USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 791 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 54 SER OG : rot 180:sc= -0.345 USER MOD Set 1.2: A 55 ASN : amide:sc= -1.37 X(o=-1.7,f=-2) USER MOD Set 2.1: A 29 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 33 THR OG1 : rot 67:sc= 1.19 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 130:sc= -1.68 USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -2.75! C(o=-2.8!,f=-4.8!) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -160:sc= 0.0196 USER MOD Single : A 26 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.096) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot -131:sc= -0.677 USER MOD Single : A 39 THR OG1 : rot 120:sc= -1.61 USER MOD Single : A 41 GLN : amide:sc=-0.00231 K(o=-0.0023,f=-0.54) USER MOD Single : A 42 TYR OH : rot -129:sc= 1.33 USER MOD Single : A 44 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.425) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -179:sc= 0.0878 (180deg=0.0877) USER MOD Single : A 52 ASN : amide:sc= -0.542 K(o=-0.54,f=-2.7!) USER MOD Single : A 58 SER OG : rot 150:sc= -0.646 USER MOD Single : A 67 HIS : no HD1:sc= -2.88 K(o=-2.9,f=-3.9) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot -18:sc= 0.531 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 148:sc= -1.83 (180deg=-2.97!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 83 THR OG1 : rot 8:sc= 0.649 USER MOD Single : A 85 HIS :FLIP no HD1:sc= -0.265 F(o=-0.95,f=-0.27) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= -0.0173 USER MOD Single : A 90 HIS : no HD1:sc=-0.00219 X(o=-0.0022,f=-0.39) USER MOD Single : A 95 ASN : amide:sc= -0.699 K(o=-0.7,f=-2.5!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 48:sc= 0.407 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.239 15.586 -13.464 1.00 0.00 N ATOM 2 CA GLY A 1 -4.557 15.501 -12.185 1.00 0.00 C ATOM 3 C GLY A 1 -5.370 14.758 -11.143 1.00 0.00 C ATOM 4 O GLY A 1 -5.969 15.371 -10.261 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.643 16.102 -14.142 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.422 14.628 -13.824 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.141 16.089 -13.344 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.599 14.999 -12.320 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.341 16.507 -11.824 1.00 0.00 H new ATOM 8 N SER A 2 -5.392 13.432 -11.246 1.00 0.00 N ATOM 9 CA SER A 2 -6.141 12.605 -10.308 1.00 0.00 C ATOM 10 C SER A 2 -5.500 12.636 -8.924 1.00 0.00 C ATOM 11 O SER A 2 -4.277 12.608 -8.794 1.00 0.00 O ATOM 12 CB SER A 2 -6.218 11.163 -10.816 1.00 0.00 C ATOM 13 OG SER A 2 -4.923 10.624 -11.018 1.00 0.00 O ATOM 0 H SER A 2 -4.900 12.908 -11.970 1.00 0.00 H new ATOM 0 HA SER A 2 -7.150 13.010 -10.230 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.763 10.550 -10.098 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.778 11.133 -11.751 1.00 0.00 H new ATOM 0 HG SER A 2 -4.999 9.702 -11.341 1.00 0.00 H new ATOM 19 N SER A 3 -6.338 12.693 -7.893 1.00 0.00 N ATOM 20 CA SER A 3 -5.854 12.731 -6.518 1.00 0.00 C ATOM 21 C SER A 3 -6.295 11.488 -5.752 1.00 0.00 C ATOM 22 O SER A 3 -7.440 11.049 -5.866 1.00 0.00 O ATOM 23 CB SER A 3 -6.363 13.989 -5.811 1.00 0.00 C ATOM 24 OG SER A 3 -7.754 13.900 -5.553 1.00 0.00 O ATOM 0 H SER A 3 -7.354 12.714 -7.984 1.00 0.00 H new ATOM 0 HA SER A 3 -4.764 12.753 -6.542 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.824 14.127 -4.874 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.159 14.864 -6.428 1.00 0.00 H new ATOM 0 HG SER A 3 -8.055 14.715 -5.099 1.00 0.00 H new ATOM 30 N GLY A 4 -5.379 10.925 -4.970 1.00 0.00 N ATOM 31 CA GLY A 4 -5.693 9.739 -4.196 1.00 0.00 C ATOM 32 C GLY A 4 -4.450 8.988 -3.759 1.00 0.00 C ATOM 33 O GLY A 4 -3.539 8.765 -4.556 1.00 0.00 O ATOM 0 H GLY A 4 -4.425 11.269 -4.859 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -6.270 10.025 -3.316 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.324 9.078 -4.790 1.00 0.00 H new ATOM 37 N SER A 5 -4.414 8.595 -2.490 1.00 0.00 N ATOM 38 CA SER A 5 -3.272 7.869 -1.946 1.00 0.00 C ATOM 39 C SER A 5 -3.544 6.369 -1.923 1.00 0.00 C ATOM 40 O SER A 5 -2.914 5.600 -2.649 1.00 0.00 O ATOM 41 CB SER A 5 -2.951 8.364 -0.534 1.00 0.00 C ATOM 42 OG SER A 5 -2.690 9.757 -0.529 1.00 0.00 O ATOM 0 H SER A 5 -5.163 8.767 -1.819 1.00 0.00 H new ATOM 0 HA SER A 5 -2.413 8.055 -2.591 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.787 8.145 0.130 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.086 7.827 -0.145 1.00 0.00 H new ATOM 0 HG SER A 5 -2.489 10.049 0.385 1.00 0.00 H new ATOM 48 N SER A 6 -4.487 5.958 -1.081 1.00 0.00 N ATOM 49 CA SER A 6 -4.841 4.548 -0.958 1.00 0.00 C ATOM 50 C SER A 6 -3.614 3.708 -0.622 1.00 0.00 C ATOM 51 O SER A 6 -3.362 2.678 -1.247 1.00 0.00 O ATOM 52 CB SER A 6 -5.478 4.046 -2.256 1.00 0.00 C ATOM 53 OG SER A 6 -6.528 4.900 -2.672 1.00 0.00 O ATOM 0 H SER A 6 -5.020 6.581 -0.474 1.00 0.00 H new ATOM 0 HA SER A 6 -5.561 4.448 -0.146 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.721 3.988 -3.038 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.862 3.037 -2.109 1.00 0.00 H new ATOM 0 HG SER A 6 -6.404 5.136 -3.615 1.00 0.00 H new ATOM 59 N GLY A 7 -2.852 4.154 0.374 1.00 0.00 N ATOM 60 CA GLY A 7 -1.660 3.432 0.777 1.00 0.00 C ATOM 61 C GLY A 7 -1.946 2.387 1.837 1.00 0.00 C ATOM 62 O GLY A 7 -3.011 2.395 2.457 1.00 0.00 O ATOM 0 H GLY A 7 -3.040 5.002 0.908 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.219 2.949 -0.095 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.922 4.138 1.157 1.00 0.00 H new ATOM 66 N LEU A 8 -0.995 1.484 2.046 1.00 0.00 N ATOM 67 CA LEU A 8 -1.151 0.425 3.037 1.00 0.00 C ATOM 68 C LEU A 8 0.191 0.070 3.670 1.00 0.00 C ATOM 69 O LEU A 8 1.167 -0.200 2.968 1.00 0.00 O ATOM 70 CB LEU A 8 -1.769 -0.818 2.394 1.00 0.00 C ATOM 71 CG LEU A 8 -3.296 -0.836 2.302 1.00 0.00 C ATOM 72 CD1 LEU A 8 -3.763 -1.976 1.411 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.913 -0.953 3.688 1.00 0.00 C ATOM 0 H LEU A 8 -0.108 1.464 1.543 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.817 0.790 3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.363 -0.922 1.388 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.448 -1.693 2.960 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.625 0.104 1.858 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.852 -1.973 1.357 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.350 -1.848 0.410 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.423 -2.925 1.826 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.000 -0.964 3.603 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.576 -1.876 4.159 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.606 -0.102 4.296 1.00 0.00 H new ATOM 85 N ILE A 9 0.232 0.068 4.998 1.00 0.00 N ATOM 86 CA ILE A 9 1.454 -0.258 5.724 1.00 0.00 C ATOM 87 C ILE A 9 1.474 -1.726 6.134 1.00 0.00 C ATOM 88 O ILE A 9 0.895 -2.105 7.152 1.00 0.00 O ATOM 89 CB ILE A 9 1.612 0.617 6.981 1.00 0.00 C ATOM 90 CG1 ILE A 9 1.571 2.100 6.605 1.00 0.00 C ATOM 91 CG2 ILE A 9 2.911 0.284 7.698 1.00 0.00 C ATOM 92 CD1 ILE A 9 2.892 2.631 6.094 1.00 0.00 C ATOM 0 H ILE A 9 -0.566 0.288 5.593 1.00 0.00 H new ATOM 0 HA ILE A 9 2.286 -0.061 5.047 1.00 0.00 H new ATOM 0 HB ILE A 9 0.782 0.409 7.657 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.808 2.252 5.842 1.00 0.00 H new ATOM 0 HG13 ILE A 9 1.269 2.679 7.477 1.00 0.00 H new ATOM 0 HG21 ILE A 9 3.008 0.911 8.584 1.00 0.00 H new ATOM 0 HG22 ILE A 9 2.905 -0.765 7.994 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.753 0.467 7.030 1.00 0.00 H new ATOM 0 HD11 ILE A 9 2.788 3.688 5.847 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.654 2.511 6.864 1.00 0.00 H new ATOM 0 HD13 ILE A 9 3.186 2.077 5.202 1.00 0.00 H new ATOM 104 N ALA A 10 2.146 -2.549 5.336 1.00 0.00 N ATOM 105 CA ALA A 10 2.246 -3.976 5.618 1.00 0.00 C ATOM 106 C ALA A 10 3.456 -4.279 6.495 1.00 0.00 C ATOM 107 O ALA A 10 4.552 -3.775 6.250 1.00 0.00 O ATOM 108 CB ALA A 10 2.320 -4.767 4.321 1.00 0.00 C ATOM 0 H ALA A 10 2.630 -2.252 4.488 1.00 0.00 H new ATOM 0 HA ALA A 10 1.351 -4.277 6.163 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.394 -5.831 4.547 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.422 -4.583 3.731 1.00 0.00 H new ATOM 0 HB3 ALA A 10 3.197 -4.455 3.754 1.00 0.00 H new ATOM 114 N CYS A 11 3.250 -5.105 7.515 1.00 0.00 N ATOM 115 CA CYS A 11 4.325 -5.474 8.428 1.00 0.00 C ATOM 116 C CYS A 11 4.638 -6.963 8.326 1.00 0.00 C ATOM 117 O CYS A 11 3.855 -7.804 8.765 1.00 0.00 O ATOM 118 CB CYS A 11 3.946 -5.117 9.866 1.00 0.00 C ATOM 119 SG CYS A 11 5.334 -4.554 10.878 1.00 0.00 S ATOM 0 H CYS A 11 2.349 -5.531 7.730 1.00 0.00 H new ATOM 0 HA CYS A 11 5.217 -4.914 8.146 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.185 -4.337 9.847 1.00 0.00 H new ATOM 0 HB3 CYS A 11 3.496 -5.990 10.339 1.00 0.00 H new ATOM 0 HG CYS A 11 4.913 -4.274 12.076 1.00 0.00 H new ATOM 125 N VAL A 12 5.790 -7.282 7.743 1.00 0.00 N ATOM 126 CA VAL A 12 6.207 -8.670 7.583 1.00 0.00 C ATOM 127 C VAL A 12 7.210 -9.070 8.659 1.00 0.00 C ATOM 128 O VAL A 12 8.015 -8.255 9.106 1.00 0.00 O ATOM 129 CB VAL A 12 6.834 -8.911 6.197 1.00 0.00 C ATOM 130 CG1 VAL A 12 6.407 -10.263 5.646 1.00 0.00 C ATOM 131 CG2 VAL A 12 6.454 -7.791 5.239 1.00 0.00 C ATOM 0 H VAL A 12 6.451 -6.598 7.374 1.00 0.00 H new ATOM 0 HA VAL A 12 5.311 -9.283 7.680 1.00 0.00 H new ATOM 0 HB VAL A 12 7.919 -8.915 6.303 1.00 0.00 H new ATOM 0 HG11 VAL A 12 6.860 -10.416 4.666 1.00 0.00 H new ATOM 0 HG12 VAL A 12 6.734 -11.052 6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.321 -10.291 5.553 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.905 -7.977 4.264 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.370 -7.753 5.135 1.00 0.00 H new ATOM 0 HG23 VAL A 12 6.815 -6.840 5.630 1.00 0.00 H new ATOM 141 N ALA A 13 7.155 -10.333 9.071 1.00 0.00 N ATOM 142 CA ALA A 13 8.061 -10.843 10.093 1.00 0.00 C ATOM 143 C ALA A 13 9.207 -11.630 9.467 1.00 0.00 C ATOM 144 O ALA A 13 10.254 -11.818 10.085 1.00 0.00 O ATOM 145 CB ALA A 13 7.301 -11.711 11.085 1.00 0.00 C ATOM 0 H ALA A 13 6.493 -11.021 8.713 1.00 0.00 H new ATOM 0 HA ALA A 13 8.488 -9.992 10.624 1.00 0.00 H new ATOM 0 HB1 ALA A 13 7.989 -12.085 11.843 1.00 0.00 H new ATOM 0 HB2 ALA A 13 6.521 -11.119 11.564 1.00 0.00 H new ATOM 0 HB3 ALA A 13 6.847 -12.552 10.560 1.00 0.00 H new ATOM 151 N ASN A 14 9.001 -12.091 8.237 1.00 0.00 N ATOM 152 CA ASN A 14 10.017 -12.859 7.528 1.00 0.00 C ATOM 153 C ASN A 14 11.116 -11.946 6.994 1.00 0.00 C ATOM 154 O ASN A 14 10.930 -11.253 5.992 1.00 0.00 O ATOM 155 CB ASN A 14 9.384 -13.642 6.376 1.00 0.00 C ATOM 156 CG ASN A 14 9.224 -15.115 6.697 1.00 0.00 C ATOM 157 OD1 ASN A 14 9.970 -15.671 7.502 1.00 0.00 O ATOM 158 ND2 ASN A 14 8.247 -15.755 6.065 1.00 0.00 N ATOM 0 H ASN A 14 8.139 -11.946 7.711 1.00 0.00 H new ATOM 0 HA ASN A 14 10.463 -13.561 8.233 1.00 0.00 H new ATOM 0 HB2 ASN A 14 8.408 -13.216 6.144 1.00 0.00 H new ATOM 0 HB3 ASN A 14 10.001 -13.532 5.484 1.00 0.00 H new ATOM 0 HD21 ASN A 14 8.091 -16.748 6.239 1.00 0.00 H new ATOM 0 HD22 ASN A 14 7.652 -15.254 5.405 1.00 0.00 H new ATOM 165 N ASP A 15 12.262 -11.951 7.667 1.00 0.00 N ATOM 166 CA ASP A 15 13.392 -11.124 7.259 1.00 0.00 C ATOM 167 C ASP A 15 13.840 -11.477 5.844 1.00 0.00 C ATOM 168 O ASP A 15 14.590 -10.729 5.216 1.00 0.00 O ATOM 169 CB ASP A 15 14.557 -11.298 8.235 1.00 0.00 C ATOM 170 CG ASP A 15 14.163 -10.995 9.667 1.00 0.00 C ATOM 171 OD1 ASP A 15 13.229 -10.191 9.868 1.00 0.00 O ATOM 172 OD2 ASP A 15 14.788 -11.564 10.586 1.00 0.00 O ATOM 0 H ASP A 15 12.433 -12.518 8.497 1.00 0.00 H new ATOM 0 HA ASP A 15 13.072 -10.082 7.270 1.00 0.00 H new ATOM 0 HB2 ASP A 15 14.930 -12.320 8.172 1.00 0.00 H new ATOM 0 HB3 ASP A 15 15.376 -10.642 7.940 1.00 0.00 H new ATOM 177 N ASP A 16 13.376 -12.619 5.349 1.00 0.00 N ATOM 178 CA ASP A 16 13.729 -13.069 4.008 1.00 0.00 C ATOM 179 C ASP A 16 13.007 -12.242 2.948 1.00 0.00 C ATOM 180 O ASP A 16 13.483 -12.107 1.822 1.00 0.00 O ATOM 181 CB ASP A 16 13.384 -14.550 3.839 1.00 0.00 C ATOM 182 CG ASP A 16 14.091 -15.429 4.852 1.00 0.00 C ATOM 183 OD1 ASP A 16 15.335 -15.518 4.794 1.00 0.00 O ATOM 184 OD2 ASP A 16 13.400 -16.026 5.702 1.00 0.00 O ATOM 0 H ASP A 16 12.755 -13.250 5.856 1.00 0.00 H new ATOM 0 HA ASP A 16 14.803 -12.935 3.877 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.307 -14.682 3.937 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.654 -14.870 2.833 1.00 0.00 H new ATOM 189 N VAL A 17 11.856 -11.690 3.319 1.00 0.00 N ATOM 190 CA VAL A 17 11.069 -10.876 2.401 1.00 0.00 C ATOM 191 C VAL A 17 11.829 -9.619 1.992 1.00 0.00 C ATOM 192 O VAL A 17 11.498 -8.978 0.993 1.00 0.00 O ATOM 193 CB VAL A 17 9.722 -10.468 3.027 1.00 0.00 C ATOM 194 CG1 VAL A 17 9.050 -9.389 2.191 1.00 0.00 C ATOM 195 CG2 VAL A 17 8.816 -11.680 3.177 1.00 0.00 C ATOM 0 H VAL A 17 11.448 -11.792 4.248 1.00 0.00 H new ATOM 0 HA VAL A 17 10.881 -11.486 1.518 1.00 0.00 H new ATOM 0 HB VAL A 17 9.911 -10.060 4.020 1.00 0.00 H new ATOM 0 HG11 VAL A 17 8.100 -9.113 2.648 1.00 0.00 H new ATOM 0 HG12 VAL A 17 9.696 -8.513 2.140 1.00 0.00 H new ATOM 0 HG13 VAL A 17 8.872 -9.767 1.184 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.869 -11.374 3.621 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.632 -12.120 2.197 1.00 0.00 H new ATOM 0 HG23 VAL A 17 9.297 -12.416 3.821 1.00 0.00 H new ATOM 205 N PHE A 18 12.848 -9.271 2.769 1.00 0.00 N ATOM 206 CA PHE A 18 13.656 -8.089 2.489 1.00 0.00 C ATOM 207 C PHE A 18 14.836 -8.439 1.587 1.00 0.00 C ATOM 208 O PHE A 18 15.832 -7.718 1.543 1.00 0.00 O ATOM 209 CB PHE A 18 14.162 -7.469 3.793 1.00 0.00 C ATOM 210 CG PHE A 18 13.061 -6.975 4.688 1.00 0.00 C ATOM 211 CD1 PHE A 18 12.398 -7.846 5.538 1.00 0.00 C ATOM 212 CD2 PHE A 18 12.691 -5.640 4.679 1.00 0.00 C ATOM 213 CE1 PHE A 18 11.384 -7.393 6.362 1.00 0.00 C ATOM 214 CE2 PHE A 18 11.678 -5.182 5.502 1.00 0.00 C ATOM 215 CZ PHE A 18 11.026 -6.060 6.345 1.00 0.00 C ATOM 0 H PHE A 18 13.135 -9.791 3.599 1.00 0.00 H new ATOM 0 HA PHE A 18 13.027 -7.364 1.971 1.00 0.00 H new ATOM 0 HB2 PHE A 18 14.754 -8.209 4.332 1.00 0.00 H new ATOM 0 HB3 PHE A 18 14.828 -6.639 3.557 1.00 0.00 H new ATOM 0 HD1 PHE A 18 12.676 -8.889 5.557 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.199 -4.949 4.022 1.00 0.00 H new ATOM 0 HE1 PHE A 18 10.873 -8.082 7.018 1.00 0.00 H new ATOM 0 HE2 PHE A 18 11.397 -4.139 5.485 1.00 0.00 H new ATOM 0 HZ PHE A 18 10.237 -5.704 6.990 1.00 0.00 H new ATOM 225 N SER A 19 14.716 -9.552 0.870 1.00 0.00 N ATOM 226 CA SER A 19 15.774 -10.001 -0.027 1.00 0.00 C ATOM 227 C SER A 19 15.286 -10.026 -1.473 1.00 0.00 C ATOM 228 O SER A 19 14.090 -10.160 -1.732 1.00 0.00 O ATOM 229 CB SER A 19 16.263 -11.392 0.382 1.00 0.00 C ATOM 230 OG SER A 19 17.530 -11.674 -0.186 1.00 0.00 O ATOM 0 H SER A 19 13.897 -10.159 0.893 1.00 0.00 H new ATOM 0 HA SER A 19 16.602 -9.296 0.047 1.00 0.00 H new ATOM 0 HB2 SER A 19 16.326 -11.454 1.468 1.00 0.00 H new ATOM 0 HB3 SER A 19 15.542 -12.144 0.061 1.00 0.00 H new ATOM 0 HG SER A 19 17.821 -12.568 0.092 1.00 0.00 H new ATOM 236 N GLU A 20 16.221 -9.897 -2.408 1.00 0.00 N ATOM 237 CA GLU A 20 15.887 -9.904 -3.828 1.00 0.00 C ATOM 238 C GLU A 20 15.844 -11.331 -4.370 1.00 0.00 C ATOM 239 O GLU A 20 15.432 -11.562 -5.506 1.00 0.00 O ATOM 240 CB GLU A 20 16.903 -9.076 -4.618 1.00 0.00 C ATOM 241 CG GLU A 20 18.338 -9.536 -4.433 1.00 0.00 C ATOM 242 CD GLU A 20 19.016 -9.878 -5.745 1.00 0.00 C ATOM 243 OE1 GLU A 20 19.507 -8.949 -6.420 1.00 0.00 O ATOM 244 OE2 GLU A 20 19.055 -11.075 -6.099 1.00 0.00 O ATOM 0 H GLU A 20 17.215 -9.786 -2.209 1.00 0.00 H new ATOM 0 HA GLU A 20 14.899 -9.460 -3.945 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.650 -9.120 -5.677 1.00 0.00 H new ATOM 0 HB3 GLU A 20 16.823 -8.032 -4.314 1.00 0.00 H new ATOM 0 HG2 GLU A 20 18.904 -8.753 -3.929 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.354 -10.410 -3.782 1.00 0.00 H new ATOM 251 N SER A 21 16.274 -12.283 -3.547 1.00 0.00 N ATOM 252 CA SER A 21 16.291 -13.685 -3.945 1.00 0.00 C ATOM 253 C SER A 21 14.997 -14.062 -4.662 1.00 0.00 C ATOM 254 O SER A 21 14.983 -14.255 -5.877 1.00 0.00 O ATOM 255 CB SER A 21 16.488 -14.581 -2.721 1.00 0.00 C ATOM 256 OG SER A 21 17.767 -15.192 -2.737 1.00 0.00 O ATOM 0 H SER A 21 16.615 -12.108 -2.602 1.00 0.00 H new ATOM 0 HA SER A 21 17.124 -13.832 -4.633 1.00 0.00 H new ATOM 0 HB2 SER A 21 16.375 -13.990 -1.812 1.00 0.00 H new ATOM 0 HB3 SER A 21 15.715 -15.349 -2.700 1.00 0.00 H new ATOM 0 HG SER A 21 17.869 -15.758 -1.944 1.00 0.00 H new ATOM 262 N GLU A 22 13.913 -14.163 -3.899 1.00 0.00 N ATOM 263 CA GLU A 22 12.615 -14.517 -4.460 1.00 0.00 C ATOM 264 C GLU A 22 11.501 -14.285 -3.445 1.00 0.00 C ATOM 265 O GLU A 22 10.454 -13.725 -3.770 1.00 0.00 O ATOM 266 CB GLU A 22 12.612 -15.979 -4.913 1.00 0.00 C ATOM 267 CG GLU A 22 12.343 -16.156 -6.398 1.00 0.00 C ATOM 268 CD GLU A 22 13.272 -17.164 -7.044 1.00 0.00 C ATOM 269 OE1 GLU A 22 13.337 -18.311 -6.554 1.00 0.00 O ATOM 270 OE2 GLU A 22 13.935 -16.806 -8.040 1.00 0.00 O ATOM 0 H GLU A 22 13.908 -14.005 -2.891 1.00 0.00 H new ATOM 0 HA GLU A 22 12.434 -13.876 -5.323 1.00 0.00 H new ATOM 0 HB2 GLU A 22 13.576 -16.427 -4.671 1.00 0.00 H new ATOM 0 HB3 GLU A 22 11.856 -16.524 -4.348 1.00 0.00 H new ATOM 0 HG2 GLU A 22 11.311 -16.476 -6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 22 12.451 -15.194 -6.900 1.00 0.00 H new ATOM 277 N THR A 23 11.734 -14.721 -2.210 1.00 0.00 N ATOM 278 CA THR A 23 10.750 -14.563 -1.146 1.00 0.00 C ATOM 279 C THR A 23 10.008 -13.239 -1.275 1.00 0.00 C ATOM 280 O THR A 23 8.824 -13.146 -0.950 1.00 0.00 O ATOM 281 CB THR A 23 11.411 -14.634 0.245 1.00 0.00 C ATOM 282 OG1 THR A 23 12.335 -15.727 0.292 1.00 0.00 O ATOM 283 CG2 THR A 23 10.363 -14.801 1.334 1.00 0.00 C ATOM 0 H THR A 23 12.595 -15.186 -1.923 1.00 0.00 H new ATOM 0 HA THR A 23 10.041 -15.385 -1.247 1.00 0.00 H new ATOM 0 HB THR A 23 11.945 -13.700 0.418 1.00 0.00 H new ATOM 0 HG1 THR A 23 12.509 -15.968 1.226 1.00 0.00 H new ATOM 0 HG21 THR A 23 10.853 -14.849 2.306 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.679 -13.953 1.314 1.00 0.00 H new ATOM 0 HG23 THR A 23 9.805 -15.722 1.164 1.00 0.00 H new ATOM 291 N ARG A 24 10.708 -12.217 -1.754 1.00 0.00 N ATOM 292 CA ARG A 24 10.114 -10.897 -1.927 1.00 0.00 C ATOM 293 C ARG A 24 8.958 -10.946 -2.922 1.00 0.00 C ATOM 294 O ARG A 24 7.811 -10.673 -2.569 1.00 0.00 O ATOM 295 CB ARG A 24 11.169 -9.897 -2.405 1.00 0.00 C ATOM 296 CG ARG A 24 10.588 -8.568 -2.858 1.00 0.00 C ATOM 297 CD ARG A 24 11.584 -7.433 -2.676 1.00 0.00 C ATOM 298 NE ARG A 24 12.599 -7.422 -3.727 1.00 0.00 N ATOM 299 CZ ARG A 24 12.349 -7.082 -4.986 1.00 0.00 C ATOM 300 NH1 ARG A 24 11.124 -6.727 -5.350 1.00 0.00 N ATOM 301 NH2 ARG A 24 13.325 -7.097 -5.885 1.00 0.00 N ATOM 0 H ARG A 24 11.688 -12.277 -2.030 1.00 0.00 H new ATOM 0 HA ARG A 24 9.726 -10.573 -0.961 1.00 0.00 H new ATOM 0 HB2 ARG A 24 11.879 -9.717 -1.598 1.00 0.00 H new ATOM 0 HB3 ARG A 24 11.729 -10.339 -3.229 1.00 0.00 H new ATOM 0 HG2 ARG A 24 10.299 -8.635 -3.907 1.00 0.00 H new ATOM 0 HG3 ARG A 24 9.682 -8.353 -2.291 1.00 0.00 H new ATOM 0 HD2 ARG A 24 11.053 -6.481 -2.675 1.00 0.00 H new ATOM 0 HD3 ARG A 24 12.069 -7.528 -1.705 1.00 0.00 H new ATOM 0 HE ARG A 24 13.552 -7.690 -3.480 1.00 0.00 H new ATOM 0 HH11 ARG A 24 10.371 -6.715 -4.662 1.00 0.00 H new ATOM 0 HH12 ARG A 24 10.935 -6.466 -6.318 1.00 0.00 H new ATOM 0 HH21 ARG A 24 14.268 -7.370 -5.609 1.00 0.00 H new ATOM 0 HH22 ARG A 24 13.132 -6.836 -6.852 1.00 0.00 H new ATOM 315 N ALA A 25 9.269 -11.297 -4.165 1.00 0.00 N ATOM 316 CA ALA A 25 8.256 -11.385 -5.210 1.00 0.00 C ATOM 317 C ALA A 25 6.923 -11.859 -4.643 1.00 0.00 C ATOM 318 O ALA A 25 5.910 -11.167 -4.747 1.00 0.00 O ATOM 319 CB ALA A 25 8.723 -12.314 -6.321 1.00 0.00 C ATOM 0 H ALA A 25 10.214 -11.525 -4.473 1.00 0.00 H new ATOM 0 HA ALA A 25 8.109 -10.388 -5.625 1.00 0.00 H new ATOM 0 HB1 ALA A 25 7.957 -12.370 -7.094 1.00 0.00 H new ATOM 0 HB2 ALA A 25 9.647 -11.929 -6.753 1.00 0.00 H new ATOM 0 HB3 ALA A 25 8.900 -13.309 -5.913 1.00 0.00 H new ATOM 325 N LYS A 26 6.929 -13.046 -4.046 1.00 0.00 N ATOM 326 CA LYS A 26 5.720 -13.616 -3.463 1.00 0.00 C ATOM 327 C LYS A 26 4.915 -12.547 -2.730 1.00 0.00 C ATOM 328 O LYS A 26 3.700 -12.441 -2.906 1.00 0.00 O ATOM 329 CB LYS A 26 6.079 -14.749 -2.499 1.00 0.00 C ATOM 330 CG LYS A 26 6.772 -15.922 -3.170 1.00 0.00 C ATOM 331 CD LYS A 26 8.219 -16.045 -2.722 1.00 0.00 C ATOM 332 CE LYS A 26 9.049 -16.828 -3.728 1.00 0.00 C ATOM 333 NZ LYS A 26 8.454 -18.161 -4.021 1.00 0.00 N ATOM 0 H LYS A 26 7.758 -13.632 -3.953 1.00 0.00 H new ATOM 0 HA LYS A 26 5.109 -14.016 -4.272 1.00 0.00 H new ATOM 0 HB2 LYS A 26 6.726 -14.356 -1.715 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.170 -15.104 -2.014 1.00 0.00 H new ATOM 0 HG2 LYS A 26 6.238 -16.843 -2.936 1.00 0.00 H new ATOM 0 HG3 LYS A 26 6.734 -15.797 -4.252 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.646 -15.051 -2.591 1.00 0.00 H new ATOM 0 HD3 LYS A 26 8.260 -16.540 -1.752 1.00 0.00 H new ATOM 0 HE2 LYS A 26 9.133 -16.257 -4.653 1.00 0.00 H new ATOM 0 HE3 LYS A 26 10.060 -16.959 -3.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 9.147 -18.746 -4.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 8.194 -18.629 -3.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 7.605 -18.040 -4.609 1.00 0.00 H new ATOM 347 N PHE A 27 5.597 -11.756 -1.908 1.00 0.00 N ATOM 348 CA PHE A 27 4.946 -10.696 -1.149 1.00 0.00 C ATOM 349 C PHE A 27 4.367 -9.637 -2.083 1.00 0.00 C ATOM 350 O PHE A 27 3.310 -9.068 -1.813 1.00 0.00 O ATOM 351 CB PHE A 27 5.936 -10.051 -0.179 1.00 0.00 C ATOM 352 CG PHE A 27 5.409 -8.806 0.476 1.00 0.00 C ATOM 353 CD1 PHE A 27 5.330 -7.616 -0.229 1.00 0.00 C ATOM 354 CD2 PHE A 27 4.994 -8.825 1.798 1.00 0.00 C ATOM 355 CE1 PHE A 27 4.845 -6.470 0.371 1.00 0.00 C ATOM 356 CE2 PHE A 27 4.509 -7.682 2.404 1.00 0.00 C ATOM 357 CZ PHE A 27 4.435 -6.502 1.690 1.00 0.00 C ATOM 0 H PHE A 27 6.602 -11.830 -1.751 1.00 0.00 H new ATOM 0 HA PHE A 27 4.129 -11.140 -0.580 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.200 -10.774 0.593 1.00 0.00 H new ATOM 0 HB3 PHE A 27 6.853 -9.809 -0.716 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.651 -7.584 -1.260 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.050 -9.745 2.362 1.00 0.00 H new ATOM 0 HE1 PHE A 27 4.786 -5.549 -0.191 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.188 -7.711 3.435 1.00 0.00 H new ATOM 0 HZ PHE A 27 4.058 -5.607 2.162 1.00 0.00 H new ATOM 367 N GLU A 28 5.069 -9.376 -3.182 1.00 0.00 N ATOM 368 CA GLU A 28 4.626 -8.385 -4.154 1.00 0.00 C ATOM 369 C GLU A 28 3.441 -8.907 -4.963 1.00 0.00 C ATOM 370 O GLU A 28 2.354 -8.331 -4.933 1.00 0.00 O ATOM 371 CB GLU A 28 5.774 -8.011 -5.094 1.00 0.00 C ATOM 372 CG GLU A 28 6.334 -6.620 -4.847 1.00 0.00 C ATOM 373 CD GLU A 28 7.279 -6.169 -5.944 1.00 0.00 C ATOM 374 OE1 GLU A 28 7.130 -6.645 -7.088 1.00 0.00 O ATOM 375 OE2 GLU A 28 8.168 -5.340 -5.657 1.00 0.00 O ATOM 0 H GLU A 28 5.947 -9.838 -3.421 1.00 0.00 H new ATOM 0 HA GLU A 28 4.308 -7.496 -3.609 1.00 0.00 H new ATOM 0 HB2 GLU A 28 6.576 -8.741 -4.983 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.424 -8.075 -6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.511 -5.910 -4.767 1.00 0.00 H new ATOM 0 HG3 GLU A 28 6.859 -6.608 -3.892 1.00 0.00 H new ATOM 382 N SER A 29 3.662 -10.000 -5.685 1.00 0.00 N ATOM 383 CA SER A 29 2.615 -10.598 -6.506 1.00 0.00 C ATOM 384 C SER A 29 1.262 -10.511 -5.807 1.00 0.00 C ATOM 385 O SER A 29 0.220 -10.416 -6.458 1.00 0.00 O ATOM 386 CB SER A 29 2.950 -12.059 -6.813 1.00 0.00 C ATOM 387 OG SER A 29 2.002 -12.624 -7.701 1.00 0.00 O ATOM 0 H SER A 29 4.556 -10.490 -5.719 1.00 0.00 H new ATOM 0 HA SER A 29 2.558 -10.042 -7.442 1.00 0.00 H new ATOM 0 HB2 SER A 29 3.946 -12.123 -7.251 1.00 0.00 H new ATOM 0 HB3 SER A 29 2.972 -12.633 -5.886 1.00 0.00 H new ATOM 0 HG SER A 29 2.239 -13.557 -7.882 1.00 0.00 H new ATOM 393 N LEU A 30 1.284 -10.545 -4.480 1.00 0.00 N ATOM 394 CA LEU A 30 0.060 -10.470 -3.691 1.00 0.00 C ATOM 395 C LEU A 30 -0.687 -9.170 -3.968 1.00 0.00 C ATOM 396 O LEU A 30 -1.873 -9.182 -4.301 1.00 0.00 O ATOM 397 CB LEU A 30 0.383 -10.577 -2.200 1.00 0.00 C ATOM 398 CG LEU A 30 0.811 -11.960 -1.704 1.00 0.00 C ATOM 399 CD1 LEU A 30 1.399 -11.866 -0.305 1.00 0.00 C ATOM 400 CD2 LEU A 30 -0.368 -12.922 -1.726 1.00 0.00 C ATOM 0 H LEU A 30 2.137 -10.624 -3.927 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.580 -11.304 -3.979 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.178 -9.868 -1.969 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.496 -10.266 -1.635 1.00 0.00 H new ATOM 0 HG LEU A 30 1.580 -12.344 -2.374 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.698 -12.859 0.032 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.270 -11.210 -0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 30 0.652 -11.461 0.377 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.046 -13.901 -1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.159 -12.543 -1.079 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.745 -13.012 -2.745 1.00 0.00 H new ATOM 412 N PHE A 31 0.013 -8.049 -3.830 1.00 0.00 N ATOM 413 CA PHE A 31 -0.583 -6.740 -4.068 1.00 0.00 C ATOM 414 C PHE A 31 -0.553 -6.389 -5.552 1.00 0.00 C ATOM 415 O PHE A 31 -1.561 -5.976 -6.124 1.00 0.00 O ATOM 416 CB PHE A 31 0.153 -5.667 -3.263 1.00 0.00 C ATOM 417 CG PHE A 31 0.455 -6.079 -1.851 1.00 0.00 C ATOM 418 CD1 PHE A 31 1.547 -6.884 -1.568 1.00 0.00 C ATOM 419 CD2 PHE A 31 -0.353 -5.662 -0.806 1.00 0.00 C ATOM 420 CE1 PHE A 31 1.828 -7.264 -0.269 1.00 0.00 C ATOM 421 CE2 PHE A 31 -0.077 -6.039 0.495 1.00 0.00 C ATOM 422 CZ PHE A 31 1.014 -6.842 0.763 1.00 0.00 C ATOM 0 H PHE A 31 0.995 -8.021 -3.554 1.00 0.00 H new ATOM 0 HA PHE A 31 -1.623 -6.778 -3.744 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.087 -5.421 -3.769 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.450 -4.759 -3.247 1.00 0.00 H new ATOM 0 HD1 PHE A 31 2.186 -7.218 -2.372 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.208 -5.035 -1.010 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.683 -7.890 -0.062 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.714 -5.706 1.301 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.230 -7.139 1.778 1.00 0.00 H new ATOM 432 N ARG A 32 0.612 -6.555 -6.169 1.00 0.00 N ATOM 433 CA ARG A 32 0.776 -6.255 -7.587 1.00 0.00 C ATOM 434 C ARG A 32 -0.350 -6.878 -8.409 1.00 0.00 C ATOM 435 O ARG A 32 -0.987 -6.205 -9.218 1.00 0.00 O ATOM 436 CB ARG A 32 2.128 -6.766 -8.085 1.00 0.00 C ATOM 437 CG ARG A 32 2.843 -5.795 -9.011 1.00 0.00 C ATOM 438 CD ARG A 32 2.152 -5.704 -10.363 1.00 0.00 C ATOM 439 NE ARG A 32 2.859 -4.812 -11.279 1.00 0.00 N ATOM 440 CZ ARG A 32 4.042 -5.094 -11.812 1.00 0.00 C ATOM 441 NH1 ARG A 32 4.648 -6.237 -11.522 1.00 0.00 N ATOM 442 NH2 ARG A 32 4.622 -4.233 -12.638 1.00 0.00 N ATOM 0 H ARG A 32 1.457 -6.896 -5.710 1.00 0.00 H new ATOM 0 HA ARG A 32 0.737 -5.173 -7.710 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.767 -6.974 -7.227 1.00 0.00 H new ATOM 0 HB3 ARG A 32 1.980 -7.711 -8.608 1.00 0.00 H new ATOM 0 HG2 ARG A 32 2.875 -4.808 -8.550 1.00 0.00 H new ATOM 0 HG3 ARG A 32 3.875 -6.116 -9.150 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.086 -6.699 -10.804 1.00 0.00 H new ATOM 0 HD3 ARG A 32 1.131 -5.348 -10.225 1.00 0.00 H new ATOM 0 HE ARG A 32 2.420 -3.924 -11.522 1.00 0.00 H new ATOM 0 HH11 ARG A 32 4.205 -6.902 -10.888 1.00 0.00 H new ATOM 0 HH12 ARG A 32 5.557 -6.451 -11.933 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.159 -3.353 -12.865 1.00 0.00 H new ATOM 0 HH22 ARG A 32 5.531 -4.451 -13.046 1.00 0.00 H new ATOM 456 N THR A 33 -0.587 -8.168 -8.193 1.00 0.00 N ATOM 457 CA THR A 33 -1.633 -8.883 -8.915 1.00 0.00 C ATOM 458 C THR A 33 -2.877 -8.018 -9.078 1.00 0.00 C ATOM 459 O THR A 33 -3.516 -8.025 -10.131 1.00 0.00 O ATOM 460 CB THR A 33 -2.020 -10.188 -8.195 1.00 0.00 C ATOM 461 OG1 THR A 33 -1.023 -11.189 -8.424 1.00 0.00 O ATOM 462 CG2 THR A 33 -3.373 -10.692 -8.678 1.00 0.00 C ATOM 0 H THR A 33 -0.069 -8.739 -7.525 1.00 0.00 H new ATOM 0 HA THR A 33 -1.230 -9.125 -9.899 1.00 0.00 H new ATOM 0 HB THR A 33 -2.087 -9.981 -7.127 1.00 0.00 H new ATOM 0 HG1 THR A 33 -0.186 -10.923 -7.989 1.00 0.00 H new ATOM 0 HG21 THR A 33 -3.625 -11.615 -8.155 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.135 -9.940 -8.475 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.329 -10.883 -9.750 1.00 0.00 H new ATOM 470 N TYR A 34 -3.216 -7.272 -8.032 1.00 0.00 N ATOM 471 CA TYR A 34 -4.386 -6.402 -8.060 1.00 0.00 C ATOM 472 C TYR A 34 -4.159 -5.214 -8.990 1.00 0.00 C ATOM 473 O TYR A 34 -4.753 -5.130 -10.065 1.00 0.00 O ATOM 474 CB TYR A 34 -4.711 -5.906 -6.650 1.00 0.00 C ATOM 475 CG TYR A 34 -4.656 -6.991 -5.598 1.00 0.00 C ATOM 476 CD1 TYR A 34 -5.318 -8.198 -5.783 1.00 0.00 C ATOM 477 CD2 TYR A 34 -3.944 -6.808 -4.420 1.00 0.00 C ATOM 478 CE1 TYR A 34 -5.272 -9.192 -4.824 1.00 0.00 C ATOM 479 CE2 TYR A 34 -3.890 -7.797 -3.457 1.00 0.00 C ATOM 480 CZ TYR A 34 -4.556 -8.987 -3.664 1.00 0.00 C ATOM 481 OH TYR A 34 -4.506 -9.974 -2.706 1.00 0.00 O ATOM 0 H TYR A 34 -2.697 -7.252 -7.154 1.00 0.00 H new ATOM 0 HA TYR A 34 -5.229 -6.980 -8.438 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.010 -5.116 -6.382 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -5.707 -5.462 -6.651 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -5.878 -8.362 -6.692 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -3.423 -5.876 -4.254 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -5.794 -10.124 -4.982 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.330 -7.639 -2.547 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.959 -9.670 -1.952 1.00 0.00 H new ATOM 491 N ASP A 35 -3.294 -4.298 -8.568 1.00 0.00 N ATOM 492 CA ASP A 35 -2.986 -3.114 -9.362 1.00 0.00 C ATOM 493 C ASP A 35 -1.585 -3.208 -9.957 1.00 0.00 C ATOM 494 O ASP A 35 -0.688 -3.811 -9.368 1.00 0.00 O ATOM 495 CB ASP A 35 -3.106 -1.853 -8.505 1.00 0.00 C ATOM 496 CG ASP A 35 -3.637 -0.669 -9.289 1.00 0.00 C ATOM 497 OD1 ASP A 35 -4.847 -0.657 -9.599 1.00 0.00 O ATOM 498 OD2 ASP A 35 -2.842 0.246 -9.594 1.00 0.00 O ATOM 0 H ASP A 35 -2.794 -4.353 -7.681 1.00 0.00 H new ATOM 0 HA ASP A 35 -3.705 -3.058 -10.179 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.767 -2.052 -7.661 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.129 -1.603 -8.092 1.00 0.00 H new ATOM 503 N LYS A 36 -1.403 -2.609 -11.129 1.00 0.00 N ATOM 504 CA LYS A 36 -0.111 -2.625 -11.805 1.00 0.00 C ATOM 505 C LYS A 36 0.698 -1.378 -11.462 1.00 0.00 C ATOM 506 O LYS A 36 1.928 -1.397 -11.489 1.00 0.00 O ATOM 507 CB LYS A 36 -0.306 -2.719 -13.320 1.00 0.00 C ATOM 508 CG LYS A 36 -0.982 -4.002 -13.768 1.00 0.00 C ATOM 509 CD LYS A 36 -0.089 -4.808 -14.696 1.00 0.00 C ATOM 510 CE LYS A 36 -0.904 -5.721 -15.599 1.00 0.00 C ATOM 511 NZ LYS A 36 -1.472 -4.985 -16.763 1.00 0.00 N ATOM 0 H LYS A 36 -2.135 -2.106 -11.631 1.00 0.00 H new ATOM 0 HA LYS A 36 0.440 -3.500 -11.461 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.901 -1.869 -13.655 1.00 0.00 H new ATOM 0 HB3 LYS A 36 0.665 -2.640 -13.808 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.238 -4.603 -12.896 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.916 -3.764 -14.277 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.509 -4.131 -15.306 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.607 -5.405 -14.106 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.274 -6.535 -15.956 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.713 -6.172 -15.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.021 -5.641 -17.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.093 -4.224 -16.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.699 -4.576 -17.326 1.00 0.00 H new ATOM 525 N ASP A 37 -0.001 -0.296 -11.137 1.00 0.00 N ATOM 526 CA ASP A 37 0.651 0.960 -10.785 1.00 0.00 C ATOM 527 C ASP A 37 0.904 1.038 -9.282 1.00 0.00 C ATOM 528 O ASP A 37 1.228 2.102 -8.751 1.00 0.00 O ATOM 529 CB ASP A 37 -0.202 2.146 -11.235 1.00 0.00 C ATOM 530 CG ASP A 37 0.390 2.866 -12.431 1.00 0.00 C ATOM 531 OD1 ASP A 37 1.215 3.781 -12.225 1.00 0.00 O ATOM 532 OD2 ASP A 37 0.030 2.512 -13.573 1.00 0.00 O ATOM 0 H ASP A 37 -1.020 -0.264 -11.110 1.00 0.00 H new ATOM 0 HA ASP A 37 1.611 0.999 -11.299 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.203 1.795 -11.485 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -0.308 2.848 -10.408 1.00 0.00 H new ATOM 537 N THR A 38 0.751 -0.093 -8.602 1.00 0.00 N ATOM 538 CA THR A 38 0.961 -0.151 -7.160 1.00 0.00 C ATOM 539 C THR A 38 2.443 -0.065 -6.816 1.00 0.00 C ATOM 540 O THR A 38 3.241 -0.900 -7.244 1.00 0.00 O ATOM 541 CB THR A 38 0.381 -1.445 -6.560 1.00 0.00 C ATOM 542 OG1 THR A 38 0.289 -2.456 -7.571 1.00 0.00 O ATOM 543 CG2 THR A 38 -0.996 -1.195 -5.961 1.00 0.00 C ATOM 0 H THR A 38 0.483 -0.981 -9.026 1.00 0.00 H new ATOM 0 HA THR A 38 0.441 0.705 -6.730 1.00 0.00 H new ATOM 0 HB THR A 38 1.049 -1.782 -5.768 1.00 0.00 H new ATOM 0 HG1 THR A 38 -0.606 -2.854 -7.555 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.385 -2.124 -5.543 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.919 -0.447 -5.172 1.00 0.00 H new ATOM 0 HG23 THR A 38 -1.671 -0.836 -6.738 1.00 0.00 H new ATOM 551 N THR A 39 2.807 0.950 -6.037 1.00 0.00 N ATOM 552 CA THR A 39 4.195 1.145 -5.636 1.00 0.00 C ATOM 553 C THR A 39 4.504 0.396 -4.344 1.00 0.00 C ATOM 554 O THR A 39 3.647 0.269 -3.468 1.00 0.00 O ATOM 555 CB THR A 39 4.518 2.638 -5.439 1.00 0.00 C ATOM 556 OG1 THR A 39 3.666 3.196 -4.433 1.00 0.00 O ATOM 557 CG2 THR A 39 4.342 3.405 -6.741 1.00 0.00 C ATOM 0 H THR A 39 2.160 1.649 -5.672 1.00 0.00 H new ATOM 0 HA THR A 39 4.815 0.749 -6.440 1.00 0.00 H new ATOM 0 HB THR A 39 5.557 2.723 -5.122 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.212 3.543 -3.697 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.576 4.457 -6.578 1.00 0.00 H new ATOM 0 HG22 THR A 39 5.013 2.997 -7.497 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.311 3.311 -7.082 1.00 0.00 H new ATOM 565 N PHE A 40 5.731 -0.098 -4.232 1.00 0.00 N ATOM 566 CA PHE A 40 6.154 -0.836 -3.046 1.00 0.00 C ATOM 567 C PHE A 40 7.352 -0.162 -2.385 1.00 0.00 C ATOM 568 O PHE A 40 8.329 0.182 -3.050 1.00 0.00 O ATOM 569 CB PHE A 40 6.505 -2.278 -3.416 1.00 0.00 C ATOM 570 CG PHE A 40 5.339 -3.061 -3.947 1.00 0.00 C ATOM 571 CD1 PHE A 40 4.848 -2.822 -5.220 1.00 0.00 C ATOM 572 CD2 PHE A 40 4.733 -4.038 -3.173 1.00 0.00 C ATOM 573 CE1 PHE A 40 3.776 -3.542 -5.713 1.00 0.00 C ATOM 574 CE2 PHE A 40 3.660 -4.761 -3.660 1.00 0.00 C ATOM 575 CZ PHE A 40 3.181 -4.511 -4.930 1.00 0.00 C ATOM 0 H PHE A 40 6.451 -0.001 -4.948 1.00 0.00 H new ATOM 0 HA PHE A 40 5.326 -0.841 -2.337 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.298 -2.270 -4.164 1.00 0.00 H new ATOM 0 HB3 PHE A 40 6.902 -2.784 -2.536 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.309 -2.063 -5.835 1.00 0.00 H new ATOM 0 HD2 PHE A 40 5.103 -4.237 -2.178 1.00 0.00 H new ATOM 0 HE1 PHE A 40 3.405 -3.347 -6.708 1.00 0.00 H new ATOM 0 HE2 PHE A 40 3.197 -5.521 -3.047 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.341 -5.073 -5.311 1.00 0.00 H new ATOM 585 N GLN A 41 7.269 0.024 -1.072 1.00 0.00 N ATOM 586 CA GLN A 41 8.345 0.659 -0.319 1.00 0.00 C ATOM 587 C GLN A 41 8.791 -0.225 0.841 1.00 0.00 C ATOM 588 O GLN A 41 8.066 -0.389 1.822 1.00 0.00 O ATOM 589 CB GLN A 41 7.896 2.023 0.204 1.00 0.00 C ATOM 590 CG GLN A 41 8.417 3.192 -0.615 1.00 0.00 C ATOM 591 CD GLN A 41 7.716 4.495 -0.285 1.00 0.00 C ATOM 592 OE1 GLN A 41 8.303 5.394 0.319 1.00 0.00 O ATOM 593 NE2 GLN A 41 6.452 4.605 -0.681 1.00 0.00 N ATOM 0 H GLN A 41 6.467 -0.256 -0.507 1.00 0.00 H new ATOM 0 HA GLN A 41 9.192 0.799 -0.991 1.00 0.00 H new ATOM 0 HB2 GLN A 41 6.807 2.057 0.217 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.231 2.135 1.235 1.00 0.00 H new ATOM 0 HG2 GLN A 41 9.487 3.305 -0.440 1.00 0.00 H new ATOM 0 HG3 GLN A 41 8.289 2.973 -1.675 1.00 0.00 H new ATOM 0 HE21 GLN A 41 6.005 3.835 -1.179 1.00 0.00 H new ATOM 0 HE22 GLN A 41 5.929 5.459 -0.487 1.00 0.00 H new ATOM 602 N TYR A 42 9.987 -0.789 0.723 1.00 0.00 N ATOM 603 CA TYR A 42 10.529 -1.656 1.762 1.00 0.00 C ATOM 604 C TYR A 42 11.460 -0.881 2.688 1.00 0.00 C ATOM 605 O TYR A 42 12.375 -0.194 2.235 1.00 0.00 O ATOM 606 CB TYR A 42 11.280 -2.832 1.134 1.00 0.00 C ATOM 607 CG TYR A 42 10.377 -3.816 0.423 1.00 0.00 C ATOM 608 CD1 TYR A 42 9.908 -3.558 -0.858 1.00 0.00 C ATOM 609 CD2 TYR A 42 9.995 -5.004 1.034 1.00 0.00 C ATOM 610 CE1 TYR A 42 9.083 -4.454 -1.511 1.00 0.00 C ATOM 611 CE2 TYR A 42 9.171 -5.906 0.389 1.00 0.00 C ATOM 612 CZ TYR A 42 8.718 -5.626 -0.884 1.00 0.00 C ATOM 613 OH TYR A 42 7.897 -6.522 -1.530 1.00 0.00 O ATOM 0 H TYR A 42 10.600 -0.661 -0.082 1.00 0.00 H new ATOM 0 HA TYR A 42 9.695 -2.038 2.351 1.00 0.00 H new ATOM 0 HB2 TYR A 42 12.014 -2.447 0.426 1.00 0.00 H new ATOM 0 HB3 TYR A 42 11.834 -3.357 1.913 1.00 0.00 H new ATOM 0 HD1 TYR A 42 10.193 -2.641 -1.353 1.00 0.00 H new ATOM 0 HD2 TYR A 42 10.348 -5.226 2.030 1.00 0.00 H new ATOM 0 HE1 TYR A 42 8.726 -4.237 -2.507 1.00 0.00 H new ATOM 0 HE2 TYR A 42 8.883 -6.825 0.878 1.00 0.00 H new ATOM 0 HH TYR A 42 7.147 -6.759 -0.945 1.00 0.00 H new ATOM 623 N PHE A 43 11.220 -0.998 3.991 1.00 0.00 N ATOM 624 CA PHE A 43 12.036 -0.309 4.983 1.00 0.00 C ATOM 625 C PHE A 43 12.856 -1.304 5.800 1.00 0.00 C ATOM 626 O PHE A 43 12.354 -1.911 6.745 1.00 0.00 O ATOM 627 CB PHE A 43 11.151 0.524 5.913 1.00 0.00 C ATOM 628 CG PHE A 43 10.276 1.505 5.187 1.00 0.00 C ATOM 629 CD1 PHE A 43 10.800 2.687 4.691 1.00 0.00 C ATOM 630 CD2 PHE A 43 8.927 1.245 5.001 1.00 0.00 C ATOM 631 CE1 PHE A 43 9.998 3.592 4.022 1.00 0.00 C ATOM 632 CE2 PHE A 43 8.120 2.145 4.332 1.00 0.00 C ATOM 633 CZ PHE A 43 8.655 3.321 3.844 1.00 0.00 C ATOM 0 H PHE A 43 10.467 -1.563 4.383 1.00 0.00 H new ATOM 0 HA PHE A 43 12.722 0.353 4.455 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.523 -0.146 6.500 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.784 1.065 6.616 1.00 0.00 H new ATOM 0 HD1 PHE A 43 11.849 2.904 4.829 1.00 0.00 H new ATOM 0 HD2 PHE A 43 8.502 0.329 5.383 1.00 0.00 H new ATOM 0 HE1 PHE A 43 10.420 4.509 3.639 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.071 1.929 4.191 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.025 4.027 3.324 1.00 0.00 H new ATOM 643 N LYS A 44 14.121 -1.466 5.427 1.00 0.00 N ATOM 644 CA LYS A 44 15.013 -2.386 6.123 1.00 0.00 C ATOM 645 C LYS A 44 15.157 -1.996 7.591 1.00 0.00 C ATOM 646 O LYS A 44 15.251 -2.859 8.464 1.00 0.00 O ATOM 647 CB LYS A 44 16.387 -2.403 5.450 1.00 0.00 C ATOM 648 CG LYS A 44 17.119 -3.725 5.597 1.00 0.00 C ATOM 649 CD LYS A 44 18.068 -3.970 4.435 1.00 0.00 C ATOM 650 CE LYS A 44 19.473 -3.481 4.750 1.00 0.00 C ATOM 651 NZ LYS A 44 19.547 -1.994 4.792 1.00 0.00 N ATOM 0 H LYS A 44 14.552 -0.972 4.646 1.00 0.00 H new ATOM 0 HA LYS A 44 14.579 -3.384 6.072 1.00 0.00 H new ATOM 0 HB2 LYS A 44 16.266 -2.180 4.390 1.00 0.00 H new ATOM 0 HB3 LYS A 44 17.000 -1.608 5.875 1.00 0.00 H new ATOM 0 HG2 LYS A 44 17.679 -3.730 6.532 1.00 0.00 H new ATOM 0 HG3 LYS A 44 16.395 -4.538 5.654 1.00 0.00 H new ATOM 0 HD2 LYS A 44 18.095 -5.035 4.205 1.00 0.00 H new ATOM 0 HD3 LYS A 44 17.695 -3.461 3.546 1.00 0.00 H new ATOM 0 HE2 LYS A 44 19.792 -3.888 5.710 1.00 0.00 H new ATOM 0 HE3 LYS A 44 20.166 -3.858 3.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.539 -1.693 4.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 18.993 -1.597 4.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 19.161 -1.653 5.695 1.00 0.00 H new ATOM 665 N SER A 45 15.174 -0.694 7.855 1.00 0.00 N ATOM 666 CA SER A 45 15.310 -0.192 9.216 1.00 0.00 C ATOM 667 C SER A 45 14.010 -0.370 9.994 1.00 0.00 C ATOM 668 O SER A 45 13.998 -0.943 11.083 1.00 0.00 O ATOM 669 CB SER A 45 15.710 1.285 9.201 1.00 0.00 C ATOM 670 OG SER A 45 16.966 1.467 8.570 1.00 0.00 O ATOM 0 H SER A 45 15.095 0.033 7.144 1.00 0.00 H new ATOM 0 HA SER A 45 16.092 -0.768 9.712 1.00 0.00 H new ATOM 0 HB2 SER A 45 14.950 1.866 8.679 1.00 0.00 H new ATOM 0 HB3 SER A 45 15.754 1.663 10.222 1.00 0.00 H new ATOM 0 HG SER A 45 17.198 2.419 8.572 1.00 0.00 H new ATOM 676 N PHE A 46 12.916 0.126 9.425 1.00 0.00 N ATOM 677 CA PHE A 46 11.609 0.023 10.064 1.00 0.00 C ATOM 678 C PHE A 46 10.993 -1.352 9.825 1.00 0.00 C ATOM 679 O PHE A 46 9.888 -1.641 10.286 1.00 0.00 O ATOM 680 CB PHE A 46 10.672 1.111 9.535 1.00 0.00 C ATOM 681 CG PHE A 46 11.064 2.498 9.960 1.00 0.00 C ATOM 682 CD1 PHE A 46 11.376 2.769 11.283 1.00 0.00 C ATOM 683 CD2 PHE A 46 11.122 3.530 9.037 1.00 0.00 C ATOM 684 CE1 PHE A 46 11.737 4.044 11.676 1.00 0.00 C ATOM 685 CE2 PHE A 46 11.482 4.806 9.425 1.00 0.00 C ATOM 686 CZ PHE A 46 11.791 5.063 10.746 1.00 0.00 C ATOM 0 H PHE A 46 12.909 0.603 8.523 1.00 0.00 H new ATOM 0 HA PHE A 46 11.746 0.160 11.137 1.00 0.00 H new ATOM 0 HB2 PHE A 46 10.653 1.065 8.446 1.00 0.00 H new ATOM 0 HB3 PHE A 46 9.659 0.906 9.881 1.00 0.00 H new ATOM 0 HD1 PHE A 46 11.337 1.975 12.015 1.00 0.00 H new ATOM 0 HD2 PHE A 46 10.883 3.334 8.002 1.00 0.00 H new ATOM 0 HE1 PHE A 46 11.977 4.243 12.710 1.00 0.00 H new ATOM 0 HE2 PHE A 46 11.522 5.602 8.696 1.00 0.00 H new ATOM 0 HZ PHE A 46 12.074 6.059 11.051 1.00 0.00 H new ATOM 696 N LYS A 47 11.716 -2.200 9.101 1.00 0.00 N ATOM 697 CA LYS A 47 11.245 -3.546 8.799 1.00 0.00 C ATOM 698 C LYS A 47 9.768 -3.532 8.414 1.00 0.00 C ATOM 699 O LYS A 47 9.006 -4.414 8.809 1.00 0.00 O ATOM 700 CB LYS A 47 11.460 -4.465 10.004 1.00 0.00 C ATOM 701 CG LYS A 47 12.908 -4.554 10.451 1.00 0.00 C ATOM 702 CD LYS A 47 13.611 -5.750 9.831 1.00 0.00 C ATOM 703 CE LYS A 47 14.646 -6.339 10.776 1.00 0.00 C ATOM 704 NZ LYS A 47 14.122 -7.529 11.503 1.00 0.00 N ATOM 0 H LYS A 47 12.632 -1.978 8.712 1.00 0.00 H new ATOM 0 HA LYS A 47 11.819 -3.924 7.953 1.00 0.00 H new ATOM 0 HB2 LYS A 47 10.853 -4.107 10.836 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.103 -5.465 9.756 1.00 0.00 H new ATOM 0 HG2 LYS A 47 13.432 -3.639 10.174 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.950 -4.629 11.538 1.00 0.00 H new ATOM 0 HD2 LYS A 47 12.876 -6.513 9.574 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.095 -5.448 8.902 1.00 0.00 H new ATOM 0 HE2 LYS A 47 15.534 -6.621 10.211 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.954 -5.580 11.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 14.852 -7.890 12.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.279 -7.259 12.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 13.868 -8.270 10.819 1.00 0.00 H new ATOM 718 N ARG A 48 9.374 -2.527 7.640 1.00 0.00 N ATOM 719 CA ARG A 48 7.989 -2.399 7.202 1.00 0.00 C ATOM 720 C ARG A 48 7.901 -2.379 5.678 1.00 0.00 C ATOM 721 O ARG A 48 8.920 -2.391 4.987 1.00 0.00 O ATOM 722 CB ARG A 48 7.366 -1.125 7.776 1.00 0.00 C ATOM 723 CG ARG A 48 6.865 -1.283 9.202 1.00 0.00 C ATOM 724 CD ARG A 48 6.142 -0.032 9.679 1.00 0.00 C ATOM 725 NE ARG A 48 6.974 0.775 10.568 1.00 0.00 N ATOM 726 CZ ARG A 48 6.505 1.773 11.309 1.00 0.00 C ATOM 727 NH1 ARG A 48 5.217 2.084 11.267 1.00 0.00 N ATOM 728 NH2 ARG A 48 7.323 2.461 12.093 1.00 0.00 N ATOM 0 H ARG A 48 9.993 -1.790 7.303 1.00 0.00 H new ATOM 0 HA ARG A 48 7.436 -3.263 7.570 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.104 -0.324 7.746 1.00 0.00 H new ATOM 0 HB3 ARG A 48 6.536 -0.818 7.140 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.192 -2.138 9.260 1.00 0.00 H new ATOM 0 HG3 ARG A 48 7.706 -1.494 9.863 1.00 0.00 H new ATOM 0 HD2 ARG A 48 5.846 0.566 8.817 1.00 0.00 H new ATOM 0 HD3 ARG A 48 5.227 -0.318 10.198 1.00 0.00 H new ATOM 0 HE ARG A 48 7.970 0.561 10.623 1.00 0.00 H new ATOM 0 HH11 ARG A 48 4.584 1.557 10.665 1.00 0.00 H new ATOM 0 HH12 ARG A 48 4.859 2.851 11.837 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.315 2.225 12.128 1.00 0.00 H new ATOM 0 HH22 ARG A 48 6.961 3.227 12.661 1.00 0.00 H new ATOM 742 N VAL A 49 6.676 -2.349 5.161 1.00 0.00 N ATOM 743 CA VAL A 49 6.455 -2.327 3.721 1.00 0.00 C ATOM 744 C VAL A 49 5.241 -1.477 3.364 1.00 0.00 C ATOM 745 O VAL A 49 4.100 -1.888 3.574 1.00 0.00 O ATOM 746 CB VAL A 49 6.255 -3.747 3.162 1.00 0.00 C ATOM 747 CG1 VAL A 49 6.301 -3.735 1.641 1.00 0.00 C ATOM 748 CG2 VAL A 49 7.304 -4.695 3.726 1.00 0.00 C ATOM 0 H VAL A 49 5.822 -2.339 5.719 1.00 0.00 H new ATOM 0 HA VAL A 49 7.346 -1.890 3.271 1.00 0.00 H new ATOM 0 HB VAL A 49 5.272 -4.103 3.470 1.00 0.00 H new ATOM 0 HG11 VAL A 49 6.158 -4.748 1.265 1.00 0.00 H new ATOM 0 HG12 VAL A 49 5.510 -3.090 1.258 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.268 -3.358 1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 49 7.147 -5.694 3.320 1.00 0.00 H new ATOM 0 HG22 VAL A 49 8.298 -4.343 3.450 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.219 -4.727 4.812 1.00 0.00 H new ATOM 758 N ARG A 50 5.495 -0.288 2.825 1.00 0.00 N ATOM 759 CA ARG A 50 4.422 0.620 2.439 1.00 0.00 C ATOM 760 C ARG A 50 4.041 0.422 0.975 1.00 0.00 C ATOM 761 O ARG A 50 4.848 0.659 0.076 1.00 0.00 O ATOM 762 CB ARG A 50 4.846 2.071 2.675 1.00 0.00 C ATOM 763 CG ARG A 50 4.027 3.080 1.886 1.00 0.00 C ATOM 764 CD ARG A 50 3.560 4.229 2.767 1.00 0.00 C ATOM 765 NE ARG A 50 3.636 5.514 2.077 1.00 0.00 N ATOM 766 CZ ARG A 50 4.778 6.141 1.818 1.00 0.00 C ATOM 767 NH1 ARG A 50 5.932 5.604 2.188 1.00 0.00 N ATOM 768 NH2 ARG A 50 4.766 7.308 1.187 1.00 0.00 N ATOM 0 H ARG A 50 6.434 0.068 2.646 1.00 0.00 H new ATOM 0 HA ARG A 50 3.551 0.397 3.055 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.760 2.298 3.738 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.897 2.181 2.409 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.625 3.471 1.063 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.163 2.584 1.445 1.00 0.00 H new ATOM 0 HD2 ARG A 50 2.533 4.048 3.084 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.171 4.265 3.669 1.00 0.00 H new ATOM 0 HE ARG A 50 2.765 5.954 1.778 1.00 0.00 H new ATOM 0 HH11 ARG A 50 5.945 4.707 2.673 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.807 6.088 1.988 1.00 0.00 H new ATOM 0 HH21 ARG A 50 3.880 7.724 0.901 1.00 0.00 H new ATOM 0 HH22 ARG A 50 5.643 7.789 0.988 1.00 0.00 H new ATOM 782 N ILE A 51 2.807 -0.014 0.744 1.00 0.00 N ATOM 783 CA ILE A 51 2.319 -0.244 -0.610 1.00 0.00 C ATOM 784 C ILE A 51 1.275 0.795 -1.002 1.00 0.00 C ATOM 785 O ILE A 51 0.228 0.910 -0.365 1.00 0.00 O ATOM 786 CB ILE A 51 1.708 -1.650 -0.757 1.00 0.00 C ATOM 787 CG1 ILE A 51 2.746 -2.720 -0.411 1.00 0.00 C ATOM 788 CG2 ILE A 51 1.181 -1.853 -2.170 1.00 0.00 C ATOM 789 CD1 ILE A 51 2.286 -3.684 0.659 1.00 0.00 C ATOM 0 H ILE A 51 2.127 -0.215 1.477 1.00 0.00 H new ATOM 0 HA ILE A 51 3.179 -0.159 -1.274 1.00 0.00 H new ATOM 0 HB ILE A 51 0.874 -1.742 -0.062 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.992 -3.281 -1.313 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.662 -2.232 -0.079 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.752 -2.851 -2.259 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.414 -1.108 -2.383 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.999 -1.745 -2.882 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.072 -4.414 0.853 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.067 -3.134 1.574 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.387 -4.200 0.322 1.00 0.00 H new ATOM 801 N ASN A 52 1.565 1.551 -2.057 1.00 0.00 N ATOM 802 CA ASN A 52 0.650 2.580 -2.534 1.00 0.00 C ATOM 803 C ASN A 52 -0.145 2.085 -3.739 1.00 0.00 C ATOM 804 O ASN A 52 0.419 1.536 -4.684 1.00 0.00 O ATOM 805 CB ASN A 52 1.424 3.846 -2.906 1.00 0.00 C ATOM 806 CG ASN A 52 0.754 5.107 -2.391 1.00 0.00 C ATOM 807 OD1 ASN A 52 -0.429 5.098 -2.052 1.00 0.00 O ATOM 808 ND2 ASN A 52 1.510 6.196 -2.329 1.00 0.00 N ATOM 0 H ASN A 52 2.427 1.469 -2.597 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.049 2.811 -1.730 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.434 3.783 -2.501 1.00 0.00 H new ATOM 0 HB3 ASN A 52 1.519 3.905 -3.990 1.00 0.00 H new ATOM 0 HD21 ASN A 52 1.115 7.073 -1.989 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.487 6.156 -2.621 1.00 0.00 H new ATOM 815 N PHE A 53 -1.458 2.284 -3.696 1.00 0.00 N ATOM 816 CA PHE A 53 -2.332 1.858 -4.783 1.00 0.00 C ATOM 817 C PHE A 53 -2.842 3.060 -5.574 1.00 0.00 C ATOM 818 O PHE A 53 -2.621 4.207 -5.190 1.00 0.00 O ATOM 819 CB PHE A 53 -3.513 1.056 -4.233 1.00 0.00 C ATOM 820 CG PHE A 53 -3.100 -0.153 -3.443 1.00 0.00 C ATOM 821 CD1 PHE A 53 -2.342 -0.018 -2.291 1.00 0.00 C ATOM 822 CD2 PHE A 53 -3.470 -1.424 -3.852 1.00 0.00 C ATOM 823 CE1 PHE A 53 -1.960 -1.129 -1.562 1.00 0.00 C ATOM 824 CE2 PHE A 53 -3.092 -2.538 -3.129 1.00 0.00 C ATOM 825 CZ PHE A 53 -2.336 -2.391 -1.982 1.00 0.00 C ATOM 0 H PHE A 53 -1.940 2.738 -2.920 1.00 0.00 H new ATOM 0 HA PHE A 53 -1.753 1.223 -5.454 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -4.119 1.704 -3.600 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -4.145 0.740 -5.063 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -2.046 0.966 -1.959 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -4.061 -1.545 -4.748 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -1.369 -1.011 -0.666 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -3.387 -3.523 -3.460 1.00 0.00 H new ATOM 0 HZ PHE A 53 -2.039 -3.261 -1.415 1.00 0.00 H new ATOM 835 N SER A 54 -3.525 2.785 -6.680 1.00 0.00 N ATOM 836 CA SER A 54 -4.065 3.842 -7.528 1.00 0.00 C ATOM 837 C SER A 54 -5.496 4.185 -7.126 1.00 0.00 C ATOM 838 O SER A 54 -6.016 5.241 -7.482 1.00 0.00 O ATOM 839 CB SER A 54 -4.023 3.418 -8.997 1.00 0.00 C ATOM 840 OG SER A 54 -5.142 2.612 -9.326 1.00 0.00 O ATOM 0 H SER A 54 -3.718 1.839 -7.010 1.00 0.00 H new ATOM 0 HA SER A 54 -3.447 4.730 -7.396 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.008 4.302 -9.634 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.103 2.867 -9.194 1.00 0.00 H new ATOM 0 HG SER A 54 -5.094 2.355 -10.270 1.00 0.00 H new ATOM 846 N ASN A 55 -6.126 3.283 -6.380 1.00 0.00 N ATOM 847 CA ASN A 55 -7.497 3.488 -5.929 1.00 0.00 C ATOM 848 C ASN A 55 -7.702 2.913 -4.531 1.00 0.00 C ATOM 849 O ASN A 55 -7.137 1.880 -4.169 1.00 0.00 O ATOM 850 CB ASN A 55 -8.481 2.842 -6.908 1.00 0.00 C ATOM 851 CG ASN A 55 -8.016 2.949 -8.347 1.00 0.00 C ATOM 852 OD1 ASN A 55 -7.878 4.047 -8.887 1.00 0.00 O ATOM 853 ND2 ASN A 55 -7.775 1.805 -8.977 1.00 0.00 N ATOM 0 H ASN A 55 -5.709 2.404 -6.075 1.00 0.00 H new ATOM 0 HA ASN A 55 -7.684 4.561 -5.892 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -8.612 1.792 -6.648 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -9.456 3.319 -6.807 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -7.462 1.813 -9.948 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -7.903 0.918 -8.490 1.00 0.00 H new ATOM 860 N PRO A 56 -8.530 3.595 -3.725 1.00 0.00 N ATOM 861 CA PRO A 56 -8.830 3.168 -2.356 1.00 0.00 C ATOM 862 C PRO A 56 -9.675 1.900 -2.314 1.00 0.00 C ATOM 863 O PRO A 56 -10.026 1.411 -1.239 1.00 0.00 O ATOM 864 CB PRO A 56 -9.611 4.352 -1.780 1.00 0.00 C ATOM 865 CG PRO A 56 -10.217 5.020 -2.966 1.00 0.00 C ATOM 866 CD PRO A 56 -9.238 4.833 -4.090 1.00 0.00 C ATOM 0 HA PRO A 56 -7.926 2.923 -1.798 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.377 4.018 -1.080 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -8.955 5.031 -1.235 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.183 4.578 -3.212 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.391 6.078 -2.772 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -9.743 4.738 -5.051 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -8.554 5.678 -4.172 1.00 0.00 H new ATOM 874 N LEU A 57 -10.000 1.374 -3.489 1.00 0.00 N ATOM 875 CA LEU A 57 -10.806 0.161 -3.586 1.00 0.00 C ATOM 876 C LEU A 57 -9.945 -1.082 -3.381 1.00 0.00 C ATOM 877 O LEU A 57 -10.143 -1.834 -2.426 1.00 0.00 O ATOM 878 CB LEU A 57 -11.500 0.095 -4.948 1.00 0.00 C ATOM 879 CG LEU A 57 -12.694 1.030 -5.139 1.00 0.00 C ATOM 880 CD1 LEU A 57 -12.745 1.545 -6.570 1.00 0.00 C ATOM 881 CD2 LEU A 57 -13.991 0.321 -4.778 1.00 0.00 C ATOM 0 H LEU A 57 -9.719 1.767 -4.387 1.00 0.00 H new ATOM 0 HA LEU A 57 -11.561 0.191 -2.801 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -10.763 0.317 -5.720 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -11.836 -0.929 -5.113 1.00 0.00 H new ATOM 0 HG LEU A 57 -12.573 1.883 -4.472 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -13.601 2.209 -6.687 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -11.829 2.092 -6.793 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.842 0.704 -7.256 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -14.830 1.002 -4.920 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -14.119 -0.551 -5.419 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -13.954 0.003 -3.736 1.00 0.00 H new ATOM 893 N SER A 58 -8.990 -1.290 -4.281 1.00 0.00 N ATOM 894 CA SER A 58 -8.100 -2.443 -4.199 1.00 0.00 C ATOM 895 C SER A 58 -7.484 -2.555 -2.808 1.00 0.00 C ATOM 896 O SER A 58 -7.473 -3.629 -2.207 1.00 0.00 O ATOM 897 CB SER A 58 -6.995 -2.337 -5.252 1.00 0.00 C ATOM 898 OG SER A 58 -6.796 -3.576 -5.909 1.00 0.00 O ATOM 0 H SER A 58 -8.812 -0.676 -5.076 1.00 0.00 H new ATOM 0 HA SER A 58 -8.689 -3.340 -4.390 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.257 -1.572 -5.983 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.066 -2.020 -4.778 1.00 0.00 H new ATOM 0 HG SER A 58 -6.490 -3.415 -6.826 1.00 0.00 H new ATOM 904 N ALA A 59 -6.972 -1.438 -2.303 1.00 0.00 N ATOM 905 CA ALA A 59 -6.355 -1.409 -0.982 1.00 0.00 C ATOM 906 C ALA A 59 -7.134 -2.270 0.006 1.00 0.00 C ATOM 907 O ALA A 59 -6.554 -2.884 0.901 1.00 0.00 O ATOM 908 CB ALA A 59 -6.257 0.022 -0.476 1.00 0.00 C ATOM 0 H ALA A 59 -6.972 -0.541 -2.788 1.00 0.00 H new ATOM 0 HA ALA A 59 -5.350 -1.821 -1.069 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -5.795 0.028 0.511 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.651 0.611 -1.164 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -7.256 0.454 -0.411 1.00 0.00 H new ATOM 914 N ALA A 60 -8.452 -2.308 -0.161 1.00 0.00 N ATOM 915 CA ALA A 60 -9.311 -3.095 0.717 1.00 0.00 C ATOM 916 C ALA A 60 -9.149 -4.587 0.449 1.00 0.00 C ATOM 917 O ALA A 60 -8.787 -5.352 1.344 1.00 0.00 O ATOM 918 CB ALA A 60 -10.764 -2.680 0.543 1.00 0.00 C ATOM 0 H ALA A 60 -8.948 -1.804 -0.896 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.011 -2.903 1.747 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -11.394 -3.275 1.204 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.873 -1.624 0.791 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.068 -2.843 -0.491 1.00 0.00 H new ATOM 924 N ASP A 61 -9.419 -4.995 -0.786 1.00 0.00 N ATOM 925 CA ASP A 61 -9.303 -6.397 -1.171 1.00 0.00 C ATOM 926 C ASP A 61 -7.930 -6.950 -0.802 1.00 0.00 C ATOM 927 O ASP A 61 -7.783 -8.140 -0.526 1.00 0.00 O ATOM 928 CB ASP A 61 -9.544 -6.557 -2.673 1.00 0.00 C ATOM 929 CG ASP A 61 -10.756 -7.415 -2.977 1.00 0.00 C ATOM 930 OD1 ASP A 61 -11.746 -7.333 -2.220 1.00 0.00 O ATOM 931 OD2 ASP A 61 -10.714 -8.168 -3.972 1.00 0.00 O ATOM 0 H ASP A 61 -9.720 -4.375 -1.538 1.00 0.00 H new ATOM 0 HA ASP A 61 -10.060 -6.962 -0.627 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -9.677 -5.573 -3.123 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -8.662 -7.002 -3.134 1.00 0.00 H new ATOM 936 N ALA A 62 -6.927 -6.078 -0.801 1.00 0.00 N ATOM 937 CA ALA A 62 -5.567 -6.478 -0.465 1.00 0.00 C ATOM 938 C ALA A 62 -5.446 -6.827 1.015 1.00 0.00 C ATOM 939 O ALA A 62 -4.595 -7.625 1.407 1.00 0.00 O ATOM 940 CB ALA A 62 -4.585 -5.375 -0.832 1.00 0.00 C ATOM 0 H ALA A 62 -7.031 -5.089 -1.029 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.325 -7.370 -1.042 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -3.573 -5.688 -0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.643 -5.178 -1.902 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -4.835 -4.468 -0.282 1.00 0.00 H new ATOM 946 N ARG A 63 -6.302 -6.221 1.831 1.00 0.00 N ATOM 947 CA ARG A 63 -6.290 -6.466 3.268 1.00 0.00 C ATOM 948 C ARG A 63 -6.947 -7.803 3.598 1.00 0.00 C ATOM 949 O ARG A 63 -6.391 -8.614 4.340 1.00 0.00 O ATOM 950 CB ARG A 63 -7.011 -5.336 4.005 1.00 0.00 C ATOM 951 CG ARG A 63 -6.934 -5.450 5.520 1.00 0.00 C ATOM 952 CD ARG A 63 -7.780 -4.387 6.202 1.00 0.00 C ATOM 953 NE ARG A 63 -9.128 -4.865 6.496 1.00 0.00 N ATOM 954 CZ ARG A 63 -9.895 -4.358 7.457 1.00 0.00 C ATOM 955 NH1 ARG A 63 -9.448 -3.363 8.210 1.00 0.00 N ATOM 956 NH2 ARG A 63 -11.111 -4.846 7.663 1.00 0.00 N ATOM 0 H ARG A 63 -7.012 -5.557 1.522 1.00 0.00 H new ATOM 0 HA ARG A 63 -5.251 -6.501 3.596 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.582 -4.382 3.699 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -8.058 -5.326 3.703 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.272 -6.439 5.829 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.897 -5.353 5.841 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.295 -4.077 7.128 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.839 -3.506 5.563 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.502 -5.629 5.934 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.514 -2.984 8.053 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.038 -2.976 8.946 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -11.458 -5.611 7.084 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -11.699 -4.457 8.400 1.00 0.00 H new ATOM 970 N LEU A 64 -8.133 -8.027 3.042 1.00 0.00 N ATOM 971 CA LEU A 64 -8.866 -9.266 3.277 1.00 0.00 C ATOM 972 C LEU A 64 -8.089 -10.467 2.749 1.00 0.00 C ATOM 973 O LEU A 64 -8.057 -11.524 3.380 1.00 0.00 O ATOM 974 CB LEU A 64 -10.242 -9.201 2.610 1.00 0.00 C ATOM 975 CG LEU A 64 -10.360 -9.885 1.248 1.00 0.00 C ATOM 976 CD1 LEU A 64 -10.548 -11.385 1.418 1.00 0.00 C ATOM 977 CD2 LEU A 64 -11.510 -9.289 0.450 1.00 0.00 C ATOM 0 H LEU A 64 -8.607 -7.367 2.426 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.995 -9.385 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -10.972 -9.649 3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -10.518 -8.153 2.493 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.435 -9.716 0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.630 -11.855 0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.692 -11.801 1.949 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.457 -11.575 1.989 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -11.579 -9.788 -0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -12.443 -9.427 0.997 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -11.333 -8.224 0.297 1.00 0.00 H new ATOM 989 N ARG A 65 -7.460 -10.297 1.590 1.00 0.00 N ATOM 990 CA ARG A 65 -6.682 -11.367 0.979 1.00 0.00 C ATOM 991 C ARG A 65 -5.358 -11.562 1.711 1.00 0.00 C ATOM 992 O ARG A 65 -4.748 -12.631 1.640 1.00 0.00 O ATOM 993 CB ARG A 65 -6.422 -11.058 -0.497 1.00 0.00 C ATOM 994 CG ARG A 65 -7.482 -11.613 -1.432 1.00 0.00 C ATOM 995 CD ARG A 65 -6.871 -12.506 -2.500 1.00 0.00 C ATOM 996 NE ARG A 65 -7.863 -13.385 -3.113 1.00 0.00 N ATOM 997 CZ ARG A 65 -8.822 -12.956 -3.925 1.00 0.00 C ATOM 998 NH1 ARG A 65 -8.918 -11.668 -4.222 1.00 0.00 N ATOM 999 NH2 ARG A 65 -9.688 -13.817 -4.444 1.00 0.00 N ATOM 0 H ARG A 65 -7.474 -9.428 1.056 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.257 -12.290 1.054 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -6.364 -9.977 -0.628 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.451 -11.466 -0.779 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -8.214 -12.180 -0.858 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -8.017 -10.790 -1.907 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.410 -11.887 -3.270 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.077 -13.108 -2.058 1.00 0.00 H new ATOM 0 HE ARG A 65 -7.817 -14.383 -2.906 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.254 -11.003 -3.826 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -9.656 -11.342 -4.846 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -9.617 -14.809 -4.219 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.424 -13.486 -5.068 1.00 0.00 H new ATOM 1013 N LEU A 66 -4.917 -10.524 2.413 1.00 0.00 N ATOM 1014 CA LEU A 66 -3.665 -10.581 3.158 1.00 0.00 C ATOM 1015 C LEU A 66 -3.904 -10.339 4.645 1.00 0.00 C ATOM 1016 O LEU A 66 -4.957 -10.688 5.181 1.00 0.00 O ATOM 1017 CB LEU A 66 -2.677 -9.546 2.615 1.00 0.00 C ATOM 1018 CG LEU A 66 -2.571 -9.457 1.092 1.00 0.00 C ATOM 1019 CD1 LEU A 66 -1.843 -8.187 0.682 1.00 0.00 C ATOM 1020 CD2 LEU A 66 -1.865 -10.684 0.534 1.00 0.00 C ATOM 0 H LEU A 66 -5.408 -9.633 2.482 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.243 -11.578 3.034 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.961 -8.566 2.998 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.689 -9.771 3.016 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.579 -9.423 0.677 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.777 -8.140 -0.405 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.390 -7.319 1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.839 -8.190 1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.799 -10.604 -0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.862 -10.749 0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.428 -11.579 0.798 1.00 0.00 H new ATOM 1032 N HIS A 67 -2.921 -9.737 5.308 1.00 0.00 N ATOM 1033 CA HIS A 67 -3.026 -9.444 6.733 1.00 0.00 C ATOM 1034 C HIS A 67 -2.648 -10.665 7.566 1.00 0.00 C ATOM 1035 O HIS A 67 -1.793 -11.458 7.174 1.00 0.00 O ATOM 1036 CB HIS A 67 -4.446 -8.995 7.080 1.00 0.00 C ATOM 1037 CG HIS A 67 -4.507 -8.044 8.235 1.00 0.00 C ATOM 1038 ND1 HIS A 67 -3.384 -7.551 8.865 1.00 0.00 N ATOM 1039 CD2 HIS A 67 -5.567 -7.493 8.874 1.00 0.00 C ATOM 1040 CE1 HIS A 67 -3.749 -6.740 9.842 1.00 0.00 C ATOM 1041 NE2 HIS A 67 -5.069 -6.688 9.867 1.00 0.00 N ATOM 0 H HIS A 67 -2.043 -9.443 4.881 1.00 0.00 H new ATOM 0 HA HIS A 67 -2.331 -8.637 6.966 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -4.892 -8.521 6.206 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -5.050 -9.873 7.310 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -6.610 -7.657 8.644 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.083 -6.210 10.506 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -5.628 -6.138 10.519 1.00 0.00 H new ATOM 1049 N LYS A 68 -3.292 -10.810 8.720 1.00 0.00 N ATOM 1050 CA LYS A 68 -3.025 -11.934 9.610 1.00 0.00 C ATOM 1051 C LYS A 68 -2.712 -13.196 8.813 1.00 0.00 C ATOM 1052 O LYS A 68 -1.940 -14.047 9.256 1.00 0.00 O ATOM 1053 CB LYS A 68 -4.225 -12.181 10.526 1.00 0.00 C ATOM 1054 CG LYS A 68 -4.349 -11.171 11.653 1.00 0.00 C ATOM 1055 CD LYS A 68 -5.799 -10.797 11.910 1.00 0.00 C ATOM 1056 CE LYS A 68 -6.035 -9.308 11.708 1.00 0.00 C ATOM 1057 NZ LYS A 68 -6.179 -8.588 13.003 1.00 0.00 N ATOM 0 H LYS A 68 -4.003 -10.163 9.061 1.00 0.00 H new ATOM 0 HA LYS A 68 -2.156 -11.685 10.219 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.137 -12.160 9.929 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.146 -13.181 10.953 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -3.912 -11.584 12.562 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.780 -10.275 11.404 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.446 -11.363 11.240 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.073 -11.075 12.928 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -5.204 -8.882 11.146 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.934 -9.161 11.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.338 -7.576 12.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.988 -8.977 13.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.312 -8.707 13.565 1.00 0.00 H new ATOM 1071 N THR A 69 -3.313 -13.311 7.633 1.00 0.00 N ATOM 1072 CA THR A 69 -3.098 -14.469 6.775 1.00 0.00 C ATOM 1073 C THR A 69 -1.675 -15.000 6.915 1.00 0.00 C ATOM 1074 O THR A 69 -0.709 -14.248 6.796 1.00 0.00 O ATOM 1075 CB THR A 69 -3.363 -14.128 5.296 1.00 0.00 C ATOM 1076 OG1 THR A 69 -2.543 -13.027 4.893 1.00 0.00 O ATOM 1077 CG2 THR A 69 -4.828 -13.786 5.074 1.00 0.00 C ATOM 0 H THR A 69 -3.953 -12.615 7.250 1.00 0.00 H new ATOM 0 HA THR A 69 -3.803 -15.236 7.096 1.00 0.00 H new ATOM 0 HB THR A 69 -3.116 -15.002 4.694 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.216 -12.555 5.687 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.991 -13.549 4.023 1.00 0.00 H new ATOM 0 HG22 THR A 69 -5.447 -14.638 5.354 1.00 0.00 H new ATOM 0 HG23 THR A 69 -5.098 -12.925 5.686 1.00 0.00 H new ATOM 1085 N GLU A 70 -1.556 -16.300 7.167 1.00 0.00 N ATOM 1086 CA GLU A 70 -0.250 -16.930 7.324 1.00 0.00 C ATOM 1087 C GLU A 70 0.558 -16.833 6.034 1.00 0.00 C ATOM 1088 O GLU A 70 0.556 -17.753 5.215 1.00 0.00 O ATOM 1089 CB GLU A 70 -0.413 -18.397 7.728 1.00 0.00 C ATOM 1090 CG GLU A 70 -0.166 -18.653 9.204 1.00 0.00 C ATOM 1091 CD GLU A 70 -0.492 -20.076 9.613 1.00 0.00 C ATOM 1092 OE1 GLU A 70 -0.337 -20.986 8.771 1.00 0.00 O ATOM 1093 OE2 GLU A 70 -0.901 -20.280 10.775 1.00 0.00 O ATOM 0 H GLU A 70 -2.347 -16.937 7.267 1.00 0.00 H new ATOM 0 HA GLU A 70 0.289 -16.402 8.111 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.421 -18.725 7.475 1.00 0.00 H new ATOM 0 HB3 GLU A 70 0.276 -19.005 7.142 1.00 0.00 H new ATOM 0 HG2 GLU A 70 0.878 -18.443 9.435 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -0.768 -17.962 9.794 1.00 0.00 H new ATOM 1100 N PHE A 71 1.250 -15.711 5.858 1.00 0.00 N ATOM 1101 CA PHE A 71 2.062 -15.492 4.667 1.00 0.00 C ATOM 1102 C PHE A 71 3.265 -16.429 4.650 1.00 0.00 C ATOM 1103 O PHE A 71 4.259 -16.196 5.340 1.00 0.00 O ATOM 1104 CB PHE A 71 2.533 -14.037 4.607 1.00 0.00 C ATOM 1105 CG PHE A 71 3.613 -13.799 3.590 1.00 0.00 C ATOM 1106 CD1 PHE A 71 3.293 -13.559 2.263 1.00 0.00 C ATOM 1107 CD2 PHE A 71 4.947 -13.816 3.960 1.00 0.00 C ATOM 1108 CE1 PHE A 71 4.284 -13.339 1.325 1.00 0.00 C ATOM 1109 CE2 PHE A 71 5.943 -13.596 3.027 1.00 0.00 C ATOM 1110 CZ PHE A 71 5.611 -13.359 1.708 1.00 0.00 C ATOM 0 H PHE A 71 1.264 -14.940 6.525 1.00 0.00 H new ATOM 0 HA PHE A 71 1.446 -15.704 3.793 1.00 0.00 H new ATOM 0 HB2 PHE A 71 1.681 -13.397 4.378 1.00 0.00 H new ATOM 0 HB3 PHE A 71 2.899 -13.741 5.590 1.00 0.00 H new ATOM 0 HD1 PHE A 71 2.257 -13.544 1.958 1.00 0.00 H new ATOM 0 HD2 PHE A 71 5.213 -14.003 4.990 1.00 0.00 H new ATOM 0 HE1 PHE A 71 4.021 -13.152 0.294 1.00 0.00 H new ATOM 0 HE2 PHE A 71 6.980 -13.609 3.330 1.00 0.00 H new ATOM 0 HZ PHE A 71 6.388 -13.190 0.977 1.00 0.00 H new ATOM 1120 N LEU A 72 3.170 -17.491 3.858 1.00 0.00 N ATOM 1121 CA LEU A 72 4.250 -18.465 3.750 1.00 0.00 C ATOM 1122 C LEU A 72 4.515 -19.136 5.094 1.00 0.00 C ATOM 1123 O LEU A 72 5.563 -19.746 5.299 1.00 0.00 O ATOM 1124 CB LEU A 72 5.525 -17.789 3.244 1.00 0.00 C ATOM 1125 CG LEU A 72 5.698 -17.732 1.726 1.00 0.00 C ATOM 1126 CD1 LEU A 72 5.724 -16.289 1.245 1.00 0.00 C ATOM 1127 CD2 LEU A 72 6.966 -18.460 1.305 1.00 0.00 C ATOM 0 H LEU A 72 2.355 -17.700 3.281 1.00 0.00 H new ATOM 0 HA LEU A 72 3.945 -19.231 3.037 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.550 -16.770 3.631 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.382 -18.312 3.668 1.00 0.00 H new ATOM 0 HG LEU A 72 4.847 -18.232 1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.848 -16.269 0.162 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.788 -15.799 1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.555 -15.764 1.715 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.072 -18.409 0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.829 -17.990 1.777 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.906 -19.503 1.615 1.00 0.00 H new ATOM 1139 N GLY A 73 3.556 -19.018 6.008 1.00 0.00 N ATOM 1140 CA GLY A 73 3.705 -19.618 7.320 1.00 0.00 C ATOM 1141 C GLY A 73 3.775 -18.585 8.427 1.00 0.00 C ATOM 1142 O GLY A 73 3.386 -18.853 9.564 1.00 0.00 O ATOM 0 H GLY A 73 2.679 -18.518 5.863 1.00 0.00 H new ATOM 0 HA2 GLY A 73 2.866 -20.289 7.506 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.610 -20.226 7.337 1.00 0.00 H new ATOM 1146 N LYS A 74 4.275 -17.399 8.096 1.00 0.00 N ATOM 1147 CA LYS A 74 4.397 -16.320 9.069 1.00 0.00 C ATOM 1148 C LYS A 74 3.216 -15.361 8.969 1.00 0.00 C ATOM 1149 O LYS A 74 2.817 -14.967 7.873 1.00 0.00 O ATOM 1150 CB LYS A 74 5.707 -15.558 8.855 1.00 0.00 C ATOM 1151 CG LYS A 74 6.947 -16.418 9.023 1.00 0.00 C ATOM 1152 CD LYS A 74 7.501 -16.329 10.435 1.00 0.00 C ATOM 1153 CE LYS A 74 8.654 -15.340 10.519 1.00 0.00 C ATOM 1154 NZ LYS A 74 9.125 -15.154 11.919 1.00 0.00 N ATOM 0 H LYS A 74 4.603 -17.161 7.160 1.00 0.00 H new ATOM 0 HA LYS A 74 4.400 -16.762 10.065 1.00 0.00 H new ATOM 0 HB2 LYS A 74 5.707 -15.127 7.854 1.00 0.00 H new ATOM 0 HB3 LYS A 74 5.753 -14.727 9.559 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.706 -17.455 8.791 1.00 0.00 H new ATOM 0 HG3 LYS A 74 7.710 -16.101 8.311 1.00 0.00 H new ATOM 0 HD2 LYS A 74 6.709 -16.025 11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 74 7.840 -17.314 10.757 1.00 0.00 H new ATOM 0 HE2 LYS A 74 9.480 -15.693 9.902 1.00 0.00 H new ATOM 0 HE3 LYS A 74 8.339 -14.379 10.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.911 -14.473 11.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 8.344 -14.793 12.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 9.450 -16.066 12.300 1.00 0.00 H new ATOM 1168 N GLU A 75 2.662 -14.988 10.118 1.00 0.00 N ATOM 1169 CA GLU A 75 1.527 -14.075 10.158 1.00 0.00 C ATOM 1170 C GLU A 75 1.972 -12.642 9.879 1.00 0.00 C ATOM 1171 O GLU A 75 2.771 -12.074 10.622 1.00 0.00 O ATOM 1172 CB GLU A 75 0.832 -14.148 11.519 1.00 0.00 C ATOM 1173 CG GLU A 75 -0.214 -13.066 11.728 1.00 0.00 C ATOM 1174 CD GLU A 75 -0.527 -12.832 13.193 1.00 0.00 C ATOM 1175 OE1 GLU A 75 0.331 -12.259 13.898 1.00 0.00 O ATOM 1176 OE2 GLU A 75 -1.628 -13.222 13.635 1.00 0.00 O ATOM 0 H GLU A 75 2.981 -15.304 11.034 1.00 0.00 H new ATOM 0 HA GLU A 75 0.823 -14.377 9.382 1.00 0.00 H new ATOM 0 HB2 GLU A 75 0.358 -15.124 11.624 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.583 -14.072 12.305 1.00 0.00 H new ATOM 0 HG2 GLU A 75 0.137 -12.135 11.282 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -1.129 -13.344 11.205 1.00 0.00 H new ATOM 1183 N MET A 76 1.449 -12.065 8.802 1.00 0.00 N ATOM 1184 CA MET A 76 1.792 -10.699 8.425 1.00 0.00 C ATOM 1185 C MET A 76 0.697 -9.726 8.852 1.00 0.00 C ATOM 1186 O MET A 76 -0.472 -10.099 8.961 1.00 0.00 O ATOM 1187 CB MET A 76 2.011 -10.604 6.914 1.00 0.00 C ATOM 1188 CG MET A 76 1.709 -9.230 6.340 1.00 0.00 C ATOM 1189 SD MET A 76 2.018 -9.133 4.566 1.00 0.00 S ATOM 1190 CE MET A 76 0.639 -10.082 3.931 1.00 0.00 C ATOM 0 H MET A 76 0.786 -12.522 8.175 1.00 0.00 H new ATOM 0 HA MET A 76 2.715 -10.429 8.937 1.00 0.00 H new ATOM 0 HB2 MET A 76 3.045 -10.863 6.688 1.00 0.00 H new ATOM 0 HB3 MET A 76 1.382 -11.342 6.417 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.667 -8.980 6.537 1.00 0.00 H new ATOM 0 HG3 MET A 76 2.318 -8.485 6.852 1.00 0.00 H new ATOM 0 HE1 MET A 76 0.340 -9.685 2.961 1.00 0.00 H new ATOM 0 HE2 MET A 76 0.935 -11.125 3.820 1.00 0.00 H new ATOM 0 HE3 MET A 76 -0.199 -10.015 4.625 1.00 0.00 H new ATOM 1200 N LYS A 77 1.083 -8.477 9.094 1.00 0.00 N ATOM 1201 CA LYS A 77 0.135 -7.450 9.510 1.00 0.00 C ATOM 1202 C LYS A 77 -0.054 -6.409 8.411 1.00 0.00 C ATOM 1203 O LYS A 77 0.729 -6.342 7.463 1.00 0.00 O ATOM 1204 CB LYS A 77 0.616 -6.771 10.793 1.00 0.00 C ATOM 1205 CG LYS A 77 -0.081 -7.272 12.046 1.00 0.00 C ATOM 1206 CD LYS A 77 0.673 -6.873 13.303 1.00 0.00 C ATOM 1207 CE LYS A 77 1.699 -7.926 13.696 1.00 0.00 C ATOM 1208 NZ LYS A 77 2.006 -7.884 15.151 1.00 0.00 N ATOM 0 H LYS A 77 2.046 -8.152 9.009 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.824 -7.932 9.700 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.689 -6.929 10.897 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.459 -5.696 10.706 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.093 -6.870 12.085 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.171 -8.357 12.004 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.174 -5.918 13.141 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -0.033 -6.728 14.121 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.324 -8.915 13.432 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.615 -7.770 13.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.709 -8.616 15.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.388 -6.949 15.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.136 -8.058 15.694 1.00 0.00 H new ATOM 1222 N LEU A 78 -1.098 -5.597 8.546 1.00 0.00 N ATOM 1223 CA LEU A 78 -1.388 -4.557 7.565 1.00 0.00 C ATOM 1224 C LEU A 78 -2.199 -3.428 8.192 1.00 0.00 C ATOM 1225 O LEU A 78 -3.167 -3.672 8.914 1.00 0.00 O ATOM 1226 CB LEU A 78 -2.151 -5.147 6.377 1.00 0.00 C ATOM 1227 CG LEU A 78 -1.294 -5.715 5.244 1.00 0.00 C ATOM 1228 CD1 LEU A 78 -1.767 -7.108 4.863 1.00 0.00 C ATOM 1229 CD2 LEU A 78 -1.325 -4.790 4.037 1.00 0.00 C ATOM 0 H LEU A 78 -1.756 -5.639 9.324 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.440 -4.149 7.215 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.802 -5.940 6.746 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -2.796 -4.372 5.964 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.264 -5.787 5.595 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.145 -7.495 4.056 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.691 -7.767 5.728 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.804 -7.062 4.532 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.710 -5.210 3.241 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.351 -4.685 3.685 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.936 -3.812 4.318 1.00 0.00 H new ATOM 1241 N TYR A 79 -1.800 -2.193 7.912 1.00 0.00 N ATOM 1242 CA TYR A 79 -2.489 -1.026 8.450 1.00 0.00 C ATOM 1243 C TYR A 79 -2.849 -0.046 7.337 1.00 0.00 C ATOM 1244 O TYR A 79 -2.160 0.038 6.320 1.00 0.00 O ATOM 1245 CB TYR A 79 -1.618 -0.330 9.496 1.00 0.00 C ATOM 1246 CG TYR A 79 -1.349 -1.176 10.720 1.00 0.00 C ATOM 1247 CD1 TYR A 79 -0.386 -2.176 10.700 1.00 0.00 C ATOM 1248 CD2 TYR A 79 -2.059 -0.973 11.898 1.00 0.00 C ATOM 1249 CE1 TYR A 79 -0.138 -2.953 11.815 1.00 0.00 C ATOM 1250 CE2 TYR A 79 -1.817 -1.743 13.019 1.00 0.00 C ATOM 1251 CZ TYR A 79 -0.856 -2.732 12.972 1.00 0.00 C ATOM 1252 OH TYR A 79 -0.611 -3.502 14.087 1.00 0.00 O ATOM 0 H TYR A 79 -1.002 -1.974 7.315 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.410 -1.365 8.923 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -0.667 -0.054 9.040 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -2.104 0.595 9.804 1.00 0.00 H new ATOM 0 HD1 TYR A 79 0.179 -2.350 9.796 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -2.812 -0.200 11.937 1.00 0.00 H new ATOM 0 HE1 TYR A 79 0.613 -3.728 11.781 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.377 -1.572 13.927 1.00 0.00 H new ATOM 0 HH TYR A 79 -1.200 -3.218 14.817 1.00 0.00 H new ATOM 1262 N PHE A 80 -3.932 0.696 7.539 1.00 0.00 N ATOM 1263 CA PHE A 80 -4.386 1.672 6.554 1.00 0.00 C ATOM 1264 C PHE A 80 -3.579 2.963 6.657 1.00 0.00 C ATOM 1265 O PHE A 80 -3.841 3.806 7.515 1.00 0.00 O ATOM 1266 CB PHE A 80 -5.874 1.971 6.749 1.00 0.00 C ATOM 1267 CG PHE A 80 -6.773 1.099 5.920 1.00 0.00 C ATOM 1268 CD1 PHE A 80 -6.872 1.285 4.551 1.00 0.00 C ATOM 1269 CD2 PHE A 80 -7.521 0.094 6.511 1.00 0.00 C ATOM 1270 CE1 PHE A 80 -7.698 0.484 3.785 1.00 0.00 C ATOM 1271 CE2 PHE A 80 -8.349 -0.711 5.751 1.00 0.00 C ATOM 1272 CZ PHE A 80 -8.438 -0.515 4.386 1.00 0.00 C ATOM 0 H PHE A 80 -4.512 0.641 8.376 1.00 0.00 H new ATOM 0 HA PHE A 80 -4.235 1.247 5.562 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -6.127 1.844 7.802 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -6.063 3.015 6.500 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -6.297 2.066 4.076 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -7.457 -0.062 7.578 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -7.764 0.639 2.718 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -8.926 -1.492 6.224 1.00 0.00 H new ATOM 0 HZ PHE A 80 -9.085 -1.142 3.790 1.00 0.00 H new ATOM 1282 N ALA A 81 -2.594 3.111 5.776 1.00 0.00 N ATOM 1283 CA ALA A 81 -1.749 4.298 5.765 1.00 0.00 C ATOM 1284 C ALA A 81 -2.570 5.557 6.026 1.00 0.00 C ATOM 1285 O ALA A 81 -2.071 6.526 6.598 1.00 0.00 O ATOM 1286 CB ALA A 81 -1.014 4.411 4.438 1.00 0.00 C ATOM 0 H ALA A 81 -2.362 2.422 5.060 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.016 4.200 6.566 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -0.387 5.302 4.444 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -0.390 3.529 4.291 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -1.738 4.482 3.626 1.00 0.00 H new ATOM 1292 N GLN A 82 -3.829 5.536 5.601 1.00 0.00 N ATOM 1293 CA GLN A 82 -4.716 6.678 5.788 1.00 0.00 C ATOM 1294 C GLN A 82 -4.509 7.311 7.161 1.00 0.00 C ATOM 1295 O GLN A 82 -4.151 8.484 7.268 1.00 0.00 O ATOM 1296 CB GLN A 82 -6.175 6.248 5.627 1.00 0.00 C ATOM 1297 CG GLN A 82 -7.174 7.319 6.035 1.00 0.00 C ATOM 1298 CD GLN A 82 -7.435 8.325 4.931 1.00 0.00 C ATOM 1299 OE1 GLN A 82 -6.540 9.070 4.529 1.00 0.00 O ATOM 1300 NE2 GLN A 82 -8.666 8.351 4.433 1.00 0.00 N ATOM 0 H GLN A 82 -4.257 4.742 5.125 1.00 0.00 H new ATOM 0 HA GLN A 82 -4.476 7.420 5.027 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -6.352 5.975 4.587 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -6.349 5.354 6.225 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -8.114 6.845 6.319 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.801 7.841 6.916 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -9.377 7.716 4.796 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -8.901 9.006 3.687 1.00 0.00 H new ATOM 1309 N THR A 83 -4.735 6.525 8.209 1.00 0.00 N ATOM 1310 CA THR A 83 -4.574 7.008 9.574 1.00 0.00 C ATOM 1311 C THR A 83 -5.332 8.314 9.789 1.00 0.00 C ATOM 1312 O THR A 83 -5.926 8.858 8.857 1.00 0.00 O ATOM 1313 CB THR A 83 -3.090 7.227 9.922 1.00 0.00 C ATOM 1314 OG1 THR A 83 -2.542 8.265 9.101 1.00 0.00 O ATOM 1315 CG2 THR A 83 -2.293 5.945 9.725 1.00 0.00 C ATOM 0 H THR A 83 -5.030 5.551 8.138 1.00 0.00 H new ATOM 0 HA THR A 83 -4.984 6.240 10.230 1.00 0.00 H new ATOM 0 HB THR A 83 -3.025 7.520 10.970 1.00 0.00 H new ATOM 0 HG1 THR A 83 -3.261 8.694 8.592 1.00 0.00 H new ATOM 0 HG21 THR A 83 -1.248 6.124 9.977 1.00 0.00 H new ATOM 0 HG22 THR A 83 -2.694 5.164 10.372 1.00 0.00 H new ATOM 0 HG23 THR A 83 -2.366 5.627 8.685 1.00 0.00 H new ATOM 1323 N LEU A 84 -5.308 8.811 11.020 1.00 0.00 N ATOM 1324 CA LEU A 84 -5.992 10.055 11.357 1.00 0.00 C ATOM 1325 C LEU A 84 -5.496 11.203 10.483 1.00 0.00 C ATOM 1326 O LEU A 84 -4.339 11.613 10.577 1.00 0.00 O ATOM 1327 CB LEU A 84 -5.779 10.393 12.834 1.00 0.00 C ATOM 1328 CG LEU A 84 -4.344 10.277 13.349 1.00 0.00 C ATOM 1329 CD1 LEU A 84 -4.071 11.331 14.411 1.00 0.00 C ATOM 1330 CD2 LEU A 84 -4.087 8.883 13.901 1.00 0.00 C ATOM 0 H LEU A 84 -4.822 8.372 11.802 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.057 9.917 11.173 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -6.124 11.412 13.006 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.412 9.737 13.431 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.664 10.447 12.514 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.045 11.233 14.766 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.214 12.324 13.984 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.758 11.193 15.246 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.061 8.818 14.263 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -4.775 8.685 14.723 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -4.241 8.146 13.113 1.00 0.00 H new ATOM 1342 N HIS A 85 -6.380 11.718 9.635 1.00 0.00 N ATOM 1343 CA HIS A 85 -6.033 12.822 8.746 1.00 0.00 C ATOM 1344 C HIS A 85 -6.000 14.144 9.508 1.00 0.00 C ATOM 1345 O HIS A 85 -6.604 14.272 10.573 1.00 0.00 O ATOM 1346 CB HIS A 85 -7.033 12.910 7.593 1.00 0.00 C ATOM 1347 CG HIS A 85 -8.430 13.218 8.034 1.00 0.00 C ATOM 1348 ND1 HIS A 85 -8.946 14.312 8.641 1.00 0.00 N flip ATOM 1349 CD2 HIS A 85 -9.483 12.343 7.866 1.00 0.00 C flip ATOM 1350 CE1 HIS A 85 -10.286 14.082 8.827 1.00 0.00 C flip ATOM 1351 NE2 HIS A 85 -10.586 12.887 8.349 1.00 0.00 N flip ATOM 0 H HIS A 85 -7.341 11.389 9.544 1.00 0.00 H new ATOM 0 HA HIS A 85 -5.039 12.631 8.341 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -6.703 13.679 6.895 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -7.032 11.965 7.050 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -9.416 11.366 7.411 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -10.982 14.766 9.289 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -11.511 12.458 8.352 1.00 0.00 H new ATOM 1359 N ILE A 86 -5.289 15.122 8.956 1.00 0.00 N ATOM 1360 CA ILE A 86 -5.179 16.432 9.584 1.00 0.00 C ATOM 1361 C ILE A 86 -6.019 17.469 8.845 1.00 0.00 C ATOM 1362 O ILE A 86 -5.530 18.157 7.951 1.00 0.00 O ATOM 1363 CB ILE A 86 -3.716 16.912 9.631 1.00 0.00 C ATOM 1364 CG1 ILE A 86 -2.857 15.924 10.420 1.00 0.00 C ATOM 1365 CG2 ILE A 86 -3.634 18.302 10.244 1.00 0.00 C ATOM 1366 CD1 ILE A 86 -1.423 15.852 9.942 1.00 0.00 C ATOM 0 H ILE A 86 -4.781 15.031 8.076 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.552 16.326 10.603 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.333 16.963 8.612 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.867 16.207 11.473 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.304 14.932 10.352 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -2.594 18.627 10.270 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.217 19.000 9.643 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -4.032 18.276 11.258 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -0.873 15.131 10.548 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.403 15.539 8.898 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.959 16.834 10.036 1.00 0.00 H new ATOM 1378 N GLY A 87 -7.289 17.575 9.227 1.00 0.00 N ATOM 1379 CA GLY A 87 -8.176 18.531 8.592 1.00 0.00 C ATOM 1380 C GLY A 87 -8.532 19.687 9.505 1.00 0.00 C ATOM 1381 O GLY A 87 -8.837 19.489 10.681 1.00 0.00 O ATOM 0 H GLY A 87 -7.718 17.016 9.964 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.702 18.917 7.690 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -9.089 18.024 8.281 1.00 0.00 H new ATOM 1385 N SER A 88 -8.490 20.902 8.964 1.00 0.00 N ATOM 1386 CA SER A 88 -8.804 22.096 9.739 1.00 0.00 C ATOM 1387 C SER A 88 -10.050 21.876 10.593 1.00 0.00 C ATOM 1388 O SER A 88 -10.899 21.046 10.271 1.00 0.00 O ATOM 1389 CB SER A 88 -9.014 23.292 8.809 1.00 0.00 C ATOM 1390 OG SER A 88 -10.301 23.258 8.217 1.00 0.00 O ATOM 0 H SER A 88 -8.241 21.084 7.992 1.00 0.00 H new ATOM 0 HA SER A 88 -7.963 22.303 10.400 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.893 24.219 9.370 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.252 23.289 8.030 1.00 0.00 H new ATOM 0 HG SER A 88 -10.411 24.034 7.629 1.00 0.00 H new ATOM 1396 N SER A 89 -10.150 22.628 11.685 1.00 0.00 N ATOM 1397 CA SER A 89 -11.289 22.514 12.589 1.00 0.00 C ATOM 1398 C SER A 89 -12.363 23.541 12.243 1.00 0.00 C ATOM 1399 O SER A 89 -12.182 24.366 11.346 1.00 0.00 O ATOM 1400 CB SER A 89 -10.836 22.700 14.039 1.00 0.00 C ATOM 1401 OG SER A 89 -11.826 22.243 14.944 1.00 0.00 O ATOM 0 H SER A 89 -9.457 23.322 11.965 1.00 0.00 H new ATOM 0 HA SER A 89 -11.715 21.517 12.474 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.907 22.155 14.206 1.00 0.00 H new ATOM 0 HB3 SER A 89 -10.626 23.753 14.226 1.00 0.00 H new ATOM 0 HG SER A 89 -11.513 22.371 15.864 1.00 0.00 H new ATOM 1407 N HIS A 90 -13.479 23.485 12.961 1.00 0.00 N ATOM 1408 CA HIS A 90 -14.583 24.411 12.731 1.00 0.00 C ATOM 1409 C HIS A 90 -15.463 24.526 13.972 1.00 0.00 C ATOM 1410 O HIS A 90 -15.272 23.801 14.950 1.00 0.00 O ATOM 1411 CB HIS A 90 -15.421 23.952 11.538 1.00 0.00 C ATOM 1412 CG HIS A 90 -16.353 22.824 11.858 1.00 0.00 C ATOM 1413 ND1 HIS A 90 -15.959 21.693 12.543 1.00 0.00 N ATOM 1414 CD2 HIS A 90 -17.668 22.656 11.586 1.00 0.00 C ATOM 1415 CE1 HIS A 90 -16.991 20.880 12.677 1.00 0.00 C ATOM 1416 NE2 HIS A 90 -18.041 21.441 12.105 1.00 0.00 N ATOM 0 H HIS A 90 -13.644 22.809 13.707 1.00 0.00 H new ATOM 0 HA HIS A 90 -14.162 25.393 12.513 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -16.001 24.797 11.166 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -14.754 23.644 10.733 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -18.306 23.349 11.058 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -16.979 19.919 13.171 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -18.976 21.037 12.057 1.00 0.00 H new ATOM 1424 N LEU A 91 -16.426 25.439 13.926 1.00 0.00 N ATOM 1425 CA LEU A 91 -17.336 25.650 15.047 1.00 0.00 C ATOM 1426 C LEU A 91 -18.641 26.285 14.577 1.00 0.00 C ATOM 1427 O LEU A 91 -18.813 26.571 13.393 1.00 0.00 O ATOM 1428 CB LEU A 91 -16.677 26.536 16.105 1.00 0.00 C ATOM 1429 CG LEU A 91 -16.379 25.869 17.449 1.00 0.00 C ATOM 1430 CD1 LEU A 91 -14.971 26.208 17.913 1.00 0.00 C ATOM 1431 CD2 LEU A 91 -17.403 26.291 18.492 1.00 0.00 C ATOM 0 H LEU A 91 -16.597 26.046 13.124 1.00 0.00 H new ATOM 0 HA LEU A 91 -17.563 24.679 15.486 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -15.742 26.920 15.697 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -17.323 27.395 16.284 1.00 0.00 H new ATOM 0 HG LEU A 91 -16.446 24.789 17.320 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -14.777 25.725 18.871 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -14.250 25.855 17.176 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -14.875 27.288 18.026 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -17.176 25.807 19.442 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -17.369 27.373 18.619 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -18.400 25.996 18.164 1.00 0.00 H new ATOM 1443 N ALA A 92 -19.557 26.504 15.514 1.00 0.00 N ATOM 1444 CA ALA A 92 -20.845 27.109 15.198 1.00 0.00 C ATOM 1445 C ALA A 92 -21.157 28.263 16.144 1.00 0.00 C ATOM 1446 O ALA A 92 -20.848 28.222 17.335 1.00 0.00 O ATOM 1447 CB ALA A 92 -21.948 26.063 15.256 1.00 0.00 C ATOM 0 H ALA A 92 -19.431 26.271 16.499 1.00 0.00 H new ATOM 0 HA ALA A 92 -20.792 27.509 14.185 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -22.904 26.529 15.018 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -21.739 25.274 14.534 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -21.992 25.636 16.258 1.00 0.00 H new ATOM 1453 N PRO A 93 -21.784 29.319 15.605 1.00 0.00 N ATOM 1454 CA PRO A 93 -22.151 30.505 16.385 1.00 0.00 C ATOM 1455 C PRO A 93 -23.274 30.222 17.376 1.00 0.00 C ATOM 1456 O PRO A 93 -23.962 29.203 17.299 1.00 0.00 O ATOM 1457 CB PRO A 93 -22.618 31.500 15.319 1.00 0.00 C ATOM 1458 CG PRO A 93 -23.069 30.651 14.181 1.00 0.00 C ATOM 1459 CD PRO A 93 -22.183 29.437 14.192 1.00 0.00 C ATOM 0 HA PRO A 93 -21.321 30.867 16.991 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -23.428 32.127 15.691 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -21.810 32.167 15.019 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -24.116 30.371 14.295 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -22.983 31.188 13.236 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -22.714 28.549 13.849 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -21.319 29.564 13.540 1.00 0.00 H new ATOM 1467 N PRO A 94 -23.466 31.142 18.333 1.00 0.00 N ATOM 1468 CA PRO A 94 -24.505 31.013 19.359 1.00 0.00 C ATOM 1469 C PRO A 94 -25.909 31.174 18.784 1.00 0.00 C ATOM 1470 O PRO A 94 -26.085 31.714 17.693 1.00 0.00 O ATOM 1471 CB PRO A 94 -24.191 32.154 20.328 1.00 0.00 C ATOM 1472 CG PRO A 94 -23.466 33.162 19.505 1.00 0.00 C ATOM 1473 CD PRO A 94 -22.684 32.380 18.487 1.00 0.00 C ATOM 0 HA PRO A 94 -24.499 30.027 19.824 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -25.102 32.573 20.755 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -23.579 31.809 21.161 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -24.164 33.845 19.021 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -22.804 33.768 20.124 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -22.598 32.921 17.544 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -21.670 32.175 18.830 1.00 0.00 H new ATOM 1481 N ASN A 95 -26.905 30.702 19.528 1.00 0.00 N ATOM 1482 CA ASN A 95 -28.294 30.795 19.092 1.00 0.00 C ATOM 1483 C ASN A 95 -29.247 30.527 20.252 1.00 0.00 C ATOM 1484 O ASN A 95 -28.877 29.939 21.270 1.00 0.00 O ATOM 1485 CB ASN A 95 -28.561 29.803 17.958 1.00 0.00 C ATOM 1486 CG ASN A 95 -28.488 30.454 16.591 1.00 0.00 C ATOM 1487 OD1 ASN A 95 -28.702 31.658 16.452 1.00 0.00 O ATOM 1488 ND2 ASN A 95 -28.182 29.658 15.573 1.00 0.00 N ATOM 0 H ASN A 95 -26.776 30.252 20.434 1.00 0.00 H new ATOM 0 HA ASN A 95 -28.468 31.808 18.729 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -27.835 28.992 18.010 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -29.547 29.358 18.093 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -28.116 30.039 14.629 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -28.013 28.665 15.735 1.00 0.00 H new ATOM 1495 N PRO A 96 -30.505 30.965 20.098 1.00 0.00 N ATOM 1496 CA PRO A 96 -31.538 30.783 21.122 1.00 0.00 C ATOM 1497 C PRO A 96 -31.961 29.325 21.267 1.00 0.00 C ATOM 1498 O PRO A 96 -31.323 28.426 20.718 1.00 0.00 O ATOM 1499 CB PRO A 96 -32.704 31.629 20.604 1.00 0.00 C ATOM 1500 CG PRO A 96 -32.504 31.686 19.129 1.00 0.00 C ATOM 1501 CD PRO A 96 -31.016 31.673 18.912 1.00 0.00 C ATOM 0 HA PRO A 96 -31.187 31.076 22.111 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -33.664 31.178 20.856 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -32.696 32.626 21.044 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -32.977 30.836 18.638 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -32.952 32.587 18.709 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -30.749 31.157 17.990 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -30.611 32.683 18.841 1.00 0.00 H new ATOM 1509 N ASP A 97 -33.040 29.098 22.008 1.00 0.00 N ATOM 1510 CA ASP A 97 -33.549 27.748 22.223 1.00 0.00 C ATOM 1511 C ASP A 97 -33.854 27.063 20.894 1.00 0.00 C ATOM 1512 O ASP A 97 -33.188 26.102 20.510 1.00 0.00 O ATOM 1513 CB ASP A 97 -34.806 27.787 23.092 1.00 0.00 C ATOM 1514 CG ASP A 97 -34.533 28.324 24.483 1.00 0.00 C ATOM 1515 OD1 ASP A 97 -34.169 29.514 24.599 1.00 0.00 O ATOM 1516 OD2 ASP A 97 -34.684 27.557 25.455 1.00 0.00 O ATOM 0 H ASP A 97 -33.579 29.831 22.470 1.00 0.00 H new ATOM 0 HA ASP A 97 -32.779 27.174 22.738 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -35.560 28.408 22.608 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -35.222 26.782 23.169 1.00 0.00 H new ATOM 1521 N LYS A 98 -34.866 27.566 20.195 1.00 0.00 N ATOM 1522 CA LYS A 98 -35.261 27.005 18.908 1.00 0.00 C ATOM 1523 C LYS A 98 -36.307 27.883 18.230 1.00 0.00 C ATOM 1524 O LYS A 98 -37.501 27.768 18.506 1.00 0.00 O ATOM 1525 CB LYS A 98 -35.812 25.589 19.093 1.00 0.00 C ATOM 1526 CG LYS A 98 -35.370 24.619 18.012 1.00 0.00 C ATOM 1527 CD LYS A 98 -35.109 23.233 18.577 1.00 0.00 C ATOM 1528 CE LYS A 98 -33.688 22.772 18.290 1.00 0.00 C ATOM 1529 NZ LYS A 98 -33.118 21.995 19.425 1.00 0.00 N ATOM 0 H LYS A 98 -35.428 28.361 20.498 1.00 0.00 H new ATOM 0 HA LYS A 98 -34.377 26.965 18.271 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -35.494 25.208 20.063 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -36.901 25.631 19.109 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -36.137 24.559 17.240 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -34.465 24.994 17.534 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -35.280 23.240 19.653 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -35.816 22.524 18.146 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -33.680 22.158 17.389 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -33.058 23.639 18.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -32.149 21.699 19.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -33.102 22.589 20.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -33.704 21.154 19.599 1.00 0.00 H new ATOM 1543 N SER A 99 -35.852 28.759 17.340 1.00 0.00 N ATOM 1544 CA SER A 99 -36.748 29.658 16.624 1.00 0.00 C ATOM 1545 C SER A 99 -37.693 28.875 15.718 1.00 0.00 C ATOM 1546 O SER A 99 -37.386 28.618 14.555 1.00 0.00 O ATOM 1547 CB SER A 99 -35.945 30.662 15.795 1.00 0.00 C ATOM 1548 OG SER A 99 -35.002 30.002 14.969 1.00 0.00 O ATOM 0 H SER A 99 -34.867 28.865 17.098 1.00 0.00 H new ATOM 0 HA SER A 99 -37.342 30.199 17.360 1.00 0.00 H new ATOM 0 HB2 SER A 99 -36.622 31.254 15.179 1.00 0.00 H new ATOM 0 HB3 SER A 99 -35.429 31.356 16.458 1.00 0.00 H new ATOM 0 HG SER A 99 -35.440 29.263 14.498 1.00 0.00 H new ATOM 1554 N GLY A 100 -38.847 28.497 16.260 1.00 0.00 N ATOM 1555 CA GLY A 100 -39.820 27.747 15.489 1.00 0.00 C ATOM 1556 C GLY A 100 -41.175 27.686 16.164 1.00 0.00 C ATOM 1557 O GLY A 100 -41.511 28.519 17.008 1.00 0.00 O ATOM 0 H GLY A 100 -39.125 28.697 17.221 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -39.928 28.203 14.505 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -39.451 26.734 15.331 1.00 0.00 H new ATOM 1561 N PRO A 101 -41.981 26.680 15.794 1.00 0.00 N ATOM 1562 CA PRO A 101 -43.321 26.490 16.358 1.00 0.00 C ATOM 1563 C PRO A 101 -43.278 26.048 17.818 1.00 0.00 C ATOM 1564 O PRO A 101 -42.267 25.527 18.289 1.00 0.00 O ATOM 1565 CB PRO A 101 -43.920 25.387 15.484 1.00 0.00 C ATOM 1566 CG PRO A 101 -42.745 24.637 14.960 1.00 0.00 C ATOM 1567 CD PRO A 101 -41.647 25.650 14.797 1.00 0.00 C ATOM 0 HA PRO A 101 -43.898 27.414 16.357 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -44.578 24.738 16.062 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -44.516 25.805 14.673 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -42.448 23.847 15.649 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -42.980 24.159 14.009 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -40.666 25.213 14.984 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -41.626 26.060 13.787 1.00 0.00 H new ATOM 1575 N SER A 102 -44.382 26.260 18.528 1.00 0.00 N ATOM 1576 CA SER A 102 -44.469 25.886 19.934 1.00 0.00 C ATOM 1577 C SER A 102 -45.606 24.895 20.163 1.00 0.00 C ATOM 1578 O SER A 102 -46.771 25.198 19.901 1.00 0.00 O ATOM 1579 CB SER A 102 -44.677 27.129 20.802 1.00 0.00 C ATOM 1580 OG SER A 102 -43.529 27.402 21.587 1.00 0.00 O ATOM 0 H SER A 102 -45.228 26.689 18.152 1.00 0.00 H new ATOM 0 HA SER A 102 -43.531 25.407 20.216 1.00 0.00 H new ATOM 0 HB2 SER A 102 -44.899 27.987 20.167 1.00 0.00 H new ATOM 0 HB3 SER A 102 -45.539 26.982 21.452 1.00 0.00 H new ATOM 0 HG SER A 102 -43.687 28.202 22.131 1.00 0.00 H new ATOM 1586 N SER A 103 -45.260 23.710 20.656 1.00 0.00 N ATOM 1587 CA SER A 103 -46.250 22.672 20.918 1.00 0.00 C ATOM 1588 C SER A 103 -46.903 22.877 22.280 1.00 0.00 C ATOM 1589 O SER A 103 -46.614 23.846 22.981 1.00 0.00 O ATOM 1590 CB SER A 103 -45.598 21.289 20.855 1.00 0.00 C ATOM 1591 OG SER A 103 -45.934 20.621 19.651 1.00 0.00 O ATOM 0 H SER A 103 -44.301 23.445 20.882 1.00 0.00 H new ATOM 0 HA SER A 103 -47.022 22.737 20.151 1.00 0.00 H new ATOM 0 HB2 SER A 103 -44.515 21.390 20.928 1.00 0.00 H new ATOM 0 HB3 SER A 103 -45.921 20.692 21.708 1.00 0.00 H new ATOM 0 HG SER A 103 -45.504 19.741 19.634 1.00 0.00 H new ATOM 1597 N GLY A 104 -47.789 21.956 22.649 1.00 0.00 N ATOM 1598 CA GLY A 104 -48.472 22.053 23.926 1.00 0.00 C ATOM 1599 C GLY A 104 -49.574 23.094 23.917 1.00 0.00 C ATOM 1600 O GLY A 104 -50.701 22.818 24.332 1.00 0.00 O ATOM 0 H GLY A 104 -48.046 21.145 22.086 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -48.896 21.082 24.182 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -47.749 22.301 24.703 1.00 0.00 H new TER 1604 GLY A 104