USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 651 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 36 ASN : amide:sc= -0.49 K(o=-0.49,f=-6.7!) USER MOD Set 1.2: A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 36:sc= 0.146 USER MOD Single : A 27 ASN : amide:sc= -0.0611 X(o=-0.061,f=0) USER MOD Single : A 32 ASN : amide:sc= 0.359 X(o=0.36,f=0) USER MOD Single : A 34 GLN : amide:sc= -0.333 K(o=-0.33,f=-2) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 138:sc= 0.617 USER MOD Single : A 68 GLN :FLIP amide:sc=-0.00837 F(o=-0.58,f=-0.0084) USER MOD Single : A 82 HIS : no HD1:sc= -0.0331 X(o=-0.033,f=-0.0044) USER MOD Single : A 84 GLN : amide:sc= -0.232 K(o=-0.23,f=-5!) USER MOD Single : A 85 GLN : amide:sc= 0.169 X(o=0.17,f=0) USER MOD Single : A 87 LYS NZ :NH3+ -150:sc= 0.409 (180deg=0.0856) USER MOD Single : A 90 GLN : amide:sc= -0.0296 X(o=-0.03,f=-0.063) USER MOD Single : A 91 LYS NZ :NH3+ 158:sc= 0.665 (180deg=0.413) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.0282 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.102 K(o=-0.1,f=-2.1!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ -164:sc= -0.0379 (180deg=-0.313) USER MOD Single : A 105 SER OG : rot 53:sc= 0.123 USER MOD Single : A 106 GLN : amide:sc= -0.299 X(o=-0.3,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 21 1.084 -0.343 0.207 1.00 0.00 N ATOM 2 CA MET A 21 1.545 -0.187 -1.187 1.00 0.00 C ATOM 3 C MET A 21 2.229 -1.475 -1.655 1.00 0.00 C ATOM 4 O MET A 21 3.185 -1.941 -1.022 1.00 0.00 O ATOM 5 CB MET A 21 2.480 1.046 -1.325 1.00 0.00 C ATOM 6 CG MET A 21 1.754 2.388 -1.163 1.00 0.00 C ATOM 7 SD MET A 21 0.497 2.630 -2.447 1.00 0.00 S ATOM 8 CE MET A 21 -0.360 4.096 -1.875 1.00 0.00 C ATOM 0 HA MET A 21 0.683 -0.008 -1.830 1.00 0.00 H new ATOM 0 HB2 MET A 21 3.271 0.978 -0.578 1.00 0.00 H new ATOM 0 HB3 MET A 21 2.962 1.019 -2.302 1.00 0.00 H new ATOM 0 HG2 MET A 21 1.284 2.431 -0.181 1.00 0.00 H new ATOM 0 HG3 MET A 21 2.479 3.201 -1.205 1.00 0.00 H new ATOM 0 HE1 MET A 21 -1.155 4.349 -2.576 1.00 0.00 H new ATOM 0 HE2 MET A 21 -0.790 3.906 -0.892 1.00 0.00 H new ATOM 0 HE3 MET A 21 0.343 4.926 -1.809 1.00 0.00 H new ATOM 18 N ALA A 22 1.709 -2.049 -2.762 1.00 0.00 N ATOM 19 CA ALA A 22 2.218 -3.293 -3.356 1.00 0.00 C ATOM 20 C ALA A 22 3.555 -3.030 -4.079 1.00 0.00 C ATOM 21 O ALA A 22 3.572 -2.676 -5.264 1.00 0.00 O ATOM 22 CB ALA A 22 1.172 -3.907 -4.311 1.00 0.00 C ATOM 0 H ALA A 22 0.917 -1.654 -3.269 1.00 0.00 H new ATOM 0 HA ALA A 22 2.401 -4.015 -2.560 1.00 0.00 H new ATOM 0 HB1 ALA A 22 1.568 -4.827 -4.741 1.00 0.00 H new ATOM 0 HB2 ALA A 22 0.259 -4.128 -3.757 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.949 -3.200 -5.110 1.00 0.00 H new ATOM 28 N SER A 23 4.662 -3.156 -3.325 1.00 0.00 N ATOM 29 CA SER A 23 6.028 -2.978 -3.826 1.00 0.00 C ATOM 30 C SER A 23 6.968 -3.926 -3.063 1.00 0.00 C ATOM 31 O SER A 23 7.114 -3.804 -1.841 1.00 0.00 O ATOM 32 CB SER A 23 6.457 -1.494 -3.669 1.00 0.00 C ATOM 33 OG SER A 23 6.244 -1.023 -2.348 1.00 0.00 O ATOM 0 H SER A 23 4.627 -3.389 -2.333 1.00 0.00 H new ATOM 0 HA SER A 23 6.078 -3.224 -4.887 1.00 0.00 H new ATOM 0 HB2 SER A 23 7.511 -1.391 -3.927 1.00 0.00 H new ATOM 0 HB3 SER A 23 5.896 -0.877 -4.370 1.00 0.00 H new ATOM 0 HG SER A 23 6.427 -1.744 -1.710 1.00 0.00 H new ATOM 39 N GLY A 24 7.583 -4.873 -3.802 1.00 0.00 N ATOM 40 CA GLY A 24 8.440 -5.904 -3.213 1.00 0.00 C ATOM 41 C GLY A 24 7.656 -6.860 -2.317 1.00 0.00 C ATOM 42 O GLY A 24 8.085 -7.185 -1.204 1.00 0.00 O ATOM 0 H GLY A 24 7.496 -4.938 -4.816 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.925 -6.469 -4.009 1.00 0.00 H new ATOM 0 HA3 GLY A 24 9.230 -5.429 -2.632 1.00 0.00 H new ATOM 46 N TRP A 25 6.487 -7.295 -2.820 1.00 0.00 N ATOM 47 CA TRP A 25 5.537 -8.153 -2.080 1.00 0.00 C ATOM 48 C TRP A 25 5.567 -9.607 -2.602 1.00 0.00 C ATOM 49 O TRP A 25 5.302 -10.542 -1.837 1.00 0.00 O ATOM 50 CB TRP A 25 4.099 -7.555 -2.171 1.00 0.00 C ATOM 51 CG TRP A 25 3.522 -7.481 -3.570 1.00 0.00 C ATOM 52 CD1 TRP A 25 3.844 -6.581 -4.549 1.00 0.00 C ATOM 53 CD2 TRP A 25 2.517 -8.333 -4.139 1.00 0.00 C ATOM 54 NE1 TRP A 25 3.128 -6.834 -5.684 1.00 0.00 N ATOM 55 CE2 TRP A 25 2.309 -7.906 -5.463 1.00 0.00 C ATOM 56 CE3 TRP A 25 1.797 -9.431 -3.669 1.00 0.00 C ATOM 57 CZ2 TRP A 25 1.394 -8.521 -6.310 1.00 0.00 C ATOM 58 CZ3 TRP A 25 0.882 -10.035 -4.511 1.00 0.00 C ATOM 59 CH2 TRP A 25 0.702 -9.591 -5.825 1.00 0.00 C ATOM 0 H TRP A 25 6.170 -7.060 -3.760 1.00 0.00 H new ATOM 0 HA TRP A 25 5.840 -8.179 -1.033 1.00 0.00 H new ATOM 0 HB2 TRP A 25 3.433 -8.155 -1.551 1.00 0.00 H new ATOM 0 HB3 TRP A 25 4.112 -6.551 -1.746 1.00 0.00 H new ATOM 0 HD1 TRP A 25 4.563 -5.783 -4.440 1.00 0.00 H new ATOM 0 HE1 TRP A 25 3.194 -6.308 -6.556 1.00 0.00 H new ATOM 0 HE3 TRP A 25 1.951 -9.802 -2.667 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 1.237 -8.164 -7.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 0.295 -10.865 -4.147 1.00 0.00 H new ATOM 0 HH2 TRP A 25 0.002 -10.105 -6.467 1.00 0.00 H new ATOM 70 N ALA A 26 5.888 -9.787 -3.905 1.00 0.00 N ATOM 71 CA ALA A 26 5.865 -11.118 -4.569 1.00 0.00 C ATOM 72 C ALA A 26 6.661 -11.131 -5.886 1.00 0.00 C ATOM 73 O ALA A 26 7.205 -12.176 -6.273 1.00 0.00 O ATOM 74 CB ALA A 26 4.415 -11.573 -4.834 1.00 0.00 C ATOM 0 H ALA A 26 6.168 -9.025 -4.522 1.00 0.00 H new ATOM 0 HA ALA A 26 6.346 -11.816 -3.883 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.423 -12.549 -5.320 1.00 0.00 H new ATOM 0 HB2 ALA A 26 3.877 -11.643 -3.889 1.00 0.00 H new ATOM 0 HB3 ALA A 26 3.919 -10.849 -5.481 1.00 0.00 H new ATOM 80 N ASN A 27 6.700 -9.979 -6.585 1.00 0.00 N ATOM 81 CA ASN A 27 7.359 -9.856 -7.903 1.00 0.00 C ATOM 82 C ASN A 27 8.880 -9.841 -7.723 1.00 0.00 C ATOM 83 O ASN A 27 9.482 -8.809 -7.402 1.00 0.00 O ATOM 84 CB ASN A 27 6.855 -8.590 -8.657 1.00 0.00 C ATOM 85 CG ASN A 27 5.352 -8.634 -8.940 1.00 0.00 C ATOM 86 OD1 ASN A 27 4.923 -9.046 -10.017 1.00 0.00 O ATOM 87 ND2 ASN A 27 4.540 -8.228 -7.968 1.00 0.00 N ATOM 0 H ASN A 27 6.278 -9.111 -6.255 1.00 0.00 H new ATOM 0 HA ASN A 27 7.098 -10.719 -8.515 1.00 0.00 H new ATOM 0 HB2 ASN A 27 7.084 -7.704 -8.065 1.00 0.00 H new ATOM 0 HB3 ASN A 27 7.396 -8.493 -9.598 1.00 0.00 H new ATOM 0 HD21 ASN A 27 3.529 -8.253 -8.104 1.00 0.00 H new ATOM 0 HD22 ASN A 27 4.928 -7.892 -7.087 1.00 0.00 H new ATOM 94 N ASP A 28 9.470 -11.035 -7.841 1.00 0.00 N ATOM 95 CA ASP A 28 10.923 -11.261 -7.767 1.00 0.00 C ATOM 96 C ASP A 28 11.438 -11.786 -9.113 1.00 0.00 C ATOM 97 O ASP A 28 10.658 -12.278 -9.936 1.00 0.00 O ATOM 98 CB ASP A 28 11.252 -12.271 -6.640 1.00 0.00 C ATOM 99 CG ASP A 28 10.940 -11.724 -5.238 1.00 0.00 C ATOM 100 OD1 ASP A 28 11.762 -10.954 -4.694 1.00 0.00 O ATOM 101 OD2 ASP A 28 9.868 -12.037 -4.680 1.00 0.00 O ATOM 0 H ASP A 28 8.941 -11.893 -7.994 1.00 0.00 H new ATOM 0 HA ASP A 28 11.416 -10.315 -7.542 1.00 0.00 H new ATOM 0 HB2 ASP A 28 10.684 -13.187 -6.802 1.00 0.00 H new ATOM 0 HB3 ASP A 28 12.308 -12.537 -6.694 1.00 0.00 H new ATOM 106 N ASP A 29 12.754 -11.680 -9.316 1.00 0.00 N ATOM 107 CA ASP A 29 13.424 -12.167 -10.535 1.00 0.00 C ATOM 108 C ASP A 29 13.407 -13.707 -10.576 1.00 0.00 C ATOM 109 O ASP A 29 13.095 -14.308 -11.610 1.00 0.00 O ATOM 110 CB ASP A 29 14.880 -11.648 -10.582 1.00 0.00 C ATOM 111 CG ASP A 29 14.972 -10.114 -10.629 1.00 0.00 C ATOM 112 OD1 ASP A 29 14.936 -9.479 -9.555 1.00 0.00 O ATOM 113 OD2 ASP A 29 15.065 -9.537 -11.735 1.00 0.00 O ATOM 0 H ASP A 29 13.390 -11.254 -8.642 1.00 0.00 H new ATOM 0 HA ASP A 29 12.886 -11.790 -11.405 1.00 0.00 H new ATOM 0 HB2 ASP A 29 15.418 -12.012 -9.706 1.00 0.00 H new ATOM 0 HB3 ASP A 29 15.379 -12.063 -11.458 1.00 0.00 H new ATOM 118 N ALA A 30 13.681 -14.324 -9.406 1.00 0.00 N ATOM 119 CA ALA A 30 13.797 -15.794 -9.250 1.00 0.00 C ATOM 120 C ALA A 30 12.420 -16.501 -9.145 1.00 0.00 C ATOM 121 O ALA A 30 12.351 -17.682 -8.784 1.00 0.00 O ATOM 122 CB ALA A 30 14.673 -16.110 -8.025 1.00 0.00 C ATOM 0 H ALA A 30 13.829 -13.814 -8.535 1.00 0.00 H new ATOM 0 HA ALA A 30 14.268 -16.186 -10.151 1.00 0.00 H new ATOM 0 HB1 ALA A 30 14.760 -17.190 -7.909 1.00 0.00 H new ATOM 0 HB2 ALA A 30 15.664 -15.680 -8.166 1.00 0.00 H new ATOM 0 HB3 ALA A 30 14.216 -15.684 -7.132 1.00 0.00 H new ATOM 128 N VAL A 31 11.334 -15.778 -9.477 1.00 0.00 N ATOM 129 CA VAL A 31 9.974 -16.348 -9.583 1.00 0.00 C ATOM 130 C VAL A 31 9.358 -15.978 -10.960 1.00 0.00 C ATOM 131 O VAL A 31 8.486 -16.687 -11.475 1.00 0.00 O ATOM 132 CB VAL A 31 9.063 -15.860 -8.379 1.00 0.00 C ATOM 133 CG1 VAL A 31 8.645 -14.377 -8.524 1.00 0.00 C ATOM 134 CG2 VAL A 31 7.826 -16.773 -8.162 1.00 0.00 C ATOM 0 H VAL A 31 11.373 -14.779 -9.680 1.00 0.00 H new ATOM 0 HA VAL A 31 10.033 -17.434 -9.518 1.00 0.00 H new ATOM 0 HB VAL A 31 9.681 -15.939 -7.485 1.00 0.00 H new ATOM 0 HG11 VAL A 31 8.023 -14.090 -7.676 1.00 0.00 H new ATOM 0 HG12 VAL A 31 9.535 -13.749 -8.550 1.00 0.00 H new ATOM 0 HG13 VAL A 31 8.082 -14.246 -9.448 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.237 -16.395 -7.327 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.215 -16.778 -9.064 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.157 -17.788 -7.942 1.00 0.00 H new ATOM 144 N ASN A 32 9.856 -14.867 -11.561 1.00 0.00 N ATOM 145 CA ASN A 32 9.372 -14.350 -12.868 1.00 0.00 C ATOM 146 C ASN A 32 9.945 -15.199 -14.027 1.00 0.00 C ATOM 147 O ASN A 32 9.332 -15.303 -15.088 1.00 0.00 O ATOM 148 CB ASN A 32 9.783 -12.848 -13.038 1.00 0.00 C ATOM 149 CG ASN A 32 8.949 -12.009 -14.042 1.00 0.00 C ATOM 150 OD1 ASN A 32 8.910 -10.781 -13.933 1.00 0.00 O ATOM 151 ND2 ASN A 32 8.257 -12.618 -15.003 1.00 0.00 N ATOM 0 H ASN A 32 10.603 -14.305 -11.154 1.00 0.00 H new ATOM 0 HA ASN A 32 8.285 -14.421 -12.892 1.00 0.00 H new ATOM 0 HB2 ASN A 32 9.726 -12.367 -12.062 1.00 0.00 H new ATOM 0 HB3 ASN A 32 10.827 -12.814 -13.350 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.693 -12.069 -15.651 1.00 0.00 H new ATOM 0 HD22 ASN A 32 8.291 -13.634 -15.091 1.00 0.00 H new ATOM 158 N GLU A 33 11.114 -15.821 -13.794 1.00 0.00 N ATOM 159 CA GLU A 33 11.807 -16.657 -14.804 1.00 0.00 C ATOM 160 C GLU A 33 11.028 -17.960 -15.115 1.00 0.00 C ATOM 161 O GLU A 33 11.198 -18.543 -16.195 1.00 0.00 O ATOM 162 CB GLU A 33 13.290 -16.932 -14.367 1.00 0.00 C ATOM 163 CG GLU A 33 13.517 -17.264 -12.867 1.00 0.00 C ATOM 164 CD GLU A 33 12.869 -18.569 -12.395 1.00 0.00 C ATOM 165 OE1 GLU A 33 13.401 -19.649 -12.716 1.00 0.00 O ATOM 166 OE2 GLU A 33 11.816 -18.522 -11.724 1.00 0.00 O ATOM 0 H GLU A 33 11.608 -15.762 -12.904 1.00 0.00 H new ATOM 0 HA GLU A 33 11.839 -16.099 -15.740 1.00 0.00 H new ATOM 0 HB2 GLU A 33 13.674 -17.761 -14.962 1.00 0.00 H new ATOM 0 HB3 GLU A 33 13.888 -16.056 -14.617 1.00 0.00 H new ATOM 0 HG2 GLU A 33 14.589 -17.318 -12.679 1.00 0.00 H new ATOM 0 HG3 GLU A 33 13.129 -16.443 -12.264 1.00 0.00 H new ATOM 173 N GLN A 34 10.177 -18.398 -14.164 1.00 0.00 N ATOM 174 CA GLN A 34 9.267 -19.549 -14.359 1.00 0.00 C ATOM 175 C GLN A 34 8.098 -19.097 -15.264 1.00 0.00 C ATOM 176 O GLN A 34 7.670 -19.820 -16.165 1.00 0.00 O ATOM 177 CB GLN A 34 8.755 -20.087 -12.981 1.00 0.00 C ATOM 178 CG GLN A 34 8.395 -21.603 -12.923 1.00 0.00 C ATOM 179 CD GLN A 34 7.273 -22.068 -13.865 1.00 0.00 C ATOM 180 OE1 GLN A 34 7.523 -22.495 -14.991 1.00 0.00 O ATOM 181 NE2 GLN A 34 6.026 -21.945 -13.432 1.00 0.00 N ATOM 0 H GLN A 34 10.100 -17.967 -13.243 1.00 0.00 H new ATOM 0 HA GLN A 34 9.797 -20.370 -14.841 1.00 0.00 H new ATOM 0 HB2 GLN A 34 9.520 -19.888 -12.230 1.00 0.00 H new ATOM 0 HB3 GLN A 34 7.872 -19.514 -12.697 1.00 0.00 H new ATOM 0 HG2 GLN A 34 9.293 -22.178 -13.149 1.00 0.00 H new ATOM 0 HG3 GLN A 34 8.108 -21.849 -11.900 1.00 0.00 H new ATOM 0 HE21 GLN A 34 5.845 -21.588 -12.494 1.00 0.00 H new ATOM 0 HE22 GLN A 34 5.248 -22.207 -14.037 1.00 0.00 H new ATOM 190 N ILE A 35 7.625 -17.865 -15.020 1.00 0.00 N ATOM 191 CA ILE A 35 6.554 -17.223 -15.806 1.00 0.00 C ATOM 192 C ILE A 35 7.049 -16.903 -17.240 1.00 0.00 C ATOM 193 O ILE A 35 6.258 -16.869 -18.195 1.00 0.00 O ATOM 194 CB ILE A 35 6.073 -15.907 -15.083 1.00 0.00 C ATOM 195 CG1 ILE A 35 5.666 -16.213 -13.601 1.00 0.00 C ATOM 196 CG2 ILE A 35 4.912 -15.221 -15.849 1.00 0.00 C ATOM 197 CD1 ILE A 35 5.333 -14.986 -12.766 1.00 0.00 C ATOM 0 H ILE A 35 7.978 -17.278 -14.264 1.00 0.00 H new ATOM 0 HA ILE A 35 5.713 -17.912 -15.881 1.00 0.00 H new ATOM 0 HB ILE A 35 6.909 -15.208 -15.075 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.802 -16.878 -13.606 1.00 0.00 H new ATOM 0 HG13 ILE A 35 6.481 -16.753 -13.119 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.609 -14.318 -15.319 1.00 0.00 H new ATOM 0 HG22 ILE A 35 5.244 -14.958 -16.853 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.065 -15.904 -15.914 1.00 0.00 H new ATOM 0 HD11 ILE A 35 5.063 -15.295 -11.756 1.00 0.00 H new ATOM 0 HD12 ILE A 35 6.201 -14.328 -12.724 1.00 0.00 H new ATOM 0 HD13 ILE A 35 4.496 -14.454 -13.218 1.00 0.00 H new ATOM 209 N ASN A 36 8.375 -16.709 -17.374 1.00 0.00 N ATOM 210 CA ASN A 36 9.036 -16.411 -18.656 1.00 0.00 C ATOM 211 C ASN A 36 8.898 -17.615 -19.612 1.00 0.00 C ATOM 212 O ASN A 36 8.927 -18.781 -19.180 1.00 0.00 O ATOM 213 CB ASN A 36 10.537 -16.064 -18.405 1.00 0.00 C ATOM 214 CG ASN A 36 11.281 -15.423 -19.598 1.00 0.00 C ATOM 215 OD1 ASN A 36 10.973 -15.654 -20.766 1.00 0.00 O ATOM 216 ND2 ASN A 36 12.295 -14.625 -19.303 1.00 0.00 N ATOM 0 H ASN A 36 9.022 -16.756 -16.587 1.00 0.00 H new ATOM 0 HA ASN A 36 8.557 -15.550 -19.122 1.00 0.00 H new ATOM 0 HB2 ASN A 36 10.597 -15.385 -17.555 1.00 0.00 H new ATOM 0 HB3 ASN A 36 11.060 -16.977 -18.121 1.00 0.00 H new ATOM 0 HD21 ASN A 36 12.836 -14.190 -20.050 1.00 0.00 H new ATOM 0 HD22 ASN A 36 12.536 -14.445 -18.328 1.00 0.00 H new ATOM 223 N SER A 37 8.802 -17.309 -20.910 1.00 0.00 N ATOM 224 CA SER A 37 8.603 -18.292 -21.994 1.00 0.00 C ATOM 225 C SER A 37 9.832 -19.198 -22.225 1.00 0.00 C ATOM 226 O SER A 37 9.784 -20.078 -23.082 1.00 0.00 O ATOM 227 CB SER A 37 8.237 -17.540 -23.292 1.00 0.00 C ATOM 228 OG SER A 37 9.209 -16.551 -23.611 1.00 0.00 O ATOM 0 H SER A 37 8.861 -16.349 -21.250 1.00 0.00 H new ATOM 0 HA SER A 37 7.791 -18.955 -21.694 1.00 0.00 H new ATOM 0 HB2 SER A 37 8.155 -18.250 -24.115 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.260 -17.069 -23.178 1.00 0.00 H new ATOM 0 HG SER A 37 8.951 -16.093 -24.438 1.00 0.00 H new ATOM 234 N THR A 38 10.916 -18.972 -21.459 1.00 0.00 N ATOM 235 CA THR A 38 12.116 -19.829 -21.466 1.00 0.00 C ATOM 236 C THR A 38 11.761 -21.286 -21.083 1.00 0.00 C ATOM 237 O THR A 38 12.274 -22.242 -21.679 1.00 0.00 O ATOM 238 CB THR A 38 13.185 -19.272 -20.472 1.00 0.00 C ATOM 239 OG1 THR A 38 13.508 -17.910 -20.813 1.00 0.00 O ATOM 240 CG2 THR A 38 14.472 -20.118 -20.452 1.00 0.00 C ATOM 0 H THR A 38 10.984 -18.185 -20.814 1.00 0.00 H new ATOM 0 HA THR A 38 12.524 -19.825 -22.477 1.00 0.00 H new ATOM 0 HB THR A 38 12.749 -19.318 -19.474 1.00 0.00 H new ATOM 0 HG1 THR A 38 14.177 -17.566 -20.185 1.00 0.00 H new ATOM 0 HG21 THR A 38 15.180 -19.686 -19.745 1.00 0.00 H new ATOM 0 HG22 THR A 38 14.233 -21.137 -20.149 1.00 0.00 H new ATOM 0 HG23 THR A 38 14.915 -20.130 -21.448 1.00 0.00 H new ATOM 248 N ILE A 39 10.845 -21.418 -20.106 1.00 0.00 N ATOM 249 CA ILE A 39 10.400 -22.719 -19.576 1.00 0.00 C ATOM 250 C ILE A 39 9.611 -23.489 -20.647 1.00 0.00 C ATOM 251 O ILE A 39 9.868 -24.668 -20.890 1.00 0.00 O ATOM 252 CB ILE A 39 9.505 -22.532 -18.289 1.00 0.00 C ATOM 253 CG1 ILE A 39 10.221 -21.619 -17.242 1.00 0.00 C ATOM 254 CG2 ILE A 39 9.103 -23.899 -17.664 1.00 0.00 C ATOM 255 CD1 ILE A 39 11.574 -22.107 -16.768 1.00 0.00 C ATOM 0 H ILE A 39 10.391 -20.621 -19.660 1.00 0.00 H new ATOM 0 HA ILE A 39 11.287 -23.289 -19.301 1.00 0.00 H new ATOM 0 HB ILE A 39 8.584 -22.036 -18.597 1.00 0.00 H new ATOM 0 HG12 ILE A 39 10.344 -20.626 -17.675 1.00 0.00 H new ATOM 0 HG13 ILE A 39 9.569 -21.510 -16.375 1.00 0.00 H new ATOM 0 HG21 ILE A 39 8.488 -23.728 -16.781 1.00 0.00 H new ATOM 0 HG22 ILE A 39 8.538 -24.480 -18.393 1.00 0.00 H new ATOM 0 HG23 ILE A 39 10.001 -24.447 -17.380 1.00 0.00 H new ATOM 0 HD11 ILE A 39 11.983 -21.401 -16.045 1.00 0.00 H new ATOM 0 HD12 ILE A 39 11.464 -23.085 -16.299 1.00 0.00 H new ATOM 0 HD13 ILE A 39 12.250 -22.187 -17.619 1.00 0.00 H new ATOM 267 N GLU A 40 8.696 -22.778 -21.328 1.00 0.00 N ATOM 268 CA GLU A 40 7.775 -23.400 -22.309 1.00 0.00 C ATOM 269 C GLU A 40 8.530 -23.751 -23.604 1.00 0.00 C ATOM 270 O GLU A 40 8.207 -24.731 -24.269 1.00 0.00 O ATOM 271 CB GLU A 40 6.553 -22.476 -22.610 1.00 0.00 C ATOM 272 CG GLU A 40 6.820 -21.299 -23.582 1.00 0.00 C ATOM 273 CD GLU A 40 5.557 -20.498 -23.924 1.00 0.00 C ATOM 274 OE1 GLU A 40 4.788 -20.932 -24.807 1.00 0.00 O ATOM 275 OE2 GLU A 40 5.327 -19.437 -23.316 1.00 0.00 O ATOM 0 H GLU A 40 8.570 -21.771 -21.221 1.00 0.00 H new ATOM 0 HA GLU A 40 7.388 -24.321 -21.872 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.751 -23.089 -23.023 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.189 -22.068 -21.667 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.557 -20.630 -23.138 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.256 -21.688 -24.502 1.00 0.00 H new ATOM 282 N ASP A 41 9.551 -22.929 -23.919 1.00 0.00 N ATOM 283 CA ASP A 41 10.458 -23.117 -25.072 1.00 0.00 C ATOM 284 C ASP A 41 11.356 -24.342 -24.846 1.00 0.00 C ATOM 285 O ASP A 41 11.617 -25.122 -25.775 1.00 0.00 O ATOM 286 CB ASP A 41 11.292 -21.816 -25.272 1.00 0.00 C ATOM 287 CG ASP A 41 12.539 -21.964 -26.167 1.00 0.00 C ATOM 288 OD1 ASP A 41 12.408 -22.362 -27.346 1.00 0.00 O ATOM 289 OD2 ASP A 41 13.661 -21.671 -25.688 1.00 0.00 O ATOM 0 H ASP A 41 9.774 -22.099 -23.369 1.00 0.00 H new ATOM 0 HA ASP A 41 9.883 -23.304 -25.979 1.00 0.00 H new ATOM 0 HB2 ASP A 41 10.645 -21.052 -25.702 1.00 0.00 H new ATOM 0 HB3 ASP A 41 11.608 -21.453 -24.294 1.00 0.00 H new ATOM 294 N ALA A 42 11.795 -24.510 -23.587 1.00 0.00 N ATOM 295 CA ALA A 42 12.587 -25.672 -23.164 1.00 0.00 C ATOM 296 C ALA A 42 11.758 -26.965 -23.304 1.00 0.00 C ATOM 297 O ALA A 42 12.210 -27.933 -23.904 1.00 0.00 O ATOM 298 CB ALA A 42 13.077 -25.486 -21.721 1.00 0.00 C ATOM 0 H ALA A 42 11.610 -23.844 -22.837 1.00 0.00 H new ATOM 0 HA ALA A 42 13.460 -25.757 -23.811 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.663 -26.355 -21.421 1.00 0.00 H new ATOM 0 HB2 ALA A 42 13.697 -24.592 -21.660 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.220 -25.379 -21.057 1.00 0.00 H new ATOM 304 N ILE A 43 10.515 -26.925 -22.786 1.00 0.00 N ATOM 305 CA ILE A 43 9.568 -28.069 -22.814 1.00 0.00 C ATOM 306 C ILE A 43 9.086 -28.382 -24.257 1.00 0.00 C ATOM 307 O ILE A 43 8.836 -29.554 -24.601 1.00 0.00 O ATOM 308 CB ILE A 43 8.343 -27.802 -21.845 1.00 0.00 C ATOM 309 CG1 ILE A 43 8.830 -27.613 -20.366 1.00 0.00 C ATOM 310 CG2 ILE A 43 7.264 -28.912 -21.929 1.00 0.00 C ATOM 311 CD1 ILE A 43 9.606 -28.786 -19.775 1.00 0.00 C ATOM 0 H ILE A 43 10.132 -26.095 -22.332 1.00 0.00 H new ATOM 0 HA ILE A 43 10.101 -28.950 -22.457 1.00 0.00 H new ATOM 0 HB ILE A 43 7.874 -26.877 -22.181 1.00 0.00 H new ATOM 0 HG12 ILE A 43 9.459 -26.724 -20.320 1.00 0.00 H new ATOM 0 HG13 ILE A 43 7.960 -27.422 -19.737 1.00 0.00 H new ATOM 0 HG21 ILE A 43 6.448 -28.679 -21.245 1.00 0.00 H new ATOM 0 HG22 ILE A 43 6.879 -28.969 -22.947 1.00 0.00 H new ATOM 0 HG23 ILE A 43 7.705 -29.870 -21.654 1.00 0.00 H new ATOM 0 HD11 ILE A 43 9.895 -28.552 -18.751 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.978 -29.677 -19.780 1.00 0.00 H new ATOM 0 HD13 ILE A 43 10.500 -28.968 -20.372 1.00 0.00 H new ATOM 323 N ALA A 44 9.006 -27.334 -25.101 1.00 0.00 N ATOM 324 CA ALA A 44 8.575 -27.451 -26.512 1.00 0.00 C ATOM 325 C ALA A 44 9.553 -28.319 -27.320 1.00 0.00 C ATOM 326 O ALA A 44 9.134 -29.187 -28.091 1.00 0.00 O ATOM 327 CB ALA A 44 8.452 -26.056 -27.147 1.00 0.00 C ATOM 0 H ALA A 44 9.238 -26.380 -24.825 1.00 0.00 H new ATOM 0 HA ALA A 44 7.599 -27.936 -26.529 1.00 0.00 H new ATOM 0 HB1 ALA A 44 8.134 -26.155 -28.185 1.00 0.00 H new ATOM 0 HB2 ALA A 44 7.716 -25.469 -26.597 1.00 0.00 H new ATOM 0 HB3 ALA A 44 9.418 -25.553 -27.110 1.00 0.00 H new ATOM 333 N ARG A 45 10.862 -28.081 -27.114 1.00 0.00 N ATOM 334 CA ARG A 45 11.931 -28.842 -27.789 1.00 0.00 C ATOM 335 C ARG A 45 12.274 -30.132 -27.012 1.00 0.00 C ATOM 336 O ARG A 45 12.857 -31.057 -27.584 1.00 0.00 O ATOM 337 CB ARG A 45 13.198 -27.955 -27.979 1.00 0.00 C ATOM 338 CG ARG A 45 13.902 -27.524 -26.672 1.00 0.00 C ATOM 339 CD ARG A 45 15.188 -26.725 -26.921 1.00 0.00 C ATOM 340 NE ARG A 45 15.801 -26.271 -25.654 1.00 0.00 N ATOM 341 CZ ARG A 45 15.696 -25.036 -25.141 1.00 0.00 C ATOM 342 NH1 ARG A 45 15.004 -24.101 -25.771 1.00 0.00 N ATOM 343 NH2 ARG A 45 16.278 -24.748 -23.992 1.00 0.00 N ATOM 0 H ARG A 45 11.207 -27.361 -26.479 1.00 0.00 H new ATOM 0 HA ARG A 45 11.566 -29.135 -28.773 1.00 0.00 H new ATOM 0 HB2 ARG A 45 13.913 -28.499 -28.596 1.00 0.00 H new ATOM 0 HB3 ARG A 45 12.915 -27.060 -28.533 1.00 0.00 H new ATOM 0 HG2 ARG A 45 13.215 -26.921 -26.077 1.00 0.00 H new ATOM 0 HG3 ARG A 45 14.139 -28.411 -26.084 1.00 0.00 H new ATOM 0 HD2 ARG A 45 15.900 -27.342 -27.470 1.00 0.00 H new ATOM 0 HD3 ARG A 45 14.965 -25.862 -27.548 1.00 0.00 H new ATOM 0 HE ARG A 45 16.348 -26.952 -25.128 1.00 0.00 H new ATOM 0 HH11 ARG A 45 14.544 -24.316 -26.656 1.00 0.00 H new ATOM 0 HH12 ARG A 45 14.930 -23.165 -25.372 1.00 0.00 H new ATOM 0 HH21 ARG A 45 16.807 -25.464 -23.495 1.00 0.00 H new ATOM 0 HH22 ARG A 45 16.199 -23.809 -23.601 1.00 0.00 H new ATOM 357 N ALA A 46 11.908 -30.182 -25.709 1.00 0.00 N ATOM 358 CA ALA A 46 12.231 -31.320 -24.824 1.00 0.00 C ATOM 359 C ALA A 46 11.381 -32.554 -25.159 1.00 0.00 C ATOM 360 O ALA A 46 11.915 -33.627 -25.438 1.00 0.00 O ATOM 361 CB ALA A 46 12.040 -30.944 -23.343 1.00 0.00 C ATOM 0 H ALA A 46 11.384 -29.439 -25.247 1.00 0.00 H new ATOM 0 HA ALA A 46 13.279 -31.567 -24.993 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.285 -31.801 -22.716 1.00 0.00 H new ATOM 0 HB2 ALA A 46 12.696 -30.111 -23.092 1.00 0.00 H new ATOM 0 HB3 ALA A 46 11.003 -30.654 -23.172 1.00 0.00 H new ATOM 367 N ARG A 47 10.049 -32.373 -25.157 1.00 0.00 N ATOM 368 CA ARG A 47 9.082 -33.490 -25.284 1.00 0.00 C ATOM 369 C ARG A 47 8.028 -33.225 -26.381 1.00 0.00 C ATOM 370 O ARG A 47 7.267 -34.132 -26.729 1.00 0.00 O ATOM 371 CB ARG A 47 8.390 -33.736 -23.916 1.00 0.00 C ATOM 372 CG ARG A 47 7.498 -32.571 -23.440 1.00 0.00 C ATOM 373 CD ARG A 47 6.871 -32.812 -22.058 1.00 0.00 C ATOM 374 NE ARG A 47 7.880 -32.782 -20.982 1.00 0.00 N ATOM 375 CZ ARG A 47 7.750 -32.143 -19.808 1.00 0.00 C ATOM 376 NH1 ARG A 47 6.656 -31.437 -19.537 1.00 0.00 N ATOM 377 NH2 ARG A 47 8.738 -32.175 -18.928 1.00 0.00 N ATOM 0 H ARG A 47 9.609 -31.457 -25.068 1.00 0.00 H new ATOM 0 HA ARG A 47 9.635 -34.381 -25.582 1.00 0.00 H new ATOM 0 HB2 ARG A 47 7.783 -34.639 -23.986 1.00 0.00 H new ATOM 0 HB3 ARG A 47 9.155 -33.924 -23.163 1.00 0.00 H new ATOM 0 HG2 ARG A 47 8.092 -31.657 -23.408 1.00 0.00 H new ATOM 0 HG3 ARG A 47 6.704 -32.409 -24.169 1.00 0.00 H new ATOM 0 HD2 ARG A 47 6.113 -32.052 -21.866 1.00 0.00 H new ATOM 0 HD3 ARG A 47 6.364 -33.777 -22.053 1.00 0.00 H new ATOM 0 HE ARG A 47 8.750 -33.290 -21.143 1.00 0.00 H new ATOM 0 HH11 ARG A 47 5.905 -31.377 -20.224 1.00 0.00 H new ATOM 0 HH12 ARG A 47 6.568 -30.956 -18.642 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.596 -32.684 -19.142 1.00 0.00 H new ATOM 0 HH22 ARG A 47 8.642 -31.691 -18.036 1.00 0.00 H new ATOM 391 N GLY A 48 7.988 -31.984 -26.907 1.00 0.00 N ATOM 392 CA GLY A 48 7.009 -31.595 -27.940 1.00 0.00 C ATOM 393 C GLY A 48 5.604 -31.384 -27.384 1.00 0.00 C ATOM 394 O GLY A 48 4.611 -31.652 -28.068 1.00 0.00 O ATOM 0 H GLY A 48 8.623 -31.234 -26.633 1.00 0.00 H new ATOM 0 HA2 GLY A 48 7.344 -30.677 -28.422 1.00 0.00 H new ATOM 0 HA3 GLY A 48 6.977 -32.366 -28.710 1.00 0.00 H new ATOM 398 N GLU A 49 5.543 -30.895 -26.134 1.00 0.00 N ATOM 399 CA GLU A 49 4.275 -30.627 -25.415 1.00 0.00 C ATOM 400 C GLU A 49 3.594 -29.382 -26.004 1.00 0.00 C ATOM 401 O GLU A 49 2.438 -29.434 -26.439 1.00 0.00 O ATOM 402 CB GLU A 49 4.570 -30.428 -23.910 1.00 0.00 C ATOM 403 CG GLU A 49 3.339 -30.242 -22.995 1.00 0.00 C ATOM 404 CD GLU A 49 3.719 -30.090 -21.510 1.00 0.00 C ATOM 405 OE1 GLU A 49 4.019 -31.111 -20.859 1.00 0.00 O ATOM 406 OE2 GLU A 49 3.746 -28.951 -20.998 1.00 0.00 O ATOM 0 H GLU A 49 6.374 -30.672 -25.586 1.00 0.00 H new ATOM 0 HA GLU A 49 3.600 -31.475 -25.532 1.00 0.00 H new ATOM 0 HB2 GLU A 49 5.135 -31.290 -23.554 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.215 -29.556 -23.799 1.00 0.00 H new ATOM 0 HG2 GLU A 49 2.783 -29.361 -23.315 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.674 -31.098 -23.110 1.00 0.00 H new ATOM 413 N ILE A 50 4.333 -28.258 -25.988 1.00 0.00 N ATOM 414 CA ILE A 50 3.921 -27.013 -26.642 1.00 0.00 C ATOM 415 C ILE A 50 3.989 -27.224 -28.174 1.00 0.00 C ATOM 416 O ILE A 50 4.974 -27.801 -28.659 1.00 0.00 O ATOM 417 CB ILE A 50 4.849 -25.811 -26.191 1.00 0.00 C ATOM 418 CG1 ILE A 50 4.773 -25.588 -24.638 1.00 0.00 C ATOM 419 CG2 ILE A 50 4.538 -24.493 -26.961 1.00 0.00 C ATOM 420 CD1 ILE A 50 3.404 -25.185 -24.113 1.00 0.00 C ATOM 0 H ILE A 50 5.236 -28.192 -25.518 1.00 0.00 H new ATOM 0 HA ILE A 50 2.901 -26.759 -26.352 1.00 0.00 H new ATOM 0 HB ILE A 50 5.870 -26.092 -26.448 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.081 -26.507 -24.139 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.493 -24.818 -24.361 1.00 0.00 H new ATOM 0 HG21 ILE A 50 5.203 -23.703 -26.613 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.690 -24.651 -28.029 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.503 -24.202 -26.781 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.453 -25.055 -23.032 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.097 -24.248 -24.578 1.00 0.00 H new ATOM 0 HD13 ILE A 50 2.679 -25.963 -24.352 1.00 0.00 H new ATOM 432 N PRO A 51 2.944 -26.800 -28.958 1.00 0.00 N ATOM 433 CA PRO A 51 2.963 -26.897 -30.437 1.00 0.00 C ATOM 434 C PRO A 51 4.053 -25.993 -31.066 1.00 0.00 C ATOM 435 O PRO A 51 4.776 -25.274 -30.358 1.00 0.00 O ATOM 436 CB PRO A 51 1.525 -26.461 -30.854 1.00 0.00 C ATOM 437 CG PRO A 51 1.036 -25.615 -29.716 1.00 0.00 C ATOM 438 CD PRO A 51 1.673 -26.196 -28.466 1.00 0.00 C ATOM 0 HA PRO A 51 3.213 -27.899 -30.787 1.00 0.00 H new ATOM 0 HB2 PRO A 51 1.537 -25.899 -31.788 1.00 0.00 H new ATOM 0 HB3 PRO A 51 0.879 -27.325 -31.010 1.00 0.00 H new ATOM 0 HG2 PRO A 51 1.323 -24.572 -29.853 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -0.052 -25.641 -29.649 1.00 0.00 H new ATOM 0 HD2 PRO A 51 1.860 -25.425 -27.718 1.00 0.00 H new ATOM 0 HD3 PRO A 51 1.030 -26.943 -28.000 1.00 0.00 H new ATOM 446 N ARG A 52 4.168 -26.053 -32.399 1.00 0.00 N ATOM 447 CA ARG A 52 5.191 -25.305 -33.165 1.00 0.00 C ATOM 448 C ARG A 52 4.769 -23.836 -33.372 1.00 0.00 C ATOM 449 O ARG A 52 4.576 -23.380 -34.508 1.00 0.00 O ATOM 450 CB ARG A 52 5.463 -26.025 -34.525 1.00 0.00 C ATOM 451 CG ARG A 52 6.221 -27.371 -34.413 1.00 0.00 C ATOM 452 CD ARG A 52 7.674 -27.199 -33.915 1.00 0.00 C ATOM 453 NE ARG A 52 8.413 -26.225 -34.747 1.00 0.00 N ATOM 454 CZ ARG A 52 9.410 -26.501 -35.603 1.00 0.00 C ATOM 455 NH1 ARG A 52 9.867 -27.740 -35.754 1.00 0.00 N ATOM 456 NH2 ARG A 52 9.944 -25.519 -36.313 1.00 0.00 N ATOM 0 H ARG A 52 3.556 -26.621 -32.984 1.00 0.00 H new ATOM 0 HA ARG A 52 6.119 -25.289 -32.593 1.00 0.00 H new ATOM 0 HB2 ARG A 52 4.509 -26.203 -35.022 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.036 -25.355 -35.165 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.683 -28.030 -33.731 1.00 0.00 H new ATOM 0 HG3 ARG A 52 6.231 -27.860 -35.387 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.668 -26.865 -32.878 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.185 -28.162 -33.937 1.00 0.00 H new ATOM 0 HE ARG A 52 8.138 -25.246 -34.662 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.459 -28.503 -35.214 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.625 -27.927 -36.410 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.597 -24.566 -36.206 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.702 -25.716 -36.967 1.00 0.00 H new ATOM 470 N GLY A 53 4.603 -23.117 -32.246 1.00 0.00 N ATOM 471 CA GLY A 53 4.238 -21.696 -32.242 1.00 0.00 C ATOM 472 C GLY A 53 2.852 -21.399 -32.813 1.00 0.00 C ATOM 473 O GLY A 53 2.520 -20.240 -33.055 1.00 0.00 O ATOM 0 H GLY A 53 4.720 -23.511 -31.312 1.00 0.00 H new ATOM 0 HA2 GLY A 53 4.283 -21.325 -31.218 1.00 0.00 H new ATOM 0 HA3 GLY A 53 4.980 -21.141 -32.815 1.00 0.00 H new ATOM 477 N GLU A 54 2.025 -22.442 -33.000 1.00 0.00 N ATOM 478 CA GLU A 54 0.724 -22.330 -33.680 1.00 0.00 C ATOM 479 C GLU A 54 -0.425 -22.709 -32.713 1.00 0.00 C ATOM 480 O GLU A 54 -0.235 -22.752 -31.490 1.00 0.00 O ATOM 481 CB GLU A 54 0.706 -23.232 -34.958 1.00 0.00 C ATOM 482 CG GLU A 54 0.710 -24.770 -34.692 1.00 0.00 C ATOM 483 CD GLU A 54 -0.239 -25.537 -35.641 1.00 0.00 C ATOM 484 OE1 GLU A 54 -1.459 -25.614 -35.347 1.00 0.00 O ATOM 485 OE2 GLU A 54 0.211 -26.017 -36.695 1.00 0.00 O ATOM 0 H GLU A 54 2.241 -23.387 -32.683 1.00 0.00 H new ATOM 0 HA GLU A 54 0.574 -21.296 -33.990 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -0.179 -22.984 -35.545 1.00 0.00 H new ATOM 0 HB3 GLU A 54 1.574 -22.984 -35.569 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.724 -25.153 -34.809 1.00 0.00 H new ATOM 0 HG3 GLU A 54 0.416 -24.958 -33.659 1.00 0.00 H new ATOM 492 N SER A 55 -1.604 -22.979 -33.295 1.00 0.00 N ATOM 493 CA SER A 55 -2.830 -23.318 -32.576 1.00 0.00 C ATOM 494 C SER A 55 -2.774 -24.712 -31.917 1.00 0.00 C ATOM 495 O SER A 55 -1.940 -25.561 -32.271 1.00 0.00 O ATOM 496 CB SER A 55 -3.992 -23.249 -33.570 1.00 0.00 C ATOM 497 OG SER A 55 -4.044 -21.967 -34.189 1.00 0.00 O ATOM 0 H SER A 55 -1.728 -22.966 -34.307 1.00 0.00 H new ATOM 0 HA SER A 55 -2.962 -22.605 -31.763 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.875 -24.022 -34.330 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.931 -23.449 -33.055 1.00 0.00 H new ATOM 0 HG SER A 55 -4.233 -22.073 -35.145 1.00 0.00 H new ATOM 503 N LEU A 56 -3.693 -24.926 -30.969 1.00 0.00 N ATOM 504 CA LEU A 56 -3.873 -26.200 -30.251 1.00 0.00 C ATOM 505 C LEU A 56 -5.162 -26.902 -30.739 1.00 0.00 C ATOM 506 O LEU A 56 -5.839 -26.399 -31.647 1.00 0.00 O ATOM 507 CB LEU A 56 -3.874 -25.928 -28.703 1.00 0.00 C ATOM 508 CG LEU A 56 -4.697 -24.681 -28.193 1.00 0.00 C ATOM 509 CD1 LEU A 56 -6.207 -24.839 -28.403 1.00 0.00 C ATOM 510 CD2 LEU A 56 -4.387 -24.334 -26.719 1.00 0.00 C ATOM 0 H LEU A 56 -4.349 -24.204 -30.670 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.046 -26.878 -30.463 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.261 -26.816 -28.204 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.840 -25.806 -28.380 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.368 -23.845 -28.810 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.721 -23.951 -28.033 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.416 -24.963 -29.466 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.560 -25.715 -27.859 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.978 -23.470 -26.417 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.637 -25.184 -26.085 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.327 -24.103 -26.615 1.00 0.00 H new ATOM 522 N ASP A 57 -5.511 -28.035 -30.113 1.00 0.00 N ATOM 523 CA ASP A 57 -6.688 -28.848 -30.499 1.00 0.00 C ATOM 524 C ASP A 57 -7.674 -29.036 -29.320 1.00 0.00 C ATOM 525 O ASP A 57 -8.673 -29.745 -29.451 1.00 0.00 O ATOM 526 CB ASP A 57 -6.220 -30.215 -31.048 1.00 0.00 C ATOM 527 CG ASP A 57 -5.449 -31.043 -30.008 1.00 0.00 C ATOM 528 OD1 ASP A 57 -4.287 -30.693 -29.688 1.00 0.00 O ATOM 529 OD2 ASP A 57 -5.989 -32.045 -29.516 1.00 0.00 O ATOM 0 H ASP A 57 -4.990 -28.419 -29.325 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.227 -28.312 -31.280 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -7.088 -30.782 -31.386 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.586 -30.053 -31.920 1.00 0.00 H new ATOM 534 N GLU A 58 -7.416 -28.335 -28.199 1.00 0.00 N ATOM 535 CA GLU A 58 -8.236 -28.402 -26.965 1.00 0.00 C ATOM 536 C GLU A 58 -8.303 -27.002 -26.326 1.00 0.00 C ATOM 537 O GLU A 58 -7.279 -26.451 -25.910 1.00 0.00 O ATOM 538 CB GLU A 58 -7.677 -29.412 -25.921 1.00 0.00 C ATOM 539 CG GLU A 58 -7.753 -30.882 -26.337 1.00 0.00 C ATOM 540 CD GLU A 58 -7.265 -31.829 -25.235 1.00 0.00 C ATOM 541 OE1 GLU A 58 -6.061 -31.812 -24.918 1.00 0.00 O ATOM 542 OE2 GLU A 58 -8.089 -32.563 -24.650 1.00 0.00 O ATOM 0 H GLU A 58 -6.624 -27.697 -28.120 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.227 -28.750 -27.254 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.636 -29.161 -25.717 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.224 -29.286 -24.987 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.782 -31.130 -26.596 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.153 -31.034 -27.234 1.00 0.00 H new ATOM 549 N CYS A 59 -9.514 -26.439 -26.298 1.00 0.00 N ATOM 550 CA CYS A 59 -9.846 -25.141 -25.669 1.00 0.00 C ATOM 551 C CYS A 59 -9.325 -25.036 -24.220 1.00 0.00 C ATOM 552 O CYS A 59 -9.626 -25.903 -23.419 1.00 0.00 O ATOM 553 CB CYS A 59 -11.376 -25.031 -25.694 1.00 0.00 C ATOM 554 SG CYS A 59 -12.105 -23.628 -24.821 1.00 0.00 S ATOM 0 H CYS A 59 -10.326 -26.884 -26.726 1.00 0.00 H new ATOM 0 HA CYS A 59 -9.367 -24.330 -26.217 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.697 -24.987 -26.735 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.790 -25.947 -25.271 1.00 0.00 H new ATOM 559 N GLU A 60 -8.562 -23.967 -23.884 1.00 0.00 N ATOM 560 CA GLU A 60 -7.973 -23.803 -22.528 1.00 0.00 C ATOM 561 C GLU A 60 -9.050 -23.506 -21.454 1.00 0.00 C ATOM 562 O GLU A 60 -8.772 -23.594 -20.253 1.00 0.00 O ATOM 563 CB GLU A 60 -6.892 -22.688 -22.518 1.00 0.00 C ATOM 564 CG GLU A 60 -7.420 -21.271 -22.817 1.00 0.00 C ATOM 565 CD GLU A 60 -6.383 -20.174 -22.529 1.00 0.00 C ATOM 566 OE1 GLU A 60 -5.370 -20.095 -23.251 1.00 0.00 O ATOM 567 OE2 GLU A 60 -6.575 -19.382 -21.585 1.00 0.00 O ATOM 0 H GLU A 60 -8.340 -23.208 -24.528 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.503 -24.754 -22.276 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.407 -22.681 -21.542 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.126 -22.937 -23.253 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.721 -21.214 -23.863 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.312 -21.087 -22.218 1.00 0.00 H new ATOM 574 N GLU A 61 -10.273 -23.161 -21.902 1.00 0.00 N ATOM 575 CA GLU A 61 -11.383 -22.768 -21.020 1.00 0.00 C ATOM 576 C GLU A 61 -12.143 -24.000 -20.542 1.00 0.00 C ATOM 577 O GLU A 61 -12.291 -24.227 -19.338 1.00 0.00 O ATOM 578 CB GLU A 61 -12.349 -21.820 -21.778 1.00 0.00 C ATOM 579 CG GLU A 61 -11.676 -20.575 -22.361 1.00 0.00 C ATOM 580 CD GLU A 61 -11.141 -19.577 -21.321 1.00 0.00 C ATOM 581 OE1 GLU A 61 -9.987 -19.712 -20.877 1.00 0.00 O ATOM 582 OE2 GLU A 61 -11.876 -18.636 -20.958 1.00 0.00 O ATOM 0 H GLU A 61 -10.517 -23.148 -22.892 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.973 -22.249 -20.154 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.825 -22.375 -22.587 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.141 -21.507 -21.098 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -10.849 -20.892 -22.997 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.392 -20.060 -23.002 1.00 0.00 H new ATOM 589 N CYS A 62 -12.609 -24.806 -21.508 1.00 0.00 N ATOM 590 CA CYS A 62 -13.562 -25.899 -21.228 1.00 0.00 C ATOM 591 C CYS A 62 -13.141 -27.226 -21.890 1.00 0.00 C ATOM 592 O CYS A 62 -13.944 -28.164 -21.963 1.00 0.00 O ATOM 593 CB CYS A 62 -14.977 -25.448 -21.677 1.00 0.00 C ATOM 594 SG CYS A 62 -15.266 -25.404 -23.481 1.00 0.00 S ATOM 0 H CYS A 62 -12.344 -24.724 -22.490 1.00 0.00 H new ATOM 0 HA CYS A 62 -13.570 -26.099 -20.157 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -15.710 -26.118 -21.227 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -15.165 -24.453 -21.274 1.00 0.00 H new ATOM 599 N GLY A 63 -11.866 -27.295 -22.347 1.00 0.00 N ATOM 600 CA GLY A 63 -11.286 -28.486 -23.016 1.00 0.00 C ATOM 601 C GLY A 63 -12.043 -28.961 -24.252 1.00 0.00 C ATOM 602 O GLY A 63 -11.865 -30.094 -24.706 1.00 0.00 O ATOM 0 H GLY A 63 -11.207 -26.521 -22.261 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.259 -28.260 -23.302 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.244 -29.304 -22.297 1.00 0.00 H new ATOM 606 N ALA A 64 -12.870 -28.066 -24.805 1.00 0.00 N ATOM 607 CA ALA A 64 -13.778 -28.370 -25.919 1.00 0.00 C ATOM 608 C ALA A 64 -13.008 -28.500 -27.252 1.00 0.00 C ATOM 609 O ALA A 64 -11.996 -27.790 -27.431 1.00 0.00 O ATOM 610 CB ALA A 64 -14.859 -27.288 -26.006 1.00 0.00 C ATOM 0 H ALA A 64 -12.929 -27.098 -24.488 1.00 0.00 H new ATOM 0 HA ALA A 64 -14.255 -29.332 -25.732 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.533 -27.513 -26.832 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -15.424 -27.262 -25.074 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -14.390 -26.318 -26.174 1.00 0.00 H new ATOM 616 N PRO A 65 -13.474 -29.389 -28.194 1.00 0.00 N ATOM 617 CA PRO A 65 -12.831 -29.583 -29.516 1.00 0.00 C ATOM 618 C PRO A 65 -12.641 -28.270 -30.303 1.00 0.00 C ATOM 619 O PRO A 65 -13.618 -27.626 -30.697 1.00 0.00 O ATOM 620 CB PRO A 65 -13.802 -30.544 -30.263 1.00 0.00 C ATOM 621 CG PRO A 65 -14.501 -31.290 -29.171 1.00 0.00 C ATOM 622 CD PRO A 65 -14.659 -30.292 -28.041 1.00 0.00 C ATOM 0 HA PRO A 65 -11.821 -29.978 -29.410 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -14.509 -29.992 -30.883 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -13.261 -31.221 -30.923 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -15.470 -31.661 -29.506 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -13.921 -32.156 -28.852 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -15.596 -29.740 -28.122 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.663 -30.785 -27.069 1.00 0.00 H new ATOM 630 N ILE A 66 -11.376 -27.863 -30.454 1.00 0.00 N ATOM 631 CA ILE A 66 -10.986 -26.752 -31.328 1.00 0.00 C ATOM 632 C ILE A 66 -11.152 -27.201 -32.793 1.00 0.00 C ATOM 633 O ILE A 66 -10.565 -28.216 -33.174 1.00 0.00 O ATOM 634 CB ILE A 66 -9.486 -26.346 -31.065 1.00 0.00 C ATOM 635 CG1 ILE A 66 -9.297 -25.884 -29.602 1.00 0.00 C ATOM 636 CG2 ILE A 66 -8.985 -25.262 -32.060 1.00 0.00 C ATOM 637 CD1 ILE A 66 -9.769 -24.491 -29.311 1.00 0.00 C ATOM 0 H ILE A 66 -10.590 -28.298 -29.971 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.617 -25.888 -31.123 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.876 -27.234 -31.233 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.827 -26.575 -28.947 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.239 -25.953 -29.349 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -7.947 -25.016 -31.838 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.058 -25.642 -33.079 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.599 -24.367 -31.962 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.594 -24.260 -28.260 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.222 -23.784 -29.934 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -10.835 -24.416 -29.526 1.00 0.00 H new ATOM 649 N PRO A 67 -11.967 -26.487 -33.624 1.00 0.00 N ATOM 650 CA PRO A 67 -12.068 -26.797 -35.055 1.00 0.00 C ATOM 651 C PRO A 67 -10.833 -26.268 -35.812 1.00 0.00 C ATOM 652 O PRO A 67 -10.239 -25.242 -35.425 1.00 0.00 O ATOM 653 CB PRO A 67 -13.372 -26.081 -35.485 1.00 0.00 C ATOM 654 CG PRO A 67 -13.474 -24.905 -34.563 1.00 0.00 C ATOM 655 CD PRO A 67 -12.838 -25.342 -33.248 1.00 0.00 C ATOM 0 HA PRO A 67 -12.097 -27.865 -35.272 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -13.327 -25.766 -36.527 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -14.236 -26.738 -35.388 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -12.957 -24.039 -34.977 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.514 -24.615 -34.415 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.261 -24.534 -32.797 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.593 -25.639 -32.520 1.00 0.00 H new ATOM 663 N GLN A 68 -10.464 -26.973 -36.895 1.00 0.00 N ATOM 664 CA GLN A 68 -9.351 -26.584 -37.779 1.00 0.00 C ATOM 665 C GLN A 68 -9.615 -25.209 -38.412 1.00 0.00 C ATOM 666 O GLN A 68 -8.677 -24.536 -38.835 1.00 0.00 O ATOM 667 CB GLN A 68 -9.120 -27.668 -38.874 1.00 0.00 C ATOM 668 CG GLN A 68 -10.271 -27.823 -39.927 1.00 0.00 C ATOM 669 CD GLN A 68 -9.951 -27.274 -41.342 1.00 0.00 C ATOM 670 OE1 GLN A 68 -9.105 -26.248 -41.447 1.00 0.00 O flip ATOM 671 NE2 GLN A 68 -10.475 -27.778 -42.340 1.00 0.00 N flip ATOM 0 H GLN A 68 -10.931 -27.833 -37.183 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.444 -26.508 -37.179 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.197 -27.433 -39.403 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -8.970 -28.629 -38.382 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -10.523 -28.880 -40.013 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -11.158 -27.314 -39.549 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -11.119 -28.562 -42.237 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -10.264 -27.410 -43.268 1.00 0.00 H new ATOM 680 N ALA A 69 -10.910 -24.817 -38.450 1.00 0.00 N ATOM 681 CA ALA A 69 -11.374 -23.525 -38.969 1.00 0.00 C ATOM 682 C ALA A 69 -10.764 -22.376 -38.149 1.00 0.00 C ATOM 683 O ALA A 69 -10.183 -21.442 -38.701 1.00 0.00 O ATOM 684 CB ALA A 69 -12.913 -23.481 -38.924 1.00 0.00 C ATOM 0 H ALA A 69 -11.670 -25.407 -38.112 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.051 -23.407 -40.003 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.261 -22.522 -39.309 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.318 -24.287 -39.536 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -13.251 -23.603 -37.895 1.00 0.00 H new ATOM 690 N ARG A 70 -10.878 -22.491 -36.808 1.00 0.00 N ATOM 691 CA ARG A 70 -10.282 -21.526 -35.861 1.00 0.00 C ATOM 692 C ARG A 70 -8.745 -21.572 -35.902 1.00 0.00 C ATOM 693 O ARG A 70 -8.093 -20.549 -35.696 1.00 0.00 O ATOM 694 CB ARG A 70 -10.782 -21.784 -34.412 1.00 0.00 C ATOM 695 CG ARG A 70 -12.285 -21.495 -34.162 1.00 0.00 C ATOM 696 CD ARG A 70 -12.652 -19.986 -34.185 1.00 0.00 C ATOM 697 NE ARG A 70 -12.605 -19.399 -35.545 1.00 0.00 N ATOM 698 CZ ARG A 70 -12.695 -18.091 -35.837 1.00 0.00 C ATOM 699 NH1 ARG A 70 -12.837 -17.177 -34.886 1.00 0.00 N ATOM 700 NH2 ARG A 70 -12.616 -17.698 -37.094 1.00 0.00 N ATOM 0 H ARG A 70 -11.383 -23.252 -36.354 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.603 -20.532 -36.171 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.583 -22.825 -34.158 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.194 -21.171 -33.729 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -12.874 -22.013 -34.918 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.569 -21.912 -33.196 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -13.653 -19.855 -33.773 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.966 -19.441 -33.536 1.00 0.00 H new ATOM 0 HE ARG A 70 -12.495 -20.044 -36.327 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.880 -17.462 -33.907 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.903 -16.190 -35.133 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -12.487 -18.386 -37.836 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.684 -16.706 -37.324 1.00 0.00 H new ATOM 714 N ARG A 71 -8.180 -22.767 -36.162 1.00 0.00 N ATOM 715 CA ARG A 71 -6.713 -22.979 -36.181 1.00 0.00 C ATOM 716 C ARG A 71 -6.038 -22.265 -37.362 1.00 0.00 C ATOM 717 O ARG A 71 -4.954 -21.696 -37.206 1.00 0.00 O ATOM 718 CB ARG A 71 -6.361 -24.488 -36.217 1.00 0.00 C ATOM 719 CG ARG A 71 -6.874 -25.290 -35.007 1.00 0.00 C ATOM 720 CD ARG A 71 -6.340 -26.729 -34.968 1.00 0.00 C ATOM 721 NE ARG A 71 -4.883 -26.777 -34.724 1.00 0.00 N ATOM 722 CZ ARG A 71 -4.218 -27.841 -34.250 1.00 0.00 C ATOM 723 NH1 ARG A 71 -4.841 -28.995 -34.031 1.00 0.00 N ATOM 724 NH2 ARG A 71 -2.922 -27.747 -34.007 1.00 0.00 N ATOM 0 H ARG A 71 -8.720 -23.609 -36.364 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.330 -22.545 -35.257 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -6.774 -24.923 -37.127 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.278 -24.595 -36.275 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.585 -24.777 -34.090 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -7.964 -25.314 -35.030 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.856 -27.285 -34.186 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.565 -27.224 -35.913 1.00 0.00 H new ATOM 0 HE ARG A 71 -4.342 -25.937 -34.932 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.839 -29.080 -34.224 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -4.321 -29.795 -33.670 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -2.433 -26.869 -34.180 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -2.411 -28.553 -33.646 1.00 0.00 H new ATOM 738 N GLU A 72 -6.686 -22.312 -38.537 1.00 0.00 N ATOM 739 CA GLU A 72 -6.120 -21.766 -39.782 1.00 0.00 C ATOM 740 C GLU A 72 -6.453 -20.266 -39.925 1.00 0.00 C ATOM 741 O GLU A 72 -5.687 -19.503 -40.530 1.00 0.00 O ATOM 742 CB GLU A 72 -6.576 -22.629 -41.006 1.00 0.00 C ATOM 743 CG GLU A 72 -8.096 -22.674 -41.321 1.00 0.00 C ATOM 744 CD GLU A 72 -8.614 -21.484 -42.143 1.00 0.00 C ATOM 745 OE1 GLU A 72 -8.212 -21.357 -43.317 1.00 0.00 O ATOM 746 OE2 GLU A 72 -9.389 -20.658 -41.625 1.00 0.00 O ATOM 0 H GLU A 72 -7.611 -22.727 -38.651 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.032 -21.827 -39.747 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.059 -22.258 -41.891 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.235 -23.651 -40.843 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.315 -23.595 -41.862 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -8.647 -22.717 -40.382 1.00 0.00 H new ATOM 753 N ALA A 73 -7.598 -19.851 -39.350 1.00 0.00 N ATOM 754 CA ALA A 73 -8.011 -18.430 -39.307 1.00 0.00 C ATOM 755 C ALA A 73 -7.151 -17.644 -38.304 1.00 0.00 C ATOM 756 O ALA A 73 -6.643 -16.562 -38.611 1.00 0.00 O ATOM 757 CB ALA A 73 -9.504 -18.312 -38.944 1.00 0.00 C ATOM 0 H ALA A 73 -8.261 -20.485 -38.904 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.861 -18.001 -40.298 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.790 -17.261 -38.917 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.103 -18.832 -39.692 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -9.677 -18.760 -37.966 1.00 0.00 H new ATOM 763 N ILE A 74 -6.991 -18.222 -37.103 1.00 0.00 N ATOM 764 CA ILE A 74 -6.289 -17.588 -35.973 1.00 0.00 C ATOM 765 C ILE A 74 -4.991 -18.378 -35.675 1.00 0.00 C ATOM 766 O ILE A 74 -5.067 -19.482 -35.117 1.00 0.00 O ATOM 767 CB ILE A 74 -7.204 -17.556 -34.690 1.00 0.00 C ATOM 768 CG1 ILE A 74 -8.615 -16.972 -35.034 1.00 0.00 C ATOM 769 CG2 ILE A 74 -6.530 -16.766 -33.529 1.00 0.00 C ATOM 770 CD1 ILE A 74 -9.601 -16.961 -33.881 1.00 0.00 C ATOM 0 H ILE A 74 -7.349 -19.152 -36.886 1.00 0.00 H new ATOM 0 HA ILE A 74 -6.045 -16.560 -36.241 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.337 -18.582 -34.346 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -8.491 -15.952 -35.397 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -9.042 -17.551 -35.853 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.188 -16.764 -32.660 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.584 -17.241 -33.267 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.345 -15.740 -33.847 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -10.548 -16.539 -34.216 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.762 -17.980 -33.530 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -9.202 -16.356 -33.067 1.00 0.00 H new ATOM 782 N PRO A 75 -3.794 -17.856 -36.093 1.00 0.00 N ATOM 783 CA PRO A 75 -2.488 -18.478 -35.769 1.00 0.00 C ATOM 784 C PRO A 75 -2.192 -18.407 -34.250 1.00 0.00 C ATOM 785 O PRO A 75 -1.734 -17.375 -33.734 1.00 0.00 O ATOM 786 CB PRO A 75 -1.464 -17.665 -36.617 1.00 0.00 C ATOM 787 CG PRO A 75 -2.138 -16.352 -36.882 1.00 0.00 C ATOM 788 CD PRO A 75 -3.624 -16.645 -36.944 1.00 0.00 C ATOM 0 HA PRO A 75 -2.453 -19.542 -36.004 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.527 -17.526 -36.078 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.224 -18.180 -37.547 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.915 -15.634 -36.093 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.788 -15.916 -37.818 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.211 -15.808 -36.567 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.951 -16.828 -37.967 1.00 0.00 H new ATOM 796 N GLY A 76 -2.515 -19.504 -33.543 1.00 0.00 N ATOM 797 CA GLY A 76 -2.323 -19.611 -32.095 1.00 0.00 C ATOM 798 C GLY A 76 -3.628 -19.481 -31.320 1.00 0.00 C ATOM 799 O GLY A 76 -3.650 -18.892 -30.229 1.00 0.00 O ATOM 0 H GLY A 76 -2.917 -20.341 -33.965 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -1.861 -20.571 -31.863 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.630 -18.836 -31.766 1.00 0.00 H new ATOM 803 N VAL A 77 -4.732 -20.048 -31.868 1.00 0.00 N ATOM 804 CA VAL A 77 -6.040 -20.037 -31.183 1.00 0.00 C ATOM 805 C VAL A 77 -6.003 -20.984 -29.971 1.00 0.00 C ATOM 806 O VAL A 77 -5.376 -22.050 -30.018 1.00 0.00 O ATOM 807 CB VAL A 77 -7.248 -20.409 -32.130 1.00 0.00 C ATOM 808 CG1 VAL A 77 -7.162 -21.861 -32.644 1.00 0.00 C ATOM 809 CG2 VAL A 77 -8.612 -20.157 -31.433 1.00 0.00 C ATOM 0 H VAL A 77 -4.739 -20.514 -32.775 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.213 -19.012 -30.854 1.00 0.00 H new ATOM 0 HB VAL A 77 -7.178 -19.751 -32.996 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -8.014 -22.069 -33.291 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.238 -21.993 -33.207 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.173 -22.548 -31.798 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.422 -20.423 -32.112 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.678 -20.767 -30.532 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -8.695 -19.104 -31.165 1.00 0.00 H new ATOM 819 N ARG A 78 -6.660 -20.558 -28.882 1.00 0.00 N ATOM 820 CA ARG A 78 -6.710 -21.293 -27.601 1.00 0.00 C ATOM 821 C ARG A 78 -8.149 -21.369 -27.051 1.00 0.00 C ATOM 822 O ARG A 78 -8.384 -21.787 -25.917 1.00 0.00 O ATOM 823 CB ARG A 78 -5.679 -20.691 -26.575 1.00 0.00 C ATOM 824 CG ARG A 78 -5.202 -19.237 -26.859 1.00 0.00 C ATOM 825 CD ARG A 78 -6.285 -18.179 -26.613 1.00 0.00 C ATOM 826 NE ARG A 78 -6.612 -18.052 -25.177 1.00 0.00 N ATOM 827 CZ ARG A 78 -7.241 -17.023 -24.606 1.00 0.00 C ATOM 828 NH1 ARG A 78 -7.652 -15.996 -25.330 1.00 0.00 N ATOM 829 NH2 ARG A 78 -7.482 -17.046 -23.311 1.00 0.00 N ATOM 0 H ARG A 78 -7.180 -19.681 -28.862 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.407 -22.325 -27.777 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -6.128 -20.717 -25.582 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -4.804 -21.340 -26.547 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.340 -19.016 -26.229 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -4.867 -19.169 -27.894 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -5.946 -17.216 -26.995 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -7.185 -18.444 -27.169 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.331 -18.820 -24.568 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -7.489 -15.984 -26.337 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.132 -15.215 -24.882 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.188 -17.847 -22.752 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.962 -16.263 -22.868 1.00 0.00 H new ATOM 843 N LEU A 79 -9.123 -21.008 -27.904 1.00 0.00 N ATOM 844 CA LEU A 79 -10.553 -20.946 -27.552 1.00 0.00 C ATOM 845 C LEU A 79 -11.387 -21.686 -28.609 1.00 0.00 C ATOM 846 O LEU A 79 -11.225 -21.433 -29.806 1.00 0.00 O ATOM 847 CB LEU A 79 -10.996 -19.470 -27.491 1.00 0.00 C ATOM 848 CG LEU A 79 -10.198 -18.564 -26.514 1.00 0.00 C ATOM 849 CD1 LEU A 79 -10.471 -17.078 -26.787 1.00 0.00 C ATOM 850 CD2 LEU A 79 -10.499 -18.930 -25.053 1.00 0.00 C ATOM 0 H LEU A 79 -8.937 -20.747 -28.872 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.706 -21.420 -26.582 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -10.921 -19.046 -28.492 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -12.048 -19.438 -27.209 1.00 0.00 H new ATOM 0 HG LEU A 79 -9.136 -18.739 -26.687 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -9.899 -16.468 -26.088 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -10.174 -16.835 -27.807 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.534 -16.874 -26.660 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.927 -18.281 -24.390 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -11.564 -18.801 -24.858 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -10.220 -19.968 -24.873 1.00 0.00 H new ATOM 862 N CYS A 80 -12.269 -22.615 -28.164 1.00 0.00 N ATOM 863 CA CYS A 80 -13.224 -23.307 -29.062 1.00 0.00 C ATOM 864 C CYS A 80 -14.220 -22.273 -29.577 1.00 0.00 C ATOM 865 O CYS A 80 -14.418 -21.275 -28.895 1.00 0.00 O ATOM 866 CB CYS A 80 -13.954 -24.458 -28.325 1.00 0.00 C ATOM 867 SG CYS A 80 -15.163 -23.917 -27.079 1.00 0.00 S ATOM 0 H CYS A 80 -12.338 -22.902 -27.188 1.00 0.00 H new ATOM 0 HA CYS A 80 -12.686 -23.758 -29.896 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -14.465 -25.077 -29.063 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -13.210 -25.090 -27.839 1.00 0.00 H new ATOM 872 N ILE A 81 -14.876 -22.529 -30.729 1.00 0.00 N ATOM 873 CA ILE A 81 -15.692 -21.519 -31.469 1.00 0.00 C ATOM 874 C ILE A 81 -16.731 -20.814 -30.557 1.00 0.00 C ATOM 875 O ILE A 81 -17.066 -19.645 -30.770 1.00 0.00 O ATOM 876 CB ILE A 81 -16.415 -22.187 -32.699 1.00 0.00 C ATOM 877 CG1 ILE A 81 -17.141 -21.120 -33.592 1.00 0.00 C ATOM 878 CG2 ILE A 81 -17.395 -23.300 -32.244 1.00 0.00 C ATOM 879 CD1 ILE A 81 -17.894 -21.690 -34.784 1.00 0.00 C ATOM 0 H ILE A 81 -14.860 -23.443 -31.181 1.00 0.00 H new ATOM 0 HA ILE A 81 -15.002 -20.755 -31.827 1.00 0.00 H new ATOM 0 HB ILE A 81 -15.645 -22.655 -33.311 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.842 -20.563 -32.970 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.401 -20.407 -33.955 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.877 -23.740 -33.117 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -16.845 -24.072 -31.706 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -18.153 -22.872 -31.589 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.362 -20.878 -35.341 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -17.198 -22.221 -35.434 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.662 -22.380 -34.433 1.00 0.00 H new ATOM 891 N HIS A 82 -17.153 -21.533 -29.503 1.00 0.00 N ATOM 892 CA HIS A 82 -18.111 -21.050 -28.493 1.00 0.00 C ATOM 893 C HIS A 82 -17.431 -19.989 -27.598 1.00 0.00 C ATOM 894 O HIS A 82 -17.860 -18.839 -27.557 1.00 0.00 O ATOM 895 CB HIS A 82 -18.643 -22.244 -27.650 1.00 0.00 C ATOM 896 CG HIS A 82 -19.100 -23.411 -28.479 1.00 0.00 C ATOM 897 ND1 HIS A 82 -20.342 -23.478 -29.062 1.00 0.00 N ATOM 898 CD2 HIS A 82 -18.442 -24.527 -28.873 1.00 0.00 C ATOM 899 CE1 HIS A 82 -20.433 -24.579 -29.781 1.00 0.00 C ATOM 900 NE2 HIS A 82 -19.298 -25.237 -29.677 1.00 0.00 N ATOM 0 H HIS A 82 -16.832 -22.485 -29.326 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.963 -20.584 -28.989 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -17.858 -22.577 -26.971 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -19.473 -21.901 -27.033 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -17.434 -24.806 -28.605 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -21.292 -24.888 -30.357 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -19.088 -26.130 -30.122 1.00 0.00 H new ATOM 909 N CYS A 83 -16.311 -20.374 -26.933 1.00 0.00 N ATOM 910 CA CYS A 83 -15.549 -19.447 -26.060 1.00 0.00 C ATOM 911 C CYS A 83 -14.808 -18.380 -26.896 1.00 0.00 C ATOM 912 O CYS A 83 -14.366 -17.389 -26.351 1.00 0.00 O ATOM 913 CB CYS A 83 -14.516 -20.189 -25.180 1.00 0.00 C ATOM 914 SG CYS A 83 -15.173 -21.522 -24.137 1.00 0.00 S ATOM 0 H CYS A 83 -15.919 -21.314 -26.985 1.00 0.00 H new ATOM 0 HA CYS A 83 -16.283 -18.968 -25.411 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -13.748 -20.608 -25.830 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -14.025 -19.459 -24.536 1.00 0.00 H new ATOM 919 N GLN A 84 -14.634 -18.613 -28.214 1.00 0.00 N ATOM 920 CA GLN A 84 -13.863 -17.703 -29.086 1.00 0.00 C ATOM 921 C GLN A 84 -14.747 -16.519 -29.508 1.00 0.00 C ATOM 922 O GLN A 84 -14.336 -15.374 -29.365 1.00 0.00 O ATOM 923 CB GLN A 84 -13.298 -18.459 -30.339 1.00 0.00 C ATOM 924 CG GLN A 84 -11.960 -17.910 -30.918 1.00 0.00 C ATOM 925 CD GLN A 84 -11.967 -16.408 -31.230 1.00 0.00 C ATOM 926 OE1 GLN A 84 -12.377 -15.997 -32.311 1.00 0.00 O ATOM 927 NE2 GLN A 84 -11.524 -15.585 -30.280 1.00 0.00 N ATOM 0 H GLN A 84 -15.018 -19.425 -28.698 1.00 0.00 H new ATOM 0 HA GLN A 84 -13.009 -17.323 -28.526 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -13.154 -19.506 -30.073 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -14.051 -18.431 -31.127 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -11.160 -18.116 -30.207 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -11.723 -18.456 -31.831 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.190 -15.962 -29.393 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -11.519 -14.578 -30.440 1.00 0.00 H new ATOM 936 N GLN A 85 -15.968 -16.824 -30.000 1.00 0.00 N ATOM 937 CA GLN A 85 -16.882 -15.815 -30.591 1.00 0.00 C ATOM 938 C GLN A 85 -17.206 -14.670 -29.605 1.00 0.00 C ATOM 939 O GLN A 85 -17.366 -13.515 -30.017 1.00 0.00 O ATOM 940 CB GLN A 85 -18.192 -16.482 -31.096 1.00 0.00 C ATOM 941 CG GLN A 85 -19.017 -17.207 -30.015 1.00 0.00 C ATOM 942 CD GLN A 85 -20.278 -17.871 -30.559 1.00 0.00 C ATOM 943 OE1 GLN A 85 -21.361 -17.281 -30.560 1.00 0.00 O ATOM 944 NE2 GLN A 85 -20.138 -19.091 -31.052 1.00 0.00 N ATOM 0 H GLN A 85 -16.348 -17.770 -30.000 1.00 0.00 H new ATOM 0 HA GLN A 85 -16.360 -15.375 -31.441 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -18.817 -15.716 -31.555 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -17.939 -17.198 -31.878 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.393 -17.964 -29.539 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -19.297 -16.492 -29.241 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -19.226 -19.547 -31.034 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -20.942 -19.575 -31.451 1.00 0.00 H new ATOM 953 N GLU A 86 -17.283 -15.011 -28.300 1.00 0.00 N ATOM 954 CA GLU A 86 -17.517 -14.028 -27.220 1.00 0.00 C ATOM 955 C GLU A 86 -16.272 -13.128 -27.014 1.00 0.00 C ATOM 956 O GLU A 86 -16.411 -11.920 -26.826 1.00 0.00 O ATOM 957 CB GLU A 86 -17.920 -14.730 -25.890 1.00 0.00 C ATOM 958 CG GLU A 86 -16.864 -15.696 -25.328 1.00 0.00 C ATOM 959 CD GLU A 86 -17.213 -16.262 -23.944 1.00 0.00 C ATOM 960 OE1 GLU A 86 -16.957 -15.570 -22.928 1.00 0.00 O ATOM 961 OE2 GLU A 86 -17.749 -17.391 -23.861 1.00 0.00 O ATOM 0 H GLU A 86 -17.185 -15.970 -27.967 1.00 0.00 H new ATOM 0 HA GLU A 86 -18.350 -13.394 -27.525 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -18.129 -13.966 -25.141 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.847 -15.280 -26.052 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.734 -16.523 -26.026 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.907 -15.177 -25.267 1.00 0.00 H new ATOM 968 N LYS A 87 -15.054 -13.725 -27.081 1.00 0.00 N ATOM 969 CA LYS A 87 -13.785 -12.985 -26.874 1.00 0.00 C ATOM 970 C LYS A 87 -13.426 -12.148 -28.111 1.00 0.00 C ATOM 971 O LYS A 87 -12.686 -11.165 -28.004 1.00 0.00 O ATOM 972 CB LYS A 87 -12.610 -13.929 -26.523 1.00 0.00 C ATOM 973 CG LYS A 87 -12.861 -14.886 -25.341 1.00 0.00 C ATOM 974 CD LYS A 87 -13.416 -14.211 -24.073 1.00 0.00 C ATOM 975 CE LYS A 87 -13.587 -15.220 -22.919 1.00 0.00 C ATOM 976 NZ LYS A 87 -14.329 -14.646 -21.778 1.00 0.00 N ATOM 0 H LYS A 87 -14.926 -14.718 -27.277 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.947 -12.319 -26.026 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.368 -14.523 -27.404 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.733 -13.322 -26.297 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.560 -15.660 -25.660 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.925 -15.385 -25.090 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -12.743 -13.412 -23.761 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.377 -13.749 -24.298 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.113 -16.102 -23.285 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.605 -15.552 -22.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.008 -15.093 -20.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -14.155 -13.622 -21.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.347 -14.819 -21.904 1.00 0.00 H new ATOM 990 N ASP A 88 -13.941 -12.572 -29.283 1.00 0.00 N ATOM 991 CA ASP A 88 -13.750 -11.872 -30.561 1.00 0.00 C ATOM 992 C ASP A 88 -14.383 -10.467 -30.515 1.00 0.00 C ATOM 993 O ASP A 88 -13.895 -9.525 -31.151 1.00 0.00 O ATOM 994 CB ASP A 88 -14.312 -12.718 -31.736 1.00 0.00 C ATOM 995 CG ASP A 88 -13.923 -12.163 -33.119 1.00 0.00 C ATOM 996 OD1 ASP A 88 -12.774 -12.396 -33.561 1.00 0.00 O ATOM 997 OD2 ASP A 88 -14.746 -11.476 -33.766 1.00 0.00 O ATOM 0 H ASP A 88 -14.505 -13.418 -29.365 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.681 -11.742 -30.730 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -13.948 -13.741 -31.646 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -15.399 -12.759 -31.660 1.00 0.00 H new ATOM 1002 N LEU A 89 -15.453 -10.345 -29.716 1.00 0.00 N ATOM 1003 CA LEU A 89 -16.107 -9.058 -29.420 1.00 0.00 C ATOM 1004 C LEU A 89 -15.185 -8.191 -28.532 1.00 0.00 C ATOM 1005 O LEU A 89 -15.094 -6.971 -28.700 1.00 0.00 O ATOM 1006 CB LEU A 89 -17.458 -9.296 -28.680 1.00 0.00 C ATOM 1007 CG LEU A 89 -18.402 -10.384 -29.284 1.00 0.00 C ATOM 1008 CD1 LEU A 89 -19.700 -10.532 -28.456 1.00 0.00 C ATOM 1009 CD2 LEU A 89 -18.698 -10.118 -30.782 1.00 0.00 C ATOM 0 H LEU A 89 -15.893 -11.140 -29.253 1.00 0.00 H new ATOM 0 HA LEU A 89 -16.299 -8.542 -30.361 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.238 -9.570 -27.648 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.001 -8.352 -28.650 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.876 -11.337 -29.229 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -20.333 -11.297 -28.905 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.450 -10.821 -27.435 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -20.234 -9.582 -28.443 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -19.358 -10.896 -31.166 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.181 -9.147 -30.891 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -17.764 -10.124 -31.344 1.00 0.00 H new ATOM 1021 N GLN A 90 -14.488 -8.862 -27.599 1.00 0.00 N ATOM 1022 CA GLN A 90 -13.669 -8.212 -26.544 1.00 0.00 C ATOM 1023 C GLN A 90 -12.273 -7.827 -27.078 1.00 0.00 C ATOM 1024 O GLN A 90 -11.504 -7.140 -26.386 1.00 0.00 O ATOM 1025 CB GLN A 90 -13.550 -9.158 -25.304 1.00 0.00 C ATOM 1026 CG GLN A 90 -14.853 -9.912 -24.952 1.00 0.00 C ATOM 1027 CD GLN A 90 -16.061 -9.014 -24.663 1.00 0.00 C ATOM 1028 OE1 GLN A 90 -15.926 -7.917 -24.115 1.00 0.00 O ATOM 1029 NE2 GLN A 90 -17.250 -9.468 -25.042 1.00 0.00 N ATOM 0 H GLN A 90 -14.473 -9.881 -27.550 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.167 -7.292 -26.238 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.762 -9.887 -25.492 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.240 -8.569 -24.441 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -15.104 -10.579 -25.777 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.668 -10.539 -24.080 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -17.328 -10.380 -25.493 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -18.085 -8.905 -24.882 1.00 0.00 H new ATOM 1038 N LYS A 91 -11.947 -8.313 -28.291 1.00 0.00 N ATOM 1039 CA LYS A 91 -10.754 -7.895 -29.041 1.00 0.00 C ATOM 1040 C LYS A 91 -10.865 -6.389 -29.403 1.00 0.00 C ATOM 1041 O LYS A 91 -11.829 -5.999 -30.079 1.00 0.00 O ATOM 1042 CB LYS A 91 -10.599 -8.773 -30.318 1.00 0.00 C ATOM 1043 CG LYS A 91 -10.097 -10.215 -30.050 1.00 0.00 C ATOM 1044 CD LYS A 91 -10.239 -11.151 -31.276 1.00 0.00 C ATOM 1045 CE LYS A 91 -9.610 -10.598 -32.560 1.00 0.00 C ATOM 1046 NZ LYS A 91 -9.944 -11.436 -33.733 1.00 0.00 N ATOM 0 H LYS A 91 -12.509 -9.011 -28.778 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.865 -8.033 -28.425 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.562 -8.826 -30.826 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.905 -8.281 -31.000 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -9.050 -10.178 -29.749 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.654 -10.637 -29.213 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.778 -12.111 -31.042 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.297 -11.340 -31.455 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -9.960 -9.579 -32.728 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.527 -10.548 -32.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.841 -10.874 -34.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.301 -12.253 -33.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.925 -11.771 -33.652 1.00 0.00 H new ATOM 1060 N PRO A 92 -9.891 -5.527 -28.943 1.00 0.00 N ATOM 1061 CA PRO A 92 -10.010 -4.052 -29.048 1.00 0.00 C ATOM 1062 C PRO A 92 -10.004 -3.540 -30.504 1.00 0.00 C ATOM 1063 O PRO A 92 -10.605 -2.492 -30.798 1.00 0.00 O ATOM 1064 CB PRO A 92 -8.771 -3.541 -28.259 1.00 0.00 C ATOM 1065 CG PRO A 92 -7.779 -4.659 -28.350 1.00 0.00 C ATOM 1066 CD PRO A 92 -8.603 -5.923 -28.302 1.00 0.00 C ATOM 0 HA PRO A 92 -10.960 -3.692 -28.654 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -8.375 -2.623 -28.694 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.025 -3.319 -27.222 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -7.202 -4.600 -29.273 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.067 -4.622 -27.526 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.120 -6.737 -28.842 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.753 -6.265 -27.278 1.00 0.00 H new ATOM 1074 N ALA A 93 -9.323 -4.300 -31.397 1.00 0.00 N ATOM 1075 CA ALA A 93 -9.104 -3.931 -32.816 1.00 0.00 C ATOM 1076 C ALA A 93 -8.225 -2.662 -32.953 1.00 0.00 C ATOM 1077 O ALA A 93 -8.255 -1.968 -33.982 1.00 0.00 O ATOM 1078 CB ALA A 93 -10.443 -3.803 -33.576 1.00 0.00 C ATOM 0 H ALA A 93 -8.906 -5.197 -31.148 1.00 0.00 H new ATOM 0 HA ALA A 93 -8.548 -4.743 -33.285 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -10.248 -3.532 -34.613 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -10.972 -4.755 -33.543 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -11.055 -3.032 -33.108 1.00 0.00 H new ATOM 1084 N TYR A 94 -7.434 -2.381 -31.901 1.00 0.00 N ATOM 1085 CA TYR A 94 -6.419 -1.313 -31.889 1.00 0.00 C ATOM 1086 C TYR A 94 -5.331 -1.669 -30.865 1.00 0.00 C ATOM 1087 O TYR A 94 -5.501 -2.593 -30.052 1.00 0.00 O ATOM 1088 CB TYR A 94 -7.039 0.093 -31.580 1.00 0.00 C ATOM 1089 CG TYR A 94 -7.525 0.322 -30.126 1.00 0.00 C ATOM 1090 CD1 TYR A 94 -8.809 -0.046 -29.716 1.00 0.00 C ATOM 1091 CD2 TYR A 94 -6.674 0.876 -29.154 1.00 0.00 C ATOM 1092 CE1 TYR A 94 -9.240 0.170 -28.417 1.00 0.00 C ATOM 1093 CE2 TYR A 94 -7.101 1.089 -27.857 1.00 0.00 C ATOM 1094 CZ TYR A 94 -8.373 0.714 -27.486 1.00 0.00 C ATOM 1095 OH TYR A 94 -8.799 0.930 -26.191 1.00 0.00 O ATOM 0 H TYR A 94 -7.483 -2.898 -31.023 1.00 0.00 H new ATOM 0 HA TYR A 94 -5.981 -1.244 -32.885 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -6.296 0.855 -31.817 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -7.883 0.251 -32.252 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -9.479 -0.508 -30.426 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -5.663 1.141 -29.427 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -10.250 -0.086 -28.132 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -6.440 1.548 -27.137 1.00 0.00 H new ATOM 0 HH TYR A 94 -8.067 1.316 -25.666 1.00 0.00 H new ATOM 1105 N THR A 95 -4.216 -0.925 -30.909 1.00 0.00 N ATOM 1106 CA THR A 95 -3.135 -1.026 -29.923 1.00 0.00 C ATOM 1107 C THR A 95 -2.989 0.317 -29.173 1.00 0.00 C ATOM 1108 O THR A 95 -2.972 0.355 -27.935 1.00 0.00 O ATOM 1109 CB THR A 95 -1.780 -1.413 -30.608 1.00 0.00 C ATOM 1110 OG1 THR A 95 -1.445 -0.452 -31.624 1.00 0.00 O ATOM 1111 CG2 THR A 95 -1.820 -2.817 -31.242 1.00 0.00 C ATOM 0 H THR A 95 -4.040 -0.232 -31.636 1.00 0.00 H new ATOM 0 HA THR A 95 -3.388 -1.813 -29.212 1.00 0.00 H new ATOM 0 HB THR A 95 -1.023 -1.418 -29.824 1.00 0.00 H new ATOM 0 HG1 THR A 95 -0.596 -0.703 -32.044 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.857 -3.036 -31.703 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.030 -3.558 -30.471 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.602 -2.851 -32.001 1.00 0.00 H new ATOM 1119 N GLY A 96 -2.900 1.423 -29.955 1.00 0.00 N ATOM 1120 CA GLY A 96 -2.584 2.753 -29.412 1.00 0.00 C ATOM 1121 C GLY A 96 -1.209 2.774 -28.744 1.00 0.00 C ATOM 1122 O GLY A 96 -0.978 3.507 -27.776 1.00 0.00 O ATOM 0 H GLY A 96 -3.044 1.411 -30.965 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -2.611 3.490 -30.214 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.346 3.042 -28.688 1.00 0.00 H new ATOM 1126 N TYR A 97 -0.303 1.949 -29.287 1.00 0.00 N ATOM 1127 CA TYR A 97 1.001 1.632 -28.676 1.00 0.00 C ATOM 1128 C TYR A 97 2.123 2.556 -29.176 1.00 0.00 C ATOM 1129 O TYR A 97 1.997 3.211 -30.224 1.00 0.00 O ATOM 1130 CB TYR A 97 1.363 0.131 -28.953 1.00 0.00 C ATOM 1131 CG TYR A 97 1.236 -0.800 -27.737 1.00 0.00 C ATOM 1132 CD1 TYR A 97 0.018 -1.384 -27.383 1.00 0.00 C ATOM 1133 CD2 TYR A 97 2.349 -1.106 -26.954 1.00 0.00 C ATOM 1134 CE1 TYR A 97 -0.081 -2.233 -26.298 1.00 0.00 C ATOM 1135 CE2 TYR A 97 2.255 -1.956 -25.873 1.00 0.00 C ATOM 1136 CZ TYR A 97 1.039 -2.518 -25.549 1.00 0.00 C ATOM 1137 OH TYR A 97 0.945 -3.378 -24.475 1.00 0.00 O ATOM 0 H TYR A 97 -0.455 1.474 -30.177 1.00 0.00 H new ATOM 0 HA TYR A 97 0.912 1.797 -27.602 1.00 0.00 H new ATOM 0 HB2 TYR A 97 0.717 -0.243 -29.747 1.00 0.00 H new ATOM 0 HB3 TYR A 97 2.387 0.082 -29.325 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -0.863 -1.168 -27.969 1.00 0.00 H new ATOM 0 HD2 TYR A 97 3.305 -0.668 -27.200 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -1.033 -2.672 -26.038 1.00 0.00 H new ATOM 0 HE2 TYR A 97 3.131 -2.181 -25.282 1.00 0.00 H new ATOM 0 HH TYR A 97 1.825 -3.473 -24.054 1.00 0.00 H new ATOM 1147 N ASN A 98 3.217 2.571 -28.396 1.00 0.00 N ATOM 1148 CA ASN A 98 4.479 3.224 -28.759 1.00 0.00 C ATOM 1149 C ASN A 98 5.615 2.436 -28.090 1.00 0.00 C ATOM 1150 O ASN A 98 5.898 2.615 -26.903 1.00 0.00 O ATOM 1151 CB ASN A 98 4.484 4.722 -28.322 1.00 0.00 C ATOM 1152 CG ASN A 98 5.682 5.535 -28.854 1.00 0.00 C ATOM 1153 OD1 ASN A 98 6.773 5.010 -29.090 1.00 0.00 O ATOM 1154 ND2 ASN A 98 5.490 6.835 -29.037 1.00 0.00 N ATOM 0 H ASN A 98 3.246 2.121 -27.481 1.00 0.00 H new ATOM 0 HA ASN A 98 4.611 3.222 -29.841 1.00 0.00 H new ATOM 0 HB2 ASN A 98 3.561 5.191 -28.664 1.00 0.00 H new ATOM 0 HB3 ASN A 98 4.482 4.771 -27.233 1.00 0.00 H new ATOM 0 HD21 ASN A 98 6.252 7.420 -29.379 1.00 0.00 H new ATOM 0 HD22 ASN A 98 4.580 7.249 -28.836 1.00 0.00 H new ATOM 1161 N ARG A 99 6.204 1.500 -28.844 1.00 0.00 N ATOM 1162 CA ARG A 99 7.376 0.725 -28.423 1.00 0.00 C ATOM 1163 C ARG A 99 8.515 1.002 -29.413 1.00 0.00 C ATOM 1164 O ARG A 99 8.645 0.326 -30.443 1.00 0.00 O ATOM 1165 CB ARG A 99 7.050 -0.803 -28.337 1.00 0.00 C ATOM 1166 CG ARG A 99 6.018 -1.188 -27.247 1.00 0.00 C ATOM 1167 CD ARG A 99 6.466 -0.779 -25.831 1.00 0.00 C ATOM 1168 NE ARG A 99 5.523 -1.222 -24.780 1.00 0.00 N ATOM 1169 CZ ARG A 99 5.557 -0.822 -23.499 1.00 0.00 C ATOM 1170 NH1 ARG A 99 6.455 0.072 -23.086 1.00 0.00 N ATOM 1171 NH2 ARG A 99 4.687 -1.320 -22.630 1.00 0.00 N ATOM 0 H ARG A 99 5.874 1.257 -29.778 1.00 0.00 H new ATOM 0 HA ARG A 99 7.679 1.031 -27.421 1.00 0.00 H new ATOM 0 HB2 ARG A 99 6.675 -1.135 -29.305 1.00 0.00 H new ATOM 0 HB3 ARG A 99 7.975 -1.347 -28.149 1.00 0.00 H new ATOM 0 HG2 ARG A 99 5.063 -0.713 -27.473 1.00 0.00 H new ATOM 0 HG3 ARG A 99 5.852 -2.265 -27.274 1.00 0.00 H new ATOM 0 HD2 ARG A 99 7.451 -1.201 -25.630 1.00 0.00 H new ATOM 0 HD3 ARG A 99 6.569 0.305 -25.787 1.00 0.00 H new ATOM 0 HE ARG A 99 4.792 -1.881 -25.049 1.00 0.00 H new ATOM 0 HH11 ARG A 99 7.128 0.461 -23.746 1.00 0.00 H new ATOM 0 HH12 ARG A 99 6.469 0.367 -22.110 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.995 -2.004 -22.936 1.00 0.00 H new ATOM 0 HH22 ARG A 99 4.710 -1.019 -21.656 1.00 0.00 H new ATOM 1185 N ARG A 100 9.290 2.053 -29.112 1.00 0.00 N ATOM 1186 CA ARG A 100 10.456 2.451 -29.914 1.00 0.00 C ATOM 1187 C ARG A 100 11.568 1.381 -29.813 1.00 0.00 C ATOM 1188 O ARG A 100 12.017 1.030 -28.712 1.00 0.00 O ATOM 1189 CB ARG A 100 10.968 3.859 -29.488 1.00 0.00 C ATOM 1190 CG ARG A 100 11.229 4.040 -27.969 1.00 0.00 C ATOM 1191 CD ARG A 100 11.866 5.403 -27.632 1.00 0.00 C ATOM 1192 NE ARG A 100 13.194 5.568 -28.261 1.00 0.00 N ATOM 1193 CZ ARG A 100 13.916 6.696 -28.279 1.00 0.00 C ATOM 1194 NH1 ARG A 100 13.437 7.830 -27.780 1.00 0.00 N ATOM 1195 NH2 ARG A 100 15.118 6.691 -28.825 1.00 0.00 N ATOM 0 H ARG A 100 9.126 2.653 -28.304 1.00 0.00 H new ATOM 0 HA ARG A 100 10.155 2.520 -30.959 1.00 0.00 H new ATOM 0 HB2 ARG A 100 11.892 4.069 -30.026 1.00 0.00 H new ATOM 0 HB3 ARG A 100 10.238 4.604 -29.805 1.00 0.00 H new ATOM 0 HG2 ARG A 100 10.288 3.940 -27.429 1.00 0.00 H new ATOM 0 HG3 ARG A 100 11.884 3.242 -27.619 1.00 0.00 H new ATOM 0 HD2 ARG A 100 11.206 6.203 -27.966 1.00 0.00 H new ATOM 0 HD3 ARG A 100 11.963 5.500 -26.551 1.00 0.00 H new ATOM 0 HE ARG A 100 13.595 4.751 -28.722 1.00 0.00 H new ATOM 0 HH11 ARG A 100 12.502 7.853 -27.373 1.00 0.00 H new ATOM 0 HH12 ARG A 100 14.004 8.677 -27.804 1.00 0.00 H new ATOM 0 HH21 ARG A 100 15.491 5.832 -29.229 1.00 0.00 H new ATOM 0 HH22 ARG A 100 15.674 7.546 -28.842 1.00 0.00 H new ATOM 1209 N GLY A 101 11.955 0.833 -30.974 1.00 0.00 N ATOM 1210 CA GLY A 101 12.974 -0.210 -31.066 1.00 0.00 C ATOM 1211 C GLY A 101 12.933 -0.902 -32.419 1.00 0.00 C ATOM 1212 O GLY A 101 11.851 -1.120 -32.983 1.00 0.00 O ATOM 0 H GLY A 101 11.565 1.105 -31.876 1.00 0.00 H new ATOM 0 HA2 GLY A 101 13.960 0.227 -30.908 1.00 0.00 H new ATOM 0 HA3 GLY A 101 12.820 -0.944 -30.275 1.00 0.00 H new ATOM 1216 N SER A 102 14.117 -1.235 -32.949 1.00 0.00 N ATOM 1217 CA SER A 102 14.269 -1.964 -34.219 1.00 0.00 C ATOM 1218 C SER A 102 14.623 -3.427 -33.915 1.00 0.00 C ATOM 1219 O SER A 102 15.106 -3.746 -32.819 1.00 0.00 O ATOM 1220 CB SER A 102 15.353 -1.298 -35.105 1.00 0.00 C ATOM 1221 OG SER A 102 15.485 -1.951 -36.361 1.00 0.00 O ATOM 0 H SER A 102 15.006 -1.005 -32.505 1.00 0.00 H new ATOM 0 HA SER A 102 13.331 -1.932 -34.774 1.00 0.00 H new ATOM 0 HB2 SER A 102 15.098 -0.251 -35.265 1.00 0.00 H new ATOM 0 HB3 SER A 102 16.310 -1.317 -34.584 1.00 0.00 H new ATOM 0 HG SER A 102 16.176 -1.502 -36.892 1.00 0.00 H new ATOM 1227 N LYS A 103 14.401 -4.293 -34.903 1.00 0.00 N ATOM 1228 CA LYS A 103 14.511 -5.753 -34.749 1.00 0.00 C ATOM 1229 C LYS A 103 14.880 -6.385 -36.110 1.00 0.00 C ATOM 1230 O LYS A 103 14.909 -5.692 -37.130 1.00 0.00 O ATOM 1231 CB LYS A 103 13.144 -6.292 -34.204 1.00 0.00 C ATOM 1232 CG LYS A 103 13.101 -7.803 -33.893 1.00 0.00 C ATOM 1233 CD LYS A 103 11.725 -8.271 -33.369 1.00 0.00 C ATOM 1234 CE LYS A 103 11.649 -9.800 -33.210 1.00 0.00 C ATOM 1235 NZ LYS A 103 11.836 -10.488 -34.511 1.00 0.00 N ATOM 0 H LYS A 103 14.137 -4.003 -35.845 1.00 0.00 H new ATOM 0 HA LYS A 103 15.297 -6.018 -34.042 1.00 0.00 H new ATOM 0 HB2 LYS A 103 12.894 -5.745 -33.295 1.00 0.00 H new ATOM 0 HB3 LYS A 103 12.367 -6.067 -34.935 1.00 0.00 H new ATOM 0 HG2 LYS A 103 13.349 -8.362 -34.795 1.00 0.00 H new ATOM 0 HG3 LYS A 103 13.865 -8.038 -33.152 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.525 -7.798 -32.408 1.00 0.00 H new ATOM 0 HD3 LYS A 103 10.946 -7.940 -34.056 1.00 0.00 H new ATOM 0 HE2 LYS A 103 12.413 -10.133 -32.507 1.00 0.00 H new ATOM 0 HE3 LYS A 103 10.684 -10.076 -32.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 11.517 -11.475 -34.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 11.280 -10.002 -35.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 12.843 -10.470 -34.772 1.00 0.00 H new ATOM 1249 N ASP A 104 15.217 -7.683 -36.120 1.00 0.00 N ATOM 1250 CA ASP A 104 15.307 -8.473 -37.359 1.00 0.00 C ATOM 1251 C ASP A 104 13.905 -8.990 -37.715 1.00 0.00 C ATOM 1252 O ASP A 104 13.439 -10.008 -37.178 1.00 0.00 O ATOM 1253 CB ASP A 104 16.327 -9.637 -37.208 1.00 0.00 C ATOM 1254 CG ASP A 104 17.782 -9.153 -37.131 1.00 0.00 C ATOM 1255 OD1 ASP A 104 18.183 -8.618 -36.081 1.00 0.00 O ATOM 1256 OD2 ASP A 104 18.525 -9.285 -38.124 1.00 0.00 O ATOM 0 H ASP A 104 15.434 -8.213 -35.276 1.00 0.00 H new ATOM 0 HA ASP A 104 15.672 -7.843 -38.171 1.00 0.00 H new ATOM 0 HB2 ASP A 104 16.091 -10.205 -36.308 1.00 0.00 H new ATOM 0 HB3 ASP A 104 16.221 -10.318 -38.052 1.00 0.00 H new ATOM 1261 N SER A 105 13.214 -8.218 -38.561 1.00 0.00 N ATOM 1262 CA SER A 105 11.924 -8.577 -39.154 1.00 0.00 C ATOM 1263 C SER A 105 12.065 -8.486 -40.688 1.00 0.00 C ATOM 1264 O SER A 105 11.599 -7.533 -41.334 1.00 0.00 O ATOM 1265 CB SER A 105 10.805 -7.663 -38.585 1.00 0.00 C ATOM 1266 OG SER A 105 11.124 -6.294 -38.733 1.00 0.00 O ATOM 0 H SER A 105 13.547 -7.301 -38.859 1.00 0.00 H new ATOM 0 HA SER A 105 11.636 -9.597 -38.899 1.00 0.00 H new ATOM 0 HB2 SER A 105 9.866 -7.875 -39.096 1.00 0.00 H new ATOM 0 HB3 SER A 105 10.652 -7.889 -37.530 1.00 0.00 H new ATOM 0 HG SER A 105 11.356 -6.111 -39.668 1.00 0.00 H new ATOM 1272 N GLN A 106 12.778 -9.485 -41.236 1.00 0.00 N ATOM 1273 CA GLN A 106 13.205 -9.535 -42.646 1.00 0.00 C ATOM 1274 C GLN A 106 13.394 -11.003 -43.085 1.00 0.00 C ATOM 1275 O GLN A 106 13.053 -11.925 -42.332 1.00 0.00 O ATOM 1276 CB GLN A 106 14.511 -8.698 -42.809 1.00 0.00 C ATOM 1277 CG GLN A 106 15.656 -9.089 -41.847 1.00 0.00 C ATOM 1278 CD GLN A 106 16.823 -8.093 -41.833 1.00 0.00 C ATOM 1279 OE1 GLN A 106 17.126 -7.447 -42.842 1.00 0.00 O ATOM 1280 NE2 GLN A 106 17.483 -7.953 -40.689 1.00 0.00 N ATOM 0 H GLN A 106 13.080 -10.298 -40.700 1.00 0.00 H new ATOM 0 HA GLN A 106 12.442 -9.102 -43.293 1.00 0.00 H new ATOM 0 HB2 GLN A 106 14.866 -8.801 -43.834 1.00 0.00 H new ATOM 0 HB3 GLN A 106 14.272 -7.645 -42.658 1.00 0.00 H new ATOM 0 HG2 GLN A 106 15.255 -9.178 -40.837 1.00 0.00 H new ATOM 0 HG3 GLN A 106 16.034 -10.072 -42.128 1.00 0.00 H new ATOM 0 HE21 GLN A 106 17.210 -8.500 -39.872 1.00 0.00 H new ATOM 0 HE22 GLN A 106 18.263 -7.299 -40.627 1.00 0.00 H new ATOM 1289 N LEU A 107 13.913 -11.217 -44.307 1.00 0.00 N ATOM 1290 CA LEU A 107 14.090 -12.561 -44.889 1.00 0.00 C ATOM 1291 C LEU A 107 15.455 -12.661 -45.616 1.00 0.00 C ATOM 1292 O LEU A 107 15.531 -12.975 -46.809 1.00 0.00 O ATOM 1293 CB LEU A 107 12.884 -12.920 -45.833 1.00 0.00 C ATOM 1294 CG LEU A 107 12.626 -11.991 -47.090 1.00 0.00 C ATOM 1295 CD1 LEU A 107 11.744 -12.709 -48.144 1.00 0.00 C ATOM 1296 CD2 LEU A 107 12.003 -10.623 -46.696 1.00 0.00 C ATOM 0 H LEU A 107 14.222 -10.463 -44.920 1.00 0.00 H new ATOM 0 HA LEU A 107 14.097 -13.297 -44.085 1.00 0.00 H new ATOM 0 HB2 LEU A 107 13.033 -13.938 -46.194 1.00 0.00 H new ATOM 0 HB3 LEU A 107 11.977 -12.926 -45.229 1.00 0.00 H new ATOM 0 HG LEU A 107 13.600 -11.787 -47.534 1.00 0.00 H new ATOM 0 HD11 LEU A 107 11.583 -12.048 -48.995 1.00 0.00 H new ATOM 0 HD12 LEU A 107 12.245 -13.617 -48.479 1.00 0.00 H new ATOM 0 HD13 LEU A 107 10.783 -12.967 -47.699 1.00 0.00 H new ATOM 0 HD21 LEU A 107 11.846 -10.023 -47.592 1.00 0.00 H new ATOM 0 HD22 LEU A 107 11.048 -10.788 -46.198 1.00 0.00 H new ATOM 0 HD23 LEU A 107 12.678 -10.097 -46.021 1.00 0.00 H new ATOM 1308 N ARG A 108 16.550 -12.361 -44.891 1.00 0.00 N ATOM 1309 CA ARG A 108 17.926 -12.521 -45.418 1.00 0.00 C ATOM 1310 C ARG A 108 18.791 -13.349 -44.429 1.00 0.00 C ATOM 1311 O ARG A 108 19.516 -14.255 -44.873 1.00 0.00 O ATOM 1312 CB ARG A 108 18.559 -11.127 -45.766 1.00 0.00 C ATOM 1313 CG ARG A 108 18.775 -10.134 -44.579 1.00 0.00 C ATOM 1314 CD ARG A 108 20.154 -10.266 -43.901 1.00 0.00 C ATOM 1315 NE ARG A 108 20.272 -9.419 -42.700 1.00 0.00 N ATOM 1316 CZ ARG A 108 20.020 -9.813 -41.443 1.00 0.00 C ATOM 1317 NH1 ARG A 108 19.541 -11.030 -41.179 1.00 0.00 N ATOM 1318 NH2 ARG A 108 20.221 -8.966 -40.446 1.00 0.00 N ATOM 1319 OXT ARG A 108 18.713 -13.114 -43.202 1.00 0.00 O ATOM 0 H ARG A 108 16.511 -12.005 -43.936 1.00 0.00 H new ATOM 0 HA ARG A 108 17.888 -13.082 -46.352 1.00 0.00 H new ATOM 0 HB2 ARG A 108 19.524 -11.302 -46.242 1.00 0.00 H new ATOM 0 HB3 ARG A 108 17.922 -10.640 -46.505 1.00 0.00 H new ATOM 0 HG2 ARG A 108 18.656 -9.114 -44.944 1.00 0.00 H new ATOM 0 HG3 ARG A 108 17.997 -10.298 -43.834 1.00 0.00 H new ATOM 0 HD2 ARG A 108 20.323 -11.307 -43.626 1.00 0.00 H new ATOM 0 HD3 ARG A 108 20.933 -9.994 -44.613 1.00 0.00 H new ATOM 0 HE ARG A 108 20.570 -8.453 -42.836 1.00 0.00 H new ATOM 0 HH11 ARG A 108 19.359 -11.683 -41.941 1.00 0.00 H new ATOM 0 HH12 ARG A 108 19.357 -11.308 -40.215 1.00 0.00 H new ATOM 0 HH21 ARG A 108 20.564 -8.025 -40.638 1.00 0.00 H new ATOM 0 HH22 ARG A 108 20.033 -9.255 -39.486 1.00 0.00 H new TER 1333 ARG A 108 HETATM 1334 ZN ZN A 109 -14.442 -23.625 -24.833 1.00 0.00 ZN