USER MOD reduce.3.24.130724 H: found=0, std=0, add=629, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 625 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 NoAdj-H: A 39 HIS HD1 : A 39 HIS ND1 : A 400 ZNZN :(H bumps) USER MOD Set 1.1: A 17 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 22 HIS : no HD1:sc= -0.138 X(o=0.19,f=0.23) USER MOD Set 1.3: A 40 LYS NZ :NH3+ 180:sc= 0.323 (180deg=0.323) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc=-0.00513 USER MOD Single : A 8 SER OG : rot 17:sc= 0.483 USER MOD Single : A 10 MET CE :methyl 173:sc= 0 (180deg=-0.069) USER MOD Single : A 12 ASN : amide:sc= -0.226 X(o=-0.23,f=-0.066) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -107:sc= 0.988 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= -0.0508 K(o=-0.051,f=-3.5!) USER MOD Single : A 32 GLN : amide:sc= -1.33! X(o=-1.3!,f=-1.7) USER MOD Single : A 35 SER OG : rot -130:sc= -0.0605 USER MOD Single : A 38 SER OG : rot 180:sc= -0.17 USER MOD Single : A 46 SER OG : rot -116:sc= -0.029 USER MOD Single : A 49 SER OG : rot 120:sc= -0.0307 USER MOD Single : A 51 LYS NZ :NH3+ 147:sc= -0.602 (180deg=-2.34!) USER MOD Single : A 53 GLN : amide:sc= -2.79! C(o=-2.8!,f=-4.6!) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.01 USER MOD Single : A 60 TYR OH : rot -7:sc= 0.0248 USER MOD Single : A 63 SER OG : rot -92:sc= 0.599 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.203 X(o=-0.2,f=0.02) USER MOD Single : A 79 MET CE :methyl -154:sc= -0.313 (180deg=-1.23) USER MOD Single : A 80 GLN : amide:sc= -0.0675 K(o=-0.068,f=-1.2) USER MOD Single : A 85 THR OG1 : rot 67:sc= 0.481 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -26.052 -15.831 -0.140 1.00 0.00 N ATOM 2 CA GLY A 1 -26.575 -15.517 -1.456 1.00 0.00 C ATOM 3 C GLY A 1 -25.884 -14.324 -2.086 1.00 0.00 C ATOM 4 O GLY A 1 -25.039 -14.481 -2.967 1.00 0.00 O ATOM 0 H1 GLY A 1 -26.557 -16.653 0.247 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.038 -16.050 -0.213 1.00 0.00 H new ATOM 0 H3 GLY A 1 -26.185 -15.015 0.490 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.459 -16.385 -2.106 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.644 -15.316 -1.380 1.00 0.00 H new ATOM 8 N SER A 2 -26.245 -13.127 -1.635 1.00 0.00 N ATOM 9 CA SER A 2 -25.658 -11.901 -2.164 1.00 0.00 C ATOM 10 C SER A 2 -24.175 -11.816 -1.815 1.00 0.00 C ATOM 11 O SER A 2 -23.718 -12.417 -0.843 1.00 0.00 O ATOM 12 CB SER A 2 -26.394 -10.679 -1.613 1.00 0.00 C ATOM 13 OG SER A 2 -25.957 -9.491 -2.250 1.00 0.00 O ATOM 0 H SER A 2 -26.941 -12.980 -0.904 1.00 0.00 H new ATOM 0 HA SER A 2 -25.759 -11.917 -3.249 1.00 0.00 H new ATOM 0 HB2 SER A 2 -27.467 -10.800 -1.759 1.00 0.00 H new ATOM 0 HB3 SER A 2 -26.225 -10.603 -0.539 1.00 0.00 H new ATOM 0 HG SER A 2 -26.444 -8.724 -1.882 1.00 0.00 H new ATOM 19 N SER A 3 -23.427 -11.064 -2.618 1.00 0.00 N ATOM 20 CA SER A 3 -21.995 -10.902 -2.398 1.00 0.00 C ATOM 21 C SER A 3 -21.420 -9.835 -3.324 1.00 0.00 C ATOM 22 O SER A 3 -21.824 -9.718 -4.481 1.00 0.00 O ATOM 23 CB SER A 3 -21.270 -12.231 -2.620 1.00 0.00 C ATOM 24 OG SER A 3 -20.081 -12.298 -1.852 1.00 0.00 O ATOM 0 H SER A 3 -23.790 -10.558 -3.426 1.00 0.00 H new ATOM 0 HA SER A 3 -21.845 -10.582 -1.367 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.928 -13.057 -2.350 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.031 -12.346 -3.677 1.00 0.00 H new ATOM 0 HG SER A 3 -19.637 -13.157 -2.010 1.00 0.00 H new ATOM 30 N GLY A 4 -20.474 -9.057 -2.806 1.00 0.00 N ATOM 31 CA GLY A 4 -19.859 -8.009 -3.600 1.00 0.00 C ATOM 32 C GLY A 4 -19.464 -6.807 -2.765 1.00 0.00 C ATOM 33 O GLY A 4 -19.165 -6.938 -1.578 1.00 0.00 O ATOM 0 H GLY A 4 -20.123 -9.134 -1.851 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.976 -8.407 -4.100 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -20.552 -7.694 -4.380 1.00 0.00 H new ATOM 37 N SER A 5 -19.461 -5.632 -3.387 1.00 0.00 N ATOM 38 CA SER A 5 -19.094 -4.402 -2.695 1.00 0.00 C ATOM 39 C SER A 5 -20.324 -3.729 -2.093 1.00 0.00 C ATOM 40 O SER A 5 -21.448 -3.953 -2.541 1.00 0.00 O ATOM 41 CB SER A 5 -18.392 -3.441 -3.657 1.00 0.00 C ATOM 42 OG SER A 5 -17.212 -4.021 -4.187 1.00 0.00 O ATOM 0 H SER A 5 -19.709 -5.506 -4.368 1.00 0.00 H new ATOM 0 HA SER A 5 -18.410 -4.659 -1.886 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.068 -3.177 -4.470 1.00 0.00 H new ATOM 0 HB3 SER A 5 -18.144 -2.516 -3.136 1.00 0.00 H new ATOM 0 HG SER A 5 -16.783 -3.388 -4.800 1.00 0.00 H new ATOM 48 N SER A 6 -20.101 -2.904 -1.076 1.00 0.00 N ATOM 49 CA SER A 6 -21.190 -2.200 -0.409 1.00 0.00 C ATOM 50 C SER A 6 -21.167 -0.714 -0.752 1.00 0.00 C ATOM 51 O SER A 6 -22.197 -0.124 -1.076 1.00 0.00 O ATOM 52 CB SER A 6 -21.094 -2.387 1.106 1.00 0.00 C ATOM 53 OG SER A 6 -19.836 -1.954 1.595 1.00 0.00 O ATOM 0 H SER A 6 -19.176 -2.706 -0.695 1.00 0.00 H new ATOM 0 HA SER A 6 -22.132 -2.622 -0.761 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.890 -1.827 1.596 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.243 -3.437 1.356 1.00 0.00 H new ATOM 0 HG SER A 6 -19.801 -2.082 2.566 1.00 0.00 H new ATOM 59 N GLY A 7 -19.983 -0.114 -0.678 1.00 0.00 N ATOM 60 CA GLY A 7 -19.847 1.299 -0.982 1.00 0.00 C ATOM 61 C GLY A 7 -19.416 2.112 0.221 1.00 0.00 C ATOM 62 O GLY A 7 -18.914 1.564 1.202 1.00 0.00 O ATOM 0 H GLY A 7 -19.116 -0.581 -0.413 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -19.118 1.427 -1.783 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.798 1.681 -1.353 1.00 0.00 H new ATOM 66 N SER A 8 -19.610 3.425 0.147 1.00 0.00 N ATOM 67 CA SER A 8 -19.233 4.317 1.237 1.00 0.00 C ATOM 68 C SER A 8 -20.090 5.580 1.227 1.00 0.00 C ATOM 69 O SER A 8 -20.631 5.986 0.198 1.00 0.00 O ATOM 70 CB SER A 8 -17.753 4.691 1.129 1.00 0.00 C ATOM 71 OG SER A 8 -16.927 3.649 1.619 1.00 0.00 O ATOM 0 H SER A 8 -20.026 3.895 -0.657 1.00 0.00 H new ATOM 0 HA SER A 8 -19.401 3.792 2.178 1.00 0.00 H new ATOM 0 HB2 SER A 8 -17.502 4.900 0.089 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.564 5.605 1.692 1.00 0.00 H new ATOM 0 HG SER A 8 -17.443 2.817 1.665 1.00 0.00 H new ATOM 77 N PRO A 9 -20.217 6.216 2.401 1.00 0.00 N ATOM 78 CA PRO A 9 -21.006 7.442 2.555 1.00 0.00 C ATOM 79 C PRO A 9 -20.360 8.638 1.865 1.00 0.00 C ATOM 80 O PRO A 9 -19.157 8.640 1.603 1.00 0.00 O ATOM 81 CB PRO A 9 -21.041 7.653 4.071 1.00 0.00 C ATOM 82 CG PRO A 9 -19.820 6.966 4.577 1.00 0.00 C ATOM 83 CD PRO A 9 -19.600 5.788 3.668 1.00 0.00 C ATOM 0 HA PRO A 9 -21.993 7.352 2.101 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -21.032 8.713 4.323 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -21.944 7.229 4.509 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -18.961 7.636 4.562 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -19.954 6.643 5.609 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -18.540 5.568 3.545 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -20.069 4.885 4.059 1.00 0.00 H new ATOM 91 N MET A 10 -21.165 9.654 1.575 1.00 0.00 N ATOM 92 CA MET A 10 -20.670 10.858 0.916 1.00 0.00 C ATOM 93 C MET A 10 -20.044 11.812 1.928 1.00 0.00 C ATOM 94 O MET A 10 -20.710 12.710 2.443 1.00 0.00 O ATOM 95 CB MET A 10 -21.805 11.560 0.169 1.00 0.00 C ATOM 96 CG MET A 10 -21.363 12.813 -0.569 1.00 0.00 C ATOM 97 SD MET A 10 -19.940 12.523 -1.638 1.00 0.00 S ATOM 98 CE MET A 10 -20.671 11.484 -2.901 1.00 0.00 C ATOM 0 H MET A 10 -22.163 9.668 1.786 1.00 0.00 H new ATOM 0 HA MET A 10 -19.903 10.562 0.200 1.00 0.00 H new ATOM 0 HB2 MET A 10 -22.244 10.864 -0.545 1.00 0.00 H new ATOM 0 HB3 MET A 10 -22.588 11.824 0.880 1.00 0.00 H new ATOM 0 HG2 MET A 10 -22.192 13.189 -1.168 1.00 0.00 H new ATOM 0 HG3 MET A 10 -21.116 13.589 0.156 1.00 0.00 H new ATOM 0 HE1 MET A 10 -19.949 11.322 -3.701 1.00 0.00 H new ATOM 0 HE2 MET A 10 -20.952 10.525 -2.466 1.00 0.00 H new ATOM 0 HE3 MET A 10 -21.558 11.972 -3.306 1.00 0.00 H new ATOM 108 N ALA A 11 -18.761 11.612 2.209 1.00 0.00 N ATOM 109 CA ALA A 11 -18.045 12.456 3.158 1.00 0.00 C ATOM 110 C ALA A 11 -16.649 12.796 2.646 1.00 0.00 C ATOM 111 O ALA A 11 -15.756 11.950 2.643 1.00 0.00 O ATOM 112 CB ALA A 11 -17.960 11.772 4.514 1.00 0.00 C ATOM 0 H ALA A 11 -18.195 10.872 1.793 1.00 0.00 H new ATOM 0 HA ALA A 11 -18.600 13.388 3.268 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -17.423 12.414 5.212 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -18.966 11.587 4.892 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -17.431 10.825 4.411 1.00 0.00 H new ATOM 118 N ASN A 12 -16.469 14.040 2.214 1.00 0.00 N ATOM 119 CA ASN A 12 -15.181 14.491 1.699 1.00 0.00 C ATOM 120 C ASN A 12 -14.076 14.269 2.727 1.00 0.00 C ATOM 121 O ASN A 12 -13.027 13.707 2.413 1.00 0.00 O ATOM 122 CB ASN A 12 -15.251 15.972 1.320 1.00 0.00 C ATOM 123 CG ASN A 12 -16.394 16.273 0.370 1.00 0.00 C ATOM 124 OD1 ASN A 12 -16.272 16.091 -0.842 1.00 0.00 O ATOM 125 ND2 ASN A 12 -17.511 16.736 0.917 1.00 0.00 N ATOM 0 H ASN A 12 -17.198 14.753 2.210 1.00 0.00 H new ATOM 0 HA ASN A 12 -14.948 13.906 0.810 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -15.366 16.570 2.224 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -14.310 16.271 0.858 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -18.314 16.957 0.328 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -17.567 16.871 1.926 1.00 0.00 H new ATOM 132 N SER A 13 -14.320 14.712 3.956 1.00 0.00 N ATOM 133 CA SER A 13 -13.345 14.565 5.029 1.00 0.00 C ATOM 134 C SER A 13 -13.266 13.115 5.496 1.00 0.00 C ATOM 135 O SER A 13 -14.188 12.329 5.278 1.00 0.00 O ATOM 136 CB SER A 13 -13.710 15.472 6.206 1.00 0.00 C ATOM 137 OG SER A 13 -12.652 15.537 7.147 1.00 0.00 O ATOM 0 H SER A 13 -15.185 15.176 4.233 1.00 0.00 H new ATOM 0 HA SER A 13 -12.369 14.858 4.642 1.00 0.00 H new ATOM 0 HB2 SER A 13 -13.938 16.473 5.841 1.00 0.00 H new ATOM 0 HB3 SER A 13 -14.611 15.097 6.692 1.00 0.00 H new ATOM 0 HG SER A 13 -12.909 16.124 7.888 1.00 0.00 H new ATOM 143 N GLY A 14 -12.156 12.766 6.140 1.00 0.00 N ATOM 144 CA GLY A 14 -11.976 11.411 6.628 1.00 0.00 C ATOM 145 C GLY A 14 -10.672 11.235 7.381 1.00 0.00 C ATOM 146 O GLY A 14 -9.744 12.034 7.254 1.00 0.00 O ATOM 0 H GLY A 14 -11.378 13.397 6.332 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.808 11.150 7.282 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.003 10.718 5.787 1.00 0.00 H new ATOM 150 N PRO A 15 -10.591 10.168 8.190 1.00 0.00 N ATOM 151 CA PRO A 15 -9.397 9.865 8.984 1.00 0.00 C ATOM 152 C PRO A 15 -8.223 9.422 8.119 1.00 0.00 C ATOM 153 O PRO A 15 -7.114 9.943 8.245 1.00 0.00 O ATOM 154 CB PRO A 15 -9.855 8.721 9.892 1.00 0.00 C ATOM 155 CG PRO A 15 -10.972 8.073 9.149 1.00 0.00 C ATOM 156 CD PRO A 15 -11.659 9.174 8.390 1.00 0.00 C ATOM 0 HA PRO A 15 -9.036 10.739 9.526 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -9.045 8.017 10.082 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -10.187 9.093 10.861 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -10.597 7.307 8.471 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -11.663 7.581 9.834 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -12.060 8.818 7.441 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -12.495 9.590 8.953 1.00 0.00 H new ATOM 164 N LEU A 16 -8.472 8.457 7.241 1.00 0.00 N ATOM 165 CA LEU A 16 -7.434 7.943 6.354 1.00 0.00 C ATOM 166 C LEU A 16 -8.025 7.522 5.012 1.00 0.00 C ATOM 167 O LEU A 16 -9.244 7.445 4.856 1.00 0.00 O ATOM 168 CB LEU A 16 -6.721 6.756 7.004 1.00 0.00 C ATOM 169 CG LEU A 16 -6.085 7.021 8.369 1.00 0.00 C ATOM 170 CD1 LEU A 16 -5.936 5.725 9.149 1.00 0.00 C ATOM 171 CD2 LEU A 16 -4.735 7.705 8.204 1.00 0.00 C ATOM 0 H LEU A 16 -9.384 8.015 7.124 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.712 8.741 6.179 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.438 5.942 7.111 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.943 6.408 6.324 1.00 0.00 H new ATOM 0 HG LEU A 16 -6.741 7.686 8.931 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.482 5.933 10.118 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.918 5.275 9.298 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.302 5.036 8.592 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -4.297 7.886 9.185 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.071 7.065 7.623 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -4.869 8.654 7.686 1.00 0.00 H new ATOM 183 N CYS A 17 -7.153 7.250 4.047 1.00 0.00 N ATOM 184 CA CYS A 17 -7.588 6.836 2.718 1.00 0.00 C ATOM 185 C CYS A 17 -6.433 6.223 1.934 1.00 0.00 C ATOM 186 O CYS A 17 -5.268 6.374 2.304 1.00 0.00 O ATOM 187 CB CYS A 17 -8.164 8.028 1.952 1.00 0.00 C ATOM 188 SG CYS A 17 -6.994 9.387 1.714 1.00 0.00 S ATOM 0 H CYS A 17 -6.141 7.309 4.160 1.00 0.00 H new ATOM 0 HA CYS A 17 -8.364 6.080 2.837 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -8.511 7.686 0.977 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -9.036 8.403 2.487 1.00 0.00 H new ATOM 0 HG CYS A 17 -7.572 10.347 1.055 1.00 0.00 H new ATOM 194 N CYS A 18 -6.762 5.528 0.850 1.00 0.00 N ATOM 195 CA CYS A 18 -5.753 4.889 0.014 1.00 0.00 C ATOM 196 C CYS A 18 -5.105 5.901 -0.926 1.00 0.00 C ATOM 197 O CYS A 18 -5.644 6.984 -1.158 1.00 0.00 O ATOM 198 CB CYS A 18 -6.377 3.751 -0.795 1.00 0.00 C ATOM 199 SG CYS A 18 -5.169 2.738 -1.708 1.00 0.00 S ATOM 0 H CYS A 18 -7.721 5.393 0.530 1.00 0.00 H new ATOM 0 HA CYS A 18 -4.982 4.481 0.667 1.00 0.00 H new ATOM 0 HB2 CYS A 18 -6.940 3.106 -0.120 1.00 0.00 H new ATOM 0 HB3 CYS A 18 -7.091 4.172 -1.503 1.00 0.00 H new ATOM 204 N THR A 19 -3.945 5.541 -1.466 1.00 0.00 N ATOM 205 CA THR A 19 -3.223 6.416 -2.381 1.00 0.00 C ATOM 206 C THR A 19 -3.666 6.192 -3.822 1.00 0.00 C ATOM 207 O THR A 19 -3.694 7.125 -4.625 1.00 0.00 O ATOM 208 CB THR A 19 -1.702 6.198 -2.284 1.00 0.00 C ATOM 209 OG1 THR A 19 -1.232 6.591 -0.989 1.00 0.00 O ATOM 210 CG2 THR A 19 -0.971 6.992 -3.356 1.00 0.00 C ATOM 0 H THR A 19 -3.485 4.649 -1.285 1.00 0.00 H new ATOM 0 HA THR A 19 -3.455 7.440 -2.088 1.00 0.00 H new ATOM 0 HB THR A 19 -1.499 5.138 -2.438 1.00 0.00 H new ATOM 0 HG1 THR A 19 -0.729 7.429 -1.064 1.00 0.00 H new ATOM 0 HG21 THR A 19 0.102 6.822 -3.267 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.309 6.670 -4.341 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.181 8.054 -3.229 1.00 0.00 H new ATOM 218 N ILE A 20 -4.013 4.950 -4.143 1.00 0.00 N ATOM 219 CA ILE A 20 -4.457 4.604 -5.488 1.00 0.00 C ATOM 220 C ILE A 20 -5.962 4.795 -5.636 1.00 0.00 C ATOM 221 O ILE A 20 -6.436 5.329 -6.639 1.00 0.00 O ATOM 222 CB ILE A 20 -4.098 3.149 -5.842 1.00 0.00 C ATOM 223 CG1 ILE A 20 -2.579 2.982 -5.929 1.00 0.00 C ATOM 224 CG2 ILE A 20 -4.756 2.746 -7.153 1.00 0.00 C ATOM 225 CD1 ILE A 20 -2.102 1.596 -5.558 1.00 0.00 C ATOM 0 H ILE A 20 -3.995 4.167 -3.490 1.00 0.00 H new ATOM 0 HA ILE A 20 -3.939 5.275 -6.174 1.00 0.00 H new ATOM 0 HB ILE A 20 -4.472 2.496 -5.054 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -2.254 3.210 -6.944 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -2.103 3.709 -5.271 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -4.493 1.715 -7.390 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -5.838 2.832 -7.058 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -4.409 3.402 -7.951 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -1.016 1.550 -5.642 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -2.396 1.372 -4.533 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -2.549 0.865 -6.231 1.00 0.00 H new ATOM 237 N CYS A 21 -6.711 4.357 -4.629 1.00 0.00 N ATOM 238 CA CYS A 21 -8.163 4.480 -4.645 1.00 0.00 C ATOM 239 C CYS A 21 -8.594 5.891 -4.253 1.00 0.00 C ATOM 240 O CYS A 21 -9.423 6.507 -4.923 1.00 0.00 O ATOM 241 CB CYS A 21 -8.793 3.460 -3.694 1.00 0.00 C ATOM 242 SG CYS A 21 -8.100 1.782 -3.840 1.00 0.00 S ATOM 0 H CYS A 21 -6.335 3.913 -3.791 1.00 0.00 H new ATOM 0 HA CYS A 21 -8.508 4.282 -5.660 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -8.664 3.807 -2.669 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -9.866 3.417 -3.883 1.00 0.00 H new ATOM 247 N HIS A 22 -8.024 6.396 -3.164 1.00 0.00 N ATOM 248 CA HIS A 22 -8.347 7.735 -2.683 1.00 0.00 C ATOM 249 C HIS A 22 -9.810 7.820 -2.256 1.00 0.00 C ATOM 250 O HIS A 22 -10.480 8.822 -2.502 1.00 0.00 O ATOM 251 CB HIS A 22 -8.060 8.773 -3.768 1.00 0.00 C ATOM 252 CG HIS A 22 -7.917 10.167 -3.240 1.00 0.00 C ATOM 253 ND1 HIS A 22 -8.517 11.260 -3.829 1.00 0.00 N ATOM 254 CD2 HIS A 22 -7.238 10.643 -2.170 1.00 0.00 C ATOM 255 CE1 HIS A 22 -8.212 12.349 -3.145 1.00 0.00 C ATOM 256 NE2 HIS A 22 -7.437 12.002 -2.133 1.00 0.00 N ATOM 0 H HIS A 22 -7.336 5.899 -2.598 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.720 7.944 -1.816 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -7.145 8.496 -4.291 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -8.866 8.752 -4.502 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -6.649 10.063 -1.475 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -8.540 13.352 -3.374 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -7.049 12.639 -1.437 1.00 0.00 H new ATOM 264 N GLU A 23 -10.297 6.761 -1.616 1.00 0.00 N ATOM 265 CA GLU A 23 -11.680 6.717 -1.157 1.00 0.00 C ATOM 266 C GLU A 23 -11.749 6.400 0.334 1.00 0.00 C ATOM 267 O GLU A 23 -12.006 7.280 1.155 1.00 0.00 O ATOM 268 CB GLU A 23 -12.470 5.672 -1.948 1.00 0.00 C ATOM 269 CG GLU A 23 -12.651 6.028 -3.414 1.00 0.00 C ATOM 270 CD GLU A 23 -13.716 5.188 -4.092 1.00 0.00 C ATOM 271 OE1 GLU A 23 -14.819 5.055 -3.520 1.00 0.00 O ATOM 272 OE2 GLU A 23 -13.447 4.663 -5.192 1.00 0.00 O ATOM 0 H GLU A 23 -9.755 5.923 -1.404 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.122 7.699 -1.323 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.959 4.712 -1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -13.451 5.546 -1.489 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -12.917 7.082 -3.498 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -11.703 5.896 -3.936 1.00 0.00 H new ATOM 279 N ARG A 24 -11.517 5.137 0.676 1.00 0.00 N ATOM 280 CA ARG A 24 -11.554 4.702 2.067 1.00 0.00 C ATOM 281 C ARG A 24 -10.607 3.528 2.295 1.00 0.00 C ATOM 282 O ARG A 24 -10.194 2.857 1.349 1.00 0.00 O ATOM 283 CB ARG A 24 -12.978 4.307 2.462 1.00 0.00 C ATOM 284 CG ARG A 24 -13.837 5.481 2.902 1.00 0.00 C ATOM 285 CD ARG A 24 -13.322 6.095 4.195 1.00 0.00 C ATOM 286 NE ARG A 24 -14.261 7.065 4.752 1.00 0.00 N ATOM 287 CZ ARG A 24 -15.327 6.728 5.470 1.00 0.00 C ATOM 288 NH1 ARG A 24 -15.587 5.451 5.717 1.00 0.00 N ATOM 289 NH2 ARG A 24 -16.134 7.668 5.943 1.00 0.00 N ATOM 0 H ARG A 24 -11.301 4.397 0.008 1.00 0.00 H new ATOM 0 HA ARG A 24 -11.229 5.535 2.691 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -13.457 3.814 1.616 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -12.932 3.578 3.271 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -13.849 6.238 2.118 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -14.866 5.149 3.040 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -13.141 5.305 4.924 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.365 6.582 4.009 1.00 0.00 H new ATOM 0 HE ARG A 24 -14.089 8.056 4.580 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -14.968 4.725 5.356 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -16.406 5.195 6.268 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -15.937 8.651 5.756 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -16.952 7.408 6.494 1.00 0.00 H new ATOM 303 N LEU A 25 -10.266 3.286 3.556 1.00 0.00 N ATOM 304 CA LEU A 25 -9.367 2.194 3.910 1.00 0.00 C ATOM 305 C LEU A 25 -9.960 1.340 5.026 1.00 0.00 C ATOM 306 O LEU A 25 -10.094 1.793 6.162 1.00 0.00 O ATOM 307 CB LEU A 25 -8.007 2.745 4.342 1.00 0.00 C ATOM 308 CG LEU A 25 -7.000 3.003 3.221 1.00 0.00 C ATOM 309 CD1 LEU A 25 -5.771 3.717 3.761 1.00 0.00 C ATOM 310 CD2 LEU A 25 -6.607 1.696 2.547 1.00 0.00 C ATOM 0 H LEU A 25 -10.599 3.832 4.351 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.234 1.566 3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -8.170 3.680 4.879 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.562 2.045 5.049 1.00 0.00 H new ATOM 0 HG LEU A 25 -7.470 3.646 2.477 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.066 3.892 2.949 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.067 4.671 4.197 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.298 3.100 4.525 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.890 1.898 1.752 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.156 1.029 3.282 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.494 1.224 2.124 1.00 0.00 H new ATOM 322 N GLU A 26 -10.311 0.101 4.694 1.00 0.00 N ATOM 323 CA GLU A 26 -10.888 -0.816 5.669 1.00 0.00 C ATOM 324 C GLU A 26 -10.287 -0.588 7.053 1.00 0.00 C ATOM 325 O GLU A 26 -11.001 -0.288 8.010 1.00 0.00 O ATOM 326 CB GLU A 26 -10.661 -2.266 5.236 1.00 0.00 C ATOM 327 CG GLU A 26 -9.269 -2.526 4.685 1.00 0.00 C ATOM 328 CD GLU A 26 -9.221 -3.730 3.764 1.00 0.00 C ATOM 329 OE1 GLU A 26 -9.845 -4.758 4.099 1.00 0.00 O ATOM 330 OE2 GLU A 26 -8.559 -3.642 2.709 1.00 0.00 O ATOM 0 H GLU A 26 -10.206 -0.290 3.758 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.960 -0.623 5.720 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.833 -2.922 6.089 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.398 -2.529 4.477 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.927 -1.645 4.143 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.577 -2.679 5.513 1.00 0.00 H new ATOM 337 N ASP A 27 -8.970 -0.733 7.151 1.00 0.00 N ATOM 338 CA ASP A 27 -8.271 -0.542 8.417 1.00 0.00 C ATOM 339 C ASP A 27 -6.762 -0.649 8.226 1.00 0.00 C ATOM 340 O ASP A 27 -6.283 -0.955 7.133 1.00 0.00 O ATOM 341 CB ASP A 27 -8.743 -1.572 9.444 1.00 0.00 C ATOM 342 CG ASP A 27 -9.186 -2.871 8.800 1.00 0.00 C ATOM 343 OD1 ASP A 27 -8.636 -3.224 7.735 1.00 0.00 O ATOM 344 OD2 ASP A 27 -10.082 -3.536 9.361 1.00 0.00 O ATOM 0 H ASP A 27 -8.365 -0.982 6.369 1.00 0.00 H new ATOM 0 HA ASP A 27 -8.502 0.458 8.785 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.936 -1.776 10.148 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -9.569 -1.155 10.019 1.00 0.00 H new ATOM 349 N THR A 28 -6.015 -0.394 9.296 1.00 0.00 N ATOM 350 CA THR A 28 -4.560 -0.460 9.246 1.00 0.00 C ATOM 351 C THR A 28 -4.091 -1.608 8.360 1.00 0.00 C ATOM 352 O THR A 28 -3.014 -1.548 7.767 1.00 0.00 O ATOM 353 CB THR A 28 -3.957 -0.633 10.653 1.00 0.00 C ATOM 354 OG1 THR A 28 -2.528 -0.670 10.572 1.00 0.00 O ATOM 355 CG2 THR A 28 -4.466 -1.909 11.306 1.00 0.00 C ATOM 0 H THR A 28 -6.394 -0.140 10.208 1.00 0.00 H new ATOM 0 HA THR A 28 -4.216 0.484 8.824 1.00 0.00 H new ATOM 0 HB THR A 28 -4.264 0.216 11.263 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.152 -0.779 11.471 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.027 -2.010 12.298 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.552 -1.865 11.392 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.185 -2.767 10.696 1.00 0.00 H new ATOM 363 N HIS A 29 -4.908 -2.653 8.272 1.00 0.00 N ATOM 364 CA HIS A 29 -4.577 -3.816 7.456 1.00 0.00 C ATOM 365 C HIS A 29 -3.915 -3.391 6.148 1.00 0.00 C ATOM 366 O HIS A 29 -2.975 -4.033 5.679 1.00 0.00 O ATOM 367 CB HIS A 29 -5.835 -4.634 7.161 1.00 0.00 C ATOM 368 CG HIS A 29 -6.192 -5.595 8.252 1.00 0.00 C ATOM 369 ND1 HIS A 29 -7.345 -5.489 9.002 1.00 0.00 N ATOM 370 CD2 HIS A 29 -5.543 -6.688 8.718 1.00 0.00 C ATOM 371 CE1 HIS A 29 -7.388 -6.473 9.882 1.00 0.00 C ATOM 372 NE2 HIS A 29 -6.306 -7.215 9.730 1.00 0.00 N ATOM 0 H HIS A 29 -5.804 -2.718 8.756 1.00 0.00 H new ATOM 0 HA HIS A 29 -3.874 -4.433 8.016 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -6.671 -3.954 6.999 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -5.690 -5.187 6.233 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -4.600 -7.074 8.360 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -8.174 -6.642 10.603 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -6.075 -8.045 10.276 1.00 0.00 H new ATOM 380 N PHE A 30 -4.412 -2.305 5.564 1.00 0.00 N ATOM 381 CA PHE A 30 -3.870 -1.796 4.310 1.00 0.00 C ATOM 382 C PHE A 30 -2.348 -1.702 4.374 1.00 0.00 C ATOM 383 O PHE A 30 -1.771 -1.507 5.444 1.00 0.00 O ATOM 384 CB PHE A 30 -4.465 -0.422 3.994 1.00 0.00 C ATOM 385 CG PHE A 30 -3.833 0.698 4.771 1.00 0.00 C ATOM 386 CD1 PHE A 30 -2.580 1.178 4.425 1.00 0.00 C ATOM 387 CD2 PHE A 30 -4.492 1.270 5.847 1.00 0.00 C ATOM 388 CE1 PHE A 30 -1.996 2.209 5.138 1.00 0.00 C ATOM 389 CE2 PHE A 30 -3.914 2.301 6.563 1.00 0.00 C ATOM 390 CZ PHE A 30 -2.664 2.770 6.209 1.00 0.00 C ATOM 0 H PHE A 30 -5.189 -1.761 5.939 1.00 0.00 H new ATOM 0 HA PHE A 30 -4.140 -2.492 3.516 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -4.353 -0.223 2.928 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -5.534 -0.441 4.204 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -2.053 0.742 3.589 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.469 0.906 6.130 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.019 2.575 4.858 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -4.439 2.740 7.399 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.210 3.574 6.769 1.00 0.00 H new ATOM 400 N VAL A 31 -1.704 -1.842 3.220 1.00 0.00 N ATOM 401 CA VAL A 31 -0.250 -1.772 3.143 1.00 0.00 C ATOM 402 C VAL A 31 0.235 -0.327 3.194 1.00 0.00 C ATOM 403 O VAL A 31 -0.067 0.470 2.307 1.00 0.00 O ATOM 404 CB VAL A 31 0.276 -2.433 1.855 1.00 0.00 C ATOM 405 CG1 VAL A 31 1.797 -2.399 1.819 1.00 0.00 C ATOM 406 CG2 VAL A 31 -0.236 -3.861 1.742 1.00 0.00 C ATOM 0 H VAL A 31 -2.166 -2.005 2.325 1.00 0.00 H new ATOM 0 HA VAL A 31 0.139 -2.313 4.006 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.096 -1.869 1.000 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.150 -2.870 0.902 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.139 -1.364 1.850 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.193 -2.938 2.680 1.00 0.00 H new ATOM 0 HG21 VAL A 31 0.145 -4.313 0.826 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.105 -4.439 2.601 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.326 -3.856 1.718 1.00 0.00 H new ATOM 416 N GLN A 32 0.988 0.002 4.239 1.00 0.00 N ATOM 417 CA GLN A 32 1.514 1.351 4.405 1.00 0.00 C ATOM 418 C GLN A 32 3.031 1.367 4.250 1.00 0.00 C ATOM 419 O GLN A 32 3.745 0.643 4.946 1.00 0.00 O ATOM 420 CB GLN A 32 1.124 1.908 5.776 1.00 0.00 C ATOM 421 CG GLN A 32 1.032 3.424 5.813 1.00 0.00 C ATOM 422 CD GLN A 32 2.387 4.089 5.954 1.00 0.00 C ATOM 423 OE1 GLN A 32 3.146 3.787 6.876 1.00 0.00 O ATOM 424 NE2 GLN A 32 2.699 4.999 5.039 1.00 0.00 N ATOM 0 H GLN A 32 1.247 -0.647 4.982 1.00 0.00 H new ATOM 0 HA GLN A 32 1.081 1.981 3.628 1.00 0.00 H new ATOM 0 HB2 GLN A 32 0.163 1.487 6.070 1.00 0.00 H new ATOM 0 HB3 GLN A 32 1.855 1.579 6.514 1.00 0.00 H new ATOM 0 HG2 GLN A 32 0.552 3.777 4.900 1.00 0.00 H new ATOM 0 HG3 GLN A 32 0.396 3.725 6.645 1.00 0.00 H new ATOM 0 HE21 GLN A 32 2.040 5.218 4.292 1.00 0.00 H new ATOM 0 HE22 GLN A 32 3.598 5.479 5.083 1.00 0.00 H new ATOM 433 N CYS A 33 3.519 2.196 3.333 1.00 0.00 N ATOM 434 CA CYS A 33 4.951 2.306 3.085 1.00 0.00 C ATOM 435 C CYS A 33 5.705 2.607 4.377 1.00 0.00 C ATOM 436 O CYS A 33 5.412 3.570 5.087 1.00 0.00 O ATOM 437 CB CYS A 33 5.229 3.400 2.053 1.00 0.00 C ATOM 438 SG CYS A 33 6.687 3.084 1.008 1.00 0.00 S ATOM 0 H CYS A 33 2.943 2.802 2.749 1.00 0.00 H new ATOM 0 HA CYS A 33 5.301 1.350 2.694 1.00 0.00 H new ATOM 0 HB2 CYS A 33 4.354 3.511 1.413 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.367 4.348 2.573 1.00 0.00 H new ATOM 443 N PRO A 34 6.701 1.765 4.691 1.00 0.00 N ATOM 444 CA PRO A 34 7.519 1.921 5.898 1.00 0.00 C ATOM 445 C PRO A 34 8.438 3.136 5.823 1.00 0.00 C ATOM 446 O PRO A 34 9.134 3.459 6.785 1.00 0.00 O ATOM 447 CB PRO A 34 8.341 0.630 5.939 1.00 0.00 C ATOM 448 CG PRO A 34 8.407 0.178 4.521 1.00 0.00 C ATOM 449 CD PRO A 34 7.106 0.597 3.892 1.00 0.00 C ATOM 0 HA PRO A 34 6.908 2.082 6.786 1.00 0.00 H new ATOM 0 HB2 PRO A 34 9.337 0.808 6.345 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.868 -0.121 6.572 1.00 0.00 H new ATOM 0 HG2 PRO A 34 9.254 0.632 4.006 1.00 0.00 H new ATOM 0 HG3 PRO A 34 8.539 -0.902 4.461 1.00 0.00 H new ATOM 0 HD2 PRO A 34 7.233 0.854 2.840 1.00 0.00 H new ATOM 0 HD3 PRO A 34 6.363 -0.199 3.938 1.00 0.00 H new ATOM 457 N SER A 35 8.434 3.805 4.674 1.00 0.00 N ATOM 458 CA SER A 35 9.270 4.982 4.473 1.00 0.00 C ATOM 459 C SER A 35 8.419 6.201 4.128 1.00 0.00 C ATOM 460 O SER A 35 8.709 7.317 4.557 1.00 0.00 O ATOM 461 CB SER A 35 10.289 4.726 3.361 1.00 0.00 C ATOM 462 OG SER A 35 9.649 4.294 2.173 1.00 0.00 O ATOM 0 H SER A 35 7.861 3.552 3.869 1.00 0.00 H new ATOM 0 HA SER A 35 9.801 5.183 5.403 1.00 0.00 H new ATOM 0 HB2 SER A 35 10.853 5.638 3.163 1.00 0.00 H new ATOM 0 HB3 SER A 35 11.006 3.972 3.687 1.00 0.00 H new ATOM 0 HG SER A 35 10.091 3.486 1.839 1.00 0.00 H new ATOM 468 N VAL A 36 7.365 5.977 3.348 1.00 0.00 N ATOM 469 CA VAL A 36 6.470 7.055 2.945 1.00 0.00 C ATOM 470 C VAL A 36 5.141 6.972 3.688 1.00 0.00 C ATOM 471 O VAL A 36 4.419 5.978 3.610 1.00 0.00 O ATOM 472 CB VAL A 36 6.201 7.023 1.429 1.00 0.00 C ATOM 473 CG1 VAL A 36 5.339 8.206 1.015 1.00 0.00 C ATOM 474 CG2 VAL A 36 7.511 7.011 0.656 1.00 0.00 C ATOM 0 H VAL A 36 7.111 5.059 2.983 1.00 0.00 H new ATOM 0 HA VAL A 36 6.967 7.991 3.199 1.00 0.00 H new ATOM 0 HB VAL A 36 5.658 6.108 1.193 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.159 8.167 -0.059 1.00 0.00 H new ATOM 0 HG12 VAL A 36 4.387 8.165 1.544 1.00 0.00 H new ATOM 0 HG13 VAL A 36 5.852 9.135 1.263 1.00 0.00 H new ATOM 0 HG21 VAL A 36 7.302 6.988 -0.414 1.00 0.00 H new ATOM 0 HG22 VAL A 36 8.083 7.908 0.895 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.088 6.128 0.932 1.00 0.00 H new ATOM 484 N PRO A 37 4.808 8.041 4.426 1.00 0.00 N ATOM 485 CA PRO A 37 3.563 8.115 5.196 1.00 0.00 C ATOM 486 C PRO A 37 2.334 8.227 4.302 1.00 0.00 C ATOM 487 O PRO A 37 1.303 7.608 4.566 1.00 0.00 O ATOM 488 CB PRO A 37 3.737 9.387 6.030 1.00 0.00 C ATOM 489 CG PRO A 37 4.691 10.224 5.250 1.00 0.00 C ATOM 490 CD PRO A 37 5.621 9.261 4.565 1.00 0.00 C ATOM 0 HA PRO A 37 3.398 7.217 5.792 1.00 0.00 H new ATOM 0 HB2 PRO A 37 2.786 9.900 6.173 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.129 9.160 7.021 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.164 10.842 4.523 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.242 10.900 5.904 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.948 9.639 3.596 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.519 9.080 5.156 1.00 0.00 H new ATOM 498 N SER A 38 2.449 9.021 3.242 1.00 0.00 N ATOM 499 CA SER A 38 1.345 9.217 2.310 1.00 0.00 C ATOM 500 C SER A 38 0.978 7.907 1.619 1.00 0.00 C ATOM 501 O SER A 38 -0.197 7.559 1.506 1.00 0.00 O ATOM 502 CB SER A 38 1.712 10.273 1.266 1.00 0.00 C ATOM 503 OG SER A 38 2.616 9.749 0.308 1.00 0.00 O ATOM 0 H SER A 38 3.296 9.539 3.007 1.00 0.00 H new ATOM 0 HA SER A 38 0.481 9.563 2.877 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.809 10.624 0.766 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.159 11.136 1.759 1.00 0.00 H new ATOM 0 HG SER A 38 2.834 10.442 -0.349 1.00 0.00 H new ATOM 509 N HIS A 39 1.994 7.185 1.157 1.00 0.00 N ATOM 510 CA HIS A 39 1.781 5.913 0.476 1.00 0.00 C ATOM 511 C HIS A 39 0.889 4.995 1.307 1.00 0.00 C ATOM 512 O HIS A 39 1.304 4.483 2.347 1.00 0.00 O ATOM 513 CB HIS A 39 3.119 5.227 0.199 1.00 0.00 C ATOM 514 CG HIS A 39 3.772 5.680 -1.070 1.00 0.00 C ATOM 515 ND1 HIS A 39 5.071 5.359 -1.405 1.00 0.00 N ATOM 516 CD2 HIS A 39 3.298 6.433 -2.091 1.00 0.00 C ATOM 517 CE1 HIS A 39 5.367 5.895 -2.575 1.00 0.00 C ATOM 518 NE2 HIS A 39 4.308 6.552 -3.013 1.00 0.00 N ATOM 0 H HIS A 39 2.973 7.459 1.242 1.00 0.00 H new ATOM 0 HA HIS A 39 1.283 6.116 -0.472 1.00 0.00 H new ATOM 0 HB2 HIS A 39 3.795 5.416 1.033 1.00 0.00 H new ATOM 0 HB3 HIS A 39 2.963 4.149 0.153 1.00 0.00 H new ATOM 0 HD2 HIS A 39 2.309 6.860 -2.166 1.00 0.00 H new ATOM 0 HE1 HIS A 39 6.314 5.811 -3.087 1.00 0.00 H new ATOM 0 HE2 HIS A 39 4.250 7.064 -3.893 1.00 0.00 H new ATOM 526 N LYS A 40 -0.339 4.793 0.842 1.00 0.00 N ATOM 527 CA LYS A 40 -1.291 3.937 1.541 1.00 0.00 C ATOM 528 C LYS A 40 -2.005 3.007 0.565 1.00 0.00 C ATOM 529 O LYS A 40 -3.089 3.321 0.074 1.00 0.00 O ATOM 530 CB LYS A 40 -2.316 4.788 2.294 1.00 0.00 C ATOM 531 CG LYS A 40 -1.845 5.236 3.666 1.00 0.00 C ATOM 532 CD LYS A 40 -2.869 6.131 4.343 1.00 0.00 C ATOM 533 CE LYS A 40 -2.614 7.599 4.039 1.00 0.00 C ATOM 534 NZ LYS A 40 -3.874 8.394 4.049 1.00 0.00 N ATOM 0 H LYS A 40 -0.699 5.210 -0.016 1.00 0.00 H new ATOM 0 HA LYS A 40 -0.737 3.329 2.256 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -2.555 5.668 1.696 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.238 4.218 2.404 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -1.655 4.362 4.290 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.900 5.771 3.570 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -3.870 5.858 4.009 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.838 5.971 5.421 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -1.921 8.007 4.775 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -2.135 7.690 3.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -3.658 9.389 3.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -4.526 8.021 3.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.319 8.328 4.987 1.00 0.00 H new ATOM 548 N PHE A 41 -1.391 1.861 0.290 1.00 0.00 N ATOM 549 CA PHE A 41 -1.968 0.885 -0.627 1.00 0.00 C ATOM 550 C PHE A 41 -2.643 -0.249 0.140 1.00 0.00 C ATOM 551 O PHE A 41 -2.033 -0.877 1.006 1.00 0.00 O ATOM 552 CB PHE A 41 -0.887 0.319 -1.550 1.00 0.00 C ATOM 553 CG PHE A 41 0.227 1.286 -1.832 1.00 0.00 C ATOM 554 CD1 PHE A 41 0.151 2.156 -2.908 1.00 0.00 C ATOM 555 CD2 PHE A 41 1.349 1.326 -1.021 1.00 0.00 C ATOM 556 CE1 PHE A 41 1.175 3.047 -3.170 1.00 0.00 C ATOM 557 CE2 PHE A 41 2.377 2.214 -1.278 1.00 0.00 C ATOM 558 CZ PHE A 41 2.288 3.077 -2.353 1.00 0.00 C ATOM 0 H PHE A 41 -0.494 1.585 0.689 1.00 0.00 H new ATOM 0 HA PHE A 41 -2.722 1.391 -1.230 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -0.470 -0.581 -1.099 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -1.345 0.020 -2.493 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -0.718 2.138 -3.549 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.422 0.655 -0.178 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.105 3.719 -4.013 1.00 0.00 H new ATOM 0 HE2 PHE A 41 3.248 2.233 -0.640 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.088 3.774 -2.554 1.00 0.00 H new ATOM 568 N CYS A 42 -3.906 -0.505 -0.183 1.00 0.00 N ATOM 569 CA CYS A 42 -4.665 -1.561 0.474 1.00 0.00 C ATOM 570 C CYS A 42 -4.367 -2.919 -0.156 1.00 0.00 C ATOM 571 O CYS A 42 -3.494 -3.037 -1.017 1.00 0.00 O ATOM 572 CB CYS A 42 -6.164 -1.267 0.392 1.00 0.00 C ATOM 573 SG CYS A 42 -6.728 -0.733 -1.256 1.00 0.00 S ATOM 0 H CYS A 42 -4.426 0.006 -0.897 1.00 0.00 H new ATOM 0 HA CYS A 42 -4.364 -1.592 1.521 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -6.715 -2.162 0.681 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -6.412 -0.492 1.118 1.00 0.00 H new ATOM 578 N PHE A 43 -5.097 -3.940 0.278 1.00 0.00 N ATOM 579 CA PHE A 43 -4.911 -5.289 -0.242 1.00 0.00 C ATOM 580 C PHE A 43 -5.119 -5.323 -1.753 1.00 0.00 C ATOM 581 O PHE A 43 -4.267 -5.784 -2.513 1.00 0.00 O ATOM 582 CB PHE A 43 -5.879 -6.260 0.439 1.00 0.00 C ATOM 583 CG PHE A 43 -5.336 -6.858 1.705 1.00 0.00 C ATOM 584 CD1 PHE A 43 -4.455 -6.145 2.502 1.00 0.00 C ATOM 585 CD2 PHE A 43 -5.707 -8.134 2.098 1.00 0.00 C ATOM 586 CE1 PHE A 43 -3.954 -6.694 3.666 1.00 0.00 C ATOM 587 CE2 PHE A 43 -5.209 -8.688 3.262 1.00 0.00 C ATOM 588 CZ PHE A 43 -4.332 -7.967 4.048 1.00 0.00 C ATOM 0 H PHE A 43 -5.824 -3.859 0.989 1.00 0.00 H new ATOM 0 HA PHE A 43 -3.888 -5.596 -0.026 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -6.808 -5.737 0.663 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -6.125 -7.063 -0.256 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -4.157 -5.149 2.210 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -6.393 -8.702 1.488 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -3.267 -6.128 4.278 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -5.505 -9.684 3.557 1.00 0.00 H new ATOM 0 HZ PHE A 43 -3.943 -8.397 4.959 1.00 0.00 H new ATOM 598 N PRO A 44 -6.280 -4.822 -2.202 1.00 0.00 N ATOM 599 CA PRO A 44 -6.628 -4.783 -3.625 1.00 0.00 C ATOM 600 C PRO A 44 -5.782 -3.779 -4.401 1.00 0.00 C ATOM 601 O PRO A 44 -6.160 -3.344 -5.490 1.00 0.00 O ATOM 602 CB PRO A 44 -8.097 -4.354 -3.620 1.00 0.00 C ATOM 603 CG PRO A 44 -8.268 -3.604 -2.343 1.00 0.00 C ATOM 604 CD PRO A 44 -7.342 -4.256 -1.354 1.00 0.00 C ATOM 0 HA PRO A 44 -6.452 -5.741 -4.114 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -8.330 -3.728 -4.481 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.762 -5.217 -3.665 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -8.021 -2.550 -2.473 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -9.301 -3.649 -1.999 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -6.944 -3.535 -0.640 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -7.850 -5.029 -0.777 1.00 0.00 H new ATOM 612 N CYS A 45 -4.637 -3.414 -3.835 1.00 0.00 N ATOM 613 CA CYS A 45 -3.737 -2.461 -4.473 1.00 0.00 C ATOM 614 C CYS A 45 -2.327 -3.034 -4.582 1.00 0.00 C ATOM 615 O CYS A 45 -1.579 -2.700 -5.502 1.00 0.00 O ATOM 616 CB CYS A 45 -3.707 -1.150 -3.686 1.00 0.00 C ATOM 617 SG CYS A 45 -4.908 0.092 -4.265 1.00 0.00 S ATOM 0 H CYS A 45 -4.310 -3.764 -2.935 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.109 -2.265 -5.478 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.901 -1.365 -2.635 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -2.705 -0.726 -3.745 1.00 0.00 H new ATOM 622 N SER A 46 -1.970 -3.898 -3.637 1.00 0.00 N ATOM 623 CA SER A 46 -0.649 -4.514 -3.625 1.00 0.00 C ATOM 624 C SER A 46 -0.594 -5.701 -4.582 1.00 0.00 C ATOM 625 O SER A 46 0.344 -5.835 -5.369 1.00 0.00 O ATOM 626 CB SER A 46 -0.288 -4.969 -2.209 1.00 0.00 C ATOM 627 OG SER A 46 0.381 -3.942 -1.498 1.00 0.00 O ATOM 0 H SER A 46 -2.577 -4.187 -2.870 1.00 0.00 H new ATOM 0 HA SER A 46 0.075 -3.769 -3.956 1.00 0.00 H new ATOM 0 HB2 SER A 46 -1.193 -5.256 -1.674 1.00 0.00 H new ATOM 0 HB3 SER A 46 0.347 -5.854 -2.259 1.00 0.00 H new ATOM 0 HG SER A 46 1.291 -4.234 -1.281 1.00 0.00 H new ATOM 633 N ARG A 47 -1.605 -6.560 -4.508 1.00 0.00 N ATOM 634 CA ARG A 47 -1.672 -7.737 -5.367 1.00 0.00 C ATOM 635 C ARG A 47 -1.339 -7.375 -6.811 1.00 0.00 C ATOM 636 O ARG A 47 -0.350 -7.852 -7.367 1.00 0.00 O ATOM 637 CB ARG A 47 -3.064 -8.367 -5.295 1.00 0.00 C ATOM 638 CG ARG A 47 -3.528 -8.661 -3.878 1.00 0.00 C ATOM 639 CD ARG A 47 -4.928 -9.255 -3.862 1.00 0.00 C ATOM 640 NE ARG A 47 -5.805 -8.616 -4.839 1.00 0.00 N ATOM 641 CZ ARG A 47 -5.887 -8.994 -6.110 1.00 0.00 C ATOM 642 NH1 ARG A 47 -5.149 -10.002 -6.555 1.00 0.00 N ATOM 643 NH2 ARG A 47 -6.708 -8.363 -6.940 1.00 0.00 N ATOM 0 H ARG A 47 -2.389 -6.464 -3.863 1.00 0.00 H new ATOM 0 HA ARG A 47 -0.935 -8.458 -5.013 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.781 -7.698 -5.771 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.064 -9.294 -5.868 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -2.833 -9.353 -3.402 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -3.515 -7.742 -3.292 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.871 -10.323 -4.070 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -5.356 -9.147 -2.865 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.386 -7.837 -4.529 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.516 -10.490 -5.921 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -5.214 -10.290 -7.531 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.277 -7.587 -6.602 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -6.770 -8.654 -7.916 1.00 0.00 H new ATOM 657 N GLU A 48 -2.172 -6.531 -7.412 1.00 0.00 N ATOM 658 CA GLU A 48 -1.966 -6.108 -8.792 1.00 0.00 C ATOM 659 C GLU A 48 -0.495 -5.794 -9.051 1.00 0.00 C ATOM 660 O GLU A 48 -0.003 -5.952 -10.168 1.00 0.00 O ATOM 661 CB GLU A 48 -2.824 -4.881 -9.106 1.00 0.00 C ATOM 662 CG GLU A 48 -4.300 -5.199 -9.279 1.00 0.00 C ATOM 663 CD GLU A 48 -4.539 -6.378 -10.202 1.00 0.00 C ATOM 664 OE1 GLU A 48 -3.767 -6.539 -11.171 1.00 0.00 O ATOM 665 OE2 GLU A 48 -5.498 -7.139 -9.956 1.00 0.00 O ATOM 0 H GLU A 48 -2.995 -6.127 -6.965 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.265 -6.928 -9.445 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -2.709 -4.153 -8.303 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.453 -4.412 -10.017 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -4.739 -5.411 -8.304 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -4.813 -4.322 -9.675 1.00 0.00 H new ATOM 672 N SER A 49 0.200 -5.347 -8.010 1.00 0.00 N ATOM 673 CA SER A 49 1.613 -5.005 -8.124 1.00 0.00 C ATOM 674 C SER A 49 2.488 -6.239 -7.920 1.00 0.00 C ATOM 675 O SER A 49 3.585 -6.333 -8.473 1.00 0.00 O ATOM 676 CB SER A 49 1.984 -3.929 -7.103 1.00 0.00 C ATOM 677 OG SER A 49 1.600 -2.642 -7.556 1.00 0.00 O ATOM 0 H SER A 49 -0.192 -5.213 -7.078 1.00 0.00 H new ATOM 0 HA SER A 49 1.788 -4.618 -9.128 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.498 -4.143 -6.151 1.00 0.00 H new ATOM 0 HB3 SER A 49 3.059 -3.949 -6.923 1.00 0.00 H new ATOM 0 HG SER A 49 0.966 -2.248 -6.922 1.00 0.00 H new ATOM 683 N ILE A 50 1.996 -7.181 -7.123 1.00 0.00 N ATOM 684 CA ILE A 50 2.731 -8.408 -6.847 1.00 0.00 C ATOM 685 C ILE A 50 2.764 -9.317 -8.071 1.00 0.00 C ATOM 686 O ILE A 50 3.755 -10.002 -8.324 1.00 0.00 O ATOM 687 CB ILE A 50 2.115 -9.180 -5.665 1.00 0.00 C ATOM 688 CG1 ILE A 50 2.163 -8.331 -4.393 1.00 0.00 C ATOM 689 CG2 ILE A 50 2.844 -10.499 -5.456 1.00 0.00 C ATOM 690 CD1 ILE A 50 1.492 -8.984 -3.205 1.00 0.00 C ATOM 0 H ILE A 50 1.091 -7.118 -6.657 1.00 0.00 H new ATOM 0 HA ILE A 50 3.748 -8.114 -6.588 1.00 0.00 H new ATOM 0 HB ILE A 50 1.072 -9.397 -5.896 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.204 -8.123 -4.143 1.00 0.00 H new ATOM 0 HG13 ILE A 50 1.684 -7.371 -4.588 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.397 -11.033 -4.617 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.763 -11.106 -6.357 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.895 -10.304 -5.243 1.00 0.00 H new ATOM 0 HD11 ILE A 50 1.564 -8.326 -2.339 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.442 -9.167 -3.435 1.00 0.00 H new ATOM 0 HD13 ILE A 50 1.985 -9.931 -2.984 1.00 0.00 H new ATOM 702 N LYS A 51 1.673 -9.317 -8.830 1.00 0.00 N ATOM 703 CA LYS A 51 1.576 -10.139 -10.031 1.00 0.00 C ATOM 704 C LYS A 51 2.260 -9.458 -11.212 1.00 0.00 C ATOM 705 O LYS A 51 2.933 -10.110 -12.011 1.00 0.00 O ATOM 706 CB LYS A 51 0.109 -10.415 -10.367 1.00 0.00 C ATOM 707 CG LYS A 51 -0.684 -10.989 -9.206 1.00 0.00 C ATOM 708 CD LYS A 51 -1.817 -11.878 -9.689 1.00 0.00 C ATOM 709 CE LYS A 51 -3.010 -11.058 -10.155 1.00 0.00 C ATOM 710 NZ LYS A 51 -2.721 -10.330 -11.422 1.00 0.00 N ATOM 0 H LYS A 51 0.843 -8.757 -8.635 1.00 0.00 H new ATOM 0 HA LYS A 51 2.082 -11.085 -9.837 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -0.361 -9.487 -10.693 1.00 0.00 H new ATOM 0 HB3 LYS A 51 0.062 -11.109 -11.206 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -0.020 -11.563 -8.560 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -1.090 -10.176 -8.604 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -1.464 -12.506 -10.507 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.125 -12.546 -8.884 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -3.868 -11.715 -10.301 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -3.284 -10.343 -9.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.590 -10.262 -11.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -2.375 -9.374 -11.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -1.996 -10.845 -11.961 1.00 0.00 H new ATOM 724 N ALA A 52 2.085 -8.145 -11.316 1.00 0.00 N ATOM 725 CA ALA A 52 2.689 -7.377 -12.397 1.00 0.00 C ATOM 726 C ALA A 52 4.210 -7.381 -12.292 1.00 0.00 C ATOM 727 O ALA A 52 4.907 -7.672 -13.264 1.00 0.00 O ATOM 728 CB ALA A 52 2.161 -5.950 -12.389 1.00 0.00 C ATOM 0 H ALA A 52 1.530 -7.591 -10.664 1.00 0.00 H new ATOM 0 HA ALA A 52 2.416 -7.849 -13.341 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.621 -5.387 -13.202 1.00 0.00 H new ATOM 0 HB2 ALA A 52 1.079 -5.962 -12.522 1.00 0.00 H new ATOM 0 HB3 ALA A 52 2.405 -5.477 -11.438 1.00 0.00 H new ATOM 734 N GLN A 53 4.717 -7.057 -11.107 1.00 0.00 N ATOM 735 CA GLN A 53 6.156 -7.023 -10.876 1.00 0.00 C ATOM 736 C GLN A 53 6.738 -8.433 -10.852 1.00 0.00 C ATOM 737 O GLN A 53 7.534 -8.801 -11.714 1.00 0.00 O ATOM 738 CB GLN A 53 6.466 -6.308 -9.560 1.00 0.00 C ATOM 739 CG GLN A 53 6.434 -4.792 -9.669 1.00 0.00 C ATOM 740 CD GLN A 53 6.418 -4.110 -8.315 1.00 0.00 C ATOM 741 OE1 GLN A 53 7.429 -3.570 -7.866 1.00 0.00 O ATOM 742 NE2 GLN A 53 5.265 -4.131 -7.655 1.00 0.00 N ATOM 0 H GLN A 53 4.153 -6.814 -10.293 1.00 0.00 H new ATOM 0 HA GLN A 53 6.617 -6.474 -11.697 1.00 0.00 H new ATOM 0 HB2 GLN A 53 5.746 -6.625 -8.806 1.00 0.00 H new ATOM 0 HB3 GLN A 53 7.451 -6.618 -9.211 1.00 0.00 H new ATOM 0 HG2 GLN A 53 7.304 -4.454 -10.232 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.552 -4.491 -10.234 1.00 0.00 H new ATOM 0 HE21 GLN A 53 4.451 -4.590 -8.064 1.00 0.00 H new ATOM 0 HE22 GLN A 53 5.194 -3.688 -6.739 1.00 0.00 H new ATOM 751 N GLY A 54 6.333 -9.217 -9.858 1.00 0.00 N ATOM 752 CA GLY A 54 6.824 -10.578 -9.740 1.00 0.00 C ATOM 753 C GLY A 54 6.381 -11.245 -8.453 1.00 0.00 C ATOM 754 O GLY A 54 6.952 -11.001 -7.391 1.00 0.00 O ATOM 0 H GLY A 54 5.674 -8.935 -9.133 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.471 -11.163 -10.589 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.913 -10.573 -9.787 1.00 0.00 H new ATOM 758 N ALA A 55 5.358 -12.088 -8.548 1.00 0.00 N ATOM 759 CA ALA A 55 4.838 -12.792 -7.382 1.00 0.00 C ATOM 760 C ALA A 55 5.916 -13.657 -6.737 1.00 0.00 C ATOM 761 O ALA A 55 6.089 -13.646 -5.518 1.00 0.00 O ATOM 762 CB ALA A 55 3.638 -13.643 -7.771 1.00 0.00 C ATOM 0 H ALA A 55 4.873 -12.300 -9.420 1.00 0.00 H new ATOM 0 HA ALA A 55 4.520 -12.048 -6.651 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.260 -14.163 -6.891 1.00 0.00 H new ATOM 0 HB2 ALA A 55 2.855 -13.003 -8.179 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.938 -14.373 -8.523 1.00 0.00 H new ATOM 768 N THR A 56 6.639 -14.406 -7.563 1.00 0.00 N ATOM 769 CA THR A 56 7.699 -15.279 -7.073 1.00 0.00 C ATOM 770 C THR A 56 8.964 -14.486 -6.763 1.00 0.00 C ATOM 771 O THR A 56 9.632 -14.734 -5.760 1.00 0.00 O ATOM 772 CB THR A 56 8.036 -16.382 -8.095 1.00 0.00 C ATOM 773 OG1 THR A 56 8.553 -15.796 -9.295 1.00 0.00 O ATOM 774 CG2 THR A 56 6.804 -17.213 -8.420 1.00 0.00 C ATOM 0 H THR A 56 6.510 -14.426 -8.575 1.00 0.00 H new ATOM 0 HA THR A 56 7.330 -15.742 -6.158 1.00 0.00 H new ATOM 0 HB THR A 56 8.790 -17.036 -7.656 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.766 -16.503 -9.939 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.066 -17.985 -9.143 1.00 0.00 H new ATOM 0 HG22 THR A 56 6.430 -17.681 -7.509 1.00 0.00 H new ATOM 0 HG23 THR A 56 6.031 -16.569 -8.841 1.00 0.00 H new ATOM 782 N GLY A 57 9.286 -13.531 -7.630 1.00 0.00 N ATOM 783 CA GLY A 57 10.470 -12.717 -7.429 1.00 0.00 C ATOM 784 C GLY A 57 10.253 -11.620 -6.405 1.00 0.00 C ATOM 785 O GLY A 57 9.487 -11.790 -5.458 1.00 0.00 O ATOM 0 H GLY A 57 8.748 -13.307 -8.467 1.00 0.00 H new ATOM 0 HA2 GLY A 57 11.294 -13.353 -7.106 1.00 0.00 H new ATOM 0 HA3 GLY A 57 10.765 -12.270 -8.378 1.00 0.00 H new ATOM 789 N GLU A 58 10.930 -10.492 -6.596 1.00 0.00 N ATOM 790 CA GLU A 58 10.809 -9.365 -5.679 1.00 0.00 C ATOM 791 C GLU A 58 9.712 -8.407 -6.137 1.00 0.00 C ATOM 792 O GLU A 58 9.404 -8.322 -7.325 1.00 0.00 O ATOM 793 CB GLU A 58 12.141 -8.619 -5.572 1.00 0.00 C ATOM 794 CG GLU A 58 12.632 -8.058 -6.896 1.00 0.00 C ATOM 795 CD GLU A 58 14.130 -7.823 -6.910 1.00 0.00 C ATOM 796 OE1 GLU A 58 14.652 -7.269 -5.920 1.00 0.00 O ATOM 797 OE2 GLU A 58 14.779 -8.193 -7.910 1.00 0.00 O ATOM 0 H GLU A 58 11.567 -10.335 -7.377 1.00 0.00 H new ATOM 0 HA GLU A 58 10.541 -9.756 -4.697 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.034 -7.802 -4.858 1.00 0.00 H new ATOM 0 HB3 GLU A 58 12.896 -9.296 -5.171 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.369 -8.747 -7.698 1.00 0.00 H new ATOM 0 HG3 GLU A 58 12.119 -7.119 -7.101 1.00 0.00 H new ATOM 804 N VAL A 59 9.127 -7.688 -5.184 1.00 0.00 N ATOM 805 CA VAL A 59 8.066 -6.736 -5.489 1.00 0.00 C ATOM 806 C VAL A 59 8.300 -5.407 -4.779 1.00 0.00 C ATOM 807 O VAL A 59 8.132 -5.301 -3.564 1.00 0.00 O ATOM 808 CB VAL A 59 6.685 -7.285 -5.082 1.00 0.00 C ATOM 809 CG1 VAL A 59 5.612 -6.224 -5.269 1.00 0.00 C ATOM 810 CG2 VAL A 59 6.354 -8.536 -5.882 1.00 0.00 C ATOM 0 H VAL A 59 9.370 -7.747 -4.195 1.00 0.00 H new ATOM 0 HA VAL A 59 8.083 -6.578 -6.567 1.00 0.00 H new ATOM 0 HB VAL A 59 6.716 -7.553 -4.026 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.644 -6.630 -4.976 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.845 -5.358 -4.649 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.577 -5.922 -6.316 1.00 0.00 H new ATOM 0 HG21 VAL A 59 5.375 -8.911 -5.582 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.340 -8.295 -6.945 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.109 -9.299 -5.693 1.00 0.00 H new ATOM 820 N TYR A 60 8.688 -4.394 -5.546 1.00 0.00 N ATOM 821 CA TYR A 60 8.948 -3.071 -4.991 1.00 0.00 C ATOM 822 C TYR A 60 7.644 -2.318 -4.746 1.00 0.00 C ATOM 823 O TYR A 60 6.569 -2.769 -5.140 1.00 0.00 O ATOM 824 CB TYR A 60 9.845 -2.267 -5.934 1.00 0.00 C ATOM 825 CG TYR A 60 11.279 -2.743 -5.959 1.00 0.00 C ATOM 826 CD1 TYR A 60 11.581 -4.091 -6.112 1.00 0.00 C ATOM 827 CD2 TYR A 60 12.333 -1.847 -5.828 1.00 0.00 C ATOM 828 CE1 TYR A 60 12.891 -4.531 -6.135 1.00 0.00 C ATOM 829 CE2 TYR A 60 13.645 -2.278 -5.851 1.00 0.00 C ATOM 830 CZ TYR A 60 13.919 -3.621 -6.004 1.00 0.00 C ATOM 831 OH TYR A 60 15.224 -4.055 -6.026 1.00 0.00 O ATOM 0 H TYR A 60 8.829 -4.464 -6.554 1.00 0.00 H new ATOM 0 HA TYR A 60 9.458 -3.199 -4.036 1.00 0.00 H new ATOM 0 HB2 TYR A 60 9.436 -2.319 -6.943 1.00 0.00 H new ATOM 0 HB3 TYR A 60 9.824 -1.219 -5.636 1.00 0.00 H new ATOM 0 HD1 TYR A 60 10.779 -4.807 -6.215 1.00 0.00 H new ATOM 0 HD2 TYR A 60 12.123 -0.795 -5.706 1.00 0.00 H new ATOM 0 HE1 TYR A 60 13.109 -5.582 -6.255 1.00 0.00 H new ATOM 0 HE2 TYR A 60 14.452 -1.567 -5.750 1.00 0.00 H new ATOM 0 HH TYR A 60 15.243 -5.035 -6.030 1.00 0.00 H new ATOM 841 N CYS A 61 7.748 -1.166 -4.091 1.00 0.00 N ATOM 842 CA CYS A 61 6.579 -0.348 -3.792 1.00 0.00 C ATOM 843 C CYS A 61 5.551 -0.437 -4.915 1.00 0.00 C ATOM 844 O CYS A 61 5.877 -0.343 -6.098 1.00 0.00 O ATOM 845 CB CYS A 61 6.992 1.110 -3.578 1.00 0.00 C ATOM 846 SG CYS A 61 5.798 2.086 -2.609 1.00 0.00 S ATOM 0 H CYS A 61 8.630 -0.778 -3.757 1.00 0.00 H new ATOM 0 HA CYS A 61 6.125 -0.728 -2.877 1.00 0.00 H new ATOM 0 HB2 CYS A 61 7.958 1.133 -3.073 1.00 0.00 H new ATOM 0 HB3 CYS A 61 7.129 1.584 -4.550 1.00 0.00 H new ATOM 851 N PRO A 62 4.277 -0.623 -4.538 1.00 0.00 N ATOM 852 CA PRO A 62 3.174 -0.728 -5.497 1.00 0.00 C ATOM 853 C PRO A 62 2.878 0.599 -6.188 1.00 0.00 C ATOM 854 O PRO A 62 1.926 0.709 -6.960 1.00 0.00 O ATOM 855 CB PRO A 62 1.988 -1.155 -4.630 1.00 0.00 C ATOM 856 CG PRO A 62 2.319 -0.658 -3.265 1.00 0.00 C ATOM 857 CD PRO A 62 3.815 -0.744 -3.144 1.00 0.00 C ATOM 0 HA PRO A 62 3.402 -1.424 -6.304 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.056 -0.723 -4.994 1.00 0.00 H new ATOM 0 HB3 PRO A 62 1.862 -2.238 -4.637 1.00 0.00 H new ATOM 0 HG2 PRO A 62 1.975 0.367 -3.129 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.830 -1.262 -2.501 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.214 0.054 -2.518 1.00 0.00 H new ATOM 0 HD3 PRO A 62 4.129 -1.687 -2.697 1.00 0.00 H new ATOM 865 N SER A 63 3.701 1.604 -5.906 1.00 0.00 N ATOM 866 CA SER A 63 3.526 2.925 -6.498 1.00 0.00 C ATOM 867 C SER A 63 4.453 3.111 -7.695 1.00 0.00 C ATOM 868 O SER A 63 4.154 3.872 -8.614 1.00 0.00 O ATOM 869 CB SER A 63 3.793 4.013 -5.457 1.00 0.00 C ATOM 870 OG SER A 63 5.181 4.149 -5.206 1.00 0.00 O ATOM 0 H SER A 63 4.496 1.528 -5.271 1.00 0.00 H new ATOM 0 HA SER A 63 2.495 3.008 -6.843 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.389 4.963 -5.807 1.00 0.00 H new ATOM 0 HB3 SER A 63 3.275 3.769 -4.530 1.00 0.00 H new ATOM 0 HG SER A 63 5.436 3.573 -4.455 1.00 0.00 H new ATOM 876 N GLY A 64 5.582 2.409 -7.676 1.00 0.00 N ATOM 877 CA GLY A 64 6.537 2.511 -8.764 1.00 0.00 C ATOM 878 C GLY A 64 7.626 3.529 -8.487 1.00 0.00 C ATOM 879 O GLY A 64 8.145 4.157 -9.409 1.00 0.00 O ATOM 0 H GLY A 64 5.852 1.772 -6.927 1.00 0.00 H new ATOM 0 HA2 GLY A 64 6.991 1.535 -8.937 1.00 0.00 H new ATOM 0 HA3 GLY A 64 6.012 2.785 -9.679 1.00 0.00 H new ATOM 883 N GLU A 65 7.970 3.693 -7.214 1.00 0.00 N ATOM 884 CA GLU A 65 9.002 4.644 -6.819 1.00 0.00 C ATOM 885 C GLU A 65 10.201 3.924 -6.209 1.00 0.00 C ATOM 886 O GLU A 65 11.284 4.496 -6.080 1.00 0.00 O ATOM 887 CB GLU A 65 8.439 5.657 -5.819 1.00 0.00 C ATOM 888 CG GLU A 65 7.307 6.501 -6.381 1.00 0.00 C ATOM 889 CD GLU A 65 7.782 7.497 -7.420 1.00 0.00 C ATOM 890 OE1 GLU A 65 8.333 7.059 -8.452 1.00 0.00 O ATOM 891 OE2 GLU A 65 7.604 8.713 -7.203 1.00 0.00 O ATOM 0 H GLU A 65 7.550 3.180 -6.439 1.00 0.00 H new ATOM 0 HA GLU A 65 9.333 5.172 -7.713 1.00 0.00 H new ATOM 0 HB2 GLU A 65 8.081 5.125 -4.938 1.00 0.00 H new ATOM 0 HB3 GLU A 65 9.243 6.315 -5.489 1.00 0.00 H new ATOM 0 HG2 GLU A 65 6.558 5.847 -6.826 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.819 7.036 -5.566 1.00 0.00 H new ATOM 898 N LYS A 66 10.000 2.665 -5.834 1.00 0.00 N ATOM 899 CA LYS A 66 11.063 1.865 -5.238 1.00 0.00 C ATOM 900 C LYS A 66 11.566 2.503 -3.947 1.00 0.00 C ATOM 901 O LYS A 66 12.770 2.669 -3.753 1.00 0.00 O ATOM 902 CB LYS A 66 12.222 1.702 -6.225 1.00 0.00 C ATOM 903 CG LYS A 66 11.797 1.161 -7.579 1.00 0.00 C ATOM 904 CD LYS A 66 12.842 1.443 -8.645 1.00 0.00 C ATOM 905 CE LYS A 66 14.104 0.624 -8.418 1.00 0.00 C ATOM 906 NZ LYS A 66 15.221 1.071 -9.295 1.00 0.00 N ATOM 0 H LYS A 66 9.110 2.177 -5.933 1.00 0.00 H new ATOM 0 HA LYS A 66 10.655 0.882 -5.001 1.00 0.00 H new ATOM 0 HB2 LYS A 66 12.707 2.668 -6.365 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.965 1.032 -5.792 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.631 0.086 -7.506 1.00 0.00 H new ATOM 0 HG3 LYS A 66 10.848 1.611 -7.870 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.431 1.215 -9.628 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.090 2.504 -8.641 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.407 0.706 -7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.893 -0.428 -8.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 16.062 0.488 -9.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 14.942 0.969 -10.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.440 2.068 -9.097 1.00 0.00 H new ATOM 920 N CYS A 67 10.636 2.856 -3.066 1.00 0.00 N ATOM 921 CA CYS A 67 10.985 3.475 -1.793 1.00 0.00 C ATOM 922 C CYS A 67 11.820 2.526 -0.938 1.00 0.00 C ATOM 923 O CYS A 67 11.450 1.376 -0.699 1.00 0.00 O ATOM 924 CB CYS A 67 9.719 3.880 -1.035 1.00 0.00 C ATOM 925 SG CYS A 67 8.411 4.579 -2.094 1.00 0.00 S ATOM 0 H CYS A 67 9.635 2.724 -3.210 1.00 0.00 H new ATOM 0 HA CYS A 67 11.577 4.366 -2.001 1.00 0.00 H new ATOM 0 HB2 CYS A 67 9.324 3.007 -0.516 1.00 0.00 H new ATOM 0 HB3 CYS A 67 9.984 4.612 -0.272 1.00 0.00 H new ATOM 930 N PRO A 68 12.975 3.018 -0.465 1.00 0.00 N ATOM 931 CA PRO A 68 13.887 2.232 0.372 1.00 0.00 C ATOM 932 C PRO A 68 13.316 1.967 1.761 1.00 0.00 C ATOM 933 O PRO A 68 12.429 2.684 2.226 1.00 0.00 O ATOM 934 CB PRO A 68 15.133 3.115 0.464 1.00 0.00 C ATOM 935 CG PRO A 68 14.633 4.501 0.248 1.00 0.00 C ATOM 936 CD PRO A 68 13.479 4.380 -0.709 1.00 0.00 C ATOM 0 HA PRO A 68 14.078 1.245 -0.049 1.00 0.00 H new ATOM 0 HB2 PRO A 68 15.617 3.016 1.435 1.00 0.00 H new ATOM 0 HB3 PRO A 68 15.870 2.838 -0.289 1.00 0.00 H new ATOM 0 HG2 PRO A 68 14.315 4.952 1.188 1.00 0.00 H new ATOM 0 HG3 PRO A 68 15.416 5.139 -0.163 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.715 5.132 -0.514 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.799 4.511 -1.743 1.00 0.00 H new ATOM 944 N LEU A 69 13.831 0.935 2.420 1.00 0.00 N ATOM 945 CA LEU A 69 13.373 0.576 3.758 1.00 0.00 C ATOM 946 C LEU A 69 13.829 1.608 4.784 1.00 0.00 C ATOM 947 O LEU A 69 14.959 2.092 4.734 1.00 0.00 O ATOM 948 CB LEU A 69 13.897 -0.809 4.143 1.00 0.00 C ATOM 949 CG LEU A 69 13.017 -1.994 3.743 1.00 0.00 C ATOM 950 CD1 LEU A 69 13.869 -3.227 3.486 1.00 0.00 C ATOM 951 CD2 LEU A 69 11.979 -2.275 4.819 1.00 0.00 C ATOM 0 H LEU A 69 14.566 0.332 2.050 1.00 0.00 H new ATOM 0 HA LEU A 69 12.283 0.556 3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 69 14.880 -0.943 3.690 1.00 0.00 H new ATOM 0 HB3 LEU A 69 14.038 -0.835 5.224 1.00 0.00 H new ATOM 0 HG LEU A 69 12.494 -1.740 2.821 1.00 0.00 H new ATOM 0 HD11 LEU A 69 13.226 -4.061 3.203 1.00 0.00 H new ATOM 0 HD12 LEU A 69 14.573 -3.021 2.680 1.00 0.00 H new ATOM 0 HD13 LEU A 69 14.419 -3.484 4.391 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.362 -3.121 4.517 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.482 -2.509 5.757 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.348 -1.396 4.955 1.00 0.00 H new ATOM 963 N VAL A 70 12.941 1.940 5.717 1.00 0.00 N ATOM 964 CA VAL A 70 13.253 2.912 6.758 1.00 0.00 C ATOM 965 C VAL A 70 14.588 2.597 7.422 1.00 0.00 C ATOM 966 O VAL A 70 14.761 1.536 8.021 1.00 0.00 O ATOM 967 CB VAL A 70 12.153 2.952 7.835 1.00 0.00 C ATOM 968 CG1 VAL A 70 11.911 1.562 8.404 1.00 0.00 C ATOM 969 CG2 VAL A 70 12.525 3.930 8.939 1.00 0.00 C ATOM 0 H VAL A 70 12.000 1.550 5.773 1.00 0.00 H new ATOM 0 HA VAL A 70 13.313 3.887 6.274 1.00 0.00 H new ATOM 0 HB VAL A 70 11.228 3.295 7.372 1.00 0.00 H new ATOM 0 HG11 VAL A 70 11.131 1.611 9.163 1.00 0.00 H new ATOM 0 HG12 VAL A 70 11.598 0.891 7.604 1.00 0.00 H new ATOM 0 HG13 VAL A 70 12.831 1.187 8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 70 11.737 3.946 9.692 1.00 0.00 H new ATOM 0 HG22 VAL A 70 13.462 3.618 9.401 1.00 0.00 H new ATOM 0 HG23 VAL A 70 12.643 4.928 8.517 1.00 0.00 H new ATOM 979 N GLY A 71 15.532 3.527 7.311 1.00 0.00 N ATOM 980 CA GLY A 71 16.841 3.330 7.906 1.00 0.00 C ATOM 981 C GLY A 71 17.763 2.514 7.022 1.00 0.00 C ATOM 982 O GLY A 71 18.941 2.838 6.876 1.00 0.00 O ATOM 0 H GLY A 71 15.413 4.413 6.820 1.00 0.00 H new ATOM 0 HA2 GLY A 71 17.297 4.300 8.103 1.00 0.00 H new ATOM 0 HA3 GLY A 71 16.728 2.830 8.868 1.00 0.00 H new ATOM 986 N SER A 72 17.226 1.451 6.432 1.00 0.00 N ATOM 987 CA SER A 72 18.010 0.582 5.562 1.00 0.00 C ATOM 988 C SER A 72 18.108 1.166 4.157 1.00 0.00 C ATOM 989 O SER A 72 17.172 1.798 3.668 1.00 0.00 O ATOM 990 CB SER A 72 17.386 -0.814 5.504 1.00 0.00 C ATOM 991 OG SER A 72 17.671 -1.550 6.681 1.00 0.00 O ATOM 0 H SER A 72 16.251 1.171 6.541 1.00 0.00 H new ATOM 0 HA SER A 72 19.015 0.506 5.976 1.00 0.00 H new ATOM 0 HB2 SER A 72 16.307 -0.728 5.378 1.00 0.00 H new ATOM 0 HB3 SER A 72 17.767 -1.350 4.635 1.00 0.00 H new ATOM 0 HG SER A 72 17.260 -2.437 6.620 1.00 0.00 H new ATOM 997 N ASN A 73 19.250 0.951 3.512 1.00 0.00 N ATOM 998 CA ASN A 73 19.473 1.456 2.162 1.00 0.00 C ATOM 999 C ASN A 73 19.057 0.424 1.119 1.00 0.00 C ATOM 1000 O ASN A 73 19.669 0.317 0.056 1.00 0.00 O ATOM 1001 CB ASN A 73 20.945 1.827 1.970 1.00 0.00 C ATOM 1002 CG ASN A 73 21.149 2.822 0.844 1.00 0.00 C ATOM 1003 OD1 ASN A 73 21.256 2.443 -0.322 1.00 0.00 O ATOM 1004 ND2 ASN A 73 21.203 4.103 1.189 1.00 0.00 N ATOM 0 H ASN A 73 20.035 0.430 3.902 1.00 0.00 H new ATOM 0 HA ASN A 73 18.860 2.348 2.029 1.00 0.00 H new ATOM 0 HB2 ASN A 73 21.335 2.247 2.897 1.00 0.00 H new ATOM 0 HB3 ASN A 73 21.520 0.925 1.762 1.00 0.00 H new ATOM 0 HD21 ASN A 73 21.338 4.818 0.475 1.00 0.00 H new ATOM 0 HD22 ASN A 73 21.109 4.372 2.169 1.00 0.00 H new ATOM 1011 N VAL A 74 18.010 -0.335 1.429 1.00 0.00 N ATOM 1012 CA VAL A 74 17.510 -1.358 0.518 1.00 0.00 C ATOM 1013 C VAL A 74 15.989 -1.323 0.435 1.00 0.00 C ATOM 1014 O VAL A 74 15.289 -1.202 1.441 1.00 0.00 O ATOM 1015 CB VAL A 74 17.957 -2.765 0.956 1.00 0.00 C ATOM 1016 CG1 VAL A 74 17.376 -3.822 0.029 1.00 0.00 C ATOM 1017 CG2 VAL A 74 19.475 -2.854 0.994 1.00 0.00 C ATOM 0 H VAL A 74 17.492 -0.260 2.304 1.00 0.00 H new ATOM 0 HA VAL A 74 17.930 -1.141 -0.464 1.00 0.00 H new ATOM 0 HB VAL A 74 17.580 -2.951 1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 74 17.702 -4.810 0.354 1.00 0.00 H new ATOM 0 HG12 VAL A 74 16.288 -3.772 0.057 1.00 0.00 H new ATOM 0 HG13 VAL A 74 17.721 -3.642 -0.989 1.00 0.00 H new ATOM 0 HG21 VAL A 74 19.773 -3.855 1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 74 19.876 -2.648 0.002 1.00 0.00 H new ATOM 0 HG23 VAL A 74 19.865 -2.123 1.702 1.00 0.00 H new ATOM 1027 N PRO A 75 15.461 -1.431 -0.794 1.00 0.00 N ATOM 1028 CA PRO A 75 14.016 -1.416 -1.039 1.00 0.00 C ATOM 1029 C PRO A 75 13.327 -2.676 -0.526 1.00 0.00 C ATOM 1030 O PRO A 75 13.826 -3.786 -0.710 1.00 0.00 O ATOM 1031 CB PRO A 75 13.916 -1.335 -2.564 1.00 0.00 C ATOM 1032 CG PRO A 75 15.189 -1.930 -3.059 1.00 0.00 C ATOM 1033 CD PRO A 75 16.235 -1.578 -2.038 1.00 0.00 C ATOM 0 HA PRO A 75 13.524 -0.593 -0.521 1.00 0.00 H new ATOM 0 HB2 PRO A 75 13.051 -1.886 -2.934 1.00 0.00 H new ATOM 0 HB3 PRO A 75 13.804 -0.304 -2.899 1.00 0.00 H new ATOM 0 HG2 PRO A 75 15.098 -3.011 -3.168 1.00 0.00 H new ATOM 0 HG3 PRO A 75 15.451 -1.532 -4.039 1.00 0.00 H new ATOM 0 HD2 PRO A 75 16.991 -2.359 -1.951 1.00 0.00 H new ATOM 0 HD3 PRO A 75 16.757 -0.657 -2.298 1.00 0.00 H new ATOM 1041 N TRP A 76 12.180 -2.496 0.118 1.00 0.00 N ATOM 1042 CA TRP A 76 11.423 -3.620 0.658 1.00 0.00 C ATOM 1043 C TRP A 76 10.745 -4.406 -0.459 1.00 0.00 C ATOM 1044 O TRP A 76 10.283 -3.830 -1.443 1.00 0.00 O ATOM 1045 CB TRP A 76 10.376 -3.123 1.657 1.00 0.00 C ATOM 1046 CG TRP A 76 9.647 -1.898 1.194 1.00 0.00 C ATOM 1047 CD1 TRP A 76 10.100 -0.611 1.235 1.00 0.00 C ATOM 1048 CD2 TRP A 76 8.336 -1.846 0.622 1.00 0.00 C ATOM 1049 NE1 TRP A 76 9.149 0.239 0.723 1.00 0.00 N ATOM 1050 CE2 TRP A 76 8.058 -0.495 0.339 1.00 0.00 C ATOM 1051 CE3 TRP A 76 7.370 -2.810 0.319 1.00 0.00 C ATOM 1052 CZ2 TRP A 76 6.855 -0.086 -0.230 1.00 0.00 C ATOM 1053 CZ3 TRP A 76 6.176 -2.402 -0.246 1.00 0.00 C ATOM 1054 CH2 TRP A 76 5.927 -1.050 -0.516 1.00 0.00 C ATOM 0 H TRP A 76 11.754 -1.584 0.279 1.00 0.00 H new ATOM 0 HA TRP A 76 12.120 -4.282 1.172 1.00 0.00 H new ATOM 0 HB2 TRP A 76 9.654 -3.919 1.842 1.00 0.00 H new ATOM 0 HB3 TRP A 76 10.864 -2.909 2.608 1.00 0.00 H new ATOM 0 HD1 TRP A 76 11.064 -0.306 1.614 1.00 0.00 H new ATOM 0 HE1 TRP A 76 9.241 1.252 0.642 1.00 0.00 H new ATOM 0 HE3 TRP A 76 7.553 -3.855 0.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 6.661 0.956 -0.438 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 5.422 -3.138 -0.483 1.00 0.00 H new ATOM 0 HH2 TRP A 76 4.984 -0.763 -0.958 1.00 0.00 H new ATOM 1065 N ALA A 77 10.689 -5.724 -0.299 1.00 0.00 N ATOM 1066 CA ALA A 77 10.065 -6.589 -1.293 1.00 0.00 C ATOM 1067 C ALA A 77 9.224 -7.673 -0.628 1.00 0.00 C ATOM 1068 O ALA A 77 9.757 -8.585 0.006 1.00 0.00 O ATOM 1069 CB ALA A 77 11.125 -7.214 -2.188 1.00 0.00 C ATOM 0 H ALA A 77 11.068 -6.216 0.510 1.00 0.00 H new ATOM 0 HA ALA A 77 9.402 -5.978 -1.906 1.00 0.00 H new ATOM 0 HB1 ALA A 77 10.645 -7.857 -2.926 1.00 0.00 H new ATOM 0 HB2 ALA A 77 11.680 -6.427 -2.699 1.00 0.00 H new ATOM 0 HB3 ALA A 77 11.810 -7.806 -1.581 1.00 0.00 H new ATOM 1075 N PHE A 78 7.908 -7.569 -0.775 1.00 0.00 N ATOM 1076 CA PHE A 78 6.993 -8.540 -0.186 1.00 0.00 C ATOM 1077 C PHE A 78 7.613 -9.934 -0.177 1.00 0.00 C ATOM 1078 O PHE A 78 8.236 -10.355 -1.152 1.00 0.00 O ATOM 1079 CB PHE A 78 5.673 -8.562 -0.959 1.00 0.00 C ATOM 1080 CG PHE A 78 4.920 -7.264 -0.896 1.00 0.00 C ATOM 1081 CD1 PHE A 78 4.718 -6.624 0.316 1.00 0.00 C ATOM 1082 CD2 PHE A 78 4.414 -6.684 -2.048 1.00 0.00 C ATOM 1083 CE1 PHE A 78 4.024 -5.430 0.377 1.00 0.00 C ATOM 1084 CE2 PHE A 78 3.720 -5.490 -1.993 1.00 0.00 C ATOM 1085 CZ PHE A 78 3.526 -4.862 -0.779 1.00 0.00 C ATOM 0 H PHE A 78 7.451 -6.822 -1.297 1.00 0.00 H new ATOM 0 HA PHE A 78 6.798 -8.241 0.844 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.876 -8.805 -2.002 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.043 -9.358 -0.563 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.107 -7.063 1.223 1.00 0.00 H new ATOM 0 HD2 PHE A 78 4.564 -7.171 -3.000 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.871 -4.942 1.328 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.330 -5.049 -2.898 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.986 -3.928 -0.733 1.00 0.00 H new ATOM 1095 N MET A 79 7.438 -10.646 0.932 1.00 0.00 N ATOM 1096 CA MET A 79 7.980 -11.993 1.069 1.00 0.00 C ATOM 1097 C MET A 79 6.872 -13.036 0.973 1.00 0.00 C ATOM 1098 O MET A 79 5.693 -12.718 1.126 1.00 0.00 O ATOM 1099 CB MET A 79 8.718 -12.136 2.401 1.00 0.00 C ATOM 1100 CG MET A 79 7.792 -12.209 3.604 1.00 0.00 C ATOM 1101 SD MET A 79 8.629 -12.792 5.091 1.00 0.00 S ATOM 1102 CE MET A 79 9.146 -14.426 4.570 1.00 0.00 C ATOM 0 H MET A 79 6.925 -10.313 1.748 1.00 0.00 H new ATOM 0 HA MET A 79 8.684 -12.160 0.253 1.00 0.00 H new ATOM 0 HB2 MET A 79 9.333 -13.035 2.371 1.00 0.00 H new ATOM 0 HB3 MET A 79 9.395 -11.291 2.525 1.00 0.00 H new ATOM 0 HG2 MET A 79 7.370 -11.222 3.793 1.00 0.00 H new ATOM 0 HG3 MET A 79 6.959 -12.874 3.376 1.00 0.00 H new ATOM 0 HE1 MET A 79 9.248 -15.071 5.443 1.00 0.00 H new ATOM 0 HE2 MET A 79 8.401 -14.845 3.894 1.00 0.00 H new ATOM 0 HE3 MET A 79 10.105 -14.358 4.056 1.00 0.00 H new ATOM 1112 N GLN A 80 7.259 -14.282 0.720 1.00 0.00 N ATOM 1113 CA GLN A 80 6.296 -15.372 0.603 1.00 0.00 C ATOM 1114 C GLN A 80 5.115 -15.158 1.544 1.00 0.00 C ATOM 1115 O GLN A 80 3.960 -15.321 1.153 1.00 0.00 O ATOM 1116 CB GLN A 80 6.970 -16.711 0.908 1.00 0.00 C ATOM 1117 CG GLN A 80 8.129 -17.034 -0.021 1.00 0.00 C ATOM 1118 CD GLN A 80 7.691 -17.208 -1.461 1.00 0.00 C ATOM 1119 OE1 GLN A 80 6.516 -17.451 -1.740 1.00 0.00 O ATOM 1120 NE2 GLN A 80 8.635 -17.086 -2.387 1.00 0.00 N ATOM 0 H GLN A 80 8.231 -14.562 0.592 1.00 0.00 H new ATOM 0 HA GLN A 80 5.923 -15.386 -0.421 1.00 0.00 H new ATOM 0 HB2 GLN A 80 7.331 -16.700 1.936 1.00 0.00 H new ATOM 0 HB3 GLN A 80 6.228 -17.506 0.839 1.00 0.00 H new ATOM 0 HG2 GLN A 80 8.869 -16.235 0.036 1.00 0.00 H new ATOM 0 HG3 GLN A 80 8.619 -17.947 0.319 1.00 0.00 H new ATOM 0 HE21 GLN A 80 9.596 -16.884 -2.112 1.00 0.00 H new ATOM 0 HE22 GLN A 80 8.399 -17.194 -3.373 1.00 0.00 H new ATOM 1129 N GLY A 81 5.413 -14.791 2.787 1.00 0.00 N ATOM 1130 CA GLY A 81 4.365 -14.561 3.764 1.00 0.00 C ATOM 1131 C GLY A 81 3.337 -13.556 3.286 1.00 0.00 C ATOM 1132 O GLY A 81 2.226 -13.927 2.908 1.00 0.00 O ATOM 0 H GLY A 81 6.361 -14.649 3.134 1.00 0.00 H new ATOM 0 HA2 GLY A 81 3.868 -15.505 3.989 1.00 0.00 H new ATOM 0 HA3 GLY A 81 4.811 -14.206 4.693 1.00 0.00 H new ATOM 1136 N GLU A 82 3.707 -12.279 3.304 1.00 0.00 N ATOM 1137 CA GLU A 82 2.807 -11.217 2.871 1.00 0.00 C ATOM 1138 C GLU A 82 2.296 -11.480 1.457 1.00 0.00 C ATOM 1139 O GLU A 82 1.089 -11.515 1.218 1.00 0.00 O ATOM 1140 CB GLU A 82 3.516 -9.863 2.926 1.00 0.00 C ATOM 1141 CG GLU A 82 2.579 -8.695 3.185 1.00 0.00 C ATOM 1142 CD GLU A 82 3.291 -7.496 3.781 1.00 0.00 C ATOM 1143 OE1 GLU A 82 4.334 -7.692 4.439 1.00 0.00 O ATOM 1144 OE2 GLU A 82 2.805 -6.362 3.589 1.00 0.00 O ATOM 0 H GLU A 82 4.623 -11.955 3.614 1.00 0.00 H new ATOM 0 HA GLU A 82 1.954 -11.199 3.549 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.274 -9.891 3.709 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.038 -9.697 1.984 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.103 -8.402 2.249 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.785 -9.014 3.860 1.00 0.00 H new ATOM 1151 N ILE A 83 3.224 -11.662 0.524 1.00 0.00 N ATOM 1152 CA ILE A 83 2.869 -11.922 -0.866 1.00 0.00 C ATOM 1153 C ILE A 83 1.605 -12.769 -0.961 1.00 0.00 C ATOM 1154 O ILE A 83 0.770 -12.561 -1.841 1.00 0.00 O ATOM 1155 CB ILE A 83 4.010 -12.635 -1.615 1.00 0.00 C ATOM 1156 CG1 ILE A 83 5.239 -11.728 -1.701 1.00 0.00 C ATOM 1157 CG2 ILE A 83 3.552 -13.050 -3.005 1.00 0.00 C ATOM 1158 CD1 ILE A 83 6.411 -12.364 -2.415 1.00 0.00 C ATOM 0 H ILE A 83 4.227 -11.634 0.705 1.00 0.00 H new ATOM 0 HA ILE A 83 2.690 -10.953 -1.333 1.00 0.00 H new ATOM 0 HB ILE A 83 4.284 -13.533 -1.061 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.966 -10.808 -2.217 1.00 0.00 H new ATOM 0 HG13 ILE A 83 5.546 -11.449 -0.693 1.00 0.00 H new ATOM 0 HG21 ILE A 83 4.369 -13.553 -3.522 1.00 0.00 H new ATOM 0 HG22 ILE A 83 2.703 -13.729 -2.921 1.00 0.00 H new ATOM 0 HG23 ILE A 83 3.255 -12.166 -3.569 1.00 0.00 H new ATOM 0 HD11 ILE A 83 7.246 -11.664 -2.438 1.00 0.00 H new ATOM 0 HD12 ILE A 83 6.711 -13.269 -1.887 1.00 0.00 H new ATOM 0 HD13 ILE A 83 6.122 -12.618 -3.435 1.00 0.00 H new ATOM 1170 N ALA A 84 1.470 -13.725 -0.048 1.00 0.00 N ATOM 1171 CA ALA A 84 0.306 -14.602 -0.026 1.00 0.00 C ATOM 1172 C ALA A 84 -0.803 -14.022 0.845 1.00 0.00 C ATOM 1173 O ALA A 84 -1.980 -14.077 0.488 1.00 0.00 O ATOM 1174 CB ALA A 84 0.698 -15.987 0.469 1.00 0.00 C ATOM 0 H ALA A 84 2.153 -13.912 0.686 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.074 -14.685 -1.044 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.181 -16.632 0.480 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.451 -16.411 -0.196 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.105 -15.911 1.477 1.00 0.00 H new ATOM 1180 N THR A 85 -0.420 -13.464 1.990 1.00 0.00 N ATOM 1181 CA THR A 85 -1.382 -12.875 2.912 1.00 0.00 C ATOM 1182 C THR A 85 -2.288 -11.878 2.199 1.00 0.00 C ATOM 1183 O THR A 85 -3.498 -11.852 2.427 1.00 0.00 O ATOM 1184 CB THR A 85 -0.675 -12.163 4.082 1.00 0.00 C ATOM 1185 OG1 THR A 85 0.094 -13.106 4.836 1.00 0.00 O ATOM 1186 CG2 THR A 85 -1.687 -11.483 4.991 1.00 0.00 C ATOM 0 H THR A 85 0.550 -13.408 2.300 1.00 0.00 H new ATOM 0 HA THR A 85 -1.985 -13.693 3.305 1.00 0.00 H new ATOM 0 HB THR A 85 -0.012 -11.402 3.669 1.00 0.00 H new ATOM 0 HG1 THR A 85 0.840 -13.431 4.290 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.165 -10.987 5.810 1.00 0.00 H new ATOM 0 HG22 THR A 85 -2.251 -10.745 4.420 1.00 0.00 H new ATOM 0 HG23 THR A 85 -2.371 -12.229 5.396 1.00 0.00 H new ATOM 1194 N ILE A 86 -1.696 -11.061 1.335 1.00 0.00 N ATOM 1195 CA ILE A 86 -2.452 -10.064 0.587 1.00 0.00 C ATOM 1196 C ILE A 86 -3.218 -10.705 -0.566 1.00 0.00 C ATOM 1197 O ILE A 86 -4.440 -10.582 -0.658 1.00 0.00 O ATOM 1198 CB ILE A 86 -1.531 -8.963 0.027 1.00 0.00 C ATOM 1199 CG1 ILE A 86 -0.835 -8.220 1.170 1.00 0.00 C ATOM 1200 CG2 ILE A 86 -2.327 -7.994 -0.834 1.00 0.00 C ATOM 1201 CD1 ILE A 86 0.334 -7.374 0.716 1.00 0.00 C ATOM 0 H ILE A 86 -0.696 -11.070 1.135 1.00 0.00 H new ATOM 0 HA ILE A 86 -3.159 -9.616 1.285 1.00 0.00 H new ATOM 0 HB ILE A 86 -0.768 -9.430 -0.596 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.561 -7.582 1.673 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -0.485 -8.945 1.904 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -1.663 -7.222 -1.222 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -2.781 -8.534 -1.665 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.109 -7.531 -0.232 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.779 -6.876 1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 86 1.080 -8.010 0.239 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.014 -6.625 0.004 1.00 0.00 H new ATOM 1213 N LEU A 87 -2.492 -11.390 -1.442 1.00 0.00 N ATOM 1214 CA LEU A 87 -3.103 -12.053 -2.589 1.00 0.00 C ATOM 1215 C LEU A 87 -4.419 -12.716 -2.197 1.00 0.00 C ATOM 1216 O LEU A 87 -5.454 -12.480 -2.820 1.00 0.00 O ATOM 1217 CB LEU A 87 -2.146 -13.096 -3.169 1.00 0.00 C ATOM 1218 CG LEU A 87 -1.074 -12.567 -4.122 1.00 0.00 C ATOM 1219 CD1 LEU A 87 -0.045 -13.646 -4.420 1.00 0.00 C ATOM 1220 CD2 LEU A 87 -1.708 -12.062 -5.410 1.00 0.00 C ATOM 0 H LEU A 87 -1.480 -11.501 -1.380 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.310 -11.297 -3.347 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.650 -13.604 -2.342 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.735 -13.846 -3.697 1.00 0.00 H new ATOM 0 HG LEU A 87 -0.566 -11.733 -3.639 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.710 -13.251 -5.100 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.432 -13.961 -3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.538 -14.501 -4.882 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.930 -11.689 -6.077 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -2.243 -12.878 -5.897 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.406 -11.257 -5.181 1.00 0.00 H new ATOM 1232 N SER A 88 -4.372 -13.545 -1.159 1.00 0.00 N ATOM 1233 CA SER A 88 -5.561 -14.244 -0.684 1.00 0.00 C ATOM 1234 C SER A 88 -6.336 -13.384 0.310 1.00 0.00 C ATOM 1235 O SER A 88 -7.464 -12.973 0.044 1.00 0.00 O ATOM 1236 CB SER A 88 -5.171 -15.572 -0.032 1.00 0.00 C ATOM 1237 OG SER A 88 -5.100 -16.611 -0.993 1.00 0.00 O ATOM 0 H SER A 88 -3.524 -13.749 -0.631 1.00 0.00 H new ATOM 0 HA SER A 88 -6.203 -14.444 -1.542 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.207 -15.467 0.466 1.00 0.00 H new ATOM 0 HB3 SER A 88 -5.900 -15.832 0.736 1.00 0.00 H new ATOM 0 HG SER A 88 -4.847 -17.449 -0.551 1.00 0.00 H new ATOM 1243 N GLY A 89 -5.720 -13.117 1.458 1.00 0.00 N ATOM 1244 CA GLY A 89 -6.366 -12.308 2.475 1.00 0.00 C ATOM 1245 C GLY A 89 -6.991 -13.147 3.572 1.00 0.00 C ATOM 1246 O GLY A 89 -8.139 -13.579 3.474 1.00 0.00 O ATOM 0 H GLY A 89 -4.786 -13.446 1.701 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.635 -11.629 2.913 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.135 -11.692 2.010 1.00 0.00 H new ATOM 1250 N PRO A 90 -6.225 -13.389 4.646 1.00 0.00 N ATOM 1251 CA PRO A 90 -6.690 -14.184 5.787 1.00 0.00 C ATOM 1252 C PRO A 90 -7.766 -13.466 6.594 1.00 0.00 C ATOM 1253 O PRO A 90 -7.701 -12.253 6.792 1.00 0.00 O ATOM 1254 CB PRO A 90 -5.425 -14.370 6.628 1.00 0.00 C ATOM 1255 CG PRO A 90 -4.561 -13.209 6.275 1.00 0.00 C ATOM 1256 CD PRO A 90 -4.847 -12.904 4.830 1.00 0.00 C ATOM 0 HA PRO A 90 -7.150 -15.120 5.471 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.656 -14.382 7.693 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -4.932 -15.315 6.398 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.785 -12.350 6.907 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -3.508 -13.447 6.422 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -4.765 -11.837 4.620 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.149 -13.414 4.166 1.00 0.00 H new ATOM 1264 N SER A 91 -8.755 -14.223 7.058 1.00 0.00 N ATOM 1265 CA SER A 91 -9.847 -13.658 7.841 1.00 0.00 C ATOM 1266 C SER A 91 -9.656 -13.946 9.327 1.00 0.00 C ATOM 1267 O SER A 91 -8.974 -14.899 9.703 1.00 0.00 O ATOM 1268 CB SER A 91 -11.188 -14.224 7.369 1.00 0.00 C ATOM 1269 OG SER A 91 -11.523 -13.735 6.081 1.00 0.00 O ATOM 0 H SER A 91 -8.822 -15.229 6.905 1.00 0.00 H new ATOM 0 HA SER A 91 -9.845 -12.578 7.694 1.00 0.00 H new ATOM 0 HB2 SER A 91 -11.139 -15.313 7.347 1.00 0.00 H new ATOM 0 HB3 SER A 91 -11.970 -13.954 8.079 1.00 0.00 H new ATOM 0 HG SER A 91 -12.383 -14.113 5.801 1.00 0.00 H new ATOM 1275 N SER A 92 -10.263 -13.114 10.167 1.00 0.00 N ATOM 1276 CA SER A 92 -10.157 -13.276 11.613 1.00 0.00 C ATOM 1277 C SER A 92 -10.540 -14.693 12.030 1.00 0.00 C ATOM 1278 O SER A 92 -11.407 -15.318 11.423 1.00 0.00 O ATOM 1279 CB SER A 92 -11.053 -12.262 12.327 1.00 0.00 C ATOM 1280 OG SER A 92 -11.182 -12.576 13.703 1.00 0.00 O ATOM 0 H SER A 92 -10.833 -12.321 9.872 1.00 0.00 H new ATOM 0 HA SER A 92 -9.120 -13.099 11.899 1.00 0.00 H new ATOM 0 HB2 SER A 92 -10.635 -11.261 12.217 1.00 0.00 H new ATOM 0 HB3 SER A 92 -12.038 -12.249 11.860 1.00 0.00 H new ATOM 0 HG SER A 92 -11.758 -11.912 14.137 1.00 0.00 H new ATOM 1286 N GLY A 93 -9.884 -15.193 13.074 1.00 0.00 N ATOM 1287 CA GLY A 93 -10.168 -16.532 13.556 1.00 0.00 C ATOM 1288 C GLY A 93 -9.808 -17.601 12.543 1.00 0.00 C ATOM 1289 O GLY A 93 -9.066 -18.521 12.883 1.00 0.00 O ATOM 0 H GLY A 93 -9.162 -14.695 13.594 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -9.614 -16.708 14.478 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -11.227 -16.610 13.801 1.00 0.00 H new TER 1293 GLY A 93 HETATM 1294 ZN ZN A 200 -6.312 1.006 -2.684 1.00 0.00 ZN HETATM 1295 ZN ZN A 400 6.380 3.794 -1.210 1.00 0.00 ZN