USER MOD reduce.3.24.130724 H: found=0, std=0, add=854, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 858 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 33 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 35 LYS NZ :NH3+ -115:sc= -2.47 (180deg=-7.85!) USER MOD Single : A 3 ASN : amide:sc= -3.41 K(o=-3.4,f=-2.4!) USER MOD Single : A 5 GLN : amide:sc= -4.88! C(o=-4.9!,f=-2.9!) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.211 USER MOD Single : A 13 SER OG : rot -68:sc= -0.619 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.19) USER MOD Single : A 17 SER OG : rot -83:sc= 0.313 USER MOD Single : A 21 LYS NZ :NH3+ -160:sc= -1 (180deg=-1.65) USER MOD Single : A 27 THR OG1 : rot -140:sc= -0.297 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 33 SER OG : rot 28:sc= 1.05 USER MOD Single : A 35 LYS NZ :NH3+ -134:sc= -0.0166 (180deg=-0.432) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 62 TYR OH : rot -72:sc= -0.249 USER MOD Single : B 3 ASN : amide:sc= -2.14! K(o=-2.1!,f=0.071) USER MOD Single : B 5 GLN : amide:sc= -6.18! C(o=-6.2!,f=-6.8!) USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 170:sc= -0.0765 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 161:sc= -0.0515 (180deg=-0.521) USER MOD Single : B 16 GLN : amide:sc= -0.633 K(o=-0.63,f=-4.4!) USER MOD Single : B 17 SER OG : rot -110:sc= 0.0412 USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 THR OG1 : rot 180:sc= 0 USER MOD Single : B 29 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 TYR OH : rot 30:sc= -0.665 USER MOD ----------------------------------------------------------------- ATOM 32 N ASN A 3 -10.469 8.481 -9.375 1.00 0.00 N ATOM 33 CA ASN A 3 -9.269 8.361 -8.488 1.00 0.00 C ATOM 34 C ASN A 3 -9.515 7.271 -7.437 1.00 0.00 C ATOM 35 O ASN A 3 -8.592 6.768 -6.825 1.00 0.00 O ATOM 36 CB ASN A 3 -9.031 9.699 -7.780 1.00 0.00 C ATOM 37 CG ASN A 3 -10.148 9.954 -6.764 1.00 0.00 C ATOM 38 OD1 ASN A 3 -11.277 9.551 -6.971 1.00 0.00 O ATOM 39 ND2 ASN A 3 -9.880 10.596 -5.662 1.00 0.00 N ATOM 0 HA ASN A 3 -8.397 8.099 -9.087 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -8.064 9.688 -7.276 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -9.000 10.507 -8.511 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -10.616 10.760 -4.975 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -8.934 10.935 -5.486 1.00 0.00 H new ATOM 46 N ARG A 4 -10.752 6.922 -7.215 1.00 0.00 N ATOM 47 CA ARG A 4 -11.081 5.888 -6.198 1.00 0.00 C ATOM 48 C ARG A 4 -10.407 4.564 -6.544 1.00 0.00 C ATOM 49 O ARG A 4 -10.310 4.185 -7.694 1.00 0.00 O ATOM 50 CB ARG A 4 -12.598 5.679 -6.189 1.00 0.00 C ATOM 51 CG ARG A 4 -13.316 6.980 -5.794 1.00 0.00 C ATOM 52 CD ARG A 4 -13.330 7.140 -4.270 1.00 0.00 C ATOM 53 NE ARG A 4 -13.980 5.950 -3.652 1.00 0.00 N ATOM 54 CZ ARG A 4 -15.271 5.791 -3.745 1.00 0.00 C ATOM 55 NH1 ARG A 4 -15.990 6.652 -4.415 1.00 0.00 N ATOM 56 NH2 ARG A 4 -15.844 4.764 -3.179 1.00 0.00 N ATOM 0 H ARG A 4 -11.558 7.315 -7.702 1.00 0.00 H new ATOM 0 HA ARG A 4 -10.728 6.221 -5.222 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -12.933 5.356 -7.175 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -12.858 4.885 -5.488 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -12.814 7.833 -6.251 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -14.337 6.969 -6.174 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -12.312 7.247 -3.895 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -13.869 8.046 -3.994 1.00 0.00 H new ATOM 0 HE ARG A 4 -13.415 5.260 -3.156 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -15.542 7.449 -4.866 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -17.000 6.527 -4.487 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -15.282 4.086 -2.664 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -16.854 4.639 -3.251 1.00 0.00 H new ATOM 70 N GLN A 5 -9.945 3.851 -5.548 1.00 0.00 N ATOM 71 CA GLN A 5 -9.284 2.542 -5.810 1.00 0.00 C ATOM 72 C GLN A 5 -9.412 1.647 -4.576 1.00 0.00 C ATOM 73 O GLN A 5 -9.696 2.111 -3.484 1.00 0.00 O ATOM 74 CB GLN A 5 -7.810 2.775 -6.140 1.00 0.00 C ATOM 75 CG GLN A 5 -7.150 3.570 -5.013 1.00 0.00 C ATOM 76 CD GLN A 5 -5.773 4.043 -5.470 1.00 0.00 C ATOM 77 OE1 GLN A 5 -5.046 4.653 -4.712 1.00 0.00 O ATOM 78 NE2 GLN A 5 -5.379 3.785 -6.686 1.00 0.00 N ATOM 0 H GLN A 5 -9.998 4.121 -4.566 1.00 0.00 H new ATOM 0 HA GLN A 5 -9.766 2.050 -6.655 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -7.301 1.820 -6.271 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -7.719 3.316 -7.082 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -7.770 4.425 -4.744 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -7.057 2.950 -4.121 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -5.990 3.273 -7.322 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -4.460 4.095 -7.001 1.00 0.00 H new ATOM 87 N PHE A 6 -9.215 0.363 -4.745 1.00 0.00 N ATOM 88 CA PHE A 6 -9.333 -0.589 -3.599 1.00 0.00 C ATOM 89 C PHE A 6 -7.945 -1.057 -3.183 1.00 0.00 C ATOM 90 O PHE A 6 -7.158 -1.477 -4.005 1.00 0.00 O ATOM 91 CB PHE A 6 -10.135 -1.809 -4.053 1.00 0.00 C ATOM 92 CG PHE A 6 -11.367 -1.344 -4.778 1.00 0.00 C ATOM 93 CD1 PHE A 6 -11.256 -0.879 -6.091 1.00 0.00 C ATOM 94 CD2 PHE A 6 -12.612 -1.380 -4.145 1.00 0.00 C ATOM 95 CE1 PHE A 6 -12.395 -0.448 -6.776 1.00 0.00 C ATOM 96 CE2 PHE A 6 -13.752 -0.948 -4.829 1.00 0.00 C ATOM 97 CZ PHE A 6 -13.644 -0.482 -6.146 1.00 0.00 C ATOM 0 H PHE A 6 -8.975 -0.070 -5.637 1.00 0.00 H new ATOM 0 HA PHE A 6 -9.826 -0.094 -2.763 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -9.528 -2.436 -4.706 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -10.412 -2.419 -3.193 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -10.291 -0.853 -6.576 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -12.693 -1.741 -3.130 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -12.311 -0.089 -7.791 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -14.716 -0.973 -4.342 1.00 0.00 H new ATOM 0 HZ PHE A 6 -14.525 -0.149 -6.675 1.00 0.00 H new ATOM 107 N LEU A 7 -7.645 -1.002 -1.908 1.00 0.00 N ATOM 108 CA LEU A 7 -6.310 -1.461 -1.411 1.00 0.00 C ATOM 109 C LEU A 7 -6.495 -2.692 -0.543 1.00 0.00 C ATOM 110 O LEU A 7 -7.489 -2.863 0.131 1.00 0.00 O ATOM 111 CB LEU A 7 -5.633 -0.332 -0.612 1.00 0.00 C ATOM 112 CG LEU A 7 -4.751 0.513 -1.529 1.00 0.00 C ATOM 113 CD1 LEU A 7 -3.516 -0.287 -1.992 1.00 0.00 C ATOM 114 CD2 LEU A 7 -5.600 0.986 -2.711 1.00 0.00 C ATOM 0 H LEU A 7 -8.274 -0.655 -1.184 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.670 -1.716 -2.256 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.391 0.297 -0.145 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.032 -0.757 0.192 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.373 1.382 -0.991 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.903 0.335 -2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -2.931 -0.589 -1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -3.840 -1.174 -2.537 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -4.988 1.592 -3.379 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -5.982 0.121 -3.254 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.435 1.582 -2.344 1.00 0.00 H new ATOM 126 N SER A 8 -5.531 -3.563 -0.589 1.00 0.00 N ATOM 127 CA SER A 8 -5.612 -4.832 0.198 1.00 0.00 C ATOM 128 C SER A 8 -4.259 -5.162 0.812 1.00 0.00 C ATOM 129 O SER A 8 -3.226 -4.948 0.213 1.00 0.00 O ATOM 130 CB SER A 8 -6.022 -5.976 -0.731 1.00 0.00 C ATOM 131 OG SER A 8 -6.185 -7.162 0.036 1.00 0.00 O ATOM 0 H SER A 8 -4.681 -3.454 -1.141 1.00 0.00 H new ATOM 0 HA SER A 8 -6.347 -4.706 0.993 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.952 -5.729 -1.244 1.00 0.00 H new ATOM 0 HB3 SER A 8 -5.264 -6.126 -1.500 1.00 0.00 H new ATOM 0 HG SER A 8 -6.450 -7.899 -0.553 1.00 0.00 H new ATOM 137 N LEU A 9 -4.255 -5.696 2.006 1.00 0.00 N ATOM 138 CA LEU A 9 -2.964 -6.058 2.650 1.00 0.00 C ATOM 139 C LEU A 9 -3.193 -7.168 3.680 1.00 0.00 C ATOM 140 O LEU A 9 -4.165 -7.163 4.412 1.00 0.00 O ATOM 141 CB LEU A 9 -2.365 -4.830 3.342 1.00 0.00 C ATOM 142 CG LEU A 9 -0.880 -5.085 3.647 1.00 0.00 C ATOM 143 CD1 LEU A 9 -0.075 -5.204 2.331 1.00 0.00 C ATOM 144 CD2 LEU A 9 -0.336 -3.926 4.494 1.00 0.00 C ATOM 0 H LEU A 9 -5.089 -5.895 2.559 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.272 -6.412 1.886 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.470 -3.953 2.704 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -2.906 -4.620 4.265 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.779 -6.020 4.198 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.975 -5.384 2.562 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.464 -6.033 1.740 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.168 -4.278 1.763 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.717 -4.100 4.715 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.442 -2.992 3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.896 -3.863 5.427 1.00 0.00 H new ATOM 156 N THR A 10 -2.297 -8.123 3.741 1.00 0.00 N ATOM 157 CA THR A 10 -2.443 -9.239 4.727 1.00 0.00 C ATOM 158 C THR A 10 -1.060 -9.666 5.218 1.00 0.00 C ATOM 159 O THR A 10 -0.050 -9.313 4.641 1.00 0.00 O ATOM 160 CB THR A 10 -3.149 -10.427 4.074 1.00 0.00 C ATOM 161 OG1 THR A 10 -3.159 -11.519 4.983 1.00 0.00 O ATOM 162 CG2 THR A 10 -2.415 -10.828 2.794 1.00 0.00 C ATOM 0 H THR A 10 -1.468 -8.178 3.149 1.00 0.00 H new ATOM 0 HA THR A 10 -3.040 -8.896 5.572 1.00 0.00 H new ATOM 0 HB THR A 10 -4.173 -10.149 3.822 1.00 0.00 H new ATOM 0 HG1 THR A 10 -3.612 -12.284 4.571 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.923 -11.675 2.333 1.00 0.00 H new ATOM 0 HG22 THR A 10 -2.408 -9.988 2.100 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.389 -11.107 3.035 1.00 0.00 H new ATOM 170 N GLY A 11 -0.998 -10.409 6.292 1.00 0.00 N ATOM 171 CA GLY A 11 0.325 -10.840 6.828 1.00 0.00 C ATOM 172 C GLY A 11 0.881 -9.732 7.721 1.00 0.00 C ATOM 173 O GLY A 11 2.036 -9.748 8.100 1.00 0.00 O ATOM 0 H GLY A 11 -1.807 -10.736 6.821 1.00 0.00 H new ATOM 0 HA2 GLY A 11 0.219 -11.764 7.396 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.015 -11.046 6.009 1.00 0.00 H new ATOM 177 N VAL A 12 0.065 -8.768 8.046 1.00 0.00 N ATOM 178 CA VAL A 12 0.521 -7.637 8.900 1.00 0.00 C ATOM 179 C VAL A 12 0.840 -8.124 10.314 1.00 0.00 C ATOM 180 O VAL A 12 0.383 -9.163 10.743 1.00 0.00 O ATOM 181 CB VAL A 12 -0.590 -6.592 8.969 1.00 0.00 C ATOM 182 CG1 VAL A 12 -0.075 -5.337 9.672 1.00 0.00 C ATOM 183 CG2 VAL A 12 -1.035 -6.236 7.551 1.00 0.00 C ATOM 0 H VAL A 12 -0.910 -8.716 7.752 1.00 0.00 H new ATOM 0 HA VAL A 12 1.424 -7.206 8.467 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.434 -6.996 9.529 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -0.871 -4.594 9.719 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.244 -5.591 10.683 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.770 -4.929 9.116 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -1.828 -5.490 7.595 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -0.189 -5.833 6.994 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -1.406 -7.131 7.051 1.00 0.00 H new ATOM 193 N SER A 13 1.617 -7.364 11.042 1.00 0.00 N ATOM 194 CA SER A 13 1.964 -7.759 12.432 1.00 0.00 C ATOM 195 C SER A 13 0.749 -7.517 13.324 1.00 0.00 C ATOM 196 O SER A 13 0.297 -8.402 14.022 1.00 0.00 O ATOM 197 CB SER A 13 3.130 -6.907 12.928 1.00 0.00 C ATOM 198 OG SER A 13 2.639 -5.639 13.342 1.00 0.00 O ATOM 0 H SER A 13 2.026 -6.484 10.728 1.00 0.00 H new ATOM 0 HA SER A 13 2.249 -8.811 12.460 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.632 -7.404 13.758 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.869 -6.783 12.136 1.00 0.00 H new ATOM 0 HG SER A 13 2.320 -5.141 12.561 1.00 0.00 H new ATOM 204 N LYS A 14 0.205 -6.327 13.299 1.00 0.00 N ATOM 205 CA LYS A 14 -0.996 -6.045 14.140 1.00 0.00 C ATOM 206 C LYS A 14 -1.563 -4.668 13.785 1.00 0.00 C ATOM 207 O LYS A 14 -0.879 -3.825 13.241 1.00 0.00 O ATOM 208 CB LYS A 14 -0.620 -6.086 15.627 1.00 0.00 C ATOM 209 CG LYS A 14 0.517 -5.076 15.933 1.00 0.00 C ATOM 210 CD LYS A 14 -0.054 -3.794 16.568 1.00 0.00 C ATOM 211 CE LYS A 14 -0.285 -4.007 18.072 1.00 0.00 C ATOM 212 NZ LYS A 14 -0.764 -2.735 18.687 1.00 0.00 N ATOM 0 H LYS A 14 0.538 -5.544 12.737 1.00 0.00 H new ATOM 0 HA LYS A 14 -1.752 -6.806 13.946 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -1.494 -5.852 16.235 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.302 -7.092 15.899 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.243 -5.530 16.607 1.00 0.00 H new ATOM 0 HG3 LYS A 14 1.048 -4.828 15.014 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.635 -2.964 16.412 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.992 -3.525 16.083 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -1.018 -4.798 18.230 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.640 -4.329 18.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.920 -2.879 19.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -0.050 -1.992 18.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.656 -2.446 18.237 1.00 0.00 H new ATOM 226 N VAL A 15 -2.813 -4.441 14.078 1.00 0.00 N ATOM 227 CA VAL A 15 -3.437 -3.126 13.749 1.00 0.00 C ATOM 228 C VAL A 15 -3.131 -2.108 14.851 1.00 0.00 C ATOM 229 O VAL A 15 -3.665 -2.177 15.938 1.00 0.00 O ATOM 230 CB VAL A 15 -4.951 -3.311 13.630 1.00 0.00 C ATOM 231 CG1 VAL A 15 -5.576 -2.067 12.996 1.00 0.00 C ATOM 232 CG2 VAL A 15 -5.238 -4.529 12.751 1.00 0.00 C ATOM 0 H VAL A 15 -3.433 -5.111 14.533 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.031 -2.758 12.807 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.379 -3.461 14.621 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.654 -2.203 12.913 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.367 -1.197 13.619 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -5.153 -1.913 12.003 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.315 -4.667 12.662 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.809 -4.373 11.761 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.795 -5.416 13.203 1.00 0.00 H new ATOM 242 N GLN A 16 -2.281 -1.155 14.568 1.00 0.00 N ATOM 243 CA GLN A 16 -1.939 -0.121 15.584 1.00 0.00 C ATOM 244 C GLN A 16 -3.175 0.740 15.858 1.00 0.00 C ATOM 245 O GLN A 16 -3.468 1.081 16.987 1.00 0.00 O ATOM 246 CB GLN A 16 -0.809 0.756 15.038 1.00 0.00 C ATOM 247 CG GLN A 16 -0.320 1.717 16.125 1.00 0.00 C ATOM 248 CD GLN A 16 0.374 0.924 17.234 1.00 0.00 C ATOM 249 OE1 GLN A 16 -0.102 0.875 18.352 1.00 0.00 O ATOM 250 NE2 GLN A 16 1.490 0.299 16.971 1.00 0.00 N ATOM 0 H GLN A 16 -1.807 -1.050 13.671 1.00 0.00 H new ATOM 0 HA GLN A 16 -1.617 -0.596 16.511 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.016 0.130 14.697 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.160 1.320 14.174 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.370 2.445 15.698 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.161 2.277 16.535 1.00 0.00 H new ATOM 0 HE21 GLN A 16 1.889 0.340 16.033 1.00 0.00 H new ATOM 0 HE22 GLN A 16 1.963 -0.231 17.703 1.00 0.00 H new ATOM 259 N SER A 17 -3.902 1.091 14.830 1.00 0.00 N ATOM 260 CA SER A 17 -5.121 1.925 15.019 1.00 0.00 C ATOM 261 C SER A 17 -5.869 2.028 13.692 1.00 0.00 C ATOM 262 O SER A 17 -5.267 2.099 12.639 1.00 0.00 O ATOM 263 CB SER A 17 -4.723 3.329 15.476 1.00 0.00 C ATOM 264 OG SER A 17 -5.887 4.036 15.883 1.00 0.00 O ATOM 0 H SER A 17 -3.701 0.834 13.864 1.00 0.00 H new ATOM 0 HA SER A 17 -5.759 1.464 15.774 1.00 0.00 H new ATOM 0 HB2 SER A 17 -4.013 3.268 16.301 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.225 3.861 14.665 1.00 0.00 H new ATOM 0 HG SER A 17 -6.325 4.425 15.097 1.00 0.00 H new ATOM 270 N PHE A 18 -7.178 2.037 13.735 1.00 0.00 N ATOM 271 CA PHE A 18 -7.986 2.140 12.479 1.00 0.00 C ATOM 272 C PHE A 18 -8.989 3.286 12.618 1.00 0.00 C ATOM 273 O PHE A 18 -9.874 3.248 13.449 1.00 0.00 O ATOM 274 CB PHE A 18 -8.751 0.830 12.261 1.00 0.00 C ATOM 275 CG PHE A 18 -9.666 0.975 11.069 1.00 0.00 C ATOM 276 CD1 PHE A 18 -10.957 1.487 11.243 1.00 0.00 C ATOM 277 CD2 PHE A 18 -9.225 0.604 9.793 1.00 0.00 C ATOM 278 CE1 PHE A 18 -11.810 1.627 10.141 1.00 0.00 C ATOM 279 CE2 PHE A 18 -10.078 0.744 8.691 1.00 0.00 C ATOM 280 CZ PHE A 18 -11.369 1.255 8.865 1.00 0.00 C ATOM 0 H PHE A 18 -7.726 1.977 14.593 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.325 2.327 11.633 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -8.051 0.010 12.098 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -9.331 0.582 13.150 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -11.296 1.774 12.228 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.228 0.210 9.659 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -12.806 2.021 10.275 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -9.739 0.457 7.706 1.00 0.00 H new ATOM 0 HZ PHE A 18 -12.026 1.363 8.014 1.00 0.00 H new ATOM 290 N ASP A 19 -8.865 4.300 11.795 1.00 0.00 N ATOM 291 CA ASP A 19 -9.814 5.454 11.849 1.00 0.00 C ATOM 292 C ASP A 19 -10.271 5.774 10.418 1.00 0.00 C ATOM 293 O ASP A 19 -9.520 5.604 9.477 1.00 0.00 O ATOM 294 CB ASP A 19 -9.099 6.677 12.436 1.00 0.00 C ATOM 295 CG ASP A 19 -8.543 6.335 13.821 1.00 0.00 C ATOM 296 OD1 ASP A 19 -7.656 5.501 13.892 1.00 0.00 O ATOM 297 OD2 ASP A 19 -9.011 6.917 14.785 1.00 0.00 O ATOM 0 H ASP A 19 -8.140 4.377 11.082 1.00 0.00 H new ATOM 0 HA ASP A 19 -10.672 5.204 12.474 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.290 6.989 11.776 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -9.792 7.515 12.509 1.00 0.00 H new ATOM 302 N PRO A 20 -11.485 6.242 10.241 1.00 0.00 N ATOM 303 CA PRO A 20 -12.006 6.586 8.886 1.00 0.00 C ATOM 304 C PRO A 20 -11.269 7.798 8.313 1.00 0.00 C ATOM 305 O PRO A 20 -11.303 8.060 7.128 1.00 0.00 O ATOM 306 CB PRO A 20 -13.494 6.894 9.124 1.00 0.00 C ATOM 307 CG PRO A 20 -13.587 7.276 10.569 1.00 0.00 C ATOM 308 CD PRO A 20 -12.489 6.491 11.293 1.00 0.00 C ATOM 0 HA PRO A 20 -11.862 5.784 8.162 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -13.837 7.703 8.479 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -14.116 6.026 8.905 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -13.446 8.349 10.697 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.570 7.033 10.973 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -12.068 7.062 12.121 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -12.871 5.559 11.710 1.00 0.00 H new ATOM 316 N LYS A 21 -10.592 8.531 9.158 1.00 0.00 N ATOM 317 CA LYS A 21 -9.830 9.724 8.693 1.00 0.00 C ATOM 318 C LYS A 21 -8.358 9.345 8.521 1.00 0.00 C ATOM 319 O LYS A 21 -7.567 10.114 8.011 1.00 0.00 O ATOM 320 CB LYS A 21 -9.954 10.835 9.735 1.00 0.00 C ATOM 321 CG LYS A 21 -11.410 11.298 9.812 1.00 0.00 C ATOM 322 CD LYS A 21 -11.520 12.509 10.745 1.00 0.00 C ATOM 323 CE LYS A 21 -11.047 12.137 12.157 1.00 0.00 C ATOM 324 NZ LYS A 21 -11.483 10.751 12.493 1.00 0.00 N ATOM 0 H LYS A 21 -10.535 8.351 10.160 1.00 0.00 H new ATOM 0 HA LYS A 21 -10.230 10.071 7.740 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.624 10.474 10.709 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.308 11.672 9.469 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.771 11.559 8.817 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.040 10.487 10.177 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.919 13.331 10.357 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.552 12.858 10.780 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -9.961 12.210 12.216 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -11.454 12.841 12.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -11.470 10.624 13.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -12.448 10.595 12.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -10.836 10.067 12.052 1.00 0.00 H new ATOM 338 N GLU A 22 -7.985 8.161 8.939 1.00 0.00 N ATOM 339 CA GLU A 22 -6.566 7.720 8.800 1.00 0.00 C ATOM 340 C GLU A 22 -6.450 6.259 9.244 1.00 0.00 C ATOM 341 O GLU A 22 -7.198 5.800 10.082 1.00 0.00 O ATOM 342 CB GLU A 22 -5.661 8.599 9.683 1.00 0.00 C ATOM 343 CG GLU A 22 -4.228 8.606 9.137 1.00 0.00 C ATOM 344 CD GLU A 22 -3.581 7.239 9.368 1.00 0.00 C ATOM 345 OE1 GLU A 22 -3.931 6.596 10.343 1.00 0.00 O ATOM 346 OE2 GLU A 22 -2.748 6.857 8.563 1.00 0.00 O ATOM 0 H GLU A 22 -8.607 7.479 9.373 1.00 0.00 H new ATOM 0 HA GLU A 22 -6.254 7.815 7.760 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.050 9.617 9.715 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.665 8.224 10.707 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.235 8.840 8.072 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.644 9.383 9.630 1.00 0.00 H new ATOM 353 N ILE A 23 -5.515 5.525 8.690 1.00 0.00 N ATOM 354 CA ILE A 23 -5.344 4.086 9.083 1.00 0.00 C ATOM 355 C ILE A 23 -3.863 3.784 9.334 1.00 0.00 C ATOM 356 O ILE A 23 -3.010 4.100 8.529 1.00 0.00 O ATOM 357 CB ILE A 23 -5.867 3.191 7.957 1.00 0.00 C ATOM 358 CG1 ILE A 23 -7.382 3.372 7.842 1.00 0.00 C ATOM 359 CG2 ILE A 23 -5.539 1.727 8.264 1.00 0.00 C ATOM 360 CD1 ILE A 23 -7.881 2.680 6.574 1.00 0.00 C ATOM 0 H ILE A 23 -4.861 5.859 7.982 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.905 3.892 9.998 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.392 3.468 7.016 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -7.877 2.952 8.718 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.631 4.433 7.813 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -5.913 1.094 7.460 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -4.459 1.606 8.348 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -6.011 1.438 9.203 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.960 2.808 6.490 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.395 3.121 5.704 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.644 1.617 6.622 1.00 0.00 H new ATOM 372 N LEU A 24 -3.557 3.160 10.452 1.00 0.00 N ATOM 373 CA LEU A 24 -2.134 2.811 10.775 1.00 0.00 C ATOM 374 C LEU A 24 -1.992 1.290 10.817 1.00 0.00 C ATOM 375 O LEU A 24 -2.735 0.609 11.495 1.00 0.00 O ATOM 376 CB LEU A 24 -1.765 3.378 12.150 1.00 0.00 C ATOM 377 CG LEU A 24 -1.998 4.892 12.173 1.00 0.00 C ATOM 378 CD1 LEU A 24 -1.635 5.431 13.559 1.00 0.00 C ATOM 379 CD2 LEU A 24 -1.128 5.578 11.107 1.00 0.00 C ATOM 0 H LEU A 24 -4.237 2.877 11.157 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.476 3.232 10.015 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.365 2.898 12.923 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.721 3.159 12.374 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.046 5.100 11.957 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.798 6.508 13.584 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.261 4.951 14.311 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.587 5.217 13.769 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.302 6.654 11.133 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.076 5.376 11.310 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.388 5.192 10.121 1.00 0.00 H new ATOM 391 N LEU A 25 -1.038 0.751 10.098 1.00 0.00 N ATOM 392 CA LEU A 25 -0.830 -0.732 10.090 1.00 0.00 C ATOM 393 C LEU A 25 0.633 -1.033 10.387 1.00 0.00 C ATOM 394 O LEU A 25 1.527 -0.448 9.809 1.00 0.00 O ATOM 395 CB LEU A 25 -1.202 -1.292 8.715 1.00 0.00 C ATOM 396 CG LEU A 25 -2.704 -1.113 8.472 1.00 0.00 C ATOM 397 CD1 LEU A 25 -3.032 -1.519 7.033 1.00 0.00 C ATOM 398 CD2 LEU A 25 -3.513 -1.982 9.456 1.00 0.00 C ATOM 0 H LEU A 25 -0.390 1.278 9.512 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.459 -1.196 10.849 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.635 -0.780 7.938 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.938 -2.348 8.659 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.971 -0.068 8.630 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.100 -1.394 6.854 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.472 -0.890 6.341 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.758 -2.563 6.878 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.578 -1.845 9.272 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.252 -3.031 9.314 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.281 -1.686 10.479 1.00 0.00 H new ATOM 410 N GLU A 26 0.889 -1.950 11.285 1.00 0.00 N ATOM 411 CA GLU A 26 2.297 -2.299 11.621 1.00 0.00 C ATOM 412 C GLU A 26 2.683 -3.562 10.859 1.00 0.00 C ATOM 413 O GLU A 26 2.191 -4.640 11.140 1.00 0.00 O ATOM 414 CB GLU A 26 2.418 -2.546 13.122 1.00 0.00 C ATOM 415 CG GLU A 26 3.890 -2.735 13.484 1.00 0.00 C ATOM 416 CD GLU A 26 4.012 -3.036 14.977 1.00 0.00 C ATOM 417 OE1 GLU A 26 3.494 -4.058 15.396 1.00 0.00 O ATOM 418 OE2 GLU A 26 4.623 -2.243 15.674 1.00 0.00 O ATOM 0 H GLU A 26 0.180 -2.472 11.800 1.00 0.00 H new ATOM 0 HA GLU A 26 2.961 -1.481 11.341 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.000 -1.705 13.676 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.846 -3.430 13.404 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.317 -3.551 12.901 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.455 -1.837 13.236 1.00 0.00 H new ATOM 425 N THR A 27 3.557 -3.428 9.885 1.00 0.00 N ATOM 426 CA THR A 27 3.986 -4.609 9.072 1.00 0.00 C ATOM 427 C THR A 27 5.464 -4.913 9.331 1.00 0.00 C ATOM 428 O THR A 27 6.257 -4.028 9.594 1.00 0.00 O ATOM 429 CB THR A 27 3.792 -4.292 7.587 1.00 0.00 C ATOM 430 OG1 THR A 27 4.077 -5.451 6.817 1.00 0.00 O ATOM 431 CG2 THR A 27 4.733 -3.159 7.173 1.00 0.00 C ATOM 0 H THR A 27 3.992 -2.545 9.619 1.00 0.00 H new ATOM 0 HA THR A 27 3.387 -5.475 9.352 1.00 0.00 H new ATOM 0 HB THR A 27 2.761 -3.983 7.415 1.00 0.00 H new ATOM 0 HG1 THR A 27 4.565 -5.194 6.007 1.00 0.00 H new ATOM 0 HG21 THR A 27 4.592 -2.937 6.115 1.00 0.00 H new ATOM 0 HG22 THR A 27 4.513 -2.269 7.763 1.00 0.00 H new ATOM 0 HG23 THR A 27 5.766 -3.463 7.345 1.00 0.00 H new ATOM 439 N ILE A 28 5.823 -6.169 9.238 1.00 0.00 N ATOM 440 CA ILE A 28 7.235 -6.610 9.457 1.00 0.00 C ATOM 441 C ILE A 28 7.840 -5.903 10.679 1.00 0.00 C ATOM 442 O ILE A 28 7.913 -6.470 11.750 1.00 0.00 O ATOM 443 CB ILE A 28 8.071 -6.311 8.199 1.00 0.00 C ATOM 444 CG1 ILE A 28 7.205 -6.532 6.946 1.00 0.00 C ATOM 445 CG2 ILE A 28 9.301 -7.245 8.145 1.00 0.00 C ATOM 446 CD1 ILE A 28 6.536 -7.911 6.999 1.00 0.00 C ATOM 0 H ILE A 28 5.178 -6.927 9.013 1.00 0.00 H new ATOM 0 HA ILE A 28 7.243 -7.683 9.647 1.00 0.00 H new ATOM 0 HB ILE A 28 8.411 -5.276 8.234 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.445 -5.754 6.879 1.00 0.00 H new ATOM 0 HG13 ILE A 28 7.822 -6.453 6.051 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.886 -7.025 7.252 1.00 0.00 H new ATOM 0 HG22 ILE A 28 9.917 -7.087 9.030 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.969 -8.283 8.115 1.00 0.00 H new ATOM 0 HD11 ILE A 28 5.926 -8.054 6.107 1.00 0.00 H new ATOM 0 HD12 ILE A 28 7.302 -8.685 7.044 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.904 -7.975 7.884 1.00 0.00 H new ATOM 458 N GLN A 29 8.288 -4.681 10.528 1.00 0.00 N ATOM 459 CA GLN A 29 8.902 -3.954 11.679 1.00 0.00 C ATOM 460 C GLN A 29 8.527 -2.469 11.616 1.00 0.00 C ATOM 461 O GLN A 29 8.538 -1.775 12.613 1.00 0.00 O ATOM 462 CB GLN A 29 10.435 -4.090 11.598 1.00 0.00 C ATOM 463 CG GLN A 29 10.802 -5.431 10.956 1.00 0.00 C ATOM 464 CD GLN A 29 12.316 -5.629 11.006 1.00 0.00 C ATOM 465 OE1 GLN A 29 12.898 -5.694 12.073 1.00 0.00 O ATOM 466 NE2 GLN A 29 12.986 -5.728 9.890 1.00 0.00 N ATOM 0 H GLN A 29 8.254 -4.155 9.654 1.00 0.00 H new ATOM 0 HA GLN A 29 8.536 -4.380 12.613 1.00 0.00 H new ATOM 0 HB2 GLN A 29 10.852 -3.270 11.013 1.00 0.00 H new ATOM 0 HB3 GLN A 29 10.869 -4.023 12.596 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.302 -6.245 11.480 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.456 -5.457 9.923 1.00 0.00 H new ATOM 0 HE21 GLN A 29 12.498 -5.674 8.996 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.997 -5.860 9.912 1.00 0.00 H new ATOM 475 N GLY A 30 8.219 -1.970 10.446 1.00 0.00 N ATOM 476 CA GLY A 30 7.873 -0.522 10.309 1.00 0.00 C ATOM 477 C GLY A 30 6.364 -0.317 10.417 1.00 0.00 C ATOM 478 O GLY A 30 5.602 -1.260 10.491 1.00 0.00 O ATOM 0 H GLY A 30 8.192 -2.504 9.577 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.380 0.053 11.084 1.00 0.00 H new ATOM 0 HA3 GLY A 30 8.229 -0.147 9.349 1.00 0.00 H new ATOM 482 N VAL A 31 5.933 0.925 10.419 1.00 0.00 N ATOM 483 CA VAL A 31 4.472 1.236 10.511 1.00 0.00 C ATOM 484 C VAL A 31 4.044 1.991 9.255 1.00 0.00 C ATOM 485 O VAL A 31 4.667 2.951 8.856 1.00 0.00 O ATOM 486 CB VAL A 31 4.202 2.098 11.752 1.00 0.00 C ATOM 487 CG1 VAL A 31 2.763 2.629 11.714 1.00 0.00 C ATOM 488 CG2 VAL A 31 4.393 1.240 13.004 1.00 0.00 C ATOM 0 H VAL A 31 6.540 1.743 10.360 1.00 0.00 H new ATOM 0 HA VAL A 31 3.904 0.309 10.594 1.00 0.00 H new ATOM 0 HB VAL A 31 4.893 2.941 11.768 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.577 3.240 12.597 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.622 3.234 10.818 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.066 1.791 11.699 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.203 1.844 13.891 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.697 0.401 12.980 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.415 0.862 13.034 1.00 0.00 H new ATOM 498 N LEU A 32 2.986 1.555 8.629 1.00 0.00 N ATOM 499 CA LEU A 32 2.501 2.228 7.389 1.00 0.00 C ATOM 500 C LEU A 32 1.278 3.073 7.717 1.00 0.00 C ATOM 501 O LEU A 32 0.319 2.595 8.286 1.00 0.00 O ATOM 502 CB LEU A 32 2.135 1.153 6.359 1.00 0.00 C ATOM 503 CG LEU A 32 1.492 1.793 5.123 1.00 0.00 C ATOM 504 CD1 LEU A 32 2.404 2.893 4.557 1.00 0.00 C ATOM 505 CD2 LEU A 32 1.280 0.706 4.065 1.00 0.00 C ATOM 0 H LEU A 32 2.430 0.753 8.926 1.00 0.00 H new ATOM 0 HA LEU A 32 3.278 2.875 6.983 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.028 0.601 6.067 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.447 0.434 6.803 1.00 0.00 H new ATOM 0 HG LEU A 32 0.538 2.242 5.399 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.935 3.339 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.561 3.661 5.314 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.364 2.460 4.275 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.823 1.145 3.178 1.00 0.00 H new ATOM 0 HD22 LEU A 32 2.241 0.266 3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.625 -0.068 4.465 1.00 0.00 H new ATOM 517 N SER A 33 1.309 4.335 7.361 1.00 0.00 N ATOM 518 CA SER A 33 0.155 5.241 7.643 1.00 0.00 C ATOM 519 C SER A 33 -0.488 5.663 6.324 1.00 0.00 C ATOM 520 O SER A 33 0.177 6.133 5.421 1.00 0.00 O ATOM 521 CB SER A 33 0.656 6.481 8.385 1.00 0.00 C ATOM 522 OG SER A 33 -0.418 7.401 8.541 1.00 0.00 O ATOM 0 H SER A 33 2.093 4.778 6.883 1.00 0.00 H new ATOM 0 HA SER A 33 -0.580 4.721 8.257 1.00 0.00 H new ATOM 0 HB2 SER A 33 1.054 6.200 9.360 1.00 0.00 H new ATOM 0 HB3 SER A 33 1.471 6.946 7.831 1.00 0.00 H new ATOM 0 HG SER A 33 -1.267 6.912 8.560 1.00 0.00 H new ATOM 528 N ILE A 34 -1.781 5.496 6.208 1.00 0.00 N ATOM 529 CA ILE A 34 -2.496 5.878 4.954 1.00 0.00 C ATOM 530 C ILE A 34 -3.314 7.142 5.213 1.00 0.00 C ATOM 531 O ILE A 34 -4.049 7.223 6.180 1.00 0.00 O ATOM 532 CB ILE A 34 -3.438 4.741 4.550 1.00 0.00 C ATOM 533 CG1 ILE A 34 -2.617 3.477 4.293 1.00 0.00 C ATOM 534 CG2 ILE A 34 -4.198 5.126 3.278 1.00 0.00 C ATOM 535 CD1 ILE A 34 -3.559 2.286 4.117 1.00 0.00 C ATOM 0 H ILE A 34 -2.378 5.107 6.938 1.00 0.00 H new ATOM 0 HA ILE A 34 -1.777 6.061 4.156 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.153 4.558 5.352 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -2.003 3.604 3.401 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -1.937 3.297 5.125 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.867 4.314 2.994 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.780 6.029 3.461 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -3.488 5.310 2.472 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -2.975 1.384 3.934 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.154 2.156 5.021 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -4.221 2.468 3.270 1.00 0.00 H new ATOM 547 N LYS A 35 -3.185 8.129 4.356 1.00 0.00 N ATOM 548 CA LYS A 35 -3.945 9.405 4.535 1.00 0.00 C ATOM 549 C LYS A 35 -4.757 9.693 3.275 1.00 0.00 C ATOM 550 O LYS A 35 -4.292 9.516 2.166 1.00 0.00 O ATOM 551 CB LYS A 35 -2.961 10.550 4.774 1.00 0.00 C ATOM 552 CG LYS A 35 -2.294 10.365 6.135 1.00 0.00 C ATOM 553 CD LYS A 35 -1.285 11.486 6.373 1.00 0.00 C ATOM 554 CE LYS A 35 -0.580 11.250 7.709 1.00 0.00 C ATOM 555 NZ LYS A 35 -1.564 11.387 8.821 1.00 0.00 N ATOM 0 H LYS A 35 -2.581 8.103 3.535 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.616 9.313 5.389 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.208 10.568 3.986 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.482 11.507 4.739 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.047 10.368 6.923 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.793 9.398 6.176 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -0.556 11.514 5.563 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -1.791 12.452 6.380 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.132 10.256 7.726 1.00 0.00 H new ATOM 0 HE3 LYS A 35 0.231 11.967 7.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.155 11.974 9.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.431 11.837 8.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.793 10.446 9.200 1.00 0.00 H new ATOM 569 N GLY A 36 -5.969 10.141 3.441 1.00 0.00 N ATOM 570 CA GLY A 36 -6.824 10.443 2.263 1.00 0.00 C ATOM 571 C GLY A 36 -8.245 10.723 2.743 1.00 0.00 C ATOM 572 O GLY A 36 -8.445 11.290 3.800 1.00 0.00 O ATOM 0 H GLY A 36 -6.405 10.312 4.347 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.432 11.305 1.723 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.819 9.603 1.568 1.00 0.00 H new ATOM 576 N GLU A 37 -9.237 10.333 1.981 1.00 0.00 N ATOM 577 CA GLU A 37 -10.655 10.577 2.395 1.00 0.00 C ATOM 578 C GLU A 37 -11.463 9.294 2.181 1.00 0.00 C ATOM 579 O GLU A 37 -11.229 8.558 1.246 1.00 0.00 O ATOM 580 CB GLU A 37 -11.247 11.708 1.541 1.00 0.00 C ATOM 581 CG GLU A 37 -10.214 12.829 1.370 1.00 0.00 C ATOM 582 CD GLU A 37 -9.878 13.431 2.735 1.00 0.00 C ATOM 583 OE1 GLU A 37 -10.693 13.304 3.636 1.00 0.00 O ATOM 584 OE2 GLU A 37 -8.805 13.997 2.863 1.00 0.00 O ATOM 0 H GLU A 37 -9.126 9.855 1.087 1.00 0.00 H new ATOM 0 HA GLU A 37 -10.692 10.863 3.446 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -11.543 11.322 0.565 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -12.147 12.100 2.015 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.311 12.437 0.902 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.606 13.601 0.708 1.00 0.00 H new ATOM 591 N LYS A 38 -12.410 9.019 3.044 1.00 0.00 N ATOM 592 CA LYS A 38 -13.235 7.784 2.901 1.00 0.00 C ATOM 593 C LYS A 38 -12.321 6.560 2.917 1.00 0.00 C ATOM 594 O LYS A 38 -12.306 5.765 1.999 1.00 0.00 O ATOM 595 CB LYS A 38 -14.020 7.839 1.585 1.00 0.00 C ATOM 596 CG LYS A 38 -14.793 9.162 1.495 1.00 0.00 C ATOM 597 CD LYS A 38 -15.845 9.236 2.608 1.00 0.00 C ATOM 598 CE LYS A 38 -16.841 10.356 2.299 1.00 0.00 C ATOM 599 NZ LYS A 38 -17.895 10.380 3.352 1.00 0.00 N ATOM 0 H LYS A 38 -12.647 9.603 3.846 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.940 7.715 3.730 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.338 7.748 0.740 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.712 6.999 1.528 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.103 10.002 1.580 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.276 9.244 0.521 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.368 8.283 2.692 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.362 9.420 3.568 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -16.326 11.316 2.261 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -17.292 10.197 1.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.574 11.140 3.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -18.392 9.466 3.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.456 10.550 4.279 1.00 0.00 H new ATOM 613 N LEU A 39 -11.563 6.410 3.972 1.00 0.00 N ATOM 614 CA LEU A 39 -10.634 5.247 4.099 1.00 0.00 C ATOM 615 C LEU A 39 -11.322 4.146 4.905 1.00 0.00 C ATOM 616 O LEU A 39 -10.995 3.907 6.051 1.00 0.00 O ATOM 617 CB LEU A 39 -9.359 5.710 4.819 1.00 0.00 C ATOM 618 CG LEU A 39 -8.420 6.376 3.811 1.00 0.00 C ATOM 619 CD1 LEU A 39 -9.169 7.484 3.068 1.00 0.00 C ATOM 620 CD2 LEU A 39 -7.217 6.974 4.545 1.00 0.00 C ATOM 0 H LEU A 39 -11.548 7.054 4.763 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.373 4.859 3.115 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -9.612 6.410 5.615 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.864 4.860 5.288 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.072 5.631 3.096 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.499 7.958 2.350 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.022 7.056 2.541 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.520 8.228 3.783 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -6.550 7.448 3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.562 7.718 5.264 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.681 6.183 5.070 1.00 0.00 H new ATOM 632 N GLY A 40 -12.279 3.482 4.320 1.00 0.00 N ATOM 633 CA GLY A 40 -12.991 2.404 5.060 1.00 0.00 C ATOM 634 C GLY A 40 -13.972 1.697 4.122 1.00 0.00 C ATOM 635 O GLY A 40 -13.576 1.089 3.142 1.00 0.00 O ATOM 0 H GLY A 40 -12.598 3.639 3.364 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -12.273 1.687 5.458 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -13.526 2.826 5.911 1.00 0.00 H new ATOM 697 N GLN A 50 -8.348 -11.296 5.510 1.00 0.00 N ATOM 698 CA GLN A 50 -7.544 -10.240 4.820 1.00 0.00 C ATOM 699 C GLN A 50 -8.140 -8.869 5.128 1.00 0.00 C ATOM 700 O GLN A 50 -9.276 -8.760 5.539 1.00 0.00 O ATOM 701 CB GLN A 50 -7.580 -10.483 3.311 1.00 0.00 C ATOM 702 CG GLN A 50 -6.842 -11.784 2.997 1.00 0.00 C ATOM 703 CD GLN A 50 -6.866 -12.034 1.492 1.00 0.00 C ATOM 704 OE1 GLN A 50 -7.343 -11.210 0.735 1.00 0.00 O ATOM 705 NE2 GLN A 50 -6.370 -13.143 1.022 1.00 0.00 N ATOM 0 HA GLN A 50 -6.513 -10.276 5.171 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -8.612 -10.543 2.964 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -7.114 -9.650 2.785 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.812 -11.724 3.350 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -7.311 -12.616 3.522 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -5.970 -13.833 1.658 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.381 -13.321 0.018 1.00 0.00 H new ATOM 714 N VAL A 51 -7.376 -7.821 4.938 1.00 0.00 N ATOM 715 CA VAL A 51 -7.884 -6.445 5.225 1.00 0.00 C ATOM 716 C VAL A 51 -7.981 -5.669 3.912 1.00 0.00 C ATOM 717 O VAL A 51 -7.067 -5.671 3.113 1.00 0.00 O ATOM 718 CB VAL A 51 -6.900 -5.742 6.167 1.00 0.00 C ATOM 719 CG1 VAL A 51 -7.241 -4.251 6.260 1.00 0.00 C ATOM 720 CG2 VAL A 51 -7.001 -6.377 7.555 1.00 0.00 C ATOM 0 H VAL A 51 -6.417 -7.861 4.594 1.00 0.00 H new ATOM 0 HA VAL A 51 -8.867 -6.494 5.693 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.886 -5.850 5.782 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -6.538 -3.758 6.931 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.175 -3.800 5.270 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.254 -4.133 6.645 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.304 -5.883 8.233 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.017 -6.264 7.934 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.754 -7.437 7.489 1.00 0.00 H new ATOM 730 N GLU A 52 -9.094 -5.017 3.684 1.00 0.00 N ATOM 731 CA GLU A 52 -9.284 -4.235 2.424 1.00 0.00 C ATOM 732 C GLU A 52 -9.674 -2.806 2.778 1.00 0.00 C ATOM 733 O GLU A 52 -10.431 -2.568 3.693 1.00 0.00 O ATOM 734 CB GLU A 52 -10.404 -4.876 1.597 1.00 0.00 C ATOM 735 CG GLU A 52 -10.511 -4.183 0.233 1.00 0.00 C ATOM 736 CD GLU A 52 -11.211 -2.828 0.387 1.00 0.00 C ATOM 737 OE1 GLU A 52 -12.040 -2.708 1.273 1.00 0.00 O ATOM 738 OE2 GLU A 52 -10.900 -1.932 -0.381 1.00 0.00 O ATOM 0 H GLU A 52 -9.887 -4.993 4.324 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.359 -4.232 1.848 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.203 -5.939 1.460 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.352 -4.797 2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.517 -4.042 -0.191 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -11.068 -4.812 -0.461 1.00 0.00 H new ATOM 745 N VAL A 53 -9.161 -1.849 2.048 1.00 0.00 N ATOM 746 CA VAL A 53 -9.500 -0.419 2.317 1.00 0.00 C ATOM 747 C VAL A 53 -9.895 0.245 1.002 1.00 0.00 C ATOM 748 O VAL A 53 -9.227 0.089 0.000 1.00 0.00 O ATOM 749 CB VAL A 53 -8.280 0.293 2.906 1.00 0.00 C ATOM 750 CG1 VAL A 53 -8.534 1.802 2.947 1.00 0.00 C ATOM 751 CG2 VAL A 53 -8.039 -0.223 4.323 1.00 0.00 C ATOM 0 H VAL A 53 -8.517 -1.998 1.271 1.00 0.00 H new ATOM 0 HA VAL A 53 -10.325 -0.358 3.026 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.405 0.095 2.287 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.664 2.306 3.367 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.713 2.168 1.936 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.406 2.007 3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -7.171 0.279 4.750 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.915 -0.020 4.938 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.858 -1.297 4.293 1.00 0.00 H new ATOM 761 N GLU A 54 -10.975 0.986 0.998 1.00 0.00 N ATOM 762 CA GLU A 54 -11.424 1.672 -0.248 1.00 0.00 C ATOM 763 C GLU A 54 -11.392 3.179 -0.009 1.00 0.00 C ATOM 764 O GLU A 54 -11.700 3.655 1.070 1.00 0.00 O ATOM 765 CB GLU A 54 -12.852 1.222 -0.569 1.00 0.00 C ATOM 766 CG GLU A 54 -13.440 2.081 -1.691 1.00 0.00 C ATOM 767 CD GLU A 54 -12.532 2.010 -2.920 1.00 0.00 C ATOM 768 OE1 GLU A 54 -11.942 0.964 -3.137 1.00 0.00 O ATOM 769 OE2 GLU A 54 -12.450 2.999 -3.628 1.00 0.00 O ATOM 0 H GLU A 54 -11.568 1.145 1.812 1.00 0.00 H new ATOM 0 HA GLU A 54 -10.771 1.422 -1.084 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.852 0.173 -0.867 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -13.474 1.300 0.322 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -14.441 1.731 -1.945 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -13.539 3.114 -1.358 1.00 0.00 H new ATOM 776 N GLY A 55 -11.021 3.933 -1.011 1.00 0.00 N ATOM 777 CA GLY A 55 -10.969 5.417 -0.846 1.00 0.00 C ATOM 778 C GLY A 55 -9.896 5.994 -1.766 1.00 0.00 C ATOM 779 O GLY A 55 -9.328 5.298 -2.589 1.00 0.00 O ATOM 0 H GLY A 55 -10.753 3.588 -1.933 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.939 5.854 -1.082 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.749 5.671 0.191 1.00 0.00 H new ATOM 783 N LEU A 56 -9.620 7.270 -1.636 1.00 0.00 N ATOM 784 CA LEU A 56 -8.580 7.925 -2.494 1.00 0.00 C ATOM 785 C LEU A 56 -7.364 8.275 -1.633 1.00 0.00 C ATOM 786 O LEU A 56 -7.481 8.924 -0.614 1.00 0.00 O ATOM 787 CB LEU A 56 -9.154 9.205 -3.122 1.00 0.00 C ATOM 788 CG LEU A 56 -10.006 9.992 -2.092 1.00 0.00 C ATOM 789 CD1 LEU A 56 -9.901 11.498 -2.367 1.00 0.00 C ATOM 790 CD2 LEU A 56 -11.484 9.586 -2.195 1.00 0.00 C ATOM 0 H LEU A 56 -10.074 7.891 -0.967 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.281 7.242 -3.289 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.341 9.834 -3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.767 8.948 -3.986 1.00 0.00 H new ATOM 0 HG LEU A 56 -9.629 9.762 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.502 12.043 -1.639 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.860 11.811 -2.285 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.266 11.711 -3.372 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.067 10.148 -1.465 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.852 9.803 -3.198 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -11.583 8.519 -1.995 1.00 0.00 H new ATOM 802 N ILE A 57 -6.195 7.854 -2.032 1.00 0.00 N ATOM 803 CA ILE A 57 -4.977 8.168 -1.229 1.00 0.00 C ATOM 804 C ILE A 57 -4.445 9.545 -1.624 1.00 0.00 C ATOM 805 O ILE A 57 -4.075 9.781 -2.755 1.00 0.00 O ATOM 806 CB ILE A 57 -3.914 7.107 -1.506 1.00 0.00 C ATOM 807 CG1 ILE A 57 -4.409 5.761 -0.972 1.00 0.00 C ATOM 808 CG2 ILE A 57 -2.604 7.491 -0.814 1.00 0.00 C ATOM 809 CD1 ILE A 57 -3.496 4.642 -1.473 1.00 0.00 C ATOM 0 H ILE A 57 -6.030 7.307 -2.877 1.00 0.00 H new ATOM 0 HA ILE A 57 -5.224 8.172 -0.167 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.735 7.035 -2.579 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -4.421 5.773 0.118 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -5.433 5.583 -1.300 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.850 6.730 -1.015 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.260 8.453 -1.194 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.768 7.564 0.261 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.851 3.685 -1.091 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.506 4.624 -2.563 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.479 4.818 -1.123 1.00 0.00 H new ATOM 821 N ASP A 58 -4.402 10.459 -0.687 1.00 0.00 N ATOM 822 CA ASP A 58 -3.890 11.829 -0.984 1.00 0.00 C ATOM 823 C ASP A 58 -2.438 11.922 -0.528 1.00 0.00 C ATOM 824 O ASP A 58 -1.699 12.783 -0.961 1.00 0.00 O ATOM 825 CB ASP A 58 -4.733 12.853 -0.224 1.00 0.00 C ATOM 826 CG ASP A 58 -6.213 12.595 -0.511 1.00 0.00 C ATOM 827 OD1 ASP A 58 -6.499 11.939 -1.499 1.00 0.00 O ATOM 828 OD2 ASP A 58 -7.035 13.054 0.264 1.00 0.00 O ATOM 0 H ASP A 58 -4.702 10.312 0.277 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.952 12.030 -2.053 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.539 12.780 0.846 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -4.462 13.864 -0.529 1.00 0.00 H new ATOM 833 N ALA A 59 -2.020 11.040 0.344 1.00 0.00 N ATOM 834 CA ALA A 59 -0.612 11.085 0.817 1.00 0.00 C ATOM 835 C ALA A 59 -0.275 9.808 1.590 1.00 0.00 C ATOM 836 O ALA A 59 -1.138 9.166 2.157 1.00 0.00 O ATOM 837 CB ALA A 59 -0.417 12.291 1.734 1.00 0.00 C ATOM 0 H ALA A 59 -2.592 10.297 0.744 1.00 0.00 H new ATOM 0 HA ALA A 59 0.047 11.168 -0.048 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.616 12.322 2.080 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.644 13.205 1.186 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.084 12.207 2.592 1.00 0.00 H new ATOM 843 N LEU A 60 0.985 9.444 1.625 1.00 0.00 N ATOM 844 CA LEU A 60 1.412 8.220 2.375 1.00 0.00 C ATOM 845 C LEU A 60 2.635 8.559 3.220 1.00 0.00 C ATOM 846 O LEU A 60 3.521 9.268 2.786 1.00 0.00 O ATOM 847 CB LEU A 60 1.774 7.095 1.385 1.00 0.00 C ATOM 848 CG LEU A 60 0.505 6.359 0.927 1.00 0.00 C ATOM 849 CD1 LEU A 60 0.766 5.668 -0.414 1.00 0.00 C ATOM 850 CD2 LEU A 60 0.103 5.293 1.963 1.00 0.00 C ATOM 0 H LEU A 60 1.742 9.947 1.162 1.00 0.00 H new ATOM 0 HA LEU A 60 0.596 7.884 3.014 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.291 7.514 0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.460 6.392 1.858 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.300 7.087 0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -0.135 5.147 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 60 1.041 6.414 -1.160 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.579 4.951 -0.302 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.797 4.779 1.626 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.912 4.571 2.075 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -0.091 5.773 2.922 1.00 0.00 H new ATOM 862 N VAL A 61 2.690 8.057 4.426 1.00 0.00 N ATOM 863 CA VAL A 61 3.859 8.344 5.307 1.00 0.00 C ATOM 864 C VAL A 61 4.332 7.053 5.977 1.00 0.00 C ATOM 865 O VAL A 61 3.596 6.398 6.687 1.00 0.00 O ATOM 866 CB VAL A 61 3.443 9.359 6.376 1.00 0.00 C ATOM 867 CG1 VAL A 61 4.535 9.470 7.444 1.00 0.00 C ATOM 868 CG2 VAL A 61 3.234 10.724 5.715 1.00 0.00 C ATOM 0 H VAL A 61 1.974 7.459 4.839 1.00 0.00 H new ATOM 0 HA VAL A 61 4.675 8.753 4.711 1.00 0.00 H new ATOM 0 HB VAL A 61 2.517 9.030 6.848 1.00 0.00 H new ATOM 0 HG11 VAL A 61 4.232 10.194 8.201 1.00 0.00 H new ATOM 0 HG12 VAL A 61 4.686 8.497 7.912 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.465 9.798 6.980 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.938 11.452 6.470 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.163 11.047 5.245 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.453 10.646 4.959 1.00 0.00 H new ATOM 878 N TYR A 62 5.575 6.706 5.774 1.00 0.00 N ATOM 879 CA TYR A 62 6.152 5.486 6.404 1.00 0.00 C ATOM 880 C TYR A 62 7.543 5.881 6.929 1.00 0.00 C ATOM 881 O TYR A 62 8.245 6.633 6.280 1.00 0.00 O ATOM 882 CB TYR A 62 6.264 4.374 5.353 1.00 0.00 C ATOM 883 CG TYR A 62 7.105 3.243 5.890 1.00 0.00 C ATOM 884 CD1 TYR A 62 8.499 3.346 5.874 1.00 0.00 C ATOM 885 CD2 TYR A 62 6.493 2.089 6.401 1.00 0.00 C ATOM 886 CE1 TYR A 62 9.286 2.300 6.369 1.00 0.00 C ATOM 887 CE2 TYR A 62 7.280 1.043 6.897 1.00 0.00 C ATOM 888 CZ TYR A 62 8.677 1.150 6.883 1.00 0.00 C ATOM 889 OH TYR A 62 9.455 0.119 7.372 1.00 0.00 O ATOM 0 H TYR A 62 6.226 7.228 5.187 1.00 0.00 H new ATOM 0 HA TYR A 62 5.527 5.114 7.216 1.00 0.00 H new ATOM 0 HB2 TYR A 62 5.271 4.008 5.091 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.710 4.768 4.440 1.00 0.00 H new ATOM 0 HD1 TYR A 62 8.969 4.234 5.479 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.416 2.008 6.412 1.00 0.00 H new ATOM 0 HE1 TYR A 62 10.363 2.380 6.354 1.00 0.00 H new ATOM 0 HE2 TYR A 62 6.810 0.154 7.290 1.00 0.00 H new ATOM 0 HH TYR A 62 9.887 -0.347 6.626 1.00 0.00 H new ATOM 899 N PRO A 63 7.947 5.426 8.095 1.00 0.00 N ATOM 900 CA PRO A 63 9.272 5.809 8.664 1.00 0.00 C ATOM 901 C PRO A 63 10.433 5.368 7.774 1.00 0.00 C ATOM 902 O PRO A 63 10.993 4.304 7.931 1.00 0.00 O ATOM 903 CB PRO A 63 9.313 5.126 10.041 1.00 0.00 C ATOM 904 CG PRO A 63 8.281 4.040 9.981 1.00 0.00 C ATOM 905 CD PRO A 63 7.215 4.511 8.989 1.00 0.00 C ATOM 0 HA PRO A 63 9.383 6.891 8.739 1.00 0.00 H new ATOM 0 HB2 PRO A 63 10.302 4.716 10.247 1.00 0.00 H new ATOM 0 HB3 PRO A 63 9.090 5.836 10.838 1.00 0.00 H new ATOM 0 HG2 PRO A 63 8.726 3.099 9.656 1.00 0.00 H new ATOM 0 HG3 PRO A 63 7.845 3.863 10.964 1.00 0.00 H new ATOM 0 HD2 PRO A 63 6.783 3.675 8.439 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.394 5.018 9.495 1.00 0.00 H new ATOM 913 N LEU A 64 10.787 6.205 6.840 1.00 0.00 N ATOM 914 CA LEU A 64 11.907 5.900 5.904 1.00 0.00 C ATOM 915 C LEU A 64 13.171 6.611 6.378 1.00 0.00 C ATOM 916 O LEU A 64 14.167 6.647 5.681 1.00 0.00 O ATOM 917 CB LEU A 64 11.534 6.391 4.497 1.00 0.00 C ATOM 918 CG LEU A 64 11.648 7.929 4.381 1.00 0.00 C ATOM 919 CD1 LEU A 64 11.084 8.387 3.034 1.00 0.00 C ATOM 920 CD2 LEU A 64 10.869 8.619 5.507 1.00 0.00 C ATOM 0 H LEU A 64 10.338 7.107 6.682 1.00 0.00 H new ATOM 0 HA LEU A 64 12.087 4.825 5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.187 5.921 3.762 1.00 0.00 H new ATOM 0 HB3 LEU A 64 10.515 6.082 4.262 1.00 0.00 H new ATOM 0 HG LEU A 64 12.701 8.201 4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.166 9.471 2.955 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.648 7.921 2.226 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.036 8.096 2.960 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.963 9.700 5.405 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.817 8.339 5.446 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.272 8.309 6.471 1.00 0.00 H new ATOM 1082 N ASN B 3 6.284 -12.687 7.174 1.00 0.00 N ATOM 1083 CA ASN B 3 6.512 -11.314 6.642 1.00 0.00 C ATOM 1084 C ASN B 3 6.000 -11.216 5.205 1.00 0.00 C ATOM 1085 O ASN B 3 6.078 -10.174 4.587 1.00 0.00 O ATOM 1086 CB ASN B 3 8.013 -11.011 6.655 1.00 0.00 C ATOM 1087 CG ASN B 3 8.770 -12.168 6.011 1.00 0.00 C ATOM 1088 OD1 ASN B 3 8.419 -13.318 6.195 1.00 0.00 O ATOM 1089 ND2 ASN B 3 9.796 -11.912 5.251 1.00 0.00 N ATOM 0 HA ASN B 3 5.977 -10.598 7.266 1.00 0.00 H new ATOM 0 HB2 ASN B 3 8.213 -10.086 6.115 1.00 0.00 H new ATOM 0 HB3 ASN B 3 8.356 -10.863 7.679 1.00 0.00 H new ATOM 0 HD21 ASN B 3 10.307 -12.676 4.809 1.00 0.00 H new ATOM 0 HD22 ASN B 3 10.089 -10.947 5.098 1.00 0.00 H new ATOM 1096 N ARG B 4 5.485 -12.285 4.663 1.00 0.00 N ATOM 1097 CA ARG B 4 4.982 -12.234 3.262 1.00 0.00 C ATOM 1098 C ARG B 4 3.596 -11.587 3.238 1.00 0.00 C ATOM 1099 O ARG B 4 2.770 -11.842 4.092 1.00 0.00 O ATOM 1100 CB ARG B 4 4.885 -13.661 2.705 1.00 0.00 C ATOM 1101 CG ARG B 4 6.246 -14.372 2.813 1.00 0.00 C ATOM 1102 CD ARG B 4 7.182 -13.908 1.689 1.00 0.00 C ATOM 1103 NE ARG B 4 6.581 -14.256 0.367 1.00 0.00 N ATOM 1104 CZ ARG B 4 6.857 -15.399 -0.215 1.00 0.00 C ATOM 1105 NH1 ARG B 4 7.675 -16.249 0.351 1.00 0.00 N ATOM 1106 NH2 ARG B 4 6.311 -15.695 -1.362 1.00 0.00 N ATOM 0 H ARG B 4 5.391 -13.188 5.128 1.00 0.00 H new ATOM 0 HA ARG B 4 5.668 -11.646 2.652 1.00 0.00 H new ATOM 0 HB2 ARG B 4 4.129 -14.222 3.255 1.00 0.00 H new ATOM 0 HB3 ARG B 4 4.565 -13.631 1.664 1.00 0.00 H new ATOM 0 HG2 ARG B 4 6.698 -14.161 3.782 1.00 0.00 H new ATOM 0 HG3 ARG B 4 6.105 -15.451 2.756 1.00 0.00 H new ATOM 0 HD2 ARG B 4 7.343 -12.832 1.756 1.00 0.00 H new ATOM 0 HD3 ARG B 4 8.157 -14.383 1.794 1.00 0.00 H new ATOM 0 HE ARG B 4 5.949 -13.598 -0.089 1.00 0.00 H new ATOM 0 HH11 ARG B 4 8.102 -16.025 1.250 1.00 0.00 H new ATOM 0 HH12 ARG B 4 7.886 -17.136 -0.106 1.00 0.00 H new ATOM 0 HH21 ARG B 4 5.670 -15.038 -1.806 1.00 0.00 H new ATOM 0 HH22 ARG B 4 6.525 -16.584 -1.815 1.00 0.00 H new ATOM 1120 N GLN B 5 3.331 -10.747 2.269 1.00 0.00 N ATOM 1121 CA GLN B 5 1.991 -10.085 2.195 1.00 0.00 C ATOM 1122 C GLN B 5 1.618 -9.837 0.734 1.00 0.00 C ATOM 1123 O GLN B 5 2.468 -9.793 -0.133 1.00 0.00 O ATOM 1124 CB GLN B 5 2.042 -8.753 2.945 1.00 0.00 C ATOM 1125 CG GLN B 5 3.166 -7.890 2.375 1.00 0.00 C ATOM 1126 CD GLN B 5 3.299 -6.621 3.212 1.00 0.00 C ATOM 1127 OE1 GLN B 5 4.365 -6.044 3.302 1.00 0.00 O ATOM 1128 NE2 GLN B 5 2.253 -6.160 3.838 1.00 0.00 N ATOM 0 H GLN B 5 3.983 -10.491 1.527 1.00 0.00 H new ATOM 0 HA GLN B 5 1.241 -10.732 2.651 1.00 0.00 H new ATOM 0 HB2 GLN B 5 1.088 -8.234 2.852 1.00 0.00 H new ATOM 0 HB3 GLN B 5 2.207 -8.928 4.008 1.00 0.00 H new ATOM 0 HG2 GLN B 5 4.105 -8.444 2.381 1.00 0.00 H new ATOM 0 HG3 GLN B 5 2.954 -7.635 1.337 1.00 0.00 H new ATOM 0 HE21 GLN B 5 1.359 -6.645 3.762 1.00 0.00 H new ATOM 0 HE22 GLN B 5 2.329 -5.315 4.404 1.00 0.00 H new ATOM 1137 N PHE B 6 0.345 -9.677 0.455 1.00 0.00 N ATOM 1138 CA PHE B 6 -0.110 -9.433 -0.948 1.00 0.00 C ATOM 1139 C PHE B 6 -0.694 -8.026 -1.044 1.00 0.00 C ATOM 1140 O PHE B 6 -1.463 -7.603 -0.206 1.00 0.00 O ATOM 1141 CB PHE B 6 -1.188 -10.460 -1.314 1.00 0.00 C ATOM 1142 CG PHE B 6 -0.758 -11.844 -0.868 1.00 0.00 C ATOM 1143 CD1 PHE B 6 0.538 -12.317 -1.139 1.00 0.00 C ATOM 1144 CD2 PHE B 6 -1.661 -12.659 -0.170 1.00 0.00 C ATOM 1145 CE1 PHE B 6 0.921 -13.594 -0.715 1.00 0.00 C ATOM 1146 CE2 PHE B 6 -1.275 -13.935 0.252 1.00 0.00 C ATOM 1147 CZ PHE B 6 0.014 -14.403 -0.020 1.00 0.00 C ATOM 0 H PHE B 6 -0.403 -9.706 1.148 1.00 0.00 H new ATOM 0 HA PHE B 6 0.732 -9.529 -1.634 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -2.132 -10.193 -0.840 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -1.359 -10.452 -2.391 1.00 0.00 H new ATOM 0 HD1 PHE B 6 1.239 -11.694 -1.675 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -2.657 -12.300 0.042 1.00 0.00 H new ATOM 0 HE1 PHE B 6 1.917 -13.956 -0.924 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -1.974 -14.560 0.789 1.00 0.00 H new ATOM 0 HZ PHE B 6 0.310 -15.389 0.306 1.00 0.00 H new ATOM 1157 N LEU B 7 -0.322 -7.298 -2.065 1.00 0.00 N ATOM 1158 CA LEU B 7 -0.830 -5.904 -2.251 1.00 0.00 C ATOM 1159 C LEU B 7 -1.654 -5.850 -3.533 1.00 0.00 C ATOM 1160 O LEU B 7 -1.383 -6.556 -4.483 1.00 0.00 O ATOM 1161 CB LEU B 7 0.375 -4.949 -2.356 1.00 0.00 C ATOM 1162 CG LEU B 7 0.802 -4.473 -0.958 1.00 0.00 C ATOM 1163 CD1 LEU B 7 2.278 -4.065 -0.971 1.00 0.00 C ATOM 1164 CD2 LEU B 7 -0.045 -3.263 -0.540 1.00 0.00 C ATOM 0 H LEU B 7 0.322 -7.615 -2.789 1.00 0.00 H new ATOM 0 HA LEU B 7 -1.454 -5.606 -1.409 1.00 0.00 H new ATOM 0 HB2 LEU B 7 1.207 -5.455 -2.845 1.00 0.00 H new ATOM 0 HB3 LEU B 7 0.115 -4.091 -2.976 1.00 0.00 H new ATOM 0 HG LEU B 7 0.655 -5.289 -0.251 1.00 0.00 H new ATOM 0 HD11 LEU B 7 2.571 -3.729 0.024 1.00 0.00 H new ATOM 0 HD12 LEU B 7 2.889 -4.920 -1.260 1.00 0.00 H new ATOM 0 HD13 LEU B 7 2.425 -3.255 -1.685 1.00 0.00 H new ATOM 0 HD21 LEU B 7 0.261 -2.929 0.451 1.00 0.00 H new ATOM 0 HD22 LEU B 7 0.099 -2.454 -1.256 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -1.098 -3.546 -0.518 1.00 0.00 H new ATOM 1176 N SER B 8 -2.666 -5.024 -3.563 1.00 0.00 N ATOM 1177 CA SER B 8 -3.517 -4.929 -4.782 1.00 0.00 C ATOM 1178 C SER B 8 -3.900 -3.475 -5.025 1.00 0.00 C ATOM 1179 O SER B 8 -4.342 -2.782 -4.132 1.00 0.00 O ATOM 1180 CB SER B 8 -4.784 -5.760 -4.576 1.00 0.00 C ATOM 1181 OG SER B 8 -5.588 -5.691 -5.746 1.00 0.00 O ATOM 0 H SER B 8 -2.939 -4.411 -2.795 1.00 0.00 H new ATOM 0 HA SER B 8 -2.965 -5.306 -5.643 1.00 0.00 H new ATOM 0 HB2 SER B 8 -4.522 -6.796 -4.362 1.00 0.00 H new ATOM 0 HB3 SER B 8 -5.341 -5.388 -3.716 1.00 0.00 H new ATOM 0 HG SER B 8 -6.400 -6.224 -5.617 1.00 0.00 H new ATOM 1187 N LEU B 9 -3.740 -3.007 -6.235 1.00 0.00 N ATOM 1188 CA LEU B 9 -4.109 -1.597 -6.552 1.00 0.00 C ATOM 1189 C LEU B 9 -4.708 -1.567 -7.959 1.00 0.00 C ATOM 1190 O LEU B 9 -4.319 -2.330 -8.825 1.00 0.00 O ATOM 1191 CB LEU B 9 -2.866 -0.701 -6.490 1.00 0.00 C ATOM 1192 CG LEU B 9 -3.290 0.774 -6.568 1.00 0.00 C ATOM 1193 CD1 LEU B 9 -4.036 1.193 -5.283 1.00 0.00 C ATOM 1194 CD2 LEU B 9 -2.046 1.647 -6.755 1.00 0.00 C ATOM 0 H LEU B 9 -3.368 -3.543 -7.019 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.833 -1.226 -5.827 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -2.319 -0.884 -5.565 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -2.191 -0.940 -7.312 1.00 0.00 H new ATOM 0 HG LEU B 9 -3.963 0.906 -7.415 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.328 2.241 -5.357 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -4.926 0.576 -5.161 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -3.381 1.059 -4.422 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -2.342 2.695 -6.811 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -1.372 1.505 -5.911 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -1.538 1.364 -7.677 1.00 0.00 H new ATOM 1206 N THR B 10 -5.668 -0.719 -8.189 1.00 0.00 N ATOM 1207 CA THR B 10 -6.318 -0.672 -9.532 1.00 0.00 C ATOM 1208 C THR B 10 -5.340 -0.142 -10.588 1.00 0.00 C ATOM 1209 O THR B 10 -4.306 0.412 -10.275 1.00 0.00 O ATOM 1210 CB THR B 10 -7.537 0.247 -9.454 1.00 0.00 C ATOM 1211 OG1 THR B 10 -7.181 1.438 -8.767 1.00 0.00 O ATOM 1212 CG2 THR B 10 -8.664 -0.462 -8.704 1.00 0.00 C ATOM 0 H THR B 10 -6.033 -0.055 -7.507 1.00 0.00 H new ATOM 0 HA THR B 10 -6.621 -1.679 -9.820 1.00 0.00 H new ATOM 0 HB THR B 10 -7.875 0.494 -10.460 1.00 0.00 H new ATOM 0 HG1 THR B 10 -7.904 2.094 -8.854 1.00 0.00 H new ATOM 0 HG21 THR B 10 -9.533 0.194 -8.649 1.00 0.00 H new ATOM 0 HG22 THR B 10 -8.933 -1.377 -9.232 1.00 0.00 H new ATOM 0 HG23 THR B 10 -8.331 -0.709 -7.696 1.00 0.00 H new ATOM 1220 N GLY B 11 -5.673 -0.318 -11.844 1.00 0.00 N ATOM 1221 CA GLY B 11 -4.782 0.157 -12.944 1.00 0.00 C ATOM 1222 C GLY B 11 -4.292 1.571 -12.642 1.00 0.00 C ATOM 1223 O GLY B 11 -4.940 2.545 -12.966 1.00 0.00 O ATOM 0 H GLY B 11 -6.531 -0.774 -12.154 1.00 0.00 H new ATOM 0 HA2 GLY B 11 -3.932 -0.517 -13.052 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -5.321 0.144 -13.891 1.00 0.00 H new ATOM 1227 N VAL B 12 -3.153 1.687 -12.019 1.00 0.00 N ATOM 1228 CA VAL B 12 -2.614 3.030 -11.680 1.00 0.00 C ATOM 1229 C VAL B 12 -2.677 3.952 -12.904 1.00 0.00 C ATOM 1230 O VAL B 12 -2.921 3.514 -14.012 1.00 0.00 O ATOM 1231 CB VAL B 12 -1.163 2.888 -11.208 1.00 0.00 C ATOM 1232 CG1 VAL B 12 -0.264 2.526 -12.393 1.00 0.00 C ATOM 1233 CG2 VAL B 12 -0.698 4.212 -10.596 1.00 0.00 C ATOM 0 H VAL B 12 -2.569 0.902 -11.729 1.00 0.00 H new ATOM 0 HA VAL B 12 -3.216 3.468 -10.884 1.00 0.00 H new ATOM 0 HB VAL B 12 -1.102 2.098 -10.460 1.00 0.00 H new ATOM 0 HG11 VAL B 12 0.766 2.426 -12.051 1.00 0.00 H new ATOM 0 HG12 VAL B 12 -0.595 1.582 -12.826 1.00 0.00 H new ATOM 0 HG13 VAL B 12 -0.322 3.311 -13.147 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.334 4.115 -10.259 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.762 5.001 -11.345 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -1.334 4.464 -9.748 1.00 0.00 H new ATOM 1243 N SER B 13 -2.465 5.226 -12.701 1.00 0.00 N ATOM 1244 CA SER B 13 -2.520 6.196 -13.828 1.00 0.00 C ATOM 1245 C SER B 13 -1.290 6.044 -14.728 1.00 0.00 C ATOM 1246 O SER B 13 -1.387 6.139 -15.934 1.00 0.00 O ATOM 1247 CB SER B 13 -2.556 7.617 -13.262 1.00 0.00 C ATOM 1248 OG SER B 13 -3.597 7.707 -12.296 1.00 0.00 O ATOM 0 H SER B 13 -2.254 5.637 -11.792 1.00 0.00 H new ATOM 0 HA SER B 13 -3.415 6.001 -14.419 1.00 0.00 H new ATOM 0 HB2 SER B 13 -1.597 7.865 -12.806 1.00 0.00 H new ATOM 0 HB3 SER B 13 -2.723 8.337 -14.063 1.00 0.00 H new ATOM 0 HG SER B 13 -3.624 8.615 -11.928 1.00 0.00 H new ATOM 1254 N LYS B 14 -0.127 5.829 -14.161 1.00 0.00 N ATOM 1255 CA LYS B 14 1.098 5.696 -15.001 1.00 0.00 C ATOM 1256 C LYS B 14 2.093 4.748 -14.327 1.00 0.00 C ATOM 1257 O LYS B 14 2.195 4.683 -13.120 1.00 0.00 O ATOM 1258 CB LYS B 14 1.714 7.099 -15.194 1.00 0.00 C ATOM 1259 CG LYS B 14 3.235 7.022 -15.416 1.00 0.00 C ATOM 1260 CD LYS B 14 3.781 8.410 -15.735 1.00 0.00 C ATOM 1261 CE LYS B 14 5.292 8.320 -15.965 1.00 0.00 C ATOM 1262 NZ LYS B 14 5.563 7.494 -17.176 1.00 0.00 N ATOM 0 H LYS B 14 0.024 5.741 -13.156 1.00 0.00 H new ATOM 0 HA LYS B 14 0.846 5.277 -15.975 1.00 0.00 H new ATOM 0 HB2 LYS B 14 1.245 7.589 -16.047 1.00 0.00 H new ATOM 0 HB3 LYS B 14 1.504 7.713 -14.319 1.00 0.00 H new ATOM 0 HG2 LYS B 14 3.722 6.625 -14.525 1.00 0.00 H new ATOM 0 HG3 LYS B 14 3.458 6.337 -16.234 1.00 0.00 H new ATOM 0 HD2 LYS B 14 3.290 8.811 -16.622 1.00 0.00 H new ATOM 0 HD3 LYS B 14 3.567 9.095 -14.915 1.00 0.00 H new ATOM 0 HE2 LYS B 14 5.711 9.318 -16.091 1.00 0.00 H new ATOM 0 HE3 LYS B 14 5.777 7.878 -15.095 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 6.525 7.688 -17.520 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 5.478 6.486 -16.935 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 4.875 7.731 -17.919 1.00 0.00 H new ATOM 1276 N VAL B 15 2.846 4.029 -15.121 1.00 0.00 N ATOM 1277 CA VAL B 15 3.871 3.093 -14.571 1.00 0.00 C ATOM 1278 C VAL B 15 5.251 3.734 -14.729 1.00 0.00 C ATOM 1279 O VAL B 15 5.852 3.682 -15.783 1.00 0.00 O ATOM 1280 CB VAL B 15 3.808 1.778 -15.351 1.00 0.00 C ATOM 1281 CG1 VAL B 15 4.966 0.868 -14.934 1.00 0.00 C ATOM 1282 CG2 VAL B 15 2.476 1.080 -15.048 1.00 0.00 C ATOM 0 H VAL B 15 2.793 4.052 -16.139 1.00 0.00 H new ATOM 0 HA VAL B 15 3.684 2.892 -13.516 1.00 0.00 H new ATOM 0 HB VAL B 15 3.885 1.985 -16.418 1.00 0.00 H new ATOM 0 HG11 VAL B 15 4.914 -0.066 -15.493 1.00 0.00 H new ATOM 0 HG12 VAL B 15 5.913 1.365 -15.144 1.00 0.00 H new ATOM 0 HG13 VAL B 15 4.896 0.656 -13.867 1.00 0.00 H new ATOM 0 HG21 VAL B 15 2.423 0.142 -15.600 1.00 0.00 H new ATOM 0 HG22 VAL B 15 2.407 0.877 -13.979 1.00 0.00 H new ATOM 0 HG23 VAL B 15 1.650 1.725 -15.349 1.00 0.00 H new ATOM 1292 N GLN B 16 5.749 4.354 -13.693 1.00 0.00 N ATOM 1293 CA GLN B 16 7.080 5.018 -13.786 1.00 0.00 C ATOM 1294 C GLN B 16 8.169 3.968 -14.012 1.00 0.00 C ATOM 1295 O GLN B 16 9.070 4.160 -14.805 1.00 0.00 O ATOM 1296 CB GLN B 16 7.349 5.784 -12.486 1.00 0.00 C ATOM 1297 CG GLN B 16 8.651 6.579 -12.614 1.00 0.00 C ATOM 1298 CD GLN B 16 8.803 7.494 -11.397 1.00 0.00 C ATOM 1299 OE1 GLN B 16 8.909 7.028 -10.281 1.00 0.00 O ATOM 1300 NE2 GLN B 16 8.806 8.786 -11.565 1.00 0.00 N ATOM 0 H GLN B 16 5.290 4.429 -12.785 1.00 0.00 H new ATOM 0 HA GLN B 16 7.086 5.714 -14.625 1.00 0.00 H new ATOM 0 HB2 GLN B 16 6.520 6.458 -12.272 1.00 0.00 H new ATOM 0 HB3 GLN B 16 7.418 5.088 -11.650 1.00 0.00 H new ATOM 0 HG2 GLN B 16 9.501 5.900 -12.682 1.00 0.00 H new ATOM 0 HG3 GLN B 16 8.642 7.170 -13.530 1.00 0.00 H new ATOM 0 HE21 GLN B 16 8.717 9.179 -12.502 1.00 0.00 H new ATOM 0 HE22 GLN B 16 8.897 9.405 -10.759 1.00 0.00 H new ATOM 1309 N SER B 17 8.093 2.859 -13.328 1.00 0.00 N ATOM 1310 CA SER B 17 9.123 1.799 -13.511 1.00 0.00 C ATOM 1311 C SER B 17 8.721 0.569 -12.704 1.00 0.00 C ATOM 1312 O SER B 17 8.123 0.682 -11.654 1.00 0.00 O ATOM 1313 CB SER B 17 10.476 2.299 -13.012 1.00 0.00 C ATOM 1314 OG SER B 17 11.412 1.228 -13.049 1.00 0.00 O ATOM 0 H SER B 17 7.362 2.642 -12.651 1.00 0.00 H new ATOM 0 HA SER B 17 9.197 1.547 -14.569 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.824 3.124 -13.633 1.00 0.00 H new ATOM 0 HB3 SER B 17 10.384 2.682 -11.996 1.00 0.00 H new ATOM 0 HG SER B 17 11.635 0.957 -12.134 1.00 0.00 H new ATOM 1320 N PHE B 18 9.044 -0.609 -13.186 1.00 0.00 N ATOM 1321 CA PHE B 18 8.682 -1.854 -12.437 1.00 0.00 C ATOM 1322 C PHE B 18 9.934 -2.728 -12.289 1.00 0.00 C ATOM 1323 O PHE B 18 10.450 -3.255 -13.254 1.00 0.00 O ATOM 1324 CB PHE B 18 7.593 -2.616 -13.225 1.00 0.00 C ATOM 1325 CG PHE B 18 6.653 -3.310 -12.258 1.00 0.00 C ATOM 1326 CD1 PHE B 18 7.069 -4.452 -11.562 1.00 0.00 C ATOM 1327 CD2 PHE B 18 5.368 -2.790 -12.046 1.00 0.00 C ATOM 1328 CE1 PHE B 18 6.198 -5.074 -10.657 1.00 0.00 C ATOM 1329 CE2 PHE B 18 4.503 -3.411 -11.141 1.00 0.00 C ATOM 1330 CZ PHE B 18 4.918 -4.551 -10.446 1.00 0.00 C ATOM 0 H PHE B 18 9.541 -0.761 -14.063 1.00 0.00 H new ATOM 0 HA PHE B 18 8.300 -1.603 -11.448 1.00 0.00 H new ATOM 0 HB2 PHE B 18 7.035 -1.924 -13.856 1.00 0.00 H new ATOM 0 HB3 PHE B 18 8.055 -3.348 -13.887 1.00 0.00 H new ATOM 0 HD1 PHE B 18 8.059 -4.853 -11.722 1.00 0.00 H new ATOM 0 HD2 PHE B 18 5.047 -1.909 -12.582 1.00 0.00 H new ATOM 0 HE1 PHE B 18 6.515 -5.957 -10.123 1.00 0.00 H new ATOM 0 HE2 PHE B 18 3.513 -3.010 -10.978 1.00 0.00 H new ATOM 0 HZ PHE B 18 4.249 -5.028 -9.745 1.00 0.00 H new ATOM 1340 N ASP B 19 10.419 -2.883 -11.080 1.00 0.00 N ATOM 1341 CA ASP B 19 11.635 -3.723 -10.838 1.00 0.00 C ATOM 1342 C ASP B 19 11.334 -4.696 -9.684 1.00 0.00 C ATOM 1343 O ASP B 19 10.583 -4.381 -8.789 1.00 0.00 O ATOM 1344 CB ASP B 19 12.808 -2.814 -10.451 1.00 0.00 C ATOM 1345 CG ASP B 19 12.798 -1.560 -11.331 1.00 0.00 C ATOM 1346 OD1 ASP B 19 12.785 -1.709 -12.541 1.00 0.00 O ATOM 1347 OD2 ASP B 19 12.803 -0.471 -10.777 1.00 0.00 O ATOM 0 H ASP B 19 10.020 -2.459 -10.242 1.00 0.00 H new ATOM 0 HA ASP B 19 11.895 -4.281 -11.738 1.00 0.00 H new ATOM 0 HB2 ASP B 19 12.733 -2.534 -9.400 1.00 0.00 H new ATOM 0 HB3 ASP B 19 13.750 -3.348 -10.572 1.00 0.00 H new ATOM 1352 N PRO B 20 11.906 -5.870 -9.691 1.00 0.00 N ATOM 1353 CA PRO B 20 11.664 -6.869 -8.609 1.00 0.00 C ATOM 1354 C PRO B 20 12.254 -6.405 -7.275 1.00 0.00 C ATOM 1355 O PRO B 20 12.003 -6.986 -6.239 1.00 0.00 O ATOM 1356 CB PRO B 20 12.359 -8.142 -9.120 1.00 0.00 C ATOM 1357 CG PRO B 20 13.403 -7.656 -10.076 1.00 0.00 C ATOM 1358 CD PRO B 20 12.843 -6.379 -10.707 1.00 0.00 C ATOM 0 HA PRO B 20 10.603 -7.023 -8.412 1.00 0.00 H new ATOM 0 HB2 PRO B 20 12.806 -8.704 -8.300 1.00 0.00 H new ATOM 0 HB3 PRO B 20 11.651 -8.807 -9.614 1.00 0.00 H new ATOM 0 HG2 PRO B 20 14.341 -7.455 -9.559 1.00 0.00 H new ATOM 0 HG3 PRO B 20 13.613 -8.407 -10.838 1.00 0.00 H new ATOM 0 HD2 PRO B 20 13.632 -5.658 -10.921 1.00 0.00 H new ATOM 0 HD3 PRO B 20 12.337 -6.587 -11.650 1.00 0.00 H new ATOM 1366 N LYS B 21 13.039 -5.355 -7.305 1.00 0.00 N ATOM 1367 CA LYS B 21 13.663 -4.819 -6.054 1.00 0.00 C ATOM 1368 C LYS B 21 13.180 -3.385 -5.811 1.00 0.00 C ATOM 1369 O LYS B 21 13.609 -2.726 -4.886 1.00 0.00 O ATOM 1370 CB LYS B 21 15.181 -4.830 -6.219 1.00 0.00 C ATOM 1371 CG LYS B 21 15.665 -6.282 -6.285 1.00 0.00 C ATOM 1372 CD LYS B 21 17.197 -6.330 -6.350 1.00 0.00 C ATOM 1373 CE LYS B 21 17.690 -5.840 -7.717 1.00 0.00 C ATOM 1374 NZ LYS B 21 19.114 -6.239 -7.893 1.00 0.00 N ATOM 0 H LYS B 21 13.277 -4.841 -8.153 1.00 0.00 H new ATOM 0 HA LYS B 21 13.379 -5.438 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS B 21 15.465 -4.297 -7.126 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.654 -4.313 -5.384 1.00 0.00 H new ATOM 0 HG2 LYS B 21 15.314 -6.830 -5.410 1.00 0.00 H new ATOM 0 HG3 LYS B 21 15.241 -6.774 -7.160 1.00 0.00 H new ATOM 0 HD2 LYS B 21 17.620 -5.710 -5.560 1.00 0.00 H new ATOM 0 HD3 LYS B 21 17.543 -7.349 -6.175 1.00 0.00 H new ATOM 0 HE2 LYS B 21 17.079 -6.267 -8.512 1.00 0.00 H new ATOM 0 HE3 LYS B 21 17.592 -4.757 -7.786 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 19.455 -5.910 -8.819 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 19.690 -5.812 -7.140 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 19.193 -7.275 -7.844 1.00 0.00 H new ATOM 1388 N GLU B 22 12.287 -2.899 -6.634 1.00 0.00 N ATOM 1389 CA GLU B 22 11.767 -1.512 -6.450 1.00 0.00 C ATOM 1390 C GLU B 22 10.606 -1.273 -7.416 1.00 0.00 C ATOM 1391 O GLU B 22 10.714 -1.529 -8.598 1.00 0.00 O ATOM 1392 CB GLU B 22 12.883 -0.503 -6.730 1.00 0.00 C ATOM 1393 CG GLU B 22 12.341 0.917 -6.547 1.00 0.00 C ATOM 1394 CD GLU B 22 13.485 1.924 -6.666 1.00 0.00 C ATOM 1395 OE1 GLU B 22 14.579 1.514 -7.017 1.00 0.00 O ATOM 1396 OE2 GLU B 22 13.251 3.090 -6.391 1.00 0.00 O ATOM 0 H GLU B 22 11.895 -3.405 -7.428 1.00 0.00 H new ATOM 0 HA GLU B 22 11.419 -1.388 -5.425 1.00 0.00 H new ATOM 0 HB2 GLU B 22 13.721 -0.674 -6.055 1.00 0.00 H new ATOM 0 HB3 GLU B 22 13.260 -0.633 -7.745 1.00 0.00 H new ATOM 0 HG2 GLU B 22 11.580 1.126 -7.299 1.00 0.00 H new ATOM 0 HG3 GLU B 22 11.861 1.011 -5.573 1.00 0.00 H new ATOM 1403 N ILE B 23 9.492 -0.783 -6.922 1.00 0.00 N ATOM 1404 CA ILE B 23 8.311 -0.521 -7.808 1.00 0.00 C ATOM 1405 C ILE B 23 7.926 0.952 -7.709 1.00 0.00 C ATOM 1406 O ILE B 23 7.628 1.457 -6.646 1.00 0.00 O ATOM 1407 CB ILE B 23 7.134 -1.385 -7.339 1.00 0.00 C ATOM 1408 CG1 ILE B 23 7.535 -2.871 -7.359 1.00 0.00 C ATOM 1409 CG2 ILE B 23 5.915 -1.148 -8.239 1.00 0.00 C ATOM 1410 CD1 ILE B 23 7.901 -3.323 -8.778 1.00 0.00 C ATOM 0 H ILE B 23 9.350 -0.552 -5.939 1.00 0.00 H new ATOM 0 HA ILE B 23 8.560 -0.765 -8.841 1.00 0.00 H new ATOM 0 HB ILE B 23 6.871 -1.106 -6.319 1.00 0.00 H new ATOM 0 HG12 ILE B 23 8.382 -3.032 -6.693 1.00 0.00 H new ATOM 0 HG13 ILE B 23 6.713 -3.478 -6.981 1.00 0.00 H new ATOM 0 HG21 ILE B 23 5.085 -1.766 -7.897 1.00 0.00 H new ATOM 0 HG22 ILE B 23 5.628 -0.097 -8.193 1.00 0.00 H new ATOM 0 HG23 ILE B 23 6.165 -1.412 -9.267 1.00 0.00 H new ATOM 0 HD11 ILE B 23 8.180 -4.376 -8.764 1.00 0.00 H new ATOM 0 HD12 ILE B 23 7.044 -3.184 -9.437 1.00 0.00 H new ATOM 0 HD13 ILE B 23 8.739 -2.730 -9.144 1.00 0.00 H new ATOM 1422 N LEU B 24 7.932 1.641 -8.822 1.00 0.00 N ATOM 1423 CA LEU B 24 7.569 3.090 -8.833 1.00 0.00 C ATOM 1424 C LEU B 24 6.347 3.283 -9.729 1.00 0.00 C ATOM 1425 O LEU B 24 6.410 3.069 -10.923 1.00 0.00 O ATOM 1426 CB LEU B 24 8.737 3.890 -9.415 1.00 0.00 C ATOM 1427 CG LEU B 24 10.026 3.553 -8.655 1.00 0.00 C ATOM 1428 CD1 LEU B 24 11.184 4.375 -9.226 1.00 0.00 C ATOM 1429 CD2 LEU B 24 9.850 3.869 -7.164 1.00 0.00 C ATOM 0 H LEU B 24 8.176 1.256 -9.734 1.00 0.00 H new ATOM 0 HA LEU B 24 7.351 3.429 -7.820 1.00 0.00 H new ATOM 0 HB2 LEU B 24 8.857 3.659 -10.473 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.530 4.958 -9.343 1.00 0.00 H new ATOM 0 HG LEU B 24 10.245 2.491 -8.769 1.00 0.00 H new ATOM 0 HD11 LEU B 24 12.100 4.136 -8.686 1.00 0.00 H new ATOM 0 HD12 LEU B 24 11.312 4.138 -10.282 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.965 5.437 -9.117 1.00 0.00 H new ATOM 0 HD21 LEU B 24 10.769 3.627 -6.630 1.00 0.00 H new ATOM 0 HD22 LEU B 24 9.626 4.929 -7.041 1.00 0.00 H new ATOM 0 HD23 LEU B 24 9.029 3.276 -6.761 1.00 0.00 H new ATOM 1441 N LEU B 25 5.234 3.680 -9.165 1.00 0.00 N ATOM 1442 CA LEU B 25 3.997 3.884 -9.986 1.00 0.00 C ATOM 1443 C LEU B 25 3.393 5.246 -9.641 1.00 0.00 C ATOM 1444 O LEU B 25 3.160 5.554 -8.490 1.00 0.00 O ATOM 1445 CB LEU B 25 2.993 2.777 -9.652 1.00 0.00 C ATOM 1446 CG LEU B 25 3.638 1.401 -9.875 1.00 0.00 C ATOM 1447 CD1 LEU B 25 2.728 0.316 -9.296 1.00 0.00 C ATOM 1448 CD2 LEU B 25 3.825 1.141 -11.375 1.00 0.00 C ATOM 0 H LEU B 25 5.127 3.873 -8.169 1.00 0.00 H new ATOM 0 HA LEU B 25 4.238 3.850 -11.048 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.666 2.871 -8.617 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.106 2.878 -10.277 1.00 0.00 H new ATOM 0 HG LEU B 25 4.609 1.382 -9.381 1.00 0.00 H new ATOM 0 HD11 LEU B 25 3.183 -0.662 -9.453 1.00 0.00 H new ATOM 0 HD12 LEU B 25 2.593 0.486 -8.228 1.00 0.00 H new ATOM 0 HD13 LEU B 25 1.759 0.350 -9.794 1.00 0.00 H new ATOM 0 HD21 LEU B 25 4.283 0.163 -11.520 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.855 1.165 -11.872 1.00 0.00 H new ATOM 0 HD23 LEU B 25 4.470 1.910 -11.800 1.00 0.00 H new ATOM 1460 N GLU B 26 3.142 6.072 -10.624 1.00 0.00 N ATOM 1461 CA GLU B 26 2.559 7.414 -10.336 1.00 0.00 C ATOM 1462 C GLU B 26 1.035 7.308 -10.297 1.00 0.00 C ATOM 1463 O GLU B 26 0.399 7.076 -11.303 1.00 0.00 O ATOM 1464 CB GLU B 26 2.996 8.386 -11.433 1.00 0.00 C ATOM 1465 CG GLU B 26 2.723 9.831 -11.001 1.00 0.00 C ATOM 1466 CD GLU B 26 1.227 10.126 -11.112 1.00 0.00 C ATOM 1467 OE1 GLU B 26 0.752 10.265 -12.226 1.00 0.00 O ATOM 1468 OE2 GLU B 26 0.583 10.215 -10.079 1.00 0.00 O ATOM 0 H GLU B 26 3.315 5.875 -11.610 1.00 0.00 H new ATOM 0 HA GLU B 26 2.909 7.778 -9.370 1.00 0.00 H new ATOM 0 HB2 GLU B 26 4.058 8.256 -11.642 1.00 0.00 H new ATOM 0 HB3 GLU B 26 2.460 8.168 -12.357 1.00 0.00 H new ATOM 0 HG2 GLU B 26 3.059 9.984 -9.975 1.00 0.00 H new ATOM 0 HG3 GLU B 26 3.287 10.521 -11.628 1.00 0.00 H new ATOM 1475 N THR B 27 0.444 7.471 -9.133 1.00 0.00 N ATOM 1476 CA THR B 27 -1.046 7.368 -9.011 1.00 0.00 C ATOM 1477 C THR B 27 -1.653 8.761 -8.834 1.00 0.00 C ATOM 1478 O THR B 27 -1.034 9.647 -8.283 1.00 0.00 O ATOM 1479 CB THR B 27 -1.391 6.512 -7.789 1.00 0.00 C ATOM 1480 OG1 THR B 27 -2.801 6.374 -7.694 1.00 0.00 O ATOM 1481 CG2 THR B 27 -0.854 7.184 -6.524 1.00 0.00 C ATOM 0 H THR B 27 0.933 7.672 -8.261 1.00 0.00 H new ATOM 0 HA THR B 27 -1.450 6.912 -9.915 1.00 0.00 H new ATOM 0 HB THR B 27 -0.936 5.527 -7.894 1.00 0.00 H new ATOM 0 HG1 THR B 27 -3.024 5.825 -6.913 1.00 0.00 H new ATOM 0 HG21 THR B 27 -1.100 6.574 -5.655 1.00 0.00 H new ATOM 0 HG22 THR B 27 0.228 7.288 -6.599 1.00 0.00 H new ATOM 0 HG23 THR B 27 -1.307 8.169 -6.415 1.00 0.00 H new ATOM 1489 N ILE B 28 -2.869 8.937 -9.303 1.00 0.00 N ATOM 1490 CA ILE B 28 -3.575 10.252 -9.194 1.00 0.00 C ATOM 1491 C ILE B 28 -2.593 11.408 -9.415 1.00 0.00 C ATOM 1492 O ILE B 28 -2.481 11.935 -10.502 1.00 0.00 O ATOM 1493 CB ILE B 28 -4.227 10.381 -7.812 1.00 0.00 C ATOM 1494 CG1 ILE B 28 -5.116 9.161 -7.559 1.00 0.00 C ATOM 1495 CG2 ILE B 28 -5.090 11.646 -7.770 1.00 0.00 C ATOM 1496 CD1 ILE B 28 -5.668 9.210 -6.132 1.00 0.00 C ATOM 0 H ILE B 28 -3.410 8.207 -9.766 1.00 0.00 H new ATOM 0 HA ILE B 28 -4.347 10.297 -9.962 1.00 0.00 H new ATOM 0 HB ILE B 28 -3.452 10.441 -7.048 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -5.937 9.142 -8.276 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -4.543 8.245 -7.706 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -5.554 11.738 -6.788 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -4.465 12.519 -7.960 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -5.866 11.583 -8.533 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -6.300 8.340 -5.956 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -4.841 9.207 -5.422 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -6.256 10.118 -6.000 1.00 0.00 H new ATOM 1508 N GLN B 29 -1.891 11.813 -8.386 1.00 0.00 N ATOM 1509 CA GLN B 29 -0.922 12.942 -8.518 1.00 0.00 C ATOM 1510 C GLN B 29 0.356 12.638 -7.733 1.00 0.00 C ATOM 1511 O GLN B 29 1.387 13.240 -7.963 1.00 0.00 O ATOM 1512 CB GLN B 29 -1.567 14.205 -7.947 1.00 0.00 C ATOM 1513 CG GLN B 29 -2.104 13.913 -6.540 1.00 0.00 C ATOM 1514 CD GLN B 29 -2.781 15.165 -5.984 1.00 0.00 C ATOM 1515 OE1 GLN B 29 -2.905 16.160 -6.671 1.00 0.00 O ATOM 1516 NE2 GLN B 29 -3.234 15.158 -4.759 1.00 0.00 N ATOM 0 H GLN B 29 -1.949 11.406 -7.453 1.00 0.00 H new ATOM 0 HA GLN B 29 -0.668 13.080 -9.569 1.00 0.00 H new ATOM 0 HB2 GLN B 29 -0.837 15.014 -7.909 1.00 0.00 H new ATOM 0 HB3 GLN B 29 -2.378 14.538 -8.596 1.00 0.00 H new ATOM 0 HG2 GLN B 29 -2.814 13.087 -6.574 1.00 0.00 H new ATOM 0 HG3 GLN B 29 -1.289 13.606 -5.885 1.00 0.00 H new ATOM 0 HE21 GLN B 29 -3.130 14.323 -4.182 1.00 0.00 H new ATOM 0 HE22 GLN B 29 -3.691 15.987 -4.380 1.00 0.00 H new ATOM 1525 N GLY B 30 0.301 11.724 -6.795 1.00 0.00 N ATOM 1526 CA GLY B 30 1.515 11.401 -5.983 1.00 0.00 C ATOM 1527 C GLY B 30 2.236 10.179 -6.553 1.00 0.00 C ATOM 1528 O GLY B 30 1.699 9.447 -7.359 1.00 0.00 O ATOM 0 H GLY B 30 -0.533 11.187 -6.557 1.00 0.00 H new ATOM 0 HA2 GLY B 30 2.190 12.256 -5.973 1.00 0.00 H new ATOM 0 HA3 GLY B 30 1.227 11.210 -4.949 1.00 0.00 H new ATOM 1532 N VAL B 31 3.454 9.951 -6.117 1.00 0.00 N ATOM 1533 CA VAL B 31 4.244 8.772 -6.597 1.00 0.00 C ATOM 1534 C VAL B 31 4.482 7.833 -5.421 1.00 0.00 C ATOM 1535 O VAL B 31 4.890 8.251 -4.356 1.00 0.00 O ATOM 1536 CB VAL B 31 5.596 9.243 -7.151 1.00 0.00 C ATOM 1537 CG1 VAL B 31 6.487 8.029 -7.450 1.00 0.00 C ATOM 1538 CG2 VAL B 31 5.367 10.041 -8.439 1.00 0.00 C ATOM 0 H VAL B 31 3.939 10.540 -5.440 1.00 0.00 H new ATOM 0 HA VAL B 31 3.695 8.257 -7.385 1.00 0.00 H new ATOM 0 HB VAL B 31 6.089 9.875 -6.412 1.00 0.00 H new ATOM 0 HG11 VAL B 31 7.445 8.369 -7.843 1.00 0.00 H new ATOM 0 HG12 VAL B 31 6.651 7.463 -6.533 1.00 0.00 H new ATOM 0 HG13 VAL B 31 5.998 7.392 -8.187 1.00 0.00 H new ATOM 0 HG21 VAL B 31 6.326 10.377 -8.834 1.00 0.00 H new ATOM 0 HG22 VAL B 31 4.872 9.408 -9.176 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.740 10.906 -8.224 1.00 0.00 H new ATOM 1548 N LEU B 32 4.220 6.564 -5.605 1.00 0.00 N ATOM 1549 CA LEU B 32 4.419 5.576 -4.503 1.00 0.00 C ATOM 1550 C LEU B 32 5.605 4.685 -4.837 1.00 0.00 C ATOM 1551 O LEU B 32 5.675 4.102 -5.902 1.00 0.00 O ATOM 1552 CB LEU B 32 3.158 4.715 -4.365 1.00 0.00 C ATOM 1553 CG LEU B 32 3.352 3.662 -3.264 1.00 0.00 C ATOM 1554 CD1 LEU B 32 3.705 4.341 -1.927 1.00 0.00 C ATOM 1555 CD2 LEU B 32 2.058 2.857 -3.117 1.00 0.00 C ATOM 0 H LEU B 32 3.874 6.168 -6.479 1.00 0.00 H new ATOM 0 HA LEU B 32 4.609 6.101 -3.567 1.00 0.00 H new ATOM 0 HB2 LEU B 32 2.302 5.347 -4.127 1.00 0.00 H new ATOM 0 HB3 LEU B 32 2.939 4.224 -5.313 1.00 0.00 H new ATOM 0 HG LEU B 32 4.172 2.998 -3.537 1.00 0.00 H new ATOM 0 HD11 LEU B 32 3.839 3.581 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU B 32 4.628 4.910 -2.040 1.00 0.00 H new ATOM 0 HD13 LEU B 32 2.898 5.013 -1.636 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.184 2.106 -2.338 1.00 0.00 H new ATOM 0 HD22 LEU B 32 1.241 3.527 -2.847 1.00 0.00 H new ATOM 0 HD23 LEU B 32 1.826 2.365 -4.062 1.00 0.00 H new ATOM 1567 N SER B 33 6.539 4.578 -3.925 1.00 0.00 N ATOM 1568 CA SER B 33 7.740 3.723 -4.153 1.00 0.00 C ATOM 1569 C SER B 33 7.750 2.602 -3.117 1.00 0.00 C ATOM 1570 O SER B 33 7.710 2.847 -1.929 1.00 0.00 O ATOM 1571 CB SER B 33 9.001 4.573 -4.000 1.00 0.00 C ATOM 1572 OG SER B 33 10.145 3.732 -4.076 1.00 0.00 O ATOM 0 H SER B 33 6.518 5.053 -3.023 1.00 0.00 H new ATOM 0 HA SER B 33 7.711 3.298 -5.156 1.00 0.00 H new ATOM 0 HB2 SER B 33 9.040 5.331 -4.782 1.00 0.00 H new ATOM 0 HB3 SER B 33 8.985 5.100 -3.046 1.00 0.00 H new ATOM 0 HG SER B 33 10.956 4.274 -3.980 1.00 0.00 H new ATOM 1578 N ILE B 34 7.799 1.370 -3.558 1.00 0.00 N ATOM 1579 CA ILE B 34 7.805 0.216 -2.609 1.00 0.00 C ATOM 1580 C ILE B 34 9.181 -0.444 -2.638 1.00 0.00 C ATOM 1581 O ILE B 34 9.718 -0.725 -3.689 1.00 0.00 O ATOM 1582 CB ILE B 34 6.755 -0.803 -3.047 1.00 0.00 C ATOM 1583 CG1 ILE B 34 5.382 -0.129 -3.096 1.00 0.00 C ATOM 1584 CG2 ILE B 34 6.722 -1.954 -2.040 1.00 0.00 C ATOM 1585 CD1 ILE B 34 4.383 -1.053 -3.793 1.00 0.00 C ATOM 0 H ILE B 34 7.835 1.113 -4.544 1.00 0.00 H new ATOM 0 HA ILE B 34 7.580 0.566 -1.602 1.00 0.00 H new ATOM 0 HB ILE B 34 7.005 -1.188 -4.036 1.00 0.00 H new ATOM 0 HG12 ILE B 34 5.040 0.097 -2.086 1.00 0.00 H new ATOM 0 HG13 ILE B 34 5.450 0.819 -3.630 1.00 0.00 H new ATOM 0 HG21 ILE B 34 5.974 -2.685 -2.347 1.00 0.00 H new ATOM 0 HG22 ILE B 34 7.701 -2.431 -2.001 1.00 0.00 H new ATOM 0 HG23 ILE B 34 6.467 -1.567 -1.053 1.00 0.00 H new ATOM 0 HD11 ILE B 34 3.405 -0.572 -3.827 1.00 0.00 H new ATOM 0 HD12 ILE B 34 4.723 -1.257 -4.808 1.00 0.00 H new ATOM 0 HD13 ILE B 34 4.307 -1.990 -3.241 1.00 0.00 H new ATOM 1597 N LYS B 35 9.757 -0.690 -1.486 1.00 0.00 N ATOM 1598 CA LYS B 35 11.106 -1.333 -1.423 1.00 0.00 C ATOM 1599 C LYS B 35 11.030 -2.583 -0.554 1.00 0.00 C ATOM 1600 O LYS B 35 10.380 -2.603 0.472 1.00 0.00 O ATOM 1601 CB LYS B 35 12.104 -0.351 -0.811 1.00 0.00 C ATOM 1602 CG LYS B 35 12.429 0.743 -1.832 1.00 0.00 C ATOM 1603 CD LYS B 35 13.455 1.729 -1.245 1.00 0.00 C ATOM 1604 CE LYS B 35 12.738 2.806 -0.425 1.00 0.00 C ATOM 1605 NZ LYS B 35 11.788 3.540 -1.308 1.00 0.00 N ATOM 0 H LYS B 35 9.346 -0.470 -0.579 1.00 0.00 H new ATOM 0 HA LYS B 35 11.429 -1.606 -2.428 1.00 0.00 H new ATOM 0 HB2 LYS B 35 11.688 0.092 0.094 1.00 0.00 H new ATOM 0 HB3 LYS B 35 13.015 -0.874 -0.520 1.00 0.00 H new ATOM 0 HG2 LYS B 35 12.825 0.294 -2.743 1.00 0.00 H new ATOM 0 HG3 LYS B 35 11.519 1.275 -2.108 1.00 0.00 H new ATOM 0 HD2 LYS B 35 14.166 1.194 -0.615 1.00 0.00 H new ATOM 0 HD3 LYS B 35 14.027 2.193 -2.049 1.00 0.00 H new ATOM 0 HE2 LYS B 35 12.202 2.350 0.407 1.00 0.00 H new ATOM 0 HE3 LYS B 35 13.464 3.497 0.004 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 12.093 4.530 -1.399 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 11.773 3.095 -2.248 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 10.834 3.508 -0.895 1.00 0.00 H new ATOM 1619 N GLY B 36 11.691 -3.630 -0.958 1.00 0.00 N ATOM 1620 CA GLY B 36 11.653 -4.875 -0.152 1.00 0.00 C ATOM 1621 C GLY B 36 12.346 -5.996 -0.919 1.00 0.00 C ATOM 1622 O GLY B 36 13.318 -5.775 -1.613 1.00 0.00 O ATOM 0 H GLY B 36 12.253 -3.676 -1.808 1.00 0.00 H new ATOM 0 HA2 GLY B 36 12.147 -4.716 0.807 1.00 0.00 H new ATOM 0 HA3 GLY B 36 10.621 -5.151 0.063 1.00 0.00 H new ATOM 1626 N GLU B 37 11.857 -7.201 -0.792 1.00 0.00 N ATOM 1627 CA GLU B 37 12.484 -8.350 -1.504 1.00 0.00 C ATOM 1628 C GLU B 37 11.386 -9.253 -2.066 1.00 0.00 C ATOM 1629 O GLU B 37 10.330 -9.383 -1.488 1.00 0.00 O ATOM 1630 CB GLU B 37 13.340 -9.148 -0.512 1.00 0.00 C ATOM 1631 CG GLU B 37 14.347 -8.219 0.207 1.00 0.00 C ATOM 1632 CD GLU B 37 13.734 -7.669 1.504 1.00 0.00 C ATOM 1633 OE1 GLU B 37 12.588 -7.258 1.475 1.00 0.00 O ATOM 1634 OE2 GLU B 37 14.426 -7.679 2.508 1.00 0.00 O ATOM 0 H GLU B 37 11.045 -7.439 -0.222 1.00 0.00 H new ATOM 0 HA GLU B 37 13.109 -7.984 -2.318 1.00 0.00 H new ATOM 0 HB2 GLU B 37 12.698 -9.635 0.222 1.00 0.00 H new ATOM 0 HB3 GLU B 37 13.877 -9.937 -1.039 1.00 0.00 H new ATOM 0 HG2 GLU B 37 15.261 -8.768 0.433 1.00 0.00 H new ATOM 0 HG3 GLU B 37 14.625 -7.395 -0.450 1.00 0.00 H new ATOM 1641 N LYS B 38 11.636 -9.877 -3.189 1.00 0.00 N ATOM 1642 CA LYS B 38 10.621 -10.781 -3.807 1.00 0.00 C ATOM 1643 C LYS B 38 9.370 -9.984 -4.178 1.00 0.00 C ATOM 1644 O LYS B 38 8.261 -10.373 -3.869 1.00 0.00 O ATOM 1645 CB LYS B 38 10.251 -11.902 -2.826 1.00 0.00 C ATOM 1646 CG LYS B 38 11.524 -12.539 -2.255 1.00 0.00 C ATOM 1647 CD LYS B 38 12.335 -13.180 -3.383 1.00 0.00 C ATOM 1648 CE LYS B 38 13.381 -14.127 -2.792 1.00 0.00 C ATOM 1649 NZ LYS B 38 14.101 -14.818 -3.899 1.00 0.00 N ATOM 0 H LYS B 38 12.510 -9.797 -3.709 1.00 0.00 H new ATOM 0 HA LYS B 38 11.044 -11.222 -4.710 1.00 0.00 H new ATOM 0 HB2 LYS B 38 9.640 -11.502 -2.017 1.00 0.00 H new ATOM 0 HB3 LYS B 38 9.652 -12.658 -3.334 1.00 0.00 H new ATOM 0 HG2 LYS B 38 12.124 -11.783 -1.748 1.00 0.00 H new ATOM 0 HG3 LYS B 38 11.263 -13.291 -1.510 1.00 0.00 H new ATOM 0 HD2 LYS B 38 11.673 -13.727 -4.054 1.00 0.00 H new ATOM 0 HD3 LYS B 38 12.824 -12.408 -3.977 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.087 -13.569 -2.176 1.00 0.00 H new ATOM 0 HE3 LYS B 38 12.900 -14.859 -2.143 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.813 -15.463 -3.501 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 13.422 -15.362 -4.469 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 14.571 -14.112 -4.501 1.00 0.00 H new ATOM 1663 N LEU B 39 9.542 -8.883 -4.860 1.00 0.00 N ATOM 1664 CA LEU B 39 8.372 -8.058 -5.287 1.00 0.00 C ATOM 1665 C LEU B 39 7.966 -8.498 -6.692 1.00 0.00 C ATOM 1666 O LEU B 39 8.188 -7.797 -7.659 1.00 0.00 O ATOM 1667 CB LEU B 39 8.777 -6.579 -5.297 1.00 0.00 C ATOM 1668 CG LEU B 39 8.730 -6.030 -3.870 1.00 0.00 C ATOM 1669 CD1 LEU B 39 9.661 -6.850 -2.976 1.00 0.00 C ATOM 1670 CD2 LEU B 39 9.176 -4.566 -3.867 1.00 0.00 C ATOM 0 H LEU B 39 10.451 -8.516 -5.142 1.00 0.00 H new ATOM 0 HA LEU B 39 7.535 -8.191 -4.601 1.00 0.00 H new ATOM 0 HB2 LEU B 39 9.780 -6.468 -5.708 1.00 0.00 H new ATOM 0 HB3 LEU B 39 8.104 -6.011 -5.939 1.00 0.00 H new ATOM 0 HG LEU B 39 7.710 -6.097 -3.491 1.00 0.00 H new ATOM 0 HD11 LEU B 39 9.627 -6.458 -1.959 1.00 0.00 H new ATOM 0 HD12 LEU B 39 9.340 -7.892 -2.975 1.00 0.00 H new ATOM 0 HD13 LEU B 39 10.681 -6.785 -3.356 1.00 0.00 H new ATOM 0 HD21 LEU B 39 9.142 -4.177 -2.849 1.00 0.00 H new ATOM 0 HD22 LEU B 39 10.195 -4.495 -4.248 1.00 0.00 H new ATOM 0 HD23 LEU B 39 8.510 -3.981 -4.501 1.00 0.00 H new ATOM 1682 N GLY B 40 7.397 -9.675 -6.815 1.00 0.00 N ATOM 1683 CA GLY B 40 6.994 -10.193 -8.165 1.00 0.00 C ATOM 1684 C GLY B 40 5.483 -10.063 -8.360 1.00 0.00 C ATOM 1685 O GLY B 40 4.788 -9.477 -7.555 1.00 0.00 O ATOM 0 H GLY B 40 7.193 -10.302 -6.037 1.00 0.00 H new ATOM 0 HA2 GLY B 40 7.516 -9.638 -8.945 1.00 0.00 H new ATOM 0 HA3 GLY B 40 7.291 -11.237 -8.264 1.00 0.00 H new ATOM 1764 N VAL B 51 -3.414 -4.397 -11.279 1.00 0.00 N ATOM 1765 CA VAL B 51 -2.057 -4.966 -11.003 1.00 0.00 C ATOM 1766 C VAL B 51 -1.954 -5.328 -9.521 1.00 0.00 C ATOM 1767 O VAL B 51 -2.486 -4.650 -8.666 1.00 0.00 O ATOM 1768 CB VAL B 51 -0.987 -3.926 -11.355 1.00 0.00 C ATOM 1769 CG1 VAL B 51 -1.338 -2.590 -10.698 1.00 0.00 C ATOM 1770 CG2 VAL B 51 0.380 -4.400 -10.850 1.00 0.00 C ATOM 0 HA VAL B 51 -1.903 -5.860 -11.607 1.00 0.00 H new ATOM 0 HB VAL B 51 -0.948 -3.801 -12.437 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -0.577 -1.851 -10.948 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -2.308 -2.250 -11.061 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -1.379 -2.716 -9.616 1.00 0.00 H new ATOM 0 HG21 VAL B 51 1.138 -3.658 -11.102 1.00 0.00 H new ATOM 0 HG22 VAL B 51 0.344 -4.529 -9.768 1.00 0.00 H new ATOM 0 HG23 VAL B 51 0.632 -5.351 -11.320 1.00 0.00 H new ATOM 1780 N GLU B 52 -1.266 -6.399 -9.216 1.00 0.00 N ATOM 1781 CA GLU B 52 -1.108 -6.826 -7.794 1.00 0.00 C ATOM 1782 C GLU B 52 0.343 -7.243 -7.579 1.00 0.00 C ATOM 1783 O GLU B 52 1.000 -7.702 -8.491 1.00 0.00 O ATOM 1784 CB GLU B 52 -2.033 -8.011 -7.508 1.00 0.00 C ATOM 1785 CG GLU B 52 -3.479 -7.619 -7.821 1.00 0.00 C ATOM 1786 CD GLU B 52 -4.424 -8.719 -7.341 1.00 0.00 C ATOM 1787 OE1 GLU B 52 -4.237 -9.188 -6.229 1.00 0.00 O ATOM 1788 OE2 GLU B 52 -5.324 -9.067 -8.085 1.00 0.00 O ATOM 0 H GLU B 52 -0.803 -7.000 -9.898 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.367 -6.007 -7.123 1.00 0.00 H new ATOM 0 HB2 GLU B 52 -1.739 -8.869 -8.112 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -1.944 -8.311 -6.464 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -3.725 -6.676 -7.333 1.00 0.00 H new ATOM 0 HG3 GLU B 52 -3.600 -7.464 -8.893 1.00 0.00 H new ATOM 1795 N VAL B 53 0.858 -7.077 -6.384 1.00 0.00 N ATOM 1796 CA VAL B 53 2.281 -7.452 -6.111 1.00 0.00 C ATOM 1797 C VAL B 53 2.352 -8.310 -4.853 1.00 0.00 C ATOM 1798 O VAL B 53 1.461 -8.297 -4.028 1.00 0.00 O ATOM 1799 CB VAL B 53 3.103 -6.179 -5.897 1.00 0.00 C ATOM 1800 CG1 VAL B 53 4.587 -6.541 -5.793 1.00 0.00 C ATOM 1801 CG2 VAL B 53 2.884 -5.228 -7.079 1.00 0.00 C ATOM 0 H VAL B 53 0.352 -6.697 -5.584 1.00 0.00 H new ATOM 0 HA VAL B 53 2.678 -8.013 -6.957 1.00 0.00 H new ATOM 0 HB VAL B 53 2.787 -5.690 -4.976 1.00 0.00 H new ATOM 0 HG11 VAL B 53 5.173 -5.635 -5.641 1.00 0.00 H new ATOM 0 HG12 VAL B 53 4.739 -7.217 -4.951 1.00 0.00 H new ATOM 0 HG13 VAL B 53 4.908 -7.030 -6.713 1.00 0.00 H new ATOM 0 HG21 VAL B 53 3.469 -4.320 -6.929 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.201 -5.715 -8.001 1.00 0.00 H new ATOM 0 HG23 VAL B 53 1.827 -4.971 -7.149 1.00 0.00 H new ATOM 1811 N GLU B 54 3.412 -9.059 -4.697 1.00 0.00 N ATOM 1812 CA GLU B 54 3.557 -9.927 -3.491 1.00 0.00 C ATOM 1813 C GLU B 54 5.024 -9.950 -3.060 1.00 0.00 C ATOM 1814 O GLU B 54 5.927 -9.923 -3.882 1.00 0.00 O ATOM 1815 CB GLU B 54 3.094 -11.348 -3.822 1.00 0.00 C ATOM 1816 CG GLU B 54 3.697 -11.795 -5.158 1.00 0.00 C ATOM 1817 CD GLU B 54 3.171 -13.186 -5.509 1.00 0.00 C ATOM 1818 OE1 GLU B 54 1.982 -13.302 -5.756 1.00 0.00 O ATOM 1819 OE2 GLU B 54 3.966 -14.111 -5.524 1.00 0.00 O ATOM 0 H GLU B 54 4.188 -9.107 -5.357 1.00 0.00 H new ATOM 0 HA GLU B 54 2.945 -9.532 -2.680 1.00 0.00 H new ATOM 0 HB2 GLU B 54 3.397 -12.032 -3.029 1.00 0.00 H new ATOM 0 HB3 GLU B 54 2.006 -11.382 -3.875 1.00 0.00 H new ATOM 0 HG2 GLU B 54 3.436 -11.086 -5.943 1.00 0.00 H new ATOM 0 HG3 GLU B 54 4.785 -11.811 -5.092 1.00 0.00 H new ATOM 1826 N GLY B 55 5.273 -9.999 -1.774 1.00 0.00 N ATOM 1827 CA GLY B 55 6.682 -10.020 -1.281 1.00 0.00 C ATOM 1828 C GLY B 55 6.744 -9.429 0.130 1.00 0.00 C ATOM 1829 O GLY B 55 5.732 -9.106 0.722 1.00 0.00 O ATOM 0 H GLY B 55 4.560 -10.025 -1.045 1.00 0.00 H new ATOM 0 HA2 GLY B 55 7.060 -11.042 -1.274 1.00 0.00 H new ATOM 0 HA3 GLY B 55 7.321 -9.448 -1.954 1.00 0.00 H new ATOM 1833 N LEU B 56 7.931 -9.291 0.676 1.00 0.00 N ATOM 1834 CA LEU B 56 8.081 -8.722 2.052 1.00 0.00 C ATOM 1835 C LEU B 56 8.546 -7.260 1.947 1.00 0.00 C ATOM 1836 O LEU B 56 9.642 -6.981 1.503 1.00 0.00 O ATOM 1837 CB LEU B 56 9.119 -9.551 2.843 1.00 0.00 C ATOM 1838 CG LEU B 56 10.195 -10.131 1.890 1.00 0.00 C ATOM 1839 CD1 LEU B 56 11.526 -10.278 2.641 1.00 0.00 C ATOM 1840 CD2 LEU B 56 9.771 -11.514 1.372 1.00 0.00 C ATOM 0 H LEU B 56 8.807 -9.551 0.223 1.00 0.00 H new ATOM 0 HA LEU B 56 7.125 -8.760 2.573 1.00 0.00 H new ATOM 0 HB2 LEU B 56 9.594 -8.924 3.598 1.00 0.00 H new ATOM 0 HB3 LEU B 56 8.618 -10.362 3.371 1.00 0.00 H new ATOM 0 HG LEU B 56 10.308 -9.448 1.048 1.00 0.00 H new ATOM 0 HD11 LEU B 56 12.280 -10.686 1.968 1.00 0.00 H new ATOM 0 HD12 LEU B 56 11.851 -9.302 3.001 1.00 0.00 H new ATOM 0 HD13 LEU B 56 11.393 -10.951 3.488 1.00 0.00 H new ATOM 0 HD21 LEU B 56 10.540 -11.904 0.705 1.00 0.00 H new ATOM 0 HD22 LEU B 56 9.642 -12.194 2.214 1.00 0.00 H new ATOM 0 HD23 LEU B 56 8.830 -11.426 0.829 1.00 0.00 H new ATOM 1852 N ILE B 57 7.722 -6.328 2.350 1.00 0.00 N ATOM 1853 CA ILE B 57 8.119 -4.891 2.269 1.00 0.00 C ATOM 1854 C ILE B 57 9.003 -4.531 3.463 1.00 0.00 C ATOM 1855 O ILE B 57 8.642 -4.742 4.603 1.00 0.00 O ATOM 1856 CB ILE B 57 6.852 -4.015 2.272 1.00 0.00 C ATOM 1857 CG1 ILE B 57 6.201 -4.054 0.885 1.00 0.00 C ATOM 1858 CG2 ILE B 57 7.203 -2.561 2.624 1.00 0.00 C ATOM 1859 CD1 ILE B 57 5.967 -5.504 0.456 1.00 0.00 C ATOM 0 H ILE B 57 6.792 -6.500 2.732 1.00 0.00 H new ATOM 0 HA ILE B 57 8.679 -4.717 1.350 1.00 0.00 H new ATOM 0 HB ILE B 57 6.161 -4.404 3.020 1.00 0.00 H new ATOM 0 HG12 ILE B 57 5.254 -3.515 0.904 1.00 0.00 H new ATOM 0 HG13 ILE B 57 6.840 -3.551 0.160 1.00 0.00 H new ATOM 0 HG21 ILE B 57 6.296 -1.957 2.621 1.00 0.00 H new ATOM 0 HG22 ILE B 57 7.659 -2.526 3.613 1.00 0.00 H new ATOM 0 HG23 ILE B 57 7.903 -2.167 1.887 1.00 0.00 H new ATOM 0 HD11 ILE B 57 5.504 -5.521 -0.531 1.00 0.00 H new ATOM 0 HD12 ILE B 57 6.921 -6.031 0.419 1.00 0.00 H new ATOM 0 HD13 ILE B 57 5.309 -5.994 1.174 1.00 0.00 H new ATOM 1871 N ASP B 58 10.155 -3.968 3.202 1.00 0.00 N ATOM 1872 CA ASP B 58 11.075 -3.565 4.302 1.00 0.00 C ATOM 1873 C ASP B 58 10.964 -2.055 4.517 1.00 0.00 C ATOM 1874 O ASP B 58 11.280 -1.551 5.577 1.00 0.00 O ATOM 1875 CB ASP B 58 12.512 -3.922 3.916 1.00 0.00 C ATOM 1876 CG ASP B 58 13.447 -3.637 5.093 1.00 0.00 C ATOM 1877 OD1 ASP B 58 13.461 -4.431 6.019 1.00 0.00 O ATOM 1878 OD2 ASP B 58 14.132 -2.629 5.049 1.00 0.00 O ATOM 0 H ASP B 58 10.499 -3.769 2.263 1.00 0.00 H new ATOM 0 HA ASP B 58 10.806 -4.087 5.220 1.00 0.00 H new ATOM 0 HB2 ASP B 58 12.573 -4.974 3.637 1.00 0.00 H new ATOM 0 HB3 ASP B 58 12.820 -3.342 3.046 1.00 0.00 H new ATOM 1883 N ALA B 59 10.527 -1.320 3.522 1.00 0.00 N ATOM 1884 CA ALA B 59 10.418 0.156 3.696 1.00 0.00 C ATOM 1885 C ALA B 59 9.541 0.765 2.601 1.00 0.00 C ATOM 1886 O ALA B 59 9.404 0.225 1.520 1.00 0.00 O ATOM 1887 CB ALA B 59 11.810 0.777 3.615 1.00 0.00 C ATOM 0 H ALA B 59 10.245 -1.676 2.609 1.00 0.00 H new ATOM 0 HA ALA B 59 9.967 0.359 4.667 1.00 0.00 H new ATOM 0 HB1 ALA B 59 11.735 1.857 3.742 1.00 0.00 H new ATOM 0 HB2 ALA B 59 12.440 0.362 4.402 1.00 0.00 H new ATOM 0 HB3 ALA B 59 12.251 0.556 2.643 1.00 0.00 H new ATOM 1893 N LEU B 60 8.951 1.900 2.884 1.00 0.00 N ATOM 1894 CA LEU B 60 8.079 2.596 1.885 1.00 0.00 C ATOM 1895 C LEU B 60 8.493 4.062 1.797 1.00 0.00 C ATOM 1896 O LEU B 60 8.838 4.676 2.785 1.00 0.00 O ATOM 1897 CB LEU B 60 6.616 2.509 2.343 1.00 0.00 C ATOM 1898 CG LEU B 60 6.031 1.128 1.989 1.00 0.00 C ATOM 1899 CD1 LEU B 60 4.860 0.800 2.917 1.00 0.00 C ATOM 1900 CD2 LEU B 60 5.518 1.128 0.540 1.00 0.00 C ATOM 0 H LEU B 60 9.038 2.382 3.779 1.00 0.00 H new ATOM 0 HA LEU B 60 8.186 2.123 0.909 1.00 0.00 H new ATOM 0 HB2 LEU B 60 6.553 2.674 3.419 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.030 3.294 1.865 1.00 0.00 H new ATOM 0 HG LEU B 60 6.818 0.383 2.105 1.00 0.00 H new ATOM 0 HD11 LEU B 60 4.454 -0.178 2.658 1.00 0.00 H new ATOM 0 HD12 LEU B 60 5.207 0.787 3.950 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.084 1.557 2.804 1.00 0.00 H new ATOM 0 HD21 LEU B 60 5.107 0.148 0.300 1.00 0.00 H new ATOM 0 HD22 LEU B 60 4.741 1.885 0.429 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.342 1.352 -0.138 1.00 0.00 H new ATOM 1912 N VAL B 61 8.461 4.629 0.618 1.00 0.00 N ATOM 1913 CA VAL B 61 8.848 6.062 0.456 1.00 0.00 C ATOM 1914 C VAL B 61 7.814 6.765 -0.423 1.00 0.00 C ATOM 1915 O VAL B 61 7.617 6.409 -1.568 1.00 0.00 O ATOM 1916 CB VAL B 61 10.221 6.132 -0.214 1.00 0.00 C ATOM 1917 CG1 VAL B 61 10.551 7.583 -0.575 1.00 0.00 C ATOM 1918 CG2 VAL B 61 11.278 5.585 0.747 1.00 0.00 C ATOM 0 H VAL B 61 8.182 4.158 -0.243 1.00 0.00 H new ATOM 0 HA VAL B 61 8.889 6.551 1.430 1.00 0.00 H new ATOM 0 HB VAL B 61 10.211 5.535 -1.126 1.00 0.00 H new ATOM 0 HG11 VAL B 61 11.530 7.626 -1.052 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.796 7.968 -1.261 1.00 0.00 H new ATOM 0 HG13 VAL B 61 10.562 8.190 0.330 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.259 5.633 0.274 1.00 0.00 H new ATOM 0 HG22 VAL B 61 11.285 6.183 1.659 1.00 0.00 H new ATOM 0 HG23 VAL B 61 11.044 4.549 0.994 1.00 0.00 H new ATOM 1928 N TYR B 62 7.164 7.775 0.102 1.00 0.00 N ATOM 1929 CA TYR B 62 6.149 8.533 -0.691 1.00 0.00 C ATOM 1930 C TYR B 62 6.396 10.040 -0.494 1.00 0.00 C ATOM 1931 O TYR B 62 6.054 10.589 0.531 1.00 0.00 O ATOM 1932 CB TYR B 62 4.743 8.171 -0.187 1.00 0.00 C ATOM 1933 CG TYR B 62 3.721 9.060 -0.855 1.00 0.00 C ATOM 1934 CD1 TYR B 62 3.374 10.288 -0.278 1.00 0.00 C ATOM 1935 CD2 TYR B 62 3.118 8.656 -2.049 1.00 0.00 C ATOM 1936 CE1 TYR B 62 2.434 11.109 -0.896 1.00 0.00 C ATOM 1937 CE2 TYR B 62 2.173 9.479 -2.668 1.00 0.00 C ATOM 1938 CZ TYR B 62 1.830 10.706 -2.090 1.00 0.00 C ATOM 1939 OH TYR B 62 0.897 11.520 -2.695 1.00 0.00 O ATOM 0 H TYR B 62 7.296 8.109 1.057 1.00 0.00 H new ATOM 0 HA TYR B 62 6.230 8.280 -1.748 1.00 0.00 H new ATOM 0 HB2 TYR B 62 4.526 7.125 -0.403 1.00 0.00 H new ATOM 0 HB3 TYR B 62 4.692 8.290 0.895 1.00 0.00 H new ATOM 0 HD1 TYR B 62 3.836 10.599 0.647 1.00 0.00 H new ATOM 0 HD2 TYR B 62 3.382 7.708 -2.494 1.00 0.00 H new ATOM 0 HE1 TYR B 62 2.172 12.058 -0.452 1.00 0.00 H new ATOM 0 HE2 TYR B 62 1.708 9.168 -3.592 1.00 0.00 H new ATOM 0 HH TYR B 62 1.099 12.457 -2.491 1.00 0.00 H new ATOM 1949 N PRO B 63 6.993 10.715 -1.453 1.00 0.00 N ATOM 1950 CA PRO B 63 7.257 12.184 -1.338 1.00 0.00 C ATOM 1951 C PRO B 63 6.019 12.977 -0.889 1.00 0.00 C ATOM 1952 O PRO B 63 5.174 13.335 -1.683 1.00 0.00 O ATOM 1953 CB PRO B 63 7.673 12.585 -2.761 1.00 0.00 C ATOM 1954 CG PRO B 63 8.279 11.348 -3.339 1.00 0.00 C ATOM 1955 CD PRO B 63 7.501 10.176 -2.735 1.00 0.00 C ATOM 0 HA PRO B 63 8.012 12.401 -0.582 1.00 0.00 H new ATOM 0 HB2 PRO B 63 6.815 12.917 -3.346 1.00 0.00 H new ATOM 0 HB3 PRO B 63 8.388 13.408 -2.748 1.00 0.00 H new ATOM 0 HG2 PRO B 63 8.203 11.348 -4.426 1.00 0.00 H new ATOM 0 HG3 PRO B 63 9.339 11.281 -3.093 1.00 0.00 H new ATOM 0 HD2 PRO B 63 6.687 9.858 -3.386 1.00 0.00 H new ATOM 0 HD3 PRO B 63 8.142 9.308 -2.579 1.00 0.00 H new ATOM 1963 N LEU B 64 5.929 13.270 0.384 1.00 0.00 N ATOM 1964 CA LEU B 64 4.774 14.052 0.913 1.00 0.00 C ATOM 1965 C LEU B 64 5.093 15.551 0.819 1.00 0.00 C ATOM 1966 O LEU B 64 4.397 16.374 1.375 1.00 0.00 O ATOM 1967 CB LEU B 64 4.472 13.663 2.382 1.00 0.00 C ATOM 1968 CG LEU B 64 5.753 13.399 3.220 1.00 0.00 C ATOM 1969 CD1 LEU B 64 6.337 11.997 2.954 1.00 0.00 C ATOM 1970 CD2 LEU B 64 6.810 14.479 2.950 1.00 0.00 C ATOM 0 H LEU B 64 6.616 12.996 1.086 1.00 0.00 H new ATOM 0 HA LEU B 64 3.891 13.826 0.316 1.00 0.00 H new ATOM 0 HB2 LEU B 64 3.896 14.461 2.851 1.00 0.00 H new ATOM 0 HB3 LEU B 64 3.847 12.770 2.394 1.00 0.00 H new ATOM 0 HG LEU B 64 5.466 13.441 4.271 1.00 0.00 H new ATOM 0 HD11 LEU B 64 7.232 11.854 3.560 1.00 0.00 H new ATOM 0 HD12 LEU B 64 5.598 11.240 3.214 1.00 0.00 H new ATOM 0 HD13 LEU B 64 6.595 11.905 1.899 1.00 0.00 H new ATOM 0 HD21 LEU B 64 7.699 14.275 3.547 1.00 0.00 H new ATOM 0 HD22 LEU B 64 7.074 14.474 1.892 1.00 0.00 H new ATOM 0 HD23 LEU B 64 6.409 15.456 3.219 1.00 0.00 H new