USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1036 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 65 THR OG1 : rot 88:sc= -2.12! USER MOD Set 1.2: A 68 ASN : amide:sc= -0.0283 K(o=-4.3,f=-5.1) USER MOD Set 1.3: A 72 LYS NZ :NH3+ -167:sc= -0.355 (180deg=-0.663) USER MOD Set 1.4: A 118 SER OG : rot 180:sc= -1.51 USER MOD Set 1.5: A 122 LYS NZ :NH3+ 172:sc= -0.241 (180deg=-0.374) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= -0.0703 (180deg=-0.16) USER MOD Single : A 2 MET CE :methyl 152:sc= -0.0136 (180deg=-0.909) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 94:sc= 1.41 USER MOD Single : A 14 LYS NZ :NH3+ -155:sc=-0.00687 (180deg=-0.319) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.0307 X(o=-0.031,f=0) USER MOD Single : A 21 ASN : amide:sc= -2.35! C(o=-2.3!,f=-8.5!) USER MOD Single : A 23 THR OG1 : rot 116:sc= 1.14 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.0565 X(o=-0.057,f=-0.42) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc= -0.0155 X(o=-0.015,f=0) USER MOD Single : A 45 HIS : no HD1:sc= -2.57! C(o=-2.6!,f=-1.2!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 147:sc= -1.54! (180deg=-1.98!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -140:sc= -3.32 (180deg=-9.67!) USER MOD Single : A 57 SER OG : rot 102:sc= 0.167 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -128:sc= -6.44! (180deg=-8.12!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 82:sc= -3.7! USER MOD Single : A 64 HIS : no HD1:sc= -2.9! C(o=-2.9!,f=-2.2!) USER MOD Single : A 75 ASN : amide:sc= -1.08! C(o=-1.1!,f=-5.1!) USER MOD Single : A 76 SER OG : rot 82:sc= 0.982 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.0564 USER MOD Single : A 82 SER OG : rot 117:sc= -0.589 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl -156:sc= -0.329 (180deg=-1.48!) USER MOD Single : A 96 THR OG1 : rot 88:sc= 0.445 USER MOD Single : A 98 MET CE :methyl -132:sc= -4.07 (180deg=-8.76!) USER MOD Single : A 101 LYS NZ :NH3+ -108:sc= -1.64! (180deg=-3.78!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 161:sc= 0.462 USER MOD Single : A 113 ASN : amide:sc= -2.97! K(o=-3!,f=-2.2) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 116:sc= 1.1 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ -152:sc= -0.0153 (180deg=-1.06!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.401 -27.962 -5.878 1.00 0.00 N ATOM 2 CA MET A 1 6.669 -28.726 -5.690 1.00 0.00 C ATOM 3 C MET A 1 7.283 -28.401 -4.328 1.00 0.00 C ATOM 4 O MET A 1 8.109 -29.132 -3.818 1.00 0.00 O ATOM 5 CB MET A 1 7.587 -28.253 -6.817 1.00 0.00 C ATOM 6 CG MET A 1 8.307 -29.456 -7.426 1.00 0.00 C ATOM 7 SD MET A 1 7.903 -29.575 -9.186 1.00 0.00 S ATOM 8 CE MET A 1 6.479 -30.679 -9.017 1.00 0.00 C ATOM 0 H1 MET A 1 4.915 -28.301 -6.733 1.00 0.00 H new ATOM 0 H2 MET A 1 4.786 -28.102 -5.051 1.00 0.00 H new ATOM 0 H3 MET A 1 5.617 -26.950 -5.981 1.00 0.00 H new ATOM 0 HA MET A 1 6.510 -29.804 -5.719 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.006 -27.738 -7.582 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.313 -27.537 -6.433 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.384 -29.353 -7.296 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.010 -30.370 -6.911 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.063 -30.890 -10.002 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.795 -31.611 -8.549 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.720 -30.201 -8.398 1.00 0.00 H new ATOM 20 N MET A 2 6.889 -27.309 -3.735 1.00 0.00 N ATOM 21 CA MET A 2 7.452 -26.940 -2.406 1.00 0.00 C ATOM 22 C MET A 2 6.574 -25.880 -1.738 1.00 0.00 C ATOM 23 O MET A 2 6.160 -24.921 -2.358 1.00 0.00 O ATOM 24 CB MET A 2 8.838 -26.375 -2.707 1.00 0.00 C ATOM 25 CG MET A 2 8.725 -25.329 -3.813 1.00 0.00 C ATOM 26 SD MET A 2 10.088 -24.145 -3.669 1.00 0.00 S ATOM 27 CE MET A 2 11.440 -25.347 -3.717 1.00 0.00 C ATOM 0 H MET A 2 6.202 -26.656 -4.113 1.00 0.00 H new ATOM 0 HA MET A 2 7.498 -27.790 -1.725 1.00 0.00 H new ATOM 0 HB2 MET A 2 9.264 -25.927 -1.809 1.00 0.00 H new ATOM 0 HB3 MET A 2 9.511 -27.175 -3.014 1.00 0.00 H new ATOM 0 HG2 MET A 2 8.752 -25.813 -4.789 1.00 0.00 H new ATOM 0 HG3 MET A 2 7.769 -24.810 -3.740 1.00 0.00 H new ATOM 0 HE1 MET A 2 12.331 -24.876 -4.131 1.00 0.00 H new ATOM 0 HE2 MET A 2 11.651 -25.698 -2.707 1.00 0.00 H new ATOM 0 HE3 MET A 2 11.153 -26.193 -4.342 1.00 0.00 H new ATOM 37 N GLU A 3 6.289 -26.045 -0.477 1.00 0.00 N ATOM 38 CA GLU A 3 5.438 -25.046 0.232 1.00 0.00 C ATOM 39 C GLU A 3 6.293 -23.918 0.782 1.00 0.00 C ATOM 40 O GLU A 3 5.798 -22.977 1.373 1.00 0.00 O ATOM 41 CB GLU A 3 4.806 -25.801 1.393 1.00 0.00 C ATOM 42 CG GLU A 3 5.907 -26.407 2.267 1.00 0.00 C ATOM 43 CD GLU A 3 5.307 -26.866 3.596 1.00 0.00 C ATOM 44 OE1 GLU A 3 4.196 -26.458 3.893 1.00 0.00 O ATOM 45 OE2 GLU A 3 5.965 -27.621 4.292 1.00 0.00 O ATOM 0 H GLU A 3 6.608 -26.828 0.094 1.00 0.00 H new ATOM 0 HA GLU A 3 4.697 -24.610 -0.438 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.187 -25.127 1.985 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.152 -26.587 1.016 1.00 0.00 H new ATOM 0 HG2 GLU A 3 6.370 -27.250 1.754 1.00 0.00 H new ATOM 0 HG3 GLU A 3 6.692 -25.671 2.445 1.00 0.00 H new ATOM 52 N GLU A 4 7.570 -24.009 0.619 1.00 0.00 N ATOM 53 CA GLU A 4 8.441 -22.945 1.166 1.00 0.00 C ATOM 54 C GLU A 4 8.450 -21.734 0.239 1.00 0.00 C ATOM 55 O GLU A 4 9.027 -20.708 0.540 1.00 0.00 O ATOM 56 CB GLU A 4 9.831 -23.567 1.257 1.00 0.00 C ATOM 57 CG GLU A 4 9.779 -24.793 2.168 1.00 0.00 C ATOM 58 CD GLU A 4 10.567 -25.937 1.528 1.00 0.00 C ATOM 59 OE1 GLU A 4 10.749 -25.901 0.322 1.00 0.00 O ATOM 60 OE2 GLU A 4 10.975 -26.829 2.253 1.00 0.00 O ATOM 0 H GLU A 4 8.050 -24.767 0.134 1.00 0.00 H new ATOM 0 HA GLU A 4 8.093 -22.593 2.137 1.00 0.00 H new ATOM 0 HB2 GLU A 4 10.180 -23.852 0.264 1.00 0.00 H new ATOM 0 HB3 GLU A 4 10.542 -22.839 1.648 1.00 0.00 H new ATOM 0 HG2 GLU A 4 10.197 -24.551 3.145 1.00 0.00 H new ATOM 0 HG3 GLU A 4 8.744 -25.096 2.330 1.00 0.00 H new ATOM 67 N TYR A 5 7.808 -21.845 -0.884 1.00 0.00 N ATOM 68 CA TYR A 5 7.771 -20.697 -1.832 1.00 0.00 C ATOM 69 C TYR A 5 6.792 -19.646 -1.327 1.00 0.00 C ATOM 70 O TYR A 5 6.981 -18.458 -1.501 1.00 0.00 O ATOM 71 CB TYR A 5 7.306 -21.286 -3.165 1.00 0.00 C ATOM 72 CG TYR A 5 7.910 -20.491 -4.297 1.00 0.00 C ATOM 73 CD1 TYR A 5 9.202 -20.787 -4.749 1.00 0.00 C ATOM 74 CD2 TYR A 5 7.178 -19.458 -4.893 1.00 0.00 C ATOM 75 CE1 TYR A 5 9.763 -20.048 -5.797 1.00 0.00 C ATOM 76 CE2 TYR A 5 7.739 -18.718 -5.942 1.00 0.00 C ATOM 77 CZ TYR A 5 9.031 -19.013 -6.395 1.00 0.00 C ATOM 78 OH TYR A 5 9.584 -18.283 -7.427 1.00 0.00 O ATOM 0 H TYR A 5 7.306 -22.679 -1.190 1.00 0.00 H new ATOM 0 HA TYR A 5 8.740 -20.208 -1.934 1.00 0.00 H new ATOM 0 HB2 TYR A 5 7.606 -22.331 -3.239 1.00 0.00 H new ATOM 0 HB3 TYR A 5 6.218 -21.261 -3.227 1.00 0.00 H new ATOM 0 HD1 TYR A 5 9.765 -21.585 -4.289 1.00 0.00 H new ATOM 0 HD2 TYR A 5 6.181 -19.231 -4.545 1.00 0.00 H new ATOM 0 HE1 TYR A 5 10.760 -20.275 -6.145 1.00 0.00 H new ATOM 0 HE2 TYR A 5 7.175 -17.920 -6.401 1.00 0.00 H new ATOM 0 HH TYR A 5 8.943 -17.605 -7.728 1.00 0.00 H new ATOM 88 N LEU A 6 5.760 -20.084 -0.684 1.00 0.00 N ATOM 89 CA LEU A 6 4.756 -19.132 -0.134 1.00 0.00 C ATOM 90 C LEU A 6 5.153 -18.737 1.289 1.00 0.00 C ATOM 91 O LEU A 6 4.842 -17.659 1.757 1.00 0.00 O ATOM 92 CB LEU A 6 3.426 -19.892 -0.137 1.00 0.00 C ATOM 93 CG LEU A 6 3.532 -21.124 0.764 1.00 0.00 C ATOM 94 CD1 LEU A 6 2.830 -20.848 2.095 1.00 0.00 C ATOM 95 CD2 LEU A 6 2.864 -22.318 0.074 1.00 0.00 C ATOM 0 H LEU A 6 5.561 -21.069 -0.510 1.00 0.00 H new ATOM 0 HA LEU A 6 4.687 -18.215 -0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 6 2.624 -19.242 0.213 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.171 -20.194 -1.153 1.00 0.00 H new ATOM 0 HG LEU A 6 4.582 -21.349 0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.906 -21.727 2.736 1.00 0.00 H new ATOM 0 HD12 LEU A 6 3.303 -19.998 2.587 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.779 -20.622 1.912 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.939 -23.197 0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.814 -22.091 -0.110 1.00 0.00 H new ATOM 0 HD23 LEU A 6 3.364 -22.517 -0.874 1.00 0.00 H new ATOM 107 N GLY A 7 5.849 -19.602 1.979 1.00 0.00 N ATOM 108 CA GLY A 7 6.275 -19.275 3.369 1.00 0.00 C ATOM 109 C GLY A 7 7.252 -18.099 3.337 1.00 0.00 C ATOM 110 O GLY A 7 7.283 -17.281 4.235 1.00 0.00 O ATOM 0 H GLY A 7 6.140 -20.519 1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.406 -19.024 3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.748 -20.142 3.830 1.00 0.00 H new ATOM 114 N VAL A 8 8.052 -18.004 2.308 1.00 0.00 N ATOM 115 CA VAL A 8 9.022 -16.874 2.225 1.00 0.00 C ATOM 116 C VAL A 8 8.360 -15.672 1.569 1.00 0.00 C ATOM 117 O VAL A 8 8.627 -14.535 1.902 1.00 0.00 O ATOM 118 CB VAL A 8 10.180 -17.394 1.374 1.00 0.00 C ATOM 119 CG1 VAL A 8 11.179 -16.263 1.129 1.00 0.00 C ATOM 120 CG2 VAL A 8 10.876 -18.538 2.114 1.00 0.00 C ATOM 0 H VAL A 8 8.076 -18.657 1.525 1.00 0.00 H new ATOM 0 HA VAL A 8 9.367 -16.550 3.207 1.00 0.00 H new ATOM 0 HB VAL A 8 9.799 -17.755 0.418 1.00 0.00 H new ATOM 0 HG11 VAL A 8 12.005 -16.633 0.522 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.682 -15.446 0.606 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.563 -15.903 2.084 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.703 -18.912 1.510 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.258 -18.175 3.068 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.163 -19.343 2.292 1.00 0.00 H new ATOM 130 N PHE A 9 7.484 -15.925 0.657 1.00 0.00 N ATOM 131 CA PHE A 9 6.770 -14.808 -0.018 1.00 0.00 C ATOM 132 C PHE A 9 5.850 -14.129 0.995 1.00 0.00 C ATOM 133 O PHE A 9 5.562 -12.952 0.904 1.00 0.00 O ATOM 134 CB PHE A 9 5.958 -15.462 -1.136 1.00 0.00 C ATOM 135 CG PHE A 9 6.530 -15.056 -2.472 1.00 0.00 C ATOM 136 CD1 PHE A 9 7.536 -15.826 -3.068 1.00 0.00 C ATOM 137 CD2 PHE A 9 6.056 -13.906 -3.115 1.00 0.00 C ATOM 138 CE1 PHE A 9 8.065 -15.447 -4.308 1.00 0.00 C ATOM 139 CE2 PHE A 9 6.586 -13.527 -4.353 1.00 0.00 C ATOM 140 CZ PHE A 9 7.590 -14.297 -4.950 1.00 0.00 C ATOM 0 H PHE A 9 7.224 -16.860 0.342 1.00 0.00 H new ATOM 0 HA PHE A 9 7.445 -14.050 -0.416 1.00 0.00 H new ATOM 0 HB2 PHE A 9 5.982 -16.547 -1.032 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.913 -15.158 -1.068 1.00 0.00 H new ATOM 0 HD1 PHE A 9 7.904 -16.712 -2.572 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.281 -13.311 -2.655 1.00 0.00 H new ATOM 0 HE1 PHE A 9 8.839 -16.042 -4.769 1.00 0.00 H new ATOM 0 HE2 PHE A 9 6.220 -12.640 -4.848 1.00 0.00 H new ATOM 0 HZ PHE A 9 7.999 -14.004 -5.906 1.00 0.00 H new ATOM 150 N VAL A 10 5.405 -14.867 1.976 1.00 0.00 N ATOM 151 CA VAL A 10 4.523 -14.278 3.018 1.00 0.00 C ATOM 152 C VAL A 10 5.387 -13.563 4.058 1.00 0.00 C ATOM 153 O VAL A 10 5.008 -12.547 4.607 1.00 0.00 O ATOM 154 CB VAL A 10 3.796 -15.470 3.642 1.00 0.00 C ATOM 155 CG1 VAL A 10 3.061 -15.019 4.905 1.00 0.00 C ATOM 156 CG2 VAL A 10 2.787 -16.032 2.639 1.00 0.00 C ATOM 0 H VAL A 10 5.617 -15.857 2.099 1.00 0.00 H new ATOM 0 HA VAL A 10 3.819 -13.548 2.619 1.00 0.00 H new ATOM 0 HB VAL A 10 4.521 -16.241 3.901 1.00 0.00 H new ATOM 0 HG11 VAL A 10 2.544 -15.870 5.348 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.779 -14.618 5.620 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.336 -14.247 4.648 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.268 -16.882 3.082 1.00 0.00 H new ATOM 0 HG22 VAL A 10 2.063 -15.260 2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 10 3.310 -16.356 1.739 1.00 0.00 H new ATOM 166 N ASP A 11 6.557 -14.079 4.320 1.00 0.00 N ATOM 167 CA ASP A 11 7.453 -13.419 5.307 1.00 0.00 C ATOM 168 C ASP A 11 7.953 -12.102 4.725 1.00 0.00 C ATOM 169 O ASP A 11 8.353 -11.196 5.430 1.00 0.00 O ATOM 170 CB ASP A 11 8.611 -14.397 5.517 1.00 0.00 C ATOM 171 CG ASP A 11 9.115 -14.293 6.958 1.00 0.00 C ATOM 172 OD1 ASP A 11 8.492 -13.585 7.733 1.00 0.00 O ATOM 173 OD2 ASP A 11 10.114 -14.923 7.261 1.00 0.00 O ATOM 0 H ASP A 11 6.929 -14.927 3.893 1.00 0.00 H new ATOM 0 HA ASP A 11 6.953 -13.192 6.249 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.283 -15.415 5.308 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.420 -14.174 4.821 1.00 0.00 H new ATOM 178 N GLU A 12 7.913 -11.999 3.434 1.00 0.00 N ATOM 179 CA GLU A 12 8.365 -10.750 2.758 1.00 0.00 C ATOM 180 C GLU A 12 7.190 -9.774 2.624 1.00 0.00 C ATOM 181 O GLU A 12 7.359 -8.573 2.696 1.00 0.00 O ATOM 182 CB GLU A 12 8.850 -11.197 1.378 1.00 0.00 C ATOM 183 CG GLU A 12 10.213 -11.879 1.510 1.00 0.00 C ATOM 184 CD GLU A 12 11.020 -11.662 0.227 1.00 0.00 C ATOM 185 OE1 GLU A 12 10.601 -10.852 -0.583 1.00 0.00 O ATOM 186 OE2 GLU A 12 12.043 -12.310 0.076 1.00 0.00 O ATOM 0 H GLU A 12 7.584 -12.732 2.806 1.00 0.00 H new ATOM 0 HA GLU A 12 9.148 -10.236 3.316 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.130 -11.884 0.933 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.925 -10.338 0.712 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.753 -11.473 2.365 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.082 -12.945 1.693 1.00 0.00 H new ATOM 193 N THR A 13 6.002 -10.283 2.431 1.00 0.00 N ATOM 194 CA THR A 13 4.820 -9.382 2.294 1.00 0.00 C ATOM 195 C THR A 13 4.500 -8.725 3.642 1.00 0.00 C ATOM 196 O THR A 13 3.987 -7.626 3.700 1.00 0.00 O ATOM 197 CB THR A 13 3.673 -10.291 1.830 1.00 0.00 C ATOM 198 OG1 THR A 13 2.700 -9.508 1.153 1.00 0.00 O ATOM 199 CG2 THR A 13 3.021 -10.984 3.030 1.00 0.00 C ATOM 0 H THR A 13 5.799 -11.280 2.362 1.00 0.00 H new ATOM 0 HA THR A 13 4.993 -8.571 1.587 1.00 0.00 H new ATOM 0 HB THR A 13 4.073 -11.051 1.159 1.00 0.00 H new ATOM 0 HG1 THR A 13 2.882 -9.521 0.190 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.210 -11.625 2.684 1.00 0.00 H new ATOM 0 HG22 THR A 13 3.765 -11.589 3.549 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.624 -10.233 3.712 1.00 0.00 H new ATOM 207 N LYS A 14 4.805 -9.388 4.725 1.00 0.00 N ATOM 208 CA LYS A 14 4.524 -8.796 6.064 1.00 0.00 C ATOM 209 C LYS A 14 5.623 -7.799 6.429 1.00 0.00 C ATOM 210 O LYS A 14 5.353 -6.684 6.827 1.00 0.00 O ATOM 211 CB LYS A 14 4.514 -9.977 7.036 1.00 0.00 C ATOM 212 CG LYS A 14 3.217 -10.770 6.864 1.00 0.00 C ATOM 213 CD LYS A 14 3.544 -12.257 6.719 1.00 0.00 C ATOM 214 CE LYS A 14 2.925 -13.032 7.884 1.00 0.00 C ATOM 215 NZ LYS A 14 3.680 -12.585 9.088 1.00 0.00 N ATOM 0 H LYS A 14 5.236 -10.312 4.740 1.00 0.00 H new ATOM 0 HA LYS A 14 3.579 -8.254 6.089 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.374 -10.621 6.851 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.600 -9.618 8.062 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.565 -10.612 7.723 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.677 -10.418 5.985 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.159 -12.634 5.772 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.624 -12.403 6.704 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.861 -12.815 7.982 1.00 0.00 H new ATOM 0 HE3 LYS A 14 3.018 -14.108 7.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.637 -13.324 9.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 4.672 -12.410 8.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.258 -11.709 9.457 1.00 0.00 H new ATOM 229 N GLU A 15 6.863 -8.180 6.277 1.00 0.00 N ATOM 230 CA GLU A 15 7.963 -7.230 6.601 1.00 0.00 C ATOM 231 C GLU A 15 7.909 -6.045 5.640 1.00 0.00 C ATOM 232 O GLU A 15 8.555 -5.035 5.833 1.00 0.00 O ATOM 233 CB GLU A 15 9.256 -8.025 6.415 1.00 0.00 C ATOM 234 CG GLU A 15 9.352 -9.105 7.493 1.00 0.00 C ATOM 235 CD GLU A 15 10.651 -9.895 7.313 1.00 0.00 C ATOM 236 OE1 GLU A 15 11.446 -9.507 6.473 1.00 0.00 O ATOM 237 OE2 GLU A 15 10.828 -10.874 8.018 1.00 0.00 O ATOM 0 H GLU A 15 7.159 -9.098 5.946 1.00 0.00 H new ATOM 0 HA GLU A 15 7.888 -6.831 7.613 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.275 -8.482 5.425 1.00 0.00 H new ATOM 0 HB3 GLU A 15 10.117 -7.359 6.475 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.326 -8.649 8.483 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.495 -9.775 7.428 1.00 0.00 H new ATOM 244 N TYR A 16 7.127 -6.168 4.609 1.00 0.00 N ATOM 245 CA TYR A 16 6.994 -5.068 3.620 1.00 0.00 C ATOM 246 C TYR A 16 5.849 -4.144 4.026 1.00 0.00 C ATOM 247 O TYR A 16 5.973 -2.941 3.990 1.00 0.00 O ATOM 248 CB TYR A 16 6.682 -5.759 2.292 1.00 0.00 C ATOM 249 CG TYR A 16 7.967 -6.098 1.571 1.00 0.00 C ATOM 250 CD1 TYR A 16 9.167 -6.219 2.286 1.00 0.00 C ATOM 251 CD2 TYR A 16 7.956 -6.295 0.185 1.00 0.00 C ATOM 252 CE1 TYR A 16 10.353 -6.535 1.612 1.00 0.00 C ATOM 253 CE2 TYR A 16 9.142 -6.611 -0.488 1.00 0.00 C ATOM 254 CZ TYR A 16 10.341 -6.731 0.225 1.00 0.00 C ATOM 255 OH TYR A 16 11.511 -7.043 -0.437 1.00 0.00 O ATOM 0 H TYR A 16 6.566 -6.996 4.407 1.00 0.00 H new ATOM 0 HA TYR A 16 7.894 -4.457 3.554 1.00 0.00 H new ATOM 0 HB2 TYR A 16 6.106 -6.667 2.471 1.00 0.00 H new ATOM 0 HB3 TYR A 16 6.067 -5.109 1.670 1.00 0.00 H new ATOM 0 HD1 TYR A 16 9.177 -6.069 3.355 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.031 -6.203 -0.366 1.00 0.00 H new ATOM 0 HE1 TYR A 16 11.278 -6.628 2.162 1.00 0.00 H new ATOM 0 HE2 TYR A 16 9.132 -6.762 -1.557 1.00 0.00 H new ATOM 0 HH TYR A 16 11.328 -7.147 -1.394 1.00 0.00 H new ATOM 265 N LEU A 17 4.735 -4.696 4.422 1.00 0.00 N ATOM 266 CA LEU A 17 3.597 -3.834 4.841 1.00 0.00 C ATOM 267 C LEU A 17 4.043 -2.960 6.003 1.00 0.00 C ATOM 268 O LEU A 17 3.686 -1.805 6.103 1.00 0.00 O ATOM 269 CB LEU A 17 2.499 -4.801 5.278 1.00 0.00 C ATOM 270 CG LEU A 17 2.018 -5.586 4.063 1.00 0.00 C ATOM 271 CD1 LEU A 17 1.280 -6.844 4.525 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.073 -4.708 3.240 1.00 0.00 C ATOM 0 H LEU A 17 4.565 -5.700 4.473 1.00 0.00 H new ATOM 0 HA LEU A 17 3.247 -3.175 4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.878 -5.482 6.040 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.670 -4.252 5.724 1.00 0.00 H new ATOM 0 HG LEU A 17 2.873 -5.876 3.452 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.937 -7.404 3.655 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.954 -7.466 5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.423 -6.560 5.135 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.726 -5.264 2.369 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.218 -4.421 3.852 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.601 -3.813 2.912 1.00 0.00 H new ATOM 284 N GLN A 18 4.848 -3.501 6.866 1.00 0.00 N ATOM 285 CA GLN A 18 5.354 -2.702 8.008 1.00 0.00 C ATOM 286 C GLN A 18 6.334 -1.684 7.462 1.00 0.00 C ATOM 287 O GLN A 18 6.257 -0.503 7.733 1.00 0.00 O ATOM 288 CB GLN A 18 6.023 -3.730 8.917 1.00 0.00 C ATOM 289 CG GLN A 18 7.497 -3.387 9.164 1.00 0.00 C ATOM 290 CD GLN A 18 8.052 -4.275 10.278 1.00 0.00 C ATOM 291 OE1 GLN A 18 8.716 -5.258 10.013 1.00 0.00 O ATOM 292 NE2 GLN A 18 7.805 -3.969 11.521 1.00 0.00 N ATOM 0 H GLN A 18 5.179 -4.465 6.830 1.00 0.00 H new ATOM 0 HA GLN A 18 4.592 -2.148 8.556 1.00 0.00 H new ATOM 0 HB2 GLN A 18 5.494 -3.774 9.869 1.00 0.00 H new ATOM 0 HB3 GLN A 18 5.949 -4.719 8.465 1.00 0.00 H new ATOM 0 HG2 GLN A 18 8.072 -3.532 8.250 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.595 -2.337 9.440 1.00 0.00 H new ATOM 0 HE21 GLN A 18 7.248 -3.144 11.742 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.169 -4.555 12.272 1.00 0.00 H new ATOM 301 N ASN A 19 7.218 -2.147 6.649 1.00 0.00 N ATOM 302 CA ASN A 19 8.183 -1.228 6.012 1.00 0.00 C ATOM 303 C ASN A 19 7.376 -0.252 5.177 1.00 0.00 C ATOM 304 O ASN A 19 7.761 0.878 4.942 1.00 0.00 O ATOM 305 CB ASN A 19 9.061 -2.128 5.136 1.00 0.00 C ATOM 306 CG ASN A 19 9.683 -1.307 4.004 1.00 0.00 C ATOM 307 OD1 ASN A 19 10.704 -0.674 4.188 1.00 0.00 O ATOM 308 ND2 ASN A 19 9.106 -1.289 2.833 1.00 0.00 N ATOM 0 H ASN A 19 7.318 -3.129 6.393 1.00 0.00 H new ATOM 0 HA ASN A 19 8.799 -0.658 6.707 1.00 0.00 H new ATOM 0 HB2 ASN A 19 9.846 -2.584 5.740 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.464 -2.941 4.722 1.00 0.00 H new ATOM 0 HD21 ASN A 19 9.512 -0.744 2.073 1.00 0.00 H new ATOM 0 HD22 ASN A 19 8.249 -1.820 2.678 1.00 0.00 H new ATOM 315 N LEU A 20 6.232 -0.695 4.755 1.00 0.00 N ATOM 316 CA LEU A 20 5.338 0.171 3.952 1.00 0.00 C ATOM 317 C LEU A 20 4.381 0.904 4.876 1.00 0.00 C ATOM 318 O LEU A 20 3.713 1.838 4.481 1.00 0.00 O ATOM 319 CB LEU A 20 4.584 -0.774 3.014 1.00 0.00 C ATOM 320 CG LEU A 20 3.322 -0.082 2.493 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.712 1.149 1.675 1.00 0.00 C ATOM 322 CD2 LEU A 20 2.535 -1.054 1.609 1.00 0.00 C ATOM 0 H LEU A 20 5.874 -1.633 4.935 1.00 0.00 H new ATOM 0 HA LEU A 20 5.884 0.927 3.387 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.224 -1.062 2.180 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.317 -1.690 3.542 1.00 0.00 H new ATOM 0 HG LEU A 20 2.704 0.225 3.336 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.812 1.640 1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.271 1.842 2.304 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.332 0.844 0.832 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.636 -0.562 1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 20 3.154 -1.362 0.767 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.254 -1.931 2.193 1.00 0.00 H new ATOM 334 N ASN A 21 4.336 0.519 6.117 1.00 0.00 N ATOM 335 CA ASN A 21 3.463 1.225 7.063 1.00 0.00 C ATOM 336 C ASN A 21 4.308 2.283 7.692 1.00 0.00 C ATOM 337 O ASN A 21 3.871 3.360 8.006 1.00 0.00 O ATOM 338 CB ASN A 21 3.029 0.199 8.101 1.00 0.00 C ATOM 339 CG ASN A 21 1.677 -0.394 7.705 1.00 0.00 C ATOM 340 OD1 ASN A 21 1.390 -0.558 6.536 1.00 0.00 O ATOM 341 ND2 ASN A 21 0.829 -0.725 8.639 1.00 0.00 N ATOM 0 H ASN A 21 4.870 -0.256 6.509 1.00 0.00 H new ATOM 0 HA ASN A 21 2.583 1.673 6.602 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.775 -0.592 8.179 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.958 0.668 9.082 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -0.076 -1.122 8.388 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.071 -0.587 9.620 1.00 0.00 H new ATOM 348 N ASP A 22 5.547 1.973 7.846 1.00 0.00 N ATOM 349 CA ASP A 22 6.461 2.957 8.432 1.00 0.00 C ATOM 350 C ASP A 22 6.614 4.081 7.436 1.00 0.00 C ATOM 351 O ASP A 22 6.747 5.240 7.770 1.00 0.00 O ATOM 352 CB ASP A 22 7.784 2.227 8.668 1.00 0.00 C ATOM 353 CG ASP A 22 8.786 3.185 9.314 1.00 0.00 C ATOM 354 OD1 ASP A 22 8.502 3.664 10.400 1.00 0.00 O ATOM 355 OD2 ASP A 22 9.820 3.423 8.713 1.00 0.00 O ATOM 0 H ASP A 22 5.966 1.079 7.591 1.00 0.00 H new ATOM 0 HA ASP A 22 6.105 3.377 9.373 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.625 1.362 9.312 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.179 1.853 7.723 1.00 0.00 H new ATOM 360 N THR A 23 6.551 3.719 6.202 1.00 0.00 N ATOM 361 CA THR A 23 6.639 4.711 5.109 1.00 0.00 C ATOM 362 C THR A 23 5.330 5.480 5.030 1.00 0.00 C ATOM 363 O THR A 23 5.304 6.683 4.854 1.00 0.00 O ATOM 364 CB THR A 23 6.788 3.851 3.874 1.00 0.00 C ATOM 365 OG1 THR A 23 7.998 3.110 3.947 1.00 0.00 O ATOM 366 CG2 THR A 23 6.789 4.728 2.623 1.00 0.00 C ATOM 0 H THR A 23 6.439 2.754 5.892 1.00 0.00 H new ATOM 0 HA THR A 23 7.447 5.432 5.236 1.00 0.00 H new ATOM 0 HB THR A 23 5.948 3.159 3.819 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.793 2.152 3.981 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.897 4.100 1.739 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.851 5.279 2.564 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.620 5.431 2.672 1.00 0.00 H new ATOM 374 N LEU A 24 4.236 4.783 5.162 1.00 0.00 N ATOM 375 CA LEU A 24 2.921 5.457 5.099 1.00 0.00 C ATOM 376 C LEU A 24 2.637 6.101 6.457 1.00 0.00 C ATOM 377 O LEU A 24 1.886 7.049 6.562 1.00 0.00 O ATOM 378 CB LEU A 24 1.916 4.345 4.748 1.00 0.00 C ATOM 379 CG LEU A 24 1.111 3.923 5.979 1.00 0.00 C ATOM 380 CD1 LEU A 24 -0.043 4.905 6.189 1.00 0.00 C ATOM 381 CD2 LEU A 24 0.555 2.515 5.758 1.00 0.00 C ATOM 0 H LEU A 24 4.201 3.775 5.311 1.00 0.00 H new ATOM 0 HA LEU A 24 2.868 6.255 4.358 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.239 4.695 3.969 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.448 3.484 4.344 1.00 0.00 H new ATOM 0 HG LEU A 24 1.753 3.926 6.860 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.619 4.608 7.065 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.356 5.908 6.340 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.689 4.900 5.311 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.020 2.209 6.632 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.091 2.513 4.880 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.379 1.818 5.604 1.00 0.00 H new ATOM 393 N LEU A 25 3.250 5.597 7.496 1.00 0.00 N ATOM 394 CA LEU A 25 3.021 6.197 8.843 1.00 0.00 C ATOM 395 C LEU A 25 3.836 7.462 8.975 1.00 0.00 C ATOM 396 O LEU A 25 3.565 8.316 9.792 1.00 0.00 O ATOM 397 CB LEU A 25 3.462 5.146 9.846 1.00 0.00 C ATOM 398 CG LEU A 25 2.383 4.083 9.890 1.00 0.00 C ATOM 399 CD1 LEU A 25 2.952 2.791 10.475 1.00 0.00 C ATOM 400 CD2 LEU A 25 1.222 4.584 10.746 1.00 0.00 C ATOM 0 H LEU A 25 3.892 4.805 7.471 1.00 0.00 H new ATOM 0 HA LEU A 25 1.978 6.469 9.007 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.417 4.712 9.552 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.604 5.591 10.831 1.00 0.00 H new ATOM 0 HG LEU A 25 2.025 3.880 8.881 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.172 2.030 10.504 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.776 2.442 9.853 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.314 2.978 11.486 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.442 3.824 10.782 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.576 4.788 11.756 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.818 5.498 10.312 1.00 0.00 H new ATOM 412 N GLU A 26 4.784 7.616 8.120 1.00 0.00 N ATOM 413 CA GLU A 26 5.569 8.863 8.119 1.00 0.00 C ATOM 414 C GLU A 26 4.884 9.753 7.118 1.00 0.00 C ATOM 415 O GLU A 26 4.855 10.963 7.224 1.00 0.00 O ATOM 416 CB GLU A 26 6.985 8.478 7.689 1.00 0.00 C ATOM 417 CG GLU A 26 7.720 7.858 8.879 1.00 0.00 C ATOM 418 CD GLU A 26 9.226 8.074 8.719 1.00 0.00 C ATOM 419 OE1 GLU A 26 9.845 7.290 8.019 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.734 9.020 9.299 1.00 0.00 O ATOM 0 H GLU A 26 5.054 6.929 7.416 1.00 0.00 H new ATOM 0 HA GLU A 26 5.632 9.377 9.078 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.947 7.770 6.861 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.522 9.357 7.333 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.374 8.310 9.809 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.499 6.792 8.941 1.00 0.00 H new ATOM 427 N LEU A 27 4.297 9.117 6.155 1.00 0.00 N ATOM 428 CA LEU A 27 3.555 9.848 5.125 1.00 0.00 C ATOM 429 C LEU A 27 2.339 10.515 5.754 1.00 0.00 C ATOM 430 O LEU A 27 1.871 11.537 5.301 1.00 0.00 O ATOM 431 CB LEU A 27 3.113 8.791 4.120 1.00 0.00 C ATOM 432 CG LEU A 27 2.066 9.393 3.190 1.00 0.00 C ATOM 433 CD1 LEU A 27 2.711 10.505 2.363 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.530 8.305 2.259 1.00 0.00 C ATOM 0 H LEU A 27 4.304 8.103 6.042 1.00 0.00 H new ATOM 0 HA LEU A 27 4.155 10.626 4.654 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.969 8.438 3.544 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.701 7.926 4.640 1.00 0.00 H new ATOM 0 HG LEU A 27 1.244 9.804 3.775 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.967 10.940 1.695 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.096 11.277 3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.530 10.092 1.774 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.781 8.733 1.593 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.349 7.895 1.668 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.077 7.510 2.851 1.00 0.00 H new ATOM 446 N GLU A 28 1.820 9.946 6.801 1.00 0.00 N ATOM 447 CA GLU A 28 0.645 10.567 7.456 1.00 0.00 C ATOM 448 C GLU A 28 1.104 11.838 8.153 1.00 0.00 C ATOM 449 O GLU A 28 0.459 12.866 8.099 1.00 0.00 O ATOM 450 CB GLU A 28 0.157 9.518 8.447 1.00 0.00 C ATOM 451 CG GLU A 28 0.881 9.666 9.783 1.00 0.00 C ATOM 452 CD GLU A 28 0.392 8.590 10.754 1.00 0.00 C ATOM 453 OE1 GLU A 28 -0.784 8.271 10.709 1.00 0.00 O ATOM 454 OE2 GLU A 28 1.201 8.104 11.527 1.00 0.00 O ATOM 0 H GLU A 28 2.157 9.083 7.228 1.00 0.00 H new ATOM 0 HA GLU A 28 -0.153 10.847 6.769 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.918 9.622 8.596 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.328 8.520 8.043 1.00 0.00 H new ATOM 0 HG2 GLU A 28 1.957 9.576 9.637 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.698 10.656 10.200 1.00 0.00 H new ATOM 461 N LYS A 29 2.251 11.782 8.770 1.00 0.00 N ATOM 462 CA LYS A 29 2.784 12.998 9.423 1.00 0.00 C ATOM 463 C LYS A 29 3.219 13.944 8.315 1.00 0.00 C ATOM 464 O LYS A 29 3.366 15.136 8.495 1.00 0.00 O ATOM 465 CB LYS A 29 3.946 12.500 10.291 1.00 0.00 C ATOM 466 CG LYS A 29 5.304 12.990 9.777 1.00 0.00 C ATOM 467 CD LYS A 29 6.334 11.918 10.073 1.00 0.00 C ATOM 468 CE LYS A 29 6.535 11.808 11.584 1.00 0.00 C ATOM 469 NZ LYS A 29 7.726 12.651 11.879 1.00 0.00 N ATOM 0 H LYS A 29 2.836 10.950 8.848 1.00 0.00 H new ATOM 0 HA LYS A 29 2.076 13.541 10.049 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.803 12.841 11.317 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.940 11.410 10.313 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.257 13.187 8.706 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.579 13.927 10.262 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.005 10.961 9.669 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.278 12.162 9.587 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.658 12.162 12.125 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.700 10.774 11.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.926 12.625 12.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.548 12.286 11.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.538 13.632 11.588 1.00 0.00 H new ATOM 483 N ASN A 30 3.398 13.387 7.155 1.00 0.00 N ATOM 484 CA ASN A 30 3.798 14.204 5.975 1.00 0.00 C ATOM 485 C ASN A 30 3.147 13.619 4.743 1.00 0.00 C ATOM 486 O ASN A 30 3.766 12.937 3.950 1.00 0.00 O ATOM 487 CB ASN A 30 5.322 14.126 5.900 1.00 0.00 C ATOM 488 CG ASN A 30 5.903 15.538 5.824 1.00 0.00 C ATOM 489 OD1 ASN A 30 5.372 16.390 5.140 1.00 0.00 O ATOM 490 ND2 ASN A 30 6.979 15.823 6.504 1.00 0.00 N ATOM 0 H ASN A 30 3.284 12.391 6.969 1.00 0.00 H new ATOM 0 HA ASN A 30 3.483 15.245 6.051 1.00 0.00 H new ATOM 0 HB2 ASN A 30 5.713 13.607 6.775 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.624 13.550 5.026 1.00 0.00 H new ATOM 0 HD21 ASN A 30 7.375 16.762 6.462 1.00 0.00 H new ATOM 0 HD22 ASN A 30 7.424 15.107 7.078 1.00 0.00 H new ATOM 497 N PRO A 31 1.883 13.890 4.667 1.00 0.00 N ATOM 498 CA PRO A 31 1.047 13.379 3.577 1.00 0.00 C ATOM 499 C PRO A 31 1.062 14.329 2.378 1.00 0.00 C ATOM 500 O PRO A 31 0.158 14.338 1.568 1.00 0.00 O ATOM 501 CB PRO A 31 -0.325 13.333 4.226 1.00 0.00 C ATOM 502 CG PRO A 31 -0.315 14.363 5.315 1.00 0.00 C ATOM 503 CD PRO A 31 1.115 14.706 5.610 1.00 0.00 C ATOM 0 HA PRO A 31 1.378 12.419 3.181 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -1.106 13.547 3.497 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -0.530 12.342 4.631 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.865 15.252 5.005 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.808 13.979 6.208 1.00 0.00 H new ATOM 0 HD2 PRO A 31 1.307 15.769 5.465 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.376 14.473 6.642 1.00 0.00 H new ATOM 511 N GLU A 32 2.088 15.121 2.256 1.00 0.00 N ATOM 512 CA GLU A 32 2.175 16.065 1.108 1.00 0.00 C ATOM 513 C GLU A 32 3.551 15.929 0.468 1.00 0.00 C ATOM 514 O GLU A 32 3.866 16.573 -0.513 1.00 0.00 O ATOM 515 CB GLU A 32 1.979 17.478 1.687 1.00 0.00 C ATOM 516 CG GLU A 32 1.546 17.401 3.155 1.00 0.00 C ATOM 517 CD GLU A 32 1.558 18.801 3.770 1.00 0.00 C ATOM 518 OE1 GLU A 32 0.589 19.519 3.580 1.00 0.00 O ATOM 519 OE2 GLU A 32 2.536 19.133 4.419 1.00 0.00 O ATOM 0 H GLU A 32 2.874 15.156 2.905 1.00 0.00 H new ATOM 0 HA GLU A 32 1.423 15.861 0.346 1.00 0.00 H new ATOM 0 HB2 GLU A 32 2.907 18.043 1.605 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.227 18.014 1.108 1.00 0.00 H new ATOM 0 HG2 GLU A 32 0.547 16.970 3.228 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.218 16.744 3.708 1.00 0.00 H new ATOM 526 N ASP A 33 4.370 15.079 1.020 1.00 0.00 N ATOM 527 CA ASP A 33 5.724 14.875 0.457 1.00 0.00 C ATOM 528 C ASP A 33 5.674 13.782 -0.612 1.00 0.00 C ATOM 529 O ASP A 33 4.804 12.932 -0.601 1.00 0.00 O ATOM 530 CB ASP A 33 6.591 14.438 1.638 1.00 0.00 C ATOM 531 CG ASP A 33 7.234 15.668 2.282 1.00 0.00 C ATOM 532 OD1 ASP A 33 6.935 16.766 1.844 1.00 0.00 O ATOM 533 OD2 ASP A 33 8.013 15.490 3.204 1.00 0.00 O ATOM 0 H ASP A 33 4.154 14.515 1.842 1.00 0.00 H new ATOM 0 HA ASP A 33 6.120 15.774 -0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.984 13.906 2.371 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.362 13.746 1.300 1.00 0.00 H new ATOM 538 N MET A 34 6.590 13.794 -1.538 1.00 0.00 N ATOM 539 CA MET A 34 6.578 12.754 -2.604 1.00 0.00 C ATOM 540 C MET A 34 7.519 11.605 -2.240 1.00 0.00 C ATOM 541 O MET A 34 7.565 10.596 -2.916 1.00 0.00 O ATOM 542 CB MET A 34 7.062 13.472 -3.863 1.00 0.00 C ATOM 543 CG MET A 34 6.274 14.770 -4.047 1.00 0.00 C ATOM 544 SD MET A 34 4.593 14.383 -4.595 1.00 0.00 S ATOM 545 CE MET A 34 4.810 14.845 -6.331 1.00 0.00 C ATOM 0 H MET A 34 7.345 14.477 -1.604 1.00 0.00 H new ATOM 0 HA MET A 34 5.589 12.316 -2.741 1.00 0.00 H new ATOM 0 HB2 MET A 34 8.127 13.689 -3.783 1.00 0.00 H new ATOM 0 HB3 MET A 34 6.932 12.829 -4.734 1.00 0.00 H new ATOM 0 HG2 MET A 34 6.244 15.325 -3.110 1.00 0.00 H new ATOM 0 HG3 MET A 34 6.769 15.408 -4.779 1.00 0.00 H new ATOM 0 HE1 MET A 34 3.876 14.684 -6.870 1.00 0.00 H new ATOM 0 HE2 MET A 34 5.089 15.897 -6.395 1.00 0.00 H new ATOM 0 HE3 MET A 34 5.596 14.233 -6.775 1.00 0.00 H new ATOM 555 N GLU A 35 8.262 11.736 -1.177 1.00 0.00 N ATOM 556 CA GLU A 35 9.180 10.630 -0.788 1.00 0.00 C ATOM 557 C GLU A 35 8.394 9.554 -0.047 1.00 0.00 C ATOM 558 O GLU A 35 8.481 8.385 -0.364 1.00 0.00 O ATOM 559 CB GLU A 35 10.246 11.263 0.112 1.00 0.00 C ATOM 560 CG GLU A 35 9.602 11.834 1.376 1.00 0.00 C ATOM 561 CD GLU A 35 10.653 12.607 2.174 1.00 0.00 C ATOM 562 OE1 GLU A 35 10.948 13.729 1.794 1.00 0.00 O ATOM 563 OE2 GLU A 35 11.143 12.066 3.150 1.00 0.00 O ATOM 0 H GLU A 35 8.274 12.553 -0.566 1.00 0.00 H new ATOM 0 HA GLU A 35 9.643 10.152 -1.651 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.994 10.517 0.382 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.765 12.054 -0.429 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.774 12.491 1.111 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.188 11.029 1.983 1.00 0.00 H new ATOM 570 N LEU A 36 7.597 9.932 0.913 1.00 0.00 N ATOM 571 CA LEU A 36 6.787 8.909 1.623 1.00 0.00 C ATOM 572 C LEU A 36 5.632 8.515 0.712 1.00 0.00 C ATOM 573 O LEU A 36 5.062 7.447 0.826 1.00 0.00 O ATOM 574 CB LEU A 36 6.274 9.582 2.898 1.00 0.00 C ATOM 575 CG LEU A 36 7.443 10.141 3.708 1.00 0.00 C ATOM 576 CD1 LEU A 36 6.989 10.383 5.144 1.00 0.00 C ATOM 577 CD2 LEU A 36 8.606 9.142 3.710 1.00 0.00 C ATOM 0 H LEU A 36 7.473 10.893 1.232 1.00 0.00 H new ATOM 0 HA LEU A 36 7.353 8.012 1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.583 10.385 2.641 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.717 8.863 3.499 1.00 0.00 H new ATOM 0 HG LEU A 36 7.774 11.077 3.258 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.820 10.782 5.726 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.166 11.097 5.150 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.656 9.443 5.584 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.434 9.549 4.290 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.278 8.203 4.156 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.933 8.963 2.686 1.00 0.00 H new ATOM 589 N ILE A 37 5.302 9.373 -0.216 1.00 0.00 N ATOM 590 CA ILE A 37 4.210 9.061 -1.167 1.00 0.00 C ATOM 591 C ILE A 37 4.755 8.139 -2.256 1.00 0.00 C ATOM 592 O ILE A 37 4.046 7.319 -2.802 1.00 0.00 O ATOM 593 CB ILE A 37 3.801 10.418 -1.744 1.00 0.00 C ATOM 594 CG1 ILE A 37 2.900 11.140 -0.742 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.050 10.221 -3.062 1.00 0.00 C ATOM 596 CD1 ILE A 37 2.286 12.381 -1.394 1.00 0.00 C ATOM 0 H ILE A 37 5.748 10.280 -0.352 1.00 0.00 H new ATOM 0 HA ILE A 37 3.362 8.554 -0.707 1.00 0.00 H new ATOM 0 HB ILE A 37 4.694 11.015 -1.932 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.111 10.470 -0.400 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.477 11.428 0.137 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.763 11.192 -3.466 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.695 9.708 -3.775 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.156 9.623 -2.886 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.645 12.891 -0.674 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.081 13.055 -1.713 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.694 12.082 -2.259 1.00 0.00 H new ATOM 608 N ASN A 38 6.023 8.259 -2.566 1.00 0.00 N ATOM 609 CA ASN A 38 6.608 7.374 -3.611 1.00 0.00 C ATOM 610 C ASN A 38 7.174 6.112 -2.969 1.00 0.00 C ATOM 611 O ASN A 38 7.365 5.102 -3.616 1.00 0.00 O ATOM 612 CB ASN A 38 7.712 8.196 -4.277 1.00 0.00 C ATOM 613 CG ASN A 38 8.163 7.499 -5.561 1.00 0.00 C ATOM 614 OD1 ASN A 38 7.600 7.719 -6.615 1.00 0.00 O ATOM 615 ND2 ASN A 38 9.162 6.660 -5.518 1.00 0.00 N ATOM 0 H ASN A 38 6.669 8.925 -2.144 1.00 0.00 H new ATOM 0 HA ASN A 38 5.865 7.051 -4.340 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.348 9.198 -4.503 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.556 8.310 -3.597 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.470 6.189 -6.369 1.00 0.00 H new ATOM 0 HD22 ASN A 38 9.635 6.475 -4.633 1.00 0.00 H new ATOM 622 N GLU A 39 7.421 6.160 -1.697 1.00 0.00 N ATOM 623 CA GLU A 39 7.950 4.956 -1.000 1.00 0.00 C ATOM 624 C GLU A 39 6.783 4.039 -0.671 1.00 0.00 C ATOM 625 O GLU A 39 6.913 2.834 -0.575 1.00 0.00 O ATOM 626 CB GLU A 39 8.623 5.479 0.270 1.00 0.00 C ATOM 627 CG GLU A 39 9.900 6.235 -0.106 1.00 0.00 C ATOM 628 CD GLU A 39 11.118 5.350 0.167 1.00 0.00 C ATOM 629 OE1 GLU A 39 11.104 4.209 -0.264 1.00 0.00 O ATOM 630 OE2 GLU A 39 12.043 5.828 0.801 1.00 0.00 O ATOM 0 H GLU A 39 7.281 6.979 -1.106 1.00 0.00 H new ATOM 0 HA GLU A 39 8.660 4.387 -1.601 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.943 6.138 0.810 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.861 4.650 0.937 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.871 6.517 -1.158 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.972 7.158 0.470 1.00 0.00 H new ATOM 637 N ALA A 40 5.634 4.620 -0.536 1.00 0.00 N ATOM 638 CA ALA A 40 4.411 3.828 -0.248 1.00 0.00 C ATOM 639 C ALA A 40 3.810 3.364 -1.576 1.00 0.00 C ATOM 640 O ALA A 40 3.457 2.213 -1.742 1.00 0.00 O ATOM 641 CB ALA A 40 3.472 4.791 0.475 1.00 0.00 C ATOM 0 H ALA A 40 5.484 5.626 -0.614 1.00 0.00 H new ATOM 0 HA ALA A 40 4.601 2.942 0.358 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.543 4.277 0.722 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.946 5.143 1.391 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.255 5.642 -0.171 1.00 0.00 H new ATOM 647 N PHE A 41 3.718 4.251 -2.537 1.00 0.00 N ATOM 648 CA PHE A 41 3.172 3.853 -3.863 1.00 0.00 C ATOM 649 C PHE A 41 3.986 2.668 -4.398 1.00 0.00 C ATOM 650 O PHE A 41 3.480 1.815 -5.101 1.00 0.00 O ATOM 651 CB PHE A 41 3.349 5.103 -4.739 1.00 0.00 C ATOM 652 CG PHE A 41 3.516 4.721 -6.194 1.00 0.00 C ATOM 653 CD1 PHE A 41 4.720 4.161 -6.637 1.00 0.00 C ATOM 654 CD2 PHE A 41 2.468 4.932 -7.098 1.00 0.00 C ATOM 655 CE1 PHE A 41 4.877 3.812 -7.983 1.00 0.00 C ATOM 656 CE2 PHE A 41 2.624 4.582 -8.444 1.00 0.00 C ATOM 657 CZ PHE A 41 3.830 4.022 -8.887 1.00 0.00 C ATOM 0 H PHE A 41 3.997 5.229 -2.457 1.00 0.00 H new ATOM 0 HA PHE A 41 2.130 3.536 -3.834 1.00 0.00 H new ATOM 0 HB2 PHE A 41 2.484 5.756 -4.627 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.220 5.667 -4.404 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.528 3.998 -5.939 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.539 5.365 -6.757 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.806 3.381 -8.324 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.815 4.743 -9.141 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.951 3.753 -9.926 1.00 0.00 H new ATOM 667 N ARG A 42 5.247 2.616 -4.060 1.00 0.00 N ATOM 668 CA ARG A 42 6.112 1.499 -4.531 1.00 0.00 C ATOM 669 C ARG A 42 5.746 0.198 -3.811 1.00 0.00 C ATOM 670 O ARG A 42 5.185 -0.709 -4.393 1.00 0.00 O ATOM 671 CB ARG A 42 7.531 1.931 -4.161 1.00 0.00 C ATOM 672 CG ARG A 42 8.141 2.719 -5.318 1.00 0.00 C ATOM 673 CD ARG A 42 8.789 1.745 -6.299 1.00 0.00 C ATOM 674 NE ARG A 42 10.094 2.368 -6.656 1.00 0.00 N ATOM 675 CZ ARG A 42 10.325 2.743 -7.884 1.00 0.00 C ATOM 676 NH1 ARG A 42 10.621 1.853 -8.794 1.00 0.00 N ATOM 677 NH2 ARG A 42 10.259 4.006 -8.204 1.00 0.00 N ATOM 0 H ARG A 42 5.717 3.306 -3.473 1.00 0.00 H new ATOM 0 HA ARG A 42 6.000 1.309 -5.598 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.513 2.543 -3.259 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.143 1.056 -3.940 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.371 3.304 -5.822 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.883 3.424 -4.943 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.931 0.764 -5.845 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.166 1.601 -7.182 1.00 0.00 H new ATOM 0 HE ARG A 42 10.808 2.502 -5.940 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.671 0.865 -8.544 1.00 0.00 H new ATOM 0 HH12 ARG A 42 10.802 2.146 -9.754 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.027 4.701 -7.494 1.00 0.00 H new ATOM 0 HH22 ARG A 42 10.440 4.299 -9.164 1.00 0.00 H new ATOM 691 N ALA A 43 6.068 0.104 -2.547 1.00 0.00 N ATOM 692 CA ALA A 43 5.748 -1.135 -1.775 1.00 0.00 C ATOM 693 C ALA A 43 4.382 -1.687 -2.177 1.00 0.00 C ATOM 694 O ALA A 43 4.222 -2.874 -2.369 1.00 0.00 O ATOM 695 CB ALA A 43 5.739 -0.695 -0.311 1.00 0.00 C ATOM 0 H ALA A 43 6.540 0.834 -2.014 1.00 0.00 H new ATOM 0 HA ALA A 43 6.470 -1.930 -1.962 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.511 -1.551 0.325 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.718 -0.296 -0.045 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.982 0.076 -0.167 1.00 0.00 H new ATOM 701 N LEU A 44 3.399 -0.842 -2.316 1.00 0.00 N ATOM 702 CA LEU A 44 2.051 -1.339 -2.710 1.00 0.00 C ATOM 703 C LEU A 44 2.107 -1.908 -4.125 1.00 0.00 C ATOM 704 O LEU A 44 1.544 -2.946 -4.410 1.00 0.00 O ATOM 705 CB LEU A 44 1.142 -0.116 -2.643 1.00 0.00 C ATOM 706 CG LEU A 44 0.697 0.104 -1.197 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.248 1.555 -1.014 1.00 0.00 C ATOM 708 CD2 LEU A 44 -0.466 -0.838 -0.876 1.00 0.00 C ATOM 0 H LEU A 44 3.469 0.166 -2.175 1.00 0.00 H new ATOM 0 HA LEU A 44 1.689 -2.137 -2.062 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.669 0.764 -3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.273 -0.259 -3.285 1.00 0.00 H new ATOM 0 HG LEU A 44 1.529 -0.102 -0.524 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.069 1.710 0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.077 2.224 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.585 1.766 -1.685 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.786 -0.683 0.155 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.298 -0.631 -1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.144 -1.871 -1.005 1.00 0.00 H new ATOM 720 N HIS A 45 2.803 -1.252 -5.010 1.00 0.00 N ATOM 721 CA HIS A 45 2.918 -1.777 -6.396 1.00 0.00 C ATOM 722 C HIS A 45 3.740 -3.066 -6.359 1.00 0.00 C ATOM 723 O HIS A 45 3.517 -3.988 -7.118 1.00 0.00 O ATOM 724 CB HIS A 45 3.648 -0.682 -7.177 1.00 0.00 C ATOM 725 CG HIS A 45 4.262 -1.268 -8.420 1.00 0.00 C ATOM 726 ND1 HIS A 45 3.843 -0.913 -9.692 1.00 0.00 N ATOM 727 CD2 HIS A 45 5.263 -2.190 -8.599 1.00 0.00 C ATOM 728 CE1 HIS A 45 4.583 -1.613 -10.572 1.00 0.00 C ATOM 729 NE2 HIS A 45 5.463 -2.407 -9.958 1.00 0.00 N ATOM 0 H HIS A 45 3.296 -0.377 -4.833 1.00 0.00 H new ATOM 0 HA HIS A 45 1.956 -2.009 -6.854 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.952 0.113 -7.444 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.422 -0.233 -6.555 1.00 0.00 H new ATOM 0 HD2 HIS A 45 5.812 -2.674 -7.805 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.478 -1.541 -11.644 1.00 0.00 H new ATOM 0 HE2 HIS A 45 6.137 -3.037 -10.392 1.00 0.00 H new ATOM 737 N THR A 46 4.682 -3.132 -5.457 1.00 0.00 N ATOM 738 CA THR A 46 5.521 -4.353 -5.331 1.00 0.00 C ATOM 739 C THR A 46 4.744 -5.405 -4.532 1.00 0.00 C ATOM 740 O THR A 46 4.853 -6.592 -4.770 1.00 0.00 O ATOM 741 CB THR A 46 6.785 -3.874 -4.590 1.00 0.00 C ATOM 742 OG1 THR A 46 7.855 -3.764 -5.518 1.00 0.00 O ATOM 743 CG2 THR A 46 7.180 -4.855 -3.480 1.00 0.00 C ATOM 0 H THR A 46 4.906 -2.386 -4.799 1.00 0.00 H new ATOM 0 HA THR A 46 5.782 -4.815 -6.283 1.00 0.00 H new ATOM 0 HB THR A 46 6.573 -2.906 -4.136 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.661 -3.458 -5.053 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.075 -4.491 -2.975 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.365 -4.938 -2.761 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.381 -5.834 -3.914 1.00 0.00 H new ATOM 751 N LEU A 47 3.950 -4.968 -3.590 1.00 0.00 N ATOM 752 CA LEU A 47 3.150 -5.928 -2.779 1.00 0.00 C ATOM 753 C LEU A 47 1.924 -6.377 -3.580 1.00 0.00 C ATOM 754 O LEU A 47 1.486 -7.506 -3.487 1.00 0.00 O ATOM 755 CB LEU A 47 2.728 -5.141 -1.535 1.00 0.00 C ATOM 756 CG LEU A 47 3.748 -5.361 -0.416 1.00 0.00 C ATOM 757 CD1 LEU A 47 3.514 -4.335 0.694 1.00 0.00 C ATOM 758 CD2 LEU A 47 3.588 -6.772 0.154 1.00 0.00 C ATOM 0 H LEU A 47 3.822 -3.985 -3.348 1.00 0.00 H new ATOM 0 HA LEU A 47 3.709 -6.826 -2.515 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.656 -4.079 -1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.739 -5.462 -1.207 1.00 0.00 H new ATOM 0 HG LEU A 47 4.755 -5.244 -0.816 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.240 -4.490 1.492 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.629 -3.329 0.290 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.506 -4.453 1.092 1.00 0.00 H new ATOM 0 HD21 LEU A 47 4.315 -6.927 0.951 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.581 -6.891 0.554 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.754 -7.504 -0.636 1.00 0.00 H new ATOM 770 N LYS A 48 1.378 -5.499 -4.381 1.00 0.00 N ATOM 771 CA LYS A 48 0.194 -5.866 -5.206 1.00 0.00 C ATOM 772 C LYS A 48 0.591 -6.939 -6.225 1.00 0.00 C ATOM 773 O LYS A 48 -0.174 -7.831 -6.536 1.00 0.00 O ATOM 774 CB LYS A 48 -0.189 -4.558 -5.902 1.00 0.00 C ATOM 775 CG LYS A 48 -1.053 -4.837 -7.135 1.00 0.00 C ATOM 776 CD LYS A 48 -1.000 -3.617 -8.052 1.00 0.00 C ATOM 777 CE LYS A 48 0.222 -3.721 -8.963 1.00 0.00 C ATOM 778 NZ LYS A 48 -0.332 -3.971 -10.322 1.00 0.00 N ATOM 0 H LYS A 48 1.705 -4.540 -4.498 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.631 -6.277 -4.625 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.732 -3.916 -5.208 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.712 -4.019 -6.197 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -0.690 -5.721 -7.660 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.081 -5.043 -6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.909 -3.558 -8.650 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -0.949 -2.704 -7.459 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.811 -2.804 -8.939 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.880 -4.531 -8.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.448 -4.054 -11.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.882 -4.853 -10.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.949 -3.180 -10.596 1.00 0.00 H new ATOM 792 N GLY A 49 1.786 -6.854 -6.747 1.00 0.00 N ATOM 793 CA GLY A 49 2.240 -7.863 -7.746 1.00 0.00 C ATOM 794 C GLY A 49 2.353 -9.231 -7.075 1.00 0.00 C ATOM 795 O GLY A 49 1.760 -10.198 -7.510 1.00 0.00 O ATOM 0 H GLY A 49 2.467 -6.128 -6.524 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.535 -7.911 -8.576 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.204 -7.570 -8.162 1.00 0.00 H new ATOM 799 N MET A 50 3.110 -9.320 -6.016 1.00 0.00 N ATOM 800 CA MET A 50 3.259 -10.627 -5.315 1.00 0.00 C ATOM 801 C MET A 50 1.899 -11.102 -4.797 1.00 0.00 C ATOM 802 O MET A 50 1.740 -12.238 -4.397 1.00 0.00 O ATOM 803 CB MET A 50 4.206 -10.347 -4.153 1.00 0.00 C ATOM 804 CG MET A 50 3.564 -9.324 -3.223 1.00 0.00 C ATOM 805 SD MET A 50 4.067 -9.658 -1.517 1.00 0.00 S ATOM 806 CE MET A 50 5.629 -8.747 -1.564 1.00 0.00 C ATOM 0 H MET A 50 3.631 -8.545 -5.606 1.00 0.00 H new ATOM 0 HA MET A 50 3.642 -11.409 -5.971 1.00 0.00 H new ATOM 0 HB2 MET A 50 4.418 -11.268 -3.610 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.158 -9.971 -4.526 1.00 0.00 H new ATOM 0 HG2 MET A 50 3.864 -8.316 -3.511 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.478 -9.370 -3.309 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.828 -8.315 -0.583 1.00 0.00 H new ATOM 0 HE2 MET A 50 6.438 -9.426 -1.832 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.564 -7.951 -2.305 1.00 0.00 H new ATOM 816 N ALA A 51 0.917 -10.243 -4.808 1.00 0.00 N ATOM 817 CA ALA A 51 -0.432 -10.648 -4.326 1.00 0.00 C ATOM 818 C ALA A 51 -1.225 -11.245 -5.484 1.00 0.00 C ATOM 819 O ALA A 51 -2.157 -12.001 -5.294 1.00 0.00 O ATOM 820 CB ALA A 51 -1.083 -9.356 -3.835 1.00 0.00 C ATOM 0 H ALA A 51 0.991 -9.278 -5.130 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.391 -11.400 -3.538 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.084 -9.572 -3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.482 -8.928 -3.033 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.148 -8.645 -4.659 1.00 0.00 H new ATOM 826 N GLY A 52 -0.843 -10.922 -6.688 1.00 0.00 N ATOM 827 CA GLY A 52 -1.549 -11.479 -7.868 1.00 0.00 C ATOM 828 C GLY A 52 -0.846 -12.767 -8.272 1.00 0.00 C ATOM 829 O GLY A 52 -1.442 -13.685 -8.797 1.00 0.00 O ATOM 0 H GLY A 52 -0.069 -10.294 -6.903 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.595 -11.674 -7.629 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.538 -10.764 -8.691 1.00 0.00 H new ATOM 833 N THR A 53 0.431 -12.834 -8.015 1.00 0.00 N ATOM 834 CA THR A 53 1.203 -14.054 -8.364 1.00 0.00 C ATOM 835 C THR A 53 1.045 -15.102 -7.264 1.00 0.00 C ATOM 836 O THR A 53 1.434 -16.244 -7.410 1.00 0.00 O ATOM 837 CB THR A 53 2.651 -13.576 -8.456 1.00 0.00 C ATOM 838 OG1 THR A 53 2.834 -12.847 -9.662 1.00 0.00 O ATOM 839 CG2 THR A 53 3.586 -14.780 -8.437 1.00 0.00 C ATOM 0 H THR A 53 0.974 -12.090 -7.576 1.00 0.00 H new ATOM 0 HA THR A 53 0.867 -14.518 -9.291 1.00 0.00 H new ATOM 0 HB THR A 53 2.876 -12.931 -7.607 1.00 0.00 H new ATOM 0 HG1 THR A 53 3.762 -12.539 -9.720 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.619 -14.439 -8.503 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.445 -15.335 -7.510 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.363 -15.427 -9.285 1.00 0.00 H new ATOM 847 N MET A 54 0.464 -14.715 -6.167 1.00 0.00 N ATOM 848 CA MET A 54 0.256 -15.673 -5.043 1.00 0.00 C ATOM 849 C MET A 54 -1.188 -16.175 -5.050 1.00 0.00 C ATOM 850 O MET A 54 -1.620 -16.873 -4.154 1.00 0.00 O ATOM 851 CB MET A 54 0.542 -14.871 -3.772 1.00 0.00 C ATOM 852 CG MET A 54 0.777 -15.832 -2.604 1.00 0.00 C ATOM 853 SD MET A 54 2.390 -15.492 -1.856 1.00 0.00 S ATOM 854 CE MET A 54 3.376 -15.671 -3.361 1.00 0.00 C ATOM 0 H MET A 54 0.121 -13.770 -5.996 1.00 0.00 H new ATOM 0 HA MET A 54 0.901 -16.548 -5.119 1.00 0.00 H new ATOM 0 HB2 MET A 54 1.417 -14.238 -3.918 1.00 0.00 H new ATOM 0 HB3 MET A 54 -0.296 -14.210 -3.550 1.00 0.00 H new ATOM 0 HG2 MET A 54 -0.012 -15.717 -1.861 1.00 0.00 H new ATOM 0 HG3 MET A 54 0.737 -16.863 -2.954 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.305 -16.192 -3.128 1.00 0.00 H new ATOM 0 HE2 MET A 54 2.814 -16.244 -4.098 1.00 0.00 H new ATOM 0 HE3 MET A 54 3.605 -14.685 -3.765 1.00 0.00 H new ATOM 864 N GLY A 55 -1.935 -15.824 -6.059 1.00 0.00 N ATOM 865 CA GLY A 55 -3.350 -16.277 -6.132 1.00 0.00 C ATOM 866 C GLY A 55 -4.218 -15.403 -5.226 1.00 0.00 C ATOM 867 O GLY A 55 -5.417 -15.581 -5.142 1.00 0.00 O ATOM 0 H GLY A 55 -1.625 -15.242 -6.837 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.708 -16.220 -7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.424 -17.321 -5.826 1.00 0.00 H new ATOM 871 N PHE A 56 -3.628 -14.455 -4.548 1.00 0.00 N ATOM 872 CA PHE A 56 -4.431 -13.576 -3.654 1.00 0.00 C ATOM 873 C PHE A 56 -4.729 -12.248 -4.354 1.00 0.00 C ATOM 874 O PHE A 56 -4.401 -11.188 -3.861 1.00 0.00 O ATOM 875 CB PHE A 56 -3.553 -13.346 -2.421 1.00 0.00 C ATOM 876 CG PHE A 56 -3.216 -14.671 -1.775 1.00 0.00 C ATOM 877 CD1 PHE A 56 -4.039 -15.787 -1.984 1.00 0.00 C ATOM 878 CD2 PHE A 56 -2.081 -14.782 -0.963 1.00 0.00 C ATOM 879 CE1 PHE A 56 -3.725 -17.011 -1.381 1.00 0.00 C ATOM 880 CE2 PHE A 56 -1.767 -16.005 -0.359 1.00 0.00 C ATOM 881 CZ PHE A 56 -2.589 -17.120 -0.569 1.00 0.00 C ATOM 0 H PHE A 56 -2.629 -14.253 -4.575 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.390 -14.022 -3.390 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -2.638 -12.828 -2.707 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.072 -12.706 -1.708 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -4.915 -15.702 -2.610 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.447 -13.923 -0.802 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -4.359 -17.871 -1.542 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -0.892 -16.089 0.268 1.00 0.00 H new ATOM 0 HZ PHE A 56 -2.346 -18.064 -0.104 1.00 0.00 H new ATOM 891 N SER A 57 -5.349 -12.296 -5.502 1.00 0.00 N ATOM 892 CA SER A 57 -5.664 -11.032 -6.224 1.00 0.00 C ATOM 893 C SER A 57 -6.671 -10.218 -5.425 1.00 0.00 C ATOM 894 O SER A 57 -6.758 -9.013 -5.542 1.00 0.00 O ATOM 895 CB SER A 57 -6.255 -11.466 -7.564 1.00 0.00 C ATOM 896 OG SER A 57 -5.809 -12.780 -7.871 1.00 0.00 O ATOM 0 H SER A 57 -5.649 -13.152 -5.969 1.00 0.00 H new ATOM 0 HA SER A 57 -4.784 -10.404 -6.363 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.344 -11.440 -7.520 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.952 -10.774 -8.349 1.00 0.00 H new ATOM 0 HG SER A 57 -6.523 -13.422 -7.676 1.00 0.00 H new ATOM 902 N SER A 58 -7.414 -10.872 -4.594 1.00 0.00 N ATOM 903 CA SER A 58 -8.409 -10.151 -3.758 1.00 0.00 C ATOM 904 C SER A 58 -7.661 -9.172 -2.864 1.00 0.00 C ATOM 905 O SER A 58 -8.190 -8.167 -2.429 1.00 0.00 O ATOM 906 CB SER A 58 -9.093 -11.233 -2.925 1.00 0.00 C ATOM 907 OG SER A 58 -9.785 -12.123 -3.790 1.00 0.00 O ATOM 0 H SER A 58 -7.379 -11.882 -4.453 1.00 0.00 H new ATOM 0 HA SER A 58 -9.138 -9.588 -4.341 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.354 -11.779 -2.339 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.788 -10.779 -2.219 1.00 0.00 H new ATOM 0 HG SER A 58 -10.224 -12.820 -3.259 1.00 0.00 H new ATOM 913 N MET A 59 -6.420 -9.463 -2.603 1.00 0.00 N ATOM 914 CA MET A 59 -5.599 -8.564 -1.756 1.00 0.00 C ATOM 915 C MET A 59 -4.635 -7.778 -2.639 1.00 0.00 C ATOM 916 O MET A 59 -4.114 -6.752 -2.247 1.00 0.00 O ATOM 917 CB MET A 59 -4.844 -9.498 -0.811 1.00 0.00 C ATOM 918 CG MET A 59 -3.758 -8.717 -0.067 1.00 0.00 C ATOM 919 SD MET A 59 -2.486 -9.866 0.511 1.00 0.00 S ATOM 920 CE MET A 59 -1.868 -10.356 -1.118 1.00 0.00 C ATOM 0 H MET A 59 -5.936 -10.294 -2.944 1.00 0.00 H new ATOM 0 HA MET A 59 -6.193 -7.835 -1.204 1.00 0.00 H new ATOM 0 HB2 MET A 59 -5.536 -9.945 -0.098 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.395 -10.315 -1.375 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.317 -7.969 -0.725 1.00 0.00 H new ATOM 0 HG3 MET A 59 -4.192 -8.182 0.778 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.860 -11.443 -1.192 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.516 -9.945 -1.892 1.00 0.00 H new ATOM 0 HE3 MET A 59 -0.855 -9.976 -1.253 1.00 0.00 H new ATOM 930 N ALA A 60 -4.403 -8.243 -3.835 1.00 0.00 N ATOM 931 CA ALA A 60 -3.484 -7.510 -4.744 1.00 0.00 C ATOM 932 C ALA A 60 -4.204 -6.286 -5.301 1.00 0.00 C ATOM 933 O ALA A 60 -3.630 -5.226 -5.446 1.00 0.00 O ATOM 934 CB ALA A 60 -3.138 -8.497 -5.860 1.00 0.00 C ATOM 0 H ALA A 60 -4.809 -9.096 -4.220 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.583 -7.160 -4.240 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.461 -8.021 -6.569 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.656 -9.376 -5.432 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.050 -8.798 -6.375 1.00 0.00 H new ATOM 940 N LYS A 61 -5.473 -6.415 -5.578 1.00 0.00 N ATOM 941 CA LYS A 61 -6.235 -5.242 -6.083 1.00 0.00 C ATOM 942 C LYS A 61 -6.314 -4.241 -4.952 1.00 0.00 C ATOM 943 O LYS A 61 -6.306 -3.039 -5.140 1.00 0.00 O ATOM 944 CB LYS A 61 -7.624 -5.779 -6.413 1.00 0.00 C ATOM 945 CG LYS A 61 -7.657 -6.199 -7.874 1.00 0.00 C ATOM 946 CD LYS A 61 -7.617 -7.722 -7.958 1.00 0.00 C ATOM 947 CE LYS A 61 -8.919 -8.300 -7.395 1.00 0.00 C ATOM 948 NZ LYS A 61 -9.762 -8.582 -8.589 1.00 0.00 N ATOM 0 H LYS A 61 -6.010 -7.276 -5.477 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.785 -4.764 -6.953 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.862 -6.628 -5.772 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.378 -5.015 -6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -8.559 -5.820 -8.354 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.808 -5.771 -8.407 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.485 -8.036 -8.993 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.764 -8.105 -7.398 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.732 -9.207 -6.820 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.408 -7.593 -6.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.673 -8.981 -8.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.929 -7.699 -9.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -9.274 -9.263 -9.205 1.00 0.00 H new ATOM 962 N LEU A 62 -6.361 -4.762 -3.770 1.00 0.00 N ATOM 963 CA LEU A 62 -6.409 -3.912 -2.566 1.00 0.00 C ATOM 964 C LEU A 62 -5.096 -3.142 -2.461 1.00 0.00 C ATOM 965 O LEU A 62 -5.069 -1.987 -2.098 1.00 0.00 O ATOM 966 CB LEU A 62 -6.551 -4.910 -1.420 1.00 0.00 C ATOM 967 CG LEU A 62 -6.556 -4.169 -0.086 1.00 0.00 C ATOM 968 CD1 LEU A 62 -7.473 -2.947 -0.173 1.00 0.00 C ATOM 969 CD2 LEU A 62 -7.060 -5.106 1.014 1.00 0.00 C ATOM 0 H LEU A 62 -6.368 -5.765 -3.584 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.216 -3.180 -2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.474 -5.479 -1.534 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.730 -5.626 -1.445 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.543 -3.841 0.146 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.472 -2.423 0.783 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.114 -2.278 -0.955 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.487 -3.269 -0.409 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.064 -4.578 1.968 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.072 -5.435 0.777 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.403 -5.973 1.082 1.00 0.00 H new ATOM 981 N CYS A 63 -4.009 -3.782 -2.798 1.00 0.00 N ATOM 982 CA CYS A 63 -2.688 -3.098 -2.741 1.00 0.00 C ATOM 983 C CYS A 63 -2.583 -2.097 -3.893 1.00 0.00 C ATOM 984 O CYS A 63 -1.983 -1.049 -3.771 1.00 0.00 O ATOM 985 CB CYS A 63 -1.652 -4.210 -2.901 1.00 0.00 C ATOM 986 SG CYS A 63 -1.806 -5.385 -1.533 1.00 0.00 S ATOM 0 H CYS A 63 -3.980 -4.752 -3.111 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.542 -2.546 -1.813 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.798 -4.722 -3.852 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -0.648 -3.786 -2.918 1.00 0.00 H new ATOM 0 HG CYS A 63 -2.773 -6.217 -1.783 1.00 0.00 H new ATOM 992 N HIS A 64 -3.177 -2.418 -5.009 1.00 0.00 N ATOM 993 CA HIS A 64 -3.137 -1.498 -6.179 1.00 0.00 C ATOM 994 C HIS A 64 -4.065 -0.316 -5.919 1.00 0.00 C ATOM 995 O HIS A 64 -3.901 0.757 -6.464 1.00 0.00 O ATOM 996 CB HIS A 64 -3.653 -2.333 -7.349 1.00 0.00 C ATOM 997 CG HIS A 64 -3.329 -1.644 -8.646 1.00 0.00 C ATOM 998 ND1 HIS A 64 -4.169 -1.712 -9.746 1.00 0.00 N ATOM 999 CD2 HIS A 64 -2.265 -0.867 -9.035 1.00 0.00 C ATOM 1000 CE1 HIS A 64 -3.602 -0.998 -10.735 1.00 0.00 C ATOM 1001 NE2 HIS A 64 -2.440 -0.461 -10.355 1.00 0.00 N ATOM 0 H HIS A 64 -3.692 -3.285 -5.161 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.141 -1.099 -6.374 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.199 -3.324 -7.329 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.730 -2.474 -7.260 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -1.421 -0.610 -8.412 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -4.034 -0.874 -11.717 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -1.815 0.121 -10.912 1.00 0.00 H new ATOM 1009 N THR A 65 -5.041 -0.516 -5.081 1.00 0.00 N ATOM 1010 CA THR A 65 -5.994 0.575 -4.761 1.00 0.00 C ATOM 1011 C THR A 65 -5.289 1.648 -3.920 1.00 0.00 C ATOM 1012 O THR A 65 -5.248 2.806 -4.282 1.00 0.00 O ATOM 1013 CB THR A 65 -7.111 -0.130 -3.980 1.00 0.00 C ATOM 1014 OG1 THR A 65 -8.156 -0.477 -4.874 1.00 0.00 O ATOM 1015 CG2 THR A 65 -7.664 0.777 -2.883 1.00 0.00 C ATOM 0 H THR A 65 -5.219 -1.398 -4.601 1.00 0.00 H new ATOM 0 HA THR A 65 -6.384 1.092 -5.638 1.00 0.00 H new ATOM 0 HB THR A 65 -6.700 -1.026 -3.514 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.972 -1.356 -5.266 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.454 0.255 -2.343 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.864 1.040 -2.191 1.00 0.00 H new ATOM 0 HG23 THR A 65 -8.069 1.685 -3.331 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.715 1.265 -2.810 1.00 0.00 N ATOM 1024 CA LEU A 66 -3.996 2.267 -1.966 1.00 0.00 C ATOM 1025 C LEU A 66 -2.924 2.938 -2.821 1.00 0.00 C ATOM 1026 O LEU A 66 -2.802 4.145 -2.861 1.00 0.00 O ATOM 1027 CB LEU A 66 -3.328 1.484 -0.822 1.00 0.00 C ATOM 1028 CG LEU A 66 -4.226 0.348 -0.317 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -3.680 -0.172 1.012 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -5.659 0.851 -0.114 1.00 0.00 C ATOM 0 H LEU A 66 -4.712 0.310 -2.452 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.670 3.028 -1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.379 1.073 -1.167 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.101 2.162 0.000 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.234 -0.453 -1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.315 -0.980 1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.666 -0.545 0.868 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.669 0.637 1.742 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.284 0.033 0.245 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.661 1.658 0.619 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.053 1.220 -1.061 1.00 0.00 H new ATOM 1042 N GLU A 67 -2.152 2.145 -3.512 1.00 0.00 N ATOM 1043 CA GLU A 67 -1.073 2.691 -4.379 1.00 0.00 C ATOM 1044 C GLU A 67 -1.667 3.621 -5.429 1.00 0.00 C ATOM 1045 O GLU A 67 -1.010 4.510 -5.933 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.430 1.436 -5.002 1.00 0.00 C ATOM 1047 CG GLU A 67 -0.592 1.406 -6.531 1.00 0.00 C ATOM 1048 CD GLU A 67 0.460 2.310 -7.177 1.00 0.00 C ATOM 1049 OE1 GLU A 67 1.404 2.669 -6.493 1.00 0.00 O ATOM 1050 OE2 GLU A 67 0.304 2.628 -8.345 1.00 0.00 O ATOM 0 H GLU A 67 -2.225 1.128 -3.512 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.339 3.291 -3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.630 1.408 -4.749 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.885 0.544 -4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.484 0.385 -6.898 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.592 1.740 -6.807 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.904 3.427 -5.759 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.528 4.305 -6.768 1.00 0.00 C ATOM 1059 C ASN A 68 -3.596 5.719 -6.222 1.00 0.00 C ATOM 1060 O ASN A 68 -3.290 6.675 -6.900 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.927 3.755 -6.956 1.00 0.00 C ATOM 1062 CG ASN A 68 -5.250 3.655 -8.448 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -6.146 4.316 -8.932 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -4.553 2.849 -9.201 1.00 0.00 N ATOM 0 H ASN A 68 -3.508 2.700 -5.374 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.972 4.332 -7.705 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -5.007 2.772 -6.491 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.651 4.402 -6.461 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.761 2.774 -10.197 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.800 2.294 -8.794 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.978 5.848 -4.982 1.00 0.00 N ATOM 1072 CA ILE A 69 -4.057 7.195 -4.361 1.00 0.00 C ATOM 1073 C ILE A 69 -2.657 7.719 -4.206 1.00 0.00 C ATOM 1074 O ILE A 69 -2.377 8.893 -4.346 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.718 6.970 -3.009 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -6.199 6.711 -3.236 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -4.543 8.212 -2.129 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -6.395 5.322 -3.840 1.00 0.00 C ATOM 0 H ILE A 69 -4.239 5.074 -4.371 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.621 7.919 -4.949 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.258 6.118 -2.508 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.740 6.787 -2.293 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.612 7.469 -3.902 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.019 8.043 -1.163 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.481 8.407 -1.981 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.005 9.071 -2.616 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.458 5.142 -4.001 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.869 5.262 -4.793 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.998 4.570 -3.158 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.774 6.827 -3.970 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.355 7.218 -3.862 1.00 0.00 C ATOM 1092 C LEU A 70 0.159 7.461 -5.265 1.00 0.00 C ATOM 1093 O LEU A 70 1.204 8.047 -5.471 1.00 0.00 O ATOM 1094 CB LEU A 70 0.366 6.051 -3.185 1.00 0.00 C ATOM 1095 CG LEU A 70 -0.325 5.700 -1.860 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.660 4.967 -0.952 1.00 0.00 C ATOM 1097 CD2 LEU A 70 -0.802 6.976 -1.155 1.00 0.00 C ATOM 0 H LEU A 70 -1.965 5.833 -3.845 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.197 8.125 -3.279 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.368 5.183 -3.844 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.408 6.314 -3.002 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.185 5.064 -2.069 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.170 4.717 -0.011 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.994 4.052 -1.441 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.519 5.608 -0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.290 6.712 -0.217 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.053 7.620 -0.951 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.508 7.503 -1.796 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.602 7.053 -6.242 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.187 7.306 -7.636 1.00 0.00 C ATOM 1111 C ASP A 71 -0.645 8.706 -8.004 1.00 0.00 C ATOM 1112 O ASP A 71 0.144 9.547 -8.387 1.00 0.00 O ATOM 1113 CB ASP A 71 -0.890 6.245 -8.481 1.00 0.00 C ATOM 1114 CG ASP A 71 -0.287 6.226 -9.887 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.097 7.282 -10.361 1.00 0.00 O ATOM 1116 OD2 ASP A 71 -0.217 5.153 -10.466 1.00 0.00 O ATOM 0 H ASP A 71 -1.487 6.559 -6.130 1.00 0.00 H new ATOM 0 HA ASP A 71 0.891 7.248 -7.790 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.783 5.265 -8.015 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.958 6.457 -8.535 1.00 0.00 H new ATOM 1121 N LYS A 72 -1.910 8.991 -7.857 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.370 10.354 -8.161 1.00 0.00 C ATOM 1123 C LYS A 72 -1.692 11.315 -7.201 1.00 0.00 C ATOM 1124 O LYS A 72 -1.416 12.455 -7.518 1.00 0.00 O ATOM 1125 CB LYS A 72 -3.853 10.262 -7.917 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.436 9.324 -8.966 1.00 0.00 C ATOM 1127 CD LYS A 72 -5.753 8.739 -8.478 1.00 0.00 C ATOM 1128 CE LYS A 72 -5.657 8.327 -7.013 1.00 0.00 C ATOM 1129 NZ LYS A 72 -6.426 7.054 -6.917 1.00 0.00 N ATOM 0 H LYS A 72 -2.630 8.340 -7.543 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.144 10.710 -9.166 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.053 9.886 -6.914 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.314 11.247 -7.986 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.594 9.864 -9.899 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.730 8.521 -9.178 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.549 9.473 -8.602 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.019 7.874 -9.086 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -4.620 8.185 -6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.077 9.092 -6.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -6.594 6.824 -5.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.338 7.162 -7.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -5.884 6.286 -7.362 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.394 10.834 -6.036 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.695 11.672 -5.036 1.00 0.00 C ATOM 1145 C ALA A 73 0.710 11.965 -5.543 1.00 0.00 C ATOM 1146 O ALA A 73 1.282 13.006 -5.281 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.640 10.802 -3.783 1.00 0.00 C ATOM 0 H ALA A 73 -1.607 9.885 -5.730 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.187 12.626 -4.846 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.135 11.346 -2.984 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.653 10.553 -3.468 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.092 9.885 -4.000 1.00 0.00 H new ATOM 1153 N ARG A 74 1.261 11.051 -6.289 1.00 0.00 N ATOM 1154 CA ARG A 74 2.623 11.264 -6.845 1.00 0.00 C ATOM 1155 C ARG A 74 2.497 11.910 -8.224 1.00 0.00 C ATOM 1156 O ARG A 74 3.414 12.535 -8.719 1.00 0.00 O ATOM 1157 CB ARG A 74 3.271 9.865 -6.910 1.00 0.00 C ATOM 1158 CG ARG A 74 3.145 9.251 -8.315 1.00 0.00 C ATOM 1159 CD ARG A 74 4.079 8.045 -8.427 1.00 0.00 C ATOM 1160 NE ARG A 74 5.090 8.436 -9.448 1.00 0.00 N ATOM 1161 CZ ARG A 74 4.927 8.090 -10.698 1.00 0.00 C ATOM 1162 NH1 ARG A 74 3.759 7.689 -11.120 1.00 0.00 N ATOM 1163 NH2 ARG A 74 5.935 8.147 -11.528 1.00 0.00 N ATOM 0 H ARG A 74 0.825 10.163 -6.538 1.00 0.00 H new ATOM 0 HA ARG A 74 3.238 11.930 -6.239 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.324 9.937 -6.636 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.796 9.209 -6.181 1.00 0.00 H new ATOM 0 HG2 ARG A 74 2.115 8.946 -8.500 1.00 0.00 H new ATOM 0 HG3 ARG A 74 3.398 9.993 -9.072 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.550 7.820 -7.470 1.00 0.00 H new ATOM 0 HD3 ARG A 74 3.535 7.151 -8.732 1.00 0.00 H new ATOM 0 HE ARG A 74 5.911 8.975 -9.172 1.00 0.00 H new ATOM 0 HH11 ARG A 74 2.971 7.645 -10.474 1.00 0.00 H new ATOM 0 HH12 ARG A 74 3.634 7.420 -12.096 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.848 8.461 -11.200 1.00 0.00 H new ATOM 0 HH22 ARG A 74 5.808 7.877 -12.503 1.00 0.00 H new ATOM 1177 N ASN A 75 1.355 11.767 -8.839 1.00 0.00 N ATOM 1178 CA ASN A 75 1.152 12.372 -10.178 1.00 0.00 C ATOM 1179 C ASN A 75 0.771 13.837 -10.011 1.00 0.00 C ATOM 1180 O ASN A 75 1.496 14.722 -10.422 1.00 0.00 O ATOM 1181 CB ASN A 75 0.002 11.579 -10.801 1.00 0.00 C ATOM 1182 CG ASN A 75 -0.299 12.122 -12.198 1.00 0.00 C ATOM 1183 OD1 ASN A 75 0.058 13.237 -12.520 1.00 0.00 O ATOM 1184 ND2 ASN A 75 -0.948 11.373 -13.049 1.00 0.00 N ATOM 0 H ASN A 75 0.554 11.255 -8.468 1.00 0.00 H new ATOM 0 HA ASN A 75 2.045 12.335 -10.802 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.265 10.523 -10.859 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -0.886 11.652 -10.173 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -1.155 11.725 -13.984 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -1.248 10.436 -12.779 1.00 0.00 H new ATOM 1191 N SER A 76 -0.357 14.086 -9.385 1.00 0.00 N ATOM 1192 CA SER A 76 -0.834 15.491 -9.143 1.00 0.00 C ATOM 1193 C SER A 76 -2.367 15.550 -9.085 1.00 0.00 C ATOM 1194 O SER A 76 -2.945 16.605 -9.260 1.00 0.00 O ATOM 1195 CB SER A 76 -0.356 16.332 -10.331 1.00 0.00 C ATOM 1196 OG SER A 76 0.885 16.945 -10.005 1.00 0.00 O ATOM 0 H SER A 76 -0.979 13.363 -9.025 1.00 0.00 H new ATOM 0 HA SER A 76 -0.444 15.858 -8.194 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.243 15.703 -11.214 1.00 0.00 H new ATOM 0 HB3 SER A 76 -1.098 17.093 -10.574 1.00 0.00 H new ATOM 0 HG SER A 76 1.613 16.303 -10.141 1.00 0.00 H new ATOM 1202 N GLU A 77 -3.048 14.453 -8.853 1.00 0.00 N ATOM 1203 CA GLU A 77 -4.532 14.534 -8.811 1.00 0.00 C ATOM 1204 C GLU A 77 -5.034 14.495 -7.375 1.00 0.00 C ATOM 1205 O GLU A 77 -6.116 14.961 -7.075 1.00 0.00 O ATOM 1206 CB GLU A 77 -5.029 13.321 -9.595 1.00 0.00 C ATOM 1207 CG GLU A 77 -4.644 13.454 -11.064 1.00 0.00 C ATOM 1208 CD GLU A 77 -5.271 14.721 -11.645 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -6.413 14.997 -11.317 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -4.600 15.394 -12.409 1.00 0.00 O ATOM 0 H GLU A 77 -2.648 13.528 -8.695 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.898 15.467 -9.240 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -4.600 12.409 -9.180 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.112 13.236 -9.501 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.559 13.494 -11.164 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.983 12.580 -11.620 1.00 0.00 H new ATOM 1217 N ILE A 78 -4.269 13.940 -6.485 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.730 13.874 -5.069 1.00 0.00 C ATOM 1219 C ILE A 78 -3.540 13.738 -4.112 1.00 0.00 C ATOM 1220 O ILE A 78 -2.450 14.197 -4.385 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.598 12.618 -5.018 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.774 11.437 -5.491 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.802 12.776 -5.945 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -4.201 10.698 -4.291 1.00 0.00 C ATOM 0 H ILE A 78 -3.353 13.532 -6.669 1.00 0.00 H new ATOM 0 HA ILE A 78 -5.267 14.773 -4.766 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.945 12.461 -3.997 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.393 10.763 -6.083 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.967 11.780 -6.138 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.415 11.876 -5.902 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.395 13.634 -5.628 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.456 12.931 -6.967 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.609 9.850 -4.635 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.567 11.373 -3.716 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -5.015 10.341 -3.661 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.757 13.107 -2.990 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.670 12.918 -1.993 1.00 0.00 C ATOM 1238 C LYS A 79 -3.178 12.001 -0.878 1.00 0.00 C ATOM 1239 O LYS A 79 -4.016 11.151 -1.101 1.00 0.00 O ATOM 1240 CB LYS A 79 -2.370 14.314 -1.452 1.00 0.00 C ATOM 1241 CG LYS A 79 -3.553 14.806 -0.614 1.00 0.00 C ATOM 1242 CD LYS A 79 -4.214 15.999 -1.305 1.00 0.00 C ATOM 1243 CE LYS A 79 -3.147 17.024 -1.692 1.00 0.00 C ATOM 1244 NZ LYS A 79 -3.874 18.319 -1.782 1.00 0.00 N ATOM 0 H LYS A 79 -4.657 12.709 -2.720 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.776 12.462 -2.418 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -1.465 14.293 -0.845 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -2.184 15.002 -2.277 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.277 14.002 -0.483 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.212 15.093 0.381 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -4.751 15.666 -2.193 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.948 16.456 -0.641 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.353 17.068 -0.947 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -2.679 16.767 -2.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.208 19.074 -2.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.619 18.249 -2.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.304 18.541 -0.861 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.697 12.171 0.317 1.00 0.00 N ATOM 1259 CA ILE A 80 -3.170 11.317 1.435 1.00 0.00 C ATOM 1260 C ILE A 80 -3.561 12.219 2.600 1.00 0.00 C ATOM 1261 O ILE A 80 -2.987 12.169 3.669 1.00 0.00 O ATOM 1262 CB ILE A 80 -2.002 10.420 1.821 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -0.692 10.985 1.296 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -2.230 9.007 1.278 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.546 10.706 -0.202 1.00 0.00 C ATOM 0 H ILE A 80 -1.995 12.867 0.569 1.00 0.00 H new ATOM 0 HA ILE A 80 -4.035 10.714 1.159 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.940 10.377 2.908 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.655 12.059 1.476 1.00 0.00 H new ATOM 0 HG13 ILE A 80 0.144 10.542 1.837 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.391 8.370 1.557 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.150 8.600 1.698 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.312 9.043 0.192 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.398 11.118 -0.559 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.560 9.630 -0.375 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.372 11.171 -0.741 1.00 0.00 H new ATOM 1277 N THR A 81 -4.526 13.057 2.373 1.00 0.00 N ATOM 1278 CA THR A 81 -4.990 14.009 3.422 1.00 0.00 C ATOM 1279 C THR A 81 -5.548 13.271 4.635 1.00 0.00 C ATOM 1280 O THR A 81 -6.677 13.488 5.024 1.00 0.00 O ATOM 1281 CB THR A 81 -6.109 14.790 2.740 1.00 0.00 C ATOM 1282 OG1 THR A 81 -6.941 13.885 2.028 1.00 0.00 O ATOM 1283 CG2 THR A 81 -5.506 15.799 1.767 1.00 0.00 C ATOM 0 H THR A 81 -5.026 13.127 1.487 1.00 0.00 H new ATOM 0 HA THR A 81 -4.178 14.638 3.788 1.00 0.00 H new ATOM 0 HB THR A 81 -6.698 15.319 3.490 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.663 14.381 1.589 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.305 16.357 1.280 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.861 16.489 2.311 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.920 15.273 1.014 1.00 0.00 H new ATOM 1291 N SER A 82 -4.787 12.397 5.235 1.00 0.00 N ATOM 1292 CA SER A 82 -5.311 11.650 6.414 1.00 0.00 C ATOM 1293 C SER A 82 -6.431 10.717 5.953 1.00 0.00 C ATOM 1294 O SER A 82 -6.354 9.517 6.103 1.00 0.00 O ATOM 1295 CB SER A 82 -5.853 12.720 7.361 1.00 0.00 C ATOM 1296 OG SER A 82 -5.108 13.918 7.191 1.00 0.00 O ATOM 0 H SER A 82 -3.831 12.169 4.962 1.00 0.00 H new ATOM 0 HA SER A 82 -4.551 11.040 6.902 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.908 12.902 7.157 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.783 12.378 8.393 1.00 0.00 H new ATOM 0 HG SER A 82 -5.699 14.627 6.862 1.00 0.00 H new ATOM 1302 N ASP A 83 -7.464 11.271 5.380 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.599 10.448 4.882 1.00 0.00 C ATOM 1304 C ASP A 83 -8.153 9.576 3.713 1.00 0.00 C ATOM 1305 O ASP A 83 -8.307 8.371 3.729 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.608 11.470 4.385 1.00 0.00 C ATOM 1307 CG ASP A 83 -10.492 11.937 5.543 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -10.064 11.813 6.678 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -11.584 12.412 5.273 1.00 0.00 O ATOM 0 H ASP A 83 -7.570 12.275 5.234 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.996 9.785 5.651 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.089 12.322 3.946 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.224 11.033 3.599 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.590 10.172 2.696 1.00 0.00 N ATOM 1315 CA LEU A 84 -7.131 9.362 1.546 1.00 0.00 C ATOM 1316 C LEU A 84 -6.120 8.373 2.076 1.00 0.00 C ATOM 1317 O LEU A 84 -6.223 7.182 1.860 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.495 10.358 0.577 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.581 11.253 -0.023 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.932 12.323 -0.903 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.532 10.405 -0.872 1.00 0.00 C ATOM 0 H LEU A 84 -7.432 11.177 2.617 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.922 8.807 1.042 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.755 10.966 1.098 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.969 9.825 -0.215 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.140 11.732 0.781 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.706 12.961 -1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.255 12.928 -0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.372 11.843 -1.706 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.306 11.043 -1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.973 9.925 -1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.996 9.642 -0.247 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.159 8.852 2.806 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.174 7.922 3.384 1.00 0.00 C ATOM 1335 C LEU A 85 -4.894 6.977 4.358 1.00 0.00 C ATOM 1336 O LEU A 85 -4.480 5.854 4.571 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.170 8.845 4.086 1.00 0.00 C ATOM 1338 CG LEU A 85 -3.219 8.668 5.605 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -2.624 7.311 5.984 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -2.408 9.783 6.266 1.00 0.00 C ATOM 0 H LEU A 85 -5.018 9.839 3.023 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.673 7.281 2.659 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.164 8.632 3.725 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.387 9.882 3.832 1.00 0.00 H new ATOM 0 HG LEU A 85 -4.254 8.714 5.945 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.660 7.187 7.066 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.199 6.516 5.509 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.588 7.261 5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.439 9.663 7.349 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.374 9.732 5.925 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.832 10.750 5.996 1.00 0.00 H new ATOM 1352 N ASP A 86 -5.971 7.431 4.947 1.00 0.00 N ATOM 1353 CA ASP A 86 -6.722 6.567 5.906 1.00 0.00 C ATOM 1354 C ASP A 86 -7.322 5.368 5.177 1.00 0.00 C ATOM 1355 O ASP A 86 -7.299 4.257 5.666 1.00 0.00 O ATOM 1356 CB ASP A 86 -7.834 7.454 6.469 1.00 0.00 C ATOM 1357 CG ASP A 86 -7.429 7.971 7.849 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -6.671 7.289 8.518 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -7.883 9.044 8.214 1.00 0.00 O ATOM 0 H ASP A 86 -6.362 8.362 4.805 1.00 0.00 H new ATOM 0 HA ASP A 86 -6.076 6.177 6.693 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.021 8.291 5.796 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.763 6.889 6.540 1.00 0.00 H new ATOM 1364 N LYS A 87 -7.845 5.580 4.003 1.00 0.00 N ATOM 1365 CA LYS A 87 -8.423 4.441 3.248 1.00 0.00 C ATOM 1366 C LYS A 87 -7.278 3.581 2.741 1.00 0.00 C ATOM 1367 O LYS A 87 -7.365 2.371 2.685 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.193 5.066 2.087 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.246 6.030 2.633 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.126 5.301 3.650 1.00 0.00 C ATOM 1371 CE LYS A 87 -11.747 4.065 2.995 1.00 0.00 C ATOM 1372 NZ LYS A 87 -12.681 3.517 4.017 1.00 0.00 N ATOM 0 H LYS A 87 -7.896 6.486 3.538 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.080 3.813 3.850 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.508 5.596 1.426 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.671 4.287 1.493 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.762 6.886 3.103 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.858 6.417 1.818 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.533 5.007 4.516 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.910 5.967 4.012 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.275 4.327 2.078 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -10.984 3.335 2.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.146 2.666 3.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.150 3.270 4.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.401 4.231 4.248 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.186 4.202 2.402 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.015 3.422 1.937 1.00 0.00 C ATOM 1388 C ILE A 88 -4.522 2.561 3.098 1.00 0.00 C ATOM 1389 O ILE A 88 -4.264 1.385 2.957 1.00 0.00 O ATOM 1390 CB ILE A 88 -3.989 4.484 1.536 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -4.102 4.744 0.043 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -2.569 4.027 1.870 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.107 6.250 -0.197 1.00 0.00 C ATOM 0 H ILE A 88 -6.056 5.213 2.427 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.223 2.749 1.105 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.194 5.398 2.094 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.268 4.281 -0.484 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.015 4.297 -0.350 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -1.859 4.800 1.575 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.487 3.849 2.942 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.347 3.106 1.331 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.188 6.448 -1.266 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.956 6.698 0.320 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.181 6.682 0.183 1.00 0.00 H new ATOM 1405 N PHE A 89 -4.411 3.149 4.253 1.00 0.00 N ATOM 1406 CA PHE A 89 -3.955 2.378 5.441 1.00 0.00 C ATOM 1407 C PHE A 89 -5.044 1.399 5.860 1.00 0.00 C ATOM 1408 O PHE A 89 -4.798 0.426 6.546 1.00 0.00 O ATOM 1409 CB PHE A 89 -3.711 3.429 6.523 1.00 0.00 C ATOM 1410 CG PHE A 89 -3.303 2.752 7.810 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -2.487 1.614 7.775 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -3.738 3.263 9.039 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -2.107 0.988 8.968 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -3.357 2.636 10.232 1.00 0.00 C ATOM 1415 CZ PHE A 89 -2.542 1.499 10.196 1.00 0.00 C ATOM 0 H PHE A 89 -4.617 4.133 4.427 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.057 1.791 5.248 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.932 4.121 6.202 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.614 4.018 6.681 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.151 1.220 6.827 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -4.367 4.140 9.067 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.478 0.111 8.941 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.692 3.030 11.180 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.249 1.016 11.116 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.239 1.638 5.421 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.353 0.713 5.752 1.00 0.00 C ATOM 1427 C ALA A 90 -7.281 -0.475 4.800 1.00 0.00 C ATOM 1428 O ALA A 90 -7.672 -1.578 5.126 1.00 0.00 O ATOM 1429 CB ALA A 90 -8.635 1.519 5.533 1.00 0.00 C ATOM 0 H ALA A 90 -6.497 2.438 4.843 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.311 0.332 6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.500 0.896 5.760 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.634 2.390 6.188 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -8.686 1.847 4.495 1.00 0.00 H new ATOM 1435 N GLY A 91 -6.743 -0.257 3.630 1.00 0.00 N ATOM 1436 CA GLY A 91 -6.598 -1.370 2.661 1.00 0.00 C ATOM 1437 C GLY A 91 -5.463 -2.265 3.154 1.00 0.00 C ATOM 1438 O GLY A 91 -5.566 -3.475 3.161 1.00 0.00 O ATOM 0 H GLY A 91 -6.398 0.647 3.307 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.527 -1.936 2.585 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.377 -0.985 1.665 1.00 0.00 H new ATOM 1442 N VAL A 92 -4.388 -1.666 3.601 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.254 -2.467 4.132 1.00 0.00 C ATOM 1444 C VAL A 92 -3.706 -3.142 5.429 1.00 0.00 C ATOM 1445 O VAL A 92 -3.166 -4.147 5.846 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.142 -1.446 4.399 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.175 -1.987 5.457 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -1.375 -1.181 3.102 1.00 0.00 C ATOM 0 H VAL A 92 -4.251 -0.655 3.619 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.914 -3.248 3.452 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.588 -0.520 4.762 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.389 -1.255 5.640 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.718 -2.176 6.383 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.730 -2.916 5.102 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.584 -0.455 3.289 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.936 -2.112 2.742 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.058 -0.787 2.349 1.00 0.00 H new ATOM 1458 N ASP A 93 -4.714 -2.595 6.053 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.237 -3.194 7.309 1.00 0.00 C ATOM 1460 C ASP A 93 -5.939 -4.506 6.974 1.00 0.00 C ATOM 1461 O ASP A 93 -5.789 -5.500 7.657 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.228 -2.163 7.853 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.011 -1.993 9.358 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -4.937 -1.553 9.735 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -6.921 -2.307 10.107 1.00 0.00 O ATOM 0 H ASP A 93 -5.199 -1.753 5.742 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.459 -3.417 8.039 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.092 -1.208 7.345 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.250 -2.486 7.656 1.00 0.00 H new ATOM 1470 N MET A 94 -6.684 -4.524 5.904 1.00 0.00 N ATOM 1471 CA MET A 94 -7.368 -5.779 5.500 1.00 0.00 C ATOM 1472 C MET A 94 -6.331 -6.704 4.871 1.00 0.00 C ATOM 1473 O MET A 94 -6.309 -7.896 5.108 1.00 0.00 O ATOM 1474 CB MET A 94 -8.420 -5.353 4.476 1.00 0.00 C ATOM 1475 CG MET A 94 -9.699 -4.927 5.202 1.00 0.00 C ATOM 1476 SD MET A 94 -11.115 -5.114 4.090 1.00 0.00 S ATOM 1477 CE MET A 94 -10.407 -4.235 2.675 1.00 0.00 C ATOM 0 H MET A 94 -6.847 -3.723 5.294 1.00 0.00 H new ATOM 0 HA MET A 94 -7.832 -6.310 6.331 1.00 0.00 H new ATOM 0 HB2 MET A 94 -8.041 -4.529 3.871 1.00 0.00 H new ATOM 0 HB3 MET A 94 -8.633 -6.176 3.795 1.00 0.00 H new ATOM 0 HG2 MET A 94 -9.842 -5.534 6.096 1.00 0.00 H new ATOM 0 HG3 MET A 94 -9.615 -3.891 5.531 1.00 0.00 H new ATOM 0 HE1 MET A 94 -11.210 -3.854 2.044 1.00 0.00 H new ATOM 0 HE2 MET A 94 -9.799 -3.403 3.031 1.00 0.00 H new ATOM 0 HE3 MET A 94 -9.784 -4.918 2.097 1.00 0.00 H new ATOM 1487 N ILE A 95 -5.446 -6.144 4.092 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.374 -6.959 3.462 1.00 0.00 C ATOM 1489 C ILE A 95 -3.651 -7.745 4.562 1.00 0.00 C ATOM 1490 O ILE A 95 -3.368 -8.918 4.422 1.00 0.00 O ATOM 1491 CB ILE A 95 -3.454 -5.918 2.798 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -3.811 -5.794 1.315 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -1.985 -6.326 2.924 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -3.377 -4.419 0.803 1.00 0.00 C ATOM 0 H ILE A 95 -5.421 -5.150 3.865 1.00 0.00 H new ATOM 0 HA ILE A 95 -4.731 -7.688 2.734 1.00 0.00 H new ATOM 0 HB ILE A 95 -3.598 -4.963 3.303 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.317 -6.580 0.743 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.884 -5.925 1.175 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -1.356 -5.574 2.447 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -1.719 -6.406 3.978 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.832 -7.289 2.437 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.630 -4.328 -0.253 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.891 -3.641 1.368 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.300 -4.307 0.929 1.00 0.00 H new ATOM 1506 N THR A 96 -3.371 -7.101 5.662 1.00 0.00 N ATOM 1507 CA THR A 96 -2.689 -7.800 6.785 1.00 0.00 C ATOM 1508 C THR A 96 -3.678 -8.753 7.459 1.00 0.00 C ATOM 1509 O THR A 96 -3.331 -9.849 7.852 1.00 0.00 O ATOM 1510 CB THR A 96 -2.267 -6.685 7.744 1.00 0.00 C ATOM 1511 OG1 THR A 96 -1.224 -5.926 7.149 1.00 0.00 O ATOM 1512 CG2 THR A 96 -1.773 -7.293 9.058 1.00 0.00 C ATOM 0 H THR A 96 -3.586 -6.118 5.831 1.00 0.00 H new ATOM 0 HA THR A 96 -1.834 -8.394 6.462 1.00 0.00 H new ATOM 0 HB THR A 96 -3.121 -6.038 7.948 1.00 0.00 H new ATOM 0 HG1 THR A 96 -1.611 -5.205 6.610 1.00 0.00 H new ATOM 0 HG21 THR A 96 -1.473 -6.496 9.738 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.574 -7.876 9.513 1.00 0.00 H new ATOM 0 HG23 THR A 96 -0.919 -7.941 8.861 1.00 0.00 H new ATOM 1520 N ARG A 97 -4.914 -8.345 7.582 1.00 0.00 N ATOM 1521 CA ARG A 97 -5.930 -9.230 8.217 1.00 0.00 C ATOM 1522 C ARG A 97 -6.166 -10.461 7.338 1.00 0.00 C ATOM 1523 O ARG A 97 -6.333 -11.560 7.829 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.197 -8.378 8.315 1.00 0.00 C ATOM 1525 CG ARG A 97 -7.172 -7.575 9.616 1.00 0.00 C ATOM 1526 CD ARG A 97 -7.867 -6.231 9.399 1.00 0.00 C ATOM 1527 NE ARG A 97 -9.026 -6.246 10.335 1.00 0.00 N ATOM 1528 CZ ARG A 97 -10.237 -6.060 9.880 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -10.742 -6.888 9.007 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -10.943 -5.049 10.304 1.00 0.00 N ATOM 0 H ARG A 97 -5.262 -7.438 7.270 1.00 0.00 H new ATOM 0 HA ARG A 97 -5.616 -9.593 9.196 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.262 -7.704 7.461 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.080 -9.016 8.286 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.672 -8.131 10.409 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.143 -7.416 9.938 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -7.196 -5.399 9.614 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -8.195 -6.117 8.366 1.00 0.00 H new ATOM 0 HE ARG A 97 -8.874 -6.402 11.332 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -10.192 -7.682 8.679 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -11.687 -6.742 8.653 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.550 -4.404 10.990 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.888 -4.903 9.950 1.00 0.00 H new ATOM 1544 N MET A 98 -6.159 -10.295 6.041 1.00 0.00 N ATOM 1545 CA MET A 98 -6.355 -11.465 5.147 1.00 0.00 C ATOM 1546 C MET A 98 -5.129 -12.359 5.262 1.00 0.00 C ATOM 1547 O MET A 98 -5.213 -13.569 5.232 1.00 0.00 O ATOM 1548 CB MET A 98 -6.459 -10.885 3.736 1.00 0.00 C ATOM 1549 CG MET A 98 -7.658 -9.941 3.650 1.00 0.00 C ATOM 1550 SD MET A 98 -7.238 -8.527 2.601 1.00 0.00 S ATOM 1551 CE MET A 98 -8.653 -8.648 1.479 1.00 0.00 C ATOM 0 H MET A 98 -6.026 -9.401 5.567 1.00 0.00 H new ATOM 0 HA MET A 98 -7.238 -12.053 5.396 1.00 0.00 H new ATOM 0 HB2 MET A 98 -5.544 -10.349 3.485 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.566 -11.690 3.009 1.00 0.00 H new ATOM 0 HG2 MET A 98 -8.520 -10.467 3.241 1.00 0.00 H new ATOM 0 HG3 MET A 98 -7.937 -9.598 4.646 1.00 0.00 H new ATOM 0 HE1 MET A 98 -8.306 -8.585 0.448 1.00 0.00 H new ATOM 0 HE2 MET A 98 -9.160 -9.601 1.634 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.347 -7.832 1.679 1.00 0.00 H new ATOM 1561 N VAL A 99 -3.986 -11.752 5.406 1.00 0.00 N ATOM 1562 CA VAL A 99 -2.731 -12.533 5.539 1.00 0.00 C ATOM 1563 C VAL A 99 -2.696 -13.230 6.902 1.00 0.00 C ATOM 1564 O VAL A 99 -2.129 -14.294 7.049 1.00 0.00 O ATOM 1565 CB VAL A 99 -1.619 -11.487 5.427 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.331 -12.027 6.055 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.367 -11.167 3.952 1.00 0.00 C ATOM 0 H VAL A 99 -3.868 -10.739 5.437 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.631 -13.314 4.786 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.925 -10.582 5.953 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.456 -11.278 5.972 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.506 -12.254 7.107 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.025 -12.934 5.534 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.575 -10.422 3.871 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.066 -12.075 3.429 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.280 -10.776 3.503 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.304 -12.642 7.899 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.306 -13.288 9.242 1.00 0.00 C ATOM 1579 C ASP A 100 -4.202 -14.518 9.210 1.00 0.00 C ATOM 1580 O ASP A 100 -3.942 -15.506 9.867 1.00 0.00 O ATOM 1581 CB ASP A 100 -3.856 -12.234 10.203 1.00 0.00 C ATOM 1582 CG ASP A 100 -3.332 -12.510 11.615 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -2.396 -13.282 11.736 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -3.878 -11.946 12.549 1.00 0.00 O ATOM 0 H ASP A 100 -3.795 -11.750 7.841 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.314 -13.618 9.550 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -3.554 -11.238 9.879 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.946 -12.254 10.197 1.00 0.00 H new ATOM 1589 N LYS A 101 -5.238 -14.480 8.424 1.00 0.00 N ATOM 1590 CA LYS A 101 -6.125 -15.659 8.323 1.00 0.00 C ATOM 1591 C LYS A 101 -5.594 -16.541 7.196 1.00 0.00 C ATOM 1592 O LYS A 101 -5.582 -17.751 7.288 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.523 -15.080 8.047 1.00 0.00 C ATOM 1594 CG LYS A 101 -8.069 -15.517 6.685 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.745 -14.333 6.039 1.00 0.00 C ATOM 1596 CE LYS A 101 -10.015 -14.812 5.342 1.00 0.00 C ATOM 1597 NZ LYS A 101 -11.112 -14.561 6.318 1.00 0.00 N ATOM 0 H LYS A 101 -5.506 -13.682 7.848 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.166 -16.285 9.215 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.209 -15.400 8.832 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.478 -13.992 8.087 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -7.260 -15.883 6.052 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -8.776 -16.338 6.806 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -8.987 -13.581 6.790 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -8.075 -13.862 5.320 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -10.183 -14.269 4.412 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.949 -15.870 5.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -11.444 -15.466 6.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.759 -13.961 7.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -11.900 -14.080 5.839 1.00 0.00 H new ATOM 1611 N ILE A 102 -5.119 -15.928 6.141 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.555 -16.721 5.025 1.00 0.00 C ATOM 1613 C ILE A 102 -3.435 -17.561 5.613 1.00 0.00 C ATOM 1614 O ILE A 102 -3.187 -18.683 5.220 1.00 0.00 O ATOM 1615 CB ILE A 102 -4.017 -15.690 4.028 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -5.136 -15.277 3.071 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.862 -16.295 3.224 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.551 -14.431 1.940 1.00 0.00 C ATOM 0 H ILE A 102 -5.101 -14.916 6.011 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.268 -17.381 4.531 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.657 -14.818 4.574 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.625 -16.161 2.663 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.897 -14.711 3.607 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -2.485 -15.556 2.517 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -2.062 -16.590 3.903 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -3.217 -17.170 2.679 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -5.348 -14.136 1.257 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.082 -13.540 2.357 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.806 -15.013 1.398 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.785 -17.011 6.591 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.694 -17.748 7.271 1.00 0.00 C ATOM 1632 C VAL A 103 -2.332 -18.755 8.227 1.00 0.00 C ATOM 1633 O VAL A 103 -1.826 -19.837 8.451 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.918 -16.668 8.033 1.00 0.00 C ATOM 1635 CG1 VAL A 103 -0.200 -17.287 9.236 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.116 -16.032 7.100 1.00 0.00 C ATOM 0 H VAL A 103 -2.964 -16.074 6.952 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.037 -18.299 6.598 1.00 0.00 H new ATOM 0 HB VAL A 103 -1.616 -15.909 8.385 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.348 -16.512 9.771 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.933 -17.739 9.904 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.496 -18.051 8.890 1.00 0.00 H new ATOM 0 HG21 VAL A 103 0.669 -15.263 7.640 1.00 0.00 H new ATOM 0 HG22 VAL A 103 0.808 -16.797 6.748 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.392 -15.582 6.247 1.00 0.00 H new ATOM 1646 N SER A 104 -3.452 -18.389 8.787 1.00 0.00 N ATOM 1647 CA SER A 104 -4.158 -19.299 9.733 1.00 0.00 C ATOM 1648 C SER A 104 -4.989 -20.334 8.977 1.00 0.00 C ATOM 1649 O SER A 104 -5.438 -21.317 9.532 1.00 0.00 O ATOM 1650 CB SER A 104 -5.075 -18.382 10.531 1.00 0.00 C ATOM 1651 OG SER A 104 -5.660 -19.115 11.599 1.00 0.00 O ATOM 0 H SER A 104 -3.912 -17.492 8.629 1.00 0.00 H new ATOM 0 HA SER A 104 -3.461 -19.854 10.361 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.511 -17.535 10.922 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.853 -17.975 9.885 1.00 0.00 H new ATOM 0 HG SER A 104 -6.250 -18.527 12.115 1.00 0.00 H new ATOM 1657 N GLU A 105 -5.201 -20.113 7.719 1.00 0.00 N ATOM 1658 CA GLU A 105 -6.012 -21.075 6.918 1.00 0.00 C ATOM 1659 C GLU A 105 -5.678 -20.948 5.428 1.00 0.00 C ATOM 1660 O GLU A 105 -5.678 -21.918 4.698 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.474 -20.688 7.191 1.00 0.00 C ATOM 1662 CG GLU A 105 -7.884 -19.517 6.295 1.00 0.00 C ATOM 1663 CD GLU A 105 -9.374 -19.231 6.477 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -10.170 -20.055 6.056 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -9.696 -18.195 7.034 1.00 0.00 O ATOM 0 H GLU A 105 -4.849 -19.307 7.203 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.811 -22.111 7.191 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.125 -21.543 7.007 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.596 -20.414 8.239 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.300 -18.632 6.546 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.673 -19.753 5.252 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.396 -19.758 4.972 1.00 0.00 N ATOM 1673 CA GLY A 106 -5.066 -19.579 3.528 1.00 0.00 C ATOM 1674 C GLY A 106 -6.225 -18.883 2.816 1.00 0.00 C ATOM 1675 O GLY A 106 -6.353 -18.952 1.611 1.00 0.00 O ATOM 0 H GLY A 106 -5.380 -18.906 5.533 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -4.156 -18.989 3.424 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.872 -20.547 3.067 1.00 0.00 H new ATOM 1679 N SER A 107 -7.070 -18.209 3.546 1.00 0.00 N ATOM 1680 CA SER A 107 -8.212 -17.510 2.897 1.00 0.00 C ATOM 1681 C SER A 107 -8.011 -16.007 2.969 1.00 0.00 C ATOM 1682 O SER A 107 -7.768 -15.458 4.015 1.00 0.00 O ATOM 1683 CB SER A 107 -9.441 -17.918 3.704 1.00 0.00 C ATOM 1684 OG SER A 107 -9.637 -19.323 3.586 1.00 0.00 O ATOM 0 H SER A 107 -7.019 -18.113 4.560 1.00 0.00 H new ATOM 0 HA SER A 107 -8.310 -17.773 1.844 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.310 -17.644 4.751 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.321 -17.385 3.343 1.00 0.00 H new ATOM 0 HG SER A 107 -10.209 -19.636 4.318 1.00 0.00 H new ATOM 1690 N ASP A 108 -8.136 -15.338 1.863 1.00 0.00 N ATOM 1691 CA ASP A 108 -7.986 -13.860 1.869 1.00 0.00 C ATOM 1692 C ASP A 108 -9.379 -13.243 1.925 1.00 0.00 C ATOM 1693 O ASP A 108 -9.565 -12.066 1.688 1.00 0.00 O ATOM 1694 CB ASP A 108 -7.301 -13.513 0.546 1.00 0.00 C ATOM 1695 CG ASP A 108 -6.873 -12.043 0.563 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -7.713 -11.199 0.295 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -5.713 -11.786 0.841 1.00 0.00 O ATOM 0 H ASP A 108 -8.336 -15.751 0.952 1.00 0.00 H new ATOM 0 HA ASP A 108 -7.409 -13.490 2.716 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.432 -14.154 0.395 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -7.981 -13.695 -0.286 1.00 0.00 H new ATOM 1702 N ASP A 109 -10.367 -14.046 2.227 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.760 -13.518 2.283 1.00 0.00 C ATOM 1704 C ASP A 109 -12.137 -13.119 3.712 1.00 0.00 C ATOM 1705 O ASP A 109 -12.604 -13.926 4.491 1.00 0.00 O ATOM 1706 CB ASP A 109 -12.639 -14.671 1.797 1.00 0.00 C ATOM 1707 CG ASP A 109 -13.635 -14.149 0.760 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -13.190 -13.658 -0.264 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -14.826 -14.249 1.008 1.00 0.00 O ATOM 0 H ASP A 109 -10.269 -15.039 2.436 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.880 -12.623 1.673 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -12.021 -15.455 1.361 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -13.172 -15.116 2.637 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.949 -11.873 4.057 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.311 -11.413 5.428 1.00 0.00 C ATOM 1716 C ILE A 110 -13.533 -10.494 5.357 1.00 0.00 C ATOM 1717 O ILE A 110 -13.683 -9.584 6.148 1.00 0.00 O ATOM 1718 CB ILE A 110 -11.090 -10.641 5.932 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -10.697 -9.583 4.901 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -9.919 -11.603 6.147 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -9.997 -8.419 5.606 1.00 0.00 C ATOM 0 H ILE A 110 -11.560 -11.154 3.447 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.563 -12.241 6.090 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.335 -10.158 6.878 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.036 -10.018 4.151 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.583 -9.225 4.376 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.053 -11.047 6.506 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.198 -12.356 6.884 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.672 -12.092 5.205 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.717 -7.664 4.871 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.673 -7.978 6.339 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.102 -8.784 6.111 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.401 -10.721 4.410 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.608 -9.857 4.280 1.00 0.00 C ATOM 1735 C GLY A 111 -15.216 -8.529 3.629 1.00 0.00 C ATOM 1736 O GLY A 111 -16.014 -7.619 3.521 1.00 0.00 O ATOM 0 H GLY A 111 -14.326 -11.468 3.720 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.365 -10.360 3.678 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.048 -9.678 5.261 1.00 0.00 H new ATOM 1740 N GLU A 112 -13.989 -8.407 3.199 1.00 0.00 N ATOM 1741 CA GLU A 112 -13.544 -7.134 2.562 1.00 0.00 C ATOM 1742 C GLU A 112 -14.313 -6.865 1.263 1.00 0.00 C ATOM 1743 O GLU A 112 -14.983 -7.728 0.729 1.00 0.00 O ATOM 1744 CB GLU A 112 -12.062 -7.343 2.258 1.00 0.00 C ATOM 1745 CG GLU A 112 -11.901 -8.608 1.420 1.00 0.00 C ATOM 1746 CD GLU A 112 -11.555 -8.228 -0.022 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -12.335 -7.509 -0.626 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -10.519 -8.663 -0.497 1.00 0.00 O ATOM 0 H GLU A 112 -13.276 -9.134 3.261 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.723 -6.278 3.212 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.663 -6.482 1.721 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.496 -7.431 3.185 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -11.116 -9.237 1.840 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -12.822 -9.191 1.442 1.00 0.00 H new ATOM 1755 N ASN A 113 -14.206 -5.669 0.749 1.00 0.00 N ATOM 1756 CA ASN A 113 -14.906 -5.314 -0.522 1.00 0.00 C ATOM 1757 C ASN A 113 -13.968 -4.478 -1.388 1.00 0.00 C ATOM 1758 O ASN A 113 -13.862 -3.289 -1.216 1.00 0.00 O ATOM 1759 CB ASN A 113 -16.123 -4.486 -0.104 1.00 0.00 C ATOM 1760 CG ASN A 113 -16.774 -5.109 1.134 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -17.070 -4.420 2.089 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -17.012 -6.393 1.157 1.00 0.00 N ATOM 0 H ASN A 113 -13.657 -4.914 1.160 1.00 0.00 H new ATOM 0 HA ASN A 113 -15.203 -6.192 -1.096 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.821 -3.461 0.110 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -16.843 -4.442 -0.921 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -17.446 -6.817 1.977 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -16.764 -6.972 0.355 1.00 0.00 H new ATOM 1769 N ILE A 114 -13.267 -5.089 -2.299 1.00 0.00 N ATOM 1770 CA ILE A 114 -12.318 -4.308 -3.143 1.00 0.00 C ATOM 1771 C ILE A 114 -13.061 -3.397 -4.117 1.00 0.00 C ATOM 1772 O ILE A 114 -13.007 -2.189 -4.001 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.499 -5.353 -3.895 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -11.020 -6.441 -2.922 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -10.293 -4.672 -4.541 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -10.608 -5.811 -1.585 1.00 0.00 C ATOM 0 H ILE A 114 -13.308 -6.089 -2.497 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.690 -3.653 -2.539 1.00 0.00 H new ATOM 0 HB ILE A 114 -12.117 -5.815 -4.665 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -11.814 -7.170 -2.760 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -10.177 -6.980 -3.354 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.703 -5.413 -5.080 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -10.637 -3.906 -5.236 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.678 -4.211 -3.768 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.270 -6.592 -0.904 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -9.799 -5.100 -1.752 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.462 -5.293 -1.148 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.748 -3.952 -5.078 1.00 0.00 N ATOM 1789 CA ASP A 115 -14.484 -3.089 -6.046 1.00 0.00 C ATOM 1790 C ASP A 115 -15.193 -1.973 -5.289 1.00 0.00 C ATOM 1791 O ASP A 115 -15.435 -0.899 -5.804 1.00 0.00 O ATOM 1792 CB ASP A 115 -15.493 -4.013 -6.730 1.00 0.00 C ATOM 1793 CG ASP A 115 -15.850 -3.449 -8.107 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -15.773 -2.244 -8.271 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -16.196 -4.236 -8.974 1.00 0.00 O ATOM 0 H ASP A 115 -13.832 -4.956 -5.234 1.00 0.00 H new ATOM 0 HA ASP A 115 -13.825 -2.619 -6.776 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -15.074 -5.014 -6.833 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -16.391 -4.104 -6.119 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.516 -2.234 -4.065 1.00 0.00 N ATOM 1801 CA VAL A 116 -16.207 -1.219 -3.224 1.00 0.00 C ATOM 1802 C VAL A 116 -15.200 -0.380 -2.449 1.00 0.00 C ATOM 1803 O VAL A 116 -15.218 0.834 -2.484 1.00 0.00 O ATOM 1804 CB VAL A 116 -17.071 -2.037 -2.268 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -17.795 -1.101 -1.297 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -18.100 -2.834 -3.071 1.00 0.00 C ATOM 0 H VAL A 116 -15.330 -3.121 -3.598 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.793 -0.520 -3.821 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.438 -2.721 -1.703 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.411 -1.689 -0.616 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -17.062 -0.533 -0.724 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -18.429 -0.414 -1.858 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.718 -3.419 -2.391 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.731 -2.148 -3.636 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.585 -3.504 -3.760 1.00 0.00 H new ATOM 1816 N PHE A 117 -14.333 -1.029 -1.746 1.00 0.00 N ATOM 1817 CA PHE A 117 -13.311 -0.292 -0.944 1.00 0.00 C ATOM 1818 C PHE A 117 -12.495 0.613 -1.861 1.00 0.00 C ATOM 1819 O PHE A 117 -11.933 1.605 -1.438 1.00 0.00 O ATOM 1820 CB PHE A 117 -12.429 -1.381 -0.330 1.00 0.00 C ATOM 1821 CG PHE A 117 -11.399 -0.758 0.577 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -10.272 -0.131 0.035 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -11.569 -0.814 1.966 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -9.315 0.440 0.881 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -10.614 -0.242 2.812 1.00 0.00 C ATOM 1826 CZ PHE A 117 -9.486 0.385 2.270 1.00 0.00 C ATOM 0 H PHE A 117 -14.279 -2.046 -1.685 1.00 0.00 H new ATOM 0 HA PHE A 117 -13.755 0.344 -0.178 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.043 -2.084 0.232 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -11.935 -1.949 -1.119 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.141 -0.088 -1.036 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -12.438 -1.299 2.384 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.444 0.923 0.463 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.747 -0.284 3.883 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.748 0.826 2.923 1.00 0.00 H new ATOM 1836 N SER A 118 -12.447 0.290 -3.120 1.00 0.00 N ATOM 1837 CA SER A 118 -11.697 1.124 -4.073 1.00 0.00 C ATOM 1838 C SER A 118 -12.637 2.156 -4.646 1.00 0.00 C ATOM 1839 O SER A 118 -12.328 3.321 -4.720 1.00 0.00 O ATOM 1840 CB SER A 118 -11.224 0.157 -5.154 1.00 0.00 C ATOM 1841 OG SER A 118 -11.338 0.779 -6.427 1.00 0.00 O ATOM 0 H SER A 118 -12.903 -0.527 -3.527 1.00 0.00 H new ATOM 0 HA SER A 118 -10.856 1.652 -3.623 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.190 -0.133 -4.970 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.820 -0.755 -5.128 1.00 0.00 H new ATOM 0 HG SER A 118 -11.033 0.159 -7.122 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.795 1.720 -5.022 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.800 2.662 -5.585 1.00 0.00 C ATOM 1849 C ASP A 119 -15.175 3.672 -4.522 1.00 0.00 C ATOM 1850 O ASP A 119 -15.544 4.791 -4.802 1.00 0.00 O ATOM 1851 CB ASP A 119 -16.001 1.802 -5.980 1.00 0.00 C ATOM 1852 CG ASP A 119 -17.064 2.685 -6.638 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -17.795 3.339 -5.911 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -17.130 2.692 -7.856 1.00 0.00 O ATOM 0 H ASP A 119 -14.096 0.747 -4.966 1.00 0.00 H new ATOM 0 HA ASP A 119 -14.425 3.215 -6.446 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.689 1.016 -6.668 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -16.415 1.310 -5.100 1.00 0.00 H new ATOM 1859 N THR A 120 -15.040 3.280 -3.299 1.00 0.00 N ATOM 1860 CA THR A 120 -15.340 4.202 -2.178 1.00 0.00 C ATOM 1861 C THR A 120 -14.247 5.260 -2.149 1.00 0.00 C ATOM 1862 O THR A 120 -14.492 6.450 -2.142 1.00 0.00 O ATOM 1863 CB THR A 120 -15.317 3.303 -0.931 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.650 2.988 -0.555 1.00 0.00 O ATOM 1865 CG2 THR A 120 -14.612 4.000 0.233 1.00 0.00 C ATOM 0 H THR A 120 -14.731 2.349 -3.020 1.00 0.00 H new ATOM 0 HA THR A 120 -16.294 4.724 -2.253 1.00 0.00 H new ATOM 0 HB THR A 120 -14.769 2.392 -1.170 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.639 2.413 0.239 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.609 3.343 1.103 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.585 4.232 -0.050 1.00 0.00 H new ATOM 0 HG23 THR A 120 -15.138 4.923 0.477 1.00 0.00 H new ATOM 1873 N ILE A 121 -13.042 4.805 -2.160 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.877 5.722 -2.164 1.00 0.00 C ATOM 1875 C ILE A 121 -11.798 6.429 -3.523 1.00 0.00 C ATOM 1876 O ILE A 121 -11.493 7.602 -3.608 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.684 4.786 -1.918 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -10.027 5.154 -0.591 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.651 4.876 -3.045 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -9.317 6.505 -0.718 1.00 0.00 C ATOM 0 H ILE A 121 -12.803 3.813 -2.167 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.921 6.514 -1.417 1.00 0.00 H new ATOM 0 HB ILE A 121 -11.054 3.761 -1.888 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -10.779 5.201 0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -9.312 4.383 -0.303 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.823 4.199 -2.834 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -10.117 4.596 -3.989 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -9.276 5.897 -3.115 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.850 6.762 0.233 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -8.552 6.443 -1.492 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -10.042 7.274 -0.985 1.00 0.00 H new ATOM 1892 N LYS A 122 -12.088 5.723 -4.584 1.00 0.00 N ATOM 1893 CA LYS A 122 -12.050 6.350 -5.924 1.00 0.00 C ATOM 1894 C LYS A 122 -13.197 7.343 -6.024 1.00 0.00 C ATOM 1895 O LYS A 122 -13.093 8.381 -6.648 1.00 0.00 O ATOM 1896 CB LYS A 122 -12.226 5.191 -6.901 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.860 4.839 -7.484 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.448 3.433 -7.049 1.00 0.00 C ATOM 1899 CE LYS A 122 -9.182 3.518 -6.191 1.00 0.00 C ATOM 1900 NZ LYS A 122 -8.185 2.657 -6.886 1.00 0.00 N ATOM 0 H LYS A 122 -12.349 4.737 -4.573 1.00 0.00 H new ATOM 0 HA LYS A 122 -11.129 6.895 -6.129 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.655 4.328 -6.392 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.918 5.468 -7.697 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.895 4.895 -8.572 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -10.117 5.563 -7.151 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.253 2.964 -6.483 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.267 2.808 -7.923 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.828 4.546 -6.111 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.369 3.165 -5.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.254 2.771 -6.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.481 1.662 -6.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.122 2.936 -7.886 1.00 0.00 H new ATOM 1914 N SER A 123 -14.282 7.040 -5.375 1.00 0.00 N ATOM 1915 CA SER A 123 -15.437 7.969 -5.384 1.00 0.00 C ATOM 1916 C SER A 123 -15.215 9.042 -4.330 1.00 0.00 C ATOM 1917 O SER A 123 -15.893 10.049 -4.290 1.00 0.00 O ATOM 1918 CB SER A 123 -16.637 7.113 -5.014 1.00 0.00 C ATOM 1919 OG SER A 123 -16.948 6.239 -6.093 1.00 0.00 O ATOM 0 H SER A 123 -14.418 6.184 -4.837 1.00 0.00 H new ATOM 0 HA SER A 123 -15.575 8.463 -6.346 1.00 0.00 H new ATOM 0 HB2 SER A 123 -16.422 6.536 -4.115 1.00 0.00 H new ATOM 0 HB3 SER A 123 -17.494 7.748 -4.788 1.00 0.00 H new ATOM 0 HG SER A 123 -16.817 5.310 -5.810 1.00 0.00 H new ATOM 1925 N PHE A 124 -14.253 8.831 -3.483 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.956 9.833 -2.424 1.00 0.00 C ATOM 1927 C PHE A 124 -13.205 11.014 -3.033 1.00 0.00 C ATOM 1928 O PHE A 124 -12.854 11.962 -2.359 1.00 0.00 O ATOM 1929 CB PHE A 124 -13.071 9.098 -1.421 1.00 0.00 C ATOM 1930 CG PHE A 124 -13.549 9.389 -0.019 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -14.130 10.627 0.278 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -13.413 8.421 0.984 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -14.575 10.898 1.577 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -13.858 8.692 2.282 1.00 0.00 C ATOM 1935 CZ PHE A 124 -14.439 9.931 2.579 1.00 0.00 C ATOM 0 H PHE A 124 -13.655 8.004 -3.477 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.858 10.227 -1.955 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -13.101 8.025 -1.611 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -12.034 9.413 -1.536 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -14.235 11.373 -0.495 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -12.965 7.465 0.755 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -15.023 11.854 1.806 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -13.753 7.945 3.055 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.782 10.140 3.581 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.957 10.954 -4.308 1.00 0.00 N ATOM 1946 CA ALA A 125 -12.226 12.062 -4.985 1.00 0.00 C ATOM 1947 C ALA A 125 -12.888 12.390 -6.326 1.00 0.00 C ATOM 1948 O ALA A 125 -13.094 13.539 -6.663 1.00 0.00 O ATOM 1949 CB ALA A 125 -10.812 11.525 -5.205 1.00 0.00 C ATOM 0 H ALA A 125 -13.230 10.182 -4.916 1.00 0.00 H new ATOM 0 HA ALA A 125 -12.228 12.979 -4.396 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -10.208 12.284 -5.701 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -10.364 11.276 -4.243 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.855 10.632 -5.828 1.00 0.00 H new ATOM 1955 N SER A 126 -13.220 11.389 -7.094 1.00 0.00 N ATOM 1956 CA SER A 126 -13.868 11.642 -8.414 1.00 0.00 C ATOM 1957 C SER A 126 -15.391 11.631 -8.268 1.00 0.00 C ATOM 1958 O SER A 126 -16.083 10.899 -8.947 1.00 0.00 O ATOM 1959 CB SER A 126 -13.406 10.492 -9.307 1.00 0.00 C ATOM 1960 OG SER A 126 -12.151 10.821 -9.887 1.00 0.00 O ATOM 0 H SER A 126 -13.071 10.406 -6.865 1.00 0.00 H new ATOM 0 HA SER A 126 -13.598 12.614 -8.827 1.00 0.00 H new ATOM 0 HB2 SER A 126 -13.320 9.575 -8.723 1.00 0.00 H new ATOM 0 HB3 SER A 126 -14.143 10.305 -10.088 1.00 0.00 H new ATOM 0 HG SER A 126 -11.852 10.084 -10.459 1.00 0.00 H new ATOM 1966 N SER A 127 -15.919 12.437 -7.387 1.00 0.00 N ATOM 1967 CA SER A 127 -17.399 12.469 -7.200 1.00 0.00 C ATOM 1968 C SER A 127 -17.780 13.528 -6.163 1.00 0.00 C ATOM 1969 O SER A 127 -17.768 13.279 -4.973 1.00 0.00 O ATOM 1970 CB SER A 127 -17.764 11.072 -6.700 1.00 0.00 C ATOM 1971 OG SER A 127 -19.107 10.780 -7.061 1.00 0.00 O ATOM 0 H SER A 127 -15.391 13.074 -6.790 1.00 0.00 H new ATOM 0 HA SER A 127 -17.926 12.724 -8.120 1.00 0.00 H new ATOM 0 HB2 SER A 127 -17.090 10.331 -7.131 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.646 11.018 -5.618 1.00 0.00 H new ATOM 0 HG SER A 127 -19.344 9.884 -6.743 1.00 0.00 H new ATOM 1977 N GLY A 128 -18.121 14.708 -6.604 1.00 0.00 N ATOM 1978 CA GLY A 128 -18.504 15.780 -5.642 1.00 0.00 C ATOM 1979 C GLY A 128 -18.908 17.038 -6.415 1.00 0.00 C ATOM 1980 O GLY A 128 -19.042 17.019 -7.622 1.00 0.00 O ATOM 0 H GLY A 128 -18.151 14.976 -7.588 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -19.331 15.444 -5.016 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -17.670 16.001 -4.976 1.00 0.00 H new ATOM 1984 N LYS A 129 -19.102 18.130 -5.727 1.00 0.00 N ATOM 1985 CA LYS A 129 -19.499 19.390 -6.423 1.00 0.00 C ATOM 1986 C LYS A 129 -19.482 20.564 -5.439 1.00 0.00 C ATOM 1987 O LYS A 129 -19.580 20.385 -4.241 1.00 0.00 O ATOM 1988 CB LYS A 129 -20.919 19.137 -6.926 1.00 0.00 C ATOM 1989 CG LYS A 129 -21.861 18.987 -5.731 1.00 0.00 C ATOM 1990 CD LYS A 129 -23.305 18.885 -6.226 1.00 0.00 C ATOM 1991 CE LYS A 129 -24.215 18.483 -5.063 1.00 0.00 C ATOM 1992 NZ LYS A 129 -25.577 18.382 -5.657 1.00 0.00 N ATOM 0 H LYS A 129 -19.003 18.206 -4.715 1.00 0.00 H new ATOM 0 HA LYS A 129 -18.818 19.644 -7.236 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -21.245 19.962 -7.559 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -20.945 18.236 -7.539 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -21.599 18.098 -5.158 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -21.755 19.841 -5.062 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -23.627 19.840 -6.641 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -23.375 18.150 -7.028 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -23.903 17.534 -4.627 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -24.186 19.225 -4.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -26.258 18.110 -4.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -25.850 19.302 -6.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -25.575 17.664 -6.409 1.00 0.00 H new ATOM 2006 N GLU A 130 -19.359 21.765 -5.935 1.00 0.00 N ATOM 2007 CA GLU A 130 -19.336 22.948 -5.026 1.00 0.00 C ATOM 2008 C GLU A 130 -18.222 22.791 -3.987 1.00 0.00 C ATOM 2009 O GLU A 130 -17.668 21.724 -3.815 1.00 0.00 O ATOM 2010 CB GLU A 130 -20.706 22.954 -4.347 1.00 0.00 C ATOM 2011 CG GLU A 130 -21.544 24.110 -4.898 1.00 0.00 C ATOM 2012 CD GLU A 130 -22.903 23.583 -5.363 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -23.255 22.482 -4.974 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -23.569 24.290 -6.101 1.00 0.00 O ATOM 0 H GLU A 130 -19.274 21.979 -6.929 1.00 0.00 H new ATOM 0 HA GLU A 130 -19.144 23.878 -5.561 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -21.215 22.006 -4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -20.589 23.058 -3.268 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -21.681 24.871 -4.130 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -21.023 24.586 -5.729 1.00 0.00 H new ATOM 2021 N LYS A 131 -17.891 23.845 -3.294 1.00 0.00 N ATOM 2022 CA LYS A 131 -16.812 23.754 -2.268 1.00 0.00 C ATOM 2023 C LYS A 131 -15.471 23.448 -2.940 1.00 0.00 C ATOM 2024 O LYS A 131 -14.497 23.128 -2.287 1.00 0.00 O ATOM 2025 CB LYS A 131 -17.233 22.602 -1.355 1.00 0.00 C ATOM 2026 CG LYS A 131 -16.933 22.967 0.100 1.00 0.00 C ATOM 2027 CD LYS A 131 -17.550 21.918 1.025 1.00 0.00 C ATOM 2028 CE LYS A 131 -17.915 22.564 2.363 1.00 0.00 C ATOM 2029 NZ LYS A 131 -16.698 23.320 2.770 1.00 0.00 N ATOM 0 H LYS A 131 -18.320 24.765 -3.393 1.00 0.00 H new ATOM 0 HA LYS A 131 -16.684 24.685 -1.715 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -18.297 22.397 -1.478 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -16.699 21.692 -1.630 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -15.856 23.019 0.259 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -17.337 23.953 0.330 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -18.439 21.489 0.563 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -16.847 21.100 1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -18.775 23.226 2.260 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -18.179 21.811 3.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -16.661 23.385 3.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -15.851 22.826 2.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -16.732 24.277 2.364 1.00 0.00 H new ATOM 2043 N LEU A 132 -15.415 23.544 -4.240 1.00 0.00 N ATOM 2044 CA LEU A 132 -14.138 23.260 -4.956 1.00 0.00 C ATOM 2045 C LEU A 132 -13.543 21.933 -4.476 1.00 0.00 C ATOM 2046 O LEU A 132 -12.880 21.871 -3.460 1.00 0.00 O ATOM 2047 CB LEU A 132 -13.214 24.425 -4.596 1.00 0.00 C ATOM 2048 CG LEU A 132 -13.350 25.523 -5.649 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -14.564 26.395 -5.324 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -12.089 26.388 -5.648 1.00 0.00 C ATOM 0 H LEU A 132 -16.198 23.807 -4.838 1.00 0.00 H new ATOM 0 HA LEU A 132 -14.281 23.171 -6.033 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -13.470 24.816 -3.611 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -12.181 24.082 -4.544 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.481 25.069 -6.631 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -14.661 27.179 -6.076 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -15.464 25.780 -5.323 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -14.433 26.849 -4.342 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.185 27.172 -6.399 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -11.959 26.841 -4.665 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -11.223 25.768 -5.879 1.00 0.00 H new ATOM 2062 N GLU A 133 -13.778 20.872 -5.199 1.00 0.00 N ATOM 2063 CA GLU A 133 -13.226 19.549 -4.784 1.00 0.00 C ATOM 2064 C GLU A 133 -11.724 19.665 -4.508 1.00 0.00 C ATOM 2065 O GLU A 133 -11.184 20.739 -4.716 1.00 0.00 O ATOM 2066 CB GLU A 133 -13.483 18.625 -5.974 1.00 0.00 C ATOM 2067 CG GLU A 133 -14.252 17.389 -5.503 1.00 0.00 C ATOM 2068 CD GLU A 133 -14.724 16.588 -6.718 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -14.195 16.815 -7.794 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -15.605 15.762 -6.552 1.00 0.00 O ATOM 0 H GLU A 133 -14.328 20.863 -6.058 1.00 0.00 H new ATOM 0 HA GLU A 133 -13.688 19.176 -3.870 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -14.053 19.151 -6.740 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.538 18.327 -6.428 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.615 16.770 -4.871 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -15.107 17.689 -4.897 1.00 0.00 H new TER 2077 GLU A 133