USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 794 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 10 THR OG1 : rot 180:sc= 0.0135 USER MOD Set 1.2: A 13 THR OG1 : rot 180:sc= -0.684 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 20:sc= 0.553 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 29:sc= 0.443 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= -3.87! C(o=-3.9!,f=-3.4!) USER MOD Single : A 18 GLN : amide:sc= -7.53! K(o=-7.5!,f=-3.8) USER MOD Single : A 20 SER OG : rot -36:sc= 1.13 USER MOD Single : A 23 GLN : amide:sc= -0.091 X(o=-0.091,f=0) USER MOD Single : A 25 SER OG : rot 170:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.706 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 93:sc= 0.473 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -55:sc= -0.692! USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 56:sc= 0.00524 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 31:sc= 1.1 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= -0.786 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.994 USER MOD Single : A 70 GLN : amide:sc= -0.542 K(o=-0.54,f=-3.1!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= -0.216 X(o=-0.22,f=-0.029) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.505 10.919 0.139 1.00 0.00 N ATOM 2 CA GLY A 1 -15.190 12.324 0.319 1.00 0.00 C ATOM 3 C GLY A 1 -14.687 12.631 1.715 1.00 0.00 C ATOM 4 O GLY A 1 -15.478 12.798 2.644 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.844 10.761 -0.831 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.652 10.348 0.305 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.245 10.640 0.814 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.435 12.620 -0.409 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.079 12.921 0.117 1.00 0.00 H new ATOM 8 N SER A 2 -13.369 12.705 1.865 1.00 0.00 N ATOM 9 CA SER A 2 -12.761 12.989 3.160 1.00 0.00 C ATOM 10 C SER A 2 -11.404 13.662 2.987 1.00 0.00 C ATOM 11 O SER A 2 -10.512 13.127 2.329 1.00 0.00 O ATOM 12 CB SER A 2 -12.603 11.698 3.966 1.00 0.00 C ATOM 13 OG SER A 2 -11.590 10.873 3.416 1.00 0.00 O ATOM 0 H SER A 2 -12.701 12.572 1.106 1.00 0.00 H new ATOM 0 HA SER A 2 -13.418 13.670 3.701 1.00 0.00 H new ATOM 0 HB2 SER A 2 -12.358 11.939 5.000 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.549 11.157 3.980 1.00 0.00 H new ATOM 0 HG SER A 2 -10.999 11.413 2.851 1.00 0.00 H new ATOM 19 N SER A 3 -11.255 14.842 3.582 1.00 0.00 N ATOM 20 CA SER A 3 -10.008 15.593 3.491 1.00 0.00 C ATOM 21 C SER A 3 -9.416 15.832 4.877 1.00 0.00 C ATOM 22 O SER A 3 -10.142 15.941 5.865 1.00 0.00 O ATOM 23 CB SER A 3 -10.245 16.930 2.787 1.00 0.00 C ATOM 24 OG SER A 3 -10.849 17.867 3.662 1.00 0.00 O ATOM 0 H SER A 3 -11.983 15.298 4.132 1.00 0.00 H new ATOM 0 HA SER A 3 -9.299 15.005 2.909 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.297 17.326 2.423 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.882 16.778 1.916 1.00 0.00 H new ATOM 0 HG SER A 3 -10.988 18.714 3.189 1.00 0.00 H new ATOM 30 N GLY A 4 -8.091 15.913 4.942 1.00 0.00 N ATOM 31 CA GLY A 4 -7.422 16.138 6.209 1.00 0.00 C ATOM 32 C GLY A 4 -5.962 16.504 6.038 1.00 0.00 C ATOM 33 O GLY A 4 -5.074 15.730 6.398 1.00 0.00 O ATOM 0 H GLY A 4 -7.468 15.827 4.139 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.932 16.936 6.749 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.499 15.239 6.821 1.00 0.00 H new ATOM 37 N SER A 5 -5.711 17.686 5.485 1.00 0.00 N ATOM 38 CA SER A 5 -4.347 18.151 5.260 1.00 0.00 C ATOM 39 C SER A 5 -3.866 19.009 6.427 1.00 0.00 C ATOM 40 O SER A 5 -4.425 20.071 6.703 1.00 0.00 O ATOM 41 CB SER A 5 -4.265 18.950 3.958 1.00 0.00 C ATOM 42 OG SER A 5 -5.118 20.081 3.998 1.00 0.00 O ATOM 0 H SER A 5 -6.434 18.339 5.184 1.00 0.00 H new ATOM 0 HA SER A 5 -3.700 17.277 5.183 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.237 19.272 3.789 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.541 18.312 3.118 1.00 0.00 H new ATOM 0 HG SER A 5 -5.219 20.382 4.925 1.00 0.00 H new ATOM 48 N SER A 6 -2.825 18.541 7.109 1.00 0.00 N ATOM 49 CA SER A 6 -2.272 19.263 8.249 1.00 0.00 C ATOM 50 C SER A 6 -0.746 19.270 8.197 1.00 0.00 C ATOM 51 O SER A 6 -0.132 18.431 7.539 1.00 0.00 O ATOM 52 CB SER A 6 -2.746 18.632 9.559 1.00 0.00 C ATOM 53 OG SER A 6 -3.568 19.527 10.287 1.00 0.00 O ATOM 0 H SER A 6 -2.348 17.666 6.892 1.00 0.00 H new ATOM 0 HA SER A 6 -2.626 20.293 8.202 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.298 17.717 9.347 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.884 18.351 10.164 1.00 0.00 H new ATOM 0 HG SER A 6 -3.860 19.100 11.119 1.00 0.00 H new ATOM 59 N GLY A 7 -0.142 20.225 8.897 1.00 0.00 N ATOM 60 CA GLY A 7 1.306 20.324 8.919 1.00 0.00 C ATOM 61 C GLY A 7 1.860 20.992 7.675 1.00 0.00 C ATOM 62 O GLY A 7 1.346 20.791 6.575 1.00 0.00 O ATOM 0 H GLY A 7 -0.629 20.931 9.449 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.615 20.888 9.799 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.734 19.326 9.013 1.00 0.00 H new ATOM 66 N ILE A 8 2.909 21.788 7.851 1.00 0.00 N ATOM 67 CA ILE A 8 3.532 22.488 6.734 1.00 0.00 C ATOM 68 C ILE A 8 5.038 22.255 6.711 1.00 0.00 C ATOM 69 O ILE A 8 5.653 21.993 7.745 1.00 0.00 O ATOM 70 CB ILE A 8 3.259 24.002 6.795 1.00 0.00 C ATOM 71 CG1 ILE A 8 3.889 24.605 8.051 1.00 0.00 C ATOM 72 CG2 ILE A 8 1.762 24.272 6.765 1.00 0.00 C ATOM 73 CD1 ILE A 8 4.104 26.101 7.961 1.00 0.00 C ATOM 0 H ILE A 8 3.345 21.964 8.756 1.00 0.00 H new ATOM 0 HA ILE A 8 3.090 22.084 5.823 1.00 0.00 H new ATOM 0 HB ILE A 8 3.711 24.473 5.922 1.00 0.00 H new ATOM 0 HG12 ILE A 8 3.251 24.389 8.908 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.847 24.119 8.236 1.00 0.00 H new ATOM 0 HG21 ILE A 8 1.585 25.347 6.809 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.338 23.872 5.844 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.288 23.791 7.621 1.00 0.00 H new ATOM 0 HD11 ILE A 8 4.554 26.460 8.887 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.767 26.324 7.125 1.00 0.00 H new ATOM 0 HD13 ILE A 8 3.146 26.598 7.807 1.00 0.00 H new ATOM 85 N LEU A 9 5.628 22.353 5.525 1.00 0.00 N ATOM 86 CA LEU A 9 7.065 22.155 5.366 1.00 0.00 C ATOM 87 C LEU A 9 7.739 23.430 4.869 1.00 0.00 C ATOM 88 O LEU A 9 7.083 24.450 4.656 1.00 0.00 O ATOM 89 CB LEU A 9 7.338 21.008 4.392 1.00 0.00 C ATOM 90 CG LEU A 9 6.426 19.786 4.523 1.00 0.00 C ATOM 91 CD1 LEU A 9 6.149 19.482 5.987 1.00 0.00 C ATOM 92 CD2 LEU A 9 5.126 20.007 3.766 1.00 0.00 C ATOM 0 H LEU A 9 5.134 22.568 4.659 1.00 0.00 H new ATOM 0 HA LEU A 9 7.481 21.902 6.341 1.00 0.00 H new ATOM 0 HB2 LEU A 9 7.253 21.393 3.376 1.00 0.00 H new ATOM 0 HB3 LEU A 9 8.370 20.683 4.525 1.00 0.00 H new ATOM 0 HG LEU A 9 6.935 18.927 4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 9 5.499 18.610 6.061 1.00 0.00 H new ATOM 0 HD12 LEU A 9 7.089 19.279 6.500 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.660 20.339 6.450 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.490 19.128 3.870 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.611 20.877 4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.343 20.174 2.711 1.00 0.00 H new ATOM 104 N THR A 10 9.054 23.365 4.683 1.00 0.00 N ATOM 105 CA THR A 10 9.816 24.512 4.209 1.00 0.00 C ATOM 106 C THR A 10 10.187 24.357 2.738 1.00 0.00 C ATOM 107 O THR A 10 9.828 25.192 1.908 1.00 0.00 O ATOM 108 CB THR A 10 11.104 24.710 5.032 1.00 0.00 C ATOM 109 OG1 THR A 10 11.581 23.446 5.506 1.00 0.00 O ATOM 110 CG2 THR A 10 10.853 25.637 6.213 1.00 0.00 C ATOM 0 H THR A 10 9.613 22.529 4.854 1.00 0.00 H new ATOM 0 HA THR A 10 9.177 25.387 4.330 1.00 0.00 H new ATOM 0 HB THR A 10 11.856 25.163 4.386 1.00 0.00 H new ATOM 0 HG1 THR A 10 12.400 23.580 6.027 1.00 0.00 H new ATOM 0 HG21 THR A 10 11.776 25.762 6.780 1.00 0.00 H new ATOM 0 HG22 THR A 10 10.516 26.608 5.849 1.00 0.00 H new ATOM 0 HG23 THR A 10 10.087 25.206 6.858 1.00 0.00 H new ATOM 118 N GLU A 11 10.907 23.285 2.423 1.00 0.00 N ATOM 119 CA GLU A 11 11.324 23.023 1.051 1.00 0.00 C ATOM 120 C GLU A 11 11.017 21.581 0.656 1.00 0.00 C ATOM 121 O GLU A 11 10.721 21.295 -0.504 1.00 0.00 O ATOM 122 CB GLU A 11 12.821 23.299 0.889 1.00 0.00 C ATOM 123 CG GLU A 11 13.708 22.286 1.592 1.00 0.00 C ATOM 124 CD GLU A 11 15.174 22.669 1.555 1.00 0.00 C ATOM 125 OE1 GLU A 11 15.504 23.799 1.971 1.00 0.00 O ATOM 126 OE2 GLU A 11 15.993 21.837 1.109 1.00 0.00 O ATOM 0 H GLU A 11 11.213 22.585 3.099 1.00 0.00 H new ATOM 0 HA GLU A 11 10.765 23.689 0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.067 23.309 -0.173 1.00 0.00 H new ATOM 0 HB3 GLU A 11 13.042 24.293 1.277 1.00 0.00 H new ATOM 0 HG2 GLU A 11 13.388 22.187 2.629 1.00 0.00 H new ATOM 0 HG3 GLU A 11 13.580 21.310 1.124 1.00 0.00 H new ATOM 133 N ASN A 12 11.092 20.679 1.628 1.00 0.00 N ATOM 134 CA ASN A 12 10.823 19.266 1.381 1.00 0.00 C ATOM 135 C ASN A 12 10.913 18.461 2.674 1.00 0.00 C ATOM 136 O ASN A 12 11.227 17.270 2.658 1.00 0.00 O ATOM 137 CB ASN A 12 11.807 18.710 0.351 1.00 0.00 C ATOM 138 CG ASN A 12 11.326 18.905 -1.073 1.00 0.00 C ATOM 139 OD1 ASN A 12 12.081 19.342 -1.942 1.00 0.00 O ATOM 140 ND2 ASN A 12 10.062 18.579 -1.320 1.00 0.00 N ATOM 0 H ASN A 12 11.336 20.900 2.593 1.00 0.00 H new ATOM 0 HA ASN A 12 9.810 19.178 0.989 1.00 0.00 H new ATOM 0 HB2 ASN A 12 12.773 19.199 0.475 1.00 0.00 H new ATOM 0 HB3 ASN A 12 11.961 17.647 0.537 1.00 0.00 H new ATOM 0 HD21 ASN A 12 9.682 18.687 -2.260 1.00 0.00 H new ATOM 0 HD22 ASN A 12 9.472 18.220 -0.569 1.00 0.00 H new ATOM 147 N THR A 13 10.636 19.119 3.795 1.00 0.00 N ATOM 148 CA THR A 13 10.686 18.467 5.098 1.00 0.00 C ATOM 149 C THR A 13 10.271 17.003 4.995 1.00 0.00 C ATOM 150 O THR A 13 9.154 16.677 4.592 1.00 0.00 O ATOM 151 CB THR A 13 9.776 19.176 6.118 1.00 0.00 C ATOM 152 OG1 THR A 13 10.010 20.588 6.083 1.00 0.00 O ATOM 153 CG2 THR A 13 10.024 18.650 7.523 1.00 0.00 C ATOM 0 H THR A 13 10.374 20.104 3.827 1.00 0.00 H new ATOM 0 HA THR A 13 11.719 18.527 5.442 1.00 0.00 H new ATOM 0 HB THR A 13 8.739 18.973 5.850 1.00 0.00 H new ATOM 0 HG1 THR A 13 9.427 21.032 6.733 1.00 0.00 H new ATOM 0 HG21 THR A 13 9.370 19.166 8.225 1.00 0.00 H new ATOM 0 HG22 THR A 13 9.817 17.580 7.553 1.00 0.00 H new ATOM 0 HG23 THR A 13 11.064 18.826 7.799 1.00 0.00 H new ATOM 161 N PRO A 14 11.189 16.100 5.369 1.00 0.00 N ATOM 162 CA PRO A 14 10.940 14.655 5.329 1.00 0.00 C ATOM 163 C PRO A 14 9.931 14.212 6.383 1.00 0.00 C ATOM 164 O PRO A 14 9.670 14.931 7.348 1.00 0.00 O ATOM 165 CB PRO A 14 12.316 14.051 5.617 1.00 0.00 C ATOM 166 CG PRO A 14 13.038 15.101 6.388 1.00 0.00 C ATOM 167 CD PRO A 14 12.540 16.418 5.860 1.00 0.00 C ATOM 0 HA PRO A 14 10.512 14.340 4.377 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.231 13.128 6.190 1.00 0.00 H new ATOM 0 HB3 PRO A 14 12.842 13.806 4.694 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.839 15.008 7.456 1.00 0.00 H new ATOM 0 HG3 PRO A 14 14.116 15.010 6.256 1.00 0.00 H new ATOM 0 HD2 PRO A 14 12.515 17.180 6.639 1.00 0.00 H new ATOM 0 HD3 PRO A 14 13.178 16.798 5.062 1.00 0.00 H new ATOM 175 N VAL A 15 9.368 13.022 6.193 1.00 0.00 N ATOM 176 CA VAL A 15 8.389 12.483 7.129 1.00 0.00 C ATOM 177 C VAL A 15 8.492 10.964 7.217 1.00 0.00 C ATOM 178 O VAL A 15 9.006 10.313 6.307 1.00 0.00 O ATOM 179 CB VAL A 15 6.954 12.866 6.722 1.00 0.00 C ATOM 180 CG1 VAL A 15 6.073 13.020 7.953 1.00 0.00 C ATOM 181 CG2 VAL A 15 6.957 14.143 5.896 1.00 0.00 C ATOM 0 H VAL A 15 9.573 12.414 5.400 1.00 0.00 H new ATOM 0 HA VAL A 15 8.610 12.917 8.104 1.00 0.00 H new ATOM 0 HB VAL A 15 6.543 12.065 6.108 1.00 0.00 H new ATOM 0 HG11 VAL A 15 5.063 13.291 7.646 1.00 0.00 H new ATOM 0 HG12 VAL A 15 6.046 12.078 8.501 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.479 13.802 8.595 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.935 14.398 5.617 1.00 0.00 H new ATOM 0 HG22 VAL A 15 7.387 14.955 6.483 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.552 13.992 4.995 1.00 0.00 H new ATOM 191 N PHE A 16 8.001 10.406 8.318 1.00 0.00 N ATOM 192 CA PHE A 16 8.038 8.963 8.526 1.00 0.00 C ATOM 193 C PHE A 16 6.695 8.453 9.040 1.00 0.00 C ATOM 194 O PHE A 16 6.194 8.916 10.064 1.00 0.00 O ATOM 195 CB PHE A 16 9.147 8.597 9.514 1.00 0.00 C ATOM 196 CG PHE A 16 9.793 7.272 9.227 1.00 0.00 C ATOM 197 CD1 PHE A 16 10.896 7.190 8.392 1.00 0.00 C ATOM 198 CD2 PHE A 16 9.298 6.108 9.793 1.00 0.00 C ATOM 199 CE1 PHE A 16 11.491 5.972 8.125 1.00 0.00 C ATOM 200 CE2 PHE A 16 9.891 4.887 9.531 1.00 0.00 C ATOM 201 CZ PHE A 16 10.988 4.819 8.696 1.00 0.00 C ATOM 0 H PHE A 16 7.573 10.931 9.080 1.00 0.00 H new ATOM 0 HA PHE A 16 8.244 8.488 7.567 1.00 0.00 H new ATOM 0 HB2 PHE A 16 9.910 9.375 9.496 1.00 0.00 H new ATOM 0 HB3 PHE A 16 8.733 8.579 10.522 1.00 0.00 H new ATOM 0 HD1 PHE A 16 11.295 8.088 7.945 1.00 0.00 H new ATOM 0 HD2 PHE A 16 8.439 6.155 10.446 1.00 0.00 H new ATOM 0 HE1 PHE A 16 12.349 5.921 7.470 1.00 0.00 H new ATOM 0 HE2 PHE A 16 9.496 3.987 9.979 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.452 3.866 8.489 1.00 0.00 H new ATOM 211 N GLU A 17 6.117 7.496 8.319 1.00 0.00 N ATOM 212 CA GLU A 17 4.831 6.924 8.702 1.00 0.00 C ATOM 213 C GLU A 17 4.802 5.423 8.430 1.00 0.00 C ATOM 214 O GLU A 17 5.441 4.939 7.496 1.00 0.00 O ATOM 215 CB GLU A 17 3.696 7.613 7.942 1.00 0.00 C ATOM 216 CG GLU A 17 2.460 7.861 8.791 1.00 0.00 C ATOM 217 CD GLU A 17 2.378 9.286 9.302 1.00 0.00 C ATOM 218 OE1 GLU A 17 2.833 10.201 8.584 1.00 0.00 O ATOM 219 OE2 GLU A 17 1.857 9.486 10.419 1.00 0.00 O ATOM 0 H GLU A 17 6.518 7.101 7.468 1.00 0.00 H new ATOM 0 HA GLU A 17 4.693 7.085 9.771 1.00 0.00 H new ATOM 0 HB2 GLU A 17 4.056 8.565 7.552 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.420 7.001 7.083 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.570 7.638 8.203 1.00 0.00 H new ATOM 0 HG3 GLU A 17 2.462 7.175 9.638 1.00 0.00 H new ATOM 226 N GLN A 18 4.056 4.693 9.253 1.00 0.00 N ATOM 227 CA GLN A 18 3.944 3.247 9.102 1.00 0.00 C ATOM 228 C GLN A 18 2.484 2.823 8.989 1.00 0.00 C ATOM 229 O GLN A 18 1.622 3.329 9.708 1.00 0.00 O ATOM 230 CB GLN A 18 4.605 2.537 10.285 1.00 0.00 C ATOM 231 CG GLN A 18 6.029 2.086 10.007 1.00 0.00 C ATOM 232 CD GLN A 18 6.435 0.887 10.840 1.00 0.00 C ATOM 233 OE1 GLN A 18 6.665 1.003 12.044 1.00 0.00 O ATOM 234 NE2 GLN A 18 6.526 -0.274 10.202 1.00 0.00 N ATOM 0 H GLN A 18 3.521 5.079 10.031 1.00 0.00 H new ATOM 0 HA GLN A 18 4.457 2.962 8.184 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.607 3.207 11.145 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.005 1.669 10.558 1.00 0.00 H new ATOM 0 HG2 GLN A 18 6.128 1.839 8.950 1.00 0.00 H new ATOM 0 HG3 GLN A 18 6.713 2.911 10.207 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.326 -0.324 9.203 1.00 0.00 H new ATOM 0 HE22 GLN A 18 6.796 -1.116 10.711 1.00 0.00 H new ATOM 243 N LEU A 19 2.211 1.891 8.083 1.00 0.00 N ATOM 244 CA LEU A 19 0.854 1.398 7.875 1.00 0.00 C ATOM 245 C LEU A 19 0.810 -0.125 7.952 1.00 0.00 C ATOM 246 O LEU A 19 1.424 -0.815 7.139 1.00 0.00 O ATOM 247 CB LEU A 19 0.322 1.867 6.519 1.00 0.00 C ATOM 248 CG LEU A 19 -0.677 3.025 6.556 1.00 0.00 C ATOM 249 CD1 LEU A 19 -0.049 4.252 7.199 1.00 0.00 C ATOM 250 CD2 LEU A 19 -1.167 3.348 5.151 1.00 0.00 C ATOM 0 H LEU A 19 2.912 1.461 7.480 1.00 0.00 H new ATOM 0 HA LEU A 19 0.222 1.802 8.666 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.170 2.164 5.901 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -0.152 1.020 6.024 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.533 2.724 7.159 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -0.775 5.065 7.216 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.254 4.014 8.219 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.825 4.558 6.623 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.877 4.174 5.194 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -0.320 3.630 4.526 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.656 2.471 4.726 1.00 0.00 H new ATOM 262 N SER A 20 0.078 -0.642 8.934 1.00 0.00 N ATOM 263 CA SER A 20 -0.045 -2.082 9.118 1.00 0.00 C ATOM 264 C SER A 20 -1.035 -2.675 8.120 1.00 0.00 C ATOM 265 O SER A 20 -2.225 -2.361 8.148 1.00 0.00 O ATOM 266 CB SER A 20 -0.493 -2.398 10.547 1.00 0.00 C ATOM 267 OG SER A 20 -1.861 -2.765 10.584 1.00 0.00 O ATOM 0 H SER A 20 -0.439 -0.084 9.614 1.00 0.00 H new ATOM 0 HA SER A 20 0.933 -2.531 8.943 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.115 -3.208 10.951 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.329 -1.528 11.183 1.00 0.00 H new ATOM 0 HG SER A 20 -2.358 -2.242 9.920 1.00 0.00 H new ATOM 273 N VAL A 21 -0.534 -3.535 7.238 1.00 0.00 N ATOM 274 CA VAL A 21 -1.373 -4.174 6.231 1.00 0.00 C ATOM 275 C VAL A 21 -1.358 -5.690 6.385 1.00 0.00 C ATOM 276 O VAL A 21 -0.342 -6.293 6.733 1.00 0.00 O ATOM 277 CB VAL A 21 -0.917 -3.807 4.807 1.00 0.00 C ATOM 278 CG1 VAL A 21 -0.640 -2.315 4.702 1.00 0.00 C ATOM 279 CG2 VAL A 21 0.312 -4.615 4.417 1.00 0.00 C ATOM 0 H VAL A 21 0.449 -3.805 7.201 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.388 -3.808 6.384 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.721 -4.052 4.112 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.319 -2.075 3.688 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.548 -1.759 4.936 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.146 -2.040 5.406 1.00 0.00 H new ATOM 0 HG21 VAL A 21 0.621 -4.343 3.408 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.123 -4.403 5.114 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.074 -5.678 4.450 1.00 0.00 H new ATOM 289 N PRO A 22 -2.510 -6.323 6.118 1.00 0.00 N ATOM 290 CA PRO A 22 -2.654 -7.779 6.218 1.00 0.00 C ATOM 291 C PRO A 22 -1.883 -8.514 5.127 1.00 0.00 C ATOM 292 O PRO A 22 -1.787 -8.039 3.996 1.00 0.00 O ATOM 293 CB PRO A 22 -4.160 -7.998 6.049 1.00 0.00 C ATOM 294 CG PRO A 22 -4.630 -6.817 5.272 1.00 0.00 C ATOM 295 CD PRO A 22 -3.759 -5.667 5.698 1.00 0.00 C ATOM 0 HA PRO A 22 -2.256 -8.165 7.156 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -4.368 -8.928 5.520 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -4.662 -8.062 7.015 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -4.544 -6.996 4.200 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.680 -6.608 5.477 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -3.590 -4.967 4.880 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -4.210 -5.102 6.514 1.00 0.00 H new ATOM 303 N GLN A 23 -1.338 -9.675 5.474 1.00 0.00 N ATOM 304 CA GLN A 23 -0.576 -10.476 4.523 1.00 0.00 C ATOM 305 C GLN A 23 -1.465 -10.957 3.381 1.00 0.00 C ATOM 306 O GLN A 23 -0.974 -11.350 2.322 1.00 0.00 O ATOM 307 CB GLN A 23 0.063 -11.673 5.229 1.00 0.00 C ATOM 308 CG GLN A 23 -0.917 -12.796 5.527 1.00 0.00 C ATOM 309 CD GLN A 23 -0.456 -14.134 4.984 1.00 0.00 C ATOM 310 OE1 GLN A 23 -0.657 -14.443 3.809 1.00 0.00 O ATOM 311 NE2 GLN A 23 0.167 -14.937 5.837 1.00 0.00 N ATOM 0 H GLN A 23 -1.410 -10.082 6.406 1.00 0.00 H new ATOM 0 HA GLN A 23 0.211 -9.848 4.105 1.00 0.00 H new ATOM 0 HB2 GLN A 23 0.871 -12.062 4.609 1.00 0.00 H new ATOM 0 HB3 GLN A 23 0.512 -11.336 6.163 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -1.056 -12.875 6.605 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.888 -12.549 5.097 1.00 0.00 H new ATOM 0 HE21 GLN A 23 0.313 -14.641 6.802 1.00 0.00 H new ATOM 0 HE22 GLN A 23 0.500 -15.850 5.527 1.00 0.00 H new ATOM 320 N ARG A 24 -2.775 -10.924 3.603 1.00 0.00 N ATOM 321 CA ARG A 24 -3.732 -11.359 2.594 1.00 0.00 C ATOM 322 C ARG A 24 -3.826 -10.341 1.461 1.00 0.00 C ATOM 323 O ARG A 24 -4.191 -10.682 0.336 1.00 0.00 O ATOM 324 CB ARG A 24 -5.111 -11.567 3.224 1.00 0.00 C ATOM 325 CG ARG A 24 -5.682 -10.314 3.866 1.00 0.00 C ATOM 326 CD ARG A 24 -7.067 -9.993 3.327 1.00 0.00 C ATOM 327 NE ARG A 24 -7.800 -9.087 4.207 1.00 0.00 N ATOM 328 CZ ARG A 24 -8.312 -9.453 5.377 1.00 0.00 C ATOM 329 NH1 ARG A 24 -8.170 -10.700 5.805 1.00 0.00 N ATOM 330 NH2 ARG A 24 -8.967 -8.571 6.121 1.00 0.00 N ATOM 0 H ARG A 24 -3.197 -10.600 4.473 1.00 0.00 H new ATOM 0 HA ARG A 24 -3.383 -12.306 2.181 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.802 -11.920 2.458 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.042 -12.352 3.977 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -5.733 -10.449 4.946 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -5.014 -9.473 3.681 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -6.976 -9.543 2.338 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -7.632 -10.917 3.206 1.00 0.00 H new ATOM 0 HE ARG A 24 -7.926 -8.120 3.907 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -7.667 -11.380 5.236 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -8.564 -10.979 6.704 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.078 -7.611 5.795 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -9.360 -8.853 7.019 1.00 0.00 H new ATOM 344 N SER A 25 -3.497 -9.091 1.767 1.00 0.00 N ATOM 345 CA SER A 25 -3.550 -8.022 0.775 1.00 0.00 C ATOM 346 C SER A 25 -2.145 -7.533 0.430 1.00 0.00 C ATOM 347 O SER A 25 -1.950 -6.811 -0.548 1.00 0.00 O ATOM 348 CB SER A 25 -4.394 -6.857 1.295 1.00 0.00 C ATOM 349 OG SER A 25 -5.752 -7.236 1.437 1.00 0.00 O ATOM 0 H SER A 25 -3.191 -8.793 2.693 1.00 0.00 H new ATOM 0 HA SER A 25 -4.011 -8.420 -0.129 1.00 0.00 H new ATOM 0 HB2 SER A 25 -4.004 -6.522 2.256 1.00 0.00 H new ATOM 0 HB3 SER A 25 -4.318 -6.014 0.609 1.00 0.00 H new ATOM 0 HG SER A 25 -6.239 -6.535 1.918 1.00 0.00 H new ATOM 355 N VAL A 26 -1.170 -7.932 1.240 1.00 0.00 N ATOM 356 CA VAL A 26 0.216 -7.537 1.021 1.00 0.00 C ATOM 357 C VAL A 26 0.739 -8.081 -0.304 1.00 0.00 C ATOM 358 O VAL A 26 1.681 -7.539 -0.881 1.00 0.00 O ATOM 359 CB VAL A 26 1.127 -8.028 2.161 1.00 0.00 C ATOM 360 CG1 VAL A 26 1.546 -9.471 1.926 1.00 0.00 C ATOM 361 CG2 VAL A 26 2.344 -7.126 2.297 1.00 0.00 C ATOM 0 H VAL A 26 -1.315 -8.529 2.054 1.00 0.00 H new ATOM 0 HA VAL A 26 0.235 -6.447 0.996 1.00 0.00 H new ATOM 0 HB VAL A 26 0.566 -7.985 3.095 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.189 -9.801 2.742 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.660 -10.105 1.884 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.089 -9.543 0.984 1.00 0.00 H new ATOM 0 HG21 VAL A 26 2.977 -7.488 3.107 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.909 -7.134 1.365 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.020 -6.109 2.516 1.00 0.00 H new ATOM 371 N GLY A 27 0.121 -9.156 -0.782 1.00 0.00 N ATOM 372 CA GLY A 27 0.538 -9.756 -2.035 1.00 0.00 C ATOM 373 C GLY A 27 0.153 -8.917 -3.236 1.00 0.00 C ATOM 374 O GLY A 27 0.739 -9.051 -4.311 1.00 0.00 O ATOM 0 H GLY A 27 -0.662 -9.622 -0.323 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.619 -9.896 -2.025 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.089 -10.745 -2.128 1.00 0.00 H new ATOM 378 N ARG A 28 -0.836 -8.047 -3.056 1.00 0.00 N ATOM 379 CA ARG A 28 -1.301 -7.184 -4.134 1.00 0.00 C ATOM 380 C ARG A 28 -0.676 -5.796 -4.029 1.00 0.00 C ATOM 381 O ARG A 28 -0.615 -5.055 -5.010 1.00 0.00 O ATOM 382 CB ARG A 28 -2.826 -7.072 -4.105 1.00 0.00 C ATOM 383 CG ARG A 28 -3.422 -6.526 -5.393 1.00 0.00 C ATOM 384 CD ARG A 28 -3.827 -7.646 -6.338 1.00 0.00 C ATOM 385 NE ARG A 28 -2.713 -8.084 -7.176 1.00 0.00 N ATOM 386 CZ ARG A 28 -2.754 -9.166 -7.945 1.00 0.00 C ATOM 387 NH1 ARG A 28 -3.847 -9.917 -7.982 1.00 0.00 N ATOM 388 NH2 ARG A 28 -1.700 -9.500 -8.680 1.00 0.00 N ATOM 0 H ARG A 28 -1.331 -7.922 -2.173 1.00 0.00 H new ATOM 0 HA ARG A 28 -0.994 -7.630 -5.080 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.250 -8.056 -3.907 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.119 -6.426 -3.277 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -4.292 -5.912 -5.161 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.697 -5.878 -5.885 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.200 -8.491 -5.760 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -4.646 -7.307 -6.972 1.00 0.00 H new ATOM 0 HE ARG A 28 -1.857 -7.529 -7.170 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -4.659 -9.664 -7.419 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -3.875 -10.747 -8.574 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -0.858 -8.925 -8.654 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -1.733 -10.331 -9.270 1.00 0.00 H new ATOM 402 N ILE A 29 -0.215 -5.451 -2.831 1.00 0.00 N ATOM 403 CA ILE A 29 0.405 -4.153 -2.597 1.00 0.00 C ATOM 404 C ILE A 29 1.885 -4.175 -2.969 1.00 0.00 C ATOM 405 O ILE A 29 2.369 -3.294 -3.680 1.00 0.00 O ATOM 406 CB ILE A 29 0.264 -3.718 -1.127 1.00 0.00 C ATOM 407 CG1 ILE A 29 -1.202 -3.781 -0.692 1.00 0.00 C ATOM 408 CG2 ILE A 29 0.819 -2.315 -0.933 1.00 0.00 C ATOM 409 CD1 ILE A 29 -1.383 -4.007 0.792 1.00 0.00 C ATOM 0 H ILE A 29 -0.259 -6.052 -2.008 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.116 -3.436 -3.231 1.00 0.00 H new ATOM 0 HB ILE A 29 0.839 -4.404 -0.505 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.696 -2.851 -0.972 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.700 -4.583 -1.237 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.712 -2.022 0.112 1.00 0.00 H new ATOM 0 HG22 ILE A 29 1.874 -2.300 -1.208 1.00 0.00 H new ATOM 0 HG23 ILE A 29 0.270 -1.616 -1.564 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.447 -4.041 1.028 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.918 -4.951 1.076 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.914 -3.192 1.344 1.00 0.00 H new ATOM 421 N ILE A 30 2.596 -5.187 -2.483 1.00 0.00 N ATOM 422 CA ILE A 30 4.018 -5.326 -2.767 1.00 0.00 C ATOM 423 C ILE A 30 4.250 -5.806 -4.195 1.00 0.00 C ATOM 424 O ILE A 30 5.214 -5.407 -4.848 1.00 0.00 O ATOM 425 CB ILE A 30 4.694 -6.306 -1.790 1.00 0.00 C ATOM 426 CG1 ILE A 30 4.846 -5.664 -0.410 1.00 0.00 C ATOM 427 CG2 ILE A 30 6.049 -6.741 -2.330 1.00 0.00 C ATOM 428 CD1 ILE A 30 6.049 -4.756 -0.295 1.00 0.00 C ATOM 0 H ILE A 30 2.210 -5.922 -1.891 1.00 0.00 H new ATOM 0 HA ILE A 30 4.462 -4.338 -2.643 1.00 0.00 H new ATOM 0 HB ILE A 30 4.063 -7.189 -1.690 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.946 -5.092 -0.183 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.921 -6.450 0.341 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.515 -7.433 -1.629 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.916 -7.234 -3.293 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.688 -5.867 -2.456 1.00 0.00 H new ATOM 0 HD11 ILE A 30 6.093 -4.336 0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.956 -5.328 -0.490 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.966 -3.948 -1.022 1.00 0.00 H new ATOM 440 N GLY A 31 3.358 -6.666 -4.676 1.00 0.00 N ATOM 441 CA GLY A 31 3.482 -7.186 -6.026 1.00 0.00 C ATOM 442 C GLY A 31 4.460 -8.341 -6.115 1.00 0.00 C ATOM 443 O GLY A 31 5.061 -8.733 -5.113 1.00 0.00 O ATOM 0 H GLY A 31 2.552 -7.012 -4.156 1.00 0.00 H new ATOM 0 HA2 GLY A 31 2.504 -7.515 -6.377 1.00 0.00 H new ATOM 0 HA3 GLY A 31 3.807 -6.386 -6.692 1.00 0.00 H new ATOM 447 N ARG A 32 4.621 -8.887 -7.315 1.00 0.00 N ATOM 448 CA ARG A 32 5.531 -10.007 -7.529 1.00 0.00 C ATOM 449 C ARG A 32 6.961 -9.623 -7.160 1.00 0.00 C ATOM 450 O ARG A 32 7.612 -8.858 -7.870 1.00 0.00 O ATOM 451 CB ARG A 32 5.475 -10.464 -8.988 1.00 0.00 C ATOM 452 CG ARG A 32 5.157 -11.942 -9.151 1.00 0.00 C ATOM 453 CD ARG A 32 5.908 -12.546 -10.327 1.00 0.00 C ATOM 454 NE ARG A 32 6.139 -13.978 -10.152 1.00 0.00 N ATOM 455 CZ ARG A 32 6.343 -14.818 -11.160 1.00 0.00 C ATOM 456 NH1 ARG A 32 6.347 -14.372 -12.409 1.00 0.00 N ATOM 457 NH2 ARG A 32 6.546 -16.107 -10.920 1.00 0.00 N ATOM 0 H ARG A 32 4.134 -8.573 -8.154 1.00 0.00 H new ATOM 0 HA ARG A 32 5.216 -10.828 -6.885 1.00 0.00 H new ATOM 0 HB2 ARG A 32 4.721 -9.879 -9.515 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.433 -10.252 -9.463 1.00 0.00 H new ATOM 0 HG2 ARG A 32 5.420 -12.475 -8.237 1.00 0.00 H new ATOM 0 HG3 ARG A 32 4.085 -12.071 -9.298 1.00 0.00 H new ATOM 0 HD2 ARG A 32 5.341 -12.380 -11.243 1.00 0.00 H new ATOM 0 HD3 ARG A 32 6.864 -12.037 -10.447 1.00 0.00 H new ATOM 0 HE ARG A 32 6.144 -14.353 -9.203 1.00 0.00 H new ATOM 0 HH11 ARG A 32 6.193 -13.381 -12.597 1.00 0.00 H new ATOM 0 HH12 ARG A 32 6.504 -15.020 -13.181 1.00 0.00 H new ATOM 0 HH21 ARG A 32 6.545 -16.453 -9.961 1.00 0.00 H new ATOM 0 HH22 ARG A 32 6.703 -16.752 -11.695 1.00 0.00 H new ATOM 471 N GLY A 33 7.443 -10.159 -6.043 1.00 0.00 N ATOM 472 CA GLY A 33 8.791 -9.861 -5.598 1.00 0.00 C ATOM 473 C GLY A 33 9.018 -8.376 -5.391 1.00 0.00 C ATOM 474 O GLY A 33 10.151 -7.936 -5.195 1.00 0.00 O ATOM 0 H GLY A 33 6.923 -10.795 -5.438 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.987 -10.389 -4.665 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.504 -10.236 -6.332 1.00 0.00 H new ATOM 478 N GLY A 34 7.939 -7.601 -5.438 1.00 0.00 N ATOM 479 CA GLY A 34 8.047 -6.166 -5.254 1.00 0.00 C ATOM 480 C GLY A 34 7.732 -5.394 -6.519 1.00 0.00 C ATOM 481 O GLY A 34 7.707 -4.164 -6.514 1.00 0.00 O ATOM 0 H GLY A 34 6.991 -7.942 -5.600 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.367 -5.852 -4.462 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.056 -5.920 -4.924 1.00 0.00 H new ATOM 485 N GLU A 35 7.492 -6.119 -7.608 1.00 0.00 N ATOM 486 CA GLU A 35 7.180 -5.493 -8.887 1.00 0.00 C ATOM 487 C GLU A 35 6.183 -4.351 -8.706 1.00 0.00 C ATOM 488 O GLU A 35 6.172 -3.392 -9.479 1.00 0.00 O ATOM 489 CB GLU A 35 6.614 -6.528 -9.863 1.00 0.00 C ATOM 490 CG GLU A 35 5.115 -6.737 -9.726 1.00 0.00 C ATOM 491 CD GLU A 35 4.320 -5.946 -10.745 1.00 0.00 C ATOM 492 OE1 GLU A 35 4.520 -4.716 -10.830 1.00 0.00 O ATOM 493 OE2 GLU A 35 3.497 -6.557 -11.459 1.00 0.00 O ATOM 0 H GLU A 35 7.508 -7.139 -7.629 1.00 0.00 H new ATOM 0 HA GLU A 35 8.104 -5.085 -9.297 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.837 -6.214 -10.883 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.121 -7.480 -9.705 1.00 0.00 H new ATOM 0 HG2 GLU A 35 4.888 -7.797 -9.838 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.802 -6.448 -8.723 1.00 0.00 H new ATOM 500 N THR A 36 5.346 -4.462 -7.679 1.00 0.00 N ATOM 501 CA THR A 36 4.344 -3.441 -7.395 1.00 0.00 C ATOM 502 C THR A 36 4.853 -2.445 -6.361 1.00 0.00 C ATOM 503 O THR A 36 4.510 -1.263 -6.403 1.00 0.00 O ATOM 504 CB THR A 36 3.033 -4.068 -6.887 1.00 0.00 C ATOM 505 OG1 THR A 36 2.511 -4.975 -7.866 1.00 0.00 O ATOM 506 CG2 THR A 36 2.001 -2.992 -6.585 1.00 0.00 C ATOM 0 H THR A 36 5.342 -5.249 -7.030 1.00 0.00 H new ATOM 0 HA THR A 36 4.149 -2.919 -8.332 1.00 0.00 H new ATOM 0 HB THR A 36 3.249 -4.612 -5.967 1.00 0.00 H new ATOM 0 HG1 THR A 36 1.678 -5.371 -7.534 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.083 -3.458 -6.228 1.00 0.00 H new ATOM 0 HG22 THR A 36 2.389 -2.321 -5.819 1.00 0.00 H new ATOM 0 HG23 THR A 36 1.791 -2.425 -7.492 1.00 0.00 H new ATOM 514 N ILE A 37 5.672 -2.929 -5.433 1.00 0.00 N ATOM 515 CA ILE A 37 6.229 -2.078 -4.388 1.00 0.00 C ATOM 516 C ILE A 37 7.266 -1.116 -4.957 1.00 0.00 C ATOM 517 O ILE A 37 7.575 -0.090 -4.350 1.00 0.00 O ATOM 518 CB ILE A 37 6.878 -2.913 -3.269 1.00 0.00 C ATOM 519 CG1 ILE A 37 6.849 -2.146 -1.946 1.00 0.00 C ATOM 520 CG2 ILE A 37 8.308 -3.280 -3.644 1.00 0.00 C ATOM 521 CD1 ILE A 37 5.451 -1.822 -1.467 1.00 0.00 C ATOM 0 H ILE A 37 5.964 -3.905 -5.383 1.00 0.00 H new ATOM 0 HA ILE A 37 5.400 -1.508 -3.970 1.00 0.00 H new ATOM 0 HB ILE A 37 6.307 -3.833 -3.145 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.359 -2.734 -1.183 1.00 0.00 H new ATOM 0 HG13 ILE A 37 7.409 -1.218 -2.061 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.754 -3.870 -2.843 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.304 -3.862 -4.565 1.00 0.00 H new ATOM 0 HG23 ILE A 37 8.890 -2.370 -3.792 1.00 0.00 H new ATOM 0 HD11 ILE A 37 5.506 -1.278 -0.524 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.945 -1.207 -2.211 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.893 -2.747 -1.320 1.00 0.00 H new ATOM 533 N ARG A 38 7.800 -1.453 -6.126 1.00 0.00 N ATOM 534 CA ARG A 38 8.802 -0.619 -6.778 1.00 0.00 C ATOM 535 C ARG A 38 8.142 0.430 -7.668 1.00 0.00 C ATOM 536 O ARG A 38 8.647 1.543 -7.813 1.00 0.00 O ATOM 537 CB ARG A 38 9.754 -1.483 -7.608 1.00 0.00 C ATOM 538 CG ARG A 38 10.415 -2.597 -6.814 1.00 0.00 C ATOM 539 CD ARG A 38 11.750 -2.999 -7.422 1.00 0.00 C ATOM 540 NE ARG A 38 12.817 -3.033 -6.426 1.00 0.00 N ATOM 541 CZ ARG A 38 14.101 -3.178 -6.730 1.00 0.00 C ATOM 542 NH1 ARG A 38 14.477 -3.301 -7.996 1.00 0.00 N ATOM 543 NH2 ARG A 38 15.015 -3.200 -5.768 1.00 0.00 N ATOM 0 H ARG A 38 7.555 -2.298 -6.641 1.00 0.00 H new ATOM 0 HA ARG A 38 9.371 -0.106 -6.003 1.00 0.00 H new ATOM 0 HB2 ARG A 38 9.202 -1.920 -8.440 1.00 0.00 H new ATOM 0 HB3 ARG A 38 10.527 -0.846 -8.038 1.00 0.00 H new ATOM 0 HG2 ARG A 38 10.566 -2.271 -5.785 1.00 0.00 H new ATOM 0 HG3 ARG A 38 9.754 -3.463 -6.780 1.00 0.00 H new ATOM 0 HD2 ARG A 38 11.656 -3.981 -7.886 1.00 0.00 H new ATOM 0 HD3 ARG A 38 12.014 -2.297 -8.213 1.00 0.00 H new ATOM 0 HE ARG A 38 12.562 -2.940 -5.443 1.00 0.00 H new ATOM 0 HH11 ARG A 38 13.779 -3.284 -8.739 1.00 0.00 H new ATOM 0 HH12 ARG A 38 15.464 -3.412 -8.226 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.731 -3.105 -4.793 1.00 0.00 H new ATOM 0 HH22 ARG A 38 16.001 -3.312 -6.004 1.00 0.00 H new ATOM 557 N SER A 39 7.010 0.066 -8.262 1.00 0.00 N ATOM 558 CA SER A 39 6.283 0.972 -9.143 1.00 0.00 C ATOM 559 C SER A 39 5.653 2.112 -8.348 1.00 0.00 C ATOM 560 O SER A 39 5.602 3.252 -8.812 1.00 0.00 O ATOM 561 CB SER A 39 5.200 0.212 -9.911 1.00 0.00 C ATOM 562 OG SER A 39 5.625 -0.090 -11.228 1.00 0.00 O ATOM 0 H SER A 39 6.576 -0.850 -8.149 1.00 0.00 H new ATOM 0 HA SER A 39 6.993 1.395 -9.854 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.956 -0.710 -9.384 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.289 0.809 -9.948 1.00 0.00 H new ATOM 0 HG SER A 39 4.916 -0.577 -11.697 1.00 0.00 H new ATOM 568 N ILE A 40 5.178 1.797 -7.148 1.00 0.00 N ATOM 569 CA ILE A 40 4.553 2.793 -6.288 1.00 0.00 C ATOM 570 C ILE A 40 5.570 3.827 -5.815 1.00 0.00 C ATOM 571 O ILE A 40 5.348 5.032 -5.931 1.00 0.00 O ATOM 572 CB ILE A 40 3.890 2.142 -5.059 1.00 0.00 C ATOM 573 CG1 ILE A 40 2.875 1.086 -5.501 1.00 0.00 C ATOM 574 CG2 ILE A 40 3.220 3.200 -4.196 1.00 0.00 C ATOM 575 CD1 ILE A 40 2.563 0.063 -4.431 1.00 0.00 C ATOM 0 H ILE A 40 5.214 0.859 -6.749 1.00 0.00 H new ATOM 0 HA ILE A 40 3.786 3.287 -6.884 1.00 0.00 H new ATOM 0 HB ILE A 40 4.661 1.652 -4.465 1.00 0.00 H new ATOM 0 HG12 ILE A 40 1.951 1.583 -5.797 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.258 0.572 -6.383 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.756 2.724 -3.332 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.966 3.919 -3.858 1.00 0.00 H new ATOM 0 HG23 ILE A 40 2.457 3.716 -4.779 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.837 -0.654 -4.814 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.477 -0.461 -4.151 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.150 0.566 -3.556 1.00 0.00 H new ATOM 587 N CYS A 41 6.688 3.346 -5.281 1.00 0.00 N ATOM 588 CA CYS A 41 7.742 4.227 -4.791 1.00 0.00 C ATOM 589 C CYS A 41 8.102 5.278 -5.837 1.00 0.00 C ATOM 590 O CYS A 41 8.373 6.432 -5.505 1.00 0.00 O ATOM 591 CB CYS A 41 8.982 3.415 -4.418 1.00 0.00 C ATOM 592 SG CYS A 41 8.705 2.206 -3.102 1.00 0.00 S ATOM 0 H CYS A 41 6.887 2.351 -5.177 1.00 0.00 H new ATOM 0 HA CYS A 41 7.371 4.737 -3.902 1.00 0.00 H new ATOM 0 HB2 CYS A 41 9.342 2.894 -5.305 1.00 0.00 H new ATOM 0 HB3 CYS A 41 9.771 4.099 -4.108 1.00 0.00 H new ATOM 0 HG CYS A 41 8.407 1.054 -3.626 1.00 0.00 H new ATOM 598 N LYS A 42 8.106 4.870 -7.101 1.00 0.00 N ATOM 599 CA LYS A 42 8.434 5.774 -8.196 1.00 0.00 C ATOM 600 C LYS A 42 7.211 6.582 -8.619 1.00 0.00 C ATOM 601 O LYS A 42 7.338 7.667 -9.187 1.00 0.00 O ATOM 602 CB LYS A 42 8.975 4.986 -9.392 1.00 0.00 C ATOM 603 CG LYS A 42 7.897 4.270 -10.186 1.00 0.00 C ATOM 604 CD LYS A 42 8.376 3.922 -11.587 1.00 0.00 C ATOM 605 CE LYS A 42 8.442 2.417 -11.795 1.00 0.00 C ATOM 606 NZ LYS A 42 9.463 2.042 -12.812 1.00 0.00 N ATOM 0 H LYS A 42 7.885 3.918 -7.393 1.00 0.00 H new ATOM 0 HA LYS A 42 9.202 6.464 -7.846 1.00 0.00 H new ATOM 0 HB2 LYS A 42 9.510 5.668 -10.054 1.00 0.00 H new ATOM 0 HB3 LYS A 42 9.699 4.253 -9.036 1.00 0.00 H new ATOM 0 HG2 LYS A 42 7.603 3.359 -9.664 1.00 0.00 H new ATOM 0 HG3 LYS A 42 7.011 4.901 -10.250 1.00 0.00 H new ATOM 0 HD2 LYS A 42 7.703 4.363 -12.323 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.361 4.357 -11.755 1.00 0.00 H new ATOM 0 HE2 LYS A 42 8.676 1.929 -10.849 1.00 0.00 H new ATOM 0 HE3 LYS A 42 7.465 2.051 -12.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 9.477 1.008 -12.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 9.226 2.486 -13.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 10.400 2.369 -12.500 1.00 0.00 H new ATOM 620 N ALA A 43 6.028 6.047 -8.337 1.00 0.00 N ATOM 621 CA ALA A 43 4.782 6.720 -8.685 1.00 0.00 C ATOM 622 C ALA A 43 4.454 7.821 -7.682 1.00 0.00 C ATOM 623 O ALA A 43 3.739 8.771 -8.000 1.00 0.00 O ATOM 624 CB ALA A 43 3.643 5.716 -8.761 1.00 0.00 C ATOM 0 H ALA A 43 5.906 5.149 -7.868 1.00 0.00 H new ATOM 0 HA ALA A 43 4.909 7.183 -9.664 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.719 6.233 -9.022 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.867 4.968 -9.521 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.524 5.226 -7.794 1.00 0.00 H new ATOM 630 N SER A 44 4.982 7.686 -6.469 1.00 0.00 N ATOM 631 CA SER A 44 4.741 8.667 -5.418 1.00 0.00 C ATOM 632 C SER A 44 6.031 9.392 -5.045 1.00 0.00 C ATOM 633 O SER A 44 6.023 10.586 -4.748 1.00 0.00 O ATOM 634 CB SER A 44 4.151 7.987 -4.182 1.00 0.00 C ATOM 635 OG SER A 44 4.827 6.775 -3.893 1.00 0.00 O ATOM 0 H SER A 44 5.579 6.907 -6.191 1.00 0.00 H new ATOM 0 HA SER A 44 4.028 9.400 -5.796 1.00 0.00 H new ATOM 0 HB2 SER A 44 4.220 8.658 -3.326 1.00 0.00 H new ATOM 0 HB3 SER A 44 3.092 7.786 -4.345 1.00 0.00 H new ATOM 0 HG SER A 44 4.813 6.196 -4.684 1.00 0.00 H new ATOM 641 N GLY A 45 7.141 8.659 -5.065 1.00 0.00 N ATOM 642 CA GLY A 45 8.424 9.248 -4.728 1.00 0.00 C ATOM 643 C GLY A 45 8.833 8.967 -3.295 1.00 0.00 C ATOM 644 O GLY A 45 9.960 9.253 -2.896 1.00 0.00 O ATOM 0 H GLY A 45 7.174 7.669 -5.308 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.187 8.860 -5.403 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.378 10.326 -4.885 1.00 0.00 H new ATOM 648 N ALA A 46 7.911 8.405 -2.518 1.00 0.00 N ATOM 649 CA ALA A 46 8.181 8.086 -1.122 1.00 0.00 C ATOM 650 C ALA A 46 8.761 6.683 -0.982 1.00 0.00 C ATOM 651 O ALA A 46 8.461 5.794 -1.779 1.00 0.00 O ATOM 652 CB ALA A 46 6.910 8.219 -0.295 1.00 0.00 C ATOM 0 H ALA A 46 6.972 8.162 -2.832 1.00 0.00 H new ATOM 0 HA ALA A 46 8.920 8.795 -0.749 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.126 7.978 0.746 1.00 0.00 H new ATOM 0 HB2 ALA A 46 6.538 9.242 -0.361 1.00 0.00 H new ATOM 0 HB3 ALA A 46 6.154 7.533 -0.677 1.00 0.00 H new ATOM 658 N LYS A 47 9.595 6.491 0.035 1.00 0.00 N ATOM 659 CA LYS A 47 10.218 5.196 0.280 1.00 0.00 C ATOM 660 C LYS A 47 9.267 4.268 1.028 1.00 0.00 C ATOM 661 O LYS A 47 8.866 4.553 2.157 1.00 0.00 O ATOM 662 CB LYS A 47 11.510 5.372 1.081 1.00 0.00 C ATOM 663 CG LYS A 47 12.737 4.805 0.387 1.00 0.00 C ATOM 664 CD LYS A 47 12.680 3.289 0.304 1.00 0.00 C ATOM 665 CE LYS A 47 13.913 2.650 0.923 1.00 0.00 C ATOM 666 NZ LYS A 47 14.133 1.266 0.420 1.00 0.00 N ATOM 0 H LYS A 47 9.855 7.217 0.703 1.00 0.00 H new ATOM 0 HA LYS A 47 10.454 4.746 -0.684 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.668 6.434 1.271 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.395 4.888 2.051 1.00 0.00 H new ATOM 0 HG2 LYS A 47 12.814 5.223 -0.617 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.634 5.107 0.927 1.00 0.00 H new ATOM 0 HD2 LYS A 47 11.787 2.929 0.815 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.595 2.984 -0.739 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.788 3.260 0.701 1.00 0.00 H new ATOM 0 HE3 LYS A 47 13.806 2.629 2.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 14.983 0.866 0.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.309 0.676 0.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.261 1.288 -0.612 1.00 0.00 H new ATOM 680 N ILE A 48 8.910 3.157 0.393 1.00 0.00 N ATOM 681 CA ILE A 48 8.007 2.186 1.000 1.00 0.00 C ATOM 682 C ILE A 48 8.700 0.843 1.202 1.00 0.00 C ATOM 683 O ILE A 48 9.237 0.260 0.259 1.00 0.00 O ATOM 684 CB ILE A 48 6.746 1.977 0.143 1.00 0.00 C ATOM 685 CG1 ILE A 48 6.060 3.317 -0.130 1.00 0.00 C ATOM 686 CG2 ILE A 48 5.788 1.017 0.835 1.00 0.00 C ATOM 687 CD1 ILE A 48 5.593 3.477 -1.560 1.00 0.00 C ATOM 0 H ILE A 48 9.232 2.906 -0.542 1.00 0.00 H new ATOM 0 HA ILE A 48 7.714 2.590 1.969 1.00 0.00 H new ATOM 0 HB ILE A 48 7.042 1.540 -0.811 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.204 3.420 0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 48 6.751 4.125 0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 48 4.901 0.879 0.217 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.280 0.056 0.983 1.00 0.00 H new ATOM 0 HG23 ILE A 48 5.496 1.428 1.802 1.00 0.00 H new ATOM 0 HD11 ILE A 48 5.116 4.450 -1.680 1.00 0.00 H new ATOM 0 HD12 ILE A 48 6.448 3.406 -2.232 1.00 0.00 H new ATOM 0 HD13 ILE A 48 4.877 2.690 -1.799 1.00 0.00 H new ATOM 699 N THR A 49 8.683 0.354 2.439 1.00 0.00 N ATOM 700 CA THR A 49 9.308 -0.921 2.764 1.00 0.00 C ATOM 701 C THR A 49 8.417 -1.754 3.680 1.00 0.00 C ATOM 702 O THR A 49 7.719 -1.215 4.539 1.00 0.00 O ATOM 703 CB THR A 49 10.676 -0.718 3.444 1.00 0.00 C ATOM 704 OG1 THR A 49 11.429 -1.935 3.402 1.00 0.00 O ATOM 705 CG2 THR A 49 10.501 -0.275 4.890 1.00 0.00 C ATOM 0 H THR A 49 8.243 0.822 3.231 1.00 0.00 H new ATOM 0 HA THR A 49 9.452 -1.451 1.823 1.00 0.00 H new ATOM 0 HB THR A 49 11.214 0.061 2.904 1.00 0.00 H new ATOM 0 HG1 THR A 49 12.298 -1.797 3.834 1.00 0.00 H new ATOM 0 HG21 THR A 49 11.480 -0.138 5.350 1.00 0.00 H new ATOM 0 HG22 THR A 49 9.952 0.666 4.918 1.00 0.00 H new ATOM 0 HG23 THR A 49 9.946 -1.036 5.439 1.00 0.00 H new ATOM 713 N CYS A 50 8.444 -3.068 3.488 1.00 0.00 N ATOM 714 CA CYS A 50 7.637 -3.974 4.298 1.00 0.00 C ATOM 715 C CYS A 50 8.466 -4.581 5.425 1.00 0.00 C ATOM 716 O CYS A 50 9.696 -4.614 5.357 1.00 0.00 O ATOM 717 CB CYS A 50 7.053 -5.086 3.425 1.00 0.00 C ATOM 718 SG CYS A 50 8.289 -6.206 2.728 1.00 0.00 S ATOM 0 H CYS A 50 9.015 -3.529 2.780 1.00 0.00 H new ATOM 0 HA CYS A 50 6.822 -3.400 4.739 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.347 -5.666 4.019 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.488 -4.634 2.610 1.00 0.00 H new ATOM 0 HG CYS A 50 9.000 -6.719 3.688 1.00 0.00 H new ATOM 724 N ASP A 51 7.787 -5.055 6.463 1.00 0.00 N ATOM 725 CA ASP A 51 8.460 -5.659 7.607 1.00 0.00 C ATOM 726 C ASP A 51 9.527 -6.649 7.150 1.00 0.00 C ATOM 727 O ASP A 51 9.631 -6.962 5.963 1.00 0.00 O ATOM 728 CB ASP A 51 7.446 -6.365 8.509 1.00 0.00 C ATOM 729 CG ASP A 51 7.896 -6.418 9.956 1.00 0.00 C ATOM 730 OD1 ASP A 51 7.910 -5.354 10.611 1.00 0.00 O ATOM 731 OD2 ASP A 51 8.233 -7.521 10.431 1.00 0.00 O ATOM 0 H ASP A 51 6.770 -5.033 6.536 1.00 0.00 H new ATOM 0 HA ASP A 51 8.946 -4.863 8.172 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.488 -5.848 8.448 1.00 0.00 H new ATOM 0 HB3 ASP A 51 7.284 -7.379 8.144 1.00 0.00 H new ATOM 736 N LYS A 52 10.320 -7.136 8.097 1.00 0.00 N ATOM 737 CA LYS A 52 11.380 -8.090 7.793 1.00 0.00 C ATOM 738 C LYS A 52 11.505 -9.135 8.897 1.00 0.00 C ATOM 739 O LYS A 52 11.504 -10.336 8.630 1.00 0.00 O ATOM 740 CB LYS A 52 12.714 -7.362 7.612 1.00 0.00 C ATOM 741 CG LYS A 52 12.885 -6.169 8.537 1.00 0.00 C ATOM 742 CD LYS A 52 14.093 -6.337 9.445 1.00 0.00 C ATOM 743 CE LYS A 52 14.373 -5.070 10.237 1.00 0.00 C ATOM 744 NZ LYS A 52 15.816 -4.704 10.205 1.00 0.00 N ATOM 0 H LYS A 52 10.249 -6.886 9.083 1.00 0.00 H new ATOM 0 HA LYS A 52 11.121 -8.598 6.864 1.00 0.00 H new ATOM 0 HB2 LYS A 52 13.529 -8.065 7.785 1.00 0.00 H new ATOM 0 HB3 LYS A 52 12.798 -7.025 6.579 1.00 0.00 H new ATOM 0 HG2 LYS A 52 12.997 -5.261 7.945 1.00 0.00 H new ATOM 0 HG3 LYS A 52 11.987 -6.045 9.143 1.00 0.00 H new ATOM 0 HD2 LYS A 52 13.921 -7.166 10.131 1.00 0.00 H new ATOM 0 HD3 LYS A 52 14.967 -6.594 8.846 1.00 0.00 H new ATOM 0 HE2 LYS A 52 13.781 -4.250 9.831 1.00 0.00 H new ATOM 0 HE3 LYS A 52 14.057 -5.210 11.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 15.966 -3.835 10.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 16.379 -5.476 10.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 16.112 -4.545 9.221 1.00 0.00 H new ATOM 758 N GLU A 53 11.611 -8.670 10.137 1.00 0.00 N ATOM 759 CA GLU A 53 11.736 -9.565 11.281 1.00 0.00 C ATOM 760 C GLU A 53 10.930 -10.843 11.062 1.00 0.00 C ATOM 761 O GLU A 53 11.381 -11.939 11.395 1.00 0.00 O ATOM 762 CB GLU A 53 11.265 -8.866 12.558 1.00 0.00 C ATOM 763 CG GLU A 53 12.399 -8.293 13.392 1.00 0.00 C ATOM 764 CD GLU A 53 13.466 -9.322 13.712 1.00 0.00 C ATOM 765 OE1 GLU A 53 13.110 -10.415 14.197 1.00 0.00 O ATOM 766 OE2 GLU A 53 14.657 -9.032 13.475 1.00 0.00 O ATOM 0 H GLU A 53 11.613 -7.678 10.375 1.00 0.00 H new ATOM 0 HA GLU A 53 12.787 -9.832 11.388 1.00 0.00 H new ATOM 0 HB2 GLU A 53 10.580 -8.062 12.290 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.702 -9.576 13.164 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.853 -7.459 12.857 1.00 0.00 H new ATOM 0 HG3 GLU A 53 11.995 -7.893 14.322 1.00 0.00 H new ATOM 773 N SER A 54 9.736 -10.694 10.498 1.00 0.00 N ATOM 774 CA SER A 54 8.866 -11.834 10.239 1.00 0.00 C ATOM 775 C SER A 54 8.733 -12.085 8.739 1.00 0.00 C ATOM 776 O SER A 54 7.993 -11.389 8.046 1.00 0.00 O ATOM 777 CB SER A 54 7.484 -11.598 10.850 1.00 0.00 C ATOM 778 OG SER A 54 6.829 -10.507 10.228 1.00 0.00 O ATOM 0 H SER A 54 9.349 -9.795 10.212 1.00 0.00 H new ATOM 0 HA SER A 54 9.315 -12.714 10.701 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.878 -12.498 10.744 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.584 -11.405 11.918 1.00 0.00 H new ATOM 0 HG SER A 54 7.110 -10.448 9.291 1.00 0.00 H new ATOM 784 N GLU A 55 9.458 -13.087 8.247 1.00 0.00 N ATOM 785 CA GLU A 55 9.423 -13.429 6.830 1.00 0.00 C ATOM 786 C GLU A 55 8.068 -14.019 6.446 1.00 0.00 C ATOM 787 O GLU A 55 7.141 -14.049 7.255 1.00 0.00 O ATOM 788 CB GLU A 55 10.536 -14.423 6.495 1.00 0.00 C ATOM 789 CG GLU A 55 11.930 -13.908 6.817 1.00 0.00 C ATOM 790 CD GLU A 55 13.024 -14.830 6.316 1.00 0.00 C ATOM 791 OE1 GLU A 55 13.351 -15.804 7.026 1.00 0.00 O ATOM 792 OE2 GLU A 55 13.552 -14.578 5.212 1.00 0.00 O ATOM 0 H GLU A 55 10.075 -13.674 8.808 1.00 0.00 H new ATOM 0 HA GLU A 55 9.578 -12.514 6.258 1.00 0.00 H new ATOM 0 HB2 GLU A 55 10.363 -15.348 7.045 1.00 0.00 H new ATOM 0 HB3 GLU A 55 10.485 -14.669 5.434 1.00 0.00 H new ATOM 0 HG2 GLU A 55 12.060 -12.921 6.372 1.00 0.00 H new ATOM 0 HG3 GLU A 55 12.028 -13.787 7.896 1.00 0.00 H new ATOM 799 N GLY A 56 7.962 -14.485 5.206 1.00 0.00 N ATOM 800 CA GLY A 56 6.718 -15.067 4.736 1.00 0.00 C ATOM 801 C GLY A 56 6.568 -16.520 5.141 1.00 0.00 C ATOM 802 O GLY A 56 6.246 -17.373 4.314 1.00 0.00 O ATOM 0 H GLY A 56 8.715 -14.470 4.518 1.00 0.00 H new ATOM 0 HA2 GLY A 56 5.880 -14.494 5.133 1.00 0.00 H new ATOM 0 HA3 GLY A 56 6.672 -14.989 3.650 1.00 0.00 H new ATOM 806 N THR A 57 6.803 -16.804 6.418 1.00 0.00 N ATOM 807 CA THR A 57 6.694 -18.164 6.931 1.00 0.00 C ATOM 808 C THR A 57 5.238 -18.548 7.167 1.00 0.00 C ATOM 809 O THR A 57 4.730 -19.495 6.566 1.00 0.00 O ATOM 810 CB THR A 57 7.477 -18.332 8.247 1.00 0.00 C ATOM 811 OG1 THR A 57 8.863 -18.041 8.033 1.00 0.00 O ATOM 812 CG2 THR A 57 7.329 -19.746 8.788 1.00 0.00 C ATOM 0 H THR A 57 7.070 -16.110 7.116 1.00 0.00 H new ATOM 0 HA THR A 57 7.122 -18.822 6.175 1.00 0.00 H new ATOM 0 HB THR A 57 7.068 -17.635 8.979 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.354 -18.148 8.875 1.00 0.00 H new ATOM 0 HG21 THR A 57 7.890 -19.841 9.717 1.00 0.00 H new ATOM 0 HG22 THR A 57 6.276 -19.955 8.977 1.00 0.00 H new ATOM 0 HG23 THR A 57 7.714 -20.457 8.057 1.00 0.00 H new ATOM 820 N LEU A 58 4.571 -17.807 8.045 1.00 0.00 N ATOM 821 CA LEU A 58 3.170 -18.070 8.359 1.00 0.00 C ATOM 822 C LEU A 58 2.616 -17.008 9.304 1.00 0.00 C ATOM 823 O LEU A 58 1.725 -17.282 10.109 1.00 0.00 O ATOM 824 CB LEU A 58 3.021 -19.456 8.989 1.00 0.00 C ATOM 825 CG LEU A 58 1.625 -20.077 8.920 1.00 0.00 C ATOM 826 CD1 LEU A 58 1.705 -21.520 8.446 1.00 0.00 C ATOM 827 CD2 LEU A 58 0.938 -19.997 10.276 1.00 0.00 C ATOM 0 H LEU A 58 4.977 -17.020 8.552 1.00 0.00 H new ATOM 0 HA LEU A 58 2.601 -18.036 7.430 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.723 -20.133 8.501 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.317 -19.391 10.036 1.00 0.00 H new ATOM 0 HG LEU A 58 1.032 -19.512 8.200 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.702 -21.945 8.403 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.156 -21.553 7.454 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.315 -22.098 9.141 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.054 -20.443 10.208 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.529 -20.537 11.016 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.846 -18.953 10.576 1.00 0.00 H new ATOM 839 N LEU A 59 3.147 -15.795 9.197 1.00 0.00 N ATOM 840 CA LEU A 59 2.704 -14.690 10.041 1.00 0.00 C ATOM 841 C LEU A 59 1.213 -14.428 9.855 1.00 0.00 C ATOM 842 O LEU A 59 0.535 -15.133 9.107 1.00 0.00 O ATOM 843 CB LEU A 59 3.500 -13.424 9.717 1.00 0.00 C ATOM 844 CG LEU A 59 3.837 -13.202 8.242 1.00 0.00 C ATOM 845 CD1 LEU A 59 2.607 -13.426 7.375 1.00 0.00 C ATOM 846 CD2 LEU A 59 4.394 -11.803 8.027 1.00 0.00 C ATOM 0 H LEU A 59 3.884 -15.552 8.535 1.00 0.00 H new ATOM 0 HA LEU A 59 2.879 -14.966 11.081 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.935 -12.563 10.074 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.432 -13.450 10.282 1.00 0.00 H new ATOM 0 HG LEU A 59 4.600 -13.924 7.950 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.865 -13.264 6.328 1.00 0.00 H new ATOM 0 HD12 LEU A 59 2.250 -14.448 7.507 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.823 -12.727 7.668 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.628 -11.663 6.972 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.653 -11.065 8.335 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.300 -11.677 8.620 1.00 0.00 H new ATOM 858 N LEU A 60 0.708 -13.406 10.539 1.00 0.00 N ATOM 859 CA LEU A 60 -0.704 -13.048 10.449 1.00 0.00 C ATOM 860 C LEU A 60 -0.899 -11.829 9.554 1.00 0.00 C ATOM 861 O LEU A 60 -1.666 -11.868 8.591 1.00 0.00 O ATOM 862 CB LEU A 60 -1.270 -12.769 11.841 1.00 0.00 C ATOM 863 CG LEU A 60 -1.514 -13.994 12.724 1.00 0.00 C ATOM 864 CD1 LEU A 60 -1.470 -13.608 14.195 1.00 0.00 C ATOM 865 CD2 LEU A 60 -2.847 -14.643 12.380 1.00 0.00 C ATOM 0 H LEU A 60 1.255 -12.811 11.161 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.240 -13.889 10.009 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.585 -12.101 12.363 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.213 -12.234 11.728 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.721 -14.718 12.535 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.646 -14.492 14.808 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.492 -13.190 14.432 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -2.241 -12.865 14.399 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.004 -15.513 13.018 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.653 -13.926 12.539 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.841 -14.956 11.336 1.00 0.00 H new ATOM 877 N SER A 61 -0.200 -10.746 9.877 1.00 0.00 N ATOM 878 CA SER A 61 -0.297 -9.514 9.103 1.00 0.00 C ATOM 879 C SER A 61 1.082 -8.898 8.885 1.00 0.00 C ATOM 880 O SER A 61 2.038 -9.225 9.588 1.00 0.00 O ATOM 881 CB SER A 61 -1.208 -8.511 9.814 1.00 0.00 C ATOM 882 OG SER A 61 -2.565 -8.912 9.737 1.00 0.00 O ATOM 0 H SER A 61 0.440 -10.697 10.670 1.00 0.00 H new ATOM 0 HA SER A 61 -0.725 -9.758 8.131 1.00 0.00 H new ATOM 0 HB2 SER A 61 -0.911 -8.422 10.859 1.00 0.00 H new ATOM 0 HB3 SER A 61 -1.091 -7.525 9.364 1.00 0.00 H new ATOM 0 HG SER A 61 -3.127 -8.256 10.200 1.00 0.00 H new ATOM 888 N ARG A 62 1.176 -8.006 7.904 1.00 0.00 N ATOM 889 CA ARG A 62 2.437 -7.346 7.591 1.00 0.00 C ATOM 890 C ARG A 62 2.368 -5.857 7.920 1.00 0.00 C ATOM 891 O ARG A 62 1.294 -5.321 8.197 1.00 0.00 O ATOM 892 CB ARG A 62 2.785 -7.537 6.114 1.00 0.00 C ATOM 893 CG ARG A 62 3.726 -8.703 5.856 1.00 0.00 C ATOM 894 CD ARG A 62 5.159 -8.230 5.667 1.00 0.00 C ATOM 895 NE ARG A 62 5.695 -8.618 4.365 1.00 0.00 N ATOM 896 CZ ARG A 62 6.050 -9.860 4.055 1.00 0.00 C ATOM 897 NH1 ARG A 62 5.925 -10.831 4.950 1.00 0.00 N ATOM 898 NH2 ARG A 62 6.531 -10.134 2.849 1.00 0.00 N ATOM 0 H ARG A 62 0.394 -7.724 7.313 1.00 0.00 H new ATOM 0 HA ARG A 62 3.217 -7.800 8.202 1.00 0.00 H new ATOM 0 HB2 ARG A 62 1.865 -7.692 5.550 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.241 -6.622 5.736 1.00 0.00 H new ATOM 0 HG2 ARG A 62 3.679 -9.402 6.691 1.00 0.00 H new ATOM 0 HG3 ARG A 62 3.400 -9.245 4.968 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.199 -7.145 5.767 1.00 0.00 H new ATOM 0 HD3 ARG A 62 5.785 -8.646 6.456 1.00 0.00 H new ATOM 0 HE ARG A 62 5.803 -7.895 3.654 1.00 0.00 H new ATOM 0 HH11 ARG A 62 5.556 -10.625 5.878 1.00 0.00 H new ATOM 0 HH12 ARG A 62 6.198 -11.784 4.710 1.00 0.00 H new ATOM 0 HH21 ARG A 62 6.629 -9.390 2.158 1.00 0.00 H new ATOM 0 HH22 ARG A 62 6.803 -11.088 2.613 1.00 0.00 H new ATOM 912 N LEU A 63 3.519 -5.195 7.886 1.00 0.00 N ATOM 913 CA LEU A 63 3.589 -3.767 8.180 1.00 0.00 C ATOM 914 C LEU A 63 4.486 -3.049 7.177 1.00 0.00 C ATOM 915 O LEU A 63 5.590 -3.506 6.878 1.00 0.00 O ATOM 916 CB LEU A 63 4.111 -3.545 9.600 1.00 0.00 C ATOM 917 CG LEU A 63 4.185 -2.091 10.068 1.00 0.00 C ATOM 918 CD1 LEU A 63 2.818 -1.431 9.973 1.00 0.00 C ATOM 919 CD2 LEU A 63 4.718 -2.016 11.491 1.00 0.00 C ATOM 0 H LEU A 63 4.416 -5.623 7.658 1.00 0.00 H new ATOM 0 HA LEU A 63 2.584 -3.354 8.101 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.473 -4.096 10.291 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.108 -3.980 9.671 1.00 0.00 H new ATOM 0 HG LEU A 63 4.872 -1.553 9.415 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.889 -0.397 10.310 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.474 -1.453 8.939 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.109 -1.970 10.602 1.00 0.00 H new ATOM 0 HD21 LEU A 63 4.764 -0.974 11.808 1.00 0.00 H new ATOM 0 HD22 LEU A 63 4.056 -2.569 12.157 1.00 0.00 H new ATOM 0 HD23 LEU A 63 5.717 -2.451 11.529 1.00 0.00 H new ATOM 931 N ILE A 64 4.006 -1.921 6.664 1.00 0.00 N ATOM 932 CA ILE A 64 4.767 -1.138 5.698 1.00 0.00 C ATOM 933 C ILE A 64 5.330 0.127 6.337 1.00 0.00 C ATOM 934 O ILE A 64 4.838 0.587 7.368 1.00 0.00 O ATOM 935 CB ILE A 64 3.902 -0.745 4.487 1.00 0.00 C ATOM 936 CG1 ILE A 64 3.667 -1.958 3.585 1.00 0.00 C ATOM 937 CG2 ILE A 64 4.562 0.382 3.706 1.00 0.00 C ATOM 938 CD1 ILE A 64 4.945 -2.599 3.089 1.00 0.00 C ATOM 0 H ILE A 64 3.095 -1.529 6.901 1.00 0.00 H new ATOM 0 HA ILE A 64 5.589 -1.768 5.359 1.00 0.00 H new ATOM 0 HB ILE A 64 2.936 -0.392 4.849 1.00 0.00 H new ATOM 0 HG12 ILE A 64 3.086 -2.701 4.132 1.00 0.00 H new ATOM 0 HG13 ILE A 64 3.067 -1.652 2.728 1.00 0.00 H new ATOM 0 HG21 ILE A 64 3.938 0.648 2.853 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.682 1.251 4.353 1.00 0.00 H new ATOM 0 HG23 ILE A 64 5.540 0.055 3.352 1.00 0.00 H new ATOM 0 HD11 ILE A 64 4.702 -3.452 2.456 1.00 0.00 H new ATOM 0 HD12 ILE A 64 5.518 -1.871 2.514 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.537 -2.936 3.940 1.00 0.00 H new ATOM 950 N LYS A 65 6.364 0.685 5.719 1.00 0.00 N ATOM 951 CA LYS A 65 6.995 1.900 6.225 1.00 0.00 C ATOM 952 C LYS A 65 7.112 2.950 5.125 1.00 0.00 C ATOM 953 O LYS A 65 7.939 2.826 4.222 1.00 0.00 O ATOM 954 CB LYS A 65 8.380 1.581 6.791 1.00 0.00 C ATOM 955 CG LYS A 65 8.428 1.568 8.310 1.00 0.00 C ATOM 956 CD LYS A 65 9.841 1.334 8.820 1.00 0.00 C ATOM 957 CE LYS A 65 9.940 0.034 9.604 1.00 0.00 C ATOM 958 NZ LYS A 65 11.353 -0.311 9.927 1.00 0.00 N ATOM 0 H LYS A 65 6.784 0.316 4.866 1.00 0.00 H new ATOM 0 HA LYS A 65 6.368 2.302 7.021 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.701 0.609 6.417 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.093 2.317 6.419 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.053 2.516 8.695 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.769 0.787 8.689 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.533 1.307 7.979 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.143 2.167 9.454 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.367 0.122 10.527 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.492 -0.774 9.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 11.379 -1.203 10.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 11.894 -0.420 9.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 11.773 0.448 10.500 1.00 0.00 H new ATOM 972 N ILE A 66 6.281 3.983 5.210 1.00 0.00 N ATOM 973 CA ILE A 66 6.295 5.056 4.223 1.00 0.00 C ATOM 974 C ILE A 66 7.132 6.236 4.705 1.00 0.00 C ATOM 975 O ILE A 66 6.923 6.750 5.805 1.00 0.00 O ATOM 976 CB ILE A 66 4.870 5.547 3.905 1.00 0.00 C ATOM 977 CG1 ILE A 66 3.977 4.369 3.511 1.00 0.00 C ATOM 978 CG2 ILE A 66 4.903 6.588 2.796 1.00 0.00 C ATOM 979 CD1 ILE A 66 2.563 4.480 4.037 1.00 0.00 C ATOM 0 H ILE A 66 5.590 4.100 5.951 1.00 0.00 H new ATOM 0 HA ILE A 66 6.740 4.645 3.317 1.00 0.00 H new ATOM 0 HB ILE A 66 4.454 6.011 4.799 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.947 4.294 2.424 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.423 3.446 3.882 1.00 0.00 H new ATOM 0 HG21 ILE A 66 3.889 6.925 2.583 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.509 7.437 3.112 1.00 0.00 H new ATOM 0 HG23 ILE A 66 5.336 6.149 1.897 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.987 3.611 3.719 1.00 0.00 H new ATOM 0 HD12 ILE A 66 2.582 4.524 5.126 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.099 5.385 3.645 1.00 0.00 H new ATOM 991 N SER A 67 8.077 6.663 3.875 1.00 0.00 N ATOM 992 CA SER A 67 8.947 7.783 4.218 1.00 0.00 C ATOM 993 C SER A 67 9.095 8.736 3.036 1.00 0.00 C ATOM 994 O SER A 67 8.843 8.368 1.890 1.00 0.00 O ATOM 995 CB SER A 67 10.322 7.272 4.651 1.00 0.00 C ATOM 996 OG SER A 67 10.766 6.222 3.809 1.00 0.00 O ATOM 0 H SER A 67 8.261 6.251 2.960 1.00 0.00 H new ATOM 0 HA SER A 67 8.492 8.326 5.046 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.041 8.090 4.627 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.274 6.920 5.682 1.00 0.00 H new ATOM 0 HG SER A 67 11.648 5.915 4.107 1.00 0.00 H new ATOM 1002 N GLY A 68 9.507 9.967 3.325 1.00 0.00 N ATOM 1003 CA GLY A 68 9.682 10.956 2.277 1.00 0.00 C ATOM 1004 C GLY A 68 9.072 12.296 2.638 1.00 0.00 C ATOM 1005 O GLY A 68 8.818 12.576 3.810 1.00 0.00 O ATOM 0 H GLY A 68 9.723 10.297 4.266 1.00 0.00 H new ATOM 0 HA2 GLY A 68 10.746 11.086 2.078 1.00 0.00 H new ATOM 0 HA3 GLY A 68 9.228 10.590 1.356 1.00 0.00 H new ATOM 1009 N THR A 69 8.840 13.129 1.628 1.00 0.00 N ATOM 1010 CA THR A 69 8.259 14.449 1.845 1.00 0.00 C ATOM 1011 C THR A 69 6.750 14.360 2.037 1.00 0.00 C ATOM 1012 O THR A 69 6.102 13.451 1.520 1.00 0.00 O ATOM 1013 CB THR A 69 8.561 15.395 0.668 1.00 0.00 C ATOM 1014 OG1 THR A 69 7.764 15.037 -0.466 1.00 0.00 O ATOM 1015 CG2 THR A 69 10.036 15.342 0.295 1.00 0.00 C ATOM 0 H THR A 69 9.045 12.913 0.652 1.00 0.00 H new ATOM 0 HA THR A 69 8.714 14.851 2.750 1.00 0.00 H new ATOM 0 HB THR A 69 8.317 16.412 0.976 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.961 15.645 -1.209 1.00 0.00 H new ATOM 0 HG21 THR A 69 10.225 16.018 -0.539 1.00 0.00 H new ATOM 0 HG22 THR A 69 10.639 15.644 1.151 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.302 14.325 0.005 1.00 0.00 H new ATOM 1023 N GLN A 70 6.196 15.312 2.782 1.00 0.00 N ATOM 1024 CA GLN A 70 4.762 15.340 3.041 1.00 0.00 C ATOM 1025 C GLN A 70 3.973 14.993 1.782 1.00 0.00 C ATOM 1026 O GLN A 70 2.906 14.384 1.852 1.00 0.00 O ATOM 1027 CB GLN A 70 4.342 16.718 3.555 1.00 0.00 C ATOM 1028 CG GLN A 70 3.093 16.690 4.421 1.00 0.00 C ATOM 1029 CD GLN A 70 3.379 16.257 5.845 1.00 0.00 C ATOM 1030 OE1 GLN A 70 3.903 17.029 6.648 1.00 0.00 O ATOM 1031 NE2 GLN A 70 3.035 15.015 6.166 1.00 0.00 N ATOM 0 H GLN A 70 6.718 16.073 3.216 1.00 0.00 H new ATOM 0 HA GLN A 70 4.542 14.592 3.803 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.163 17.148 4.129 1.00 0.00 H new ATOM 0 HB3 GLN A 70 4.169 17.377 2.704 1.00 0.00 H new ATOM 0 HG2 GLN A 70 2.640 17.681 4.431 1.00 0.00 H new ATOM 0 HG3 GLN A 70 2.364 16.011 3.978 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.603 14.409 5.469 1.00 0.00 H new ATOM 0 HE22 GLN A 70 3.203 14.667 7.110 1.00 0.00 H new ATOM 1040 N LYS A 71 4.508 15.383 0.629 1.00 0.00 N ATOM 1041 CA LYS A 71 3.857 15.113 -0.647 1.00 0.00 C ATOM 1042 C LYS A 71 3.823 13.616 -0.934 1.00 0.00 C ATOM 1043 O LYS A 71 2.758 13.040 -1.150 1.00 0.00 O ATOM 1044 CB LYS A 71 4.583 15.845 -1.779 1.00 0.00 C ATOM 1045 CG LYS A 71 4.334 17.344 -1.792 1.00 0.00 C ATOM 1046 CD LYS A 71 2.864 17.662 -2.013 1.00 0.00 C ATOM 1047 CE LYS A 71 2.659 19.130 -2.354 1.00 0.00 C ATOM 1048 NZ LYS A 71 1.236 19.542 -2.196 1.00 0.00 N ATOM 0 H LYS A 71 5.391 15.887 0.553 1.00 0.00 H new ATOM 0 HA LYS A 71 2.831 15.477 -0.587 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.654 15.664 -1.689 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.267 15.424 -2.734 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.663 17.777 -0.847 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.930 17.806 -2.579 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.473 17.042 -2.820 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.297 17.413 -1.116 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.289 19.744 -1.710 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.978 19.313 -3.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.137 20.549 -2.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.638 18.974 -2.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.938 19.392 -1.211 1.00 0.00 H new ATOM 1062 N GLU A 72 4.997 12.991 -0.934 1.00 0.00 N ATOM 1063 CA GLU A 72 5.100 11.560 -1.195 1.00 0.00 C ATOM 1064 C GLU A 72 4.410 10.756 -0.096 1.00 0.00 C ATOM 1065 O GLU A 72 3.362 10.152 -0.318 1.00 0.00 O ATOM 1066 CB GLU A 72 6.568 11.143 -1.302 1.00 0.00 C ATOM 1067 CG GLU A 72 7.433 12.146 -2.048 1.00 0.00 C ATOM 1068 CD GLU A 72 6.818 12.583 -3.362 1.00 0.00 C ATOM 1069 OE1 GLU A 72 5.633 12.977 -3.362 1.00 0.00 O ATOM 1070 OE2 GLU A 72 7.523 12.532 -4.392 1.00 0.00 O ATOM 0 H GLU A 72 5.889 13.453 -0.756 1.00 0.00 H new ATOM 0 HA GLU A 72 4.601 11.352 -2.142 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.971 11.003 -0.299 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.627 10.179 -1.807 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.594 13.021 -1.418 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.412 11.706 -2.238 1.00 0.00 H new ATOM 1077 N VAL A 73 5.008 10.753 1.091 1.00 0.00 N ATOM 1078 CA VAL A 73 4.454 10.025 2.226 1.00 0.00 C ATOM 1079 C VAL A 73 2.931 10.099 2.234 1.00 0.00 C ATOM 1080 O VAL A 73 2.256 9.172 2.682 1.00 0.00 O ATOM 1081 CB VAL A 73 4.991 10.572 3.561 1.00 0.00 C ATOM 1082 CG1 VAL A 73 4.439 9.767 4.729 1.00 0.00 C ATOM 1083 CG2 VAL A 73 6.512 10.562 3.568 1.00 0.00 C ATOM 0 H VAL A 73 5.877 11.247 1.292 1.00 0.00 H new ATOM 0 HA VAL A 73 4.765 8.986 2.118 1.00 0.00 H new ATOM 0 HB VAL A 73 4.657 11.604 3.671 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.830 10.168 5.664 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.351 9.831 4.733 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.741 8.725 4.627 1.00 0.00 H new ATOM 0 HG21 VAL A 73 6.874 10.952 4.519 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.870 9.541 3.435 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.884 11.186 2.755 1.00 0.00 H new ATOM 1093 N ALA A 74 2.395 11.208 1.736 1.00 0.00 N ATOM 1094 CA ALA A 74 0.951 11.403 1.683 1.00 0.00 C ATOM 1095 C ALA A 74 0.358 10.773 0.427 1.00 0.00 C ATOM 1096 O ALA A 74 -0.688 10.128 0.480 1.00 0.00 O ATOM 1097 CB ALA A 74 0.616 12.886 1.742 1.00 0.00 C ATOM 0 H ALA A 74 2.939 11.986 1.363 1.00 0.00 H new ATOM 0 HA ALA A 74 0.510 10.908 2.548 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -0.465 13.017 1.702 1.00 0.00 H new ATOM 0 HB2 ALA A 74 0.998 13.309 2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 74 1.075 13.397 0.895 1.00 0.00 H new ATOM 1103 N ALA A 75 1.032 10.969 -0.701 1.00 0.00 N ATOM 1104 CA ALA A 75 0.572 10.419 -1.971 1.00 0.00 C ATOM 1105 C ALA A 75 0.723 8.902 -2.000 1.00 0.00 C ATOM 1106 O ALA A 75 -0.243 8.176 -2.237 1.00 0.00 O ATOM 1107 CB ALA A 75 1.335 11.049 -3.127 1.00 0.00 C ATOM 0 H ALA A 75 1.898 11.504 -0.762 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.487 10.655 -2.077 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.981 10.629 -4.068 1.00 0.00 H new ATOM 0 HB2 ALA A 75 1.172 12.127 -3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.400 10.843 -3.015 1.00 0.00 H new ATOM 1113 N ALA A 76 1.941 8.428 -1.756 1.00 0.00 N ATOM 1114 CA ALA A 76 2.217 6.997 -1.753 1.00 0.00 C ATOM 1115 C ALA A 76 1.207 6.245 -0.893 1.00 0.00 C ATOM 1116 O ALA A 76 0.682 5.207 -1.297 1.00 0.00 O ATOM 1117 CB ALA A 76 3.632 6.735 -1.260 1.00 0.00 C ATOM 0 H ALA A 76 2.752 9.014 -1.558 1.00 0.00 H new ATOM 0 HA ALA A 76 2.126 6.632 -2.776 1.00 0.00 H new ATOM 0 HB1 ALA A 76 3.825 5.662 -1.263 1.00 0.00 H new ATOM 0 HB2 ALA A 76 4.344 7.234 -1.917 1.00 0.00 H new ATOM 0 HB3 ALA A 76 3.741 7.121 -0.247 1.00 0.00 H new ATOM 1123 N LYS A 77 0.940 6.773 0.296 1.00 0.00 N ATOM 1124 CA LYS A 77 -0.008 6.153 1.215 1.00 0.00 C ATOM 1125 C LYS A 77 -1.284 5.745 0.486 1.00 0.00 C ATOM 1126 O LYS A 77 -1.802 4.646 0.688 1.00 0.00 O ATOM 1127 CB LYS A 77 -0.345 7.113 2.358 1.00 0.00 C ATOM 1128 CG LYS A 77 -0.701 6.410 3.657 1.00 0.00 C ATOM 1129 CD LYS A 77 -1.352 7.363 4.646 1.00 0.00 C ATOM 1130 CE LYS A 77 -0.347 7.883 5.662 1.00 0.00 C ATOM 1131 NZ LYS A 77 -1.017 8.426 6.876 1.00 0.00 N ATOM 0 H LYS A 77 1.367 7.630 0.647 1.00 0.00 H new ATOM 0 HA LYS A 77 0.456 5.257 1.627 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.507 7.771 2.532 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.180 7.745 2.056 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.378 5.581 3.450 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.199 5.984 4.100 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.794 8.201 4.108 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.164 6.853 5.164 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.329 7.078 5.950 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.262 8.662 5.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -0.298 8.770 7.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.643 9.211 6.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.578 7.676 7.327 1.00 0.00 H new ATOM 1145 N HIS A 78 -1.786 6.637 -0.363 1.00 0.00 N ATOM 1146 CA HIS A 78 -3.001 6.367 -1.124 1.00 0.00 C ATOM 1147 C HIS A 78 -2.777 5.237 -2.124 1.00 0.00 C ATOM 1148 O HIS A 78 -3.658 4.403 -2.342 1.00 0.00 O ATOM 1149 CB HIS A 78 -3.458 7.629 -1.857 1.00 0.00 C ATOM 1150 CG HIS A 78 -4.839 7.523 -2.428 1.00 0.00 C ATOM 1151 ND1 HIS A 78 -5.965 7.958 -1.761 1.00 0.00 N ATOM 1152 CD2 HIS A 78 -5.272 7.028 -3.611 1.00 0.00 C ATOM 1153 CE1 HIS A 78 -7.030 7.734 -2.509 1.00 0.00 C ATOM 1154 NE2 HIS A 78 -6.638 7.171 -3.637 1.00 0.00 N ATOM 0 H HIS A 78 -1.371 7.552 -0.541 1.00 0.00 H new ATOM 0 HA HIS A 78 -3.778 6.059 -0.424 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -3.422 8.473 -1.168 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -2.756 7.846 -2.662 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.658 6.600 -4.390 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -8.049 7.971 -2.243 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -7.250 6.888 -4.403 1.00 0.00 H new ATOM 1162 N LEU A 79 -1.595 5.214 -2.729 1.00 0.00 N ATOM 1163 CA LEU A 79 -1.256 4.187 -3.707 1.00 0.00 C ATOM 1164 C LEU A 79 -1.243 2.804 -3.062 1.00 0.00 C ATOM 1165 O LEU A 79 -1.667 1.821 -3.669 1.00 0.00 O ATOM 1166 CB LEU A 79 0.108 4.481 -4.335 1.00 0.00 C ATOM 1167 CG LEU A 79 0.259 5.850 -4.999 1.00 0.00 C ATOM 1168 CD1 LEU A 79 1.679 6.043 -5.509 1.00 0.00 C ATOM 1169 CD2 LEU A 79 -0.743 6.003 -6.136 1.00 0.00 C ATOM 0 H LEU A 79 -0.855 5.895 -2.559 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.018 4.198 -4.487 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.870 4.389 -3.561 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.316 3.713 -5.080 1.00 0.00 H new ATOM 0 HG LEU A 79 0.055 6.619 -4.254 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.767 7.023 -5.978 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.377 5.976 -4.675 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.912 5.268 -6.240 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.622 6.983 -6.598 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.569 5.227 -6.881 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.756 5.909 -5.744 1.00 0.00 H new ATOM 1181 N ILE A 80 -0.754 2.737 -1.828 1.00 0.00 N ATOM 1182 CA ILE A 80 -0.689 1.476 -1.100 1.00 0.00 C ATOM 1183 C ILE A 80 -2.084 0.920 -0.838 1.00 0.00 C ATOM 1184 O ILE A 80 -2.318 -0.283 -0.965 1.00 0.00 O ATOM 1185 CB ILE A 80 0.047 1.639 0.244 1.00 0.00 C ATOM 1186 CG1 ILE A 80 1.556 1.749 0.014 1.00 0.00 C ATOM 1187 CG2 ILE A 80 -0.271 0.472 1.167 1.00 0.00 C ATOM 1188 CD1 ILE A 80 2.147 3.054 0.498 1.00 0.00 C ATOM 0 H ILE A 80 -0.397 3.541 -1.312 1.00 0.00 H new ATOM 0 HA ILE A 80 -0.134 0.778 -1.727 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.296 2.557 0.721 1.00 0.00 H new ATOM 0 HG12 ILE A 80 2.054 0.923 0.522 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.762 1.639 -1.051 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.256 0.602 2.112 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.345 0.437 1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.047 -0.459 0.699 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.219 3.062 0.303 1.00 0.00 H new ATOM 0 HD12 ILE A 80 1.676 3.884 -0.028 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.972 3.158 1.569 1.00 0.00 H new ATOM 1200 N LEU A 81 -3.009 1.803 -0.475 1.00 0.00 N ATOM 1201 CA LEU A 81 -4.383 1.401 -0.199 1.00 0.00 C ATOM 1202 C LEU A 81 -5.098 0.984 -1.480 1.00 0.00 C ATOM 1203 O LEU A 81 -5.916 0.066 -1.474 1.00 0.00 O ATOM 1204 CB LEU A 81 -5.144 2.545 0.475 1.00 0.00 C ATOM 1205 CG LEU A 81 -4.942 2.690 1.983 1.00 0.00 C ATOM 1206 CD1 LEU A 81 -5.838 1.720 2.737 1.00 0.00 C ATOM 1207 CD2 LEU A 81 -3.482 2.465 2.349 1.00 0.00 C ATOM 0 H LEU A 81 -2.832 2.801 -0.365 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.356 0.544 0.474 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.851 3.480 -0.002 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.208 2.409 0.283 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.216 3.705 2.271 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.681 1.838 3.809 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.881 1.928 2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.596 0.698 2.445 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.356 2.572 3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.181 1.462 2.047 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.861 3.200 1.837 1.00 0.00 H new ATOM 1219 N GLU A 82 -4.780 1.665 -2.577 1.00 0.00 N ATOM 1220 CA GLU A 82 -5.392 1.363 -3.866 1.00 0.00 C ATOM 1221 C GLU A 82 -5.246 -0.118 -4.205 1.00 0.00 C ATOM 1222 O GLU A 82 -6.000 -0.658 -5.013 1.00 0.00 O ATOM 1223 CB GLU A 82 -4.757 2.214 -4.968 1.00 0.00 C ATOM 1224 CG GLU A 82 -5.347 3.611 -5.075 1.00 0.00 C ATOM 1225 CD GLU A 82 -6.104 3.826 -6.371 1.00 0.00 C ATOM 1226 OE1 GLU A 82 -5.613 3.375 -7.427 1.00 0.00 O ATOM 1227 OE2 GLU A 82 -7.188 4.445 -6.328 1.00 0.00 O ATOM 0 H GLU A 82 -4.103 2.428 -2.599 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.454 1.599 -3.799 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.686 2.294 -4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.877 1.704 -5.924 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.018 3.783 -4.234 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.546 4.347 -5.000 1.00 0.00 H new ATOM 1234 N LYS A 83 -4.270 -0.768 -3.579 1.00 0.00 N ATOM 1235 CA LYS A 83 -4.024 -2.186 -3.812 1.00 0.00 C ATOM 1236 C LYS A 83 -4.798 -3.043 -2.815 1.00 0.00 C ATOM 1237 O LYS A 83 -5.426 -4.033 -3.190 1.00 0.00 O ATOM 1238 CB LYS A 83 -2.528 -2.489 -3.707 1.00 0.00 C ATOM 1239 CG LYS A 83 -1.749 -2.153 -4.967 1.00 0.00 C ATOM 1240 CD LYS A 83 -1.487 -0.660 -5.080 1.00 0.00 C ATOM 1241 CE LYS A 83 -1.040 -0.278 -6.483 1.00 0.00 C ATOM 1242 NZ LYS A 83 -2.192 -0.153 -7.417 1.00 0.00 N ATOM 0 H LYS A 83 -3.637 -0.335 -2.907 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.368 -2.429 -4.817 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.110 -1.928 -2.871 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.395 -3.547 -3.479 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.801 -2.690 -4.964 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.305 -2.493 -5.841 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -2.392 -0.110 -4.823 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.722 -0.368 -4.361 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.498 0.667 -6.447 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.346 -1.029 -6.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.846 0.108 -8.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.695 -1.062 -7.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -2.841 0.582 -7.071 1.00 0.00 H new ATOM 1256 N VAL A 84 -4.749 -2.656 -1.545 1.00 0.00 N ATOM 1257 CA VAL A 84 -5.448 -3.387 -0.495 1.00 0.00 C ATOM 1258 C VAL A 84 -6.927 -3.544 -0.825 1.00 0.00 C ATOM 1259 O VAL A 84 -7.549 -4.547 -0.475 1.00 0.00 O ATOM 1260 CB VAL A 84 -5.309 -2.681 0.868 1.00 0.00 C ATOM 1261 CG1 VAL A 84 -6.018 -3.476 1.954 1.00 0.00 C ATOM 1262 CG2 VAL A 84 -3.842 -2.478 1.216 1.00 0.00 C ATOM 0 H VAL A 84 -4.232 -1.840 -1.218 1.00 0.00 H new ATOM 0 HA VAL A 84 -4.986 -4.373 -0.435 1.00 0.00 H new ATOM 0 HB VAL A 84 -5.781 -1.701 0.801 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -5.910 -2.963 2.910 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -7.076 -3.565 1.708 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.577 -4.470 2.024 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.763 -1.978 2.181 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.343 -3.446 1.266 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.368 -1.864 0.450 1.00 0.00 H new ATOM 1272 N SER A 85 -7.485 -2.547 -1.504 1.00 0.00 N ATOM 1273 CA SER A 85 -8.894 -2.572 -1.880 1.00 0.00 C ATOM 1274 C SER A 85 -9.129 -3.536 -3.038 1.00 0.00 C ATOM 1275 O SER A 85 -10.171 -4.187 -3.115 1.00 0.00 O ATOM 1276 CB SER A 85 -9.366 -1.169 -2.265 1.00 0.00 C ATOM 1277 OG SER A 85 -10.217 -0.627 -1.270 1.00 0.00 O ATOM 0 H SER A 85 -6.983 -1.712 -1.805 1.00 0.00 H new ATOM 0 HA SER A 85 -9.468 -2.917 -1.020 1.00 0.00 H new ATOM 0 HB2 SER A 85 -8.504 -0.517 -2.405 1.00 0.00 H new ATOM 0 HB3 SER A 85 -9.894 -1.208 -3.218 1.00 0.00 H new ATOM 0 HG SER A 85 -10.504 0.271 -1.539 1.00 0.00 H new ATOM 1283 N GLU A 86 -8.154 -3.622 -3.937 1.00 0.00 N ATOM 1284 CA GLU A 86 -8.255 -4.506 -5.092 1.00 0.00 C ATOM 1285 C GLU A 86 -8.436 -5.956 -4.654 1.00 0.00 C ATOM 1286 O GLU A 86 -9.453 -6.583 -4.950 1.00 0.00 O ATOM 1287 CB GLU A 86 -7.009 -4.378 -5.971 1.00 0.00 C ATOM 1288 CG GLU A 86 -7.089 -3.247 -6.982 1.00 0.00 C ATOM 1289 CD GLU A 86 -6.560 -3.645 -8.346 1.00 0.00 C ATOM 1290 OE1 GLU A 86 -7.342 -4.204 -9.145 1.00 0.00 O ATOM 1291 OE2 GLU A 86 -5.366 -3.399 -8.615 1.00 0.00 O ATOM 0 H GLU A 86 -7.285 -3.090 -3.888 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.130 -4.208 -5.670 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -6.139 -4.222 -5.333 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.851 -5.317 -6.501 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -8.125 -2.924 -7.079 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.522 -2.393 -6.612 1.00 0.00 H new ATOM 1298 N ASP A 87 -7.441 -6.482 -3.947 1.00 0.00 N ATOM 1299 CA ASP A 87 -7.489 -7.858 -3.466 1.00 0.00 C ATOM 1300 C ASP A 87 -8.636 -8.048 -2.478 1.00 0.00 C ATOM 1301 O ASP A 87 -9.220 -9.128 -2.392 1.00 0.00 O ATOM 1302 CB ASP A 87 -6.162 -8.237 -2.807 1.00 0.00 C ATOM 1303 CG ASP A 87 -5.906 -9.731 -2.840 1.00 0.00 C ATOM 1304 OD1 ASP A 87 -6.434 -10.443 -1.961 1.00 0.00 O ATOM 1305 OD2 ASP A 87 -5.178 -10.188 -3.746 1.00 0.00 O ATOM 0 H ASP A 87 -6.592 -5.976 -3.695 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.659 -8.511 -4.322 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.347 -7.720 -3.314 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.162 -7.894 -1.772 1.00 0.00 H new ATOM 1310 N GLU A 88 -8.950 -6.993 -1.733 1.00 0.00 N ATOM 1311 CA GLU A 88 -10.025 -7.046 -0.749 1.00 0.00 C ATOM 1312 C GLU A 88 -11.353 -7.399 -1.413 1.00 0.00 C ATOM 1313 O GLU A 88 -12.189 -8.084 -0.824 1.00 0.00 O ATOM 1314 CB GLU A 88 -10.146 -5.706 -0.022 1.00 0.00 C ATOM 1315 CG GLU A 88 -11.555 -5.399 0.459 1.00 0.00 C ATOM 1316 CD GLU A 88 -11.660 -4.045 1.134 1.00 0.00 C ATOM 1317 OE1 GLU A 88 -11.887 -3.045 0.425 1.00 0.00 O ATOM 1318 OE2 GLU A 88 -11.514 -3.989 2.374 1.00 0.00 O ATOM 0 H GLU A 88 -8.476 -6.092 -1.792 1.00 0.00 H new ATOM 0 HA GLU A 88 -9.783 -7.824 -0.025 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.471 -5.704 0.834 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.817 -4.909 -0.689 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.239 -5.432 -0.389 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.874 -6.174 1.156 1.00 0.00 H new ATOM 1325 N GLU A 89 -11.538 -6.926 -2.641 1.00 0.00 N ATOM 1326 CA GLU A 89 -12.765 -7.190 -3.383 1.00 0.00 C ATOM 1327 C GLU A 89 -12.607 -8.418 -4.277 1.00 0.00 C ATOM 1328 O GLU A 89 -13.416 -9.344 -4.226 1.00 0.00 O ATOM 1329 CB GLU A 89 -13.146 -5.975 -4.231 1.00 0.00 C ATOM 1330 CG GLU A 89 -14.585 -5.528 -4.043 1.00 0.00 C ATOM 1331 CD GLU A 89 -15.158 -4.862 -5.279 1.00 0.00 C ATOM 1332 OE1 GLU A 89 -15.254 -5.539 -6.326 1.00 0.00 O ATOM 1333 OE2 GLU A 89 -15.507 -3.666 -5.203 1.00 0.00 O ATOM 0 H GLU A 89 -10.855 -6.359 -3.143 1.00 0.00 H new ATOM 0 HA GLU A 89 -13.560 -7.385 -2.663 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -12.482 -5.147 -3.983 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.982 -6.211 -5.283 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -15.198 -6.391 -3.783 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -14.639 -4.835 -3.204 1.00 0.00 H new ATOM 1340 N LEU A 90 -11.559 -8.417 -5.092 1.00 0.00 N ATOM 1341 CA LEU A 90 -11.294 -9.530 -5.998 1.00 0.00 C ATOM 1342 C LEU A 90 -11.601 -10.864 -5.325 1.00 0.00 C ATOM 1343 O LEU A 90 -12.188 -11.757 -5.936 1.00 0.00 O ATOM 1344 CB LEU A 90 -9.834 -9.502 -6.458 1.00 0.00 C ATOM 1345 CG LEU A 90 -8.939 -10.617 -5.915 1.00 0.00 C ATOM 1346 CD1 LEU A 90 -9.246 -11.934 -6.611 1.00 0.00 C ATOM 1347 CD2 LEU A 90 -7.471 -10.251 -6.085 1.00 0.00 C ATOM 0 H LEU A 90 -10.879 -7.659 -5.145 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.945 -9.423 -6.866 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.816 -9.546 -7.547 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.402 -8.544 -6.171 1.00 0.00 H new ATOM 0 HG LEU A 90 -9.143 -10.736 -4.851 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.600 -12.716 -6.212 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.288 -12.202 -6.439 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -9.070 -11.829 -7.682 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.848 -11.055 -5.693 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -7.253 -10.105 -7.143 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.260 -9.331 -5.540 1.00 0.00 H new ATOM 1359 N ARG A 91 -11.203 -10.991 -4.064 1.00 0.00 N ATOM 1360 CA ARG A 91 -11.438 -12.215 -3.308 1.00 0.00 C ATOM 1361 C ARG A 91 -12.919 -12.377 -2.980 1.00 0.00 C ATOM 1362 O ARG A 91 -13.451 -13.486 -2.988 1.00 0.00 O ATOM 1363 CB ARG A 91 -10.617 -12.208 -2.017 1.00 0.00 C ATOM 1364 CG ARG A 91 -9.122 -12.359 -2.245 1.00 0.00 C ATOM 1365 CD ARG A 91 -8.426 -12.931 -1.020 1.00 0.00 C ATOM 1366 NE ARG A 91 -7.142 -13.541 -1.354 1.00 0.00 N ATOM 1367 CZ ARG A 91 -6.495 -14.380 -0.553 1.00 0.00 C ATOM 1368 NH1 ARG A 91 -7.010 -14.706 0.623 1.00 0.00 N ATOM 1369 NH2 ARG A 91 -5.331 -14.893 -0.928 1.00 0.00 N ATOM 0 H ARG A 91 -10.716 -10.261 -3.544 1.00 0.00 H new ATOM 0 HA ARG A 91 -11.126 -13.058 -3.925 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -10.802 -11.276 -1.484 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -10.961 -13.017 -1.373 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -8.948 -13.011 -3.101 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -8.690 -11.388 -2.490 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -8.271 -12.138 -0.288 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -9.070 -13.675 -0.552 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.718 -13.310 -2.253 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.905 -14.313 0.915 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -6.512 -15.350 1.237 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.931 -14.643 -1.833 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.835 -15.537 -0.312 1.00 0.00 H new ATOM 1383 N LYS A 92 -13.581 -11.261 -2.690 1.00 0.00 N ATOM 1384 CA LYS A 92 -15.001 -11.276 -2.360 1.00 0.00 C ATOM 1385 C LYS A 92 -15.838 -11.657 -3.577 1.00 0.00 C ATOM 1386 O LYS A 92 -16.775 -12.449 -3.473 1.00 0.00 O ATOM 1387 CB LYS A 92 -15.438 -9.907 -1.834 1.00 0.00 C ATOM 1388 CG LYS A 92 -14.784 -9.523 -0.519 1.00 0.00 C ATOM 1389 CD LYS A 92 -15.763 -9.617 0.640 1.00 0.00 C ATOM 1390 CE LYS A 92 -15.517 -8.523 1.668 1.00 0.00 C ATOM 1391 NZ LYS A 92 -15.485 -9.062 3.055 1.00 0.00 N ATOM 0 H LYS A 92 -13.156 -10.334 -2.677 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.160 -12.024 -1.583 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -15.204 -9.149 -2.581 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -16.520 -9.905 -1.706 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -13.932 -10.177 -0.331 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -14.397 -8.506 -0.588 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -16.783 -9.541 0.263 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -15.671 -10.593 1.117 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -14.572 -8.026 1.450 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -16.300 -7.768 1.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -15.315 -8.285 3.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -16.396 -9.514 3.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -14.722 -9.763 3.137 1.00 0.00 H new ATOM 1405 N ARG A 93 -15.492 -11.090 -4.728 1.00 0.00 N ATOM 1406 CA ARG A 93 -16.213 -11.370 -5.964 1.00 0.00 C ATOM 1407 C ARG A 93 -16.207 -12.866 -6.269 1.00 0.00 C ATOM 1408 O ARG A 93 -17.084 -13.368 -6.973 1.00 0.00 O ATOM 1409 CB ARG A 93 -15.589 -10.599 -7.129 1.00 0.00 C ATOM 1410 CG ARG A 93 -15.646 -9.090 -6.959 1.00 0.00 C ATOM 1411 CD ARG A 93 -15.188 -8.370 -8.218 1.00 0.00 C ATOM 1412 NE ARG A 93 -16.190 -7.426 -8.705 1.00 0.00 N ATOM 1413 CZ ARG A 93 -15.986 -6.598 -9.723 1.00 0.00 C ATOM 1414 NH1 ARG A 93 -14.823 -6.598 -10.359 1.00 0.00 N ATOM 1415 NH2 ARG A 93 -16.948 -5.768 -10.107 1.00 0.00 N ATOM 0 H ARG A 93 -14.717 -10.434 -4.830 1.00 0.00 H new ATOM 0 HA ARG A 93 -17.246 -11.046 -5.835 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -14.549 -10.905 -7.241 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -16.102 -10.872 -8.051 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -16.665 -8.788 -6.716 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -15.017 -8.793 -6.120 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -14.259 -7.838 -8.014 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -14.972 -9.102 -8.996 1.00 0.00 H new ATOM 0 HE ARG A 93 -17.096 -7.401 -8.238 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -14.082 -7.235 -10.067 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -14.669 -5.961 -11.141 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -17.844 -5.766 -9.620 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -16.791 -5.132 -10.889 1.00 0.00 H new ATOM 1429 N ILE A 94 -15.215 -13.570 -5.735 1.00 0.00 N ATOM 1430 CA ILE A 94 -15.097 -15.006 -5.949 1.00 0.00 C ATOM 1431 C ILE A 94 -15.759 -15.787 -4.819 1.00 0.00 C ATOM 1432 O ILE A 94 -16.514 -16.727 -5.061 1.00 0.00 O ATOM 1433 CB ILE A 94 -13.623 -15.438 -6.062 1.00 0.00 C ATOM 1434 CG1 ILE A 94 -12.894 -14.576 -7.095 1.00 0.00 C ATOM 1435 CG2 ILE A 94 -13.530 -16.911 -6.433 1.00 0.00 C ATOM 1436 CD1 ILE A 94 -11.392 -14.764 -7.086 1.00 0.00 C ATOM 0 H ILE A 94 -14.481 -13.169 -5.151 1.00 0.00 H new ATOM 0 HA ILE A 94 -15.606 -15.228 -6.887 1.00 0.00 H new ATOM 0 HB ILE A 94 -13.143 -15.296 -5.094 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -13.276 -14.812 -8.088 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -13.122 -13.527 -6.907 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -12.482 -17.202 -6.509 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -14.018 -17.511 -5.665 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -14.023 -17.077 -7.391 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -10.940 -14.123 -7.843 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -10.998 -14.500 -6.105 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -11.154 -15.805 -7.304 1.00 0.00 H new ATOM 1448 N ALA A 95 -15.471 -15.389 -3.585 1.00 0.00 N ATOM 1449 CA ALA A 95 -16.041 -16.049 -2.417 1.00 0.00 C ATOM 1450 C ALA A 95 -17.563 -15.953 -2.421 1.00 0.00 C ATOM 1451 O ALA A 95 -18.256 -16.901 -2.050 1.00 0.00 O ATOM 1452 CB ALA A 95 -15.475 -15.447 -1.140 1.00 0.00 C ATOM 0 H ALA A 95 -14.846 -14.613 -3.368 1.00 0.00 H new ATOM 0 HA ALA A 95 -15.769 -17.104 -2.458 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -15.910 -15.950 -0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -14.393 -15.574 -1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -15.716 -14.385 -1.100 1.00 0.00 H new ATOM 1458 N HIS A 96 -18.077 -14.801 -2.839 1.00 0.00 N ATOM 1459 CA HIS A 96 -19.518 -14.580 -2.889 1.00 0.00 C ATOM 1460 C HIS A 96 -20.033 -14.682 -4.322 1.00 0.00 C ATOM 1461 O HIS A 96 -19.602 -13.937 -5.202 1.00 0.00 O ATOM 1462 CB HIS A 96 -19.867 -13.211 -2.307 1.00 0.00 C ATOM 1463 CG HIS A 96 -19.372 -13.011 -0.908 1.00 0.00 C ATOM 1464 ND1 HIS A 96 -18.369 -12.121 -0.583 1.00 0.00 N ATOM 1465 CD2 HIS A 96 -19.747 -13.592 0.256 1.00 0.00 C ATOM 1466 CE1 HIS A 96 -18.149 -12.164 0.718 1.00 0.00 C ATOM 1467 NE2 HIS A 96 -18.972 -13.049 1.251 1.00 0.00 N ATOM 0 H HIS A 96 -17.517 -14.006 -3.148 1.00 0.00 H new ATOM 0 HA HIS A 96 -20.000 -15.354 -2.291 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -19.446 -12.435 -2.947 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -20.949 -13.084 -2.322 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -20.513 -14.343 0.379 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -17.420 -11.576 1.255 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -19.023 -13.290 2.241 1.00 0.00 H new ATOM 1475 N SER A 97 -20.956 -15.612 -4.549 1.00 0.00 N ATOM 1476 CA SER A 97 -21.526 -15.815 -5.876 1.00 0.00 C ATOM 1477 C SER A 97 -22.692 -14.860 -6.118 1.00 0.00 C ATOM 1478 O SER A 97 -23.694 -15.229 -6.730 1.00 0.00 O ATOM 1479 CB SER A 97 -21.996 -17.262 -6.037 1.00 0.00 C ATOM 1480 OG SER A 97 -21.385 -17.874 -7.160 1.00 0.00 O ATOM 0 H SER A 97 -21.325 -16.236 -3.831 1.00 0.00 H new ATOM 0 HA SER A 97 -20.750 -15.609 -6.613 1.00 0.00 H new ATOM 0 HB2 SER A 97 -21.758 -17.828 -5.136 1.00 0.00 H new ATOM 0 HB3 SER A 97 -23.080 -17.285 -6.151 1.00 0.00 H new ATOM 0 HG SER A 97 -21.700 -18.798 -7.241 1.00 0.00 H new ATOM 1486 N ALA A 98 -22.552 -13.631 -5.634 1.00 0.00 N ATOM 1487 CA ALA A 98 -23.591 -12.622 -5.798 1.00 0.00 C ATOM 1488 C ALA A 98 -24.151 -12.638 -7.217 1.00 0.00 C ATOM 1489 O ALA A 98 -25.365 -12.572 -7.415 1.00 0.00 O ATOM 1490 CB ALA A 98 -23.046 -11.242 -5.459 1.00 0.00 C ATOM 0 H ALA A 98 -21.729 -13.310 -5.125 1.00 0.00 H new ATOM 0 HA ALA A 98 -24.404 -12.858 -5.111 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -23.833 -10.499 -5.586 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -22.700 -11.231 -4.425 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -22.214 -11.006 -6.122 1.00 0.00 H new ATOM 1496 N SER A 99 -23.260 -12.724 -8.199 1.00 0.00 N ATOM 1497 CA SER A 99 -23.666 -12.743 -9.600 1.00 0.00 C ATOM 1498 C SER A 99 -24.312 -11.419 -9.996 1.00 0.00 C ATOM 1499 O SER A 99 -25.369 -11.052 -9.484 1.00 0.00 O ATOM 1500 CB SER A 99 -24.640 -13.895 -9.854 1.00 0.00 C ATOM 1501 OG SER A 99 -24.196 -14.710 -10.925 1.00 0.00 O ATOM 0 H SER A 99 -22.252 -12.782 -8.051 1.00 0.00 H new ATOM 0 HA SER A 99 -22.774 -12.889 -10.210 1.00 0.00 H new ATOM 0 HB2 SER A 99 -24.739 -14.497 -8.951 1.00 0.00 H new ATOM 0 HB3 SER A 99 -25.629 -13.496 -10.082 1.00 0.00 H new ATOM 0 HG SER A 99 -24.834 -15.440 -11.067 1.00 0.00 H new ATOM 1507 N GLY A 100 -23.667 -10.705 -10.915 1.00 0.00 N ATOM 1508 CA GLY A 100 -24.193 -9.430 -11.366 1.00 0.00 C ATOM 1509 C GLY A 100 -23.306 -8.265 -10.970 1.00 0.00 C ATOM 1510 O GLY A 100 -22.792 -8.199 -9.853 1.00 0.00 O ATOM 0 H GLY A 100 -22.791 -10.987 -11.354 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -24.301 -9.448 -12.450 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -25.189 -9.283 -10.948 1.00 0.00 H new ATOM 1514 N PRO A 101 -23.113 -7.320 -11.903 1.00 0.00 N ATOM 1515 CA PRO A 101 -22.281 -6.136 -11.669 1.00 0.00 C ATOM 1516 C PRO A 101 -22.916 -5.167 -10.676 1.00 0.00 C ATOM 1517 O PRO A 101 -24.138 -5.032 -10.623 1.00 0.00 O ATOM 1518 CB PRO A 101 -22.180 -5.493 -13.054 1.00 0.00 C ATOM 1519 CG PRO A 101 -23.403 -5.952 -13.774 1.00 0.00 C ATOM 1520 CD PRO A 101 -23.693 -7.334 -13.256 1.00 0.00 C ATOM 0 HA PRO A 101 -21.316 -6.396 -11.234 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -22.146 -4.406 -12.984 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -21.274 -5.808 -13.572 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -24.241 -5.281 -13.587 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -23.240 -5.965 -14.852 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -24.764 -7.538 -13.232 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -23.236 -8.101 -13.881 1.00 0.00 H new ATOM 1528 N SER A 102 -22.077 -4.495 -9.895 1.00 0.00 N ATOM 1529 CA SER A 102 -22.558 -3.540 -8.902 1.00 0.00 C ATOM 1530 C SER A 102 -21.453 -2.565 -8.507 1.00 0.00 C ATOM 1531 O SER A 102 -20.269 -2.840 -8.701 1.00 0.00 O ATOM 1532 CB SER A 102 -23.072 -4.276 -7.663 1.00 0.00 C ATOM 1533 OG SER A 102 -24.307 -3.738 -7.226 1.00 0.00 O ATOM 0 H SER A 102 -21.062 -4.593 -9.930 1.00 0.00 H new ATOM 0 HA SER A 102 -23.377 -2.974 -9.345 1.00 0.00 H new ATOM 0 HB2 SER A 102 -23.193 -5.335 -7.890 1.00 0.00 H new ATOM 0 HB3 SER A 102 -22.336 -4.204 -6.862 1.00 0.00 H new ATOM 0 HG SER A 102 -24.615 -4.227 -6.434 1.00 0.00 H new ATOM 1539 N SER A 103 -21.849 -1.425 -7.951 1.00 0.00 N ATOM 1540 CA SER A 103 -20.894 -0.407 -7.530 1.00 0.00 C ATOM 1541 C SER A 103 -20.042 0.058 -8.708 1.00 0.00 C ATOM 1542 O SER A 103 -19.250 -0.707 -9.257 1.00 0.00 O ATOM 1543 CB SER A 103 -19.994 -0.949 -6.419 1.00 0.00 C ATOM 1544 OG SER A 103 -19.269 0.096 -5.794 1.00 0.00 O ATOM 0 H SER A 103 -22.825 -1.183 -7.781 1.00 0.00 H new ATOM 0 HA SER A 103 -21.455 0.446 -7.149 1.00 0.00 H new ATOM 0 HB2 SER A 103 -20.600 -1.469 -5.677 1.00 0.00 H new ATOM 0 HB3 SER A 103 -19.300 -1.680 -6.833 1.00 0.00 H new ATOM 0 HG SER A 103 -18.703 -0.277 -5.086 1.00 0.00 H new ATOM 1550 N GLY A 104 -20.212 1.321 -9.092 1.00 0.00 N ATOM 1551 CA GLY A 104 -19.453 1.867 -10.202 1.00 0.00 C ATOM 1552 C GLY A 104 -19.107 3.329 -10.004 1.00 0.00 C ATOM 1553 O GLY A 104 -18.610 3.985 -10.918 1.00 0.00 O ATOM 0 H GLY A 104 -20.861 1.974 -8.654 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.535 1.293 -10.327 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -20.027 1.754 -11.121 1.00 0.00 H new TER 1557 GLY A 104