USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 890 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: B 54 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 54 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 THR OG1 : rot -71:sc= 0.893 USER MOD Single : A 8 THR OG1 : rot 154:sc= 0.195 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 105:sc= 0.402 USER MOD Single : A 16 SER OG : rot 180:sc= 0.0454 USER MOD Single : A 18 GLN : amide:sc= -2.72! K(o=-2.7!,f=-0.6) USER MOD Single : A 21 GLN : amide:sc= -0.648 K(o=-0.65,f=-0.14) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -110:sc= 0.157 USER MOD Single : A 31 SER OG : rot 180:sc= -0.0905 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0161 X(o=-0.016,f=0) USER MOD Single : A 35 SER OG : rot -135:sc= -0.12 USER MOD Single : A 36 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000807) USER MOD Single : A 43 THR OG1 : rot -81:sc= 1.4 USER MOD Single : A 44 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.213) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -6.9! C(o=-6.9!,f=-13!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 30:sc= -1.61! USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot -72:sc= 0.798 USER MOD Single : B 8 THR OG1 : rot 161:sc= 1.16 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot 105:sc= 0.391 USER MOD Single : B 16 SER OG : rot 180:sc= 0.0449 USER MOD Single : B 18 GLN : amide:sc= -2.56! K(o=-2.6!,f=-0.58) USER MOD Single : B 21 GLN : amide:sc= -0.657 K(o=-0.66,f=-0.14) USER MOD Single : B 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot -110:sc= 0.158 USER MOD Single : B 31 SER OG : rot 180:sc= -0.0874 USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.013) USER MOD Single : B 35 SER OG : rot -130:sc= -0.224 USER MOD Single : B 36 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00238) USER MOD Single : B 43 THR OG1 : rot -90:sc= 1.41 USER MOD Single : B 44 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.187) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -7.66! C(o=-7.7!,f=-13!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 30:sc= -1.89 USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 53 N ASP A 5 56.930 -1.959 -10.185 1.00 0.00 N ATOM 54 CA ASP A 5 56.189 -2.905 -9.307 1.00 0.00 C ATOM 55 C ASP A 5 56.119 -2.341 -7.885 1.00 0.00 C ATOM 56 O ASP A 5 56.791 -1.384 -7.552 1.00 0.00 O ATOM 57 CB ASP A 5 56.916 -4.251 -9.284 1.00 0.00 C ATOM 58 CG ASP A 5 56.209 -5.231 -10.221 1.00 0.00 C ATOM 59 OD1 ASP A 5 55.038 -5.493 -9.998 1.00 0.00 O ATOM 60 OD2 ASP A 5 56.849 -5.702 -11.146 1.00 0.00 O ATOM 0 HA ASP A 5 55.178 -3.040 -9.692 1.00 0.00 H new ATOM 0 HB2 ASP A 5 57.953 -4.121 -9.593 1.00 0.00 H new ATOM 0 HB3 ASP A 5 56.933 -4.650 -8.270 1.00 0.00 H new ATOM 65 N THR A 6 55.315 -2.933 -7.044 1.00 0.00 N ATOM 66 CA THR A 6 55.204 -2.439 -5.642 1.00 0.00 C ATOM 67 C THR A 6 54.517 -1.067 -5.629 1.00 0.00 C ATOM 68 O THR A 6 54.621 -0.313 -6.576 1.00 0.00 O ATOM 69 CB THR A 6 56.603 -2.316 -5.027 1.00 0.00 C ATOM 70 OG1 THR A 6 57.110 -1.010 -5.263 1.00 0.00 O ATOM 71 CG2 THR A 6 57.539 -3.351 -5.659 1.00 0.00 C ATOM 0 H THR A 6 54.730 -3.738 -7.268 1.00 0.00 H new ATOM 0 HA THR A 6 54.612 -3.145 -5.059 1.00 0.00 H new ATOM 0 HB THR A 6 56.542 -2.495 -3.954 1.00 0.00 H new ATOM 0 HG1 THR A 6 57.323 -0.909 -6.214 1.00 0.00 H new ATOM 0 HG21 THR A 6 58.532 -3.260 -5.219 1.00 0.00 H new ATOM 0 HG22 THR A 6 57.151 -4.353 -5.475 1.00 0.00 H new ATOM 0 HG23 THR A 6 57.601 -3.178 -6.733 1.00 0.00 H new ATOM 79 N PRO A 7 53.833 -0.789 -4.547 1.00 0.00 N ATOM 80 CA PRO A 7 53.109 0.481 -4.361 1.00 0.00 C ATOM 81 C PRO A 7 54.083 1.586 -3.938 1.00 0.00 C ATOM 82 O PRO A 7 55.257 1.345 -3.742 1.00 0.00 O ATOM 83 CB PRO A 7 52.122 0.166 -3.231 1.00 0.00 C ATOM 84 CG PRO A 7 52.712 -1.040 -2.460 1.00 0.00 C ATOM 85 CD PRO A 7 53.717 -1.721 -3.408 1.00 0.00 C ATOM 0 HA PRO A 7 52.616 0.835 -5.266 1.00 0.00 H new ATOM 0 HB2 PRO A 7 51.999 1.026 -2.572 1.00 0.00 H new ATOM 0 HB3 PRO A 7 51.137 -0.073 -3.631 1.00 0.00 H new ATOM 0 HG2 PRO A 7 53.205 -0.711 -1.545 1.00 0.00 H new ATOM 0 HG3 PRO A 7 51.925 -1.734 -2.166 1.00 0.00 H new ATOM 0 HD2 PRO A 7 54.680 -1.877 -2.922 1.00 0.00 H new ATOM 0 HD3 PRO A 7 53.360 -2.700 -3.729 1.00 0.00 H new ATOM 93 N THR A 8 53.607 2.793 -3.789 1.00 0.00 N ATOM 94 CA THR A 8 54.511 3.901 -3.368 1.00 0.00 C ATOM 95 C THR A 8 54.549 3.959 -1.840 1.00 0.00 C ATOM 96 O THR A 8 53.673 4.516 -1.210 1.00 0.00 O ATOM 97 CB THR A 8 53.988 5.231 -3.918 1.00 0.00 C ATOM 98 OG1 THR A 8 53.938 5.169 -5.337 1.00 0.00 O ATOM 99 CG2 THR A 8 54.918 6.368 -3.488 1.00 0.00 C ATOM 0 H THR A 8 52.634 3.059 -3.940 1.00 0.00 H new ATOM 0 HA THR A 8 55.514 3.724 -3.756 1.00 0.00 H new ATOM 0 HB THR A 8 52.988 5.416 -3.526 1.00 0.00 H new ATOM 0 HG1 THR A 8 53.259 5.794 -5.668 1.00 0.00 H new ATOM 0 HG21 THR A 8 54.543 7.313 -3.881 1.00 0.00 H new ATOM 0 HG22 THR A 8 54.954 6.416 -2.400 1.00 0.00 H new ATOM 0 HG23 THR A 8 55.920 6.185 -3.877 1.00 0.00 H new ATOM 107 N ALA A 9 55.553 3.380 -1.240 1.00 0.00 N ATOM 108 CA ALA A 9 55.642 3.396 0.247 1.00 0.00 C ATOM 109 C ALA A 9 55.282 4.788 0.771 1.00 0.00 C ATOM 110 O ALA A 9 55.554 5.790 0.140 1.00 0.00 O ATOM 111 CB ALA A 9 57.067 3.040 0.679 1.00 0.00 C ATOM 0 H ALA A 9 56.315 2.897 -1.715 1.00 0.00 H new ATOM 0 HA ALA A 9 54.945 2.665 0.657 1.00 0.00 H new ATOM 0 HB1 ALA A 9 57.131 3.052 1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 9 57.321 2.046 0.311 1.00 0.00 H new ATOM 0 HB3 ALA A 9 57.765 3.768 0.266 1.00 0.00 H new ATOM 117 N CYS A 10 54.672 4.855 1.922 1.00 0.00 N ATOM 118 CA CYS A 10 54.292 6.178 2.492 1.00 0.00 C ATOM 119 C CYS A 10 54.429 6.129 4.013 1.00 0.00 C ATOM 120 O CYS A 10 54.521 5.069 4.601 1.00 0.00 O ATOM 121 CB CYS A 10 52.842 6.497 2.121 1.00 0.00 C ATOM 122 SG CYS A 10 52.686 6.568 0.318 1.00 0.00 S ATOM 0 H CYS A 10 54.420 4.049 2.494 1.00 0.00 H new ATOM 0 HA CYS A 10 54.947 6.951 2.090 1.00 0.00 H new ATOM 0 HB2 CYS A 10 52.175 5.735 2.525 1.00 0.00 H new ATOM 0 HB3 CYS A 10 52.543 7.448 2.561 1.00 0.00 H new ATOM 127 N CYS A 11 54.443 7.262 4.657 1.00 0.00 N ATOM 128 CA CYS A 11 54.573 7.263 6.140 1.00 0.00 C ATOM 129 C CYS A 11 53.380 7.987 6.763 1.00 0.00 C ATOM 130 O CYS A 11 53.472 9.132 7.158 1.00 0.00 O ATOM 131 CB CYS A 11 55.866 7.970 6.548 1.00 0.00 C ATOM 132 SG CYS A 11 56.474 7.218 8.080 1.00 0.00 S ATOM 0 H CYS A 11 54.370 8.182 4.224 1.00 0.00 H new ATOM 0 HA CYS A 11 54.598 6.233 6.494 1.00 0.00 H new ATOM 0 HB2 CYS A 11 56.613 7.879 5.759 1.00 0.00 H new ATOM 0 HB3 CYS A 11 55.685 9.035 6.695 1.00 0.00 H new ATOM 137 N PHE A 12 52.259 7.326 6.860 1.00 0.00 N ATOM 138 CA PHE A 12 51.064 7.980 7.460 1.00 0.00 C ATOM 139 C PHE A 12 51.014 7.682 8.961 1.00 0.00 C ATOM 140 O PHE A 12 50.554 8.490 9.744 1.00 0.00 O ATOM 141 CB PHE A 12 49.795 7.452 6.788 1.00 0.00 C ATOM 142 CG PHE A 12 49.442 8.332 5.612 1.00 0.00 C ATOM 143 CD1 PHE A 12 49.403 9.724 5.764 1.00 0.00 C ATOM 144 CD2 PHE A 12 49.155 7.756 4.368 1.00 0.00 C ATOM 145 CE1 PHE A 12 49.075 10.539 4.673 1.00 0.00 C ATOM 146 CE2 PHE A 12 48.826 8.571 3.278 1.00 0.00 C ATOM 147 CZ PHE A 12 48.787 9.962 3.430 1.00 0.00 C ATOM 0 H PHE A 12 52.120 6.364 6.550 1.00 0.00 H new ATOM 0 HA PHE A 12 51.129 9.057 7.308 1.00 0.00 H new ATOM 0 HB2 PHE A 12 49.948 6.426 6.454 1.00 0.00 H new ATOM 0 HB3 PHE A 12 48.972 7.436 7.503 1.00 0.00 H new ATOM 0 HD1 PHE A 12 49.626 10.169 6.723 1.00 0.00 H new ATOM 0 HD2 PHE A 12 49.187 6.683 4.249 1.00 0.00 H new ATOM 0 HE1 PHE A 12 49.044 11.612 4.790 1.00 0.00 H new ATOM 0 HE2 PHE A 12 48.602 8.126 2.320 1.00 0.00 H new ATOM 0 HZ PHE A 12 48.535 10.590 2.589 1.00 0.00 H new ATOM 157 N SER A 13 51.477 6.531 9.375 1.00 0.00 N ATOM 158 CA SER A 13 51.440 6.206 10.831 1.00 0.00 C ATOM 159 C SER A 13 52.682 5.400 11.228 1.00 0.00 C ATOM 160 O SER A 13 52.905 4.307 10.744 1.00 0.00 O ATOM 161 CB SER A 13 50.184 5.386 11.133 1.00 0.00 C ATOM 162 OG SER A 13 49.036 6.205 10.945 1.00 0.00 O ATOM 0 H SER A 13 51.875 5.809 8.775 1.00 0.00 H new ATOM 0 HA SER A 13 51.424 7.134 11.402 1.00 0.00 H new ATOM 0 HB2 SER A 13 50.137 4.516 10.478 1.00 0.00 H new ATOM 0 HB3 SER A 13 50.216 5.013 12.157 1.00 0.00 H new ATOM 0 HG SER A 13 48.228 5.684 11.136 1.00 0.00 H new ATOM 168 N TYR A 14 53.487 5.925 12.116 1.00 0.00 N ATOM 169 CA TYR A 14 54.707 5.180 12.555 1.00 0.00 C ATOM 170 C TYR A 14 54.431 4.554 13.921 1.00 0.00 C ATOM 171 O TYR A 14 53.521 4.950 14.621 1.00 0.00 O ATOM 172 CB TYR A 14 55.919 6.121 12.657 1.00 0.00 C ATOM 173 CG TYR A 14 55.606 7.454 12.017 1.00 0.00 C ATOM 174 CD1 TYR A 14 55.101 7.506 10.711 1.00 0.00 C ATOM 175 CD2 TYR A 14 55.820 8.639 12.732 1.00 0.00 C ATOM 176 CE1 TYR A 14 54.812 8.742 10.121 1.00 0.00 C ATOM 177 CE2 TYR A 14 55.529 9.874 12.141 1.00 0.00 C ATOM 178 CZ TYR A 14 55.026 9.926 10.836 1.00 0.00 C ATOM 179 OH TYR A 14 54.739 11.144 10.255 1.00 0.00 O ATOM 0 H TYR A 14 53.353 6.836 12.556 1.00 0.00 H new ATOM 0 HA TYR A 14 54.937 4.408 11.820 1.00 0.00 H new ATOM 0 HB2 TYR A 14 56.187 6.267 13.703 1.00 0.00 H new ATOM 0 HB3 TYR A 14 56.781 5.669 12.167 1.00 0.00 H new ATOM 0 HD1 TYR A 14 54.935 6.592 10.160 1.00 0.00 H new ATOM 0 HD2 TYR A 14 56.209 8.600 13.739 1.00 0.00 H new ATOM 0 HE1 TYR A 14 54.424 8.782 9.114 1.00 0.00 H new ATOM 0 HE2 TYR A 14 55.693 10.788 12.693 1.00 0.00 H new ATOM 0 HH TYR A 14 54.944 11.864 10.887 1.00 0.00 H new ATOM 189 N THR A 15 55.198 3.572 14.304 1.00 0.00 N ATOM 190 CA THR A 15 54.957 2.921 15.622 1.00 0.00 C ATOM 191 C THR A 15 55.955 3.436 16.658 1.00 0.00 C ATOM 192 O THR A 15 57.128 3.590 16.382 1.00 0.00 O ATOM 193 CB THR A 15 55.110 1.409 15.470 1.00 0.00 C ATOM 194 OG1 THR A 15 56.320 1.124 14.779 1.00 0.00 O ATOM 195 CG2 THR A 15 53.928 0.862 14.675 1.00 0.00 C ATOM 0 H THR A 15 55.977 3.194 13.765 1.00 0.00 H new ATOM 0 HA THR A 15 53.948 3.159 15.960 1.00 0.00 H new ATOM 0 HB THR A 15 55.136 0.941 16.454 1.00 0.00 H new ATOM 0 HG1 THR A 15 56.989 0.793 15.414 1.00 0.00 H new ATOM 0 HG21 THR A 15 54.033 -0.217 14.564 1.00 0.00 H new ATOM 0 HG22 THR A 15 53.001 1.084 15.203 1.00 0.00 H new ATOM 0 HG23 THR A 15 53.905 1.328 13.690 1.00 0.00 H new ATOM 203 N SER A 16 55.500 3.684 17.857 1.00 0.00 N ATOM 204 CA SER A 16 56.426 4.167 18.917 1.00 0.00 C ATOM 205 C SER A 16 57.402 3.040 19.250 1.00 0.00 C ATOM 206 O SER A 16 58.569 3.265 19.505 1.00 0.00 O ATOM 207 CB SER A 16 55.625 4.540 20.164 1.00 0.00 C ATOM 208 OG SER A 16 54.331 4.984 19.774 1.00 0.00 O ATOM 0 H SER A 16 54.528 3.573 18.146 1.00 0.00 H new ATOM 0 HA SER A 16 56.971 5.046 18.572 1.00 0.00 H new ATOM 0 HB2 SER A 16 55.542 3.680 20.828 1.00 0.00 H new ATOM 0 HB3 SER A 16 56.139 5.324 20.720 1.00 0.00 H new ATOM 0 HG SER A 16 53.813 5.223 20.571 1.00 0.00 H new ATOM 214 N ARG A 17 56.930 1.822 19.231 1.00 0.00 N ATOM 215 CA ARG A 17 57.822 0.668 19.525 1.00 0.00 C ATOM 216 C ARG A 17 58.482 0.222 18.221 1.00 0.00 C ATOM 217 O ARG A 17 57.858 0.195 17.180 1.00 0.00 O ATOM 218 CB ARG A 17 56.996 -0.482 20.102 1.00 0.00 C ATOM 219 CG ARG A 17 57.929 -1.514 20.737 1.00 0.00 C ATOM 220 CD ARG A 17 57.438 -1.845 22.147 1.00 0.00 C ATOM 221 NE ARG A 17 55.948 -1.871 22.160 1.00 0.00 N ATOM 222 CZ ARG A 17 55.307 -2.802 21.511 1.00 0.00 C ATOM 223 NH1 ARG A 17 55.770 -4.023 21.494 1.00 0.00 N ATOM 224 NH2 ARG A 17 54.202 -2.515 20.880 1.00 0.00 N ATOM 0 H ARG A 17 55.962 1.578 19.024 1.00 0.00 H new ATOM 0 HA ARG A 17 58.583 0.957 20.250 1.00 0.00 H new ATOM 0 HB2 ARG A 17 56.296 -0.103 20.846 1.00 0.00 H new ATOM 0 HB3 ARG A 17 56.403 -0.948 19.315 1.00 0.00 H new ATOM 0 HG2 ARG A 17 57.957 -2.418 20.128 1.00 0.00 H new ATOM 0 HG3 ARG A 17 58.946 -1.125 20.777 1.00 0.00 H new ATOM 0 HD2 ARG A 17 57.832 -2.811 22.464 1.00 0.00 H new ATOM 0 HD3 ARG A 17 57.806 -1.103 22.855 1.00 0.00 H new ATOM 0 HE ARG A 17 55.430 -1.160 22.677 1.00 0.00 H new ATOM 0 HH11 ARG A 17 56.633 -4.248 21.989 1.00 0.00 H new ATOM 0 HH12 ARG A 17 55.268 -4.752 20.986 1.00 0.00 H new ATOM 0 HH21 ARG A 17 53.839 -1.562 20.894 1.00 0.00 H new ATOM 0 HH22 ARG A 17 53.701 -3.244 20.372 1.00 0.00 H new ATOM 238 N GLN A 18 59.741 -0.108 18.257 1.00 0.00 N ATOM 239 CA GLN A 18 60.431 -0.523 17.011 1.00 0.00 C ATOM 240 C GLN A 18 60.235 -2.001 16.722 1.00 0.00 C ATOM 241 O GLN A 18 59.394 -2.676 17.282 1.00 0.00 O ATOM 242 CB GLN A 18 61.915 -0.262 17.133 1.00 0.00 C ATOM 243 CG GLN A 18 62.167 0.947 18.033 1.00 0.00 C ATOM 244 CD GLN A 18 62.593 0.467 19.422 1.00 0.00 C ATOM 245 OE1 GLN A 18 63.273 1.174 20.139 1.00 0.00 O ATOM 246 NE2 GLN A 18 62.219 -0.714 19.836 1.00 0.00 N ATOM 0 H GLN A 18 60.320 -0.108 19.096 1.00 0.00 H new ATOM 0 HA GLN A 18 59.999 0.058 16.196 1.00 0.00 H new ATOM 0 HB2 GLN A 18 62.413 -1.140 17.544 1.00 0.00 H new ATOM 0 HB3 GLN A 18 62.343 -0.085 16.146 1.00 0.00 H new ATOM 0 HG2 GLN A 18 62.942 1.580 17.601 1.00 0.00 H new ATOM 0 HG3 GLN A 18 61.264 1.554 18.107 1.00 0.00 H new ATOM 0 HE21 GLN A 18 61.648 -1.308 19.235 1.00 0.00 H new ATOM 0 HE22 GLN A 18 62.498 -1.042 20.761 1.00 0.00 H new ATOM 255 N ILE A 19 61.046 -2.482 15.838 1.00 0.00 N ATOM 256 CA ILE A 19 61.029 -3.889 15.424 1.00 0.00 C ATOM 257 C ILE A 19 62.466 -4.218 15.044 1.00 0.00 C ATOM 258 O ILE A 19 62.937 -3.807 14.005 1.00 0.00 O ATOM 259 CB ILE A 19 60.128 -4.068 14.208 1.00 0.00 C ATOM 260 CG1 ILE A 19 60.072 -2.766 13.403 1.00 0.00 C ATOM 261 CG2 ILE A 19 58.721 -4.447 14.663 1.00 0.00 C ATOM 262 CD1 ILE A 19 59.224 -2.978 12.148 1.00 0.00 C ATOM 0 H ILE A 19 61.755 -1.922 15.365 1.00 0.00 H new ATOM 0 HA ILE A 19 60.652 -4.536 16.216 1.00 0.00 H new ATOM 0 HB ILE A 19 60.533 -4.861 13.579 1.00 0.00 H new ATOM 0 HG12 ILE A 19 59.647 -1.968 14.011 1.00 0.00 H new ATOM 0 HG13 ILE A 19 61.079 -2.454 13.126 1.00 0.00 H new ATOM 0 HG21 ILE A 19 58.079 -4.574 13.792 1.00 0.00 H new ATOM 0 HG22 ILE A 19 58.759 -5.380 15.225 1.00 0.00 H new ATOM 0 HG23 ILE A 19 58.319 -3.657 15.298 1.00 0.00 H new ATOM 0 HD11 ILE A 19 59.184 -2.052 11.575 1.00 0.00 H new ATOM 0 HD12 ILE A 19 59.668 -3.764 11.537 1.00 0.00 H new ATOM 0 HD13 ILE A 19 58.214 -3.270 12.436 1.00 0.00 H new ATOM 274 N PRO A 20 63.129 -4.917 15.909 1.00 0.00 N ATOM 275 CA PRO A 20 64.538 -5.279 15.710 1.00 0.00 C ATOM 276 C PRO A 20 64.700 -6.185 14.496 1.00 0.00 C ATOM 277 O PRO A 20 63.743 -6.698 13.960 1.00 0.00 O ATOM 278 CB PRO A 20 64.916 -5.967 17.024 1.00 0.00 C ATOM 279 CG PRO A 20 63.584 -6.406 17.669 1.00 0.00 C ATOM 280 CD PRO A 20 62.527 -5.448 17.142 1.00 0.00 C ATOM 0 HA PRO A 20 65.185 -4.428 15.500 1.00 0.00 H new ATOM 0 HB2 PRO A 20 65.564 -6.825 16.844 1.00 0.00 H new ATOM 0 HB3 PRO A 20 65.462 -5.287 17.678 1.00 0.00 H new ATOM 0 HG2 PRO A 20 63.343 -7.436 17.405 1.00 0.00 H new ATOM 0 HG3 PRO A 20 63.644 -6.361 18.756 1.00 0.00 H new ATOM 0 HD2 PRO A 20 61.586 -5.960 16.941 1.00 0.00 H new ATOM 0 HD3 PRO A 20 62.312 -4.654 17.858 1.00 0.00 H new ATOM 288 N GLN A 21 65.905 -6.352 14.037 1.00 0.00 N ATOM 289 CA GLN A 21 66.134 -7.195 12.835 1.00 0.00 C ATOM 290 C GLN A 21 65.427 -8.544 12.998 1.00 0.00 C ATOM 291 O GLN A 21 64.860 -9.070 12.062 1.00 0.00 O ATOM 292 CB GLN A 21 67.639 -7.417 12.651 1.00 0.00 C ATOM 293 CG GLN A 21 68.291 -6.132 12.129 1.00 0.00 C ATOM 294 CD GLN A 21 69.569 -6.480 11.364 1.00 0.00 C ATOM 295 OE1 GLN A 21 70.517 -6.977 11.938 1.00 0.00 O ATOM 296 NE2 GLN A 21 69.636 -6.236 10.083 1.00 0.00 N ATOM 0 H GLN A 21 66.745 -5.940 14.444 1.00 0.00 H new ATOM 0 HA GLN A 21 65.730 -6.690 11.958 1.00 0.00 H new ATOM 0 HB2 GLN A 21 68.092 -7.707 13.599 1.00 0.00 H new ATOM 0 HB3 GLN A 21 67.813 -8.235 11.951 1.00 0.00 H new ATOM 0 HG2 GLN A 21 67.598 -5.600 11.477 1.00 0.00 H new ATOM 0 HG3 GLN A 21 68.522 -5.466 12.960 1.00 0.00 H new ATOM 0 HE21 GLN A 21 68.840 -5.819 9.601 1.00 0.00 H new ATOM 0 HE22 GLN A 21 70.484 -6.463 9.564 1.00 0.00 H new ATOM 305 N ASN A 22 65.452 -9.113 14.172 1.00 0.00 N ATOM 306 CA ASN A 22 64.772 -10.424 14.365 1.00 0.00 C ATOM 307 C ASN A 22 63.338 -10.328 13.845 1.00 0.00 C ATOM 308 O ASN A 22 62.832 -11.235 13.215 1.00 0.00 O ATOM 309 CB ASN A 22 64.751 -10.782 15.852 1.00 0.00 C ATOM 310 CG ASN A 22 64.967 -12.289 16.011 1.00 0.00 C ATOM 311 OD1 ASN A 22 66.034 -12.725 16.396 1.00 0.00 O ATOM 312 ND2 ASN A 22 63.992 -13.108 15.723 1.00 0.00 N ATOM 0 H ASN A 22 65.910 -8.731 14.999 1.00 0.00 H new ATOM 0 HA ASN A 22 65.312 -11.197 13.818 1.00 0.00 H new ATOM 0 HB2 ASN A 22 65.530 -10.233 16.381 1.00 0.00 H new ATOM 0 HB3 ASN A 22 63.799 -10.490 16.295 1.00 0.00 H new ATOM 0 HD21 ASN A 22 64.126 -14.114 15.821 1.00 0.00 H new ATOM 0 HD22 ASN A 22 63.097 -12.741 15.400 1.00 0.00 H new ATOM 319 N PHE A 23 62.678 -9.234 14.109 1.00 0.00 N ATOM 320 CA PHE A 23 61.276 -9.074 13.639 1.00 0.00 C ATOM 321 C PHE A 23 61.257 -8.424 12.252 1.00 0.00 C ATOM 322 O PHE A 23 60.245 -8.420 11.581 1.00 0.00 O ATOM 323 CB PHE A 23 60.516 -8.187 14.625 1.00 0.00 C ATOM 324 CG PHE A 23 59.563 -9.035 15.430 1.00 0.00 C ATOM 325 CD1 PHE A 23 58.297 -9.346 14.918 1.00 0.00 C ATOM 326 CD2 PHE A 23 59.946 -9.511 16.689 1.00 0.00 C ATOM 327 CE1 PHE A 23 57.414 -10.133 15.668 1.00 0.00 C ATOM 328 CE2 PHE A 23 59.064 -10.297 17.437 1.00 0.00 C ATOM 329 CZ PHE A 23 57.798 -10.609 16.928 1.00 0.00 C ATOM 0 H PHE A 23 63.052 -8.442 14.632 1.00 0.00 H new ATOM 0 HA PHE A 23 60.803 -10.054 13.578 1.00 0.00 H new ATOM 0 HB2 PHE A 23 61.216 -7.678 15.288 1.00 0.00 H new ATOM 0 HB3 PHE A 23 59.967 -7.414 14.087 1.00 0.00 H new ATOM 0 HD1 PHE A 23 58.002 -8.979 13.946 1.00 0.00 H new ATOM 0 HD2 PHE A 23 60.923 -9.271 17.083 1.00 0.00 H new ATOM 0 HE1 PHE A 23 56.437 -10.373 15.275 1.00 0.00 H new ATOM 0 HE2 PHE A 23 59.360 -10.664 18.409 1.00 0.00 H new ATOM 0 HZ PHE A 23 57.118 -11.216 17.506 1.00 0.00 H new ATOM 339 N ILE A 24 62.356 -7.871 11.808 1.00 0.00 N ATOM 340 CA ILE A 24 62.355 -7.230 10.462 1.00 0.00 C ATOM 341 C ILE A 24 62.465 -8.297 9.379 1.00 0.00 C ATOM 342 O ILE A 24 63.189 -9.265 9.501 1.00 0.00 O ATOM 343 CB ILE A 24 63.547 -6.257 10.299 1.00 0.00 C ATOM 344 CG1 ILE A 24 63.351 -4.942 11.077 1.00 0.00 C ATOM 345 CG2 ILE A 24 63.686 -5.886 8.823 1.00 0.00 C ATOM 346 CD1 ILE A 24 61.966 -4.876 11.711 1.00 0.00 C ATOM 0 H ILE A 24 63.242 -7.836 12.312 1.00 0.00 H new ATOM 0 HA ILE A 24 61.422 -6.675 10.366 1.00 0.00 H new ATOM 0 HB ILE A 24 64.428 -6.768 10.687 1.00 0.00 H new ATOM 0 HG12 ILE A 24 64.113 -4.858 11.852 1.00 0.00 H new ATOM 0 HG13 ILE A 24 63.486 -4.095 10.404 1.00 0.00 H new ATOM 0 HG21 ILE A 24 64.524 -5.200 8.698 1.00 0.00 H new ATOM 0 HG22 ILE A 24 63.864 -6.787 8.236 1.00 0.00 H new ATOM 0 HG23 ILE A 24 62.769 -5.406 8.481 1.00 0.00 H new ATOM 0 HD11 ILE A 24 61.858 -3.936 12.253 1.00 0.00 H new ATOM 0 HD12 ILE A 24 61.206 -4.935 10.932 1.00 0.00 H new ATOM 0 HD13 ILE A 24 61.842 -5.710 12.402 1.00 0.00 H new ATOM 358 N ALA A 25 61.782 -8.083 8.296 1.00 0.00 N ATOM 359 CA ALA A 25 61.859 -9.022 7.153 1.00 0.00 C ATOM 360 C ALA A 25 62.238 -8.192 5.930 1.00 0.00 C ATOM 361 O ALA A 25 63.316 -8.317 5.384 1.00 0.00 O ATOM 362 CB ALA A 25 60.501 -9.689 6.929 1.00 0.00 C ATOM 0 H ALA A 25 61.164 -7.284 8.153 1.00 0.00 H new ATOM 0 HA ALA A 25 62.591 -9.808 7.340 1.00 0.00 H new ATOM 0 HB1 ALA A 25 60.568 -10.377 6.087 1.00 0.00 H new ATOM 0 HB2 ALA A 25 60.214 -10.239 7.825 1.00 0.00 H new ATOM 0 HB3 ALA A 25 59.752 -8.926 6.716 1.00 0.00 H new ATOM 368 N ALA A 26 61.360 -7.317 5.523 1.00 0.00 N ATOM 369 CA ALA A 26 61.661 -6.431 4.362 1.00 0.00 C ATOM 370 C ALA A 26 61.990 -5.026 4.879 1.00 0.00 C ATOM 371 O ALA A 26 62.278 -4.836 6.042 1.00 0.00 O ATOM 372 CB ALA A 26 60.449 -6.370 3.432 1.00 0.00 C ATOM 0 H ALA A 26 60.443 -7.177 5.946 1.00 0.00 H new ATOM 0 HA ALA A 26 62.512 -6.826 3.808 1.00 0.00 H new ATOM 0 HB1 ALA A 26 60.673 -5.722 2.585 1.00 0.00 H new ATOM 0 HB2 ALA A 26 60.217 -7.372 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 26 59.592 -5.973 3.976 1.00 0.00 H new ATOM 378 N TYR A 27 61.925 -4.036 4.027 1.00 0.00 N ATOM 379 CA TYR A 27 62.204 -2.639 4.474 1.00 0.00 C ATOM 380 C TYR A 27 61.298 -1.683 3.675 1.00 0.00 C ATOM 381 O TYR A 27 60.110 -1.611 3.919 1.00 0.00 O ATOM 382 CB TYR A 27 63.690 -2.287 4.260 1.00 0.00 C ATOM 383 CG TYR A 27 64.225 -2.911 2.983 1.00 0.00 C ATOM 384 CD1 TYR A 27 64.283 -4.305 2.849 1.00 0.00 C ATOM 385 CD2 TYR A 27 64.680 -2.092 1.937 1.00 0.00 C ATOM 386 CE1 TYR A 27 64.787 -4.876 1.674 1.00 0.00 C ATOM 387 CE2 TYR A 27 65.184 -2.664 0.765 1.00 0.00 C ATOM 388 CZ TYR A 27 65.237 -4.057 0.632 1.00 0.00 C ATOM 389 OH TYR A 27 65.736 -4.622 -0.524 1.00 0.00 O ATOM 0 H TYR A 27 61.690 -4.135 3.039 1.00 0.00 H new ATOM 0 HA TYR A 27 61.994 -2.542 5.539 1.00 0.00 H new ATOM 0 HB2 TYR A 27 63.807 -1.204 4.215 1.00 0.00 H new ATOM 0 HB3 TYR A 27 64.275 -2.636 5.111 1.00 0.00 H new ATOM 0 HD1 TYR A 27 63.939 -4.939 3.653 1.00 0.00 H new ATOM 0 HD2 TYR A 27 64.641 -1.017 2.038 1.00 0.00 H new ATOM 0 HE1 TYR A 27 64.829 -5.950 1.572 1.00 0.00 H new ATOM 0 HE2 TYR A 27 65.533 -2.031 -0.038 1.00 0.00 H new ATOM 0 HH TYR A 27 66.003 -3.913 -1.146 1.00 0.00 H new ATOM 399 N PHE A 28 61.847 -0.970 2.717 1.00 0.00 N ATOM 400 CA PHE A 28 61.040 -0.036 1.865 1.00 0.00 C ATOM 401 C PHE A 28 61.003 1.357 2.481 1.00 0.00 C ATOM 402 O PHE A 28 60.461 1.564 3.547 1.00 0.00 O ATOM 403 CB PHE A 28 59.605 -0.542 1.698 1.00 0.00 C ATOM 404 CG PHE A 28 59.596 -2.033 1.477 1.00 0.00 C ATOM 405 CD1 PHE A 28 60.750 -2.689 1.042 1.00 0.00 C ATOM 406 CD2 PHE A 28 58.428 -2.753 1.720 1.00 0.00 C ATOM 407 CE1 PHE A 28 60.734 -4.072 0.847 1.00 0.00 C ATOM 408 CE2 PHE A 28 58.406 -4.138 1.525 1.00 0.00 C ATOM 409 CZ PHE A 28 59.561 -4.799 1.088 1.00 0.00 C ATOM 0 H PHE A 28 62.840 -0.997 2.486 1.00 0.00 H new ATOM 0 HA PHE A 28 61.520 0.008 0.887 1.00 0.00 H new ATOM 0 HB2 PHE A 28 59.020 -0.296 2.584 1.00 0.00 H new ATOM 0 HB3 PHE A 28 59.131 -0.040 0.854 1.00 0.00 H new ATOM 0 HD1 PHE A 28 61.654 -2.127 0.857 1.00 0.00 H new ATOM 0 HD2 PHE A 28 57.539 -2.241 2.059 1.00 0.00 H new ATOM 0 HE1 PHE A 28 61.625 -4.581 0.511 1.00 0.00 H new ATOM 0 HE2 PHE A 28 57.500 -4.696 1.711 1.00 0.00 H new ATOM 0 HZ PHE A 28 59.547 -5.868 0.937 1.00 0.00 H new ATOM 419 N GLU A 29 61.557 2.317 1.797 1.00 0.00 N ATOM 420 CA GLU A 29 61.547 3.714 2.316 1.00 0.00 C ATOM 421 C GLU A 29 60.513 4.524 1.533 1.00 0.00 C ATOM 422 O GLU A 29 60.302 4.308 0.357 1.00 0.00 O ATOM 423 CB GLU A 29 62.934 4.346 2.158 1.00 0.00 C ATOM 424 CG GLU A 29 63.703 3.643 1.035 1.00 0.00 C ATOM 425 CD GLU A 29 64.949 4.456 0.682 1.00 0.00 C ATOM 426 OE1 GLU A 29 65.058 5.574 1.160 1.00 0.00 O ATOM 427 OE2 GLU A 29 65.773 3.947 -0.060 1.00 0.00 O ATOM 0 H GLU A 29 62.019 2.195 0.896 1.00 0.00 H new ATOM 0 HA GLU A 29 61.288 3.709 3.375 1.00 0.00 H new ATOM 0 HB2 GLU A 29 62.836 5.408 1.934 1.00 0.00 H new ATOM 0 HB3 GLU A 29 63.487 4.268 3.094 1.00 0.00 H new ATOM 0 HG2 GLU A 29 63.988 2.639 1.349 1.00 0.00 H new ATOM 0 HG3 GLU A 29 63.066 3.534 0.157 1.00 0.00 H new ATOM 434 N THR A 30 59.850 5.439 2.183 1.00 0.00 N ATOM 435 CA THR A 30 58.810 6.243 1.483 1.00 0.00 C ATOM 436 C THR A 30 59.390 7.583 1.031 1.00 0.00 C ATOM 437 O THR A 30 60.420 8.018 1.503 1.00 0.00 O ATOM 438 CB THR A 30 57.643 6.489 2.438 1.00 0.00 C ATOM 439 OG1 THR A 30 57.992 7.516 3.356 1.00 0.00 O ATOM 440 CG2 THR A 30 57.332 5.202 3.203 1.00 0.00 C ATOM 0 H THR A 30 59.983 5.665 3.169 1.00 0.00 H new ATOM 0 HA THR A 30 58.465 5.696 0.605 1.00 0.00 H new ATOM 0 HB THR A 30 56.764 6.794 1.870 1.00 0.00 H new ATOM 0 HG1 THR A 30 58.107 7.131 4.250 1.00 0.00 H new ATOM 0 HG21 THR A 30 56.500 5.376 3.885 1.00 0.00 H new ATOM 0 HG22 THR A 30 57.065 4.415 2.498 1.00 0.00 H new ATOM 0 HG23 THR A 30 58.210 4.896 3.773 1.00 0.00 H new ATOM 448 N SER A 31 58.727 8.239 0.115 1.00 0.00 N ATOM 449 CA SER A 31 59.226 9.554 -0.380 1.00 0.00 C ATOM 450 C SER A 31 58.421 9.976 -1.607 1.00 0.00 C ATOM 451 O SER A 31 57.557 10.827 -1.538 1.00 0.00 O ATOM 452 CB SER A 31 60.700 9.430 -0.765 1.00 0.00 C ATOM 453 OG SER A 31 61.110 10.613 -1.436 1.00 0.00 O ATOM 0 H SER A 31 57.858 7.919 -0.313 1.00 0.00 H new ATOM 0 HA SER A 31 59.115 10.300 0.406 1.00 0.00 H new ATOM 0 HB2 SER A 31 61.309 9.274 0.126 1.00 0.00 H new ATOM 0 HB3 SER A 31 60.848 8.563 -1.409 1.00 0.00 H new ATOM 0 HG SER A 31 62.055 10.538 -1.683 1.00 0.00 H new ATOM 459 N SER A 32 58.710 9.386 -2.727 1.00 0.00 N ATOM 460 CA SER A 32 57.984 9.735 -3.976 1.00 0.00 C ATOM 461 C SER A 32 56.490 9.930 -3.696 1.00 0.00 C ATOM 462 O SER A 32 55.785 9.004 -3.349 1.00 0.00 O ATOM 463 CB SER A 32 58.166 8.600 -4.974 1.00 0.00 C ATOM 464 OG SER A 32 57.060 8.573 -5.867 1.00 0.00 O ATOM 0 H SER A 32 59.427 8.668 -2.833 1.00 0.00 H new ATOM 0 HA SER A 32 58.384 10.666 -4.377 1.00 0.00 H new ATOM 0 HB2 SER A 32 59.093 8.736 -5.531 1.00 0.00 H new ATOM 0 HB3 SER A 32 58.246 7.648 -4.448 1.00 0.00 H new ATOM 0 HG SER A 32 57.177 7.844 -6.511 1.00 0.00 H new ATOM 470 N GLN A 33 56.004 11.129 -3.864 1.00 0.00 N ATOM 471 CA GLN A 33 54.554 11.398 -3.634 1.00 0.00 C ATOM 472 C GLN A 33 54.084 10.757 -2.325 1.00 0.00 C ATOM 473 O GLN A 33 53.401 9.751 -2.332 1.00 0.00 O ATOM 474 CB GLN A 33 53.744 10.814 -4.794 1.00 0.00 C ATOM 475 CG GLN A 33 53.377 11.927 -5.779 1.00 0.00 C ATOM 476 CD GLN A 33 51.935 11.733 -6.249 1.00 0.00 C ATOM 477 OE1 GLN A 33 51.004 11.958 -5.501 1.00 0.00 O ATOM 478 NE2 GLN A 33 51.708 11.319 -7.465 1.00 0.00 N ATOM 0 H GLN A 33 56.552 11.940 -4.153 1.00 0.00 H new ATOM 0 HA GLN A 33 54.405 12.476 -3.571 1.00 0.00 H new ATOM 0 HB2 GLN A 33 54.322 10.042 -5.302 1.00 0.00 H new ATOM 0 HB3 GLN A 33 52.840 10.338 -4.415 1.00 0.00 H new ATOM 0 HG2 GLN A 33 53.488 12.901 -5.302 1.00 0.00 H new ATOM 0 HG3 GLN A 33 54.055 11.911 -6.632 1.00 0.00 H new ATOM 0 HE21 GLN A 33 52.489 11.130 -8.093 1.00 0.00 H new ATOM 0 HE22 GLN A 33 50.750 11.184 -7.787 1.00 0.00 H new ATOM 487 N CYS A 34 54.421 11.339 -1.203 1.00 0.00 N ATOM 488 CA CYS A 34 53.970 10.769 0.102 1.00 0.00 C ATOM 489 C CYS A 34 54.830 11.325 1.240 1.00 0.00 C ATOM 490 O CYS A 34 55.595 12.250 1.059 1.00 0.00 O ATOM 491 CB CYS A 34 54.082 9.244 0.074 1.00 0.00 C ATOM 492 SG CYS A 34 52.425 8.530 -0.080 1.00 0.00 S ATOM 0 H CYS A 34 54.989 12.184 -1.134 1.00 0.00 H new ATOM 0 HA CYS A 34 52.930 11.049 0.267 1.00 0.00 H new ATOM 0 HB2 CYS A 34 54.706 8.928 -0.762 1.00 0.00 H new ATOM 0 HB3 CYS A 34 54.563 8.886 0.984 1.00 0.00 H new ATOM 497 N SER A 35 54.701 10.768 2.415 1.00 0.00 N ATOM 498 CA SER A 35 55.500 11.259 3.575 1.00 0.00 C ATOM 499 C SER A 35 56.947 11.509 3.139 1.00 0.00 C ATOM 500 O SER A 35 57.261 12.576 2.654 1.00 0.00 O ATOM 501 CB SER A 35 55.459 10.216 4.692 1.00 0.00 C ATOM 502 OG SER A 35 54.117 10.066 5.136 1.00 0.00 O ATOM 0 H SER A 35 54.074 9.991 2.622 1.00 0.00 H new ATOM 0 HA SER A 35 55.078 12.195 3.941 1.00 0.00 H new ATOM 0 HB2 SER A 35 55.845 9.263 4.331 1.00 0.00 H new ATOM 0 HB3 SER A 35 56.097 10.526 5.520 1.00 0.00 H new ATOM 0 HG SER A 35 54.097 10.048 6.116 1.00 0.00 H new ATOM 508 N LYS A 36 57.815 10.525 3.313 1.00 0.00 N ATOM 509 CA LYS A 36 59.266 10.654 2.916 1.00 0.00 C ATOM 510 C LYS A 36 60.181 10.500 4.142 1.00 0.00 C ATOM 511 O LYS A 36 61.185 9.819 4.063 1.00 0.00 O ATOM 512 CB LYS A 36 59.548 12.001 2.246 1.00 0.00 C ATOM 513 CG LYS A 36 61.016 12.076 1.818 1.00 0.00 C ATOM 514 CD LYS A 36 61.324 13.489 1.312 1.00 0.00 C ATOM 515 CE LYS A 36 62.395 13.426 0.222 1.00 0.00 C ATOM 516 NZ LYS A 36 63.714 13.111 0.839 1.00 0.00 N ATOM 0 H LYS A 36 57.572 9.622 3.721 1.00 0.00 H new ATOM 0 HA LYS A 36 59.474 9.857 2.202 1.00 0.00 H new ATOM 0 HB2 LYS A 36 58.901 12.127 1.378 1.00 0.00 H new ATOM 0 HB3 LYS A 36 59.320 12.814 2.935 1.00 0.00 H new ATOM 0 HG2 LYS A 36 61.665 11.829 2.658 1.00 0.00 H new ATOM 0 HG3 LYS A 36 61.216 11.345 1.035 1.00 0.00 H new ATOM 0 HD2 LYS A 36 60.418 13.950 0.918 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.667 14.114 2.137 1.00 0.00 H new ATOM 0 HE2 LYS A 36 62.135 12.666 -0.514 1.00 0.00 H new ATOM 0 HE3 LYS A 36 62.447 14.378 -0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 64.445 13.085 0.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 63.954 13.843 1.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 63.665 12.185 1.310 1.00 0.00 H new ATOM 530 N PRO A 37 59.831 11.138 5.238 1.00 0.00 N ATOM 531 CA PRO A 37 60.635 11.073 6.472 1.00 0.00 C ATOM 532 C PRO A 37 60.337 9.781 7.242 1.00 0.00 C ATOM 533 O PRO A 37 60.189 9.791 8.447 1.00 0.00 O ATOM 534 CB PRO A 37 60.166 12.291 7.271 1.00 0.00 C ATOM 535 CG PRO A 37 58.755 12.643 6.743 1.00 0.00 C ATOM 536 CD PRO A 37 58.622 11.980 5.358 1.00 0.00 C ATOM 0 HA PRO A 37 61.708 11.076 6.280 1.00 0.00 H new ATOM 0 HB2 PRO A 37 60.137 12.068 8.338 1.00 0.00 H new ATOM 0 HB3 PRO A 37 60.850 13.129 7.139 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.985 12.277 7.423 1.00 0.00 H new ATOM 0 HG3 PRO A 37 58.628 13.723 6.669 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.713 11.383 5.289 1.00 0.00 H new ATOM 0 HD3 PRO A 37 58.575 12.725 4.563 1.00 0.00 H new ATOM 544 N GLY A 38 60.241 8.670 6.561 1.00 0.00 N ATOM 545 CA GLY A 38 59.948 7.395 7.274 1.00 0.00 C ATOM 546 C GLY A 38 60.386 6.199 6.428 1.00 0.00 C ATOM 547 O GLY A 38 61.154 6.326 5.496 1.00 0.00 O ATOM 0 H GLY A 38 60.352 8.591 5.550 1.00 0.00 H new ATOM 0 HA2 GLY A 38 60.466 7.380 8.233 1.00 0.00 H new ATOM 0 HA3 GLY A 38 58.881 7.327 7.487 1.00 0.00 H new ATOM 551 N VAL A 39 59.905 5.033 6.761 1.00 0.00 N ATOM 552 CA VAL A 39 60.284 3.808 6.003 1.00 0.00 C ATOM 553 C VAL A 39 59.127 2.802 6.092 1.00 0.00 C ATOM 554 O VAL A 39 58.014 3.159 6.408 1.00 0.00 O ATOM 555 CB VAL A 39 61.558 3.223 6.640 1.00 0.00 C ATOM 556 CG1 VAL A 39 61.193 2.359 7.854 1.00 0.00 C ATOM 557 CG2 VAL A 39 62.321 2.373 5.615 1.00 0.00 C ATOM 0 H VAL A 39 59.259 4.876 7.534 1.00 0.00 H new ATOM 0 HA VAL A 39 60.477 4.035 4.955 1.00 0.00 H new ATOM 0 HB VAL A 39 62.193 4.047 6.965 1.00 0.00 H new ATOM 0 HG11 VAL A 39 62.102 1.951 8.296 1.00 0.00 H new ATOM 0 HG12 VAL A 39 60.673 2.970 8.592 1.00 0.00 H new ATOM 0 HG13 VAL A 39 60.545 1.542 7.537 1.00 0.00 H new ATOM 0 HG21 VAL A 39 63.220 1.965 6.078 1.00 0.00 H new ATOM 0 HG22 VAL A 39 61.685 1.556 5.275 1.00 0.00 H new ATOM 0 HG23 VAL A 39 62.601 2.994 4.764 1.00 0.00 H new ATOM 567 N ILE A 40 59.377 1.550 5.841 1.00 0.00 N ATOM 568 CA ILE A 40 58.295 0.540 5.948 1.00 0.00 C ATOM 569 C ILE A 40 58.951 -0.810 6.234 1.00 0.00 C ATOM 570 O ILE A 40 60.153 -0.953 6.129 1.00 0.00 O ATOM 571 CB ILE A 40 57.482 0.500 4.647 1.00 0.00 C ATOM 572 CG1 ILE A 40 56.426 1.611 4.685 1.00 0.00 C ATOM 573 CG2 ILE A 40 56.783 -0.855 4.502 1.00 0.00 C ATOM 574 CD1 ILE A 40 55.430 1.427 3.533 1.00 0.00 C ATOM 0 H ILE A 40 60.288 1.183 5.565 1.00 0.00 H new ATOM 0 HA ILE A 40 57.604 0.792 6.753 1.00 0.00 H new ATOM 0 HB ILE A 40 58.152 0.646 3.800 1.00 0.00 H new ATOM 0 HG12 ILE A 40 55.899 1.591 5.639 1.00 0.00 H new ATOM 0 HG13 ILE A 40 56.908 2.585 4.608 1.00 0.00 H new ATOM 0 HG21 ILE A 40 56.209 -0.871 3.575 1.00 0.00 H new ATOM 0 HG22 ILE A 40 57.529 -1.649 4.481 1.00 0.00 H new ATOM 0 HG23 ILE A 40 56.112 -1.010 5.347 1.00 0.00 H new ATOM 0 HD11 ILE A 40 54.683 2.220 3.567 1.00 0.00 H new ATOM 0 HD12 ILE A 40 55.961 1.470 2.582 1.00 0.00 H new ATOM 0 HD13 ILE A 40 54.937 0.460 3.630 1.00 0.00 H new ATOM 586 N PHE A 41 58.196 -1.795 6.620 1.00 0.00 N ATOM 587 CA PHE A 41 58.820 -3.108 6.927 1.00 0.00 C ATOM 588 C PHE A 41 57.848 -4.235 6.610 1.00 0.00 C ATOM 589 O PHE A 41 56.726 -4.019 6.200 1.00 0.00 O ATOM 590 CB PHE A 41 59.161 -3.166 8.416 1.00 0.00 C ATOM 591 CG PHE A 41 60.445 -2.415 8.675 1.00 0.00 C ATOM 592 CD1 PHE A 41 61.668 -2.978 8.298 1.00 0.00 C ATOM 593 CD2 PHE A 41 60.413 -1.159 9.291 1.00 0.00 C ATOM 594 CE1 PHE A 41 62.862 -2.285 8.536 1.00 0.00 C ATOM 595 CE2 PHE A 41 61.606 -0.466 9.529 1.00 0.00 C ATOM 596 CZ PHE A 41 62.830 -1.029 9.151 1.00 0.00 C ATOM 0 H PHE A 41 57.184 -1.750 6.736 1.00 0.00 H new ATOM 0 HA PHE A 41 59.721 -3.221 6.324 1.00 0.00 H new ATOM 0 HB2 PHE A 41 58.350 -2.732 9.001 1.00 0.00 H new ATOM 0 HB3 PHE A 41 59.265 -4.203 8.735 1.00 0.00 H new ATOM 0 HD1 PHE A 41 61.692 -3.948 7.823 1.00 0.00 H new ATOM 0 HD2 PHE A 41 59.468 -0.724 9.583 1.00 0.00 H new ATOM 0 HE1 PHE A 41 63.807 -2.720 8.245 1.00 0.00 H new ATOM 0 HE2 PHE A 41 61.582 0.503 10.004 1.00 0.00 H new ATOM 0 HZ PHE A 41 63.750 -0.494 9.334 1.00 0.00 H new ATOM 606 N LEU A 42 58.280 -5.438 6.826 1.00 0.00 N ATOM 607 CA LEU A 42 57.410 -6.611 6.579 1.00 0.00 C ATOM 608 C LEU A 42 57.618 -7.586 7.725 1.00 0.00 C ATOM 609 O LEU A 42 58.047 -8.707 7.539 1.00 0.00 O ATOM 610 CB LEU A 42 57.795 -7.272 5.263 1.00 0.00 C ATOM 611 CG LEU A 42 56.759 -6.914 4.199 1.00 0.00 C ATOM 612 CD1 LEU A 42 57.453 -6.780 2.844 1.00 0.00 C ATOM 613 CD2 LEU A 42 55.700 -8.015 4.123 1.00 0.00 C ATOM 0 H LEU A 42 59.214 -5.662 7.169 1.00 0.00 H new ATOM 0 HA LEU A 42 56.365 -6.307 6.518 1.00 0.00 H new ATOM 0 HB2 LEU A 42 58.785 -6.939 4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 42 57.847 -8.354 5.387 1.00 0.00 H new ATOM 0 HG LEU A 42 56.280 -5.970 4.460 1.00 0.00 H new ATOM 0 HD11 LEU A 42 56.717 -6.525 2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 42 58.207 -5.995 2.898 1.00 0.00 H new ATOM 0 HD13 LEU A 42 57.931 -7.725 2.585 1.00 0.00 H new ATOM 0 HD21 LEU A 42 54.962 -7.758 3.363 1.00 0.00 H new ATOM 0 HD22 LEU A 42 56.176 -8.960 3.861 1.00 0.00 H new ATOM 0 HD23 LEU A 42 55.207 -8.113 5.090 1.00 0.00 H new ATOM 625 N THR A 43 57.331 -7.146 8.913 1.00 0.00 N ATOM 626 CA THR A 43 57.514 -8.013 10.105 1.00 0.00 C ATOM 627 C THR A 43 57.053 -9.432 9.784 1.00 0.00 C ATOM 628 O THR A 43 56.372 -9.675 8.808 1.00 0.00 O ATOM 629 CB THR A 43 56.697 -7.453 11.272 1.00 0.00 C ATOM 630 OG1 THR A 43 55.315 -7.507 10.948 1.00 0.00 O ATOM 631 CG2 THR A 43 57.106 -6.001 11.537 1.00 0.00 C ATOM 0 H THR A 43 56.973 -6.212 9.112 1.00 0.00 H new ATOM 0 HA THR A 43 58.568 -8.035 10.380 1.00 0.00 H new ATOM 0 HB THR A 43 56.885 -8.048 12.166 1.00 0.00 H new ATOM 0 HG1 THR A 43 55.082 -6.743 10.380 1.00 0.00 H new ATOM 0 HG21 THR A 43 56.523 -5.605 12.368 1.00 0.00 H new ATOM 0 HG22 THR A 43 58.166 -5.961 11.786 1.00 0.00 H new ATOM 0 HG23 THR A 43 56.920 -5.402 10.645 1.00 0.00 H new ATOM 639 N LYS A 44 57.426 -10.368 10.602 1.00 0.00 N ATOM 640 CA LYS A 44 57.025 -11.777 10.357 1.00 0.00 C ATOM 641 C LYS A 44 55.549 -11.943 10.699 1.00 0.00 C ATOM 642 O LYS A 44 54.900 -12.873 10.264 1.00 0.00 O ATOM 643 CB LYS A 44 57.876 -12.705 11.223 1.00 0.00 C ATOM 644 CG LYS A 44 59.168 -13.040 10.477 1.00 0.00 C ATOM 645 CD LYS A 44 59.939 -11.752 10.173 1.00 0.00 C ATOM 646 CE LYS A 44 61.422 -12.080 9.994 1.00 0.00 C ATOM 647 NZ LYS A 44 61.584 -13.037 8.864 1.00 0.00 N ATOM 0 H LYS A 44 57.995 -10.218 11.435 1.00 0.00 H new ATOM 0 HA LYS A 44 57.180 -12.032 9.309 1.00 0.00 H new ATOM 0 HB2 LYS A 44 58.105 -12.226 12.175 1.00 0.00 H new ATOM 0 HB3 LYS A 44 57.325 -13.618 11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 44 59.783 -13.710 11.078 1.00 0.00 H new ATOM 0 HG3 LYS A 44 58.938 -13.565 9.550 1.00 0.00 H new ATOM 0 HD2 LYS A 44 59.547 -11.284 9.270 1.00 0.00 H new ATOM 0 HD3 LYS A 44 59.809 -11.036 10.985 1.00 0.00 H new ATOM 0 HE2 LYS A 44 61.986 -11.168 9.797 1.00 0.00 H new ATOM 0 HE3 LYS A 44 61.824 -12.511 10.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 62.585 -13.079 8.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 61.267 -13.982 9.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 61.013 -12.719 8.055 1.00 0.00 H new ATOM 661 N ARG A 45 55.008 -11.034 11.459 1.00 0.00 N ATOM 662 CA ARG A 45 53.568 -11.123 11.809 1.00 0.00 C ATOM 663 C ARG A 45 52.736 -10.759 10.579 1.00 0.00 C ATOM 664 O ARG A 45 51.522 -10.804 10.603 1.00 0.00 O ATOM 665 CB ARG A 45 53.256 -10.142 12.941 1.00 0.00 C ATOM 666 CG ARG A 45 53.989 -10.577 14.210 1.00 0.00 C ATOM 667 CD ARG A 45 53.033 -10.497 15.401 1.00 0.00 C ATOM 668 NE ARG A 45 52.146 -11.694 15.407 1.00 0.00 N ATOM 669 CZ ARG A 45 51.387 -11.948 14.377 1.00 0.00 C ATOM 670 NH1 ARG A 45 50.426 -11.124 14.056 1.00 0.00 N ATOM 671 NH2 ARG A 45 51.586 -13.026 13.670 1.00 0.00 N ATOM 0 H ARG A 45 55.503 -10.233 11.852 1.00 0.00 H new ATOM 0 HA ARG A 45 53.329 -12.136 12.133 1.00 0.00 H new ATOM 0 HB2 ARG A 45 53.563 -9.135 12.658 1.00 0.00 H new ATOM 0 HB3 ARG A 45 52.182 -10.109 13.122 1.00 0.00 H new ATOM 0 HG2 ARG A 45 54.362 -11.595 14.097 1.00 0.00 H new ATOM 0 HG3 ARG A 45 54.855 -9.937 14.381 1.00 0.00 H new ATOM 0 HD2 ARG A 45 53.598 -10.445 16.332 1.00 0.00 H new ATOM 0 HD3 ARG A 45 52.435 -9.588 15.340 1.00 0.00 H new ATOM 0 HE ARG A 45 52.132 -12.315 16.216 1.00 0.00 H new ATOM 0 HH11 ARG A 45 50.269 -10.282 14.611 1.00 0.00 H new ATOM 0 HH12 ARG A 45 49.832 -11.322 13.251 1.00 0.00 H new ATOM 0 HH21 ARG A 45 52.335 -13.670 13.923 1.00 0.00 H new ATOM 0 HH22 ARG A 45 50.992 -13.224 12.865 1.00 0.00 H new ATOM 685 N SER A 46 53.383 -10.388 9.503 1.00 0.00 N ATOM 686 CA SER A 46 52.639 -10.010 8.274 1.00 0.00 C ATOM 687 C SER A 46 52.090 -8.597 8.445 1.00 0.00 C ATOM 688 O SER A 46 51.005 -8.283 7.999 1.00 0.00 O ATOM 689 CB SER A 46 51.483 -10.987 8.050 1.00 0.00 C ATOM 690 OG SER A 46 51.242 -11.117 6.655 1.00 0.00 O ATOM 0 H SER A 46 54.399 -10.332 9.427 1.00 0.00 H new ATOM 0 HA SER A 46 53.306 -10.046 7.413 1.00 0.00 H new ATOM 0 HB2 SER A 46 51.724 -11.959 8.481 1.00 0.00 H new ATOM 0 HB3 SER A 46 50.586 -10.628 8.554 1.00 0.00 H new ATOM 0 HG SER A 46 50.503 -11.743 6.508 1.00 0.00 H new ATOM 696 N ARG A 47 52.828 -7.739 9.100 1.00 0.00 N ATOM 697 CA ARG A 47 52.327 -6.349 9.300 1.00 0.00 C ATOM 698 C ARG A 47 53.436 -5.336 9.004 1.00 0.00 C ATOM 699 O ARG A 47 54.405 -5.230 9.731 1.00 0.00 O ATOM 700 CB ARG A 47 51.859 -6.183 10.747 1.00 0.00 C ATOM 701 CG ARG A 47 50.701 -7.145 11.021 1.00 0.00 C ATOM 702 CD ARG A 47 49.659 -6.454 11.902 1.00 0.00 C ATOM 703 NE ARG A 47 50.239 -6.192 13.248 1.00 0.00 N ATOM 704 CZ ARG A 47 49.985 -7.002 14.240 1.00 0.00 C ATOM 705 NH1 ARG A 47 48.749 -7.265 14.566 1.00 0.00 N ATOM 706 NH2 ARG A 47 50.966 -7.548 14.905 1.00 0.00 N ATOM 0 H ARG A 47 53.745 -7.938 9.500 1.00 0.00 H new ATOM 0 HA ARG A 47 51.495 -6.170 8.618 1.00 0.00 H new ATOM 0 HB2 ARG A 47 52.683 -6.384 11.432 1.00 0.00 H new ATOM 0 HB3 ARG A 47 51.541 -5.155 10.922 1.00 0.00 H new ATOM 0 HG2 ARG A 47 50.247 -7.460 10.082 1.00 0.00 H new ATOM 0 HG3 ARG A 47 51.070 -8.044 11.514 1.00 0.00 H new ATOM 0 HD2 ARG A 47 49.343 -5.518 11.442 1.00 0.00 H new ATOM 0 HD3 ARG A 47 48.772 -7.080 11.993 1.00 0.00 H new ATOM 0 HE ARG A 47 50.836 -5.378 13.395 1.00 0.00 H new ATOM 0 HH11 ARG A 47 47.982 -6.838 14.046 1.00 0.00 H new ATOM 0 HH12 ARG A 47 48.549 -7.898 15.341 1.00 0.00 H new ATOM 0 HH21 ARG A 47 51.932 -7.342 14.650 1.00 0.00 H new ATOM 0 HH22 ARG A 47 50.767 -8.181 15.680 1.00 0.00 H new ATOM 720 N GLN A 48 53.295 -4.578 7.949 1.00 0.00 N ATOM 721 CA GLN A 48 54.331 -3.559 7.613 1.00 0.00 C ATOM 722 C GLN A 48 54.161 -2.357 8.543 1.00 0.00 C ATOM 723 O GLN A 48 53.098 -2.133 9.086 1.00 0.00 O ATOM 724 CB GLN A 48 54.153 -3.106 6.163 1.00 0.00 C ATOM 725 CG GLN A 48 52.881 -2.262 6.048 1.00 0.00 C ATOM 726 CD GLN A 48 53.216 -0.785 6.279 1.00 0.00 C ATOM 727 OE1 GLN A 48 54.156 -0.266 5.710 1.00 0.00 O ATOM 728 NE2 GLN A 48 52.478 -0.079 7.097 1.00 0.00 N ATOM 0 H GLN A 48 52.506 -4.621 7.305 1.00 0.00 H new ATOM 0 HA GLN A 48 55.325 -3.989 7.737 1.00 0.00 H new ATOM 0 HB2 GLN A 48 55.018 -2.526 5.843 1.00 0.00 H new ATOM 0 HB3 GLN A 48 54.089 -3.972 5.505 1.00 0.00 H new ATOM 0 HG2 GLN A 48 52.434 -2.393 5.062 1.00 0.00 H new ATOM 0 HG3 GLN A 48 52.145 -2.596 6.779 1.00 0.00 H new ATOM 0 HE21 GLN A 48 51.689 -0.513 7.575 1.00 0.00 H new ATOM 0 HE22 GLN A 48 52.692 0.905 7.256 1.00 0.00 H new ATOM 737 N VAL A 49 55.192 -1.580 8.740 1.00 0.00 N ATOM 738 CA VAL A 49 55.053 -0.404 9.648 1.00 0.00 C ATOM 739 C VAL A 49 56.083 0.674 9.298 1.00 0.00 C ATOM 740 O VAL A 49 57.209 0.384 8.943 1.00 0.00 O ATOM 741 CB VAL A 49 55.266 -0.847 11.097 1.00 0.00 C ATOM 742 CG1 VAL A 49 54.417 0.024 12.019 1.00 0.00 C ATOM 743 CG2 VAL A 49 54.849 -2.314 11.261 1.00 0.00 C ATOM 0 H VAL A 49 56.112 -1.705 8.318 1.00 0.00 H new ATOM 0 HA VAL A 49 54.052 0.009 9.526 1.00 0.00 H new ATOM 0 HB VAL A 49 56.320 -0.742 11.354 1.00 0.00 H new ATOM 0 HG11 VAL A 49 54.565 -0.288 13.053 1.00 0.00 H new ATOM 0 HG12 VAL A 49 54.713 1.067 11.909 1.00 0.00 H new ATOM 0 HG13 VAL A 49 53.365 -0.084 11.755 1.00 0.00 H new ATOM 0 HG21 VAL A 49 55.003 -2.623 12.295 1.00 0.00 H new ATOM 0 HG22 VAL A 49 53.796 -2.424 11.003 1.00 0.00 H new ATOM 0 HG23 VAL A 49 55.451 -2.939 10.602 1.00 0.00 H new ATOM 753 N CYS A 50 55.705 1.922 9.415 1.00 0.00 N ATOM 754 CA CYS A 50 56.652 3.031 9.115 1.00 0.00 C ATOM 755 C CYS A 50 57.517 3.279 10.344 1.00 0.00 C ATOM 756 O CYS A 50 57.291 2.719 11.398 1.00 0.00 O ATOM 757 CB CYS A 50 55.873 4.308 8.774 1.00 0.00 C ATOM 758 SG CYS A 50 56.813 5.291 7.573 1.00 0.00 S ATOM 0 H CYS A 50 54.774 2.219 9.708 1.00 0.00 H new ATOM 0 HA CYS A 50 57.276 2.760 8.263 1.00 0.00 H new ATOM 0 HB2 CYS A 50 54.896 4.052 8.364 1.00 0.00 H new ATOM 0 HB3 CYS A 50 55.697 4.891 9.678 1.00 0.00 H new ATOM 763 N ALA A 51 58.507 4.111 10.225 1.00 0.00 N ATOM 764 CA ALA A 51 59.377 4.381 11.396 1.00 0.00 C ATOM 765 C ALA A 51 60.003 5.765 11.267 1.00 0.00 C ATOM 766 O ALA A 51 60.211 6.264 10.179 1.00 0.00 O ATOM 767 CB ALA A 51 60.486 3.332 11.457 1.00 0.00 C ATOM 0 H ALA A 51 58.751 4.614 9.372 1.00 0.00 H new ATOM 0 HA ALA A 51 58.777 4.338 12.305 1.00 0.00 H new ATOM 0 HB1 ALA A 51 61.126 3.529 12.317 1.00 0.00 H new ATOM 0 HB2 ALA A 51 60.044 2.340 11.553 1.00 0.00 H new ATOM 0 HB3 ALA A 51 61.080 3.377 10.544 1.00 0.00 H new ATOM 773 N ASP A 52 60.311 6.377 12.375 1.00 0.00 N ATOM 774 CA ASP A 52 60.942 7.722 12.339 1.00 0.00 C ATOM 775 C ASP A 52 61.994 7.745 11.224 1.00 0.00 C ATOM 776 O ASP A 52 62.469 6.708 10.806 1.00 0.00 O ATOM 777 CB ASP A 52 61.605 7.983 13.694 1.00 0.00 C ATOM 778 CG ASP A 52 61.180 9.355 14.221 1.00 0.00 C ATOM 779 OD1 ASP A 52 60.090 9.786 13.883 1.00 0.00 O ATOM 780 OD2 ASP A 52 61.953 9.951 14.951 1.00 0.00 O ATOM 0 H ASP A 52 60.151 6.000 13.309 1.00 0.00 H new ATOM 0 HA ASP A 52 60.197 8.494 12.144 1.00 0.00 H new ATOM 0 HB2 ASP A 52 61.321 7.206 14.404 1.00 0.00 H new ATOM 0 HB3 ASP A 52 62.690 7.942 13.593 1.00 0.00 H new ATOM 785 N PRO A 53 62.318 8.922 10.763 1.00 0.00 N ATOM 786 CA PRO A 53 63.304 9.098 9.685 1.00 0.00 C ATOM 787 C PRO A 53 64.727 8.924 10.223 1.00 0.00 C ATOM 788 O PRO A 53 65.188 9.691 11.043 1.00 0.00 O ATOM 789 CB PRO A 53 63.060 10.534 9.207 1.00 0.00 C ATOM 790 CG PRO A 53 62.364 11.270 10.376 1.00 0.00 C ATOM 791 CD PRO A 53 61.739 10.183 11.270 1.00 0.00 C ATOM 0 HA PRO A 53 63.200 8.367 8.883 1.00 0.00 H new ATOM 0 HB2 PRO A 53 63.999 11.021 8.945 1.00 0.00 H new ATOM 0 HB3 PRO A 53 62.435 10.545 8.314 1.00 0.00 H new ATOM 0 HG2 PRO A 53 63.080 11.869 10.938 1.00 0.00 H new ATOM 0 HG3 PRO A 53 61.600 11.953 10.004 1.00 0.00 H new ATOM 0 HD2 PRO A 53 61.985 10.341 12.320 1.00 0.00 H new ATOM 0 HD3 PRO A 53 60.652 10.181 11.194 1.00 0.00 H new ATOM 799 N SER A 54 65.418 7.913 9.761 1.00 0.00 N ATOM 800 CA SER A 54 66.814 7.668 10.229 1.00 0.00 C ATOM 801 C SER A 54 66.799 6.924 11.569 1.00 0.00 C ATOM 802 O SER A 54 67.697 7.066 12.374 1.00 0.00 O ATOM 803 CB SER A 54 67.546 9.001 10.396 1.00 0.00 C ATOM 804 OG SER A 54 68.924 8.826 10.085 1.00 0.00 O ATOM 0 H SER A 54 65.072 7.243 9.075 1.00 0.00 H new ATOM 0 HA SER A 54 67.331 7.059 9.487 1.00 0.00 H new ATOM 0 HB2 SER A 54 67.107 9.754 9.742 1.00 0.00 H new ATOM 0 HB3 SER A 54 67.436 9.364 11.418 1.00 0.00 H new ATOM 0 HG SER A 54 69.394 9.679 10.190 1.00 0.00 H new ATOM 810 N GLU A 55 65.794 6.125 11.812 1.00 0.00 N ATOM 811 CA GLU A 55 65.740 5.371 13.099 1.00 0.00 C ATOM 812 C GLU A 55 67.046 4.633 13.313 1.00 0.00 C ATOM 813 O GLU A 55 67.711 4.208 12.392 1.00 0.00 O ATOM 814 CB GLU A 55 64.584 4.369 13.078 1.00 0.00 C ATOM 815 CG GLU A 55 63.258 5.124 13.177 1.00 0.00 C ATOM 816 CD GLU A 55 62.990 5.493 14.636 1.00 0.00 C ATOM 817 OE1 GLU A 55 63.897 6.002 15.274 1.00 0.00 O ATOM 818 OE2 GLU A 55 61.882 5.262 15.091 1.00 0.00 O ATOM 0 H GLU A 55 65.011 5.962 11.178 1.00 0.00 H new ATOM 0 HA GLU A 55 65.582 6.077 13.914 1.00 0.00 H new ATOM 0 HB2 GLU A 55 64.613 3.782 12.160 1.00 0.00 H new ATOM 0 HB3 GLU A 55 64.680 3.669 13.908 1.00 0.00 H new ATOM 0 HG2 GLU A 55 63.293 6.024 12.564 1.00 0.00 H new ATOM 0 HG3 GLU A 55 62.446 4.507 12.792 1.00 0.00 H new ATOM 825 N GLU A 56 67.408 4.502 14.543 1.00 0.00 N ATOM 826 CA GLU A 56 68.667 3.817 14.902 1.00 0.00 C ATOM 827 C GLU A 56 68.554 2.323 14.601 1.00 0.00 C ATOM 828 O GLU A 56 69.529 1.656 14.315 1.00 0.00 O ATOM 829 CB GLU A 56 68.880 4.047 16.387 1.00 0.00 C ATOM 830 CG GLU A 56 70.327 4.473 16.645 1.00 0.00 C ATOM 831 CD GLU A 56 70.401 5.261 17.954 1.00 0.00 C ATOM 832 OE1 GLU A 56 69.447 5.960 18.257 1.00 0.00 O ATOM 833 OE2 GLU A 56 71.410 5.153 18.632 1.00 0.00 O ATOM 0 H GLU A 56 66.872 4.849 15.338 1.00 0.00 H new ATOM 0 HA GLU A 56 69.507 4.205 14.326 1.00 0.00 H new ATOM 0 HB2 GLU A 56 68.196 4.815 16.747 1.00 0.00 H new ATOM 0 HB3 GLU A 56 68.656 3.136 16.941 1.00 0.00 H new ATOM 0 HG2 GLU A 56 70.971 3.596 16.699 1.00 0.00 H new ATOM 0 HG3 GLU A 56 70.690 5.084 15.819 1.00 0.00 H new ATOM 840 N TRP A 57 67.370 1.797 14.673 1.00 0.00 N ATOM 841 CA TRP A 57 67.161 0.355 14.408 1.00 0.00 C ATOM 842 C TRP A 57 66.801 0.129 12.941 1.00 0.00 C ATOM 843 O TRP A 57 66.997 -0.944 12.416 1.00 0.00 O ATOM 844 CB TRP A 57 66.039 -0.129 15.314 1.00 0.00 C ATOM 845 CG TRP A 57 64.842 0.771 15.226 1.00 0.00 C ATOM 846 CD1 TRP A 57 64.659 1.887 15.967 1.00 0.00 C ATOM 847 CD2 TRP A 57 63.654 0.642 14.395 1.00 0.00 C ATOM 848 NE1 TRP A 57 63.437 2.441 15.654 1.00 0.00 N ATOM 849 CE2 TRP A 57 62.776 1.709 14.692 1.00 0.00 C ATOM 850 CE3 TRP A 57 63.253 -0.290 13.428 1.00 0.00 C ATOM 851 CZ2 TRP A 57 61.546 1.846 14.056 1.00 0.00 C ATOM 852 CZ3 TRP A 57 62.013 -0.158 12.780 1.00 0.00 C ATOM 853 CH2 TRP A 57 61.159 0.906 13.098 1.00 0.00 C ATOM 0 H TRP A 57 66.524 2.315 14.909 1.00 0.00 H new ATOM 0 HA TRP A 57 68.075 -0.203 14.612 1.00 0.00 H new ATOM 0 HB2 TRP A 57 65.755 -1.144 15.035 1.00 0.00 H new ATOM 0 HB3 TRP A 57 66.392 -0.169 16.344 1.00 0.00 H new ATOM 0 HD1 TRP A 57 65.359 2.281 16.689 1.00 0.00 H new ATOM 0 HE1 TRP A 57 63.067 3.290 16.082 1.00 0.00 H new ATOM 0 HE3 TRP A 57 63.902 -1.116 13.179 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 60.896 2.673 14.301 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 61.717 -0.880 12.033 1.00 0.00 H new ATOM 0 HH2 TRP A 57 60.203 0.999 12.603 1.00 0.00 H new ATOM 864 N VAL A 58 66.287 1.119 12.266 1.00 0.00 N ATOM 865 CA VAL A 58 65.937 0.913 10.833 1.00 0.00 C ATOM 866 C VAL A 58 67.181 1.090 9.963 1.00 0.00 C ATOM 867 O VAL A 58 67.424 0.322 9.062 1.00 0.00 O ATOM 868 CB VAL A 58 64.879 1.918 10.394 1.00 0.00 C ATOM 869 CG1 VAL A 58 64.669 1.778 8.886 1.00 0.00 C ATOM 870 CG2 VAL A 58 63.567 1.628 11.123 1.00 0.00 C ATOM 0 H VAL A 58 66.096 2.049 12.638 1.00 0.00 H new ATOM 0 HA VAL A 58 65.545 -0.097 10.717 1.00 0.00 H new ATOM 0 HB VAL A 58 65.203 2.931 10.632 1.00 0.00 H new ATOM 0 HG11 VAL A 58 63.914 2.491 8.556 1.00 0.00 H new ATOM 0 HG12 VAL A 58 65.607 1.977 8.368 1.00 0.00 H new ATOM 0 HG13 VAL A 58 64.336 0.766 8.657 1.00 0.00 H new ATOM 0 HG21 VAL A 58 62.810 2.347 10.809 1.00 0.00 H new ATOM 0 HG22 VAL A 58 63.232 0.619 10.882 1.00 0.00 H new ATOM 0 HG23 VAL A 58 63.722 1.711 12.199 1.00 0.00 H new ATOM 880 N GLN A 59 67.965 2.098 10.220 1.00 0.00 N ATOM 881 CA GLN A 59 69.189 2.317 9.399 1.00 0.00 C ATOM 882 C GLN A 59 69.906 0.983 9.192 1.00 0.00 C ATOM 883 O GLN A 59 70.413 0.693 8.126 1.00 0.00 O ATOM 884 CB GLN A 59 70.123 3.280 10.130 1.00 0.00 C ATOM 885 CG GLN A 59 69.523 4.688 10.120 1.00 0.00 C ATOM 886 CD GLN A 59 70.580 5.688 9.651 1.00 0.00 C ATOM 887 OE1 GLN A 59 71.610 5.839 10.278 1.00 0.00 O ATOM 888 NE2 GLN A 59 70.368 6.383 8.567 1.00 0.00 N ATOM 0 H GLN A 59 67.812 2.780 10.963 1.00 0.00 H new ATOM 0 HA GLN A 59 68.909 2.738 8.433 1.00 0.00 H new ATOM 0 HB2 GLN A 59 70.274 2.946 11.156 1.00 0.00 H new ATOM 0 HB3 GLN A 59 71.101 3.288 9.650 1.00 0.00 H new ATOM 0 HG2 GLN A 59 68.657 4.721 9.459 1.00 0.00 H new ATOM 0 HG3 GLN A 59 69.173 4.953 11.118 1.00 0.00 H new ATOM 0 HE21 GLN A 59 69.503 6.256 8.041 1.00 0.00 H new ATOM 0 HE22 GLN A 59 71.067 7.053 8.246 1.00 0.00 H new ATOM 897 N LYS A 60 69.957 0.173 10.211 1.00 0.00 N ATOM 898 CA LYS A 60 70.647 -1.142 10.091 1.00 0.00 C ATOM 899 C LYS A 60 69.738 -2.138 9.365 1.00 0.00 C ATOM 900 O LYS A 60 70.171 -2.869 8.496 1.00 0.00 O ATOM 901 CB LYS A 60 70.973 -1.665 11.501 1.00 0.00 C ATOM 902 CG LYS A 60 71.124 -3.194 11.485 1.00 0.00 C ATOM 903 CD LYS A 60 72.347 -3.597 12.308 1.00 0.00 C ATOM 904 CE LYS A 60 73.183 -4.603 11.515 1.00 0.00 C ATOM 905 NZ LYS A 60 74.495 -4.806 12.190 1.00 0.00 N ATOM 0 H LYS A 60 69.549 0.365 11.126 1.00 0.00 H new ATOM 0 HA LYS A 60 71.568 -1.025 9.521 1.00 0.00 H new ATOM 0 HB2 LYS A 60 71.894 -1.206 11.862 1.00 0.00 H new ATOM 0 HB3 LYS A 60 70.182 -1.379 12.194 1.00 0.00 H new ATOM 0 HG2 LYS A 60 70.228 -3.662 11.893 1.00 0.00 H new ATOM 0 HG3 LYS A 60 71.230 -3.548 10.460 1.00 0.00 H new ATOM 0 HD2 LYS A 60 72.945 -2.717 12.546 1.00 0.00 H new ATOM 0 HD3 LYS A 60 72.033 -4.035 13.256 1.00 0.00 H new ATOM 0 HE2 LYS A 60 72.652 -5.552 11.438 1.00 0.00 H new ATOM 0 HE3 LYS A 60 73.338 -4.241 10.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 75.061 -5.490 11.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 75.003 -3.900 12.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 74.338 -5.170 13.152 1.00 0.00 H new ATOM 919 N TYR A 61 68.494 -2.202 9.744 1.00 0.00 N ATOM 920 CA TYR A 61 67.574 -3.190 9.105 1.00 0.00 C ATOM 921 C TYR A 61 67.423 -2.890 7.613 1.00 0.00 C ATOM 922 O TYR A 61 66.974 -3.719 6.847 1.00 0.00 O ATOM 923 CB TYR A 61 66.207 -3.145 9.799 1.00 0.00 C ATOM 924 CG TYR A 61 66.379 -3.127 11.292 1.00 0.00 C ATOM 925 CD1 TYR A 61 67.622 -3.389 11.877 1.00 0.00 C ATOM 926 CD2 TYR A 61 65.283 -2.832 12.094 1.00 0.00 C ATOM 927 CE1 TYR A 61 67.763 -3.351 13.255 1.00 0.00 C ATOM 928 CE2 TYR A 61 65.426 -2.794 13.476 1.00 0.00 C ATOM 929 CZ TYR A 61 66.668 -3.051 14.063 1.00 0.00 C ATOM 930 OH TYR A 61 66.807 -3.015 15.435 1.00 0.00 O ATOM 0 H TYR A 61 68.073 -1.617 10.465 1.00 0.00 H new ATOM 0 HA TYR A 61 67.995 -4.189 9.212 1.00 0.00 H new ATOM 0 HB2 TYR A 61 65.658 -2.259 9.479 1.00 0.00 H new ATOM 0 HB3 TYR A 61 65.614 -4.011 9.505 1.00 0.00 H new ATOM 0 HD1 TYR A 61 68.473 -3.621 11.254 1.00 0.00 H new ATOM 0 HD2 TYR A 61 64.322 -2.633 11.644 1.00 0.00 H new ATOM 0 HE1 TYR A 61 68.724 -3.554 13.704 1.00 0.00 H new ATOM 0 HE2 TYR A 61 64.574 -2.565 14.099 1.00 0.00 H new ATOM 0 HH TYR A 61 67.721 -2.746 15.664 1.00 0.00 H new ATOM 940 N VAL A 62 67.805 -1.720 7.192 1.00 0.00 N ATOM 941 CA VAL A 62 67.698 -1.370 5.752 1.00 0.00 C ATOM 942 C VAL A 62 69.083 -1.480 5.108 1.00 0.00 C ATOM 943 O VAL A 62 69.216 -1.783 3.938 1.00 0.00 O ATOM 944 CB VAL A 62 67.179 0.061 5.633 1.00 0.00 C ATOM 945 CG1 VAL A 62 66.915 0.397 4.163 1.00 0.00 C ATOM 946 CG2 VAL A 62 65.876 0.193 6.421 1.00 0.00 C ATOM 0 H VAL A 62 68.189 -0.986 7.787 1.00 0.00 H new ATOM 0 HA VAL A 62 67.012 -2.049 5.245 1.00 0.00 H new ATOM 0 HB VAL A 62 67.925 0.748 6.032 1.00 0.00 H new ATOM 0 HG11 VAL A 62 66.545 1.419 4.084 1.00 0.00 H new ATOM 0 HG12 VAL A 62 67.841 0.302 3.596 1.00 0.00 H new ATOM 0 HG13 VAL A 62 66.171 -0.290 3.761 1.00 0.00 H new ATOM 0 HG21 VAL A 62 65.503 1.214 6.338 1.00 0.00 H new ATOM 0 HG22 VAL A 62 65.136 -0.498 6.018 1.00 0.00 H new ATOM 0 HG23 VAL A 62 66.059 -0.042 7.469 1.00 0.00 H new ATOM 956 N SER A 63 70.114 -1.227 5.870 1.00 0.00 N ATOM 957 CA SER A 63 71.501 -1.303 5.322 1.00 0.00 C ATOM 958 C SER A 63 71.658 -2.557 4.460 1.00 0.00 C ATOM 959 O SER A 63 72.076 -2.483 3.321 1.00 0.00 O ATOM 960 CB SER A 63 72.501 -1.358 6.477 1.00 0.00 C ATOM 961 OG SER A 63 73.800 -1.060 5.987 1.00 0.00 O ATOM 0 H SER A 63 70.055 -0.969 6.855 1.00 0.00 H new ATOM 0 HA SER A 63 71.690 -0.421 4.710 1.00 0.00 H new ATOM 0 HB2 SER A 63 72.219 -0.645 7.251 1.00 0.00 H new ATOM 0 HB3 SER A 63 72.491 -2.347 6.936 1.00 0.00 H new ATOM 0 HG SER A 63 74.444 -1.093 6.725 1.00 0.00 H new ATOM 1107 N ASP B 5 46.643 0.441 11.853 1.00 0.00 N ATOM 1108 CA ASP B 5 47.758 -0.412 11.359 1.00 0.00 C ATOM 1109 C ASP B 5 47.737 -0.453 9.830 1.00 0.00 C ATOM 1110 O ASP B 5 46.789 -0.027 9.200 1.00 0.00 O ATOM 1111 CB ASP B 5 47.593 -1.831 11.907 1.00 0.00 C ATOM 1112 CG ASP B 5 48.531 -2.032 13.099 1.00 0.00 C ATOM 1113 OD1 ASP B 5 49.729 -1.894 12.915 1.00 0.00 O ATOM 1114 OD2 ASP B 5 48.034 -2.319 14.175 1.00 0.00 O ATOM 0 HA ASP B 5 48.708 0.004 11.696 1.00 0.00 H new ATOM 0 HB2 ASP B 5 46.560 -1.996 12.212 1.00 0.00 H new ATOM 0 HB3 ASP B 5 47.816 -2.561 11.129 1.00 0.00 H new ATOM 1119 N THR B 6 48.775 -0.967 9.228 1.00 0.00 N ATOM 1120 CA THR B 6 48.816 -1.043 7.740 1.00 0.00 C ATOM 1121 C THR B 6 48.939 0.370 7.153 1.00 0.00 C ATOM 1122 O THR B 6 48.477 1.326 7.742 1.00 0.00 O ATOM 1123 CB THR B 6 47.533 -1.704 7.222 1.00 0.00 C ATOM 1124 OG1 THR B 6 46.556 -0.704 6.971 1.00 0.00 O ATOM 1125 CG2 THR B 6 47.001 -2.690 8.266 1.00 0.00 C ATOM 0 H THR B 6 49.598 -1.338 9.703 1.00 0.00 H new ATOM 0 HA THR B 6 49.677 -1.637 7.434 1.00 0.00 H new ATOM 0 HB THR B 6 47.750 -2.242 6.299 1.00 0.00 H new ATOM 0 HG1 THR B 6 46.226 -0.348 7.822 1.00 0.00 H new ATOM 0 HG21 THR B 6 46.089 -3.157 7.894 1.00 0.00 H new ATOM 0 HG22 THR B 6 47.751 -3.458 8.456 1.00 0.00 H new ATOM 0 HG23 THR B 6 46.784 -2.157 9.192 1.00 0.00 H new ATOM 1133 N PRO B 7 49.561 0.449 6.003 1.00 0.00 N ATOM 1134 CA PRO B 7 49.771 1.724 5.294 1.00 0.00 C ATOM 1135 C PRO B 7 48.494 2.126 4.545 1.00 0.00 C ATOM 1136 O PRO B 7 47.518 1.404 4.536 1.00 0.00 O ATOM 1137 CB PRO B 7 50.900 1.401 4.306 1.00 0.00 C ATOM 1138 CG PRO B 7 50.873 -0.133 4.103 1.00 0.00 C ATOM 1139 CD PRO B 7 50.118 -0.727 5.307 1.00 0.00 C ATOM 0 HA PRO B 7 50.015 2.553 5.958 1.00 0.00 H new ATOM 0 HB2 PRO B 7 50.750 1.921 3.360 1.00 0.00 H new ATOM 0 HB3 PRO B 7 51.864 1.725 4.698 1.00 0.00 H new ATOM 0 HG2 PRO B 7 50.375 -0.391 3.169 1.00 0.00 H new ATOM 0 HG3 PRO B 7 51.885 -0.533 4.045 1.00 0.00 H new ATOM 0 HD2 PRO B 7 49.331 -1.409 4.986 1.00 0.00 H new ATOM 0 HD3 PRO B 7 50.786 -1.294 5.955 1.00 0.00 H new ATOM 1147 N THR B 8 48.496 3.267 3.910 1.00 0.00 N ATOM 1148 CA THR B 8 47.283 3.699 3.157 1.00 0.00 C ATOM 1149 C THR B 8 47.361 3.151 1.732 1.00 0.00 C ATOM 1150 O THR B 8 48.017 3.713 0.876 1.00 0.00 O ATOM 1151 CB THR B 8 47.220 5.229 3.115 1.00 0.00 C ATOM 1152 OG1 THR B 8 47.163 5.736 4.442 1.00 0.00 O ATOM 1153 CG2 THR B 8 45.973 5.672 2.344 1.00 0.00 C ATOM 0 H THR B 8 49.282 3.917 3.880 1.00 0.00 H new ATOM 0 HA THR B 8 46.389 3.318 3.651 1.00 0.00 H new ATOM 0 HB THR B 8 48.109 5.615 2.615 1.00 0.00 H new ATOM 0 HG1 THR B 8 47.429 6.679 4.444 1.00 0.00 H new ATOM 0 HG21 THR B 8 45.930 6.761 2.316 1.00 0.00 H new ATOM 0 HG22 THR B 8 46.017 5.284 1.326 1.00 0.00 H new ATOM 0 HG23 THR B 8 45.082 5.287 2.841 1.00 0.00 H new ATOM 1161 N ALA B 9 46.705 2.054 1.471 1.00 0.00 N ATOM 1162 CA ALA B 9 46.748 1.466 0.102 1.00 0.00 C ATOM 1163 C ALA B 9 46.605 2.577 -0.941 1.00 0.00 C ATOM 1164 O ALA B 9 45.923 3.560 -0.727 1.00 0.00 O ATOM 1165 CB ALA B 9 45.603 0.463 -0.061 1.00 0.00 C ATOM 0 H ALA B 9 46.141 1.539 2.147 1.00 0.00 H new ATOM 0 HA ALA B 9 47.701 0.957 -0.041 1.00 0.00 H new ATOM 0 HB1 ALA B 9 45.635 0.034 -1.062 1.00 0.00 H new ATOM 0 HB2 ALA B 9 45.707 -0.331 0.678 1.00 0.00 H new ATOM 0 HB3 ALA B 9 44.650 0.972 0.085 1.00 0.00 H new ATOM 1171 N CYS B 10 47.244 2.426 -2.067 1.00 0.00 N ATOM 1172 CA CYS B 10 47.150 3.469 -3.128 1.00 0.00 C ATOM 1173 C CYS B 10 47.176 2.795 -4.499 1.00 0.00 C ATOM 1174 O CYS B 10 47.539 1.643 -4.626 1.00 0.00 O ATOM 1175 CB CYS B 10 48.336 4.427 -3.007 1.00 0.00 C ATOM 1176 SG CYS B 10 48.297 5.233 -1.388 1.00 0.00 S ATOM 0 H CYS B 10 47.829 1.623 -2.300 1.00 0.00 H new ATOM 0 HA CYS B 10 46.221 4.027 -3.012 1.00 0.00 H new ATOM 0 HB2 CYS B 10 49.272 3.882 -3.131 1.00 0.00 H new ATOM 0 HB3 CYS B 10 48.295 5.175 -3.799 1.00 0.00 H new ATOM 1181 N CYS B 11 46.796 3.500 -5.528 1.00 0.00 N ATOM 1182 CA CYS B 11 46.805 2.887 -6.883 1.00 0.00 C ATOM 1183 C CYS B 11 47.691 3.710 -7.817 1.00 0.00 C ATOM 1184 O CYS B 11 47.212 4.491 -8.615 1.00 0.00 O ATOM 1185 CB CYS B 11 45.384 2.837 -7.444 1.00 0.00 C ATOM 1186 SG CYS B 11 45.240 1.390 -8.522 1.00 0.00 S ATOM 0 H CYS B 11 46.481 4.469 -5.489 1.00 0.00 H new ATOM 0 HA CYS B 11 47.198 1.873 -6.809 1.00 0.00 H new ATOM 0 HB2 CYS B 11 44.659 2.778 -6.633 1.00 0.00 H new ATOM 0 HB3 CYS B 11 45.165 3.748 -8.002 1.00 0.00 H new ATOM 1191 N PHE B 12 48.982 3.543 -7.728 1.00 0.00 N ATOM 1192 CA PHE B 12 49.893 4.316 -8.615 1.00 0.00 C ATOM 1193 C PHE B 12 50.184 3.511 -9.885 1.00 0.00 C ATOM 1194 O PHE B 12 50.374 4.068 -10.948 1.00 0.00 O ATOM 1195 CB PHE B 12 51.203 4.607 -7.879 1.00 0.00 C ATOM 1196 CG PHE B 12 51.095 5.932 -7.160 1.00 0.00 C ATOM 1197 CD1 PHE B 12 50.623 7.062 -7.839 1.00 0.00 C ATOM 1198 CD2 PHE B 12 51.468 6.029 -5.813 1.00 0.00 C ATOM 1199 CE1 PHE B 12 50.524 8.289 -7.171 1.00 0.00 C ATOM 1200 CE2 PHE B 12 51.368 7.256 -5.147 1.00 0.00 C ATOM 1201 CZ PHE B 12 50.897 8.386 -5.826 1.00 0.00 C ATOM 0 H PHE B 12 49.444 2.905 -7.080 1.00 0.00 H new ATOM 0 HA PHE B 12 49.416 5.257 -8.888 1.00 0.00 H new ATOM 0 HB2 PHE B 12 51.416 3.811 -7.166 1.00 0.00 H new ATOM 0 HB3 PHE B 12 52.032 4.632 -8.586 1.00 0.00 H new ATOM 0 HD1 PHE B 12 50.335 6.987 -8.877 1.00 0.00 H new ATOM 0 HD2 PHE B 12 51.832 5.158 -5.289 1.00 0.00 H new ATOM 0 HE1 PHE B 12 50.160 9.161 -7.694 1.00 0.00 H new ATOM 0 HE2 PHE B 12 51.654 7.331 -4.108 1.00 0.00 H new ATOM 0 HZ PHE B 12 50.822 9.333 -5.312 1.00 0.00 H new ATOM 1211 N SER B 13 50.223 2.207 -9.791 1.00 0.00 N ATOM 1212 CA SER B 13 50.508 1.392 -11.008 1.00 0.00 C ATOM 1213 C SER B 13 49.698 0.090 -10.977 1.00 0.00 C ATOM 1214 O SER B 13 49.859 -0.731 -10.096 1.00 0.00 O ATOM 1215 CB SER B 13 52.001 1.062 -11.055 1.00 0.00 C ATOM 1216 OG SER B 13 52.737 2.258 -11.277 1.00 0.00 O ATOM 0 H SER B 13 50.071 1.676 -8.933 1.00 0.00 H new ATOM 0 HA SER B 13 50.226 1.962 -11.893 1.00 0.00 H new ATOM 0 HB2 SER B 13 52.313 0.597 -10.120 1.00 0.00 H new ATOM 0 HB3 SER B 13 52.202 0.344 -11.850 1.00 0.00 H new ATOM 0 HG SER B 13 53.695 2.052 -11.306 1.00 0.00 H new ATOM 1222 N TYR B 14 48.837 -0.110 -11.942 1.00 0.00 N ATOM 1223 CA TYR B 14 48.029 -1.367 -11.974 1.00 0.00 C ATOM 1224 C TYR B 14 48.638 -2.311 -13.010 1.00 0.00 C ATOM 1225 O TYR B 14 49.390 -1.900 -13.870 1.00 0.00 O ATOM 1226 CB TYR B 14 46.567 -1.071 -12.349 1.00 0.00 C ATOM 1227 CG TYR B 14 46.299 0.416 -12.296 1.00 0.00 C ATOM 1228 CD1 TYR B 14 46.631 1.148 -11.148 1.00 0.00 C ATOM 1229 CD2 TYR B 14 45.721 1.062 -13.394 1.00 0.00 C ATOM 1230 CE1 TYR B 14 46.384 2.525 -11.101 1.00 0.00 C ATOM 1231 CE2 TYR B 14 45.475 2.438 -13.347 1.00 0.00 C ATOM 1232 CZ TYR B 14 45.806 3.170 -12.201 1.00 0.00 C ATOM 1233 OH TYR B 14 45.563 4.528 -12.155 1.00 0.00 O ATOM 0 H TYR B 14 48.659 0.540 -12.707 1.00 0.00 H new ATOM 0 HA TYR B 14 48.042 -1.824 -10.984 1.00 0.00 H new ATOM 0 HB2 TYR B 14 46.358 -1.449 -13.350 1.00 0.00 H new ATOM 0 HB3 TYR B 14 45.897 -1.592 -11.665 1.00 0.00 H new ATOM 0 HD1 TYR B 14 47.077 0.650 -10.300 1.00 0.00 H new ATOM 0 HD2 TYR B 14 45.465 0.498 -14.279 1.00 0.00 H new ATOM 0 HE1 TYR B 14 46.639 3.090 -10.216 1.00 0.00 H new ATOM 0 HE2 TYR B 14 45.029 2.936 -14.195 1.00 0.00 H new ATOM 0 HH TYR B 14 45.160 4.817 -13.000 1.00 0.00 H new ATOM 1243 N THR B 15 48.332 -3.576 -12.932 1.00 0.00 N ATOM 1244 CA THR B 15 48.913 -4.536 -13.910 1.00 0.00 C ATOM 1245 C THR B 15 47.890 -4.875 -14.993 1.00 0.00 C ATOM 1246 O THR B 15 46.726 -5.084 -14.719 1.00 0.00 O ATOM 1247 CB THR B 15 49.325 -5.812 -13.177 1.00 0.00 C ATOM 1248 OG1 THR B 15 48.254 -6.246 -12.349 1.00 0.00 O ATOM 1249 CG2 THR B 15 50.550 -5.523 -12.315 1.00 0.00 C ATOM 0 H THR B 15 47.708 -3.985 -12.237 1.00 0.00 H new ATOM 0 HA THR B 15 49.784 -4.082 -14.382 1.00 0.00 H new ATOM 0 HB THR B 15 49.563 -6.591 -13.901 1.00 0.00 H new ATOM 0 HG1 THR B 15 47.816 -7.021 -12.760 1.00 0.00 H new ATOM 0 HG21 THR B 15 50.848 -6.431 -11.790 1.00 0.00 H new ATOM 0 HG22 THR B 15 51.370 -5.185 -12.949 1.00 0.00 H new ATOM 0 HG23 THR B 15 50.309 -4.746 -11.589 1.00 0.00 H new ATOM 1257 N SER B 16 48.324 -4.950 -16.224 1.00 0.00 N ATOM 1258 CA SER B 16 47.382 -5.298 -17.321 1.00 0.00 C ATOM 1259 C SER B 16 46.932 -6.746 -17.128 1.00 0.00 C ATOM 1260 O SER B 16 45.793 -7.095 -17.369 1.00 0.00 O ATOM 1261 CB SER B 16 48.091 -5.155 -18.669 1.00 0.00 C ATOM 1262 OG SER B 16 49.084 -4.142 -18.569 1.00 0.00 O ATOM 0 H SER B 16 49.288 -4.785 -16.514 1.00 0.00 H new ATOM 0 HA SER B 16 46.519 -4.632 -17.302 1.00 0.00 H new ATOM 0 HB2 SER B 16 48.548 -6.102 -18.955 1.00 0.00 H new ATOM 0 HB3 SER B 16 47.371 -4.900 -19.447 1.00 0.00 H new ATOM 0 HG SER B 16 49.543 -4.047 -19.430 1.00 0.00 H new ATOM 1268 N ARG B 17 47.821 -7.586 -16.674 1.00 0.00 N ATOM 1269 CA ARG B 17 47.456 -9.009 -16.438 1.00 0.00 C ATOM 1270 C ARG B 17 46.899 -9.138 -15.020 1.00 0.00 C ATOM 1271 O ARG B 17 47.394 -8.528 -14.096 1.00 0.00 O ATOM 1272 CB ARG B 17 48.700 -9.886 -16.582 1.00 0.00 C ATOM 1273 CG ARG B 17 48.281 -11.353 -16.705 1.00 0.00 C ATOM 1274 CD ARG B 17 48.983 -11.982 -17.909 1.00 0.00 C ATOM 1275 NE ARG B 17 50.368 -11.446 -18.013 1.00 0.00 N ATOM 1276 CZ ARG B 17 51.253 -11.742 -17.101 1.00 0.00 C ATOM 1277 NH1 ARG B 17 51.281 -12.940 -16.583 1.00 0.00 N ATOM 1278 NH2 ARG B 17 52.108 -10.840 -16.706 1.00 0.00 N ATOM 0 H ARG B 17 48.788 -7.346 -16.456 1.00 0.00 H new ATOM 0 HA ARG B 17 46.709 -9.330 -17.164 1.00 0.00 H new ATOM 0 HB2 ARG B 17 49.270 -9.585 -17.461 1.00 0.00 H new ATOM 0 HB3 ARG B 17 49.352 -9.754 -15.719 1.00 0.00 H new ATOM 0 HG2 ARG B 17 48.540 -11.894 -15.795 1.00 0.00 H new ATOM 0 HG3 ARG B 17 47.200 -11.425 -16.822 1.00 0.00 H new ATOM 0 HD2 ARG B 17 49.009 -13.066 -17.803 1.00 0.00 H new ATOM 0 HD3 ARG B 17 48.428 -11.764 -18.822 1.00 0.00 H new ATOM 0 HE ARG B 17 50.625 -10.847 -18.798 1.00 0.00 H new ATOM 0 HH11 ARG B 17 50.611 -13.645 -16.891 1.00 0.00 H new ATOM 0 HH12 ARG B 17 51.973 -13.171 -15.870 1.00 0.00 H new ATOM 0 HH21 ARG B 17 52.085 -9.904 -17.110 1.00 0.00 H new ATOM 0 HH22 ARG B 17 52.800 -11.071 -15.993 1.00 0.00 H new ATOM 1292 N GLN B 18 45.863 -9.906 -14.841 1.00 0.00 N ATOM 1293 CA GLN B 18 45.272 -10.043 -13.487 1.00 0.00 C ATOM 1294 C GLN B 18 45.981 -11.105 -12.666 1.00 0.00 C ATOM 1295 O GLN B 18 47.059 -11.570 -12.978 1.00 0.00 O ATOM 1296 CB GLN B 18 43.816 -10.430 -13.598 1.00 0.00 C ATOM 1297 CG GLN B 18 43.209 -9.850 -14.876 1.00 0.00 C ATOM 1298 CD GLN B 18 43.118 -10.945 -15.940 1.00 0.00 C ATOM 1299 OE1 GLN B 18 42.290 -10.879 -16.825 1.00 0.00 O ATOM 1300 NE2 GLN B 18 43.942 -11.958 -15.890 1.00 0.00 N ATOM 0 H GLN B 18 45.401 -10.444 -15.575 1.00 0.00 H new ATOM 0 HA GLN B 18 45.382 -9.079 -12.990 1.00 0.00 H new ATOM 0 HB2 GLN B 18 43.721 -11.516 -13.602 1.00 0.00 H new ATOM 0 HB3 GLN B 18 43.268 -10.065 -12.729 1.00 0.00 H new ATOM 0 HG2 GLN B 18 42.218 -9.445 -14.670 1.00 0.00 H new ATOM 0 HG3 GLN B 18 43.821 -9.025 -15.240 1.00 0.00 H new ATOM 0 HE21 GLN B 18 44.638 -12.013 -15.146 1.00 0.00 H new ATOM 0 HE22 GLN B 18 43.889 -12.693 -16.595 1.00 0.00 H new ATOM 1309 N ILE B 19 45.335 -11.481 -11.610 1.00 0.00 N ATOM 1310 CA ILE B 19 45.841 -12.504 -10.689 1.00 0.00 C ATOM 1311 C ILE B 19 44.604 -13.180 -10.113 1.00 0.00 C ATOM 1312 O ILE B 19 43.924 -12.616 -9.284 1.00 0.00 O ATOM 1313 CB ILE B 19 46.631 -11.849 -9.562 1.00 0.00 C ATOM 1314 CG1 ILE B 19 46.125 -10.422 -9.327 1.00 0.00 C ATOM 1315 CG2 ILE B 19 48.113 -11.810 -9.931 1.00 0.00 C ATOM 1316 CD1 ILE B 19 46.876 -9.801 -8.148 1.00 0.00 C ATOM 0 H ILE B 19 44.430 -11.096 -11.341 1.00 0.00 H new ATOM 0 HA ILE B 19 46.501 -13.209 -11.194 1.00 0.00 H new ATOM 0 HB ILE B 19 46.497 -12.430 -8.650 1.00 0.00 H new ATOM 0 HG12 ILE B 19 46.273 -9.820 -10.224 1.00 0.00 H new ATOM 0 HG13 ILE B 19 45.054 -10.433 -9.124 1.00 0.00 H new ATOM 0 HG21 ILE B 19 48.677 -11.341 -9.124 1.00 0.00 H new ATOM 0 HG22 ILE B 19 48.476 -12.826 -10.085 1.00 0.00 H new ATOM 0 HG23 ILE B 19 48.245 -11.235 -10.847 1.00 0.00 H new ATOM 0 HD11 ILE B 19 46.516 -8.786 -7.981 1.00 0.00 H new ATOM 0 HD12 ILE B 19 46.705 -10.398 -7.252 1.00 0.00 H new ATOM 0 HD13 ILE B 19 47.943 -9.776 -8.369 1.00 0.00 H new ATOM 1328 N PRO B 20 44.330 -14.350 -10.595 1.00 0.00 N ATOM 1329 CA PRO B 20 43.147 -15.114 -10.176 1.00 0.00 C ATOM 1330 C PRO B 20 43.230 -15.474 -8.700 1.00 0.00 C ATOM 1331 O PRO B 20 44.258 -15.341 -8.075 1.00 0.00 O ATOM 1332 CB PRO B 20 43.171 -16.338 -11.095 1.00 0.00 C ATOM 1333 CG PRO B 20 44.622 -16.448 -11.610 1.00 0.00 C ATOM 1334 CD PRO B 20 45.193 -15.040 -11.567 1.00 0.00 C ATOM 0 HA PRO B 20 42.211 -14.562 -10.266 1.00 0.00 H new ATOM 0 HB2 PRO B 20 42.878 -17.238 -10.555 1.00 0.00 H new ATOM 0 HB3 PRO B 20 42.470 -16.220 -11.922 1.00 0.00 H new ATOM 0 HG2 PRO B 20 45.206 -17.125 -10.987 1.00 0.00 H new ATOM 0 HG3 PRO B 20 44.646 -16.848 -12.624 1.00 0.00 H new ATOM 0 HD2 PRO B 20 46.236 -15.039 -11.250 1.00 0.00 H new ATOM 0 HD3 PRO B 20 45.157 -14.562 -12.546 1.00 0.00 H new ATOM 1342 N GLN B 21 42.139 -15.898 -8.130 1.00 0.00 N ATOM 1343 CA GLN B 21 42.138 -16.237 -6.682 1.00 0.00 C ATOM 1344 C GLN B 21 43.309 -17.169 -6.362 1.00 0.00 C ATOM 1345 O GLN B 21 43.948 -17.040 -5.336 1.00 0.00 O ATOM 1346 CB GLN B 21 40.814 -16.923 -6.324 1.00 0.00 C ATOM 1347 CG GLN B 21 39.687 -15.887 -6.296 1.00 0.00 C ATOM 1348 CD GLN B 21 38.570 -16.372 -5.371 1.00 0.00 C ATOM 1349 OE1 GLN B 21 37.930 -17.369 -5.642 1.00 0.00 O ATOM 1350 NE2 GLN B 21 38.304 -15.704 -4.282 1.00 0.00 N ATOM 0 H GLN B 21 41.246 -16.025 -8.606 1.00 0.00 H new ATOM 0 HA GLN B 21 42.246 -15.324 -6.097 1.00 0.00 H new ATOM 0 HB2 GLN B 21 40.588 -17.701 -7.053 1.00 0.00 H new ATOM 0 HB3 GLN B 21 40.897 -17.411 -5.353 1.00 0.00 H new ATOM 0 HG2 GLN B 21 40.070 -14.927 -5.949 1.00 0.00 H new ATOM 0 HG3 GLN B 21 39.298 -15.730 -7.302 1.00 0.00 H new ATOM 0 HE21 GLN B 21 38.840 -14.867 -4.053 1.00 0.00 H new ATOM 0 HE22 GLN B 21 37.560 -16.019 -3.660 1.00 0.00 H new ATOM 1359 N ASN B 22 43.602 -18.106 -7.221 1.00 0.00 N ATOM 1360 CA ASN B 22 44.738 -19.029 -6.941 1.00 0.00 C ATOM 1361 C ASN B 22 45.980 -18.206 -6.597 1.00 0.00 C ATOM 1362 O ASN B 22 46.732 -18.538 -5.703 1.00 0.00 O ATOM 1363 CB ASN B 22 45.023 -19.890 -8.172 1.00 0.00 C ATOM 1364 CG ASN B 22 45.402 -21.302 -7.723 1.00 0.00 C ATOM 1365 OD1 ASN B 22 44.615 -22.221 -7.837 1.00 0.00 O ATOM 1366 ND2 ASN B 22 46.583 -21.514 -7.209 1.00 0.00 N ATOM 0 H ASN B 22 43.108 -18.272 -8.098 1.00 0.00 H new ATOM 0 HA ASN B 22 44.480 -19.677 -6.103 1.00 0.00 H new ATOM 0 HB2 ASN B 22 44.145 -19.924 -8.817 1.00 0.00 H new ATOM 0 HB3 ASN B 22 45.832 -19.452 -8.757 1.00 0.00 H new ATOM 0 HD21 ASN B 22 46.845 -22.451 -6.903 1.00 0.00 H new ATOM 0 HD22 ASN B 22 47.244 -20.743 -7.113 1.00 0.00 H new ATOM 1373 N PHE B 23 46.204 -17.134 -7.307 1.00 0.00 N ATOM 1374 CA PHE B 23 47.395 -16.289 -7.031 1.00 0.00 C ATOM 1375 C PHE B 23 47.048 -15.204 -6.007 1.00 0.00 C ATOM 1376 O PHE B 23 47.922 -14.562 -5.460 1.00 0.00 O ATOM 1377 CB PHE B 23 47.853 -15.630 -8.332 1.00 0.00 C ATOM 1378 CG PHE B 23 49.121 -16.290 -8.812 1.00 0.00 C ATOM 1379 CD1 PHE B 23 50.360 -15.879 -8.308 1.00 0.00 C ATOM 1380 CD2 PHE B 23 49.056 -17.317 -9.760 1.00 0.00 C ATOM 1381 CE1 PHE B 23 51.536 -16.494 -8.755 1.00 0.00 C ATOM 1382 CE2 PHE B 23 50.231 -17.932 -10.206 1.00 0.00 C ATOM 1383 CZ PHE B 23 51.471 -17.521 -9.704 1.00 0.00 C ATOM 0 H PHE B 23 45.609 -16.808 -8.069 1.00 0.00 H new ATOM 0 HA PHE B 23 48.192 -16.914 -6.628 1.00 0.00 H new ATOM 0 HB2 PHE B 23 47.075 -15.719 -9.090 1.00 0.00 H new ATOM 0 HB3 PHE B 23 48.023 -14.565 -8.172 1.00 0.00 H new ATOM 0 HD1 PHE B 23 50.409 -15.088 -7.575 1.00 0.00 H new ATOM 0 HD2 PHE B 23 48.099 -17.635 -10.147 1.00 0.00 H new ATOM 0 HE1 PHE B 23 52.493 -16.176 -8.368 1.00 0.00 H new ATOM 0 HE2 PHE B 23 50.181 -18.724 -10.938 1.00 0.00 H new ATOM 0 HZ PHE B 23 52.378 -17.996 -10.049 1.00 0.00 H new ATOM 1393 N ILE B 24 45.788 -14.985 -5.737 1.00 0.00 N ATOM 1394 CA ILE B 24 45.430 -13.931 -4.745 1.00 0.00 C ATOM 1395 C ILE B 24 45.632 -14.459 -3.329 1.00 0.00 C ATOM 1396 O ILE B 24 45.337 -15.596 -3.019 1.00 0.00 O ATOM 1397 CB ILE B 24 43.951 -13.498 -4.888 1.00 0.00 C ATOM 1398 CG1 ILE B 24 43.708 -12.612 -6.124 1.00 0.00 C ATOM 1399 CG2 ILE B 24 43.554 -12.676 -3.664 1.00 0.00 C ATOM 1400 CD1 ILE B 24 45.016 -12.274 -6.828 1.00 0.00 C ATOM 0 H ILE B 24 45.002 -15.483 -6.154 1.00 0.00 H new ATOM 0 HA ILE B 24 46.076 -13.074 -4.935 1.00 0.00 H new ATOM 0 HB ILE B 24 43.363 -14.410 -4.988 1.00 0.00 H new ATOM 0 HG12 ILE B 24 43.042 -13.126 -6.817 1.00 0.00 H new ATOM 0 HG13 ILE B 24 43.207 -11.692 -5.822 1.00 0.00 H new ATOM 0 HG21 ILE B 24 42.513 -12.366 -3.756 1.00 0.00 H new ATOM 0 HG22 ILE B 24 43.675 -13.280 -2.765 1.00 0.00 H new ATOM 0 HG23 ILE B 24 44.190 -11.794 -3.596 1.00 0.00 H new ATOM 0 HD11 ILE B 24 44.811 -11.648 -7.696 1.00 0.00 H new ATOM 0 HD12 ILE B 24 45.671 -11.738 -6.141 1.00 0.00 H new ATOM 0 HD13 ILE B 24 45.503 -13.194 -7.151 1.00 0.00 H new ATOM 1412 N ALA B 25 46.087 -13.608 -2.462 1.00 0.00 N ATOM 1413 CA ALA B 25 46.267 -13.993 -1.043 1.00 0.00 C ATOM 1414 C ALA B 25 45.498 -12.970 -0.211 1.00 0.00 C ATOM 1415 O ALA B 25 44.501 -13.276 0.412 1.00 0.00 O ATOM 1416 CB ALA B 25 47.750 -13.956 -0.672 1.00 0.00 C ATOM 0 H ALA B 25 46.346 -12.646 -2.681 1.00 0.00 H new ATOM 0 HA ALA B 25 45.902 -15.004 -0.863 1.00 0.00 H new ATOM 0 HB1 ALA B 25 47.871 -14.241 0.373 1.00 0.00 H new ATOM 0 HB2 ALA B 25 48.301 -14.653 -1.304 1.00 0.00 H new ATOM 0 HB3 ALA B 25 48.137 -12.948 -0.821 1.00 0.00 H new ATOM 1422 N ALA B 26 45.944 -11.745 -0.234 1.00 0.00 N ATOM 1423 CA ALA B 26 45.234 -10.669 0.514 1.00 0.00 C ATOM 1424 C ALA B 26 44.449 -9.805 -0.481 1.00 0.00 C ATOM 1425 O ALA B 26 44.214 -10.196 -1.605 1.00 0.00 O ATOM 1426 CB ALA B 26 46.247 -9.803 1.262 1.00 0.00 C ATOM 0 H ALA B 26 46.775 -11.441 -0.742 1.00 0.00 H new ATOM 0 HA ALA B 26 44.549 -11.114 1.236 1.00 0.00 H new ATOM 0 HB1 ALA B 26 45.723 -9.018 1.807 1.00 0.00 H new ATOM 0 HB2 ALA B 26 46.806 -10.421 1.965 1.00 0.00 H new ATOM 0 HB3 ALA B 26 46.936 -9.351 0.549 1.00 0.00 H new ATOM 1432 N TYR B 27 44.063 -8.621 -0.082 1.00 0.00 N ATOM 1433 CA TYR B 27 43.322 -7.719 -1.012 1.00 0.00 C ATOM 1434 C TYR B 27 43.729 -6.265 -0.708 1.00 0.00 C ATOM 1435 O TYR B 27 44.820 -5.848 -1.041 1.00 0.00 O ATOM 1436 CB TYR B 27 41.800 -7.902 -0.850 1.00 0.00 C ATOM 1437 CG TYR B 27 41.427 -8.145 0.602 1.00 0.00 C ATOM 1438 CD1 TYR B 27 41.884 -9.290 1.266 1.00 0.00 C ATOM 1439 CD2 TYR B 27 40.609 -7.227 1.279 1.00 0.00 C ATOM 1440 CE1 TYR B 27 41.528 -9.515 2.601 1.00 0.00 C ATOM 1441 CE2 TYR B 27 40.254 -7.454 2.613 1.00 0.00 C ATOM 1442 CZ TYR B 27 40.715 -8.597 3.275 1.00 0.00 C ATOM 1443 OH TYR B 27 40.363 -8.822 4.589 1.00 0.00 O ATOM 0 H TYR B 27 44.229 -8.240 0.849 1.00 0.00 H new ATOM 0 HA TYR B 27 43.575 -7.965 -2.043 1.00 0.00 H new ATOM 0 HB2 TYR B 27 41.283 -7.015 -1.217 1.00 0.00 H new ATOM 0 HB3 TYR B 27 41.465 -8.741 -1.460 1.00 0.00 H new ATOM 0 HD1 TYR B 27 42.512 -10.000 0.748 1.00 0.00 H new ATOM 0 HD2 TYR B 27 40.253 -6.344 0.769 1.00 0.00 H new ATOM 0 HE1 TYR B 27 41.881 -10.399 3.112 1.00 0.00 H new ATOM 0 HE2 TYR B 27 39.624 -6.747 3.132 1.00 0.00 H new ATOM 0 HH TYR B 27 39.797 -8.088 4.906 1.00 0.00 H new ATOM 1453 N PHE B 28 42.871 -5.506 -0.063 1.00 0.00 N ATOM 1454 CA PHE B 28 43.192 -4.088 0.305 1.00 0.00 C ATOM 1455 C PHE B 28 42.759 -3.134 -0.800 1.00 0.00 C ATOM 1456 O PHE B 28 43.275 -3.160 -1.898 1.00 0.00 O ATOM 1457 CB PHE B 28 44.691 -3.908 0.555 1.00 0.00 C ATOM 1458 CG PHE B 28 45.238 -5.077 1.332 1.00 0.00 C ATOM 1459 CD1 PHE B 28 44.380 -5.903 2.065 1.00 0.00 C ATOM 1460 CD2 PHE B 28 46.608 -5.335 1.307 1.00 0.00 C ATOM 1461 CE1 PHE B 28 44.897 -6.988 2.776 1.00 0.00 C ATOM 1462 CE2 PHE B 28 47.128 -6.421 2.018 1.00 0.00 C ATOM 1463 CZ PHE B 28 46.272 -7.248 2.755 1.00 0.00 C ATOM 0 H PHE B 28 41.944 -5.817 0.229 1.00 0.00 H new ATOM 0 HA PHE B 28 42.647 -3.860 1.221 1.00 0.00 H new ATOM 0 HB2 PHE B 28 45.216 -3.817 -0.396 1.00 0.00 H new ATOM 0 HB3 PHE B 28 44.866 -2.984 1.105 1.00 0.00 H new ATOM 0 HD1 PHE B 28 43.319 -5.702 2.081 1.00 0.00 H new ATOM 0 HD2 PHE B 28 47.268 -4.696 0.739 1.00 0.00 H new ATOM 0 HE1 PHE B 28 44.235 -7.627 3.342 1.00 0.00 H new ATOM 0 HE2 PHE B 28 48.189 -6.622 1.999 1.00 0.00 H new ATOM 0 HZ PHE B 28 46.672 -8.086 3.307 1.00 0.00 H new ATOM 1473 N GLU B 29 41.828 -2.272 -0.504 1.00 0.00 N ATOM 1474 CA GLU B 29 41.361 -1.288 -1.520 1.00 0.00 C ATOM 1475 C GLU B 29 41.943 0.084 -1.183 1.00 0.00 C ATOM 1476 O GLU B 29 42.114 0.431 -0.031 1.00 0.00 O ATOM 1477 CB GLU B 29 39.829 -1.220 -1.524 1.00 0.00 C ATOM 1478 CG GLU B 29 39.283 -1.677 -0.168 1.00 0.00 C ATOM 1479 CD GLU B 29 37.798 -1.328 -0.070 1.00 0.00 C ATOM 1480 OE1 GLU B 29 37.321 -0.609 -0.933 1.00 0.00 O ATOM 1481 OE2 GLU B 29 37.161 -1.786 0.865 1.00 0.00 O ATOM 0 H GLU B 29 41.367 -2.206 0.404 1.00 0.00 H new ATOM 0 HA GLU B 29 41.696 -1.598 -2.510 1.00 0.00 H new ATOM 0 HB2 GLU B 29 39.502 -0.201 -1.733 1.00 0.00 H new ATOM 0 HB3 GLU B 29 39.430 -1.852 -2.318 1.00 0.00 H new ATOM 0 HG2 GLU B 29 39.423 -2.752 -0.052 1.00 0.00 H new ATOM 0 HG3 GLU B 29 39.834 -1.195 0.639 1.00 0.00 H new ATOM 1488 N THR B 30 42.269 0.859 -2.179 1.00 0.00 N ATOM 1489 CA THR B 30 42.866 2.199 -1.916 1.00 0.00 C ATOM 1490 C THR B 30 41.789 3.282 -1.976 1.00 0.00 C ATOM 1491 O THR B 30 40.716 3.078 -2.509 1.00 0.00 O ATOM 1492 CB THR B 30 43.936 2.483 -2.970 1.00 0.00 C ATOM 1493 OG1 THR B 30 43.310 2.867 -4.186 1.00 0.00 O ATOM 1494 CG2 THR B 30 44.772 1.224 -3.199 1.00 0.00 C ATOM 0 H THR B 30 42.148 0.623 -3.164 1.00 0.00 H new ATOM 0 HA THR B 30 43.311 2.204 -0.921 1.00 0.00 H new ATOM 0 HB THR B 30 44.584 3.289 -2.625 1.00 0.00 H new ATOM 0 HG1 THR B 30 43.426 2.157 -4.852 1.00 0.00 H new ATOM 0 HG21 THR B 30 45.535 1.426 -3.951 1.00 0.00 H new ATOM 0 HG22 THR B 30 45.251 0.930 -2.265 1.00 0.00 H new ATOM 0 HG23 THR B 30 44.127 0.417 -3.545 1.00 0.00 H new ATOM 1502 N SER B 31 42.074 4.435 -1.431 1.00 0.00 N ATOM 1503 CA SER B 31 41.078 5.543 -1.448 1.00 0.00 C ATOM 1504 C SER B 31 41.556 6.671 -0.537 1.00 0.00 C ATOM 1505 O SER B 31 42.041 7.690 -0.988 1.00 0.00 O ATOM 1506 CB SER B 31 39.731 5.028 -0.945 1.00 0.00 C ATOM 1507 OG SER B 31 38.850 6.127 -0.755 1.00 0.00 O ATOM 0 H SER B 31 42.958 4.657 -0.973 1.00 0.00 H new ATOM 0 HA SER B 31 40.970 5.915 -2.467 1.00 0.00 H new ATOM 0 HB2 SER B 31 39.306 4.326 -1.662 1.00 0.00 H new ATOM 0 HB3 SER B 31 39.862 4.486 -0.008 1.00 0.00 H new ATOM 0 HG SER B 31 37.984 5.800 -0.434 1.00 0.00 H new ATOM 1513 N SER B 32 41.411 6.491 0.741 1.00 0.00 N ATOM 1514 CA SER B 32 41.839 7.537 1.707 1.00 0.00 C ATOM 1515 C SER B 32 43.170 8.159 1.271 1.00 0.00 C ATOM 1516 O SER B 32 44.198 7.513 1.261 1.00 0.00 O ATOM 1517 CB SER B 32 42.009 6.891 3.075 1.00 0.00 C ATOM 1518 OG SER B 32 42.962 7.628 3.830 1.00 0.00 O ATOM 0 H SER B 32 41.010 5.654 1.164 1.00 0.00 H new ATOM 0 HA SER B 32 41.085 8.323 1.746 1.00 0.00 H new ATOM 0 HB2 SER B 32 41.054 6.867 3.599 1.00 0.00 H new ATOM 0 HB3 SER B 32 42.338 5.858 2.963 1.00 0.00 H new ATOM 0 HG SER B 32 43.072 7.214 4.712 1.00 0.00 H new ATOM 1524 N GLN B 33 43.155 9.419 0.930 1.00 0.00 N ATOM 1525 CA GLN B 33 44.413 10.108 0.515 1.00 0.00 C ATOM 1526 C GLN B 33 45.204 9.246 -0.475 1.00 0.00 C ATOM 1527 O GLN B 33 46.209 8.659 -0.126 1.00 0.00 O ATOM 1528 CB GLN B 33 45.277 10.364 1.753 1.00 0.00 C ATOM 1529 CG GLN B 33 45.113 11.817 2.205 1.00 0.00 C ATOM 1530 CD GLN B 33 46.476 12.378 2.615 1.00 0.00 C ATOM 1531 OE1 GLN B 33 47.316 12.636 1.776 1.00 0.00 O ATOM 1532 NE2 GLN B 33 46.733 12.579 3.878 1.00 0.00 N ATOM 0 H GLN B 33 42.320 10.005 0.921 1.00 0.00 H new ATOM 0 HA GLN B 33 44.152 11.049 0.031 1.00 0.00 H new ATOM 0 HB2 GLN B 33 44.987 9.688 2.557 1.00 0.00 H new ATOM 0 HB3 GLN B 33 46.323 10.159 1.527 1.00 0.00 H new ATOM 0 HG2 GLN B 33 44.689 12.415 1.398 1.00 0.00 H new ATOM 0 HG3 GLN B 33 44.418 11.873 3.042 1.00 0.00 H new ATOM 0 HE21 GLN B 33 46.028 12.363 4.583 1.00 0.00 H new ATOM 0 HE22 GLN B 33 47.639 12.953 4.161 1.00 0.00 H new ATOM 1541 N CYS B 34 44.772 9.182 -1.708 1.00 0.00 N ATOM 1542 CA CYS B 34 45.517 8.374 -2.719 1.00 0.00 C ATOM 1543 C CYS B 34 44.616 8.083 -3.923 1.00 0.00 C ATOM 1544 O CYS B 34 43.548 8.642 -4.060 1.00 0.00 O ATOM 1545 CB CYS B 34 45.982 7.055 -2.098 1.00 0.00 C ATOM 1546 SG CYS B 34 47.765 7.138 -1.795 1.00 0.00 S ATOM 0 H CYS B 34 43.938 9.653 -2.058 1.00 0.00 H new ATOM 0 HA CYS B 34 46.387 8.942 -3.049 1.00 0.00 H new ATOM 0 HB2 CYS B 34 45.450 6.871 -1.164 1.00 0.00 H new ATOM 0 HB3 CYS B 34 45.752 6.224 -2.765 1.00 0.00 H new ATOM 1551 N SER B 35 45.047 7.214 -4.798 1.00 0.00 N ATOM 1552 CA SER B 35 44.228 6.884 -5.999 1.00 0.00 C ATOM 1553 C SER B 35 42.760 6.713 -5.595 1.00 0.00 C ATOM 1554 O SER B 35 42.029 7.680 -5.538 1.00 0.00 O ATOM 1555 CB SER B 35 44.756 5.595 -6.627 1.00 0.00 C ATOM 1556 OG SER B 35 46.089 5.806 -7.071 1.00 0.00 O ATOM 0 H SER B 35 45.935 6.717 -4.732 1.00 0.00 H new ATOM 0 HA SER B 35 44.298 7.694 -6.725 1.00 0.00 H new ATOM 0 HB2 SER B 35 44.726 4.783 -5.900 1.00 0.00 H new ATOM 0 HB3 SER B 35 44.124 5.298 -7.464 1.00 0.00 H new ATOM 0 HG SER B 35 46.179 5.496 -7.996 1.00 0.00 H new ATOM 1562 N LYS B 36 42.341 5.489 -5.316 1.00 0.00 N ATOM 1563 CA LYS B 36 40.920 5.199 -4.903 1.00 0.00 C ATOM 1564 C LYS B 36 40.241 4.256 -5.909 1.00 0.00 C ATOM 1565 O LYS B 36 39.562 3.332 -5.504 1.00 0.00 O ATOM 1566 CB LYS B 36 40.096 6.484 -4.787 1.00 0.00 C ATOM 1567 CG LYS B 36 38.675 6.156 -4.320 1.00 0.00 C ATOM 1568 CD LYS B 36 37.818 7.423 -4.379 1.00 0.00 C ATOM 1569 CE LYS B 36 36.756 7.380 -3.277 1.00 0.00 C ATOM 1570 NZ LYS B 36 35.711 6.381 -3.634 1.00 0.00 N ATOM 0 H LYS B 36 42.939 4.664 -5.359 1.00 0.00 H new ATOM 0 HA LYS B 36 40.963 4.719 -3.925 1.00 0.00 H new ATOM 0 HB2 LYS B 36 40.570 7.167 -4.083 1.00 0.00 H new ATOM 0 HB3 LYS B 36 40.062 6.992 -5.751 1.00 0.00 H new ATOM 0 HG2 LYS B 36 38.242 5.381 -4.952 1.00 0.00 H new ATOM 0 HG3 LYS B 36 38.695 5.764 -3.303 1.00 0.00 H new ATOM 0 HD2 LYS B 36 38.447 8.305 -4.257 1.00 0.00 H new ATOM 0 HD3 LYS B 36 37.340 7.505 -5.355 1.00 0.00 H new ATOM 0 HE2 LYS B 36 37.216 7.117 -2.324 1.00 0.00 H new ATOM 0 HE3 LYS B 36 36.306 8.365 -3.152 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 34.972 6.376 -2.903 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 35.289 6.632 -4.551 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 36.141 5.436 -3.698 1.00 0.00 H new ATOM 1584 N PRO B 37 40.422 4.508 -7.187 1.00 0.00 N ATOM 1585 CA PRO B 37 39.814 3.678 -8.243 1.00 0.00 C ATOM 1586 C PRO B 37 40.640 2.408 -8.473 1.00 0.00 C ATOM 1587 O PRO B 37 40.879 2.013 -9.598 1.00 0.00 O ATOM 1588 CB PRO B 37 39.861 4.579 -9.481 1.00 0.00 C ATOM 1589 CG PRO B 37 40.985 5.610 -9.226 1.00 0.00 C ATOM 1590 CD PRO B 37 41.233 5.631 -7.705 1.00 0.00 C ATOM 0 HA PRO B 37 38.806 3.347 -7.995 1.00 0.00 H new ATOM 0 HB2 PRO B 37 40.065 3.996 -10.379 1.00 0.00 H new ATOM 0 HB3 PRO B 37 38.904 5.077 -9.636 1.00 0.00 H new ATOM 0 HG2 PRO B 37 41.893 5.333 -9.762 1.00 0.00 H new ATOM 0 HG3 PRO B 37 40.693 6.597 -9.584 1.00 0.00 H new ATOM 0 HD2 PRO B 37 42.290 5.499 -7.472 1.00 0.00 H new ATOM 0 HD3 PRO B 37 40.926 6.580 -7.265 1.00 0.00 H new ATOM 1598 N GLY B 38 41.084 1.766 -7.426 1.00 0.00 N ATOM 1599 CA GLY B 38 41.895 0.531 -7.611 1.00 0.00 C ATOM 1600 C GLY B 38 41.863 -0.322 -6.341 1.00 0.00 C ATOM 1601 O GLY B 38 41.025 -0.148 -5.480 1.00 0.00 O ATOM 0 H GLY B 38 40.921 2.042 -6.458 1.00 0.00 H new ATOM 0 HA2 GLY B 38 41.508 -0.043 -8.453 1.00 0.00 H new ATOM 0 HA3 GLY B 38 42.924 0.797 -7.853 1.00 0.00 H new ATOM 1605 N VAL B 39 42.773 -1.250 -6.232 1.00 0.00 N ATOM 1606 CA VAL B 39 42.816 -2.137 -5.037 1.00 0.00 C ATOM 1607 C VAL B 39 44.269 -2.582 -4.810 1.00 0.00 C ATOM 1608 O VAL B 39 45.190 -1.980 -5.313 1.00 0.00 O ATOM 1609 CB VAL B 39 41.915 -3.355 -5.309 1.00 0.00 C ATOM 1610 CG1 VAL B 39 42.683 -4.410 -6.119 1.00 0.00 C ATOM 1611 CG2 VAL B 39 41.438 -3.970 -3.987 1.00 0.00 C ATOM 0 H VAL B 39 43.496 -1.433 -6.928 1.00 0.00 H new ATOM 0 HA VAL B 39 42.461 -1.618 -4.147 1.00 0.00 H new ATOM 0 HB VAL B 39 41.048 -3.023 -5.881 1.00 0.00 H new ATOM 0 HG11 VAL B 39 42.036 -5.267 -6.306 1.00 0.00 H new ATOM 0 HG12 VAL B 39 42.999 -3.980 -7.069 1.00 0.00 H new ATOM 0 HG13 VAL B 39 43.560 -4.733 -5.557 1.00 0.00 H new ATOM 0 HG21 VAL B 39 40.802 -4.830 -4.195 1.00 0.00 H new ATOM 0 HG22 VAL B 39 42.301 -4.289 -3.402 1.00 0.00 H new ATOM 0 HG23 VAL B 39 40.872 -3.228 -3.424 1.00 0.00 H new ATOM 1621 N ILE B 40 44.483 -3.637 -4.078 1.00 0.00 N ATOM 1622 CA ILE B 40 45.870 -4.120 -3.862 1.00 0.00 C ATOM 1623 C ILE B 40 45.795 -5.616 -3.560 1.00 0.00 C ATOM 1624 O ILE B 40 44.729 -6.151 -3.326 1.00 0.00 O ATOM 1625 CB ILE B 40 46.520 -3.350 -2.705 1.00 0.00 C ATOM 1626 CG1 ILE B 40 47.083 -2.028 -3.239 1.00 0.00 C ATOM 1627 CG2 ILE B 40 47.660 -4.173 -2.097 1.00 0.00 C ATOM 1628 CD1 ILE B 40 47.969 -1.368 -2.177 1.00 0.00 C ATOM 0 H ILE B 40 43.755 -4.186 -3.620 1.00 0.00 H new ATOM 0 HA ILE B 40 46.484 -3.953 -4.747 1.00 0.00 H new ATOM 0 HB ILE B 40 45.771 -3.158 -1.937 1.00 0.00 H new ATOM 0 HG12 ILE B 40 47.661 -2.209 -4.145 1.00 0.00 H new ATOM 0 HG13 ILE B 40 46.267 -1.359 -3.510 1.00 0.00 H new ATOM 0 HG21 ILE B 40 48.114 -3.616 -1.277 1.00 0.00 H new ATOM 0 HG22 ILE B 40 47.266 -5.117 -1.721 1.00 0.00 H new ATOM 0 HG23 ILE B 40 48.412 -4.372 -2.860 1.00 0.00 H new ATOM 0 HD11 ILE B 40 48.365 -0.429 -2.565 1.00 0.00 H new ATOM 0 HD12 ILE B 40 47.379 -1.170 -1.282 1.00 0.00 H new ATOM 0 HD13 ILE B 40 48.795 -2.034 -1.927 1.00 0.00 H new ATOM 1640 N PHE B 41 46.895 -6.308 -3.587 1.00 0.00 N ATOM 1641 CA PHE B 41 46.837 -7.768 -3.322 1.00 0.00 C ATOM 1642 C PHE B 41 48.128 -8.231 -2.661 1.00 0.00 C ATOM 1643 O PHE B 41 49.047 -7.467 -2.443 1.00 0.00 O ATOM 1644 CB PHE B 41 46.675 -8.514 -4.646 1.00 0.00 C ATOM 1645 CG PHE B 41 45.232 -8.466 -5.086 1.00 0.00 C ATOM 1646 CD1 PHE B 41 44.281 -9.260 -4.438 1.00 0.00 C ATOM 1647 CD2 PHE B 41 44.847 -7.628 -6.139 1.00 0.00 C ATOM 1648 CE1 PHE B 41 42.941 -9.218 -4.842 1.00 0.00 C ATOM 1649 CE2 PHE B 41 43.507 -7.585 -6.544 1.00 0.00 C ATOM 1650 CZ PHE B 41 42.554 -8.380 -5.895 1.00 0.00 C ATOM 0 H PHE B 41 47.823 -5.931 -3.779 1.00 0.00 H new ATOM 0 HA PHE B 41 45.994 -7.974 -2.663 1.00 0.00 H new ATOM 0 HB2 PHE B 41 47.312 -8.065 -5.408 1.00 0.00 H new ATOM 0 HB3 PHE B 41 46.996 -9.549 -4.532 1.00 0.00 H new ATOM 0 HD1 PHE B 41 44.580 -9.906 -3.626 1.00 0.00 H new ATOM 0 HD2 PHE B 41 45.583 -7.015 -6.639 1.00 0.00 H new ATOM 0 HE1 PHE B 41 42.206 -9.832 -4.342 1.00 0.00 H new ATOM 0 HE2 PHE B 41 43.209 -6.939 -7.356 1.00 0.00 H new ATOM 0 HZ PHE B 41 41.520 -8.347 -6.207 1.00 0.00 H new ATOM 1660 N LEU B 42 48.200 -9.490 -2.367 1.00 0.00 N ATOM 1661 CA LEU B 42 49.419 -10.056 -1.748 1.00 0.00 C ATOM 1662 C LEU B 42 49.694 -11.394 -2.412 1.00 0.00 C ATOM 1663 O LEU B 42 49.702 -12.431 -1.780 1.00 0.00 O ATOM 1664 CB LEU B 42 49.197 -10.258 -0.256 1.00 0.00 C ATOM 1665 CG LEU B 42 49.923 -9.158 0.515 1.00 0.00 C ATOM 1666 CD1 LEU B 42 49.114 -8.792 1.757 1.00 0.00 C ATOM 1667 CD2 LEU B 42 51.308 -9.656 0.937 1.00 0.00 C ATOM 0 H LEU B 42 47.452 -10.164 -2.532 1.00 0.00 H new ATOM 0 HA LEU B 42 50.264 -9.380 -1.882 1.00 0.00 H new ATOM 0 HB2 LEU B 42 48.131 -10.235 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU B 42 49.567 -11.237 0.049 1.00 0.00 H new ATOM 0 HG LEU B 42 50.033 -8.280 -0.121 1.00 0.00 H new ATOM 0 HD11 LEU B 42 49.630 -8.007 2.309 1.00 0.00 H new ATOM 0 HD12 LEU B 42 48.128 -8.437 1.457 1.00 0.00 H new ATOM 0 HD13 LEU B 42 49.005 -9.671 2.392 1.00 0.00 H new ATOM 0 HD21 LEU B 42 51.825 -8.870 1.487 1.00 0.00 H new ATOM 0 HD22 LEU B 42 51.200 -10.534 1.574 1.00 0.00 H new ATOM 0 HD23 LEU B 42 51.886 -9.919 0.051 1.00 0.00 H new ATOM 1679 N THR B 43 49.899 -11.368 -3.694 1.00 0.00 N ATOM 1680 CA THR B 43 50.160 -12.623 -4.445 1.00 0.00 C ATOM 1681 C THR B 43 51.088 -13.522 -3.634 1.00 0.00 C ATOM 1682 O THR B 43 51.722 -13.097 -2.689 1.00 0.00 O ATOM 1683 CB THR B 43 50.807 -12.286 -5.791 1.00 0.00 C ATOM 1684 OG1 THR B 43 52.074 -11.685 -5.567 1.00 0.00 O ATOM 1685 CG2 THR B 43 49.909 -11.318 -6.566 1.00 0.00 C ATOM 0 H THR B 43 49.897 -10.521 -4.262 1.00 0.00 H new ATOM 0 HA THR B 43 49.220 -13.146 -4.619 1.00 0.00 H new ATOM 0 HB THR B 43 50.935 -13.200 -6.371 1.00 0.00 H new ATOM 0 HG1 THR B 43 51.967 -10.713 -5.497 1.00 0.00 H new ATOM 0 HG21 THR B 43 50.372 -11.080 -7.524 1.00 0.00 H new ATOM 0 HG22 THR B 43 48.937 -11.781 -6.738 1.00 0.00 H new ATOM 0 HG23 THR B 43 49.777 -10.403 -5.989 1.00 0.00 H new ATOM 1693 N LYS B 44 51.167 -14.765 -4.001 1.00 0.00 N ATOM 1694 CA LYS B 44 52.042 -15.709 -3.260 1.00 0.00 C ATOM 1695 C LYS B 44 53.497 -15.420 -3.611 1.00 0.00 C ATOM 1696 O LYS B 44 54.407 -15.793 -2.896 1.00 0.00 O ATOM 1697 CB LYS B 44 51.681 -17.143 -3.642 1.00 0.00 C ATOM 1698 CG LYS B 44 50.547 -17.631 -2.738 1.00 0.00 C ATOM 1699 CD LYS B 44 49.327 -16.720 -2.902 1.00 0.00 C ATOM 1700 CE LYS B 44 48.065 -17.490 -2.509 1.00 0.00 C ATOM 1701 NZ LYS B 44 48.173 -17.927 -1.089 1.00 0.00 N ATOM 0 H LYS B 44 50.660 -15.171 -4.787 1.00 0.00 H new ATOM 0 HA LYS B 44 51.901 -15.584 -2.186 1.00 0.00 H new ATOM 0 HB2 LYS B 44 51.375 -17.188 -4.687 1.00 0.00 H new ATOM 0 HB3 LYS B 44 52.551 -17.791 -3.537 1.00 0.00 H new ATOM 0 HG2 LYS B 44 50.283 -18.658 -2.992 1.00 0.00 H new ATOM 0 HG3 LYS B 44 50.874 -17.634 -1.698 1.00 0.00 H new ATOM 0 HD2 LYS B 44 49.435 -15.833 -2.278 1.00 0.00 H new ATOM 0 HD3 LYS B 44 49.251 -16.377 -3.934 1.00 0.00 H new ATOM 0 HE2 LYS B 44 47.185 -16.860 -2.641 1.00 0.00 H new ATOM 0 HE3 LYS B 44 47.937 -18.356 -3.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 47.237 -18.220 -0.744 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 48.833 -18.728 -1.022 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 48.525 -17.139 -0.509 1.00 0.00 H new ATOM 1715 N ARG B 45 53.724 -14.738 -4.698 1.00 0.00 N ATOM 1716 CA ARG B 45 55.118 -14.402 -5.085 1.00 0.00 C ATOM 1717 C ARG B 45 55.640 -13.311 -4.149 1.00 0.00 C ATOM 1718 O ARG B 45 56.779 -12.898 -4.238 1.00 0.00 O ATOM 1719 CB ARG B 45 55.137 -13.888 -6.526 1.00 0.00 C ATOM 1720 CG ARG B 45 54.736 -15.016 -7.476 1.00 0.00 C ATOM 1721 CD ARG B 45 55.694 -15.042 -8.668 1.00 0.00 C ATOM 1722 NE ARG B 45 56.961 -15.718 -8.273 1.00 0.00 N ATOM 1723 CZ ARG B 45 57.666 -15.252 -7.279 1.00 0.00 C ATOM 1724 NH1 ARG B 45 58.214 -14.071 -7.367 1.00 0.00 N ATOM 1725 NH2 ARG B 45 57.823 -15.966 -6.198 1.00 0.00 N ATOM 0 H ARG B 45 53.003 -14.399 -5.335 1.00 0.00 H new ATOM 0 HA ARG B 45 55.748 -15.288 -5.010 1.00 0.00 H new ATOM 0 HB2 ARG B 45 54.451 -13.048 -6.632 1.00 0.00 H new ATOM 0 HB3 ARG B 45 56.132 -13.521 -6.779 1.00 0.00 H new ATOM 0 HG2 ARG B 45 54.762 -15.972 -6.954 1.00 0.00 H new ATOM 0 HG3 ARG B 45 53.713 -14.869 -7.821 1.00 0.00 H new ATOM 0 HD2 ARG B 45 55.235 -15.567 -9.506 1.00 0.00 H new ATOM 0 HD3 ARG B 45 55.901 -14.026 -9.004 1.00 0.00 H new ATOM 0 HE ARG B 45 57.277 -16.545 -8.779 1.00 0.00 H new ATOM 0 HH11 ARG B 45 58.091 -13.513 -8.212 1.00 0.00 H new ATOM 0 HH12 ARG B 45 58.765 -13.705 -6.591 1.00 0.00 H new ATOM 0 HH21 ARG B 45 57.394 -16.889 -6.130 1.00 0.00 H new ATOM 0 HH22 ARG B 45 58.374 -15.601 -5.421 1.00 0.00 H new ATOM 1739 N SER B 46 54.809 -12.833 -3.259 1.00 0.00 N ATOM 1740 CA SER B 46 55.246 -11.764 -2.324 1.00 0.00 C ATOM 1741 C SER B 46 55.239 -10.431 -3.064 1.00 0.00 C ATOM 1742 O SER B 46 56.084 -9.585 -2.847 1.00 0.00 O ATOM 1743 CB SER B 46 56.659 -12.066 -1.821 1.00 0.00 C ATOM 1744 OG SER B 46 56.807 -11.552 -0.503 1.00 0.00 O ATOM 0 H SER B 46 53.844 -13.141 -3.142 1.00 0.00 H new ATOM 0 HA SER B 46 54.568 -11.718 -1.472 1.00 0.00 H new ATOM 0 HB2 SER B 46 56.838 -13.141 -1.827 1.00 0.00 H new ATOM 0 HB3 SER B 46 57.398 -11.616 -2.484 1.00 0.00 H new ATOM 0 HG SER B 46 57.711 -11.745 -0.176 1.00 0.00 H new ATOM 1750 N ARG B 47 54.294 -10.235 -3.946 1.00 0.00 N ATOM 1751 CA ARG B 47 54.254 -8.949 -4.700 1.00 0.00 C ATOM 1752 C ARG B 47 52.824 -8.401 -4.742 1.00 0.00 C ATOM 1753 O ARG B 47 51.955 -8.956 -5.385 1.00 0.00 O ATOM 1754 CB ARG B 47 54.752 -9.184 -6.128 1.00 0.00 C ATOM 1755 CG ARG B 47 56.205 -9.662 -6.089 1.00 0.00 C ATOM 1756 CD ARG B 47 56.987 -9.020 -7.237 1.00 0.00 C ATOM 1757 NE ARG B 47 56.469 -9.532 -8.538 1.00 0.00 N ATOM 1758 CZ ARG B 47 57.096 -10.496 -9.154 1.00 0.00 C ATOM 1759 NH1 ARG B 47 58.364 -10.376 -9.437 1.00 0.00 N ATOM 1760 NH2 ARG B 47 56.453 -11.582 -9.489 1.00 0.00 N ATOM 0 H ARG B 47 53.557 -10.902 -4.175 1.00 0.00 H new ATOM 0 HA ARG B 47 54.895 -8.224 -4.199 1.00 0.00 H new ATOM 0 HB2 ARG B 47 54.127 -9.926 -6.625 1.00 0.00 H new ATOM 0 HB3 ARG B 47 54.676 -8.264 -6.707 1.00 0.00 H new ATOM 0 HG2 ARG B 47 56.660 -9.399 -5.134 1.00 0.00 H new ATOM 0 HG3 ARG B 47 56.244 -10.748 -6.172 1.00 0.00 H new ATOM 0 HD2 ARG B 47 56.889 -7.935 -7.196 1.00 0.00 H new ATOM 0 HD3 ARG B 47 58.048 -9.248 -7.141 1.00 0.00 H new ATOM 0 HE ARG B 47 55.625 -9.129 -8.946 1.00 0.00 H new ATOM 0 HH11 ARG B 47 58.867 -9.527 -9.177 1.00 0.00 H new ATOM 0 HH12 ARG B 47 58.853 -11.131 -9.919 1.00 0.00 H new ATOM 0 HH21 ARG B 47 55.461 -11.676 -9.269 1.00 0.00 H new ATOM 0 HH22 ARG B 47 56.942 -12.336 -9.971 1.00 0.00 H new ATOM 1774 N GLN B 48 52.579 -7.306 -4.073 1.00 0.00 N ATOM 1775 CA GLN B 48 51.210 -6.712 -4.086 1.00 0.00 C ATOM 1776 C GLN B 48 50.999 -5.988 -5.417 1.00 0.00 C ATOM 1777 O GLN B 48 51.945 -5.603 -6.075 1.00 0.00 O ATOM 1778 CB GLN B 48 51.077 -5.708 -2.939 1.00 0.00 C ATOM 1779 CG GLN B 48 51.926 -4.471 -3.245 1.00 0.00 C ATOM 1780 CD GLN B 48 51.084 -3.440 -4.004 1.00 0.00 C ATOM 1781 OE1 GLN B 48 49.973 -3.143 -3.615 1.00 0.00 O ATOM 1782 NE2 GLN B 48 51.573 -2.878 -5.079 1.00 0.00 N ATOM 0 H GLN B 48 53.267 -6.797 -3.518 1.00 0.00 H new ATOM 0 HA GLN B 48 50.465 -7.499 -3.966 1.00 0.00 H new ATOM 0 HB2 GLN B 48 50.033 -5.423 -2.810 1.00 0.00 H new ATOM 0 HB3 GLN B 48 51.402 -6.163 -2.003 1.00 0.00 H new ATOM 0 HG2 GLN B 48 52.301 -4.037 -2.318 1.00 0.00 H new ATOM 0 HG3 GLN B 48 52.795 -4.753 -3.839 1.00 0.00 H new ATOM 0 HE21 GLN B 48 52.506 -3.128 -5.405 1.00 0.00 H new ATOM 0 HE22 GLN B 48 51.021 -2.190 -5.591 1.00 0.00 H new ATOM 1791 N VAL B 49 49.775 -5.798 -5.827 1.00 0.00 N ATOM 1792 CA VAL B 49 49.543 -5.099 -7.125 1.00 0.00 C ATOM 1793 C VAL B 49 48.157 -4.446 -7.147 1.00 0.00 C ATOM 1794 O VAL B 49 47.195 -4.982 -6.632 1.00 0.00 O ATOM 1795 CB VAL B 49 49.640 -6.107 -8.273 1.00 0.00 C ATOM 1796 CG1 VAL B 49 50.178 -5.402 -9.516 1.00 0.00 C ATOM 1797 CG2 VAL B 49 50.588 -7.248 -7.886 1.00 0.00 C ATOM 0 H VAL B 49 48.935 -6.091 -5.328 1.00 0.00 H new ATOM 0 HA VAL B 49 50.301 -4.324 -7.242 1.00 0.00 H new ATOM 0 HB VAL B 49 48.651 -6.517 -8.478 1.00 0.00 H new ATOM 0 HG11 VAL B 49 50.249 -6.116 -10.337 1.00 0.00 H new ATOM 0 HG12 VAL B 49 49.503 -4.593 -9.796 1.00 0.00 H new ATOM 0 HG13 VAL B 49 51.166 -4.994 -9.304 1.00 0.00 H new ATOM 0 HG21 VAL B 49 50.653 -7.962 -8.707 1.00 0.00 H new ATOM 0 HG22 VAL B 49 51.579 -6.843 -7.678 1.00 0.00 H new ATOM 0 HG23 VAL B 49 50.208 -7.751 -6.997 1.00 0.00 H new ATOM 1807 N CYS B 50 48.049 -3.296 -7.762 1.00 0.00 N ATOM 1808 CA CYS B 50 46.733 -2.605 -7.847 1.00 0.00 C ATOM 1809 C CYS B 50 45.951 -3.190 -9.017 1.00 0.00 C ATOM 1810 O CYS B 50 46.462 -3.979 -9.785 1.00 0.00 O ATOM 1811 CB CYS B 50 46.944 -1.101 -8.080 1.00 0.00 C ATOM 1812 SG CYS B 50 45.603 -0.172 -7.290 1.00 0.00 S ATOM 0 H CYS B 50 48.822 -2.805 -8.211 1.00 0.00 H new ATOM 0 HA CYS B 50 46.184 -2.746 -6.916 1.00 0.00 H new ATOM 0 HB2 CYS B 50 47.906 -0.790 -7.671 1.00 0.00 H new ATOM 0 HB3 CYS B 50 46.968 -0.888 -9.149 1.00 0.00 H new ATOM 1817 N ALA B 51 44.715 -2.818 -9.159 1.00 0.00 N ATOM 1818 CA ALA B 51 43.914 -3.366 -10.282 1.00 0.00 C ATOM 1819 C ALA B 51 42.808 -2.388 -10.654 1.00 0.00 C ATOM 1820 O ALA B 51 42.331 -1.631 -9.831 1.00 0.00 O ATOM 1821 CB ALA B 51 43.290 -4.694 -9.858 1.00 0.00 C ATOM 0 H ALA B 51 44.226 -2.162 -8.550 1.00 0.00 H new ATOM 0 HA ALA B 51 44.563 -3.521 -11.144 1.00 0.00 H new ATOM 0 HB1 ALA B 51 42.701 -5.099 -10.681 1.00 0.00 H new ATOM 0 HB2 ALA B 51 44.079 -5.399 -9.595 1.00 0.00 H new ATOM 0 HB3 ALA B 51 42.644 -4.533 -8.995 1.00 0.00 H new ATOM 1827 N ASP B 52 42.390 -2.411 -11.887 1.00 0.00 N ATOM 1828 CA ASP B 52 41.301 -1.500 -12.329 1.00 0.00 C ATOM 1829 C ASP B 52 40.224 -1.453 -11.240 1.00 0.00 C ATOM 1830 O ASP B 52 40.137 -2.349 -10.424 1.00 0.00 O ATOM 1831 CB ASP B 52 40.712 -2.047 -13.631 1.00 0.00 C ATOM 1832 CG ASP B 52 40.636 -0.931 -14.675 1.00 0.00 C ATOM 1833 OD1 ASP B 52 41.451 -0.026 -14.605 1.00 0.00 O ATOM 1834 OD2 ASP B 52 39.763 -1.000 -15.524 1.00 0.00 O ATOM 0 H ASP B 52 42.759 -3.026 -12.612 1.00 0.00 H new ATOM 0 HA ASP B 52 41.682 -0.493 -12.497 1.00 0.00 H new ATOM 0 HB2 ASP B 52 41.328 -2.865 -14.004 1.00 0.00 H new ATOM 0 HB3 ASP B 52 39.718 -2.455 -13.448 1.00 0.00 H new ATOM 1839 N PRO B 53 39.443 -0.408 -11.247 1.00 0.00 N ATOM 1840 CA PRO B 53 38.372 -0.221 -10.256 1.00 0.00 C ATOM 1841 C PRO B 53 37.173 -1.113 -10.587 1.00 0.00 C ATOM 1842 O PRO B 53 36.531 -0.953 -11.606 1.00 0.00 O ATOM 1843 CB PRO B 53 38.017 1.263 -10.385 1.00 0.00 C ATOM 1844 CG PRO B 53 38.487 1.702 -11.793 1.00 0.00 C ATOM 1845 CD PRO B 53 39.550 0.681 -12.239 1.00 0.00 C ATOM 0 HA PRO B 53 38.671 -0.491 -9.243 1.00 0.00 H new ATOM 0 HB2 PRO B 53 36.944 1.418 -10.267 1.00 0.00 H new ATOM 0 HB3 PRO B 53 38.510 1.850 -9.610 1.00 0.00 H new ATOM 0 HG2 PRO B 53 37.651 1.722 -12.492 1.00 0.00 H new ATOM 0 HG3 PRO B 53 38.904 2.709 -11.766 1.00 0.00 H new ATOM 0 HD2 PRO B 53 39.357 0.320 -13.249 1.00 0.00 H new ATOM 0 HD3 PRO B 53 40.548 1.120 -12.243 1.00 0.00 H new ATOM 1853 N SER B 54 36.871 -2.051 -9.725 1.00 0.00 N ATOM 1854 CA SER B 54 35.715 -2.965 -9.966 1.00 0.00 C ATOM 1855 C SER B 54 36.126 -4.097 -10.912 1.00 0.00 C ATOM 1856 O SER B 54 35.314 -4.625 -11.647 1.00 0.00 O ATOM 1857 CB SER B 54 34.556 -2.182 -10.583 1.00 0.00 C ATOM 1858 OG SER B 54 33.322 -2.730 -10.136 1.00 0.00 O ATOM 0 H SER B 54 37.380 -2.223 -8.858 1.00 0.00 H new ATOM 0 HA SER B 54 35.400 -3.391 -9.014 1.00 0.00 H new ATOM 0 HB2 SER B 54 34.623 -1.131 -10.302 1.00 0.00 H new ATOM 0 HB3 SER B 54 34.612 -2.225 -11.671 1.00 0.00 H new ATOM 0 HG SER B 54 32.579 -2.227 -10.530 1.00 0.00 H new ATOM 1864 N GLU B 55 37.374 -4.484 -10.898 1.00 0.00 N ATOM 1865 CA GLU B 55 37.820 -5.590 -11.795 1.00 0.00 C ATOM 1866 C GLU B 55 36.910 -6.788 -11.619 1.00 0.00 C ATOM 1867 O GLU B 55 36.373 -7.047 -10.562 1.00 0.00 O ATOM 1868 CB GLU B 55 39.261 -5.990 -11.469 1.00 0.00 C ATOM 1869 CG GLU B 55 40.210 -4.888 -11.940 1.00 0.00 C ATOM 1870 CD GLU B 55 40.449 -5.031 -13.445 1.00 0.00 C ATOM 1871 OE1 GLU B 55 39.477 -5.189 -14.166 1.00 0.00 O ATOM 1872 OE2 GLU B 55 41.599 -4.980 -13.850 1.00 0.00 O ATOM 0 H GLU B 55 38.102 -4.084 -10.306 1.00 0.00 H new ATOM 0 HA GLU B 55 37.774 -5.245 -12.828 1.00 0.00 H new ATOM 0 HB2 GLU B 55 39.373 -6.148 -10.396 1.00 0.00 H new ATOM 0 HB3 GLU B 55 39.508 -6.932 -11.958 1.00 0.00 H new ATOM 0 HG2 GLU B 55 39.785 -3.909 -11.720 1.00 0.00 H new ATOM 0 HG3 GLU B 55 41.156 -4.953 -11.403 1.00 0.00 H new ATOM 1879 N GLU B 56 36.733 -7.505 -12.675 1.00 0.00 N ATOM 1880 CA GLU B 56 35.858 -8.695 -12.655 1.00 0.00 C ATOM 1881 C GLU B 56 36.496 -9.799 -11.810 1.00 0.00 C ATOM 1882 O GLU B 56 35.820 -10.620 -11.223 1.00 0.00 O ATOM 1883 CB GLU B 56 35.707 -9.148 -14.095 1.00 0.00 C ATOM 1884 CG GLU B 56 34.235 -9.435 -14.399 1.00 0.00 C ATOM 1885 CD GLU B 56 33.987 -9.297 -15.902 1.00 0.00 C ATOM 1886 OE1 GLU B 56 34.631 -8.462 -16.515 1.00 0.00 O ATOM 1887 OE2 GLU B 56 33.156 -10.029 -16.415 1.00 0.00 O ATOM 0 H GLU B 56 37.169 -7.313 -13.577 1.00 0.00 H new ATOM 0 HA GLU B 56 34.887 -8.466 -12.217 1.00 0.00 H new ATOM 0 HB2 GLU B 56 36.083 -8.378 -14.769 1.00 0.00 H new ATOM 0 HB3 GLU B 56 36.304 -10.043 -14.268 1.00 0.00 H new ATOM 0 HG2 GLU B 56 33.974 -10.440 -14.067 1.00 0.00 H new ATOM 0 HG3 GLU B 56 33.598 -8.742 -13.850 1.00 0.00 H new ATOM 1894 N TRP B 57 37.792 -9.821 -11.755 1.00 0.00 N ATOM 1895 CA TRP B 57 38.501 -10.857 -10.970 1.00 0.00 C ATOM 1896 C TRP B 57 38.790 -10.352 -9.558 1.00 0.00 C ATOM 1897 O TRP B 57 38.964 -11.130 -8.647 1.00 0.00 O ATOM 1898 CB TRP B 57 39.800 -11.186 -11.693 1.00 0.00 C ATOM 1899 CG TRP B 57 40.559 -9.941 -12.042 1.00 0.00 C ATOM 1900 CD1 TRP B 57 40.375 -9.213 -13.166 1.00 0.00 C ATOM 1901 CD2 TRP B 57 41.631 -9.284 -11.308 1.00 0.00 C ATOM 1902 NE1 TRP B 57 41.268 -8.164 -13.174 1.00 0.00 N ATOM 1903 CE2 TRP B 57 42.066 -8.163 -12.052 1.00 0.00 C ATOM 1904 CE3 TRP B 57 42.263 -9.548 -10.086 1.00 0.00 C ATOM 1905 CZ2 TRP B 57 43.096 -7.340 -11.605 1.00 0.00 C ATOM 1906 CZ3 TRP B 57 43.302 -8.721 -9.626 1.00 0.00 C ATOM 1907 CH2 TRP B 57 43.718 -7.620 -10.386 1.00 0.00 C ATOM 0 H TRP B 57 38.400 -9.153 -12.229 1.00 0.00 H new ATOM 0 HA TRP B 57 37.883 -11.750 -10.882 1.00 0.00 H new ATOM 0 HB2 TRP B 57 40.417 -11.826 -11.063 1.00 0.00 H new ATOM 0 HB3 TRP B 57 39.581 -11.748 -12.601 1.00 0.00 H new ATOM 0 HD1 TRP B 57 39.645 -9.420 -13.934 1.00 0.00 H new ATOM 0 HE1 TRP B 57 41.330 -7.472 -13.921 1.00 0.00 H new ATOM 0 HE3 TRP B 57 41.949 -10.394 -9.493 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 43.411 -6.493 -12.196 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 43.782 -8.935 -8.682 1.00 0.00 H new ATOM 0 HH2 TRP B 57 44.519 -6.989 -10.030 1.00 0.00 H new ATOM 1918 N VAL B 58 38.834 -9.065 -9.353 1.00 0.00 N ATOM 1919 CA VAL B 58 39.108 -8.560 -7.978 1.00 0.00 C ATOM 1920 C VAL B 58 37.816 -8.550 -7.162 1.00 0.00 C ATOM 1921 O VAL B 58 37.799 -8.947 -6.020 1.00 0.00 O ATOM 1922 CB VAL B 58 39.668 -7.144 -8.035 1.00 0.00 C ATOM 1923 CG1 VAL B 58 39.782 -6.609 -6.608 1.00 0.00 C ATOM 1924 CG2 VAL B 58 41.053 -7.170 -8.683 1.00 0.00 C ATOM 0 H VAL B 58 38.694 -8.350 -10.066 1.00 0.00 H new ATOM 0 HA VAL B 58 39.838 -9.219 -7.508 1.00 0.00 H new ATOM 0 HB VAL B 58 39.010 -6.504 -8.623 1.00 0.00 H new ATOM 0 HG11 VAL B 58 40.182 -5.595 -6.630 1.00 0.00 H new ATOM 0 HG12 VAL B 58 38.796 -6.600 -6.143 1.00 0.00 H new ATOM 0 HG13 VAL B 58 40.449 -7.250 -6.032 1.00 0.00 H new ATOM 0 HG21 VAL B 58 41.454 -6.157 -8.724 1.00 0.00 H new ATOM 0 HG22 VAL B 58 41.719 -7.801 -8.094 1.00 0.00 H new ATOM 0 HG23 VAL B 58 40.974 -7.571 -9.694 1.00 0.00 H new ATOM 1934 N GLN B 59 36.738 -8.093 -7.733 1.00 0.00 N ATOM 1935 CA GLN B 59 35.454 -8.060 -6.978 1.00 0.00 C ATOM 1936 C GLN B 59 35.272 -9.378 -6.225 1.00 0.00 C ATOM 1937 O GLN B 59 34.819 -9.408 -5.098 1.00 0.00 O ATOM 1938 CB GLN B 59 34.295 -7.881 -7.958 1.00 0.00 C ATOM 1939 CG GLN B 59 34.321 -6.463 -8.531 1.00 0.00 C ATOM 1940 CD GLN B 59 32.928 -5.840 -8.414 1.00 0.00 C ATOM 1941 OE1 GLN B 59 31.977 -6.341 -8.978 1.00 0.00 O ATOM 1942 NE2 GLN B 59 32.769 -4.760 -7.698 1.00 0.00 N ATOM 0 H GLN B 59 36.689 -7.741 -8.689 1.00 0.00 H new ATOM 0 HA GLN B 59 35.471 -7.231 -6.270 1.00 0.00 H new ATOM 0 HB2 GLN B 59 34.371 -8.611 -8.764 1.00 0.00 H new ATOM 0 HB3 GLN B 59 33.347 -8.062 -7.452 1.00 0.00 H new ATOM 0 HG2 GLN B 59 35.049 -5.855 -7.994 1.00 0.00 H new ATOM 0 HG3 GLN B 59 34.634 -6.487 -9.575 1.00 0.00 H new ATOM 0 HE21 GLN B 59 33.569 -4.340 -7.224 1.00 0.00 H new ATOM 0 HE22 GLN B 59 31.845 -4.336 -7.612 1.00 0.00 H new ATOM 1951 N LYS B 60 35.618 -10.469 -6.847 1.00 0.00 N ATOM 1952 CA LYS B 60 35.464 -11.793 -6.183 1.00 0.00 C ATOM 1953 C LYS B 60 36.611 -12.012 -5.192 1.00 0.00 C ATOM 1954 O LYS B 60 36.409 -12.461 -4.082 1.00 0.00 O ATOM 1955 CB LYS B 60 35.483 -12.896 -7.255 1.00 0.00 C ATOM 1956 CG LYS B 60 35.914 -14.235 -6.642 1.00 0.00 C ATOM 1957 CD LYS B 60 35.008 -15.353 -7.161 1.00 0.00 C ATOM 1958 CE LYS B 60 34.544 -16.215 -5.985 1.00 0.00 C ATOM 1959 NZ LYS B 60 33.468 -17.140 -6.438 1.00 0.00 N ATOM 0 H LYS B 60 36.003 -10.501 -7.791 1.00 0.00 H new ATOM 0 HA LYS B 60 34.519 -11.825 -5.641 1.00 0.00 H new ATOM 0 HB2 LYS B 60 34.493 -12.995 -7.700 1.00 0.00 H new ATOM 0 HB3 LYS B 60 36.167 -12.620 -8.057 1.00 0.00 H new ATOM 0 HG2 LYS B 60 36.952 -14.446 -6.898 1.00 0.00 H new ATOM 0 HG3 LYS B 60 35.858 -14.183 -5.555 1.00 0.00 H new ATOM 0 HD2 LYS B 60 34.147 -14.929 -7.678 1.00 0.00 H new ATOM 0 HD3 LYS B 60 35.545 -15.965 -7.886 1.00 0.00 H new ATOM 0 HE2 LYS B 60 35.383 -16.785 -5.585 1.00 0.00 H new ATOM 0 HE3 LYS B 60 34.176 -15.580 -5.179 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 33.154 -17.725 -5.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 32.665 -16.587 -6.800 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 33.834 -17.754 -7.193 1.00 0.00 H new ATOM 1973 N TYR B 61 37.818 -11.741 -5.601 1.00 0.00 N ATOM 1974 CA TYR B 61 38.980 -11.982 -4.696 1.00 0.00 C ATOM 1975 C TYR B 61 38.875 -11.102 -3.448 1.00 0.00 C ATOM 1976 O TYR B 61 39.533 -11.339 -2.455 1.00 0.00 O ATOM 1977 CB TYR B 61 40.286 -11.690 -5.445 1.00 0.00 C ATOM 1978 CG TYR B 61 40.253 -12.310 -6.814 1.00 0.00 C ATOM 1979 CD1 TYR B 61 39.255 -13.224 -7.167 1.00 0.00 C ATOM 1980 CD2 TYR B 61 41.224 -11.952 -7.741 1.00 0.00 C ATOM 1981 CE1 TYR B 61 39.231 -13.770 -8.440 1.00 0.00 C ATOM 1982 CE2 TYR B 61 41.199 -12.501 -9.018 1.00 0.00 C ATOM 1983 CZ TYR B 61 40.202 -13.412 -9.374 1.00 0.00 C ATOM 1984 OH TYR B 61 40.179 -13.958 -10.641 1.00 0.00 O ATOM 0 H TYR B 61 38.052 -11.364 -6.519 1.00 0.00 H new ATOM 0 HA TYR B 61 38.975 -13.026 -4.381 1.00 0.00 H new ATOM 0 HB2 TYR B 61 40.431 -10.613 -5.530 1.00 0.00 H new ATOM 0 HB3 TYR B 61 41.132 -12.083 -4.881 1.00 0.00 H new ATOM 0 HD1 TYR B 61 38.502 -13.505 -6.446 1.00 0.00 H new ATOM 0 HD2 TYR B 61 41.997 -11.248 -7.470 1.00 0.00 H new ATOM 0 HE1 TYR B 61 38.458 -14.475 -8.709 1.00 0.00 H new ATOM 0 HE2 TYR B 61 41.954 -12.222 -9.738 1.00 0.00 H new ATOM 0 HH TYR B 61 39.254 -14.162 -10.892 1.00 0.00 H new ATOM 1994 N VAL B 62 38.047 -10.100 -3.485 1.00 0.00 N ATOM 1995 CA VAL B 62 37.889 -9.215 -2.303 1.00 0.00 C ATOM 1996 C VAL B 62 36.594 -9.586 -1.572 1.00 0.00 C ATOM 1997 O VAL B 62 36.482 -9.447 -0.371 1.00 0.00 O ATOM 1998 CB VAL B 62 37.822 -7.766 -2.780 1.00 0.00 C ATOM 1999 CG1 VAL B 62 37.810 -6.824 -1.575 1.00 0.00 C ATOM 2000 CG2 VAL B 62 39.044 -7.461 -3.646 1.00 0.00 C ATOM 0 H VAL B 62 37.469 -9.855 -4.289 1.00 0.00 H new ATOM 0 HA VAL B 62 38.732 -9.335 -1.623 1.00 0.00 H new ATOM 0 HB VAL B 62 36.912 -7.620 -3.361 1.00 0.00 H new ATOM 0 HG11 VAL B 62 37.762 -5.791 -1.921 1.00 0.00 H new ATOM 0 HG12 VAL B 62 36.941 -7.039 -0.954 1.00 0.00 H new ATOM 0 HG13 VAL B 62 38.719 -6.969 -0.991 1.00 0.00 H new ATOM 0 HG21 VAL B 62 38.999 -6.427 -3.988 1.00 0.00 H new ATOM 0 HG22 VAL B 62 39.951 -7.610 -3.061 1.00 0.00 H new ATOM 0 HG23 VAL B 62 39.055 -8.128 -4.508 1.00 0.00 H new ATOM 2010 N SER B 63 35.615 -10.054 -2.301 1.00 0.00 N ATOM 2011 CA SER B 63 34.315 -10.433 -1.673 1.00 0.00 C ATOM 2012 C SER B 63 34.562 -11.222 -0.386 1.00 0.00 C ATOM 2013 O SER B 63 34.050 -10.884 0.663 1.00 0.00 O ATOM 2014 CB SER B 63 33.515 -11.299 -2.646 1.00 0.00 C ATOM 2015 OG SER B 63 32.160 -11.353 -2.222 1.00 0.00 O ATOM 0 H SER B 63 35.661 -10.191 -3.311 1.00 0.00 H new ATOM 0 HA SER B 63 33.758 -9.526 -1.437 1.00 0.00 H new ATOM 0 HB2 SER B 63 33.577 -10.887 -3.653 1.00 0.00 H new ATOM 0 HB3 SER B 63 33.936 -12.304 -2.687 1.00 0.00 H new ATOM 0 HG SER B 63 31.644 -11.906 -2.845 1.00 0.00 H new