USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 816 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 55 LYS NZ :NH3+ 165:sc= 0.729 (180deg=-0.36) USER MOD Set 1.2: A 145 ASN : amide:sc= -0.423 K(o=0.31,f=-6.9!) USER MOD Set 2.1: A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 71 TYR OH : rot 34:sc= 0.849 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.103 K(o=-0.1,f=-3.3!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN :FLIP amide:sc= -1.99 F(o=-2.7,f=-2) USER MOD Single : A 73 SER OG : rot -84:sc= 0.938 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.00125 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -0.47 X(o=-0.47,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 46:sc= 0.0783 USER MOD Single : A 88 ASN : amide:sc= -0.0187 X(o=-0.019,f=-0.019) USER MOD Single : A 90 GLN :FLIP amide:sc= -0.0867 F(o=-1.2,f=-0.087) USER MOD Single : A 92 LYS NZ :NH3+ 157:sc= 0.629 (180deg=0.143) USER MOD Single : A 93 ASN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : A 95 ASN : amide:sc= 0.576 K(o=0.58,f=-5.5!) USER MOD Single : A 96 LYS NZ :NH3+ 168:sc= -0.0311 (180deg=-0.204) USER MOD Single : A 99 TYR OH : rot 57:sc= -1.65! USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.559! X(o=-0.56!,f=-0.71) USER MOD Single : A 112 TYR OH : rot -146:sc= 0.446 USER MOD Single : A 113 GLN : amide:sc= -2.4! C(o=-2.4!,f=-7!) USER MOD Single : A 114 TYR OH : rot -166:sc= 0.804 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot -125:sc= -0.141 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 159:sc= 0.758 USER MOD Single : A 139 ASN : amide:sc= -0.664 K(o=-0.66,f=-3.7!) USER MOD Single : A 148 ASN : amide:sc= -0.0223 K(o=-0.022,f=-0.63) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 3.472 6.135 -0.995 1.00 64.42 N ATOM 2 CA MET A 39 4.456 5.149 -1.439 1.00 24.51 C ATOM 3 C MET A 39 3.768 3.911 -1.947 1.00 60.12 C ATOM 4 O MET A 39 3.198 3.158 -1.165 1.00 63.50 O ATOM 5 CB MET A 39 5.412 4.758 -0.314 1.00 0.20 C ATOM 6 CG MET A 39 6.484 5.772 0.010 1.00 3.44 C ATOM 7 SD MET A 39 7.691 5.923 -1.309 1.00 70.31 S ATOM 8 CE MET A 39 8.804 7.141 -0.608 1.00 51.51 C ATOM 0 HA MET A 39 5.032 5.611 -2.241 1.00 24.51 H new ATOM 0 HB2 MET A 39 4.828 4.572 0.587 1.00 0.20 H new ATOM 0 HB3 MET A 39 5.894 3.818 -0.581 1.00 0.20 H new ATOM 0 HG2 MET A 39 6.022 6.742 0.191 1.00 3.44 H new ATOM 0 HG3 MET A 39 6.989 5.483 0.932 1.00 3.44 H new ATOM 0 HE1 MET A 39 9.612 7.343 -1.311 1.00 51.51 H new ATOM 0 HE2 MET A 39 8.257 8.062 -0.410 1.00 51.51 H new ATOM 0 HE3 MET A 39 9.221 6.759 0.324 1.00 51.51 H new ATOM 20 N SER A 40 3.823 3.695 -3.235 1.00 52.00 N ATOM 21 CA SER A 40 3.217 2.531 -3.827 1.00 45.32 C ATOM 22 C SER A 40 4.305 1.540 -4.262 1.00 70.20 C ATOM 23 O SER A 40 4.635 1.436 -5.448 1.00 30.12 O ATOM 24 CB SER A 40 2.333 2.937 -5.007 1.00 62.04 C ATOM 25 OG SER A 40 1.392 3.942 -4.616 1.00 45.11 O ATOM 0 H SER A 40 4.285 4.316 -3.899 1.00 52.00 H new ATOM 0 HA SER A 40 2.584 2.040 -3.088 1.00 45.32 H new ATOM 0 HB2 SER A 40 2.954 3.311 -5.821 1.00 62.04 H new ATOM 0 HB3 SER A 40 1.802 2.064 -5.387 1.00 62.04 H new ATOM 0 HG SER A 40 0.838 4.188 -5.386 1.00 45.11 H new ATOM 31 N ARG A 41 4.904 0.875 -3.279 1.00 3.31 N ATOM 32 CA ARG A 41 5.992 -0.086 -3.483 1.00 53.44 C ATOM 33 C ARG A 41 6.020 -1.075 -2.321 1.00 45.35 C ATOM 34 O ARG A 41 5.571 -0.731 -1.231 1.00 2.10 O ATOM 35 CB ARG A 41 7.371 0.627 -3.589 1.00 53.24 C ATOM 36 CG ARG A 41 7.642 1.306 -4.928 1.00 14.44 C ATOM 37 CD ARG A 41 8.983 2.016 -4.954 1.00 74.23 C ATOM 38 NE ARG A 41 9.022 3.214 -4.093 1.00 14.01 N ATOM 39 CZ ARG A 41 10.112 3.647 -3.439 1.00 30.40 C ATOM 40 NH1 ARG A 41 11.136 2.845 -3.241 1.00 3.31 N ATOM 41 NH2 ARG A 41 10.137 4.857 -2.926 1.00 42.14 N ATOM 0 H ARG A 41 4.645 0.988 -2.299 1.00 3.31 H new ATOM 0 HA ARG A 41 5.809 -0.611 -4.421 1.00 53.44 H new ATOM 0 HB2 ARG A 41 7.439 1.375 -2.799 1.00 53.24 H new ATOM 0 HB3 ARG A 41 8.157 -0.105 -3.404 1.00 53.24 H new ATOM 0 HG2 ARG A 41 7.613 0.561 -5.723 1.00 14.44 H new ATOM 0 HG3 ARG A 41 6.849 2.025 -5.135 1.00 14.44 H new ATOM 0 HD2 ARG A 41 9.761 1.322 -4.636 1.00 74.23 H new ATOM 0 HD3 ARG A 41 9.214 2.305 -5.979 1.00 74.23 H new ATOM 0 HE ARG A 41 8.161 3.751 -3.987 1.00 14.01 H new ATOM 0 HH11 ARG A 41 11.106 1.885 -3.585 1.00 3.31 H new ATOM 0 HH12 ARG A 41 11.960 3.183 -2.743 1.00 3.31 H new ATOM 0 HH21 ARG A 41 9.327 5.469 -3.024 1.00 42.14 H new ATOM 0 HH22 ARG A 41 10.966 5.183 -2.430 1.00 42.14 H new ATOM 55 N PRO A 42 6.498 -2.320 -2.546 1.00 24.33 N ATOM 56 CA PRO A 42 6.645 -3.345 -1.485 1.00 14.10 C ATOM 57 C PRO A 42 7.426 -2.827 -0.266 1.00 21.31 C ATOM 58 O PRO A 42 8.494 -2.208 -0.404 1.00 43.24 O ATOM 59 CB PRO A 42 7.428 -4.457 -2.179 1.00 12.53 C ATOM 60 CG PRO A 42 7.038 -4.331 -3.603 1.00 33.45 C ATOM 61 CD PRO A 42 6.890 -2.861 -3.863 1.00 74.41 C ATOM 0 HA PRO A 42 5.679 -3.659 -1.089 1.00 14.10 H new ATOM 0 HB2 PRO A 42 8.503 -4.332 -2.046 1.00 12.53 H new ATOM 0 HB3 PRO A 42 7.169 -5.437 -1.779 1.00 12.53 H new ATOM 0 HG2 PRO A 42 7.794 -4.768 -4.255 1.00 33.45 H new ATOM 0 HG3 PRO A 42 6.104 -4.858 -3.800 1.00 33.45 H new ATOM 0 HD2 PRO A 42 7.821 -2.420 -4.218 1.00 74.41 H new ATOM 0 HD3 PRO A 42 6.133 -2.661 -4.621 1.00 74.41 H new ATOM 69 N ASP A 43 6.852 -3.070 0.908 1.00 74.11 N ATOM 70 CA ASP A 43 7.329 -2.638 2.256 1.00 43.03 C ATOM 71 C ASP A 43 7.025 -1.186 2.492 1.00 70.41 C ATOM 72 O ASP A 43 6.655 -0.797 3.578 1.00 12.20 O ATOM 73 CB ASP A 43 8.797 -2.943 2.530 1.00 14.12 C ATOM 74 CG ASP A 43 9.204 -2.711 3.973 1.00 52.52 C ATOM 75 OD1 ASP A 43 8.776 -3.495 4.869 1.00 71.42 O ATOM 76 OD2 ASP A 43 10.004 -1.806 4.225 1.00 34.12 O ATOM 0 H ASP A 43 5.986 -3.606 0.968 1.00 74.11 H new ATOM 0 HA ASP A 43 6.771 -3.242 2.971 1.00 43.03 H new ATOM 0 HB2 ASP A 43 9.000 -3.981 2.266 1.00 14.12 H new ATOM 0 HB3 ASP A 43 9.416 -2.323 1.882 1.00 14.12 H new ATOM 81 N GLN A 44 7.125 -0.396 1.443 1.00 43.31 N ATOM 82 CA GLN A 44 6.768 1.011 1.483 1.00 71.01 C ATOM 83 C GLN A 44 5.252 1.151 1.644 1.00 45.03 C ATOM 84 O GLN A 44 4.747 2.160 2.150 1.00 44.51 O ATOM 85 CB GLN A 44 7.226 1.719 0.218 1.00 64.25 C ATOM 86 CG GLN A 44 8.729 1.714 -0.022 1.00 62.43 C ATOM 87 CD GLN A 44 9.480 2.555 0.989 1.00 34.00 C ATOM 88 OE1 GLN A 44 9.903 2.068 2.035 1.00 63.54 O ATOM 89 NE2 GLN A 44 9.636 3.822 0.685 1.00 24.31 N ATOM 0 H GLN A 44 7.458 -0.712 0.532 1.00 43.31 H new ATOM 0 HA GLN A 44 7.267 1.475 2.333 1.00 71.01 H new ATOM 0 HB2 GLN A 44 6.737 1.253 -0.637 1.00 64.25 H new ATOM 0 HB3 GLN A 44 6.884 2.753 0.256 1.00 64.25 H new ATOM 0 HG2 GLN A 44 9.097 0.689 0.018 1.00 62.43 H new ATOM 0 HG3 GLN A 44 8.935 2.087 -1.025 1.00 62.43 H new ATOM 0 HE21 GLN A 44 9.269 4.184 -0.195 1.00 24.31 H new ATOM 0 HE22 GLN A 44 10.125 4.444 1.328 1.00 24.31 H new ATOM 98 N ALA A 45 4.537 0.117 1.227 1.00 63.33 N ATOM 99 CA ALA A 45 3.103 0.034 1.397 1.00 74.11 C ATOM 100 C ALA A 45 2.771 -0.080 2.881 1.00 32.41 C ATOM 101 O ALA A 45 1.722 0.351 3.337 1.00 21.21 O ATOM 102 CB ALA A 45 2.544 -1.155 0.636 1.00 1.33 C ATOM 0 H ALA A 45 4.944 -0.692 0.758 1.00 63.33 H new ATOM 0 HA ALA A 45 2.645 0.938 0.997 1.00 74.11 H new ATOM 0 HB1 ALA A 45 1.464 -1.201 0.776 1.00 1.33 H new ATOM 0 HB2 ALA A 45 2.768 -1.046 -0.425 1.00 1.33 H new ATOM 0 HB3 ALA A 45 2.998 -2.073 1.010 1.00 1.33 H new ATOM 108 N LYS A 46 3.698 -0.624 3.642 1.00 33.40 N ATOM 109 CA LYS A 46 3.511 -0.742 5.067 1.00 13.11 C ATOM 110 C LYS A 46 3.798 0.603 5.724 1.00 14.34 C ATOM 111 O LYS A 46 3.176 0.970 6.710 1.00 74.30 O ATOM 112 CB LYS A 46 4.482 -1.788 5.610 1.00 54.01 C ATOM 113 CG LYS A 46 4.276 -3.186 5.065 1.00 3.42 C ATOM 114 CD LYS A 46 5.338 -4.135 5.585 1.00 51.25 C ATOM 115 CE LYS A 46 5.092 -5.556 5.124 1.00 42.33 C ATOM 116 NZ LYS A 46 6.120 -6.484 5.631 1.00 1.04 N ATOM 0 H LYS A 46 4.585 -0.990 3.296 1.00 33.40 H new ATOM 0 HA LYS A 46 2.486 -1.042 5.284 1.00 13.11 H new ATOM 0 HB2 LYS A 46 5.500 -1.471 5.384 1.00 54.01 H new ATOM 0 HB3 LYS A 46 4.392 -1.819 6.696 1.00 54.01 H new ATOM 0 HG2 LYS A 46 3.288 -3.549 5.350 1.00 3.42 H new ATOM 0 HG3 LYS A 46 4.306 -3.163 3.976 1.00 3.42 H new ATOM 0 HD2 LYS A 46 6.319 -3.806 5.243 1.00 51.25 H new ATOM 0 HD3 LYS A 46 5.353 -4.103 6.674 1.00 51.25 H new ATOM 0 HE2 LYS A 46 4.109 -5.883 5.463 1.00 42.33 H new ATOM 0 HE3 LYS A 46 5.080 -5.587 4.035 1.00 42.33 H new ATOM 0 HZ1 LYS A 46 5.916 -7.446 5.293 1.00 1.04 H new ATOM 0 HZ2 LYS A 46 7.056 -6.187 5.287 1.00 1.04 H new ATOM 0 HZ3 LYS A 46 6.115 -6.474 6.671 1.00 1.04 H new ATOM 130 N VAL A 47 4.623 1.385 5.065 1.00 3.44 N ATOM 131 CA VAL A 47 5.041 2.678 5.564 1.00 61.32 C ATOM 132 C VAL A 47 3.899 3.667 5.403 1.00 4.53 C ATOM 133 O VAL A 47 3.578 4.440 6.309 1.00 5.03 O ATOM 134 CB VAL A 47 6.290 3.202 4.787 1.00 73.22 C ATOM 135 CG1 VAL A 47 6.773 4.532 5.336 1.00 61.10 C ATOM 136 CG2 VAL A 47 7.419 2.182 4.798 1.00 14.13 C ATOM 0 H VAL A 47 5.027 1.141 4.161 1.00 3.44 H new ATOM 0 HA VAL A 47 5.308 2.574 6.616 1.00 61.32 H new ATOM 0 HB VAL A 47 5.980 3.357 3.754 1.00 73.22 H new ATOM 0 HG11 VAL A 47 7.643 4.865 4.770 1.00 61.10 H new ATOM 0 HG12 VAL A 47 5.978 5.272 5.248 1.00 61.10 H new ATOM 0 HG13 VAL A 47 7.045 4.415 6.385 1.00 61.10 H new ATOM 0 HG21 VAL A 47 8.273 2.578 4.249 1.00 14.13 H new ATOM 0 HG22 VAL A 47 7.713 1.976 5.827 1.00 14.13 H new ATOM 0 HG23 VAL A 47 7.081 1.260 4.326 1.00 14.13 H new ATOM 146 N THR A 48 3.263 3.602 4.255 1.00 12.55 N ATOM 147 CA THR A 48 2.208 4.511 3.928 1.00 2.15 C ATOM 148 C THR A 48 0.937 4.247 4.788 1.00 51.21 C ATOM 149 O THR A 48 0.243 5.203 5.182 1.00 52.12 O ATOM 150 CB THR A 48 1.923 4.530 2.382 1.00 14.42 C ATOM 151 OG1 THR A 48 1.025 5.592 2.026 1.00 34.04 O ATOM 152 CG2 THR A 48 1.356 3.214 1.903 1.00 11.12 C ATOM 0 H THR A 48 3.468 2.916 3.529 1.00 12.55 H new ATOM 0 HA THR A 48 2.538 5.518 4.185 1.00 2.15 H new ATOM 0 HB THR A 48 2.882 4.698 1.892 1.00 14.42 H new ATOM 0 HG1 THR A 48 0.869 5.578 1.059 1.00 34.04 H new ATOM 0 HG21 THR A 48 1.172 3.266 0.830 1.00 11.12 H new ATOM 0 HG22 THR A 48 2.067 2.414 2.111 1.00 11.12 H new ATOM 0 HG23 THR A 48 0.419 3.011 2.422 1.00 11.12 H new ATOM 160 N VAL A 49 0.670 2.970 5.154 1.00 22.24 N ATOM 161 CA VAL A 49 -0.496 2.693 6.005 1.00 4.12 C ATOM 162 C VAL A 49 -0.211 3.138 7.419 1.00 23.10 C ATOM 163 O VAL A 49 -1.105 3.590 8.118 1.00 2.11 O ATOM 164 CB VAL A 49 -0.969 1.193 6.026 1.00 45.20 C ATOM 165 CG1 VAL A 49 -1.183 0.643 4.632 1.00 41.53 C ATOM 166 CG2 VAL A 49 -0.065 0.285 6.873 1.00 2.05 C ATOM 0 H VAL A 49 1.221 2.155 4.885 1.00 22.24 H new ATOM 0 HA VAL A 49 -1.315 3.258 5.559 1.00 4.12 H new ATOM 0 HB VAL A 49 -1.939 1.194 6.523 1.00 45.20 H new ATOM 0 HG11 VAL A 49 -1.509 -0.395 4.697 1.00 41.53 H new ATOM 0 HG12 VAL A 49 -1.945 1.232 4.122 1.00 41.53 H new ATOM 0 HG13 VAL A 49 -0.249 0.696 4.073 1.00 41.53 H new ATOM 0 HG21 VAL A 49 -0.446 -0.736 6.846 1.00 2.05 H new ATOM 0 HG22 VAL A 49 0.948 0.305 6.472 1.00 2.05 H new ATOM 0 HG23 VAL A 49 -0.055 0.641 7.903 1.00 2.05 H new ATOM 176 N ALA A 50 1.056 3.046 7.810 1.00 0.23 N ATOM 177 CA ALA A 50 1.485 3.388 9.142 1.00 21.42 C ATOM 178 C ALA A 50 1.357 4.876 9.371 1.00 14.25 C ATOM 179 O ALA A 50 0.912 5.320 10.422 1.00 42.43 O ATOM 180 CB ALA A 50 2.906 2.940 9.353 1.00 40.21 C ATOM 0 H ALA A 50 1.810 2.729 7.201 1.00 0.23 H new ATOM 0 HA ALA A 50 0.846 2.877 9.862 1.00 21.42 H new ATOM 0 HB1 ALA A 50 3.224 3.202 10.362 1.00 40.21 H new ATOM 0 HB2 ALA A 50 2.970 1.860 9.221 1.00 40.21 H new ATOM 0 HB3 ALA A 50 3.554 3.433 8.629 1.00 40.21 H new ATOM 186 N LYS A 51 1.706 5.658 8.364 1.00 50.52 N ATOM 187 CA LYS A 51 1.596 7.088 8.482 1.00 41.11 C ATOM 188 C LYS A 51 0.126 7.542 8.506 1.00 61.11 C ATOM 189 O LYS A 51 -0.221 8.554 9.107 1.00 74.33 O ATOM 190 CB LYS A 51 2.382 7.772 7.380 1.00 61.34 C ATOM 191 CG LYS A 51 3.867 7.478 7.453 1.00 51.11 C ATOM 192 CD LYS A 51 4.615 8.185 6.355 1.00 1.14 C ATOM 193 CE LYS A 51 6.122 7.998 6.495 1.00 13.20 C ATOM 194 NZ LYS A 51 6.885 8.816 5.523 1.00 10.20 N ATOM 0 H LYS A 51 2.063 5.325 7.468 1.00 50.52 H new ATOM 0 HA LYS A 51 2.030 7.386 9.436 1.00 41.11 H new ATOM 0 HB2 LYS A 51 1.999 7.449 6.412 1.00 61.34 H new ATOM 0 HB3 LYS A 51 2.225 8.849 7.442 1.00 61.34 H new ATOM 0 HG2 LYS A 51 4.256 7.792 8.422 1.00 51.11 H new ATOM 0 HG3 LYS A 51 4.032 6.403 7.376 1.00 51.11 H new ATOM 0 HD2 LYS A 51 4.288 7.804 5.387 1.00 1.14 H new ATOM 0 HD3 LYS A 51 4.376 9.248 6.376 1.00 1.14 H new ATOM 0 HE2 LYS A 51 6.426 8.264 7.507 1.00 13.20 H new ATOM 0 HE3 LYS A 51 6.370 6.946 6.354 1.00 13.20 H new ATOM 0 HZ1 LYS A 51 7.904 8.655 5.658 1.00 10.20 H new ATOM 0 HZ2 LYS A 51 6.616 8.546 4.555 1.00 10.20 H new ATOM 0 HZ3 LYS A 51 6.671 9.823 5.673 1.00 10.20 H new ATOM 208 N GLY A 52 -0.739 6.748 7.930 1.00 63.11 N ATOM 209 CA GLY A 52 -2.146 7.064 7.984 1.00 23.32 C ATOM 210 C GLY A 52 -2.724 6.614 9.302 1.00 13.22 C ATOM 211 O GLY A 52 -3.657 7.216 9.840 1.00 62.40 O ATOM 0 H GLY A 52 -0.503 5.893 7.427 1.00 63.11 H new ATOM 0 HA2 GLY A 52 -2.291 8.137 7.861 1.00 23.32 H new ATOM 0 HA3 GLY A 52 -2.669 6.575 7.162 1.00 23.32 H new ATOM 215 N ASP A 53 -2.102 5.596 9.847 1.00 74.32 N ATOM 216 CA ASP A 53 -2.536 4.963 11.071 1.00 42.00 C ATOM 217 C ASP A 53 -2.204 5.865 12.236 1.00 54.31 C ATOM 218 O ASP A 53 -3.020 6.096 13.107 1.00 14.30 O ATOM 219 CB ASP A 53 -1.830 3.631 11.224 1.00 11.11 C ATOM 220 CG ASP A 53 -2.558 2.675 12.120 1.00 2.51 C ATOM 221 OD1 ASP A 53 -3.466 1.969 11.608 1.00 3.35 O ATOM 222 OD2 ASP A 53 -2.194 2.555 13.279 1.00 44.21 O ATOM 0 H ASP A 53 -1.264 5.176 9.445 1.00 74.32 H new ATOM 0 HA ASP A 53 -3.612 4.792 11.044 1.00 42.00 H new ATOM 0 HB2 ASP A 53 -1.709 3.176 10.241 1.00 11.11 H new ATOM 0 HB3 ASP A 53 -0.830 3.801 11.622 1.00 11.11 H new ATOM 227 N ILE A 54 -1.010 6.444 12.205 1.00 55.12 N ATOM 228 CA ILE A 54 -0.592 7.388 13.235 1.00 24.23 C ATOM 229 C ILE A 54 -1.477 8.636 13.219 1.00 43.14 C ATOM 230 O ILE A 54 -1.689 9.264 14.261 1.00 63.52 O ATOM 231 CB ILE A 54 0.903 7.784 13.122 1.00 40.45 C ATOM 232 CG1 ILE A 54 1.176 8.419 11.762 1.00 25.00 C ATOM 233 CG2 ILE A 54 1.798 6.576 13.367 1.00 63.33 C ATOM 234 CD1 ILE A 54 2.604 8.804 11.496 1.00 1.33 C ATOM 0 H ILE A 54 -0.314 6.277 11.478 1.00 55.12 H new ATOM 0 HA ILE A 54 -0.712 6.876 14.190 1.00 24.23 H new ATOM 0 HB ILE A 54 1.134 8.522 13.890 1.00 40.45 H new ATOM 0 HG12 ILE A 54 0.856 7.723 10.986 1.00 25.00 H new ATOM 0 HG13 ILE A 54 0.555 9.310 11.667 1.00 25.00 H new ATOM 0 HG21 ILE A 54 2.843 6.874 13.283 1.00 63.33 H new ATOM 0 HG22 ILE A 54 1.612 6.182 14.366 1.00 63.33 H new ATOM 0 HG23 ILE A 54 1.580 5.806 12.627 1.00 63.33 H new ATOM 0 HD11 ILE A 54 2.683 9.245 10.502 1.00 1.33 H new ATOM 0 HD12 ILE A 54 2.930 9.529 12.242 1.00 1.33 H new ATOM 0 HD13 ILE A 54 3.236 7.918 11.551 1.00 1.33 H new ATOM 246 N LYS A 55 -2.019 8.980 12.041 1.00 15.20 N ATOM 247 CA LYS A 55 -2.963 10.099 11.950 1.00 13.23 C ATOM 248 C LYS A 55 -4.281 9.731 12.602 1.00 21.15 C ATOM 249 O LYS A 55 -4.973 10.583 13.159 1.00 3.33 O ATOM 250 CB LYS A 55 -3.178 10.578 10.505 1.00 41.20 C ATOM 251 CG LYS A 55 -2.234 11.697 10.061 1.00 20.22 C ATOM 252 CD LYS A 55 -0.778 11.320 10.199 1.00 60.04 C ATOM 253 CE LYS A 55 0.142 12.464 9.839 1.00 63.12 C ATOM 254 NZ LYS A 55 -0.074 13.644 10.708 1.00 72.02 N ATOM 0 H LYS A 55 -1.824 8.510 11.157 1.00 15.20 H new ATOM 0 HA LYS A 55 -2.522 10.937 12.490 1.00 13.23 H new ATOM 0 HB2 LYS A 55 -3.057 9.729 9.832 1.00 41.20 H new ATOM 0 HB3 LYS A 55 -4.206 10.924 10.399 1.00 41.20 H new ATOM 0 HG2 LYS A 55 -2.442 11.952 9.022 1.00 20.22 H new ATOM 0 HG3 LYS A 55 -2.432 12.590 10.654 1.00 20.22 H new ATOM 0 HD2 LYS A 55 -0.581 11.006 11.224 1.00 60.04 H new ATOM 0 HD3 LYS A 55 -0.563 10.466 9.557 1.00 60.04 H new ATOM 0 HE2 LYS A 55 1.178 12.136 9.923 1.00 63.12 H new ATOM 0 HE3 LYS A 55 -0.020 12.746 8.798 1.00 63.12 H new ATOM 0 HZ1 LYS A 55 0.726 14.301 10.607 1.00 72.02 H new ATOM 0 HZ2 LYS A 55 -0.953 14.124 10.429 1.00 72.02 H new ATOM 0 HZ3 LYS A 55 -0.147 13.337 11.699 1.00 72.02 H new ATOM 268 N ALA A 56 -4.606 8.454 12.549 1.00 54.31 N ATOM 269 CA ALA A 56 -5.794 7.923 13.188 1.00 3.32 C ATOM 270 C ALA A 56 -5.626 7.963 14.699 1.00 42.24 C ATOM 271 O ALA A 56 -6.537 8.359 15.440 1.00 11.11 O ATOM 272 CB ALA A 56 -6.025 6.493 12.744 1.00 20.10 C ATOM 0 H ALA A 56 -4.051 7.752 12.059 1.00 54.31 H new ATOM 0 HA ALA A 56 -6.652 8.531 12.901 1.00 3.32 H new ATOM 0 HB1 ALA A 56 -6.919 6.102 13.229 1.00 20.10 H new ATOM 0 HB2 ALA A 56 -6.156 6.465 11.662 1.00 20.10 H new ATOM 0 HB3 ALA A 56 -5.166 5.883 13.021 1.00 20.10 H new ATOM 278 N ILE A 57 -4.452 7.557 15.143 1.00 70.43 N ATOM 279 CA ILE A 57 -4.117 7.529 16.558 1.00 11.32 C ATOM 280 C ILE A 57 -4.092 8.941 17.113 1.00 50.33 C ATOM 281 O ILE A 57 -4.573 9.188 18.190 1.00 33.25 O ATOM 282 CB ILE A 57 -2.751 6.868 16.809 1.00 74.44 C ATOM 283 CG1 ILE A 57 -2.686 5.538 16.079 1.00 13.24 C ATOM 284 CG2 ILE A 57 -2.559 6.651 18.309 1.00 3.05 C ATOM 285 CD1 ILE A 57 -1.353 4.851 16.146 1.00 0.50 C ATOM 0 H ILE A 57 -3.700 7.236 14.533 1.00 70.43 H new ATOM 0 HA ILE A 57 -4.882 6.939 17.062 1.00 11.32 H new ATOM 0 HB ILE A 57 -1.958 7.516 16.437 1.00 74.44 H new ATOM 0 HG12 ILE A 57 -3.443 4.873 16.495 1.00 13.24 H new ATOM 0 HG13 ILE A 57 -2.944 5.700 15.032 1.00 13.24 H new ATOM 0 HG21 ILE A 57 -1.591 6.183 18.488 1.00 3.05 H new ATOM 0 HG22 ILE A 57 -2.598 7.611 18.823 1.00 3.05 H new ATOM 0 HG23 ILE A 57 -3.351 6.004 18.687 1.00 3.05 H new ATOM 0 HD11 ILE A 57 -1.401 3.910 15.598 1.00 0.50 H new ATOM 0 HD12 ILE A 57 -0.591 5.492 15.702 1.00 0.50 H new ATOM 0 HD13 ILE A 57 -1.098 4.652 17.187 1.00 0.50 H new ATOM 297 N ALA A 58 -3.563 9.871 16.331 1.00 64.00 N ATOM 298 CA ALA A 58 -3.519 11.287 16.716 1.00 53.41 C ATOM 299 C ALA A 58 -4.925 11.823 16.998 1.00 73.24 C ATOM 300 O ALA A 58 -5.116 12.660 17.880 1.00 3.43 O ATOM 301 CB ALA A 58 -2.847 12.115 15.631 1.00 4.21 C ATOM 0 H ALA A 58 -3.154 9.675 15.418 1.00 64.00 H new ATOM 0 HA ALA A 58 -2.933 11.368 17.631 1.00 53.41 H new ATOM 0 HB1 ALA A 58 -2.824 13.162 15.934 1.00 4.21 H new ATOM 0 HB2 ALA A 58 -1.828 11.758 15.480 1.00 4.21 H new ATOM 0 HB3 ALA A 58 -3.407 12.019 14.701 1.00 4.21 H new ATOM 307 N ALA A 59 -5.908 11.281 16.295 1.00 22.32 N ATOM 308 CA ALA A 59 -7.288 11.693 16.453 1.00 52.24 C ATOM 309 C ALA A 59 -7.876 11.056 17.703 1.00 44.15 C ATOM 310 O ALA A 59 -8.741 11.628 18.363 1.00 44.44 O ATOM 311 CB ALA A 59 -8.101 11.323 15.224 1.00 12.00 C ATOM 0 H ALA A 59 -5.769 10.546 15.602 1.00 22.32 H new ATOM 0 HA ALA A 59 -7.323 12.777 16.563 1.00 52.24 H new ATOM 0 HB1 ALA A 59 -9.134 11.641 15.362 1.00 12.00 H new ATOM 0 HB2 ALA A 59 -7.683 11.819 14.348 1.00 12.00 H new ATOM 0 HB3 ALA A 59 -8.070 10.243 15.079 1.00 12.00 H new ATOM 317 N ALA A 60 -7.384 9.883 18.039 1.00 70.43 N ATOM 318 CA ALA A 60 -7.816 9.193 19.234 1.00 33.41 C ATOM 319 C ALA A 60 -7.101 9.762 20.447 1.00 70.34 C ATOM 320 O ALA A 60 -7.623 9.742 21.549 1.00 10.01 O ATOM 321 CB ALA A 60 -7.578 7.713 19.124 1.00 1.33 C ATOM 0 H ALA A 60 -6.679 9.384 17.496 1.00 70.43 H new ATOM 0 HA ALA A 60 -8.889 9.347 19.351 1.00 33.41 H new ATOM 0 HB1 ALA A 60 -7.913 7.222 20.038 1.00 1.33 H new ATOM 0 HB2 ALA A 60 -8.134 7.317 18.274 1.00 1.33 H new ATOM 0 HB3 ALA A 60 -6.514 7.525 18.980 1.00 1.33 H new ATOM 327 N LEU A 61 -5.925 10.306 20.236 1.00 4.31 N ATOM 328 CA LEU A 61 -5.202 10.976 21.286 1.00 1.34 C ATOM 329 C LEU A 61 -5.990 12.245 21.639 1.00 0.24 C ATOM 330 O LEU A 61 -6.049 12.663 22.797 1.00 70.35 O ATOM 331 CB LEU A 61 -3.777 11.293 20.797 1.00 2.52 C ATOM 332 CG LEU A 61 -2.640 11.270 21.844 1.00 43.43 C ATOM 333 CD1 LEU A 61 -2.804 12.331 22.893 1.00 31.40 C ATOM 334 CD2 LEU A 61 -2.553 9.925 22.509 1.00 31.31 C ATOM 0 H LEU A 61 -5.446 10.296 19.335 1.00 4.31 H new ATOM 0 HA LEU A 61 -5.104 10.357 22.178 1.00 1.34 H new ATOM 0 HB2 LEU A 61 -3.525 10.581 20.012 1.00 2.52 H new ATOM 0 HB3 LEU A 61 -3.791 12.282 20.338 1.00 2.52 H new ATOM 0 HG LEU A 61 -1.718 11.473 21.300 1.00 43.43 H new ATOM 0 HD11 LEU A 61 -1.979 12.271 23.603 1.00 31.40 H new ATOM 0 HD12 LEU A 61 -2.805 13.313 22.420 1.00 31.40 H new ATOM 0 HD13 LEU A 61 -3.747 12.180 23.418 1.00 31.40 H new ATOM 0 HD21 LEU A 61 -1.746 9.933 23.242 1.00 31.31 H new ATOM 0 HD22 LEU A 61 -3.496 9.705 23.010 1.00 31.31 H new ATOM 0 HD23 LEU A 61 -2.354 9.160 21.758 1.00 31.31 H new ATOM 346 N ASP A 62 -6.680 12.793 20.632 1.00 75.43 N ATOM 347 CA ASP A 62 -7.593 13.922 20.837 1.00 71.45 C ATOM 348 C ASP A 62 -8.845 13.448 21.553 1.00 11.40 C ATOM 349 O ASP A 62 -9.589 14.232 22.139 1.00 10.25 O ATOM 350 CB ASP A 62 -8.005 14.605 19.528 1.00 74.43 C ATOM 351 CG ASP A 62 -6.896 15.346 18.848 1.00 64.20 C ATOM 352 OD1 ASP A 62 -6.168 16.097 19.526 1.00 72.54 O ATOM 353 OD2 ASP A 62 -6.757 15.242 17.605 1.00 70.11 O ATOM 0 H ASP A 62 -6.623 12.472 19.666 1.00 75.43 H new ATOM 0 HA ASP A 62 -7.052 14.654 21.437 1.00 71.45 H new ATOM 0 HB2 ASP A 62 -8.396 13.851 18.845 1.00 74.43 H new ATOM 0 HB3 ASP A 62 -8.819 15.300 19.734 1.00 74.43 H new ATOM 358 N MET A 63 -9.068 12.164 21.515 1.00 10.01 N ATOM 359 CA MET A 63 -10.192 11.577 22.188 1.00 63.04 C ATOM 360 C MET A 63 -9.860 11.377 23.644 1.00 32.51 C ATOM 361 O MET A 63 -10.709 11.536 24.482 1.00 72.54 O ATOM 362 CB MET A 63 -10.666 10.277 21.532 1.00 34.32 C ATOM 363 CG MET A 63 -11.288 10.449 20.161 1.00 14.52 C ATOM 364 SD MET A 63 -12.789 11.442 20.220 1.00 73.03 S ATOM 365 CE MET A 63 -13.266 11.426 18.496 1.00 65.04 C ATOM 0 H MET A 63 -8.478 11.497 21.018 1.00 10.01 H new ATOM 0 HA MET A 63 -11.030 12.269 22.104 1.00 63.04 H new ATOM 0 HB2 MET A 63 -9.817 9.598 21.448 1.00 34.32 H new ATOM 0 HB3 MET A 63 -11.393 9.799 22.188 1.00 34.32 H new ATOM 0 HG2 MET A 63 -10.568 10.921 19.493 1.00 14.52 H new ATOM 0 HG3 MET A 63 -11.518 9.469 19.742 1.00 14.52 H new ATOM 0 HE1 MET A 63 -14.183 12.001 18.367 1.00 65.04 H new ATOM 0 HE2 MET A 63 -12.472 11.869 17.895 1.00 65.04 H new ATOM 0 HE3 MET A 63 -13.434 10.398 18.175 1.00 65.04 H new ATOM 375 N TYR A 64 -8.609 11.047 23.953 1.00 61.41 N ATOM 376 CA TYR A 64 -8.186 11.016 25.353 1.00 71.04 C ATOM 377 C TYR A 64 -8.179 12.438 25.853 1.00 1.31 C ATOM 378 O TYR A 64 -8.504 12.716 27.006 1.00 62.02 O ATOM 379 CB TYR A 64 -6.803 10.418 25.525 1.00 42.34 C ATOM 380 CG TYR A 64 -6.375 10.368 26.978 1.00 42.03 C ATOM 381 CD1 TYR A 64 -6.769 9.334 27.813 1.00 31.25 C ATOM 382 CD2 TYR A 64 -5.577 11.359 27.522 1.00 30.15 C ATOM 383 CE1 TYR A 64 -6.389 9.287 29.089 1.00 33.24 C ATOM 384 CE2 TYR A 64 -5.187 11.308 28.824 1.00 13.22 C ATOM 385 CZ TYR A 64 -5.592 10.267 29.603 1.00 54.53 C ATOM 386 OH TYR A 64 -5.213 10.200 30.897 1.00 45.22 O ATOM 0 H TYR A 64 -7.887 10.803 23.275 1.00 61.41 H new ATOM 0 HA TYR A 64 -8.877 10.388 25.916 1.00 71.04 H new ATOM 0 HB2 TYR A 64 -6.791 9.410 25.110 1.00 42.34 H new ATOM 0 HB3 TYR A 64 -6.082 11.005 24.956 1.00 42.34 H new ATOM 0 HD1 TYR A 64 -7.398 8.549 27.420 1.00 31.25 H new ATOM 0 HD2 TYR A 64 -5.259 12.185 26.903 1.00 30.15 H new ATOM 0 HE1 TYR A 64 -6.713 8.471 29.718 1.00 33.24 H new ATOM 0 HE2 TYR A 64 -4.562 12.086 29.236 1.00 13.22 H new ATOM 0 HH TYR A 64 -4.647 10.970 31.112 1.00 45.22 H new ATOM 396 N LYS A 65 -7.820 13.341 24.947 1.00 41.23 N ATOM 397 CA LYS A 65 -7.886 14.757 25.192 1.00 71.02 C ATOM 398 C LYS A 65 -9.313 15.154 25.605 1.00 22.21 C ATOM 399 O LYS A 65 -9.507 16.081 26.341 1.00 40.50 O ATOM 400 CB LYS A 65 -7.440 15.518 23.946 1.00 2.20 C ATOM 401 CG LYS A 65 -7.591 17.014 24.022 1.00 64.01 C ATOM 402 CD LYS A 65 -7.034 17.681 22.782 1.00 53.25 C ATOM 403 CE LYS A 65 -7.124 19.190 22.874 1.00 4.12 C ATOM 404 NZ LYS A 65 -6.550 19.851 21.682 1.00 0.42 N ATOM 0 H LYS A 65 -7.474 13.098 24.019 1.00 41.23 H new ATOM 0 HA LYS A 65 -7.214 15.016 26.010 1.00 71.02 H new ATOM 0 HB2 LYS A 65 -6.393 15.284 23.752 1.00 2.20 H new ATOM 0 HB3 LYS A 65 -8.012 15.154 23.093 1.00 2.20 H new ATOM 0 HG2 LYS A 65 -8.644 17.271 24.135 1.00 64.01 H new ATOM 0 HG3 LYS A 65 -7.074 17.391 24.905 1.00 64.01 H new ATOM 0 HD2 LYS A 65 -5.994 17.385 22.645 1.00 53.25 H new ATOM 0 HD3 LYS A 65 -7.582 17.336 21.905 1.00 53.25 H new ATOM 0 HE2 LYS A 65 -8.167 19.485 22.986 1.00 4.12 H new ATOM 0 HE3 LYS A 65 -6.599 19.531 23.766 1.00 4.12 H new ATOM 0 HZ1 LYS A 65 -6.631 20.883 21.784 1.00 0.42 H new ATOM 0 HZ2 LYS A 65 -5.548 19.590 21.589 1.00 0.42 H new ATOM 0 HZ3 LYS A 65 -7.067 19.546 20.833 1.00 0.42 H new ATOM 418 N LEU A 66 -10.293 14.430 25.107 1.00 53.44 N ATOM 419 CA LEU A 66 -11.676 14.626 25.521 1.00 62.25 C ATOM 420 C LEU A 66 -12.015 13.815 26.787 1.00 50.40 C ATOM 421 O LEU A 66 -12.787 14.276 27.630 1.00 25.24 O ATOM 422 CB LEU A 66 -12.636 14.242 24.400 1.00 21.31 C ATOM 423 CG LEU A 66 -12.556 15.063 23.122 1.00 70.43 C ATOM 424 CD1 LEU A 66 -13.489 14.491 22.074 1.00 54.23 C ATOM 425 CD2 LEU A 66 -12.902 16.512 23.401 1.00 50.23 C ATOM 0 H LEU A 66 -10.162 13.696 24.411 1.00 53.44 H new ATOM 0 HA LEU A 66 -11.792 15.685 25.751 1.00 62.25 H new ATOM 0 HB2 LEU A 66 -12.461 13.197 24.145 1.00 21.31 H new ATOM 0 HB3 LEU A 66 -13.653 14.310 24.785 1.00 21.31 H new ATOM 0 HG LEU A 66 -11.535 15.019 22.743 1.00 70.43 H new ATOM 0 HD11 LEU A 66 -13.423 15.087 21.164 1.00 54.23 H new ATOM 0 HD12 LEU A 66 -13.204 13.462 21.855 1.00 54.23 H new ATOM 0 HD13 LEU A 66 -14.513 14.512 22.448 1.00 54.23 H new ATOM 0 HD21 LEU A 66 -12.840 17.085 22.476 1.00 50.23 H new ATOM 0 HD22 LEU A 66 -13.915 16.574 23.799 1.00 50.23 H new ATOM 0 HD23 LEU A 66 -12.200 16.920 24.129 1.00 50.23 H new ATOM 437 N ASP A 67 -11.420 12.620 26.932 1.00 42.22 N ATOM 438 CA ASP A 67 -11.744 11.730 28.079 1.00 54.54 C ATOM 439 C ASP A 67 -11.168 12.269 29.373 1.00 30.30 C ATOM 440 O ASP A 67 -11.675 12.005 30.423 1.00 61.23 O ATOM 441 CB ASP A 67 -11.197 10.295 27.832 1.00 61.35 C ATOM 442 CG ASP A 67 -11.499 9.296 28.968 1.00 50.35 C ATOM 443 OD1 ASP A 67 -12.656 8.837 29.087 1.00 2.52 O ATOM 444 OD2 ASP A 67 -10.579 8.956 29.746 1.00 34.41 O ATOM 0 H ASP A 67 -10.724 12.245 26.287 1.00 42.22 H new ATOM 0 HA ASP A 67 -12.830 11.694 28.166 1.00 54.54 H new ATOM 0 HB2 ASP A 67 -11.622 9.912 26.904 1.00 61.35 H new ATOM 0 HB3 ASP A 67 -10.118 10.350 27.690 1.00 61.35 H new ATOM 449 N ASN A 68 -10.140 13.072 29.284 1.00 3.11 N ATOM 450 CA ASN A 68 -9.580 13.741 30.471 1.00 2.22 C ATOM 451 C ASN A 68 -9.425 15.170 30.263 1.00 52.10 C ATOM 452 O ASN A 68 -8.672 15.803 30.995 1.00 11.20 O ATOM 453 CB ASN A 68 -8.263 13.163 30.904 1.00 15.30 C ATOM 454 CG ASN A 68 -8.370 11.873 31.683 1.00 13.04 C ATOM 455 OD1 ASN A 68 -8.581 10.785 30.999 1.00 44.40 O flip ATOM 456 ND2 ASN A 68 -8.323 11.872 32.914 1.00 41.45 N flip ATOM 0 H ASN A 68 -9.661 13.290 28.411 1.00 3.11 H new ATOM 0 HA ASN A 68 -10.306 13.567 31.265 1.00 2.22 H new ATOM 0 HB2 ASN A 68 -7.649 12.989 30.020 1.00 15.30 H new ATOM 0 HB3 ASN A 68 -7.741 13.899 31.515 1.00 15.30 H new ATOM 0 HD21 ASN A 68 -8.156 12.742 33.419 1.00 41.45 H new ATOM 0 HD22 ASN A 68 -8.451 11.001 33.429 1.00 41.45 H new ATOM 463 N PHE A 69 -10.164 15.700 29.288 1.00 54.44 N ATOM 464 CA PHE A 69 -10.197 17.143 28.931 1.00 13.21 C ATOM 465 C PHE A 69 -8.816 17.805 28.916 1.00 11.22 C ATOM 466 O PHE A 69 -8.694 19.029 29.078 1.00 65.41 O ATOM 467 CB PHE A 69 -11.179 17.895 29.830 1.00 72.34 C ATOM 468 CG PHE A 69 -11.053 17.607 31.304 1.00 32.23 C ATOM 469 CD1 PHE A 69 -10.108 18.208 32.063 1.00 35.45 C ATOM 470 CD2 PHE A 69 -11.920 16.766 31.900 1.00 62.23 C ATOM 471 CE1 PHE A 69 -10.024 17.984 33.408 1.00 23.02 C ATOM 472 CE2 PHE A 69 -11.865 16.504 33.231 1.00 33.02 C ATOM 473 CZ PHE A 69 -10.914 17.126 34.006 1.00 33.44 C ATOM 0 H PHE A 69 -10.777 15.134 28.701 1.00 54.44 H new ATOM 0 HA PHE A 69 -10.551 17.201 27.902 1.00 13.21 H new ATOM 0 HB2 PHE A 69 -11.044 18.965 29.673 1.00 72.34 H new ATOM 0 HB3 PHE A 69 -12.194 17.652 29.515 1.00 72.34 H new ATOM 0 HD1 PHE A 69 -9.404 18.880 31.595 1.00 35.45 H new ATOM 0 HD2 PHE A 69 -12.681 16.286 31.302 1.00 62.23 H new ATOM 0 HE1 PHE A 69 -9.264 18.477 33.996 1.00 23.02 H new ATOM 0 HE2 PHE A 69 -12.563 15.812 33.678 1.00 33.02 H new ATOM 0 HZ PHE A 69 -10.868 16.942 35.069 1.00 33.44 H new ATOM 483 N ALA A 70 -7.824 17.030 28.550 1.00 72.44 N ATOM 484 CA ALA A 70 -6.455 17.421 28.625 1.00 53.43 C ATOM 485 C ALA A 70 -5.621 16.287 28.097 1.00 12.21 C ATOM 486 O ALA A 70 -6.116 15.158 27.977 1.00 41.44 O ATOM 487 CB ALA A 70 -6.089 17.676 30.086 1.00 25.53 C ATOM 0 H ALA A 70 -7.960 16.088 28.184 1.00 72.44 H new ATOM 0 HA ALA A 70 -6.281 18.327 28.044 1.00 53.43 H new ATOM 0 HB1 ALA A 70 -5.043 17.976 30.152 1.00 25.53 H new ATOM 0 HB2 ALA A 70 -6.720 18.470 30.486 1.00 25.53 H new ATOM 0 HB3 ALA A 70 -6.243 16.765 30.664 1.00 25.53 H new ATOM 493 N TYR A 71 -4.406 16.575 27.737 1.00 61.11 N ATOM 494 CA TYR A 71 -3.488 15.555 27.315 1.00 42.11 C ATOM 495 C TYR A 71 -2.887 14.815 28.505 1.00 12.34 C ATOM 496 O TYR A 71 -2.923 15.317 29.637 1.00 54.24 O ATOM 497 CB TYR A 71 -2.412 16.134 26.405 1.00 21.23 C ATOM 498 CG TYR A 71 -2.911 16.374 25.018 1.00 11.42 C ATOM 499 CD1 TYR A 71 -3.475 15.338 24.295 1.00 33.13 C ATOM 500 CD2 TYR A 71 -2.805 17.605 24.424 1.00 0.21 C ATOM 501 CE1 TYR A 71 -3.917 15.514 23.016 1.00 23.11 C ATOM 502 CE2 TYR A 71 -3.248 17.807 23.142 1.00 24.30 C ATOM 503 CZ TYR A 71 -3.800 16.759 22.431 1.00 14.15 C ATOM 504 OH TYR A 71 -4.222 16.972 21.131 1.00 24.44 O ATOM 0 H TYR A 71 -4.022 17.520 27.727 1.00 61.11 H new ATOM 0 HA TYR A 71 -4.048 14.820 26.736 1.00 42.11 H new ATOM 0 HB2 TYR A 71 -2.050 17.072 26.826 1.00 21.23 H new ATOM 0 HB3 TYR A 71 -1.563 15.451 26.370 1.00 21.23 H new ATOM 0 HD1 TYR A 71 -3.568 14.365 24.755 1.00 33.13 H new ATOM 0 HD2 TYR A 71 -2.367 18.426 24.973 1.00 0.21 H new ATOM 0 HE1 TYR A 71 -4.352 14.691 22.469 1.00 23.11 H new ATOM 0 HE2 TYR A 71 -3.165 18.784 22.689 1.00 24.30 H new ATOM 0 HH TYR A 71 -5.010 16.419 20.948 1.00 24.44 H new ATOM 514 N PRO A 72 -2.361 13.600 28.286 1.00 15.42 N ATOM 515 CA PRO A 72 -1.754 12.803 29.350 1.00 75.30 C ATOM 516 C PRO A 72 -0.402 13.376 29.813 1.00 32.22 C ATOM 517 O PRO A 72 0.217 14.185 29.105 1.00 4.32 O ATOM 518 CB PRO A 72 -1.534 11.441 28.661 1.00 73.35 C ATOM 519 CG PRO A 72 -1.402 11.750 27.223 1.00 23.45 C ATOM 520 CD PRO A 72 -2.324 12.889 26.976 1.00 12.12 C ATOM 0 HA PRO A 72 -2.374 12.768 30.246 1.00 75.30 H new ATOM 0 HB2 PRO A 72 -0.640 10.948 29.041 1.00 73.35 H new ATOM 0 HB3 PRO A 72 -2.372 10.768 28.844 1.00 73.35 H new ATOM 0 HG2 PRO A 72 -0.375 12.014 26.971 1.00 23.45 H new ATOM 0 HG3 PRO A 72 -1.669 10.889 26.610 1.00 23.45 H new ATOM 0 HD2 PRO A 72 -1.958 13.536 26.179 1.00 12.12 H new ATOM 0 HD3 PRO A 72 -3.315 12.546 26.678 1.00 12.12 H new ATOM 528 N SER A 73 0.048 13.000 31.003 1.00 53.11 N ATOM 529 CA SER A 73 1.371 13.363 31.403 1.00 1.34 C ATOM 530 C SER A 73 2.225 12.169 31.074 1.00 74.43 C ATOM 531 O SER A 73 1.703 11.066 30.997 1.00 63.13 O ATOM 532 CB SER A 73 1.411 13.689 32.892 1.00 23.11 C ATOM 533 OG SER A 73 0.895 12.615 33.658 1.00 65.01 O ATOM 0 H SER A 73 -0.482 12.456 31.684 1.00 53.11 H new ATOM 0 HA SER A 73 1.727 14.257 30.891 1.00 1.34 H new ATOM 0 HB2 SER A 73 2.437 13.898 33.195 1.00 23.11 H new ATOM 0 HB3 SER A 73 0.831 14.591 33.087 1.00 23.11 H new ATOM 0 HG SER A 73 -0.082 12.682 33.698 1.00 65.01 H new ATOM 539 N THR A 74 3.494 12.338 30.865 1.00 12.41 N ATOM 540 CA THR A 74 4.320 11.220 30.468 1.00 13.43 C ATOM 541 C THR A 74 4.479 10.218 31.629 1.00 45.30 C ATOM 542 O THR A 74 4.982 9.113 31.460 1.00 14.51 O ATOM 543 CB THR A 74 5.679 11.703 29.896 1.00 64.51 C ATOM 544 OG1 THR A 74 6.110 10.814 28.834 1.00 13.31 O ATOM 545 CG2 THR A 74 6.759 11.792 30.991 1.00 25.22 C ATOM 0 H THR A 74 3.985 13.227 30.959 1.00 12.41 H new ATOM 0 HA THR A 74 3.820 10.687 29.660 1.00 13.43 H new ATOM 0 HB THR A 74 5.537 12.706 29.494 1.00 64.51 H new ATOM 0 HG1 THR A 74 6.968 11.124 28.475 1.00 13.31 H new ATOM 0 HG21 THR A 74 7.696 12.134 30.551 1.00 25.22 H new ATOM 0 HG22 THR A 74 6.441 12.496 31.759 1.00 25.22 H new ATOM 0 HG23 THR A 74 6.905 10.809 31.438 1.00 25.22 H new ATOM 553 N GLN A 75 4.031 10.620 32.793 1.00 62.14 N ATOM 554 CA GLN A 75 4.037 9.762 33.918 1.00 15.44 C ATOM 555 C GLN A 75 2.640 9.216 34.184 1.00 71.41 C ATOM 556 O GLN A 75 2.355 8.048 33.869 1.00 22.14 O ATOM 557 CB GLN A 75 4.550 10.535 35.106 1.00 24.41 C ATOM 558 CG GLN A 75 6.014 10.863 35.001 1.00 71.35 C ATOM 559 CD GLN A 75 6.474 11.776 36.087 1.00 14.23 C ATOM 560 OE1 GLN A 75 6.492 12.988 35.926 1.00 24.34 O ATOM 561 NE2 GLN A 75 6.776 11.223 37.205 1.00 24.34 N ATOM 0 H GLN A 75 3.656 11.552 32.972 1.00 62.14 H new ATOM 0 HA GLN A 75 4.689 8.909 33.730 1.00 15.44 H new ATOM 0 HB2 GLN A 75 3.982 11.460 35.205 1.00 24.41 H new ATOM 0 HB3 GLN A 75 4.376 9.956 36.013 1.00 24.41 H new ATOM 0 HG2 GLN A 75 6.593 9.940 35.037 1.00 71.35 H new ATOM 0 HG3 GLN A 75 6.211 11.326 34.034 1.00 71.35 H new ATOM 0 HE21 GLN A 75 6.748 10.207 37.296 1.00 24.34 H new ATOM 0 HE22 GLN A 75 7.044 11.799 38.003 1.00 24.34 H new ATOM 570 N GLN A 76 1.721 10.088 34.576 1.00 44.13 N ATOM 571 CA GLN A 76 0.401 9.635 34.962 1.00 30.54 C ATOM 572 C GLN A 76 -0.456 9.410 33.780 1.00 63.24 C ATOM 573 O GLN A 76 -1.176 8.437 33.737 1.00 2.01 O ATOM 574 CB GLN A 76 -0.276 10.569 35.953 1.00 61.32 C ATOM 575 CG GLN A 76 0.450 10.695 37.278 1.00 61.24 C ATOM 576 CD GLN A 76 -0.344 11.454 38.328 1.00 44.40 C ATOM 577 OE1 GLN A 76 -0.209 11.191 39.518 1.00 44.30 O ATOM 578 NE2 GLN A 76 -1.179 12.373 37.912 1.00 62.42 N ATOM 0 H GLN A 76 1.865 11.096 34.633 1.00 44.13 H new ATOM 0 HA GLN A 76 0.541 8.682 35.473 1.00 30.54 H new ATOM 0 HB2 GLN A 76 -0.363 11.558 35.503 1.00 61.32 H new ATOM 0 HB3 GLN A 76 -1.289 10.213 36.138 1.00 61.32 H new ATOM 0 HG2 GLN A 76 0.679 9.698 37.655 1.00 61.24 H new ATOM 0 HG3 GLN A 76 1.402 11.201 37.116 1.00 61.24 H new ATOM 0 HE21 GLN A 76 -1.268 12.568 36.915 1.00 62.42 H new ATOM 0 HE22 GLN A 76 -1.741 12.894 38.585 1.00 62.42 H new ATOM 587 N GLY A 77 -0.339 10.266 32.781 1.00 33.22 N ATOM 588 CA GLY A 77 -1.131 10.066 31.629 1.00 72.41 C ATOM 589 C GLY A 77 -0.663 8.880 30.814 1.00 23.34 C ATOM 590 O GLY A 77 -1.422 8.354 30.050 1.00 1.34 O ATOM 0 H GLY A 77 0.282 11.075 32.761 1.00 33.22 H new ATOM 0 HA2 GLY A 77 -2.169 9.915 31.925 1.00 72.41 H new ATOM 0 HA3 GLY A 77 -1.104 10.963 31.011 1.00 72.41 H new ATOM 594 N LEU A 78 0.592 8.454 30.991 1.00 11.41 N ATOM 595 CA LEU A 78 1.096 7.304 30.249 1.00 12.21 C ATOM 596 C LEU A 78 0.439 6.065 30.825 1.00 63.51 C ATOM 597 O LEU A 78 -0.123 5.241 30.093 1.00 40.04 O ATOM 598 CB LEU A 78 2.645 7.243 30.309 1.00 40.22 C ATOM 599 CG LEU A 78 3.381 6.283 29.329 1.00 2.41 C ATOM 600 CD1 LEU A 78 4.861 6.607 29.307 1.00 53.41 C ATOM 601 CD2 LEU A 78 3.202 4.816 29.709 1.00 32.22 C ATOM 0 H LEU A 78 1.263 8.881 31.630 1.00 11.41 H new ATOM 0 HA LEU A 78 0.846 7.382 29.191 1.00 12.21 H new ATOM 0 HB2 LEU A 78 3.025 8.250 30.137 1.00 40.22 H new ATOM 0 HB3 LEU A 78 2.928 6.964 31.324 1.00 40.22 H new ATOM 0 HG LEU A 78 2.940 6.432 28.343 1.00 2.41 H new ATOM 0 HD11 LEU A 78 5.371 5.932 28.620 1.00 53.41 H new ATOM 0 HD12 LEU A 78 5.003 7.636 28.978 1.00 53.41 H new ATOM 0 HD13 LEU A 78 5.275 6.486 30.308 1.00 53.41 H new ATOM 0 HD21 LEU A 78 3.734 4.188 28.995 1.00 32.22 H new ATOM 0 HD22 LEU A 78 3.602 4.648 30.709 1.00 32.22 H new ATOM 0 HD23 LEU A 78 2.142 4.563 29.695 1.00 32.22 H new ATOM 613 N GLU A 79 0.439 5.978 32.147 1.00 72.34 N ATOM 614 CA GLU A 79 -0.247 4.901 32.820 1.00 64.21 C ATOM 615 C GLU A 79 -1.728 4.991 32.588 1.00 2.31 C ATOM 616 O GLU A 79 -2.373 3.997 32.490 1.00 14.13 O ATOM 617 CB GLU A 79 0.076 4.846 34.306 1.00 44.11 C ATOM 618 CG GLU A 79 1.441 4.276 34.585 1.00 44.41 C ATOM 619 CD GLU A 79 1.795 4.269 36.045 1.00 72.32 C ATOM 620 OE1 GLU A 79 1.451 3.298 36.749 1.00 43.04 O ATOM 621 OE2 GLU A 79 2.454 5.229 36.525 1.00 51.02 O ATOM 0 H GLU A 79 0.906 6.640 32.767 1.00 72.34 H new ATOM 0 HA GLU A 79 0.115 3.968 32.389 1.00 64.21 H new ATOM 0 HB2 GLU A 79 0.014 5.851 34.724 1.00 44.11 H new ATOM 0 HB3 GLU A 79 -0.676 4.242 34.815 1.00 44.11 H new ATOM 0 HG2 GLU A 79 1.486 3.256 34.202 1.00 44.41 H new ATOM 0 HG3 GLU A 79 2.187 4.855 34.040 1.00 44.41 H new ATOM 628 N ALA A 80 -2.228 6.199 32.432 1.00 45.25 N ATOM 629 CA ALA A 80 -3.639 6.442 32.171 1.00 13.14 C ATOM 630 C ALA A 80 -3.984 6.280 30.688 1.00 62.31 C ATOM 631 O ALA A 80 -5.140 6.417 30.283 1.00 32.04 O ATOM 632 CB ALA A 80 -4.006 7.824 32.613 1.00 12.20 C ATOM 0 H ALA A 80 -1.666 7.049 32.482 1.00 45.25 H new ATOM 0 HA ALA A 80 -4.207 5.701 32.733 1.00 13.14 H new ATOM 0 HB1 ALA A 80 -5.063 8.001 32.415 1.00 12.20 H new ATOM 0 HB2 ALA A 80 -3.814 7.927 33.681 1.00 12.20 H new ATOM 0 HB3 ALA A 80 -3.408 8.552 32.065 1.00 12.20 H new ATOM 638 N LEU A 81 -2.986 6.061 29.883 1.00 72.31 N ATOM 639 CA LEU A 81 -3.186 5.856 28.470 1.00 52.24 C ATOM 640 C LEU A 81 -3.225 4.347 28.206 1.00 73.33 C ATOM 641 O LEU A 81 -3.794 3.872 27.216 1.00 53.21 O ATOM 642 CB LEU A 81 -2.023 6.507 27.708 1.00 4.01 C ATOM 643 CG LEU A 81 -2.245 6.863 26.248 1.00 53.34 C ATOM 644 CD1 LEU A 81 -3.323 7.935 26.109 1.00 63.12 C ATOM 645 CD2 LEU A 81 -0.931 7.319 25.616 1.00 45.23 C ATOM 0 H LEU A 81 -2.012 6.019 30.182 1.00 72.31 H new ATOM 0 HA LEU A 81 -4.121 6.305 28.136 1.00 52.24 H new ATOM 0 HB2 LEU A 81 -1.745 7.419 28.237 1.00 4.01 H new ATOM 0 HB3 LEU A 81 -1.168 5.833 27.762 1.00 4.01 H new ATOM 0 HG LEU A 81 -2.593 5.975 25.719 1.00 53.34 H new ATOM 0 HD11 LEU A 81 -3.465 8.174 25.055 1.00 63.12 H new ATOM 0 HD12 LEU A 81 -4.260 7.565 26.527 1.00 63.12 H new ATOM 0 HD13 LEU A 81 -3.015 8.832 26.646 1.00 63.12 H new ATOM 0 HD21 LEU A 81 -1.099 7.572 24.569 1.00 45.23 H new ATOM 0 HD22 LEU A 81 -0.557 8.195 26.146 1.00 45.23 H new ATOM 0 HD23 LEU A 81 -0.198 6.515 25.681 1.00 45.23 H new ATOM 657 N VAL A 82 -2.597 3.604 29.101 1.00 13.14 N ATOM 658 CA VAL A 82 -2.544 2.150 29.013 1.00 10.53 C ATOM 659 C VAL A 82 -3.565 1.508 29.970 1.00 1.44 C ATOM 660 O VAL A 82 -4.207 0.502 29.640 1.00 61.53 O ATOM 661 CB VAL A 82 -1.126 1.631 29.370 1.00 34.13 C ATOM 662 CG1 VAL A 82 -1.017 0.127 29.166 1.00 45.15 C ATOM 663 CG2 VAL A 82 -0.068 2.358 28.562 1.00 73.41 C ATOM 0 H VAL A 82 -2.109 3.989 29.910 1.00 13.14 H new ATOM 0 HA VAL A 82 -2.785 1.873 27.987 1.00 10.53 H new ATOM 0 HB VAL A 82 -0.955 1.837 30.427 1.00 34.13 H new ATOM 0 HG11 VAL A 82 -0.011 -0.203 29.425 1.00 45.15 H new ATOM 0 HG12 VAL A 82 -1.741 -0.380 29.804 1.00 45.15 H new ATOM 0 HG13 VAL A 82 -1.221 -0.114 28.123 1.00 45.15 H new ATOM 0 HG21 VAL A 82 0.918 1.978 28.829 1.00 73.41 H new ATOM 0 HG22 VAL A 82 -0.245 2.194 27.499 1.00 73.41 H new ATOM 0 HG23 VAL A 82 -0.116 3.426 28.777 1.00 73.41 H new ATOM 673 N LYS A 83 -3.700 2.108 31.124 1.00 3.51 N ATOM 674 CA LYS A 83 -4.562 1.672 32.205 1.00 74.30 C ATOM 675 C LYS A 83 -5.500 2.828 32.562 1.00 34.33 C ATOM 676 O LYS A 83 -5.168 3.959 32.319 1.00 10.25 O ATOM 677 CB LYS A 83 -3.709 1.234 33.406 1.00 61.52 C ATOM 678 CG LYS A 83 -2.859 -0.004 33.126 1.00 53.13 C ATOM 679 CD LYS A 83 -1.933 -0.356 34.286 1.00 1.10 C ATOM 680 CE LYS A 83 -2.690 -0.664 35.574 1.00 15.44 C ATOM 681 NZ LYS A 83 -1.770 -1.068 36.654 1.00 42.12 N ATOM 0 H LYS A 83 -3.187 2.959 31.352 1.00 3.51 H new ATOM 0 HA LYS A 83 -5.161 0.812 31.905 1.00 74.30 H new ATOM 0 HB2 LYS A 83 -3.055 2.056 33.697 1.00 61.52 H new ATOM 0 HB3 LYS A 83 -4.364 1.032 34.253 1.00 61.52 H new ATOM 0 HG2 LYS A 83 -3.514 -0.850 32.919 1.00 53.13 H new ATOM 0 HG3 LYS A 83 -2.263 0.164 32.229 1.00 53.13 H new ATOM 0 HD2 LYS A 83 -1.326 -1.219 34.011 1.00 1.10 H new ATOM 0 HD3 LYS A 83 -1.247 0.473 34.462 1.00 1.10 H new ATOM 0 HE2 LYS A 83 -3.255 0.215 35.885 1.00 15.44 H new ATOM 0 HE3 LYS A 83 -3.412 -1.460 35.392 1.00 15.44 H new ATOM 0 HZ1 LYS A 83 -2.315 -1.271 37.516 1.00 42.12 H new ATOM 0 HZ2 LYS A 83 -1.249 -1.920 36.365 1.00 42.12 H new ATOM 0 HZ3 LYS A 83 -1.097 -0.298 36.843 1.00 42.12 H new ATOM 695 N LYS A 84 -6.673 2.524 33.067 1.00 12.11 N ATOM 696 CA LYS A 84 -7.738 3.525 33.288 1.00 74.11 C ATOM 697 C LYS A 84 -7.280 4.727 34.147 1.00 35.44 C ATOM 698 O LYS A 84 -6.756 4.558 35.266 1.00 33.52 O ATOM 699 CB LYS A 84 -8.965 2.835 33.865 1.00 35.13 C ATOM 700 CG LYS A 84 -9.479 1.768 32.937 1.00 34.53 C ATOM 701 CD LYS A 84 -10.638 1.012 33.504 1.00 53.33 C ATOM 702 CE LYS A 84 -11.080 -0.032 32.514 1.00 62.42 C ATOM 703 NZ LYS A 84 -12.216 -0.826 33.001 1.00 31.45 N ATOM 0 H LYS A 84 -6.935 1.578 33.343 1.00 12.11 H new ATOM 0 HA LYS A 84 -7.996 3.960 32.322 1.00 74.11 H new ATOM 0 HB2 LYS A 84 -8.716 2.392 34.829 1.00 35.13 H new ATOM 0 HB3 LYS A 84 -9.748 3.572 34.045 1.00 35.13 H new ATOM 0 HG2 LYS A 84 -9.777 2.227 31.994 1.00 34.53 H new ATOM 0 HG3 LYS A 84 -8.672 1.071 32.711 1.00 34.53 H new ATOM 0 HD2 LYS A 84 -10.355 0.541 34.445 1.00 53.33 H new ATOM 0 HD3 LYS A 84 -11.460 1.694 33.723 1.00 53.33 H new ATOM 0 HE2 LYS A 84 -11.355 0.454 31.578 1.00 62.42 H new ATOM 0 HE3 LYS A 84 -10.244 -0.696 32.295 1.00 62.42 H new ATOM 0 HZ1 LYS A 84 -12.481 -1.530 32.283 1.00 31.45 H new ATOM 0 HZ2 LYS A 84 -11.948 -1.313 33.880 1.00 31.45 H new ATOM 0 HZ3 LYS A 84 -13.024 -0.198 33.186 1.00 31.45 H new ATOM 717 N PRO A 85 -7.511 5.953 33.620 1.00 61.11 N ATOM 718 CA PRO A 85 -7.012 7.214 34.176 1.00 11.21 C ATOM 719 C PRO A 85 -7.376 7.487 35.616 1.00 33.10 C ATOM 720 O PRO A 85 -8.548 7.528 36.004 1.00 24.23 O ATOM 721 CB PRO A 85 -7.612 8.293 33.272 1.00 54.30 C ATOM 722 CG PRO A 85 -8.731 7.621 32.583 1.00 21.04 C ATOM 723 CD PRO A 85 -8.305 6.205 32.416 1.00 43.03 C ATOM 0 HA PRO A 85 -5.923 7.185 34.195 1.00 11.21 H new ATOM 0 HB2 PRO A 85 -7.960 9.148 33.852 1.00 54.30 H new ATOM 0 HB3 PRO A 85 -6.876 8.668 32.561 1.00 54.30 H new ATOM 0 HG2 PRO A 85 -9.648 7.688 33.168 1.00 21.04 H new ATOM 0 HG3 PRO A 85 -8.933 8.086 31.618 1.00 21.04 H new ATOM 0 HD2 PRO A 85 -9.160 5.532 32.349 1.00 43.03 H new ATOM 0 HD3 PRO A 85 -7.717 6.065 31.509 1.00 43.03 H new ATOM 731 N THR A 86 -6.367 7.683 36.384 1.00 44.10 N ATOM 732 CA THR A 86 -6.485 8.046 37.746 1.00 44.55 C ATOM 733 C THR A 86 -6.275 9.545 37.861 1.00 21.20 C ATOM 734 O THR A 86 -5.189 10.060 37.557 1.00 51.40 O ATOM 735 CB THR A 86 -5.452 7.277 38.568 1.00 61.53 C ATOM 736 OG1 THR A 86 -4.226 7.184 37.806 1.00 71.12 O ATOM 737 CG2 THR A 86 -5.959 5.884 38.891 1.00 62.20 C ATOM 0 H THR A 86 -5.401 7.591 36.068 1.00 44.10 H new ATOM 0 HA THR A 86 -7.474 7.795 38.130 1.00 44.55 H new ATOM 0 HB THR A 86 -5.273 7.804 39.505 1.00 61.53 H new ATOM 0 HG1 THR A 86 -4.013 8.060 37.421 1.00 71.12 H new ATOM 0 HG21 THR A 86 -5.210 5.351 39.477 1.00 62.20 H new ATOM 0 HG22 THR A 86 -6.883 5.957 39.464 1.00 62.20 H new ATOM 0 HG23 THR A 86 -6.148 5.342 37.965 1.00 62.20 H new ATOM 745 N GLY A 87 -7.293 10.233 38.261 1.00 34.21 N ATOM 746 CA GLY A 87 -7.255 11.657 38.314 1.00 0.53 C ATOM 747 C GLY A 87 -8.630 12.189 38.105 1.00 2.04 C ATOM 748 O GLY A 87 -9.526 11.888 38.888 1.00 41.30 O ATOM 0 H GLY A 87 -8.177 9.822 38.561 1.00 34.21 H new ATOM 0 HA2 GLY A 87 -6.866 11.987 39.277 1.00 0.53 H new ATOM 0 HA3 GLY A 87 -6.582 12.044 37.549 1.00 0.53 H new ATOM 752 N ASN A 88 -8.839 12.926 37.045 1.00 14.25 N ATOM 753 CA ASN A 88 -10.161 13.465 36.768 1.00 63.40 C ATOM 754 C ASN A 88 -10.492 13.336 35.298 1.00 55.34 C ATOM 755 O ASN A 88 -10.078 14.174 34.501 1.00 11.21 O ATOM 756 CB ASN A 88 -10.297 14.953 37.182 1.00 42.21 C ATOM 757 CG ASN A 88 -9.949 15.230 38.633 1.00 35.43 C ATOM 758 OD1 ASN A 88 -10.786 15.094 39.530 1.00 72.03 O ATOM 759 ND2 ASN A 88 -8.732 15.658 38.874 1.00 1.23 N ATOM 0 H ASN A 88 -8.123 13.170 36.360 1.00 14.25 H new ATOM 0 HA ASN A 88 -10.860 12.880 37.365 1.00 63.40 H new ATOM 0 HB2 ASN A 88 -9.651 15.556 36.544 1.00 42.21 H new ATOM 0 HB3 ASN A 88 -11.321 15.278 36.997 1.00 42.21 H new ATOM 0 HD21 ASN A 88 -8.452 15.890 39.827 1.00 1.23 H new ATOM 0 HD22 ASN A 88 -8.066 15.759 38.108 1.00 1.23 H new ATOM 766 N PRO A 89 -11.120 12.235 34.886 1.00 24.23 N ATOM 767 CA PRO A 89 -11.613 12.080 33.546 1.00 22.43 C ATOM 768 C PRO A 89 -13.092 12.376 33.437 1.00 73.04 C ATOM 769 O PRO A 89 -13.845 12.409 34.419 1.00 53.14 O ATOM 770 CB PRO A 89 -11.259 10.626 33.201 1.00 20.43 C ATOM 771 CG PRO A 89 -11.165 9.925 34.547 1.00 73.42 C ATOM 772 CD PRO A 89 -11.308 10.995 35.633 1.00 10.12 C ATOM 0 HA PRO A 89 -11.168 12.787 32.846 1.00 22.43 H new ATOM 0 HB2 PRO A 89 -12.022 10.171 32.570 1.00 20.43 H new ATOM 0 HB3 PRO A 89 -10.317 10.566 32.656 1.00 20.43 H new ATOM 0 HG2 PRO A 89 -11.948 9.173 34.644 1.00 73.42 H new ATOM 0 HG3 PRO A 89 -10.211 9.406 34.643 1.00 73.42 H new ATOM 0 HD2 PRO A 89 -12.285 10.956 36.114 1.00 10.12 H new ATOM 0 HD3 PRO A 89 -10.561 10.878 36.418 1.00 10.12 H new ATOM 780 N GLN A 90 -13.465 12.581 32.250 1.00 62.01 N ATOM 781 CA GLN A 90 -14.728 13.034 31.857 1.00 44.24 C ATOM 782 C GLN A 90 -15.409 11.868 31.171 1.00 71.25 C ATOM 783 O GLN A 90 -14.780 11.253 30.345 1.00 20.12 O ATOM 784 CB GLN A 90 -14.416 14.136 30.866 1.00 70.21 C ATOM 785 CG GLN A 90 -15.472 15.156 30.677 1.00 51.01 C ATOM 786 CD GLN A 90 -16.701 14.666 29.919 1.00 10.42 C ATOM 787 OE1 GLN A 90 -16.512 13.773 28.965 1.00 64.40 O flip ATOM 788 NE2 GLN A 90 -17.813 15.122 30.162 1.00 25.13 N flip ATOM 0 H GLN A 90 -12.844 12.424 31.457 1.00 62.01 H new ATOM 0 HA GLN A 90 -15.371 13.391 32.662 1.00 44.24 H new ATOM 0 HB2 GLN A 90 -13.505 14.640 31.188 1.00 70.21 H new ATOM 0 HB3 GLN A 90 -14.203 13.679 29.900 1.00 70.21 H new ATOM 0 HG2 GLN A 90 -15.786 15.520 31.655 1.00 51.01 H new ATOM 0 HG3 GLN A 90 -15.047 16.005 30.142 1.00 51.01 H new ATOM 0 HE21 GLN A 90 -17.930 15.811 30.905 1.00 25.13 H new ATOM 0 HE22 GLN A 90 -18.621 14.812 29.621 1.00 25.13 H new ATOM 797 N PRO A 91 -16.685 11.542 31.508 1.00 42.34 N ATOM 798 CA PRO A 91 -17.416 10.378 30.941 1.00 13.13 C ATOM 799 C PRO A 91 -17.311 10.249 29.404 1.00 55.30 C ATOM 800 O PRO A 91 -17.968 10.975 28.634 1.00 1.44 O ATOM 801 CB PRO A 91 -18.878 10.600 31.375 1.00 14.45 C ATOM 802 CG PRO A 91 -18.915 11.978 31.959 1.00 55.12 C ATOM 803 CD PRO A 91 -17.528 12.268 32.460 1.00 14.35 C ATOM 0 HA PRO A 91 -16.986 9.446 31.307 1.00 13.13 H new ATOM 0 HB2 PRO A 91 -19.557 10.515 30.527 1.00 14.45 H new ATOM 0 HB3 PRO A 91 -19.188 9.855 32.107 1.00 14.45 H new ATOM 0 HG2 PRO A 91 -19.217 12.709 31.209 1.00 55.12 H new ATOM 0 HG3 PRO A 91 -19.640 12.036 32.771 1.00 55.12 H new ATOM 0 HD2 PRO A 91 -17.312 13.336 32.459 1.00 14.35 H new ATOM 0 HD3 PRO A 91 -17.384 11.914 33.481 1.00 14.35 H new ATOM 811 N LYS A 92 -16.421 9.384 28.999 1.00 62.30 N ATOM 812 CA LYS A 92 -16.140 9.056 27.640 1.00 34.34 C ATOM 813 C LYS A 92 -15.625 7.624 27.641 1.00 70.43 C ATOM 814 O LYS A 92 -15.137 7.166 28.679 1.00 63.44 O ATOM 815 CB LYS A 92 -15.108 10.022 27.058 1.00 31.43 C ATOM 816 CG LYS A 92 -14.843 9.814 25.587 1.00 11.01 C ATOM 817 CD LYS A 92 -13.862 10.826 25.059 1.00 70.02 C ATOM 818 CE LYS A 92 -13.590 10.615 23.584 1.00 73.13 C ATOM 819 NZ LYS A 92 -14.798 10.771 22.760 1.00 42.10 N ATOM 0 H LYS A 92 -15.841 8.861 29.655 1.00 62.30 H new ATOM 0 HA LYS A 92 -17.029 9.142 27.016 1.00 34.34 H new ATOM 0 HB2 LYS A 92 -15.452 11.044 27.215 1.00 31.43 H new ATOM 0 HB3 LYS A 92 -14.172 9.913 27.606 1.00 31.43 H new ATOM 0 HG2 LYS A 92 -14.455 8.809 25.424 1.00 11.01 H new ATOM 0 HG3 LYS A 92 -15.779 9.888 25.033 1.00 11.01 H new ATOM 0 HD2 LYS A 92 -14.253 11.831 25.218 1.00 70.02 H new ATOM 0 HD3 LYS A 92 -12.928 10.755 25.617 1.00 70.02 H new ATOM 0 HE2 LYS A 92 -12.834 11.326 23.252 1.00 73.13 H new ATOM 0 HE3 LYS A 92 -13.178 9.617 23.433 1.00 73.13 H new ATOM 0 HZ1 LYS A 92 -14.525 11.005 21.784 1.00 42.10 H new ATOM 0 HZ2 LYS A 92 -15.338 9.882 22.764 1.00 42.10 H new ATOM 0 HZ3 LYS A 92 -15.386 11.536 23.148 1.00 42.10 H new ATOM 833 N ASN A 93 -15.856 6.869 26.589 1.00 12.31 N ATOM 834 CA ASN A 93 -15.324 5.515 26.533 1.00 72.32 C ATOM 835 C ASN A 93 -13.797 5.524 26.302 1.00 3.40 C ATOM 836 O ASN A 93 -13.314 5.740 25.173 1.00 55.04 O ATOM 837 CB ASN A 93 -16.025 4.659 25.465 1.00 12.13 C ATOM 838 CG ASN A 93 -15.527 3.203 25.432 1.00 34.44 C ATOM 839 OD1 ASN A 93 -15.178 2.648 26.569 1.00 61.50 O flip ATOM 840 ND2 ASN A 93 -15.478 2.574 24.377 1.00 30.05 N flip ATOM 0 H ASN A 93 -16.397 7.157 25.774 1.00 12.31 H new ATOM 0 HA ASN A 93 -15.525 5.059 27.502 1.00 72.32 H new ATOM 0 HB2 ASN A 93 -17.099 4.665 25.651 1.00 12.13 H new ATOM 0 HB3 ASN A 93 -15.869 5.112 24.486 1.00 12.13 H new ATOM 0 HD21 ASN A 93 -15.753 3.022 23.503 1.00 30.05 H new ATOM 0 HD22 ASN A 93 -15.162 1.604 24.376 1.00 30.05 H new ATOM 847 N TRP A 94 -13.071 5.356 27.385 1.00 14.05 N ATOM 848 CA TRP A 94 -11.634 5.247 27.409 1.00 4.32 C ATOM 849 C TRP A 94 -11.143 4.018 26.616 1.00 64.31 C ATOM 850 O TRP A 94 -11.806 2.960 26.580 1.00 33.14 O ATOM 851 CB TRP A 94 -11.173 5.183 28.879 1.00 31.42 C ATOM 852 CG TRP A 94 -9.712 4.981 29.074 1.00 23.43 C ATOM 853 CD1 TRP A 94 -8.755 5.936 29.124 1.00 5.30 C ATOM 854 CD2 TRP A 94 -9.049 3.736 29.263 1.00 52.43 C ATOM 855 NE1 TRP A 94 -7.525 5.356 29.306 1.00 11.22 N ATOM 856 CE2 TRP A 94 -7.684 4.008 29.394 1.00 13.43 C ATOM 857 CE3 TRP A 94 -9.484 2.414 29.322 1.00 21.41 C ATOM 858 CZ2 TRP A 94 -6.754 3.013 29.580 1.00 62.33 C ATOM 859 CZ3 TRP A 94 -8.556 1.424 29.512 1.00 1.23 C ATOM 860 CH2 TRP A 94 -7.207 1.727 29.640 1.00 2.11 C ATOM 0 H TRP A 94 -13.488 5.289 28.314 1.00 14.05 H new ATOM 0 HA TRP A 94 -11.199 6.121 26.924 1.00 4.32 H new ATOM 0 HB2 TRP A 94 -11.466 6.108 29.376 1.00 31.42 H new ATOM 0 HB3 TRP A 94 -11.706 4.372 29.376 1.00 31.42 H new ATOM 0 HD1 TRP A 94 -8.933 6.997 29.034 1.00 5.30 H new ATOM 0 HE1 TRP A 94 -6.637 5.854 29.366 1.00 11.22 H new ATOM 0 HE3 TRP A 94 -10.532 2.174 29.220 1.00 21.41 H new ATOM 0 HZ2 TRP A 94 -5.703 3.241 29.675 1.00 62.33 H new ATOM 0 HZ3 TRP A 94 -8.878 0.394 29.563 1.00 1.23 H new ATOM 0 HH2 TRP A 94 -6.499 0.926 29.791 1.00 2.11 H new ATOM 871 N ASN A 95 -10.019 4.175 25.963 1.00 30.04 N ATOM 872 CA ASN A 95 -9.377 3.108 25.227 1.00 72.33 C ATOM 873 C ASN A 95 -7.963 2.921 25.746 1.00 52.35 C ATOM 874 O ASN A 95 -7.236 3.893 25.942 1.00 32.22 O ATOM 875 CB ASN A 95 -9.321 3.394 23.719 1.00 14.25 C ATOM 876 CG ASN A 95 -8.527 2.327 22.950 1.00 52.30 C ATOM 877 OD1 ASN A 95 -7.842 2.626 22.008 1.00 61.02 O ATOM 878 ND2 ASN A 95 -8.665 1.078 23.302 1.00 43.32 N ATOM 0 H ASN A 95 -9.514 5.061 25.925 1.00 30.04 H new ATOM 0 HA ASN A 95 -9.969 2.205 25.375 1.00 72.33 H new ATOM 0 HB2 ASN A 95 -10.335 3.444 23.323 1.00 14.25 H new ATOM 0 HB3 ASN A 95 -8.866 4.371 23.554 1.00 14.25 H new ATOM 0 HD21 ASN A 95 -8.189 0.344 22.776 1.00 43.32 H new ATOM 0 HD22 ASN A 95 -9.248 0.835 24.103 1.00 43.32 H new ATOM 885 N LYS A 96 -7.593 1.681 25.970 1.00 44.31 N ATOM 886 CA LYS A 96 -6.273 1.325 26.439 1.00 2.33 C ATOM 887 C LYS A 96 -5.252 1.417 25.330 1.00 44.12 C ATOM 888 O LYS A 96 -5.574 1.680 24.163 1.00 45.34 O ATOM 889 CB LYS A 96 -6.252 -0.130 26.904 1.00 61.45 C ATOM 890 CG LYS A 96 -6.509 -1.116 25.769 1.00 3.23 C ATOM 891 CD LYS A 96 -6.456 -2.557 26.227 1.00 4.34 C ATOM 892 CE LYS A 96 -6.816 -3.499 25.088 1.00 23.32 C ATOM 893 NZ LYS A 96 -5.931 -3.337 23.916 1.00 23.45 N ATOM 0 H LYS A 96 -8.209 0.880 25.830 1.00 44.31 H new ATOM 0 HA LYS A 96 -6.034 2.016 27.247 1.00 2.33 H new ATOM 0 HB2 LYS A 96 -5.285 -0.348 27.357 1.00 61.45 H new ATOM 0 HB3 LYS A 96 -7.006 -0.270 27.679 1.00 61.45 H new ATOM 0 HG2 LYS A 96 -7.486 -0.914 25.331 1.00 3.23 H new ATOM 0 HG3 LYS A 96 -5.769 -0.961 24.983 1.00 3.23 H new ATOM 0 HD2 LYS A 96 -5.457 -2.790 26.596 1.00 4.34 H new ATOM 0 HD3 LYS A 96 -7.145 -2.705 27.059 1.00 4.34 H new ATOM 0 HE2 LYS A 96 -6.760 -4.529 25.441 1.00 23.32 H new ATOM 0 HE3 LYS A 96 -7.848 -3.321 24.787 1.00 23.32 H new ATOM 0 HZ1 LYS A 96 -6.081 -4.126 23.256 1.00 23.45 H new ATOM 0 HZ2 LYS A 96 -6.149 -2.439 23.438 1.00 23.45 H new ATOM 0 HZ3 LYS A 96 -4.939 -3.331 24.228 1.00 23.45 H new ATOM 907 N ASP A 97 -4.027 1.182 25.729 1.00 42.41 N ATOM 908 CA ASP A 97 -2.887 0.971 24.854 1.00 5.30 C ATOM 909 C ASP A 97 -2.642 2.146 23.902 1.00 10.44 C ATOM 910 O ASP A 97 -2.103 1.993 22.803 1.00 60.30 O ATOM 911 CB ASP A 97 -3.025 -0.383 24.127 1.00 30.52 C ATOM 912 CG ASP A 97 -1.735 -0.865 23.487 1.00 74.34 C ATOM 913 OD1 ASP A 97 -0.727 -1.076 24.215 1.00 2.32 O ATOM 914 OD2 ASP A 97 -1.707 -1.070 22.256 1.00 73.05 O ATOM 0 H ASP A 97 -3.780 1.129 26.717 1.00 42.41 H new ATOM 0 HA ASP A 97 -1.989 0.927 25.470 1.00 5.30 H new ATOM 0 HB2 ASP A 97 -3.370 -1.134 24.838 1.00 30.52 H new ATOM 0 HB3 ASP A 97 -3.792 -0.296 23.357 1.00 30.52 H new ATOM 919 N GLY A 98 -3.020 3.324 24.344 1.00 63.44 N ATOM 920 CA GLY A 98 -2.603 4.506 23.640 1.00 43.14 C ATOM 921 C GLY A 98 -3.711 5.366 23.119 1.00 62.23 C ATOM 922 O GLY A 98 -3.435 6.462 22.649 1.00 53.24 O ATOM 0 H GLY A 98 -3.601 3.484 25.167 1.00 63.44 H new ATOM 0 HA2 GLY A 98 -1.983 5.106 24.306 1.00 43.14 H new ATOM 0 HA3 GLY A 98 -1.973 4.206 22.802 1.00 43.14 H new ATOM 926 N TYR A 99 -4.960 4.909 23.268 1.00 42.31 N ATOM 927 CA TYR A 99 -6.100 5.535 22.623 1.00 54.21 C ATOM 928 C TYR A 99 -5.920 5.480 21.114 1.00 74.40 C ATOM 929 O TYR A 99 -5.266 6.316 20.500 1.00 51.00 O ATOM 930 CB TYR A 99 -6.385 6.965 23.111 1.00 72.42 C ATOM 931 CG TYR A 99 -7.676 7.129 23.806 1.00 61.30 C ATOM 932 CD1 TYR A 99 -8.827 7.392 23.097 1.00 61.32 C ATOM 933 CD2 TYR A 99 -7.741 7.078 25.171 1.00 64.52 C ATOM 934 CE1 TYR A 99 -10.007 7.608 23.737 1.00 12.21 C ATOM 935 CE2 TYR A 99 -8.917 7.278 25.819 1.00 65.03 C ATOM 936 CZ TYR A 99 -10.049 7.551 25.096 1.00 61.24 C ATOM 937 OH TYR A 99 -11.209 7.788 25.729 1.00 20.32 O ATOM 0 H TYR A 99 -5.199 4.098 23.838 1.00 42.31 H new ATOM 0 HA TYR A 99 -6.985 4.965 22.907 1.00 54.21 H new ATOM 0 HB2 TYR A 99 -5.584 7.272 23.783 1.00 72.42 H new ATOM 0 HB3 TYR A 99 -6.360 7.639 22.255 1.00 72.42 H new ATOM 0 HD1 TYR A 99 -8.792 7.427 22.018 1.00 61.32 H new ATOM 0 HD2 TYR A 99 -6.846 6.876 25.740 1.00 64.52 H new ATOM 0 HE1 TYR A 99 -10.902 7.823 23.172 1.00 12.21 H new ATOM 0 HE2 TYR A 99 -8.960 7.222 26.897 1.00 65.03 H new ATOM 0 HH TYR A 99 -11.895 7.172 25.397 1.00 20.32 H new ATOM 947 N LEU A 100 -6.472 4.472 20.545 1.00 15.51 N ATOM 948 CA LEU A 100 -6.368 4.196 19.157 1.00 34.43 C ATOM 949 C LEU A 100 -7.798 3.917 18.695 1.00 53.22 C ATOM 950 O LEU A 100 -8.712 3.821 19.519 1.00 64.42 O ATOM 951 CB LEU A 100 -5.485 2.927 18.998 1.00 22.13 C ATOM 952 CG LEU A 100 -4.502 2.827 17.801 1.00 11.42 C ATOM 953 CD1 LEU A 100 -3.695 1.550 17.893 1.00 64.44 C ATOM 954 CD2 LEU A 100 -5.191 2.901 16.446 1.00 50.01 C ATOM 0 H LEU A 100 -7.032 3.788 21.053 1.00 15.51 H new ATOM 0 HA LEU A 100 -5.924 5.007 18.579 1.00 34.43 H new ATOM 0 HB2 LEU A 100 -4.900 2.819 19.911 1.00 22.13 H new ATOM 0 HB3 LEU A 100 -6.154 2.068 18.945 1.00 22.13 H new ATOM 0 HG LEU A 100 -3.846 3.695 17.870 1.00 11.42 H new ATOM 0 HD11 LEU A 100 -3.009 1.491 17.048 1.00 64.44 H new ATOM 0 HD12 LEU A 100 -3.126 1.545 18.823 1.00 64.44 H new ATOM 0 HD13 LEU A 100 -4.368 0.692 17.875 1.00 64.44 H new ATOM 0 HD21 LEU A 100 -4.446 2.825 15.654 1.00 50.01 H new ATOM 0 HD22 LEU A 100 -5.903 2.081 16.354 1.00 50.01 H new ATOM 0 HD23 LEU A 100 -5.719 3.851 16.358 1.00 50.01 H new ATOM 966 N LYS A 101 -8.008 3.828 17.427 1.00 5.01 N ATOM 967 CA LYS A 101 -9.297 3.460 16.907 1.00 4.35 C ATOM 968 C LYS A 101 -9.337 1.943 16.799 1.00 51.15 C ATOM 969 O LYS A 101 -8.462 1.251 17.330 1.00 44.04 O ATOM 970 CB LYS A 101 -9.489 4.040 15.521 1.00 63.51 C ATOM 971 CG LYS A 101 -9.425 5.542 15.413 1.00 33.04 C ATOM 972 CD LYS A 101 -9.756 5.941 13.996 1.00 61.34 C ATOM 973 CE LYS A 101 -9.675 7.439 13.783 1.00 42.42 C ATOM 974 NZ LYS A 101 -10.059 7.807 12.407 1.00 44.35 N ATOM 0 H LYS A 101 -7.299 4.006 16.716 1.00 5.01 H new ATOM 0 HA LYS A 101 -10.080 3.837 17.565 1.00 4.35 H new ATOM 0 HB2 LYS A 101 -8.729 3.617 14.864 1.00 63.51 H new ATOM 0 HB3 LYS A 101 -10.457 3.710 15.143 1.00 63.51 H new ATOM 0 HG2 LYS A 101 -10.128 6.001 16.108 1.00 33.04 H new ATOM 0 HG3 LYS A 101 -8.431 5.898 15.683 1.00 33.04 H new ATOM 0 HD2 LYS A 101 -9.070 5.442 13.311 1.00 61.34 H new ATOM 0 HD3 LYS A 101 -10.760 5.596 13.749 1.00 61.34 H new ATOM 0 HE2 LYS A 101 -10.329 7.945 14.493 1.00 42.42 H new ATOM 0 HE3 LYS A 101 -8.660 7.783 13.984 1.00 42.42 H new ATOM 0 HZ1 LYS A 101 -9.993 8.839 12.292 1.00 44.35 H new ATOM 0 HZ2 LYS A 101 -9.419 7.342 11.732 1.00 44.35 H new ATOM 0 HZ3 LYS A 101 -11.036 7.500 12.225 1.00 44.35 H new ATOM 988 N LYS A 102 -10.295 1.426 16.074 1.00 42.41 N ATOM 989 CA LYS A 102 -10.385 -0.015 15.842 1.00 3.42 C ATOM 990 C LYS A 102 -9.479 -0.477 14.683 1.00 52.14 C ATOM 991 O LYS A 102 -9.755 -1.452 13.995 1.00 55.21 O ATOM 992 CB LYS A 102 -11.853 -0.485 15.708 1.00 11.03 C ATOM 993 CG LYS A 102 -12.811 0.377 14.912 1.00 20.03 C ATOM 994 CD LYS A 102 -12.457 0.479 13.455 1.00 51.32 C ATOM 995 CE LYS A 102 -13.603 1.096 12.719 1.00 63.32 C ATOM 996 NZ LYS A 102 -13.282 1.361 11.309 1.00 73.21 N ATOM 0 H LYS A 102 -11.031 1.973 15.628 1.00 42.41 H new ATOM 0 HA LYS A 102 -9.994 -0.514 16.729 1.00 3.42 H new ATOM 0 HB2 LYS A 102 -11.845 -1.477 15.257 1.00 11.03 H new ATOM 0 HB3 LYS A 102 -12.260 -0.595 16.713 1.00 11.03 H new ATOM 0 HG2 LYS A 102 -13.817 -0.031 15.005 1.00 20.03 H new ATOM 0 HG3 LYS A 102 -12.831 1.378 15.344 1.00 20.03 H new ATOM 0 HD2 LYS A 102 -11.558 1.082 13.327 1.00 51.32 H new ATOM 0 HD3 LYS A 102 -12.238 -0.509 13.051 1.00 51.32 H new ATOM 0 HE2 LYS A 102 -14.467 0.433 12.774 1.00 63.32 H new ATOM 0 HE3 LYS A 102 -13.885 2.029 13.207 1.00 63.32 H new ATOM 0 HZ1 LYS A 102 -14.106 1.788 10.840 1.00 73.21 H new ATOM 0 HZ2 LYS A 102 -12.475 2.014 11.254 1.00 73.21 H new ATOM 0 HZ3 LYS A 102 -13.038 0.468 10.835 1.00 73.21 H new ATOM 1010 N LEU A 103 -8.372 0.206 14.548 1.00 13.01 N ATOM 1011 CA LEU A 103 -7.351 -0.054 13.555 1.00 55.34 C ATOM 1012 C LEU A 103 -6.266 -0.945 14.161 1.00 71.33 C ATOM 1013 O LEU A 103 -6.100 -0.951 15.392 1.00 54.11 O ATOM 1014 CB LEU A 103 -6.742 1.253 12.986 1.00 5.12 C ATOM 1015 CG LEU A 103 -7.517 1.954 11.844 1.00 3.53 C ATOM 1016 CD1 LEU A 103 -8.901 2.411 12.267 1.00 34.15 C ATOM 1017 CD2 LEU A 103 -6.715 3.123 11.307 1.00 34.21 C ATOM 0 H LEU A 103 -8.143 0.995 15.152 1.00 13.01 H new ATOM 0 HA LEU A 103 -7.817 -0.570 12.716 1.00 55.34 H new ATOM 0 HB2 LEU A 103 -6.635 1.962 13.807 1.00 5.12 H new ATOM 0 HB3 LEU A 103 -5.738 1.029 12.626 1.00 5.12 H new ATOM 0 HG LEU A 103 -7.657 1.216 11.055 1.00 3.53 H new ATOM 0 HD11 LEU A 103 -9.397 2.895 11.426 1.00 34.15 H new ATOM 0 HD12 LEU A 103 -9.487 1.549 12.587 1.00 34.15 H new ATOM 0 HD13 LEU A 103 -8.814 3.117 13.093 1.00 34.15 H new ATOM 0 HD21 LEU A 103 -7.271 3.608 10.504 1.00 34.21 H new ATOM 0 HD22 LEU A 103 -6.536 3.840 12.108 1.00 34.21 H new ATOM 0 HD23 LEU A 103 -5.761 2.763 10.922 1.00 34.21 H new ATOM 1029 N PRO A 104 -5.607 -1.788 13.337 1.00 53.42 N ATOM 1030 CA PRO A 104 -4.526 -2.692 13.784 1.00 64.41 C ATOM 1031 C PRO A 104 -3.282 -1.951 14.338 1.00 44.04 C ATOM 1032 O PRO A 104 -3.317 -0.768 14.651 1.00 61.34 O ATOM 1033 CB PRO A 104 -4.147 -3.476 12.515 1.00 44.12 C ATOM 1034 CG PRO A 104 -5.266 -3.260 11.564 1.00 44.13 C ATOM 1035 CD PRO A 104 -5.834 -1.916 11.885 1.00 23.22 C ATOM 0 HA PRO A 104 -4.867 -3.315 14.611 1.00 64.41 H new ATOM 0 HB2 PRO A 104 -3.205 -3.118 12.100 1.00 44.12 H new ATOM 0 HB3 PRO A 104 -4.017 -4.536 12.733 1.00 44.12 H new ATOM 0 HG2 PRO A 104 -4.913 -3.297 10.533 1.00 44.13 H new ATOM 0 HG3 PRO A 104 -6.022 -4.038 11.670 1.00 44.13 H new ATOM 0 HD2 PRO A 104 -5.333 -1.124 11.328 1.00 23.22 H new ATOM 0 HD3 PRO A 104 -6.894 -1.858 11.637 1.00 23.22 H new ATOM 1043 N VAL A 105 -2.208 -2.680 14.509 1.00 64.32 N ATOM 1044 CA VAL A 105 -0.979 -2.110 15.007 1.00 70.42 C ATOM 1045 C VAL A 105 -0.036 -1.890 13.800 1.00 20.44 C ATOM 1046 O VAL A 105 -0.410 -2.259 12.669 1.00 60.40 O ATOM 1047 CB VAL A 105 -0.353 -3.031 16.098 1.00 23.25 C ATOM 1048 CG1 VAL A 105 0.352 -4.253 15.523 1.00 42.11 C ATOM 1049 CG2 VAL A 105 0.524 -2.264 17.066 1.00 12.31 C ATOM 0 H VAL A 105 -2.159 -3.679 14.309 1.00 64.32 H new ATOM 0 HA VAL A 105 -1.160 -1.150 15.491 1.00 70.42 H new ATOM 0 HB VAL A 105 -1.194 -3.418 16.673 1.00 23.25 H new ATOM 0 HG11 VAL A 105 0.765 -4.851 16.336 1.00 42.11 H new ATOM 0 HG12 VAL A 105 -0.362 -4.852 14.958 1.00 42.11 H new ATOM 0 HG13 VAL A 105 1.158 -3.931 14.864 1.00 42.11 H new ATOM 0 HG21 VAL A 105 0.936 -2.950 17.806 1.00 12.31 H new ATOM 0 HG22 VAL A 105 1.338 -1.787 16.520 1.00 12.31 H new ATOM 0 HG23 VAL A 105 -0.070 -1.502 17.570 1.00 12.31 H new ATOM 1059 N ASP A 106 1.135 -1.298 14.005 1.00 40.04 N ATOM 1060 CA ASP A 106 2.047 -1.010 12.888 1.00 63.34 C ATOM 1061 C ASP A 106 2.634 -2.287 12.312 1.00 73.31 C ATOM 1062 O ASP A 106 2.761 -3.306 13.034 1.00 1.22 O ATOM 1063 CB ASP A 106 3.140 0.027 13.298 1.00 40.10 C ATOM 1064 CG ASP A 106 4.433 -0.057 12.568 1.00 40.32 C ATOM 1065 OD1 ASP A 106 4.497 0.458 11.450 1.00 73.34 O ATOM 1066 OD2 ASP A 106 5.413 -0.579 13.159 1.00 5.01 O ATOM 0 H ASP A 106 1.479 -1.008 14.921 1.00 40.04 H new ATOM 0 HA ASP A 106 1.468 -0.547 12.089 1.00 63.34 H new ATOM 0 HB2 ASP A 106 2.732 1.028 13.158 1.00 40.10 H new ATOM 0 HB3 ASP A 106 3.340 -0.089 14.363 1.00 40.10 H new ATOM 1071 N PRO A 107 2.849 -2.315 10.969 1.00 21.22 N ATOM 1072 CA PRO A 107 3.507 -3.416 10.276 1.00 72.32 C ATOM 1073 C PRO A 107 4.839 -3.789 10.905 1.00 31.25 C ATOM 1074 O PRO A 107 5.321 -3.142 11.787 1.00 43.41 O ATOM 1075 CB PRO A 107 3.758 -2.881 8.872 1.00 13.43 C ATOM 1076 CG PRO A 107 3.460 -1.421 8.941 1.00 44.54 C ATOM 1077 CD PRO A 107 2.460 -1.260 10.026 1.00 73.02 C ATOM 0 HA PRO A 107 2.891 -4.315 10.310 1.00 72.32 H new ATOM 0 HB2 PRO A 107 4.789 -3.057 8.564 1.00 13.43 H new ATOM 0 HB3 PRO A 107 3.118 -3.378 8.143 1.00 13.43 H new ATOM 0 HG2 PRO A 107 4.362 -0.848 9.154 1.00 44.54 H new ATOM 0 HG3 PRO A 107 3.068 -1.057 7.991 1.00 44.54 H new ATOM 0 HD2 PRO A 107 2.509 -0.270 10.480 1.00 73.02 H new ATOM 0 HD3 PRO A 107 1.441 -1.394 9.663 1.00 73.02 H new ATOM 1085 N TRP A 108 5.408 -4.878 10.439 1.00 70.32 N ATOM 1086 CA TRP A 108 6.678 -5.450 10.938 1.00 44.14 C ATOM 1087 C TRP A 108 6.511 -5.862 12.419 1.00 55.12 C ATOM 1088 O TRP A 108 7.486 -6.124 13.139 1.00 43.13 O ATOM 1089 CB TRP A 108 7.863 -4.458 10.819 1.00 75.34 C ATOM 1090 CG TRP A 108 7.841 -3.627 9.586 1.00 53.24 C ATOM 1091 CD1 TRP A 108 8.035 -4.026 8.311 1.00 73.02 C ATOM 1092 CD2 TRP A 108 7.583 -2.233 9.548 1.00 54.54 C ATOM 1093 NE1 TRP A 108 7.913 -2.947 7.466 1.00 41.15 N ATOM 1094 CE2 TRP A 108 7.623 -1.824 8.225 1.00 40.25 C ATOM 1095 CE3 TRP A 108 7.316 -1.302 10.535 1.00 33.32 C ATOM 1096 CZ2 TRP A 108 7.393 -0.491 7.864 1.00 60.21 C ATOM 1097 CZ3 TRP A 108 7.087 -0.016 10.199 1.00 53.33 C ATOM 1098 CH2 TRP A 108 7.117 0.399 8.900 1.00 30.11 C ATOM 0 H TRP A 108 5.001 -5.421 9.678 1.00 70.32 H new ATOM 0 HA TRP A 108 6.908 -6.317 10.318 1.00 44.14 H new ATOM 0 HB2 TRP A 108 7.860 -3.799 11.688 1.00 75.34 H new ATOM 0 HB3 TRP A 108 8.797 -5.020 10.849 1.00 75.34 H new ATOM 0 HD1 TRP A 108 8.253 -5.038 8.002 1.00 73.02 H new ATOM 0 HE1 TRP A 108 8.018 -2.970 6.452 1.00 41.15 H new ATOM 0 HE3 TRP A 108 7.291 -1.604 11.572 1.00 33.32 H new ATOM 0 HZ2 TRP A 108 7.428 -0.169 6.834 1.00 60.21 H new ATOM 0 HZ3 TRP A 108 6.875 0.702 10.977 1.00 53.33 H new ATOM 0 HH2 TRP A 108 6.923 1.436 8.670 1.00 30.11 H new ATOM 1109 N GLY A 109 5.262 -5.924 12.832 1.00 44.01 N ATOM 1110 CA GLY A 109 4.862 -6.360 14.144 1.00 4.25 C ATOM 1111 C GLY A 109 5.154 -5.396 15.302 1.00 0.42 C ATOM 1112 O GLY A 109 5.056 -5.816 16.448 1.00 5.24 O ATOM 0 H GLY A 109 4.474 -5.662 12.239 1.00 44.01 H new ATOM 0 HA2 GLY A 109 3.790 -6.558 14.126 1.00 4.25 H new ATOM 0 HA3 GLY A 109 5.358 -7.308 14.355 1.00 4.25 H new ATOM 1116 N ASN A 110 5.506 -4.130 15.050 1.00 35.11 N ATOM 1117 CA ASN A 110 5.818 -3.230 16.145 1.00 22.24 C ATOM 1118 C ASN A 110 4.558 -2.707 16.811 1.00 33.35 C ATOM 1119 O ASN A 110 3.625 -2.205 16.136 1.00 54.51 O ATOM 1120 CB ASN A 110 6.651 -2.003 15.723 1.00 21.45 C ATOM 1121 CG ASN A 110 7.838 -2.303 14.855 1.00 44.33 C ATOM 1122 OD1 ASN A 110 8.917 -2.693 15.337 1.00 52.24 O ATOM 1123 ND2 ASN A 110 7.696 -2.037 13.595 1.00 45.35 N ATOM 0 H ASN A 110 5.579 -3.721 14.118 1.00 35.11 H new ATOM 0 HA ASN A 110 6.407 -3.837 16.833 1.00 22.24 H new ATOM 0 HB2 ASN A 110 6.000 -1.307 15.193 1.00 21.45 H new ATOM 0 HB3 ASN A 110 6.998 -1.493 16.622 1.00 21.45 H new ATOM 0 HD21 ASN A 110 8.486 -2.145 12.959 1.00 45.35 H new ATOM 0 HD22 ASN A 110 6.794 -1.720 13.239 1.00 45.35 H new ATOM 1130 N PRO A 111 4.456 -2.895 18.136 1.00 75.42 N ATOM 1131 CA PRO A 111 3.457 -2.221 18.932 1.00 72.41 C ATOM 1132 C PRO A 111 3.775 -0.733 18.958 1.00 45.22 C ATOM 1133 O PRO A 111 4.945 -0.360 18.958 1.00 33.44 O ATOM 1134 CB PRO A 111 3.637 -2.820 20.335 1.00 62.24 C ATOM 1135 CG PRO A 111 4.368 -4.090 20.112 1.00 12.25 C ATOM 1136 CD PRO A 111 5.249 -3.835 18.936 1.00 74.54 C ATOM 0 HA PRO A 111 2.442 -2.342 18.554 1.00 72.41 H new ATOM 0 HB2 PRO A 111 4.200 -2.148 20.983 1.00 62.24 H new ATOM 0 HB3 PRO A 111 2.675 -2.996 20.817 1.00 62.24 H new ATOM 0 HG2 PRO A 111 4.953 -4.366 20.989 1.00 12.25 H new ATOM 0 HG3 PRO A 111 3.679 -4.912 19.917 1.00 12.25 H new ATOM 0 HD2 PRO A 111 6.206 -3.407 19.233 1.00 74.54 H new ATOM 0 HD3 PRO A 111 5.466 -4.751 18.387 1.00 74.54 H new ATOM 1144 N TYR A 112 2.756 0.097 19.007 1.00 62.54 N ATOM 1145 CA TYR A 112 2.941 1.536 19.001 1.00 61.13 C ATOM 1146 C TYR A 112 3.572 2.033 20.278 1.00 44.33 C ATOM 1147 O TYR A 112 3.338 1.489 21.369 1.00 52.22 O ATOM 1148 CB TYR A 112 1.658 2.320 18.652 1.00 42.11 C ATOM 1149 CG TYR A 112 1.320 2.306 17.174 1.00 74.14 C ATOM 1150 CD1 TYR A 112 1.961 3.174 16.300 1.00 43.22 C ATOM 1151 CD2 TYR A 112 0.381 1.432 16.651 1.00 22.11 C ATOM 1152 CE1 TYR A 112 1.681 3.171 14.947 1.00 22.44 C ATOM 1153 CE2 TYR A 112 0.092 1.427 15.297 1.00 23.32 C ATOM 1154 CZ TYR A 112 0.749 2.297 14.449 1.00 3.22 C ATOM 1155 OH TYR A 112 0.483 2.277 13.095 1.00 34.54 O ATOM 0 H TYR A 112 1.782 -0.201 19.052 1.00 62.54 H new ATOM 0 HA TYR A 112 3.642 1.736 18.191 1.00 61.13 H new ATOM 0 HB2 TYR A 112 0.822 1.900 19.211 1.00 42.11 H new ATOM 0 HB3 TYR A 112 1.773 3.353 18.980 1.00 42.11 H new ATOM 0 HD1 TYR A 112 2.694 3.866 16.686 1.00 43.22 H new ATOM 0 HD2 TYR A 112 -0.132 0.746 17.308 1.00 22.11 H new ATOM 0 HE1 TYR A 112 2.193 3.853 14.285 1.00 22.44 H new ATOM 0 HE2 TYR A 112 -0.646 0.744 14.904 1.00 23.32 H new ATOM 0 HH TYR A 112 -0.463 2.065 12.951 1.00 34.54 H new ATOM 1165 N GLN A 113 4.378 3.040 20.142 1.00 22.01 N ATOM 1166 CA GLN A 113 5.112 3.580 21.246 1.00 63.01 C ATOM 1167 C GLN A 113 4.376 4.822 21.649 1.00 53.55 C ATOM 1168 O GLN A 113 4.215 5.758 20.847 1.00 3.22 O ATOM 1169 CB GLN A 113 6.532 4.044 20.843 1.00 54.34 C ATOM 1170 CG GLN A 113 7.211 3.345 19.667 1.00 54.11 C ATOM 1171 CD GLN A 113 7.367 1.845 19.762 1.00 24.25 C ATOM 1172 OE1 GLN A 113 7.403 1.158 18.725 1.00 71.33 O ATOM 1173 NE2 GLN A 113 7.496 1.328 20.959 1.00 4.22 N ATOM 0 H GLN A 113 4.547 3.515 19.255 1.00 22.01 H new ATOM 0 HA GLN A 113 5.199 2.818 22.020 1.00 63.01 H new ATOM 0 HB2 GLN A 113 6.482 5.109 20.614 1.00 54.34 H new ATOM 0 HB3 GLN A 113 7.178 3.935 21.714 1.00 54.34 H new ATOM 0 HG2 GLN A 113 6.643 3.571 18.764 1.00 54.11 H new ATOM 0 HG3 GLN A 113 8.201 3.782 19.538 1.00 54.11 H new ATOM 0 HE21 GLN A 113 7.460 1.930 21.781 1.00 4.22 H new ATOM 0 HE22 GLN A 113 7.632 0.323 21.069 1.00 4.22 H new ATOM 1182 N TYR A 114 3.899 4.825 22.843 1.00 34.04 N ATOM 1183 CA TYR A 114 3.138 5.924 23.327 1.00 33.42 C ATOM 1184 C TYR A 114 3.859 6.671 24.421 1.00 51.54 C ATOM 1185 O TYR A 114 4.208 6.103 25.461 1.00 63.22 O ATOM 1186 CB TYR A 114 1.732 5.466 23.778 1.00 53.04 C ATOM 1187 CG TYR A 114 1.624 4.050 24.395 1.00 75.21 C ATOM 1188 CD1 TYR A 114 2.514 3.563 25.357 1.00 34.31 C ATOM 1189 CD2 TYR A 114 0.600 3.214 24.005 1.00 15.13 C ATOM 1190 CE1 TYR A 114 2.366 2.286 25.887 1.00 60.13 C ATOM 1191 CE2 TYR A 114 0.451 1.947 24.534 1.00 63.03 C ATOM 1192 CZ TYR A 114 1.322 1.490 25.461 1.00 62.32 C ATOM 1193 OH TYR A 114 1.141 0.225 25.980 1.00 51.23 O ATOM 0 H TYR A 114 4.025 4.066 23.513 1.00 34.04 H new ATOM 0 HA TYR A 114 3.011 6.624 22.501 1.00 33.42 H new ATOM 0 HB2 TYR A 114 1.359 6.184 24.508 1.00 53.04 H new ATOM 0 HB3 TYR A 114 1.067 5.513 22.916 1.00 53.04 H new ATOM 0 HD1 TYR A 114 3.328 4.188 25.693 1.00 34.31 H new ATOM 0 HD2 TYR A 114 -0.106 3.560 23.264 1.00 15.13 H new ATOM 0 HE1 TYR A 114 3.063 1.920 26.626 1.00 60.13 H new ATOM 0 HE2 TYR A 114 -0.364 1.319 24.206 1.00 63.03 H new ATOM 0 HH TYR A 114 0.508 -0.271 25.420 1.00 51.23 H new ATOM 1203 N LEU A 115 4.127 7.916 24.160 1.00 11.51 N ATOM 1204 CA LEU A 115 4.715 8.801 25.124 1.00 14.14 C ATOM 1205 C LEU A 115 3.913 10.079 25.203 1.00 15.52 C ATOM 1206 O LEU A 115 3.236 10.463 24.240 1.00 1.53 O ATOM 1207 CB LEU A 115 6.190 9.091 24.824 1.00 2.34 C ATOM 1208 CG LEU A 115 7.170 7.917 24.938 1.00 21.23 C ATOM 1209 CD1 LEU A 115 8.561 8.355 24.520 1.00 44.21 C ATOM 1210 CD2 LEU A 115 7.201 7.377 26.363 1.00 62.11 C ATOM 0 H LEU A 115 3.941 8.353 23.257 1.00 11.51 H new ATOM 0 HA LEU A 115 4.689 8.304 26.094 1.00 14.14 H new ATOM 0 HB2 LEU A 115 6.257 9.491 23.812 1.00 2.34 H new ATOM 0 HB3 LEU A 115 6.524 9.878 25.500 1.00 2.34 H new ATOM 0 HG LEU A 115 6.831 7.122 24.274 1.00 21.23 H new ATOM 0 HD11 LEU A 115 9.248 7.513 24.605 1.00 44.21 H new ATOM 0 HD12 LEU A 115 8.538 8.702 23.487 1.00 44.21 H new ATOM 0 HD13 LEU A 115 8.897 9.165 25.167 1.00 44.21 H new ATOM 0 HD21 LEU A 115 7.902 6.545 26.422 1.00 62.11 H new ATOM 0 HD22 LEU A 115 7.517 8.167 27.045 1.00 62.11 H new ATOM 0 HD23 LEU A 115 6.206 7.033 26.643 1.00 62.11 H new ATOM 1222 N ALA A 116 3.968 10.730 26.319 1.00 53.51 N ATOM 1223 CA ALA A 116 3.283 11.949 26.478 1.00 41.04 C ATOM 1224 C ALA A 116 4.319 13.098 26.339 1.00 52.53 C ATOM 1225 O ALA A 116 5.489 12.764 26.086 1.00 64.41 O ATOM 1226 CB ALA A 116 2.480 11.905 27.741 1.00 62.12 C ATOM 0 H ALA A 116 4.491 10.423 27.139 1.00 53.51 H new ATOM 0 HA ALA A 116 2.538 12.137 25.705 1.00 41.04 H new ATOM 0 HB1 ALA A 116 1.948 12.848 27.867 1.00 62.12 H new ATOM 0 HB2 ALA A 116 1.761 11.087 27.687 1.00 62.12 H new ATOM 0 HB3 ALA A 116 3.145 11.747 28.590 1.00 62.12 H new ATOM 1232 N PRO A 117 3.957 14.433 26.504 1.00 33.00 N ATOM 1233 CA PRO A 117 4.799 15.568 26.071 1.00 3.13 C ATOM 1234 C PRO A 117 6.267 15.414 26.323 1.00 31.34 C ATOM 1235 O PRO A 117 6.724 15.337 27.472 1.00 30.34 O ATOM 1236 CB PRO A 117 4.228 16.793 26.799 1.00 63.03 C ATOM 1237 CG PRO A 117 3.327 16.228 27.831 1.00 3.23 C ATOM 1238 CD PRO A 117 2.813 14.945 27.257 1.00 33.30 C ATOM 0 HA PRO A 117 4.754 15.652 24.985 1.00 3.13 H new ATOM 0 HB2 PRO A 117 5.020 17.392 27.249 1.00 63.03 H new ATOM 0 HB3 PRO A 117 3.686 17.445 26.114 1.00 63.03 H new ATOM 0 HG2 PRO A 117 3.861 16.053 28.765 1.00 3.23 H new ATOM 0 HG3 PRO A 117 2.509 16.913 28.055 1.00 3.23 H new ATOM 0 HD2 PRO A 117 2.502 14.251 28.038 1.00 33.30 H new ATOM 0 HD3 PRO A 117 1.949 15.110 26.614 1.00 33.30 H new ATOM 1246 N GLY A 118 6.987 15.298 25.245 1.00 40.31 N ATOM 1247 CA GLY A 118 8.398 15.143 25.307 1.00 61.34 C ATOM 1248 C GLY A 118 9.092 16.450 25.336 1.00 72.14 C ATOM 1249 O GLY A 118 9.329 17.015 26.401 1.00 54.14 O ATOM 0 H GLY A 118 6.604 15.309 24.300 1.00 40.31 H new ATOM 0 HA2 GLY A 118 8.662 14.571 26.196 1.00 61.34 H new ATOM 0 HA3 GLY A 118 8.739 14.569 24.446 1.00 61.34 H new ATOM 1253 N THR A 119 9.385 16.969 24.186 1.00 24.24 N ATOM 1254 CA THR A 119 10.077 18.207 24.127 1.00 62.41 C ATOM 1255 C THR A 119 9.121 19.263 23.664 1.00 2.22 C ATOM 1256 O THR A 119 8.851 19.376 22.472 1.00 30.45 O ATOM 1257 CB THR A 119 11.248 18.151 23.148 1.00 54.02 C ATOM 1258 OG1 THR A 119 11.929 16.900 23.297 1.00 3.30 O ATOM 1259 CG2 THR A 119 12.232 19.282 23.425 1.00 12.02 C ATOM 0 H THR A 119 9.156 16.554 23.283 1.00 24.24 H new ATOM 0 HA THR A 119 10.469 18.430 25.119 1.00 62.41 H new ATOM 0 HB THR A 119 10.861 18.255 22.135 1.00 54.02 H new ATOM 0 HG1 THR A 119 12.680 16.860 22.669 1.00 3.30 H new ATOM 0 HG21 THR A 119 13.059 19.226 22.718 1.00 12.02 H new ATOM 0 HG22 THR A 119 11.725 20.241 23.315 1.00 12.02 H new ATOM 0 HG23 THR A 119 12.616 19.189 24.441 1.00 12.02 H new ATOM 1267 N LYS A 120 8.549 19.963 24.632 1.00 71.00 N ATOM 1268 CA LYS A 120 7.649 21.114 24.430 1.00 50.25 C ATOM 1269 C LYS A 120 6.316 20.736 23.742 1.00 51.12 C ATOM 1270 O LYS A 120 5.415 21.572 23.626 1.00 13.31 O ATOM 1271 CB LYS A 120 8.354 22.220 23.615 1.00 23.04 C ATOM 1272 CG LYS A 120 9.771 22.560 24.083 1.00 64.30 C ATOM 1273 CD LYS A 120 9.814 22.996 25.536 1.00 32.02 C ATOM 1274 CE LYS A 120 11.219 23.397 25.942 1.00 54.14 C ATOM 1275 NZ LYS A 120 11.290 23.824 27.356 1.00 54.03 N ATOM 0 H LYS A 120 8.697 19.747 25.618 1.00 71.00 H new ATOM 0 HA LYS A 120 7.404 21.482 25.426 1.00 50.25 H new ATOM 0 HB2 LYS A 120 8.396 21.911 22.571 1.00 23.04 H new ATOM 0 HB3 LYS A 120 7.747 23.124 23.655 1.00 23.04 H new ATOM 0 HG2 LYS A 120 10.413 21.689 23.949 1.00 64.30 H new ATOM 0 HG3 LYS A 120 10.176 23.354 23.456 1.00 64.30 H new ATOM 0 HD2 LYS A 120 9.134 23.835 25.688 1.00 32.02 H new ATOM 0 HD3 LYS A 120 9.465 22.184 26.174 1.00 32.02 H new ATOM 0 HE2 LYS A 120 11.895 22.557 25.783 1.00 54.14 H new ATOM 0 HE3 LYS A 120 11.563 24.209 25.301 1.00 54.14 H new ATOM 0 HZ1 LYS A 120 12.268 24.089 27.590 1.00 54.03 H new ATOM 0 HZ2 LYS A 120 10.665 24.642 27.503 1.00 54.03 H new ATOM 0 HZ3 LYS A 120 10.987 23.042 27.971 1.00 54.03 H new ATOM 1289 N GLY A 121 6.185 19.505 23.312 1.00 15.13 N ATOM 1290 CA GLY A 121 5.034 19.118 22.571 1.00 11.01 C ATOM 1291 C GLY A 121 4.152 18.185 23.304 1.00 22.25 C ATOM 1292 O GLY A 121 4.632 17.171 23.769 1.00 34.01 O ATOM 0 H GLY A 121 6.867 18.762 23.468 1.00 15.13 H new ATOM 0 HA2 GLY A 121 4.466 20.009 22.304 1.00 11.01 H new ATOM 0 HA3 GLY A 121 5.351 18.650 21.639 1.00 11.01 H new ATOM 1296 N PRO A 122 2.836 18.538 23.403 1.00 30.23 N ATOM 1297 CA PRO A 122 1.749 17.784 24.080 1.00 62.21 C ATOM 1298 C PRO A 122 1.778 16.250 24.040 1.00 1.15 C ATOM 1299 O PRO A 122 1.147 15.631 24.891 1.00 5.21 O ATOM 1300 CB PRO A 122 0.525 18.292 23.366 1.00 60.11 C ATOM 1301 CG PRO A 122 0.817 19.725 23.187 1.00 24.24 C ATOM 1302 CD PRO A 122 2.283 19.806 22.866 1.00 35.11 C ATOM 0 HA PRO A 122 1.819 17.958 25.154 1.00 62.21 H new ATOM 0 HB2 PRO A 122 0.376 17.788 22.411 1.00 60.11 H new ATOM 0 HB3 PRO A 122 -0.379 18.135 23.954 1.00 60.11 H new ATOM 0 HG2 PRO A 122 0.216 20.149 22.382 1.00 24.24 H new ATOM 0 HG3 PRO A 122 0.583 20.288 24.091 1.00 24.24 H new ATOM 0 HD2 PRO A 122 2.453 19.893 21.793 1.00 35.11 H new ATOM 0 HD3 PRO A 122 2.747 20.674 23.334 1.00 35.11 H new ATOM 1310 N PHE A 123 2.441 15.631 23.068 1.00 63.10 N ATOM 1311 CA PHE A 123 2.582 14.161 23.085 1.00 41.40 C ATOM 1312 C PHE A 123 3.627 13.681 22.108 1.00 31.13 C ATOM 1313 O PHE A 123 4.184 14.485 21.371 1.00 32.22 O ATOM 1314 CB PHE A 123 1.235 13.381 22.922 1.00 21.00 C ATOM 1315 CG PHE A 123 0.484 13.565 21.625 1.00 72.13 C ATOM 1316 CD1 PHE A 123 -0.415 14.611 21.464 1.00 63.31 C ATOM 1317 CD2 PHE A 123 0.651 12.664 20.582 1.00 40.31 C ATOM 1318 CE1 PHE A 123 -1.125 14.750 20.288 1.00 54.20 C ATOM 1319 CE2 PHE A 123 -0.055 12.803 19.406 1.00 11.14 C ATOM 1320 CZ PHE A 123 -0.943 13.845 19.257 1.00 33.44 C ATOM 0 H PHE A 123 2.881 16.099 22.276 1.00 63.10 H new ATOM 0 HA PHE A 123 2.929 13.925 24.091 1.00 41.40 H new ATOM 0 HB2 PHE A 123 1.443 12.318 23.044 1.00 21.00 H new ATOM 0 HB3 PHE A 123 0.575 13.672 23.739 1.00 21.00 H new ATOM 0 HD1 PHE A 123 -0.560 15.321 22.265 1.00 63.31 H new ATOM 0 HD2 PHE A 123 1.344 11.843 20.693 1.00 40.31 H new ATOM 0 HE1 PHE A 123 -1.823 15.566 20.173 1.00 54.20 H new ATOM 0 HE2 PHE A 123 0.088 12.096 18.603 1.00 11.14 H new ATOM 0 HZ PHE A 123 -1.497 13.956 18.336 1.00 33.44 H new ATOM 1330 N ASP A 124 3.942 12.394 22.180 1.00 11.33 N ATOM 1331 CA ASP A 124 4.842 11.717 21.243 1.00 60.33 C ATOM 1332 C ASP A 124 4.244 10.369 20.873 1.00 31.14 C ATOM 1333 O ASP A 124 4.223 9.446 21.691 1.00 63.24 O ATOM 1334 CB ASP A 124 6.253 11.481 21.833 1.00 34.11 C ATOM 1335 CG ASP A 124 7.215 12.643 21.708 1.00 51.11 C ATOM 1336 OD1 ASP A 124 7.910 12.742 20.679 1.00 10.34 O ATOM 1337 OD2 ASP A 124 7.374 13.429 22.672 1.00 71.33 O ATOM 0 H ASP A 124 3.574 11.776 22.903 1.00 11.33 H new ATOM 0 HA ASP A 124 4.949 12.363 20.372 1.00 60.33 H new ATOM 0 HB2 ASP A 124 6.149 11.230 22.889 1.00 34.11 H new ATOM 0 HB3 ASP A 124 6.693 10.613 21.341 1.00 34.11 H new ATOM 1342 N LEU A 125 3.732 10.250 19.672 1.00 5.13 N ATOM 1343 CA LEU A 125 3.150 9.004 19.242 1.00 20.14 C ATOM 1344 C LEU A 125 3.885 8.526 18.001 1.00 4.42 C ATOM 1345 O LEU A 125 4.021 9.277 17.039 1.00 33.34 O ATOM 1346 CB LEU A 125 1.634 9.212 18.992 1.00 3.11 C ATOM 1347 CG LEU A 125 0.758 7.983 18.661 1.00 31.12 C ATOM 1348 CD1 LEU A 125 0.995 7.451 17.252 1.00 3.10 C ATOM 1349 CD2 LEU A 125 0.953 6.879 19.699 1.00 21.34 C ATOM 0 H LEU A 125 3.707 10.998 18.979 1.00 5.13 H new ATOM 0 HA LEU A 125 3.251 8.234 20.007 1.00 20.14 H new ATOM 0 HB2 LEU A 125 1.215 9.686 19.880 1.00 3.11 H new ATOM 0 HB3 LEU A 125 1.529 9.922 18.172 1.00 3.11 H new ATOM 0 HG LEU A 125 -0.278 8.320 18.698 1.00 31.12 H new ATOM 0 HD11 LEU A 125 0.353 6.588 17.076 1.00 3.10 H new ATOM 0 HD12 LEU A 125 0.764 8.230 16.525 1.00 3.10 H new ATOM 0 HD13 LEU A 125 2.038 7.154 17.146 1.00 3.10 H new ATOM 0 HD21 LEU A 125 0.326 6.025 19.444 1.00 21.34 H new ATOM 0 HD22 LEU A 125 1.998 6.571 19.710 1.00 21.34 H new ATOM 0 HD23 LEU A 125 0.674 7.253 20.684 1.00 21.34 H new ATOM 1361 N TYR A 126 4.343 7.284 18.014 1.00 51.53 N ATOM 1362 CA TYR A 126 5.103 6.733 16.902 1.00 54.25 C ATOM 1363 C TYR A 126 5.218 5.235 17.038 1.00 32.40 C ATOM 1364 O TYR A 126 4.828 4.692 18.047 1.00 61.45 O ATOM 1365 CB TYR A 126 6.520 7.378 16.792 1.00 51.35 C ATOM 1366 CG TYR A 126 7.496 7.106 17.930 1.00 21.44 C ATOM 1367 CD1 TYR A 126 7.455 7.843 19.108 1.00 50.21 C ATOM 1368 CD2 TYR A 126 8.491 6.143 17.797 1.00 24.33 C ATOM 1369 CE1 TYR A 126 8.376 7.621 20.114 1.00 54.51 C ATOM 1370 CE2 TYR A 126 9.400 5.918 18.793 1.00 55.23 C ATOM 1371 CZ TYR A 126 9.346 6.652 19.945 1.00 73.12 C ATOM 1372 OH TYR A 126 10.274 6.420 20.927 1.00 42.41 O ATOM 0 H TYR A 126 4.201 6.635 18.788 1.00 51.53 H new ATOM 0 HA TYR A 126 4.563 6.968 15.985 1.00 54.25 H new ATOM 0 HB2 TYR A 126 6.977 7.034 15.864 1.00 51.35 H new ATOM 0 HB3 TYR A 126 6.395 8.457 16.704 1.00 51.35 H new ATOM 0 HD1 TYR A 126 6.694 8.598 19.239 1.00 50.21 H new ATOM 0 HD2 TYR A 126 8.547 5.561 16.889 1.00 24.33 H new ATOM 0 HE1 TYR A 126 8.338 8.200 21.025 1.00 54.51 H new ATOM 0 HE2 TYR A 126 10.160 5.161 18.670 1.00 55.23 H new ATOM 0 HH TYR A 126 10.880 5.704 20.642 1.00 42.41 H new ATOM 1382 N SER A 127 5.658 4.583 16.011 1.00 34.43 N ATOM 1383 CA SER A 127 6.017 3.196 16.078 1.00 63.10 C ATOM 1384 C SER A 127 7.430 3.084 15.565 1.00 15.41 C ATOM 1385 O SER A 127 7.891 3.974 14.828 1.00 50.04 O ATOM 1386 CB SER A 127 5.086 2.321 15.246 1.00 33.32 C ATOM 1387 OG SER A 127 5.302 0.948 15.516 1.00 3.13 O ATOM 0 H SER A 127 5.781 5.000 15.088 1.00 34.43 H new ATOM 0 HA SER A 127 5.933 2.844 17.106 1.00 63.10 H new ATOM 0 HB2 SER A 127 4.049 2.579 15.462 1.00 33.32 H new ATOM 0 HB3 SER A 127 5.248 2.517 14.186 1.00 33.32 H new ATOM 0 HG SER A 127 5.492 0.476 14.679 1.00 3.13 H new ATOM 1393 N LEU A 128 8.137 2.080 15.984 1.00 54.41 N ATOM 1394 CA LEU A 128 9.466 1.835 15.457 1.00 63.30 C ATOM 1395 C LEU A 128 9.413 1.313 14.030 1.00 1.21 C ATOM 1396 O LEU A 128 8.409 0.800 13.607 1.00 65.44 O ATOM 1397 CB LEU A 128 10.230 0.883 16.362 1.00 71.52 C ATOM 1398 CG LEU A 128 11.109 1.556 17.451 1.00 74.34 C ATOM 1399 CD1 LEU A 128 10.336 2.549 18.275 1.00 20.13 C ATOM 1400 CD2 LEU A 128 11.738 0.524 18.347 1.00 73.14 C ATOM 0 H LEU A 128 7.826 1.411 16.689 1.00 54.41 H new ATOM 0 HA LEU A 128 9.998 2.786 15.433 1.00 63.30 H new ATOM 0 HB2 LEU A 128 9.514 0.224 16.854 1.00 71.52 H new ATOM 0 HB3 LEU A 128 10.869 0.254 15.742 1.00 71.52 H new ATOM 0 HG LEU A 128 11.894 2.101 16.927 1.00 74.34 H new ATOM 0 HD11 LEU A 128 10.994 2.992 19.022 1.00 20.13 H new ATOM 0 HD12 LEU A 128 9.943 3.332 17.627 1.00 20.13 H new ATOM 0 HD13 LEU A 128 9.510 2.043 18.774 1.00 20.13 H new ATOM 0 HD21 LEU A 128 12.349 1.021 19.101 1.00 73.14 H new ATOM 0 HD22 LEU A 128 10.957 -0.057 18.837 1.00 73.14 H new ATOM 0 HD23 LEU A 128 12.365 -0.140 17.752 1.00 73.14 H new ATOM 1412 N GLY A 129 10.498 1.482 13.290 1.00 24.40 N ATOM 1413 CA GLY A 129 10.533 0.998 11.928 1.00 42.33 C ATOM 1414 C GLY A 129 10.717 -0.499 11.838 1.00 41.03 C ATOM 1415 O GLY A 129 10.713 -1.208 12.846 1.00 2.13 O ATOM 0 H GLY A 129 11.351 1.943 13.607 1.00 24.40 H new ATOM 0 HA2 GLY A 129 9.606 1.275 11.426 1.00 42.33 H new ATOM 0 HA3 GLY A 129 11.345 1.491 11.394 1.00 42.33 H new ATOM 1419 N ALA A 130 10.961 -0.961 10.636 1.00 51.10 N ATOM 1420 CA ALA A 130 11.092 -2.385 10.326 1.00 44.14 C ATOM 1421 C ALA A 130 12.268 -3.046 11.034 1.00 72.15 C ATOM 1422 O ALA A 130 12.289 -4.244 11.230 1.00 73.04 O ATOM 1423 CB ALA A 130 11.206 -2.568 8.832 1.00 10.40 C ATOM 0 H ALA A 130 11.078 -0.356 9.823 1.00 51.10 H new ATOM 0 HA ALA A 130 10.195 -2.880 10.697 1.00 44.14 H new ATOM 0 HB1 ALA A 130 11.304 -3.629 8.602 1.00 10.40 H new ATOM 0 HB2 ALA A 130 10.313 -2.172 8.348 1.00 10.40 H new ATOM 0 HB3 ALA A 130 12.084 -2.035 8.466 1.00 10.40 H new ATOM 1429 N ASP A 131 13.226 -2.258 11.433 1.00 61.33 N ATOM 1430 CA ASP A 131 14.401 -2.783 12.120 1.00 10.42 C ATOM 1431 C ASP A 131 14.207 -2.704 13.633 1.00 53.55 C ATOM 1432 O ASP A 131 15.028 -3.192 14.419 1.00 61.42 O ATOM 1433 CB ASP A 131 15.652 -1.994 11.679 1.00 71.03 C ATOM 1434 CG ASP A 131 16.943 -2.409 12.371 1.00 54.45 C ATOM 1435 OD1 ASP A 131 17.441 -3.523 12.120 1.00 5.10 O ATOM 1436 OD2 ASP A 131 17.503 -1.605 13.144 1.00 33.45 O ATOM 0 H ASP A 131 13.228 -1.247 11.300 1.00 61.33 H new ATOM 0 HA ASP A 131 14.539 -3.831 11.854 1.00 10.42 H new ATOM 0 HB2 ASP A 131 15.779 -2.112 10.603 1.00 71.03 H new ATOM 0 HB3 ASP A 131 15.480 -0.934 11.865 1.00 71.03 H new ATOM 1441 N GLY A 132 13.077 -2.148 14.045 1.00 75.44 N ATOM 1442 CA GLY A 132 12.852 -1.917 15.444 1.00 72.14 C ATOM 1443 C GLY A 132 13.799 -0.864 15.923 1.00 72.44 C ATOM 1444 O GLY A 132 14.437 -1.005 16.967 1.00 62.31 O ATOM 0 H GLY A 132 12.317 -1.855 13.431 1.00 75.44 H new ATOM 0 HA2 GLY A 132 11.822 -1.602 15.612 1.00 72.14 H new ATOM 0 HA3 GLY A 132 12.999 -2.839 16.006 1.00 72.14 H new ATOM 1448 N LYS A 133 13.891 0.181 15.140 1.00 60.52 N ATOM 1449 CA LYS A 133 14.830 1.240 15.359 1.00 52.13 C ATOM 1450 C LYS A 133 14.102 2.552 15.168 1.00 41.33 C ATOM 1451 O LYS A 133 13.176 2.625 14.339 1.00 21.14 O ATOM 1452 CB LYS A 133 15.931 1.129 14.292 1.00 44.31 C ATOM 1453 CG LYS A 133 17.180 1.979 14.518 1.00 23.04 C ATOM 1454 CD LYS A 133 18.289 1.208 15.248 1.00 31.20 C ATOM 1455 CE LYS A 133 17.907 0.782 16.658 1.00 23.42 C ATOM 1456 NZ LYS A 133 18.937 -0.075 17.271 1.00 73.45 N ATOM 0 H LYS A 133 13.302 0.317 14.318 1.00 60.52 H new ATOM 0 HA LYS A 133 15.262 1.183 16.358 1.00 52.13 H new ATOM 0 HB2 LYS A 133 16.236 0.085 14.222 1.00 44.31 H new ATOM 0 HB3 LYS A 133 15.502 1.401 13.328 1.00 44.31 H new ATOM 0 HG2 LYS A 133 17.557 2.329 13.557 1.00 23.04 H new ATOM 0 HG3 LYS A 133 16.914 2.863 15.097 1.00 23.04 H new ATOM 0 HD2 LYS A 133 18.547 0.323 14.667 1.00 31.20 H new ATOM 0 HD3 LYS A 133 19.183 1.830 15.295 1.00 31.20 H new ATOM 0 HE2 LYS A 133 17.756 1.667 17.276 1.00 23.42 H new ATOM 0 HE3 LYS A 133 16.958 0.246 16.631 1.00 23.42 H new ATOM 0 HZ1 LYS A 133 18.639 -0.344 18.231 1.00 73.45 H new ATOM 0 HZ2 LYS A 133 19.063 -0.932 16.695 1.00 73.45 H new ATOM 0 HZ3 LYS A 133 19.837 0.445 17.321 1.00 73.45 H new ATOM 1470 N GLU A 134 14.452 3.550 15.944 1.00 31.43 N ATOM 1471 CA GLU A 134 13.905 4.860 15.744 1.00 70.02 C ATOM 1472 C GLU A 134 14.919 5.780 15.044 1.00 14.34 C ATOM 1473 O GLU A 134 15.937 6.159 15.598 1.00 13.24 O ATOM 1474 CB GLU A 134 13.226 5.441 17.032 1.00 32.31 C ATOM 1475 CG GLU A 134 14.040 5.478 18.333 1.00 65.43 C ATOM 1476 CD GLU A 134 15.030 6.602 18.410 1.00 3.15 C ATOM 1477 OE1 GLU A 134 14.601 7.773 18.439 1.00 72.20 O ATOM 1478 OE2 GLU A 134 16.248 6.351 18.481 1.00 31.30 O ATOM 0 H GLU A 134 15.113 3.475 16.717 1.00 31.43 H new ATOM 0 HA GLU A 134 13.069 4.784 15.048 1.00 70.02 H new ATOM 0 HB2 GLU A 134 12.909 6.460 16.809 1.00 32.31 H new ATOM 0 HB3 GLU A 134 12.323 4.861 17.222 1.00 32.31 H new ATOM 0 HG2 GLU A 134 13.353 5.556 19.176 1.00 65.43 H new ATOM 0 HG3 GLU A 134 14.572 4.533 18.442 1.00 65.43 H new ATOM 1485 N GLY A 135 14.677 6.054 13.803 1.00 64.03 N ATOM 1486 CA GLY A 135 15.585 6.865 13.023 1.00 14.21 C ATOM 1487 C GLY A 135 14.852 7.628 11.967 1.00 2.51 C ATOM 1488 O GLY A 135 13.621 7.644 11.980 1.00 12.51 O ATOM 0 H GLY A 135 13.854 5.730 13.295 1.00 64.03 H new ATOM 0 HA2 GLY A 135 16.112 7.559 13.678 1.00 14.21 H new ATOM 0 HA3 GLY A 135 16.339 6.229 12.559 1.00 14.21 H new ATOM 1492 N GLY A 136 15.573 8.307 11.093 1.00 24.12 N ATOM 1493 CA GLY A 136 14.925 8.937 9.970 1.00 10.04 C ATOM 1494 C GLY A 136 15.358 8.215 8.729 1.00 24.43 C ATOM 1495 O GLY A 136 16.554 8.175 8.434 1.00 25.20 O ATOM 0 H GLY A 136 16.584 8.432 11.140 1.00 24.12 H new ATOM 0 HA2 GLY A 136 13.841 8.893 10.080 1.00 10.04 H new ATOM 0 HA3 GLY A 136 15.197 9.991 9.914 1.00 10.04 H new ATOM 1499 N SER A 137 14.393 7.758 7.964 1.00 32.00 N ATOM 1500 CA SER A 137 14.574 6.810 6.866 1.00 0.03 C ATOM 1501 C SER A 137 13.193 6.530 6.251 1.00 72.14 C ATOM 1502 O SER A 137 12.214 7.191 6.616 1.00 45.13 O ATOM 1503 CB SER A 137 15.162 5.476 7.382 1.00 55.31 C ATOM 1504 OG SER A 137 16.483 5.573 7.914 1.00 53.14 O ATOM 0 H SER A 137 13.421 8.041 8.086 1.00 32.00 H new ATOM 0 HA SER A 137 15.261 7.234 6.133 1.00 0.03 H new ATOM 0 HB2 SER A 137 14.503 5.078 8.153 1.00 55.31 H new ATOM 0 HB3 SER A 137 15.166 4.756 6.564 1.00 55.31 H new ATOM 0 HG SER A 137 16.654 4.812 8.507 1.00 53.14 H new ATOM 1510 N ASP A 138 13.120 5.631 5.278 1.00 14.40 N ATOM 1511 CA ASP A 138 11.820 5.199 4.749 1.00 41.21 C ATOM 1512 C ASP A 138 11.104 4.316 5.758 1.00 72.45 C ATOM 1513 O ASP A 138 10.171 4.752 6.430 1.00 52.15 O ATOM 1514 CB ASP A 138 11.930 4.442 3.415 1.00 72.15 C ATOM 1515 CG ASP A 138 12.218 5.325 2.249 1.00 3.22 C ATOM 1516 OD1 ASP A 138 11.307 6.054 1.812 1.00 60.33 O ATOM 1517 OD2 ASP A 138 13.364 5.332 1.743 1.00 20.53 O ATOM 0 H ASP A 138 13.928 5.189 4.840 1.00 14.40 H new ATOM 0 HA ASP A 138 11.251 6.111 4.566 1.00 41.21 H new ATOM 0 HB2 ASP A 138 12.718 3.693 3.496 1.00 72.15 H new ATOM 0 HB3 ASP A 138 10.998 3.906 3.233 1.00 72.15 H new ATOM 1522 N ASN A 139 11.571 3.095 5.895 1.00 53.12 N ATOM 1523 CA ASN A 139 10.944 2.120 6.804 1.00 53.41 C ATOM 1524 C ASN A 139 11.814 1.910 8.021 1.00 1.24 C ATOM 1525 O ASN A 139 11.442 1.230 8.961 1.00 23.21 O ATOM 1526 CB ASN A 139 10.772 0.758 6.140 1.00 45.13 C ATOM 1527 CG ASN A 139 12.107 0.066 5.862 1.00 23.55 C ATOM 1528 OD1 ASN A 139 13.097 0.695 5.482 1.00 24.53 O ATOM 1529 ND2 ASN A 139 12.165 -1.188 6.144 1.00 41.24 N ATOM 0 H ASN A 139 12.385 2.739 5.393 1.00 53.12 H new ATOM 0 HA ASN A 139 9.969 2.526 7.075 1.00 53.41 H new ATOM 0 HB2 ASN A 139 10.163 0.120 6.780 1.00 45.13 H new ATOM 0 HB3 ASN A 139 10.229 0.881 5.203 1.00 45.13 H new ATOM 0 HD21 ASN A 139 13.048 -1.690 6.056 1.00 41.24 H new ATOM 0 HD22 ASN A 139 11.328 -1.680 6.456 1.00 41.24 H new ATOM 1536 N ASP A 140 12.993 2.455 7.964 1.00 62.45 N ATOM 1537 CA ASP A 140 13.970 2.343 9.042 1.00 25.13 C ATOM 1538 C ASP A 140 13.767 3.509 10.019 1.00 22.21 C ATOM 1539 O ASP A 140 14.450 3.665 11.027 1.00 24.50 O ATOM 1540 CB ASP A 140 15.372 2.328 8.409 1.00 64.34 C ATOM 1541 CG ASP A 140 16.515 2.337 9.380 1.00 10.34 C ATOM 1542 OD1 ASP A 140 16.838 1.268 9.932 1.00 4.32 O ATOM 1543 OD2 ASP A 140 17.147 3.408 9.558 1.00 23.12 O ATOM 0 H ASP A 140 13.321 2.999 7.166 1.00 62.45 H new ATOM 0 HA ASP A 140 13.848 1.423 9.614 1.00 25.13 H new ATOM 0 HB2 ASP A 140 15.459 1.442 7.780 1.00 64.34 H new ATOM 0 HB3 ASP A 140 15.466 3.195 7.755 1.00 64.34 H new ATOM 1548 N ALA A 141 12.769 4.287 9.707 1.00 73.31 N ATOM 1549 CA ALA A 141 12.395 5.438 10.463 1.00 45.21 C ATOM 1550 C ALA A 141 11.364 5.087 11.474 1.00 54.54 C ATOM 1551 O ALA A 141 10.645 4.106 11.313 1.00 15.32 O ATOM 1552 CB ALA A 141 11.805 6.478 9.556 1.00 32.22 C ATOM 0 H ALA A 141 12.177 4.128 8.892 1.00 73.31 H new ATOM 0 HA ALA A 141 13.290 5.818 10.956 1.00 45.21 H new ATOM 0 HB1 ALA A 141 11.522 7.353 10.141 1.00 32.22 H new ATOM 0 HB2 ALA A 141 12.541 6.766 8.805 1.00 32.22 H new ATOM 0 HB3 ALA A 141 10.923 6.071 9.062 1.00 32.22 H new ATOM 1558 N ASP A 142 11.291 5.870 12.515 1.00 22.31 N ATOM 1559 CA ASP A 142 10.218 5.720 13.441 1.00 51.53 C ATOM 1560 C ASP A 142 9.075 6.514 12.874 1.00 52.42 C ATOM 1561 O ASP A 142 9.217 7.709 12.552 1.00 21.23 O ATOM 1562 CB ASP A 142 10.572 6.173 14.880 1.00 21.12 C ATOM 1563 CG ASP A 142 10.786 7.664 15.078 1.00 61.21 C ATOM 1564 OD1 ASP A 142 11.888 8.171 14.774 1.00 20.25 O ATOM 1565 OD2 ASP A 142 9.872 8.352 15.581 1.00 44.22 O ATOM 0 H ASP A 142 11.958 6.610 12.737 1.00 22.31 H new ATOM 0 HA ASP A 142 9.967 4.665 13.553 1.00 51.53 H new ATOM 0 HB2 ASP A 142 9.773 5.849 15.548 1.00 21.12 H new ATOM 0 HB3 ASP A 142 11.478 5.652 15.191 1.00 21.12 H new ATOM 1570 N ILE A 143 7.988 5.869 12.661 1.00 53.03 N ATOM 1571 CA ILE A 143 6.887 6.512 12.049 1.00 70.33 C ATOM 1572 C ILE A 143 5.910 7.012 13.078 1.00 53.52 C ATOM 1573 O ILE A 143 5.337 6.257 13.845 1.00 53.15 O ATOM 1574 CB ILE A 143 6.246 5.672 10.875 1.00 43.34 C ATOM 1575 CG1 ILE A 143 5.957 4.188 11.238 1.00 40.14 C ATOM 1576 CG2 ILE A 143 7.145 5.723 9.653 1.00 13.34 C ATOM 1577 CD1 ILE A 143 4.768 3.948 12.134 1.00 52.32 C ATOM 0 H ILE A 143 7.837 4.890 12.903 1.00 53.03 H new ATOM 0 HA ILE A 143 7.263 7.401 11.542 1.00 70.33 H new ATOM 0 HB ILE A 143 5.280 6.135 10.671 1.00 43.34 H new ATOM 0 HG12 ILE A 143 5.809 3.630 10.313 1.00 40.14 H new ATOM 0 HG13 ILE A 143 6.841 3.774 11.722 1.00 40.14 H new ATOM 0 HG21 ILE A 143 6.697 5.142 8.847 1.00 13.34 H new ATOM 0 HG22 ILE A 143 7.264 6.758 9.331 1.00 13.34 H new ATOM 0 HG23 ILE A 143 8.121 5.306 9.902 1.00 13.34 H new ATOM 0 HD11 ILE A 143 4.663 2.879 12.320 1.00 52.32 H new ATOM 0 HD12 ILE A 143 4.915 4.468 13.080 1.00 52.32 H new ATOM 0 HD13 ILE A 143 3.866 4.323 11.650 1.00 52.32 H new ATOM 1589 N GLY A 144 5.791 8.298 13.159 1.00 35.33 N ATOM 1590 CA GLY A 144 4.935 8.851 14.133 1.00 55.32 C ATOM 1591 C GLY A 144 4.601 10.261 13.869 1.00 60.54 C ATOM 1592 O GLY A 144 5.062 10.851 12.883 1.00 21.12 O ATOM 0 H GLY A 144 6.274 8.972 12.565 1.00 35.33 H new ATOM 0 HA2 GLY A 144 4.016 8.267 14.175 1.00 55.32 H new ATOM 0 HA3 GLY A 144 5.408 8.772 15.112 1.00 55.32 H new ATOM 1596 N ASN A 145 3.823 10.808 14.738 1.00 60.32 N ATOM 1597 CA ASN A 145 3.352 12.149 14.630 1.00 64.34 C ATOM 1598 C ASN A 145 2.823 12.546 15.967 1.00 50.13 C ATOM 1599 O ASN A 145 2.520 11.671 16.801 1.00 4.22 O ATOM 1600 CB ASN A 145 2.273 12.313 13.522 1.00 4.21 C ATOM 1601 CG ASN A 145 0.864 11.769 13.827 1.00 2.02 C ATOM 1602 OD1 ASN A 145 -0.108 12.278 13.285 1.00 64.13 O ATOM 1603 ND2 ASN A 145 0.733 10.775 14.677 1.00 44.32 N ATOM 0 H ASN A 145 3.486 10.322 15.569 1.00 60.32 H new ATOM 0 HA ASN A 145 4.174 12.800 14.333 1.00 64.34 H new ATOM 0 HB2 ASN A 145 2.183 13.375 13.292 1.00 4.21 H new ATOM 0 HB3 ASN A 145 2.637 11.821 12.620 1.00 4.21 H new ATOM 0 HD21 ASN A 145 -0.194 10.411 14.898 1.00 44.32 H new ATOM 0 HD22 ASN A 145 1.558 10.367 15.116 1.00 44.32 H new ATOM 1610 N TRP A 146 2.745 13.802 16.197 1.00 72.53 N ATOM 1611 CA TRP A 146 2.304 14.309 17.447 1.00 31.30 C ATOM 1612 C TRP A 146 1.925 15.737 17.327 1.00 64.21 C ATOM 1613 O TRP A 146 2.017 16.326 16.242 1.00 1.22 O ATOM 1614 CB TRP A 146 3.376 14.122 18.529 1.00 14.43 C ATOM 1615 CG TRP A 146 4.771 14.537 18.134 1.00 31.24 C ATOM 1616 CD1 TRP A 146 5.274 15.803 18.033 1.00 65.01 C ATOM 1617 CD2 TRP A 146 5.844 13.654 17.821 1.00 14.32 C ATOM 1618 NE1 TRP A 146 6.591 15.752 17.640 1.00 75.10 N ATOM 1619 CE2 TRP A 146 6.966 14.439 17.515 1.00 22.11 C ATOM 1620 CE3 TRP A 146 5.952 12.269 17.764 1.00 71.23 C ATOM 1621 CZ2 TRP A 146 8.188 13.878 17.157 1.00 32.10 C ATOM 1622 CZ3 TRP A 146 7.160 11.709 17.415 1.00 52.42 C ATOM 1623 CH2 TRP A 146 8.266 12.512 17.115 1.00 14.00 C ATOM 0 H TRP A 146 2.988 14.520 15.515 1.00 72.53 H new ATOM 0 HA TRP A 146 1.422 13.743 17.747 1.00 31.30 H new ATOM 0 HB2 TRP A 146 3.082 14.691 19.411 1.00 14.43 H new ATOM 0 HB3 TRP A 146 3.396 13.072 18.820 1.00 14.43 H new ATOM 0 HD1 TRP A 146 4.720 16.709 18.232 1.00 65.01 H new ATOM 0 HE1 TRP A 146 7.191 16.559 17.469 1.00 75.10 H new ATOM 0 HE3 TRP A 146 5.102 11.643 17.990 1.00 71.23 H new ATOM 0 HZ2 TRP A 146 9.042 14.496 16.921 1.00 32.10 H new ATOM 0 HZ3 TRP A 146 7.256 10.634 17.372 1.00 52.42 H new ATOM 0 HH2 TRP A 146 9.201 12.044 16.845 1.00 14.00 H new ATOM 1634 N ASP A 147 1.462 16.279 18.406 1.00 13.52 N ATOM 1635 CA ASP A 147 1.150 17.670 18.468 1.00 4.42 C ATOM 1636 C ASP A 147 2.225 18.328 19.259 1.00 73.21 C ATOM 1637 O ASP A 147 2.518 17.907 20.406 1.00 24.12 O ATOM 1638 CB ASP A 147 -0.223 17.952 19.092 1.00 63.14 C ATOM 1639 CG ASP A 147 -0.543 19.445 19.130 1.00 5.31 C ATOM 1640 OD1 ASP A 147 -0.807 20.037 18.066 1.00 4.22 O ATOM 1641 OD2 ASP A 147 -0.572 20.041 20.219 1.00 10.43 O ATOM 0 H ASP A 147 1.289 15.768 19.272 1.00 13.52 H new ATOM 0 HA ASP A 147 1.098 18.065 17.454 1.00 4.42 H new ATOM 0 HB2 ASP A 147 -0.993 17.431 18.523 1.00 63.14 H new ATOM 0 HB3 ASP A 147 -0.249 17.550 20.105 1.00 63.14 H new ATOM 1646 N ASN A 148 2.869 19.253 18.615 1.00 22.50 N ATOM 1647 CA ASN A 148 3.928 20.044 19.167 1.00 53.22 C ATOM 1648 C ASN A 148 3.882 21.388 18.470 1.00 32.32 C ATOM 1649 O ASN A 148 4.681 21.640 17.545 1.00 32.42 O ATOM 1650 CB ASN A 148 5.292 19.345 18.954 1.00 54.32 C ATOM 1651 CG ASN A 148 6.482 20.156 19.455 1.00 4.25 C ATOM 1652 OD1 ASN A 148 6.366 20.956 20.376 1.00 5.50 O ATOM 1653 ND2 ASN A 148 7.632 19.939 18.870 1.00 63.03 N ATOM 1654 OXT ASN A 148 2.955 22.160 18.764 1.00 0.00 O ATOM 0 H ASN A 148 2.661 19.488 17.645 1.00 22.50 H new ATOM 0 HA ASN A 148 3.806 20.172 20.243 1.00 53.22 H new ATOM 0 HB2 ASN A 148 5.280 18.382 19.464 1.00 54.32 H new ATOM 0 HB3 ASN A 148 5.424 19.142 17.891 1.00 54.32 H new ATOM 0 HD21 ASN A 148 8.464 20.442 19.178 1.00 63.03 H new ATOM 0 HD22 ASN A 148 7.697 19.267 18.106 1.00 63.03 H new TER 1661 ASN A 148