USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1003 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 97 TYR OH : rot 70:sc= 1.74 USER MOD Set 1.2: A 117 TYR OH : rot 180:sc= 0.806 USER MOD Set 2.1: A 18 MET CE :methyl -168:sc= -1.79 (180deg=-2.63) USER MOD Set 2.2: A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -132:sc= 0.156 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 HIS : no HD1:sc= -1.5 X(o=-1.5,f=-1.5) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 THR OG1 : rot 70:sc= -0.168 USER MOD Single : A 15 SER OG : rot 180:sc= -0.11 USER MOD Single : A 17 THR OG1 : rot 180:sc=-0.000465 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -173:sc= 1.15 (180deg=1.11) USER MOD Single : A 26 LYS NZ :NH3+ 138:sc= 1.24 (180deg=0.122) USER MOD Single : A 29 GLN : amide:sc= -0.404 X(o=-0.4,f=-0.37) USER MOD Single : A 32 TYR OH : rot 108:sc= 0.0997 USER MOD Single : A 35 GLN : amide:sc= 0.94 K(o=0.94,f=-0.74) USER MOD Single : A 37 TYR OH : rot 171:sc= 1.15 USER MOD Single : A 38 HIS :FLIP no HD1:sc= -0.356 F(o=-1.2,f=-0.36) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ -173:sc= 2.07 (180deg=2) USER MOD Single : A 47 LYS NZ :NH3+ 151:sc= -0.107 (180deg=-0.55) USER MOD Single : A 48 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00164) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 12:sc= 0.791 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 81 ASN :FLIP amide:sc= -0.437 F(o=-2.7!,f=-0.44) USER MOD Single : A 88 LYS NZ :NH3+ -138:sc= 1.77 (180deg=0.172) USER MOD Single : A 89 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0101) USER MOD Single : A 95 LYS NZ :NH3+ 172:sc= -0.842 (180deg=-0.984) USER MOD Single : A 98 SER OG : rot 130:sc= 0 USER MOD Single : A 99 THR OG1 : rot -78:sc= 1.03 USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0.0043) USER MOD Single : A 103 SER OG : rot -67:sc= 1.19 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -0.429 X(o=-0.43,f=0) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ -167:sc= 0.907 (180deg=0.756) USER MOD Single : A 125 ASN : amide:sc= -0.116 K(o=-0.12,f=-0.65) USER MOD Single : A 127 LYS NZ :NH3+ -162:sc= -0.0107 (180deg=-0.515) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 47.548 -13.875 -23.723 1.00 0.00 N ATOM 2 CA GLY A 1 47.194 -13.501 -22.344 1.00 0.00 C ATOM 3 C GLY A 1 46.082 -14.410 -21.860 1.00 0.00 C ATOM 4 O GLY A 1 45.917 -15.491 -22.419 1.00 0.00 O ATOM 0 H1 GLY A 1 48.581 -13.961 -23.805 1.00 0.00 H new ATOM 0 H2 GLY A 1 47.105 -14.786 -23.960 1.00 0.00 H new ATOM 0 H3 GLY A 1 47.208 -13.143 -24.379 1.00 0.00 H new ATOM 0 HA2 GLY A 1 48.064 -13.591 -21.694 1.00 0.00 H new ATOM 0 HA3 GLY A 1 46.873 -12.460 -22.306 1.00 0.00 H new ATOM 8 N SER A 2 45.334 -13.981 -20.852 1.00 0.00 N ATOM 9 CA SER A 2 44.220 -14.702 -20.252 1.00 0.00 C ATOM 10 C SER A 2 43.153 -13.667 -19.875 1.00 0.00 C ATOM 11 O SER A 2 43.383 -12.465 -20.033 1.00 0.00 O ATOM 12 CB SER A 2 44.727 -15.523 -19.051 1.00 0.00 C ATOM 13 OG SER A 2 45.739 -14.837 -18.328 1.00 0.00 O ATOM 0 H SER A 2 45.496 -13.076 -20.409 1.00 0.00 H new ATOM 0 HA SER A 2 43.772 -15.418 -20.941 1.00 0.00 H new ATOM 0 HB2 SER A 2 43.893 -15.745 -18.385 1.00 0.00 H new ATOM 0 HB3 SER A 2 45.117 -16.478 -19.403 1.00 0.00 H new ATOM 0 HG SER A 2 46.033 -15.389 -17.574 1.00 0.00 H new ATOM 19 N THR A 3 41.997 -14.124 -19.405 1.00 0.00 N ATOM 20 CA THR A 3 40.870 -13.295 -19.002 1.00 0.00 C ATOM 21 C THR A 3 40.290 -13.855 -17.698 1.00 0.00 C ATOM 22 O THR A 3 40.774 -14.866 -17.181 1.00 0.00 O ATOM 23 CB THR A 3 39.836 -13.247 -20.150 1.00 0.00 C ATOM 24 OG1 THR A 3 39.587 -14.542 -20.669 1.00 0.00 O ATOM 25 CG2 THR A 3 40.308 -12.371 -21.315 1.00 0.00 C ATOM 0 H THR A 3 41.814 -15.121 -19.291 1.00 0.00 H new ATOM 0 HA THR A 3 41.180 -12.268 -18.810 1.00 0.00 H new ATOM 0 HB THR A 3 38.930 -12.825 -19.716 1.00 0.00 H new ATOM 0 HG1 THR A 3 38.928 -14.483 -21.392 1.00 0.00 H new ATOM 0 HG21 THR A 3 39.550 -12.367 -22.098 1.00 0.00 H new ATOM 0 HG22 THR A 3 40.470 -11.353 -20.962 1.00 0.00 H new ATOM 0 HG23 THR A 3 41.240 -12.769 -21.715 1.00 0.00 H new ATOM 33 N MET A 4 39.269 -13.192 -17.160 1.00 0.00 N ATOM 34 CA MET A 4 38.568 -13.554 -15.934 1.00 0.00 C ATOM 35 C MET A 4 37.069 -13.615 -16.256 1.00 0.00 C ATOM 36 O MET A 4 36.683 -13.514 -17.424 1.00 0.00 O ATOM 37 CB MET A 4 38.891 -12.546 -14.811 1.00 0.00 C ATOM 38 CG MET A 4 40.384 -12.455 -14.457 1.00 0.00 C ATOM 39 SD MET A 4 41.398 -11.421 -15.555 1.00 0.00 S ATOM 40 CE MET A 4 43.018 -11.655 -14.779 1.00 0.00 C ATOM 0 H MET A 4 38.891 -12.347 -17.589 1.00 0.00 H new ATOM 0 HA MET A 4 38.892 -14.528 -15.569 1.00 0.00 H new ATOM 0 HB2 MET A 4 38.540 -11.559 -15.112 1.00 0.00 H new ATOM 0 HB3 MET A 4 38.333 -12.824 -13.917 1.00 0.00 H new ATOM 0 HG2 MET A 4 40.474 -12.070 -13.441 1.00 0.00 H new ATOM 0 HG3 MET A 4 40.799 -13.463 -14.453 1.00 0.00 H new ATOM 0 HE1 MET A 4 43.769 -11.087 -15.327 1.00 0.00 H new ATOM 0 HE2 MET A 4 42.981 -11.306 -13.747 1.00 0.00 H new ATOM 0 HE3 MET A 4 43.280 -12.713 -14.795 1.00 0.00 H new ATOM 50 N HIS A 5 36.228 -13.837 -15.246 1.00 0.00 N ATOM 51 CA HIS A 5 34.778 -13.909 -15.377 1.00 0.00 C ATOM 52 C HIS A 5 34.150 -12.796 -14.523 1.00 0.00 C ATOM 53 O HIS A 5 34.859 -11.963 -13.956 1.00 0.00 O ATOM 54 CB HIS A 5 34.290 -15.329 -15.030 1.00 0.00 C ATOM 55 CG HIS A 5 32.864 -15.614 -15.446 1.00 0.00 C ATOM 56 ND1 HIS A 5 32.308 -15.355 -16.684 1.00 0.00 N ATOM 57 CD2 HIS A 5 31.876 -16.127 -14.647 1.00 0.00 C ATOM 58 CE1 HIS A 5 31.010 -15.703 -16.625 1.00 0.00 C ATOM 59 NE2 HIS A 5 30.702 -16.172 -15.406 1.00 0.00 N ATOM 0 H HIS A 5 36.549 -13.975 -14.288 1.00 0.00 H new ATOM 0 HA HIS A 5 34.460 -13.734 -16.405 1.00 0.00 H new ATOM 0 HB2 HIS A 5 34.948 -16.054 -15.509 1.00 0.00 H new ATOM 0 HB3 HIS A 5 34.380 -15.479 -13.954 1.00 0.00 H new ATOM 0 HD2 HIS A 5 31.984 -16.440 -13.619 1.00 0.00 H new ATOM 0 HE1 HIS A 5 30.312 -15.617 -17.445 1.00 0.00 H new ATOM 0 HE2 HIS A 5 29.788 -16.498 -15.093 1.00 0.00 H new ATOM 67 N PHE A 6 32.823 -12.748 -14.478 1.00 0.00 N ATOM 68 CA PHE A 6 32.003 -11.790 -13.750 1.00 0.00 C ATOM 69 C PHE A 6 30.939 -12.566 -12.975 1.00 0.00 C ATOM 70 O PHE A 6 30.881 -13.789 -13.081 1.00 0.00 O ATOM 71 CB PHE A 6 31.348 -10.838 -14.773 1.00 0.00 C ATOM 72 CG PHE A 6 30.658 -11.531 -15.947 1.00 0.00 C ATOM 73 CD1 PHE A 6 29.505 -12.324 -15.753 1.00 0.00 C ATOM 74 CD2 PHE A 6 31.190 -11.407 -17.246 1.00 0.00 C ATOM 75 CE1 PHE A 6 28.916 -13.004 -16.833 1.00 0.00 C ATOM 76 CE2 PHE A 6 30.582 -12.062 -18.332 1.00 0.00 C ATOM 77 CZ PHE A 6 29.444 -12.863 -18.127 1.00 0.00 C ATOM 0 H PHE A 6 32.254 -13.425 -14.985 1.00 0.00 H new ATOM 0 HA PHE A 6 32.598 -11.204 -13.050 1.00 0.00 H new ATOM 0 HB2 PHE A 6 30.616 -10.219 -14.254 1.00 0.00 H new ATOM 0 HB3 PHE A 6 32.113 -10.167 -15.165 1.00 0.00 H new ATOM 0 HD1 PHE A 6 29.073 -12.408 -14.767 1.00 0.00 H new ATOM 0 HD2 PHE A 6 32.071 -10.804 -17.409 1.00 0.00 H new ATOM 0 HE1 PHE A 6 28.056 -13.636 -16.668 1.00 0.00 H new ATOM 0 HE2 PHE A 6 30.990 -11.950 -19.326 1.00 0.00 H new ATOM 0 HZ PHE A 6 28.978 -13.367 -18.961 1.00 0.00 H new ATOM 87 N THR A 7 30.122 -11.877 -12.177 1.00 0.00 N ATOM 88 CA THR A 7 29.046 -12.511 -11.431 1.00 0.00 C ATOM 89 C THR A 7 27.834 -11.571 -11.440 1.00 0.00 C ATOM 90 O THR A 7 27.939 -10.379 -11.757 1.00 0.00 O ATOM 91 CB THR A 7 29.468 -12.966 -10.014 1.00 0.00 C ATOM 92 OG1 THR A 7 29.846 -11.890 -9.180 1.00 0.00 O ATOM 93 CG2 THR A 7 30.613 -13.983 -9.986 1.00 0.00 C ATOM 0 H THR A 7 30.191 -10.870 -12.033 1.00 0.00 H new ATOM 0 HA THR A 7 28.771 -13.444 -11.922 1.00 0.00 H new ATOM 0 HB THR A 7 28.563 -13.444 -9.639 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.101 -12.233 -8.298 1.00 0.00 H new ATOM 0 HG21 THR A 7 30.842 -14.245 -8.953 1.00 0.00 H new ATOM 0 HG22 THR A 7 30.317 -14.880 -10.530 1.00 0.00 H new ATOM 0 HG23 THR A 7 31.496 -13.549 -10.455 1.00 0.00 H new ATOM 101 N ASP A 8 26.679 -12.141 -11.135 1.00 0.00 N ATOM 102 CA ASP A 8 25.361 -11.525 -11.042 1.00 0.00 C ATOM 103 C ASP A 8 25.097 -11.169 -9.580 1.00 0.00 C ATOM 104 O ASP A 8 25.920 -11.443 -8.702 1.00 0.00 O ATOM 105 CB ASP A 8 24.288 -12.504 -11.551 1.00 0.00 C ATOM 106 CG ASP A 8 24.448 -13.884 -10.918 1.00 0.00 C ATOM 107 OD1 ASP A 8 25.281 -14.666 -11.440 1.00 0.00 O ATOM 108 OD2 ASP A 8 23.854 -14.155 -9.853 1.00 0.00 O ATOM 0 H ASP A 8 26.635 -13.139 -10.927 1.00 0.00 H new ATOM 0 HA ASP A 8 25.324 -10.625 -11.655 1.00 0.00 H new ATOM 0 HB2 ASP A 8 23.297 -12.111 -11.324 1.00 0.00 H new ATOM 0 HB3 ASP A 8 24.356 -12.589 -12.636 1.00 0.00 H new ATOM 113 N ASP A 9 23.961 -10.537 -9.315 1.00 0.00 N ATOM 114 CA ASP A 9 23.482 -10.095 -8.009 1.00 0.00 C ATOM 115 C ASP A 9 22.031 -10.567 -7.842 1.00 0.00 C ATOM 116 O ASP A 9 21.429 -11.055 -8.803 1.00 0.00 O ATOM 117 CB ASP A 9 23.673 -8.578 -7.842 1.00 0.00 C ATOM 118 CG ASP A 9 23.175 -7.749 -9.025 1.00 0.00 C ATOM 119 OD1 ASP A 9 21.960 -7.784 -9.328 1.00 0.00 O ATOM 120 OD2 ASP A 9 24.012 -7.089 -9.690 1.00 0.00 O ATOM 0 H ASP A 9 23.303 -10.303 -10.058 1.00 0.00 H new ATOM 0 HA ASP A 9 24.067 -10.541 -7.205 1.00 0.00 H new ATOM 0 HB2 ASP A 9 23.151 -8.255 -6.941 1.00 0.00 H new ATOM 0 HB3 ASP A 9 24.732 -8.371 -7.688 1.00 0.00 H new ATOM 125 N ASN A 10 21.476 -10.471 -6.626 1.00 0.00 N ATOM 126 CA ASN A 10 20.115 -10.905 -6.308 1.00 0.00 C ATOM 127 C ASN A 10 19.379 -9.849 -5.495 1.00 0.00 C ATOM 128 O ASN A 10 19.964 -9.240 -4.596 1.00 0.00 O ATOM 129 CB ASN A 10 20.137 -12.162 -5.425 1.00 0.00 C ATOM 130 CG ASN A 10 20.737 -13.403 -6.049 1.00 0.00 C ATOM 131 OD1 ASN A 10 20.458 -13.760 -7.192 1.00 0.00 O ATOM 132 ND2 ASN A 10 21.528 -14.126 -5.278 1.00 0.00 N ATOM 0 H ASN A 10 21.972 -10.082 -5.824 1.00 0.00 H new ATOM 0 HA ASN A 10 19.622 -11.089 -7.262 1.00 0.00 H new ATOM 0 HB2 ASN A 10 20.692 -11.933 -4.515 1.00 0.00 H new ATOM 0 HB3 ASN A 10 19.114 -12.389 -5.125 1.00 0.00 H new ATOM 0 HD21 ASN A 10 21.921 -15.000 -5.628 1.00 0.00 H new ATOM 0 HD22 ASN A 10 21.746 -13.811 -4.333 1.00 0.00 H new ATOM 139 N GLU A 11 18.078 -9.708 -5.735 1.00 0.00 N ATOM 140 CA GLU A 11 17.207 -8.759 -5.048 1.00 0.00 C ATOM 141 C GLU A 11 16.401 -9.477 -3.959 1.00 0.00 C ATOM 142 O GLU A 11 16.296 -10.704 -3.966 1.00 0.00 O ATOM 143 CB GLU A 11 16.273 -8.084 -6.068 1.00 0.00 C ATOM 144 CG GLU A 11 17.077 -7.487 -7.227 1.00 0.00 C ATOM 145 CD GLU A 11 16.285 -6.499 -8.075 1.00 0.00 C ATOM 146 OE1 GLU A 11 15.488 -6.940 -8.942 1.00 0.00 O ATOM 147 OE2 GLU A 11 16.620 -5.294 -8.011 1.00 0.00 O ATOM 0 H GLU A 11 17.587 -10.267 -6.433 1.00 0.00 H new ATOM 0 HA GLU A 11 17.813 -7.990 -4.569 1.00 0.00 H new ATOM 0 HB2 GLU A 11 15.559 -8.812 -6.452 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.696 -7.300 -5.577 1.00 0.00 H new ATOM 0 HG2 GLU A 11 17.957 -6.985 -6.826 1.00 0.00 H new ATOM 0 HG3 GLU A 11 17.434 -8.296 -7.865 1.00 0.00 H new ATOM 154 N ASN A 12 15.794 -8.729 -3.034 1.00 0.00 N ATOM 155 CA ASN A 12 14.986 -9.274 -1.934 1.00 0.00 C ATOM 156 C ASN A 12 13.748 -8.406 -1.711 1.00 0.00 C ATOM 157 O ASN A 12 13.372 -8.107 -0.576 1.00 0.00 O ATOM 158 CB ASN A 12 15.814 -9.393 -0.643 1.00 0.00 C ATOM 159 CG ASN A 12 16.935 -10.412 -0.730 1.00 0.00 C ATOM 160 OD1 ASN A 12 18.109 -10.047 -0.653 1.00 0.00 O ATOM 161 ND2 ASN A 12 16.607 -11.683 -0.866 1.00 0.00 N ATOM 0 H ASN A 12 15.850 -7.711 -3.026 1.00 0.00 H new ATOM 0 HA ASN A 12 14.662 -10.278 -2.210 1.00 0.00 H new ATOM 0 HB2 ASN A 12 16.239 -8.418 -0.403 1.00 0.00 H new ATOM 0 HB3 ASN A 12 15.152 -9.664 0.179 1.00 0.00 H new ATOM 0 HD21 ASN A 12 17.335 -12.396 -0.910 1.00 0.00 H new ATOM 0 HD22 ASN A 12 15.625 -11.953 -0.927 1.00 0.00 H new ATOM 168 N ASP A 13 13.156 -7.910 -2.796 1.00 0.00 N ATOM 169 CA ASP A 13 11.969 -7.067 -2.720 1.00 0.00 C ATOM 170 C ASP A 13 10.740 -7.944 -2.435 1.00 0.00 C ATOM 171 O ASP A 13 10.783 -9.169 -2.609 1.00 0.00 O ATOM 172 CB ASP A 13 11.864 -6.177 -3.961 1.00 0.00 C ATOM 173 CG ASP A 13 13.142 -5.362 -4.164 1.00 0.00 C ATOM 174 OD1 ASP A 13 13.500 -4.577 -3.250 1.00 0.00 O ATOM 175 OD2 ASP A 13 13.840 -5.562 -5.173 1.00 0.00 O ATOM 0 H ASP A 13 13.485 -8.081 -3.746 1.00 0.00 H new ATOM 0 HA ASP A 13 12.036 -6.368 -1.886 1.00 0.00 H new ATOM 0 HB2 ASP A 13 11.679 -6.794 -4.840 1.00 0.00 H new ATOM 0 HB3 ASP A 13 11.012 -5.504 -3.859 1.00 0.00 H new ATOM 180 N THR A 14 9.637 -7.344 -1.976 1.00 0.00 N ATOM 181 CA THR A 14 8.408 -8.062 -1.620 1.00 0.00 C ATOM 182 C THR A 14 7.741 -8.818 -2.763 1.00 0.00 C ATOM 183 O THR A 14 7.096 -9.843 -2.506 1.00 0.00 O ATOM 184 CB THR A 14 7.414 -7.101 -0.979 1.00 0.00 C ATOM 185 OG1 THR A 14 6.369 -7.835 -0.388 1.00 0.00 O ATOM 186 CG2 THR A 14 6.848 -6.060 -1.957 1.00 0.00 C ATOM 0 H THR A 14 9.571 -6.335 -1.840 1.00 0.00 H new ATOM 0 HA THR A 14 8.719 -8.832 -0.914 1.00 0.00 H new ATOM 0 HB THR A 14 7.959 -6.537 -0.222 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.708 -8.311 0.399 1.00 0.00 H new ATOM 0 HG21 THR A 14 6.148 -5.410 -1.432 1.00 0.00 H new ATOM 0 HG22 THR A 14 7.663 -5.462 -2.364 1.00 0.00 H new ATOM 0 HG23 THR A 14 6.331 -6.569 -2.770 1.00 0.00 H new ATOM 194 N SER A 15 7.880 -8.302 -3.979 1.00 0.00 N ATOM 195 CA SER A 15 7.341 -8.875 -5.206 1.00 0.00 C ATOM 196 C SER A 15 5.847 -9.245 -5.135 1.00 0.00 C ATOM 197 O SER A 15 5.400 -10.186 -5.801 1.00 0.00 O ATOM 198 CB SER A 15 8.279 -10.023 -5.640 1.00 0.00 C ATOM 199 OG SER A 15 8.419 -11.039 -4.653 1.00 0.00 O ATOM 0 H SER A 15 8.393 -7.436 -4.143 1.00 0.00 H new ATOM 0 HA SER A 15 7.331 -8.115 -5.987 1.00 0.00 H new ATOM 0 HB2 SER A 15 7.896 -10.468 -6.558 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.262 -9.612 -5.871 1.00 0.00 H new ATOM 0 HG SER A 15 9.022 -11.737 -4.985 1.00 0.00 H new ATOM 205 N GLU A 16 5.050 -8.507 -4.353 1.00 0.00 N ATOM 206 CA GLU A 16 3.617 -8.739 -4.152 1.00 0.00 C ATOM 207 C GLU A 16 2.767 -7.644 -4.810 1.00 0.00 C ATOM 208 O GLU A 16 3.251 -6.956 -5.715 1.00 0.00 O ATOM 209 CB GLU A 16 3.368 -8.994 -2.652 1.00 0.00 C ATOM 210 CG GLU A 16 3.246 -7.814 -1.671 1.00 0.00 C ATOM 211 CD GLU A 16 3.008 -8.303 -0.226 1.00 0.00 C ATOM 212 OE1 GLU A 16 2.245 -9.279 -0.045 1.00 0.00 O ATOM 213 OE2 GLU A 16 3.483 -7.676 0.752 1.00 0.00 O ATOM 0 H GLU A 16 5.398 -7.706 -3.826 1.00 0.00 H new ATOM 0 HA GLU A 16 3.283 -9.638 -4.670 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.450 -9.576 -2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 16 4.179 -9.628 -2.294 1.00 0.00 H new ATOM 0 HG2 GLU A 16 4.155 -7.213 -1.708 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.424 -7.168 -1.978 1.00 0.00 H new ATOM 220 N THR A 17 1.494 -7.501 -4.438 1.00 0.00 N ATOM 221 CA THR A 17 0.628 -6.475 -4.999 1.00 0.00 C ATOM 222 C THR A 17 -0.219 -5.827 -3.909 1.00 0.00 C ATOM 223 O THR A 17 -0.298 -6.345 -2.791 1.00 0.00 O ATOM 224 CB THR A 17 -0.186 -7.044 -6.166 1.00 0.00 C ATOM 225 OG1 THR A 17 -0.698 -5.946 -6.883 1.00 0.00 O ATOM 226 CG2 THR A 17 -1.298 -8.016 -5.773 1.00 0.00 C ATOM 0 H THR A 17 1.040 -8.093 -3.742 1.00 0.00 H new ATOM 0 HA THR A 17 1.234 -5.671 -5.417 1.00 0.00 H new ATOM 0 HB THR A 17 0.481 -7.657 -6.772 1.00 0.00 H new ATOM 0 HG1 THR A 17 -1.226 -6.269 -7.643 1.00 0.00 H new ATOM 0 HG21 THR A 17 -1.813 -8.361 -6.669 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.867 -8.870 -5.251 1.00 0.00 H new ATOM 0 HG23 THR A 17 -2.008 -7.511 -5.118 1.00 0.00 H new ATOM 234 N MET A 18 -0.855 -4.692 -4.227 1.00 0.00 N ATOM 235 CA MET A 18 -1.684 -3.985 -3.282 1.00 0.00 C ATOM 236 C MET A 18 -2.844 -4.868 -2.838 1.00 0.00 C ATOM 237 O MET A 18 -3.071 -4.994 -1.635 1.00 0.00 O ATOM 238 CB MET A 18 -2.190 -2.688 -3.919 1.00 0.00 C ATOM 239 CG MET A 18 -1.130 -1.593 -3.928 1.00 0.00 C ATOM 240 SD MET A 18 -0.719 -0.840 -2.325 1.00 0.00 S ATOM 241 CE MET A 18 -1.979 -1.411 -1.144 1.00 0.00 C ATOM 0 H MET A 18 -0.801 -4.252 -5.145 1.00 0.00 H new ATOM 0 HA MET A 18 -1.098 -3.733 -2.398 1.00 0.00 H new ATOM 0 HB2 MET A 18 -2.509 -2.889 -4.942 1.00 0.00 H new ATOM 0 HB3 MET A 18 -3.067 -2.337 -3.375 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.216 -2.008 -4.353 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.464 -0.802 -4.600 1.00 0.00 H new ATOM 0 HE1 MET A 18 -1.908 -0.828 -0.226 1.00 0.00 H new ATOM 0 HE2 MET A 18 -2.970 -1.283 -1.579 1.00 0.00 H new ATOM 0 HE3 MET A 18 -1.815 -2.465 -0.918 1.00 0.00 H new ATOM 251 N GLU A 19 -3.454 -5.597 -3.778 1.00 0.00 N ATOM 252 CA GLU A 19 -4.589 -6.459 -3.495 1.00 0.00 C ATOM 253 C GLU A 19 -4.209 -7.485 -2.432 1.00 0.00 C ATOM 254 O GLU A 19 -4.997 -7.728 -1.528 1.00 0.00 O ATOM 255 CB GLU A 19 -5.103 -7.153 -4.761 1.00 0.00 C ATOM 256 CG GLU A 19 -5.847 -6.234 -5.731 1.00 0.00 C ATOM 257 CD GLU A 19 -4.913 -5.514 -6.707 1.00 0.00 C ATOM 258 OE1 GLU A 19 -4.079 -4.682 -6.271 1.00 0.00 O ATOM 259 OE2 GLU A 19 -4.991 -5.810 -7.918 1.00 0.00 O ATOM 0 H GLU A 19 -3.168 -5.601 -4.757 1.00 0.00 H new ATOM 0 HA GLU A 19 -5.401 -5.837 -3.117 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -4.258 -7.602 -5.282 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -5.767 -7.967 -4.470 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -6.571 -6.821 -6.296 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.410 -5.494 -5.162 1.00 0.00 H new ATOM 266 N SER A 20 -3.016 -8.088 -2.518 1.00 0.00 N ATOM 267 CA SER A 20 -2.543 -9.073 -1.551 1.00 0.00 C ATOM 268 C SER A 20 -2.439 -8.450 -0.159 1.00 0.00 C ATOM 269 O SER A 20 -2.780 -9.107 0.830 1.00 0.00 O ATOM 270 CB SER A 20 -1.191 -9.631 -2.006 1.00 0.00 C ATOM 271 OG SER A 20 -1.412 -10.604 -3.011 1.00 0.00 O ATOM 0 H SER A 20 -2.351 -7.901 -3.268 1.00 0.00 H new ATOM 0 HA SER A 20 -3.259 -9.893 -1.495 1.00 0.00 H new ATOM 0 HB2 SER A 20 -0.562 -8.828 -2.390 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.663 -10.074 -1.162 1.00 0.00 H new ATOM 0 HG SER A 20 -0.552 -10.966 -3.310 1.00 0.00 H new ATOM 277 N LEU A 21 -2.000 -7.188 -0.076 1.00 0.00 N ATOM 278 CA LEU A 21 -1.877 -6.496 1.195 1.00 0.00 C ATOM 279 C LEU A 21 -3.261 -6.377 1.809 1.00 0.00 C ATOM 280 O LEU A 21 -3.478 -6.798 2.943 1.00 0.00 O ATOM 281 CB LEU A 21 -1.292 -5.075 1.056 1.00 0.00 C ATOM 282 CG LEU A 21 0.055 -4.915 0.352 1.00 0.00 C ATOM 283 CD1 LEU A 21 0.684 -3.608 0.820 1.00 0.00 C ATOM 284 CD2 LEU A 21 1.035 -6.028 0.642 1.00 0.00 C ATOM 0 H LEU A 21 -1.725 -6.630 -0.884 1.00 0.00 H new ATOM 0 HA LEU A 21 -1.194 -7.075 1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.021 -4.465 0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.197 -4.655 2.057 1.00 0.00 H new ATOM 0 HG LEU A 21 -0.146 -4.933 -0.719 1.00 0.00 H new ATOM 0 HD11 LEU A 21 1.648 -3.472 0.330 1.00 0.00 H new ATOM 0 HD12 LEU A 21 0.027 -2.776 0.565 1.00 0.00 H new ATOM 0 HD13 LEU A 21 0.827 -3.639 1.900 1.00 0.00 H new ATOM 0 HD21 LEU A 21 1.966 -5.842 0.106 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.234 -6.067 1.713 1.00 0.00 H new ATOM 0 HD23 LEU A 21 0.613 -6.979 0.316 1.00 0.00 H new ATOM 296 N ILE A 22 -4.209 -5.820 1.060 1.00 0.00 N ATOM 297 CA ILE A 22 -5.569 -5.634 1.531 1.00 0.00 C ATOM 298 C ILE A 22 -6.158 -6.987 1.927 1.00 0.00 C ATOM 299 O ILE A 22 -6.730 -7.103 3.009 1.00 0.00 O ATOM 300 CB ILE A 22 -6.426 -4.955 0.451 1.00 0.00 C ATOM 301 CG1 ILE A 22 -5.861 -3.612 -0.053 1.00 0.00 C ATOM 302 CG2 ILE A 22 -7.806 -4.711 1.062 1.00 0.00 C ATOM 303 CD1 ILE A 22 -6.582 -3.146 -1.323 1.00 0.00 C ATOM 0 H ILE A 22 -4.051 -5.486 0.109 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.562 -4.983 2.405 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.450 -5.614 -0.417 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.966 -2.856 0.725 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.795 -3.716 -0.255 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.449 -4.228 0.326 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.246 -5.663 1.360 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.708 -4.067 1.936 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -6.161 -2.196 -1.653 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.455 -3.892 -2.108 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -7.644 -3.018 -1.112 1.00 0.00 H new ATOM 315 N ASP A 23 -5.996 -7.993 1.072 1.00 0.00 N ATOM 316 CA ASP A 23 -6.467 -9.370 1.225 1.00 0.00 C ATOM 317 C ASP A 23 -5.975 -10.011 2.532 1.00 0.00 C ATOM 318 O ASP A 23 -6.624 -10.927 3.031 1.00 0.00 O ATOM 319 CB ASP A 23 -6.097 -10.168 -0.028 1.00 0.00 C ATOM 320 CG ASP A 23 -6.619 -11.603 -0.026 1.00 0.00 C ATOM 321 OD1 ASP A 23 -7.766 -11.829 -0.484 1.00 0.00 O ATOM 322 OD2 ASP A 23 -5.812 -12.502 0.295 1.00 0.00 O ATOM 0 H ASP A 23 -5.498 -7.860 0.192 1.00 0.00 H new ATOM 0 HA ASP A 23 -7.553 -9.373 1.314 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -6.488 -9.651 -0.904 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.012 -10.187 -0.127 1.00 0.00 H new ATOM 327 N LYS A 24 -4.878 -9.532 3.138 1.00 0.00 N ATOM 328 CA LYS A 24 -4.391 -10.073 4.415 1.00 0.00 C ATOM 329 C LYS A 24 -4.690 -9.102 5.562 1.00 0.00 C ATOM 330 O LYS A 24 -4.592 -9.476 6.728 1.00 0.00 O ATOM 331 CB LYS A 24 -2.878 -10.382 4.305 1.00 0.00 C ATOM 332 CG LYS A 24 -1.934 -9.344 4.951 1.00 0.00 C ATOM 333 CD LYS A 24 -1.639 -9.612 6.452 1.00 0.00 C ATOM 334 CE LYS A 24 -1.823 -8.375 7.357 1.00 0.00 C ATOM 335 NZ LYS A 24 -2.736 -8.577 8.507 1.00 0.00 N ATOM 0 H LYS A 24 -4.312 -8.771 2.764 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.914 -11.003 4.637 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.690 -11.352 4.764 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -2.620 -10.473 3.250 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -0.992 -9.332 4.402 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.375 -8.353 4.849 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -2.295 -10.408 6.804 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -0.616 -9.974 6.552 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.847 -8.070 7.735 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.201 -7.552 6.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -2.893 -7.669 8.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -3.645 -8.951 8.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -2.311 -9.253 9.173 1.00 0.00 H new ATOM 349 N GLY A 25 -5.067 -7.862 5.265 1.00 0.00 N ATOM 350 CA GLY A 25 -5.358 -6.843 6.255 1.00 0.00 C ATOM 351 C GLY A 25 -4.145 -5.937 6.487 1.00 0.00 C ATOM 352 O GLY A 25 -3.896 -5.533 7.619 1.00 0.00 O ATOM 0 H GLY A 25 -5.180 -7.535 4.305 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -6.206 -6.243 5.925 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.648 -7.316 7.194 1.00 0.00 H new ATOM 356 N LYS A 26 -3.328 -5.655 5.463 1.00 0.00 N ATOM 357 CA LYS A 26 -2.148 -4.780 5.561 1.00 0.00 C ATOM 358 C LYS A 26 -2.612 -3.367 5.171 1.00 0.00 C ATOM 359 O LYS A 26 -2.231 -2.833 4.132 1.00 0.00 O ATOM 360 CB LYS A 26 -0.973 -5.305 4.691 1.00 0.00 C ATOM 361 CG LYS A 26 0.017 -6.231 5.413 1.00 0.00 C ATOM 362 CD LYS A 26 1.333 -6.506 4.654 1.00 0.00 C ATOM 363 CE LYS A 26 1.301 -7.783 3.798 1.00 0.00 C ATOM 364 NZ LYS A 26 2.633 -8.134 3.248 1.00 0.00 N ATOM 0 H LYS A 26 -3.470 -6.034 4.527 1.00 0.00 H new ATOM 0 HA LYS A 26 -1.748 -4.765 6.575 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -1.387 -5.839 3.836 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -0.424 -4.450 4.297 1.00 0.00 H new ATOM 0 HG2 LYS A 26 0.259 -5.793 6.381 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.477 -7.183 5.608 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.555 -5.654 4.011 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.148 -6.583 5.374 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.931 -8.612 4.402 1.00 0.00 H new ATOM 0 HE3 LYS A 26 0.597 -7.648 2.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 2.781 -9.160 3.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 2.681 -7.852 2.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.372 -7.636 3.784 1.00 0.00 H new ATOM 378 N LEU A 27 -3.451 -2.744 6.003 1.00 0.00 N ATOM 379 CA LEU A 27 -4.005 -1.397 5.771 1.00 0.00 C ATOM 380 C LEU A 27 -3.079 -0.277 6.243 1.00 0.00 C ATOM 381 O LEU A 27 -3.454 0.894 6.204 1.00 0.00 O ATOM 382 CB LEU A 27 -5.362 -1.217 6.485 1.00 0.00 C ATOM 383 CG LEU A 27 -6.521 -2.100 6.006 1.00 0.00 C ATOM 384 CD1 LEU A 27 -6.679 -2.079 4.482 1.00 0.00 C ATOM 385 CD2 LEU A 27 -6.360 -3.547 6.462 1.00 0.00 C ATOM 0 H LEU A 27 -3.773 -3.165 6.874 1.00 0.00 H new ATOM 0 HA LEU A 27 -4.125 -1.323 4.690 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -5.213 -1.401 7.549 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -5.664 -0.175 6.381 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.417 -1.676 6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -7.513 -2.720 4.194 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -6.874 -1.059 4.150 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -5.763 -2.443 4.016 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.202 -4.138 6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -5.432 -3.954 6.060 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.331 -3.584 7.551 1.00 0.00 H new ATOM 397 N ASP A 28 -1.905 -0.609 6.755 1.00 0.00 N ATOM 398 CA ASP A 28 -0.920 0.362 7.252 1.00 0.00 C ATOM 399 C ASP A 28 0.317 0.403 6.367 1.00 0.00 C ATOM 400 O ASP A 28 1.339 0.976 6.737 1.00 0.00 O ATOM 401 CB ASP A 28 -0.551 0.009 8.697 1.00 0.00 C ATOM 402 CG ASP A 28 -0.085 1.238 9.471 1.00 0.00 C ATOM 403 OD1 ASP A 28 -0.913 2.178 9.581 1.00 0.00 O ATOM 404 OD2 ASP A 28 1.014 1.239 10.066 1.00 0.00 O ATOM 0 H ASP A 28 -1.596 -1.577 6.842 1.00 0.00 H new ATOM 0 HA ASP A 28 -1.362 1.358 7.225 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.414 -0.431 9.197 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.237 -0.744 8.699 1.00 0.00 H new ATOM 409 N GLN A 29 0.278 -0.244 5.202 1.00 0.00 N ATOM 410 CA GLN A 29 1.408 -0.309 4.294 1.00 0.00 C ATOM 411 C GLN A 29 0.912 -0.517 2.853 1.00 0.00 C ATOM 412 O GLN A 29 -0.242 -0.893 2.645 1.00 0.00 O ATOM 413 CB GLN A 29 2.342 -1.386 4.864 1.00 0.00 C ATOM 414 CG GLN A 29 1.752 -2.793 5.018 1.00 0.00 C ATOM 415 CD GLN A 29 2.675 -3.665 5.857 1.00 0.00 C ATOM 416 OE1 GLN A 29 2.265 -4.270 6.839 1.00 0.00 O ATOM 417 NE2 GLN A 29 3.935 -3.746 5.486 1.00 0.00 N ATOM 0 H GLN A 29 -0.548 -0.739 4.866 1.00 0.00 H new ATOM 0 HA GLN A 29 1.983 0.614 4.224 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.219 -1.453 4.220 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.690 -1.053 5.842 1.00 0.00 H new ATOM 0 HG2 GLN A 29 0.770 -2.733 5.488 1.00 0.00 H new ATOM 0 HG3 GLN A 29 1.608 -3.244 4.036 1.00 0.00 H new ATOM 0 HE21 GLN A 29 4.259 -3.235 4.665 1.00 0.00 H new ATOM 0 HE22 GLN A 29 4.588 -4.320 6.020 1.00 0.00 H new ATOM 426 N VAL A 30 1.762 -0.237 1.863 1.00 0.00 N ATOM 427 CA VAL A 30 1.461 -0.339 0.422 1.00 0.00 C ATOM 428 C VAL A 30 2.625 -0.894 -0.414 1.00 0.00 C ATOM 429 O VAL A 30 3.708 -1.086 0.145 1.00 0.00 O ATOM 430 CB VAL A 30 1.107 1.069 -0.100 1.00 0.00 C ATOM 431 CG1 VAL A 30 -0.131 1.664 0.583 1.00 0.00 C ATOM 432 CG2 VAL A 30 2.271 2.054 0.025 1.00 0.00 C ATOM 0 H VAL A 30 2.715 0.079 2.043 1.00 0.00 H new ATOM 0 HA VAL A 30 0.634 -1.041 0.316 1.00 0.00 H new ATOM 0 HB VAL A 30 0.883 0.924 -1.157 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.331 2.655 0.175 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.991 1.018 0.405 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.048 1.743 1.655 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.966 3.028 -0.357 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.557 2.148 1.073 1.00 0.00 H new ATOM 0 HG23 VAL A 30 3.121 1.688 -0.551 1.00 0.00 H new ATOM 442 N VAL A 31 2.412 -1.183 -1.708 1.00 0.00 N ATOM 443 CA VAL A 31 3.440 -1.633 -2.640 1.00 0.00 C ATOM 444 C VAL A 31 3.451 -0.647 -3.801 1.00 0.00 C ATOM 445 O VAL A 31 2.428 -0.029 -4.115 1.00 0.00 O ATOM 446 CB VAL A 31 3.339 -3.068 -3.231 1.00 0.00 C ATOM 447 CG1 VAL A 31 2.946 -4.169 -2.277 1.00 0.00 C ATOM 448 CG2 VAL A 31 2.657 -3.286 -4.582 1.00 0.00 C ATOM 0 H VAL A 31 1.491 -1.105 -2.140 1.00 0.00 H new ATOM 0 HA VAL A 31 4.349 -1.672 -2.040 1.00 0.00 H new ATOM 0 HB VAL A 31 4.405 -3.152 -3.445 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.911 -5.118 -2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.679 -4.232 -1.472 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.964 -3.953 -1.857 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.680 -4.346 -4.834 1.00 0.00 H new ATOM 0 HG22 VAL A 31 1.622 -2.949 -4.526 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.182 -2.719 -5.350 1.00 0.00 H new ATOM 458 N TYR A 32 4.598 -0.524 -4.453 1.00 0.00 N ATOM 459 CA TYR A 32 4.785 0.325 -5.618 1.00 0.00 C ATOM 460 C TYR A 32 6.110 -0.092 -6.233 1.00 0.00 C ATOM 461 O TYR A 32 7.122 -0.077 -5.530 1.00 0.00 O ATOM 462 CB TYR A 32 4.783 1.822 -5.257 1.00 0.00 C ATOM 463 CG TYR A 32 5.414 2.751 -6.291 1.00 0.00 C ATOM 464 CD1 TYR A 32 5.095 2.591 -7.648 1.00 0.00 C ATOM 465 CD2 TYR A 32 6.393 3.702 -5.935 1.00 0.00 C ATOM 466 CE1 TYR A 32 5.813 3.267 -8.640 1.00 0.00 C ATOM 467 CE2 TYR A 32 7.118 4.397 -6.919 1.00 0.00 C ATOM 468 CZ TYR A 32 6.853 4.147 -8.283 1.00 0.00 C ATOM 469 OH TYR A 32 7.560 4.763 -9.266 1.00 0.00 O ATOM 0 H TYR A 32 5.444 -1.024 -4.179 1.00 0.00 H new ATOM 0 HA TYR A 32 3.960 0.199 -6.319 1.00 0.00 H new ATOM 0 HB2 TYR A 32 3.752 2.137 -5.094 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.309 1.950 -4.311 1.00 0.00 H new ATOM 0 HD1 TYR A 32 4.284 1.937 -7.931 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.589 3.899 -4.891 1.00 0.00 H new ATOM 0 HE1 TYR A 32 5.570 3.114 -9.681 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.871 5.116 -6.634 1.00 0.00 H new ATOM 0 HH TYR A 32 7.314 5.711 -9.301 1.00 0.00 H new ATOM 479 N ASP A 33 6.081 -0.478 -7.510 1.00 0.00 N ATOM 480 CA ASP A 33 7.247 -0.884 -8.298 1.00 0.00 C ATOM 481 C ASP A 33 8.009 -2.085 -7.727 1.00 0.00 C ATOM 482 O ASP A 33 9.231 -2.118 -7.800 1.00 0.00 O ATOM 483 CB ASP A 33 8.135 0.355 -8.543 1.00 0.00 C ATOM 484 CG ASP A 33 8.946 0.265 -9.831 1.00 0.00 C ATOM 485 OD1 ASP A 33 8.325 0.060 -10.901 1.00 0.00 O ATOM 486 OD2 ASP A 33 10.163 0.548 -9.803 1.00 0.00 O ATOM 0 H ASP A 33 5.213 -0.518 -8.044 1.00 0.00 H new ATOM 0 HA ASP A 33 6.894 -1.262 -9.258 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.506 1.244 -8.578 1.00 0.00 H new ATOM 0 HB3 ASP A 33 8.815 0.479 -7.700 1.00 0.00 H new ATOM 491 N ASP A 34 7.271 -3.083 -7.204 1.00 0.00 N ATOM 492 CA ASP A 34 7.758 -4.344 -6.590 1.00 0.00 C ATOM 493 C ASP A 34 8.266 -4.158 -5.156 1.00 0.00 C ATOM 494 O ASP A 34 8.775 -5.101 -4.549 1.00 0.00 O ATOM 495 CB ASP A 34 8.900 -4.976 -7.424 1.00 0.00 C ATOM 496 CG ASP A 34 8.761 -6.492 -7.567 1.00 0.00 C ATOM 497 OD1 ASP A 34 7.812 -6.887 -8.289 1.00 0.00 O ATOM 498 OD2 ASP A 34 9.618 -7.291 -7.139 1.00 0.00 O ATOM 0 H ASP A 34 6.252 -3.031 -7.196 1.00 0.00 H new ATOM 0 HA ASP A 34 6.890 -5.003 -6.571 1.00 0.00 H new ATOM 0 HB2 ASP A 34 8.914 -4.522 -8.415 1.00 0.00 H new ATOM 0 HB3 ASP A 34 9.857 -4.746 -6.955 1.00 0.00 H new ATOM 503 N GLN A 35 8.123 -2.953 -4.596 1.00 0.00 N ATOM 504 CA GLN A 35 8.614 -2.587 -3.276 1.00 0.00 C ATOM 505 C GLN A 35 7.506 -2.556 -2.247 1.00 0.00 C ATOM 506 O GLN A 35 6.343 -2.487 -2.619 1.00 0.00 O ATOM 507 CB GLN A 35 9.270 -1.207 -3.362 1.00 0.00 C ATOM 508 CG GLN A 35 10.233 -1.008 -4.542 1.00 0.00 C ATOM 509 CD GLN A 35 11.233 -2.149 -4.655 1.00 0.00 C ATOM 510 OE1 GLN A 35 11.166 -3.010 -5.520 1.00 0.00 O ATOM 511 NE2 GLN A 35 12.157 -2.210 -3.729 1.00 0.00 N ATOM 0 H GLN A 35 7.646 -2.185 -5.069 1.00 0.00 H new ATOM 0 HA GLN A 35 9.335 -3.341 -2.958 1.00 0.00 H new ATOM 0 HB2 GLN A 35 8.485 -0.453 -3.425 1.00 0.00 H new ATOM 0 HB3 GLN A 35 9.815 -1.024 -2.436 1.00 0.00 H new ATOM 0 HG2 GLN A 35 9.662 -0.932 -5.468 1.00 0.00 H new ATOM 0 HG3 GLN A 35 10.768 -0.067 -4.419 1.00 0.00 H new ATOM 0 HE21 GLN A 35 12.207 -1.488 -3.010 1.00 0.00 H new ATOM 0 HE22 GLN A 35 12.827 -2.979 -3.727 1.00 0.00 H new ATOM 520 N LEU A 36 7.866 -2.541 -0.964 1.00 0.00 N ATOM 521 CA LEU A 36 6.929 -2.539 0.162 1.00 0.00 C ATOM 522 C LEU A 36 7.251 -1.377 1.085 1.00 0.00 C ATOM 523 O LEU A 36 8.385 -1.313 1.577 1.00 0.00 O ATOM 524 CB LEU A 36 7.078 -3.870 0.919 1.00 0.00 C ATOM 525 CG LEU A 36 5.867 -4.348 1.739 1.00 0.00 C ATOM 526 CD1 LEU A 36 4.618 -4.618 0.892 1.00 0.00 C ATOM 527 CD2 LEU A 36 6.229 -5.686 2.364 1.00 0.00 C ATOM 0 H LEU A 36 8.843 -2.530 -0.670 1.00 0.00 H new ATOM 0 HA LEU A 36 5.905 -2.430 -0.196 1.00 0.00 H new ATOM 0 HB2 LEU A 36 7.324 -4.646 0.194 1.00 0.00 H new ATOM 0 HB3 LEU A 36 7.930 -3.782 1.593 1.00 0.00 H new ATOM 0 HG LEU A 36 5.644 -3.557 2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 36 3.806 -4.951 1.538 1.00 0.00 H new ATOM 0 HD12 LEU A 36 4.322 -3.703 0.379 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.838 -5.392 0.156 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.388 -6.052 2.953 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.461 -6.404 1.577 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.098 -5.563 3.010 1.00 0.00 H new ATOM 539 N TYR A 37 6.288 -0.490 1.342 1.00 0.00 N ATOM 540 CA TYR A 37 6.496 0.668 2.204 1.00 0.00 C ATOM 541 C TYR A 37 5.523 0.673 3.384 1.00 0.00 C ATOM 542 O TYR A 37 4.317 0.523 3.175 1.00 0.00 O ATOM 543 CB TYR A 37 6.368 1.992 1.437 1.00 0.00 C ATOM 544 CG TYR A 37 6.868 2.027 0.009 1.00 0.00 C ATOM 545 CD1 TYR A 37 8.164 1.596 -0.322 1.00 0.00 C ATOM 546 CD2 TYR A 37 6.048 2.585 -0.983 1.00 0.00 C ATOM 547 CE1 TYR A 37 8.619 1.659 -1.649 1.00 0.00 C ATOM 548 CE2 TYR A 37 6.528 2.717 -2.290 1.00 0.00 C ATOM 549 CZ TYR A 37 7.786 2.184 -2.655 1.00 0.00 C ATOM 550 OH TYR A 37 8.201 2.175 -3.955 1.00 0.00 O ATOM 0 H TYR A 37 5.345 -0.556 0.958 1.00 0.00 H new ATOM 0 HA TYR A 37 7.515 0.583 2.581 1.00 0.00 H new ATOM 0 HB2 TYR A 37 5.316 2.276 1.431 1.00 0.00 H new ATOM 0 HB3 TYR A 37 6.902 2.758 1.999 1.00 0.00 H new ATOM 0 HD1 TYR A 37 8.815 1.213 0.450 1.00 0.00 H new ATOM 0 HD2 TYR A 37 5.048 2.912 -0.738 1.00 0.00 H new ATOM 0 HE1 TYR A 37 9.608 1.305 -1.898 1.00 0.00 H new ATOM 0 HE2 TYR A 37 5.931 3.232 -3.029 1.00 0.00 H new ATOM 0 HH TYR A 37 7.458 2.436 -4.538 1.00 0.00 H new ATOM 560 N HIS A 38 6.031 0.845 4.608 1.00 0.00 N ATOM 561 CA HIS A 38 5.245 0.886 5.842 1.00 0.00 C ATOM 562 C HIS A 38 4.917 2.341 6.134 1.00 0.00 C ATOM 563 O HIS A 38 5.828 3.170 6.108 1.00 0.00 O ATOM 564 CB HIS A 38 6.023 0.283 7.031 1.00 0.00 C ATOM 565 CG HIS A 38 5.292 -0.810 7.777 1.00 0.00 C ATOM 566 ND1 HIS A 38 3.950 -0.835 8.037 1.00 0.00 N flip ATOM 567 CD2 HIS A 38 5.830 -1.985 8.273 1.00 0.00 C flip ATOM 568 CE1 HIS A 38 3.660 -2.034 8.691 1.00 0.00 C flip ATOM 569 NE2 HIS A 38 4.821 -2.703 8.794 1.00 0.00 N flip ATOM 0 H HIS A 38 7.031 0.963 4.771 1.00 0.00 H new ATOM 0 HA HIS A 38 4.339 0.295 5.711 1.00 0.00 H new ATOM 0 HB2 HIS A 38 6.968 -0.117 6.664 1.00 0.00 H new ATOM 0 HB3 HIS A 38 6.266 1.082 7.731 1.00 0.00 H new ATOM 0 HD2 HIS A 38 6.871 -2.272 8.246 1.00 0.00 H new ATOM 0 HE1 HIS A 38 2.693 -2.360 9.045 1.00 0.00 H new ATOM 0 HE2 HIS A 38 4.922 -3.629 9.210 1.00 0.00 H new ATOM 577 N LEU A 39 3.644 2.668 6.344 1.00 0.00 N ATOM 578 CA LEU A 39 3.220 4.034 6.641 1.00 0.00 C ATOM 579 C LEU A 39 3.651 4.378 8.068 1.00 0.00 C ATOM 580 O LEU A 39 3.539 3.543 8.964 1.00 0.00 O ATOM 581 CB LEU A 39 1.694 4.174 6.480 1.00 0.00 C ATOM 582 CG LEU A 39 1.154 3.810 5.081 1.00 0.00 C ATOM 583 CD1 LEU A 39 -0.310 4.236 4.972 1.00 0.00 C ATOM 584 CD2 LEU A 39 1.925 4.444 3.920 1.00 0.00 C ATOM 0 H LEU A 39 2.878 1.995 6.313 1.00 0.00 H new ATOM 0 HA LEU A 39 3.688 4.727 5.942 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.205 3.539 7.219 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.412 5.202 6.707 1.00 0.00 H new ATOM 0 HG LEU A 39 1.275 2.730 4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -0.691 3.979 3.984 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.897 3.721 5.733 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -0.388 5.313 5.122 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.478 4.135 2.975 1.00 0.00 H new ATOM 0 HD22 LEU A 39 1.882 5.530 4.004 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.965 4.119 3.953 1.00 0.00 H new ATOM 596 N LYS A 40 4.120 5.608 8.294 1.00 0.00 N ATOM 597 CA LYS A 40 4.582 6.072 9.599 1.00 0.00 C ATOM 598 C LYS A 40 3.664 7.186 10.097 1.00 0.00 C ATOM 599 O LYS A 40 2.976 7.014 11.100 1.00 0.00 O ATOM 600 CB LYS A 40 6.061 6.503 9.526 1.00 0.00 C ATOM 601 CG LYS A 40 7.000 5.578 8.730 1.00 0.00 C ATOM 602 CD LYS A 40 7.123 4.116 9.200 1.00 0.00 C ATOM 603 CE LYS A 40 8.070 4.000 10.399 1.00 0.00 C ATOM 604 NZ LYS A 40 8.222 2.616 10.901 1.00 0.00 N ATOM 0 H LYS A 40 4.189 6.317 7.564 1.00 0.00 H new ATOM 0 HA LYS A 40 4.533 5.258 10.323 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.106 7.499 9.085 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.444 6.587 10.543 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.666 5.571 7.693 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.996 6.020 8.741 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.139 3.734 9.472 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.490 3.497 8.381 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.050 4.385 10.116 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.700 4.632 11.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.875 2.610 11.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.295 2.252 11.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 8.603 2.012 10.145 1.00 0.00 H new ATOM 618 N GLU A 41 3.622 8.325 9.401 1.00 0.00 N ATOM 619 CA GLU A 41 2.771 9.454 9.788 1.00 0.00 C ATOM 620 C GLU A 41 2.198 10.174 8.575 1.00 0.00 C ATOM 621 O GLU A 41 2.595 9.908 7.445 1.00 0.00 O ATOM 622 CB GLU A 41 3.541 10.460 10.662 1.00 0.00 C ATOM 623 CG GLU A 41 4.507 11.365 9.879 1.00 0.00 C ATOM 624 CD GLU A 41 5.338 12.244 10.823 1.00 0.00 C ATOM 625 OE1 GLU A 41 6.114 11.691 11.634 1.00 0.00 O ATOM 626 OE2 GLU A 41 5.170 13.488 10.789 1.00 0.00 O ATOM 0 H GLU A 41 4.173 8.491 8.559 1.00 0.00 H new ATOM 0 HA GLU A 41 1.946 9.037 10.365 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.824 11.086 11.193 1.00 0.00 H new ATOM 0 HB3 GLU A 41 4.105 9.912 11.416 1.00 0.00 H new ATOM 0 HG2 GLU A 41 5.172 10.751 9.271 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.942 11.997 9.194 1.00 0.00 H new ATOM 633 N LYS A 42 1.258 11.084 8.826 1.00 0.00 N ATOM 634 CA LYS A 42 0.593 11.905 7.831 1.00 0.00 C ATOM 635 C LYS A 42 1.434 13.169 7.720 1.00 0.00 C ATOM 636 O LYS A 42 1.837 13.717 8.749 1.00 0.00 O ATOM 637 CB LYS A 42 -0.846 12.216 8.292 1.00 0.00 C ATOM 638 CG LYS A 42 -1.840 12.354 7.132 1.00 0.00 C ATOM 639 CD LYS A 42 -1.656 13.577 6.241 1.00 0.00 C ATOM 640 CE LYS A 42 -1.969 14.956 6.817 1.00 0.00 C ATOM 641 NZ LYS A 42 -2.009 15.942 5.716 1.00 0.00 N ATOM 0 H LYS A 42 0.929 11.273 9.773 1.00 0.00 H new ATOM 0 HA LYS A 42 0.510 11.410 6.863 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.185 11.424 8.959 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -0.843 13.140 8.870 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.770 11.461 6.510 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -2.849 12.377 7.544 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.620 13.587 5.903 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.278 13.439 5.357 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -2.925 14.937 7.340 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.212 15.239 7.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.103 16.900 6.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -1.130 15.881 5.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -2.821 15.740 5.099 1.00 0.00 H new ATOM 655 N VAL A 43 1.718 13.616 6.505 1.00 0.00 N ATOM 656 CA VAL A 43 2.493 14.819 6.240 1.00 0.00 C ATOM 657 C VAL A 43 1.677 15.788 5.381 1.00 0.00 C ATOM 658 O VAL A 43 0.643 15.411 4.816 1.00 0.00 O ATOM 659 CB VAL A 43 3.837 14.441 5.602 1.00 0.00 C ATOM 660 CG1 VAL A 43 4.667 13.543 6.530 1.00 0.00 C ATOM 661 CG2 VAL A 43 3.687 13.770 4.236 1.00 0.00 C ATOM 0 H VAL A 43 1.409 13.141 5.657 1.00 0.00 H new ATOM 0 HA VAL A 43 2.716 15.336 7.174 1.00 0.00 H new ATOM 0 HB VAL A 43 4.362 15.384 5.448 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.612 13.295 6.047 1.00 0.00 H new ATOM 0 HG12 VAL A 43 4.864 14.069 7.464 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.115 12.627 6.739 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.673 13.528 3.839 1.00 0.00 H new ATOM 0 HG22 VAL A 43 3.104 12.855 4.342 1.00 0.00 H new ATOM 0 HG23 VAL A 43 3.177 14.448 3.552 1.00 0.00 H new ATOM 671 N ASP A 44 2.113 17.045 5.282 1.00 0.00 N ATOM 672 CA ASP A 44 1.401 18.014 4.457 1.00 0.00 C ATOM 673 C ASP A 44 1.800 17.812 2.996 1.00 0.00 C ATOM 674 O ASP A 44 2.778 17.133 2.665 1.00 0.00 O ATOM 675 CB ASP A 44 1.674 19.466 4.873 1.00 0.00 C ATOM 676 CG ASP A 44 0.773 20.447 4.127 1.00 0.00 C ATOM 677 OD1 ASP A 44 -0.422 20.136 3.930 1.00 0.00 O ATOM 678 OD2 ASP A 44 1.286 21.484 3.658 1.00 0.00 O ATOM 0 H ASP A 44 2.941 17.408 5.755 1.00 0.00 H new ATOM 0 HA ASP A 44 0.333 17.842 4.595 1.00 0.00 H new ATOM 0 HB2 ASP A 44 1.517 19.572 5.946 1.00 0.00 H new ATOM 0 HB3 ASP A 44 2.718 19.710 4.677 1.00 0.00 H new ATOM 683 N GLU A 45 1.002 18.367 2.106 1.00 0.00 N ATOM 684 CA GLU A 45 1.199 18.332 0.676 1.00 0.00 C ATOM 685 C GLU A 45 2.344 19.234 0.260 1.00 0.00 C ATOM 686 O GLU A 45 2.851 19.056 -0.841 1.00 0.00 O ATOM 687 CB GLU A 45 -0.099 18.641 -0.070 1.00 0.00 C ATOM 688 CG GLU A 45 -0.671 20.052 0.155 1.00 0.00 C ATOM 689 CD GLU A 45 -1.684 20.422 -0.943 1.00 0.00 C ATOM 690 OE1 GLU A 45 -2.253 19.506 -1.589 1.00 0.00 O ATOM 691 OE2 GLU A 45 -1.806 21.613 -1.313 1.00 0.00 O ATOM 0 H GLU A 45 0.161 18.877 2.375 1.00 0.00 H new ATOM 0 HA GLU A 45 1.483 17.318 0.395 1.00 0.00 H new ATOM 0 HB2 GLU A 45 0.074 18.504 -1.137 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.852 17.911 0.227 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.154 20.100 1.131 1.00 0.00 H new ATOM 0 HG3 GLU A 45 0.141 20.779 0.165 1.00 0.00 H new ATOM 698 N ASP A 46 2.788 20.165 1.113 1.00 0.00 N ATOM 699 CA ASP A 46 3.883 21.056 0.734 1.00 0.00 C ATOM 700 C ASP A 46 5.238 20.466 1.120 1.00 0.00 C ATOM 701 O ASP A 46 6.283 21.032 0.806 1.00 0.00 O ATOM 702 CB ASP A 46 3.651 22.477 1.263 1.00 0.00 C ATOM 703 CG ASP A 46 4.305 23.501 0.335 1.00 0.00 C ATOM 704 OD1 ASP A 46 4.002 23.483 -0.881 1.00 0.00 O ATOM 705 OD2 ASP A 46 5.133 24.317 0.808 1.00 0.00 O ATOM 0 H ASP A 46 2.414 20.317 2.050 1.00 0.00 H new ATOM 0 HA ASP A 46 3.900 21.144 -0.352 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.582 22.675 1.338 1.00 0.00 H new ATOM 0 HB3 ASP A 46 4.064 22.570 2.268 1.00 0.00 H new ATOM 710 N LYS A 47 5.229 19.314 1.804 1.00 0.00 N ATOM 711 CA LYS A 47 6.442 18.623 2.222 1.00 0.00 C ATOM 712 C LYS A 47 7.009 17.803 1.075 1.00 0.00 C ATOM 713 O LYS A 47 8.203 17.503 1.090 1.00 0.00 O ATOM 714 CB LYS A 47 6.141 17.621 3.346 1.00 0.00 C ATOM 715 CG LYS A 47 5.267 18.148 4.476 1.00 0.00 C ATOM 716 CD LYS A 47 5.838 19.362 5.203 1.00 0.00 C ATOM 717 CE LYS A 47 5.337 19.335 6.647 1.00 0.00 C ATOM 718 NZ LYS A 47 5.967 18.244 7.434 1.00 0.00 N ATOM 0 H LYS A 47 4.371 18.838 2.081 1.00 0.00 H new ATOM 0 HA LYS A 47 7.142 19.390 2.553 1.00 0.00 H new ATOM 0 HB2 LYS A 47 5.655 16.748 2.911 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.086 17.281 3.769 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.289 18.409 4.071 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.109 17.348 5.199 1.00 0.00 H new ATOM 0 HD2 LYS A 47 6.928 19.342 5.178 1.00 0.00 H new ATOM 0 HD3 LYS A 47 5.525 20.282 4.709 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.548 20.293 7.122 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.254 19.208 6.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.015 18.521 8.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 5.400 17.377 7.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.928 18.069 7.077 1.00 0.00 H new ATOM 732 N LYS A 48 6.172 17.427 0.107 1.00 0.00 N ATOM 733 CA LYS A 48 6.595 16.608 -1.023 1.00 0.00 C ATOM 734 C LYS A 48 7.768 17.217 -1.782 1.00 0.00 C ATOM 735 O LYS A 48 7.715 18.389 -2.155 1.00 0.00 O ATOM 736 CB LYS A 48 5.401 16.352 -1.956 1.00 0.00 C ATOM 737 CG LYS A 48 4.927 17.585 -2.744 1.00 0.00 C ATOM 738 CD LYS A 48 3.549 17.318 -3.350 1.00 0.00 C ATOM 739 CE LYS A 48 2.865 18.541 -3.959 1.00 0.00 C ATOM 740 NZ LYS A 48 3.727 19.338 -4.856 1.00 0.00 N ATOM 0 H LYS A 48 5.185 17.682 0.087 1.00 0.00 H new ATOM 0 HA LYS A 48 6.951 15.657 -0.628 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.671 15.567 -2.663 1.00 0.00 H new ATOM 0 HB3 LYS A 48 4.568 15.974 -1.363 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.882 18.453 -2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.641 17.820 -3.533 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.649 16.555 -4.121 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.902 16.906 -2.576 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.988 18.212 -4.516 1.00 0.00 H new ATOM 0 HE3 LYS A 48 2.509 19.182 -3.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.184 20.138 -5.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 4.544 19.698 -4.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.061 18.740 -5.638 1.00 0.00 H new ATOM 754 N GLY A 49 8.780 16.404 -2.079 1.00 0.00 N ATOM 755 CA GLY A 49 9.930 16.866 -2.839 1.00 0.00 C ATOM 756 C GLY A 49 9.530 16.954 -4.309 1.00 0.00 C ATOM 757 O GLY A 49 9.643 17.999 -4.946 1.00 0.00 O ATOM 0 H GLY A 49 8.823 15.423 -1.803 1.00 0.00 H new ATOM 0 HA2 GLY A 49 10.258 17.840 -2.476 1.00 0.00 H new ATOM 0 HA3 GLY A 49 10.768 16.180 -2.714 1.00 0.00 H new ATOM 761 N LYS A 50 9.014 15.843 -4.843 1.00 0.00 N ATOM 762 CA LYS A 50 8.586 15.670 -6.228 1.00 0.00 C ATOM 763 C LYS A 50 7.808 14.366 -6.341 1.00 0.00 C ATOM 764 O LYS A 50 7.864 13.546 -5.422 1.00 0.00 O ATOM 765 CB LYS A 50 9.858 15.549 -7.104 1.00 0.00 C ATOM 766 CG LYS A 50 10.812 14.454 -6.578 1.00 0.00 C ATOM 767 CD LYS A 50 11.962 14.109 -7.525 1.00 0.00 C ATOM 768 CE LYS A 50 12.480 12.715 -7.152 1.00 0.00 C ATOM 769 NZ LYS A 50 13.687 12.311 -7.892 1.00 0.00 N ATOM 0 H LYS A 50 8.878 14.998 -4.289 1.00 0.00 H new ATOM 0 HA LYS A 50 7.966 16.508 -6.546 1.00 0.00 H new ATOM 0 HB2 LYS A 50 9.572 15.320 -8.131 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.379 16.506 -7.124 1.00 0.00 H new ATOM 0 HG2 LYS A 50 11.228 14.779 -5.624 1.00 0.00 H new ATOM 0 HG3 LYS A 50 10.235 13.550 -6.382 1.00 0.00 H new ATOM 0 HD2 LYS A 50 11.621 14.125 -8.560 1.00 0.00 H new ATOM 0 HD3 LYS A 50 12.760 14.847 -7.441 1.00 0.00 H new ATOM 0 HE2 LYS A 50 12.696 12.692 -6.084 1.00 0.00 H new ATOM 0 HE3 LYS A 50 11.692 11.984 -7.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 13.979 11.360 -7.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 13.482 12.301 -8.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 14.454 12.986 -7.700 1.00 0.00 H new ATOM 783 N VAL A 51 7.086 14.169 -7.437 1.00 0.00 N ATOM 784 CA VAL A 51 6.341 12.944 -7.708 1.00 0.00 C ATOM 785 C VAL A 51 7.365 11.952 -8.269 1.00 0.00 C ATOM 786 O VAL A 51 8.389 12.349 -8.836 1.00 0.00 O ATOM 787 CB VAL A 51 5.208 13.262 -8.707 1.00 0.00 C ATOM 788 CG1 VAL A 51 4.605 12.018 -9.369 1.00 0.00 C ATOM 789 CG2 VAL A 51 4.065 14.009 -8.020 1.00 0.00 C ATOM 0 H VAL A 51 7.000 14.867 -8.176 1.00 0.00 H new ATOM 0 HA VAL A 51 5.866 12.519 -6.824 1.00 0.00 H new ATOM 0 HB VAL A 51 5.679 13.874 -9.476 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.816 12.319 -10.058 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.382 11.485 -9.918 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.188 11.364 -8.603 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.280 14.221 -8.746 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.660 13.394 -7.216 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.439 14.946 -7.607 1.00 0.00 H new ATOM 799 N ILE A 52 7.113 10.658 -8.066 1.00 0.00 N ATOM 800 CA ILE A 52 7.960 9.563 -8.550 1.00 0.00 C ATOM 801 C ILE A 52 7.104 8.422 -9.116 1.00 0.00 C ATOM 802 O ILE A 52 7.488 7.783 -10.097 1.00 0.00 O ATOM 803 CB ILE A 52 8.933 9.056 -7.459 1.00 0.00 C ATOM 804 CG1 ILE A 52 8.207 8.592 -6.179 1.00 0.00 C ATOM 805 CG2 ILE A 52 9.989 10.128 -7.142 1.00 0.00 C ATOM 806 CD1 ILE A 52 9.122 7.857 -5.200 1.00 0.00 C ATOM 0 H ILE A 52 6.296 10.333 -7.549 1.00 0.00 H new ATOM 0 HA ILE A 52 8.575 9.957 -9.359 1.00 0.00 H new ATOM 0 HB ILE A 52 9.435 8.176 -7.861 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.774 9.459 -5.680 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.380 7.937 -6.455 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.666 9.756 -6.373 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.556 10.358 -8.044 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.495 11.031 -6.784 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.550 7.558 -4.322 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.535 6.971 -5.683 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.935 8.517 -4.896 1.00 0.00 H new ATOM 818 N GLY A 53 5.927 8.176 -8.533 1.00 0.00 N ATOM 819 CA GLY A 53 5.027 7.108 -8.963 1.00 0.00 C ATOM 820 C GLY A 53 3.594 7.439 -8.605 1.00 0.00 C ATOM 821 O GLY A 53 3.355 8.502 -8.034 1.00 0.00 O ATOM 0 H GLY A 53 5.572 8.717 -7.745 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.114 6.964 -10.040 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.317 6.169 -8.491 1.00 0.00 H new ATOM 825 N ALA A 54 2.638 6.565 -8.919 1.00 0.00 N ATOM 826 CA ALA A 54 1.236 6.795 -8.625 1.00 0.00 C ATOM 827 C ALA A 54 0.446 5.503 -8.430 1.00 0.00 C ATOM 828 O ALA A 54 0.308 4.730 -9.379 1.00 0.00 O ATOM 829 CB ALA A 54 0.602 7.603 -9.767 1.00 0.00 C ATOM 0 H ALA A 54 2.821 5.677 -9.386 1.00 0.00 H new ATOM 0 HA ALA A 54 1.194 7.345 -7.685 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.452 7.777 -9.548 1.00 0.00 H new ATOM 0 HB2 ALA A 54 1.115 8.560 -9.864 1.00 0.00 H new ATOM 0 HB3 ALA A 54 0.692 7.046 -10.700 1.00 0.00 H new ATOM 835 N ILE A 55 -0.087 5.270 -7.223 1.00 0.00 N ATOM 836 CA ILE A 55 -0.882 4.068 -6.985 1.00 0.00 C ATOM 837 C ILE A 55 -2.242 4.358 -7.639 1.00 0.00 C ATOM 838 O ILE A 55 -2.647 3.679 -8.576 1.00 0.00 O ATOM 839 CB ILE A 55 -0.954 3.772 -5.471 1.00 0.00 C ATOM 840 CG1 ILE A 55 0.446 3.604 -4.836 1.00 0.00 C ATOM 841 CG2 ILE A 55 -1.822 2.540 -5.240 1.00 0.00 C ATOM 842 CD1 ILE A 55 0.410 3.268 -3.341 1.00 0.00 C ATOM 0 H ILE A 55 0.017 5.885 -6.416 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.455 3.163 -7.417 1.00 0.00 H new ATOM 0 HB ILE A 55 -1.407 4.631 -4.976 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.982 2.815 -5.364 1.00 0.00 H new ATOM 0 HG13 ILE A 55 1.012 4.524 -4.979 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -1.875 2.328 -4.172 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -2.825 2.725 -5.624 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -1.387 1.686 -5.759 1.00 0.00 H new ATOM 0 HD11 ILE A 55 1.428 3.165 -2.967 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -0.097 4.068 -2.800 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.128 2.332 -3.191 1.00 0.00 H new ATOM 854 N GLY A 56 -2.924 5.420 -7.192 1.00 0.00 N ATOM 855 CA GLY A 56 -4.214 5.881 -7.705 1.00 0.00 C ATOM 856 C GLY A 56 -5.356 4.860 -7.847 1.00 0.00 C ATOM 857 O GLY A 56 -6.351 5.213 -8.490 1.00 0.00 O ATOM 0 H GLY A 56 -2.575 6.003 -6.432 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -4.564 6.680 -7.052 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -4.041 6.324 -8.686 1.00 0.00 H new ATOM 861 N GLN A 57 -5.256 3.637 -7.318 1.00 0.00 N ATOM 862 CA GLN A 57 -6.283 2.598 -7.425 1.00 0.00 C ATOM 863 C GLN A 57 -7.400 2.771 -6.388 1.00 0.00 C ATOM 864 O GLN A 57 -7.294 3.604 -5.489 1.00 0.00 O ATOM 865 CB GLN A 57 -5.644 1.210 -7.211 1.00 0.00 C ATOM 866 CG GLN A 57 -4.340 0.969 -7.984 1.00 0.00 C ATOM 867 CD GLN A 57 -4.014 -0.517 -8.107 1.00 0.00 C ATOM 868 OE1 GLN A 57 -4.400 -1.145 -9.088 1.00 0.00 O ATOM 869 NE2 GLN A 57 -3.345 -1.127 -7.142 1.00 0.00 N ATOM 0 H GLN A 57 -4.437 3.335 -6.790 1.00 0.00 H new ATOM 0 HA GLN A 57 -6.717 2.685 -8.421 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.448 1.077 -6.147 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.366 0.446 -7.499 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -4.423 1.406 -8.979 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -3.520 1.479 -7.479 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -3.027 -0.599 -6.329 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -3.147 -2.125 -7.211 1.00 0.00 H new ATOM 878 N THR A 58 -8.471 1.984 -6.491 1.00 0.00 N ATOM 879 CA THR A 58 -9.595 1.985 -5.555 1.00 0.00 C ATOM 880 C THR A 58 -10.068 0.537 -5.395 1.00 0.00 C ATOM 881 O THR A 58 -10.194 -0.183 -6.389 1.00 0.00 O ATOM 882 CB THR A 58 -10.756 2.902 -5.974 1.00 0.00 C ATOM 883 OG1 THR A 58 -10.297 4.151 -6.459 1.00 0.00 O ATOM 884 CG2 THR A 58 -11.697 3.196 -4.800 1.00 0.00 C ATOM 0 H THR A 58 -8.584 1.310 -7.248 1.00 0.00 H new ATOM 0 HA THR A 58 -9.248 2.395 -4.607 1.00 0.00 H new ATOM 0 HB THR A 58 -11.282 2.362 -6.761 1.00 0.00 H new ATOM 0 HG1 THR A 58 -11.064 4.704 -6.716 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.505 3.847 -5.135 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.115 2.261 -4.426 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.141 3.689 -4.003 1.00 0.00 H new ATOM 892 N PHE A 59 -10.316 0.115 -4.151 1.00 0.00 N ATOM 893 CA PHE A 59 -10.775 -1.227 -3.798 1.00 0.00 C ATOM 894 C PHE A 59 -11.733 -1.148 -2.595 1.00 0.00 C ATOM 895 O PHE A 59 -11.885 -0.063 -2.020 1.00 0.00 O ATOM 896 CB PHE A 59 -9.557 -2.093 -3.454 1.00 0.00 C ATOM 897 CG PHE A 59 -8.547 -2.265 -4.566 1.00 0.00 C ATOM 898 CD1 PHE A 59 -8.698 -3.323 -5.476 1.00 0.00 C ATOM 899 CD2 PHE A 59 -7.404 -1.447 -4.628 1.00 0.00 C ATOM 900 CE1 PHE A 59 -7.717 -3.548 -6.452 1.00 0.00 C ATOM 901 CE2 PHE A 59 -6.425 -1.683 -5.610 1.00 0.00 C ATOM 902 CZ PHE A 59 -6.600 -2.706 -6.553 1.00 0.00 C ATOM 0 H PHE A 59 -10.198 0.719 -3.338 1.00 0.00 H new ATOM 0 HA PHE A 59 -11.309 -1.672 -4.638 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -9.053 -1.655 -2.593 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -9.908 -3.079 -3.150 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -9.567 -3.962 -5.424 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.278 -0.639 -3.923 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.823 -4.379 -7.134 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.534 -1.073 -5.638 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.882 -2.844 -7.348 1.00 0.00 H new ATOM 912 N PHE A 60 -12.381 -2.262 -2.205 1.00 0.00 N ATOM 913 CA PHE A 60 -13.292 -2.285 -1.044 1.00 0.00 C ATOM 914 C PHE A 60 -13.136 -3.537 -0.169 1.00 0.00 C ATOM 915 O PHE A 60 -12.743 -4.593 -0.674 1.00 0.00 O ATOM 916 CB PHE A 60 -14.755 -2.253 -1.489 1.00 0.00 C ATOM 917 CG PHE A 60 -15.138 -1.097 -2.377 1.00 0.00 C ATOM 918 CD1 PHE A 60 -15.024 -1.224 -3.770 1.00 0.00 C ATOM 919 CD2 PHE A 60 -15.662 0.079 -1.820 1.00 0.00 C ATOM 920 CE1 PHE A 60 -15.452 -0.183 -4.602 1.00 0.00 C ATOM 921 CE2 PHE A 60 -16.150 1.094 -2.654 1.00 0.00 C ATOM 922 CZ PHE A 60 -16.038 0.971 -4.052 1.00 0.00 C ATOM 0 H PHE A 60 -12.290 -3.161 -2.679 1.00 0.00 H new ATOM 0 HA PHE A 60 -13.022 -1.400 -0.467 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -14.977 -3.182 -2.015 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -15.386 -2.231 -0.601 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -14.607 -2.123 -4.199 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -15.689 0.202 -0.747 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -15.332 -0.266 -5.672 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -16.612 1.971 -2.224 1.00 0.00 H new ATOM 0 HZ PHE A 60 -16.400 1.758 -4.698 1.00 0.00 H new ATOM 932 N VAL A 61 -13.465 -3.441 1.130 1.00 0.00 N ATOM 933 CA VAL A 61 -13.428 -4.562 2.073 1.00 0.00 C ATOM 934 C VAL A 61 -14.664 -4.502 2.963 1.00 0.00 C ATOM 935 O VAL A 61 -15.380 -3.500 2.958 1.00 0.00 O ATOM 936 CB VAL A 61 -12.168 -4.636 2.950 1.00 0.00 C ATOM 937 CG1 VAL A 61 -10.913 -4.837 2.125 1.00 0.00 C ATOM 938 CG2 VAL A 61 -11.989 -3.411 3.840 1.00 0.00 C ATOM 0 H VAL A 61 -13.769 -2.566 1.557 1.00 0.00 H new ATOM 0 HA VAL A 61 -13.409 -5.465 1.463 1.00 0.00 H new ATOM 0 HB VAL A 61 -12.320 -5.504 3.592 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -10.047 -4.884 2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.992 -5.768 1.564 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.796 -4.004 1.432 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -11.082 -3.523 4.435 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.908 -2.519 3.219 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.849 -3.314 4.503 1.00 0.00 H new ATOM 948 N ASP A 62 -14.910 -5.549 3.737 1.00 0.00 N ATOM 949 CA ASP A 62 -16.021 -5.666 4.671 1.00 0.00 C ATOM 950 C ASP A 62 -15.452 -5.650 6.103 1.00 0.00 C ATOM 951 O ASP A 62 -14.259 -5.391 6.308 1.00 0.00 O ATOM 952 CB ASP A 62 -16.845 -6.927 4.363 1.00 0.00 C ATOM 953 CG ASP A 62 -16.273 -8.126 5.104 1.00 0.00 C ATOM 954 OD1 ASP A 62 -15.048 -8.330 4.980 1.00 0.00 O ATOM 955 OD2 ASP A 62 -16.999 -8.711 5.939 1.00 0.00 O ATOM 0 H ASP A 62 -14.314 -6.377 3.731 1.00 0.00 H new ATOM 0 HA ASP A 62 -16.708 -4.826 4.570 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -17.883 -6.772 4.656 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -16.842 -7.119 3.290 1.00 0.00 H new ATOM 960 N GLY A 63 -16.287 -5.887 7.115 1.00 0.00 N ATOM 961 CA GLY A 63 -15.899 -5.924 8.523 1.00 0.00 C ATOM 962 C GLY A 63 -14.957 -7.088 8.830 1.00 0.00 C ATOM 963 O GLY A 63 -14.221 -7.044 9.820 1.00 0.00 O ATOM 0 H GLY A 63 -17.281 -6.064 6.972 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -15.413 -4.985 8.789 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -16.792 -6.008 9.142 1.00 0.00 H new ATOM 967 N ASP A 64 -14.963 -8.116 7.986 1.00 0.00 N ATOM 968 CA ASP A 64 -14.110 -9.291 8.112 1.00 0.00 C ATOM 969 C ASP A 64 -12.776 -9.036 7.400 1.00 0.00 C ATOM 970 O ASP A 64 -11.829 -9.823 7.491 1.00 0.00 O ATOM 971 CB ASP A 64 -14.820 -10.547 7.587 1.00 0.00 C ATOM 972 CG ASP A 64 -14.044 -11.789 8.022 1.00 0.00 C ATOM 973 OD1 ASP A 64 -13.855 -11.943 9.254 1.00 0.00 O ATOM 974 OD2 ASP A 64 -13.676 -12.643 7.182 1.00 0.00 O ATOM 0 H ASP A 64 -15.579 -8.154 7.174 1.00 0.00 H new ATOM 0 HA ASP A 64 -13.900 -9.473 9.166 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -15.839 -10.589 7.971 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -14.890 -10.511 6.500 1.00 0.00 H new ATOM 979 N GLY A 65 -12.636 -7.857 6.783 1.00 0.00 N ATOM 980 CA GLY A 65 -11.451 -7.438 6.066 1.00 0.00 C ATOM 981 C GLY A 65 -11.262 -8.291 4.826 1.00 0.00 C ATOM 982 O GLY A 65 -10.122 -8.584 4.472 1.00 0.00 O ATOM 0 H GLY A 65 -13.375 -7.154 6.775 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -11.539 -6.389 5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -10.577 -7.523 6.712 1.00 0.00 H new ATOM 986 N LYS A 66 -12.354 -8.756 4.214 1.00 0.00 N ATOM 987 CA LYS A 66 -12.342 -9.575 3.014 1.00 0.00 C ATOM 988 C LYS A 66 -12.480 -8.644 1.828 1.00 0.00 C ATOM 989 O LYS A 66 -13.292 -7.712 1.868 1.00 0.00 O ATOM 990 CB LYS A 66 -13.514 -10.554 3.022 1.00 0.00 C ATOM 991 CG LYS A 66 -13.383 -11.691 4.042 1.00 0.00 C ATOM 992 CD LYS A 66 -12.262 -12.700 3.748 1.00 0.00 C ATOM 993 CE LYS A 66 -12.384 -13.292 2.342 1.00 0.00 C ATOM 994 NZ LYS A 66 -11.382 -14.335 2.052 1.00 0.00 N ATOM 0 H LYS A 66 -13.296 -8.563 4.555 1.00 0.00 H new ATOM 0 HA LYS A 66 -11.417 -10.149 2.963 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -14.431 -10.002 3.227 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -13.618 -10.986 2.026 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -13.212 -11.257 5.027 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -14.331 -12.227 4.090 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -11.294 -12.209 3.853 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -12.293 -13.503 4.484 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -13.381 -13.714 2.220 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -12.285 -12.491 1.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -11.522 -14.692 1.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -10.427 -13.932 2.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -11.490 -15.117 2.729 1.00 0.00 H new ATOM 1008 N ARG A 67 -11.674 -8.860 0.796 1.00 0.00 N ATOM 1009 CA ARG A 67 -11.701 -8.052 -0.405 1.00 0.00 C ATOM 1010 C ARG A 67 -12.982 -8.410 -1.136 1.00 0.00 C ATOM 1011 O ARG A 67 -13.223 -9.585 -1.412 1.00 0.00 O ATOM 1012 CB ARG A 67 -10.411 -8.295 -1.209 1.00 0.00 C ATOM 1013 CG ARG A 67 -9.656 -6.977 -1.447 1.00 0.00 C ATOM 1014 CD ARG A 67 -10.223 -6.184 -2.630 1.00 0.00 C ATOM 1015 NE ARG A 67 -9.952 -6.921 -3.863 1.00 0.00 N ATOM 1016 CZ ARG A 67 -10.540 -6.921 -5.062 1.00 0.00 C ATOM 1017 NH1 ARG A 67 -11.574 -6.133 -5.316 1.00 0.00 N ATOM 1018 NH2 ARG A 67 -10.059 -7.725 -6.003 1.00 0.00 N ATOM 0 H ARG A 67 -10.980 -9.607 0.774 1.00 0.00 H new ATOM 0 HA ARG A 67 -11.715 -6.980 -0.209 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.770 -8.994 -0.672 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -10.656 -8.756 -2.166 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -9.705 -6.365 -0.546 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -8.603 -7.192 -1.629 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -11.296 -6.037 -2.506 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -9.768 -5.194 -2.674 1.00 0.00 H new ATOM 0 HE ARG A 67 -9.160 -7.560 -3.794 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -11.933 -5.513 -4.590 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -12.011 -6.146 -6.238 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -9.258 -8.324 -5.802 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -10.490 -7.744 -6.927 1.00 0.00 H new ATOM 1032 N TRP A 68 -13.824 -7.408 -1.376 1.00 0.00 N ATOM 1033 CA TRP A 68 -15.091 -7.610 -2.059 1.00 0.00 C ATOM 1034 C TRP A 68 -14.836 -8.078 -3.484 1.00 0.00 C ATOM 1035 O TRP A 68 -13.967 -7.525 -4.166 1.00 0.00 O ATOM 1036 CB TRP A 68 -15.879 -6.297 -2.118 1.00 0.00 C ATOM 1037 CG TRP A 68 -16.742 -5.955 -0.944 1.00 0.00 C ATOM 1038 CD1 TRP A 68 -16.333 -5.669 0.313 1.00 0.00 C ATOM 1039 CD2 TRP A 68 -18.198 -5.918 -0.902 1.00 0.00 C ATOM 1040 NE1 TRP A 68 -17.423 -5.376 1.108 1.00 0.00 N ATOM 1041 CE2 TRP A 68 -18.605 -5.547 0.413 1.00 0.00 C ATOM 1042 CE3 TRP A 68 -19.214 -6.210 -1.839 1.00 0.00 C ATOM 1043 CZ2 TRP A 68 -19.958 -5.456 0.766 1.00 0.00 C ATOM 1044 CZ3 TRP A 68 -20.572 -6.160 -1.480 1.00 0.00 C ATOM 1045 CH2 TRP A 68 -20.944 -5.793 -0.176 1.00 0.00 C ATOM 0 H TRP A 68 -13.646 -6.441 -1.103 1.00 0.00 H new ATOM 0 HA TRP A 68 -15.662 -8.358 -1.510 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -15.167 -5.484 -2.260 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -16.513 -6.325 -3.004 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -15.306 -5.670 0.646 1.00 0.00 H new ATOM 0 HE1 TRP A 68 -17.364 -5.073 2.080 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -18.942 -6.477 -2.850 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -20.241 -5.129 1.756 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -21.331 -6.404 -2.208 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -21.987 -5.770 0.102 1.00 0.00 H new ATOM 1056 N SER A 69 -15.577 -9.096 -3.918 1.00 0.00 N ATOM 1057 CA SER A 69 -15.477 -9.620 -5.267 1.00 0.00 C ATOM 1058 C SER A 69 -16.081 -8.535 -6.155 1.00 0.00 C ATOM 1059 O SER A 69 -17.121 -7.977 -5.796 1.00 0.00 O ATOM 1060 CB SER A 69 -16.314 -10.905 -5.333 1.00 0.00 C ATOM 1061 OG SER A 69 -16.422 -11.464 -6.631 1.00 0.00 O ATOM 0 H SER A 69 -16.264 -9.578 -3.338 1.00 0.00 H new ATOM 0 HA SER A 69 -14.459 -9.857 -5.575 1.00 0.00 H new ATOM 0 HB2 SER A 69 -15.874 -11.646 -4.666 1.00 0.00 H new ATOM 0 HB3 SER A 69 -17.315 -10.693 -4.957 1.00 0.00 H new ATOM 0 HG SER A 69 -16.966 -12.278 -6.592 1.00 0.00 H new ATOM 1067 N GLU A 70 -15.489 -8.234 -7.315 1.00 0.00 N ATOM 1068 CA GLU A 70 -16.059 -7.211 -8.196 1.00 0.00 C ATOM 1069 C GLU A 70 -17.473 -7.617 -8.618 1.00 0.00 C ATOM 1070 O GLU A 70 -18.293 -6.751 -8.919 1.00 0.00 O ATOM 1071 CB GLU A 70 -15.169 -6.910 -9.409 1.00 0.00 C ATOM 1072 CG GLU A 70 -13.859 -6.236 -8.973 1.00 0.00 C ATOM 1073 CD GLU A 70 -13.042 -5.643 -10.126 1.00 0.00 C ATOM 1074 OE1 GLU A 70 -13.542 -5.488 -11.257 1.00 0.00 O ATOM 1075 OE2 GLU A 70 -11.894 -5.209 -9.868 1.00 0.00 O ATOM 0 H GLU A 70 -14.635 -8.673 -7.660 1.00 0.00 H new ATOM 0 HA GLU A 70 -16.114 -6.280 -7.632 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -14.947 -7.835 -9.941 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -15.702 -6.262 -10.105 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.091 -5.443 -8.262 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.245 -6.967 -8.446 1.00 0.00 H new ATOM 1082 N GLU A 71 -17.779 -8.916 -8.612 1.00 0.00 N ATOM 1083 CA GLU A 71 -19.093 -9.417 -8.962 1.00 0.00 C ATOM 1084 C GLU A 71 -20.116 -8.977 -7.920 1.00 0.00 C ATOM 1085 O GLU A 71 -21.235 -8.602 -8.262 1.00 0.00 O ATOM 1086 CB GLU A 71 -19.092 -10.937 -9.048 1.00 0.00 C ATOM 1087 CG GLU A 71 -18.152 -11.455 -10.128 1.00 0.00 C ATOM 1088 CD GLU A 71 -18.518 -12.874 -10.532 1.00 0.00 C ATOM 1089 OE1 GLU A 71 -19.543 -13.030 -11.240 1.00 0.00 O ATOM 1090 OE2 GLU A 71 -17.807 -13.815 -10.111 1.00 0.00 O ATOM 0 H GLU A 71 -17.113 -9.647 -8.362 1.00 0.00 H new ATOM 0 HA GLU A 71 -19.359 -9.008 -9.937 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -18.798 -11.353 -8.084 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -20.104 -11.288 -9.252 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -18.198 -10.802 -10.999 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -17.125 -11.430 -9.764 1.00 0.00 H new ATOM 1097 N GLU A 72 -19.740 -9.030 -6.643 1.00 0.00 N ATOM 1098 CA GLU A 72 -20.597 -8.630 -5.524 1.00 0.00 C ATOM 1099 C GLU A 72 -20.842 -7.120 -5.572 1.00 0.00 C ATOM 1100 O GLU A 72 -21.855 -6.636 -5.075 1.00 0.00 O ATOM 1101 CB GLU A 72 -19.977 -9.054 -4.188 1.00 0.00 C ATOM 1102 CG GLU A 72 -19.963 -10.589 -4.060 1.00 0.00 C ATOM 1103 CD GLU A 72 -19.050 -11.100 -2.946 1.00 0.00 C ATOM 1104 OE1 GLU A 72 -18.093 -10.392 -2.549 1.00 0.00 O ATOM 1105 OE2 GLU A 72 -19.248 -12.253 -2.491 1.00 0.00 O ATOM 0 H GLU A 72 -18.819 -9.356 -6.351 1.00 0.00 H new ATOM 0 HA GLU A 72 -21.558 -9.136 -5.613 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -18.960 -8.668 -4.114 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -20.543 -8.620 -3.364 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -20.979 -10.939 -3.876 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -19.643 -11.022 -5.008 1.00 0.00 H new ATOM 1112 N LEU A 73 -19.933 -6.350 -6.181 1.00 0.00 N ATOM 1113 CA LEU A 73 -20.100 -4.906 -6.311 1.00 0.00 C ATOM 1114 C LEU A 73 -21.230 -4.608 -7.312 1.00 0.00 C ATOM 1115 O LEU A 73 -21.737 -3.488 -7.326 1.00 0.00 O ATOM 1116 CB LEU A 73 -18.782 -4.225 -6.728 1.00 0.00 C ATOM 1117 CG LEU A 73 -17.586 -4.471 -5.788 1.00 0.00 C ATOM 1118 CD1 LEU A 73 -16.336 -3.791 -6.346 1.00 0.00 C ATOM 1119 CD2 LEU A 73 -17.814 -3.970 -4.359 1.00 0.00 C ATOM 0 H LEU A 73 -19.071 -6.709 -6.592 1.00 0.00 H new ATOM 0 HA LEU A 73 -20.375 -4.493 -5.340 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -18.515 -4.570 -7.727 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -18.954 -3.151 -6.797 1.00 0.00 H new ATOM 0 HG LEU A 73 -17.461 -5.553 -5.739 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -15.495 -3.969 -5.676 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -16.109 -4.199 -7.331 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -16.512 -2.719 -6.430 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -16.930 -4.177 -3.755 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -17.998 -2.896 -4.375 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -18.676 -4.480 -3.928 1.00 0.00 H new ATOM 1131 N LYS A 74 -21.626 -5.567 -8.160 1.00 0.00 N ATOM 1132 CA LYS A 74 -22.708 -5.402 -9.142 1.00 0.00 C ATOM 1133 C LYS A 74 -24.071 -5.672 -8.499 1.00 0.00 C ATOM 1134 O LYS A 74 -25.088 -5.320 -9.101 1.00 0.00 O ATOM 1135 CB LYS A 74 -22.550 -6.387 -10.315 1.00 0.00 C ATOM 1136 CG LYS A 74 -21.184 -6.328 -11.021 1.00 0.00 C ATOM 1137 CD LYS A 74 -20.789 -7.684 -11.625 1.00 0.00 C ATOM 1138 CE LYS A 74 -21.367 -7.990 -13.006 1.00 0.00 C ATOM 1139 NZ LYS A 74 -20.721 -7.220 -14.086 1.00 0.00 N ATOM 0 H LYS A 74 -21.198 -6.493 -8.184 1.00 0.00 H new ATOM 0 HA LYS A 74 -22.651 -4.375 -9.503 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -22.710 -7.400 -9.946 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -23.332 -6.188 -11.048 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -21.215 -5.576 -11.809 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -20.421 -6.012 -10.309 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -19.702 -7.729 -11.689 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -21.101 -8.471 -10.939 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -21.258 -9.055 -13.211 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -22.435 -7.774 -13.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -21.155 -7.470 -14.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -20.847 -6.203 -13.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -19.706 -7.444 -14.113 1.00 0.00 H new ATOM 1153 N GLU A 75 -24.107 -6.297 -7.323 1.00 0.00 N ATOM 1154 CA GLU A 75 -25.330 -6.639 -6.591 1.00 0.00 C ATOM 1155 C GLU A 75 -26.233 -5.414 -6.368 1.00 0.00 C ATOM 1156 O GLU A 75 -25.766 -4.270 -6.440 1.00 0.00 O ATOM 1157 CB GLU A 75 -24.979 -7.276 -5.249 1.00 0.00 C ATOM 1158 CG GLU A 75 -24.421 -8.691 -5.406 1.00 0.00 C ATOM 1159 CD GLU A 75 -25.552 -9.707 -5.528 1.00 0.00 C ATOM 1160 OE1 GLU A 75 -26.112 -9.823 -6.647 1.00 0.00 O ATOM 1161 OE2 GLU A 75 -25.878 -10.342 -4.498 1.00 0.00 O ATOM 0 H GLU A 75 -23.260 -6.589 -6.836 1.00 0.00 H new ATOM 0 HA GLU A 75 -25.885 -7.351 -7.201 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -24.246 -6.654 -4.735 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -25.869 -7.306 -4.620 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -23.785 -8.740 -6.290 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -23.795 -8.938 -4.548 1.00 0.00 H new ATOM 1168 N PRO A 76 -27.534 -5.626 -6.102 1.00 0.00 N ATOM 1169 CA PRO A 76 -28.471 -4.549 -5.870 1.00 0.00 C ATOM 1170 C PRO A 76 -28.201 -4.010 -4.470 1.00 0.00 C ATOM 1171 O PRO A 76 -28.499 -4.651 -3.461 1.00 0.00 O ATOM 1172 CB PRO A 76 -29.863 -5.143 -6.052 1.00 0.00 C ATOM 1173 CG PRO A 76 -29.688 -6.640 -5.784 1.00 0.00 C ATOM 1174 CD PRO A 76 -28.194 -6.918 -5.981 1.00 0.00 C ATOM 0 HA PRO A 76 -28.376 -3.709 -6.558 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -30.577 -4.698 -5.359 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -30.241 -4.963 -7.058 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -30.005 -6.898 -4.774 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -30.292 -7.235 -6.469 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -27.792 -7.479 -5.138 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -28.028 -7.521 -6.874 1.00 0.00 H new ATOM 1182 N TYR A 77 -27.607 -2.822 -4.424 1.00 0.00 N ATOM 1183 CA TYR A 77 -27.251 -2.163 -3.176 1.00 0.00 C ATOM 1184 C TYR A 77 -28.490 -1.855 -2.326 1.00 0.00 C ATOM 1185 O TYR A 77 -28.510 -2.101 -1.118 1.00 0.00 O ATOM 1186 CB TYR A 77 -26.426 -0.913 -3.488 1.00 0.00 C ATOM 1187 CG TYR A 77 -25.842 -0.317 -2.234 1.00 0.00 C ATOM 1188 CD1 TYR A 77 -24.729 -0.928 -1.639 1.00 0.00 C ATOM 1189 CD2 TYR A 77 -26.486 0.751 -1.594 1.00 0.00 C ATOM 1190 CE1 TYR A 77 -24.258 -0.474 -0.400 1.00 0.00 C ATOM 1191 CE2 TYR A 77 -26.037 1.193 -0.339 1.00 0.00 C ATOM 1192 CZ TYR A 77 -24.926 0.568 0.273 1.00 0.00 C ATOM 1193 OH TYR A 77 -24.508 0.915 1.520 1.00 0.00 O ATOM 0 H TYR A 77 -27.358 -2.288 -5.257 1.00 0.00 H new ATOM 0 HA TYR A 77 -26.641 -2.835 -2.573 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -25.624 -1.168 -4.180 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -27.054 -0.175 -3.986 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -24.234 -1.749 -2.136 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -27.328 1.234 -2.067 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -23.381 -0.924 0.040 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -26.540 2.009 0.158 1.00 0.00 H new ATOM 0 HH TYR A 77 -25.062 1.649 1.858 1.00 0.00 H new ATOM 1203 N ILE A 78 -29.514 -1.261 -2.943 1.00 0.00 N ATOM 1204 CA ILE A 78 -30.763 -0.935 -2.262 1.00 0.00 C ATOM 1205 C ILE A 78 -31.468 -2.234 -1.861 1.00 0.00 C ATOM 1206 O ILE A 78 -31.493 -3.200 -2.625 1.00 0.00 O ATOM 1207 CB ILE A 78 -31.673 -0.018 -3.110 1.00 0.00 C ATOM 1208 CG1 ILE A 78 -32.109 -0.641 -4.457 1.00 0.00 C ATOM 1209 CG2 ILE A 78 -30.971 1.335 -3.320 1.00 0.00 C ATOM 1210 CD1 ILE A 78 -33.247 0.121 -5.146 1.00 0.00 C ATOM 0 H ILE A 78 -29.498 -0.994 -3.927 1.00 0.00 H new ATOM 0 HA ILE A 78 -30.532 -0.364 -1.363 1.00 0.00 H new ATOM 0 HB ILE A 78 -32.599 0.124 -2.553 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -31.249 -0.677 -5.126 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -32.423 -1.671 -4.287 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -31.608 1.987 -3.918 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -30.782 1.801 -2.353 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -30.025 1.178 -3.838 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -33.500 -0.373 -6.084 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -34.122 0.135 -4.496 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -32.930 1.144 -5.349 1.00 0.00 H new ATOM 1222 N SER A 79 -32.047 -2.266 -0.667 1.00 0.00 N ATOM 1223 CA SER A 79 -32.779 -3.393 -0.110 1.00 0.00 C ATOM 1224 C SER A 79 -33.640 -2.883 1.047 1.00 0.00 C ATOM 1225 O SER A 79 -33.267 -1.920 1.722 1.00 0.00 O ATOM 1226 CB SER A 79 -31.786 -4.452 0.386 1.00 0.00 C ATOM 1227 OG SER A 79 -31.124 -5.086 -0.693 1.00 0.00 O ATOM 0 H SER A 79 -32.016 -1.468 -0.032 1.00 0.00 H new ATOM 0 HA SER A 79 -33.418 -3.847 -0.867 1.00 0.00 H new ATOM 0 HB2 SER A 79 -31.051 -3.985 1.042 1.00 0.00 H new ATOM 0 HB3 SER A 79 -32.314 -5.198 0.980 1.00 0.00 H new ATOM 0 HG SER A 79 -31.294 -4.587 -1.519 1.00 0.00 H new ATOM 1233 N ASN A 80 -34.783 -3.529 1.303 1.00 0.00 N ATOM 1234 CA ASN A 80 -35.686 -3.139 2.398 1.00 0.00 C ATOM 1235 C ASN A 80 -35.079 -3.479 3.763 1.00 0.00 C ATOM 1236 O ASN A 80 -35.548 -3.001 4.791 1.00 0.00 O ATOM 1237 CB ASN A 80 -37.034 -3.868 2.284 1.00 0.00 C ATOM 1238 CG ASN A 80 -37.816 -3.479 1.039 1.00 0.00 C ATOM 1239 OD1 ASN A 80 -38.003 -2.308 0.743 1.00 0.00 O ATOM 1240 ND2 ASN A 80 -38.282 -4.447 0.267 1.00 0.00 N ATOM 0 H ASN A 80 -35.109 -4.331 0.763 1.00 0.00 H new ATOM 0 HA ASN A 80 -35.834 -2.062 2.316 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -36.859 -4.944 2.275 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -37.635 -3.650 3.167 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -38.801 -4.218 -0.581 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -38.122 -5.422 0.520 1.00 0.00 H new ATOM 1247 N ASN A 81 -34.029 -4.295 3.758 1.00 0.00 N ATOM 1248 CA ASN A 81 -33.253 -4.809 4.867 1.00 0.00 C ATOM 1249 C ASN A 81 -31.852 -4.171 4.829 1.00 0.00 C ATOM 1250 O ASN A 81 -30.888 -4.840 4.463 1.00 0.00 O ATOM 1251 CB ASN A 81 -33.239 -6.351 4.733 1.00 0.00 C ATOM 1252 CG ASN A 81 -32.963 -6.840 3.300 1.00 0.00 C ATOM 1253 OD1 ASN A 81 -31.719 -7.016 2.896 1.00 0.00 O flip ATOM 1254 ND2 ASN A 81 -33.896 -6.966 2.515 1.00 0.00 N flip ATOM 0 H ASN A 81 -33.666 -4.648 2.873 1.00 0.00 H new ATOM 0 HA ASN A 81 -33.677 -4.558 5.839 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -32.480 -6.759 5.400 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -34.200 -6.745 5.064 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -34.854 -6.828 2.836 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -33.714 -7.209 1.541 1.00 0.00 H new ATOM 1261 N PRO A 82 -31.686 -2.896 5.228 1.00 0.00 N ATOM 1262 CA PRO A 82 -30.384 -2.230 5.201 1.00 0.00 C ATOM 1263 C PRO A 82 -29.364 -2.815 6.183 1.00 0.00 C ATOM 1264 O PRO A 82 -28.173 -2.544 6.053 1.00 0.00 O ATOM 1265 CB PRO A 82 -30.676 -0.757 5.501 1.00 0.00 C ATOM 1266 CG PRO A 82 -31.961 -0.808 6.325 1.00 0.00 C ATOM 1267 CD PRO A 82 -32.714 -1.977 5.695 1.00 0.00 C ATOM 0 HA PRO A 82 -29.912 -2.372 4.229 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -29.862 -0.292 6.056 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -30.809 -0.180 4.586 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -31.758 -0.979 7.382 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -32.525 0.122 6.255 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -33.370 -2.458 6.421 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -33.343 -1.640 4.871 1.00 0.00 H new ATOM 1275 N ASP A 83 -29.798 -3.597 7.167 1.00 0.00 N ATOM 1276 CA ASP A 83 -28.911 -4.214 8.159 1.00 0.00 C ATOM 1277 C ASP A 83 -28.256 -5.492 7.619 1.00 0.00 C ATOM 1278 O ASP A 83 -27.210 -5.927 8.089 1.00 0.00 O ATOM 1279 CB ASP A 83 -29.745 -4.529 9.404 1.00 0.00 C ATOM 1280 CG ASP A 83 -28.871 -4.966 10.578 1.00 0.00 C ATOM 1281 OD1 ASP A 83 -28.198 -4.084 11.161 1.00 0.00 O ATOM 1282 OD2 ASP A 83 -28.880 -6.168 10.910 1.00 0.00 O ATOM 0 H ASP A 83 -30.783 -3.825 7.303 1.00 0.00 H new ATOM 0 HA ASP A 83 -28.103 -3.523 8.400 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -30.321 -3.648 9.688 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -30.461 -5.317 9.172 1.00 0.00 H new ATOM 1287 N GLU A 84 -28.883 -6.107 6.618 1.00 0.00 N ATOM 1288 CA GLU A 84 -28.463 -7.341 5.950 1.00 0.00 C ATOM 1289 C GLU A 84 -27.391 -7.132 4.877 1.00 0.00 C ATOM 1290 O GLU A 84 -26.920 -8.111 4.301 1.00 0.00 O ATOM 1291 CB GLU A 84 -29.708 -7.962 5.307 1.00 0.00 C ATOM 1292 CG GLU A 84 -30.406 -9.019 6.163 1.00 0.00 C ATOM 1293 CD GLU A 84 -29.736 -10.384 6.002 1.00 0.00 C ATOM 1294 OE1 GLU A 84 -30.056 -11.059 4.997 1.00 0.00 O ATOM 1295 OE2 GLU A 84 -28.808 -10.699 6.783 1.00 0.00 O ATOM 0 H GLU A 84 -29.749 -5.737 6.227 1.00 0.00 H new ATOM 0 HA GLU A 84 -28.012 -7.990 6.701 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -30.420 -7.167 5.082 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -29.423 -8.413 4.356 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -30.381 -8.719 7.210 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -31.455 -9.089 5.877 1.00 0.00 H new ATOM 1302 N ILE A 85 -27.056 -5.891 4.516 1.00 0.00 N ATOM 1303 CA ILE A 85 -26.022 -5.627 3.518 1.00 0.00 C ATOM 1304 C ILE A 85 -24.720 -5.394 4.288 1.00 0.00 C ATOM 1305 O ILE A 85 -24.658 -4.574 5.214 1.00 0.00 O ATOM 1306 CB ILE A 85 -26.404 -4.501 2.533 1.00 0.00 C ATOM 1307 CG1 ILE A 85 -26.811 -3.193 3.226 1.00 0.00 C ATOM 1308 CG2 ILE A 85 -27.528 -4.994 1.602 1.00 0.00 C ATOM 1309 CD1 ILE A 85 -26.808 -1.972 2.302 1.00 0.00 C ATOM 0 H ILE A 85 -27.489 -5.052 4.903 1.00 0.00 H new ATOM 0 HA ILE A 85 -25.895 -6.480 2.851 1.00 0.00 H new ATOM 0 HB ILE A 85 -25.511 -4.265 1.954 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -27.808 -3.313 3.649 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -26.132 -3.008 4.058 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -27.799 -4.200 0.906 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -27.182 -5.864 1.043 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -28.399 -5.268 2.197 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -27.106 -1.088 2.866 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -25.806 -1.824 1.898 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -27.509 -2.134 1.483 1.00 0.00 H new ATOM 1321 N ARG A 86 -23.694 -6.165 3.936 1.00 0.00 N ATOM 1322 CA ARG A 86 -22.377 -6.111 4.565 1.00 0.00 C ATOM 1323 C ARG A 86 -21.758 -4.731 4.414 1.00 0.00 C ATOM 1324 O ARG A 86 -22.064 -4.022 3.450 1.00 0.00 O ATOM 1325 CB ARG A 86 -21.463 -7.208 3.975 1.00 0.00 C ATOM 1326 CG ARG A 86 -20.602 -7.885 5.049 1.00 0.00 C ATOM 1327 CD ARG A 86 -21.468 -8.853 5.858 1.00 0.00 C ATOM 1328 NE ARG A 86 -20.912 -9.136 7.187 1.00 0.00 N ATOM 1329 CZ ARG A 86 -21.642 -9.522 8.238 1.00 0.00 C ATOM 1330 NH1 ARG A 86 -22.941 -9.779 8.091 1.00 0.00 N ATOM 1331 NH2 ARG A 86 -21.054 -9.650 9.420 1.00 0.00 N ATOM 0 H ARG A 86 -23.756 -6.859 3.191 1.00 0.00 H new ATOM 0 HA ARG A 86 -22.491 -6.299 5.633 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -22.075 -7.959 3.476 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -20.815 -6.769 3.216 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -19.775 -8.421 4.583 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -20.165 -7.134 5.707 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -22.468 -8.434 5.969 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -21.574 -9.787 5.306 1.00 0.00 H new ATOM 0 HE ARG A 86 -19.906 -9.032 7.316 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -23.380 -9.681 7.175 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -23.497 -10.073 8.894 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -20.058 -9.455 9.518 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -21.598 -9.944 10.231 1.00 0.00 H new ATOM 1345 N GLU A 87 -20.900 -4.332 5.352 1.00 0.00 N ATOM 1346 CA GLU A 87 -20.264 -3.027 5.257 1.00 0.00 C ATOM 1347 C GLU A 87 -19.305 -3.029 4.065 1.00 0.00 C ATOM 1348 O GLU A 87 -18.845 -4.074 3.594 1.00 0.00 O ATOM 1349 CB GLU A 87 -19.553 -2.608 6.550 1.00 0.00 C ATOM 1350 CG GLU A 87 -18.476 -3.573 7.032 1.00 0.00 C ATOM 1351 CD GLU A 87 -19.013 -4.654 7.980 1.00 0.00 C ATOM 1352 OE1 GLU A 87 -19.220 -4.374 9.187 1.00 0.00 O ATOM 1353 OE2 GLU A 87 -19.118 -5.813 7.527 1.00 0.00 O ATOM 0 H GLU A 87 -20.636 -4.883 6.169 1.00 0.00 H new ATOM 0 HA GLU A 87 -21.044 -2.281 5.103 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -19.100 -1.628 6.397 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -20.298 -2.496 7.337 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -18.014 -4.053 6.169 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -17.693 -3.010 7.540 1.00 0.00 H new ATOM 1360 N LYS A 88 -18.958 -1.834 3.599 1.00 0.00 N ATOM 1361 CA LYS A 88 -18.070 -1.658 2.465 1.00 0.00 C ATOM 1362 C LYS A 88 -17.155 -0.485 2.746 1.00 0.00 C ATOM 1363 O LYS A 88 -17.592 0.661 2.722 1.00 0.00 O ATOM 1364 CB LYS A 88 -18.934 -1.495 1.208 1.00 0.00 C ATOM 1365 CG LYS A 88 -18.145 -1.130 -0.038 1.00 0.00 C ATOM 1366 CD LYS A 88 -19.014 -1.017 -1.292 1.00 0.00 C ATOM 1367 CE LYS A 88 -19.311 -2.380 -1.911 1.00 0.00 C ATOM 1368 NZ LYS A 88 -20.622 -2.946 -1.497 1.00 0.00 N ATOM 0 H LYS A 88 -19.289 -0.958 4.003 1.00 0.00 H new ATOM 0 HA LYS A 88 -17.423 -2.519 2.298 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -19.472 -2.425 1.026 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -19.683 -0.724 1.391 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -17.634 -0.182 0.128 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -17.374 -1.882 -0.205 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -19.952 -0.522 -1.039 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -18.510 -0.388 -2.026 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -19.290 -2.289 -2.997 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -18.520 -3.076 -1.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -20.515 -3.962 -1.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -20.955 -2.460 -0.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -21.315 -2.812 -2.261 1.00 0.00 H new ATOM 1382 N LYS A 89 -15.898 -0.762 3.072 1.00 0.00 N ATOM 1383 CA LYS A 89 -14.879 0.224 3.371 1.00 0.00 C ATOM 1384 C LYS A 89 -14.107 0.542 2.093 1.00 0.00 C ATOM 1385 O LYS A 89 -13.348 -0.320 1.645 1.00 0.00 O ATOM 1386 CB LYS A 89 -13.905 -0.313 4.425 1.00 0.00 C ATOM 1387 CG LYS A 89 -14.529 -0.550 5.801 1.00 0.00 C ATOM 1388 CD LYS A 89 -15.155 -1.929 6.046 1.00 0.00 C ATOM 1389 CE LYS A 89 -14.781 -2.445 7.438 1.00 0.00 C ATOM 1390 NZ LYS A 89 -15.327 -1.649 8.557 1.00 0.00 N ATOM 0 H LYS A 89 -15.552 -1.719 3.136 1.00 0.00 H new ATOM 0 HA LYS A 89 -15.358 1.123 3.760 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -13.481 -1.251 4.066 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -13.079 0.391 4.531 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -13.760 -0.387 6.556 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -15.298 0.206 5.961 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -16.239 -1.865 5.954 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -14.812 -2.631 5.286 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -15.131 -3.473 7.536 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -13.695 -2.469 7.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -15.083 -2.105 9.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -14.922 -0.692 8.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -16.361 -1.589 8.468 1.00 0.00 H new ATOM 1404 N PRO A 90 -14.309 1.706 1.461 1.00 0.00 N ATOM 1405 CA PRO A 90 -13.592 2.086 0.256 1.00 0.00 C ATOM 1406 C PRO A 90 -12.152 2.450 0.629 1.00 0.00 C ATOM 1407 O PRO A 90 -11.905 3.126 1.632 1.00 0.00 O ATOM 1408 CB PRO A 90 -14.347 3.301 -0.287 1.00 0.00 C ATOM 1409 CG PRO A 90 -14.925 3.954 0.964 1.00 0.00 C ATOM 1410 CD PRO A 90 -15.190 2.774 1.893 1.00 0.00 C ATOM 0 HA PRO A 90 -13.544 1.290 -0.487 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.683 3.979 -0.822 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -15.131 3.007 -0.984 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -14.225 4.663 1.406 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.840 4.504 0.743 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -14.993 3.045 2.930 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.233 2.463 1.838 1.00 0.00 H new ATOM 1418 N LEU A 91 -11.192 2.043 -0.196 1.00 0.00 N ATOM 1419 CA LEU A 91 -9.767 2.297 -0.022 1.00 0.00 C ATOM 1420 C LEU A 91 -9.347 3.031 -1.290 1.00 0.00 C ATOM 1421 O LEU A 91 -9.260 2.402 -2.342 1.00 0.00 O ATOM 1422 CB LEU A 91 -8.995 0.977 0.166 1.00 0.00 C ATOM 1423 CG LEU A 91 -9.492 0.012 1.263 1.00 0.00 C ATOM 1424 CD1 LEU A 91 -8.501 -1.152 1.325 1.00 0.00 C ATOM 1425 CD2 LEU A 91 -9.625 0.591 2.675 1.00 0.00 C ATOM 0 H LEU A 91 -11.395 1.505 -1.039 1.00 0.00 H new ATOM 0 HA LEU A 91 -9.551 2.887 0.869 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -9.007 0.442 -0.784 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -7.955 1.223 0.380 1.00 0.00 H new ATOM 0 HG LEU A 91 -10.506 -0.266 0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -8.818 -1.859 2.091 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.469 -1.655 0.358 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.509 -0.773 1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.982 -0.184 3.354 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -8.653 0.951 3.014 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -10.334 1.418 2.664 1.00 0.00 H new ATOM 1437 N ARG A 92 -9.198 4.359 -1.233 1.00 0.00 N ATOM 1438 CA ARG A 92 -8.814 5.197 -2.373 1.00 0.00 C ATOM 1439 C ARG A 92 -7.329 5.471 -2.263 1.00 0.00 C ATOM 1440 O ARG A 92 -6.903 6.145 -1.330 1.00 0.00 O ATOM 1441 CB ARG A 92 -9.594 6.523 -2.371 1.00 0.00 C ATOM 1442 CG ARG A 92 -11.064 6.367 -2.791 1.00 0.00 C ATOM 1443 CD ARG A 92 -11.854 7.645 -2.469 1.00 0.00 C ATOM 1444 NE ARG A 92 -12.543 8.256 -3.613 1.00 0.00 N ATOM 1445 CZ ARG A 92 -13.761 7.939 -4.059 1.00 0.00 C ATOM 1446 NH1 ARG A 92 -14.355 6.814 -3.680 1.00 0.00 N ATOM 1447 NH2 ARG A 92 -14.398 8.754 -4.886 1.00 0.00 N ATOM 0 H ARG A 92 -9.344 4.892 -0.375 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.046 4.681 -3.305 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.553 6.958 -1.373 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -9.104 7.225 -3.045 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.123 6.155 -3.859 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.508 5.517 -2.273 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -12.592 7.413 -1.701 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.170 8.379 -2.042 1.00 0.00 H new ATOM 0 HE ARG A 92 -12.044 8.991 -4.114 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -13.881 6.178 -3.039 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -15.286 6.586 -4.029 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.958 9.625 -5.183 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -15.328 8.511 -5.226 1.00 0.00 H new ATOM 1461 N TYR A 93 -6.532 4.895 -3.146 1.00 0.00 N ATOM 1462 CA TYR A 93 -5.094 5.075 -3.171 1.00 0.00 C ATOM 1463 C TYR A 93 -4.782 6.334 -3.973 1.00 0.00 C ATOM 1464 O TYR A 93 -5.493 6.699 -4.909 1.00 0.00 O ATOM 1465 CB TYR A 93 -4.387 3.813 -3.646 1.00 0.00 C ATOM 1466 CG TYR A 93 -4.584 2.627 -2.716 1.00 0.00 C ATOM 1467 CD1 TYR A 93 -5.780 1.884 -2.712 1.00 0.00 C ATOM 1468 CD2 TYR A 93 -3.566 2.291 -1.807 1.00 0.00 C ATOM 1469 CE1 TYR A 93 -5.974 0.869 -1.754 1.00 0.00 C ATOM 1470 CE2 TYR A 93 -3.772 1.321 -0.817 1.00 0.00 C ATOM 1471 CZ TYR A 93 -4.986 0.608 -0.776 1.00 0.00 C ATOM 1472 OH TYR A 93 -5.202 -0.313 0.200 1.00 0.00 O ATOM 0 H TYR A 93 -6.876 4.276 -3.881 1.00 0.00 H new ATOM 0 HA TYR A 93 -4.699 5.231 -2.167 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -4.753 3.552 -4.639 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -3.321 4.017 -3.743 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -6.548 2.092 -3.442 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -2.610 2.788 -1.873 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.883 0.286 -1.767 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -3.002 1.121 -0.087 1.00 0.00 H new ATOM 0 HH TYR A 93 -4.416 -0.362 0.783 1.00 0.00 H new ATOM 1482 N GLY A 94 -3.692 6.990 -3.614 1.00 0.00 N ATOM 1483 CA GLY A 94 -3.112 8.200 -4.058 1.00 0.00 C ATOM 1484 C GLY A 94 -1.750 8.114 -4.730 1.00 0.00 C ATOM 1485 O GLY A 94 -1.166 7.035 -4.877 1.00 0.00 O ATOM 0 H GLY A 94 -3.113 6.594 -2.874 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -3.804 8.670 -4.757 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -3.024 8.867 -3.200 1.00 0.00 H new ATOM 1489 N LYS A 95 -1.370 9.213 -5.376 1.00 0.00 N ATOM 1490 CA LYS A 95 -0.090 9.308 -6.064 1.00 0.00 C ATOM 1491 C LYS A 95 1.059 9.250 -5.032 1.00 0.00 C ATOM 1492 O LYS A 95 0.828 9.386 -3.827 1.00 0.00 O ATOM 1493 CB LYS A 95 -0.107 10.620 -6.853 1.00 0.00 C ATOM 1494 CG LYS A 95 1.023 10.737 -7.879 1.00 0.00 C ATOM 1495 CD LYS A 95 0.565 11.438 -9.166 1.00 0.00 C ATOM 1496 CE LYS A 95 -0.105 12.808 -8.971 1.00 0.00 C ATOM 1497 NZ LYS A 95 0.878 13.900 -8.883 1.00 0.00 N ATOM 0 H LYS A 95 -1.939 10.058 -5.436 1.00 0.00 H new ATOM 0 HA LYS A 95 0.071 8.478 -6.752 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -1.064 10.712 -7.367 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -0.039 11.454 -6.155 1.00 0.00 H new ATOM 0 HG2 LYS A 95 1.854 11.291 -7.441 1.00 0.00 H new ATOM 0 HG3 LYS A 95 1.396 9.742 -8.122 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.430 11.565 -9.817 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -0.133 10.783 -9.687 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -0.785 12.999 -9.801 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -0.708 12.790 -8.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.383 14.814 -8.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.423 13.806 -8.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 1.524 13.852 -9.696 1.00 0.00 H new ATOM 1511 N VAL A 96 2.292 9.009 -5.488 1.00 0.00 N ATOM 1512 CA VAL A 96 3.478 8.886 -4.637 1.00 0.00 C ATOM 1513 C VAL A 96 4.468 10.015 -4.902 1.00 0.00 C ATOM 1514 O VAL A 96 4.693 10.433 -6.045 1.00 0.00 O ATOM 1515 CB VAL A 96 4.146 7.504 -4.830 1.00 0.00 C ATOM 1516 CG1 VAL A 96 5.348 7.285 -3.891 1.00 0.00 C ATOM 1517 CG2 VAL A 96 3.123 6.381 -4.600 1.00 0.00 C ATOM 0 H VAL A 96 2.497 8.892 -6.480 1.00 0.00 H new ATOM 0 HA VAL A 96 3.157 8.967 -3.598 1.00 0.00 H new ATOM 0 HB VAL A 96 4.515 7.480 -5.856 1.00 0.00 H new ATOM 0 HG11 VAL A 96 5.776 6.299 -4.072 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.102 8.048 -4.081 1.00 0.00 H new ATOM 0 HG13 VAL A 96 5.017 7.353 -2.855 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.607 5.414 -4.739 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.731 6.448 -3.585 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.304 6.483 -5.312 1.00 0.00 H new ATOM 1527 N TYR A 97 5.107 10.466 -3.828 1.00 0.00 N ATOM 1528 CA TYR A 97 6.088 11.530 -3.818 1.00 0.00 C ATOM 1529 C TYR A 97 7.352 11.058 -3.101 1.00 0.00 C ATOM 1530 O TYR A 97 7.323 10.058 -2.380 1.00 0.00 O ATOM 1531 CB TYR A 97 5.494 12.778 -3.152 1.00 0.00 C ATOM 1532 CG TYR A 97 4.066 13.105 -3.558 1.00 0.00 C ATOM 1533 CD1 TYR A 97 2.985 12.514 -2.875 1.00 0.00 C ATOM 1534 CD2 TYR A 97 3.825 13.962 -4.641 1.00 0.00 C ATOM 1535 CE1 TYR A 97 1.650 12.764 -3.258 1.00 0.00 C ATOM 1536 CE2 TYR A 97 2.501 14.231 -5.035 1.00 0.00 C ATOM 1537 CZ TYR A 97 1.412 13.626 -4.360 1.00 0.00 C ATOM 1538 OH TYR A 97 0.143 13.881 -4.783 1.00 0.00 O ATOM 0 H TYR A 97 4.943 10.077 -2.900 1.00 0.00 H new ATOM 0 HA TYR A 97 6.359 11.793 -4.840 1.00 0.00 H new ATOM 0 HB2 TYR A 97 5.527 12.645 -2.071 1.00 0.00 H new ATOM 0 HB3 TYR A 97 6.128 13.633 -3.387 1.00 0.00 H new ATOM 0 HD1 TYR A 97 3.182 11.856 -2.041 1.00 0.00 H new ATOM 0 HD2 TYR A 97 4.651 14.413 -5.170 1.00 0.00 H new ATOM 0 HE1 TYR A 97 0.828 12.310 -2.725 1.00 0.00 H new ATOM 0 HE2 TYR A 97 2.313 14.904 -5.859 1.00 0.00 H new ATOM 0 HH TYR A 97 -0.319 14.434 -4.118 1.00 0.00 H new ATOM 1548 N SER A 98 8.446 11.798 -3.271 1.00 0.00 N ATOM 1549 CA SER A 98 9.740 11.502 -2.687 1.00 0.00 C ATOM 1550 C SER A 98 10.021 12.345 -1.442 1.00 0.00 C ATOM 1551 O SER A 98 9.615 13.514 -1.408 1.00 0.00 O ATOM 1552 CB SER A 98 10.808 11.645 -3.786 1.00 0.00 C ATOM 1553 OG SER A 98 11.487 12.894 -3.782 1.00 0.00 O ATOM 0 H SER A 98 8.450 12.646 -3.838 1.00 0.00 H new ATOM 0 HA SER A 98 9.758 10.476 -2.321 1.00 0.00 H new ATOM 0 HB2 SER A 98 11.540 10.846 -3.671 1.00 0.00 H new ATOM 0 HB3 SER A 98 10.334 11.505 -4.758 1.00 0.00 H new ATOM 0 HG SER A 98 12.455 12.740 -3.807 1.00 0.00 H new ATOM 1559 N THR A 99 10.756 11.787 -0.476 1.00 0.00 N ATOM 1560 CA THR A 99 11.112 12.445 0.787 1.00 0.00 C ATOM 1561 C THR A 99 12.371 13.318 0.679 1.00 0.00 C ATOM 1562 O THR A 99 13.380 13.083 1.347 1.00 0.00 O ATOM 1563 CB THR A 99 11.249 11.428 1.925 1.00 0.00 C ATOM 1564 OG1 THR A 99 12.153 10.381 1.602 1.00 0.00 O ATOM 1565 CG2 THR A 99 9.901 10.861 2.372 1.00 0.00 C ATOM 0 H THR A 99 11.130 10.841 -0.551 1.00 0.00 H new ATOM 0 HA THR A 99 10.287 13.118 1.020 1.00 0.00 H new ATOM 0 HB THR A 99 11.665 11.980 2.768 1.00 0.00 H new ATOM 0 HG1 THR A 99 11.711 9.738 1.010 1.00 0.00 H new ATOM 0 HG21 THR A 99 10.057 10.146 3.180 1.00 0.00 H new ATOM 0 HG22 THR A 99 9.264 11.672 2.723 1.00 0.00 H new ATOM 0 HG23 THR A 99 9.420 10.360 1.532 1.00 0.00 H new ATOM 1573 N ASN A 100 12.319 14.332 -0.185 1.00 0.00 N ATOM 1574 CA ASN A 100 13.418 15.288 -0.460 1.00 0.00 C ATOM 1575 C ASN A 100 14.744 14.558 -0.752 1.00 0.00 C ATOM 1576 O ASN A 100 15.824 15.102 -0.540 1.00 0.00 O ATOM 1577 CB ASN A 100 13.618 16.285 0.700 1.00 0.00 C ATOM 1578 CG ASN A 100 12.330 16.772 1.332 1.00 0.00 C ATOM 1579 OD1 ASN A 100 11.467 17.335 0.673 1.00 0.00 O ATOM 1580 ND2 ASN A 100 12.099 16.468 2.599 1.00 0.00 N ATOM 0 H ASN A 100 11.484 14.526 -0.738 1.00 0.00 H new ATOM 0 HA ASN A 100 13.123 15.848 -1.347 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.230 15.813 1.468 1.00 0.00 H new ATOM 0 HB3 ASN A 100 14.177 17.146 0.332 1.00 0.00 H new ATOM 0 HD21 ASN A 100 11.202 16.703 3.025 1.00 0.00 H new ATOM 0 HD22 ASN A 100 12.818 15.998 3.150 1.00 0.00 H new ATOM 1587 N GLU A 101 14.647 13.326 -1.250 1.00 0.00 N ATOM 1588 CA GLU A 101 15.706 12.389 -1.577 1.00 0.00 C ATOM 1589 C GLU A 101 16.981 13.001 -2.134 1.00 0.00 C ATOM 1590 O GLU A 101 18.045 12.927 -1.513 1.00 0.00 O ATOM 1591 CB GLU A 101 15.133 11.338 -2.535 1.00 0.00 C ATOM 1592 CG GLU A 101 14.100 10.384 -1.936 1.00 0.00 C ATOM 1593 CD GLU A 101 14.628 9.349 -0.937 1.00 0.00 C ATOM 1594 OE1 GLU A 101 15.730 9.534 -0.373 1.00 0.00 O ATOM 1595 OE2 GLU A 101 13.969 8.302 -0.775 1.00 0.00 O ATOM 0 H GLU A 101 13.731 12.926 -1.452 1.00 0.00 H new ATOM 0 HA GLU A 101 16.031 11.944 -0.637 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.676 11.854 -3.379 1.00 0.00 H new ATOM 0 HB3 GLU A 101 15.959 10.747 -2.932 1.00 0.00 H new ATOM 0 HG2 GLU A 101 13.333 10.979 -1.439 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.612 9.853 -2.753 1.00 0.00 H new ATOM 1602 N ASP A 102 16.865 13.539 -3.342 1.00 0.00 N ATOM 1603 CA ASP A 102 17.926 14.179 -4.124 1.00 0.00 C ATOM 1604 C ASP A 102 19.191 13.300 -4.259 1.00 0.00 C ATOM 1605 O ASP A 102 20.265 13.812 -4.570 1.00 0.00 O ATOM 1606 CB ASP A 102 18.224 15.556 -3.508 1.00 0.00 C ATOM 1607 CG ASP A 102 18.850 16.576 -4.461 1.00 0.00 C ATOM 1608 OD1 ASP A 102 19.271 16.264 -5.596 1.00 0.00 O ATOM 1609 OD2 ASP A 102 18.838 17.773 -4.094 1.00 0.00 O ATOM 0 H ASP A 102 15.973 13.542 -3.836 1.00 0.00 H new ATOM 0 HA ASP A 102 17.578 14.312 -5.148 1.00 0.00 H new ATOM 0 HB2 ASP A 102 17.294 15.970 -3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 102 18.893 15.419 -2.658 1.00 0.00 H new ATOM 1614 N SER A 103 19.099 11.983 -4.039 1.00 0.00 N ATOM 1615 CA SER A 103 20.214 11.045 -4.103 1.00 0.00 C ATOM 1616 C SER A 103 19.756 9.670 -4.609 1.00 0.00 C ATOM 1617 O SER A 103 18.626 9.525 -5.085 1.00 0.00 O ATOM 1618 CB SER A 103 20.849 10.998 -2.703 1.00 0.00 C ATOM 1619 OG SER A 103 19.878 10.895 -1.670 1.00 0.00 O ATOM 0 H SER A 103 18.215 11.531 -3.804 1.00 0.00 H new ATOM 0 HA SER A 103 20.964 11.372 -4.823 1.00 0.00 H new ATOM 0 HB2 SER A 103 21.529 10.148 -2.644 1.00 0.00 H new ATOM 0 HB3 SER A 103 21.447 11.896 -2.548 1.00 0.00 H new ATOM 0 HG SER A 103 19.350 11.720 -1.634 1.00 0.00 H new ATOM 1625 N ASP A 104 20.624 8.662 -4.501 1.00 0.00 N ATOM 1626 CA ASP A 104 20.373 7.284 -4.927 1.00 0.00 C ATOM 1627 C ASP A 104 19.968 6.391 -3.741 1.00 0.00 C ATOM 1628 O ASP A 104 20.138 5.165 -3.787 1.00 0.00 O ATOM 1629 CB ASP A 104 21.598 6.719 -5.668 1.00 0.00 C ATOM 1630 CG ASP A 104 21.888 7.363 -7.023 1.00 0.00 C ATOM 1631 OD1 ASP A 104 21.115 8.217 -7.518 1.00 0.00 O ATOM 1632 OD2 ASP A 104 22.984 7.066 -7.555 1.00 0.00 O ATOM 0 H ASP A 104 21.554 8.787 -4.100 1.00 0.00 H new ATOM 0 HA ASP A 104 19.532 7.291 -5.620 1.00 0.00 H new ATOM 0 HB2 ASP A 104 22.475 6.837 -5.032 1.00 0.00 H new ATOM 0 HB3 ASP A 104 21.453 5.649 -5.815 1.00 0.00 H new ATOM 1637 N ALA A 105 19.514 6.974 -2.627 1.00 0.00 N ATOM 1638 CA ALA A 105 19.074 6.219 -1.459 1.00 0.00 C ATOM 1639 C ALA A 105 17.723 5.596 -1.817 1.00 0.00 C ATOM 1640 O ALA A 105 17.613 4.372 -1.892 1.00 0.00 O ATOM 1641 CB ALA A 105 19.027 7.104 -0.209 1.00 0.00 C ATOM 0 H ALA A 105 19.443 7.985 -2.514 1.00 0.00 H new ATOM 0 HA ALA A 105 19.779 5.427 -1.207 1.00 0.00 H new ATOM 0 HB1 ALA A 105 18.695 6.512 0.644 1.00 0.00 H new ATOM 0 HB2 ALA A 105 20.021 7.504 -0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 105 18.331 7.927 -0.372 1.00 0.00 H new ATOM 1647 N LYS A 106 16.726 6.438 -2.107 1.00 0.00 N ATOM 1648 CA LYS A 106 15.378 6.027 -2.495 1.00 0.00 C ATOM 1649 C LYS A 106 14.792 4.974 -1.537 1.00 0.00 C ATOM 1650 O LYS A 106 14.226 3.977 -1.983 1.00 0.00 O ATOM 1651 CB LYS A 106 15.404 5.625 -3.976 1.00 0.00 C ATOM 1652 CG LYS A 106 14.033 5.786 -4.635 1.00 0.00 C ATOM 1653 CD LYS A 106 14.085 5.612 -6.151 1.00 0.00 C ATOM 1654 CE LYS A 106 14.493 4.181 -6.509 1.00 0.00 C ATOM 1655 NZ LYS A 106 14.220 3.839 -7.919 1.00 0.00 N ATOM 0 H LYS A 106 16.840 7.451 -2.077 1.00 0.00 H new ATOM 0 HA LYS A 106 14.680 6.858 -2.398 1.00 0.00 H new ATOM 0 HB2 LYS A 106 16.135 6.236 -4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 106 15.730 4.589 -4.065 1.00 0.00 H new ATOM 0 HG2 LYS A 106 13.343 5.055 -4.213 1.00 0.00 H new ATOM 0 HG3 LYS A 106 13.635 6.773 -4.400 1.00 0.00 H new ATOM 0 HD2 LYS A 106 13.110 5.838 -6.583 1.00 0.00 H new ATOM 0 HD3 LYS A 106 14.796 6.318 -6.581 1.00 0.00 H new ATOM 0 HE2 LYS A 106 15.557 4.051 -6.309 1.00 0.00 H new ATOM 0 HE3 LYS A 106 13.960 3.484 -5.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 14.517 2.859 -8.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 13.202 3.934 -8.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 14.749 4.483 -8.541 1.00 0.00 H new ATOM 1669 N ASP A 107 14.862 5.209 -0.222 1.00 0.00 N ATOM 1670 CA ASP A 107 14.348 4.281 0.787 1.00 0.00 C ATOM 1671 C ASP A 107 13.140 4.838 1.541 1.00 0.00 C ATOM 1672 O ASP A 107 12.499 4.087 2.271 1.00 0.00 O ATOM 1673 CB ASP A 107 15.443 3.831 1.761 1.00 0.00 C ATOM 1674 CG ASP A 107 16.519 2.949 1.130 1.00 0.00 C ATOM 1675 OD1 ASP A 107 16.243 2.172 0.185 1.00 0.00 O ATOM 1676 OD2 ASP A 107 17.661 2.984 1.649 1.00 0.00 O ATOM 0 H ASP A 107 15.279 6.052 0.172 1.00 0.00 H new ATOM 0 HA ASP A 107 14.005 3.403 0.240 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.918 4.714 2.189 1.00 0.00 H new ATOM 0 HB3 ASP A 107 14.980 3.287 2.584 1.00 0.00 H new ATOM 1681 N GLU A 108 12.764 6.113 1.388 1.00 0.00 N ATOM 1682 CA GLU A 108 11.589 6.659 2.078 1.00 0.00 C ATOM 1683 C GLU A 108 10.763 7.401 1.039 1.00 0.00 C ATOM 1684 O GLU A 108 11.312 8.129 0.217 1.00 0.00 O ATOM 1685 CB GLU A 108 12.010 7.617 3.189 1.00 0.00 C ATOM 1686 CG GLU A 108 11.997 7.021 4.601 1.00 0.00 C ATOM 1687 CD GLU A 108 12.237 8.133 5.623 1.00 0.00 C ATOM 1688 OE1 GLU A 108 11.724 9.264 5.453 1.00 0.00 O ATOM 1689 OE2 GLU A 108 12.889 7.878 6.656 1.00 0.00 O ATOM 0 H GLU A 108 13.254 6.784 0.795 1.00 0.00 H new ATOM 0 HA GLU A 108 11.013 5.856 2.537 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.015 7.979 2.974 1.00 0.00 H new ATOM 0 HB3 GLU A 108 11.348 8.483 3.171 1.00 0.00 H new ATOM 0 HG2 GLU A 108 11.041 6.535 4.794 1.00 0.00 H new ATOM 0 HG3 GLU A 108 12.768 6.256 4.692 1.00 0.00 H new ATOM 1696 N ILE A 109 9.442 7.336 1.101 1.00 0.00 N ATOM 1697 CA ILE A 109 8.543 7.969 0.137 1.00 0.00 C ATOM 1698 C ILE A 109 7.312 8.477 0.856 1.00 0.00 C ATOM 1699 O ILE A 109 7.170 8.290 2.060 1.00 0.00 O ATOM 1700 CB ILE A 109 8.144 6.938 -0.946 1.00 0.00 C ATOM 1701 CG1 ILE A 109 7.634 5.602 -0.360 1.00 0.00 C ATOM 1702 CG2 ILE A 109 9.280 6.658 -1.912 1.00 0.00 C ATOM 1703 CD1 ILE A 109 6.120 5.611 -0.364 1.00 0.00 C ATOM 0 H ILE A 109 8.950 6.831 1.838 1.00 0.00 H new ATOM 0 HA ILE A 109 9.046 8.810 -0.341 1.00 0.00 H new ATOM 0 HB ILE A 109 7.319 7.405 -1.485 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.008 4.765 -0.950 1.00 0.00 H new ATOM 0 HG13 ILE A 109 8.008 5.469 0.655 1.00 0.00 H new ATOM 0 HG21 ILE A 109 8.955 5.929 -2.654 1.00 0.00 H new ATOM 0 HG22 ILE A 109 9.568 7.582 -2.413 1.00 0.00 H new ATOM 0 HG23 ILE A 109 10.134 6.261 -1.364 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.749 4.672 0.048 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.759 6.441 0.244 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.760 5.726 -1.386 1.00 0.00 H new ATOM 1715 N ILE A 110 6.387 9.086 0.122 1.00 0.00 N ATOM 1716 CA ILE A 110 5.157 9.608 0.667 1.00 0.00 C ATOM 1717 C ILE A 110 4.041 9.085 -0.224 1.00 0.00 C ATOM 1718 O ILE A 110 3.979 9.418 -1.409 1.00 0.00 O ATOM 1719 CB ILE A 110 5.232 11.139 0.776 1.00 0.00 C ATOM 1720 CG1 ILE A 110 6.644 11.570 1.231 1.00 0.00 C ATOM 1721 CG2 ILE A 110 4.155 11.614 1.755 1.00 0.00 C ATOM 1722 CD1 ILE A 110 6.817 13.050 1.461 1.00 0.00 C ATOM 0 H ILE A 110 6.480 9.229 -0.884 1.00 0.00 H new ATOM 0 HA ILE A 110 4.966 9.276 1.687 1.00 0.00 H new ATOM 0 HB ILE A 110 5.050 11.597 -0.196 1.00 0.00 H new ATOM 0 HG12 ILE A 110 6.888 11.044 2.154 1.00 0.00 H new ATOM 0 HG13 ILE A 110 7.365 11.248 0.480 1.00 0.00 H new ATOM 0 HG21 ILE A 110 4.196 12.700 1.843 1.00 0.00 H new ATOM 0 HG22 ILE A 110 3.173 11.317 1.388 1.00 0.00 H new ATOM 0 HG23 ILE A 110 4.328 11.164 2.733 1.00 0.00 H new ATOM 0 HD11 ILE A 110 7.840 13.252 1.777 1.00 0.00 H new ATOM 0 HD12 ILE A 110 6.610 13.589 0.536 1.00 0.00 H new ATOM 0 HD13 ILE A 110 6.126 13.381 2.236 1.00 0.00 H new ATOM 1734 N VAL A 111 3.220 8.203 0.331 1.00 0.00 N ATOM 1735 CA VAL A 111 2.076 7.573 -0.319 1.00 0.00 C ATOM 1736 C VAL A 111 0.803 8.283 0.077 1.00 0.00 C ATOM 1737 O VAL A 111 0.542 8.481 1.258 1.00 0.00 O ATOM 1738 CB VAL A 111 2.032 6.097 0.115 1.00 0.00 C ATOM 1739 CG1 VAL A 111 0.648 5.422 0.110 1.00 0.00 C ATOM 1740 CG2 VAL A 111 2.992 5.340 -0.796 1.00 0.00 C ATOM 0 H VAL A 111 3.339 7.891 1.295 1.00 0.00 H new ATOM 0 HA VAL A 111 2.171 7.636 -1.403 1.00 0.00 H new ATOM 0 HB VAL A 111 2.318 6.068 1.166 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.747 4.386 0.434 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.018 5.953 0.790 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.234 5.449 -0.898 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.995 4.284 -0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.671 5.448 -1.832 1.00 0.00 H new ATOM 0 HG23 VAL A 111 3.997 5.746 -0.683 1.00 0.00 H new ATOM 1750 N GLU A 112 -0.023 8.638 -0.902 1.00 0.00 N ATOM 1751 CA GLU A 112 -1.281 9.296 -0.600 1.00 0.00 C ATOM 1752 C GLU A 112 -2.340 8.201 -0.414 1.00 0.00 C ATOM 1753 O GLU A 112 -2.315 7.206 -1.144 1.00 0.00 O ATOM 1754 CB GLU A 112 -1.672 10.186 -1.760 1.00 0.00 C ATOM 1755 CG GLU A 112 -3.112 10.773 -1.746 1.00 0.00 C ATOM 1756 CD GLU A 112 -3.556 11.221 -3.151 1.00 0.00 C ATOM 1757 OE1 GLU A 112 -2.699 11.544 -4.004 1.00 0.00 O ATOM 1758 OE2 GLU A 112 -4.756 11.056 -3.473 1.00 0.00 O ATOM 0 H GLU A 112 0.155 8.483 -1.894 1.00 0.00 H new ATOM 0 HA GLU A 112 -1.195 9.906 0.299 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -0.968 11.017 -1.802 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.547 9.616 -2.681 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -3.807 10.024 -1.366 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -3.153 11.622 -1.063 1.00 0.00 H new ATOM 1765 N PHE A 113 -3.268 8.362 0.522 1.00 0.00 N ATOM 1766 CA PHE A 113 -4.361 7.456 0.801 1.00 0.00 C ATOM 1767 C PHE A 113 -5.537 8.326 1.234 1.00 0.00 C ATOM 1768 O PHE A 113 -5.376 9.140 2.137 1.00 0.00 O ATOM 1769 CB PHE A 113 -3.974 6.447 1.888 1.00 0.00 C ATOM 1770 CG PHE A 113 -4.986 5.329 1.989 1.00 0.00 C ATOM 1771 CD1 PHE A 113 -5.321 4.577 0.849 1.00 0.00 C ATOM 1772 CD2 PHE A 113 -5.634 5.060 3.203 1.00 0.00 C ATOM 1773 CE1 PHE A 113 -6.303 3.585 0.907 1.00 0.00 C ATOM 1774 CE2 PHE A 113 -6.614 4.056 3.266 1.00 0.00 C ATOM 1775 CZ PHE A 113 -6.966 3.329 2.118 1.00 0.00 C ATOM 0 H PHE A 113 -3.273 9.175 1.137 1.00 0.00 H new ATOM 0 HA PHE A 113 -4.621 6.865 -0.077 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -2.991 6.031 1.667 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -3.896 6.957 2.848 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -4.812 4.769 -0.084 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -5.380 5.624 4.088 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -6.551 3.017 0.023 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -7.101 3.841 4.206 1.00 0.00 H new ATOM 0 HZ PHE A 113 -7.741 2.578 2.166 1.00 0.00 H new ATOM 1785 N ASN A 114 -6.719 8.152 0.639 1.00 0.00 N ATOM 1786 CA ASN A 114 -7.927 8.929 0.928 1.00 0.00 C ATOM 1787 C ASN A 114 -7.584 10.428 0.907 1.00 0.00 C ATOM 1788 O ASN A 114 -7.911 11.164 1.839 1.00 0.00 O ATOM 1789 CB ASN A 114 -8.620 8.527 2.253 1.00 0.00 C ATOM 1790 CG ASN A 114 -9.039 7.075 2.453 1.00 0.00 C ATOM 1791 OD1 ASN A 114 -8.915 6.537 3.548 1.00 0.00 O ATOM 1792 ND2 ASN A 114 -9.686 6.436 1.492 1.00 0.00 N ATOM 0 H ASN A 114 -6.867 7.444 -0.080 1.00 0.00 H new ATOM 0 HA ASN A 114 -8.654 8.705 0.147 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.949 8.792 3.070 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -9.511 9.145 2.360 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -10.074 5.509 1.667 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -9.797 6.870 0.576 1.00 0.00 H new ATOM 1799 N ARG A 115 -6.882 10.889 -0.140 1.00 0.00 N ATOM 1800 CA ARG A 115 -6.458 12.282 -0.374 1.00 0.00 C ATOM 1801 C ARG A 115 -5.451 12.843 0.639 1.00 0.00 C ATOM 1802 O ARG A 115 -5.129 14.030 0.570 1.00 0.00 O ATOM 1803 CB ARG A 115 -7.689 13.215 -0.392 1.00 0.00 C ATOM 1804 CG ARG A 115 -8.892 12.749 -1.213 1.00 0.00 C ATOM 1805 CD ARG A 115 -8.556 12.502 -2.686 1.00 0.00 C ATOM 1806 NE ARG A 115 -9.660 12.979 -3.529 1.00 0.00 N ATOM 1807 CZ ARG A 115 -9.895 14.266 -3.825 1.00 0.00 C ATOM 1808 NH1 ARG A 115 -9.030 15.227 -3.505 1.00 0.00 N ATOM 1809 NH2 ARG A 115 -11.021 14.596 -4.435 1.00 0.00 N ATOM 0 H ARG A 115 -6.577 10.267 -0.889 1.00 0.00 H new ATOM 0 HA ARG A 115 -5.947 12.252 -1.337 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -8.017 13.366 0.637 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -7.374 14.187 -0.772 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -9.287 11.831 -0.778 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -9.681 13.498 -1.147 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -7.633 13.019 -2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -8.387 11.439 -2.858 1.00 0.00 H new ATOM 0 HE ARG A 115 -10.294 12.281 -3.918 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -8.163 14.992 -3.022 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -9.235 16.198 -3.743 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -11.701 13.875 -4.676 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -11.210 15.572 -4.665 1.00 0.00 H new ATOM 1823 N GLU A 116 -4.959 12.041 1.571 1.00 0.00 N ATOM 1824 CA GLU A 116 -4.029 12.418 2.620 1.00 0.00 C ATOM 1825 C GLU A 116 -2.691 11.785 2.317 1.00 0.00 C ATOM 1826 O GLU A 116 -2.627 10.633 1.911 1.00 0.00 O ATOM 1827 CB GLU A 116 -4.589 11.945 3.967 1.00 0.00 C ATOM 1828 CG GLU A 116 -5.610 12.935 4.530 1.00 0.00 C ATOM 1829 CD GLU A 116 -4.914 14.093 5.234 1.00 0.00 C ATOM 1830 OE1 GLU A 116 -4.375 14.990 4.549 1.00 0.00 O ATOM 1831 OE2 GLU A 116 -4.843 14.088 6.478 1.00 0.00 O ATOM 0 H GLU A 116 -5.214 11.054 1.616 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.897 13.499 2.669 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.057 10.968 3.844 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -3.772 11.820 4.678 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -6.235 13.318 3.723 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -6.271 12.423 5.230 1.00 0.00 H new ATOM 1838 N TYR A 117 -1.616 12.539 2.483 1.00 0.00 N ATOM 1839 CA TYR A 117 -0.258 12.073 2.210 1.00 0.00 C ATOM 1840 C TYR A 117 0.358 11.444 3.453 1.00 0.00 C ATOM 1841 O TYR A 117 0.428 12.086 4.492 1.00 0.00 O ATOM 1842 CB TYR A 117 0.571 13.258 1.700 1.00 0.00 C ATOM 1843 CG TYR A 117 0.148 13.861 0.367 1.00 0.00 C ATOM 1844 CD1 TYR A 117 -0.964 13.399 -0.371 1.00 0.00 C ATOM 1845 CD2 TYR A 117 0.908 14.924 -0.140 1.00 0.00 C ATOM 1846 CE1 TYR A 117 -1.360 14.036 -1.556 1.00 0.00 C ATOM 1847 CE2 TYR A 117 0.522 15.566 -1.329 1.00 0.00 C ATOM 1848 CZ TYR A 117 -0.624 15.140 -2.025 1.00 0.00 C ATOM 1849 OH TYR A 117 -0.993 15.761 -3.171 1.00 0.00 O ATOM 0 H TYR A 117 -1.658 13.503 2.814 1.00 0.00 H new ATOM 0 HA TYR A 117 -0.276 11.298 1.444 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.542 14.044 2.454 1.00 0.00 H new ATOM 0 HB3 TYR A 117 1.609 12.936 1.615 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -1.518 12.542 -0.017 1.00 0.00 H new ATOM 0 HD2 TYR A 117 1.793 15.251 0.385 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -2.221 13.683 -2.103 1.00 0.00 H new ATOM 0 HE2 TYR A 117 1.107 16.390 -1.710 1.00 0.00 H new ATOM 0 HH TYR A 117 -0.380 16.504 -3.353 1.00 0.00 H new ATOM 1859 N TYR A 118 0.909 10.241 3.338 1.00 0.00 N ATOM 1860 CA TYR A 118 1.515 9.523 4.457 1.00 0.00 C ATOM 1861 C TYR A 118 2.958 9.159 4.164 1.00 0.00 C ATOM 1862 O TYR A 118 3.259 8.540 3.142 1.00 0.00 O ATOM 1863 CB TYR A 118 0.751 8.239 4.780 1.00 0.00 C ATOM 1864 CG TYR A 118 -0.651 8.506 5.252 1.00 0.00 C ATOM 1865 CD1 TYR A 118 -1.666 8.658 4.298 1.00 0.00 C ATOM 1866 CD2 TYR A 118 -0.924 8.684 6.622 1.00 0.00 C ATOM 1867 CE1 TYR A 118 -2.953 9.013 4.707 1.00 0.00 C ATOM 1868 CE2 TYR A 118 -2.228 9.004 7.041 1.00 0.00 C ATOM 1869 CZ TYR A 118 -3.243 9.192 6.076 1.00 0.00 C ATOM 1870 OH TYR A 118 -4.495 9.588 6.431 1.00 0.00 O ATOM 0 H TYR A 118 0.949 9.730 2.456 1.00 0.00 H new ATOM 0 HA TYR A 118 1.473 10.197 5.313 1.00 0.00 H new ATOM 0 HB2 TYR A 118 0.718 7.607 3.893 1.00 0.00 H new ATOM 0 HB3 TYR A 118 1.290 7.683 5.547 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -1.454 8.501 3.251 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -0.133 8.575 7.350 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -3.731 9.151 3.971 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -2.452 9.105 8.093 1.00 0.00 H new ATOM 0 HH TYR A 118 -4.548 9.669 7.406 1.00 0.00 H new ATOM 1880 N ARG A 119 3.876 9.612 5.015 1.00 0.00 N ATOM 1881 CA ARG A 119 5.282 9.299 4.858 1.00 0.00 C ATOM 1882 C ARG A 119 5.413 7.813 5.164 1.00 0.00 C ATOM 1883 O ARG A 119 4.887 7.346 6.175 1.00 0.00 O ATOM 1884 CB ARG A 119 6.144 10.182 5.767 1.00 0.00 C ATOM 1885 CG ARG A 119 7.632 9.975 5.461 1.00 0.00 C ATOM 1886 CD ARG A 119 8.340 8.922 6.329 1.00 0.00 C ATOM 1887 NE ARG A 119 8.402 9.305 7.757 1.00 0.00 N ATOM 1888 CZ ARG A 119 9.480 9.734 8.429 1.00 0.00 C ATOM 1889 NH1 ARG A 119 10.666 9.858 7.864 1.00 0.00 N ATOM 1890 NH2 ARG A 119 9.382 10.052 9.706 1.00 0.00 N ATOM 0 H ARG A 119 3.663 10.199 5.822 1.00 0.00 H new ATOM 0 HA ARG A 119 5.642 9.504 3.850 1.00 0.00 H new ATOM 0 HB2 ARG A 119 5.879 11.230 5.624 1.00 0.00 H new ATOM 0 HB3 ARG A 119 5.945 9.943 6.812 1.00 0.00 H new ATOM 0 HG2 ARG A 119 7.734 9.688 4.414 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.147 10.928 5.582 1.00 0.00 H new ATOM 0 HD2 ARG A 119 7.818 7.970 6.235 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.352 8.769 5.954 1.00 0.00 H new ATOM 0 HE ARG A 119 7.533 9.235 8.286 1.00 0.00 H new ATOM 0 HH11 ARG A 119 10.789 9.624 6.879 1.00 0.00 H new ATOM 0 HH12 ARG A 119 11.460 10.188 8.412 1.00 0.00 H new ATOM 0 HH21 ARG A 119 8.485 9.972 10.184 1.00 0.00 H new ATOM 0 HH22 ARG A 119 10.204 10.378 10.215 1.00 0.00 H new ATOM 1904 N ALA A 120 6.112 7.088 4.300 1.00 0.00 N ATOM 1905 CA ALA A 120 6.339 5.657 4.408 1.00 0.00 C ATOM 1906 C ALA A 120 7.831 5.325 4.246 1.00 0.00 C ATOM 1907 O ALA A 120 8.568 6.099 3.631 1.00 0.00 O ATOM 1908 CB ALA A 120 5.526 4.969 3.313 1.00 0.00 C ATOM 0 H ALA A 120 6.551 7.498 3.476 1.00 0.00 H new ATOM 0 HA ALA A 120 6.029 5.307 5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 120 5.678 3.891 3.370 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.468 5.194 3.449 1.00 0.00 H new ATOM 0 HB3 ALA A 120 5.851 5.330 2.337 1.00 0.00 H new ATOM 1914 N VAL A 121 8.259 4.151 4.711 1.00 0.00 N ATOM 1915 CA VAL A 121 9.650 3.686 4.635 1.00 0.00 C ATOM 1916 C VAL A 121 9.711 2.346 3.928 1.00 0.00 C ATOM 1917 O VAL A 121 8.808 1.530 4.109 1.00 0.00 O ATOM 1918 CB VAL A 121 10.253 3.409 6.035 1.00 0.00 C ATOM 1919 CG1 VAL A 121 11.784 3.315 5.999 1.00 0.00 C ATOM 1920 CG2 VAL A 121 9.914 4.410 7.121 1.00 0.00 C ATOM 0 H VAL A 121 7.637 3.480 5.161 1.00 0.00 H new ATOM 0 HA VAL A 121 10.197 4.474 4.118 1.00 0.00 H new ATOM 0 HB VAL A 121 9.783 2.460 6.292 1.00 0.00 H new ATOM 0 HG11 VAL A 121 12.160 3.120 7.003 1.00 0.00 H new ATOM 0 HG12 VAL A 121 12.083 2.504 5.335 1.00 0.00 H new ATOM 0 HG13 VAL A 121 12.198 4.255 5.633 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.392 4.111 8.054 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.272 5.398 6.830 1.00 0.00 H new ATOM 0 HG23 VAL A 121 8.834 4.443 7.261 1.00 0.00 H new ATOM 1930 N LEU A 122 10.755 2.115 3.129 1.00 0.00 N ATOM 1931 CA LEU A 122 11.003 0.856 2.443 1.00 0.00 C ATOM 1932 C LEU A 122 11.209 -0.108 3.608 1.00 0.00 C ATOM 1933 O LEU A 122 12.009 0.175 4.501 1.00 0.00 O ATOM 1934 CB LEU A 122 12.221 0.999 1.528 1.00 0.00 C ATOM 1935 CG LEU A 122 12.531 -0.287 0.757 1.00 0.00 C ATOM 1936 CD1 LEU A 122 11.404 -0.708 -0.188 1.00 0.00 C ATOM 1937 CD2 LEU A 122 13.779 -0.051 -0.085 1.00 0.00 C ATOM 0 H LEU A 122 11.467 2.820 2.940 1.00 0.00 H new ATOM 0 HA LEU A 122 10.209 0.515 1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 122 12.046 1.810 0.820 1.00 0.00 H new ATOM 0 HB3 LEU A 122 13.089 1.279 2.125 1.00 0.00 H new ATOM 0 HG LEU A 122 12.664 -1.081 1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 122 11.686 -1.626 -0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 122 10.493 -0.879 0.386 1.00 0.00 H new ATOM 0 HD13 LEU A 122 11.229 0.081 -0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 122 14.018 -0.956 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 122 13.599 0.768 -0.781 1.00 0.00 H new ATOM 0 HD23 LEU A 122 14.615 0.204 0.567 1.00 0.00 H new ATOM 1949 N ILE A 123 10.448 -1.199 3.644 1.00 0.00 N ATOM 1950 CA ILE A 123 10.518 -2.115 4.772 1.00 0.00 C ATOM 1951 C ILE A 123 11.644 -3.096 4.539 1.00 0.00 C ATOM 1952 O ILE A 123 12.488 -3.308 5.389 1.00 0.00 O ATOM 1953 CB ILE A 123 9.183 -2.888 4.872 1.00 0.00 C ATOM 1954 CG1 ILE A 123 8.047 -1.963 5.317 1.00 0.00 C ATOM 1955 CG2 ILE A 123 9.245 -4.064 5.858 1.00 0.00 C ATOM 1956 CD1 ILE A 123 6.698 -2.400 4.746 1.00 0.00 C ATOM 0 H ILE A 123 9.786 -1.465 2.915 1.00 0.00 H new ATOM 0 HA ILE A 123 10.696 -1.561 5.694 1.00 0.00 H new ATOM 0 HB ILE A 123 8.996 -3.278 3.872 1.00 0.00 H new ATOM 0 HG12 ILE A 123 7.994 -1.952 6.406 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.263 -0.943 4.998 1.00 0.00 H new ATOM 0 HG21 ILE A 123 8.279 -4.568 5.885 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.012 -4.768 5.537 1.00 0.00 H new ATOM 0 HG23 ILE A 123 9.488 -3.692 6.853 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.920 -1.717 5.087 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.742 -2.386 3.657 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.469 -3.410 5.087 1.00 0.00 H new ATOM 1968 N LYS A 124 11.672 -3.665 3.336 1.00 0.00 N ATOM 1969 CA LYS A 124 12.640 -4.653 2.889 1.00 0.00 C ATOM 1970 C LYS A 124 14.100 -4.221 3.110 1.00 0.00 C ATOM 1971 O LYS A 124 14.999 -5.060 3.163 1.00 0.00 O ATOM 1972 CB LYS A 124 12.229 -5.045 1.463 1.00 0.00 C ATOM 1973 CG LYS A 124 12.786 -4.152 0.358 1.00 0.00 C ATOM 1974 CD LYS A 124 14.134 -4.651 -0.162 1.00 0.00 C ATOM 1975 CE LYS A 124 14.831 -3.486 -0.852 1.00 0.00 C ATOM 1976 NZ LYS A 124 15.789 -3.968 -1.865 1.00 0.00 N ATOM 0 H LYS A 124 10.987 -3.436 2.616 1.00 0.00 H new ATOM 0 HA LYS A 124 12.620 -5.555 3.500 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.552 -6.069 1.278 1.00 0.00 H new ATOM 0 HB3 LYS A 124 11.141 -5.037 1.401 1.00 0.00 H new ATOM 0 HG2 LYS A 124 12.074 -4.109 -0.466 1.00 0.00 H new ATOM 0 HG3 LYS A 124 12.898 -3.136 0.736 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.744 -5.028 0.659 1.00 0.00 H new ATOM 0 HD3 LYS A 124 13.992 -5.477 -0.859 1.00 0.00 H new ATOM 0 HE2 LYS A 124 14.089 -2.842 -1.325 1.00 0.00 H new ATOM 0 HE3 LYS A 124 15.353 -2.880 -0.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 16.404 -3.184 -2.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 16.370 -4.729 -1.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 15.269 -4.332 -2.689 1.00 0.00 H new ATOM 1990 N ASN A 125 14.334 -2.908 3.213 1.00 0.00 N ATOM 1991 CA ASN A 125 15.633 -2.290 3.449 1.00 0.00 C ATOM 1992 C ASN A 125 16.161 -2.638 4.842 1.00 0.00 C ATOM 1993 O ASN A 125 17.360 -2.564 5.092 1.00 0.00 O ATOM 1994 CB ASN A 125 15.467 -0.771 3.362 1.00 0.00 C ATOM 1995 CG ASN A 125 16.784 -0.049 3.114 1.00 0.00 C ATOM 1996 OD1 ASN A 125 17.616 -0.498 2.329 1.00 0.00 O ATOM 1997 ND2 ASN A 125 16.939 1.132 3.677 1.00 0.00 N ATOM 0 H ASN A 125 13.585 -2.220 3.130 1.00 0.00 H new ATOM 0 HA ASN A 125 16.338 -2.658 2.704 1.00 0.00 H new ATOM 0 HB2 ASN A 125 14.769 -0.531 2.560 1.00 0.00 H new ATOM 0 HB3 ASN A 125 15.025 -0.404 4.289 1.00 0.00 H new ATOM 0 HD21 ASN A 125 17.763 1.694 3.464 1.00 0.00 H new ATOM 0 HD22 ASN A 125 16.235 1.484 4.326 1.00 0.00 H new ATOM 2004 N GLU A 126 15.266 -2.973 5.767 1.00 0.00 N ATOM 2005 CA GLU A 126 15.513 -3.365 7.142 1.00 0.00 C ATOM 2006 C GLU A 126 14.982 -4.801 7.295 1.00 0.00 C ATOM 2007 O GLU A 126 14.347 -5.335 6.380 1.00 0.00 O ATOM 2008 CB GLU A 126 14.915 -2.330 8.123 1.00 0.00 C ATOM 2009 CG GLU A 126 13.397 -2.079 8.037 1.00 0.00 C ATOM 2010 CD GLU A 126 12.869 -1.093 9.093 1.00 0.00 C ATOM 2011 OE1 GLU A 126 12.974 -1.355 10.315 1.00 0.00 O ATOM 2012 OE2 GLU A 126 12.316 -0.020 8.739 1.00 0.00 O ATOM 0 H GLU A 126 14.269 -2.976 5.551 1.00 0.00 H new ATOM 0 HA GLU A 126 16.574 -3.372 7.393 1.00 0.00 H new ATOM 0 HB2 GLU A 126 15.148 -2.652 9.138 1.00 0.00 H new ATOM 0 HB3 GLU A 126 15.425 -1.380 7.965 1.00 0.00 H new ATOM 0 HG2 GLU A 126 13.157 -1.697 7.045 1.00 0.00 H new ATOM 0 HG3 GLU A 126 12.874 -3.029 8.147 1.00 0.00 H new ATOM 2019 N LYS A 127 15.259 -5.473 8.415 1.00 0.00 N ATOM 2020 CA LYS A 127 14.811 -6.843 8.664 1.00 0.00 C ATOM 2021 C LYS A 127 14.506 -7.123 10.135 1.00 0.00 C ATOM 2022 O LYS A 127 14.573 -8.275 10.575 1.00 0.00 O ATOM 2023 CB LYS A 127 15.829 -7.812 8.059 1.00 0.00 C ATOM 2024 CG LYS A 127 17.187 -7.918 8.771 1.00 0.00 C ATOM 2025 CD LYS A 127 18.002 -9.114 8.251 1.00 0.00 C ATOM 2026 CE LYS A 127 18.896 -8.824 7.039 1.00 0.00 C ATOM 2027 NZ LYS A 127 18.163 -8.545 5.790 1.00 0.00 N ATOM 0 H LYS A 127 15.805 -5.077 9.180 1.00 0.00 H new ATOM 0 HA LYS A 127 13.851 -6.992 8.170 1.00 0.00 H new ATOM 0 HB2 LYS A 127 15.380 -8.805 8.033 1.00 0.00 H new ATOM 0 HB3 LYS A 127 16.009 -7.516 7.026 1.00 0.00 H new ATOM 0 HG2 LYS A 127 17.752 -6.998 8.620 1.00 0.00 H new ATOM 0 HG3 LYS A 127 17.029 -8.022 9.844 1.00 0.00 H new ATOM 0 HD2 LYS A 127 18.628 -9.485 9.062 1.00 0.00 H new ATOM 0 HD3 LYS A 127 17.312 -9.916 7.988 1.00 0.00 H new ATOM 0 HE2 LYS A 127 19.533 -7.970 7.270 1.00 0.00 H new ATOM 0 HE3 LYS A 127 19.554 -9.678 6.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 18.803 -8.661 4.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 17.366 -9.207 5.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.803 -7.570 5.810 1.00 0.00 H new ATOM 2041 N GLU A 128 14.253 -6.071 10.901 1.00 0.00 N ATOM 2042 CA GLU A 128 13.933 -6.077 12.317 1.00 0.00 C ATOM 2043 C GLU A 128 12.812 -5.066 12.473 1.00 0.00 C ATOM 2044 O GLU A 128 12.697 -4.179 11.602 1.00 0.00 O ATOM 2045 CB GLU A 128 15.196 -5.702 13.119 1.00 0.00 C ATOM 2046 CG GLU A 128 15.122 -5.924 14.634 1.00 0.00 C ATOM 2047 CD GLU A 128 14.922 -7.393 15.024 1.00 0.00 C ATOM 2048 OE1 GLU A 128 15.724 -8.265 14.613 1.00 0.00 O ATOM 2049 OE2 GLU A 128 13.945 -7.681 15.745 1.00 0.00 O ATOM 0 H GLU A 128 14.268 -5.125 10.520 1.00 0.00 H new ATOM 0 HA GLU A 128 13.613 -7.049 12.692 1.00 0.00 H new ATOM 0 HB2 GLU A 128 16.035 -6.278 12.728 1.00 0.00 H new ATOM 0 HB3 GLU A 128 15.419 -4.651 12.937 1.00 0.00 H new ATOM 0 HG2 GLU A 128 16.039 -5.555 15.093 1.00 0.00 H new ATOM 0 HG3 GLU A 128 14.302 -5.333 15.041 1.00 0.00 H new TER 2056 GLU A 128