USER MOD reduce.3.24.130724 H: found=0, std=0, add=524, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 522 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -111:sc= -0.168 (180deg=-2.24!) USER MOD Single : A 11 GLN : amide:sc= -4.9! C(o=-4.9!,f=-13!) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -1.05 K(o=-1,f=-3.4!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -2.93! C(o=-2.9!,f=-5.3!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.563 X(o=-0.56,f=-0.8) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -1.71 K(o=-1.7,f=-11!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 125:sc= 1.02 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=-0.0076) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 41:sc= 0.588 USER MOD Single : A 67 SER OG : rot 32:sc= 0.566 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.793 15.829 20.305 1.00 0.00 N ATOM 2 CA GLY A 1 6.142 15.039 19.139 1.00 0.00 C ATOM 3 C GLY A 1 7.629 15.067 18.844 1.00 0.00 C ATOM 4 O GLY A 1 8.186 16.117 18.525 1.00 0.00 O ATOM 0 H1 GLY A 1 4.767 15.778 20.465 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.292 15.457 21.138 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.070 16.819 20.149 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.825 14.008 19.294 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.596 15.414 18.273 1.00 0.00 H new ATOM 8 N SER A 2 8.274 13.910 18.954 1.00 0.00 N ATOM 9 CA SER A 2 9.707 13.807 18.702 1.00 0.00 C ATOM 10 C SER A 2 9.996 13.791 17.204 1.00 0.00 C ATOM 11 O SER A 2 9.192 13.302 16.411 1.00 0.00 O ATOM 12 CB SER A 2 10.271 12.544 19.355 1.00 0.00 C ATOM 13 OG SER A 2 9.889 11.384 18.636 1.00 0.00 O ATOM 0 H SER A 2 7.827 13.031 19.216 1.00 0.00 H new ATOM 0 HA SER A 2 10.191 14.681 19.138 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.358 12.607 19.398 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.915 12.472 20.383 1.00 0.00 H new ATOM 0 HG SER A 2 10.263 10.590 19.073 1.00 0.00 H new ATOM 19 N SER A 3 11.150 14.331 16.825 1.00 0.00 N ATOM 20 CA SER A 3 11.544 14.383 15.422 1.00 0.00 C ATOM 21 C SER A 3 11.582 12.984 14.815 1.00 0.00 C ATOM 22 O SER A 3 12.247 12.088 15.334 1.00 0.00 O ATOM 23 CB SER A 3 12.914 15.049 15.280 1.00 0.00 C ATOM 24 OG SER A 3 13.191 15.363 13.926 1.00 0.00 O ATOM 0 H SER A 3 11.828 14.738 17.469 1.00 0.00 H new ATOM 0 HA SER A 3 10.802 14.973 14.884 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.944 15.958 15.881 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.687 14.385 15.668 1.00 0.00 H new ATOM 0 HG SER A 3 14.071 15.789 13.862 1.00 0.00 H new ATOM 30 N GLY A 4 10.861 12.804 13.712 1.00 0.00 N ATOM 31 CA GLY A 4 10.824 11.512 13.052 1.00 0.00 C ATOM 32 C GLY A 4 10.257 11.594 11.649 1.00 0.00 C ATOM 33 O GLY A 4 9.132 12.053 11.453 1.00 0.00 O ATOM 0 H GLY A 4 10.302 13.530 13.264 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.832 11.100 13.010 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.223 10.822 13.644 1.00 0.00 H new ATOM 37 N SER A 5 11.038 11.149 10.670 1.00 0.00 N ATOM 38 CA SER A 5 10.609 11.178 9.277 1.00 0.00 C ATOM 39 C SER A 5 9.522 10.139 9.020 1.00 0.00 C ATOM 40 O SER A 5 9.486 9.091 9.664 1.00 0.00 O ATOM 41 CB SER A 5 11.800 10.927 8.349 1.00 0.00 C ATOM 42 OG SER A 5 11.416 11.024 6.988 1.00 0.00 O ATOM 0 H SER A 5 11.971 10.764 10.816 1.00 0.00 H new ATOM 0 HA SER A 5 10.198 12.166 9.071 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.588 11.650 8.560 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.214 9.938 8.544 1.00 0.00 H new ATOM 0 HG SER A 5 12.195 10.861 6.416 1.00 0.00 H new ATOM 48 N SER A 6 8.637 10.439 8.075 1.00 0.00 N ATOM 49 CA SER A 6 7.546 9.533 7.735 1.00 0.00 C ATOM 50 C SER A 6 7.863 8.753 6.463 1.00 0.00 C ATOM 51 O SER A 6 8.857 9.021 5.789 1.00 0.00 O ATOM 52 CB SER A 6 6.243 10.315 7.555 1.00 0.00 C ATOM 53 OG SER A 6 5.923 11.048 8.725 1.00 0.00 O ATOM 0 H SER A 6 8.654 11.302 7.531 1.00 0.00 H new ATOM 0 HA SER A 6 7.427 8.824 8.555 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.338 10.996 6.710 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.431 9.626 7.320 1.00 0.00 H new ATOM 0 HG SER A 6 5.087 11.540 8.584 1.00 0.00 H new ATOM 59 N GLY A 7 7.010 7.786 6.141 1.00 0.00 N ATOM 60 CA GLY A 7 7.216 6.980 4.951 1.00 0.00 C ATOM 61 C GLY A 7 5.934 6.754 4.175 1.00 0.00 C ATOM 62 O GLY A 7 5.015 7.572 4.227 1.00 0.00 O ATOM 0 H GLY A 7 6.180 7.546 6.683 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.946 7.470 4.306 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.639 6.017 5.237 1.00 0.00 H new ATOM 66 N LEU A 8 5.870 5.641 3.453 1.00 0.00 N ATOM 67 CA LEU A 8 4.691 5.309 2.661 1.00 0.00 C ATOM 68 C LEU A 8 3.860 4.230 3.347 1.00 0.00 C ATOM 69 O LEU A 8 4.304 3.091 3.499 1.00 0.00 O ATOM 70 CB LEU A 8 5.106 4.839 1.265 1.00 0.00 C ATOM 71 CG LEU A 8 3.996 4.800 0.213 1.00 0.00 C ATOM 72 CD1 LEU A 8 2.738 4.169 0.788 1.00 0.00 C ATOM 73 CD2 LEU A 8 3.704 6.200 -0.306 1.00 0.00 C ATOM 0 H LEU A 8 6.621 4.953 3.400 1.00 0.00 H new ATOM 0 HA LEU A 8 4.081 6.207 2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.899 5.494 0.904 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.533 3.840 1.352 1.00 0.00 H new ATOM 0 HG LEU A 8 4.335 4.188 -0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.959 4.150 0.025 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.956 3.151 1.110 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.395 4.754 1.642 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.912 6.153 -1.053 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.386 6.835 0.521 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.605 6.616 -0.757 1.00 0.00 H new ATOM 85 N LYS A 9 2.651 4.594 3.760 1.00 0.00 N ATOM 86 CA LYS A 9 1.755 3.657 4.427 1.00 0.00 C ATOM 87 C LYS A 9 0.473 3.464 3.623 1.00 0.00 C ATOM 88 O LYS A 9 -0.052 4.410 3.036 1.00 0.00 O ATOM 89 CB LYS A 9 1.416 4.157 5.833 1.00 0.00 C ATOM 90 CG LYS A 9 2.408 3.709 6.893 1.00 0.00 C ATOM 91 CD LYS A 9 1.743 3.559 8.251 1.00 0.00 C ATOM 92 CE LYS A 9 1.012 2.230 8.369 1.00 0.00 C ATOM 93 NZ LYS A 9 0.187 2.159 9.607 1.00 0.00 N ATOM 0 H LYS A 9 2.269 5.533 3.644 1.00 0.00 H new ATOM 0 HA LYS A 9 2.265 2.696 4.502 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.375 5.246 5.822 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.421 3.804 6.105 1.00 0.00 H new ATOM 0 HG2 LYS A 9 2.853 2.759 6.598 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.220 4.433 6.962 1.00 0.00 H new ATOM 0 HD2 LYS A 9 2.496 3.633 9.036 1.00 0.00 H new ATOM 0 HD3 LYS A 9 1.040 4.377 8.406 1.00 0.00 H new ATOM 0 HE2 LYS A 9 0.372 2.089 7.498 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.736 1.416 8.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -0.295 1.238 9.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 0.800 2.268 10.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -0.521 2.920 9.596 1.00 0.00 H new ATOM 107 N MET A 10 -0.026 2.232 3.601 1.00 0.00 N ATOM 108 CA MET A 10 -1.248 1.916 2.871 1.00 0.00 C ATOM 109 C MET A 10 -2.072 0.872 3.617 1.00 0.00 C ATOM 110 O MET A 10 -1.540 0.108 4.422 1.00 0.00 O ATOM 111 CB MET A 10 -0.912 1.409 1.467 1.00 0.00 C ATOM 112 CG MET A 10 -0.232 2.450 0.591 1.00 0.00 C ATOM 113 SD MET A 10 -0.251 2.007 -1.156 1.00 0.00 S ATOM 114 CE MET A 10 -1.559 3.071 -1.761 1.00 0.00 C ATOM 0 H MET A 10 0.397 1.437 4.080 1.00 0.00 H new ATOM 0 HA MET A 10 -1.839 2.828 2.789 1.00 0.00 H new ATOM 0 HB2 MET A 10 -0.264 0.537 1.550 1.00 0.00 H new ATOM 0 HB3 MET A 10 -1.829 1.079 0.980 1.00 0.00 H new ATOM 0 HG2 MET A 10 -0.729 3.411 0.723 1.00 0.00 H new ATOM 0 HG3 MET A 10 0.800 2.577 0.918 1.00 0.00 H new ATOM 0 HE1 MET A 10 -2.420 2.465 -2.042 1.00 0.00 H new ATOM 0 HE2 MET A 10 -1.849 3.773 -0.979 1.00 0.00 H new ATOM 0 HE3 MET A 10 -1.205 3.624 -2.631 1.00 0.00 H new ATOM 124 N GLN A 11 -3.373 0.845 3.343 1.00 0.00 N ATOM 125 CA GLN A 11 -4.269 -0.106 3.990 1.00 0.00 C ATOM 126 C GLN A 11 -4.750 -1.161 3.000 1.00 0.00 C ATOM 127 O GLN A 11 -4.874 -0.895 1.804 1.00 0.00 O ATOM 128 CB GLN A 11 -5.468 0.625 4.598 1.00 0.00 C ATOM 129 CG GLN A 11 -6.380 1.263 3.562 1.00 0.00 C ATOM 130 CD GLN A 11 -7.537 2.017 4.189 1.00 0.00 C ATOM 131 OE1 GLN A 11 -7.519 3.245 4.273 1.00 0.00 O ATOM 132 NE2 GLN A 11 -8.551 1.284 4.632 1.00 0.00 N ATOM 0 H GLN A 11 -3.829 1.470 2.678 1.00 0.00 H new ATOM 0 HA GLN A 11 -3.716 -0.606 4.785 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -6.047 -0.079 5.196 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -5.106 1.397 5.277 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.799 1.946 2.943 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.771 0.489 2.902 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -8.524 0.268 4.542 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -9.357 1.736 5.063 1.00 0.00 H new ATOM 141 N VAL A 12 -5.019 -2.361 3.506 1.00 0.00 N ATOM 142 CA VAL A 12 -5.487 -3.457 2.666 1.00 0.00 C ATOM 143 C VAL A 12 -6.940 -3.250 2.251 1.00 0.00 C ATOM 144 O VAL A 12 -7.778 -2.852 3.061 1.00 0.00 O ATOM 145 CB VAL A 12 -5.359 -4.811 3.388 1.00 0.00 C ATOM 146 CG1 VAL A 12 -5.780 -5.948 2.469 1.00 0.00 C ATOM 147 CG2 VAL A 12 -3.936 -5.017 3.885 1.00 0.00 C ATOM 0 H VAL A 12 -4.921 -2.598 4.493 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.856 -3.466 1.777 1.00 0.00 H new ATOM 0 HB VAL A 12 -6.025 -4.807 4.251 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.683 -6.897 2.996 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.817 -5.806 2.166 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.142 -5.957 1.585 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.864 -5.979 4.393 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.249 -5.001 3.039 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.674 -4.219 4.580 1.00 0.00 H new ATOM 157 N LEU A 13 -7.232 -3.523 0.984 1.00 0.00 N ATOM 158 CA LEU A 13 -8.585 -3.368 0.461 1.00 0.00 C ATOM 159 C LEU A 13 -9.288 -4.717 0.361 1.00 0.00 C ATOM 160 O LEU A 13 -10.444 -4.858 0.762 1.00 0.00 O ATOM 161 CB LEU A 13 -8.547 -2.697 -0.914 1.00 0.00 C ATOM 162 CG LEU A 13 -9.765 -1.848 -1.280 1.00 0.00 C ATOM 163 CD1 LEU A 13 -9.821 -0.596 -0.418 1.00 0.00 C ATOM 164 CD2 LEU A 13 -9.734 -1.480 -2.756 1.00 0.00 C ATOM 0 H LEU A 13 -6.551 -3.853 0.300 1.00 0.00 H new ATOM 0 HA LEU A 13 -9.145 -2.738 1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.660 -2.065 -0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.428 -3.472 -1.671 1.00 0.00 H new ATOM 0 HG LEU A 13 -10.664 -2.435 -1.091 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -10.694 -0.004 -0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.891 -0.880 0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -8.918 -0.005 -0.575 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -10.608 -0.876 -2.999 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.829 -0.911 -2.970 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.742 -2.389 -3.358 1.00 0.00 H new ATOM 176 N TYR A 14 -8.584 -5.708 -0.174 1.00 0.00 N ATOM 177 CA TYR A 14 -9.141 -7.047 -0.327 1.00 0.00 C ATOM 178 C TYR A 14 -8.232 -8.091 0.314 1.00 0.00 C ATOM 179 O TYR A 14 -7.062 -8.217 -0.048 1.00 0.00 O ATOM 180 CB TYR A 14 -9.344 -7.371 -1.808 1.00 0.00 C ATOM 181 CG TYR A 14 -10.023 -6.264 -2.583 1.00 0.00 C ATOM 182 CD1 TYR A 14 -11.394 -6.064 -2.490 1.00 0.00 C ATOM 183 CD2 TYR A 14 -9.291 -5.418 -3.407 1.00 0.00 C ATOM 184 CE1 TYR A 14 -12.018 -5.054 -3.196 1.00 0.00 C ATOM 185 CE2 TYR A 14 -9.906 -4.405 -4.117 1.00 0.00 C ATOM 186 CZ TYR A 14 -11.270 -4.227 -4.008 1.00 0.00 C ATOM 187 OH TYR A 14 -11.887 -3.219 -4.713 1.00 0.00 O ATOM 0 H TYR A 14 -7.626 -5.609 -0.509 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.106 -7.072 0.179 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -8.375 -7.579 -2.262 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -9.938 -8.281 -1.894 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.983 -6.709 -1.855 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -8.223 -5.555 -3.494 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -13.085 -4.913 -3.113 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.323 -3.756 -4.754 1.00 0.00 H new ATOM 0 HH TYR A 14 -11.218 -2.728 -5.235 1.00 0.00 H new ATOM 197 N GLU A 15 -8.780 -8.838 1.268 1.00 0.00 N ATOM 198 CA GLU A 15 -8.019 -9.872 1.959 1.00 0.00 C ATOM 199 C GLU A 15 -7.178 -10.679 0.975 1.00 0.00 C ATOM 200 O GLU A 15 -7.675 -11.135 -0.055 1.00 0.00 O ATOM 201 CB GLU A 15 -8.961 -10.803 2.726 1.00 0.00 C ATOM 202 CG GLU A 15 -8.238 -11.862 3.542 1.00 0.00 C ATOM 203 CD GLU A 15 -7.994 -13.136 2.757 1.00 0.00 C ATOM 204 OE1 GLU A 15 -8.978 -13.739 2.281 1.00 0.00 O ATOM 205 OE2 GLU A 15 -6.817 -13.530 2.620 1.00 0.00 O ATOM 0 H GLU A 15 -9.747 -8.746 1.579 1.00 0.00 H new ATOM 0 HA GLU A 15 -7.349 -9.382 2.666 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -9.585 -10.207 3.392 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -9.628 -11.294 2.018 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.284 -11.462 3.885 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -8.825 -12.094 4.431 1.00 0.00 H new ATOM 212 N PHE A 16 -5.900 -10.850 1.299 1.00 0.00 N ATOM 213 CA PHE A 16 -4.989 -11.601 0.443 1.00 0.00 C ATOM 214 C PHE A 16 -4.224 -12.647 1.248 1.00 0.00 C ATOM 215 O PHE A 16 -3.899 -12.431 2.415 1.00 0.00 O ATOM 216 CB PHE A 16 -4.005 -10.652 -0.246 1.00 0.00 C ATOM 217 CG PHE A 16 -2.968 -11.360 -1.071 1.00 0.00 C ATOM 218 CD1 PHE A 16 -3.319 -12.002 -2.247 1.00 0.00 C ATOM 219 CD2 PHE A 16 -1.642 -11.382 -0.669 1.00 0.00 C ATOM 220 CE1 PHE A 16 -2.367 -12.654 -3.007 1.00 0.00 C ATOM 221 CE2 PHE A 16 -0.685 -12.033 -1.426 1.00 0.00 C ATOM 222 CZ PHE A 16 -1.048 -12.669 -2.597 1.00 0.00 C ATOM 0 H PHE A 16 -5.472 -10.479 2.147 1.00 0.00 H new ATOM 0 HA PHE A 16 -5.582 -12.113 -0.315 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.561 -9.967 -0.886 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.505 -10.047 0.511 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.348 -11.993 -2.574 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.353 -10.885 0.245 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.654 -13.152 -3.921 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.345 -12.044 -1.102 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.302 -13.177 -3.191 1.00 0.00 H new ATOM 232 N GLU A 17 -3.941 -13.782 0.616 1.00 0.00 N ATOM 233 CA GLU A 17 -3.217 -14.862 1.274 1.00 0.00 C ATOM 234 C GLU A 17 -1.871 -15.107 0.597 1.00 0.00 C ATOM 235 O GLU A 17 -1.792 -15.218 -0.626 1.00 0.00 O ATOM 236 CB GLU A 17 -4.048 -16.147 1.261 1.00 0.00 C ATOM 237 CG GLU A 17 -3.688 -17.117 2.374 1.00 0.00 C ATOM 238 CD GLU A 17 -4.278 -18.497 2.158 1.00 0.00 C ATOM 239 OE1 GLU A 17 -5.461 -18.698 2.501 1.00 0.00 O ATOM 240 OE2 GLU A 17 -3.554 -19.376 1.645 1.00 0.00 O ATOM 0 H GLU A 17 -4.202 -13.977 -0.351 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.036 -14.566 2.307 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.103 -15.888 1.344 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.917 -16.645 0.300 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.603 -17.197 2.445 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.041 -16.720 3.326 1.00 0.00 H new ATOM 247 N ALA A 18 -0.817 -15.189 1.401 1.00 0.00 N ATOM 248 CA ALA A 18 0.525 -15.422 0.880 1.00 0.00 C ATOM 249 C ALA A 18 0.640 -16.811 0.260 1.00 0.00 C ATOM 250 O ALA A 18 0.633 -17.819 0.967 1.00 0.00 O ATOM 251 CB ALA A 18 1.557 -15.247 1.984 1.00 0.00 C ATOM 0 H ALA A 18 -0.866 -15.098 2.416 1.00 0.00 H new ATOM 0 HA ALA A 18 0.717 -14.687 0.098 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.554 -15.424 1.581 1.00 0.00 H new ATOM 0 HB2 ALA A 18 1.500 -14.232 2.378 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.358 -15.959 2.785 1.00 0.00 H new ATOM 257 N ARG A 19 0.744 -16.856 -1.064 1.00 0.00 N ATOM 258 CA ARG A 19 0.858 -18.122 -1.778 1.00 0.00 C ATOM 259 C ARG A 19 2.259 -18.294 -2.359 1.00 0.00 C ATOM 260 O ARG A 19 2.422 -18.764 -3.484 1.00 0.00 O ATOM 261 CB ARG A 19 -0.182 -18.196 -2.897 1.00 0.00 C ATOM 262 CG ARG A 19 -1.616 -18.237 -2.395 1.00 0.00 C ATOM 263 CD ARG A 19 -2.611 -18.129 -3.539 1.00 0.00 C ATOM 264 NE ARG A 19 -2.465 -19.223 -4.496 1.00 0.00 N ATOM 265 CZ ARG A 19 -3.126 -19.287 -5.646 1.00 0.00 C ATOM 266 NH1 ARG A 19 -3.974 -18.324 -5.981 1.00 0.00 N ATOM 267 NH2 ARG A 19 -2.940 -20.315 -6.464 1.00 0.00 N ATOM 0 H ARG A 19 0.752 -16.031 -1.664 1.00 0.00 H new ATOM 0 HA ARG A 19 0.676 -18.929 -1.068 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -0.060 -17.333 -3.552 1.00 0.00 H new ATOM 0 HB3 ARG A 19 0.008 -19.084 -3.500 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -1.785 -19.166 -1.851 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -1.780 -17.421 -1.691 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -3.625 -18.130 -3.139 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.472 -17.177 -4.052 1.00 0.00 H new ATOM 0 HE ARG A 19 -1.820 -19.979 -4.268 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.120 -17.532 -5.355 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -4.481 -18.375 -6.865 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -2.289 -21.058 -6.210 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -3.448 -20.363 -7.347 1.00 0.00 H new ATOM 281 N ASN A 20 3.267 -17.908 -1.583 1.00 0.00 N ATOM 282 CA ASN A 20 4.654 -18.018 -2.021 1.00 0.00 C ATOM 283 C ASN A 20 5.609 -17.884 -0.839 1.00 0.00 C ATOM 284 O ASN A 20 5.240 -17.421 0.240 1.00 0.00 O ATOM 285 CB ASN A 20 4.967 -16.948 -3.068 1.00 0.00 C ATOM 286 CG ASN A 20 4.760 -17.448 -4.485 1.00 0.00 C ATOM 287 OD1 ASN A 20 5.526 -18.274 -4.981 1.00 0.00 O ATOM 288 ND2 ASN A 20 3.722 -16.946 -5.144 1.00 0.00 N ATOM 0 H ASN A 20 3.149 -17.517 -0.648 1.00 0.00 H new ATOM 0 HA ASN A 20 4.791 -19.003 -2.467 1.00 0.00 H new ATOM 0 HB2 ASN A 20 4.332 -16.079 -2.896 1.00 0.00 H new ATOM 0 HB3 ASN A 20 5.999 -16.618 -2.949 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.533 -17.243 -6.101 1.00 0.00 H new ATOM 0 HD22 ASN A 20 3.113 -16.263 -4.693 1.00 0.00 H new ATOM 295 N PRO A 21 6.868 -18.298 -1.046 1.00 0.00 N ATOM 296 CA PRO A 21 7.903 -18.234 -0.010 1.00 0.00 C ATOM 297 C PRO A 21 8.322 -16.801 0.302 1.00 0.00 C ATOM 298 O PRO A 21 8.963 -16.540 1.320 1.00 0.00 O ATOM 299 CB PRO A 21 9.070 -19.010 -0.626 1.00 0.00 C ATOM 300 CG PRO A 21 8.867 -18.896 -2.097 1.00 0.00 C ATOM 301 CD PRO A 21 7.378 -18.861 -2.308 1.00 0.00 C ATOM 0 HA PRO A 21 7.556 -18.642 0.939 1.00 0.00 H new ATOM 0 HB2 PRO A 21 10.029 -18.588 -0.325 1.00 0.00 H new ATOM 0 HB3 PRO A 21 9.066 -20.052 -0.305 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.338 -17.994 -2.487 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.315 -19.741 -2.620 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.108 -18.241 -3.163 1.00 0.00 H new ATOM 0 HD3 PRO A 21 6.975 -19.856 -2.496 1.00 0.00 H new ATOM 309 N ARG A 22 7.956 -15.877 -0.580 1.00 0.00 N ATOM 310 CA ARG A 22 8.295 -14.470 -0.398 1.00 0.00 C ATOM 311 C ARG A 22 7.036 -13.607 -0.371 1.00 0.00 C ATOM 312 O ARG A 22 6.931 -12.625 -1.104 1.00 0.00 O ATOM 313 CB ARG A 22 9.225 -13.999 -1.517 1.00 0.00 C ATOM 314 CG ARG A 22 8.627 -14.141 -2.907 1.00 0.00 C ATOM 315 CD ARG A 22 9.253 -13.161 -3.886 1.00 0.00 C ATOM 316 NE ARG A 22 8.751 -13.347 -5.245 1.00 0.00 N ATOM 317 CZ ARG A 22 7.521 -13.019 -5.625 1.00 0.00 C ATOM 318 NH1 ARG A 22 6.673 -12.489 -4.754 1.00 0.00 N ATOM 319 NH2 ARG A 22 7.137 -13.219 -6.879 1.00 0.00 N ATOM 0 H ARG A 22 7.425 -16.077 -1.428 1.00 0.00 H new ATOM 0 HA ARG A 22 8.807 -14.366 0.559 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.483 -12.954 -1.347 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.153 -14.569 -1.470 1.00 0.00 H new ATOM 0 HG2 ARG A 22 8.775 -15.160 -3.266 1.00 0.00 H new ATOM 0 HG3 ARG A 22 7.551 -13.973 -2.860 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.047 -12.142 -3.560 1.00 0.00 H new ATOM 0 HD3 ARG A 22 10.336 -13.285 -3.880 1.00 0.00 H new ATOM 0 HE ARG A 22 9.379 -13.751 -5.940 1.00 0.00 H new ATOM 0 HH11 ARG A 22 6.964 -12.332 -3.789 1.00 0.00 H new ATOM 0 HH12 ARG A 22 5.729 -12.238 -5.049 1.00 0.00 H new ATOM 0 HH21 ARG A 22 7.786 -13.625 -7.553 1.00 0.00 H new ATOM 0 HH22 ARG A 22 6.192 -12.967 -7.169 1.00 0.00 H new ATOM 333 N GLU A 23 6.086 -13.983 0.479 1.00 0.00 N ATOM 334 CA GLU A 23 4.834 -13.244 0.600 1.00 0.00 C ATOM 335 C GLU A 23 4.363 -13.206 2.050 1.00 0.00 C ATOM 336 O GLU A 23 4.934 -13.868 2.918 1.00 0.00 O ATOM 337 CB GLU A 23 3.756 -13.875 -0.283 1.00 0.00 C ATOM 338 CG GLU A 23 3.945 -13.601 -1.765 1.00 0.00 C ATOM 339 CD GLU A 23 2.725 -13.970 -2.587 1.00 0.00 C ATOM 340 OE1 GLU A 23 2.061 -14.971 -2.246 1.00 0.00 O ATOM 341 OE2 GLU A 23 2.434 -13.257 -3.571 1.00 0.00 O ATOM 0 H GLU A 23 6.159 -14.794 1.093 1.00 0.00 H new ATOM 0 HA GLU A 23 5.012 -12.221 0.268 1.00 0.00 H new ATOM 0 HB2 GLU A 23 3.749 -14.953 -0.119 1.00 0.00 H new ATOM 0 HB3 GLU A 23 2.780 -13.500 0.026 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.170 -12.544 -1.909 1.00 0.00 H new ATOM 0 HG3 GLU A 23 4.806 -14.162 -2.128 1.00 0.00 H new ATOM 348 N LEU A 24 3.317 -12.428 2.306 1.00 0.00 N ATOM 349 CA LEU A 24 2.767 -12.303 3.651 1.00 0.00 C ATOM 350 C LEU A 24 1.246 -12.198 3.611 1.00 0.00 C ATOM 351 O LEU A 24 0.684 -11.477 2.785 1.00 0.00 O ATOM 352 CB LEU A 24 3.355 -11.077 4.352 1.00 0.00 C ATOM 353 CG LEU A 24 2.774 -10.746 5.727 1.00 0.00 C ATOM 354 CD1 LEU A 24 3.430 -11.597 6.803 1.00 0.00 C ATOM 355 CD2 LEU A 24 2.946 -9.266 6.037 1.00 0.00 C ATOM 0 H LEU A 24 2.833 -11.874 1.600 1.00 0.00 H new ATOM 0 HA LEU A 24 3.036 -13.199 4.211 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.429 -11.226 4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.217 -10.212 3.704 1.00 0.00 H new ATOM 0 HG LEU A 24 1.708 -10.972 5.713 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.004 -11.347 7.775 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.255 -12.652 6.590 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.503 -11.403 6.817 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.527 -9.049 7.019 1.00 0.00 H new ATOM 0 HD22 LEU A 24 4.006 -9.014 6.031 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.428 -8.674 5.283 1.00 0.00 H new ATOM 367 N THR A 25 0.584 -12.921 4.509 1.00 0.00 N ATOM 368 CA THR A 25 -0.872 -12.909 4.576 1.00 0.00 C ATOM 369 C THR A 25 -1.384 -11.599 5.164 1.00 0.00 C ATOM 370 O THR A 25 -0.730 -10.987 6.009 1.00 0.00 O ATOM 371 CB THR A 25 -1.405 -14.081 5.422 1.00 0.00 C ATOM 372 OG1 THR A 25 -0.897 -15.320 4.916 1.00 0.00 O ATOM 373 CG2 THR A 25 -2.926 -14.108 5.411 1.00 0.00 C ATOM 0 H THR A 25 1.033 -13.522 5.200 1.00 0.00 H new ATOM 0 HA THR A 25 -1.237 -13.013 3.554 1.00 0.00 H new ATOM 0 HB THR A 25 -1.067 -13.943 6.449 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.239 -16.060 5.460 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.279 -14.944 6.015 1.00 0.00 H new ATOM 0 HG22 THR A 25 -3.309 -13.175 5.823 1.00 0.00 H new ATOM 0 HG23 THR A 25 -3.280 -14.225 4.387 1.00 0.00 H new ATOM 381 N VAL A 26 -2.560 -11.172 4.713 1.00 0.00 N ATOM 382 CA VAL A 26 -3.161 -9.935 5.196 1.00 0.00 C ATOM 383 C VAL A 26 -4.682 -9.990 5.102 1.00 0.00 C ATOM 384 O VAL A 26 -5.246 -10.925 4.534 1.00 0.00 O ATOM 385 CB VAL A 26 -2.652 -8.717 4.403 1.00 0.00 C ATOM 386 CG1 VAL A 26 -1.132 -8.710 4.351 1.00 0.00 C ATOM 387 CG2 VAL A 26 -3.242 -8.710 3.001 1.00 0.00 C ATOM 0 H VAL A 26 -3.115 -11.665 4.014 1.00 0.00 H new ATOM 0 HA VAL A 26 -2.868 -9.827 6.240 1.00 0.00 H new ATOM 0 HB VAL A 26 -2.978 -7.811 4.914 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.791 -7.842 3.787 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -0.733 -8.663 5.364 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.780 -9.620 3.865 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.872 -7.843 2.455 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.949 -9.620 2.478 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.329 -8.662 3.064 1.00 0.00 H new ATOM 397 N VAL A 27 -5.341 -8.981 5.663 1.00 0.00 N ATOM 398 CA VAL A 27 -6.797 -8.912 5.641 1.00 0.00 C ATOM 399 C VAL A 27 -7.276 -7.505 5.302 1.00 0.00 C ATOM 400 O VAL A 27 -6.554 -6.529 5.502 1.00 0.00 O ATOM 401 CB VAL A 27 -7.399 -9.336 6.994 1.00 0.00 C ATOM 402 CG1 VAL A 27 -7.058 -10.786 7.300 1.00 0.00 C ATOM 403 CG2 VAL A 27 -6.909 -8.419 8.105 1.00 0.00 C ATOM 0 H VAL A 27 -4.889 -8.200 6.138 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.135 -9.603 4.869 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.484 -9.248 6.933 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -7.492 -11.067 8.260 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.462 -11.428 6.517 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -5.975 -10.904 7.343 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.344 -8.733 9.054 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.822 -8.473 8.168 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.209 -7.394 7.889 1.00 0.00 H new ATOM 413 N GLN A 28 -8.498 -7.410 4.788 1.00 0.00 N ATOM 414 CA GLN A 28 -9.074 -6.122 4.421 1.00 0.00 C ATOM 415 C GLN A 28 -9.179 -5.207 5.637 1.00 0.00 C ATOM 416 O GLN A 28 -9.415 -5.666 6.753 1.00 0.00 O ATOM 417 CB GLN A 28 -10.455 -6.317 3.793 1.00 0.00 C ATOM 418 CG GLN A 28 -11.199 -5.015 3.543 1.00 0.00 C ATOM 419 CD GLN A 28 -11.878 -4.482 4.790 1.00 0.00 C ATOM 420 OE1 GLN A 28 -12.008 -5.189 5.790 1.00 0.00 O ATOM 421 NE2 GLN A 28 -12.315 -3.229 4.737 1.00 0.00 N ATOM 0 H GLN A 28 -9.108 -8.209 4.616 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.415 -5.652 3.691 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.343 -6.849 2.848 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -11.056 -6.950 4.446 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -10.500 -4.268 3.167 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -11.947 -5.172 2.766 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -12.186 -2.679 3.888 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -12.780 -2.816 5.546 1.00 0.00 H new ATOM 430 N GLY A 29 -9.003 -3.908 5.411 1.00 0.00 N ATOM 431 CA GLY A 29 -9.081 -2.949 6.497 1.00 0.00 C ATOM 432 C GLY A 29 -7.771 -2.814 7.247 1.00 0.00 C ATOM 433 O GLY A 29 -7.382 -1.713 7.635 1.00 0.00 O ATOM 0 H GLY A 29 -8.808 -3.503 4.495 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -9.370 -1.976 6.099 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.864 -3.254 7.191 1.00 0.00 H new ATOM 437 N GLU A 30 -7.090 -3.937 7.454 1.00 0.00 N ATOM 438 CA GLU A 30 -5.817 -3.938 8.165 1.00 0.00 C ATOM 439 C GLU A 30 -4.854 -2.921 7.559 1.00 0.00 C ATOM 440 O GLU A 30 -4.815 -2.734 6.343 1.00 0.00 O ATOM 441 CB GLU A 30 -5.190 -5.333 8.132 1.00 0.00 C ATOM 442 CG GLU A 30 -3.871 -5.426 8.881 1.00 0.00 C ATOM 443 CD GLU A 30 -3.475 -6.857 9.188 1.00 0.00 C ATOM 444 OE1 GLU A 30 -4.283 -7.576 9.812 1.00 0.00 O ATOM 445 OE2 GLU A 30 -2.355 -7.257 8.806 1.00 0.00 O ATOM 0 H GLU A 30 -7.398 -4.857 7.140 1.00 0.00 H new ATOM 0 HA GLU A 30 -6.009 -3.658 9.201 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.892 -6.048 8.560 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.030 -5.626 7.094 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.087 -4.955 8.288 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.946 -4.866 9.813 1.00 0.00 H new ATOM 452 N LYS A 31 -4.079 -2.265 8.416 1.00 0.00 N ATOM 453 CA LYS A 31 -3.115 -1.267 7.968 1.00 0.00 C ATOM 454 C LYS A 31 -1.702 -1.840 7.961 1.00 0.00 C ATOM 455 O LYS A 31 -1.345 -2.648 8.820 1.00 0.00 O ATOM 456 CB LYS A 31 -3.172 -0.032 8.869 1.00 0.00 C ATOM 457 CG LYS A 31 -4.535 0.198 9.500 1.00 0.00 C ATOM 458 CD LYS A 31 -5.508 0.822 8.515 1.00 0.00 C ATOM 459 CE LYS A 31 -6.544 1.681 9.223 1.00 0.00 C ATOM 460 NZ LYS A 31 -7.551 2.231 8.273 1.00 0.00 N ATOM 0 H LYS A 31 -4.100 -2.407 9.426 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.376 -0.978 6.950 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.428 -0.134 9.659 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.898 0.847 8.285 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.936 -0.750 9.857 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.430 0.847 10.369 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.959 1.430 7.796 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.010 0.036 7.950 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.049 1.087 9.984 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -6.045 2.501 9.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.240 2.811 8.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.072 2.819 7.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -8.046 1.448 7.800 1.00 0.00 H new ATOM 474 N LEU A 32 -0.901 -1.417 6.990 1.00 0.00 N ATOM 475 CA LEU A 32 0.475 -1.887 6.873 1.00 0.00 C ATOM 476 C LEU A 32 1.386 -0.781 6.349 1.00 0.00 C ATOM 477 O LEU A 32 0.915 0.222 5.814 1.00 0.00 O ATOM 478 CB LEU A 32 0.543 -3.101 5.946 1.00 0.00 C ATOM 479 CG LEU A 32 -0.263 -4.325 6.383 1.00 0.00 C ATOM 480 CD1 LEU A 32 -0.525 -5.242 5.198 1.00 0.00 C ATOM 481 CD2 LEU A 32 0.463 -5.075 7.490 1.00 0.00 C ATOM 0 H LEU A 32 -1.181 -0.749 6.272 1.00 0.00 H new ATOM 0 HA LEU A 32 0.819 -2.176 7.866 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.198 -2.798 4.957 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.587 -3.396 5.843 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.223 -3.984 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.100 -6.108 5.528 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.088 -4.701 4.437 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.424 -5.575 4.779 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.125 -5.943 7.788 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.437 -5.404 7.128 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.598 -4.416 8.348 1.00 0.00 H new ATOM 493 N GLU A 33 2.692 -0.973 6.506 1.00 0.00 N ATOM 494 CA GLU A 33 3.668 0.008 6.047 1.00 0.00 C ATOM 495 C GLU A 33 4.372 -0.475 4.782 1.00 0.00 C ATOM 496 O GLU A 33 4.894 -1.589 4.736 1.00 0.00 O ATOM 497 CB GLU A 33 4.699 0.286 7.143 1.00 0.00 C ATOM 498 CG GLU A 33 6.036 0.774 6.611 1.00 0.00 C ATOM 499 CD GLU A 33 6.809 1.585 7.633 1.00 0.00 C ATOM 500 OE1 GLU A 33 6.174 2.137 8.556 1.00 0.00 O ATOM 501 OE2 GLU A 33 8.049 1.667 7.510 1.00 0.00 O ATOM 0 H GLU A 33 3.098 -1.798 6.947 1.00 0.00 H new ATOM 0 HA GLU A 33 3.136 0.931 5.816 1.00 0.00 H new ATOM 0 HB2 GLU A 33 4.296 1.032 7.828 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.858 -0.625 7.720 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.635 -0.083 6.304 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.869 1.381 5.721 1.00 0.00 H new ATOM 508 N VAL A 34 4.381 0.371 3.757 1.00 0.00 N ATOM 509 CA VAL A 34 5.020 0.031 2.491 1.00 0.00 C ATOM 510 C VAL A 34 6.525 0.268 2.555 1.00 0.00 C ATOM 511 O VAL A 34 6.991 1.196 3.217 1.00 0.00 O ATOM 512 CB VAL A 34 4.432 0.851 1.327 1.00 0.00 C ATOM 513 CG1 VAL A 34 5.133 0.505 0.022 1.00 0.00 C ATOM 514 CG2 VAL A 34 2.933 0.616 1.215 1.00 0.00 C ATOM 0 H VAL A 34 3.953 1.297 3.778 1.00 0.00 H new ATOM 0 HA VAL A 34 4.828 -1.027 2.313 1.00 0.00 H new ATOM 0 HB VAL A 34 4.597 1.909 1.531 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.704 1.094 -0.789 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.196 0.728 0.110 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.002 -0.556 -0.191 1.00 0.00 H new ATOM 0 HG21 VAL A 34 2.534 1.203 0.388 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.743 -0.442 1.034 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.447 0.919 2.142 1.00 0.00 H new ATOM 524 N LEU A 35 7.281 -0.577 1.862 1.00 0.00 N ATOM 525 CA LEU A 35 8.735 -0.460 1.839 1.00 0.00 C ATOM 526 C LEU A 35 9.249 -0.348 0.407 1.00 0.00 C ATOM 527 O LEU A 35 9.986 0.579 0.072 1.00 0.00 O ATOM 528 CB LEU A 35 9.374 -1.665 2.530 1.00 0.00 C ATOM 529 CG LEU A 35 9.013 -1.865 4.002 1.00 0.00 C ATOM 530 CD1 LEU A 35 9.285 -3.299 4.429 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.786 -0.890 4.878 1.00 0.00 C ATOM 0 H LEU A 35 6.911 -1.350 1.309 1.00 0.00 H new ATOM 0 HA LEU A 35 9.011 0.447 2.377 1.00 0.00 H new ATOM 0 HB2 LEU A 35 9.092 -2.564 1.982 1.00 0.00 H new ATOM 0 HB3 LEU A 35 10.457 -1.571 2.452 1.00 0.00 H new ATOM 0 HG LEU A 35 7.948 -1.667 4.125 1.00 0.00 H new ATOM 0 HD11 LEU A 35 9.022 -3.422 5.480 1.00 0.00 H new ATOM 0 HD12 LEU A 35 8.686 -3.979 3.823 1.00 0.00 H new ATOM 0 HD13 LEU A 35 10.342 -3.525 4.291 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.516 -1.047 5.922 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.856 -1.056 4.751 1.00 0.00 H new ATOM 0 HD23 LEU A 35 9.540 0.132 4.589 1.00 0.00 H new ATOM 543 N ASP A 36 8.854 -1.298 -0.434 1.00 0.00 N ATOM 544 CA ASP A 36 9.272 -1.305 -1.831 1.00 0.00 C ATOM 545 C ASP A 36 8.076 -1.109 -2.757 1.00 0.00 C ATOM 546 O ASP A 36 7.485 -2.076 -3.237 1.00 0.00 O ATOM 547 CB ASP A 36 9.983 -2.617 -2.166 1.00 0.00 C ATOM 548 CG ASP A 36 10.869 -2.499 -3.391 1.00 0.00 C ATOM 549 OD1 ASP A 36 11.700 -1.568 -3.433 1.00 0.00 O ATOM 550 OD2 ASP A 36 10.730 -3.337 -4.307 1.00 0.00 O ATOM 0 H ASP A 36 8.245 -2.073 -0.172 1.00 0.00 H new ATOM 0 HA ASP A 36 9.965 -0.477 -1.982 1.00 0.00 H new ATOM 0 HB2 ASP A 36 10.587 -2.928 -1.313 1.00 0.00 H new ATOM 0 HB3 ASP A 36 9.240 -3.397 -2.332 1.00 0.00 H new ATOM 555 N HIS A 37 7.725 0.149 -3.003 1.00 0.00 N ATOM 556 CA HIS A 37 6.598 0.473 -3.871 1.00 0.00 C ATOM 557 C HIS A 37 7.083 0.892 -5.256 1.00 0.00 C ATOM 558 O HIS A 37 6.540 1.817 -5.860 1.00 0.00 O ATOM 559 CB HIS A 37 5.754 1.588 -3.254 1.00 0.00 C ATOM 560 CG HIS A 37 6.475 2.897 -3.151 1.00 0.00 C ATOM 561 ND1 HIS A 37 6.269 3.941 -4.029 1.00 0.00 N ATOM 562 CD2 HIS A 37 7.403 3.330 -2.265 1.00 0.00 C ATOM 563 CE1 HIS A 37 7.041 4.958 -3.689 1.00 0.00 C ATOM 564 NE2 HIS A 37 7.738 4.613 -2.621 1.00 0.00 N ATOM 0 H HIS A 37 8.204 0.961 -2.614 1.00 0.00 H new ATOM 0 HA HIS A 37 5.983 -0.421 -3.975 1.00 0.00 H new ATOM 0 HB2 HIS A 37 4.853 1.725 -3.853 1.00 0.00 H new ATOM 0 HB3 HIS A 37 5.432 1.281 -2.259 1.00 0.00 H new ATOM 0 HD2 HIS A 37 7.805 2.770 -1.433 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.093 5.909 -4.198 1.00 0.00 H new ATOM 0 HE2 HIS A 37 8.415 5.204 -2.139 1.00 0.00 H new ATOM 573 N SER A 38 8.108 0.207 -5.752 1.00 0.00 N ATOM 574 CA SER A 38 8.669 0.512 -7.063 1.00 0.00 C ATOM 575 C SER A 38 8.348 -0.596 -8.061 1.00 0.00 C ATOM 576 O SER A 38 7.811 -0.341 -9.139 1.00 0.00 O ATOM 577 CB SER A 38 10.184 0.700 -6.962 1.00 0.00 C ATOM 578 OG SER A 38 10.514 1.645 -5.959 1.00 0.00 O ATOM 0 H SER A 38 8.567 -0.563 -5.266 1.00 0.00 H new ATOM 0 HA SER A 38 8.218 1.439 -7.417 1.00 0.00 H new ATOM 0 HB2 SER A 38 10.658 -0.255 -6.736 1.00 0.00 H new ATOM 0 HB3 SER A 38 10.577 1.032 -7.923 1.00 0.00 H new ATOM 0 HG SER A 38 11.488 1.746 -5.913 1.00 0.00 H new ATOM 584 N LYS A 39 8.682 -1.829 -7.695 1.00 0.00 N ATOM 585 CA LYS A 39 8.430 -2.978 -8.556 1.00 0.00 C ATOM 586 C LYS A 39 6.939 -3.291 -8.624 1.00 0.00 C ATOM 587 O LYS A 39 6.162 -2.842 -7.781 1.00 0.00 O ATOM 588 CB LYS A 39 9.195 -4.202 -8.046 1.00 0.00 C ATOM 589 CG LYS A 39 10.639 -4.255 -8.514 1.00 0.00 C ATOM 590 CD LYS A 39 11.279 -5.596 -8.196 1.00 0.00 C ATOM 591 CE LYS A 39 10.915 -6.648 -9.232 1.00 0.00 C ATOM 592 NZ LYS A 39 11.958 -7.705 -9.339 1.00 0.00 N ATOM 0 H LYS A 39 9.128 -2.058 -6.807 1.00 0.00 H new ATOM 0 HA LYS A 39 8.778 -2.731 -9.559 1.00 0.00 H new ATOM 0 HB2 LYS A 39 9.175 -4.205 -6.956 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.681 -5.105 -8.377 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.681 -4.076 -9.588 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.207 -3.457 -8.036 1.00 0.00 H new ATOM 0 HD2 LYS A 39 12.362 -5.483 -8.156 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.957 -5.929 -7.209 1.00 0.00 H new ATOM 0 HE2 LYS A 39 9.961 -7.104 -8.967 1.00 0.00 H new ATOM 0 HE3 LYS A 39 10.781 -6.171 -10.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 11.673 -8.403 -10.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.862 -7.273 -9.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.068 -8.178 -8.419 1.00 0.00 H new ATOM 606 N ARG A 40 6.546 -4.063 -9.632 1.00 0.00 N ATOM 607 CA ARG A 40 5.147 -4.435 -9.809 1.00 0.00 C ATOM 608 C ARG A 40 4.472 -4.670 -8.461 1.00 0.00 C ATOM 609 O ARG A 40 3.455 -4.050 -8.148 1.00 0.00 O ATOM 610 CB ARG A 40 5.037 -5.693 -10.672 1.00 0.00 C ATOM 611 CG ARG A 40 4.933 -5.403 -12.161 1.00 0.00 C ATOM 612 CD ARG A 40 6.306 -5.328 -12.811 1.00 0.00 C ATOM 613 NE ARG A 40 6.794 -6.644 -13.213 1.00 0.00 N ATOM 614 CZ ARG A 40 7.777 -6.828 -14.087 1.00 0.00 C ATOM 615 NH1 ARG A 40 8.375 -5.785 -14.646 1.00 0.00 N ATOM 616 NH2 ARG A 40 8.165 -8.057 -14.402 1.00 0.00 N ATOM 0 H ARG A 40 7.176 -4.443 -10.338 1.00 0.00 H new ATOM 0 HA ARG A 40 4.639 -3.612 -10.312 1.00 0.00 H new ATOM 0 HB2 ARG A 40 5.908 -6.323 -10.493 1.00 0.00 H new ATOM 0 HB3 ARG A 40 4.162 -6.263 -10.359 1.00 0.00 H new ATOM 0 HG2 ARG A 40 4.343 -6.182 -12.644 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.405 -4.462 -12.314 1.00 0.00 H new ATOM 0 HD2 ARG A 40 6.259 -4.677 -13.684 1.00 0.00 H new ATOM 0 HD3 ARG A 40 7.013 -4.877 -12.114 1.00 0.00 H new ATOM 0 HE ARG A 40 6.356 -7.467 -12.800 1.00 0.00 H new ATOM 0 HH11 ARG A 40 8.080 -4.839 -14.405 1.00 0.00 H new ATOM 0 HH12 ARG A 40 9.130 -5.929 -15.317 1.00 0.00 H new ATOM 0 HH21 ARG A 40 7.708 -8.862 -13.973 1.00 0.00 H new ATOM 0 HH22 ARG A 40 8.920 -8.197 -15.073 1.00 0.00 H new ATOM 630 N TRP A 41 5.044 -5.568 -7.667 1.00 0.00 N ATOM 631 CA TRP A 41 4.497 -5.885 -6.353 1.00 0.00 C ATOM 632 C TRP A 41 5.038 -4.931 -5.294 1.00 0.00 C ATOM 633 O TRP A 41 6.191 -4.505 -5.360 1.00 0.00 O ATOM 634 CB TRP A 41 4.831 -7.329 -5.974 1.00 0.00 C ATOM 635 CG TRP A 41 3.890 -8.332 -6.570 1.00 0.00 C ATOM 636 CD1 TRP A 41 3.581 -8.481 -7.892 1.00 0.00 C ATOM 637 CD2 TRP A 41 3.136 -9.324 -5.865 1.00 0.00 C ATOM 638 NE1 TRP A 41 2.679 -9.506 -8.051 1.00 0.00 N ATOM 639 CE2 TRP A 41 2.391 -10.040 -6.823 1.00 0.00 C ATOM 640 CE3 TRP A 41 3.018 -9.679 -4.519 1.00 0.00 C ATOM 641 CZ2 TRP A 41 1.542 -11.087 -6.475 1.00 0.00 C ATOM 642 CZ3 TRP A 41 2.174 -10.718 -4.175 1.00 0.00 C ATOM 643 CH2 TRP A 41 1.446 -11.412 -5.150 1.00 0.00 C ATOM 0 H TRP A 41 5.886 -6.089 -7.910 1.00 0.00 H new ATOM 0 HA TRP A 41 3.414 -5.770 -6.400 1.00 0.00 H new ATOM 0 HB2 TRP A 41 5.846 -7.557 -6.298 1.00 0.00 H new ATOM 0 HB3 TRP A 41 4.814 -7.426 -4.888 1.00 0.00 H new ATOM 0 HD1 TRP A 41 3.986 -7.882 -8.694 1.00 0.00 H new ATOM 0 HE1 TRP A 41 2.288 -9.818 -8.940 1.00 0.00 H new ATOM 0 HE3 TRP A 41 3.577 -9.151 -3.760 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.979 -11.623 -7.225 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 2.074 -11.000 -3.137 1.00 0.00 H new ATOM 0 HH2 TRP A 41 0.796 -12.220 -4.849 1.00 0.00 H new ATOM 654 N TRP A 42 4.198 -4.599 -4.320 1.00 0.00 N ATOM 655 CA TRP A 42 4.593 -3.695 -3.246 1.00 0.00 C ATOM 656 C TRP A 42 4.910 -4.468 -1.971 1.00 0.00 C ATOM 657 O TRP A 42 4.111 -5.287 -1.515 1.00 0.00 O ATOM 658 CB TRP A 42 3.485 -2.675 -2.977 1.00 0.00 C ATOM 659 CG TRP A 42 3.299 -1.692 -4.092 1.00 0.00 C ATOM 660 CD1 TRP A 42 3.460 -1.927 -5.428 1.00 0.00 C ATOM 661 CD2 TRP A 42 2.917 -0.318 -3.968 1.00 0.00 C ATOM 662 NE1 TRP A 42 3.202 -0.782 -6.142 1.00 0.00 N ATOM 663 CE2 TRP A 42 2.866 0.220 -5.270 1.00 0.00 C ATOM 664 CE3 TRP A 42 2.612 0.511 -2.885 1.00 0.00 C ATOM 665 CZ2 TRP A 42 2.523 1.547 -5.514 1.00 0.00 C ATOM 666 CZ3 TRP A 42 2.272 1.828 -3.129 1.00 0.00 C ATOM 667 CH2 TRP A 42 2.230 2.335 -4.435 1.00 0.00 C ATOM 0 H TRP A 42 3.240 -4.942 -4.252 1.00 0.00 H new ATOM 0 HA TRP A 42 5.494 -3.168 -3.562 1.00 0.00 H new ATOM 0 HB2 TRP A 42 2.547 -3.204 -2.809 1.00 0.00 H new ATOM 0 HB3 TRP A 42 3.715 -2.133 -2.059 1.00 0.00 H new ATOM 0 HD1 TRP A 42 3.748 -2.874 -5.860 1.00 0.00 H new ATOM 0 HE1 TRP A 42 3.252 -0.692 -7.157 1.00 0.00 H new ATOM 0 HE3 TRP A 42 2.642 0.129 -1.875 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 2.489 1.940 -6.519 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 2.035 2.478 -2.299 1.00 0.00 H new ATOM 0 HH2 TRP A 42 1.961 3.369 -4.593 1.00 0.00 H new ATOM 678 N LEU A 43 6.080 -4.204 -1.399 1.00 0.00 N ATOM 679 CA LEU A 43 6.502 -4.876 -0.175 1.00 0.00 C ATOM 680 C LEU A 43 5.989 -4.137 1.057 1.00 0.00 C ATOM 681 O LEU A 43 6.080 -2.913 1.142 1.00 0.00 O ATOM 682 CB LEU A 43 8.028 -4.977 -0.125 1.00 0.00 C ATOM 683 CG LEU A 43 8.619 -5.590 1.145 1.00 0.00 C ATOM 684 CD1 LEU A 43 8.397 -7.094 1.164 1.00 0.00 C ATOM 685 CD2 LEU A 43 10.101 -5.265 1.253 1.00 0.00 C ATOM 0 H LEU A 43 6.753 -3.530 -1.763 1.00 0.00 H new ATOM 0 HA LEU A 43 6.078 -5.880 -0.176 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.361 -5.568 -0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.443 -3.976 -0.248 1.00 0.00 H new ATOM 0 HG LEU A 43 8.110 -5.158 2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.824 -7.513 2.075 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.328 -7.304 1.134 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.880 -7.544 0.296 1.00 0.00 H new ATOM 0 HD21 LEU A 43 10.506 -5.709 2.163 1.00 0.00 H new ATOM 0 HD22 LEU A 43 10.626 -5.669 0.387 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.235 -4.184 1.286 1.00 0.00 H new ATOM 697 N VAL A 44 5.451 -4.890 2.011 1.00 0.00 N ATOM 698 CA VAL A 44 4.926 -4.308 3.240 1.00 0.00 C ATOM 699 C VAL A 44 5.351 -5.120 4.458 1.00 0.00 C ATOM 700 O VAL A 44 5.837 -6.243 4.331 1.00 0.00 O ATOM 701 CB VAL A 44 3.389 -4.218 3.207 1.00 0.00 C ATOM 702 CG1 VAL A 44 2.920 -3.540 1.929 1.00 0.00 C ATOM 703 CG2 VAL A 44 2.772 -5.602 3.343 1.00 0.00 C ATOM 0 H VAL A 44 5.367 -5.905 1.956 1.00 0.00 H new ATOM 0 HA VAL A 44 5.339 -3.302 3.315 1.00 0.00 H new ATOM 0 HB VAL A 44 3.060 -3.613 4.052 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.831 -3.486 1.924 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.334 -2.533 1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.258 -4.115 1.067 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.685 -5.520 3.318 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.108 -6.232 2.520 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.080 -6.046 4.289 1.00 0.00 H new ATOM 713 N LYS A 45 5.164 -4.543 5.641 1.00 0.00 N ATOM 714 CA LYS A 45 5.526 -5.213 6.885 1.00 0.00 C ATOM 715 C LYS A 45 4.418 -5.068 7.923 1.00 0.00 C ATOM 716 O LYS A 45 3.596 -4.156 7.844 1.00 0.00 O ATOM 717 CB LYS A 45 6.834 -4.639 7.435 1.00 0.00 C ATOM 718 CG LYS A 45 7.578 -5.594 8.351 1.00 0.00 C ATOM 719 CD LYS A 45 9.055 -5.246 8.439 1.00 0.00 C ATOM 720 CE LYS A 45 9.316 -4.190 9.502 1.00 0.00 C ATOM 721 NZ LYS A 45 10.767 -4.065 9.815 1.00 0.00 N ATOM 0 H LYS A 45 4.764 -3.613 5.764 1.00 0.00 H new ATOM 0 HA LYS A 45 5.663 -6.273 6.672 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.482 -4.369 6.601 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.617 -3.720 7.980 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.136 -5.563 9.347 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.465 -6.614 7.984 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.629 -6.144 8.668 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.403 -4.884 7.472 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.934 -3.228 9.160 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.769 -4.445 10.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.903 -3.335 10.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 11.126 -4.976 10.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.286 -3.796 8.955 1.00 0.00 H new ATOM 735 N ASN A 46 4.403 -5.973 8.896 1.00 0.00 N ATOM 736 CA ASN A 46 3.396 -5.945 9.951 1.00 0.00 C ATOM 737 C ASN A 46 4.031 -5.626 11.301 1.00 0.00 C ATOM 738 O ASN A 46 5.241 -5.421 11.395 1.00 0.00 O ATOM 739 CB ASN A 46 2.665 -7.287 10.023 1.00 0.00 C ATOM 740 CG ASN A 46 3.613 -8.467 9.933 1.00 0.00 C ATOM 741 OD1 ASN A 46 4.767 -8.384 10.352 1.00 0.00 O ATOM 742 ND2 ASN A 46 3.128 -9.575 9.383 1.00 0.00 N ATOM 0 H ASN A 46 5.077 -6.735 8.976 1.00 0.00 H new ATOM 0 HA ASN A 46 2.678 -5.160 9.713 1.00 0.00 H new ATOM 0 HB2 ASN A 46 2.106 -7.344 10.957 1.00 0.00 H new ATOM 0 HB3 ASN A 46 1.938 -7.346 9.213 1.00 0.00 H new ATOM 0 HD21 ASN A 46 3.719 -10.402 9.295 1.00 0.00 H new ATOM 0 HD22 ASN A 46 2.165 -9.599 9.049 1.00 0.00 H new ATOM 749 N GLU A 47 3.207 -5.588 12.343 1.00 0.00 N ATOM 750 CA GLU A 47 3.688 -5.294 13.687 1.00 0.00 C ATOM 751 C GLU A 47 4.648 -6.378 14.170 1.00 0.00 C ATOM 752 O GLU A 47 5.607 -6.097 14.888 1.00 0.00 O ATOM 753 CB GLU A 47 2.513 -5.168 14.658 1.00 0.00 C ATOM 754 CG GLU A 47 1.907 -6.503 15.056 1.00 0.00 C ATOM 755 CD GLU A 47 0.509 -6.363 15.628 1.00 0.00 C ATOM 756 OE1 GLU A 47 0.386 -6.181 16.857 1.00 0.00 O ATOM 757 OE2 GLU A 47 -0.461 -6.435 14.845 1.00 0.00 O ATOM 0 H GLU A 47 2.203 -5.757 12.282 1.00 0.00 H new ATOM 0 HA GLU A 47 4.225 -4.346 13.654 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.848 -4.649 15.556 1.00 0.00 H new ATOM 0 HB3 GLU A 47 1.740 -4.549 14.202 1.00 0.00 H new ATOM 0 HG2 GLU A 47 1.875 -7.157 14.185 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.550 -6.984 15.793 1.00 0.00 H new ATOM 764 N ALA A 48 4.380 -7.617 13.771 1.00 0.00 N ATOM 765 CA ALA A 48 5.219 -8.743 14.162 1.00 0.00 C ATOM 766 C ALA A 48 6.641 -8.576 13.636 1.00 0.00 C ATOM 767 O ALA A 48 7.602 -9.018 14.265 1.00 0.00 O ATOM 768 CB ALA A 48 4.619 -10.048 13.660 1.00 0.00 C ATOM 0 H ALA A 48 3.589 -7.866 13.177 1.00 0.00 H new ATOM 0 HA ALA A 48 5.263 -8.771 15.251 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.256 -10.880 13.959 1.00 0.00 H new ATOM 0 HB2 ALA A 48 3.625 -10.180 14.088 1.00 0.00 H new ATOM 0 HB3 ALA A 48 4.545 -10.020 12.573 1.00 0.00 H new ATOM 774 N GLY A 49 6.768 -7.936 12.477 1.00 0.00 N ATOM 775 CA GLY A 49 8.076 -7.724 11.886 1.00 0.00 C ATOM 776 C GLY A 49 8.252 -8.475 10.582 1.00 0.00 C ATOM 777 O GLY A 49 9.226 -8.260 9.860 1.00 0.00 O ATOM 0 H GLY A 49 5.988 -7.561 11.937 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.223 -6.658 11.711 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.845 -8.041 12.591 1.00 0.00 H new ATOM 781 N ARG A 50 7.308 -9.361 10.279 1.00 0.00 N ATOM 782 CA ARG A 50 7.364 -10.149 9.054 1.00 0.00 C ATOM 783 C ARG A 50 6.924 -9.318 7.852 1.00 0.00 C ATOM 784 O ARG A 50 5.785 -8.854 7.789 1.00 0.00 O ATOM 785 CB ARG A 50 6.481 -11.391 9.180 1.00 0.00 C ATOM 786 CG ARG A 50 7.197 -12.589 9.782 1.00 0.00 C ATOM 787 CD ARG A 50 6.532 -13.896 9.380 1.00 0.00 C ATOM 788 NE ARG A 50 7.369 -15.053 9.684 1.00 0.00 N ATOM 789 CZ ARG A 50 7.145 -16.270 9.201 1.00 0.00 C ATOM 790 NH1 ARG A 50 6.115 -16.487 8.395 1.00 0.00 N ATOM 791 NH2 ARG A 50 7.952 -17.272 9.524 1.00 0.00 N ATOM 0 H ARG A 50 6.495 -9.551 10.866 1.00 0.00 H new ATOM 0 HA ARG A 50 8.397 -10.461 8.900 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.614 -11.149 9.796 1.00 0.00 H new ATOM 0 HB3 ARG A 50 6.106 -11.661 8.193 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.237 -12.594 9.456 1.00 0.00 H new ATOM 0 HG3 ARG A 50 7.203 -12.502 10.869 1.00 0.00 H new ATOM 0 HD2 ARG A 50 5.579 -13.992 9.899 1.00 0.00 H new ATOM 0 HD3 ARG A 50 6.313 -13.878 8.312 1.00 0.00 H new ATOM 0 HE ARG A 50 8.170 -14.919 10.301 1.00 0.00 H new ATOM 0 HH11 ARG A 50 5.493 -15.719 8.145 1.00 0.00 H new ATOM 0 HH12 ARG A 50 5.945 -17.422 8.025 1.00 0.00 H new ATOM 0 HH21 ARG A 50 8.745 -17.108 10.144 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.779 -18.206 9.153 1.00 0.00 H new ATOM 805 N SER A 51 7.833 -9.135 6.900 1.00 0.00 N ATOM 806 CA SER A 51 7.540 -8.357 5.702 1.00 0.00 C ATOM 807 C SER A 51 7.443 -9.261 4.477 1.00 0.00 C ATOM 808 O SER A 51 8.266 -10.155 4.285 1.00 0.00 O ATOM 809 CB SER A 51 8.618 -7.294 5.482 1.00 0.00 C ATOM 810 OG SER A 51 9.906 -7.881 5.414 1.00 0.00 O ATOM 0 H SER A 51 8.779 -9.515 6.935 1.00 0.00 H new ATOM 0 HA SER A 51 6.578 -7.864 5.845 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.414 -6.750 4.560 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.588 -6.568 6.294 1.00 0.00 H new ATOM 0 HG SER A 51 10.577 -7.181 5.271 1.00 0.00 H new ATOM 816 N GLY A 52 6.431 -9.020 3.650 1.00 0.00 N ATOM 817 CA GLY A 52 6.244 -9.820 2.453 1.00 0.00 C ATOM 818 C GLY A 52 5.739 -9.001 1.281 1.00 0.00 C ATOM 819 O GLY A 52 5.292 -7.867 1.454 1.00 0.00 O ATOM 0 H GLY A 52 5.737 -8.285 3.787 1.00 0.00 H new ATOM 0 HA2 GLY A 52 7.189 -10.291 2.183 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.537 -10.623 2.663 1.00 0.00 H new ATOM 823 N TYR A 53 5.813 -9.575 0.086 1.00 0.00 N ATOM 824 CA TYR A 53 5.364 -8.889 -1.120 1.00 0.00 C ATOM 825 C TYR A 53 3.865 -9.077 -1.328 1.00 0.00 C ATOM 826 O TYR A 53 3.362 -10.202 -1.323 1.00 0.00 O ATOM 827 CB TYR A 53 6.128 -9.407 -2.340 1.00 0.00 C ATOM 828 CG TYR A 53 7.606 -9.090 -2.309 1.00 0.00 C ATOM 829 CD1 TYR A 53 8.058 -7.782 -2.432 1.00 0.00 C ATOM 830 CD2 TYR A 53 8.550 -10.098 -2.158 1.00 0.00 C ATOM 831 CE1 TYR A 53 9.408 -7.487 -2.404 1.00 0.00 C ATOM 832 CE2 TYR A 53 9.901 -9.812 -2.128 1.00 0.00 C ATOM 833 CZ TYR A 53 10.325 -8.506 -2.251 1.00 0.00 C ATOM 834 OH TYR A 53 11.671 -8.218 -2.223 1.00 0.00 O ATOM 0 H TYR A 53 6.179 -10.513 -0.074 1.00 0.00 H new ATOM 0 HA TYR A 53 5.565 -7.825 -0.998 1.00 0.00 H new ATOM 0 HB2 TYR A 53 5.998 -10.487 -2.408 1.00 0.00 H new ATOM 0 HB3 TYR A 53 5.692 -8.976 -3.241 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.342 -6.982 -2.552 1.00 0.00 H new ATOM 0 HD2 TYR A 53 8.222 -11.123 -2.062 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.743 -6.465 -2.501 1.00 0.00 H new ATOM 0 HE2 TYR A 53 10.622 -10.608 -2.009 1.00 0.00 H new ATOM 0 HH TYR A 53 12.181 -9.047 -2.108 1.00 0.00 H new ATOM 844 N ILE A 54 3.156 -7.968 -1.509 1.00 0.00 N ATOM 845 CA ILE A 54 1.714 -8.010 -1.720 1.00 0.00 C ATOM 846 C ILE A 54 1.319 -7.237 -2.974 1.00 0.00 C ATOM 847 O ILE A 54 1.971 -6.269 -3.367 1.00 0.00 O ATOM 848 CB ILE A 54 0.952 -7.432 -0.513 1.00 0.00 C ATOM 849 CG1 ILE A 54 1.133 -5.914 -0.447 1.00 0.00 C ATOM 850 CG2 ILE A 54 1.428 -8.085 0.776 1.00 0.00 C ATOM 851 CD1 ILE A 54 0.180 -5.233 0.510 1.00 0.00 C ATOM 0 H ILE A 54 3.556 -7.030 -1.514 1.00 0.00 H new ATOM 0 HA ILE A 54 1.443 -9.059 -1.842 1.00 0.00 H new ATOM 0 HB ILE A 54 -0.110 -7.647 -0.635 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.157 -5.691 -0.147 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.994 -5.496 -1.444 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.880 -7.666 1.620 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.252 -9.159 0.726 1.00 0.00 H new ATOM 0 HG23 ILE A 54 2.494 -7.898 0.907 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.365 -4.159 0.505 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -0.847 -5.425 0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.334 -5.623 1.516 1.00 0.00 H new ATOM 863 N PRO A 55 0.226 -7.671 -3.617 1.00 0.00 N ATOM 864 CA PRO A 55 -0.283 -7.033 -4.835 1.00 0.00 C ATOM 865 C PRO A 55 -0.871 -5.652 -4.564 1.00 0.00 C ATOM 866 O PRO A 55 -1.837 -5.515 -3.814 1.00 0.00 O ATOM 867 CB PRO A 55 -1.374 -7.995 -5.311 1.00 0.00 C ATOM 868 CG PRO A 55 -1.818 -8.703 -4.078 1.00 0.00 C ATOM 869 CD PRO A 55 -0.600 -8.819 -3.205 1.00 0.00 C ATOM 0 HA PRO A 55 0.506 -6.867 -5.568 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -2.199 -7.458 -5.778 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -0.989 -8.695 -6.053 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -2.609 -8.148 -3.573 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -2.222 -9.687 -4.317 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -0.858 -8.769 -2.147 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -0.081 -9.765 -3.363 1.00 0.00 H new ATOM 877 N SER A 56 -0.282 -4.632 -5.179 1.00 0.00 N ATOM 878 CA SER A 56 -0.746 -3.261 -5.001 1.00 0.00 C ATOM 879 C SER A 56 -2.243 -3.154 -5.276 1.00 0.00 C ATOM 880 O SER A 56 -2.890 -2.186 -4.881 1.00 0.00 O ATOM 881 CB SER A 56 0.023 -2.315 -5.926 1.00 0.00 C ATOM 882 OG SER A 56 -0.105 -0.970 -5.500 1.00 0.00 O ATOM 0 H SER A 56 0.517 -4.729 -5.805 1.00 0.00 H new ATOM 0 HA SER A 56 -0.563 -2.973 -3.966 1.00 0.00 H new ATOM 0 HB2 SER A 56 1.076 -2.595 -5.944 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.351 -2.414 -6.945 1.00 0.00 H new ATOM 0 HG SER A 56 0.785 -0.582 -5.369 1.00 0.00 H new ATOM 888 N ASN A 57 -2.786 -4.158 -5.958 1.00 0.00 N ATOM 889 CA ASN A 57 -4.206 -4.177 -6.288 1.00 0.00 C ATOM 890 C ASN A 57 -5.059 -4.150 -5.023 1.00 0.00 C ATOM 891 O ASN A 57 -6.223 -3.749 -5.055 1.00 0.00 O ATOM 892 CB ASN A 57 -4.542 -5.419 -7.116 1.00 0.00 C ATOM 893 CG ASN A 57 -4.392 -5.178 -8.606 1.00 0.00 C ATOM 894 OD1 ASN A 57 -5.139 -4.400 -9.198 1.00 0.00 O ATOM 895 ND2 ASN A 57 -3.423 -5.848 -9.219 1.00 0.00 N ATOM 0 H ASN A 57 -2.264 -4.968 -6.292 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.429 -3.286 -6.875 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -3.890 -6.240 -6.816 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -5.565 -5.729 -6.902 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -3.275 -5.728 -10.221 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -2.827 -6.483 -8.688 1.00 0.00 H new ATOM 902 N ILE A 58 -4.472 -4.580 -3.911 1.00 0.00 N ATOM 903 CA ILE A 58 -5.176 -4.603 -2.636 1.00 0.00 C ATOM 904 C ILE A 58 -4.654 -3.519 -1.699 1.00 0.00 C ATOM 905 O ILE A 58 -4.830 -3.597 -0.482 1.00 0.00 O ATOM 906 CB ILE A 58 -5.042 -5.972 -1.943 1.00 0.00 C ATOM 907 CG1 ILE A 58 -3.593 -6.211 -1.514 1.00 0.00 C ATOM 908 CG2 ILE A 58 -5.516 -7.083 -2.869 1.00 0.00 C ATOM 909 CD1 ILE A 58 -3.458 -7.163 -0.346 1.00 0.00 C ATOM 0 H ILE A 58 -3.510 -4.917 -3.868 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.228 -4.416 -2.854 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.670 -5.975 -1.052 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -3.032 -6.606 -2.361 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.139 -5.256 -1.249 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -5.415 -8.044 -2.365 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -6.561 -6.918 -3.130 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.911 -7.083 -3.776 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -2.404 -7.285 -0.096 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.991 -6.760 0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.882 -8.131 -0.614 1.00 0.00 H new ATOM 921 N LEU A 59 -4.014 -2.507 -2.273 1.00 0.00 N ATOM 922 CA LEU A 59 -3.467 -1.404 -1.490 1.00 0.00 C ATOM 923 C LEU A 59 -4.115 -0.081 -1.887 1.00 0.00 C ATOM 924 O LEU A 59 -4.145 0.277 -3.063 1.00 0.00 O ATOM 925 CB LEU A 59 -1.951 -1.320 -1.680 1.00 0.00 C ATOM 926 CG LEU A 59 -1.119 -2.325 -0.884 1.00 0.00 C ATOM 927 CD1 LEU A 59 0.361 -1.987 -0.979 1.00 0.00 C ATOM 928 CD2 LEU A 59 -1.568 -2.358 0.570 1.00 0.00 C ATOM 0 H LEU A 59 -3.861 -2.427 -3.278 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.685 -1.594 -0.439 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.730 -1.453 -2.739 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.626 -0.315 -1.410 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.273 -3.315 -1.313 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.938 -2.713 -0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.675 -2.016 -2.022 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.533 -0.989 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.964 -3.079 1.121 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.445 -1.369 1.011 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.617 -2.649 0.620 1.00 0.00 H new ATOM 940 N GLU A 60 -4.630 0.640 -0.896 1.00 0.00 N ATOM 941 CA GLU A 60 -5.275 1.924 -1.142 1.00 0.00 C ATOM 942 C GLU A 60 -4.666 3.016 -0.268 1.00 0.00 C ATOM 943 O GLU A 60 -4.150 2.759 0.820 1.00 0.00 O ATOM 944 CB GLU A 60 -6.779 1.823 -0.878 1.00 0.00 C ATOM 945 CG GLU A 60 -7.136 1.790 0.599 1.00 0.00 C ATOM 946 CD GLU A 60 -8.559 2.242 0.865 1.00 0.00 C ATOM 947 OE1 GLU A 60 -9.363 2.261 -0.090 1.00 0.00 O ATOM 948 OE2 GLU A 60 -8.867 2.578 2.028 1.00 0.00 O ATOM 0 H GLU A 60 -4.613 0.357 0.084 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.114 2.188 -2.187 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.279 2.671 -1.345 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.164 0.923 -1.357 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.004 0.777 0.979 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -6.446 2.429 1.150 1.00 0.00 H new ATOM 955 N PRO A 61 -4.726 4.265 -0.754 1.00 0.00 N ATOM 956 CA PRO A 61 -4.185 5.421 -0.033 1.00 0.00 C ATOM 957 C PRO A 61 -4.999 5.762 1.210 1.00 0.00 C ATOM 958 O PRO A 61 -5.838 6.663 1.188 1.00 0.00 O ATOM 959 CB PRO A 61 -4.278 6.553 -1.060 1.00 0.00 C ATOM 960 CG PRO A 61 -5.379 6.145 -1.976 1.00 0.00 C ATOM 961 CD PRO A 61 -5.326 4.644 -2.044 1.00 0.00 C ATOM 0 HA PRO A 61 -3.174 5.238 0.331 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -4.496 7.507 -0.579 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -3.339 6.676 -1.600 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -6.345 6.485 -1.601 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -5.248 6.585 -2.964 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -6.319 4.212 -2.168 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -4.722 4.301 -2.884 1.00 0.00 H new ATOM 969 N LEU A 62 -4.746 5.036 2.294 1.00 0.00 N ATOM 970 CA LEU A 62 -5.455 5.262 3.549 1.00 0.00 C ATOM 971 C LEU A 62 -5.257 6.694 4.036 1.00 0.00 C ATOM 972 O LEU A 62 -6.139 7.271 4.672 1.00 0.00 O ATOM 973 CB LEU A 62 -4.973 4.277 4.614 1.00 0.00 C ATOM 974 CG LEU A 62 -3.661 4.634 5.314 1.00 0.00 C ATOM 975 CD1 LEU A 62 -3.927 5.489 6.543 1.00 0.00 C ATOM 976 CD2 LEU A 62 -2.899 3.373 5.694 1.00 0.00 C ATOM 0 H LEU A 62 -4.055 4.286 2.329 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.519 5.103 3.371 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.751 4.182 5.371 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.859 3.298 4.149 1.00 0.00 H new ATOM 0 HG LEU A 62 -3.047 5.211 4.622 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.982 5.733 7.028 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.430 6.409 6.244 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.560 4.939 7.239 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.968 3.646 6.191 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.507 2.770 6.368 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.675 2.798 4.795 1.00 0.00 H new ATOM 988 N SER A 63 -4.095 7.261 3.732 1.00 0.00 N ATOM 989 CA SER A 63 -3.780 8.625 4.140 1.00 0.00 C ATOM 990 C SER A 63 -4.624 9.633 3.367 1.00 0.00 C ATOM 991 O SER A 63 -4.942 9.425 2.196 1.00 0.00 O ATOM 992 CB SER A 63 -2.293 8.915 3.923 1.00 0.00 C ATOM 993 OG SER A 63 -1.486 8.064 4.718 1.00 0.00 O ATOM 0 H SER A 63 -3.355 6.797 3.204 1.00 0.00 H new ATOM 0 HA SER A 63 -4.011 8.722 5.201 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.043 8.780 2.871 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.082 9.956 4.170 1.00 0.00 H new ATOM 0 HG SER A 63 -0.541 8.268 4.560 1.00 0.00 H new ATOM 999 N GLY A 64 -4.986 10.727 4.031 1.00 0.00 N ATOM 1000 CA GLY A 64 -5.790 11.751 3.391 1.00 0.00 C ATOM 1001 C GLY A 64 -7.193 11.827 3.961 1.00 0.00 C ATOM 1002 O GLY A 64 -7.540 11.120 4.907 1.00 0.00 O ATOM 0 H GLY A 64 -4.737 10.922 5.001 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.301 12.718 3.507 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -5.846 11.549 2.321 1.00 0.00 H new ATOM 1006 N PRO A 65 -8.026 12.702 3.380 1.00 0.00 N ATOM 1007 CA PRO A 65 -9.412 12.889 3.820 1.00 0.00 C ATOM 1008 C PRO A 65 -10.291 11.687 3.494 1.00 0.00 C ATOM 1009 O PRO A 65 -11.335 11.483 4.113 1.00 0.00 O ATOM 1010 CB PRO A 65 -9.872 14.118 3.032 1.00 0.00 C ATOM 1011 CG PRO A 65 -9.008 14.134 1.818 1.00 0.00 C ATOM 1012 CD PRO A 65 -7.679 13.577 2.247 1.00 0.00 C ATOM 0 HA PRO A 65 -9.484 13.008 4.901 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -10.927 14.046 2.766 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -9.752 15.031 3.616 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.444 13.532 1.021 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -8.900 15.147 1.430 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -7.198 13.021 1.442 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -6.990 14.367 2.546 1.00 0.00 H new ATOM 1020 N SER A 66 -9.861 10.893 2.518 1.00 0.00 N ATOM 1021 CA SER A 66 -10.612 9.712 2.107 1.00 0.00 C ATOM 1022 C SER A 66 -10.797 8.752 3.277 1.00 0.00 C ATOM 1023 O SER A 66 -9.867 8.045 3.668 1.00 0.00 O ATOM 1024 CB SER A 66 -9.895 9.001 0.957 1.00 0.00 C ATOM 1025 OG SER A 66 -8.565 8.669 1.313 1.00 0.00 O ATOM 0 H SER A 66 -8.997 11.046 1.998 1.00 0.00 H new ATOM 0 HA SER A 66 -11.596 10.037 1.767 1.00 0.00 H new ATOM 0 HB2 SER A 66 -10.440 8.096 0.689 1.00 0.00 H new ATOM 0 HB3 SER A 66 -9.890 9.642 0.076 1.00 0.00 H new ATOM 0 HG SER A 66 -8.545 8.343 2.237 1.00 0.00 H new ATOM 1031 N SER A 67 -12.004 8.732 3.834 1.00 0.00 N ATOM 1032 CA SER A 67 -12.311 7.862 4.962 1.00 0.00 C ATOM 1033 C SER A 67 -13.479 6.937 4.633 1.00 0.00 C ATOM 1034 O SER A 67 -14.607 7.388 4.440 1.00 0.00 O ATOM 1035 CB SER A 67 -12.640 8.696 6.202 1.00 0.00 C ATOM 1036 OG SER A 67 -13.752 9.542 5.967 1.00 0.00 O ATOM 0 H SER A 67 -12.785 9.309 3.522 1.00 0.00 H new ATOM 0 HA SER A 67 -11.432 7.250 5.167 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.853 8.035 7.042 1.00 0.00 H new ATOM 0 HB3 SER A 67 -11.774 9.297 6.480 1.00 0.00 H new ATOM 0 HG SER A 67 -14.367 9.107 5.341 1.00 0.00 H new ATOM 1042 N GLY A 68 -13.199 5.639 4.571 1.00 0.00 N ATOM 1043 CA GLY A 68 -14.235 4.670 4.264 1.00 0.00 C ATOM 1044 C GLY A 68 -13.977 3.937 2.963 1.00 0.00 C ATOM 1045 O GLY A 68 -12.828 3.688 2.600 1.00 0.00 O ATOM 0 H GLY A 68 -12.273 5.241 4.728 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -14.304 3.947 5.077 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -15.198 5.178 4.206 1.00 0.00 H new TER 1049 GLY A 68