USER MOD reduce.3.24.130724 H: found=0, std=0, add=1058, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 891 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 116 THR OG1 : rot 164:sc= -1.41! USER MOD Set 1.2: A 125 LYS NZ :NH3+ 170:sc= -1.39 (180deg=-2.43!) USER MOD Set 2.1: A 115 GLN : amide:sc= -1.53! K(o=-6.1!,f=-7.7) USER MOD Set 2.2: A 117 TYR OH : rot -74:sc= 0.847 USER MOD Set 2.3: A 129 LYS NZ :NH3+ 141:sc= -5.37! (180deg=-10.4!) USER MOD Set 3.1: A 98 ASN : amide:sc= -1.87! C(o=-0.65!,f=-16!) USER MOD Set 3.2: A 100 LYS NZ :NH3+ -164:sc= 1.22 (180deg=0.0661) USER MOD Set 4.1: A 84 MET CE :methyl 154:sc= -7.75! (180deg=-8.85!) USER MOD Set 4.2: A 88 LYS NZ :NH3+ 146:sc= -2.51! (180deg=-3.45!) USER MOD Set 5.1: A 42 GLN : amide:sc= 0.767 K(o=3.1,f=-5.9!) USER MOD Set 5.2: A 46 LYS NZ :NH3+ -152:sc= 2.38 (180deg=-0.485) USER MOD Set 6.1: A 5 THR OG1 : rot 21:sc= 2.3 USER MOD Set 6.2: A 39 THR OG1 : rot -17:sc= 0.584 USER MOD Set 7.1: A 11 ASN : amide:sc= -14! C(o=-22!,f=-23!) USER MOD Set 7.2: A 13 ASN :FLIP amide:sc= -5.49! C(o=-27!,f=-22!) USER MOD Set 7.3: A 16 LYS NZ :NH3+ -175:sc= -2.79! (180deg=-2.98!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 168:sc= 1.1 (180deg=0.9) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -136:sc= -1.86! (180deg=-4.34!) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -1.25! C(o=-1.2!,f=-10!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -109:sc= -2.34! (180deg=-4.9!) USER MOD Single : A 33 HIS : no HD1:sc= -0.116 X(o=-0.12,f=-0.36) USER MOD Single : A 35 ASN : amide:sc= -0.336 X(o=-0.34,f=-0.34) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc=-0.00251 USER MOD Single : A 45 ASN :FLIP amide:sc= -3.76! C(o=-5.9!,f=-3.8!) USER MOD Single : A 48 THR OG1 : rot -108:sc= -2.89! USER MOD Single : A 50 LYS NZ :NH3+ -109:sc= 0.579 (180deg=-2.37!) USER MOD Single : A 52 SER OG : rot 170:sc= -1.16 USER MOD Single : A 53 SER OG : rot 12:sc= 1.22 USER MOD Single : A 54 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 57 ASN :FLIP amide:sc= 1.08 F(o=-0.066,f=1.1) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 139:sc= -0.459 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot -60:sc= 0.0354 USER MOD Single : A 81 THR OG1 : rot -41:sc= -0.898 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.0665 USER MOD Single : A 87 ASN : amide:sc=-0.00978 K(o=-0.0098,f=-0.55) USER MOD Single : A 92 LYS NZ :NH3+ 152:sc= -0.883! (180deg=-1.57!) USER MOD Single : A 94 LYS NZ :NH3+ 153:sc= 1.25 (180deg=0.156) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0.18 K(o=0.18,f=-0.76) USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.278 USER MOD Single : A 119 TYR OH : rot -80:sc= -2.61! USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 14.191 -11.957 7.491 1.00 0.00 N ATOM 2 CA ALA A 1 13.417 -11.120 6.550 1.00 0.00 C ATOM 3 C ALA A 1 12.743 -11.993 5.500 1.00 0.00 C ATOM 4 O ALA A 1 13.379 -12.865 4.909 1.00 0.00 O ATOM 5 CB ALA A 1 14.321 -10.094 5.885 1.00 0.00 C ATOM 0 H1 ALA A 1 14.646 -11.350 8.202 1.00 0.00 H new ATOM 0 H2 ALA A 1 13.553 -12.627 7.965 1.00 0.00 H new ATOM 0 H3 ALA A 1 14.920 -12.484 6.968 1.00 0.00 H new ATOM 0 HA ALA A 1 12.646 -10.590 7.109 1.00 0.00 H new ATOM 0 HB1 ALA A 1 13.736 -9.486 5.195 1.00 0.00 H new ATOM 0 HB2 ALA A 1 14.765 -9.453 6.646 1.00 0.00 H new ATOM 0 HB3 ALA A 1 15.111 -10.607 5.336 1.00 0.00 H new ATOM 13 N PHE A 2 11.462 -11.745 5.256 1.00 0.00 N ATOM 14 CA PHE A 2 10.712 -12.510 4.269 1.00 0.00 C ATOM 15 C PHE A 2 11.151 -12.121 2.871 1.00 0.00 C ATOM 16 O PHE A 2 11.234 -12.960 1.975 1.00 0.00 O ATOM 17 CB PHE A 2 9.206 -12.276 4.432 1.00 0.00 C ATOM 18 CG PHE A 2 8.365 -12.848 3.319 1.00 0.00 C ATOM 19 CD1 PHE A 2 8.369 -14.206 3.046 1.00 0.00 C ATOM 20 CD2 PHE A 2 7.579 -12.013 2.539 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.600 -14.722 2.017 1.00 0.00 C ATOM 22 CE2 PHE A 2 6.809 -12.523 1.512 1.00 0.00 C ATOM 23 CZ PHE A 2 6.820 -13.878 1.249 1.00 0.00 C ATOM 0 H PHE A 2 10.921 -11.020 5.728 1.00 0.00 H new ATOM 0 HA PHE A 2 10.914 -13.570 4.426 1.00 0.00 H new ATOM 0 HB2 PHE A 2 8.883 -12.712 5.377 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.022 -11.204 4.497 1.00 0.00 H new ATOM 0 HD1 PHE A 2 8.978 -14.869 3.642 1.00 0.00 H new ATOM 0 HD2 PHE A 2 7.569 -10.951 2.737 1.00 0.00 H new ATOM 0 HE1 PHE A 2 7.610 -15.783 1.815 1.00 0.00 H new ATOM 0 HE2 PHE A 2 6.198 -11.862 0.915 1.00 0.00 H new ATOM 0 HZ PHE A 2 6.220 -14.278 0.445 1.00 0.00 H new ATOM 32 N ASP A 3 11.465 -10.850 2.694 1.00 0.00 N ATOM 33 CA ASP A 3 11.898 -10.367 1.403 1.00 0.00 C ATOM 34 C ASP A 3 13.053 -9.413 1.574 1.00 0.00 C ATOM 35 O ASP A 3 14.096 -9.549 0.932 1.00 0.00 O ATOM 36 CB ASP A 3 10.763 -9.633 0.702 1.00 0.00 C ATOM 37 CG ASP A 3 10.947 -9.543 -0.798 1.00 0.00 C ATOM 38 OD1 ASP A 3 11.980 -9.011 -1.248 1.00 0.00 O ATOM 39 OD2 ASP A 3 10.048 -10.005 -1.534 1.00 0.00 O ATOM 0 H ASP A 3 11.427 -10.140 3.426 1.00 0.00 H new ATOM 0 HA ASP A 3 12.204 -11.224 0.803 1.00 0.00 H new ATOM 0 HB2 ASP A 3 9.823 -10.142 0.916 1.00 0.00 H new ATOM 0 HB3 ASP A 3 10.682 -8.627 1.113 1.00 0.00 H new ATOM 43 N GLY A 4 12.861 -8.447 2.456 1.00 0.00 N ATOM 44 CA GLY A 4 13.881 -7.463 2.683 1.00 0.00 C ATOM 45 C GLY A 4 13.439 -6.370 3.628 1.00 0.00 C ATOM 46 O GLY A 4 12.330 -6.403 4.166 1.00 0.00 O ATOM 0 H GLY A 4 12.016 -8.331 3.016 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.767 -7.951 3.088 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.170 -7.019 1.730 1.00 0.00 H new ATOM 50 N THR A 5 14.214 -5.313 3.623 1.00 0.00 N ATOM 51 CA THR A 5 13.873 -4.075 4.222 1.00 0.00 C ATOM 52 C THR A 5 14.767 -3.110 3.546 1.00 0.00 C ATOM 53 O THR A 5 15.847 -3.488 3.094 1.00 0.00 O ATOM 54 CB THR A 5 14.054 -3.995 5.741 1.00 0.00 C ATOM 55 OG1 THR A 5 13.668 -2.682 6.140 1.00 0.00 O ATOM 56 CG2 THR A 5 15.490 -4.265 6.170 1.00 0.00 C ATOM 0 H THR A 5 15.133 -5.306 3.180 1.00 0.00 H new ATOM 0 HA THR A 5 12.806 -3.888 4.098 1.00 0.00 H new ATOM 0 HB THR A 5 13.441 -4.760 6.217 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.087 -2.289 5.455 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.565 -4.196 7.255 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.784 -5.264 5.849 1.00 0.00 H new ATOM 0 HG23 THR A 5 16.151 -3.528 5.714 1.00 0.00 H new ATOM 64 N TRP A 6 14.183 -2.038 3.139 1.00 0.00 N ATOM 65 CA TRP A 6 14.737 -1.248 2.140 1.00 0.00 C ATOM 66 C TRP A 6 13.940 -0.012 2.299 1.00 0.00 C ATOM 67 O TRP A 6 12.787 -0.135 2.720 1.00 0.00 O ATOM 68 CB TRP A 6 14.580 -1.916 0.787 1.00 0.00 C ATOM 69 CG TRP A 6 13.647 -3.109 0.662 1.00 0.00 C ATOM 70 CD1 TRP A 6 13.975 -4.305 0.087 1.00 0.00 C ATOM 71 CD2 TRP A 6 12.273 -3.241 1.062 1.00 0.00 C ATOM 72 NE1 TRP A 6 12.888 -5.116 0.007 1.00 0.00 N ATOM 73 CE2 TRP A 6 11.833 -4.497 0.597 1.00 0.00 C ATOM 74 CE3 TRP A 6 11.363 -2.428 1.729 1.00 0.00 C ATOM 75 CZ2 TRP A 6 10.532 -4.934 0.757 1.00 0.00 C ATOM 76 CZ3 TRP A 6 10.068 -2.880 1.898 1.00 0.00 C ATOM 77 CH2 TRP A 6 9.663 -4.113 1.405 1.00 0.00 C ATOM 0 H TRP A 6 13.295 -1.695 3.507 1.00 0.00 H new ATOM 0 HA TRP A 6 15.810 -1.069 2.207 1.00 0.00 H new ATOM 0 HB2 TRP A 6 14.241 -1.157 0.082 1.00 0.00 H new ATOM 0 HB3 TRP A 6 15.570 -2.236 0.460 1.00 0.00 H new ATOM 0 HD1 TRP A 6 14.964 -4.569 -0.257 1.00 0.00 H new ATOM 0 HE1 TRP A 6 12.868 -6.039 -0.426 1.00 0.00 H new ATOM 0 HE3 TRP A 6 11.663 -1.462 2.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 10.216 -5.895 0.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 9.356 -2.261 2.424 1.00 0.00 H new ATOM 0 HH2 TRP A 6 8.638 -4.426 1.539 1.00 0.00 H new ATOM 87 N LYS A 7 14.530 1.149 2.346 1.00 0.00 N ATOM 88 CA LYS A 7 13.784 2.153 3.032 1.00 0.00 C ATOM 89 C LYS A 7 14.238 3.564 2.806 1.00 0.00 C ATOM 90 O LYS A 7 15.340 3.956 3.176 1.00 0.00 O ATOM 91 CB LYS A 7 13.787 1.826 4.516 1.00 0.00 C ATOM 92 CG LYS A 7 14.970 1.017 5.042 1.00 0.00 C ATOM 93 CD LYS A 7 16.282 1.783 4.963 1.00 0.00 C ATOM 94 CE LYS A 7 17.457 0.922 5.391 1.00 0.00 C ATOM 95 NZ LYS A 7 18.734 1.678 5.358 1.00 0.00 N ATOM 0 H LYS A 7 15.437 1.407 1.958 1.00 0.00 H new ATOM 0 HA LYS A 7 12.778 2.126 2.613 1.00 0.00 H new ATOM 0 HB2 LYS A 7 13.744 2.764 5.070 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.873 1.278 4.745 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.780 0.734 6.077 1.00 0.00 H new ATOM 0 HG3 LYS A 7 15.057 0.093 4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 7 16.439 2.133 3.943 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.227 2.667 5.598 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.284 0.545 6.399 1.00 0.00 H new ATOM 0 HE3 LYS A 7 17.531 0.055 4.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 19.474 1.131 5.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 19.016 1.841 4.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.609 2.592 5.837 1.00 0.00 H new ATOM 105 N VAL A 8 13.315 4.349 2.295 1.00 0.00 N ATOM 106 CA VAL A 8 13.524 5.766 2.124 1.00 0.00 C ATOM 107 C VAL A 8 12.276 6.440 1.717 1.00 0.00 C ATOM 108 O VAL A 8 11.958 7.531 2.185 1.00 0.00 O ATOM 109 CB VAL A 8 14.519 6.076 0.991 1.00 0.00 C ATOM 110 CG1 VAL A 8 15.840 6.561 1.511 1.00 0.00 C ATOM 111 CG2 VAL A 8 14.674 4.880 0.071 1.00 0.00 C ATOM 0 H VAL A 8 12.400 4.021 1.987 1.00 0.00 H new ATOM 0 HA VAL A 8 13.895 6.116 3.087 1.00 0.00 H new ATOM 0 HB VAL A 8 14.105 6.896 0.405 1.00 0.00 H new ATOM 0 HG11 VAL A 8 16.507 6.766 0.674 1.00 0.00 H new ATOM 0 HG12 VAL A 8 15.691 7.473 2.088 1.00 0.00 H new ATOM 0 HG13 VAL A 8 16.283 5.796 2.149 1.00 0.00 H new ATOM 0 HG21 VAL A 8 15.381 5.121 -0.723 1.00 0.00 H new ATOM 0 HG22 VAL A 8 15.044 4.028 0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 8 13.708 4.631 -0.368 1.00 0.00 H new ATOM 121 N ASP A 9 11.841 5.986 0.588 1.00 0.00 N ATOM 122 CA ASP A 9 10.963 6.769 -0.190 1.00 0.00 C ATOM 123 C ASP A 9 9.689 6.005 -0.533 1.00 0.00 C ATOM 124 O ASP A 9 9.297 5.070 0.167 1.00 0.00 O ATOM 125 CB ASP A 9 11.738 7.233 -1.419 1.00 0.00 C ATOM 126 CG ASP A 9 12.639 8.442 -1.178 1.00 0.00 C ATOM 127 OD1 ASP A 9 13.269 8.535 -0.111 1.00 0.00 O ATOM 128 OD2 ASP A 9 12.765 9.285 -2.087 1.00 0.00 O ATOM 0 H ASP A 9 12.083 5.078 0.191 1.00 0.00 H new ATOM 0 HA ASP A 9 10.621 7.642 0.366 1.00 0.00 H new ATOM 0 HB2 ASP A 9 12.349 6.406 -1.781 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.029 7.476 -2.210 1.00 0.00 H new ATOM 132 N ARG A 10 8.968 6.570 -1.463 1.00 0.00 N ATOM 133 CA ARG A 10 7.607 6.209 -1.790 1.00 0.00 C ATOM 134 C ARG A 10 7.347 6.985 -3.043 1.00 0.00 C ATOM 135 O ARG A 10 8.249 7.543 -3.565 1.00 0.00 O ATOM 136 CB ARG A 10 6.618 6.563 -0.679 1.00 0.00 C ATOM 137 CG ARG A 10 6.434 8.053 -0.491 1.00 0.00 C ATOM 138 CD ARG A 10 5.214 8.390 0.362 1.00 0.00 C ATOM 139 NE ARG A 10 5.414 8.092 1.786 1.00 0.00 N ATOM 140 CZ ARG A 10 5.027 6.961 2.392 1.00 0.00 C ATOM 141 NH1 ARG A 10 4.359 6.027 1.722 1.00 0.00 N ATOM 142 NH2 ARG A 10 5.296 6.775 3.683 1.00 0.00 N ATOM 0 H ARG A 10 9.326 7.330 -2.042 1.00 0.00 H new ATOM 0 HA ARG A 10 7.477 5.134 -1.914 1.00 0.00 H new ATOM 0 HB2 ARG A 10 5.652 6.111 -0.905 1.00 0.00 H new ATOM 0 HB3 ARG A 10 6.964 6.126 0.258 1.00 0.00 H new ATOM 0 HG2 ARG A 10 7.326 8.469 -0.023 1.00 0.00 H new ATOM 0 HG3 ARG A 10 6.334 8.529 -1.466 1.00 0.00 H new ATOM 0 HD2 ARG A 10 4.977 9.448 0.247 1.00 0.00 H new ATOM 0 HD3 ARG A 10 4.354 7.829 -0.004 1.00 0.00 H new ATOM 0 HE ARG A 10 5.882 8.797 2.355 1.00 0.00 H new ATOM 0 HH11 ARG A 10 4.136 6.167 0.737 1.00 0.00 H new ATOM 0 HH12 ARG A 10 4.069 5.170 2.193 1.00 0.00 H new ATOM 0 HH21 ARG A 10 5.796 7.493 4.208 1.00 0.00 H new ATOM 0 HH22 ARG A 10 5.002 5.915 4.146 1.00 0.00 H new ATOM 153 N ASN A 11 6.202 7.035 -3.582 1.00 0.00 N ATOM 154 CA ASN A 11 6.086 7.815 -4.770 1.00 0.00 C ATOM 155 C ASN A 11 5.760 9.209 -4.340 1.00 0.00 C ATOM 156 O ASN A 11 5.285 9.408 -3.220 1.00 0.00 O ATOM 157 CB ASN A 11 5.023 7.175 -5.676 1.00 0.00 C ATOM 158 CG ASN A 11 3.686 7.931 -5.923 1.00 0.00 C ATOM 159 OD1 ASN A 11 2.944 7.573 -6.831 1.00 0.00 O ATOM 160 ND2 ASN A 11 3.293 8.865 -5.082 1.00 0.00 N ATOM 0 H ASN A 11 5.355 6.573 -3.251 1.00 0.00 H new ATOM 0 HA ASN A 11 7.003 7.849 -5.358 1.00 0.00 H new ATOM 0 HB2 ASN A 11 5.484 6.996 -6.647 1.00 0.00 H new ATOM 0 HB3 ASN A 11 4.777 6.200 -5.256 1.00 0.00 H new ATOM 0 HD21 ASN A 11 2.372 9.290 -5.186 1.00 0.00 H new ATOM 0 HD22 ASN A 11 3.910 9.163 -4.326 1.00 0.00 H new ATOM 166 N GLU A 12 5.887 10.168 -5.218 1.00 0.00 N ATOM 167 CA GLU A 12 5.514 11.484 -4.821 1.00 0.00 C ATOM 168 C GLU A 12 4.120 11.726 -5.245 1.00 0.00 C ATOM 169 O GLU A 12 3.871 12.212 -6.301 1.00 0.00 O ATOM 170 CB GLU A 12 6.339 12.610 -5.408 1.00 0.00 C ATOM 171 CG GLU A 12 7.726 12.824 -4.839 1.00 0.00 C ATOM 172 CD GLU A 12 8.840 12.242 -5.680 1.00 0.00 C ATOM 173 OE1 GLU A 12 8.556 11.688 -6.754 1.00 0.00 O ATOM 174 OE2 GLU A 12 10.016 12.367 -5.275 1.00 0.00 O ATOM 0 H GLU A 12 6.232 10.065 -6.172 1.00 0.00 H new ATOM 0 HA GLU A 12 5.669 11.503 -3.742 1.00 0.00 H new ATOM 0 HB2 GLU A 12 6.437 12.433 -6.479 1.00 0.00 H new ATOM 0 HB3 GLU A 12 5.778 13.537 -5.288 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.897 13.894 -4.721 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.770 12.383 -3.843 1.00 0.00 H new ATOM 179 N ASN A 13 3.327 11.809 -4.252 1.00 0.00 N ATOM 180 CA ASN A 13 2.070 12.437 -4.359 1.00 0.00 C ATOM 181 C ASN A 13 2.368 13.891 -4.409 1.00 0.00 C ATOM 182 O ASN A 13 1.865 14.628 -5.240 1.00 0.00 O ATOM 183 CB ASN A 13 1.246 12.122 -3.141 1.00 0.00 C ATOM 184 CG ASN A 13 0.912 10.658 -2.989 1.00 0.00 C ATOM 185 OD1 ASN A 13 0.475 10.060 -4.070 1.00 0.00 O flip ATOM 186 ND2 ASN A 13 0.987 10.098 -1.904 1.00 0.00 N flip ATOM 0 H ASN A 13 3.534 11.437 -3.325 1.00 0.00 H new ATOM 0 HA ASN A 13 1.511 12.104 -5.234 1.00 0.00 H new ATOM 0 HB2 ASN A 13 1.785 12.455 -2.254 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.319 12.693 -3.184 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.334 10.606 -1.091 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.702 9.123 -1.813 1.00 0.00 H new ATOM 192 N TYR A 14 3.423 14.183 -3.687 1.00 0.00 N ATOM 193 CA TYR A 14 4.155 15.390 -3.807 1.00 0.00 C ATOM 194 C TYR A 14 4.523 15.694 -5.247 1.00 0.00 C ATOM 195 O TYR A 14 5.075 16.736 -5.506 1.00 0.00 O ATOM 196 CB TYR A 14 5.459 15.249 -2.992 1.00 0.00 C ATOM 197 CG TYR A 14 6.461 16.394 -3.143 1.00 0.00 C ATOM 198 CD1 TYR A 14 6.049 17.718 -3.094 1.00 0.00 C ATOM 199 CD2 TYR A 14 7.812 16.149 -3.355 1.00 0.00 C ATOM 200 CE1 TYR A 14 6.932 18.757 -3.254 1.00 0.00 C ATOM 201 CE2 TYR A 14 8.712 17.191 -3.516 1.00 0.00 C ATOM 202 CZ TYR A 14 8.263 18.495 -3.466 1.00 0.00 C ATOM 203 OH TYR A 14 9.144 19.542 -3.627 1.00 0.00 O ATOM 0 H TYR A 14 3.797 13.553 -2.977 1.00 0.00 H new ATOM 0 HA TYR A 14 3.530 16.204 -3.438 1.00 0.00 H new ATOM 0 HB2 TYR A 14 5.199 15.155 -1.938 1.00 0.00 H new ATOM 0 HB3 TYR A 14 5.950 14.320 -3.283 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.005 17.937 -2.925 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.167 15.130 -3.395 1.00 0.00 H new ATOM 0 HE1 TYR A 14 6.581 19.777 -3.213 1.00 0.00 H new ATOM 0 HE2 TYR A 14 9.759 16.983 -3.680 1.00 0.00 H new ATOM 0 HH TYR A 14 10.048 19.190 -3.767 1.00 0.00 H new ATOM 212 N GLU A 15 4.358 14.748 -6.149 1.00 0.00 N ATOM 213 CA GLU A 15 4.545 15.023 -7.542 1.00 0.00 C ATOM 214 C GLU A 15 3.270 14.859 -8.270 1.00 0.00 C ATOM 215 O GLU A 15 2.863 15.699 -8.968 1.00 0.00 O ATOM 216 CB GLU A 15 5.670 14.194 -8.142 1.00 0.00 C ATOM 217 CG GLU A 15 5.275 12.768 -8.517 1.00 0.00 C ATOM 218 CD GLU A 15 6.327 12.052 -9.338 1.00 0.00 C ATOM 219 OE1 GLU A 15 6.805 12.629 -10.339 1.00 0.00 O ATOM 220 OE2 GLU A 15 6.665 10.902 -9.007 1.00 0.00 O ATOM 0 H GLU A 15 4.095 13.786 -5.934 1.00 0.00 H new ATOM 0 HA GLU A 15 4.856 16.062 -7.647 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.042 14.700 -9.032 1.00 0.00 H new ATOM 0 HB3 GLU A 15 6.494 14.154 -7.430 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.085 12.199 -7.607 1.00 0.00 H new ATOM 0 HG3 GLU A 15 4.341 12.793 -9.078 1.00 0.00 H new ATOM 225 N LYS A 16 2.622 13.788 -8.034 1.00 0.00 N ATOM 226 CA LYS A 16 1.379 13.501 -8.728 1.00 0.00 C ATOM 227 C LYS A 16 0.429 14.587 -8.492 1.00 0.00 C ATOM 228 O LYS A 16 -0.025 15.276 -9.376 1.00 0.00 O ATOM 229 CB LYS A 16 0.732 12.267 -8.123 1.00 0.00 C ATOM 230 CG LYS A 16 1.690 11.314 -7.482 1.00 0.00 C ATOM 231 CD LYS A 16 0.984 10.168 -6.867 1.00 0.00 C ATOM 232 CE LYS A 16 0.709 9.086 -7.879 1.00 0.00 C ATOM 233 NZ LYS A 16 -0.084 7.980 -7.305 1.00 0.00 N ATOM 0 H LYS A 16 2.913 13.075 -7.365 1.00 0.00 H new ATOM 0 HA LYS A 16 1.603 13.370 -9.787 1.00 0.00 H new ATOM 0 HB2 LYS A 16 0.002 12.584 -7.378 1.00 0.00 H new ATOM 0 HB3 LYS A 16 0.183 11.740 -8.904 1.00 0.00 H new ATOM 0 HG2 LYS A 16 2.397 10.950 -8.228 1.00 0.00 H new ATOM 0 HG3 LYS A 16 2.270 11.836 -6.721 1.00 0.00 H new ATOM 0 HD2 LYS A 16 1.585 9.763 -6.053 1.00 0.00 H new ATOM 0 HD3 LYS A 16 0.045 10.508 -6.431 1.00 0.00 H new ATOM 0 HE2 LYS A 16 0.175 9.512 -8.729 1.00 0.00 H new ATOM 0 HE3 LYS A 16 1.653 8.696 -8.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -0.179 7.219 -8.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 0.396 7.612 -6.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -1.028 8.329 -7.044 1.00 0.00 H new ATOM 243 N PHE A 17 0.224 14.792 -7.258 1.00 0.00 N ATOM 244 CA PHE A 17 -0.715 15.751 -6.833 1.00 0.00 C ATOM 245 C PHE A 17 -0.103 17.066 -6.999 1.00 0.00 C ATOM 246 O PHE A 17 -0.770 18.083 -6.987 1.00 0.00 O ATOM 247 CB PHE A 17 -1.093 15.559 -5.385 1.00 0.00 C ATOM 248 CG PHE A 17 -1.437 14.120 -5.009 1.00 0.00 C ATOM 249 CD1 PHE A 17 -0.754 13.061 -5.562 1.00 0.00 C ATOM 250 CD2 PHE A 17 -2.509 13.829 -4.183 1.00 0.00 C ATOM 251 CE1 PHE A 17 -1.104 11.783 -5.324 1.00 0.00 C ATOM 252 CE2 PHE A 17 -2.856 12.513 -3.913 1.00 0.00 C ATOM 253 CZ PHE A 17 -2.142 11.488 -4.497 1.00 0.00 C ATOM 0 H PHE A 17 0.703 14.299 -6.505 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.625 15.651 -7.425 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.268 15.898 -4.759 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -1.948 16.195 -5.158 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.089 13.261 -6.207 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -3.081 14.634 -3.745 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -0.554 10.982 -5.796 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.680 12.293 -3.250 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.405 10.459 -4.299 1.00 0.00 H new ATOM 262 N MET A 18 1.191 17.023 -7.099 1.00 0.00 N ATOM 263 CA MET A 18 1.939 18.200 -7.315 1.00 0.00 C ATOM 264 C MET A 18 1.770 18.676 -8.731 1.00 0.00 C ATOM 265 O MET A 18 1.892 19.860 -9.040 1.00 0.00 O ATOM 266 CB MET A 18 3.364 17.871 -7.054 1.00 0.00 C ATOM 267 CG MET A 18 4.323 18.719 -7.869 1.00 0.00 C ATOM 268 SD MET A 18 6.046 18.209 -7.738 1.00 0.00 S ATOM 269 CE MET A 18 6.814 19.285 -8.947 1.00 0.00 C ATOM 0 H MET A 18 1.746 16.170 -7.032 1.00 0.00 H new ATOM 0 HA MET A 18 1.598 18.997 -6.654 1.00 0.00 H new ATOM 0 HB2 MET A 18 3.576 18.009 -5.994 1.00 0.00 H new ATOM 0 HB3 MET A 18 3.536 16.818 -7.279 1.00 0.00 H new ATOM 0 HG2 MET A 18 4.023 18.683 -8.916 1.00 0.00 H new ATOM 0 HG3 MET A 18 4.237 19.757 -7.548 1.00 0.00 H new ATOM 0 HE1 MET A 18 7.885 19.087 -8.982 1.00 0.00 H new ATOM 0 HE2 MET A 18 6.379 19.098 -9.929 1.00 0.00 H new ATOM 0 HE3 MET A 18 6.646 20.325 -8.667 1.00 0.00 H new ATOM 277 N GLU A 19 1.704 17.715 -9.593 1.00 0.00 N ATOM 278 CA GLU A 19 1.681 17.969 -10.987 1.00 0.00 C ATOM 279 C GLU A 19 0.266 18.120 -11.450 1.00 0.00 C ATOM 280 O GLU A 19 0.025 18.603 -12.558 1.00 0.00 O ATOM 281 CB GLU A 19 2.287 16.803 -11.739 1.00 0.00 C ATOM 282 CG GLU A 19 3.714 16.490 -11.310 1.00 0.00 C ATOM 283 CD GLU A 19 4.413 15.504 -12.221 1.00 0.00 C ATOM 284 OE1 GLU A 19 3.873 14.402 -12.452 1.00 0.00 O ATOM 285 OE2 GLU A 19 5.516 15.827 -12.710 1.00 0.00 O ATOM 0 H GLU A 19 1.664 16.727 -9.343 1.00 0.00 H new ATOM 0 HA GLU A 19 2.249 18.880 -11.178 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.667 15.920 -11.588 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.275 17.022 -12.807 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.288 17.416 -11.281 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.701 16.090 -10.296 1.00 0.00 H new ATOM 290 N LYS A 20 -0.644 17.443 -10.751 1.00 0.00 N ATOM 291 CA LYS A 20 -1.937 17.247 -11.358 1.00 0.00 C ATOM 292 C LYS A 20 -3.097 17.389 -10.380 1.00 0.00 C ATOM 293 O LYS A 20 -4.185 17.821 -10.756 1.00 0.00 O ATOM 294 CB LYS A 20 -1.994 15.881 -12.086 1.00 0.00 C ATOM 295 CG LYS A 20 -1.935 14.630 -11.196 1.00 0.00 C ATOM 296 CD LYS A 20 -3.307 14.232 -10.643 1.00 0.00 C ATOM 297 CE LYS A 20 -4.249 13.688 -11.713 1.00 0.00 C ATOM 298 NZ LYS A 20 -4.887 14.757 -12.528 1.00 0.00 N ATOM 0 H LYS A 20 -0.515 17.046 -9.820 1.00 0.00 H new ATOM 0 HA LYS A 20 -2.058 18.049 -12.086 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.914 15.843 -12.669 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.166 15.836 -12.794 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -1.525 13.800 -11.771 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.252 14.812 -10.366 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -3.174 13.478 -9.867 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -3.767 15.100 -10.170 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -3.694 13.020 -12.372 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.026 13.091 -11.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -5.898 14.545 -12.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -4.781 15.672 -12.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -4.429 14.803 -13.460 1.00 0.00 H new ATOM 308 N MET A 21 -2.923 16.795 -9.219 1.00 0.00 N ATOM 309 CA MET A 21 -4.016 16.583 -8.282 1.00 0.00 C ATOM 310 C MET A 21 -4.636 17.879 -7.806 1.00 0.00 C ATOM 311 O MET A 21 -5.826 18.128 -7.999 1.00 0.00 O ATOM 312 CB MET A 21 -3.463 15.836 -7.109 1.00 0.00 C ATOM 313 CG MET A 21 -4.387 15.563 -5.983 1.00 0.00 C ATOM 314 SD MET A 21 -5.759 14.482 -6.422 1.00 0.00 S ATOM 315 CE MET A 21 -6.564 14.290 -4.834 1.00 0.00 C ATOM 0 H MET A 21 -2.022 16.444 -8.894 1.00 0.00 H new ATOM 0 HA MET A 21 -4.805 16.025 -8.786 1.00 0.00 H new ATOM 0 HB2 MET A 21 -3.077 14.882 -7.468 1.00 0.00 H new ATOM 0 HB3 MET A 21 -2.614 16.398 -6.720 1.00 0.00 H new ATOM 0 HG2 MET A 21 -3.826 15.110 -5.165 1.00 0.00 H new ATOM 0 HG3 MET A 21 -4.784 16.508 -5.613 1.00 0.00 H new ATOM 0 HE1 MET A 21 -7.435 13.644 -4.943 1.00 0.00 H new ATOM 0 HE2 MET A 21 -5.868 13.843 -4.125 1.00 0.00 H new ATOM 0 HE3 MET A 21 -6.880 15.266 -4.466 1.00 0.00 H new ATOM 323 N GLY A 22 -3.832 18.651 -7.110 1.00 0.00 N ATOM 324 CA GLY A 22 -4.320 19.896 -6.529 1.00 0.00 C ATOM 325 C GLY A 22 -3.191 20.859 -6.289 1.00 0.00 C ATOM 326 O GLY A 22 -3.306 22.056 -6.548 1.00 0.00 O ATOM 0 H GLY A 22 -2.849 18.449 -6.930 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -5.054 20.349 -7.196 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.830 19.687 -5.589 1.00 0.00 H new ATOM 330 N ILE A 23 -2.054 20.269 -5.959 1.00 0.00 N ATOM 331 CA ILE A 23 -0.766 20.943 -5.847 1.00 0.00 C ATOM 332 C ILE A 23 -0.731 21.978 -4.699 1.00 0.00 C ATOM 333 O ILE A 23 -0.197 21.656 -3.630 1.00 0.00 O ATOM 334 CB ILE A 23 -0.268 21.488 -7.234 1.00 0.00 C ATOM 335 CG1 ILE A 23 -0.682 22.935 -7.523 1.00 0.00 C ATOM 336 CG2 ILE A 23 -0.790 20.584 -8.357 1.00 0.00 C ATOM 337 CD1 ILE A 23 -0.158 23.466 -8.839 1.00 0.00 C ATOM 0 H ILE A 23 -1.998 19.271 -5.754 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.031 20.194 -5.554 1.00 0.00 H new ATOM 0 HB ILE A 23 0.821 21.479 -7.189 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.770 22.999 -7.523 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.325 23.574 -6.715 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -0.444 20.962 -9.319 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.417 19.570 -8.211 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.880 20.576 -8.341 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -0.491 24.495 -8.975 1.00 0.00 H new ATOM 0 HD12 ILE A 23 0.932 23.435 -8.836 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.536 22.851 -9.656 1.00 0.00 H new ATOM 348 N ASN A 24 -1.423 23.110 -4.844 1.00 0.00 N ATOM 349 CA ASN A 24 -1.542 24.120 -3.788 1.00 0.00 C ATOM 350 C ASN A 24 -0.182 24.391 -3.125 1.00 0.00 C ATOM 351 O ASN A 24 0.858 24.378 -3.791 1.00 0.00 O ATOM 352 CB ASN A 24 -2.585 23.662 -2.757 1.00 0.00 C ATOM 353 CG ASN A 24 -3.257 24.814 -2.031 1.00 0.00 C ATOM 354 OD1 ASN A 24 -2.635 25.514 -1.237 1.00 0.00 O ATOM 355 ND2 ASN A 24 -4.531 25.020 -2.303 1.00 0.00 N ATOM 0 H ASN A 24 -1.919 23.354 -5.701 1.00 0.00 H new ATOM 0 HA ASN A 24 -1.875 25.059 -4.231 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.346 23.065 -3.260 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -2.103 23.013 -2.026 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.033 25.782 -1.848 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.014 24.417 -2.969 1.00 0.00 H new ATOM 361 N VAL A 25 -0.183 24.557 -1.810 1.00 0.00 N ATOM 362 CA VAL A 25 1.049 24.721 -1.048 1.00 0.00 C ATOM 363 C VAL A 25 1.522 23.373 -0.507 1.00 0.00 C ATOM 364 O VAL A 25 1.521 23.138 0.704 1.00 0.00 O ATOM 365 CB VAL A 25 0.899 25.741 0.108 1.00 0.00 C ATOM 366 CG1 VAL A 25 0.812 27.158 -0.438 1.00 0.00 C ATOM 367 CG2 VAL A 25 -0.319 25.431 0.968 1.00 0.00 C ATOM 0 H VAL A 25 -1.031 24.582 -1.244 1.00 0.00 H new ATOM 0 HA VAL A 25 1.798 25.119 -1.732 1.00 0.00 H new ATOM 0 HB VAL A 25 1.785 25.660 0.738 1.00 0.00 H new ATOM 0 HG11 VAL A 25 0.707 27.861 0.389 1.00 0.00 H new ATOM 0 HG12 VAL A 25 1.719 27.389 -0.997 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.052 27.242 -1.097 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.395 26.166 1.770 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -1.218 25.471 0.353 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -0.217 24.434 1.398 1.00 0.00 H new ATOM 377 N VAL A 26 1.833 22.464 -1.440 1.00 0.00 N ATOM 378 CA VAL A 26 2.253 21.086 -1.138 1.00 0.00 C ATOM 379 C VAL A 26 1.387 20.428 -0.062 1.00 0.00 C ATOM 380 O VAL A 26 1.884 19.683 0.785 1.00 0.00 O ATOM 381 CB VAL A 26 3.762 20.966 -0.766 1.00 0.00 C ATOM 382 CG1 VAL A 26 4.624 21.277 -1.977 1.00 0.00 C ATOM 383 CG2 VAL A 26 4.155 21.856 0.406 1.00 0.00 C ATOM 0 H VAL A 26 1.800 22.666 -2.439 1.00 0.00 H new ATOM 0 HA VAL A 26 2.105 20.542 -2.071 1.00 0.00 H new ATOM 0 HB VAL A 26 3.931 19.937 -0.449 1.00 0.00 H new ATOM 0 HG11 VAL A 26 5.676 21.190 -1.706 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.396 20.572 -2.777 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.419 22.292 -2.318 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.217 21.730 0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.957 22.898 0.154 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.573 21.578 1.285 1.00 0.00 H new ATOM 393 N LYS A 27 0.078 20.645 -0.157 1.00 0.00 N ATOM 394 CA LYS A 27 -0.868 20.059 0.787 1.00 0.00 C ATOM 395 C LYS A 27 -0.898 18.540 0.654 1.00 0.00 C ATOM 396 O LYS A 27 -0.425 17.824 1.535 1.00 0.00 O ATOM 397 CB LYS A 27 -2.269 20.629 0.559 1.00 0.00 C ATOM 398 CG LYS A 27 -2.352 22.136 0.709 1.00 0.00 C ATOM 399 CD LYS A 27 -2.282 22.564 2.164 1.00 0.00 C ATOM 400 CE LYS A 27 -3.524 22.141 2.933 1.00 0.00 C ATOM 401 NZ LYS A 27 -3.612 22.821 4.250 1.00 0.00 N ATOM 0 H LYS A 27 -0.352 21.223 -0.879 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.540 20.312 1.795 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -2.604 20.354 -0.441 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.958 20.165 1.264 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.538 22.602 0.154 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -3.283 22.494 0.269 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.399 22.127 2.630 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.170 23.647 2.220 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -4.412 22.371 2.345 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.510 21.061 3.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -4.471 22.508 4.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -2.776 22.582 4.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -3.650 23.850 4.107 1.00 0.00 H new ATOM 411 N ARG A 28 -1.413 18.045 -0.466 1.00 0.00 N ATOM 412 CA ARG A 28 -1.490 16.605 -0.680 1.00 0.00 C ATOM 413 C ARG A 28 -0.207 16.070 -1.305 1.00 0.00 C ATOM 414 O ARG A 28 -0.196 14.974 -1.874 1.00 0.00 O ATOM 415 CB ARG A 28 -2.689 16.227 -1.557 1.00 0.00 C ATOM 416 CG ARG A 28 -3.513 15.063 -1.010 1.00 0.00 C ATOM 417 CD ARG A 28 -2.668 13.813 -0.795 1.00 0.00 C ATOM 418 NE ARG A 28 -3.460 12.678 -0.331 1.00 0.00 N ATOM 419 CZ ARG A 28 -3.002 11.429 -0.259 1.00 0.00 C ATOM 420 NH1 ARG A 28 -1.774 11.140 -0.676 1.00 0.00 N ATOM 421 NH2 ARG A 28 -3.776 10.470 0.229 1.00 0.00 N ATOM 0 H ARG A 28 -1.779 18.612 -1.231 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.622 16.147 0.300 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.336 17.098 -1.666 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -2.331 15.969 -2.554 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.972 15.357 -0.066 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -4.324 14.837 -1.702 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -2.172 13.548 -1.729 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.885 14.028 -0.068 1.00 0.00 H new ATOM 0 HE ARG A 28 -4.423 12.852 -0.044 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -1.177 11.876 -1.053 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.428 10.182 -0.619 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -4.720 10.689 0.548 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -3.428 9.513 0.285 1.00 0.00 H new ATOM 432 N LYS A 29 0.917 16.706 -1.015 1.00 0.00 N ATOM 433 CA LYS A 29 2.170 16.057 -1.301 1.00 0.00 C ATOM 434 C LYS A 29 2.514 15.219 -0.115 1.00 0.00 C ATOM 435 O LYS A 29 3.374 15.561 0.693 1.00 0.00 O ATOM 436 CB LYS A 29 3.324 16.983 -1.585 1.00 0.00 C ATOM 437 CG LYS A 29 3.008 18.224 -2.386 1.00 0.00 C ATOM 438 CD LYS A 29 2.669 17.983 -3.832 1.00 0.00 C ATOM 439 CE LYS A 29 1.259 17.508 -4.006 1.00 0.00 C ATOM 440 NZ LYS A 29 0.295 18.644 -4.005 1.00 0.00 N ATOM 0 H LYS A 29 0.982 17.635 -0.598 1.00 0.00 H new ATOM 0 HA LYS A 29 2.026 15.484 -2.217 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.757 17.292 -0.633 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.091 16.420 -2.116 1.00 0.00 H new ATOM 0 HG2 LYS A 29 2.171 18.739 -1.914 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.864 18.897 -2.337 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.814 18.904 -4.397 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.354 17.244 -4.247 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.173 16.957 -4.943 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.006 16.814 -3.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.259 18.628 -3.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.816 19.542 -4.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.346 18.556 -4.819 1.00 0.00 H new ATOM 450 N LEU A 30 2.005 14.030 -0.163 1.00 0.00 N ATOM 451 CA LEU A 30 2.405 13.024 0.777 1.00 0.00 C ATOM 452 C LEU A 30 3.457 12.236 0.077 1.00 0.00 C ATOM 453 O LEU A 30 3.735 11.084 0.391 1.00 0.00 O ATOM 454 CB LEU A 30 1.224 12.141 1.158 1.00 0.00 C ATOM 455 CG LEU A 30 0.000 12.885 1.711 1.00 0.00 C ATOM 456 CD1 LEU A 30 -0.948 11.915 2.395 1.00 0.00 C ATOM 457 CD2 LEU A 30 0.417 13.989 2.673 1.00 0.00 C ATOM 0 H LEU A 30 1.309 13.728 -0.844 1.00 0.00 H new ATOM 0 HA LEU A 30 2.775 13.456 1.707 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.917 11.574 0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.557 11.419 1.903 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.520 13.348 0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.810 12.460 2.781 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.283 11.167 1.677 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.432 11.422 3.219 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.470 14.499 3.049 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.967 13.555 3.508 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.053 14.705 2.152 1.00 0.00 H new ATOM 468 N GLY A 31 3.914 12.843 -1.008 1.00 0.00 N ATOM 469 CA GLY A 31 4.807 12.186 -1.874 1.00 0.00 C ATOM 470 C GLY A 31 6.186 12.102 -1.305 1.00 0.00 C ATOM 471 O GLY A 31 6.774 11.036 -1.219 1.00 0.00 O ATOM 0 H GLY A 31 3.665 13.792 -1.287 1.00 0.00 H new ATOM 0 HA2 GLY A 31 4.438 11.181 -2.079 1.00 0.00 H new ATOM 0 HA3 GLY A 31 4.841 12.714 -2.827 1.00 0.00 H new ATOM 475 N ALA A 32 6.678 13.244 -0.893 1.00 0.00 N ATOM 476 CA ALA A 32 8.015 13.333 -0.328 1.00 0.00 C ATOM 477 C ALA A 32 8.105 14.409 0.742 1.00 0.00 C ATOM 478 O ALA A 32 7.901 15.588 0.459 1.00 0.00 O ATOM 479 CB ALA A 32 9.028 13.611 -1.426 1.00 0.00 C ATOM 0 H ALA A 32 6.176 14.131 -0.936 1.00 0.00 H new ATOM 0 HA ALA A 32 8.238 12.375 0.142 1.00 0.00 H new ATOM 0 HB1 ALA A 32 10.026 13.676 -0.992 1.00 0.00 H new ATOM 0 HB2 ALA A 32 9.002 12.804 -2.158 1.00 0.00 H new ATOM 0 HB3 ALA A 32 8.784 14.553 -1.916 1.00 0.00 H new ATOM 485 N HIS A 33 8.516 13.983 1.937 1.00 0.00 N ATOM 486 CA HIS A 33 8.805 14.877 3.065 1.00 0.00 C ATOM 487 C HIS A 33 8.998 14.055 4.342 1.00 0.00 C ATOM 488 O HIS A 33 8.547 14.447 5.422 1.00 0.00 O ATOM 489 CB HIS A 33 7.703 15.943 3.262 1.00 0.00 C ATOM 490 CG HIS A 33 6.373 15.435 3.755 1.00 0.00 C ATOM 491 ND1 HIS A 33 5.719 14.349 3.215 1.00 0.00 N ATOM 492 CD2 HIS A 33 5.558 15.917 4.720 1.00 0.00 C ATOM 493 CE1 HIS A 33 4.559 14.192 3.825 1.00 0.00 C ATOM 494 NE2 HIS A 33 4.435 15.129 4.743 1.00 0.00 N ATOM 0 H HIS A 33 8.660 12.997 2.154 1.00 0.00 H new ATOM 0 HA HIS A 33 9.726 15.413 2.838 1.00 0.00 H new ATOM 0 HB2 HIS A 33 8.069 16.689 3.968 1.00 0.00 H new ATOM 0 HB3 HIS A 33 7.545 16.453 2.312 1.00 0.00 H new ATOM 0 HD2 HIS A 33 5.755 16.767 5.356 1.00 0.00 H new ATOM 0 HE1 HIS A 33 3.832 13.423 3.608 1.00 0.00 H new ATOM 0 HE2 HIS A 33 3.637 15.249 5.367 1.00 0.00 H new ATOM 502 N ALA A 34 9.666 12.903 4.211 1.00 0.00 N ATOM 503 CA ALA A 34 9.861 12.005 5.345 1.00 0.00 C ATOM 504 C ALA A 34 10.777 10.826 5.017 1.00 0.00 C ATOM 505 O ALA A 34 10.555 10.115 4.035 1.00 0.00 O ATOM 506 CB ALA A 34 8.519 11.461 5.810 1.00 0.00 C ATOM 0 H ALA A 34 10.076 12.576 3.336 1.00 0.00 H new ATOM 0 HA ALA A 34 10.338 12.593 6.129 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.671 10.791 6.657 1.00 0.00 H new ATOM 0 HB2 ALA A 34 7.876 12.288 6.112 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.046 10.913 4.995 1.00 0.00 H new ATOM 512 N ASN A 35 11.636 10.496 5.979 1.00 0.00 N ATOM 513 CA ASN A 35 12.377 9.235 5.964 1.00 0.00 C ATOM 514 C ASN A 35 11.424 8.117 6.384 1.00 0.00 C ATOM 515 O ASN A 35 10.367 8.406 6.944 1.00 0.00 O ATOM 516 CB ASN A 35 13.571 9.302 6.924 1.00 0.00 C ATOM 517 CG ASN A 35 14.366 8.010 6.957 1.00 0.00 C ATOM 518 OD1 ASN A 35 14.988 7.624 5.967 1.00 0.00 O ATOM 519 ND2 ASN A 35 14.331 7.320 8.088 1.00 0.00 N ATOM 0 H ASN A 35 11.838 11.089 6.784 1.00 0.00 H new ATOM 0 HA ASN A 35 12.763 9.044 4.963 1.00 0.00 H new ATOM 0 HB2 ASN A 35 14.227 10.120 6.626 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.213 9.530 7.928 1.00 0.00 H new ATOM 0 HD21 ASN A 35 14.831 6.434 8.161 1.00 0.00 H new ATOM 0 HD22 ASN A 35 13.804 7.675 8.886 1.00 0.00 H new ATOM 525 N LEU A 36 11.737 6.862 6.064 1.00 0.00 N ATOM 526 CA LEU A 36 10.846 5.772 6.358 1.00 0.00 C ATOM 527 C LEU A 36 11.595 4.488 6.182 1.00 0.00 C ATOM 528 O LEU A 36 12.512 4.424 5.365 1.00 0.00 O ATOM 529 CB LEU A 36 9.631 5.826 5.422 1.00 0.00 C ATOM 530 CG LEU A 36 9.979 5.931 3.933 1.00 0.00 C ATOM 531 CD1 LEU A 36 10.331 4.564 3.354 1.00 0.00 C ATOM 532 CD2 LEU A 36 8.839 6.586 3.152 1.00 0.00 C ATOM 0 H LEU A 36 12.604 6.588 5.601 1.00 0.00 H new ATOM 0 HA LEU A 36 10.485 5.843 7.384 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.028 4.932 5.579 1.00 0.00 H new ATOM 0 HB3 LEU A 36 9.013 6.680 5.699 1.00 0.00 H new ATOM 0 HG LEU A 36 10.859 6.567 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.574 4.668 2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 36 11.190 4.154 3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.481 3.891 3.467 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.109 6.649 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 36 7.934 5.988 3.259 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.660 7.588 3.542 1.00 0.00 H new ATOM 543 N LYS A 37 11.228 3.453 6.905 1.00 0.00 N ATOM 544 CA LYS A 37 11.861 2.204 6.648 1.00 0.00 C ATOM 545 C LYS A 37 10.818 1.175 6.298 1.00 0.00 C ATOM 546 O LYS A 37 9.732 1.205 6.868 1.00 0.00 O ATOM 547 CB LYS A 37 12.708 1.745 7.818 1.00 0.00 C ATOM 548 CG LYS A 37 11.901 1.208 8.979 1.00 0.00 C ATOM 549 CD LYS A 37 12.782 1.073 10.196 1.00 0.00 C ATOM 550 CE LYS A 37 13.873 0.034 9.978 1.00 0.00 C ATOM 551 NZ LYS A 37 14.716 -0.159 11.185 1.00 0.00 N ATOM 0 H LYS A 37 10.524 3.458 7.643 1.00 0.00 H new ATOM 0 HA LYS A 37 12.539 2.331 5.804 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.395 0.971 7.476 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.316 2.581 8.165 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.068 1.877 9.195 1.00 0.00 H new ATOM 0 HG3 LYS A 37 11.473 0.240 8.719 1.00 0.00 H new ATOM 0 HD2 LYS A 37 13.236 2.037 10.427 1.00 0.00 H new ATOM 0 HD3 LYS A 37 12.176 0.791 11.057 1.00 0.00 H new ATOM 0 HE2 LYS A 37 13.417 -0.916 9.700 1.00 0.00 H new ATOM 0 HE3 LYS A 37 14.503 0.341 9.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 15.444 -0.875 10.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 15.174 0.740 11.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 14.121 -0.478 11.976 1.00 0.00 H new ATOM 561 N LEU A 38 11.077 0.336 5.300 1.00 0.00 N ATOM 562 CA LEU A 38 10.081 -0.569 4.844 1.00 0.00 C ATOM 563 C LEU A 38 10.606 -1.985 4.948 1.00 0.00 C ATOM 564 O LEU A 38 11.726 -2.254 4.541 1.00 0.00 O ATOM 565 CB LEU A 38 9.752 -0.232 3.400 1.00 0.00 C ATOM 566 CG LEU A 38 8.838 0.989 3.136 1.00 0.00 C ATOM 567 CD1 LEU A 38 7.806 0.654 2.071 1.00 0.00 C ATOM 568 CD2 LEU A 38 8.132 1.475 4.390 1.00 0.00 C ATOM 0 H LEU A 38 11.969 0.280 4.808 1.00 0.00 H new ATOM 0 HA LEU A 38 9.180 -0.486 5.452 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.691 -0.068 2.872 1.00 0.00 H new ATOM 0 HB3 LEU A 38 9.282 -1.106 2.950 1.00 0.00 H new ATOM 0 HG LEU A 38 9.485 1.795 2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.170 1.521 1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.313 0.383 1.145 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.194 -0.183 2.408 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.505 2.332 4.145 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.511 0.674 4.791 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.873 1.768 5.134 1.00 0.00 H new ATOM 579 N THR A 39 9.840 -2.845 5.569 1.00 0.00 N ATOM 580 CA THR A 39 10.220 -4.223 5.803 1.00 0.00 C ATOM 581 C THR A 39 8.944 -5.060 5.513 1.00 0.00 C ATOM 582 O THR A 39 7.897 -4.438 5.315 1.00 0.00 O ATOM 583 CB THR A 39 10.670 -4.368 7.266 1.00 0.00 C ATOM 584 OG1 THR A 39 11.679 -3.404 7.594 1.00 0.00 O ATOM 585 CG2 THR A 39 11.173 -5.771 7.569 1.00 0.00 C ATOM 0 H THR A 39 8.918 -2.607 5.934 1.00 0.00 H new ATOM 0 HA THR A 39 11.046 -4.555 5.173 1.00 0.00 H new ATOM 0 HB THR A 39 9.792 -4.184 7.885 1.00 0.00 H new ATOM 0 HG1 THR A 39 12.070 -3.046 6.770 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.481 -5.830 8.613 1.00 0.00 H new ATOM 0 HG22 THR A 39 10.376 -6.491 7.385 1.00 0.00 H new ATOM 0 HG23 THR A 39 12.024 -5.999 6.927 1.00 0.00 H new ATOM 593 N ILE A 40 8.960 -6.410 5.444 1.00 0.00 N ATOM 594 CA ILE A 40 7.752 -7.155 5.128 1.00 0.00 C ATOM 595 C ILE A 40 7.989 -8.614 5.508 1.00 0.00 C ATOM 596 O ILE A 40 8.930 -9.238 5.015 1.00 0.00 O ATOM 597 CB ILE A 40 7.401 -7.141 3.601 1.00 0.00 C ATOM 598 CG1 ILE A 40 8.462 -7.878 2.800 1.00 0.00 C ATOM 599 CG2 ILE A 40 7.170 -5.748 3.024 1.00 0.00 C ATOM 600 CD1 ILE A 40 9.767 -7.147 2.652 1.00 0.00 C ATOM 0 H ILE A 40 9.788 -6.985 5.602 1.00 0.00 H new ATOM 0 HA ILE A 40 6.933 -6.688 5.674 1.00 0.00 H new ATOM 0 HB ILE A 40 6.447 -7.660 3.515 1.00 0.00 H new ATOM 0 HG12 ILE A 40 8.653 -8.839 3.277 1.00 0.00 H new ATOM 0 HG13 ILE A 40 8.066 -8.088 1.807 1.00 0.00 H new ATOM 0 HG21 ILE A 40 6.933 -5.828 1.963 1.00 0.00 H new ATOM 0 HG22 ILE A 40 6.341 -5.271 3.546 1.00 0.00 H new ATOM 0 HG23 ILE A 40 8.071 -5.148 3.150 1.00 0.00 H new ATOM 0 HD11 ILE A 40 10.459 -7.752 2.066 1.00 0.00 H new ATOM 0 HD12 ILE A 40 9.597 -6.197 2.145 1.00 0.00 H new ATOM 0 HD13 ILE A 40 10.193 -6.961 3.638 1.00 0.00 H new ATOM 611 N THR A 41 7.353 -9.089 6.547 1.00 0.00 N ATOM 612 CA THR A 41 7.709 -10.425 6.996 1.00 0.00 C ATOM 613 C THR A 41 6.744 -10.996 8.057 1.00 0.00 C ATOM 614 O THR A 41 6.586 -10.423 9.135 1.00 0.00 O ATOM 615 CB THR A 41 9.198 -10.411 7.452 1.00 0.00 C ATOM 616 OG1 THR A 41 9.714 -11.738 7.586 1.00 0.00 O ATOM 617 CG2 THR A 41 9.430 -9.635 8.731 1.00 0.00 C ATOM 0 H THR A 41 6.625 -8.610 7.078 1.00 0.00 H new ATOM 0 HA THR A 41 7.602 -11.119 6.162 1.00 0.00 H new ATOM 0 HB THR A 41 9.739 -9.891 6.661 1.00 0.00 H new ATOM 0 HG1 THR A 41 10.651 -11.698 7.872 1.00 0.00 H new ATOM 0 HG21 THR A 41 10.488 -9.667 8.989 1.00 0.00 H new ATOM 0 HG22 THR A 41 9.123 -8.599 8.589 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.846 -10.079 9.537 1.00 0.00 H new ATOM 625 N GLN A 42 6.136 -12.162 7.758 1.00 0.00 N ATOM 626 CA GLN A 42 5.294 -12.872 8.715 1.00 0.00 C ATOM 627 C GLN A 42 4.828 -14.191 8.140 1.00 0.00 C ATOM 628 O GLN A 42 5.334 -15.253 8.495 1.00 0.00 O ATOM 629 CB GLN A 42 4.051 -12.084 9.126 1.00 0.00 C ATOM 630 CG GLN A 42 3.099 -12.936 9.942 1.00 0.00 C ATOM 631 CD GLN A 42 1.848 -12.189 10.360 1.00 0.00 C ATOM 632 OE1 GLN A 42 1.093 -11.697 9.522 1.00 0.00 O ATOM 633 NE2 GLN A 42 1.621 -12.093 11.660 1.00 0.00 N ATOM 0 H GLN A 42 6.220 -12.626 6.853 1.00 0.00 H new ATOM 0 HA GLN A 42 5.919 -13.021 9.595 1.00 0.00 H new ATOM 0 HB2 GLN A 42 4.348 -11.210 9.706 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.541 -11.717 8.236 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.815 -13.813 9.360 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.615 -13.297 10.832 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.271 -12.515 12.324 1.00 0.00 H new ATOM 0 HE22 GLN A 42 0.796 -11.597 11.998 1.00 0.00 H new ATOM 640 N GLU A 43 3.842 -14.119 7.262 1.00 0.00 N ATOM 641 CA GLU A 43 3.274 -15.295 6.687 1.00 0.00 C ATOM 642 C GLU A 43 3.751 -15.380 5.265 1.00 0.00 C ATOM 643 O GLU A 43 4.118 -14.337 4.713 1.00 0.00 O ATOM 644 CB GLU A 43 1.752 -15.230 6.747 1.00 0.00 C ATOM 645 CG GLU A 43 1.211 -15.131 8.159 1.00 0.00 C ATOM 646 CD GLU A 43 -0.292 -15.310 8.220 1.00 0.00 C ATOM 647 OE1 GLU A 43 -0.782 -16.385 7.822 1.00 0.00 O ATOM 648 OE2 GLU A 43 -0.990 -14.374 8.659 1.00 0.00 O ATOM 0 H GLU A 43 3.426 -13.245 6.939 1.00 0.00 H new ATOM 0 HA GLU A 43 3.584 -16.182 7.239 1.00 0.00 H new ATOM 0 HB2 GLU A 43 1.409 -14.369 6.173 1.00 0.00 H new ATOM 0 HB3 GLU A 43 1.338 -16.118 6.268 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.689 -15.888 8.781 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.475 -14.160 8.578 1.00 0.00 H new ATOM 653 N GLY A 44 3.599 -16.501 4.571 1.00 0.00 N ATOM 654 CA GLY A 44 3.916 -16.357 3.192 1.00 0.00 C ATOM 655 C GLY A 44 2.699 -16.362 2.306 1.00 0.00 C ATOM 656 O GLY A 44 2.666 -17.065 1.298 1.00 0.00 O ATOM 0 H GLY A 44 3.293 -17.415 4.906 1.00 0.00 H new ATOM 0 HA2 GLY A 44 4.462 -15.425 3.046 1.00 0.00 H new ATOM 0 HA3 GLY A 44 4.581 -17.166 2.891 1.00 0.00 H new ATOM 660 N ASN A 45 2.133 -15.185 2.375 1.00 0.00 N ATOM 661 CA ASN A 45 1.381 -14.521 1.332 1.00 0.00 C ATOM 662 C ASN A 45 1.093 -13.184 1.953 1.00 0.00 C ATOM 663 O ASN A 45 0.128 -13.030 2.703 1.00 0.00 O ATOM 664 CB ASN A 45 0.066 -15.230 0.933 1.00 0.00 C ATOM 665 CG ASN A 45 -0.824 -15.674 2.105 1.00 0.00 C ATOM 666 OD1 ASN A 45 -0.235 -16.137 3.204 1.00 0.00 O flip ATOM 667 ND2 ASN A 45 -2.051 -15.650 1.996 1.00 0.00 N flip ATOM 0 H ASN A 45 2.188 -14.621 3.223 1.00 0.00 H new ATOM 0 HA ASN A 45 1.939 -14.492 0.396 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -0.510 -14.559 0.295 1.00 0.00 H new ATOM 0 HB3 ASN A 45 0.313 -16.106 0.334 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -2.480 -15.290 1.144 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -2.637 -15.990 2.758 1.00 0.00 H new ATOM 673 N LYS A 46 2.068 -12.321 1.861 1.00 0.00 N ATOM 674 CA LYS A 46 2.060 -11.128 2.669 1.00 0.00 C ATOM 675 C LYS A 46 3.272 -10.293 2.326 1.00 0.00 C ATOM 676 O LYS A 46 4.278 -10.839 1.875 1.00 0.00 O ATOM 677 CB LYS A 46 2.078 -11.515 4.157 1.00 0.00 C ATOM 678 CG LYS A 46 1.430 -10.492 5.067 1.00 0.00 C ATOM 679 CD LYS A 46 1.182 -11.061 6.455 1.00 0.00 C ATOM 680 CE LYS A 46 0.079 -12.099 6.443 1.00 0.00 C ATOM 681 NZ LYS A 46 -0.846 -11.952 7.600 1.00 0.00 N ATOM 0 H LYS A 46 2.872 -12.418 1.241 1.00 0.00 H new ATOM 0 HA LYS A 46 1.159 -10.548 2.471 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.568 -12.470 4.280 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.111 -11.663 4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 46 2.070 -9.613 5.142 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.486 -10.163 4.633 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.100 -11.509 6.834 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.916 -10.254 7.137 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.487 -12.014 5.515 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.520 -13.096 6.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.258 -12.878 7.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.320 -11.589 8.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -1.607 -11.287 7.354 1.00 0.00 H new ATOM 691 N PHE A 47 3.272 -9.045 2.746 1.00 0.00 N ATOM 692 CA PHE A 47 4.465 -8.226 2.674 1.00 0.00 C ATOM 693 C PHE A 47 4.236 -7.052 3.585 1.00 0.00 C ATOM 694 O PHE A 47 3.462 -6.173 3.256 1.00 0.00 O ATOM 695 CB PHE A 47 4.716 -7.765 1.224 1.00 0.00 C ATOM 696 CG PHE A 47 3.525 -7.967 0.324 1.00 0.00 C ATOM 697 CD1 PHE A 47 2.350 -7.267 0.543 1.00 0.00 C ATOM 698 CD2 PHE A 47 3.570 -8.886 -0.711 1.00 0.00 C ATOM 699 CE1 PHE A 47 1.245 -7.477 -0.252 1.00 0.00 C ATOM 700 CE2 PHE A 47 2.463 -9.105 -1.506 1.00 0.00 C ATOM 701 CZ PHE A 47 1.298 -8.400 -1.278 1.00 0.00 C ATOM 0 H PHE A 47 2.458 -8.575 3.142 1.00 0.00 H new ATOM 0 HA PHE A 47 5.348 -8.785 2.983 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.987 -6.709 1.227 1.00 0.00 H new ATOM 0 HB3 PHE A 47 5.567 -8.311 0.818 1.00 0.00 H new ATOM 0 HD1 PHE A 47 2.300 -6.548 1.347 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.480 -9.437 -0.898 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.337 -6.920 -0.073 1.00 0.00 H new ATOM 0 HE2 PHE A 47 2.508 -9.828 -2.307 1.00 0.00 H new ATOM 0 HZ PHE A 47 0.431 -8.570 -1.900 1.00 0.00 H new ATOM 710 N THR A 48 4.760 -7.132 4.803 1.00 0.00 N ATOM 711 CA THR A 48 4.315 -6.190 5.809 1.00 0.00 C ATOM 712 C THR A 48 5.142 -6.156 7.081 1.00 0.00 C ATOM 713 O THR A 48 4.826 -6.834 8.055 1.00 0.00 O ATOM 714 CB THR A 48 2.899 -6.574 6.186 1.00 0.00 C ATOM 715 OG1 THR A 48 2.406 -5.702 7.190 1.00 0.00 O ATOM 716 CG2 THR A 48 2.855 -7.991 6.675 1.00 0.00 C ATOM 0 H THR A 48 5.461 -7.808 5.104 1.00 0.00 H new ATOM 0 HA THR A 48 4.408 -5.198 5.367 1.00 0.00 H new ATOM 0 HB THR A 48 2.270 -6.488 5.300 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.354 -6.181 8.043 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.831 -8.252 6.942 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.206 -8.659 5.888 1.00 0.00 H new ATOM 0 HG23 THR A 48 3.496 -8.094 7.551 1.00 0.00 H new ATOM 724 N VAL A 49 5.991 -5.173 7.189 1.00 0.00 N ATOM 725 CA VAL A 49 6.695 -4.925 8.421 1.00 0.00 C ATOM 726 C VAL A 49 7.392 -3.591 8.309 1.00 0.00 C ATOM 727 O VAL A 49 8.345 -3.539 7.640 1.00 0.00 O ATOM 728 CB VAL A 49 7.825 -5.967 8.629 1.00 0.00 C ATOM 729 CG1 VAL A 49 8.752 -5.548 9.753 1.00 0.00 C ATOM 730 CG2 VAL A 49 7.341 -7.363 8.883 1.00 0.00 C ATOM 0 H VAL A 49 6.215 -4.525 6.434 1.00 0.00 H new ATOM 0 HA VAL A 49 5.974 -4.966 9.238 1.00 0.00 H new ATOM 0 HB VAL A 49 8.362 -5.988 7.681 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.535 -6.296 9.877 1.00 0.00 H new ATOM 0 HG12 VAL A 49 9.205 -4.586 9.512 1.00 0.00 H new ATOM 0 HG13 VAL A 49 8.184 -5.460 10.679 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.196 -8.026 9.017 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.727 -7.377 9.783 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.748 -7.703 8.034 1.00 0.00 H new ATOM 740 N LYS A 50 6.997 -2.497 8.871 1.00 0.00 N ATOM 741 CA LYS A 50 7.837 -1.335 8.633 1.00 0.00 C ATOM 742 C LYS A 50 7.505 -0.178 9.521 1.00 0.00 C ATOM 743 O LYS A 50 6.614 0.606 9.227 1.00 0.00 O ATOM 744 CB LYS A 50 7.775 -0.925 7.164 1.00 0.00 C ATOM 745 CG LYS A 50 6.453 -1.214 6.492 1.00 0.00 C ATOM 746 CD LYS A 50 6.612 -1.447 4.997 1.00 0.00 C ATOM 747 CE LYS A 50 5.320 -1.930 4.353 1.00 0.00 C ATOM 748 NZ LYS A 50 4.263 -0.885 4.358 1.00 0.00 N ATOM 0 H LYS A 50 6.171 -2.367 9.454 1.00 0.00 H new ATOM 0 HA LYS A 50 8.857 -1.629 8.882 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.982 0.142 7.088 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.566 -1.442 6.621 1.00 0.00 H new ATOM 0 HG2 LYS A 50 5.998 -2.093 6.949 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.772 -0.380 6.658 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.931 -0.521 4.518 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.399 -2.182 4.827 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.521 -2.236 3.326 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.959 -2.811 4.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.520 -1.146 5.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.678 0.028 4.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 3.850 -0.804 3.407 1.00 0.00 H new ATOM 758 N GLU A 51 8.295 0.012 10.541 1.00 0.00 N ATOM 759 CA GLU A 51 8.070 1.126 11.407 1.00 0.00 C ATOM 760 C GLU A 51 9.215 2.125 11.306 1.00 0.00 C ATOM 761 O GLU A 51 10.055 2.191 12.207 1.00 0.00 O ATOM 762 CB GLU A 51 7.986 0.610 12.852 1.00 0.00 C ATOM 763 CG GLU A 51 7.803 -0.899 12.980 1.00 0.00 C ATOM 764 CD GLU A 51 9.121 -1.658 12.958 1.00 0.00 C ATOM 765 OE1 GLU A 51 9.811 -1.653 11.916 1.00 0.00 O ATOM 766 OE2 GLU A 51 9.489 -2.242 13.997 1.00 0.00 O ATOM 0 H GLU A 51 9.087 -0.582 10.787 1.00 0.00 H new ATOM 0 HA GLU A 51 7.145 1.624 11.117 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.895 0.898 13.380 1.00 0.00 H new ATOM 0 HB3 GLU A 51 7.155 1.107 13.353 1.00 0.00 H new ATOM 0 HG2 GLU A 51 7.278 -1.119 13.910 1.00 0.00 H new ATOM 0 HG3 GLU A 51 7.171 -1.254 12.166 1.00 0.00 H new ATOM 771 N SER A 52 9.073 3.083 10.395 1.00 0.00 N ATOM 772 CA SER A 52 9.873 4.294 10.438 1.00 0.00 C ATOM 773 C SER A 52 9.341 5.320 9.470 1.00 0.00 C ATOM 774 O SER A 52 8.990 4.996 8.337 1.00 0.00 O ATOM 775 CB SER A 52 11.344 3.982 10.216 1.00 0.00 C ATOM 776 OG SER A 52 11.915 4.681 9.132 1.00 0.00 O ATOM 0 H SER A 52 8.411 3.041 9.620 1.00 0.00 H new ATOM 0 HA SER A 52 9.795 4.731 11.434 1.00 0.00 H new ATOM 0 HB2 SER A 52 11.898 4.222 11.124 1.00 0.00 H new ATOM 0 HB3 SER A 52 11.458 2.911 10.047 1.00 0.00 H new ATOM 0 HG SER A 52 12.888 4.562 9.142 1.00 0.00 H new ATOM 781 N SER A 53 9.210 6.535 9.969 1.00 0.00 N ATOM 782 CA SER A 53 8.744 7.669 9.200 1.00 0.00 C ATOM 783 C SER A 53 9.027 8.942 9.986 1.00 0.00 C ATOM 784 O SER A 53 9.466 8.871 11.138 1.00 0.00 O ATOM 785 CB SER A 53 7.254 7.561 8.838 1.00 0.00 C ATOM 786 OG SER A 53 7.051 6.659 7.762 1.00 0.00 O ATOM 0 H SER A 53 9.429 6.763 10.939 1.00 0.00 H new ATOM 0 HA SER A 53 9.282 7.690 8.252 1.00 0.00 H new ATOM 0 HB2 SER A 53 6.689 7.226 9.708 1.00 0.00 H new ATOM 0 HB3 SER A 53 6.870 8.545 8.568 1.00 0.00 H new ATOM 0 HG SER A 53 7.873 6.149 7.603 1.00 0.00 H new ATOM 791 N ASN A 54 8.916 10.079 9.317 1.00 0.00 N ATOM 792 CA ASN A 54 9.273 11.385 9.892 1.00 0.00 C ATOM 793 C ASN A 54 8.701 11.628 11.298 1.00 0.00 C ATOM 794 O ASN A 54 9.206 12.486 12.025 1.00 0.00 O ATOM 795 CB ASN A 54 8.796 12.514 8.973 1.00 0.00 C ATOM 796 CG ASN A 54 7.280 12.620 8.909 1.00 0.00 C ATOM 797 OD1 ASN A 54 6.599 11.713 8.427 1.00 0.00 O ATOM 798 ND2 ASN A 54 6.742 13.724 9.397 1.00 0.00 N ATOM 0 H ASN A 54 8.576 10.132 8.357 1.00 0.00 H new ATOM 0 HA ASN A 54 10.359 11.377 9.981 1.00 0.00 H new ATOM 0 HB2 ASN A 54 9.207 13.460 9.324 1.00 0.00 H new ATOM 0 HB3 ASN A 54 9.187 12.349 7.969 1.00 0.00 H new ATOM 0 HD21 ASN A 54 5.730 13.847 9.383 1.00 0.00 H new ATOM 0 HD22 ASN A 54 7.339 14.453 9.788 1.00 0.00 H new ATOM 804 N PHE A 55 7.618 10.952 11.660 1.00 0.00 N ATOM 805 CA PHE A 55 6.961 11.225 12.937 1.00 0.00 C ATOM 806 C PHE A 55 6.354 9.959 13.525 1.00 0.00 C ATOM 807 O PHE A 55 6.538 9.657 14.703 1.00 0.00 O ATOM 808 CB PHE A 55 5.870 12.281 12.736 1.00 0.00 C ATOM 809 CG PHE A 55 5.246 12.763 14.013 1.00 0.00 C ATOM 810 CD1 PHE A 55 6.030 13.272 15.035 1.00 0.00 C ATOM 811 CD2 PHE A 55 3.872 12.718 14.189 1.00 0.00 C ATOM 812 CE1 PHE A 55 5.457 13.723 16.208 1.00 0.00 C ATOM 813 CE2 PHE A 55 3.294 13.169 15.359 1.00 0.00 C ATOM 814 CZ PHE A 55 4.087 13.672 16.369 1.00 0.00 C ATOM 0 H PHE A 55 7.179 10.221 11.099 1.00 0.00 H new ATOM 0 HA PHE A 55 7.709 11.597 13.637 1.00 0.00 H new ATOM 0 HB2 PHE A 55 6.297 13.133 12.207 1.00 0.00 H new ATOM 0 HB3 PHE A 55 5.091 11.867 12.096 1.00 0.00 H new ATOM 0 HD1 PHE A 55 7.102 13.317 14.913 1.00 0.00 H new ATOM 0 HD2 PHE A 55 3.246 12.325 13.401 1.00 0.00 H new ATOM 0 HE1 PHE A 55 6.080 14.115 16.998 1.00 0.00 H new ATOM 0 HE2 PHE A 55 2.222 13.128 15.483 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.637 14.026 17.285 1.00 0.00 H new ATOM 823 N ARG A 56 5.677 9.202 12.684 1.00 0.00 N ATOM 824 CA ARG A 56 5.082 7.940 13.086 1.00 0.00 C ATOM 825 C ARG A 56 5.968 6.818 12.574 1.00 0.00 C ATOM 826 O ARG A 56 6.669 7.004 11.589 1.00 0.00 O ATOM 827 CB ARG A 56 3.678 7.810 12.483 1.00 0.00 C ATOM 828 CG ARG A 56 2.814 6.730 13.115 1.00 0.00 C ATOM 829 CD ARG A 56 1.646 6.359 12.213 1.00 0.00 C ATOM 830 NE ARG A 56 0.554 5.712 12.941 1.00 0.00 N ATOM 831 CZ ARG A 56 -0.482 5.115 12.346 1.00 0.00 C ATOM 832 NH1 ARG A 56 -0.445 4.851 11.045 1.00 0.00 N ATOM 833 NH2 ARG A 56 -1.533 4.737 13.061 1.00 0.00 N ATOM 0 H ARG A 56 5.523 9.443 11.705 1.00 0.00 H new ATOM 0 HA ARG A 56 4.998 7.891 14.172 1.00 0.00 H new ATOM 0 HB2 ARG A 56 3.166 8.768 12.578 1.00 0.00 H new ATOM 0 HB3 ARG A 56 3.773 7.603 11.417 1.00 0.00 H new ATOM 0 HG2 ARG A 56 3.420 5.845 13.312 1.00 0.00 H new ATOM 0 HG3 ARG A 56 2.437 7.079 14.077 1.00 0.00 H new ATOM 0 HD2 ARG A 56 1.269 7.258 11.725 1.00 0.00 H new ATOM 0 HD3 ARG A 56 1.998 5.692 11.426 1.00 0.00 H new ATOM 0 HE ARG A 56 0.586 5.717 13.960 1.00 0.00 H new ATOM 0 HH11 ARG A 56 0.377 5.104 10.496 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -1.238 4.395 10.594 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -1.551 4.902 14.067 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -2.323 4.281 12.605 1.00 0.00 H new ATOM 844 N ASN A 57 5.896 5.643 13.169 1.00 0.00 N ATOM 845 CA ASN A 57 6.623 4.513 12.642 1.00 0.00 C ATOM 846 C ASN A 57 6.029 3.242 13.139 1.00 0.00 C ATOM 847 O ASN A 57 6.428 2.677 14.156 1.00 0.00 O ATOM 848 CB ASN A 57 8.125 4.582 12.960 1.00 0.00 C ATOM 849 CG ASN A 57 8.455 5.086 14.354 1.00 0.00 C ATOM 850 OD1 ASN A 57 9.305 6.101 14.417 1.00 0.00 O flip ATOM 851 ND2 ASN A 57 7.980 4.562 15.361 1.00 0.00 N flip ATOM 0 H ASN A 57 5.348 5.451 14.007 1.00 0.00 H new ATOM 0 HA ASN A 57 6.534 4.544 11.556 1.00 0.00 H new ATOM 0 HB2 ASN A 57 8.555 3.588 12.836 1.00 0.00 H new ATOM 0 HB3 ASN A 57 8.608 5.231 12.230 1.00 0.00 H new ATOM 0 HD21 ASN A 57 7.328 3.782 15.271 1.00 0.00 H new ATOM 0 HD22 ASN A 57 8.238 4.907 16.285 1.00 0.00 H new ATOM 857 N ILE A 58 5.213 2.715 12.269 1.00 0.00 N ATOM 858 CA ILE A 58 4.718 1.395 12.355 1.00 0.00 C ATOM 859 C ILE A 58 3.934 1.140 11.102 1.00 0.00 C ATOM 860 O ILE A 58 2.989 1.873 10.796 1.00 0.00 O ATOM 861 CB ILE A 58 3.844 1.134 13.581 1.00 0.00 C ATOM 862 CG1 ILE A 58 3.249 -0.280 13.457 1.00 0.00 C ATOM 863 CG2 ILE A 58 2.787 2.220 13.731 1.00 0.00 C ATOM 864 CD1 ILE A 58 4.225 -1.361 13.852 1.00 0.00 C ATOM 0 H ILE A 58 4.869 3.224 11.454 1.00 0.00 H new ATOM 0 HA ILE A 58 5.566 0.718 12.462 1.00 0.00 H new ATOM 0 HB ILE A 58 4.437 1.175 14.495 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.361 -0.352 14.084 1.00 0.00 H new ATOM 0 HG13 ILE A 58 2.927 -0.445 12.429 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.176 2.014 14.610 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.274 3.188 13.846 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.153 2.236 12.844 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.751 -2.336 13.745 1.00 0.00 H new ATOM 0 HD12 ILE A 58 5.103 -1.312 13.208 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.527 -1.217 14.889 1.00 0.00 H new ATOM 875 N ASP A 59 4.258 0.097 10.416 1.00 0.00 N ATOM 876 CA ASP A 59 3.445 -0.283 9.309 1.00 0.00 C ATOM 877 C ASP A 59 3.528 -1.774 9.147 1.00 0.00 C ATOM 878 O ASP A 59 4.413 -2.304 8.485 1.00 0.00 O ATOM 879 CB ASP A 59 3.913 0.431 8.042 1.00 0.00 C ATOM 880 CG ASP A 59 2.985 0.223 6.859 1.00 0.00 C ATOM 881 OD1 ASP A 59 2.762 -0.936 6.456 1.00 0.00 O ATOM 882 OD2 ASP A 59 2.502 1.225 6.296 1.00 0.00 O ATOM 0 H ASP A 59 5.065 -0.500 10.596 1.00 0.00 H new ATOM 0 HA ASP A 59 2.409 0.005 9.487 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.998 1.499 8.245 1.00 0.00 H new ATOM 0 HB3 ASP A 59 4.910 0.076 7.780 1.00 0.00 H new ATOM 886 N VAL A 60 2.581 -2.444 9.744 1.00 0.00 N ATOM 887 CA VAL A 60 2.522 -3.887 9.681 1.00 0.00 C ATOM 888 C VAL A 60 1.062 -4.386 9.684 1.00 0.00 C ATOM 889 O VAL A 60 0.588 -4.915 10.694 1.00 0.00 O ATOM 890 CB VAL A 60 3.242 -4.489 10.911 1.00 0.00 C ATOM 891 CG1 VAL A 60 4.738 -4.256 10.853 1.00 0.00 C ATOM 892 CG2 VAL A 60 2.699 -3.915 12.222 1.00 0.00 C ATOM 0 H VAL A 60 1.831 -2.013 10.285 1.00 0.00 H new ATOM 0 HA VAL A 60 3.006 -4.201 8.756 1.00 0.00 H new ATOM 0 HB VAL A 60 3.047 -5.561 10.884 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.209 -4.693 11.734 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.144 -4.722 9.955 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.939 -3.185 10.828 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.230 -4.362 13.062 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.845 -2.835 12.234 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.635 -4.139 12.304 1.00 0.00 H new ATOM 902 N VAL A 61 0.506 -4.554 8.489 1.00 0.00 N ATOM 903 CA VAL A 61 -0.773 -5.251 8.280 1.00 0.00 C ATOM 904 C VAL A 61 -0.942 -5.500 6.784 1.00 0.00 C ATOM 905 O VAL A 61 -1.182 -4.559 6.037 1.00 0.00 O ATOM 906 CB VAL A 61 -2.041 -4.456 8.737 1.00 0.00 C ATOM 907 CG1 VAL A 61 -3.289 -5.308 8.552 1.00 0.00 C ATOM 908 CG2 VAL A 61 -1.977 -3.962 10.175 1.00 0.00 C ATOM 0 H VAL A 61 0.928 -4.210 7.627 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.716 -6.156 8.884 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.080 -3.570 8.103 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.165 -4.745 8.873 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -3.395 -5.575 7.500 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -3.202 -6.215 9.150 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.892 -3.421 10.415 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.872 -4.813 10.848 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.121 -3.298 10.294 1.00 0.00 H new ATOM 918 N PHE A 62 -0.938 -6.745 6.344 1.00 0.00 N ATOM 919 CA PHE A 62 -1.220 -7.024 4.937 1.00 0.00 C ATOM 920 C PHE A 62 -1.917 -8.343 4.764 1.00 0.00 C ATOM 921 O PHE A 62 -1.863 -9.224 5.623 1.00 0.00 O ATOM 922 CB PHE A 62 0.027 -7.042 4.049 1.00 0.00 C ATOM 923 CG PHE A 62 0.564 -5.694 3.674 1.00 0.00 C ATOM 924 CD1 PHE A 62 1.262 -4.966 4.596 1.00 0.00 C ATOM 925 CD2 PHE A 62 0.429 -5.191 2.392 1.00 0.00 C ATOM 926 CE1 PHE A 62 1.822 -3.757 4.283 1.00 0.00 C ATOM 927 CE2 PHE A 62 0.997 -3.977 2.051 1.00 0.00 C ATOM 928 CZ PHE A 62 1.696 -3.255 3.001 1.00 0.00 C ATOM 0 H PHE A 62 -0.748 -7.565 6.920 1.00 0.00 H new ATOM 0 HA PHE A 62 -1.860 -6.200 4.622 1.00 0.00 H new ATOM 0 HB2 PHE A 62 0.811 -7.597 4.563 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -0.205 -7.590 3.136 1.00 0.00 H new ATOM 0 HD1 PHE A 62 1.375 -5.355 5.597 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -0.124 -5.751 1.652 1.00 0.00 H new ATOM 0 HE1 PHE A 62 2.360 -3.198 5.034 1.00 0.00 H new ATOM 0 HE2 PHE A 62 0.895 -3.594 1.046 1.00 0.00 H new ATOM 0 HZ PHE A 62 2.141 -2.305 2.743 1.00 0.00 H new ATOM 937 N GLU A 63 -2.448 -8.503 3.583 1.00 0.00 N ATOM 938 CA GLU A 63 -3.036 -9.732 3.155 1.00 0.00 C ATOM 939 C GLU A 63 -2.385 -10.099 1.864 1.00 0.00 C ATOM 940 O GLU A 63 -1.767 -9.246 1.223 1.00 0.00 O ATOM 941 CB GLU A 63 -4.535 -9.553 2.966 1.00 0.00 C ATOM 942 CG GLU A 63 -5.321 -10.844 3.138 1.00 0.00 C ATOM 943 CD GLU A 63 -6.810 -10.610 3.260 1.00 0.00 C ATOM 944 OE1 GLU A 63 -7.233 -9.950 4.233 1.00 0.00 O ATOM 945 OE2 GLU A 63 -7.563 -11.078 2.383 1.00 0.00 O ATOM 0 H GLU A 63 -2.482 -7.764 2.880 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.889 -10.518 3.896 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.899 -8.816 3.682 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -4.723 -9.151 1.971 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.129 -11.497 2.287 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.965 -11.365 4.027 1.00 0.00 H new ATOM 950 N LEU A 64 -2.601 -11.328 1.448 1.00 0.00 N ATOM 951 CA LEU A 64 -2.217 -11.764 0.129 1.00 0.00 C ATOM 952 C LEU A 64 -2.698 -10.738 -0.901 1.00 0.00 C ATOM 953 O LEU A 64 -2.034 -10.502 -1.909 1.00 0.00 O ATOM 954 CB LEU A 64 -2.828 -13.139 -0.110 1.00 0.00 C ATOM 955 CG LEU A 64 -2.732 -13.692 -1.535 1.00 0.00 C ATOM 956 CD1 LEU A 64 -2.631 -15.208 -1.504 1.00 0.00 C ATOM 957 CD2 LEU A 64 -3.936 -13.276 -2.367 1.00 0.00 C ATOM 0 H LEU A 64 -3.047 -12.049 2.015 1.00 0.00 H new ATOM 0 HA LEU A 64 -1.134 -11.841 0.034 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.347 -13.848 0.564 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.881 -13.098 0.170 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.835 -13.278 -1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.563 -15.589 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.742 -15.502 -0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.516 -15.622 -1.020 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.841 -13.683 -3.374 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.847 -13.658 -1.906 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.985 -12.188 -2.418 1.00 0.00 H new ATOM 968 N GLY A 65 -3.759 -10.007 -0.535 1.00 0.00 N ATOM 969 CA GLY A 65 -4.195 -8.892 -1.341 1.00 0.00 C ATOM 970 C GLY A 65 -5.104 -7.901 -0.624 1.00 0.00 C ATOM 971 O GLY A 65 -6.292 -7.844 -0.933 1.00 0.00 O ATOM 0 H GLY A 65 -4.315 -10.175 0.304 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.316 -8.360 -1.705 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.719 -9.277 -2.216 1.00 0.00 H new ATOM 975 N VAL A 66 -4.534 -7.013 0.221 1.00 0.00 N ATOM 976 CA VAL A 66 -5.296 -5.853 0.754 1.00 0.00 C ATOM 977 C VAL A 66 -4.372 -4.705 1.196 1.00 0.00 C ATOM 978 O VAL A 66 -3.287 -4.930 1.731 1.00 0.00 O ATOM 979 CB VAL A 66 -6.175 -6.166 1.988 1.00 0.00 C ATOM 980 CG1 VAL A 66 -7.217 -5.075 2.162 1.00 0.00 C ATOM 981 CG2 VAL A 66 -6.848 -7.517 1.926 1.00 0.00 C ATOM 0 H VAL A 66 -3.569 -7.071 0.546 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.929 -5.578 -0.090 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.506 -6.197 2.848 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -7.835 -5.298 3.032 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -6.719 -4.116 2.306 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.846 -5.027 1.273 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -7.447 -7.667 2.824 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -7.493 -7.562 1.048 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.091 -8.298 1.861 1.00 0.00 H new ATOM 991 N ASP A 67 -4.922 -3.492 1.114 1.00 0.00 N ATOM 992 CA ASP A 67 -4.320 -2.265 1.634 1.00 0.00 C ATOM 993 C ASP A 67 -5.408 -1.504 2.413 1.00 0.00 C ATOM 994 O ASP A 67 -6.507 -2.033 2.597 1.00 0.00 O ATOM 995 CB ASP A 67 -3.703 -1.378 0.546 1.00 0.00 C ATOM 996 CG ASP A 67 -2.767 -0.310 1.104 1.00 0.00 C ATOM 997 OD1 ASP A 67 -2.535 -0.296 2.329 1.00 0.00 O ATOM 998 OD2 ASP A 67 -2.245 0.499 0.311 1.00 0.00 O ATOM 0 H ASP A 67 -5.826 -3.333 0.670 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.488 -2.537 2.284 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.152 -2.004 -0.156 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.502 -0.895 -0.017 1.00 0.00 H new ATOM 1002 N PHE A 68 -5.085 -0.367 2.990 1.00 0.00 N ATOM 1003 CA PHE A 68 -6.017 0.346 3.845 1.00 0.00 C ATOM 1004 C PHE A 68 -6.544 1.607 3.225 1.00 0.00 C ATOM 1005 O PHE A 68 -5.914 2.227 2.402 1.00 0.00 O ATOM 1006 CB PHE A 68 -5.332 0.745 5.121 1.00 0.00 C ATOM 1007 CG PHE A 68 -4.444 -0.322 5.642 1.00 0.00 C ATOM 1008 CD1 PHE A 68 -4.941 -1.302 6.476 1.00 0.00 C ATOM 1009 CD2 PHE A 68 -3.119 -0.365 5.258 1.00 0.00 C ATOM 1010 CE1 PHE A 68 -4.132 -2.316 6.918 1.00 0.00 C ATOM 1011 CE2 PHE A 68 -2.298 -1.375 5.704 1.00 0.00 C ATOM 1012 CZ PHE A 68 -2.811 -2.353 6.531 1.00 0.00 C ATOM 0 H PHE A 68 -4.179 0.088 2.883 1.00 0.00 H new ATOM 0 HA PHE A 68 -6.848 -0.338 4.015 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.748 1.649 4.949 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -6.083 0.989 5.873 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -5.976 -1.270 6.783 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.724 0.398 4.604 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -4.529 -3.083 7.567 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -1.259 -1.402 5.409 1.00 0.00 H new ATOM 0 HZ PHE A 68 -2.173 -3.152 6.877 1.00 0.00 H new ATOM 1021 N ALA A 69 -7.591 2.093 3.822 1.00 0.00 N ATOM 1022 CA ALA A 69 -8.118 3.382 3.484 1.00 0.00 C ATOM 1023 C ALA A 69 -8.024 4.347 4.684 1.00 0.00 C ATOM 1024 O ALA A 69 -8.808 4.262 5.628 1.00 0.00 O ATOM 1025 CB ALA A 69 -9.551 3.207 3.007 1.00 0.00 C ATOM 0 H ALA A 69 -8.104 1.607 4.557 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.529 3.828 2.682 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.969 4.179 2.745 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.566 2.558 2.132 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.147 2.758 3.802 1.00 0.00 H new ATOM 1031 N TYR A 70 -7.062 5.274 4.616 1.00 0.00 N ATOM 1032 CA TYR A 70 -6.817 6.283 5.621 1.00 0.00 C ATOM 1033 C TYR A 70 -5.873 7.259 4.993 1.00 0.00 C ATOM 1034 O TYR A 70 -5.356 6.983 3.935 1.00 0.00 O ATOM 1035 CB TYR A 70 -6.224 5.671 6.887 1.00 0.00 C ATOM 1036 CG TYR A 70 -4.811 5.129 6.752 1.00 0.00 C ATOM 1037 CD1 TYR A 70 -3.706 5.960 6.914 1.00 0.00 C ATOM 1038 CD2 TYR A 70 -4.581 3.787 6.474 1.00 0.00 C ATOM 1039 CE1 TYR A 70 -2.420 5.471 6.805 1.00 0.00 C ATOM 1040 CE2 TYR A 70 -3.294 3.291 6.363 1.00 0.00 C ATOM 1041 CZ TYR A 70 -2.218 4.136 6.530 1.00 0.00 C ATOM 1042 OH TYR A 70 -0.934 3.647 6.424 1.00 0.00 O ATOM 0 H TYR A 70 -6.417 5.334 3.828 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.742 6.769 5.932 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -6.231 6.427 7.673 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -6.875 4.862 7.218 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -3.858 7.007 7.129 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -5.420 3.120 6.342 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -1.576 6.132 6.935 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -3.133 2.245 6.146 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.965 2.687 6.228 1.00 0.00 H new ATOM 1051 N SER A 71 -5.679 8.420 5.538 1.00 0.00 N ATOM 1052 CA SER A 71 -4.855 9.339 4.828 1.00 0.00 C ATOM 1053 C SER A 71 -3.464 9.342 5.409 1.00 0.00 C ATOM 1054 O SER A 71 -3.278 9.540 6.610 1.00 0.00 O ATOM 1055 CB SER A 71 -5.451 10.720 4.789 1.00 0.00 C ATOM 1056 OG SER A 71 -4.623 11.607 4.066 1.00 0.00 O ATOM 0 H SER A 71 -6.060 8.741 6.428 1.00 0.00 H new ATOM 0 HA SER A 71 -4.792 9.008 3.792 1.00 0.00 H new ATOM 0 HB2 SER A 71 -6.438 10.681 4.329 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.587 11.090 5.805 1.00 0.00 H new ATOM 0 HG SER A 71 -5.178 12.190 3.506 1.00 0.00 H new ATOM 1061 N LEU A 72 -2.538 8.911 4.569 1.00 0.00 N ATOM 1062 CA LEU A 72 -1.142 8.673 4.960 1.00 0.00 C ATOM 1063 C LEU A 72 -0.549 9.828 5.776 1.00 0.00 C ATOM 1064 O LEU A 72 0.341 9.613 6.599 1.00 0.00 O ATOM 1065 CB LEU A 72 -0.280 8.405 3.717 1.00 0.00 C ATOM 1066 CG LEU A 72 -0.589 7.094 2.980 1.00 0.00 C ATOM 1067 CD1 LEU A 72 0.263 6.952 1.725 1.00 0.00 C ATOM 1068 CD2 LEU A 72 -0.363 5.905 3.900 1.00 0.00 C ATOM 0 H LEU A 72 -2.727 8.712 3.587 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.139 7.794 5.605 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.407 9.234 3.020 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.768 8.397 4.016 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.636 7.119 2.679 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.021 6.014 1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.060 7.785 1.052 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.318 6.956 1.999 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.586 4.983 3.364 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.676 5.892 4.229 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.017 5.987 4.768 1.00 0.00 H new ATOM 1079 N ALA A 73 -1.056 11.042 5.565 1.00 0.00 N ATOM 1080 CA ALA A 73 -0.599 12.207 6.317 1.00 0.00 C ATOM 1081 C ALA A 73 -1.609 13.348 6.217 1.00 0.00 C ATOM 1082 O ALA A 73 -1.254 14.479 5.879 1.00 0.00 O ATOM 1083 CB ALA A 73 0.770 12.662 5.827 1.00 0.00 C ATOM 0 H ALA A 73 -1.784 11.243 4.879 1.00 0.00 H new ATOM 0 HA ALA A 73 -0.511 11.919 7.365 1.00 0.00 H new ATOM 0 HB1 ALA A 73 1.091 13.531 6.401 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.490 11.854 5.958 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.709 12.927 4.771 1.00 0.00 H new ATOM 1089 N ASP A 74 -2.867 13.039 6.517 1.00 0.00 N ATOM 1090 CA ASP A 74 -3.944 14.028 6.478 1.00 0.00 C ATOM 1091 C ASP A 74 -5.194 13.430 7.138 1.00 0.00 C ATOM 1092 O ASP A 74 -5.080 12.726 8.146 1.00 0.00 O ATOM 1093 CB ASP A 74 -4.223 14.453 5.023 1.00 0.00 C ATOM 1094 CG ASP A 74 -4.866 15.826 4.897 1.00 0.00 C ATOM 1095 OD1 ASP A 74 -6.033 15.990 5.312 1.00 0.00 O ATOM 1096 OD2 ASP A 74 -4.212 16.748 4.363 1.00 0.00 O ATOM 0 H ASP A 74 -3.169 12.104 6.792 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.651 14.922 7.029 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.286 14.449 4.467 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.874 13.713 4.557 1.00 0.00 H new ATOM 1100 N GLY A 75 -6.371 13.692 6.579 1.00 0.00 N ATOM 1101 CA GLY A 75 -7.608 13.174 7.143 1.00 0.00 C ATOM 1102 C GLY A 75 -7.776 11.687 6.913 1.00 0.00 C ATOM 1103 O GLY A 75 -7.397 10.876 7.758 1.00 0.00 O ATOM 0 H GLY A 75 -6.492 14.258 5.739 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -7.627 13.377 8.214 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -8.453 13.704 6.703 1.00 0.00 H new ATOM 1107 N THR A 76 -8.246 11.324 5.729 1.00 0.00 N ATOM 1108 CA THR A 76 -8.393 9.929 5.345 1.00 0.00 C ATOM 1109 C THR A 76 -8.545 9.838 3.846 1.00 0.00 C ATOM 1110 O THR A 76 -9.466 10.409 3.264 1.00 0.00 O ATOM 1111 CB THR A 76 -9.606 9.265 6.032 1.00 0.00 C ATOM 1112 OG1 THR A 76 -10.539 10.271 6.458 1.00 0.00 O ATOM 1113 CG2 THR A 76 -9.180 8.417 7.221 1.00 0.00 C ATOM 0 H THR A 76 -8.535 11.986 5.009 1.00 0.00 H new ATOM 0 HA THR A 76 -7.499 9.395 5.668 1.00 0.00 H new ATOM 0 HB THR A 76 -10.084 8.608 5.305 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.307 9.843 6.891 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.060 7.965 7.680 1.00 0.00 H new ATOM 0 HG22 THR A 76 -8.503 7.632 6.884 1.00 0.00 H new ATOM 0 HG23 THR A 76 -8.672 9.045 7.952 1.00 0.00 H new ATOM 1121 N GLU A 77 -7.577 9.176 3.221 1.00 0.00 N ATOM 1122 CA GLU A 77 -7.503 9.064 1.782 1.00 0.00 C ATOM 1123 C GLU A 77 -6.562 7.961 1.407 1.00 0.00 C ATOM 1124 O GLU A 77 -5.379 8.227 1.184 1.00 0.00 O ATOM 1125 CB GLU A 77 -6.884 10.286 1.184 1.00 0.00 C ATOM 1126 CG GLU A 77 -7.282 11.595 1.779 1.00 0.00 C ATOM 1127 CD GLU A 77 -6.309 12.678 1.397 1.00 0.00 C ATOM 1128 OE1 GLU A 77 -6.052 12.837 0.185 1.00 0.00 O ATOM 1129 OE2 GLU A 77 -5.755 13.321 2.298 1.00 0.00 O ATOM 0 H GLU A 77 -6.819 8.701 3.710 1.00 0.00 H new ATOM 0 HA GLU A 77 -8.521 8.901 1.428 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.801 10.192 1.261 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.127 10.306 0.122 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.282 11.864 1.440 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -7.326 11.507 2.865 1.00 0.00 H new ATOM 1134 N LEU A 78 -7.076 6.781 1.175 1.00 0.00 N ATOM 1135 CA LEU A 78 -6.240 5.729 0.695 1.00 0.00 C ATOM 1136 C LEU A 78 -7.029 4.494 0.343 1.00 0.00 C ATOM 1137 O LEU A 78 -8.238 4.424 0.530 1.00 0.00 O ATOM 1138 CB LEU A 78 -5.133 5.442 1.714 1.00 0.00 C ATOM 1139 CG LEU A 78 -4.241 4.229 1.471 1.00 0.00 C ATOM 1140 CD1 LEU A 78 -3.340 4.445 0.261 1.00 0.00 C ATOM 1141 CD2 LEU A 78 -3.404 3.904 2.708 1.00 0.00 C ATOM 0 H LEU A 78 -8.056 6.533 1.310 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.772 6.055 -0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -4.493 6.323 1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -5.600 5.324 2.692 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.891 3.379 1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.715 3.565 0.111 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -3.954 4.610 -0.625 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.706 5.315 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.778 3.035 2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.772 4.757 2.954 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.064 3.688 3.548 1.00 0.00 H new ATOM 1152 N THR A 79 -6.338 3.639 -0.338 1.00 0.00 N ATOM 1153 CA THR A 79 -6.886 2.461 -0.936 1.00 0.00 C ATOM 1154 C THR A 79 -6.429 1.226 -0.279 1.00 0.00 C ATOM 1155 O THR A 79 -5.295 1.127 0.166 1.00 0.00 O ATOM 1156 CB THR A 79 -6.441 2.345 -2.392 1.00 0.00 C ATOM 1157 OG1 THR A 79 -5.298 1.480 -2.494 1.00 0.00 O ATOM 1158 CG2 THR A 79 -6.080 3.710 -2.975 1.00 0.00 C ATOM 0 H THR A 79 -5.337 3.744 -0.500 1.00 0.00 H new ATOM 0 HA THR A 79 -7.967 2.561 -0.838 1.00 0.00 H new ATOM 0 HB THR A 79 -7.276 1.930 -2.957 1.00 0.00 H new ATOM 0 HG1 THR A 79 -4.561 1.848 -1.963 1.00 0.00 H new ATOM 0 HG21 THR A 79 -5.768 3.591 -4.012 1.00 0.00 H new ATOM 0 HG22 THR A 79 -6.949 4.366 -2.931 1.00 0.00 H new ATOM 0 HG23 THR A 79 -5.265 4.148 -2.398 1.00 0.00 H new ATOM 1166 N GLY A 80 -7.214 0.207 -0.469 1.00 0.00 N ATOM 1167 CA GLY A 80 -6.783 -1.036 -0.044 1.00 0.00 C ATOM 1168 C GLY A 80 -6.832 -2.193 -0.983 1.00 0.00 C ATOM 1169 O GLY A 80 -7.652 -3.090 -0.785 1.00 0.00 O ATOM 0 H GLY A 80 -8.134 0.237 -0.909 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -5.750 -0.928 0.286 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.372 -1.303 0.834 1.00 0.00 H new ATOM 1173 N THR A 81 -5.639 -2.438 -1.478 1.00 0.00 N ATOM 1174 CA THR A 81 -5.224 -3.747 -1.836 1.00 0.00 C ATOM 1175 C THR A 81 -3.752 -3.704 -2.072 1.00 0.00 C ATOM 1176 O THR A 81 -3.219 -2.703 -2.527 1.00 0.00 O ATOM 1177 CB THR A 81 -5.877 -4.376 -3.066 1.00 0.00 C ATOM 1178 OG1 THR A 81 -7.218 -3.970 -3.155 1.00 0.00 O ATOM 1179 CG2 THR A 81 -5.880 -5.869 -2.941 1.00 0.00 C ATOM 0 H THR A 81 -4.935 -1.718 -1.639 1.00 0.00 H new ATOM 0 HA THR A 81 -5.537 -4.378 -1.004 1.00 0.00 H new ATOM 0 HB THR A 81 -5.313 -4.061 -3.944 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.621 -3.974 -2.262 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.348 -6.307 -3.823 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.855 -6.229 -2.857 1.00 0.00 H new ATOM 0 HG23 THR A 81 -6.440 -6.159 -2.052 1.00 0.00 H new ATOM 1187 N TRP A 82 -3.222 -4.869 -2.046 1.00 0.00 N ATOM 1188 CA TRP A 82 -1.925 -5.162 -2.569 1.00 0.00 C ATOM 1189 C TRP A 82 -1.857 -6.668 -2.782 1.00 0.00 C ATOM 1190 O TRP A 82 -1.830 -7.402 -1.803 1.00 0.00 O ATOM 1191 CB TRP A 82 -0.797 -4.809 -1.610 1.00 0.00 C ATOM 1192 CG TRP A 82 -0.503 -3.367 -1.486 1.00 0.00 C ATOM 1193 CD1 TRP A 82 -1.086 -2.502 -0.637 1.00 0.00 C ATOM 1194 CD2 TRP A 82 0.455 -2.630 -2.228 1.00 0.00 C ATOM 1195 NE1 TRP A 82 -0.577 -1.253 -0.816 1.00 0.00 N ATOM 1196 CE2 TRP A 82 0.393 -1.302 -1.780 1.00 0.00 C ATOM 1197 CE3 TRP A 82 1.356 -2.968 -3.228 1.00 0.00 C ATOM 1198 CZ2 TRP A 82 1.212 -0.305 -2.304 1.00 0.00 C ATOM 1199 CZ3 TRP A 82 2.170 -1.986 -3.745 1.00 0.00 C ATOM 1200 CH2 TRP A 82 2.099 -0.673 -3.283 1.00 0.00 C ATOM 0 H TRP A 82 -3.691 -5.682 -1.646 1.00 0.00 H new ATOM 0 HA TRP A 82 -1.795 -4.575 -3.479 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -1.046 -5.199 -0.623 1.00 0.00 H new ATOM 0 HB3 TRP A 82 0.108 -5.321 -1.936 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -1.848 -2.761 0.083 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -0.871 -0.416 -0.313 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.417 -3.982 -3.594 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.151 0.715 -1.954 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 2.876 -2.237 -4.522 1.00 0.00 H new ATOM 0 HH2 TRP A 82 2.757 0.072 -3.706 1.00 0.00 H new ATOM 1210 N THR A 83 -1.929 -7.144 -4.009 1.00 0.00 N ATOM 1211 CA THR A 83 -2.017 -8.579 -4.222 1.00 0.00 C ATOM 1212 C THR A 83 -0.893 -9.112 -5.096 1.00 0.00 C ATOM 1213 O THR A 83 -1.084 -9.322 -6.291 1.00 0.00 O ATOM 1214 CB THR A 83 -3.343 -8.939 -4.916 1.00 0.00 C ATOM 1215 OG1 THR A 83 -4.385 -8.054 -4.489 1.00 0.00 O ATOM 1216 CG2 THR A 83 -3.742 -10.376 -4.623 1.00 0.00 C ATOM 0 H THR A 83 -1.929 -6.576 -4.857 1.00 0.00 H new ATOM 0 HA THR A 83 -1.948 -9.032 -3.233 1.00 0.00 H new ATOM 0 HB THR A 83 -3.196 -8.832 -5.991 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.222 -8.293 -4.939 1.00 0.00 H new ATOM 0 HG21 THR A 83 -4.682 -10.602 -5.126 1.00 0.00 H new ATOM 0 HG22 THR A 83 -2.966 -11.050 -4.985 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.865 -10.508 -3.548 1.00 0.00 H new ATOM 1224 N MET A 84 0.120 -9.630 -4.454 1.00 0.00 N ATOM 1225 CA MET A 84 1.140 -10.409 -5.123 1.00 0.00 C ATOM 1226 C MET A 84 1.730 -11.416 -4.222 1.00 0.00 C ATOM 1227 O MET A 84 1.402 -11.524 -3.042 1.00 0.00 O ATOM 1228 CB MET A 84 2.288 -9.689 -5.752 1.00 0.00 C ATOM 1229 CG MET A 84 2.052 -9.407 -7.179 1.00 0.00 C ATOM 1230 SD MET A 84 0.895 -10.558 -7.987 1.00 0.00 S ATOM 1231 CE MET A 84 1.717 -12.144 -7.873 1.00 0.00 C ATOM 0 H MET A 84 0.266 -9.526 -3.450 1.00 0.00 H new ATOM 0 HA MET A 84 0.558 -10.832 -5.942 1.00 0.00 H new ATOM 0 HB2 MET A 84 2.462 -8.753 -5.222 1.00 0.00 H new ATOM 0 HB3 MET A 84 3.193 -10.288 -5.646 1.00 0.00 H new ATOM 0 HG2 MET A 84 1.666 -8.392 -7.278 1.00 0.00 H new ATOM 0 HG3 MET A 84 3.005 -9.438 -7.706 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.974 -12.941 -7.891 1.00 0.00 H new ATOM 0 HE2 MET A 84 2.397 -12.263 -8.717 1.00 0.00 H new ATOM 0 HE3 MET A 84 2.282 -12.195 -6.942 1.00 0.00 H new ATOM 1239 N GLU A 85 2.707 -12.056 -4.786 1.00 0.00 N ATOM 1240 CA GLU A 85 3.521 -12.945 -4.056 1.00 0.00 C ATOM 1241 C GLU A 85 4.718 -12.160 -3.587 1.00 0.00 C ATOM 1242 O GLU A 85 4.898 -11.016 -3.997 1.00 0.00 O ATOM 1243 CB GLU A 85 3.979 -14.085 -4.947 1.00 0.00 C ATOM 1244 CG GLU A 85 2.835 -14.879 -5.554 1.00 0.00 C ATOM 1245 CD GLU A 85 3.309 -16.015 -6.432 1.00 0.00 C ATOM 1246 OE1 GLU A 85 4.536 -16.172 -6.607 1.00 0.00 O ATOM 1247 OE2 GLU A 85 2.454 -16.753 -6.963 1.00 0.00 O ATOM 0 H GLU A 85 2.954 -11.968 -5.772 1.00 0.00 H new ATOM 0 HA GLU A 85 2.972 -13.369 -3.216 1.00 0.00 H new ATOM 0 HB2 GLU A 85 4.597 -13.682 -5.750 1.00 0.00 H new ATOM 0 HB3 GLU A 85 4.610 -14.758 -4.366 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.213 -15.280 -4.754 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.206 -14.210 -6.142 1.00 0.00 H new ATOM 1252 N GLY A 86 5.510 -12.716 -2.716 1.00 0.00 N ATOM 1253 CA GLY A 86 6.571 -11.927 -2.163 1.00 0.00 C ATOM 1254 C GLY A 86 7.777 -12.073 -3.029 1.00 0.00 C ATOM 1255 O GLY A 86 8.397 -13.136 -3.112 1.00 0.00 O ATOM 0 H GLY A 86 5.447 -13.678 -2.383 1.00 0.00 H new ATOM 0 HA2 GLY A 86 6.272 -10.880 -2.104 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.794 -12.252 -1.147 1.00 0.00 H new ATOM 1259 N ASN A 87 7.906 -11.042 -3.850 1.00 0.00 N ATOM 1260 CA ASN A 87 8.801 -11.001 -4.989 1.00 0.00 C ATOM 1261 C ASN A 87 8.381 -9.829 -5.852 1.00 0.00 C ATOM 1262 O ASN A 87 9.180 -9.252 -6.583 1.00 0.00 O ATOM 1263 CB ASN A 87 8.726 -12.296 -5.819 1.00 0.00 C ATOM 1264 CG ASN A 87 9.840 -12.411 -6.845 1.00 0.00 C ATOM 1265 OD1 ASN A 87 9.910 -11.639 -7.800 1.00 0.00 O ATOM 1266 ND2 ASN A 87 10.720 -13.381 -6.653 1.00 0.00 N ATOM 0 H ASN A 87 7.370 -10.182 -3.735 1.00 0.00 H new ATOM 0 HA ASN A 87 9.828 -10.897 -4.638 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.768 -13.154 -5.148 1.00 0.00 H new ATOM 0 HB3 ASN A 87 7.764 -12.338 -6.330 1.00 0.00 H new ATOM 0 HD21 ASN A 87 11.490 -13.508 -7.310 1.00 0.00 H new ATOM 0 HD22 ASN A 87 10.628 -14.001 -5.848 1.00 0.00 H new ATOM 1272 N LYS A 88 7.103 -9.471 -5.749 1.00 0.00 N ATOM 1273 CA LYS A 88 6.557 -8.399 -6.529 1.00 0.00 C ATOM 1274 C LYS A 88 5.256 -7.959 -5.897 1.00 0.00 C ATOM 1275 O LYS A 88 4.785 -8.590 -4.962 1.00 0.00 O ATOM 1276 CB LYS A 88 6.275 -8.849 -7.950 1.00 0.00 C ATOM 1277 CG LYS A 88 4.872 -9.404 -8.119 1.00 0.00 C ATOM 1278 CD LYS A 88 4.687 -10.780 -7.490 1.00 0.00 C ATOM 1279 CE LYS A 88 5.212 -11.873 -8.413 1.00 0.00 C ATOM 1280 NZ LYS A 88 4.930 -13.240 -7.909 1.00 0.00 N ATOM 0 H LYS A 88 6.434 -9.921 -5.124 1.00 0.00 H new ATOM 0 HA LYS A 88 7.279 -7.582 -6.556 1.00 0.00 H new ATOM 0 HB2 LYS A 88 6.413 -8.007 -8.628 1.00 0.00 H new ATOM 0 HB3 LYS A 88 7.000 -9.611 -8.237 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.159 -8.710 -7.674 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.638 -9.464 -9.182 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.211 -10.822 -6.535 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.631 -10.950 -7.282 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.763 -11.755 -9.399 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.288 -11.752 -8.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.756 -13.877 -8.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.746 -13.584 -7.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.090 -13.218 -7.297 1.00 0.00 H new ATOM 1290 N LEU A 89 4.762 -6.811 -6.287 1.00 0.00 N ATOM 1291 CA LEU A 89 3.544 -6.314 -5.709 1.00 0.00 C ATOM 1292 C LEU A 89 2.519 -5.977 -6.782 1.00 0.00 C ATOM 1293 O LEU A 89 2.865 -5.333 -7.768 1.00 0.00 O ATOM 1294 CB LEU A 89 3.840 -5.039 -4.918 1.00 0.00 C ATOM 1295 CG LEU A 89 4.415 -5.198 -3.529 1.00 0.00 C ATOM 1296 CD1 LEU A 89 4.473 -3.848 -2.822 1.00 0.00 C ATOM 1297 CD2 LEU A 89 3.605 -6.204 -2.736 1.00 0.00 C ATOM 0 H LEU A 89 5.181 -6.209 -6.996 1.00 0.00 H new ATOM 0 HA LEU A 89 3.141 -7.092 -5.061 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.534 -4.434 -5.502 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.913 -4.471 -4.836 1.00 0.00 H new ATOM 0 HG LEU A 89 5.434 -5.578 -3.608 1.00 0.00 H new ATOM 0 HD11 LEU A 89 4.889 -3.978 -1.823 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.104 -3.166 -3.392 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.468 -3.434 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.031 -6.308 -1.738 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.574 -5.859 -2.657 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.627 -7.169 -3.242 1.00 0.00 H new ATOM 1308 N VAL A 90 1.237 -6.230 -6.524 1.00 0.00 N ATOM 1309 CA VAL A 90 0.215 -5.664 -7.388 1.00 0.00 C ATOM 1310 C VAL A 90 -1.166 -5.809 -6.769 1.00 0.00 C ATOM 1311 O VAL A 90 -1.758 -6.874 -6.732 1.00 0.00 O ATOM 1312 CB VAL A 90 0.238 -6.277 -8.800 1.00 0.00 C ATOM 1313 CG1 VAL A 90 -0.046 -7.768 -8.783 1.00 0.00 C ATOM 1314 CG2 VAL A 90 -0.743 -5.549 -9.699 1.00 0.00 C ATOM 0 H VAL A 90 0.894 -6.802 -5.752 1.00 0.00 H new ATOM 0 HA VAL A 90 0.443 -4.603 -7.490 1.00 0.00 H new ATOM 0 HB VAL A 90 1.245 -6.153 -9.198 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.019 -8.155 -9.802 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.709 -8.275 -8.182 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.032 -7.946 -8.353 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.719 -5.990 -10.696 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.748 -5.637 -9.287 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -0.467 -4.496 -9.761 1.00 0.00 H new ATOM 1324 N GLY A 91 -1.644 -4.741 -6.220 1.00 0.00 N ATOM 1325 CA GLY A 91 -2.884 -4.785 -5.496 1.00 0.00 C ATOM 1326 C GLY A 91 -3.340 -3.425 -5.216 1.00 0.00 C ATOM 1327 O GLY A 91 -2.518 -2.524 -5.167 1.00 0.00 O ATOM 0 H GLY A 91 -1.199 -3.824 -6.256 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -3.636 -5.319 -6.077 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -2.752 -5.334 -4.564 1.00 0.00 H new ATOM 1331 N LYS A 92 -4.637 -3.223 -5.229 1.00 0.00 N ATOM 1332 CA LYS A 92 -5.113 -1.889 -5.215 1.00 0.00 C ATOM 1333 C LYS A 92 -6.583 -1.732 -4.907 1.00 0.00 C ATOM 1334 O LYS A 92 -7.426 -2.509 -5.350 1.00 0.00 O ATOM 1335 CB LYS A 92 -4.803 -1.334 -6.554 1.00 0.00 C ATOM 1336 CG LYS A 92 -5.583 -0.082 -6.888 1.00 0.00 C ATOM 1337 CD LYS A 92 -6.634 -0.250 -7.983 1.00 0.00 C ATOM 1338 CE LYS A 92 -6.902 -1.688 -8.348 1.00 0.00 C ATOM 1339 NZ LYS A 92 -5.947 -2.159 -9.381 1.00 0.00 N ATOM 0 H LYS A 92 -5.351 -3.951 -5.249 1.00 0.00 H new ATOM 0 HA LYS A 92 -4.621 -1.357 -4.401 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.737 -1.113 -6.608 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -5.010 -2.093 -7.309 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -6.076 0.273 -5.983 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -4.882 0.694 -7.194 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -7.565 0.212 -7.655 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -6.308 0.287 -8.873 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -6.821 -2.314 -7.459 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -7.923 -1.790 -8.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -5.812 -3.186 -9.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -6.325 -1.945 -10.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -5.034 -1.677 -9.256 1.00 0.00 H new ATOM 1349 N PHE A 93 -6.858 -0.557 -4.399 1.00 0.00 N ATOM 1350 CA PHE A 93 -8.188 -0.077 -4.138 1.00 0.00 C ATOM 1351 C PHE A 93 -8.224 1.359 -4.396 1.00 0.00 C ATOM 1352 O PHE A 93 -7.291 1.927 -4.958 1.00 0.00 O ATOM 1353 CB PHE A 93 -8.677 -0.296 -2.732 1.00 0.00 C ATOM 1354 CG PHE A 93 -9.743 -1.336 -2.634 1.00 0.00 C ATOM 1355 CD1 PHE A 93 -9.670 -2.462 -3.416 1.00 0.00 C ATOM 1356 CD2 PHE A 93 -10.811 -1.186 -1.770 1.00 0.00 C ATOM 1357 CE1 PHE A 93 -10.640 -3.438 -3.347 1.00 0.00 C ATOM 1358 CE2 PHE A 93 -11.791 -2.155 -1.689 1.00 0.00 C ATOM 1359 CZ PHE A 93 -11.705 -3.286 -2.480 1.00 0.00 C ATOM 0 H PHE A 93 -6.133 0.115 -4.147 1.00 0.00 H new ATOM 0 HA PHE A 93 -8.843 -0.651 -4.794 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -7.836 -0.587 -2.103 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -9.059 0.645 -2.337 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -8.840 -2.585 -4.096 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -10.880 -0.303 -1.152 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -10.568 -4.319 -3.968 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -12.622 -2.030 -1.010 1.00 0.00 H new ATOM 0 HZ PHE A 93 -12.468 -4.048 -2.420 1.00 0.00 H new ATOM 1368 N LYS A 94 -9.360 1.907 -4.151 1.00 0.00 N ATOM 1369 CA LYS A 94 -9.572 3.258 -4.355 1.00 0.00 C ATOM 1370 C LYS A 94 -9.395 4.009 -3.058 1.00 0.00 C ATOM 1371 O LYS A 94 -9.496 3.436 -1.976 1.00 0.00 O ATOM 1372 CB LYS A 94 -10.960 3.482 -4.863 1.00 0.00 C ATOM 1373 CG LYS A 94 -11.943 3.746 -3.755 1.00 0.00 C ATOM 1374 CD LYS A 94 -12.351 2.454 -3.047 1.00 0.00 C ATOM 1375 CE LYS A 94 -12.867 2.710 -1.637 1.00 0.00 C ATOM 1376 NZ LYS A 94 -11.768 2.990 -0.666 1.00 0.00 N ATOM 0 H LYS A 94 -10.172 1.401 -3.796 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.850 3.620 -5.087 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.959 4.326 -5.553 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.282 2.608 -5.429 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.503 4.434 -3.033 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.829 4.234 -4.162 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.123 1.951 -3.629 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.495 1.780 -3.002 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.556 3.554 -1.654 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.434 1.843 -1.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -12.132 3.581 0.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -11.410 2.094 -0.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -10.996 3.491 -1.150 1.00 0.00 H new ATOM 1386 N ARG A 95 -8.971 5.235 -3.194 1.00 0.00 N ATOM 1387 CA ARG A 95 -8.647 6.071 -2.044 1.00 0.00 C ATOM 1388 C ARG A 95 -9.824 6.251 -1.101 1.00 0.00 C ATOM 1389 O ARG A 95 -10.936 5.792 -1.358 1.00 0.00 O ATOM 1390 CB ARG A 95 -8.240 7.461 -2.482 1.00 0.00 C ATOM 1391 CG ARG A 95 -9.436 8.331 -2.875 1.00 0.00 C ATOM 1392 CD ARG A 95 -9.062 9.789 -2.970 1.00 0.00 C ATOM 1393 NE ARG A 95 -7.666 10.008 -3.331 1.00 0.00 N ATOM 1394 CZ ARG A 95 -6.875 10.830 -2.661 1.00 0.00 C ATOM 1395 NH1 ARG A 95 -7.223 11.218 -1.449 1.00 0.00 N ATOM 1396 NH2 ARG A 95 -5.697 11.188 -3.152 1.00 0.00 N ATOM 0 H ARG A 95 -8.837 5.692 -4.096 1.00 0.00 H new ATOM 0 HA ARG A 95 -7.835 5.553 -1.534 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.693 7.946 -1.674 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.557 7.385 -3.328 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -9.831 7.994 -3.833 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -10.232 8.207 -2.141 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -9.701 10.273 -3.709 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -9.262 10.270 -2.013 1.00 0.00 H new ATOM 0 HE ARG A 95 -7.284 9.507 -4.133 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -8.095 10.884 -1.037 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -6.620 11.852 -0.924 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -5.391 10.829 -4.056 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -5.097 11.822 -2.625 1.00 0.00 H new ATOM 1407 N VAL A 96 -9.598 7.100 -0.108 1.00 0.00 N ATOM 1408 CA VAL A 96 -10.674 7.454 0.832 1.00 0.00 C ATOM 1409 C VAL A 96 -11.362 8.759 0.466 1.00 0.00 C ATOM 1410 O VAL A 96 -12.530 8.952 0.806 1.00 0.00 O ATOM 1411 CB VAL A 96 -10.186 7.586 2.285 1.00 0.00 C ATOM 1412 CG1 VAL A 96 -11.339 7.900 3.231 1.00 0.00 C ATOM 1413 CG2 VAL A 96 -9.493 6.337 2.738 1.00 0.00 C ATOM 0 H VAL A 96 -8.702 7.553 0.073 1.00 0.00 H new ATOM 0 HA VAL A 96 -11.376 6.624 0.755 1.00 0.00 H new ATOM 0 HB VAL A 96 -9.477 8.413 2.310 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -10.961 7.987 4.250 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -11.806 8.840 2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -12.076 7.098 3.185 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.159 6.459 3.768 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -10.183 5.496 2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.632 6.146 2.098 1.00 0.00 H new ATOM 1423 N ASP A 97 -10.615 9.702 -0.114 1.00 0.00 N ATOM 1424 CA ASP A 97 -11.168 11.050 -0.345 1.00 0.00 C ATOM 1425 C ASP A 97 -12.504 10.949 -1.051 1.00 0.00 C ATOM 1426 O ASP A 97 -13.506 11.469 -0.561 1.00 0.00 O ATOM 1427 CB ASP A 97 -10.210 11.941 -1.130 1.00 0.00 C ATOM 1428 CG ASP A 97 -10.851 13.232 -1.598 1.00 0.00 C ATOM 1429 OD1 ASP A 97 -11.362 13.992 -0.752 1.00 0.00 O ATOM 1430 OD2 ASP A 97 -10.826 13.494 -2.815 1.00 0.00 O ATOM 0 H ASP A 97 -9.653 9.570 -0.426 1.00 0.00 H new ATOM 0 HA ASP A 97 -11.310 11.518 0.629 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -9.347 12.175 -0.506 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -9.838 11.392 -1.995 1.00 0.00 H new ATOM 1434 N ASN A 98 -12.576 10.018 -1.989 1.00 0.00 N ATOM 1435 CA ASN A 98 -13.869 9.599 -2.498 1.00 0.00 C ATOM 1436 C ASN A 98 -13.717 8.221 -3.102 1.00 0.00 C ATOM 1437 O ASN A 98 -14.077 7.220 -2.484 1.00 0.00 O ATOM 1438 CB ASN A 98 -14.448 10.618 -3.502 1.00 0.00 C ATOM 1439 CG ASN A 98 -13.613 10.792 -4.757 1.00 0.00 C ATOM 1440 OD1 ASN A 98 -12.398 10.960 -4.683 1.00 0.00 O ATOM 1441 ND2 ASN A 98 -14.251 10.734 -5.913 1.00 0.00 N ATOM 0 H ASN A 98 -11.772 9.548 -2.405 1.00 0.00 H new ATOM 0 HA ASN A 98 -14.589 9.555 -1.681 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -15.451 10.302 -3.787 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -14.547 11.584 -3.007 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -13.733 10.830 -6.787 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -15.261 10.593 -5.932 1.00 0.00 H new ATOM 1447 N GLY A 99 -12.980 8.159 -4.182 1.00 0.00 N ATOM 1448 CA GLY A 99 -12.568 6.894 -4.707 1.00 0.00 C ATOM 1449 C GLY A 99 -11.591 7.042 -5.834 1.00 0.00 C ATOM 1450 O GLY A 99 -11.992 7.178 -6.987 1.00 0.00 O ATOM 0 H GLY A 99 -12.657 8.970 -4.709 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.116 6.302 -3.911 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -13.442 6.345 -5.056 1.00 0.00 H new ATOM 1454 N LYS A 100 -10.332 6.791 -5.555 1.00 0.00 N ATOM 1455 CA LYS A 100 -9.392 6.618 -6.654 1.00 0.00 C ATOM 1456 C LYS A 100 -8.733 5.279 -6.510 1.00 0.00 C ATOM 1457 O LYS A 100 -7.861 5.111 -5.662 1.00 0.00 O ATOM 1458 CB LYS A 100 -8.277 7.664 -6.715 1.00 0.00 C ATOM 1459 CG LYS A 100 -8.496 8.984 -5.998 1.00 0.00 C ATOM 1460 CD LYS A 100 -9.709 9.766 -6.452 1.00 0.00 C ATOM 1461 CE LYS A 100 -9.660 11.183 -5.891 1.00 0.00 C ATOM 1462 NZ LYS A 100 -10.710 12.063 -6.472 1.00 0.00 N ATOM 0 H LYS A 100 -9.940 6.703 -4.617 1.00 0.00 H new ATOM 0 HA LYS A 100 -9.980 6.720 -7.566 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.372 7.211 -6.310 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.082 7.883 -7.765 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.588 8.789 -4.930 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.611 9.605 -6.134 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -9.743 9.799 -7.541 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -10.619 9.266 -6.119 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -9.780 11.146 -4.808 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -8.679 11.615 -6.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -10.476 13.057 -6.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -10.758 11.914 -7.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -11.630 11.834 -6.045 1.00 0.00 H new ATOM 1472 N GLU A 101 -9.170 4.317 -7.291 1.00 0.00 N ATOM 1473 CA GLU A 101 -8.671 2.977 -7.146 1.00 0.00 C ATOM 1474 C GLU A 101 -7.600 2.729 -8.196 1.00 0.00 C ATOM 1475 O GLU A 101 -7.908 2.520 -9.363 1.00 0.00 O ATOM 1476 CB GLU A 101 -9.807 1.937 -7.256 1.00 0.00 C ATOM 1477 CG GLU A 101 -10.404 1.762 -8.634 1.00 0.00 C ATOM 1478 CD GLU A 101 -11.672 0.936 -8.622 1.00 0.00 C ATOM 1479 OE1 GLU A 101 -12.154 0.593 -7.522 1.00 0.00 O ATOM 1480 OE2 GLU A 101 -12.199 0.631 -9.712 1.00 0.00 O ATOM 0 H GLU A 101 -9.865 4.440 -8.027 1.00 0.00 H new ATOM 0 HA GLU A 101 -8.235 2.867 -6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.426 0.973 -6.920 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.603 2.222 -6.569 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -10.618 2.742 -9.060 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -9.671 1.285 -9.285 1.00 0.00 H new ATOM 1485 N LEU A 102 -6.344 2.762 -7.767 1.00 0.00 N ATOM 1486 CA LEU A 102 -5.193 2.487 -8.635 1.00 0.00 C ATOM 1487 C LEU A 102 -3.923 2.417 -7.830 1.00 0.00 C ATOM 1488 O LEU A 102 -3.636 3.306 -7.075 1.00 0.00 O ATOM 1489 CB LEU A 102 -5.062 3.500 -9.758 1.00 0.00 C ATOM 1490 CG LEU A 102 -5.865 3.139 -10.990 1.00 0.00 C ATOM 1491 CD1 LEU A 102 -5.356 3.870 -12.213 1.00 0.00 C ATOM 1492 CD2 LEU A 102 -5.819 1.626 -11.197 1.00 0.00 C ATOM 0 H LEU A 102 -6.088 2.981 -6.804 1.00 0.00 H new ATOM 0 HA LEU A 102 -5.368 1.516 -9.099 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -5.385 4.476 -9.396 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -4.011 3.593 -10.033 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.899 3.449 -10.840 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.954 3.589 -13.080 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.433 4.945 -12.052 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.314 3.603 -12.389 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.396 1.362 -12.083 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -4.785 1.308 -11.330 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.243 1.127 -10.326 1.00 0.00 H new ATOM 1503 N ILE A 103 -3.245 1.304 -7.917 1.00 0.00 N ATOM 1504 CA ILE A 103 -1.990 1.086 -7.221 1.00 0.00 C ATOM 1505 C ILE A 103 -1.424 -0.276 -7.652 1.00 0.00 C ATOM 1506 O ILE A 103 -2.135 -1.270 -7.540 1.00 0.00 O ATOM 1507 CB ILE A 103 -2.181 1.146 -5.664 1.00 0.00 C ATOM 1508 CG1 ILE A 103 -1.848 2.549 -5.131 1.00 0.00 C ATOM 1509 CG2 ILE A 103 -1.293 0.130 -4.955 1.00 0.00 C ATOM 1510 CD1 ILE A 103 -2.466 2.840 -3.787 1.00 0.00 C ATOM 0 H ILE A 103 -3.547 0.508 -8.479 1.00 0.00 H new ATOM 0 HA ILE A 103 -1.289 1.878 -7.484 1.00 0.00 H new ATOM 0 HB ILE A 103 -3.225 0.910 -5.460 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.766 2.654 -5.055 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -2.191 3.294 -5.849 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.450 0.198 -3.879 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.545 -0.874 -5.296 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -0.248 0.338 -5.183 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -2.191 3.846 -3.470 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -3.551 2.767 -3.862 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -2.104 2.117 -3.056 1.00 0.00 H new ATOM 1521 N ALA A 104 -0.219 -0.366 -8.210 1.00 0.00 N ATOM 1522 CA ALA A 104 0.273 -1.694 -8.597 1.00 0.00 C ATOM 1523 C ALA A 104 1.739 -1.737 -8.986 1.00 0.00 C ATOM 1524 O ALA A 104 2.079 -1.469 -10.140 1.00 0.00 O ATOM 1525 CB ALA A 104 -0.562 -2.233 -9.736 1.00 0.00 C ATOM 0 H ALA A 104 0.409 0.416 -8.399 1.00 0.00 H new ATOM 0 HA ALA A 104 0.179 -2.315 -7.706 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -0.195 -3.219 -10.022 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -1.602 -2.311 -9.420 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -0.492 -1.559 -10.589 1.00 0.00 H new ATOM 1531 N VAL A 105 2.591 -2.213 -8.082 1.00 0.00 N ATOM 1532 CA VAL A 105 3.971 -2.484 -8.427 1.00 0.00 C ATOM 1533 C VAL A 105 4.647 -3.148 -7.251 1.00 0.00 C ATOM 1534 O VAL A 105 4.404 -2.717 -6.122 1.00 0.00 O ATOM 1535 CB VAL A 105 4.705 -1.181 -8.757 1.00 0.00 C ATOM 1536 CG1 VAL A 105 4.866 -0.394 -7.490 1.00 0.00 C ATOM 1537 CG2 VAL A 105 6.037 -1.437 -9.439 1.00 0.00 C ATOM 0 H VAL A 105 2.346 -2.416 -7.113 1.00 0.00 H new ATOM 0 HA VAL A 105 3.999 -3.136 -9.300 1.00 0.00 H new ATOM 0 HB VAL A 105 4.116 -0.604 -9.469 1.00 0.00 H new ATOM 0 HG11 VAL A 105 5.387 0.539 -7.705 1.00 0.00 H new ATOM 0 HG12 VAL A 105 3.884 -0.173 -7.072 1.00 0.00 H new ATOM 0 HG13 VAL A 105 5.444 -0.975 -6.771 1.00 0.00 H new ATOM 0 HG21 VAL A 105 6.524 -0.486 -9.655 1.00 0.00 H new ATOM 0 HG22 VAL A 105 6.674 -2.030 -8.782 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.871 -1.979 -10.370 1.00 0.00 H new ATOM 1547 N ARG A 106 5.725 -3.883 -7.476 1.00 0.00 N ATOM 1548 CA ARG A 106 6.585 -4.060 -6.345 1.00 0.00 C ATOM 1549 C ARG A 106 7.718 -3.131 -6.489 1.00 0.00 C ATOM 1550 O ARG A 106 8.214 -2.856 -7.580 1.00 0.00 O ATOM 1551 CB ARG A 106 7.174 -5.448 -6.074 1.00 0.00 C ATOM 1552 CG ARG A 106 7.923 -5.538 -4.748 1.00 0.00 C ATOM 1553 CD ARG A 106 7.266 -6.575 -3.854 1.00 0.00 C ATOM 1554 NE ARG A 106 7.448 -6.397 -2.381 1.00 0.00 N ATOM 1555 CZ ARG A 106 7.222 -5.262 -1.676 1.00 0.00 C ATOM 1556 NH1 ARG A 106 7.288 -4.089 -2.246 1.00 0.00 N ATOM 1557 NH2 ARG A 106 7.012 -5.284 -0.363 1.00 0.00 N ATOM 0 H ARG A 106 6.000 -4.326 -8.352 1.00 0.00 H new ATOM 0 HA ARG A 106 5.925 -3.879 -5.497 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.370 -6.184 -6.080 1.00 0.00 H new ATOM 0 HB3 ARG A 106 7.853 -5.712 -6.885 1.00 0.00 H new ATOM 0 HG2 ARG A 106 8.965 -5.806 -4.926 1.00 0.00 H new ATOM 0 HG3 ARG A 106 7.923 -4.567 -4.254 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.197 -6.581 -4.067 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.652 -7.557 -4.129 1.00 0.00 H new ATOM 0 HE ARG A 106 7.774 -7.208 -1.856 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.513 -4.016 -3.238 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.115 -3.246 -1.699 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.018 -6.171 0.140 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.845 -4.413 0.141 1.00 0.00 H new ATOM 1568 N GLU A 107 8.207 -2.806 -5.370 1.00 0.00 N ATOM 1569 CA GLU A 107 9.372 -2.036 -5.263 1.00 0.00 C ATOM 1570 C GLU A 107 10.540 -2.978 -5.056 1.00 0.00 C ATOM 1571 O GLU A 107 10.677 -3.541 -3.982 1.00 0.00 O ATOM 1572 CB GLU A 107 9.200 -1.119 -4.055 1.00 0.00 C ATOM 1573 CG GLU A 107 8.034 -1.523 -3.176 1.00 0.00 C ATOM 1574 CD GLU A 107 8.195 -1.090 -1.736 1.00 0.00 C ATOM 1575 OE1 GLU A 107 8.797 -0.026 -1.496 1.00 0.00 O ATOM 1576 OE2 GLU A 107 7.724 -1.823 -0.840 1.00 0.00 O ATOM 0 H GLU A 107 7.799 -3.074 -4.474 1.00 0.00 H new ATOM 0 HA GLU A 107 9.554 -1.438 -6.156 1.00 0.00 H new ATOM 0 HB2 GLU A 107 10.116 -1.128 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 107 9.053 -0.095 -4.399 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.118 -1.091 -3.578 1.00 0.00 H new ATOM 0 HG3 GLU A 107 7.918 -2.606 -3.212 1.00 0.00 H new ATOM 1581 N ILE A 108 11.299 -3.218 -6.133 1.00 0.00 N ATOM 1582 CA ILE A 108 12.437 -4.134 -6.137 1.00 0.00 C ATOM 1583 C ILE A 108 13.253 -3.928 -7.424 1.00 0.00 C ATOM 1584 O ILE A 108 12.682 -3.987 -8.516 1.00 0.00 O ATOM 1585 CB ILE A 108 12.013 -5.637 -6.118 1.00 0.00 C ATOM 1586 CG1 ILE A 108 11.226 -6.010 -4.858 1.00 0.00 C ATOM 1587 CG2 ILE A 108 13.242 -6.511 -6.263 1.00 0.00 C ATOM 1588 CD1 ILE A 108 11.081 -7.500 -4.621 1.00 0.00 C ATOM 0 H ILE A 108 11.134 -2.773 -7.036 1.00 0.00 H new ATOM 0 HA ILE A 108 13.007 -3.913 -5.235 1.00 0.00 H new ATOM 0 HB ILE A 108 11.342 -5.804 -6.961 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.718 -5.564 -3.993 1.00 0.00 H new ATOM 0 HG13 ILE A 108 10.232 -5.567 -4.922 1.00 0.00 H new ATOM 0 HG21 ILE A 108 12.946 -7.560 -6.250 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.739 -6.286 -7.207 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.926 -6.317 -5.437 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.510 -7.669 -3.708 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.560 -7.953 -5.464 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.069 -7.950 -4.520 1.00 0.00 H new ATOM 1599 N SER A 109 14.581 -3.782 -7.319 1.00 0.00 N ATOM 1600 CA SER A 109 15.425 -3.724 -8.517 1.00 0.00 C ATOM 1601 C SER A 109 16.885 -3.824 -8.110 1.00 0.00 C ATOM 1602 O SER A 109 17.424 -2.864 -7.568 1.00 0.00 O ATOM 1603 CB SER A 109 15.176 -2.413 -9.280 1.00 0.00 C ATOM 1604 OG SER A 109 15.800 -2.430 -10.553 1.00 0.00 O ATOM 0 H SER A 109 15.085 -3.703 -6.435 1.00 0.00 H new ATOM 0 HA SER A 109 15.175 -4.558 -9.173 1.00 0.00 H new ATOM 0 HB2 SER A 109 14.104 -2.258 -9.401 1.00 0.00 H new ATOM 0 HB3 SER A 109 15.556 -1.573 -8.698 1.00 0.00 H new ATOM 0 HG SER A 109 15.623 -1.584 -11.015 1.00 0.00 H new ATOM 1609 N GLY A 110 17.496 -5.000 -8.280 1.00 0.00 N ATOM 1610 CA GLY A 110 18.823 -5.218 -7.710 1.00 0.00 C ATOM 1611 C GLY A 110 18.737 -5.021 -6.214 1.00 0.00 C ATOM 1612 O GLY A 110 17.970 -5.732 -5.558 1.00 0.00 O ATOM 0 H GLY A 110 17.106 -5.792 -8.792 1.00 0.00 H new ATOM 0 HA2 GLY A 110 19.174 -6.224 -7.941 1.00 0.00 H new ATOM 0 HA3 GLY A 110 19.541 -4.522 -8.144 1.00 0.00 H new ATOM 1616 N ASN A 111 19.096 -3.818 -5.800 1.00 0.00 N ATOM 1617 CA ASN A 111 18.547 -3.305 -4.565 1.00 0.00 C ATOM 1618 C ASN A 111 18.262 -1.821 -4.736 1.00 0.00 C ATOM 1619 O ASN A 111 19.146 -0.968 -4.734 1.00 0.00 O ATOM 1620 CB ASN A 111 19.459 -3.580 -3.353 1.00 0.00 C ATOM 1621 CG ASN A 111 20.820 -2.907 -3.431 1.00 0.00 C ATOM 1622 OD1 ASN A 111 21.598 -3.140 -4.358 1.00 0.00 O ATOM 1623 ND2 ASN A 111 21.126 -2.078 -2.442 1.00 0.00 N ATOM 0 H ASN A 111 19.744 -3.198 -6.285 1.00 0.00 H new ATOM 0 HA ASN A 111 17.616 -3.830 -4.351 1.00 0.00 H new ATOM 0 HB2 ASN A 111 18.952 -3.245 -2.448 1.00 0.00 H new ATOM 0 HB3 ASN A 111 19.603 -4.656 -3.258 1.00 0.00 H new ATOM 0 HD21 ASN A 111 22.031 -1.608 -2.432 1.00 0.00 H new ATOM 0 HD22 ASN A 111 20.456 -1.910 -1.692 1.00 0.00 H new ATOM 1629 N GLU A 112 17.003 -1.584 -5.018 1.00 0.00 N ATOM 1630 CA GLU A 112 16.443 -0.283 -5.312 1.00 0.00 C ATOM 1631 C GLU A 112 14.950 -0.491 -5.345 1.00 0.00 C ATOM 1632 O GLU A 112 14.507 -1.506 -5.868 1.00 0.00 O ATOM 1633 CB GLU A 112 16.944 0.229 -6.668 1.00 0.00 C ATOM 1634 CG GLU A 112 15.942 1.101 -7.409 1.00 0.00 C ATOM 1635 CD GLU A 112 16.403 1.466 -8.804 1.00 0.00 C ATOM 1636 OE1 GLU A 112 17.579 1.204 -9.135 1.00 0.00 O ATOM 1637 OE2 GLU A 112 15.597 2.028 -9.577 1.00 0.00 O ATOM 0 H GLU A 112 16.306 -2.328 -5.051 1.00 0.00 H new ATOM 0 HA GLU A 112 16.735 0.460 -4.570 1.00 0.00 H new ATOM 0 HB2 GLU A 112 17.861 0.798 -6.514 1.00 0.00 H new ATOM 0 HB3 GLU A 112 17.200 -0.625 -7.295 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.988 0.578 -7.472 1.00 0.00 H new ATOM 0 HG3 GLU A 112 15.768 2.013 -6.838 1.00 0.00 H new ATOM 1642 N LEU A 113 14.168 0.320 -4.680 1.00 0.00 N ATOM 1643 CA LEU A 113 12.763 0.004 -4.635 1.00 0.00 C ATOM 1644 C LEU A 113 11.930 1.011 -5.406 1.00 0.00 C ATOM 1645 O LEU A 113 12.421 2.055 -5.816 1.00 0.00 O ATOM 1646 CB LEU A 113 12.299 -0.178 -3.202 1.00 0.00 C ATOM 1647 CG LEU A 113 12.210 -1.655 -2.819 1.00 0.00 C ATOM 1648 CD1 LEU A 113 13.575 -2.293 -2.648 1.00 0.00 C ATOM 1649 CD2 LEU A 113 11.337 -1.879 -1.606 1.00 0.00 C ATOM 0 H LEU A 113 14.459 1.163 -4.185 1.00 0.00 H new ATOM 0 HA LEU A 113 12.613 -0.949 -5.141 1.00 0.00 H new ATOM 0 HB2 LEU A 113 12.989 0.331 -2.529 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.323 0.291 -3.073 1.00 0.00 H new ATOM 0 HG LEU A 113 11.729 -2.157 -3.659 1.00 0.00 H new ATOM 0 HD11 LEU A 113 13.455 -3.342 -2.376 1.00 0.00 H new ATOM 0 HD12 LEU A 113 14.130 -2.222 -3.584 1.00 0.00 H new ATOM 0 HD13 LEU A 113 14.123 -1.775 -1.861 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.305 -2.943 -1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.748 -1.334 -0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 113 10.328 -1.522 -1.813 1.00 0.00 H new ATOM 1660 N ILE A 114 10.719 0.597 -5.736 1.00 0.00 N ATOM 1661 CA ILE A 114 9.844 1.341 -6.619 1.00 0.00 C ATOM 1662 C ILE A 114 8.419 1.202 -6.142 1.00 0.00 C ATOM 1663 O ILE A 114 7.751 0.217 -6.447 1.00 0.00 O ATOM 1664 CB ILE A 114 9.890 0.770 -8.048 1.00 0.00 C ATOM 1665 CG1 ILE A 114 11.291 0.249 -8.378 1.00 0.00 C ATOM 1666 CG2 ILE A 114 9.456 1.827 -9.055 1.00 0.00 C ATOM 1667 CD1 ILE A 114 11.361 -0.569 -9.643 1.00 0.00 C ATOM 0 H ILE A 114 10.313 -0.274 -5.394 1.00 0.00 H new ATOM 0 HA ILE A 114 10.174 2.380 -6.616 1.00 0.00 H new ATOM 0 HB ILE A 114 9.196 -0.068 -8.107 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.970 1.097 -8.468 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.647 -0.358 -7.545 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.494 1.409 -10.061 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.438 2.145 -8.832 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.126 2.685 -8.994 1.00 0.00 H new ATOM 0 HD11 ILE A 114 12.387 -0.900 -9.806 1.00 0.00 H new ATOM 0 HD12 ILE A 114 10.709 -1.438 -9.551 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.038 0.039 -10.488 1.00 0.00 H new ATOM 1678 N GLN A 115 7.915 2.215 -5.501 1.00 0.00 N ATOM 1679 CA GLN A 115 6.545 2.198 -5.081 1.00 0.00 C ATOM 1680 C GLN A 115 5.768 3.050 -6.030 1.00 0.00 C ATOM 1681 O GLN A 115 5.798 4.273 -5.960 1.00 0.00 O ATOM 1682 CB GLN A 115 6.383 2.734 -3.662 1.00 0.00 C ATOM 1683 CG GLN A 115 6.809 1.772 -2.566 1.00 0.00 C ATOM 1684 CD GLN A 115 6.842 2.455 -1.211 1.00 0.00 C ATOM 1685 OE1 GLN A 115 5.824 2.930 -0.714 1.00 0.00 O ATOM 1686 NE2 GLN A 115 8.019 2.542 -0.618 1.00 0.00 N ATOM 0 H GLN A 115 8.430 3.061 -5.258 1.00 0.00 H new ATOM 0 HA GLN A 115 6.182 1.170 -5.083 1.00 0.00 H new ATOM 0 HB2 GLN A 115 6.963 3.652 -3.567 1.00 0.00 H new ATOM 0 HB3 GLN A 115 5.338 3.000 -3.506 1.00 0.00 H new ATOM 0 HG2 GLN A 115 6.120 0.928 -2.533 1.00 0.00 H new ATOM 0 HG3 GLN A 115 7.795 1.370 -2.796 1.00 0.00 H new ATOM 0 HE21 GLN A 115 8.844 2.136 -1.060 1.00 0.00 H new ATOM 0 HE22 GLN A 115 8.103 3.015 0.282 1.00 0.00 H new ATOM 1693 N THR A 116 5.072 2.395 -6.907 1.00 0.00 N ATOM 1694 CA THR A 116 4.291 3.058 -7.888 1.00 0.00 C ATOM 1695 C THR A 116 2.859 3.066 -7.415 1.00 0.00 C ATOM 1696 O THR A 116 2.193 2.030 -7.390 1.00 0.00 O ATOM 1697 CB THR A 116 4.373 2.355 -9.254 1.00 0.00 C ATOM 1698 OG1 THR A 116 5.735 2.095 -9.588 1.00 0.00 O ATOM 1699 CG2 THR A 116 3.742 3.211 -10.317 1.00 0.00 C ATOM 0 H THR A 116 5.034 1.377 -6.957 1.00 0.00 H new ATOM 0 HA THR A 116 4.672 4.071 -8.017 1.00 0.00 H new ATOM 0 HB THR A 116 3.833 1.410 -9.194 1.00 0.00 H new ATOM 0 HG1 THR A 116 5.774 1.435 -10.311 1.00 0.00 H new ATOM 0 HG21 THR A 116 3.806 2.703 -11.279 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.695 3.387 -10.069 1.00 0.00 H new ATOM 0 HG23 THR A 116 4.266 4.165 -10.375 1.00 0.00 H new ATOM 1707 N TYR A 117 2.380 4.233 -7.063 1.00 0.00 N ATOM 1708 CA TYR A 117 1.016 4.362 -6.641 1.00 0.00 C ATOM 1709 C TYR A 117 0.251 4.959 -7.791 1.00 0.00 C ATOM 1710 O TYR A 117 0.842 5.566 -8.676 1.00 0.00 O ATOM 1711 CB TYR A 117 0.822 5.299 -5.442 1.00 0.00 C ATOM 1712 CG TYR A 117 1.666 5.064 -4.187 1.00 0.00 C ATOM 1713 CD1 TYR A 117 3.045 5.309 -4.149 1.00 0.00 C ATOM 1714 CD2 TYR A 117 1.050 4.687 -2.997 1.00 0.00 C ATOM 1715 CE1 TYR A 117 3.764 5.166 -2.980 1.00 0.00 C ATOM 1716 CE2 TYR A 117 1.769 4.563 -1.820 1.00 0.00 C ATOM 1717 CZ TYR A 117 3.127 4.799 -1.820 1.00 0.00 C ATOM 1718 OH TYR A 117 3.844 4.714 -0.644 1.00 0.00 O ATOM 0 H TYR A 117 2.915 5.101 -7.062 1.00 0.00 H new ATOM 0 HA TYR A 117 0.674 3.371 -6.342 1.00 0.00 H new ATOM 0 HB2 TYR A 117 1.011 6.317 -5.783 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -0.227 5.251 -5.150 1.00 0.00 H new ATOM 0 HD1 TYR A 117 3.554 5.615 -5.051 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -0.011 4.487 -2.992 1.00 0.00 H new ATOM 0 HE1 TYR A 117 4.829 5.343 -2.977 1.00 0.00 H new ATOM 0 HE2 TYR A 117 1.268 4.282 -0.906 1.00 0.00 H new ATOM 0 HH TYR A 117 4.408 3.912 -0.662 1.00 0.00 H new ATOM 1727 N THR A 118 -1.049 4.822 -7.758 1.00 0.00 N ATOM 1728 CA THR A 118 -1.893 5.291 -8.828 1.00 0.00 C ATOM 1729 C THR A 118 -3.217 5.786 -8.219 1.00 0.00 C ATOM 1730 O THR A 118 -3.371 5.699 -7.002 1.00 0.00 O ATOM 1731 CB THR A 118 -2.075 4.139 -9.848 1.00 0.00 C ATOM 1732 OG1 THR A 118 -0.866 3.363 -9.911 1.00 0.00 O ATOM 1733 CG2 THR A 118 -2.342 4.724 -11.228 1.00 0.00 C ATOM 0 H THR A 118 -1.554 4.382 -6.988 1.00 0.00 H new ATOM 0 HA THR A 118 -1.453 6.130 -9.367 1.00 0.00 H new ATOM 0 HB THR A 118 -2.910 3.512 -9.537 1.00 0.00 H new ATOM 0 HG1 THR A 118 -0.979 2.633 -10.555 1.00 0.00 H new ATOM 0 HG21 THR A 118 -2.470 3.915 -11.947 1.00 0.00 H new ATOM 0 HG22 THR A 118 -3.248 5.330 -11.197 1.00 0.00 H new ATOM 0 HG23 THR A 118 -1.499 5.347 -11.529 1.00 0.00 H new ATOM 1741 N TYR A 119 -4.068 6.505 -8.961 1.00 0.00 N ATOM 1742 CA TYR A 119 -5.340 6.956 -8.388 1.00 0.00 C ATOM 1743 C TYR A 119 -6.186 7.561 -9.468 1.00 0.00 C ATOM 1744 O TYR A 119 -5.878 8.645 -9.960 1.00 0.00 O ATOM 1745 CB TYR A 119 -5.135 7.923 -7.220 1.00 0.00 C ATOM 1746 CG TYR A 119 -4.325 9.159 -7.535 1.00 0.00 C ATOM 1747 CD1 TYR A 119 -2.940 9.101 -7.621 1.00 0.00 C ATOM 1748 CD2 TYR A 119 -4.946 10.385 -7.733 1.00 0.00 C ATOM 1749 CE1 TYR A 119 -2.198 10.228 -7.898 1.00 0.00 C ATOM 1750 CE2 TYR A 119 -4.213 11.519 -8.011 1.00 0.00 C ATOM 1751 CZ TYR A 119 -2.842 11.438 -8.092 1.00 0.00 C ATOM 1752 OH TYR A 119 -2.112 12.570 -8.359 1.00 0.00 O ATOM 0 H TYR A 119 -3.906 6.780 -9.930 1.00 0.00 H new ATOM 0 HA TYR A 119 -5.859 6.091 -7.975 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -6.113 8.234 -6.853 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -4.645 7.386 -6.408 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -2.437 8.158 -7.468 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -6.022 10.451 -7.668 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -1.122 10.168 -7.963 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -4.712 12.465 -8.164 1.00 0.00 H new ATOM 0 HH TYR A 119 -1.742 12.925 -7.524 1.00 0.00 H new ATOM 1761 N GLU A 120 -7.152 6.774 -9.934 1.00 0.00 N ATOM 1762 CA GLU A 120 -7.922 7.097 -11.129 1.00 0.00 C ATOM 1763 C GLU A 120 -6.997 7.023 -12.342 1.00 0.00 C ATOM 1764 O GLU A 120 -7.063 6.066 -13.107 1.00 0.00 O ATOM 1765 CB GLU A 120 -8.585 8.467 -11.004 1.00 0.00 C ATOM 1766 CG GLU A 120 -9.368 8.630 -9.711 1.00 0.00 C ATOM 1767 CD GLU A 120 -10.173 9.912 -9.692 1.00 0.00 C ATOM 1768 OE1 GLU A 120 -11.314 9.906 -10.198 1.00 0.00 O ATOM 1769 OE2 GLU A 120 -9.666 10.933 -9.190 1.00 0.00 O ATOM 0 H GLU A 120 -7.422 5.895 -9.493 1.00 0.00 H new ATOM 0 HA GLU A 120 -8.728 6.374 -11.253 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -7.820 9.242 -11.060 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -9.255 8.619 -11.850 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -10.038 7.780 -9.583 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -8.679 8.622 -8.867 1.00 0.00 H new ATOM 1774 N GLY A 121 -5.944 7.832 -12.312 1.00 0.00 N ATOM 1775 CA GLY A 121 -4.804 7.548 -13.126 1.00 0.00 C ATOM 1776 C GLY A 121 -3.660 8.501 -12.868 1.00 0.00 C ATOM 1777 O GLY A 121 -3.499 9.470 -13.604 1.00 0.00 O ATOM 0 H GLY A 121 -5.870 8.672 -11.738 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -4.472 6.527 -12.938 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -5.089 7.602 -14.177 1.00 0.00 H new ATOM 1781 N VAL A 122 -2.713 8.048 -12.058 1.00 0.00 N ATOM 1782 CA VAL A 122 -1.407 8.681 -11.933 1.00 0.00 C ATOM 1783 C VAL A 122 -0.508 7.692 -11.276 1.00 0.00 C ATOM 1784 O VAL A 122 -0.585 7.513 -10.061 1.00 0.00 O ATOM 1785 CB VAL A 122 -1.335 9.980 -11.065 1.00 0.00 C ATOM 1786 CG1 VAL A 122 0.108 10.442 -10.927 1.00 0.00 C ATOM 1787 CG2 VAL A 122 -2.157 11.111 -11.625 1.00 0.00 C ATOM 0 H VAL A 122 -2.830 7.226 -11.465 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.133 8.979 -12.945 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.750 9.719 -10.092 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.144 11.347 -10.321 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.696 9.660 -10.447 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.519 10.651 -11.915 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.065 11.983 -10.977 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.799 11.361 -12.624 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -3.203 10.808 -11.680 1.00 0.00 H new ATOM 1797 N GLU A 123 0.436 7.172 -12.011 1.00 0.00 N ATOM 1798 CA GLU A 123 1.436 6.390 -11.367 1.00 0.00 C ATOM 1799 C GLU A 123 2.693 7.214 -11.255 1.00 0.00 C ATOM 1800 O GLU A 123 2.939 8.119 -12.054 1.00 0.00 O ATOM 1801 CB GLU A 123 1.718 5.057 -12.040 1.00 0.00 C ATOM 1802 CG GLU A 123 2.746 5.112 -13.149 1.00 0.00 C ATOM 1803 CD GLU A 123 2.198 5.719 -14.424 1.00 0.00 C ATOM 1804 OE1 GLU A 123 1.289 5.115 -15.030 1.00 0.00 O ATOM 1805 OE2 GLU A 123 2.655 6.812 -14.816 1.00 0.00 O ATOM 0 H GLU A 123 0.528 7.274 -13.022 1.00 0.00 H new ATOM 0 HA GLU A 123 1.055 6.127 -10.380 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.057 4.349 -11.284 1.00 0.00 H new ATOM 0 HB3 GLU A 123 0.785 4.667 -12.447 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.605 5.694 -12.814 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.105 4.104 -13.356 1.00 0.00 H new ATOM 1810 N ALA A 124 3.365 7.012 -10.166 1.00 0.00 N ATOM 1811 CA ALA A 124 4.508 7.806 -9.803 1.00 0.00 C ATOM 1812 C ALA A 124 5.226 7.068 -8.708 1.00 0.00 C ATOM 1813 O ALA A 124 4.656 6.111 -8.176 1.00 0.00 O ATOM 1814 CB ALA A 124 4.059 9.188 -9.336 1.00 0.00 C ATOM 0 H ALA A 124 3.136 6.282 -9.491 1.00 0.00 H new ATOM 0 HA ALA A 124 5.173 7.956 -10.654 1.00 0.00 H new ATOM 0 HB1 ALA A 124 4.932 9.781 -9.063 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.518 9.686 -10.141 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.406 9.085 -8.470 1.00 0.00 H new ATOM 1820 N LYS A 125 6.534 7.273 -8.589 1.00 0.00 N ATOM 1821 CA LYS A 125 7.347 6.493 -7.656 1.00 0.00 C ATOM 1822 C LYS A 125 8.656 7.220 -7.337 1.00 0.00 C ATOM 1823 O LYS A 125 9.123 8.034 -8.133 1.00 0.00 O ATOM 1824 CB LYS A 125 7.646 5.080 -8.184 1.00 0.00 C ATOM 1825 CG LYS A 125 6.881 4.641 -9.434 1.00 0.00 C ATOM 1826 CD LYS A 125 7.082 5.534 -10.633 1.00 0.00 C ATOM 1827 CE LYS A 125 6.129 5.123 -11.732 1.00 0.00 C ATOM 1828 NZ LYS A 125 6.140 3.650 -11.981 1.00 0.00 N ATOM 0 H LYS A 125 7.054 7.969 -9.123 1.00 0.00 H new ATOM 0 HA LYS A 125 6.763 6.387 -6.742 1.00 0.00 H new ATOM 0 HB2 LYS A 125 8.713 5.014 -8.397 1.00 0.00 H new ATOM 0 HB3 LYS A 125 7.435 4.367 -7.387 1.00 0.00 H new ATOM 0 HG2 LYS A 125 7.187 3.628 -9.695 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.817 4.602 -9.199 1.00 0.00 H new ATOM 0 HD2 LYS A 125 6.910 6.575 -10.358 1.00 0.00 H new ATOM 0 HD3 LYS A 125 8.111 5.463 -10.984 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.119 5.435 -11.467 1.00 0.00 H new ATOM 0 HE3 LYS A 125 6.394 5.645 -12.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.356 3.400 -12.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 7.043 3.379 -12.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.029 3.145 -11.079 1.00 0.00 H new ATOM 1838 N ARG A 126 9.258 6.904 -6.183 1.00 0.00 N ATOM 1839 CA ARG A 126 10.515 7.514 -5.773 1.00 0.00 C ATOM 1840 C ARG A 126 11.076 6.692 -4.644 1.00 0.00 C ATOM 1841 O ARG A 126 10.442 6.560 -3.630 1.00 0.00 O ATOM 1842 CB ARG A 126 10.328 8.987 -5.315 1.00 0.00 C ATOM 1843 CG ARG A 126 10.425 9.208 -3.808 1.00 0.00 C ATOM 1844 CD ARG A 126 9.337 10.028 -3.214 1.00 0.00 C ATOM 1845 NE ARG A 126 9.032 9.521 -1.897 1.00 0.00 N ATOM 1846 CZ ARG A 126 9.602 9.927 -0.766 1.00 0.00 C ATOM 1847 NH1 ARG A 126 10.522 10.879 -0.785 1.00 0.00 N ATOM 1848 NH2 ARG A 126 9.266 9.353 0.389 1.00 0.00 N ATOM 0 H ARG A 126 8.887 6.225 -5.518 1.00 0.00 H new ATOM 0 HA ARG A 126 11.196 7.533 -6.624 1.00 0.00 H new ATOM 0 HB2 ARG A 126 11.080 9.604 -5.807 1.00 0.00 H new ATOM 0 HB3 ARG A 126 9.354 9.338 -5.657 1.00 0.00 H new ATOM 0 HG2 ARG A 126 10.435 8.236 -3.315 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.379 9.687 -3.588 1.00 0.00 H new ATOM 0 HD2 ARG A 126 9.643 11.073 -3.154 1.00 0.00 H new ATOM 0 HD3 ARG A 126 8.450 9.991 -3.846 1.00 0.00 H new ATOM 0 HE ARG A 126 8.322 8.792 -1.828 1.00 0.00 H new ATOM 0 HH11 ARG A 126 10.797 11.305 -1.670 1.00 0.00 H new ATOM 0 HH12 ARG A 126 10.956 11.186 0.085 1.00 0.00 H new ATOM 0 HH21 ARG A 126 8.573 8.604 0.404 1.00 0.00 H new ATOM 0 HH22 ARG A 126 9.702 9.662 1.258 1.00 0.00 H new ATOM 1859 N ILE A 127 12.160 5.997 -4.850 1.00 0.00 N ATOM 1860 CA ILE A 127 12.743 5.208 -3.778 1.00 0.00 C ATOM 1861 C ILE A 127 14.117 4.739 -4.176 1.00 0.00 C ATOM 1862 O ILE A 127 14.240 4.042 -5.176 1.00 0.00 O ATOM 1863 CB ILE A 127 11.960 3.925 -3.388 1.00 0.00 C ATOM 1864 CG1 ILE A 127 10.466 3.923 -3.766 1.00 0.00 C ATOM 1865 CG2 ILE A 127 12.077 3.721 -1.896 1.00 0.00 C ATOM 1866 CD1 ILE A 127 9.770 2.703 -3.235 1.00 0.00 C ATOM 0 H ILE A 127 12.660 5.954 -5.738 1.00 0.00 H new ATOM 0 HA ILE A 127 12.735 5.885 -2.924 1.00 0.00 H new ATOM 0 HB ILE A 127 12.414 3.118 -3.963 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.987 4.819 -3.370 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.363 3.960 -4.851 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.531 2.823 -1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.127 3.610 -1.625 1.00 0.00 H new ATOM 0 HG23 ILE A 127 11.657 4.583 -1.377 1.00 0.00 H new ATOM 0 HD11 ILE A 127 8.718 2.732 -3.519 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.234 1.809 -3.652 1.00 0.00 H new ATOM 0 HD13 ILE A 127 9.852 2.681 -2.148 1.00 0.00 H new ATOM 1877 N PHE A 128 15.077 4.835 -3.275 1.00 0.00 N ATOM 1878 CA PHE A 128 16.306 4.106 -3.491 1.00 0.00 C ATOM 1879 C PHE A 128 16.751 3.448 -2.229 1.00 0.00 C ATOM 1880 O PHE A 128 16.973 4.079 -1.206 1.00 0.00 O ATOM 1881 CB PHE A 128 17.388 4.955 -4.102 1.00 0.00 C ATOM 1882 CG PHE A 128 17.027 5.329 -5.496 1.00 0.00 C ATOM 1883 CD1 PHE A 128 16.844 4.330 -6.423 1.00 0.00 C ATOM 1884 CD2 PHE A 128 16.796 6.644 -5.862 1.00 0.00 C ATOM 1885 CE1 PHE A 128 16.450 4.627 -7.714 1.00 0.00 C ATOM 1886 CE2 PHE A 128 16.395 6.954 -7.148 1.00 0.00 C ATOM 1887 CZ PHE A 128 16.228 5.944 -8.078 1.00 0.00 C ATOM 0 H PHE A 128 15.033 5.389 -2.419 1.00 0.00 H new ATOM 0 HA PHE A 128 16.098 3.326 -4.224 1.00 0.00 H new ATOM 0 HB2 PHE A 128 17.535 5.854 -3.504 1.00 0.00 H new ATOM 0 HB3 PHE A 128 18.332 4.411 -4.097 1.00 0.00 H new ATOM 0 HD1 PHE A 128 17.010 3.301 -6.139 1.00 0.00 H new ATOM 0 HD2 PHE A 128 16.930 7.434 -5.137 1.00 0.00 H new ATOM 0 HE1 PHE A 128 16.316 3.835 -8.436 1.00 0.00 H new ATOM 0 HE2 PHE A 128 16.213 7.982 -7.426 1.00 0.00 H new ATOM 0 HZ PHE A 128 15.925 6.182 -9.087 1.00 0.00 H new ATOM 1896 N LYS A 129 16.507 2.180 -2.269 1.00 0.00 N ATOM 1897 CA LYS A 129 16.344 1.396 -1.055 1.00 0.00 C ATOM 1898 C LYS A 129 17.454 0.426 -0.732 1.00 0.00 C ATOM 1899 O LYS A 129 18.141 -0.090 -1.613 1.00 0.00 O ATOM 1900 CB LYS A 129 15.056 0.609 -1.101 1.00 0.00 C ATOM 1901 CG LYS A 129 13.823 1.409 -0.787 1.00 0.00 C ATOM 1902 CD LYS A 129 12.730 0.519 -0.255 1.00 0.00 C ATOM 1903 CE LYS A 129 11.435 1.259 -0.021 1.00 0.00 C ATOM 1904 NZ LYS A 129 10.372 0.347 0.447 1.00 0.00 N ATOM 0 H LYS A 129 16.412 1.645 -3.132 1.00 0.00 H new ATOM 0 HA LYS A 129 16.350 2.151 -0.269 1.00 0.00 H new ATOM 0 HB2 LYS A 129 14.947 0.173 -2.094 1.00 0.00 H new ATOM 0 HB3 LYS A 129 15.126 -0.219 -0.395 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.061 2.179 -0.053 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.477 1.920 -1.685 1.00 0.00 H new ATOM 0 HD2 LYS A 129 12.556 -0.295 -0.959 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.059 0.067 0.681 1.00 0.00 H new ATOM 0 HE2 LYS A 129 11.592 2.046 0.716 1.00 0.00 H new ATOM 0 HE3 LYS A 129 11.120 1.745 -0.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 9.801 0.823 1.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 9.763 0.084 -0.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 10.802 -0.509 0.851 1.00 0.00 H new ATOM 1914 N LYS A 130 17.309 -0.047 0.505 1.00 0.00 N ATOM 1915 CA LYS A 130 18.000 -1.205 1.034 1.00 0.00 C ATOM 1916 C LYS A 130 19.514 -1.065 1.087 1.00 0.00 C ATOM 1917 O LYS A 130 20.177 -0.901 0.063 1.00 0.00 O ATOM 1918 CB LYS A 130 17.628 -2.409 0.213 1.00 0.00 C ATOM 1919 CG LYS A 130 17.854 -3.721 0.916 1.00 0.00 C ATOM 1920 CD LYS A 130 17.569 -4.879 -0.010 1.00 0.00 C ATOM 1921 CE LYS A 130 16.673 -5.884 0.663 1.00 0.00 C ATOM 1922 NZ LYS A 130 17.398 -6.651 1.711 1.00 0.00 N ATOM 0 H LYS A 130 16.683 0.386 1.184 1.00 0.00 H new ATOM 0 HA LYS A 130 17.680 -1.313 2.070 1.00 0.00 H new ATOM 0 HB2 LYS A 130 16.577 -2.335 -0.067 1.00 0.00 H new ATOM 0 HB3 LYS A 130 18.206 -2.399 -0.711 1.00 0.00 H new ATOM 0 HG2 LYS A 130 18.883 -3.777 1.270 1.00 0.00 H new ATOM 0 HG3 LYS A 130 17.211 -3.784 1.794 1.00 0.00 H new ATOM 0 HD2 LYS A 130 17.096 -4.515 -0.922 1.00 0.00 H new ATOM 0 HD3 LYS A 130 18.504 -5.356 -0.304 1.00 0.00 H new ATOM 0 HE2 LYS A 130 15.822 -5.371 1.111 1.00 0.00 H new ATOM 0 HE3 LYS A 130 16.274 -6.573 -0.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 16.749 -7.333 2.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 18.195 -7.160 1.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 17.757 -5.996 2.435 1.00 0.00 H new ATOM 1932 N GLU A 131 20.049 -1.387 2.251 1.00 0.00 N ATOM 1933 CA GLU A 131 21.481 -1.554 2.412 1.00 0.00 C ATOM 1934 C GLU A 131 21.877 -2.960 1.982 1.00 0.00 C ATOM 1935 O GLU A 131 22.567 -3.097 0.954 1.00 0.00 O ATOM 1936 CB GLU A 131 21.891 -1.304 3.864 1.00 0.00 C ATOM 1937 CG GLU A 131 21.647 0.126 4.321 1.00 0.00 C ATOM 1938 CD GLU A 131 21.918 0.327 5.795 1.00 0.00 C ATOM 1939 OE1 GLU A 131 23.077 0.143 6.227 1.00 0.00 O ATOM 1940 OE2 GLU A 131 20.974 0.680 6.529 1.00 0.00 O ATOM 1941 OXT GLU A 131 21.462 -3.930 2.653 1.00 0.00 O ATOM 0 H GLU A 131 19.509 -1.539 3.103 1.00 0.00 H new ATOM 0 HA GLU A 131 21.998 -0.827 1.785 1.00 0.00 H new ATOM 0 HB2 GLU A 131 21.339 -1.984 4.512 1.00 0.00 H new ATOM 0 HB3 GLU A 131 22.949 -1.540 3.981 1.00 0.00 H new ATOM 0 HG2 GLU A 131 22.282 0.799 3.745 1.00 0.00 H new ATOM 0 HG3 GLU A 131 20.614 0.400 4.106 1.00 0.00 H new TER 1946 GLU A 131