USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 647 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -142:sc= -0.0159 (180deg=-0.54) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 76:sc= 0.649 USER MOD Single : A 21 GLN : amide:sc= -0.176 X(o=-0.18,f=-0.18) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0249) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.261 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -126:sc= -0.31 USER MOD Single : A 40 ASN : amide:sc= -0.142 K(o=-0.14,f=-2!) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -167:sc= -0.0374 (180deg=-0.25) USER MOD Single : A 64 ASN : amide:sc= -3! K(o=-3!,f=0.22) USER MOD Single : A 67 ASN : amide:sc= -1.06 K(o=-1.1,f=-0.081) USER MOD Single : A 71 THR OG1 : rot -60:sc= -0.736 USER MOD Single : A 77 ASN : amide:sc= -1.74 X(o=-1.7,f=-1.4!) USER MOD Single : A 80 LYS NZ :NH3+ -140:sc= 0.806 (180deg=-0.996) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.602 -1.667 -5.770 1.00 22.51 N ATOM 2 CA GLY A 1 7.039 -0.363 -6.064 1.00 4.40 C ATOM 3 C GLY A 1 6.506 0.331 -4.826 1.00 71.02 C ATOM 4 O GLY A 1 5.297 0.407 -4.603 1.00 64.32 O ATOM 0 H1 GLY A 1 8.447 -1.821 -6.357 1.00 22.51 H new ATOM 0 H2 GLY A 1 7.865 -1.713 -4.765 1.00 22.51 H new ATOM 0 H3 GLY A 1 6.898 -2.404 -5.977 1.00 22.51 H new ATOM 0 HA2 GLY A 1 7.802 0.263 -6.527 1.00 4.40 H new ATOM 0 HA3 GLY A 1 6.233 -0.474 -6.790 1.00 4.40 H new ATOM 8 N PRO A 2 7.420 0.851 -3.994 1.00 42.53 N ATOM 9 CA PRO A 2 7.058 1.550 -2.758 1.00 4.44 C ATOM 10 C PRO A 2 6.393 2.896 -3.026 1.00 1.04 C ATOM 11 O PRO A 2 5.384 3.234 -2.409 1.00 54.11 O ATOM 12 CB PRO A 2 8.404 1.750 -2.056 1.00 22.40 C ATOM 13 CG PRO A 2 9.409 1.744 -3.156 1.00 22.33 C ATOM 14 CD PRO A 2 8.878 0.798 -4.197 1.00 52.33 C ATOM 0 HA PRO A 2 6.334 0.987 -2.169 1.00 4.44 H new ATOM 0 HB2 PRO A 2 8.427 2.690 -1.504 1.00 22.40 H new ATOM 0 HB3 PRO A 2 8.598 0.953 -1.338 1.00 22.40 H new ATOM 0 HG2 PRO A 2 9.542 2.744 -3.569 1.00 22.33 H new ATOM 0 HG3 PRO A 2 10.383 1.417 -2.793 1.00 22.33 H new ATOM 0 HD2 PRO A 2 9.155 1.111 -5.204 1.00 52.33 H new ATOM 0 HD3 PRO A 2 9.267 -0.211 -4.059 1.00 52.33 H new ATOM 22 N GLY A 3 6.966 3.661 -3.950 1.00 72.34 N ATOM 23 CA GLY A 3 6.414 4.961 -4.284 1.00 31.12 C ATOM 24 C GLY A 3 6.449 5.923 -3.113 1.00 42.11 C ATOM 25 O GLY A 3 5.689 6.890 -3.073 1.00 13.25 O ATOM 0 H GLY A 3 7.803 3.404 -4.473 1.00 72.34 H new ATOM 0 HA2 GLY A 3 6.973 5.387 -5.117 1.00 31.12 H new ATOM 0 HA3 GLY A 3 5.384 4.840 -4.620 1.00 31.12 H new ATOM 29 N SER A 4 7.334 5.657 -2.157 1.00 54.41 N ATOM 30 CA SER A 4 7.461 6.504 -0.977 1.00 2.31 C ATOM 31 C SER A 4 8.779 7.272 -0.999 1.00 44.12 C ATOM 32 O SER A 4 9.784 6.818 -0.453 1.00 30.15 O ATOM 33 CB SER A 4 7.372 5.659 0.295 1.00 15.43 C ATOM 34 OG SER A 4 6.439 4.604 0.142 1.00 60.54 O ATOM 0 H SER A 4 7.973 4.862 -2.177 1.00 54.41 H new ATOM 0 HA SER A 4 6.641 7.222 -0.986 1.00 2.31 H new ATOM 0 HB2 SER A 4 8.354 5.249 0.532 1.00 15.43 H new ATOM 0 HB3 SER A 4 7.078 6.289 1.134 1.00 15.43 H new ATOM 0 HG SER A 4 6.402 4.078 0.968 1.00 60.54 H new ATOM 40 N MET A 5 8.767 8.439 -1.636 1.00 33.33 N ATOM 41 CA MET A 5 9.961 9.271 -1.729 1.00 15.12 C ATOM 42 C MET A 5 9.637 10.615 -2.373 1.00 41.33 C ATOM 43 O MET A 5 8.533 10.823 -2.877 1.00 10.34 O ATOM 44 CB MET A 5 11.046 8.554 -2.534 1.00 4.53 C ATOM 45 CG MET A 5 10.543 7.960 -3.839 1.00 52.20 C ATOM 46 SD MET A 5 11.842 7.122 -4.767 1.00 53.24 S ATOM 47 CE MET A 5 11.433 5.408 -4.449 1.00 62.40 C ATOM 0 H MET A 5 7.944 8.829 -2.095 1.00 33.33 H new ATOM 0 HA MET A 5 10.328 9.452 -0.719 1.00 15.12 H new ATOM 0 HB2 MET A 5 11.850 9.257 -2.751 1.00 4.53 H new ATOM 0 HB3 MET A 5 11.474 7.759 -1.924 1.00 4.53 H new ATOM 0 HG2 MET A 5 9.740 7.254 -3.627 1.00 52.20 H new ATOM 0 HG3 MET A 5 10.116 8.752 -4.454 1.00 52.20 H new ATOM 0 HE1 MET A 5 12.149 4.763 -4.958 1.00 62.40 H new ATOM 0 HE2 MET A 5 11.472 5.218 -3.376 1.00 62.40 H new ATOM 0 HE3 MET A 5 10.429 5.199 -4.819 1.00 62.40 H new ATOM 57 N ASP A 6 10.606 11.524 -2.354 1.00 20.11 N ATOM 58 CA ASP A 6 10.424 12.848 -2.937 1.00 43.03 C ATOM 59 C ASP A 6 10.108 12.747 -4.426 1.00 53.11 C ATOM 60 O ASP A 6 9.569 13.680 -5.021 1.00 30.34 O ATOM 61 CB ASP A 6 11.678 13.698 -2.726 1.00 41.13 C ATOM 62 CG ASP A 6 12.934 13.011 -3.226 1.00 10.51 C ATOM 63 OD1 ASP A 6 13.238 13.133 -4.431 1.00 55.14 O ATOM 64 OD2 ASP A 6 13.614 12.353 -2.411 1.00 52.24 O ATOM 0 H ASP A 6 11.526 11.368 -1.941 1.00 20.11 H new ATOM 0 HA ASP A 6 9.582 13.326 -2.437 1.00 43.03 H new ATOM 0 HB2 ASP A 6 11.559 14.651 -3.242 1.00 41.13 H new ATOM 0 HB3 ASP A 6 11.788 13.922 -1.665 1.00 41.13 H new ATOM 69 N ASN A 7 10.447 11.609 -5.022 1.00 63.23 N ATOM 70 CA ASN A 7 10.201 11.387 -6.442 1.00 73.35 C ATOM 71 C ASN A 7 8.741 11.661 -6.791 1.00 12.05 C ATOM 72 O ASN A 7 8.443 12.333 -7.778 1.00 42.21 O ATOM 73 CB ASN A 7 10.567 9.952 -6.827 1.00 23.23 C ATOM 74 CG ASN A 7 10.712 9.774 -8.326 1.00 33.42 C ATOM 75 OD1 ASN A 7 11.434 10.522 -8.984 1.00 54.44 O ATOM 76 ND2 ASN A 7 10.023 8.778 -8.872 1.00 42.11 N ATOM 0 H ASN A 7 10.893 10.826 -4.544 1.00 63.23 H new ATOM 0 HA ASN A 7 10.827 12.079 -7.005 1.00 73.35 H new ATOM 0 HB2 ASN A 7 11.501 9.675 -6.339 1.00 23.23 H new ATOM 0 HB3 ASN A 7 9.800 9.272 -6.456 1.00 23.23 H new ATOM 0 HD21 ASN A 7 10.080 8.609 -9.876 1.00 42.11 H new ATOM 0 HD22 ASN A 7 9.437 8.183 -8.287 1.00 42.11 H new ATOM 83 N ASP A 8 7.835 11.137 -5.973 1.00 31.25 N ATOM 84 CA ASP A 8 6.406 11.326 -6.192 1.00 53.33 C ATOM 85 C ASP A 8 5.912 12.591 -5.497 1.00 40.20 C ATOM 86 O ASP A 8 4.709 12.838 -5.419 1.00 42.33 O ATOM 87 CB ASP A 8 5.625 10.113 -5.685 1.00 72.22 C ATOM 88 CG ASP A 8 6.010 8.835 -6.404 1.00 60.20 C ATOM 89 OD1 ASP A 8 6.632 8.925 -7.484 1.00 14.23 O ATOM 90 OD2 ASP A 8 5.691 7.744 -5.887 1.00 13.34 O ATOM 0 H ASP A 8 8.065 10.578 -5.152 1.00 31.25 H new ATOM 0 HA ASP A 8 6.240 11.433 -7.264 1.00 53.33 H new ATOM 0 HB2 ASP A 8 5.801 9.992 -4.616 1.00 72.22 H new ATOM 0 HB3 ASP A 8 4.558 10.292 -5.814 1.00 72.22 H new ATOM 95 N GLU A 9 6.849 13.388 -4.993 1.00 24.54 N ATOM 96 CA GLU A 9 6.508 14.626 -4.302 1.00 64.31 C ATOM 97 C GLU A 9 6.784 15.837 -5.189 1.00 20.23 C ATOM 98 O GLU A 9 6.163 16.888 -5.032 1.00 13.22 O ATOM 99 CB GLU A 9 7.301 14.744 -2.998 1.00 75.43 C ATOM 100 CG GLU A 9 6.959 13.670 -1.979 1.00 72.43 C ATOM 101 CD GLU A 9 7.300 14.082 -0.561 1.00 22.35 C ATOM 102 OE1 GLU A 9 8.500 14.085 -0.216 1.00 3.43 O ATOM 103 OE2 GLU A 9 6.366 14.401 0.205 1.00 63.11 O ATOM 0 H GLU A 9 7.850 13.199 -5.050 1.00 24.54 H new ATOM 0 HA GLU A 9 5.443 14.601 -4.070 1.00 64.31 H new ATOM 0 HB2 GLU A 9 8.366 14.692 -3.224 1.00 75.43 H new ATOM 0 HB3 GLU A 9 7.116 15.724 -2.557 1.00 75.43 H new ATOM 0 HG2 GLU A 9 5.895 13.441 -2.041 1.00 72.43 H new ATOM 0 HG3 GLU A 9 7.497 12.755 -2.227 1.00 72.43 H new ATOM 110 N ILE A 10 7.720 15.681 -6.119 1.00 74.42 N ATOM 111 CA ILE A 10 8.077 16.760 -7.031 1.00 3.22 C ATOM 112 C ILE A 10 6.878 17.193 -7.867 1.00 41.52 C ATOM 113 O ILE A 10 6.504 18.366 -7.874 1.00 55.31 O ATOM 114 CB ILE A 10 9.223 16.345 -7.973 1.00 11.32 C ATOM 115 CG1 ILE A 10 10.464 15.962 -7.164 1.00 41.40 C ATOM 116 CG2 ILE A 10 9.544 17.471 -8.944 1.00 52.15 C ATOM 117 CD1 ILE A 10 11.350 14.952 -7.859 1.00 32.13 C ATOM 0 H ILE A 10 8.245 14.818 -6.261 1.00 74.42 H new ATOM 0 HA ILE A 10 8.408 17.596 -6.416 1.00 3.22 H new ATOM 0 HB ILE A 10 8.904 15.475 -8.548 1.00 11.32 H new ATOM 0 HG12 ILE A 10 11.045 16.861 -6.957 1.00 41.40 H new ATOM 0 HG13 ILE A 10 10.150 15.557 -6.202 1.00 41.40 H new ATOM 0 HG21 ILE A 10 10.356 17.163 -9.603 1.00 52.15 H new ATOM 0 HG22 ILE A 10 8.660 17.701 -9.539 1.00 52.15 H new ATOM 0 HG23 ILE A 10 9.846 18.357 -8.386 1.00 52.15 H new ATOM 0 HD11 ILE A 10 12.210 14.727 -7.228 1.00 32.13 H new ATOM 0 HD12 ILE A 10 10.785 14.038 -8.042 1.00 32.13 H new ATOM 0 HD13 ILE A 10 11.694 15.362 -8.809 1.00 32.13 H new ATOM 129 N PHE A 11 6.278 16.239 -8.571 1.00 23.35 N ATOM 130 CA PHE A 11 5.120 16.521 -9.410 1.00 60.13 C ATOM 131 C PHE A 11 3.897 16.849 -8.558 1.00 45.13 C ATOM 132 O PHE A 11 3.042 17.638 -8.959 1.00 10.30 O ATOM 133 CB PHE A 11 4.818 15.326 -10.317 1.00 52.22 C ATOM 134 CG PHE A 11 3.965 14.277 -9.663 1.00 12.43 C ATOM 135 CD1 PHE A 11 4.503 13.419 -8.717 1.00 14.31 C ATOM 136 CD2 PHE A 11 2.625 14.150 -9.993 1.00 22.14 C ATOM 137 CE1 PHE A 11 3.720 12.453 -8.114 1.00 20.02 C ATOM 138 CE2 PHE A 11 1.838 13.186 -9.392 1.00 75.44 C ATOM 139 CZ PHE A 11 2.386 12.337 -8.451 1.00 34.30 C ATOM 0 H PHE A 11 6.575 15.263 -8.577 1.00 23.35 H new ATOM 0 HA PHE A 11 5.353 17.388 -10.028 1.00 60.13 H new ATOM 0 HB2 PHE A 11 4.317 15.681 -11.217 1.00 52.22 H new ATOM 0 HB3 PHE A 11 5.758 14.873 -10.633 1.00 52.22 H new ATOM 0 HD1 PHE A 11 5.545 13.506 -8.448 1.00 14.31 H new ATOM 0 HD2 PHE A 11 2.191 14.812 -10.728 1.00 22.14 H new ATOM 0 HE1 PHE A 11 4.151 11.789 -7.379 1.00 20.02 H new ATOM 0 HE2 PHE A 11 0.795 13.097 -9.658 1.00 75.44 H new ATOM 0 HZ PHE A 11 1.772 11.584 -7.979 1.00 34.30 H new ATOM 149 N SER A 12 3.823 16.237 -7.381 1.00 34.02 N ATOM 150 CA SER A 12 2.703 16.460 -6.473 1.00 63.12 C ATOM 151 C SER A 12 2.713 17.889 -5.940 1.00 54.30 C ATOM 152 O SER A 12 1.684 18.565 -5.923 1.00 53.33 O ATOM 153 CB SER A 12 2.758 15.469 -5.309 1.00 21.10 C ATOM 154 OG SER A 12 2.435 16.103 -4.084 1.00 4.34 O ATOM 0 H SER A 12 4.524 15.583 -7.033 1.00 34.02 H new ATOM 0 HA SER A 12 1.779 16.305 -7.030 1.00 63.12 H new ATOM 0 HB2 SER A 12 2.063 14.649 -5.492 1.00 21.10 H new ATOM 0 HB3 SER A 12 3.755 15.033 -5.245 1.00 21.10 H new ATOM 0 HG SER A 12 2.476 15.448 -3.356 1.00 4.34 H new ATOM 160 N LYS A 13 3.883 18.344 -5.504 1.00 73.15 N ATOM 161 CA LYS A 13 4.029 19.693 -4.971 1.00 65.02 C ATOM 162 C LYS A 13 3.835 20.736 -6.067 1.00 74.44 C ATOM 163 O LYS A 13 3.142 21.734 -5.872 1.00 53.22 O ATOM 164 CB LYS A 13 5.409 19.863 -4.330 1.00 73.03 C ATOM 165 CG LYS A 13 5.658 21.258 -3.784 1.00 14.04 C ATOM 166 CD LYS A 13 6.982 21.338 -3.042 1.00 54.43 C ATOM 167 CE LYS A 13 6.907 20.645 -1.691 1.00 34.13 C ATOM 168 NZ LYS A 13 8.255 20.465 -1.084 1.00 73.21 N ATOM 0 H LYS A 13 4.744 17.798 -5.509 1.00 73.15 H new ATOM 0 HA LYS A 13 3.261 19.842 -4.212 1.00 65.02 H new ATOM 0 HB2 LYS A 13 5.516 19.141 -3.521 1.00 73.03 H new ATOM 0 HB3 LYS A 13 6.175 19.629 -5.069 1.00 73.03 H new ATOM 0 HG2 LYS A 13 5.655 21.976 -4.604 1.00 14.04 H new ATOM 0 HG3 LYS A 13 4.846 21.537 -3.113 1.00 14.04 H new ATOM 0 HD2 LYS A 13 7.766 20.879 -3.644 1.00 54.43 H new ATOM 0 HD3 LYS A 13 7.259 22.383 -2.901 1.00 54.43 H new ATOM 0 HE2 LYS A 13 6.281 21.230 -1.017 1.00 34.13 H new ATOM 0 HE3 LYS A 13 6.429 19.673 -1.808 1.00 34.13 H new ATOM 0 HZ1 LYS A 13 8.161 19.989 -0.164 1.00 73.21 H new ATOM 0 HZ2 LYS A 13 8.845 19.886 -1.715 1.00 73.21 H new ATOM 0 HZ3 LYS A 13 8.702 21.394 -0.949 1.00 73.21 H new ATOM 182 N VAL A 14 4.449 20.496 -7.222 1.00 1.24 N ATOM 183 CA VAL A 14 4.341 21.413 -8.350 1.00 11.21 C ATOM 184 C VAL A 14 2.912 21.468 -8.879 1.00 20.14 C ATOM 185 O VAL A 14 2.368 22.546 -9.116 1.00 42.45 O ATOM 186 CB VAL A 14 5.286 21.006 -9.496 1.00 54.34 C ATOM 187 CG1 VAL A 14 5.106 21.931 -10.690 1.00 53.35 C ATOM 188 CG2 VAL A 14 6.731 21.010 -9.022 1.00 31.21 C ATOM 0 H VAL A 14 5.026 19.674 -7.400 1.00 1.24 H new ATOM 0 HA VAL A 14 4.628 22.399 -7.985 1.00 11.21 H new ATOM 0 HB VAL A 14 5.033 19.993 -9.809 1.00 54.34 H new ATOM 0 HG11 VAL A 14 5.782 21.628 -11.490 1.00 53.35 H new ATOM 0 HG12 VAL A 14 4.076 21.873 -11.043 1.00 53.35 H new ATOM 0 HG13 VAL A 14 5.331 22.956 -10.394 1.00 53.35 H new ATOM 0 HG21 VAL A 14 7.385 20.720 -9.845 1.00 31.21 H new ATOM 0 HG22 VAL A 14 6.999 22.010 -8.681 1.00 31.21 H new ATOM 0 HG23 VAL A 14 6.846 20.303 -8.200 1.00 31.21 H new ATOM 198 N ARG A 15 2.309 20.298 -9.060 1.00 31.41 N ATOM 199 CA ARG A 15 0.943 20.212 -9.561 1.00 74.22 C ATOM 200 C ARG A 15 -0.048 20.759 -8.537 1.00 44.45 C ATOM 201 O ARG A 15 -1.099 21.289 -8.897 1.00 71.55 O ATOM 202 CB ARG A 15 0.592 18.762 -9.901 1.00 54.24 C ATOM 203 CG ARG A 15 -0.814 18.590 -10.455 1.00 25.43 C ATOM 204 CD ARG A 15 -1.809 18.258 -9.354 1.00 1.32 C ATOM 205 NE ARG A 15 -1.427 17.059 -8.614 1.00 32.34 N ATOM 206 CZ ARG A 15 -2.173 16.517 -7.657 1.00 70.12 C ATOM 207 NH1 ARG A 15 -3.334 17.065 -7.327 1.00 74.32 N ATOM 208 NH2 ARG A 15 -1.758 15.424 -7.029 1.00 44.30 N ATOM 0 H ARG A 15 2.745 19.396 -8.867 1.00 31.41 H new ATOM 0 HA ARG A 15 0.876 20.817 -10.465 1.00 74.22 H new ATOM 0 HB2 ARG A 15 1.309 18.385 -10.630 1.00 54.24 H new ATOM 0 HB3 ARG A 15 0.697 18.152 -9.004 1.00 54.24 H new ATOM 0 HG2 ARG A 15 -1.121 19.505 -10.961 1.00 25.43 H new ATOM 0 HG3 ARG A 15 -0.818 17.796 -11.202 1.00 25.43 H new ATOM 0 HD2 ARG A 15 -1.883 19.100 -8.666 1.00 1.32 H new ATOM 0 HD3 ARG A 15 -2.798 18.115 -9.790 1.00 1.32 H new ATOM 0 HE ARG A 15 -0.539 16.613 -8.844 1.00 32.34 H new ATOM 0 HH11 ARG A 15 -3.657 17.905 -7.808 1.00 74.32 H new ATOM 0 HH12 ARG A 15 -3.905 16.647 -6.592 1.00 74.32 H new ATOM 0 HH21 ARG A 15 -0.866 14.999 -7.281 1.00 44.30 H new ATOM 0 HH22 ARG A 15 -2.331 15.009 -6.295 1.00 44.30 H new ATOM 222 N SER A 16 0.296 20.628 -7.260 1.00 61.33 N ATOM 223 CA SER A 16 -0.564 21.105 -6.184 1.00 53.10 C ATOM 224 C SER A 16 -0.730 22.620 -6.253 1.00 11.23 C ATOM 225 O SER A 16 -1.715 23.170 -5.760 1.00 13.53 O ATOM 226 CB SER A 16 0.013 20.705 -4.825 1.00 45.01 C ATOM 227 OG SER A 16 -0.746 21.260 -3.765 1.00 22.41 O ATOM 0 H SER A 16 1.164 20.195 -6.945 1.00 61.33 H new ATOM 0 HA SER A 16 -1.544 20.643 -6.304 1.00 53.10 H new ATOM 0 HB2 SER A 16 0.026 19.619 -4.737 1.00 45.01 H new ATOM 0 HB3 SER A 16 1.047 21.043 -4.752 1.00 45.01 H new ATOM 0 HG SER A 16 -0.358 20.988 -2.907 1.00 22.41 H new ATOM 233 N ILE A 17 0.240 23.288 -6.867 1.00 64.12 N ATOM 234 CA ILE A 17 0.202 24.739 -7.002 1.00 21.23 C ATOM 235 C ILE A 17 -0.773 25.164 -8.094 1.00 13.10 C ATOM 236 O ILE A 17 -1.670 25.975 -7.858 1.00 63.12 O ATOM 237 CB ILE A 17 1.595 25.311 -7.322 1.00 45.50 C ATOM 238 CG1 ILE A 17 2.588 24.946 -6.216 1.00 14.10 C ATOM 239 CG2 ILE A 17 1.520 26.821 -7.496 1.00 64.03 C ATOM 240 CD1 ILE A 17 4.033 25.008 -6.657 1.00 23.25 C ATOM 0 H ILE A 17 1.062 22.848 -7.279 1.00 64.12 H new ATOM 0 HA ILE A 17 -0.134 25.136 -6.044 1.00 21.23 H new ATOM 0 HB ILE A 17 1.945 24.873 -8.257 1.00 45.50 H new ATOM 0 HG12 ILE A 17 2.445 25.622 -5.373 1.00 14.10 H new ATOM 0 HG13 ILE A 17 2.368 23.940 -5.859 1.00 14.10 H new ATOM 0 HG21 ILE A 17 2.512 27.211 -7.722 1.00 64.03 H new ATOM 0 HG22 ILE A 17 0.841 27.060 -8.315 1.00 64.03 H new ATOM 0 HG23 ILE A 17 1.152 27.275 -6.576 1.00 64.03 H new ATOM 0 HD11 ILE A 17 4.680 24.737 -5.823 1.00 23.25 H new ATOM 0 HD12 ILE A 17 4.192 24.312 -7.480 1.00 23.25 H new ATOM 0 HD13 ILE A 17 4.270 26.020 -6.986 1.00 23.25 H new ATOM 252 N ILE A 18 -0.594 24.611 -9.288 1.00 65.54 N ATOM 253 CA ILE A 18 -1.460 24.930 -10.416 1.00 43.33 C ATOM 254 C ILE A 18 -2.844 24.316 -10.238 1.00 22.30 C ATOM 255 O ILE A 18 -3.842 24.863 -10.706 1.00 71.45 O ATOM 256 CB ILE A 18 -0.858 24.437 -11.745 1.00 75.35 C ATOM 257 CG1 ILE A 18 -0.849 22.907 -11.789 1.00 53.35 C ATOM 258 CG2 ILE A 18 0.549 24.986 -11.927 1.00 32.25 C ATOM 259 CD1 ILE A 18 -0.273 22.343 -13.069 1.00 55.14 C ATOM 0 H ILE A 18 0.144 23.939 -9.500 1.00 65.54 H new ATOM 0 HA ILE A 18 -1.549 26.016 -10.448 1.00 43.33 H new ATOM 0 HB ILE A 18 -1.477 24.802 -12.564 1.00 75.35 H new ATOM 0 HG12 ILE A 18 -0.273 22.531 -10.944 1.00 53.35 H new ATOM 0 HG13 ILE A 18 -1.869 22.542 -11.667 1.00 53.35 H new ATOM 0 HG21 ILE A 18 0.960 24.628 -12.871 1.00 32.25 H new ATOM 0 HG22 ILE A 18 0.516 26.075 -11.935 1.00 32.25 H new ATOM 0 HG23 ILE A 18 1.180 24.648 -11.105 1.00 32.25 H new ATOM 0 HD11 ILE A 18 -0.298 21.254 -13.030 1.00 55.14 H new ATOM 0 HD12 ILE A 18 -0.863 22.690 -13.917 1.00 55.14 H new ATOM 0 HD13 ILE A 18 0.758 22.678 -13.183 1.00 55.14 H new ATOM 271 N SER A 19 -2.896 23.176 -9.556 1.00 1.11 N ATOM 272 CA SER A 19 -4.158 22.485 -9.317 1.00 3.32 C ATOM 273 C SER A 19 -5.196 23.438 -8.731 1.00 23.41 C ATOM 274 O SER A 19 -6.395 23.281 -8.959 1.00 3.31 O ATOM 275 CB SER A 19 -3.944 21.301 -8.372 1.00 11.43 C ATOM 276 OG SER A 19 -5.169 20.879 -7.798 1.00 53.21 O ATOM 0 H SER A 19 -2.079 22.712 -9.159 1.00 1.11 H new ATOM 0 HA SER A 19 -4.529 22.115 -10.273 1.00 3.32 H new ATOM 0 HB2 SER A 19 -3.490 20.474 -8.918 1.00 11.43 H new ATOM 0 HB3 SER A 19 -3.247 21.583 -7.583 1.00 11.43 H new ATOM 0 HG SER A 19 -5.683 20.371 -8.460 1.00 53.21 H new ATOM 282 N GLU A 20 -4.725 24.424 -7.975 1.00 5.22 N ATOM 283 CA GLU A 20 -5.612 25.401 -7.355 1.00 42.52 C ATOM 284 C GLU A 20 -6.264 26.290 -8.410 1.00 74.25 C ATOM 285 O GLU A 20 -7.430 26.665 -8.285 1.00 44.50 O ATOM 286 CB GLU A 20 -4.839 26.263 -6.355 1.00 3.23 C ATOM 287 CG GLU A 20 -5.721 27.209 -5.557 1.00 24.34 C ATOM 288 CD GLU A 20 -4.953 27.957 -4.484 1.00 31.42 C ATOM 289 OE1 GLU A 20 -3.803 27.565 -4.196 1.00 64.22 O ATOM 290 OE2 GLU A 20 -5.502 28.933 -3.932 1.00 33.30 O ATOM 0 H GLU A 20 -3.735 24.568 -7.777 1.00 5.22 H new ATOM 0 HA GLU A 20 -6.395 24.858 -6.827 1.00 42.52 H new ATOM 0 HB2 GLU A 20 -4.302 25.612 -5.665 1.00 3.23 H new ATOM 0 HB3 GLU A 20 -4.090 26.845 -6.892 1.00 3.23 H new ATOM 0 HG2 GLU A 20 -6.184 27.927 -6.234 1.00 24.34 H new ATOM 0 HG3 GLU A 20 -6.528 26.643 -5.093 1.00 24.34 H new ATOM 297 N GLN A 21 -5.504 26.621 -9.449 1.00 1.42 N ATOM 298 CA GLN A 21 -6.008 27.466 -10.525 1.00 44.51 C ATOM 299 C GLN A 21 -6.760 26.638 -11.561 1.00 33.11 C ATOM 300 O GLN A 21 -7.917 26.921 -11.876 1.00 60.33 O ATOM 301 CB GLN A 21 -4.855 28.217 -11.195 1.00 31.04 C ATOM 302 CG GLN A 21 -4.335 29.388 -10.377 1.00 21.14 C ATOM 303 CD GLN A 21 -5.393 30.446 -10.133 1.00 71.15 C ATOM 304 OE1 GLN A 21 -5.810 30.674 -8.997 1.00 45.44 O ATOM 305 NE2 GLN A 21 -5.834 31.099 -11.202 1.00 74.33 N ATOM 0 H GLN A 21 -4.538 26.317 -9.568 1.00 1.42 H new ATOM 0 HA GLN A 21 -6.700 28.188 -10.092 1.00 44.51 H new ATOM 0 HB2 GLN A 21 -4.037 27.521 -11.378 1.00 31.04 H new ATOM 0 HB3 GLN A 21 -5.186 28.582 -12.167 1.00 31.04 H new ATOM 0 HG2 GLN A 21 -3.966 29.021 -9.419 1.00 21.14 H new ATOM 0 HG3 GLN A 21 -3.488 29.839 -10.894 1.00 21.14 H new ATOM 0 HE21 GLN A 21 -5.460 30.878 -12.125 1.00 74.33 H new ATOM 0 HE22 GLN A 21 -6.546 31.822 -11.100 1.00 74.33 H new ATOM 314 N LEU A 22 -6.097 25.614 -12.087 1.00 54.23 N ATOM 315 CA LEU A 22 -6.704 24.744 -13.089 1.00 23.33 C ATOM 316 C LEU A 22 -7.797 23.879 -12.469 1.00 1.33 C ATOM 317 O LEU A 22 -8.558 23.220 -13.177 1.00 44.15 O ATOM 318 CB LEU A 22 -5.638 23.855 -13.732 1.00 73.44 C ATOM 319 CG LEU A 22 -4.646 24.559 -14.658 1.00 41.11 C ATOM 320 CD1 LEU A 22 -5.381 25.436 -15.660 1.00 63.23 C ATOM 321 CD2 LEU A 22 -3.656 25.385 -13.849 1.00 71.24 C ATOM 0 H LEU A 22 -5.140 25.366 -11.837 1.00 54.23 H new ATOM 0 HA LEU A 22 -7.156 25.373 -13.856 1.00 23.33 H new ATOM 0 HB2 LEU A 22 -5.077 23.363 -12.938 1.00 73.44 H new ATOM 0 HB3 LEU A 22 -6.141 23.072 -14.299 1.00 73.44 H new ATOM 0 HG LEU A 22 -4.091 23.800 -15.209 1.00 41.11 H new ATOM 0 HD11 LEU A 22 -4.659 25.929 -16.311 1.00 63.23 H new ATOM 0 HD12 LEU A 22 -6.050 24.820 -16.261 1.00 63.23 H new ATOM 0 HD13 LEU A 22 -5.962 26.189 -15.127 1.00 63.23 H new ATOM 0 HD21 LEU A 22 -2.957 25.879 -14.524 1.00 71.24 H new ATOM 0 HD22 LEU A 22 -4.195 26.136 -13.271 1.00 71.24 H new ATOM 0 HD23 LEU A 22 -3.106 24.732 -13.171 1.00 71.24 H new ATOM 333 N ASP A 23 -7.870 23.889 -11.142 1.00 54.04 N ATOM 334 CA ASP A 23 -8.873 23.109 -10.426 1.00 61.54 C ATOM 335 C ASP A 23 -8.836 21.647 -10.861 1.00 61.22 C ATOM 336 O ASP A 23 -9.849 20.948 -10.816 1.00 3.22 O ATOM 337 CB ASP A 23 -10.268 23.689 -10.664 1.00 43.24 C ATOM 338 CG ASP A 23 -10.273 25.205 -10.655 1.00 11.23 C ATOM 339 OD1 ASP A 23 -10.249 25.791 -9.552 1.00 51.14 O ATOM 340 OD2 ASP A 23 -10.302 25.806 -11.749 1.00 72.25 O ATOM 0 H ASP A 23 -7.247 24.428 -10.541 1.00 54.04 H new ATOM 0 HA ASP A 23 -8.644 23.159 -9.361 1.00 61.54 H new ATOM 0 HB2 ASP A 23 -10.648 23.333 -11.622 1.00 43.24 H new ATOM 0 HB3 ASP A 23 -10.947 23.322 -9.895 1.00 43.24 H new ATOM 345 N LYS A 24 -7.662 21.190 -11.284 1.00 1.11 N ATOM 346 CA LYS A 24 -7.491 19.812 -11.727 1.00 72.43 C ATOM 347 C LYS A 24 -6.411 19.108 -10.912 1.00 33.40 C ATOM 348 O LYS A 24 -5.552 19.753 -10.312 1.00 4.30 O ATOM 349 CB LYS A 24 -7.129 19.773 -13.214 1.00 12.43 C ATOM 350 CG LYS A 24 -8.319 19.977 -14.135 1.00 55.00 C ATOM 351 CD LYS A 24 -9.242 18.770 -14.129 1.00 71.22 C ATOM 352 CE LYS A 24 -10.129 18.740 -15.365 1.00 22.13 C ATOM 353 NZ LYS A 24 -11.292 17.827 -15.190 1.00 55.23 N ATOM 0 H LYS A 24 -6.814 21.755 -11.329 1.00 1.11 H new ATOM 0 HA LYS A 24 -8.435 19.289 -11.575 1.00 72.43 H new ATOM 0 HB2 LYS A 24 -6.386 20.543 -13.419 1.00 12.43 H new ATOM 0 HB3 LYS A 24 -6.665 18.813 -13.441 1.00 12.43 H new ATOM 0 HG2 LYS A 24 -8.874 20.862 -13.823 1.00 55.00 H new ATOM 0 HG3 LYS A 24 -7.967 20.162 -15.150 1.00 55.00 H new ATOM 0 HD2 LYS A 24 -8.648 17.857 -14.084 1.00 71.22 H new ATOM 0 HD3 LYS A 24 -9.864 18.791 -13.234 1.00 71.22 H new ATOM 0 HE2 LYS A 24 -10.487 19.747 -15.580 1.00 22.13 H new ATOM 0 HE3 LYS A 24 -9.542 18.420 -16.226 1.00 22.13 H new ATOM 0 HZ1 LYS A 24 -11.872 17.834 -16.053 1.00 55.23 H new ATOM 0 HZ2 LYS A 24 -10.951 16.861 -15.010 1.00 55.23 H new ATOM 0 HZ3 LYS A 24 -11.866 18.147 -14.384 1.00 55.23 H new ATOM 367 N LYS A 25 -6.460 17.780 -10.895 1.00 71.14 N ATOM 368 CA LYS A 25 -5.485 16.987 -10.156 1.00 43.14 C ATOM 369 C LYS A 25 -4.453 16.377 -11.100 1.00 21.24 C ATOM 370 O LYS A 25 -4.508 16.583 -12.311 1.00 53.43 O ATOM 371 CB LYS A 25 -6.189 15.880 -9.368 1.00 44.23 C ATOM 372 CG LYS A 25 -7.163 16.401 -8.326 1.00 72.02 C ATOM 373 CD LYS A 25 -8.565 16.542 -8.895 1.00 50.42 C ATOM 374 CE LYS A 25 -9.341 17.649 -8.197 1.00 42.14 C ATOM 375 NZ LYS A 25 -9.527 17.366 -6.747 1.00 55.23 N ATOM 0 H LYS A 25 -7.165 17.230 -11.385 1.00 71.14 H new ATOM 0 HA LYS A 25 -4.969 17.648 -9.459 1.00 43.14 H new ATOM 0 HB2 LYS A 25 -6.725 15.235 -10.064 1.00 44.23 H new ATOM 0 HB3 LYS A 25 -5.438 15.263 -8.875 1.00 44.23 H new ATOM 0 HG2 LYS A 25 -7.182 15.723 -7.473 1.00 72.02 H new ATOM 0 HG3 LYS A 25 -6.820 17.368 -7.957 1.00 72.02 H new ATOM 0 HD2 LYS A 25 -8.506 16.755 -9.962 1.00 50.42 H new ATOM 0 HD3 LYS A 25 -9.099 15.598 -8.787 1.00 50.42 H new ATOM 0 HE2 LYS A 25 -8.813 18.595 -8.318 1.00 42.14 H new ATOM 0 HE3 LYS A 25 -10.315 17.765 -8.672 1.00 42.14 H new ATOM 0 HZ1 LYS A 25 -10.117 18.109 -6.321 1.00 55.23 H new ATOM 0 HZ2 LYS A 25 -9.993 16.444 -6.630 1.00 55.23 H new ATOM 0 HZ3 LYS A 25 -8.600 17.348 -6.275 1.00 55.23 H new ATOM 389 N GLU A 26 -3.514 15.624 -10.535 1.00 70.31 N ATOM 390 CA GLU A 26 -2.471 14.983 -11.327 1.00 43.33 C ATOM 391 C GLU A 26 -3.073 13.999 -12.326 1.00 22.54 C ATOM 392 O GLU A 26 -2.420 13.598 -13.290 1.00 1.25 O ATOM 393 CB GLU A 26 -1.479 14.259 -10.415 1.00 23.01 C ATOM 394 CG GLU A 26 -2.133 13.259 -9.477 1.00 31.05 C ATOM 395 CD GLU A 26 -2.337 11.902 -10.121 1.00 32.41 C ATOM 396 OE1 GLU A 26 -1.343 11.317 -10.599 1.00 44.14 O ATOM 397 OE2 GLU A 26 -3.491 11.424 -10.147 1.00 24.01 O ATOM 0 H GLU A 26 -3.454 15.443 -9.533 1.00 70.31 H new ATOM 0 HA GLU A 26 -1.943 15.759 -11.881 1.00 43.33 H new ATOM 0 HB2 GLU A 26 -0.744 13.740 -11.031 1.00 23.01 H new ATOM 0 HB3 GLU A 26 -0.936 14.997 -9.825 1.00 23.01 H new ATOM 0 HG2 GLU A 26 -1.516 13.145 -8.586 1.00 31.05 H new ATOM 0 HG3 GLU A 26 -3.096 13.650 -9.149 1.00 31.05 H new ATOM 404 N ASP A 27 -4.321 13.612 -12.087 1.00 12.32 N ATOM 405 CA ASP A 27 -5.013 12.675 -12.964 1.00 64.12 C ATOM 406 C ASP A 27 -5.055 13.201 -14.396 1.00 22.43 C ATOM 407 O ASP A 27 -5.249 12.437 -15.341 1.00 42.42 O ATOM 408 CB ASP A 27 -6.434 12.423 -12.458 1.00 42.12 C ATOM 409 CG ASP A 27 -6.475 11.416 -11.325 1.00 51.43 C ATOM 410 OD1 ASP A 27 -5.721 10.423 -11.387 1.00 50.11 O ATOM 411 OD2 ASP A 27 -7.262 11.621 -10.377 1.00 51.43 O ATOM 0 H ASP A 27 -4.874 13.933 -11.293 1.00 12.32 H new ATOM 0 HA ASP A 27 -4.462 11.735 -12.957 1.00 64.12 H new ATOM 0 HB2 ASP A 27 -6.868 13.364 -12.120 1.00 42.12 H new ATOM 0 HB3 ASP A 27 -7.052 12.064 -13.281 1.00 42.12 H new ATOM 416 N GLU A 28 -4.873 14.509 -14.546 1.00 63.10 N ATOM 417 CA GLU A 28 -4.892 15.136 -15.862 1.00 72.24 C ATOM 418 C GLU A 28 -3.600 14.847 -16.622 1.00 12.35 C ATOM 419 O GLU A 28 -3.553 14.946 -17.848 1.00 55.50 O ATOM 420 CB GLU A 28 -5.092 16.647 -15.729 1.00 43.01 C ATOM 421 CG GLU A 28 -6.551 17.064 -15.654 1.00 41.02 C ATOM 422 CD GLU A 28 -7.310 16.762 -16.932 1.00 12.34 C ATOM 423 OE1 GLU A 28 -6.796 17.094 -18.020 1.00 74.22 O ATOM 424 OE2 GLU A 28 -8.419 16.194 -16.842 1.00 2.12 O ATOM 0 H GLU A 28 -4.711 15.155 -13.773 1.00 63.10 H new ATOM 0 HA GLU A 28 -5.725 14.715 -16.424 1.00 72.24 H new ATOM 0 HB2 GLU A 28 -4.577 16.996 -14.834 1.00 43.01 H new ATOM 0 HB3 GLU A 28 -4.624 17.143 -16.580 1.00 43.01 H new ATOM 0 HG2 GLU A 28 -7.030 16.549 -14.821 1.00 41.02 H new ATOM 0 HG3 GLU A 28 -6.610 18.132 -15.445 1.00 41.02 H new ATOM 431 N ILE A 29 -2.554 14.491 -15.884 1.00 34.24 N ATOM 432 CA ILE A 29 -1.262 14.188 -16.486 1.00 75.45 C ATOM 433 C ILE A 29 -1.395 13.111 -17.559 1.00 12.44 C ATOM 434 O ILE A 29 -1.463 11.920 -17.254 1.00 42.01 O ATOM 435 CB ILE A 29 -0.244 13.721 -15.430 1.00 22.21 C ATOM 436 CG1 ILE A 29 0.045 14.847 -14.436 1.00 11.35 C ATOM 437 CG2 ILE A 29 1.040 13.257 -16.101 1.00 5.11 C ATOM 438 CD1 ILE A 29 0.633 16.084 -15.078 1.00 13.33 C ATOM 0 H ILE A 29 -2.576 14.405 -14.868 1.00 34.24 H new ATOM 0 HA ILE A 29 -0.902 15.110 -16.942 1.00 75.45 H new ATOM 0 HB ILE A 29 -0.670 12.880 -14.883 1.00 22.21 H new ATOM 0 HG12 ILE A 29 -0.880 15.117 -13.926 1.00 11.35 H new ATOM 0 HG13 ILE A 29 0.733 14.481 -13.675 1.00 11.35 H new ATOM 0 HG21 ILE A 29 1.750 12.930 -15.341 1.00 5.11 H new ATOM 0 HG22 ILE A 29 0.820 12.428 -16.773 1.00 5.11 H new ATOM 0 HG23 ILE A 29 1.471 14.081 -16.670 1.00 5.11 H new ATOM 0 HD11 ILE A 29 0.812 16.840 -14.314 1.00 13.33 H new ATOM 0 HD12 ILE A 29 1.575 15.829 -15.564 1.00 13.33 H new ATOM 0 HD13 ILE A 29 -0.064 16.475 -15.820 1.00 13.33 H new ATOM 450 N THR A 30 -1.430 13.539 -18.817 1.00 73.42 N ATOM 451 CA THR A 30 -1.554 12.612 -19.936 1.00 11.35 C ATOM 452 C THR A 30 -1.261 13.307 -21.260 1.00 42.41 C ATOM 453 O THR A 30 -1.215 14.536 -21.332 1.00 61.14 O ATOM 454 CB THR A 30 -2.962 11.990 -19.996 1.00 64.41 C ATOM 455 OG1 THR A 30 -3.040 11.061 -21.084 1.00 12.34 O ATOM 456 CG2 THR A 30 -4.023 13.066 -20.164 1.00 41.43 C ATOM 0 H THR A 30 -1.374 14.521 -19.087 1.00 73.42 H new ATOM 0 HA THR A 30 -0.822 11.821 -19.774 1.00 11.35 H new ATOM 0 HB THR A 30 -3.145 11.467 -19.057 1.00 64.41 H new ATOM 0 HG1 THR A 30 -3.937 10.668 -21.115 1.00 12.34 H new ATOM 0 HG21 THR A 30 -5.009 12.602 -20.204 1.00 41.43 H new ATOM 0 HG22 THR A 30 -3.980 13.755 -19.320 1.00 41.43 H new ATOM 0 HG23 THR A 30 -3.842 13.614 -21.089 1.00 41.43 H new ATOM 464 N THR A 31 -1.063 12.514 -22.309 1.00 10.05 N ATOM 465 CA THR A 31 -0.774 13.053 -23.631 1.00 43.22 C ATOM 466 C THR A 31 -2.049 13.513 -24.329 1.00 21.14 C ATOM 467 O THR A 31 -1.997 14.150 -25.381 1.00 12.13 O ATOM 468 CB THR A 31 -0.063 12.014 -24.518 1.00 60.25 C ATOM 469 OG1 THR A 31 -0.918 10.885 -24.732 1.00 53.53 O ATOM 470 CG2 THR A 31 1.239 11.556 -23.878 1.00 72.34 C ATOM 0 H THR A 31 -1.098 11.495 -22.268 1.00 10.05 H new ATOM 0 HA THR A 31 -0.114 13.908 -23.486 1.00 43.22 H new ATOM 0 HB THR A 31 0.166 12.482 -25.475 1.00 60.25 H new ATOM 0 HG1 THR A 31 -0.459 10.230 -25.298 1.00 53.53 H new ATOM 0 HG21 THR A 31 1.723 10.822 -24.523 1.00 72.34 H new ATOM 0 HG22 THR A 31 1.899 12.413 -23.743 1.00 72.34 H new ATOM 0 HG23 THR A 31 1.029 11.104 -22.909 1.00 72.34 H new ATOM 478 N ASP A 32 -3.192 13.186 -23.736 1.00 51.50 N ATOM 479 CA ASP A 32 -4.482 13.568 -24.300 1.00 62.20 C ATOM 480 C ASP A 32 -4.998 14.851 -23.656 1.00 73.15 C ATOM 481 O ASP A 32 -6.194 15.141 -23.699 1.00 61.30 O ATOM 482 CB ASP A 32 -5.499 12.442 -24.109 1.00 61.43 C ATOM 483 CG ASP A 32 -6.641 12.518 -25.104 1.00 5.01 C ATOM 484 OD1 ASP A 32 -6.369 12.484 -26.322 1.00 62.51 O ATOM 485 OD2 ASP A 32 -7.806 12.613 -24.664 1.00 43.21 O ATOM 0 H ASP A 32 -3.252 12.658 -22.866 1.00 51.50 H new ATOM 0 HA ASP A 32 -4.346 13.747 -25.366 1.00 62.20 H new ATOM 0 HB2 ASP A 32 -4.996 11.481 -24.211 1.00 61.43 H new ATOM 0 HB3 ASP A 32 -5.900 12.486 -23.096 1.00 61.43 H new ATOM 490 N SER A 33 -4.089 15.615 -23.060 1.00 11.21 N ATOM 491 CA SER A 33 -4.453 16.865 -22.403 1.00 15.02 C ATOM 492 C SER A 33 -3.619 18.024 -22.940 1.00 12.25 C ATOM 493 O SER A 33 -4.156 19.063 -23.325 1.00 4.23 O ATOM 494 CB SER A 33 -4.265 16.744 -20.889 1.00 70.04 C ATOM 495 OG SER A 33 -5.115 15.748 -20.348 1.00 12.13 O ATOM 0 H SER A 33 -3.095 15.391 -23.018 1.00 11.21 H new ATOM 0 HA SER A 33 -5.503 17.067 -22.616 1.00 15.02 H new ATOM 0 HB2 SER A 33 -3.226 16.500 -20.667 1.00 70.04 H new ATOM 0 HB3 SER A 33 -4.476 17.703 -20.415 1.00 70.04 H new ATOM 0 HG SER A 33 -5.649 16.133 -19.622 1.00 12.13 H new ATOM 501 N ARG A 34 -2.304 17.838 -22.961 1.00 65.33 N ATOM 502 CA ARG A 34 -1.394 18.867 -23.449 1.00 41.32 C ATOM 503 C ARG A 34 -1.501 20.133 -22.603 1.00 72.33 C ATOM 504 O ARG A 34 -2.204 20.159 -21.593 1.00 75.01 O ATOM 505 CB ARG A 34 -1.696 19.193 -24.913 1.00 61.52 C ATOM 506 CG ARG A 34 -1.638 17.982 -25.830 1.00 73.15 C ATOM 507 CD ARG A 34 -2.589 18.129 -27.008 1.00 14.32 C ATOM 508 NE ARG A 34 -2.246 19.272 -27.849 1.00 43.43 N ATOM 509 CZ ARG A 34 -1.219 19.282 -28.693 1.00 13.05 C ATOM 510 NH1 ARG A 34 -0.440 18.215 -28.806 1.00 55.12 N ATOM 511 NH2 ARG A 34 -0.971 20.360 -29.425 1.00 3.33 N ATOM 0 H ARG A 34 -1.844 16.984 -22.646 1.00 65.33 H new ATOM 0 HA ARG A 34 -0.377 18.483 -23.372 1.00 41.32 H new ATOM 0 HB2 ARG A 34 -2.687 19.642 -24.980 1.00 61.52 H new ATOM 0 HB3 ARG A 34 -0.984 19.939 -25.265 1.00 61.52 H new ATOM 0 HG2 ARG A 34 -0.620 17.851 -26.197 1.00 73.15 H new ATOM 0 HG3 ARG A 34 -1.892 17.085 -25.266 1.00 73.15 H new ATOM 0 HD2 ARG A 34 -2.567 17.219 -27.607 1.00 14.32 H new ATOM 0 HD3 ARG A 34 -3.608 18.243 -26.639 1.00 14.32 H new ATOM 0 HE ARG A 34 -2.826 20.109 -27.786 1.00 43.43 H new ATOM 0 HH11 ARG A 34 -0.628 17.384 -28.245 1.00 55.12 H new ATOM 0 HH12 ARG A 34 0.347 18.225 -29.454 1.00 55.12 H new ATOM 0 HH21 ARG A 34 -1.569 21.182 -29.341 1.00 3.33 H new ATOM 0 HH22 ARG A 34 -0.183 20.367 -30.072 1.00 3.33 H new ATOM 525 N PHE A 35 -0.799 21.180 -23.023 1.00 23.13 N ATOM 526 CA PHE A 35 -0.814 22.448 -22.303 1.00 45.22 C ATOM 527 C PHE A 35 -2.183 23.114 -22.403 1.00 21.14 C ATOM 528 O PHE A 35 -2.618 23.805 -21.481 1.00 74.33 O ATOM 529 CB PHE A 35 0.263 23.385 -22.856 1.00 32.13 C ATOM 530 CG PHE A 35 1.609 22.735 -22.995 1.00 25.41 C ATOM 531 CD1 PHE A 35 2.244 22.182 -21.894 1.00 33.11 C ATOM 532 CD2 PHE A 35 2.241 22.675 -24.227 1.00 10.43 C ATOM 533 CE1 PHE A 35 3.483 21.584 -22.019 1.00 62.32 C ATOM 534 CE2 PHE A 35 3.480 22.078 -24.358 1.00 45.03 C ATOM 535 CZ PHE A 35 4.102 21.531 -23.253 1.00 71.51 C ATOM 0 H PHE A 35 -0.213 21.176 -23.858 1.00 23.13 H new ATOM 0 HA PHE A 35 -0.605 22.244 -21.253 1.00 45.22 H new ATOM 0 HB2 PHE A 35 -0.055 23.756 -23.830 1.00 32.13 H new ATOM 0 HB3 PHE A 35 0.352 24.250 -22.199 1.00 32.13 H new ATOM 0 HD1 PHE A 35 1.764 22.219 -20.927 1.00 33.11 H new ATOM 0 HD2 PHE A 35 1.759 23.100 -25.095 1.00 10.43 H new ATOM 0 HE1 PHE A 35 3.967 21.158 -21.153 1.00 62.32 H new ATOM 0 HE2 PHE A 35 3.962 22.039 -25.324 1.00 45.03 H new ATOM 0 HZ PHE A 35 5.070 21.063 -23.353 1.00 71.51 H new ATOM 545 N VAL A 36 -2.857 22.901 -23.528 1.00 54.32 N ATOM 546 CA VAL A 36 -4.177 23.479 -23.749 1.00 55.53 C ATOM 547 C VAL A 36 -5.160 23.034 -22.672 1.00 70.22 C ATOM 548 O VAL A 36 -5.861 23.854 -22.081 1.00 34.00 O ATOM 549 CB VAL A 36 -4.736 23.091 -25.131 1.00 32.31 C ATOM 550 CG1 VAL A 36 -4.033 23.871 -26.231 1.00 4.44 C ATOM 551 CG2 VAL A 36 -4.600 21.593 -25.358 1.00 63.22 C ATOM 0 H VAL A 36 -2.511 22.332 -24.301 1.00 54.32 H new ATOM 0 HA VAL A 36 -4.059 24.562 -23.704 1.00 55.53 H new ATOM 0 HB VAL A 36 -5.795 23.346 -25.159 1.00 32.31 H new ATOM 0 HG11 VAL A 36 -4.442 23.583 -27.200 1.00 4.44 H new ATOM 0 HG12 VAL A 36 -4.187 24.939 -26.075 1.00 4.44 H new ATOM 0 HG13 VAL A 36 -2.966 23.651 -26.208 1.00 4.44 H new ATOM 0 HG21 VAL A 36 -5.000 21.336 -26.339 1.00 63.22 H new ATOM 0 HG22 VAL A 36 -3.548 21.312 -25.310 1.00 63.22 H new ATOM 0 HG23 VAL A 36 -5.155 21.057 -24.588 1.00 63.22 H new ATOM 561 N GLU A 37 -5.204 21.729 -22.422 1.00 73.24 N ATOM 562 CA GLU A 37 -6.102 21.174 -21.416 1.00 1.41 C ATOM 563 C GLU A 37 -5.481 21.264 -20.025 1.00 11.13 C ATOM 564 O GLU A 37 -6.064 21.846 -19.110 1.00 31.25 O ATOM 565 CB GLU A 37 -6.435 19.718 -21.745 1.00 32.34 C ATOM 566 CG GLU A 37 -7.804 19.280 -21.252 1.00 13.44 C ATOM 567 CD GLU A 37 -8.901 19.544 -22.265 1.00 40.21 C ATOM 568 OE1 GLU A 37 -8.674 20.353 -23.189 1.00 21.01 O ATOM 569 OE2 GLU A 37 -9.987 18.941 -22.134 1.00 23.10 O ATOM 0 H GLU A 37 -4.629 21.037 -22.902 1.00 73.24 H new ATOM 0 HA GLU A 37 -7.021 21.759 -21.423 1.00 1.41 H new ATOM 0 HB2 GLU A 37 -6.385 19.578 -22.825 1.00 32.34 H new ATOM 0 HB3 GLU A 37 -5.676 19.072 -21.304 1.00 32.34 H new ATOM 0 HG2 GLU A 37 -7.779 18.216 -21.019 1.00 13.44 H new ATOM 0 HG3 GLU A 37 -8.037 19.804 -20.325 1.00 13.44 H new ATOM 576 N ASP A 38 -4.296 20.684 -19.874 1.00 22.31 N ATOM 577 CA ASP A 38 -3.595 20.698 -18.595 1.00 63.23 C ATOM 578 C ASP A 38 -3.295 22.128 -18.156 1.00 21.43 C ATOM 579 O ASP A 38 -3.806 22.595 -17.137 1.00 50.54 O ATOM 580 CB ASP A 38 -2.295 19.898 -18.693 1.00 63.03 C ATOM 581 CG ASP A 38 -1.675 19.632 -17.336 1.00 3.14 C ATOM 582 OD1 ASP A 38 -1.613 20.573 -16.517 1.00 12.15 O ATOM 583 OD2 ASP A 38 -1.252 18.483 -17.092 1.00 22.12 O ATOM 0 H ASP A 38 -3.800 20.198 -20.621 1.00 22.31 H new ATOM 0 HA ASP A 38 -4.241 20.236 -17.849 1.00 63.23 H new ATOM 0 HB2 ASP A 38 -2.493 18.949 -19.191 1.00 63.03 H new ATOM 0 HB3 ASP A 38 -1.583 20.442 -19.314 1.00 63.03 H new ATOM 588 N LEU A 39 -2.463 22.816 -18.929 1.00 2.42 N ATOM 589 CA LEU A 39 -2.093 24.193 -18.619 1.00 54.31 C ATOM 590 C LEU A 39 -3.215 25.156 -18.997 1.00 23.04 C ATOM 591 O LEU A 39 -4.184 24.770 -19.649 1.00 3.31 O ATOM 592 CB LEU A 39 -0.808 24.575 -19.355 1.00 53.45 C ATOM 593 CG LEU A 39 0.353 25.047 -18.479 1.00 73.31 C ATOM 594 CD1 LEU A 39 1.616 24.264 -18.801 1.00 44.31 C ATOM 595 CD2 LEU A 39 0.587 26.539 -18.661 1.00 15.30 C ATOM 0 H LEU A 39 -2.032 22.444 -19.775 1.00 2.42 H new ATOM 0 HA LEU A 39 -1.924 24.265 -17.545 1.00 54.31 H new ATOM 0 HB2 LEU A 39 -0.474 23.713 -19.932 1.00 53.45 H new ATOM 0 HB3 LEU A 39 -1.043 25.365 -20.068 1.00 53.45 H new ATOM 0 HG LEU A 39 0.093 24.866 -17.436 1.00 73.31 H new ATOM 0 HD11 LEU A 39 2.432 24.613 -18.168 1.00 44.31 H new ATOM 0 HD12 LEU A 39 1.443 23.203 -18.618 1.00 44.31 H new ATOM 0 HD13 LEU A 39 1.880 24.413 -19.848 1.00 44.31 H new ATOM 0 HD21 LEU A 39 1.417 26.857 -18.030 1.00 15.30 H new ATOM 0 HD22 LEU A 39 0.825 26.745 -19.704 1.00 15.30 H new ATOM 0 HD23 LEU A 39 -0.313 27.085 -18.379 1.00 15.30 H new ATOM 607 N ASN A 40 -3.074 26.411 -18.583 1.00 52.31 N ATOM 608 CA ASN A 40 -4.075 27.430 -18.879 1.00 42.14 C ATOM 609 C ASN A 40 -3.590 28.364 -19.984 1.00 44.00 C ATOM 610 O ASN A 40 -3.876 29.561 -19.969 1.00 71.34 O ATOM 611 CB ASN A 40 -4.400 28.237 -17.621 1.00 20.44 C ATOM 612 CG ASN A 40 -5.780 28.862 -17.675 1.00 53.23 C ATOM 613 OD1 ASN A 40 -6.649 28.411 -18.421 1.00 54.04 O ATOM 614 ND2 ASN A 40 -5.988 29.908 -16.883 1.00 22.51 N ATOM 0 H ASN A 40 -2.277 26.747 -18.042 1.00 52.31 H new ATOM 0 HA ASN A 40 -4.978 26.926 -19.223 1.00 42.14 H new ATOM 0 HB2 ASN A 40 -4.332 27.587 -16.748 1.00 20.44 H new ATOM 0 HB3 ASN A 40 -3.654 29.021 -17.493 1.00 20.44 H new ATOM 0 HD21 ASN A 40 -6.897 30.371 -16.877 1.00 22.51 H new ATOM 0 HD22 ASN A 40 -5.239 30.248 -16.280 1.00 22.51 H new ATOM 621 N ALA A 41 -2.854 27.808 -20.941 1.00 23.12 N ATOM 622 CA ALA A 41 -2.331 28.590 -22.054 1.00 60.33 C ATOM 623 C ALA A 41 -1.896 27.686 -23.203 1.00 43.20 C ATOM 624 O ALA A 41 -2.117 26.476 -23.171 1.00 71.43 O ATOM 625 CB ALA A 41 -1.168 29.455 -21.592 1.00 15.54 C ATOM 0 H ALA A 41 -2.607 26.819 -20.968 1.00 23.12 H new ATOM 0 HA ALA A 41 -3.129 29.238 -22.417 1.00 60.33 H new ATOM 0 HB1 ALA A 41 -0.788 30.033 -22.434 1.00 15.54 H new ATOM 0 HB2 ALA A 41 -1.508 30.134 -20.810 1.00 15.54 H new ATOM 0 HB3 ALA A 41 -0.374 28.819 -21.201 1.00 15.54 H new ATOM 631 N ASP A 42 -1.277 28.282 -24.216 1.00 64.01 N ATOM 632 CA ASP A 42 -0.810 27.530 -25.375 1.00 42.44 C ATOM 633 C ASP A 42 0.710 27.401 -25.363 1.00 21.20 C ATOM 634 O ASP A 42 1.390 28.024 -24.548 1.00 15.34 O ATOM 635 CB ASP A 42 -1.266 28.210 -26.668 1.00 24.13 C ATOM 636 CG ASP A 42 -2.776 28.263 -26.792 1.00 44.23 C ATOM 637 OD1 ASP A 42 -3.424 27.214 -26.600 1.00 22.53 O ATOM 638 OD2 ASP A 42 -3.309 29.354 -27.083 1.00 51.43 O ATOM 0 H ASP A 42 -1.087 29.283 -24.258 1.00 64.01 H new ATOM 0 HA ASP A 42 -1.242 26.530 -25.327 1.00 42.44 H new ATOM 0 HB2 ASP A 42 -0.866 29.223 -26.703 1.00 24.13 H new ATOM 0 HB3 ASP A 42 -0.853 27.674 -27.522 1.00 24.13 H new ATOM 643 N SER A 43 1.237 26.586 -26.272 1.00 10.33 N ATOM 644 CA SER A 43 2.676 26.371 -26.362 1.00 63.12 C ATOM 645 C SER A 43 3.421 27.700 -26.433 1.00 42.45 C ATOM 646 O SER A 43 4.594 27.789 -26.068 1.00 21.12 O ATOM 647 CB SER A 43 3.010 25.520 -27.589 1.00 71.01 C ATOM 648 OG SER A 43 4.411 25.393 -27.756 1.00 24.33 O ATOM 0 H SER A 43 0.689 26.064 -26.956 1.00 10.33 H new ATOM 0 HA SER A 43 2.996 25.843 -25.464 1.00 63.12 H new ATOM 0 HB2 SER A 43 2.562 24.532 -27.483 1.00 71.01 H new ATOM 0 HB3 SER A 43 2.574 25.973 -28.479 1.00 71.01 H new ATOM 0 HG SER A 43 4.598 24.844 -28.546 1.00 24.33 H new ATOM 654 N LEU A 44 2.732 28.733 -26.907 1.00 30.40 N ATOM 655 CA LEU A 44 3.327 30.059 -27.027 1.00 53.31 C ATOM 656 C LEU A 44 3.985 30.482 -25.717 1.00 74.24 C ATOM 657 O LEU A 44 5.145 30.893 -25.698 1.00 53.44 O ATOM 658 CB LEU A 44 2.263 31.082 -27.430 1.00 11.01 C ATOM 659 CG LEU A 44 1.450 30.748 -28.681 1.00 33.51 C ATOM 660 CD1 LEU A 44 0.080 31.406 -28.619 1.00 61.31 C ATOM 661 CD2 LEU A 44 2.196 31.182 -29.934 1.00 21.50 C ATOM 0 H LEU A 44 1.761 28.677 -27.214 1.00 30.40 H new ATOM 0 HA LEU A 44 4.094 30.017 -27.800 1.00 53.31 H new ATOM 0 HB2 LEU A 44 1.573 31.207 -26.595 1.00 11.01 H new ATOM 0 HB3 LEU A 44 2.753 32.043 -27.585 1.00 11.01 H new ATOM 0 HG LEU A 44 1.310 29.668 -28.722 1.00 33.51 H new ATOM 0 HD11 LEU A 44 -0.484 31.157 -29.518 1.00 61.31 H new ATOM 0 HD12 LEU A 44 -0.457 31.046 -27.742 1.00 61.31 H new ATOM 0 HD13 LEU A 44 0.198 32.488 -28.553 1.00 61.31 H new ATOM 0 HD21 LEU A 44 1.602 30.936 -30.814 1.00 21.50 H new ATOM 0 HD22 LEU A 44 2.368 32.258 -29.901 1.00 21.50 H new ATOM 0 HD23 LEU A 44 3.153 30.663 -29.986 1.00 21.50 H new ATOM 673 N ASP A 45 3.237 30.375 -24.625 1.00 11.14 N ATOM 674 CA ASP A 45 3.748 30.743 -23.309 1.00 63.24 C ATOM 675 C ASP A 45 4.617 29.629 -22.733 1.00 35.21 C ATOM 676 O ASP A 45 5.437 29.864 -21.845 1.00 51.33 O ATOM 677 CB ASP A 45 2.592 31.050 -22.357 1.00 10.04 C ATOM 678 CG ASP A 45 3.010 30.989 -20.901 1.00 12.35 C ATOM 679 OD1 ASP A 45 2.920 29.896 -20.302 1.00 44.43 O ATOM 680 OD2 ASP A 45 3.427 32.034 -20.359 1.00 41.24 O ATOM 0 H ASP A 45 2.275 30.037 -24.624 1.00 11.14 H new ATOM 0 HA ASP A 45 4.362 31.637 -23.421 1.00 63.24 H new ATOM 0 HB2 ASP A 45 2.197 32.042 -22.577 1.00 10.04 H new ATOM 0 HB3 ASP A 45 1.784 30.339 -22.530 1.00 10.04 H new ATOM 685 N ILE A 46 4.429 28.416 -23.242 1.00 42.04 N ATOM 686 CA ILE A 46 5.195 27.266 -22.778 1.00 42.20 C ATOM 687 C ILE A 46 6.633 27.323 -23.284 1.00 33.40 C ATOM 688 O ILE A 46 7.550 26.816 -22.637 1.00 73.35 O ATOM 689 CB ILE A 46 4.554 25.942 -23.233 1.00 63.21 C ATOM 690 CG1 ILE A 46 3.083 25.892 -22.816 1.00 22.14 C ATOM 691 CG2 ILE A 46 5.315 24.759 -22.654 1.00 24.42 C ATOM 692 CD1 ILE A 46 2.883 25.751 -21.323 1.00 2.52 C ATOM 0 H ILE A 46 3.753 28.204 -23.976 1.00 42.04 H new ATOM 0 HA ILE A 46 5.194 27.305 -21.689 1.00 42.20 H new ATOM 0 HB ILE A 46 4.606 25.885 -24.320 1.00 63.21 H new ATOM 0 HG12 ILE A 46 2.586 26.800 -23.157 1.00 22.14 H new ATOM 0 HG13 ILE A 46 2.599 25.055 -23.320 1.00 22.14 H new ATOM 0 HG21 ILE A 46 4.850 23.830 -22.985 1.00 24.42 H new ATOM 0 HG22 ILE A 46 6.349 24.789 -22.997 1.00 24.42 H new ATOM 0 HG23 ILE A 46 5.292 24.809 -21.565 1.00 24.42 H new ATOM 0 HD11 ILE A 46 1.816 25.722 -21.100 1.00 2.52 H new ATOM 0 HD12 ILE A 46 3.351 24.829 -20.979 1.00 2.52 H new ATOM 0 HD13 ILE A 46 3.337 26.601 -20.813 1.00 2.52 H new ATOM 704 N TYR A 47 6.822 27.944 -24.443 1.00 20.23 N ATOM 705 CA TYR A 47 8.148 28.067 -25.036 1.00 61.43 C ATOM 706 C TYR A 47 9.151 28.610 -24.023 1.00 34.33 C ATOM 707 O TYR A 47 10.193 28.003 -23.779 1.00 32.25 O ATOM 708 CB TYR A 47 8.099 28.981 -26.262 1.00 33.23 C ATOM 709 CG TYR A 47 9.420 29.090 -26.989 1.00 53.31 C ATOM 710 CD1 TYR A 47 10.429 29.919 -26.516 1.00 25.13 C ATOM 711 CD2 TYR A 47 9.658 28.364 -28.150 1.00 2.24 C ATOM 712 CE1 TYR A 47 11.638 30.022 -27.178 1.00 15.54 C ATOM 713 CE2 TYR A 47 10.864 28.460 -28.817 1.00 52.53 C ATOM 714 CZ TYR A 47 11.850 29.291 -28.328 1.00 0.33 C ATOM 715 OH TYR A 47 13.053 29.391 -28.989 1.00 74.42 O ATOM 0 H TYR A 47 6.074 28.370 -24.990 1.00 20.23 H new ATOM 0 HA TYR A 47 8.473 27.073 -25.344 1.00 61.43 H new ATOM 0 HB2 TYR A 47 7.343 28.608 -26.953 1.00 33.23 H new ATOM 0 HB3 TYR A 47 7.782 29.976 -25.950 1.00 33.23 H new ATOM 0 HD1 TYR A 47 10.266 30.493 -25.616 1.00 25.13 H new ATOM 0 HD2 TYR A 47 8.887 27.714 -28.537 1.00 2.24 H new ATOM 0 HE1 TYR A 47 12.412 30.671 -26.797 1.00 15.54 H new ATOM 0 HE2 TYR A 47 11.034 27.887 -29.717 1.00 52.53 H new ATOM 0 HH TYR A 47 13.041 28.811 -29.779 1.00 74.42 H new ATOM 725 N GLU A 48 8.826 29.757 -23.436 1.00 11.44 N ATOM 726 CA GLU A 48 9.698 30.383 -22.448 1.00 53.13 C ATOM 727 C GLU A 48 9.746 29.559 -21.165 1.00 61.31 C ATOM 728 O GLU A 48 10.793 29.445 -20.526 1.00 70.40 O ATOM 729 CB GLU A 48 9.218 31.802 -22.138 1.00 13.41 C ATOM 730 CG GLU A 48 9.504 32.798 -23.249 1.00 55.33 C ATOM 731 CD GLU A 48 9.019 34.197 -22.919 1.00 32.54 C ATOM 732 OE1 GLU A 48 9.386 34.714 -21.843 1.00 20.50 O ATOM 733 OE2 GLU A 48 8.272 34.774 -23.737 1.00 31.35 O ATOM 0 H GLU A 48 7.966 30.272 -23.627 1.00 11.44 H new ATOM 0 HA GLU A 48 10.703 30.431 -22.867 1.00 53.13 H new ATOM 0 HB2 GLU A 48 8.145 31.780 -21.949 1.00 13.41 H new ATOM 0 HB3 GLU A 48 9.697 32.146 -21.221 1.00 13.41 H new ATOM 0 HG2 GLU A 48 10.577 32.825 -23.440 1.00 55.33 H new ATOM 0 HG3 GLU A 48 9.025 32.459 -24.168 1.00 55.33 H new ATOM 740 N LEU A 49 8.606 28.986 -20.793 1.00 44.44 N ATOM 741 CA LEU A 49 8.517 28.172 -19.586 1.00 41.41 C ATOM 742 C LEU A 49 9.607 27.106 -19.567 1.00 21.33 C ATOM 743 O LEU A 49 10.446 27.076 -18.665 1.00 34.22 O ATOM 744 CB LEU A 49 7.140 27.513 -19.493 1.00 22.41 C ATOM 745 CG LEU A 49 6.764 26.933 -18.129 1.00 5.34 C ATOM 746 CD1 LEU A 49 6.705 28.033 -17.080 1.00 22.13 C ATOM 747 CD2 LEU A 49 5.434 26.198 -18.209 1.00 44.32 C ATOM 0 H LEU A 49 7.731 29.070 -21.310 1.00 44.44 H new ATOM 0 HA LEU A 49 8.659 28.825 -18.725 1.00 41.41 H new ATOM 0 HB2 LEU A 49 6.387 28.250 -19.772 1.00 22.41 H new ATOM 0 HB3 LEU A 49 7.092 26.713 -20.232 1.00 22.41 H new ATOM 0 HG LEU A 49 7.533 26.219 -17.835 1.00 5.34 H new ATOM 0 HD11 LEU A 49 6.436 27.602 -16.116 1.00 22.13 H new ATOM 0 HD12 LEU A 49 7.680 28.515 -17.003 1.00 22.13 H new ATOM 0 HD13 LEU A 49 5.957 28.771 -17.369 1.00 22.13 H new ATOM 0 HD21 LEU A 49 5.183 25.792 -17.229 1.00 44.32 H new ATOM 0 HD22 LEU A 49 4.654 26.891 -18.526 1.00 44.32 H new ATOM 0 HD23 LEU A 49 5.511 25.384 -18.930 1.00 44.32 H new ATOM 759 N LEU A 50 9.591 26.233 -20.568 1.00 21.32 N ATOM 760 CA LEU A 50 10.580 25.165 -20.668 1.00 31.23 C ATOM 761 C LEU A 50 11.961 25.729 -20.984 1.00 41.34 C ATOM 762 O LEU A 50 12.960 25.324 -20.390 1.00 20.32 O ATOM 763 CB LEU A 50 10.168 24.160 -21.745 1.00 54.31 C ATOM 764 CG LEU A 50 9.728 24.754 -23.084 1.00 11.53 C ATOM 765 CD1 LEU A 50 10.775 24.491 -24.155 1.00 21.25 C ATOM 766 CD2 LEU A 50 8.380 24.186 -23.502 1.00 53.22 C ATOM 0 H LEU A 50 8.904 26.243 -21.322 1.00 21.32 H new ATOM 0 HA LEU A 50 10.627 24.657 -19.705 1.00 31.23 H new ATOM 0 HB2 LEU A 50 11.007 23.488 -21.926 1.00 54.31 H new ATOM 0 HB3 LEU A 50 9.352 23.553 -21.354 1.00 54.31 H new ATOM 0 HG LEU A 50 9.624 25.832 -22.964 1.00 11.53 H new ATOM 0 HD11 LEU A 50 10.444 24.921 -25.100 1.00 21.25 H new ATOM 0 HD12 LEU A 50 11.720 24.947 -23.860 1.00 21.25 H new ATOM 0 HD13 LEU A 50 10.912 23.416 -24.274 1.00 21.25 H new ATOM 0 HD21 LEU A 50 8.083 24.620 -24.457 1.00 53.22 H new ATOM 0 HD22 LEU A 50 8.457 23.103 -23.604 1.00 53.22 H new ATOM 0 HD23 LEU A 50 7.633 24.427 -22.746 1.00 53.22 H new ATOM 778 N TYR A 51 12.010 26.668 -21.923 1.00 14.34 N ATOM 779 CA TYR A 51 13.268 27.289 -22.319 1.00 22.14 C ATOM 780 C TYR A 51 14.035 27.791 -21.099 1.00 41.42 C ATOM 781 O TYR A 51 15.246 27.595 -20.988 1.00 20.31 O ATOM 782 CB TYR A 51 13.009 28.446 -23.284 1.00 53.33 C ATOM 783 CG TYR A 51 14.198 29.362 -23.466 1.00 23.22 C ATOM 784 CD1 TYR A 51 15.468 28.846 -23.697 1.00 74.22 C ATOM 785 CD2 TYR A 51 14.054 30.742 -23.405 1.00 55.21 C ATOM 786 CE1 TYR A 51 16.558 29.678 -23.863 1.00 13.20 C ATOM 787 CE2 TYR A 51 15.138 31.582 -23.571 1.00 54.11 C ATOM 788 CZ TYR A 51 16.387 31.045 -23.800 1.00 5.54 C ATOM 789 OH TYR A 51 17.470 31.879 -23.964 1.00 61.21 O ATOM 0 H TYR A 51 11.192 27.016 -22.424 1.00 14.34 H new ATOM 0 HA TYR A 51 13.874 26.535 -22.822 1.00 22.14 H new ATOM 0 HB2 TYR A 51 12.721 28.041 -24.254 1.00 53.33 H new ATOM 0 HB3 TYR A 51 12.164 29.030 -22.919 1.00 53.33 H new ATOM 0 HD1 TYR A 51 15.605 27.776 -23.748 1.00 74.22 H new ATOM 0 HD2 TYR A 51 13.077 31.166 -23.225 1.00 55.21 H new ATOM 0 HE1 TYR A 51 17.538 29.261 -24.041 1.00 13.20 H new ATOM 0 HE2 TYR A 51 15.008 32.653 -23.522 1.00 54.11 H new ATOM 0 HH TYR A 51 17.178 32.812 -23.892 1.00 61.21 H new ATOM 799 N LEU A 52 13.321 28.441 -20.186 1.00 65.22 N ATOM 800 CA LEU A 52 13.933 28.972 -18.973 1.00 31.01 C ATOM 801 C LEU A 52 14.195 27.859 -17.963 1.00 15.32 C ATOM 802 O LEU A 52 15.103 27.957 -17.136 1.00 54.34 O ATOM 803 CB LEU A 52 13.033 30.040 -18.350 1.00 54.41 C ATOM 804 CG LEU A 52 13.315 31.484 -18.769 1.00 24.44 C ATOM 805 CD1 LEU A 52 13.064 31.667 -20.257 1.00 75.22 C ATOM 806 CD2 LEU A 52 12.464 32.450 -17.959 1.00 13.42 C ATOM 0 H LEU A 52 12.319 28.613 -20.263 1.00 65.22 H new ATOM 0 HA LEU A 52 14.887 29.423 -19.244 1.00 31.01 H new ATOM 0 HB2 LEU A 52 11.998 29.806 -18.600 1.00 54.41 H new ATOM 0 HB3 LEU A 52 13.121 29.974 -17.266 1.00 54.41 H new ATOM 0 HG LEU A 52 14.364 31.702 -18.570 1.00 24.44 H new ATOM 0 HD11 LEU A 52 13.270 32.700 -20.536 1.00 75.22 H new ATOM 0 HD12 LEU A 52 13.718 31.002 -20.821 1.00 75.22 H new ATOM 0 HD13 LEU A 52 12.024 31.431 -20.482 1.00 75.22 H new ATOM 0 HD21 LEU A 52 12.678 33.472 -18.270 1.00 13.42 H new ATOM 0 HD22 LEU A 52 11.409 32.233 -18.126 1.00 13.42 H new ATOM 0 HD23 LEU A 52 12.695 32.338 -16.900 1.00 13.42 H new ATOM 818 N LEU A 53 13.395 26.801 -18.036 1.00 50.11 N ATOM 819 CA LEU A 53 13.541 25.667 -17.130 1.00 1.55 C ATOM 820 C LEU A 53 14.821 24.893 -17.428 1.00 72.10 C ATOM 821 O LEU A 53 15.619 24.627 -16.531 1.00 24.43 O ATOM 822 CB LEU A 53 12.331 24.739 -17.243 1.00 71.25 C ATOM 823 CG LEU A 53 11.332 24.793 -16.087 1.00 50.11 C ATOM 824 CD1 LEU A 53 10.951 26.233 -15.778 1.00 71.41 C ATOM 825 CD2 LEU A 53 10.094 23.970 -16.413 1.00 22.14 C ATOM 0 H LEU A 53 12.638 26.705 -18.713 1.00 50.11 H new ATOM 0 HA LEU A 53 13.601 26.052 -16.112 1.00 1.55 H new ATOM 0 HB2 LEU A 53 11.801 24.977 -18.166 1.00 71.25 H new ATOM 0 HB3 LEU A 53 12.692 23.715 -17.337 1.00 71.25 H new ATOM 0 HG LEU A 53 11.805 24.366 -15.203 1.00 50.11 H new ATOM 0 HD11 LEU A 53 10.239 26.252 -14.953 1.00 71.41 H new ATOM 0 HD12 LEU A 53 11.843 26.794 -15.501 1.00 71.41 H new ATOM 0 HD13 LEU A 53 10.497 26.686 -16.659 1.00 71.41 H new ATOM 0 HD21 LEU A 53 9.394 24.020 -15.579 1.00 22.14 H new ATOM 0 HD22 LEU A 53 9.619 24.367 -17.310 1.00 22.14 H new ATOM 0 HD23 LEU A 53 10.381 22.933 -16.584 1.00 22.14 H new ATOM 837 N GLU A 54 15.009 24.537 -18.695 1.00 31.51 N ATOM 838 CA GLU A 54 16.193 23.794 -19.111 1.00 32.20 C ATOM 839 C GLU A 54 17.451 24.643 -18.955 1.00 12.42 C ATOM 840 O GLU A 54 18.499 24.148 -18.544 1.00 22.44 O ATOM 841 CB GLU A 54 16.050 23.336 -20.564 1.00 43.21 C ATOM 842 CG GLU A 54 15.702 24.461 -21.525 1.00 64.51 C ATOM 843 CD GLU A 54 16.867 24.847 -22.416 1.00 54.44 C ATOM 844 OE1 GLU A 54 17.675 25.703 -22.000 1.00 14.32 O ATOM 845 OE2 GLU A 54 16.969 24.293 -23.531 1.00 2.31 O ATOM 0 H GLU A 54 14.358 24.751 -19.450 1.00 31.51 H new ATOM 0 HA GLU A 54 16.285 22.918 -18.469 1.00 32.20 H new ATOM 0 HB2 GLU A 54 16.983 22.872 -20.883 1.00 43.21 H new ATOM 0 HB3 GLU A 54 15.277 22.569 -20.620 1.00 43.21 H new ATOM 0 HG2 GLU A 54 14.860 24.156 -22.146 1.00 64.51 H new ATOM 0 HG3 GLU A 54 15.380 25.333 -20.956 1.00 64.51 H new ATOM 852 N GLU A 55 17.337 25.926 -19.287 1.00 71.40 N ATOM 853 CA GLU A 55 18.465 26.844 -19.185 1.00 23.50 C ATOM 854 C GLU A 55 19.006 26.884 -17.759 1.00 3.33 C ATOM 855 O GLU A 55 20.174 27.203 -17.535 1.00 53.03 O ATOM 856 CB GLU A 55 18.050 28.249 -19.625 1.00 35.12 C ATOM 857 CG GLU A 55 19.185 29.258 -19.592 1.00 21.13 C ATOM 858 CD GLU A 55 18.922 30.462 -20.475 1.00 35.11 C ATOM 859 OE1 GLU A 55 17.781 30.599 -20.966 1.00 22.42 O ATOM 860 OE2 GLU A 55 19.855 31.267 -20.676 1.00 33.14 O ATOM 0 H GLU A 55 16.476 26.352 -19.628 1.00 71.40 H new ATOM 0 HA GLU A 55 19.254 26.484 -19.845 1.00 23.50 H new ATOM 0 HB2 GLU A 55 17.649 28.200 -20.637 1.00 35.12 H new ATOM 0 HB3 GLU A 55 17.245 28.600 -18.979 1.00 35.12 H new ATOM 0 HG2 GLU A 55 19.340 29.592 -18.566 1.00 21.13 H new ATOM 0 HG3 GLU A 55 20.107 28.772 -19.912 1.00 21.13 H new ATOM 867 N ALA A 56 18.148 26.560 -16.797 1.00 62.32 N ATOM 868 CA ALA A 56 18.539 26.558 -15.393 1.00 62.50 C ATOM 869 C ALA A 56 19.294 25.282 -15.035 1.00 61.23 C ATOM 870 O ALA A 56 20.024 25.238 -14.045 1.00 65.41 O ATOM 871 CB ALA A 56 17.315 26.715 -14.504 1.00 14.41 C ATOM 0 H ALA A 56 17.177 26.295 -16.965 1.00 62.32 H new ATOM 0 HA ALA A 56 19.207 27.403 -15.227 1.00 62.50 H new ATOM 0 HB1 ALA A 56 17.622 26.712 -13.458 1.00 14.41 H new ATOM 0 HB2 ALA A 56 16.817 27.657 -14.733 1.00 14.41 H new ATOM 0 HB3 ALA A 56 16.627 25.889 -14.683 1.00 14.41 H new ATOM 877 N PHE A 57 19.113 24.245 -15.847 1.00 13.22 N ATOM 878 CA PHE A 57 19.776 22.967 -15.615 1.00 13.34 C ATOM 879 C PHE A 57 20.851 22.714 -16.667 1.00 24.44 C ATOM 880 O PHE A 57 21.513 21.675 -16.656 1.00 14.10 O ATOM 881 CB PHE A 57 18.754 21.828 -15.629 1.00 11.52 C ATOM 882 CG PHE A 57 17.481 22.156 -14.903 1.00 14.53 C ATOM 883 CD1 PHE A 57 17.514 22.663 -13.614 1.00 14.25 C ATOM 884 CD2 PHE A 57 16.251 21.959 -15.509 1.00 72.45 C ATOM 885 CE1 PHE A 57 16.343 22.965 -12.943 1.00 44.00 C ATOM 886 CE2 PHE A 57 15.077 22.259 -14.844 1.00 2.00 C ATOM 887 CZ PHE A 57 15.124 22.764 -13.559 1.00 72.14 C ATOM 0 H PHE A 57 18.513 24.265 -16.671 1.00 13.22 H new ATOM 0 HA PHE A 57 20.253 23.006 -14.636 1.00 13.34 H new ATOM 0 HB2 PHE A 57 18.518 21.575 -16.663 1.00 11.52 H new ATOM 0 HB3 PHE A 57 19.202 20.943 -15.178 1.00 11.52 H new ATOM 0 HD1 PHE A 57 18.465 22.824 -13.128 1.00 14.25 H new ATOM 0 HD2 PHE A 57 16.209 21.566 -16.514 1.00 72.45 H new ATOM 0 HE1 PHE A 57 16.382 23.358 -11.938 1.00 44.00 H new ATOM 0 HE2 PHE A 57 14.125 22.099 -15.328 1.00 2.00 H new ATOM 0 HZ PHE A 57 14.209 23.001 -13.037 1.00 72.14 H new ATOM 897 N ASP A 58 21.020 23.669 -17.574 1.00 1.23 N ATOM 898 CA ASP A 58 22.015 23.551 -18.633 1.00 64.10 C ATOM 899 C ASP A 58 21.739 22.330 -19.505 1.00 31.24 C ATOM 900 O ASP A 58 22.425 21.313 -19.401 1.00 72.31 O ATOM 901 CB ASP A 58 23.420 23.458 -18.034 1.00 52.24 C ATOM 902 CG ASP A 58 24.506 23.630 -19.078 1.00 23.03 C ATOM 903 OD1 ASP A 58 24.822 24.789 -19.419 1.00 62.45 O ATOM 904 OD2 ASP A 58 25.040 22.606 -19.553 1.00 62.31 O ATOM 0 H ASP A 58 20.480 24.534 -17.597 1.00 1.23 H new ATOM 0 HA ASP A 58 21.952 24.442 -19.257 1.00 64.10 H new ATOM 0 HB2 ASP A 58 23.535 24.221 -17.265 1.00 52.24 H new ATOM 0 HB3 ASP A 58 23.540 22.492 -17.545 1.00 52.24 H new ATOM 909 N ASP A 59 20.730 22.438 -20.362 1.00 33.54 N ATOM 910 CA ASP A 59 20.362 21.342 -21.251 1.00 50.24 C ATOM 911 C ASP A 59 19.448 21.834 -22.369 1.00 71.24 C ATOM 912 O ASP A 59 18.844 22.902 -22.268 1.00 44.23 O ATOM 913 CB ASP A 59 19.672 20.227 -20.464 1.00 54.24 C ATOM 914 CG ASP A 59 20.602 19.068 -20.165 1.00 1.54 C ATOM 915 OD1 ASP A 59 21.337 18.646 -21.081 1.00 42.12 O ATOM 916 OD2 ASP A 59 20.594 18.583 -19.014 1.00 5.44 O ATOM 0 H ASP A 59 20.152 23.273 -20.460 1.00 33.54 H new ATOM 0 HA ASP A 59 21.274 20.948 -21.698 1.00 50.24 H new ATOM 0 HB2 ASP A 59 19.288 20.632 -19.528 1.00 54.24 H new ATOM 0 HB3 ASP A 59 18.814 19.864 -21.030 1.00 54.24 H new ATOM 921 N LYS A 60 19.351 21.048 -23.436 1.00 71.42 N ATOM 922 CA LYS A 60 18.511 21.401 -24.574 1.00 52.31 C ATOM 923 C LYS A 60 17.179 20.659 -24.519 1.00 3.21 C ATOM 924 O LYS A 60 17.146 19.432 -24.422 1.00 53.10 O ATOM 925 CB LYS A 60 19.231 21.081 -25.886 1.00 24.34 C ATOM 926 CG LYS A 60 20.366 22.038 -26.206 1.00 52.51 C ATOM 927 CD LYS A 60 20.543 22.212 -27.705 1.00 73.44 C ATOM 928 CE LYS A 60 21.630 23.226 -28.025 1.00 22.21 C ATOM 929 NZ LYS A 60 21.275 24.590 -27.545 1.00 54.04 N ATOM 0 H LYS A 60 19.845 20.161 -23.536 1.00 71.42 H new ATOM 0 HA LYS A 60 18.313 22.472 -24.528 1.00 52.31 H new ATOM 0 HB2 LYS A 60 19.626 20.066 -25.836 1.00 24.34 H new ATOM 0 HB3 LYS A 60 18.508 21.102 -26.702 1.00 24.34 H new ATOM 0 HG2 LYS A 60 20.167 23.007 -25.747 1.00 52.51 H new ATOM 0 HG3 LYS A 60 21.292 21.664 -25.770 1.00 52.51 H new ATOM 0 HD2 LYS A 60 20.795 21.252 -28.156 1.00 73.44 H new ATOM 0 HD3 LYS A 60 19.601 22.535 -28.148 1.00 73.44 H new ATOM 0 HE2 LYS A 60 22.567 22.912 -27.565 1.00 22.21 H new ATOM 0 HE3 LYS A 60 21.797 23.252 -29.102 1.00 22.21 H new ATOM 0 HZ1 LYS A 60 21.923 25.286 -27.967 1.00 54.04 H new ATOM 0 HZ2 LYS A 60 20.298 24.813 -27.824 1.00 54.04 H new ATOM 0 HZ3 LYS A 60 21.356 24.625 -26.509 1.00 54.04 H new ATOM 943 N ILE A 61 16.085 21.411 -24.583 1.00 23.35 N ATOM 944 CA ILE A 61 14.752 20.823 -24.542 1.00 60.13 C ATOM 945 C ILE A 61 14.406 20.154 -25.868 1.00 61.32 C ATOM 946 O ILE A 61 14.105 18.961 -25.930 1.00 43.54 O ATOM 947 CB ILE A 61 13.680 21.880 -24.219 1.00 1.41 C ATOM 948 CG1 ILE A 61 13.507 22.016 -22.705 1.00 0.23 C ATOM 949 CG2 ILE A 61 12.359 21.514 -24.878 1.00 33.12 C ATOM 950 CD1 ILE A 61 12.485 21.063 -22.125 1.00 42.15 C ATOM 0 H ILE A 61 16.096 22.428 -24.663 1.00 23.35 H new ATOM 0 HA ILE A 61 14.762 20.074 -23.750 1.00 60.13 H new ATOM 0 HB ILE A 61 14.007 22.841 -24.616 1.00 1.41 H new ATOM 0 HG12 ILE A 61 14.468 21.844 -22.221 1.00 0.23 H new ATOM 0 HG13 ILE A 61 13.211 23.039 -22.472 1.00 0.23 H new ATOM 0 HG21 ILE A 61 11.612 22.271 -24.640 1.00 33.12 H new ATOM 0 HG22 ILE A 61 12.493 21.464 -25.959 1.00 33.12 H new ATOM 0 HG23 ILE A 61 12.024 20.545 -24.508 1.00 33.12 H new ATOM 0 HD11 ILE A 61 12.415 21.216 -21.048 1.00 42.15 H new ATOM 0 HD12 ILE A 61 11.513 21.250 -22.582 1.00 42.15 H new ATOM 0 HD13 ILE A 61 12.789 20.036 -22.327 1.00 42.15 H new ATOM 962 N PRO A 62 14.451 20.937 -26.956 1.00 12.31 N ATOM 963 CA PRO A 62 14.147 20.442 -28.302 1.00 25.44 C ATOM 964 C PRO A 62 15.218 19.489 -28.823 1.00 52.15 C ATOM 965 O PRO A 62 15.095 18.945 -29.921 1.00 4.45 O ATOM 966 CB PRO A 62 14.107 21.716 -29.148 1.00 41.14 C ATOM 967 CG PRO A 62 14.970 22.685 -28.416 1.00 14.11 C ATOM 968 CD PRO A 62 14.802 22.367 -26.956 1.00 14.53 C ATOM 0 HA PRO A 62 13.220 19.869 -28.327 1.00 25.44 H new ATOM 0 HB2 PRO A 62 14.482 21.534 -30.155 1.00 41.14 H new ATOM 0 HB3 PRO A 62 13.089 22.091 -29.250 1.00 41.14 H new ATOM 0 HG2 PRO A 62 16.012 22.586 -28.720 1.00 14.11 H new ATOM 0 HG3 PRO A 62 14.672 23.712 -28.629 1.00 14.11 H new ATOM 0 HD2 PRO A 62 15.718 22.556 -26.396 1.00 14.53 H new ATOM 0 HD3 PRO A 62 14.019 22.973 -26.500 1.00 14.53 H new ATOM 976 N GLU A 63 16.266 19.292 -28.030 1.00 31.22 N ATOM 977 CA GLU A 63 17.357 18.404 -28.414 1.00 5.44 C ATOM 978 C GLU A 63 17.370 17.150 -27.545 1.00 21.02 C ATOM 979 O GLU A 63 17.140 16.043 -28.031 1.00 4.53 O ATOM 980 CB GLU A 63 18.699 19.131 -28.299 1.00 22.01 C ATOM 981 CG GLU A 63 19.716 18.700 -29.343 1.00 12.31 C ATOM 982 CD GLU A 63 19.939 17.201 -29.355 1.00 64.55 C ATOM 983 OE1 GLU A 63 20.496 16.676 -28.368 1.00 42.12 O ATOM 984 OE2 GLU A 63 19.558 16.552 -30.352 1.00 23.42 O ATOM 0 H GLU A 63 16.383 19.735 -27.119 1.00 31.22 H new ATOM 0 HA GLU A 63 17.201 18.105 -29.450 1.00 5.44 H new ATOM 0 HB2 GLU A 63 18.530 20.204 -28.390 1.00 22.01 H new ATOM 0 HB3 GLU A 63 19.114 18.956 -27.306 1.00 22.01 H new ATOM 0 HG2 GLU A 63 19.378 19.021 -30.328 1.00 12.31 H new ATOM 0 HG3 GLU A 63 20.664 19.203 -29.151 1.00 12.31 H new ATOM 991 N ASN A 64 17.641 17.332 -26.256 1.00 52.44 N ATOM 992 CA ASN A 64 17.685 16.216 -25.319 1.00 72.11 C ATOM 993 C ASN A 64 16.277 15.779 -24.927 1.00 14.23 C ATOM 994 O ASN A 64 15.875 14.644 -25.182 1.00 0.44 O ATOM 995 CB ASN A 64 18.478 16.603 -24.069 1.00 53.22 C ATOM 996 CG ASN A 64 19.767 17.328 -24.404 1.00 22.31 C ATOM 997 OD1 ASN A 64 20.394 17.061 -25.429 1.00 61.42 O ATOM 998 ND2 ASN A 64 20.169 18.250 -23.537 1.00 44.14 N ATOM 0 H ASN A 64 17.833 18.242 -25.837 1.00 52.44 H new ATOM 0 HA ASN A 64 18.182 15.380 -25.811 1.00 72.11 H new ATOM 0 HB2 ASN A 64 17.862 17.238 -23.433 1.00 53.22 H new ATOM 0 HB3 ASN A 64 18.708 15.705 -23.495 1.00 53.22 H new ATOM 0 HD21 ASN A 64 21.030 18.770 -23.708 1.00 44.14 H new ATOM 0 HD22 ASN A 64 19.617 18.438 -22.700 1.00 44.14 H new ATOM 1005 N GLU A 65 15.532 16.689 -24.306 1.00 22.01 N ATOM 1006 CA GLU A 65 14.169 16.397 -23.878 1.00 50.05 C ATOM 1007 C GLU A 65 13.300 15.997 -25.067 1.00 51.03 C ATOM 1008 O GLU A 65 12.269 15.345 -24.904 1.00 53.55 O ATOM 1009 CB GLU A 65 13.561 17.611 -23.174 1.00 13.33 C ATOM 1010 CG GLU A 65 14.318 18.033 -21.926 1.00 13.05 C ATOM 1011 CD GLU A 65 13.395 18.412 -20.784 1.00 12.14 C ATOM 1012 OE1 GLU A 65 12.349 17.749 -20.620 1.00 5.12 O ATOM 1013 OE2 GLU A 65 13.719 19.372 -20.054 1.00 12.24 O ATOM 0 H GLU A 65 15.849 17.634 -24.088 1.00 22.01 H new ATOM 0 HA GLU A 65 14.206 15.561 -23.179 1.00 50.05 H new ATOM 0 HB2 GLU A 65 13.532 18.448 -23.872 1.00 13.33 H new ATOM 0 HB3 GLU A 65 12.529 17.385 -22.904 1.00 13.33 H new ATOM 0 HG2 GLU A 65 14.969 17.219 -21.607 1.00 13.05 H new ATOM 0 HG3 GLU A 65 14.961 18.880 -22.165 1.00 13.05 H new ATOM 1020 N ALA A 66 13.724 16.393 -26.263 1.00 4.02 N ATOM 1021 CA ALA A 66 12.987 16.075 -27.479 1.00 52.22 C ATOM 1022 C ALA A 66 13.081 14.589 -27.806 1.00 34.44 C ATOM 1023 O ALA A 66 12.382 14.092 -28.688 1.00 14.04 O ATOM 1024 CB ALA A 66 13.505 16.907 -28.643 1.00 61.12 C ATOM 0 H ALA A 66 14.575 16.935 -26.415 1.00 4.02 H new ATOM 0 HA ALA A 66 11.938 16.317 -27.312 1.00 52.22 H new ATOM 0 HB1 ALA A 66 12.945 16.659 -29.545 1.00 61.12 H new ATOM 0 HB2 ALA A 66 13.379 17.966 -28.418 1.00 61.12 H new ATOM 0 HB3 ALA A 66 14.562 16.693 -28.801 1.00 61.12 H new ATOM 1030 N ASN A 67 13.950 13.884 -27.089 1.00 32.25 N ATOM 1031 CA ASN A 67 14.136 12.453 -27.303 1.00 52.34 C ATOM 1032 C ASN A 67 12.868 11.681 -26.953 1.00 14.22 C ATOM 1033 O ASN A 67 12.653 10.570 -27.436 1.00 32.04 O ATOM 1034 CB ASN A 67 15.308 11.939 -26.465 1.00 72.33 C ATOM 1035 CG ASN A 67 14.897 11.594 -25.047 1.00 11.23 C ATOM 1036 OD1 ASN A 67 15.109 10.474 -24.582 1.00 0.22 O ATOM 1037 ND2 ASN A 67 14.305 12.559 -24.352 1.00 30.43 N ATOM 0 H ASN A 67 14.537 14.280 -26.355 1.00 32.25 H new ATOM 0 HA ASN A 67 14.356 12.294 -28.359 1.00 52.34 H new ATOM 0 HB2 ASN A 67 15.733 11.056 -26.942 1.00 72.33 H new ATOM 0 HB3 ASN A 67 16.092 12.696 -26.439 1.00 72.33 H new ATOM 0 HD21 ASN A 67 14.006 12.386 -23.392 1.00 30.43 H new ATOM 0 HD22 ASN A 67 14.150 13.473 -24.778 1.00 30.43 H new ATOM 1044 N GLU A 68 12.031 12.279 -26.110 1.00 1.00 N ATOM 1045 CA GLU A 68 10.784 11.647 -25.695 1.00 24.21 C ATOM 1046 C GLU A 68 9.802 12.683 -25.157 1.00 31.15 C ATOM 1047 O GLU A 68 9.148 12.464 -24.136 1.00 64.23 O ATOM 1048 CB GLU A 68 11.056 10.583 -24.629 1.00 2.31 C ATOM 1049 CG GLU A 68 10.035 9.458 -24.617 1.00 51.32 C ATOM 1050 CD GLU A 68 9.998 8.690 -25.924 1.00 52.42 C ATOM 1051 OE1 GLU A 68 11.076 8.479 -26.518 1.00 50.12 O ATOM 1052 OE2 GLU A 68 8.892 8.301 -26.353 1.00 54.32 O ATOM 0 H GLU A 68 12.194 13.199 -25.702 1.00 1.00 H new ATOM 0 HA GLU A 68 10.339 11.170 -26.569 1.00 24.21 H new ATOM 0 HB2 GLU A 68 12.047 10.161 -24.794 1.00 2.31 H new ATOM 0 HB3 GLU A 68 11.071 11.059 -23.648 1.00 2.31 H new ATOM 0 HG2 GLU A 68 10.266 8.771 -23.803 1.00 51.32 H new ATOM 0 HG3 GLU A 68 9.047 9.871 -24.415 1.00 51.32 H new ATOM 1059 N PHE A 69 9.704 13.812 -25.850 1.00 14.55 N ATOM 1060 CA PHE A 69 8.803 14.884 -25.441 1.00 74.12 C ATOM 1061 C PHE A 69 7.483 14.805 -26.203 1.00 40.04 C ATOM 1062 O PHE A 69 7.434 14.311 -27.329 1.00 50.34 O ATOM 1063 CB PHE A 69 9.458 16.247 -25.674 1.00 22.23 C ATOM 1064 CG PHE A 69 9.533 17.095 -24.436 1.00 71.04 C ATOM 1065 CD1 PHE A 69 9.826 16.527 -23.207 1.00 64.45 C ATOM 1066 CD2 PHE A 69 9.309 18.461 -24.502 1.00 71.23 C ATOM 1067 CE1 PHE A 69 9.896 17.304 -22.067 1.00 3.31 C ATOM 1068 CE2 PHE A 69 9.378 19.244 -23.365 1.00 71.44 C ATOM 1069 CZ PHE A 69 9.671 18.665 -22.146 1.00 73.51 C ATOM 0 H PHE A 69 10.237 14.009 -26.697 1.00 14.55 H new ATOM 0 HA PHE A 69 8.597 14.765 -24.377 1.00 74.12 H new ATOM 0 HB2 PHE A 69 10.465 16.096 -26.063 1.00 22.23 H new ATOM 0 HB3 PHE A 69 8.898 16.784 -26.440 1.00 22.23 H new ATOM 0 HD1 PHE A 69 10.002 15.464 -23.139 1.00 64.45 H new ATOM 0 HD2 PHE A 69 9.078 18.919 -25.452 1.00 71.23 H new ATOM 0 HE1 PHE A 69 10.126 16.848 -21.115 1.00 3.31 H new ATOM 0 HE2 PHE A 69 9.203 20.308 -23.430 1.00 71.44 H new ATOM 0 HZ PHE A 69 9.724 19.275 -21.256 1.00 73.51 H new ATOM 1079 N GLU A 70 6.416 15.295 -25.580 1.00 21.02 N ATOM 1080 CA GLU A 70 5.096 15.279 -26.199 1.00 31.52 C ATOM 1081 C GLU A 70 4.154 16.253 -25.498 1.00 1.32 C ATOM 1082 O GLU A 70 3.633 17.184 -26.114 1.00 32.41 O ATOM 1083 CB GLU A 70 4.507 13.867 -26.160 1.00 25.41 C ATOM 1084 CG GLU A 70 3.247 13.709 -26.993 1.00 54.51 C ATOM 1085 CD GLU A 70 3.539 13.580 -28.475 1.00 62.23 C ATOM 1086 OE1 GLU A 70 4.726 13.441 -28.836 1.00 45.24 O ATOM 1087 OE2 GLU A 70 2.580 13.617 -29.274 1.00 71.22 O ATOM 0 H GLU A 70 6.440 15.708 -24.648 1.00 21.02 H new ATOM 0 HA GLU A 70 5.207 15.591 -27.238 1.00 31.52 H new ATOM 0 HB2 GLU A 70 5.257 13.160 -26.514 1.00 25.41 H new ATOM 0 HB3 GLU A 70 4.284 13.604 -25.126 1.00 25.41 H new ATOM 0 HG2 GLU A 70 2.702 12.827 -26.656 1.00 54.51 H new ATOM 0 HG3 GLU A 70 2.597 14.568 -26.828 1.00 54.51 H new ATOM 1094 N THR A 71 3.940 16.033 -24.204 1.00 54.33 N ATOM 1095 CA THR A 71 3.060 16.890 -23.419 1.00 20.31 C ATOM 1096 C THR A 71 3.570 17.039 -21.990 1.00 42.02 C ATOM 1097 O THR A 71 4.629 16.517 -21.640 1.00 72.05 O ATOM 1098 CB THR A 71 1.623 16.337 -23.383 1.00 73.05 C ATOM 1099 OG1 THR A 71 1.573 15.152 -22.581 1.00 61.24 O ATOM 1100 CG2 THR A 71 1.128 16.026 -24.788 1.00 32.11 C ATOM 0 H THR A 71 4.364 15.269 -23.678 1.00 54.33 H new ATOM 0 HA THR A 71 3.054 17.866 -23.904 1.00 20.31 H new ATOM 0 HB THR A 71 0.976 17.097 -22.946 1.00 73.05 H new ATOM 0 HG1 THR A 71 2.168 14.473 -22.963 1.00 61.24 H new ATOM 0 HG21 THR A 71 0.111 15.637 -24.738 1.00 32.11 H new ATOM 0 HG22 THR A 71 1.139 16.936 -25.387 1.00 32.11 H new ATOM 0 HG23 THR A 71 1.779 15.282 -25.247 1.00 32.11 H new ATOM 1108 N VAL A 72 2.810 17.755 -21.167 1.00 63.31 N ATOM 1109 CA VAL A 72 3.185 17.971 -19.775 1.00 11.22 C ATOM 1110 C VAL A 72 3.533 16.655 -19.088 1.00 52.23 C ATOM 1111 O VAL A 72 4.478 16.583 -18.304 1.00 62.35 O ATOM 1112 CB VAL A 72 2.054 18.664 -18.991 1.00 25.55 C ATOM 1113 CG1 VAL A 72 2.455 18.858 -17.536 1.00 32.20 C ATOM 1114 CG2 VAL A 72 1.696 19.994 -19.636 1.00 22.33 C ATOM 0 H VAL A 72 1.931 18.195 -21.440 1.00 63.31 H new ATOM 0 HA VAL A 72 4.063 18.617 -19.780 1.00 11.22 H new ATOM 0 HB VAL A 72 1.172 18.025 -19.018 1.00 25.55 H new ATOM 0 HG11 VAL A 72 1.644 19.349 -16.998 1.00 32.20 H new ATOM 0 HG12 VAL A 72 2.657 17.888 -17.082 1.00 32.20 H new ATOM 0 HG13 VAL A 72 3.351 19.476 -17.485 1.00 32.20 H new ATOM 0 HG21 VAL A 72 0.896 20.470 -19.069 1.00 22.33 H new ATOM 0 HG22 VAL A 72 2.572 20.643 -19.642 1.00 22.33 H new ATOM 0 HG23 VAL A 72 1.364 19.824 -20.660 1.00 22.33 H new ATOM 1124 N GLY A 73 2.761 15.615 -19.389 1.00 63.21 N ATOM 1125 CA GLY A 73 3.004 14.314 -18.793 1.00 11.33 C ATOM 1126 C GLY A 73 4.456 13.891 -18.896 1.00 12.14 C ATOM 1127 O GLY A 73 5.007 13.306 -17.963 1.00 14.43 O ATOM 0 H GLY A 73 1.972 15.650 -20.035 1.00 63.21 H new ATOM 0 HA2 GLY A 73 2.709 14.338 -17.744 1.00 11.33 H new ATOM 0 HA3 GLY A 73 2.376 13.570 -19.284 1.00 11.33 H new ATOM 1131 N ASP A 74 5.077 14.185 -20.033 1.00 12.04 N ATOM 1132 CA ASP A 74 6.474 13.830 -20.255 1.00 12.54 C ATOM 1133 C ASP A 74 7.388 14.612 -19.317 1.00 5.40 C ATOM 1134 O ASP A 74 8.289 14.047 -18.697 1.00 31.34 O ATOM 1135 CB ASP A 74 6.865 14.098 -21.709 1.00 20.51 C ATOM 1136 CG ASP A 74 6.159 13.170 -22.678 1.00 60.20 C ATOM 1137 OD1 ASP A 74 5.170 12.527 -22.269 1.00 73.04 O ATOM 1138 OD2 ASP A 74 6.596 13.086 -23.845 1.00 64.10 O ATOM 0 H ASP A 74 4.635 14.668 -20.815 1.00 12.04 H new ATOM 0 HA ASP A 74 6.592 12.767 -20.045 1.00 12.54 H new ATOM 0 HB2 ASP A 74 6.628 15.131 -21.962 1.00 20.51 H new ATOM 0 HB3 ASP A 74 7.943 13.982 -21.820 1.00 20.51 H new ATOM 1143 N VAL A 75 7.152 15.917 -19.219 1.00 70.24 N ATOM 1144 CA VAL A 75 7.954 16.777 -18.358 1.00 22.23 C ATOM 1145 C VAL A 75 7.825 16.364 -16.896 1.00 23.02 C ATOM 1146 O VAL A 75 8.801 16.383 -16.146 1.00 24.53 O ATOM 1147 CB VAL A 75 7.544 18.254 -18.500 1.00 54.55 C ATOM 1148 CG1 VAL A 75 8.568 19.160 -17.835 1.00 45.42 C ATOM 1149 CG2 VAL A 75 7.370 18.619 -19.967 1.00 53.31 C ATOM 0 H VAL A 75 6.411 16.401 -19.726 1.00 70.24 H new ATOM 0 HA VAL A 75 8.991 16.664 -18.675 1.00 22.23 H new ATOM 0 HB VAL A 75 6.588 18.397 -17.997 1.00 54.55 H new ATOM 0 HG11 VAL A 75 8.260 20.200 -17.946 1.00 45.42 H new ATOM 0 HG12 VAL A 75 8.638 18.914 -16.776 1.00 45.42 H new ATOM 0 HG13 VAL A 75 9.541 19.017 -18.306 1.00 45.42 H new ATOM 0 HG21 VAL A 75 7.080 19.667 -20.049 1.00 53.31 H new ATOM 0 HG22 VAL A 75 8.310 18.460 -20.495 1.00 53.31 H new ATOM 0 HG23 VAL A 75 6.595 17.992 -20.408 1.00 53.31 H new ATOM 1159 N VAL A 76 6.614 15.991 -16.497 1.00 34.45 N ATOM 1160 CA VAL A 76 6.356 15.571 -15.124 1.00 44.11 C ATOM 1161 C VAL A 76 7.272 14.421 -14.720 1.00 42.22 C ATOM 1162 O VAL A 76 7.937 14.478 -13.687 1.00 30.54 O ATOM 1163 CB VAL A 76 4.891 15.136 -14.935 1.00 51.25 C ATOM 1164 CG1 VAL A 76 4.667 14.608 -13.526 1.00 45.45 C ATOM 1165 CG2 VAL A 76 3.950 16.293 -15.236 1.00 35.21 C ATOM 0 H VAL A 76 5.795 15.971 -17.105 1.00 34.45 H new ATOM 0 HA VAL A 76 6.556 16.433 -14.487 1.00 44.11 H new ATOM 0 HB VAL A 76 4.676 14.330 -15.637 1.00 51.25 H new ATOM 0 HG11 VAL A 76 3.626 14.306 -13.412 1.00 45.45 H new ATOM 0 HG12 VAL A 76 5.315 13.749 -13.352 1.00 45.45 H new ATOM 0 HG13 VAL A 76 4.899 15.390 -12.803 1.00 45.45 H new ATOM 0 HG21 VAL A 76 2.919 15.969 -15.098 1.00 35.21 H new ATOM 0 HG22 VAL A 76 4.164 17.121 -14.560 1.00 35.21 H new ATOM 0 HG23 VAL A 76 4.093 16.619 -16.266 1.00 35.21 H new ATOM 1175 N ASN A 77 7.302 13.378 -15.544 1.00 10.34 N ATOM 1176 CA ASN A 77 8.137 12.214 -15.272 1.00 72.32 C ATOM 1177 C ASN A 77 9.605 12.520 -15.553 1.00 30.43 C ATOM 1178 O ASN A 77 10.500 11.906 -14.971 1.00 42.12 O ATOM 1179 CB ASN A 77 7.681 11.025 -16.120 1.00 71.43 C ATOM 1180 CG ASN A 77 8.443 10.920 -17.427 1.00 43.51 C ATOM 1181 OD1 ASN A 77 9.590 10.473 -17.456 1.00 12.03 O ATOM 1182 ND2 ASN A 77 7.808 11.335 -18.517 1.00 71.31 N ATOM 0 H ASN A 77 6.758 13.315 -16.405 1.00 10.34 H new ATOM 0 HA ASN A 77 8.033 11.961 -14.217 1.00 72.32 H new ATOM 0 HB2 ASN A 77 7.813 10.105 -15.551 1.00 71.43 H new ATOM 0 HB3 ASN A 77 6.616 11.120 -16.330 1.00 71.43 H new ATOM 0 HD21 ASN A 77 8.271 11.290 -19.425 1.00 71.31 H new ATOM 0 HD22 ASN A 77 6.858 11.698 -18.446 1.00 71.31 H new ATOM 1189 N PHE A 78 9.845 13.473 -16.447 1.00 73.42 N ATOM 1190 CA PHE A 78 11.204 13.860 -16.806 1.00 10.34 C ATOM 1191 C PHE A 78 11.887 14.581 -15.647 1.00 43.12 C ATOM 1192 O PHE A 78 12.915 14.129 -15.141 1.00 13.32 O ATOM 1193 CB PHE A 78 11.191 14.759 -18.044 1.00 10.22 C ATOM 1194 CG PHE A 78 11.505 14.029 -19.318 1.00 64.20 C ATOM 1195 CD1 PHE A 78 10.770 12.916 -19.694 1.00 5.12 C ATOM 1196 CD2 PHE A 78 12.537 14.455 -20.140 1.00 35.12 C ATOM 1197 CE1 PHE A 78 11.057 12.242 -20.866 1.00 30.10 C ATOM 1198 CE2 PHE A 78 12.827 13.785 -21.313 1.00 43.02 C ATOM 1199 CZ PHE A 78 12.088 12.677 -21.676 1.00 75.52 C ATOM 0 H PHE A 78 9.116 13.992 -16.936 1.00 73.42 H new ATOM 0 HA PHE A 78 11.767 12.954 -17.030 1.00 10.34 H new ATOM 0 HB2 PHE A 78 10.210 15.225 -18.134 1.00 10.22 H new ATOM 0 HB3 PHE A 78 11.915 15.563 -17.907 1.00 10.22 H new ATOM 0 HD1 PHE A 78 9.963 12.571 -19.064 1.00 5.12 H new ATOM 0 HD2 PHE A 78 13.120 15.320 -19.860 1.00 35.12 H new ATOM 0 HE1 PHE A 78 10.476 11.376 -21.148 1.00 30.10 H new ATOM 0 HE2 PHE A 78 13.632 14.128 -21.946 1.00 43.02 H new ATOM 0 HZ PHE A 78 12.315 12.151 -22.592 1.00 75.52 H new ATOM 1209 N ILE A 79 11.310 15.704 -15.234 1.00 14.02 N ATOM 1210 CA ILE A 79 11.862 16.487 -14.136 1.00 11.25 C ATOM 1211 C ILE A 79 11.973 15.651 -12.866 1.00 24.55 C ATOM 1212 O ILE A 79 12.762 15.960 -11.972 1.00 33.02 O ATOM 1213 CB ILE A 79 11.003 17.731 -13.843 1.00 55.34 C ATOM 1214 CG1 ILE A 79 10.939 18.635 -15.076 1.00 52.14 C ATOM 1215 CG2 ILE A 79 11.561 18.493 -12.650 1.00 71.53 C ATOM 1216 CD1 ILE A 79 10.151 19.907 -14.853 1.00 61.03 C ATOM 0 H ILE A 79 10.460 16.092 -15.643 1.00 14.02 H new ATOM 0 HA ILE A 79 12.857 16.807 -14.447 1.00 11.25 H new ATOM 0 HB ILE A 79 9.991 17.406 -13.600 1.00 55.34 H new ATOM 0 HG12 ILE A 79 11.953 18.894 -15.379 1.00 52.14 H new ATOM 0 HG13 ILE A 79 10.492 18.080 -15.901 1.00 52.14 H new ATOM 0 HG21 ILE A 79 10.942 19.369 -12.456 1.00 71.53 H new ATOM 0 HG22 ILE A 79 11.560 17.847 -11.772 1.00 71.53 H new ATOM 0 HG23 ILE A 79 12.581 18.810 -12.866 1.00 71.53 H new ATOM 0 HD11 ILE A 79 10.148 20.498 -15.769 1.00 61.03 H new ATOM 0 HD12 ILE A 79 9.126 19.657 -14.579 1.00 61.03 H new ATOM 0 HD13 ILE A 79 10.610 20.484 -14.050 1.00 61.03 H new ATOM 1228 N LYS A 80 11.180 14.587 -12.793 1.00 0.24 N ATOM 1229 CA LYS A 80 11.190 13.702 -11.634 1.00 5.22 C ATOM 1230 C LYS A 80 12.394 12.766 -11.675 1.00 71.12 C ATOM 1231 O LYS A 80 13.023 12.500 -10.650 1.00 55.15 O ATOM 1232 CB LYS A 80 9.897 12.886 -11.578 1.00 63.22 C ATOM 1233 CG LYS A 80 8.829 13.498 -10.688 1.00 63.14 C ATOM 1234 CD LYS A 80 7.502 12.772 -10.831 1.00 12.42 C ATOM 1235 CE LYS A 80 7.634 11.297 -10.487 1.00 74.41 C ATOM 1236 NZ LYS A 80 6.372 10.744 -9.922 1.00 34.03 N ATOM 0 H LYS A 80 10.522 14.317 -13.524 1.00 0.24 H new ATOM 0 HA LYS A 80 11.262 14.318 -10.738 1.00 5.22 H new ATOM 0 HB2 LYS A 80 9.500 12.781 -12.588 1.00 63.22 H new ATOM 0 HB3 LYS A 80 10.126 11.883 -11.219 1.00 63.22 H new ATOM 0 HG2 LYS A 80 9.155 13.461 -9.649 1.00 63.14 H new ATOM 0 HG3 LYS A 80 8.699 14.550 -10.944 1.00 63.14 H new ATOM 0 HD2 LYS A 80 6.761 13.234 -10.178 1.00 12.42 H new ATOM 0 HD3 LYS A 80 7.137 12.877 -11.853 1.00 12.42 H new ATOM 0 HE2 LYS A 80 7.906 10.738 -11.382 1.00 74.41 H new ATOM 0 HE3 LYS A 80 8.443 11.163 -9.769 1.00 74.41 H new ATOM 0 HZ1 LYS A 80 6.596 10.095 -9.141 1.00 34.03 H new ATOM 0 HZ2 LYS A 80 5.781 11.522 -9.566 1.00 34.03 H new ATOM 0 HZ3 LYS A 80 5.856 10.229 -10.664 1.00 34.03 H new ATOM 1250 N LYS A 81 12.711 12.269 -12.866 1.00 53.32 N ATOM 1251 CA LYS A 81 13.841 11.365 -13.043 1.00 34.34 C ATOM 1252 C LYS A 81 15.152 12.140 -13.112 1.00 25.21 C ATOM 1253 O LYS A 81 16.217 11.607 -12.797 1.00 35.22 O ATOM 1254 CB LYS A 81 13.660 10.532 -14.314 1.00 1.01 C ATOM 1255 CG LYS A 81 13.644 11.361 -15.587 1.00 32.24 C ATOM 1256 CD LYS A 81 14.170 10.571 -16.773 1.00 71.12 C ATOM 1257 CE LYS A 81 15.225 11.353 -17.540 1.00 4.13 C ATOM 1258 NZ LYS A 81 16.039 10.470 -18.421 1.00 11.41 N ATOM 0 H LYS A 81 12.200 12.478 -13.724 1.00 53.32 H new ATOM 0 HA LYS A 81 13.879 10.698 -12.182 1.00 34.34 H new ATOM 0 HB2 LYS A 81 14.466 9.800 -14.377 1.00 1.01 H new ATOM 0 HB3 LYS A 81 12.727 9.973 -14.242 1.00 1.01 H new ATOM 0 HG2 LYS A 81 12.627 11.694 -15.793 1.00 32.24 H new ATOM 0 HG3 LYS A 81 14.250 12.256 -15.447 1.00 32.24 H new ATOM 0 HD2 LYS A 81 14.595 9.630 -16.425 1.00 71.12 H new ATOM 0 HD3 LYS A 81 13.345 10.321 -17.440 1.00 71.12 H new ATOM 0 HE2 LYS A 81 14.741 12.121 -18.143 1.00 4.13 H new ATOM 0 HE3 LYS A 81 15.880 11.867 -16.836 1.00 4.13 H new ATOM 0 HZ1 LYS A 81 16.746 11.041 -18.926 1.00 11.41 H new ATOM 0 HZ2 LYS A 81 16.522 9.753 -17.843 1.00 11.41 H new ATOM 0 HZ3 LYS A 81 15.418 9.999 -19.110 1.00 11.41 H new ATOM 1272 N ARG A 82 15.069 13.400 -13.525 1.00 13.33 N ATOM 1273 CA ARG A 82 16.250 14.248 -13.635 1.00 15.33 C ATOM 1274 C ARG A 82 16.545 14.943 -12.309 1.00 3.03 C ATOM 1275 O ARG A 82 17.613 15.528 -12.126 1.00 41.23 O ATOM 1276 CB ARG A 82 16.054 15.291 -14.737 1.00 12.24 C ATOM 1277 CG ARG A 82 15.667 16.665 -14.213 1.00 64.14 C ATOM 1278 CD ARG A 82 15.597 17.689 -15.335 1.00 70.25 C ATOM 1279 NE ARG A 82 14.386 17.539 -16.138 1.00 10.01 N ATOM 1280 CZ ARG A 82 13.927 18.478 -16.958 1.00 60.20 C ATOM 1281 NH1 ARG A 82 14.575 19.628 -17.084 1.00 21.44 N ATOM 1282 NH2 ARG A 82 12.818 18.267 -17.655 1.00 52.11 N ATOM 0 H ARG A 82 14.196 13.857 -13.789 1.00 13.33 H new ATOM 0 HA ARG A 82 17.099 13.614 -13.891 1.00 15.33 H new ATOM 0 HB2 ARG A 82 16.976 15.377 -15.312 1.00 12.24 H new ATOM 0 HB3 ARG A 82 15.282 14.942 -15.423 1.00 12.24 H new ATOM 0 HG2 ARG A 82 14.701 16.606 -13.712 1.00 64.14 H new ATOM 0 HG3 ARG A 82 16.393 16.989 -13.468 1.00 64.14 H new ATOM 0 HD2 ARG A 82 15.629 18.693 -14.912 1.00 70.25 H new ATOM 0 HD3 ARG A 82 16.472 17.585 -15.976 1.00 70.25 H new ATOM 0 HE ARG A 82 13.864 16.666 -16.065 1.00 10.01 H new ATOM 0 HH11 ARG A 82 15.428 19.794 -16.551 1.00 21.44 H new ATOM 0 HH12 ARG A 82 14.220 20.347 -17.714 1.00 21.44 H new ATOM 0 HH21 ARG A 82 12.317 17.383 -17.561 1.00 52.11 H new ATOM 0 HH22 ARG A 82 12.466 18.988 -18.284 1.00 52.11 H new ATOM 1296 N LYS A 83 15.592 14.875 -11.386 1.00 21.04 N ATOM 1297 CA LYS A 83 15.749 15.496 -10.076 1.00 0.13 C ATOM 1298 C LYS A 83 15.911 14.439 -8.988 1.00 61.12 C ATOM 1299 O LYS A 83 16.758 14.568 -8.105 1.00 33.30 O ATOM 1300 CB LYS A 83 14.543 16.385 -9.762 1.00 64.12 C ATOM 1301 CG LYS A 83 14.685 17.168 -8.468 1.00 61.04 C ATOM 1302 CD LYS A 83 15.568 18.391 -8.651 1.00 23.13 C ATOM 1303 CE LYS A 83 15.490 19.319 -7.448 1.00 50.24 C ATOM 1304 NZ LYS A 83 15.805 20.728 -7.814 1.00 1.00 N ATOM 0 H LYS A 83 14.702 14.396 -11.521 1.00 21.04 H new ATOM 0 HA LYS A 83 16.649 16.110 -10.099 1.00 0.13 H new ATOM 0 HB2 LYS A 83 14.393 17.084 -10.585 1.00 64.12 H new ATOM 0 HB3 LYS A 83 13.649 15.764 -9.705 1.00 64.12 H new ATOM 0 HG2 LYS A 83 13.700 17.478 -8.119 1.00 61.04 H new ATOM 0 HG3 LYS A 83 15.108 16.524 -7.697 1.00 61.04 H new ATOM 0 HD2 LYS A 83 16.600 18.076 -8.803 1.00 23.13 H new ATOM 0 HD3 LYS A 83 15.264 18.930 -9.548 1.00 23.13 H new ATOM 0 HE2 LYS A 83 14.490 19.271 -7.016 1.00 50.24 H new ATOM 0 HE3 LYS A 83 16.186 18.979 -6.681 1.00 50.24 H new ATOM 0 HZ1 LYS A 83 15.741 21.329 -6.968 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 16.768 20.779 -8.203 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 15.126 21.062 -8.527 1.00 1.00 H new ATOM 1318 N GLY A 84 15.094 13.392 -9.060 1.00 2.21 N ATOM 1319 CA GLY A 84 15.165 12.328 -8.076 1.00 75.52 C ATOM 1320 C GLY A 84 15.790 11.064 -8.633 1.00 4.20 C ATOM 1321 O GLY A 84 16.954 10.768 -8.361 1.00 33.03 O ATOM 0 H GLY A 84 14.385 13.262 -9.782 1.00 2.21 H new ATOM 0 HA2 GLY A 84 15.745 12.669 -7.218 1.00 75.52 H new ATOM 0 HA3 GLY A 84 14.161 12.104 -7.714 1.00 75.52 H new TER 1325 GLY A 84