USER MOD reduce.3.24.130724 H: found=0, std=0, add=524, rem=0, adj=17 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 32:sc= 0.536 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+ -157:sc= -0.117 (180deg=-0.628) USER MOD Single : A 10 MET CE :methyl -114:sc= -0.311 (180deg=-3.79!) USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.0763 K(o=-0.076,f=-1.8!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.201 K(o=-0.2,f=-1.2) USER MOD Single : A 31 LYS NZ :NH3+ 158:sc= -0.0727 (180deg=-0.428) USER MOD Single : A 37 HIS : no HD1:sc= -0.308 X(o=-0.31,f=-0.24) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0459) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.8! C(o=-0.8!,f=-17!) 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 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.515 19.856 14.236 1.00 0.00 N ATOM 2 CA GLY A 1 17.732 19.920 12.802 1.00 0.00 C ATOM 3 C GLY A 1 16.771 19.038 12.031 1.00 0.00 C ATOM 4 O GLY A 1 15.653 19.449 11.721 1.00 0.00 O ATOM 0 H1 GLY A 1 18.197 20.476 14.718 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.547 20.168 14.455 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.645 18.878 14.563 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.623 20.951 12.467 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.756 19.619 12.579 1.00 0.00 H new ATOM 8 N SER A 2 17.207 17.822 11.718 1.00 0.00 N ATOM 9 CA SER A 2 16.378 16.881 10.973 1.00 0.00 C ATOM 10 C SER A 2 15.499 16.065 11.916 1.00 0.00 C ATOM 11 O SER A 2 15.999 15.345 12.781 1.00 0.00 O ATOM 12 CB SER A 2 17.256 15.946 10.139 1.00 0.00 C ATOM 13 OG SER A 2 18.097 15.162 10.968 1.00 0.00 O ATOM 0 H SER A 2 18.129 17.465 11.969 1.00 0.00 H new ATOM 0 HA SER A 2 15.732 17.453 10.307 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.626 15.294 9.534 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.864 16.532 9.449 1.00 0.00 H new ATOM 0 HG SER A 2 17.641 14.977 11.816 1.00 0.00 H new ATOM 19 N SER A 3 14.187 16.185 11.743 1.00 0.00 N ATOM 20 CA SER A 3 13.237 15.462 12.581 1.00 0.00 C ATOM 21 C SER A 3 11.990 15.085 11.787 1.00 0.00 C ATOM 22 O SER A 3 11.175 15.942 11.445 1.00 0.00 O ATOM 23 CB SER A 3 12.846 16.309 13.793 1.00 0.00 C ATOM 24 OG SER A 3 11.845 15.667 14.563 1.00 0.00 O ATOM 0 H SER A 3 13.757 16.775 11.031 1.00 0.00 H new ATOM 0 HA SER A 3 13.718 14.547 12.926 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.725 16.491 14.412 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.484 17.282 13.459 1.00 0.00 H new ATOM 0 HG SER A 3 11.614 16.228 15.332 1.00 0.00 H new ATOM 30 N GLY A 4 11.848 13.796 11.496 1.00 0.00 N ATOM 31 CA GLY A 4 10.698 13.327 10.745 1.00 0.00 C ATOM 32 C GLY A 4 10.899 11.931 10.189 1.00 0.00 C ATOM 33 O GLY A 4 11.873 11.670 9.483 1.00 0.00 O ATOM 0 H GLY A 4 12.509 13.068 11.767 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.819 13.335 11.390 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.498 14.016 9.925 1.00 0.00 H new ATOM 37 N SER A 5 9.976 11.029 10.510 1.00 0.00 N ATOM 38 CA SER A 5 10.059 9.650 10.043 1.00 0.00 C ATOM 39 C SER A 5 9.372 9.493 8.690 1.00 0.00 C ATOM 40 O SER A 5 8.157 9.310 8.617 1.00 0.00 O ATOM 41 CB SER A 5 9.424 8.705 11.064 1.00 0.00 C ATOM 42 OG SER A 5 10.350 8.351 12.077 1.00 0.00 O ATOM 0 H SER A 5 9.162 11.229 11.092 1.00 0.00 H new ATOM 0 HA SER A 5 11.112 9.393 9.928 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.553 9.182 11.514 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.070 7.806 10.560 1.00 0.00 H new ATOM 0 HG SER A 5 9.919 7.748 12.718 1.00 0.00 H new ATOM 48 N SER A 6 10.159 9.565 7.622 1.00 0.00 N ATOM 49 CA SER A 6 9.627 9.434 6.270 1.00 0.00 C ATOM 50 C SER A 6 9.270 7.983 5.965 1.00 0.00 C ATOM 51 O SER A 6 10.147 7.151 5.735 1.00 0.00 O ATOM 52 CB SER A 6 10.643 9.947 5.248 1.00 0.00 C ATOM 53 OG SER A 6 10.018 10.236 4.009 1.00 0.00 O ATOM 0 H SER A 6 11.167 9.713 7.666 1.00 0.00 H new ATOM 0 HA SER A 6 8.720 10.035 6.203 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.129 10.844 5.632 1.00 0.00 H new ATOM 0 HB3 SER A 6 11.423 9.201 5.100 1.00 0.00 H new ATOM 0 HG SER A 6 10.688 10.564 3.373 1.00 0.00 H new ATOM 59 N GLY A 7 7.974 7.686 5.965 1.00 0.00 N ATOM 60 CA GLY A 7 7.522 6.335 5.687 1.00 0.00 C ATOM 61 C GLY A 7 6.148 6.304 5.048 1.00 0.00 C ATOM 62 O GLY A 7 5.254 7.054 5.442 1.00 0.00 O ATOM 0 H GLY A 7 7.229 8.357 6.153 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.237 5.844 5.027 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.501 5.764 6.615 1.00 0.00 H new ATOM 66 N LEU A 8 5.977 5.435 4.058 1.00 0.00 N ATOM 67 CA LEU A 8 4.702 5.309 3.361 1.00 0.00 C ATOM 68 C LEU A 8 3.818 4.261 4.029 1.00 0.00 C ATOM 69 O LEU A 8 4.284 3.184 4.400 1.00 0.00 O ATOM 70 CB LEU A 8 4.934 4.938 1.895 1.00 0.00 C ATOM 71 CG LEU A 8 3.700 4.966 0.993 1.00 0.00 C ATOM 72 CD1 LEU A 8 4.109 4.941 -0.472 1.00 0.00 C ATOM 73 CD2 LEU A 8 2.780 3.796 1.311 1.00 0.00 C ATOM 0 H LEU A 8 6.706 4.807 3.720 1.00 0.00 H new ATOM 0 HA LEU A 8 4.193 6.272 3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 8 5.677 5.620 1.482 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.364 3.937 1.858 1.00 0.00 H new ATOM 0 HG LEU A 8 3.157 5.892 1.182 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.218 4.961 -1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 8 4.727 5.811 -0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 8 4.675 4.032 -0.676 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.907 3.832 0.659 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.314 2.859 1.151 1.00 0.00 H new ATOM 0 HD23 LEU A 8 2.459 3.858 2.351 1.00 0.00 H new ATOM 85 N LYS A 9 2.537 4.583 4.178 1.00 0.00 N ATOM 86 CA LYS A 9 1.585 3.669 4.797 1.00 0.00 C ATOM 87 C LYS A 9 0.383 3.436 3.887 1.00 0.00 C ATOM 88 O LYS A 9 -0.083 4.353 3.213 1.00 0.00 O ATOM 89 CB LYS A 9 1.118 4.223 6.145 1.00 0.00 C ATOM 90 CG LYS A 9 2.200 4.223 7.211 1.00 0.00 C ATOM 91 CD LYS A 9 2.437 2.829 7.765 1.00 0.00 C ATOM 92 CE LYS A 9 1.349 2.428 8.750 1.00 0.00 C ATOM 93 NZ LYS A 9 1.305 3.338 9.928 1.00 0.00 N ATOM 0 H LYS A 9 2.135 5.471 3.878 1.00 0.00 H new ATOM 0 HA LYS A 9 2.087 2.715 4.957 1.00 0.00 H new ATOM 0 HB2 LYS A 9 0.758 5.242 6.004 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.272 3.632 6.498 1.00 0.00 H new ATOM 0 HG2 LYS A 9 3.127 4.610 6.789 1.00 0.00 H new ATOM 0 HG3 LYS A 9 1.914 4.894 8.021 1.00 0.00 H new ATOM 0 HD2 LYS A 9 2.470 2.111 6.945 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.408 2.793 8.259 1.00 0.00 H new ATOM 0 HE2 LYS A 9 0.382 2.438 8.247 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.523 1.406 9.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 0.860 2.847 10.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.273 3.617 10.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.752 4.186 9.691 1.00 0.00 H new ATOM 107 N MET A 10 -0.114 2.204 3.875 1.00 0.00 N ATOM 108 CA MET A 10 -1.264 1.852 3.050 1.00 0.00 C ATOM 109 C MET A 10 -2.180 0.876 3.781 1.00 0.00 C ATOM 110 O MET A 10 -1.741 0.146 4.669 1.00 0.00 O ATOM 111 CB MET A 10 -0.800 1.240 1.726 1.00 0.00 C ATOM 112 CG MET A 10 -0.256 2.262 0.742 1.00 0.00 C ATOM 113 SD MET A 10 -0.365 1.705 -0.970 1.00 0.00 S ATOM 114 CE MET A 10 -1.709 2.724 -1.573 1.00 0.00 C ATOM 0 H MET A 10 0.261 1.433 4.427 1.00 0.00 H new ATOM 0 HA MET A 10 -1.825 2.764 2.844 1.00 0.00 H new ATOM 0 HB2 MET A 10 -0.029 0.497 1.929 1.00 0.00 H new ATOM 0 HB3 MET A 10 -1.636 0.714 1.266 1.00 0.00 H new ATOM 0 HG2 MET A 10 -0.807 3.196 0.852 1.00 0.00 H new ATOM 0 HG3 MET A 10 0.785 2.476 0.985 1.00 0.00 H new ATOM 0 HE1 MET A 10 -2.563 2.092 -1.818 1.00 0.00 H new ATOM 0 HE2 MET A 10 -1.996 3.440 -0.803 1.00 0.00 H new ATOM 0 HE3 MET A 10 -1.387 3.260 -2.465 1.00 0.00 H new ATOM 124 N GLN A 11 -3.454 0.870 3.402 1.00 0.00 N ATOM 125 CA GLN A 11 -4.431 -0.016 4.024 1.00 0.00 C ATOM 126 C GLN A 11 -4.899 -1.085 3.041 1.00 0.00 C ATOM 127 O GLN A 11 -5.149 -0.800 1.870 1.00 0.00 O ATOM 128 CB GLN A 11 -5.630 0.788 4.530 1.00 0.00 C ATOM 129 CG GLN A 11 -6.451 1.421 3.419 1.00 0.00 C ATOM 130 CD GLN A 11 -7.693 2.120 3.936 1.00 0.00 C ATOM 131 OE1 GLN A 11 -7.694 2.676 5.035 1.00 0.00 O ATOM 132 NE2 GLN A 11 -8.759 2.095 3.145 1.00 0.00 N ATOM 0 H GLN A 11 -3.833 1.468 2.668 1.00 0.00 H new ATOM 0 HA GLN A 11 -3.951 -0.510 4.869 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -6.273 0.134 5.118 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -5.275 1.571 5.199 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.833 2.139 2.880 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.743 0.651 2.705 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -8.713 1.622 2.242 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -9.624 2.548 3.440 1.00 0.00 H new ATOM 141 N VAL A 12 -5.015 -2.317 3.526 1.00 0.00 N ATOM 142 CA VAL A 12 -5.454 -3.429 2.692 1.00 0.00 C ATOM 143 C VAL A 12 -6.913 -3.266 2.280 1.00 0.00 C ATOM 144 O VAL A 12 -7.733 -2.763 3.049 1.00 0.00 O ATOM 145 CB VAL A 12 -5.285 -4.777 3.418 1.00 0.00 C ATOM 146 CG1 VAL A 12 -5.690 -5.928 2.510 1.00 0.00 C ATOM 147 CG2 VAL A 12 -3.852 -4.946 3.900 1.00 0.00 C ATOM 0 H VAL A 12 -4.811 -2.570 4.493 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.825 -3.423 1.802 1.00 0.00 H new ATOM 0 HB VAL A 12 -5.941 -4.785 4.289 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.564 -6.872 3.041 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -6.734 -5.812 2.219 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.063 -5.926 1.618 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.750 -5.904 4.411 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.175 -4.916 3.046 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.602 -4.139 4.589 1.00 0.00 H new ATOM 157 N LEU A 13 -7.230 -3.694 1.063 1.00 0.00 N ATOM 158 CA LEU A 13 -8.591 -3.595 0.549 1.00 0.00 C ATOM 159 C LEU A 13 -9.243 -4.972 0.466 1.00 0.00 C ATOM 160 O LEU A 13 -10.356 -5.173 0.953 1.00 0.00 O ATOM 161 CB LEU A 13 -8.589 -2.936 -0.832 1.00 0.00 C ATOM 162 CG LEU A 13 -9.941 -2.429 -1.335 1.00 0.00 C ATOM 163 CD1 LEU A 13 -10.421 -1.260 -0.489 1.00 0.00 C ATOM 164 CD2 LEU A 13 -9.848 -2.026 -2.800 1.00 0.00 C ATOM 0 H LEU A 13 -6.563 -4.113 0.414 1.00 0.00 H new ATOM 0 HA LEU A 13 -9.169 -2.980 1.238 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.894 -2.097 -0.811 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.201 -3.654 -1.555 1.00 0.00 H new ATOM 0 HG LEU A 13 -10.666 -3.238 -1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.385 -0.912 -0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.527 -1.580 0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -9.696 -0.448 -0.545 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -10.819 -1.668 -3.141 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -9.109 -1.233 -2.913 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.549 -2.888 -3.396 1.00 0.00 H new ATOM 176 N TYR A 14 -8.542 -5.917 -0.150 1.00 0.00 N ATOM 177 CA TYR A 14 -9.052 -7.275 -0.296 1.00 0.00 C ATOM 178 C TYR A 14 -8.177 -8.270 0.461 1.00 0.00 C ATOM 179 O TYR A 14 -6.960 -8.307 0.277 1.00 0.00 O ATOM 180 CB TYR A 14 -9.120 -7.660 -1.775 1.00 0.00 C ATOM 181 CG TYR A 14 -9.959 -6.718 -2.608 1.00 0.00 C ATOM 182 CD1 TYR A 14 -11.347 -6.781 -2.579 1.00 0.00 C ATOM 183 CD2 TYR A 14 -9.364 -5.763 -3.423 1.00 0.00 C ATOM 184 CE1 TYR A 14 -12.117 -5.922 -3.339 1.00 0.00 C ATOM 185 CE2 TYR A 14 -10.126 -4.899 -4.186 1.00 0.00 C ATOM 186 CZ TYR A 14 -11.502 -4.983 -4.140 1.00 0.00 C ATOM 187 OH TYR A 14 -12.266 -4.125 -4.898 1.00 0.00 O ATOM 0 H TYR A 14 -7.619 -5.768 -0.556 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.056 -7.307 0.127 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -8.109 -7.688 -2.181 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -9.526 -8.668 -1.861 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.832 -7.514 -1.952 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -8.287 -5.695 -3.461 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -13.195 -5.986 -3.306 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -9.647 -4.163 -4.814 1.00 0.00 H new ATOM 0 HH TYR A 14 -11.679 -3.525 -5.404 1.00 0.00 H new ATOM 197 N GLU A 15 -8.806 -9.075 1.310 1.00 0.00 N ATOM 198 CA GLU A 15 -8.086 -10.071 2.095 1.00 0.00 C ATOM 199 C GLU A 15 -7.253 -10.976 1.192 1.00 0.00 C ATOM 200 O GLU A 15 -7.772 -11.589 0.259 1.00 0.00 O ATOM 201 CB GLU A 15 -9.065 -10.912 2.916 1.00 0.00 C ATOM 202 CG GLU A 15 -8.408 -12.073 3.644 1.00 0.00 C ATOM 203 CD GLU A 15 -9.382 -13.194 3.953 1.00 0.00 C ATOM 204 OE1 GLU A 15 -10.041 -13.683 3.012 1.00 0.00 O ATOM 205 OE2 GLU A 15 -9.486 -13.581 5.136 1.00 0.00 O ATOM 0 H GLU A 15 -9.813 -9.057 1.472 1.00 0.00 H new ATOM 0 HA GLU A 15 -7.414 -9.545 2.773 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -9.560 -10.270 3.645 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -9.840 -11.300 2.255 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -7.592 -12.463 3.036 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -7.968 -11.712 4.574 1.00 0.00 H new ATOM 212 N PHE A 16 -5.957 -11.055 1.476 1.00 0.00 N ATOM 213 CA PHE A 16 -5.050 -11.883 0.690 1.00 0.00 C ATOM 214 C PHE A 16 -4.280 -12.849 1.586 1.00 0.00 C ATOM 215 O PHE A 16 -3.997 -12.544 2.744 1.00 0.00 O ATOM 216 CB PHE A 16 -4.072 -11.005 -0.092 1.00 0.00 C ATOM 217 CG PHE A 16 -3.028 -11.787 -0.837 1.00 0.00 C ATOM 218 CD1 PHE A 16 -3.274 -12.251 -2.119 1.00 0.00 C ATOM 219 CD2 PHE A 16 -1.800 -12.058 -0.254 1.00 0.00 C ATOM 220 CE1 PHE A 16 -2.315 -12.972 -2.805 1.00 0.00 C ATOM 221 CE2 PHE A 16 -0.837 -12.778 -0.936 1.00 0.00 C ATOM 222 CZ PHE A 16 -1.095 -13.234 -2.214 1.00 0.00 C ATOM 0 H PHE A 16 -5.511 -10.555 2.245 1.00 0.00 H new ATOM 0 HA PHE A 16 -5.647 -12.465 -0.013 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.631 -10.394 -0.801 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -3.578 -10.321 0.598 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.226 -12.047 -2.587 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.593 -11.703 0.745 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.520 -13.330 -3.803 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.116 -12.984 -0.470 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.344 -13.795 -2.750 1.00 0.00 H new ATOM 232 N GLU A 17 -3.946 -14.014 1.041 1.00 0.00 N ATOM 233 CA GLU A 17 -3.210 -15.025 1.792 1.00 0.00 C ATOM 234 C GLU A 17 -1.847 -15.289 1.157 1.00 0.00 C ATOM 235 O GLU A 17 -1.736 -15.438 -0.059 1.00 0.00 O ATOM 236 CB GLU A 17 -4.013 -16.325 1.861 1.00 0.00 C ATOM 237 CG GLU A 17 -5.057 -16.338 2.965 1.00 0.00 C ATOM 238 CD GLU A 17 -6.237 -17.233 2.642 1.00 0.00 C ATOM 239 OE1 GLU A 17 -6.060 -18.185 1.852 1.00 0.00 O ATOM 240 OE2 GLU A 17 -7.337 -16.983 3.178 1.00 0.00 O ATOM 0 H GLU A 17 -4.173 -14.281 0.083 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.054 -14.649 2.803 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -4.507 -16.488 0.903 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.327 -17.158 2.012 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.595 -16.674 3.893 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -5.413 -15.322 3.136 1.00 0.00 H new ATOM 247 N ALA A 18 -0.814 -15.344 1.991 1.00 0.00 N ATOM 248 CA ALA A 18 0.541 -15.592 1.513 1.00 0.00 C ATOM 249 C ALA A 18 0.738 -17.062 1.160 1.00 0.00 C ATOM 250 O ALA A 18 0.460 -17.947 1.968 1.00 0.00 O ATOM 251 CB ALA A 18 1.557 -15.157 2.559 1.00 0.00 C ATOM 0 H ALA A 18 -0.889 -15.220 3.001 1.00 0.00 H new ATOM 0 HA ALA A 18 0.694 -15.005 0.608 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.564 -15.348 2.189 1.00 0.00 H new ATOM 0 HB2 ALA A 18 1.440 -14.092 2.759 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.396 -15.719 3.479 1.00 0.00 H new ATOM 257 N ARG A 19 1.220 -17.314 -0.053 1.00 0.00 N ATOM 258 CA ARG A 19 1.453 -18.677 -0.514 1.00 0.00 C ATOM 259 C ARG A 19 2.941 -19.014 -0.488 1.00 0.00 C ATOM 260 O ARG A 19 3.324 -20.163 -0.277 1.00 0.00 O ATOM 261 CB ARG A 19 0.902 -18.861 -1.930 1.00 0.00 C ATOM 262 CG ARG A 19 -0.616 -18.916 -1.990 1.00 0.00 C ATOM 263 CD ARG A 19 -1.115 -18.959 -3.426 1.00 0.00 C ATOM 264 NE ARG A 19 -1.093 -20.313 -3.972 1.00 0.00 N ATOM 265 CZ ARG A 19 -0.019 -20.866 -4.524 1.00 0.00 C ATOM 266 NH1 ARG A 19 1.116 -20.185 -4.602 1.00 0.00 N ATOM 267 NH2 ARG A 19 -0.078 -22.104 -4.999 1.00 0.00 N ATOM 0 H ARG A 19 1.457 -16.592 -0.734 1.00 0.00 H new ATOM 0 HA ARG A 19 0.933 -19.356 0.162 1.00 0.00 H new ATOM 0 HB2 ARG A 19 1.253 -18.041 -2.557 1.00 0.00 H new ATOM 0 HB3 ARG A 19 1.308 -19.781 -2.352 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -0.971 -19.796 -1.454 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -1.033 -18.045 -1.485 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -2.131 -18.567 -3.469 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -0.497 -18.309 -4.044 1.00 0.00 H new ATOM 0 HE ARG A 19 -1.950 -20.865 -3.927 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.166 -19.234 -4.237 1.00 0.00 H new ATOM 0 HH12 ARG A 19 1.939 -20.612 -5.026 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -0.949 -22.632 -4.940 1.00 0.00 H new ATOM 0 HH22 ARG A 19 0.748 -22.528 -5.423 1.00 0.00 H new ATOM 281 N ASN A 20 3.775 -18.001 -0.705 1.00 0.00 N ATOM 282 CA ASN A 20 5.221 -18.190 -0.708 1.00 0.00 C ATOM 283 C ASN A 20 5.814 -17.867 0.660 1.00 0.00 C ATOM 284 O ASN A 20 5.184 -17.227 1.502 1.00 0.00 O ATOM 285 CB ASN A 20 5.869 -17.309 -1.778 1.00 0.00 C ATOM 286 CG ASN A 20 6.035 -18.032 -3.100 1.00 0.00 C ATOM 287 OD1 ASN A 20 6.661 -19.090 -3.167 1.00 0.00 O ATOM 288 ND2 ASN A 20 5.472 -17.464 -4.160 1.00 0.00 N ATOM 0 H ASN A 20 3.474 -17.042 -0.881 1.00 0.00 H new ATOM 0 HA ASN A 20 5.426 -19.236 -0.935 1.00 0.00 H new ATOM 0 HB2 ASN A 20 5.260 -16.418 -1.929 1.00 0.00 H new ATOM 0 HB3 ASN A 20 6.844 -16.973 -1.426 1.00 0.00 H new ATOM 0 HD21 ASN A 20 5.549 -17.905 -5.076 1.00 0.00 H new ATOM 0 HD22 ASN A 20 4.962 -16.586 -4.058 1.00 0.00 H new ATOM 295 N PRO A 21 7.056 -18.319 0.888 1.00 0.00 N ATOM 296 CA PRO A 21 7.762 -18.090 2.152 1.00 0.00 C ATOM 297 C PRO A 21 8.155 -16.628 2.340 1.00 0.00 C ATOM 298 O PRO A 21 8.456 -16.194 3.452 1.00 0.00 O ATOM 299 CB PRO A 21 9.011 -18.966 2.025 1.00 0.00 C ATOM 300 CG PRO A 21 9.233 -19.099 0.558 1.00 0.00 C ATOM 301 CD PRO A 21 7.866 -19.089 -0.070 1.00 0.00 C ATOM 0 HA PRO A 21 7.141 -18.331 3.015 1.00 0.00 H new ATOM 0 HB2 PRO A 21 9.869 -18.506 2.515 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.861 -19.939 2.493 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.842 -18.278 0.179 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.763 -20.023 0.326 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.879 -18.619 -1.054 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.478 -20.099 -0.204 1.00 0.00 H new ATOM 309 N ARG A 22 8.148 -15.873 1.246 1.00 0.00 N ATOM 310 CA ARG A 22 8.504 -14.460 1.290 1.00 0.00 C ATOM 311 C ARG A 22 7.255 -13.585 1.298 1.00 0.00 C ATOM 312 O ARG A 22 7.346 -12.358 1.320 1.00 0.00 O ATOM 313 CB ARG A 22 9.387 -14.097 0.095 1.00 0.00 C ATOM 314 CG ARG A 22 8.669 -14.185 -1.242 1.00 0.00 C ATOM 315 CD ARG A 22 9.517 -13.615 -2.368 1.00 0.00 C ATOM 316 NE ARG A 22 8.952 -13.912 -3.682 1.00 0.00 N ATOM 317 CZ ARG A 22 9.109 -15.076 -4.303 1.00 0.00 C ATOM 318 NH1 ARG A 22 9.808 -16.047 -3.732 1.00 0.00 N ATOM 319 NH2 ARG A 22 8.564 -15.270 -5.497 1.00 0.00 N ATOM 0 H ARG A 22 7.900 -16.217 0.318 1.00 0.00 H new ATOM 0 HA ARG A 22 9.059 -14.279 2.211 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.766 -13.084 0.228 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.251 -14.761 0.078 1.00 0.00 H new ATOM 0 HG2 ARG A 22 8.427 -15.225 -1.458 1.00 0.00 H new ATOM 0 HG3 ARG A 22 7.725 -13.643 -1.186 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.603 -12.535 -2.246 1.00 0.00 H new ATOM 0 HD3 ARG A 22 10.525 -14.025 -2.306 1.00 0.00 H new ATOM 0 HE ARG A 22 8.407 -13.186 -4.148 1.00 0.00 H new ATOM 0 HH11 ARG A 22 10.227 -15.902 -2.813 1.00 0.00 H new ATOM 0 HH12 ARG A 22 9.927 -16.940 -4.211 1.00 0.00 H new ATOM 0 HH21 ARG A 22 8.024 -14.525 -5.938 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.685 -16.164 -5.974 1.00 0.00 H new ATOM 333 N GLU A 23 6.090 -14.225 1.280 1.00 0.00 N ATOM 334 CA GLU A 23 4.822 -13.503 1.284 1.00 0.00 C ATOM 335 C GLU A 23 4.313 -13.306 2.709 1.00 0.00 C ATOM 336 O GLU A 23 4.847 -13.883 3.657 1.00 0.00 O ATOM 337 CB GLU A 23 3.779 -14.257 0.457 1.00 0.00 C ATOM 338 CG GLU A 23 3.870 -13.982 -1.035 1.00 0.00 C ATOM 339 CD GLU A 23 2.782 -14.684 -1.825 1.00 0.00 C ATOM 340 OE1 GLU A 23 1.628 -14.206 -1.798 1.00 0.00 O ATOM 341 OE2 GLU A 23 3.084 -15.710 -2.469 1.00 0.00 O ATOM 0 H GLU A 23 5.997 -15.241 1.263 1.00 0.00 H new ATOM 0 HA GLU A 23 4.989 -12.523 0.838 1.00 0.00 H new ATOM 0 HB2 GLU A 23 3.896 -15.327 0.628 1.00 0.00 H new ATOM 0 HB3 GLU A 23 2.784 -13.985 0.808 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.803 -12.908 -1.207 1.00 0.00 H new ATOM 0 HG3 GLU A 23 4.845 -14.304 -1.401 1.00 0.00 H new ATOM 348 N LEU A 24 3.276 -12.487 2.852 1.00 0.00 N ATOM 349 CA LEU A 24 2.694 -12.213 4.161 1.00 0.00 C ATOM 350 C LEU A 24 1.175 -12.103 4.068 1.00 0.00 C ATOM 351 O LEU A 24 0.643 -11.399 3.209 1.00 0.00 O ATOM 352 CB LEU A 24 3.275 -10.922 4.739 1.00 0.00 C ATOM 353 CG LEU A 24 2.746 -10.502 6.111 1.00 0.00 C ATOM 354 CD1 LEU A 24 3.529 -11.189 7.219 1.00 0.00 C ATOM 355 CD2 LEU A 24 2.810 -8.990 6.268 1.00 0.00 C ATOM 0 H LEU A 24 2.822 -12.002 2.078 1.00 0.00 H new ATOM 0 HA LEU A 24 2.941 -13.043 4.823 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.357 -11.033 4.808 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.082 -10.113 4.034 1.00 0.00 H new ATOM 0 HG LEU A 24 1.703 -10.811 6.187 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.138 -10.878 8.188 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.430 -12.270 7.118 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.581 -10.913 7.146 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.430 -8.710 7.250 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.843 -8.658 6.171 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.203 -8.518 5.496 1.00 0.00 H new ATOM 367 N THR A 25 0.481 -12.802 4.961 1.00 0.00 N ATOM 368 CA THR A 25 -0.976 -12.783 4.981 1.00 0.00 C ATOM 369 C THR A 25 -1.502 -11.442 5.482 1.00 0.00 C ATOM 370 O THR A 25 -0.888 -10.804 6.337 1.00 0.00 O ATOM 371 CB THR A 25 -1.541 -13.907 5.870 1.00 0.00 C ATOM 372 OG1 THR A 25 -1.056 -15.177 5.421 1.00 0.00 O ATOM 373 CG2 THR A 25 -3.062 -13.902 5.848 1.00 0.00 C ATOM 0 H THR A 25 0.905 -13.388 5.680 1.00 0.00 H new ATOM 0 HA THR A 25 -1.308 -12.940 3.955 1.00 0.00 H new ATOM 0 HB THR A 25 -1.208 -13.733 6.893 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.418 -15.886 5.992 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.438 -14.704 6.483 1.00 0.00 H new ATOM 0 HG22 THR A 25 -3.428 -12.944 6.218 1.00 0.00 H new ATOM 0 HG23 THR A 25 -3.412 -14.054 4.827 1.00 0.00 H new ATOM 381 N VAL A 26 -2.641 -11.020 4.943 1.00 0.00 N ATOM 382 CA VAL A 26 -3.250 -9.755 5.337 1.00 0.00 C ATOM 383 C VAL A 26 -4.767 -9.806 5.190 1.00 0.00 C ATOM 384 O VAL A 26 -5.312 -10.730 4.586 1.00 0.00 O ATOM 385 CB VAL A 26 -2.703 -8.584 4.500 1.00 0.00 C ATOM 386 CG1 VAL A 26 -1.189 -8.507 4.615 1.00 0.00 C ATOM 387 CG2 VAL A 26 -3.129 -8.725 3.046 1.00 0.00 C ATOM 0 H VAL A 26 -3.161 -11.535 4.232 1.00 0.00 H new ATOM 0 HA VAL A 26 -2.995 -9.593 6.384 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.120 -7.655 4.889 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.821 -7.674 4.017 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -0.911 -8.356 5.658 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.749 -9.436 4.253 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.734 -7.889 2.468 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.741 -9.660 2.642 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.217 -8.727 2.984 1.00 0.00 H new ATOM 397 N VAL A 27 -5.444 -8.806 5.745 1.00 0.00 N ATOM 398 CA VAL A 27 -6.899 -8.736 5.675 1.00 0.00 C ATOM 399 C VAL A 27 -7.365 -7.318 5.363 1.00 0.00 C ATOM 400 O VAL A 27 -6.663 -6.347 5.644 1.00 0.00 O ATOM 401 CB VAL A 27 -7.548 -9.200 6.992 1.00 0.00 C ATOM 402 CG1 VAL A 27 -7.174 -10.644 7.292 1.00 0.00 C ATOM 403 CG2 VAL A 27 -7.140 -8.286 8.138 1.00 0.00 C ATOM 0 H VAL A 27 -5.008 -8.033 6.248 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.210 -9.404 4.872 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.631 -9.146 6.882 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -7.642 -10.954 8.226 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.521 -11.286 6.482 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -6.091 -10.728 7.383 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.608 -8.629 9.061 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.056 -8.306 8.251 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.463 -7.267 7.924 1.00 0.00 H new ATOM 413 N GLN A 28 -8.555 -7.207 4.780 1.00 0.00 N ATOM 414 CA GLN A 28 -9.115 -5.908 4.430 1.00 0.00 C ATOM 415 C GLN A 28 -9.190 -5.000 5.653 1.00 0.00 C ATOM 416 O GLN A 28 -9.427 -5.462 6.768 1.00 0.00 O ATOM 417 CB GLN A 28 -10.508 -6.077 3.820 1.00 0.00 C ATOM 418 CG GLN A 28 -11.219 -4.760 3.553 1.00 0.00 C ATOM 419 CD GLN A 28 -12.569 -4.950 2.889 1.00 0.00 C ATOM 420 OE1 GLN A 28 -12.793 -5.934 2.184 1.00 0.00 O ATOM 421 NE2 GLN A 28 -13.476 -4.006 3.111 1.00 0.00 N ATOM 0 H GLN A 28 -9.149 -8.001 4.541 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.458 -5.444 3.695 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -10.421 -6.630 2.885 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -11.119 -6.681 4.491 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -11.353 -4.226 4.494 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -10.591 -4.134 2.919 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -13.247 -3.207 3.703 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -14.402 -4.080 2.690 1.00 0.00 H new ATOM 430 N GLY A 29 -8.985 -3.704 5.436 1.00 0.00 N ATOM 431 CA GLY A 29 -9.033 -2.751 6.529 1.00 0.00 C ATOM 432 C GLY A 29 -7.710 -2.640 7.260 1.00 0.00 C ATOM 433 O GLY A 29 -7.353 -1.570 7.750 1.00 0.00 O ATOM 0 H GLY A 29 -8.786 -3.297 4.522 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -9.313 -1.772 6.141 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.810 -3.049 7.233 1.00 0.00 H new ATOM 437 N GLU A 30 -6.981 -3.750 7.333 1.00 0.00 N ATOM 438 CA GLU A 30 -5.691 -3.772 8.012 1.00 0.00 C ATOM 439 C GLU A 30 -4.791 -2.648 7.506 1.00 0.00 C ATOM 440 O GLU A 30 -4.880 -2.239 6.348 1.00 0.00 O ATOM 441 CB GLU A 30 -5.004 -5.123 7.805 1.00 0.00 C ATOM 442 CG GLU A 30 -3.636 -5.218 8.461 1.00 0.00 C ATOM 443 CD GLU A 30 -3.719 -5.298 9.973 1.00 0.00 C ATOM 444 OE1 GLU A 30 -4.141 -6.354 10.488 1.00 0.00 O ATOM 445 OE2 GLU A 30 -3.362 -4.305 10.641 1.00 0.00 O ATOM 0 H GLU A 30 -7.262 -4.644 6.931 1.00 0.00 H new ATOM 0 HA GLU A 30 -5.867 -3.622 9.077 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.644 -5.911 8.203 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.898 -5.307 6.736 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.116 -6.098 8.082 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.041 -4.350 8.179 1.00 0.00 H new ATOM 452 N LYS A 31 -3.923 -2.154 8.382 1.00 0.00 N ATOM 453 CA LYS A 31 -3.005 -1.078 8.026 1.00 0.00 C ATOM 454 C LYS A 31 -1.571 -1.592 7.944 1.00 0.00 C ATOM 455 O LYS A 31 -1.041 -2.141 8.911 1.00 0.00 O ATOM 456 CB LYS A 31 -3.094 0.056 9.049 1.00 0.00 C ATOM 457 CG LYS A 31 -4.457 0.174 9.708 1.00 0.00 C ATOM 458 CD LYS A 31 -5.460 0.860 8.796 1.00 0.00 C ATOM 459 CE LYS A 31 -6.668 1.362 9.572 1.00 0.00 C ATOM 460 NZ LYS A 31 -6.309 2.464 10.506 1.00 0.00 N ATOM 0 H LYS A 31 -3.836 -2.482 9.344 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.293 -0.698 7.046 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.339 -0.101 9.820 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.855 0.998 8.556 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.822 -0.819 9.971 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.365 0.736 10.637 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.979 1.696 8.289 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.786 0.164 8.024 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.429 1.711 8.874 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.106 0.538 10.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -7.159 3.020 10.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.917 2.063 11.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.600 3.080 10.060 1.00 0.00 H new ATOM 474 N LEU A 32 -0.946 -1.408 6.786 1.00 0.00 N ATOM 475 CA LEU A 32 0.428 -1.851 6.579 1.00 0.00 C ATOM 476 C LEU A 32 1.329 -0.677 6.209 1.00 0.00 C ATOM 477 O LEU A 32 0.866 0.455 6.079 1.00 0.00 O ATOM 478 CB LEU A 32 0.481 -2.916 5.482 1.00 0.00 C ATOM 479 CG LEU A 32 -0.196 -4.248 5.805 1.00 0.00 C ATOM 480 CD1 LEU A 32 -0.414 -5.057 4.536 1.00 0.00 C ATOM 481 CD2 LEU A 32 0.632 -5.037 6.808 1.00 0.00 C ATOM 0 H LEU A 32 -1.369 -0.955 5.976 1.00 0.00 H new ATOM 0 HA LEU A 32 0.790 -2.282 7.513 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.020 -2.506 4.583 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.527 -3.111 5.244 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.169 -4.041 6.251 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.897 -6.002 4.785 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.048 -4.495 3.851 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.547 -5.255 4.061 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.135 -5.982 7.026 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.619 -5.234 6.390 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.736 -4.461 7.727 1.00 0.00 H new ATOM 493 N GLU A 33 2.617 -0.957 6.039 1.00 0.00 N ATOM 494 CA GLU A 33 3.582 0.076 5.682 1.00 0.00 C ATOM 495 C GLU A 33 4.417 -0.351 4.479 1.00 0.00 C ATOM 496 O GLU A 33 5.114 -1.366 4.521 1.00 0.00 O ATOM 497 CB GLU A 33 4.498 0.382 6.869 1.00 0.00 C ATOM 498 CG GLU A 33 5.749 1.157 6.490 1.00 0.00 C ATOM 499 CD GLU A 33 6.244 2.050 7.610 1.00 0.00 C ATOM 500 OE1 GLU A 33 7.007 1.559 8.468 1.00 0.00 O ATOM 501 OE2 GLU A 33 5.868 3.241 7.629 1.00 0.00 O ATOM 0 H GLU A 33 3.016 -1.890 6.143 1.00 0.00 H new ATOM 0 HA GLU A 33 3.029 0.977 5.417 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.939 0.952 7.611 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.791 -0.555 7.342 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.537 0.456 6.215 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.542 1.766 5.610 1.00 0.00 H new ATOM 508 N VAL A 34 4.341 0.429 3.406 1.00 0.00 N ATOM 509 CA VAL A 34 5.090 0.133 2.190 1.00 0.00 C ATOM 510 C VAL A 34 6.587 0.318 2.408 1.00 0.00 C ATOM 511 O VAL A 34 7.012 1.181 3.177 1.00 0.00 O ATOM 512 CB VAL A 34 4.638 1.028 1.020 1.00 0.00 C ATOM 513 CG1 VAL A 34 5.472 0.747 -0.220 1.00 0.00 C ATOM 514 CG2 VAL A 34 3.158 0.824 0.735 1.00 0.00 C ATOM 0 H VAL A 34 3.768 1.271 3.354 1.00 0.00 H new ATOM 0 HA VAL A 34 4.888 -0.909 1.940 1.00 0.00 H new ATOM 0 HB VAL A 34 4.790 2.070 1.302 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.138 1.388 -1.036 1.00 0.00 H new ATOM 0 HG12 VAL A 34 6.522 0.949 -0.006 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.355 -0.298 -0.508 1.00 0.00 H new ATOM 0 HG21 VAL A 34 2.856 1.464 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 34 2.978 -0.219 0.473 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.578 1.081 1.622 1.00 0.00 H new ATOM 524 N LEU A 35 7.383 -0.498 1.725 1.00 0.00 N ATOM 525 CA LEU A 35 8.836 -0.425 1.843 1.00 0.00 C ATOM 526 C LEU A 35 9.486 -0.272 0.472 1.00 0.00 C ATOM 527 O LEU A 35 10.331 0.600 0.268 1.00 0.00 O ATOM 528 CB LEU A 35 9.374 -1.675 2.540 1.00 0.00 C ATOM 529 CG LEU A 35 9.028 -1.820 4.022 1.00 0.00 C ATOM 530 CD1 LEU A 35 9.099 -3.278 4.448 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.959 -0.968 4.873 1.00 0.00 C ATOM 0 H LEU A 35 7.047 -1.217 1.084 1.00 0.00 H new ATOM 0 HA LEU A 35 9.084 0.451 2.442 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.997 -2.551 2.012 1.00 0.00 H new ATOM 0 HB3 LEU A 35 10.459 -1.684 2.439 1.00 0.00 H new ATOM 0 HG LEU A 35 8.007 -1.469 4.172 1.00 0.00 H new ATOM 0 HD11 LEU A 35 8.850 -3.361 5.506 1.00 0.00 H new ATOM 0 HD12 LEU A 35 8.391 -3.863 3.861 1.00 0.00 H new ATOM 0 HD13 LEU A 35 10.108 -3.657 4.282 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.698 -1.084 5.925 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.989 -1.288 4.717 1.00 0.00 H new ATOM 0 HD23 LEU A 35 9.857 0.079 4.587 1.00 0.00 H new ATOM 543 N ASP A 36 9.086 -1.125 -0.465 1.00 0.00 N ATOM 544 CA ASP A 36 9.627 -1.083 -1.818 1.00 0.00 C ATOM 545 C ASP A 36 8.506 -1.092 -2.853 1.00 0.00 C ATOM 546 O ASP A 36 7.917 -2.136 -3.136 1.00 0.00 O ATOM 547 CB ASP A 36 10.564 -2.270 -2.052 1.00 0.00 C ATOM 548 CG ASP A 36 11.212 -2.234 -3.422 1.00 0.00 C ATOM 549 OD1 ASP A 36 11.887 -1.230 -3.732 1.00 0.00 O ATOM 550 OD2 ASP A 36 11.045 -3.209 -4.184 1.00 0.00 O ATOM 0 H ASP A 36 8.389 -1.854 -0.312 1.00 0.00 H new ATOM 0 HA ASP A 36 10.191 -0.157 -1.929 1.00 0.00 H new ATOM 0 HB2 ASP A 36 11.340 -2.273 -1.286 1.00 0.00 H new ATOM 0 HB3 ASP A 36 10.004 -3.199 -1.942 1.00 0.00 H new ATOM 555 N HIS A 37 8.215 0.077 -3.413 1.00 0.00 N ATOM 556 CA HIS A 37 7.163 0.204 -4.416 1.00 0.00 C ATOM 557 C HIS A 37 7.760 0.357 -5.812 1.00 0.00 C ATOM 558 O HIS A 37 7.242 1.105 -6.640 1.00 0.00 O ATOM 559 CB HIS A 37 6.268 1.402 -4.097 1.00 0.00 C ATOM 560 CG HIS A 37 7.014 2.696 -3.989 1.00 0.00 C ATOM 561 ND1 HIS A 37 7.112 3.597 -5.027 1.00 0.00 N ATOM 562 CD2 HIS A 37 7.699 3.239 -2.955 1.00 0.00 C ATOM 563 CE1 HIS A 37 7.827 4.638 -4.637 1.00 0.00 C ATOM 564 NE2 HIS A 37 8.195 4.445 -3.384 1.00 0.00 N ATOM 0 H HIS A 37 8.692 0.950 -3.190 1.00 0.00 H new ATOM 0 HA HIS A 37 6.562 -0.705 -4.395 1.00 0.00 H new ATOM 0 HB2 HIS A 37 5.508 1.494 -4.873 1.00 0.00 H new ATOM 0 HB3 HIS A 37 5.745 1.215 -3.159 1.00 0.00 H new ATOM 0 HD2 HIS A 37 7.831 2.804 -1.975 1.00 0.00 H new ATOM 0 HE1 HIS A 37 8.069 5.500 -5.241 1.00 0.00 H new ATOM 0 HE2 HIS A 37 8.757 5.088 -2.825 1.00 0.00 H new ATOM 573 N SER A 38 8.852 -0.357 -6.065 1.00 0.00 N ATOM 574 CA SER A 38 9.521 -0.298 -7.359 1.00 0.00 C ATOM 575 C SER A 38 9.406 -1.631 -8.092 1.00 0.00 C ATOM 576 O SER A 38 10.376 -2.123 -8.667 1.00 0.00 O ATOM 577 CB SER A 38 10.995 0.071 -7.178 1.00 0.00 C ATOM 578 OG SER A 38 11.159 1.474 -7.062 1.00 0.00 O ATOM 0 H SER A 38 9.292 -0.983 -5.391 1.00 0.00 H new ATOM 0 HA SER A 38 9.032 0.470 -7.958 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.389 -0.419 -6.288 1.00 0.00 H new ATOM 0 HB3 SER A 38 11.572 -0.297 -8.026 1.00 0.00 H new ATOM 0 HG SER A 38 12.109 1.684 -6.946 1.00 0.00 H new ATOM 584 N LYS A 39 8.210 -2.211 -8.067 1.00 0.00 N ATOM 585 CA LYS A 39 7.964 -3.486 -8.730 1.00 0.00 C ATOM 586 C LYS A 39 6.481 -3.840 -8.693 1.00 0.00 C ATOM 587 O LYS A 39 5.774 -3.495 -7.746 1.00 0.00 O ATOM 588 CB LYS A 39 8.781 -4.596 -8.065 1.00 0.00 C ATOM 589 CG LYS A 39 9.192 -5.703 -9.019 1.00 0.00 C ATOM 590 CD LYS A 39 8.156 -6.814 -9.064 1.00 0.00 C ATOM 591 CE LYS A 39 8.392 -7.749 -10.240 1.00 0.00 C ATOM 592 NZ LYS A 39 9.733 -8.394 -10.175 1.00 0.00 N ATOM 0 H LYS A 39 7.396 -1.818 -7.594 1.00 0.00 H new ATOM 0 HA LYS A 39 8.272 -3.391 -9.771 1.00 0.00 H new ATOM 0 HB2 LYS A 39 9.676 -4.160 -7.620 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.198 -5.027 -7.251 1.00 0.00 H new ATOM 0 HG2 LYS A 39 9.328 -5.291 -10.019 1.00 0.00 H new ATOM 0 HG3 LYS A 39 10.153 -6.113 -8.709 1.00 0.00 H new ATOM 0 HD2 LYS A 39 8.189 -7.382 -8.134 1.00 0.00 H new ATOM 0 HD3 LYS A 39 7.159 -6.380 -9.137 1.00 0.00 H new ATOM 0 HE2 LYS A 39 7.619 -8.518 -10.254 1.00 0.00 H new ATOM 0 HE3 LYS A 39 8.302 -7.191 -11.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 9.817 -9.098 -10.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 10.472 -7.671 -10.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.848 -8.863 -9.254 1.00 0.00 H new ATOM 606 N ARG A 40 6.016 -4.532 -9.728 1.00 0.00 N ATOM 607 CA ARG A 40 4.617 -4.933 -9.814 1.00 0.00 C ATOM 608 C ARG A 40 4.055 -5.243 -8.429 1.00 0.00 C ATOM 609 O ARG A 40 2.939 -4.845 -8.099 1.00 0.00 O ATOM 610 CB ARG A 40 4.470 -6.156 -10.721 1.00 0.00 C ATOM 611 CG ARG A 40 3.104 -6.266 -11.378 1.00 0.00 C ATOM 612 CD ARG A 40 2.956 -5.277 -12.524 1.00 0.00 C ATOM 613 NE ARG A 40 1.682 -5.434 -13.221 1.00 0.00 N ATOM 614 CZ ARG A 40 1.439 -4.937 -14.429 1.00 0.00 C ATOM 615 NH1 ARG A 40 2.378 -4.257 -15.071 1.00 0.00 N ATOM 616 NH2 ARG A 40 0.254 -5.122 -14.997 1.00 0.00 N ATOM 0 H ARG A 40 6.588 -4.827 -10.519 1.00 0.00 H new ATOM 0 HA ARG A 40 4.052 -4.104 -10.240 1.00 0.00 H new ATOM 0 HB2 ARG A 40 5.235 -6.117 -11.497 1.00 0.00 H new ATOM 0 HB3 ARG A 40 4.656 -7.056 -10.136 1.00 0.00 H new ATOM 0 HG2 ARG A 40 2.959 -7.280 -11.750 1.00 0.00 H new ATOM 0 HG3 ARG A 40 2.326 -6.084 -10.636 1.00 0.00 H new ATOM 0 HD2 ARG A 40 3.035 -4.261 -12.138 1.00 0.00 H new ATOM 0 HD3 ARG A 40 3.775 -5.415 -13.230 1.00 0.00 H new ATOM 0 HE ARG A 40 0.938 -5.954 -12.755 1.00 0.00 H new ATOM 0 HH11 ARG A 40 3.290 -4.114 -14.638 1.00 0.00 H new ATOM 0 HH12 ARG A 40 2.188 -3.877 -15.998 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -0.471 -5.646 -14.506 1.00 0.00 H new ATOM 0 HH22 ARG A 40 0.068 -4.740 -15.924 1.00 0.00 H new ATOM 630 N TRP A 41 4.836 -5.957 -7.626 1.00 0.00 N ATOM 631 CA TRP A 41 4.416 -6.321 -6.277 1.00 0.00 C ATOM 632 C TRP A 41 5.104 -5.443 -5.237 1.00 0.00 C ATOM 633 O TRP A 41 6.332 -5.401 -5.163 1.00 0.00 O ATOM 634 CB TRP A 41 4.724 -7.794 -6.005 1.00 0.00 C ATOM 635 CG TRP A 41 3.674 -8.727 -6.527 1.00 0.00 C ATOM 636 CD1 TRP A 41 3.270 -8.863 -7.824 1.00 0.00 C ATOM 637 CD2 TRP A 41 2.894 -9.652 -5.762 1.00 0.00 C ATOM 638 NE1 TRP A 41 2.285 -9.817 -7.912 1.00 0.00 N ATOM 639 CE2 TRP A 41 2.036 -10.317 -6.661 1.00 0.00 C ATOM 640 CE3 TRP A 41 2.837 -9.985 -4.406 1.00 0.00 C ATOM 641 CZ2 TRP A 41 1.134 -11.292 -6.245 1.00 0.00 C ATOM 642 CZ3 TRP A 41 1.941 -10.954 -3.995 1.00 0.00 C ATOM 643 CH2 TRP A 41 1.100 -11.599 -4.912 1.00 0.00 C ATOM 0 H TRP A 41 5.763 -6.295 -7.885 1.00 0.00 H new ATOM 0 HA TRP A 41 3.340 -6.163 -6.203 1.00 0.00 H new ATOM 0 HB2 TRP A 41 5.682 -8.047 -6.458 1.00 0.00 H new ATOM 0 HB3 TRP A 41 4.830 -7.943 -4.930 1.00 0.00 H new ATOM 0 HD1 TRP A 41 3.666 -8.303 -8.658 1.00 0.00 H new ATOM 0 HE1 TRP A 41 1.815 -10.106 -8.770 1.00 0.00 H new ATOM 0 HE3 TRP A 41 3.482 -9.494 -3.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.484 -11.789 -6.950 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 1.888 -11.219 -2.949 1.00 0.00 H new ATOM 0 HH2 TRP A 41 0.412 -12.353 -4.560 1.00 0.00 H new ATOM 654 N TRP A 42 4.306 -4.746 -4.437 1.00 0.00 N ATOM 655 CA TRP A 42 4.841 -3.870 -3.400 1.00 0.00 C ATOM 656 C TRP A 42 5.185 -4.661 -2.143 1.00 0.00 C ATOM 657 O TRP A 42 4.509 -5.634 -1.805 1.00 0.00 O ATOM 658 CB TRP A 42 3.833 -2.769 -3.065 1.00 0.00 C ATOM 659 CG TRP A 42 3.517 -1.879 -4.229 1.00 0.00 C ATOM 660 CD1 TRP A 42 3.740 -2.147 -5.550 1.00 0.00 C ATOM 661 CD2 TRP A 42 2.921 -0.578 -4.176 1.00 0.00 C ATOM 662 NE1 TRP A 42 3.319 -1.090 -6.321 1.00 0.00 N ATOM 663 CE2 TRP A 42 2.813 -0.116 -5.503 1.00 0.00 C ATOM 664 CE3 TRP A 42 2.468 0.240 -3.138 1.00 0.00 C ATOM 665 CZ2 TRP A 42 2.271 1.128 -5.815 1.00 0.00 C ATOM 666 CZ3 TRP A 42 1.930 1.475 -3.450 1.00 0.00 C ATOM 667 CH2 TRP A 42 1.835 1.909 -4.779 1.00 0.00 C ATOM 0 H TRP A 42 3.287 -4.770 -4.486 1.00 0.00 H new ATOM 0 HA TRP A 42 5.755 -3.414 -3.780 1.00 0.00 H new ATOM 0 HB2 TRP A 42 2.911 -3.227 -2.706 1.00 0.00 H new ATOM 0 HB3 TRP A 42 4.226 -2.162 -2.249 1.00 0.00 H new ATOM 0 HD1 TRP A 42 4.182 -3.055 -5.932 1.00 0.00 H new ATOM 0 HE1 TRP A 42 3.375 -1.039 -7.338 1.00 0.00 H new ATOM 0 HE3 TRP A 42 2.537 -0.086 -2.111 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 2.197 1.465 -6.838 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 1.577 2.116 -2.656 1.00 0.00 H new ATOM 0 HH2 TRP A 42 1.409 2.879 -4.990 1.00 0.00 H new ATOM 678 N LEU A 43 6.238 -4.238 -1.453 1.00 0.00 N ATOM 679 CA LEU A 43 6.672 -4.907 -0.232 1.00 0.00 C ATOM 680 C LEU A 43 6.259 -4.111 1.002 1.00 0.00 C ATOM 681 O LEU A 43 6.666 -2.962 1.177 1.00 0.00 O ATOM 682 CB LEU A 43 8.189 -5.100 -0.244 1.00 0.00 C ATOM 683 CG LEU A 43 8.818 -5.557 1.073 1.00 0.00 C ATOM 684 CD1 LEU A 43 8.338 -6.953 1.438 1.00 0.00 C ATOM 685 CD2 LEU A 43 10.337 -5.520 0.980 1.00 0.00 C ATOM 0 H LEU A 43 6.807 -3.434 -1.718 1.00 0.00 H new ATOM 0 HA LEU A 43 6.188 -5.883 -0.191 1.00 0.00 H new ATOM 0 HB2 LEU A 43 8.436 -5.831 -1.014 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.653 -4.158 -0.537 1.00 0.00 H new ATOM 0 HG LEU A 43 8.505 -4.871 1.860 1.00 0.00 H new ATOM 0 HD11 LEU A 43 8.796 -7.261 2.378 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.254 -6.948 1.547 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.620 -7.652 0.651 1.00 0.00 H new ATOM 0 HD21 LEU A 43 10.768 -5.848 1.926 1.00 0.00 H new ATOM 0 HD22 LEU A 43 10.669 -6.183 0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.664 -4.502 0.766 1.00 0.00 H new ATOM 697 N VAL A 44 5.449 -4.729 1.855 1.00 0.00 N ATOM 698 CA VAL A 44 4.983 -4.079 3.075 1.00 0.00 C ATOM 699 C VAL A 44 5.380 -4.880 4.310 1.00 0.00 C ATOM 700 O VAL A 44 5.765 -6.045 4.211 1.00 0.00 O ATOM 701 CB VAL A 44 3.454 -3.897 3.064 1.00 0.00 C ATOM 702 CG1 VAL A 44 3.014 -3.142 1.819 1.00 0.00 C ATOM 703 CG2 VAL A 44 2.756 -5.246 3.154 1.00 0.00 C ATOM 0 H VAL A 44 5.101 -5.679 1.724 1.00 0.00 H new ATOM 0 HA VAL A 44 5.458 -3.099 3.113 1.00 0.00 H new ATOM 0 HB VAL A 44 3.170 -3.308 3.936 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.931 -3.023 1.829 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.486 -2.160 1.803 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.309 -3.701 0.931 1.00 0.00 H new ATOM 0 HG21 VAL A 44 1.676 -5.098 3.145 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.045 -5.863 2.303 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.046 -5.745 4.079 1.00 0.00 H new ATOM 713 N LYS A 45 5.284 -4.247 5.474 1.00 0.00 N ATOM 714 CA LYS A 45 5.631 -4.899 6.731 1.00 0.00 C ATOM 715 C LYS A 45 4.488 -4.790 7.735 1.00 0.00 C ATOM 716 O LYS A 45 3.680 -3.864 7.671 1.00 0.00 O ATOM 717 CB LYS A 45 6.900 -4.277 7.319 1.00 0.00 C ATOM 718 CG LYS A 45 7.684 -5.223 8.212 1.00 0.00 C ATOM 719 CD LYS A 45 9.158 -4.858 8.253 1.00 0.00 C ATOM 720 CE LYS A 45 9.458 -3.877 9.376 1.00 0.00 C ATOM 721 NZ LYS A 45 10.913 -3.575 9.475 1.00 0.00 N ATOM 0 H LYS A 45 4.968 -3.282 5.573 1.00 0.00 H new ATOM 0 HA LYS A 45 5.812 -5.954 6.525 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.543 -3.944 6.504 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.628 -3.391 7.893 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.273 -5.196 9.221 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.571 -6.245 7.849 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.754 -5.761 8.388 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.453 -4.421 7.299 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.906 -2.952 9.208 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.108 -4.290 10.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.076 -2.903 10.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 11.438 -4.453 9.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.242 -3.157 8.581 1.00 0.00 H new ATOM 735 N ASN A 46 4.426 -5.742 8.661 1.00 0.00 N ATOM 736 CA ASN A 46 3.382 -5.751 9.678 1.00 0.00 C ATOM 737 C ASN A 46 3.926 -5.273 11.021 1.00 0.00 C ATOM 738 O ASN A 46 5.099 -4.921 11.136 1.00 0.00 O ATOM 739 CB ASN A 46 2.796 -7.157 9.824 1.00 0.00 C ATOM 740 CG ASN A 46 3.811 -8.155 10.348 1.00 0.00 C ATOM 741 OD1 ASN A 46 4.985 -7.829 10.524 1.00 0.00 O ATOM 742 ND2 ASN A 46 3.362 -9.379 10.601 1.00 0.00 N ATOM 0 H ASN A 46 5.086 -6.516 8.727 1.00 0.00 H new ATOM 0 HA ASN A 46 2.595 -5.067 9.361 1.00 0.00 H new ATOM 0 HB2 ASN A 46 1.942 -7.123 10.500 1.00 0.00 H new ATOM 0 HB3 ASN A 46 2.424 -7.495 8.857 1.00 0.00 H new ATOM 0 HD21 ASN A 46 3.999 -10.093 10.956 1.00 0.00 H new ATOM 0 HD22 ASN A 46 2.381 -9.605 10.440 1.00 0.00 H new ATOM 749 N GLU A 47 3.064 -5.264 12.033 1.00 0.00 N ATOM 750 CA GLU A 47 3.459 -4.829 13.368 1.00 0.00 C ATOM 751 C GLU A 47 4.464 -5.800 13.982 1.00 0.00 C ATOM 752 O GLU A 47 5.405 -5.389 14.659 1.00 0.00 O ATOM 753 CB GLU A 47 2.232 -4.708 14.273 1.00 0.00 C ATOM 754 CG GLU A 47 1.582 -3.335 14.238 1.00 0.00 C ATOM 755 CD GLU A 47 0.208 -3.322 14.879 1.00 0.00 C ATOM 756 OE1 GLU A 47 -0.720 -3.931 14.307 1.00 0.00 O ATOM 757 OE2 GLU A 47 0.062 -2.704 15.955 1.00 0.00 O ATOM 0 H GLU A 47 2.089 -5.553 11.954 1.00 0.00 H new ATOM 0 HA GLU A 47 3.933 -3.852 13.278 1.00 0.00 H new ATOM 0 HB2 GLU A 47 1.497 -5.456 13.976 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.523 -4.937 15.298 1.00 0.00 H new ATOM 0 HG2 GLU A 47 2.225 -2.620 14.751 1.00 0.00 H new ATOM 0 HG3 GLU A 47 1.499 -3.003 13.203 1.00 0.00 H new ATOM 764 N ALA A 48 4.255 -7.090 13.739 1.00 0.00 N ATOM 765 CA ALA A 48 5.142 -8.120 14.266 1.00 0.00 C ATOM 766 C ALA A 48 6.569 -7.922 13.769 1.00 0.00 C ATOM 767 O ALA A 48 7.531 -8.181 14.491 1.00 0.00 O ATOM 768 CB ALA A 48 4.633 -9.501 13.882 1.00 0.00 C ATOM 0 H ALA A 48 3.479 -7.446 13.181 1.00 0.00 H new ATOM 0 HA ALA A 48 5.150 -8.037 15.353 1.00 0.00 H new ATOM 0 HB1 ALA A 48 5.305 -10.261 14.282 1.00 0.00 H new ATOM 0 HB2 ALA A 48 3.634 -9.648 14.292 1.00 0.00 H new ATOM 0 HB3 ALA A 48 4.595 -9.586 12.796 1.00 0.00 H new ATOM 774 N GLY A 49 6.700 -7.461 12.528 1.00 0.00 N ATOM 775 CA GLY A 49 8.015 -7.238 11.955 1.00 0.00 C ATOM 776 C GLY A 49 8.249 -8.060 10.703 1.00 0.00 C ATOM 777 O GLY A 49 9.305 -7.965 10.078 1.00 0.00 O ATOM 0 H GLY A 49 5.920 -7.238 11.910 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.130 -6.180 11.718 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.777 -7.484 12.695 1.00 0.00 H new ATOM 781 N ARG A 50 7.261 -8.870 10.335 1.00 0.00 N ATOM 782 CA ARG A 50 7.366 -9.714 9.151 1.00 0.00 C ATOM 783 C ARG A 50 6.902 -8.964 7.906 1.00 0.00 C ATOM 784 O ARG A 50 5.804 -8.408 7.877 1.00 0.00 O ATOM 785 CB ARG A 50 6.536 -10.986 9.331 1.00 0.00 C ATOM 786 CG ARG A 50 7.290 -12.113 10.020 1.00 0.00 C ATOM 787 CD ARG A 50 6.626 -13.459 9.774 1.00 0.00 C ATOM 788 NE ARG A 50 7.525 -14.573 10.064 1.00 0.00 N ATOM 789 CZ ARG A 50 7.727 -15.057 11.284 1.00 0.00 C ATOM 790 NH1 ARG A 50 7.096 -14.528 12.323 1.00 0.00 N ATOM 791 NH2 ARG A 50 8.561 -16.073 11.467 1.00 0.00 N ATOM 0 H ARG A 50 6.379 -8.959 10.840 1.00 0.00 H new ATOM 0 HA ARG A 50 8.413 -9.986 9.021 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.644 -10.749 9.911 1.00 0.00 H new ATOM 0 HB3 ARG A 50 6.198 -11.331 8.354 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.317 -12.141 9.656 1.00 0.00 H new ATOM 0 HG3 ARG A 50 7.337 -11.919 11.092 1.00 0.00 H new ATOM 0 HD2 ARG A 50 5.734 -13.542 10.395 1.00 0.00 H new ATOM 0 HD3 ARG A 50 6.299 -13.518 8.736 1.00 0.00 H new ATOM 0 HE ARG A 50 8.025 -15.003 9.286 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.454 -13.748 12.186 1.00 0.00 H new ATOM 0 HH12 ARG A 50 7.253 -14.902 13.259 1.00 0.00 H new ATOM 0 HH21 ARG A 50 9.048 -16.483 10.670 1.00 0.00 H new ATOM 0 HH22 ARG A 50 8.715 -16.444 12.405 1.00 0.00 H new ATOM 805 N SER A 51 7.748 -8.951 6.880 1.00 0.00 N ATOM 806 CA SER A 51 7.427 -8.266 5.634 1.00 0.00 C ATOM 807 C SER A 51 7.209 -9.267 4.504 1.00 0.00 C ATOM 808 O SER A 51 7.990 -10.201 4.327 1.00 0.00 O ATOM 809 CB SER A 51 8.546 -7.292 5.260 1.00 0.00 C ATOM 810 OG SER A 51 9.820 -7.882 5.453 1.00 0.00 O ATOM 0 H SER A 51 8.660 -9.407 6.888 1.00 0.00 H new ATOM 0 HA SER A 51 6.503 -7.707 5.783 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.436 -6.989 4.219 1.00 0.00 H new ATOM 0 HB3 SER A 51 8.464 -6.389 5.865 1.00 0.00 H new ATOM 0 HG SER A 51 10.518 -7.241 5.206 1.00 0.00 H new ATOM 816 N GLY A 52 6.140 -9.064 3.739 1.00 0.00 N ATOM 817 CA GLY A 52 5.837 -9.956 2.636 1.00 0.00 C ATOM 818 C GLY A 52 5.450 -9.209 1.375 1.00 0.00 C ATOM 819 O GLY A 52 5.020 -8.056 1.436 1.00 0.00 O ATOM 0 H GLY A 52 5.479 -8.297 3.864 1.00 0.00 H new ATOM 0 HA2 GLY A 52 6.705 -10.583 2.431 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.023 -10.622 2.924 1.00 0.00 H new ATOM 823 N TYR A 53 5.604 -9.864 0.230 1.00 0.00 N ATOM 824 CA TYR A 53 5.271 -9.252 -1.051 1.00 0.00 C ATOM 825 C TYR A 53 3.773 -9.340 -1.324 1.00 0.00 C ATOM 826 O TYR A 53 3.190 -10.425 -1.305 1.00 0.00 O ATOM 827 CB TYR A 53 6.048 -9.930 -2.181 1.00 0.00 C ATOM 828 CG TYR A 53 7.506 -9.534 -2.236 1.00 0.00 C ATOM 829 CD1 TYR A 53 7.896 -8.321 -2.791 1.00 0.00 C ATOM 830 CD2 TYR A 53 8.493 -10.373 -1.734 1.00 0.00 C ATOM 831 CE1 TYR A 53 9.227 -7.956 -2.845 1.00 0.00 C ATOM 832 CE2 TYR A 53 9.827 -10.014 -1.782 1.00 0.00 C ATOM 833 CZ TYR A 53 10.188 -8.805 -2.338 1.00 0.00 C ATOM 834 OH TYR A 53 11.516 -8.445 -2.389 1.00 0.00 O ATOM 0 H TYR A 53 5.957 -10.819 0.162 1.00 0.00 H new ATOM 0 HA TYR A 53 5.552 -8.200 -1.006 1.00 0.00 H new ATOM 0 HB2 TYR A 53 5.978 -11.011 -2.061 1.00 0.00 H new ATOM 0 HB3 TYR A 53 5.577 -9.684 -3.133 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.146 -7.653 -3.187 1.00 0.00 H new ATOM 0 HD2 TYR A 53 8.213 -11.321 -1.299 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.513 -7.011 -3.282 1.00 0.00 H new ATOM 0 HE2 TYR A 53 10.582 -10.677 -1.386 1.00 0.00 H new ATOM 0 HH TYR A 53 12.063 -9.153 -1.989 1.00 0.00 H new ATOM 844 N ILE A 54 3.155 -8.192 -1.579 1.00 0.00 N ATOM 845 CA ILE A 54 1.726 -8.139 -1.858 1.00 0.00 C ATOM 846 C ILE A 54 1.432 -7.240 -3.054 1.00 0.00 C ATOM 847 O ILE A 54 2.133 -6.262 -3.315 1.00 0.00 O ATOM 848 CB ILE A 54 0.933 -7.628 -0.640 1.00 0.00 C ATOM 849 CG1 ILE A 54 1.259 -6.158 -0.372 1.00 0.00 C ATOM 850 CG2 ILE A 54 1.240 -8.476 0.585 1.00 0.00 C ATOM 851 CD1 ILE A 54 0.169 -5.424 0.378 1.00 0.00 C ATOM 0 H ILE A 54 3.622 -7.285 -1.598 1.00 0.00 H new ATOM 0 HA ILE A 54 1.411 -9.158 -2.086 1.00 0.00 H new ATOM 0 HB ILE A 54 -0.132 -7.710 -0.858 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.185 -6.098 0.199 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.437 -5.655 -1.322 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.672 -8.103 1.437 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.962 -9.512 0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 54 2.306 -8.422 0.807 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.468 -4.387 0.533 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -0.754 -5.452 -0.201 1.00 0.00 H new ATOM 0 HD13 ILE A 54 0.006 -5.903 1.344 1.00 0.00 H new ATOM 863 N PRO A 55 0.369 -7.576 -3.800 1.00 0.00 N ATOM 864 CA PRO A 55 -0.044 -6.811 -4.980 1.00 0.00 C ATOM 865 C PRO A 55 -0.610 -5.443 -4.615 1.00 0.00 C ATOM 866 O PRO A 55 -1.389 -5.315 -3.672 1.00 0.00 O ATOM 867 CB PRO A 55 -1.129 -7.688 -5.610 1.00 0.00 C ATOM 868 CG PRO A 55 -1.669 -8.493 -4.478 1.00 0.00 C ATOM 869 CD PRO A 55 -0.512 -8.729 -3.548 1.00 0.00 C ATOM 0 HA PRO A 55 0.794 -6.603 -5.645 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -1.908 -7.083 -6.073 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -0.717 -8.328 -6.390 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -2.475 -7.962 -3.971 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -2.083 -9.437 -4.833 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -0.834 -8.769 -2.508 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -0.010 -9.673 -3.762 1.00 0.00 H new ATOM 877 N SER A 56 -0.212 -4.423 -5.369 1.00 0.00 N ATOM 878 CA SER A 56 -0.677 -3.063 -5.122 1.00 0.00 C ATOM 879 C SER A 56 -2.174 -2.944 -5.392 1.00 0.00 C ATOM 880 O SER A 56 -2.780 -1.903 -5.140 1.00 0.00 O ATOM 881 CB SER A 56 0.091 -2.072 -5.999 1.00 0.00 C ATOM 882 OG SER A 56 -0.510 -1.949 -7.277 1.00 0.00 O ATOM 0 H SER A 56 0.431 -4.513 -6.156 1.00 0.00 H new ATOM 0 HA SER A 56 -0.494 -2.827 -4.074 1.00 0.00 H new ATOM 0 HB2 SER A 56 0.120 -1.097 -5.512 1.00 0.00 H new ATOM 0 HB3 SER A 56 1.123 -2.404 -6.110 1.00 0.00 H new ATOM 0 HG SER A 56 -0.001 -1.309 -7.817 1.00 0.00 H new ATOM 888 N ASN A 57 -2.764 -4.018 -5.906 1.00 0.00 N ATOM 889 CA ASN A 57 -4.190 -4.035 -6.211 1.00 0.00 C ATOM 890 C ASN A 57 -5.018 -4.127 -4.933 1.00 0.00 C ATOM 891 O ASN A 57 -6.164 -3.676 -4.890 1.00 0.00 O ATOM 892 CB ASN A 57 -4.522 -5.211 -7.133 1.00 0.00 C ATOM 893 CG ASN A 57 -6.014 -5.374 -7.346 1.00 0.00 C ATOM 894 OD1 ASN A 57 -6.646 -4.571 -8.033 1.00 0.00 O ATOM 895 ND2 ASN A 57 -6.585 -6.418 -6.757 1.00 0.00 N ATOM 0 H ASN A 57 -2.277 -4.888 -6.120 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.439 -3.103 -6.718 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -4.034 -5.063 -8.096 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -4.116 -6.129 -6.708 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -7.586 -6.580 -6.865 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -6.022 -7.058 -6.197 1.00 0.00 H new ATOM 902 N ILE A 58 -4.431 -4.712 -3.895 1.00 0.00 N ATOM 903 CA ILE A 58 -5.115 -4.861 -2.616 1.00 0.00 C ATOM 904 C ILE A 58 -4.697 -3.766 -1.639 1.00 0.00 C ATOM 905 O ILE A 58 -4.826 -3.921 -0.424 1.00 0.00 O ATOM 906 CB ILE A 58 -4.829 -6.235 -1.981 1.00 0.00 C ATOM 907 CG1 ILE A 58 -3.369 -6.320 -1.531 1.00 0.00 C ATOM 908 CG2 ILE A 58 -5.151 -7.349 -2.966 1.00 0.00 C ATOM 909 CD1 ILE A 58 -3.107 -7.429 -0.536 1.00 0.00 C ATOM 0 H ILE A 58 -3.484 -5.090 -3.914 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.183 -4.778 -2.818 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.466 -6.354 -1.105 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.736 -6.470 -2.405 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.078 -5.368 -1.087 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.944 -8.314 -2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -6.204 -7.297 -3.242 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.536 -7.235 -3.858 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -2.052 -7.430 -0.262 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.714 -7.269 0.355 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.366 -8.388 -0.984 1.00 0.00 H new ATOM 921 N LEU A 59 -4.199 -2.659 -2.178 1.00 0.00 N ATOM 922 CA LEU A 59 -3.764 -1.536 -1.355 1.00 0.00 C ATOM 923 C LEU A 59 -4.491 -0.256 -1.752 1.00 0.00 C ATOM 924 O LEU A 59 -4.712 0.002 -2.935 1.00 0.00 O ATOM 925 CB LEU A 59 -2.253 -1.339 -1.484 1.00 0.00 C ATOM 926 CG LEU A 59 -1.378 -2.410 -0.833 1.00 0.00 C ATOM 927 CD1 LEU A 59 0.095 -2.112 -1.066 1.00 0.00 C ATOM 928 CD2 LEU A 59 -1.674 -2.509 0.657 1.00 0.00 C ATOM 0 H LEU A 59 -4.086 -2.515 -3.181 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.007 -1.763 -0.317 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.003 -1.289 -2.544 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.994 -0.374 -1.049 1.00 0.00 H new ATOM 0 HG LEU A 59 -1.611 -3.370 -1.294 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.702 -2.885 -0.595 1.00 0.00 H new ATOM 0 HD12 LEU A 59 0.298 -2.094 -2.137 1.00 0.00 H new ATOM 0 HD13 LEU A 59 0.343 -1.143 -0.633 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.042 -3.276 1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.471 -1.550 1.133 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.722 -2.772 0.803 1.00 0.00 H new ATOM 940 N GLU A 60 -4.859 0.544 -0.756 1.00 0.00 N ATOM 941 CA GLU A 60 -5.560 1.798 -1.003 1.00 0.00 C ATOM 942 C GLU A 60 -4.822 2.970 -0.361 1.00 0.00 C ATOM 943 O GLU A 60 -4.007 2.800 0.546 1.00 0.00 O ATOM 944 CB GLU A 60 -6.990 1.724 -0.462 1.00 0.00 C ATOM 945 CG GLU A 60 -7.995 1.193 -1.470 1.00 0.00 C ATOM 946 CD GLU A 60 -7.814 1.798 -2.849 1.00 0.00 C ATOM 947 OE1 GLU A 60 -8.437 2.845 -3.124 1.00 0.00 O ATOM 948 OE2 GLU A 60 -7.050 1.224 -3.653 1.00 0.00 O ATOM 0 H GLU A 60 -4.683 0.346 0.229 1.00 0.00 H new ATOM 0 HA GLU A 60 -5.594 1.959 -2.081 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.003 1.086 0.422 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -7.300 2.719 -0.142 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.898 0.109 -1.537 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.004 1.402 -1.115 1.00 0.00 H new ATOM 955 N PRO A 61 -5.114 4.187 -0.842 1.00 0.00 N ATOM 956 CA PRO A 61 -4.489 5.411 -0.330 1.00 0.00 C ATOM 957 C PRO A 61 -4.952 5.751 1.082 1.00 0.00 C ATOM 958 O PRO A 61 -5.843 6.580 1.272 1.00 0.00 O ATOM 959 CB PRO A 61 -4.952 6.485 -1.318 1.00 0.00 C ATOM 960 CG PRO A 61 -6.228 5.959 -1.879 1.00 0.00 C ATOM 961 CD PRO A 61 -6.076 4.463 -1.922 1.00 0.00 C ATOM 0 HA PRO A 61 -3.405 5.317 -0.258 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -5.104 7.442 -0.820 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.212 6.647 -2.102 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -7.076 6.247 -1.258 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -6.412 6.361 -2.875 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -7.027 3.957 -1.752 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -5.703 4.125 -2.889 1.00 0.00 H new ATOM 969 N LEU A 62 -4.342 5.106 2.071 1.00 0.00 N ATOM 970 CA LEU A 62 -4.691 5.341 3.468 1.00 0.00 C ATOM 971 C LEU A 62 -4.690 6.833 3.786 1.00 0.00 C ATOM 972 O LEU A 62 -5.576 7.330 4.481 1.00 0.00 O ATOM 973 CB LEU A 62 -3.711 4.611 4.388 1.00 0.00 C ATOM 974 CG LEU A 62 -4.272 4.147 5.733 1.00 0.00 C ATOM 975 CD1 LEU A 62 -3.248 3.306 6.477 1.00 0.00 C ATOM 976 CD2 LEU A 62 -4.696 5.342 6.574 1.00 0.00 C ATOM 0 H LEU A 62 -3.604 4.416 1.931 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.696 4.953 3.636 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.326 3.740 3.858 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.863 5.269 4.578 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.151 3.530 5.545 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.665 2.985 7.432 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.993 2.431 5.880 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -2.350 3.898 6.654 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.093 4.993 7.528 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.834 5.985 6.753 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.465 5.905 6.045 1.00 0.00 H new ATOM 988 N SER A 63 -3.691 7.542 3.271 1.00 0.00 N ATOM 989 CA SER A 63 -3.573 8.977 3.502 1.00 0.00 C ATOM 990 C SER A 63 -4.248 9.764 2.382 1.00 0.00 C ATOM 991 O SER A 63 -4.658 9.198 1.370 1.00 0.00 O ATOM 992 CB SER A 63 -2.101 9.379 3.608 1.00 0.00 C ATOM 993 OG SER A 63 -1.430 9.189 2.374 1.00 0.00 O ATOM 0 H SER A 63 -2.951 7.146 2.691 1.00 0.00 H new ATOM 0 HA SER A 63 -4.074 9.212 4.441 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.027 10.424 3.909 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.615 8.789 4.385 1.00 0.00 H new ATOM 0 HG SER A 63 -0.491 9.455 2.468 1.00 0.00 H new ATOM 999 N GLY A 64 -4.359 11.075 2.572 1.00 0.00 N ATOM 1000 CA GLY A 64 -4.984 11.920 1.572 1.00 0.00 C ATOM 1001 C GLY A 64 -4.454 11.656 0.177 1.00 0.00 C ATOM 1002 O GLY A 64 -3.281 11.332 -0.014 1.00 0.00 O ATOM 0 H GLY A 64 -4.027 11.567 3.401 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -6.062 11.757 1.585 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -4.817 12.966 1.829 1.00 0.00 H new ATOM 1006 N PRO A 65 -5.330 11.792 -0.830 1.00 0.00 N ATOM 1007 CA PRO A 65 -4.966 11.569 -2.232 1.00 0.00 C ATOM 1008 C PRO A 65 -4.033 12.650 -2.768 1.00 0.00 C ATOM 1009 O PRO A 65 -3.444 12.500 -3.838 1.00 0.00 O ATOM 1010 CB PRO A 65 -6.312 11.615 -2.960 1.00 0.00 C ATOM 1011 CG PRO A 65 -7.186 12.448 -2.087 1.00 0.00 C ATOM 1012 CD PRO A 65 -6.744 12.175 -0.676 1.00 0.00 C ATOM 0 HA PRO A 65 -4.424 10.633 -2.368 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -6.210 12.054 -3.953 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -6.724 10.615 -3.094 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -7.085 13.506 -2.330 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -8.236 12.188 -2.224 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -6.855 13.055 -0.043 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.329 11.377 -0.219 1.00 0.00 H new ATOM 1020 N SER A 66 -3.903 13.738 -2.016 1.00 0.00 N ATOM 1021 CA SER A 66 -3.044 14.846 -2.418 1.00 0.00 C ATOM 1022 C SER A 66 -1.576 14.513 -2.171 1.00 0.00 C ATOM 1023 O SER A 66 -1.219 13.967 -1.126 1.00 0.00 O ATOM 1024 CB SER A 66 -3.425 16.117 -1.656 1.00 0.00 C ATOM 1025 OG SER A 66 -4.629 16.671 -2.158 1.00 0.00 O ATOM 0 H SER A 66 -4.381 13.876 -1.126 1.00 0.00 H new ATOM 0 HA SER A 66 -3.186 15.014 -3.486 1.00 0.00 H new ATOM 0 HB2 SER A 66 -3.540 15.889 -0.596 1.00 0.00 H new ATOM 0 HB3 SER A 66 -2.622 16.849 -1.739 1.00 0.00 H new ATOM 0 HG SER A 66 -4.852 17.481 -1.653 1.00 0.00 H new ATOM 1031 N SER A 67 -0.729 14.844 -3.140 1.00 0.00 N ATOM 1032 CA SER A 67 0.700 14.577 -3.031 1.00 0.00 C ATOM 1033 C SER A 67 1.366 15.565 -2.078 1.00 0.00 C ATOM 1034 O SER A 67 0.843 16.649 -1.824 1.00 0.00 O ATOM 1035 CB SER A 67 1.361 14.654 -4.408 1.00 0.00 C ATOM 1036 OG SER A 67 1.113 13.479 -5.160 1.00 0.00 O ATOM 0 H SER A 67 -1.008 15.298 -4.010 1.00 0.00 H new ATOM 0 HA SER A 67 0.827 13.571 -2.631 1.00 0.00 H new ATOM 0 HB2 SER A 67 0.983 15.522 -4.948 1.00 0.00 H new ATOM 0 HB3 SER A 67 2.436 14.795 -4.292 1.00 0.00 H new ATOM 0 HG SER A 67 1.545 13.554 -6.037 1.00 0.00 H new ATOM 1042 N GLY A 68 2.526 15.180 -1.553 1.00 0.00 N ATOM 1043 CA GLY A 68 3.246 16.042 -0.634 1.00 0.00 C ATOM 1044 C GLY A 68 4.610 15.491 -0.270 1.00 0.00 C ATOM 1045 O GLY A 68 5.309 14.938 -1.119 1.00 0.00 O ATOM 0 H GLY A 68 2.979 14.287 -1.748 1.00 0.00 H new ATOM 0 HA2 GLY A 68 3.364 17.028 -1.083 1.00 0.00 H new ATOM 0 HA3 GLY A 68 2.657 16.173 0.273 1.00 0.00 H new TER 1049 GLY A 68