087 -22.219 1.00 0.00 H new ATOM 0 HG3 LYS A 88 2.208 -8.862 -21.765 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.399 -8.331 -23.818 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.846 -9.010 -24.262 1.00 0.00 H new ATOM 0 HE2 LYS A 88 1.697 -6.979 -23.287 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.262 -6.297 -22.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 2.428 -5.424 -24.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 3.841 -6.325 -25.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 2.324 -6.986 -25.626 1.00 0.00 H new ATOM 1415 N LEU A 89 2.707 -9.035 -18.029 1.00 0.00 N ATOM 1416 CA LEU A 89 1.342 -9.081 -17.564 1.00 0.00 C ATOM 1417 C LEU A 89 0.432 -8.200 -18.349 1.00 0.00 C ATOM 1418 O LEU A 89 0.858 -7.125 -18.731 1.00 0.00 O ATOM 1419 CB LEU A 89 1.054 -8.672 -16.110 1.00 0.00 C ATOM 1420 CG LEU A 89 1.371 -9.704 -15.021 1.00 0.00 C ATOM 1421 CD1 LEU A 89 2.874 -9.932 -15.036 1.00 0.00 C ATOM 1422 CD2 LEU A 89 1.064 -9.122 -13.645 1.00 0.00 C ATOM 0 H LEU A 89 3.370 -8.567 -17.410 1.00 0.00 H new ATOM 0 HA LEU A 89 1.164 -10.150 -17.680 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.621 -7.767 -15.894 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.002 -8.413 -16.034 1.00 0.00 H new ATOM 0 HG LEU A 89 0.790 -10.608 -15.203 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.139 -10.663 -14.272 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.176 -10.305 -16.015 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.387 -8.992 -14.832 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.292 -9.862 -12.878 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.672 -8.232 -13.483 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.008 -8.856 -13.590 1.00 0.00 H new ATOM 1434 N ILE A 90 -0.821 -8.695 -18.492 1.00 0.00 N ATOM 1435 CA ILE A 90 -1.879 -7.954 -19.142 1.00 0.00 C ATOM 1436 C ILE A 90 -3.007 -7.958 -18.143 1.00 0.00 C ATOM 1437 O ILE A 90 -3.335 -9.043 -17.685 1.00 0.00 O ATOM 1438 CB ILE A 90 -2.152 -8.707 -20.472 1.00 0.00 C ATOM 1439 CG1 ILE A 90 -0.871 -8.590 -21.346 1.00 0.00 C ATOM 1440 CG2 ILE A 90 -3.401 -8.129 -21.177 1.00 0.00 C ATOM 1441 CD1 ILE A 90 -0.998 -9.191 -22.771 1.00 0.00 C ATOM 0 H ILE A 90 -1.105 -9.615 -18.155 1.00 0.00 H new ATOM 0 HA ILE A 90 -1.679 -6.916 -19.408 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.368 -9.760 -20.290 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -0.603 -7.537 -21.434 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -0.049 -9.086 -20.830 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.576 -8.669 -22.107 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.269 -8.236 -20.526 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -3.240 -7.073 -21.396 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.057 -9.063 -23.305 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -1.232 -10.253 -22.698 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.794 -8.680 -23.312 1.00 0.00 H new ATOM 1453 N GLY A 91 -3.569 -6.778 -17.779 1.00 0.00 N ATOM 1454 CA GLY A 91 -4.615 -6.769 -16.760 1.00 0.00 C ATOM 1455 C GLY A 91 -5.790 -5.943 -17.188 1.00 0.00 C ATOM 1456 O GLY A 91 -5.734 -5.255 -18.197 1.00 0.00 O ATOM 0 H GLY A 91 -3.321 -5.866 -18.163 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -4.940 -7.790 -16.561 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -4.212 -6.375 -15.827 1.00 0.00 H new ATOM 1460 N LYS A 92 -6.848 -5.994 -16.354 1.00 0.00 N ATOM 1461 CA LYS A 92 -7.984 -5.111 -16.563 1.00 0.00 C ATOM 1462 C LYS A 92 -8.688 -4.927 -15.252 1.00 0.00 C ATOM 1463 O LYS A 92 -8.545 -5.788 -14.401 1.00 0.00 O ATOM 1464 CB LYS A 92 -8.944 -5.476 -17.728 1.00 0.00 C ATOM 1465 CG LYS A 92 -9.798 -6.758 -17.510 1.00 0.00 C ATOM 1466 CD LYS A 92 -10.761 -6.675 -16.288 1.00 0.00 C ATOM 1467 CE LYS A 92 -11.998 -7.603 -16.435 1.00 0.00 C ATOM 1468 NZ LYS A 92 -12.846 -7.577 -15.219 1.00 0.00 N ATOM 0 H LYS A 92 -6.929 -6.623 -15.555 1.00 0.00 H new ATOM 0 HA LYS A 92 -7.580 -4.162 -16.916 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -9.617 -4.636 -17.899 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -8.355 -5.602 -18.636 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -10.384 -6.950 -18.409 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -9.130 -7.609 -17.377 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -10.216 -6.943 -15.383 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -11.097 -5.645 -16.165 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -12.587 -7.291 -17.297 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -11.667 -8.624 -16.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -13.662 -8.207 -15.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -12.290 -7.898 -14.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -13.181 -6.607 -15.050 1.00 0.00 H new ATOM 1482 N PHE A 93 -9.382 -3.788 -15.064 1.00 0.00 N ATOM 1483 CA PHE A 93 -10.053 -3.512 -13.809 1.00 0.00 C ATOM 1484 C PHE A 93 -11.421 -2.972 -14.154 1.00 0.00 C ATOM 1485 O PHE A 93 -11.585 -2.562 -15.292 1.00 0.00 O ATOM 1486 CB PHE A 93 -9.150 -2.631 -12.910 1.00 0.00 C ATOM 1487 CG PHE A 93 -7.813 -3.238 -12.445 1.00 0.00 C ATOM 1488 CD1 PHE A 93 -6.927 -3.869 -13.321 1.00 0.00 C ATOM 1489 CD2 PHE A 93 -7.400 -3.147 -11.114 1.00 0.00 C ATOM 1490 CE1 PHE A 93 -6.009 -4.812 -12.847 1.00 0.00 C ATOM 1491 CE2 PHE A 93 -6.283 -3.853 -10.668 1.00 0.00 C ATOM 1492 CZ PHE A 93 -5.692 -4.816 -11.488 1.00 0.00 C ATOM 0 H PHE A 93 -9.484 -3.058 -15.769 1.00 0.00 H new ATOM 0 HA PHE A 93 -10.221 -4.395 -13.192 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -8.933 -1.709 -13.449 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -9.722 -2.355 -12.024 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -6.951 -3.627 -14.373 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -7.950 -2.525 -10.424 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -5.554 -5.524 -13.520 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -5.875 -3.655 -9.688 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.007 -5.545 -11.081 1.00 0.00 H new ATOM 1502 N LYS A 94 -12.420 -2.981 -13.238 1.00 0.00 N ATOM 1503 CA LYS A 94 -13.758 -2.503 -13.587 1.00 0.00 C ATOM 1504 C LYS A 94 -14.452 -1.950 -12.369 1.00 0.00 C ATOM 1505 O LYS A 94 -14.434 -2.611 -11.344 1.00 0.00 O ATOM 1506 CB LYS A 94 -14.570 -3.611 -14.310 1.00 0.00 C ATOM 1507 CG LYS A 94 -15.845 -3.133 -15.067 1.00 0.00 C ATOM 1508 CD LYS A 94 -17.100 -2.876 -14.182 1.00 0.00 C ATOM 1509 CE LYS A 94 -17.865 -4.159 -13.751 1.00 0.00 C ATOM 1510 NZ LYS A 94 -18.633 -4.785 -14.855 1.00 0.00 N ATOM 0 H LYS A 94 -12.319 -3.308 -12.277 1.00 0.00 H new ATOM 0 HA LYS A 94 -13.674 -1.680 -14.297 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -13.913 -4.110 -15.022 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -14.866 -4.357 -13.573 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -15.605 -2.213 -15.600 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -16.100 -3.880 -15.819 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -16.792 -2.335 -13.287 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -17.785 -2.227 -14.727 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -17.152 -4.884 -13.358 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -18.548 -3.910 -12.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -19.119 -5.634 -14.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -19.336 -4.109 -15.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -17.983 -5.052 -15.622 1.00 0.00 H new ATOM 1524 N ARG A 95 -15.040 -0.733 -12.482 1.00 0.00 N ATOM 1525 CA ARG A 95 -15.520 0.006 -11.325 1.00 0.00 C ATOM 1526 C ARG A 95 -17.014 -0.150 -11.207 1.00 0.00 C ATOM 1527 O ARG A 95 -17.673 -0.202 -12.233 1.00 0.00 O ATOM 1528 CB ARG A 95 -15.013 1.458 -11.529 1.00 0.00 C ATOM 1529 CG ARG A 95 -15.174 2.342 -10.274 1.00 0.00 C ATOM 1530 CD ARG A 95 -14.721 3.799 -10.571 1.00 0.00 C ATOM 1531 NE ARG A 95 -15.247 4.732 -9.576 1.00 0.00 N ATOM 1532 CZ ARG A 95 -14.855 5.981 -9.445 1.00 0.00 C ATOM 1533 NH1 ARG A 95 -13.976 6.538 -10.242 1.00 0.00 N ATOM 1534 NH2 ARG A 95 -15.371 6.710 -8.479 1.00 0.00 N ATOM 0 H ARG A 95 -15.186 -0.256 -13.372 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.143 -0.359 -10.370 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -13.961 1.432 -11.814 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -15.557 1.912 -12.357 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -16.215 2.338 -9.950 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -14.584 1.931 -9.455 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -13.632 3.849 -10.580 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -15.061 4.093 -11.564 1.00 0.00 H new ATOM 0 HE ARG A 95 -15.968 4.391 -8.940 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -13.565 5.999 -11.004 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -13.703 7.511 -10.100 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -16.062 6.305 -7.848 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -15.080 7.680 -8.361 1.00 0.00 H new ATOM 1548 N THR A 96 -17.540 -0.257 -9.963 1.00 0.00 N ATOM 1549 CA THR A 96 -18.928 -0.664 -9.754 1.00 0.00 C ATOM 1550 C THR A 96 -19.732 0.352 -8.981 1.00 0.00 C ATOM 1551 O THR A 96 -20.789 0.017 -8.469 1.00 0.00 O ATOM 1552 CB THR A 96 -18.941 -2.077 -9.112 1.00 0.00 C ATOM 1553 OG1 THR A 96 -20.281 -2.535 -8.854 1.00 0.00 O ATOM 1554 CG2 THR A 96 -18.139 -2.131 -7.789 1.00 0.00 C ATOM 0 H THR A 96 -17.021 -0.067 -9.106 1.00 0.00 H new ATOM 0 HA THR A 96 -19.432 -0.715 -10.719 1.00 0.00 H new ATOM 0 HB THR A 96 -18.465 -2.732 -9.841 1.00 0.00 H new ATOM 0 HG1 THR A 96 -20.860 -1.766 -8.673 1.00 0.00 H new ATOM 0 HG21 THR A 96 -18.179 -3.141 -7.380 1.00 0.00 H new ATOM 0 HG22 THR A 96 -17.101 -1.858 -7.981 1.00 0.00 H new ATOM 0 HG23 THR A 96 -18.571 -1.432 -7.073 1.00 0.00 H new ATOM 1562 N ASP A 97 -19.263 1.618 -8.939 1.00 0.00 N ATOM 1563 CA ASP A 97 -20.114 2.737 -8.596 1.00 0.00 C ATOM 1564 C ASP A 97 -20.208 3.559 -9.858 1.00 0.00 C ATOM 1565 O ASP A 97 -20.188 4.780 -9.800 1.00 0.00 O ATOM 1566 CB ASP A 97 -19.489 3.418 -7.352 1.00 0.00 C ATOM 1567 CG ASP A 97 -17.989 3.579 -7.374 1.00 0.00 C ATOM 1568 OD1 ASP A 97 -17.276 2.538 -7.334 1.00 0.00 O ATOM 1569 OD2 ASP A 97 -17.504 4.742 -7.428 1.00 0.00 O ATOM 0 H ASP A 97 -18.296 1.872 -9.141 1.00 0.00 H new ATOM 0 HA ASP A 97 -21.137 2.505 -8.298 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -19.939 4.404 -7.237 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -19.760 2.838 -6.470 1.00 0.00 H new ATOM 1574 N ASN A 98 -20.272 2.854 -11.015 1.00 0.00 N ATOM 1575 CA ASN A 98 -19.945 3.484 -12.285 1.00 0.00 C ATOM 1576 C ASN A 98 -20.315 2.615 -13.468 1.00 0.00 C ATOM 1577 O ASN A 98 -21.056 3.073 -14.325 1.00 0.00 O ATOM 1578 CB ASN A 98 -18.408 3.659 -12.311 1.00 0.00 C ATOM 1579 CG ASN A 98 -17.882 4.602 -11.292 1.00 0.00 C ATOM 1580 OD1 ASN A 98 -17.669 4.253 -10.142 1.00 0.00 O ATOM 1581 ND2 ASN A 98 -17.631 5.826 -11.747 1.00 0.00 N ATOM 0 H ASN A 98 -20.542 1.873 -11.079 1.00 0.00 H new ATOM 0 HA ASN A 98 -20.495 4.422 -12.363 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -17.941 2.685 -12.163 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.111 4.008 -13.300 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -17.239 6.532 -11.123 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -17.830 6.059 -12.720 1.00 0.00 H new ATOM 1588 N GLY A 99 -19.795 1.365 -13.545 1.00 0.00 N ATOM 1589 CA GLY A 99 -20.041 0.536 -14.719 1.00 0.00 C ATOM 1590 C GLY A 99 -19.077 0.942 -15.806 1.00 0.00 C ATOM 1591 O GLY A 99 -19.520 1.321 -16.877 1.00 0.00 O ATOM 0 H GLY A 99 -19.220 0.931 -12.823 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -19.911 -0.518 -14.472 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -21.069 0.659 -15.060 1.00 0.00 H new ATOM 1595 N ASN A 100 -17.749 0.860 -15.546 1.00 0.00 N ATOM 1596 CA ASN A 100 -16.778 1.176 -16.592 1.00 0.00 C ATOM 1597 C ASN A 100 -15.453 0.523 -16.295 1.00 0.00 C ATOM 1598 O ASN A 100 -15.228 0.175 -15.147 1.00 0.00 O ATOM 1599 CB ASN A 100 -16.528 2.701 -16.717 1.00 0.00 C ATOM 1600 CG ASN A 100 -15.214 3.090 -16.110 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -14.175 3.109 -16.748 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -15.245 3.366 -14.817 1.00 0.00 N ATOM 0 H ASN A 100 -17.347 0.586 -14.649 1.00 0.00 H new ATOM 0 HA ASN A 100 -17.200 0.802 -17.525 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -16.545 2.989 -17.768 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -17.334 3.245 -16.224 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -14.383 3.603 -14.325 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -16.131 3.342 -14.311 1.00 0.00 H new ATOM 1609 N GLU A 101 -14.577 0.398 -17.319 1.00 0.00 N ATOM 1610 CA GLU A 101 -13.288 -0.246 -17.134 1.00 0.00 C ATOM 1611 C GLU A 101 -12.114 0.651 -16.851 1.00 0.00 C ATOM 1612 O GLU A 101 -12.078 1.805 -17.249 1.00 0.00 O ATOM 1613 CB GLU A 101 -12.854 -1.137 -18.325 1.00 0.00 C ATOM 1614 CG GLU A 101 -13.949 -2.179 -18.589 1.00 0.00 C ATOM 1615 CD GLU A 101 -13.604 -3.224 -19.619 1.00 0.00 C ATOM 1616 OE1 GLU A 101 -12.601 -3.046 -20.359 1.00 0.00 O ATOM 1617 OE2 GLU A 101 -14.345 -4.242 -19.695 1.00 0.00 O ATOM 0 H GLU A 101 -14.751 0.736 -18.266 1.00 0.00 H new ATOM 0 HA GLU A 101 -13.506 -0.832 -16.241 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -12.692 -0.527 -19.213 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -11.909 -1.631 -18.101 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.185 -2.681 -17.650 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -14.853 -1.660 -18.909 1.00 0.00 H new ATOM 1624 N LEU A 102 -11.124 0.028 -16.177 1.00 0.00 N ATOM 1625 CA LEU A 102 -9.814 0.615 -15.983 1.00 0.00 C ATOM 1626 C LEU A 102 -8.902 -0.429 -16.586 1.00 0.00 C ATOM 1627 O LEU A 102 -8.706 -1.445 -15.943 1.00 0.00 O ATOM 1628 CB LEU A 102 -9.561 0.817 -14.461 1.00 0.00 C ATOM 1629 CG LEU A 102 -8.041 0.826 -14.113 1.00 0.00 C ATOM 1630 CD1 LEU A 102 -7.334 1.840 -15.019 1.00 0.00 C ATOM 1631 CD2 LEU A 102 -7.763 1.190 -12.634 1.00 0.00 C ATOM 0 H LEU A 102 -11.227 -0.896 -15.758 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.673 1.597 -16.435 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.011 1.757 -14.141 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.055 0.021 -13.903 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.663 -0.184 -14.273 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -6.269 1.856 -14.786 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -7.473 1.555 -16.062 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -7.756 2.831 -14.855 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.688 1.180 -12.453 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -8.157 2.184 -12.424 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -8.248 0.462 -11.983 1.00 0.00 H new ATOM 1643 N ASN A 103 -8.348 -0.248 -17.803 1.00 0.00 N ATOM 1644 CA ASN A 103 -7.483 -1.286 -18.356 1.00 0.00 C ATOM 1645 C ASN A 103 -6.073 -1.070 -17.845 1.00 0.00 C ATOM 1646 O ASN A 103 -5.742 0.031 -17.445 1.00 0.00 O ATOM 1647 CB ASN A 103 -7.614 -1.398 -19.892 1.00 0.00 C ATOM 1648 CG ASN A 103 -8.839 -2.176 -20.306 1.00 0.00 C ATOM 1649 OD1 ASN A 103 -8.698 -3.191 -20.972 1.00 0.00 O ATOM 1650 ND2 ASN A 103 -10.056 -1.719 -19.937 1.00 0.00 N ATOM 0 H ASN A 103 -8.481 0.573 -18.393 1.00 0.00 H new ATOM 0 HA ASN A 103 -7.802 -2.268 -18.007 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -7.657 -0.399 -20.325 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -6.725 -1.882 -20.296 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -10.897 -2.225 -20.215 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -10.134 -0.868 -19.381 1.00 0.00 H new ATOM 1657 N THR A 104 -5.250 -2.140 -17.826 1.00 0.00 N ATOM 1658 CA THR A 104 -3.991 -2.156 -17.080 1.00 0.00 C ATOM 1659 C THR A 104 -2.896 -2.853 -17.861 1.00 0.00 C ATOM 1660 O THR A 104 -3.252 -3.719 -18.645 1.00 0.00 O ATOM 1661 CB THR A 104 -4.287 -3.040 -15.825 1.00 0.00 C ATOM 1662 OG1 THR A 104 -4.654 -2.289 -14.665 1.00 0.00 O ATOM 1663 CG2 THR A 104 -3.082 -3.892 -15.398 1.00 0.00 C ATOM 0 H THR A 104 -5.445 -3.007 -18.326 1.00 0.00 H new ATOM 0 HA THR A 104 -3.664 -1.140 -16.857 1.00 0.00 H new ATOM 0 HB THR A 104 -5.118 -3.662 -16.157 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.269 -1.390 -14.722 1.00 0.00 H new ATOM 0 HG21 THR A 104 -3.347 -4.484 -14.522 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.799 -4.557 -16.214 1.00 0.00 H new ATOM 0 HG23 THR A 104 -2.243 -3.240 -15.155 1.00 0.00 H new ATOM 1671 N VAL A 105 -1.583 -2.590 -17.600 1.00 0.00 N ATOM 1672 CA VAL A 105 -0.580 -3.583 -18.000 1.00 0.00 C ATOM 1673 C VAL A 105 0.651 -3.470 -17.153 1.00 0.00 C ATOM 1674 O VAL A 105 0.901 -2.347 -16.770 1.00 0.00 O ATOM 1675 CB VAL A 105 -0.266 -3.455 -19.509 1.00 0.00 C ATOM 1676 CG1 VAL A 105 0.489 -2.152 -19.758 1.00 0.00 C ATOM 1677 CG2 VAL A 105 0.628 -4.575 -20.072 1.00 0.00 C ATOM 0 H VAL A 105 -1.224 -1.751 -17.144 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.987 -4.581 -17.835 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.235 -3.503 -20.006 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.712 -2.058 -20.821 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.125 -1.309 -19.440 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.420 -2.157 -19.191 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.797 -4.406 -21.135 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.584 -4.575 -19.548 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.137 -5.538 -19.931 1.00 0.00 H new ATOM 1687 N ARG A 106 1.412 -4.549 -16.842 1.00 0.00 N ATOM 1688 CA ARG A 106 2.634 -4.381 -16.065 1.00 0.00 C ATOM 1689 C ARG A 106 3.589 -5.443 -16.441 1.00 0.00 C ATOM 1690 O ARG A 106 3.208 -6.546 -16.792 1.00 0.00 O ATOM 1691 CB ARG A 106 2.677 -4.271 -14.527 1.00 0.00 C ATOM 1692 CG ARG A 106 1.941 -5.308 -13.639 1.00 0.00 C ATOM 1693 CD ARG A 106 2.882 -6.008 -12.625 1.00 0.00 C ATOM 1694 NE ARG A 106 4.005 -6.743 -13.231 1.00 0.00 N ATOM 1695 CZ ARG A 106 4.425 -7.953 -12.900 1.00 0.00 C ATOM 1696 NH1 ARG A 106 3.884 -8.729 -11.986 1.00 0.00 N ATOM 1697 NH2 ARG A 106 5.473 -8.435 -13.537 1.00 0.00 N ATOM 0 H ARG A 106 1.199 -5.509 -17.113 1.00 0.00 H new ATOM 0 HA ARG A 106 2.855 -3.352 -16.348 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.727 -4.285 -14.234 1.00 0.00 H new ATOM 0 HB3 ARG A 106 2.285 -3.288 -14.264 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.137 -4.810 -13.097 1.00 0.00 H new ATOM 0 HG3 ARG A 106 1.477 -6.061 -14.276 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.283 -5.257 -11.944 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.294 -6.702 -12.024 1.00 0.00 H new ATOM 0 HE ARG A 106 4.510 -6.272 -13.982 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.068 -8.409 -11.463 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.280 -9.650 -11.800 1.00 0.00 H new ATOM 0 HH21 ARG A 106 5.932 -7.879 -14.258 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.825 -9.365 -13.309 1.00 0.00 H new ATOM 1711 N GLU A 107 4.863 -5.044 -16.481 1.00 0.00 N ATOM 1712 CA GLU A 107 5.632 -5.687 -17.523 1.00 0.00 C ATOM 1713 C GLU A 107 7.001 -5.185 -17.263 1.00 0.00 C ATOM 1714 O GLU A 107 7.367 -4.091 -17.666 1.00 0.00 O ATOM 1715 CB GLU A 107 4.945 -5.226 -18.829 1.00 0.00 C ATOM 1716 CG GLU A 107 5.898 -5.192 -20.055 1.00 0.00 C ATOM 1717 CD GLU A 107 5.167 -4.906 -21.339 1.00 0.00 C ATOM 1718 OE1 GLU A 107 4.109 -4.220 -21.293 1.00 0.00 O ATOM 1719 OE2 GLU A 107 5.652 -5.365 -22.409 1.00 0.00 O ATOM 0 H GLU A 107 5.331 -4.364 -15.882 1.00 0.00 H new ATOM 0 HA GLU A 107 5.684 -6.775 -17.575 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.111 -5.894 -19.046 1.00 0.00 H new ATOM 0 HB3 GLU A 107 4.526 -4.231 -18.678 1.00 0.00 H new ATOM 0 HG2 GLU A 107 6.662 -4.431 -19.897 1.00 0.00 H new ATOM 0 HG3 GLU A 107 6.413 -6.149 -20.138 1.00 0.00 H new ATOM 1726 N ILE A 108 7.729 -6.013 -16.494 1.00 0.00 N ATOM 1727 CA ILE A 108 9.064 -5.604 -16.161 1.00 0.00 C ATOM 1728 C ILE A 108 9.706 -5.126 -17.441 1.00 0.00 C ATOM 1729 O ILE A 108 9.595 -5.833 -18.431 1.00 0.00 O ATOM 1730 CB ILE A 108 9.948 -6.723 -15.543 1.00 0.00 C ATOM 1731 CG1 ILE A 108 11.330 -6.207 -15.057 1.00 0.00 C ATOM 1732 CG2 ILE A 108 10.237 -7.847 -16.568 1.00 0.00 C ATOM 1733 CD1 ILE A 108 11.182 -5.146 -13.955 1.00 0.00 C ATOM 0 H ILE A 108 7.423 -6.912 -16.121 1.00 0.00 H new ATOM 0 HA ILE A 108 8.992 -4.832 -15.395 1.00 0.00 H new ATOM 0 HB ILE A 108 9.372 -7.093 -14.695 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.920 -7.043 -14.681 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.878 -5.784 -15.899 1.00 0.00 H new ATOM 0 HG21 ILE A 108 10.857 -8.613 -16.103 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.297 -8.291 -16.896 1.00 0.00 H new ATOM 0 HG23 ILE A 108 10.760 -7.429 -17.428 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.169 -4.808 -13.640 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.614 -4.299 -14.340 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.657 -5.577 -13.103 1.00 0.00 H new ATOM 1745 N ILE A 109 10.357 -3.947 -17.446 1.00 0.00 N ATOM 1746 CA ILE A 109 11.205 -3.569 -18.571 1.00 0.00 C ATOM 1747 C ILE A 109 12.622 -3.586 -18.035 1.00 0.00 C ATOM 1748 O ILE A 109 13.007 -2.664 -17.337 1.00 0.00 O ATOM 1749 CB ILE A 109 10.822 -2.262 -19.336 1.00 0.00 C ATOM 1750 CG1 ILE A 109 11.903 -2.045 -20.435 1.00 0.00 C ATOM 1751 CG2 ILE A 109 10.663 -1.002 -18.439 1.00 0.00 C ATOM 1752 CD1 ILE A 109 11.631 -0.856 -21.389 1.00 0.00 C ATOM 0 H ILE A 109 10.308 -3.258 -16.695 1.00 0.00 H new ATOM 0 HA ILE A 109 11.067 -4.288 -19.378 1.00 0.00 H new ATOM 0 HB ILE A 109 9.829 -2.396 -19.764 1.00 0.00 H new ATOM 0 HG12 ILE A 109 12.867 -1.890 -19.951 1.00 0.00 H new ATOM 0 HG13 ILE A 109 11.986 -2.956 -21.028 1.00 0.00 H new ATOM 0 HG21 ILE A 109 10.397 -0.146 -19.059 1.00 0.00 H new ATOM 0 HG22 ILE A 109 9.878 -1.176 -17.703 1.00 0.00 H new ATOM 0 HG23 ILE A 109 11.603 -0.800 -17.925 1.00 0.00 H new ATOM 0 HD11 ILE A 109 12.437 -0.784 -22.119 1.00 0.00 H new ATOM 0 HD12 ILE A 109 10.685 -1.014 -21.907 1.00 0.00 H new ATOM 0 HD13 ILE A 109 11.580 0.068 -20.813 1.00 0.00 H new ATOM 1764 N GLY A 110 13.427 -4.629 -18.347 1.00 0.00 N ATOM 1765 CA GLY A 110 14.805 -4.653 -17.873 1.00 0.00 C ATOM 1766 C GLY A 110 14.866 -4.769 -16.365 1.00 0.00 C ATOM 1767 O GLY A 110 14.549 -5.826 -15.843 1.00 0.00 O ATOM 0 H GLY A 110 13.146 -5.434 -18.907 1.00 0.00 H new ATOM 0 HA2 GLY A 110 15.333 -5.492 -18.326 1.00 0.00 H new ATOM 0 HA3 GLY A 110 15.317 -3.745 -18.191 1.00 0.00 H new ATOM 1771 N ASP A 111 15.263 -3.682 -15.664 1.00 0.00 N ATOM 1772 CA ASP A 111 15.272 -3.644 -14.199 1.00 0.00 C ATOM 1773 C ASP A 111 14.482 -2.435 -13.759 1.00 0.00 C ATOM 1774 O ASP A 111 14.838 -1.761 -12.805 1.00 0.00 O ATOM 1775 CB ASP A 111 16.732 -3.597 -13.690 1.00 0.00 C ATOM 1776 CG ASP A 111 17.466 -4.819 -14.177 1.00 0.00 C ATOM 1777 OD1 ASP A 111 18.055 -4.758 -15.290 1.00 0.00 O ATOM 1778 OD2 ASP A 111 17.456 -5.850 -13.451 1.00 0.00 O ATOM 0 H ASP A 111 15.582 -2.818 -16.102 1.00 0.00 H new ATOM 0 HA ASP A 111 14.812 -4.538 -13.778 1.00 0.00 H new ATOM 0 HB2 ASP A 111 17.226 -2.694 -14.049 1.00 0.00 H new ATOM 0 HB3 ASP A 111 16.749 -3.558 -12.601 1.00 0.00 H new ATOM 1783 N GLU A 112 13.384 -2.175 -14.495 1.00 0.00 N ATOM 1784 CA GLU A 112 12.509 -1.051 -14.211 1.00 0.00 C ATOM 1785 C GLU A 112 11.155 -1.543 -14.599 1.00 0.00 C ATOM 1786 O GLU A 112 11.074 -2.133 -15.661 1.00 0.00 O ATOM 1787 CB GLU A 112 12.895 0.124 -15.117 1.00 0.00 C ATOM 1788 CG GLU A 112 11.821 1.227 -15.130 1.00 0.00 C ATOM 1789 CD GLU A 112 12.236 2.338 -16.058 1.00 0.00 C ATOM 1790 OE1 GLU A 112 12.127 2.143 -17.298 1.00 0.00 O ATOM 1791 OE2 GLU A 112 12.666 3.413 -15.562 1.00 0.00 O ATOM 0 H GLU A 112 13.092 -2.740 -15.293 1.00 0.00 H new ATOM 0 HA GLU A 112 12.562 -0.717 -13.175 1.00 0.00 H new ATOM 0 HB2 GLU A 112 13.842 0.545 -14.779 1.00 0.00 H new ATOM 0 HB3 GLU A 112 13.052 -0.239 -16.133 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.865 0.812 -15.451 1.00 0.00 H new ATOM 0 HG3 GLU A 112 11.677 1.618 -14.123 1.00 0.00 H new ATOM 1798 N LEU A 113 10.110 -1.341 -13.786 1.00 0.00 N ATOM 1799 CA LEU A 113 8.835 -1.960 -14.080 1.00 0.00 C ATOM 1800 C LEU A 113 8.121 -0.919 -14.878 1.00 0.00 C ATOM 1801 O LEU A 113 8.101 0.221 -14.444 1.00 0.00 O ATOM 1802 CB LEU A 113 8.169 -2.479 -12.780 1.00 0.00 C ATOM 1803 CG LEU A 113 6.676 -2.895 -12.895 1.00 0.00 C ATOM 1804 CD1 LEU A 113 6.250 -3.814 -11.718 1.00 0.00 C ATOM 1805 CD2 LEU A 113 5.781 -1.645 -12.744 1.00 0.00 C ATOM 0 H LEU A 113 10.130 -0.767 -12.943 1.00 0.00 H new ATOM 0 HA LEU A 113 8.866 -2.877 -14.669 1.00 0.00 H new ATOM 0 HB2 LEU A 113 8.738 -3.337 -12.422 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.251 -1.703 -12.019 1.00 0.00 H new ATOM 0 HG LEU A 113 6.565 -3.397 -13.856 1.00 0.00 H new ATOM 0 HD11 LEU A 113 5.200 -4.086 -11.830 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.861 -4.717 -11.722 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.389 -3.285 -10.775 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.734 -1.936 -12.825 1.00 0.00 H new ATOM 0 HD22 LEU A 113 5.957 -1.187 -11.771 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.020 -0.929 -13.530 1.00 0.00 H new ATOM 1817 N VAL A 114 7.547 -1.267 -16.047 1.00 0.00 N ATOM 1818 CA VAL A 114 6.677 -0.299 -16.695 1.00 0.00 C ATOM 1819 C VAL A 114 5.272 -0.671 -16.301 1.00 0.00 C ATOM 1820 O VAL A 114 5.044 -1.833 -15.983 1.00 0.00 O ATOM 1821 CB VAL A 114 6.838 -0.381 -18.239 1.00 0.00 C ATOM 1822 CG1 VAL A 114 5.796 -1.327 -18.864 1.00 0.00 C ATOM 1823 CG2 VAL A 114 6.872 1.013 -18.917 1.00 0.00 C ATOM 0 H VAL A 114 7.666 -2.158 -16.529 1.00 0.00 H new ATOM 0 HA VAL A 114 6.921 0.720 -16.393 1.00 0.00 H new ATOM 0 HB VAL A 114 7.818 -0.817 -18.433 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.937 -1.361 -19.944 1.00 0.00 H new ATOM 0 HG12 VAL A 114 5.919 -2.328 -18.450 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.793 -0.963 -18.640 1.00 0.00 H new ATOM 0 HG21 VAL A 114 6.986 0.891 -19.994 1.00 0.00 H new ATOM 0 HG22 VAL A 114 5.942 1.542 -18.708 1.00 0.00 H new ATOM 0 HG23 VAL A 114 7.712 1.587 -18.526 1.00 0.00 H new ATOM 1833 N GLN A 115 4.329 0.291 -16.403 1.00 0.00 N ATOM 1834 CA GLN A 115 2.930 -0.094 -16.517 1.00 0.00 C ATOM 1835 C GLN A 115 2.146 0.980 -17.212 1.00 0.00 C ATOM 1836 O GLN A 115 2.612 2.105 -17.272 1.00 0.00 O ATOM 1837 CB GLN A 115 2.291 -0.549 -15.190 1.00 0.00 C ATOM 1838 CG GLN A 115 2.459 0.433 -14.033 1.00 0.00 C ATOM 1839 CD GLN A 115 1.763 0.015 -12.763 1.00 0.00 C ATOM 1840 OE1 GLN A 115 1.080 0.819 -12.153 1.00 0.00 O ATOM 1841 NE2 GLN A 115 1.950 -1.251 -12.351 1.00 0.00 N ATOM 0 H GLN A 115 4.511 1.295 -16.408 1.00 0.00 H new ATOM 0 HA GLN A 115 2.898 -0.989 -17.139 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.227 -0.718 -15.354 1.00 0.00 H new ATOM 0 HB3 GLN A 115 2.725 -1.506 -14.902 1.00 0.00 H new ATOM 0 HG2 GLN A 115 3.522 0.557 -13.828 1.00 0.00 H new ATOM 0 HG3 GLN A 115 2.078 1.407 -14.339 1.00 0.00 H new ATOM 0 HE21 GLN A 115 2.532 -1.885 -12.899 1.00 0.00 H new ATOM 0 HE22 GLN A 115 1.510 -1.578 -11.491 1.00 0.00 H new ATOM 1850 N THR A 116 0.969 0.607 -17.753 1.00 0.00 N ATOM 1851 CA THR A 116 0.211 1.493 -18.624 1.00 0.00 C ATOM 1852 C THR A 116 -1.214 1.347 -18.147 1.00 0.00 C ATOM 1853 O THR A 116 -1.726 0.244 -18.283 1.00 0.00 O ATOM 1854 CB THR A 116 0.519 1.322 -20.148 1.00 0.00 C ATOM 1855 OG1 THR A 116 -0.375 0.416 -20.816 1.00 0.00 O ATOM 1856 CG2 THR A 116 1.995 0.855 -20.351 1.00 0.00 C ATOM 0 H THR A 116 0.533 -0.302 -17.596 1.00 0.00 H new ATOM 0 HA THR A 116 0.502 2.541 -18.547 1.00 0.00 H new ATOM 0 HB THR A 116 0.368 2.302 -20.601 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.131 0.354 -21.763 1.00 0.00 H new ATOM 0 HG21 THR A 116 2.197 0.740 -21.416 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.673 1.599 -19.932 1.00 0.00 H new ATOM 0 HG23 THR A 116 2.147 -0.100 -19.847 1.00 0.00 H new ATOM 1864 N TYR A 117 -1.842 2.398 -17.558 1.00 0.00 N ATOM 1865 CA TYR A 117 -3.221 2.258 -17.089 1.00 0.00 C ATOM 1866 C TYR A 117 -4.067 2.967 -18.123 1.00 0.00 C ATOM 1867 O TYR A 117 -3.552 3.849 -18.786 1.00 0.00 O ATOM 1868 CB TYR A 117 -3.520 2.754 -15.642 1.00 0.00 C ATOM 1869 CG TYR A 117 -3.220 1.754 -14.496 1.00 0.00 C ATOM 1870 CD1 TYR A 117 -4.105 0.700 -14.245 1.00 0.00 C ATOM 1871 CD2 TYR A 117 -2.104 1.902 -13.667 1.00 0.00 C ATOM 1872 CE1 TYR A 117 -4.076 0.028 -13.020 1.00 0.00 C ATOM 1873 CE2 TYR A 117 -2.044 1.193 -12.464 1.00 0.00 C ATOM 1874 CZ TYR A 117 -3.034 0.270 -12.119 1.00 0.00 C ATOM 1875 OH TYR A 117 -2.963 -0.389 -10.887 1.00 0.00 O ATOM 0 H TYR A 117 -1.423 3.315 -17.406 1.00 0.00 H new ATOM 0 HA TYR A 117 -3.451 1.196 -16.998 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -2.941 3.661 -15.465 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -4.573 3.032 -15.586 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -4.815 0.404 -15.003 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -1.296 2.558 -13.954 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -4.856 -0.676 -12.770 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -1.218 1.362 -11.789 1.00 0.00 H new ATOM 0 HH TYR A 117 -2.167 -0.089 -10.401 1.00 0.00 H new ATOM 1885 N VAL A 118 -5.352 2.584 -18.289 1.00 0.00 N ATOM 1886 CA VAL A 118 -6.203 3.134 -19.347 1.00 0.00 C ATOM 1887 C VAL A 118 -7.599 3.283 -18.777 1.00 0.00 C ATOM 1888 O VAL A 118 -7.941 2.446 -17.963 1.00 0.00 O ATOM 1889 CB VAL A 118 -6.180 2.131 -20.541 1.00 0.00 C ATOM 1890 CG1 VAL A 118 -7.431 2.255 -21.460 1.00 0.00 C ATOM 1891 CG2 VAL A 118 -4.882 2.213 -21.392 1.00 0.00 C ATOM 0 H VAL A 118 -5.816 1.894 -17.698 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.859 4.107 -19.699 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.202 1.148 -20.070 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.359 1.532 -22.273 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.331 2.057 -20.878 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.480 3.262 -21.874 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -4.933 1.489 -22.205 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -4.781 3.216 -21.806 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -4.020 1.992 -20.763 1.00 0.00 H new ATOM 1901 N TYR A 119 -8.418 4.295 -19.160 1.00 0.00 N ATOM 1902 CA TYR A 119 -9.752 4.461 -18.552 1.00 0.00 C ATOM 1903 C TYR A 119 -10.805 4.940 -19.512 1.00 0.00 C ATOM 1904 O TYR A 119 -10.604 5.995 -20.092 1.00 0.00 O ATOM 1905 CB TYR A 119 -9.692 5.520 -17.434 1.00 0.00 C ATOM 1906 CG TYR A 119 -11.040 6.092 -16.974 1.00 0.00 C ATOM 1907 CD1 TYR A 119 -11.793 5.464 -15.977 1.00 0.00 C ATOM 1908 CD2 TYR A 119 -11.510 7.287 -17.533 1.00 0.00 C ATOM 1909 CE1 TYR A 119 -12.914 6.111 -15.446 1.00 0.00 C ATOM 1910 CE2 TYR A 119 -12.691 7.875 -17.075 1.00 0.00 C ATOM 1911 CZ TYR A 119 -13.380 7.306 -15.998 1.00 0.00 C ATOM 1912 OH TYR A 119 -14.523 7.907 -15.461 1.00 0.00 O ATOM 0 H TYR A 119 -8.182 4.989 -19.869 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.022 3.469 -18.191 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -9.193 5.080 -16.571 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.068 6.345 -17.776 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.511 4.485 -15.619 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -10.952 7.760 -18.328 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.426 5.681 -14.598 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.072 8.767 -17.551 1.00 0.00 H new ATOM 0 HH TYR A 119 -15.308 7.644 -15.986 1.00 0.00 H new ATOM 1922 N GLU A 120 -11.910 4.176 -19.695 1.00 0.00 N ATOM 1923 CA GLU A 120 -12.920 4.510 -20.699 1.00 0.00 C ATOM 1924 C GLU A 120 -12.382 5.065 -21.982 1.00 0.00 C ATOM 1925 O GLU A 120 -13.128 5.714 -22.701 1.00 0.00 O ATOM 1926 CB GLU A 120 -13.928 5.539 -20.122 1.00 0.00 C ATOM 1927 CG GLU A 120 -14.509 4.998 -18.804 1.00 0.00 C ATOM 1928 CD GLU A 120 -15.820 5.656 -18.458 1.00 0.00 C ATOM 1929 OE1 GLU A 120 -16.851 5.295 -19.088 1.00 0.00 O ATOM 1930 OE2 GLU A 120 -15.832 6.540 -17.560 1.00 0.00 O ATOM 0 H GLU A 120 -12.113 3.332 -19.159 1.00 0.00 H new ATOM 0 HA GLU A 120 -13.393 3.557 -20.938 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -13.432 6.494 -19.949 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -14.729 5.721 -20.838 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -14.654 3.921 -18.886 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -13.795 5.164 -17.997 1.00 0.00 H new ATOM 1937 N GLY A 121 -11.081 4.872 -22.274 1.00 0.00 N ATOM 1938 CA GLY A 121 -10.485 5.784 -23.230 1.00 0.00 C ATOM 1939 C GLY A 121 -9.057 6.203 -23.024 1.00 0.00 C ATOM 1940 O GLY A 121 -8.194 5.842 -23.809 1.00 0.00 O ATOM 0 H GLY A 121 -10.474 4.148 -21.889 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -10.557 5.325 -24.216 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -11.096 6.687 -23.253 1.00 0.00 H new ATOM 1944 N VAL A 122 -8.832 7.036 -21.981 1.00 0.00 N ATOM 1945 CA VAL A 122 -7.601 7.817 -21.927 1.00 0.00 C ATOM 1946 C VAL A 122 -6.478 6.837 -21.735 1.00 0.00 C ATOM 1947 O VAL A 122 -6.755 5.763 -21.226 1.00 0.00 O ATOM 1948 CB VAL A 122 -7.697 8.903 -20.811 1.00 0.00 C ATOM 1949 CG1 VAL A 122 -7.300 8.302 -19.439 1.00 0.00 C ATOM 1950 CG2 VAL A 122 -6.860 10.169 -21.115 1.00 0.00 C ATOM 0 H VAL A 122 -9.470 7.174 -21.197 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.421 8.377 -22.845 1.00 0.00 H new ATOM 0 HB VAL A 122 -8.738 9.225 -20.779 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -7.372 9.071 -18.670 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -7.972 7.480 -19.194 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.276 7.931 -19.487 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -6.971 10.883 -20.299 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -5.810 9.895 -21.217 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -7.208 10.621 -22.043 1.00 0.00 H new ATOM 1960 N GLU A 123 -5.234 7.180 -22.134 1.00 0.00 N ATOM 1961 CA GLU A 123 -4.111 6.272 -21.923 1.00 0.00 C ATOM 1962 C GLU A 123 -3.201 6.933 -20.929 1.00 0.00 C ATOM 1963 O GLU A 123 -2.742 8.029 -21.212 1.00 0.00 O ATOM 1964 CB GLU A 123 -3.376 5.895 -23.236 1.00 0.00 C ATOM 1965 CG GLU A 123 -2.045 5.138 -22.977 1.00 0.00 C ATOM 1966 CD GLU A 123 -0.938 6.064 -22.540 1.00 0.00 C ATOM 1967 OE1 GLU A 123 -0.712 7.083 -23.244 1.00 0.00 O ATOM 1968 OE2 GLU A 123 -0.282 5.785 -21.501 1.00 0.00 O ATOM 0 H GLU A 123 -4.996 8.060 -22.592 1.00 0.00 H new ATOM 0 HA GLU A 123 -4.473 5.318 -21.540 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -4.030 5.274 -23.849 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -3.170 6.801 -23.806 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -2.204 4.378 -22.212 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.743 4.617 -23.885 1.00 0.00 H new ATOM 1975 N ALA A 124 -2.941 6.277 -19.773 1.00 0.00 N ATOM 1976 CA ALA A 124 -2.023 6.826 -18.793 1.00 0.00 C ATOM 1977 C ALA A 124 -0.904 5.831 -18.662 1.00 0.00 C ATOM 1978 O ALA A 124 -1.036 4.716 -19.142 1.00 0.00 O ATOM 1979 CB ALA A 124 -2.770 6.966 -17.449 1.00 0.00 C ATOM 0 H ALA A 124 -3.356 5.382 -19.515 1.00 0.00 H new ATOM 0 HA ALA A 124 -1.640 7.804 -19.084 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -2.095 7.378 -16.699 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -3.623 7.633 -17.575 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.120 5.986 -17.124 1.00 0.00 H new ATOM 1985 N LYS A 125 0.204 6.207 -18.002 1.00 0.00 N ATOM 1986 CA LYS A 125 1.251 5.220 -17.793 1.00 0.00 C ATOM 1987 C LYS A 125 2.145 5.636 -16.712 1.00 0.00 C ATOM 1988 O LYS A 125 2.242 6.839 -16.567 1.00 0.00 O ATOM 1989 CB LYS A 125 2.172 5.039 -19.021 1.00 0.00 C ATOM 1990 CG LYS A 125 3.702 4.808 -18.796 1.00 0.00 C ATOM 1991 CD LYS A 125 4.499 5.206 -20.075 1.00 0.00 C ATOM 1992 CE LYS A 125 4.803 6.730 -19.984 1.00 0.00 C ATOM 1993 NZ LYS A 125 5.609 7.280 -21.091 1.00 0.00 N ATOM 0 H LYS A 125 0.385 7.138 -17.626 1.00 0.00 H new ATOM 0 HA LYS A 125 0.718 4.294 -17.575 1.00 0.00 H new ATOM 0 HB2 LYS A 125 1.793 4.193 -19.594 1.00 0.00 H new ATOM 0 HB3 LYS A 125 2.062 5.924 -19.648 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.045 5.398 -17.946 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.888 3.762 -18.554 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.424 4.634 -20.143 1.00 0.00 H new ATOM 0 HD3 LYS A 125 3.920 4.984 -20.972 1.00 0.00 H new ATOM 0 HE2 LYS A 125 3.857 7.270 -19.942 1.00 0.00 H new ATOM 0 HE3 LYS A 125 5.323 6.924 -19.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.757 8.298 -20.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.530 6.797 -21.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.109 7.133 -21.991 1.00 0.00 H new ATOM 2007 N ARG A 126 2.791 4.672 -16.016 1.00 0.00 N ATOM 2008 CA ARG A 126 3.545 5.064 -14.852 1.00 0.00 C ATOM 2009 C ARG A 126 4.783 4.196 -14.820 1.00 0.00 C ATOM 2010 O ARG A 126 4.667 3.018 -15.120 1.00 0.00 O ATOM 2011 CB ARG A 126 2.390 4.975 -13.820 1.00 0.00 C ATOM 2012 CG ARG A 126 2.618 5.552 -12.407 1.00 0.00 C ATOM 2013 CD ARG A 126 2.369 7.049 -12.091 1.00 0.00 C ATOM 2014 NE ARG A 126 3.492 7.889 -12.455 1.00 0.00 N ATOM 2015 CZ ARG A 126 3.648 9.090 -11.927 1.00 0.00 C ATOM 2016 NH1 ARG A 126 2.691 9.709 -11.273 1.00 0.00 N ATOM 2017 NH2 ARG A 126 4.793 9.708 -12.049 1.00 0.00 N ATOM 0 H ARG A 126 2.796 3.677 -16.240 1.00 0.00 H new ATOM 0 HA ARG A 126 4.027 6.033 -14.722 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.524 5.479 -14.248 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.124 3.924 -13.710 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.992 4.976 -11.725 1.00 0.00 H new ATOM 0 HG3 ARG A 126 3.654 5.341 -12.143 1.00 0.00 H new ATOM 0 HD2 ARG A 126 1.480 7.386 -12.624 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.165 7.163 -11.026 1.00 0.00 H new ATOM 0 HE ARG A 126 4.175 7.547 -13.131 1.00 0.00 H new ATOM 0 HH11 ARG A 126 1.782 9.262 -11.156 1.00 0.00 H new ATOM 0 HH12 ARG A 126 2.858 10.636 -10.882 1.00 0.00 H new ATOM 0 HH21 ARG A 126 5.562 9.263 -12.550 1.00 0.00 H new ATOM 0 HH22 ARG A 126 4.918 10.635 -11.643 1.00 0.00 H new ATOM 2031 N ILE A 127 5.967 4.796 -14.529 1.00 0.00 N ATOM 2032 CA ILE A 127 7.250 4.108 -14.696 1.00 0.00 C ATOM 2033 C ILE A 127 7.763 3.949 -13.299 1.00 0.00 C ATOM 2034 O ILE A 127 7.523 4.853 -12.513 1.00 0.00 O ATOM 2035 CB ILE A 127 8.369 4.856 -15.485 1.00 0.00 C ATOM 2036 CG1 ILE A 127 7.822 5.625 -16.716 1.00 0.00 C ATOM 2037 CG2 ILE A 127 9.560 3.916 -15.835 1.00 0.00 C ATOM 2038 CD1 ILE A 127 7.144 4.712 -17.750 1.00 0.00 C ATOM 0 H ILE A 127 6.047 5.751 -14.180 1.00 0.00 H new ATOM 0 HA ILE A 127 7.053 3.206 -15.276 1.00 0.00 H new ATOM 0 HB ILE A 127 8.766 5.621 -14.817 1.00 0.00 H new ATOM 0 HG12 ILE A 127 7.106 6.375 -16.379 1.00 0.00 H new ATOM 0 HG13 ILE A 127 8.642 6.160 -17.196 1.00 0.00 H new ATOM 0 HG21 ILE A 127 10.317 4.476 -16.384 1.00 0.00 H new ATOM 0 HG22 ILE A 127 9.995 3.523 -14.916 1.00 0.00 H new ATOM 0 HG23 ILE A 127 9.203 3.090 -16.450 1.00 0.00 H new ATOM 0 HD11 ILE A 127 6.784 5.313 -18.585 1.00 0.00 H new ATOM 0 HD12 ILE A 127 7.863 3.978 -18.114 1.00 0.00 H new ATOM 0 HD13 ILE A 127 6.304 4.197 -17.285 1.00 0.00 H new ATOM 2050 N PHE A 128 8.442 2.823 -13.008 1.00 0.00 N ATOM 2051 CA PHE A 128 8.718 2.474 -11.625 1.00 0.00 C ATOM 2052 C PHE A 128 10.107 1.930 -11.460 1.00 0.00 C ATOM 2053 O PHE A 128 10.454 1.112 -12.292 1.00 0.00 O ATOM 2054 CB PHE A 128 7.794 1.277 -11.346 1.00 0.00 C ATOM 2055 CG PHE A 128 6.382 1.685 -11.007 1.00 0.00 C ATOM 2056 CD1 PHE A 128 5.506 1.967 -12.057 1.00 0.00 C ATOM 2057 CD2 PHE A 128 5.935 1.757 -9.683 1.00 0.00 C ATOM 2058 CE1 PHE A 128 4.180 2.302 -11.785 1.00 0.00 C ATOM 2059 CE2 PHE A 128 4.585 2.001 -9.428 1.00 0.00 C ATOM 2060 CZ PHE A 128 3.710 2.293 -10.473 1.00 0.00 C ATOM 0 H PHE A 128 8.796 2.163 -13.700 1.00 0.00 H new ATOM 0 HA PHE A 128 8.588 3.347 -10.985 1.00 0.00 H new ATOM 0 HB2 PHE A 128 7.778 0.627 -12.221 1.00 0.00 H new ATOM 0 HB3 PHE A 128 8.205 0.693 -10.522 1.00 0.00 H new ATOM 0 HD1 PHE A 128 5.855 1.926 -13.078 1.00 0.00 H new ATOM 0 HD2 PHE A 128 6.629 1.625 -8.866 1.00 0.00 H new ATOM 0 HE1 PHE A 128 3.515 2.569 -12.593 1.00 0.00 H new ATOM 0 HE2 PHE A 128 4.215 1.963 -8.414 1.00 0.00 H new ATOM 0 HZ PHE A 128 2.673 2.511 -10.267 1.00 0.00 H new ATOM 2070 N LYS A 129 10.863 2.304 -10.402 1.00 0.00 N ATOM 2071 CA LYS A 129 12.197 1.731 -10.209 1.00 0.00 C ATOM 2072 C LYS A 129 12.200 1.098 -8.840 1.00 0.00 C ATOM 2073 O LYS A 129 11.411 1.485 -7.995 1.00 0.00 O ATOM 2074 CB LYS A 129 13.457 2.643 -10.128 1.00 0.00 C ATOM 2075 CG LYS A 129 13.621 3.723 -11.234 1.00 0.00 C ATOM 2076 CD LYS A 129 14.302 3.147 -12.512 1.00 0.00 C ATOM 2077 CE LYS A 129 14.737 4.231 -13.538 1.00 0.00 C ATOM 2078 NZ LYS A 129 15.924 5.011 -13.109 1.00 0.00 N ATOM 0 H LYS A 129 10.576 2.980 -9.694 1.00 0.00 H new ATOM 0 HA LYS A 129 12.306 1.126 -11.109 1.00 0.00 H new ATOM 0 HB2 LYS A 129 13.448 3.147 -9.162 1.00 0.00 H new ATOM 0 HB3 LYS A 129 14.339 2.003 -10.146 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.643 4.127 -11.495 1.00 0.00 H new ATOM 0 HG3 LYS A 129 14.215 4.551 -10.848 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.177 2.569 -12.216 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.613 2.456 -12.998 1.00 0.00 H new ATOM 0 HE2 LYS A 129 14.954 3.750 -14.492 1.00 0.00 H new ATOM 0 HE3 LYS A 129 13.905 4.914 -13.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.159 5.715 -13.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.715 5.497 -12.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 16.731 4.369 -12.974 1.00 0.00 H new ATOM 2092 N LYS A 130 13.137 0.161 -8.622 1.00 0.00 N ATOM 2093 CA LYS A 130 13.386 -0.370 -7.292 1.00 0.00 C ATOM 2094 C LYS A 130 13.431 0.694 -6.224 1.00 0.00 C ATOM 2095 O LYS A 130 13.610 1.863 -6.524 1.00 0.00 O ATOM 2096 CB LYS A 130 14.664 -1.239 -7.245 1.00 0.00 C ATOM 2097 CG LYS A 130 16.027 -0.493 -7.292 1.00 0.00 C ATOM 2098 CD LYS A 130 16.177 0.404 -8.553 1.00 0.00 C ATOM 2099 CE LYS A 130 17.636 0.877 -8.811 1.00 0.00 C ATOM 2100 NZ LYS A 130 18.509 -0.190 -9.364 1.00 0.00 N ATOM 0 H LYS A 130 13.727 -0.237 -9.353 1.00 0.00 H new ATOM 0 HA LYS A 130 12.529 -1.006 -7.071 1.00 0.00 H new ATOM 0 HB2 LYS A 130 14.635 -1.835 -6.333 1.00 0.00 H new ATOM 0 HB3 LYS A 130 14.630 -1.936 -8.082 1.00 0.00 H new ATOM 0 HG2 LYS A 130 16.130 0.123 -6.399 1.00 0.00 H new ATOM 0 HG3 LYS A 130 16.837 -1.222 -7.272 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.823 -0.147 -9.424 1.00 0.00 H new ATOM 0 HD3 LYS A 130 15.534 1.278 -8.446 1.00 0.00 H new ATOM 0 HE2 LYS A 130 17.621 1.719 -9.502 1.00 0.00 H new ATOM 0 HE3 LYS A 130 18.064 1.239 -7.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 19.466 0.188 -9.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 18.551 -0.985 -8.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 18.122 -0.520 -10.271 1.00 0.00 H new ATOM 2114 N ASP A 131 13.252 0.255 -4.960 1.00 0.00 N ATOM 2115 CA ASP A 131 13.093 1.178 -3.841 1.00 0.00 C ATOM 2116 C ASP A 131 14.101 0.855 -2.770 1.00 0.00 C ATOM 2117 O ASP A 131 14.929 -0.039 -2.934 1.00 0.00 O ATOM 2118 CB ASP A 131 11.656 0.964 -3.313 1.00 0.00 C ATOM 2119 CG ASP A 131 11.393 1.750 -2.055 1.00 0.00 C ATOM 2120 OD1 ASP A 131 11.272 3.001 -2.154 1.00 0.00 O ATOM 2121 OD2 ASP A 131 11.298 1.127 -0.963 1.00 0.00 O ATOM 2122 OXT ASP A 131 14.096 1.572 -1.590 1.00 0.00 O ATOM 0 H ASP A 131 13.216 -0.731 -4.700 1.00 0.00 H new ATOM 0 HA ASP A 131 13.252 2.214 -4.142 1.00 0.00 H new ATOM 0 HB2 ASP A 131 10.940 1.259 -4.081 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.496 -0.096 -3.118 1.00 0.00 H new