USER MOD reduce.3.24.130724 H: found=0, std=0, add=711, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 709 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.0901 (180deg=0) USER MOD Single : A 2 SER OG : rot -160:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 146:sc= 0.969 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -0.0117 X(o=-0.012,f=-0.36) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 GLN : amide:sc=-0.000435 X(o=-0.00043,f=0) USER MOD Single : A 24 SER OG : rot 70:sc= 0.235 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -85:sc= 1.75 USER MOD Single : A 29 GLN : amide:sc= -0.415 X(o=-0.42,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 79:sc= 0.265 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.24) USER MOD Single : A 46 TYR OH : rot 165:sc= 0.114 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= 0.011 K(o=0.011,f=-9.2!) USER MOD Single : A 55 ASN : amide:sc= -0.0908 X(o=-0.091,f=-0.093) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= 0.142 (180deg=0.0773) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.981 -19.745 1.196 1.00 0.00 N ATOM 2 CA GLY A 1 4.529 -19.297 -0.091 1.00 0.00 C ATOM 3 C GLY A 1 3.580 -18.298 -0.729 1.00 0.00 C ATOM 4 O GLY A 1 2.802 -17.648 -0.028 1.00 0.00 O ATOM 0 H1 GLY A 1 4.716 -19.677 1.929 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.174 -19.144 1.458 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.665 -20.732 1.114 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.507 -18.840 0.058 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.673 -20.151 -0.753 1.00 0.00 H new ATOM 8 N SER A 2 3.616 -18.174 -2.056 1.00 0.00 N ATOM 9 CA SER A 2 2.745 -17.275 -2.803 1.00 0.00 C ATOM 10 C SER A 2 2.377 -17.869 -4.169 1.00 0.00 C ATOM 11 O SER A 2 1.229 -17.733 -4.589 1.00 0.00 O ATOM 12 CB SER A 2 3.451 -15.917 -2.922 1.00 0.00 C ATOM 13 OG SER A 2 2.582 -14.914 -3.410 1.00 0.00 O ATOM 0 H SER A 2 4.259 -18.702 -2.646 1.00 0.00 H new ATOM 0 HA SER A 2 1.800 -17.137 -2.277 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.836 -15.621 -1.946 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.309 -16.010 -3.588 1.00 0.00 H new ATOM 0 HG SER A 2 3.110 -14.171 -3.770 1.00 0.00 H new ATOM 19 N SER A 3 3.310 -18.555 -4.845 1.00 0.00 N ATOM 20 CA SER A 3 3.130 -19.324 -6.082 1.00 0.00 C ATOM 21 C SER A 3 2.096 -18.760 -7.070 1.00 0.00 C ATOM 22 O SER A 3 1.222 -19.486 -7.558 1.00 0.00 O ATOM 23 CB SER A 3 2.861 -20.791 -5.717 1.00 0.00 C ATOM 24 OG SER A 3 3.939 -21.279 -4.941 1.00 0.00 O ATOM 0 H SER A 3 4.276 -18.589 -4.518 1.00 0.00 H new ATOM 0 HA SER A 3 4.060 -19.241 -6.644 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.928 -20.875 -5.160 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.747 -21.389 -6.621 1.00 0.00 H new ATOM 0 HG SER A 3 3.773 -22.215 -4.703 1.00 0.00 H new ATOM 30 N GLY A 4 2.189 -17.461 -7.374 1.00 0.00 N ATOM 31 CA GLY A 4 1.229 -16.797 -8.244 1.00 0.00 C ATOM 32 C GLY A 4 1.213 -17.409 -9.644 1.00 0.00 C ATOM 33 O GLY A 4 2.221 -17.964 -10.087 1.00 0.00 O ATOM 0 H GLY A 4 2.927 -16.850 -7.024 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.233 -16.866 -7.806 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.474 -15.737 -8.314 1.00 0.00 H new ATOM 37 N SER A 5 0.085 -17.320 -10.343 1.00 0.00 N ATOM 38 CA SER A 5 -0.080 -17.872 -11.679 1.00 0.00 C ATOM 39 C SER A 5 -1.303 -17.237 -12.335 1.00 0.00 C ATOM 40 O SER A 5 -2.354 -17.878 -12.453 1.00 0.00 O ATOM 41 CB SER A 5 -0.159 -19.410 -11.627 1.00 0.00 C ATOM 42 OG SER A 5 -0.950 -19.875 -10.544 1.00 0.00 O ATOM 0 H SER A 5 -0.751 -16.855 -9.990 1.00 0.00 H new ATOM 0 HA SER A 5 0.789 -17.634 -12.293 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.575 -19.782 -12.563 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.847 -19.820 -11.541 1.00 0.00 H new ATOM 0 HG SER A 5 -0.973 -20.855 -10.552 1.00 0.00 H new ATOM 48 N SER A 6 -1.184 -15.983 -12.769 1.00 0.00 N ATOM 49 CA SER A 6 -2.254 -15.291 -13.480 1.00 0.00 C ATOM 50 C SER A 6 -1.685 -14.381 -14.561 1.00 0.00 C ATOM 51 O SER A 6 -0.551 -13.909 -14.442 1.00 0.00 O ATOM 52 CB SER A 6 -3.118 -14.491 -12.497 1.00 0.00 C ATOM 53 OG SER A 6 -3.686 -15.364 -11.544 1.00 0.00 O ATOM 0 H SER A 6 -0.344 -15.420 -12.637 1.00 0.00 H new ATOM 0 HA SER A 6 -2.883 -16.037 -13.965 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.512 -13.735 -11.997 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.905 -13.963 -13.036 1.00 0.00 H new ATOM 0 HG SER A 6 -4.236 -14.850 -10.916 1.00 0.00 H new ATOM 59 N GLY A 7 -2.492 -14.122 -15.591 1.00 0.00 N ATOM 60 CA GLY A 7 -2.167 -13.173 -16.640 1.00 0.00 C ATOM 61 C GLY A 7 -2.477 -11.762 -16.162 1.00 0.00 C ATOM 62 O GLY A 7 -1.760 -11.215 -15.324 1.00 0.00 O ATOM 0 H GLY A 7 -3.398 -14.574 -15.715 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.113 -13.255 -16.905 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.741 -13.398 -17.539 1.00 0.00 H new ATOM 66 N ASP A 8 -3.567 -11.180 -16.655 1.00 0.00 N ATOM 67 CA ASP A 8 -3.898 -9.765 -16.514 1.00 0.00 C ATOM 68 C ASP A 8 -5.387 -9.626 -16.186 1.00 0.00 C ATOM 69 O ASP A 8 -6.245 -9.721 -17.064 1.00 0.00 O ATOM 70 CB ASP A 8 -3.476 -8.989 -17.778 1.00 0.00 C ATOM 71 CG ASP A 8 -4.185 -9.414 -19.073 1.00 0.00 C ATOM 72 OD1 ASP A 8 -4.313 -10.631 -19.351 1.00 0.00 O ATOM 73 OD2 ASP A 8 -4.602 -8.529 -19.856 1.00 0.00 O ATOM 0 H ASP A 8 -4.269 -11.699 -17.182 1.00 0.00 H new ATOM 0 HA ASP A 8 -3.342 -9.323 -15.687 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -3.662 -7.928 -17.612 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -2.401 -9.107 -17.915 1.00 0.00 H new ATOM 78 N ARG A 9 -5.717 -9.473 -14.898 1.00 0.00 N ATOM 79 CA ARG A 9 -7.102 -9.473 -14.404 1.00 0.00 C ATOM 80 C ARG A 9 -7.385 -8.345 -13.412 1.00 0.00 C ATOM 81 O ARG A 9 -8.479 -8.297 -12.836 1.00 0.00 O ATOM 82 CB ARG A 9 -7.438 -10.850 -13.794 1.00 0.00 C ATOM 83 CG ARG A 9 -7.593 -11.981 -14.820 1.00 0.00 C ATOM 84 CD ARG A 9 -8.789 -11.739 -15.755 1.00 0.00 C ATOM 85 NE ARG A 9 -9.061 -12.918 -16.583 1.00 0.00 N ATOM 86 CZ ARG A 9 -9.773 -13.998 -16.246 1.00 0.00 C ATOM 87 NH1 ARG A 9 -10.420 -14.057 -15.087 1.00 0.00 N ATOM 88 NH2 ARG A 9 -9.817 -15.029 -17.076 1.00 0.00 N ATOM 0 H ARG A 9 -5.024 -9.344 -14.161 1.00 0.00 H new ATOM 0 HA ARG A 9 -7.752 -9.287 -15.259 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -6.653 -11.122 -13.089 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -8.363 -10.765 -13.224 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -6.680 -12.065 -15.410 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.724 -12.930 -14.299 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -9.672 -11.494 -15.165 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -8.586 -10.881 -16.395 1.00 0.00 H new ATOM 0 HE ARG A 9 -8.662 -12.914 -17.522 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -10.378 -13.271 -14.439 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -10.959 -14.889 -14.845 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -9.311 -14.993 -17.961 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -10.357 -15.859 -16.830 1.00 0.00 H new ATOM 102 N VAL A 10 -6.440 -7.435 -13.192 1.00 0.00 N ATOM 103 CA VAL A 10 -6.655 -6.301 -12.309 1.00 0.00 C ATOM 104 C VAL A 10 -7.778 -5.399 -12.841 1.00 0.00 C ATOM 105 O VAL A 10 -7.971 -5.263 -14.056 1.00 0.00 O ATOM 106 CB VAL A 10 -5.317 -5.579 -12.084 1.00 0.00 C ATOM 107 CG1 VAL A 10 -4.864 -4.775 -13.305 1.00 0.00 C ATOM 108 CG2 VAL A 10 -5.321 -4.699 -10.831 1.00 0.00 C ATOM 0 H VAL A 10 -5.514 -7.465 -13.618 1.00 0.00 H new ATOM 0 HA VAL A 10 -7.002 -6.636 -11.332 1.00 0.00 H new ATOM 0 HB VAL A 10 -4.589 -6.374 -11.925 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.914 -4.287 -13.087 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.742 -5.444 -14.156 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.614 -4.020 -13.542 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -4.351 -4.215 -10.724 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -6.098 -3.940 -10.922 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -5.518 -5.316 -9.954 1.00 0.00 H new ATOM 118 N THR A 11 -8.473 -4.749 -11.916 1.00 0.00 N ATOM 119 CA THR A 11 -9.596 -3.851 -12.134 1.00 0.00 C ATOM 120 C THR A 11 -9.319 -2.529 -11.419 1.00 0.00 C ATOM 121 O THR A 11 -8.270 -2.365 -10.780 1.00 0.00 O ATOM 122 CB THR A 11 -10.881 -4.537 -11.627 1.00 0.00 C ATOM 123 OG1 THR A 11 -10.647 -5.103 -10.356 1.00 0.00 O ATOM 124 CG2 THR A 11 -11.333 -5.655 -12.563 1.00 0.00 C ATOM 0 H THR A 11 -8.250 -4.843 -10.925 1.00 0.00 H new ATOM 0 HA THR A 11 -9.731 -3.630 -13.193 1.00 0.00 H new ATOM 0 HB THR A 11 -11.659 -3.775 -11.582 1.00 0.00 H new ATOM 0 HG1 THR A 11 -11.461 -5.039 -9.815 1.00 0.00 H new ATOM 0 HG21 THR A 11 -12.241 -6.113 -12.171 1.00 0.00 H new ATOM 0 HG22 THR A 11 -11.533 -5.243 -13.552 1.00 0.00 H new ATOM 0 HG23 THR A 11 -10.549 -6.408 -12.635 1.00 0.00 H new ATOM 132 N LEU A 12 -10.262 -1.588 -11.522 1.00 0.00 N ATOM 133 CA LEU A 12 -10.345 -0.392 -10.693 1.00 0.00 C ATOM 134 C LEU A 12 -9.185 0.579 -10.920 1.00 0.00 C ATOM 135 O LEU A 12 -8.343 0.392 -11.804 1.00 0.00 O ATOM 136 CB LEU A 12 -10.498 -0.806 -9.210 1.00 0.00 C ATOM 137 CG LEU A 12 -11.934 -0.640 -8.693 1.00 0.00 C ATOM 138 CD1 LEU A 12 -12.855 -1.702 -9.297 1.00 0.00 C ATOM 139 CD2 LEU A 12 -11.919 -0.744 -7.166 1.00 0.00 C ATOM 0 H LEU A 12 -11.013 -1.644 -12.210 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.231 0.169 -10.991 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.193 -1.846 -9.094 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.824 -0.206 -8.598 1.00 0.00 H new ATOM 0 HG LEU A 12 -12.319 0.335 -8.991 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -13.867 -1.565 -8.916 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -12.859 -1.605 -10.383 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.496 -2.694 -9.023 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -12.933 -0.628 -6.783 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.529 -1.718 -6.871 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -11.284 0.040 -6.754 1.00 0.00 H new ATOM 151 N GLU A 13 -9.167 1.665 -10.152 1.00 0.00 N ATOM 152 CA GLU A 13 -7.973 2.451 -9.891 1.00 0.00 C ATOM 153 C GLU A 13 -7.361 2.046 -8.542 1.00 0.00 C ATOM 154 O GLU A 13 -6.156 1.844 -8.476 1.00 0.00 O ATOM 155 CB GLU A 13 -8.321 3.937 -9.985 1.00 0.00 C ATOM 156 CG GLU A 13 -9.212 4.420 -8.840 1.00 0.00 C ATOM 157 CD GLU A 13 -9.993 5.659 -9.235 1.00 0.00 C ATOM 158 OE1 GLU A 13 -9.441 6.772 -9.139 1.00 0.00 O ATOM 159 OE2 GLU A 13 -11.171 5.516 -9.642 1.00 0.00 O ATOM 0 H GLU A 13 -9.999 2.027 -9.687 1.00 0.00 H new ATOM 0 HA GLU A 13 -7.207 2.254 -10.641 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -7.400 4.520 -9.991 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -8.824 4.127 -10.933 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.903 3.627 -8.555 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -8.598 4.637 -7.966 1.00 0.00 H new ATOM 166 N VAL A 14 -8.163 1.886 -7.476 1.00 0.00 N ATOM 167 CA VAL A 14 -7.687 1.475 -6.153 1.00 0.00 C ATOM 168 C VAL A 14 -7.044 0.095 -6.259 1.00 0.00 C ATOM 169 O VAL A 14 -5.862 -0.036 -5.956 1.00 0.00 O ATOM 170 CB VAL A 14 -8.838 1.571 -5.126 1.00 0.00 C ATOM 171 CG1 VAL A 14 -8.606 0.860 -3.792 1.00 0.00 C ATOM 172 CG2 VAL A 14 -9.077 3.039 -4.767 1.00 0.00 C ATOM 0 H VAL A 14 -9.170 2.041 -7.514 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.912 2.147 -5.784 1.00 0.00 H new ATOM 0 HB VAL A 14 -9.674 1.082 -5.626 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.478 0.994 -3.152 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.447 -0.204 -3.969 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.728 1.282 -3.303 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.889 3.109 -4.043 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.169 3.461 -4.336 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.344 3.595 -5.666 1.00 0.00 H new ATOM 182 N GLY A 15 -7.780 -0.910 -6.739 1.00 0.00 N ATOM 183 CA GLY A 15 -7.262 -2.255 -6.930 1.00 0.00 C ATOM 184 C GLY A 15 -5.995 -2.267 -7.782 1.00 0.00 C ATOM 185 O GLY A 15 -5.037 -2.958 -7.439 1.00 0.00 O ATOM 0 H GLY A 15 -8.759 -0.806 -7.006 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.050 -2.702 -5.959 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -8.024 -2.872 -7.406 1.00 0.00 H new ATOM 189 N LYS A 16 -5.950 -1.456 -8.847 1.00 0.00 N ATOM 190 CA LYS A 16 -4.748 -1.272 -9.650 1.00 0.00 C ATOM 191 C LYS A 16 -3.597 -0.775 -8.793 1.00 0.00 C ATOM 192 O LYS A 16 -2.583 -1.457 -8.726 1.00 0.00 O ATOM 193 CB LYS A 16 -5.007 -0.345 -10.843 1.00 0.00 C ATOM 194 CG LYS A 16 -3.817 -0.281 -11.814 1.00 0.00 C ATOM 195 CD LYS A 16 -3.627 -1.572 -12.616 1.00 0.00 C ATOM 196 CE LYS A 16 -2.606 -1.355 -13.739 1.00 0.00 C ATOM 197 NZ LYS A 16 -2.892 -2.181 -14.931 1.00 0.00 N ATOM 0 H LYS A 16 -6.749 -0.912 -9.171 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.464 -2.243 -10.056 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -5.891 -0.689 -11.380 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.227 0.658 -10.477 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.963 0.550 -12.504 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -2.907 -0.072 -11.251 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.288 -2.371 -11.957 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.580 -1.890 -13.038 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.601 -0.303 -14.023 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.608 -1.590 -13.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.174 -1.998 -15.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.871 -3.187 -14.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.833 -1.940 -15.303 1.00 0.00 H new ATOM 211 N VAL A 17 -3.716 0.397 -8.167 1.00 0.00 N ATOM 212 CA VAL A 17 -2.636 0.997 -7.387 1.00 0.00 C ATOM 213 C VAL A 17 -2.210 0.048 -6.262 1.00 0.00 C ATOM 214 O VAL A 17 -1.036 0.025 -5.899 1.00 0.00 O ATOM 215 CB VAL A 17 -3.053 2.395 -6.865 1.00 0.00 C ATOM 216 CG1 VAL A 17 -1.990 2.985 -5.929 1.00 0.00 C ATOM 217 CG2 VAL A 17 -3.259 3.375 -8.036 1.00 0.00 C ATOM 0 H VAL A 17 -4.568 0.958 -8.188 1.00 0.00 H new ATOM 0 HA VAL A 17 -1.767 1.149 -8.027 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.986 2.262 -6.317 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.315 3.966 -5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.852 2.324 -5.073 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.047 3.085 -6.466 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.551 4.350 -7.647 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.330 3.472 -8.597 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -4.042 2.997 -8.693 1.00 0.00 H new ATOM 227 N ILE A 18 -3.129 -0.748 -5.715 1.00 0.00 N ATOM 228 CA ILE A 18 -2.814 -1.741 -4.706 1.00 0.00 C ATOM 229 C ILE A 18 -1.906 -2.796 -5.324 1.00 0.00 C ATOM 230 O ILE A 18 -0.799 -2.970 -4.815 1.00 0.00 O ATOM 231 CB ILE A 18 -4.102 -2.298 -4.064 1.00 0.00 C ATOM 232 CG1 ILE A 18 -4.666 -1.165 -3.180 1.00 0.00 C ATOM 233 CG2 ILE A 18 -3.830 -3.564 -3.218 1.00 0.00 C ATOM 234 CD1 ILE A 18 -6.141 -1.297 -2.829 1.00 0.00 C ATOM 0 H ILE A 18 -4.117 -0.716 -5.966 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.263 -1.295 -3.878 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.810 -2.601 -4.836 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.090 -1.125 -2.255 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.513 -0.215 -3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.765 -3.921 -2.786 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -3.404 -4.341 -3.853 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -3.129 -3.324 -2.419 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.444 -0.455 -2.206 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.734 -1.303 -3.744 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.304 -2.227 -2.285 1.00 0.00 H new ATOM 246 N GLN A 19 -2.351 -3.481 -6.383 1.00 0.00 N ATOM 247 CA GLN A 19 -1.583 -4.520 -7.054 1.00 0.00 C ATOM 248 C GLN A 19 -0.211 -3.970 -7.465 1.00 0.00 C ATOM 249 O GLN A 19 0.813 -4.578 -7.152 1.00 0.00 O ATOM 250 CB GLN A 19 -2.371 -5.053 -8.266 1.00 0.00 C ATOM 251 CG GLN A 19 -1.805 -6.393 -8.763 1.00 0.00 C ATOM 252 CD GLN A 19 -2.271 -6.748 -10.176 1.00 0.00 C ATOM 253 OE1 GLN A 19 -3.035 -7.680 -10.403 1.00 0.00 O ATOM 254 NE2 GLN A 19 -1.796 -6.024 -11.174 1.00 0.00 N ATOM 0 H GLN A 19 -3.269 -3.322 -6.799 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.417 -5.354 -6.372 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.419 -5.179 -7.993 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -2.337 -4.321 -9.073 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -0.716 -6.351 -8.745 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -2.105 -7.185 -8.077 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -1.161 -5.249 -10.984 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -2.065 -6.240 -12.134 1.00 0.00 H new ATOM 263 N GLN A 20 -0.175 -2.812 -8.130 1.00 0.00 N ATOM 264 CA GLN A 20 1.042 -2.203 -8.619 1.00 0.00 C ATOM 265 C GLN A 20 1.962 -1.849 -7.458 1.00 0.00 C ATOM 266 O GLN A 20 3.120 -2.254 -7.448 1.00 0.00 O ATOM 267 CB GLN A 20 0.673 -0.966 -9.455 1.00 0.00 C ATOM 268 CG GLN A 20 1.272 -1.008 -10.859 1.00 0.00 C ATOM 269 CD GLN A 20 2.425 -0.028 -10.991 1.00 0.00 C ATOM 270 OE1 GLN A 20 3.379 -0.049 -10.217 1.00 0.00 O ATOM 271 NE2 GLN A 20 2.344 0.904 -11.913 1.00 0.00 N ATOM 0 H GLN A 20 -1.013 -2.270 -8.342 1.00 0.00 H new ATOM 0 HA GLN A 20 1.585 -2.904 -9.253 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -0.412 -0.892 -9.529 1.00 0.00 H new ATOM 0 HB3 GLN A 20 1.020 -0.069 -8.942 1.00 0.00 H new ATOM 0 HG2 GLN A 20 1.621 -2.017 -11.079 1.00 0.00 H new ATOM 0 HG3 GLN A 20 0.502 -0.770 -11.593 1.00 0.00 H new ATOM 0 HE21 GLN A 20 1.551 0.919 -12.554 1.00 0.00 H new ATOM 0 HE22 GLN A 20 3.074 1.612 -11.988 1.00 0.00 H new ATOM 280 N GLY A 21 1.464 -1.127 -6.457 1.00 0.00 N ATOM 281 CA GLY A 21 2.262 -0.691 -5.327 1.00 0.00 C ATOM 282 C GLY A 21 2.797 -1.865 -4.516 1.00 0.00 C ATOM 283 O GLY A 21 3.912 -1.772 -3.999 1.00 0.00 O ATOM 0 H GLY A 21 0.489 -0.829 -6.412 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.096 -0.088 -5.684 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.659 -0.051 -4.683 1.00 0.00 H new ATOM 287 N ARG A 22 2.039 -2.965 -4.414 1.00 0.00 N ATOM 288 CA ARG A 22 2.530 -4.205 -3.842 1.00 0.00 C ATOM 289 C ARG A 22 3.727 -4.700 -4.641 1.00 0.00 C ATOM 290 O ARG A 22 4.806 -4.912 -4.085 1.00 0.00 O ATOM 291 CB ARG A 22 1.429 -5.283 -3.873 1.00 0.00 C ATOM 292 CG ARG A 22 0.486 -5.211 -2.695 1.00 0.00 C ATOM 293 CD ARG A 22 -0.311 -6.499 -2.449 1.00 0.00 C ATOM 294 NE ARG A 22 -0.997 -7.037 -3.636 1.00 0.00 N ATOM 295 CZ ARG A 22 -0.528 -7.912 -4.538 1.00 0.00 C ATOM 296 NH1 ARG A 22 0.694 -8.420 -4.434 1.00 0.00 N ATOM 297 NH2 ARG A 22 -1.269 -8.300 -5.563 1.00 0.00 N ATOM 0 H ARG A 22 1.070 -3.010 -4.728 1.00 0.00 H new ATOM 0 HA ARG A 22 2.823 -4.018 -2.809 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.856 -5.180 -4.795 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.896 -6.268 -3.896 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.059 -4.975 -1.799 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -0.212 -4.389 -2.852 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.366 -7.260 -2.062 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -1.053 -6.308 -1.673 1.00 0.00 H new ATOM 0 HE ARG A 22 -1.948 -6.702 -3.792 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.296 -8.146 -3.657 1.00 0.00 H new ATOM 0 HH12 ARG A 22 1.031 -9.084 -5.131 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -2.214 -7.933 -5.677 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -0.896 -8.966 -6.239 1.00 0.00 H new ATOM 311 N GLN A 23 3.518 -4.917 -5.935 1.00 0.00 N ATOM 312 CA GLN A 23 4.489 -5.446 -6.873 1.00 0.00 C ATOM 313 C GLN A 23 5.695 -4.525 -7.077 1.00 0.00 C ATOM 314 O GLN A 23 6.729 -4.985 -7.553 1.00 0.00 O ATOM 315 CB GLN A 23 3.753 -5.651 -8.194 1.00 0.00 C ATOM 316 CG GLN A 23 2.796 -6.850 -8.178 1.00 0.00 C ATOM 317 CD GLN A 23 3.490 -8.215 -8.186 1.00 0.00 C ATOM 318 OE1 GLN A 23 3.207 -9.057 -7.329 1.00 0.00 O ATOM 319 NE2 GLN A 23 4.384 -8.489 -9.122 1.00 0.00 N ATOM 0 H GLN A 23 2.620 -4.717 -6.376 1.00 0.00 H new ATOM 0 HA GLN A 23 4.897 -6.377 -6.479 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.189 -4.749 -8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 23 4.484 -5.789 -8.991 1.00 0.00 H new ATOM 0 HG2 GLN A 23 2.164 -6.783 -7.292 1.00 0.00 H new ATOM 0 HG3 GLN A 23 2.138 -6.786 -9.045 1.00 0.00 H new ATOM 0 HE21 GLN A 23 4.614 -7.790 -9.828 1.00 0.00 H new ATOM 0 HE22 GLN A 23 4.843 -9.400 -9.138 1.00 0.00 H new ATOM 328 N SER A 24 5.602 -3.251 -6.712 1.00 0.00 N ATOM 329 CA SER A 24 6.736 -2.336 -6.636 1.00 0.00 C ATOM 330 C SER A 24 7.666 -2.632 -5.449 1.00 0.00 C ATOM 331 O SER A 24 8.749 -2.053 -5.394 1.00 0.00 O ATOM 332 CB SER A 24 6.242 -0.890 -6.553 1.00 0.00 C ATOM 333 OG SER A 24 5.618 -0.484 -7.755 1.00 0.00 O ATOM 0 H SER A 24 4.716 -2.816 -6.455 1.00 0.00 H new ATOM 0 HA SER A 24 7.317 -2.483 -7.546 1.00 0.00 H new ATOM 0 HB2 SER A 24 5.539 -0.792 -5.726 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.082 -0.230 -6.337 1.00 0.00 H new ATOM 0 HG SER A 24 4.764 -0.955 -7.856 1.00 0.00 H new ATOM 339 N LYS A 25 7.289 -3.485 -4.490 1.00 0.00 N ATOM 340 CA LYS A 25 8.104 -3.819 -3.319 1.00 0.00 C ATOM 341 C LYS A 25 8.109 -5.329 -3.033 1.00 0.00 C ATOM 342 O LYS A 25 8.285 -5.748 -1.886 1.00 0.00 O ATOM 343 CB LYS A 25 7.632 -2.965 -2.135 1.00 0.00 C ATOM 344 CG LYS A 25 7.909 -1.467 -2.330 1.00 0.00 C ATOM 345 CD LYS A 25 7.549 -0.754 -1.033 1.00 0.00 C ATOM 346 CE LYS A 25 7.691 0.760 -1.171 1.00 0.00 C ATOM 347 NZ LYS A 25 7.719 1.441 0.139 1.00 0.00 N ATOM 0 H LYS A 25 6.392 -3.971 -4.507 1.00 0.00 H new ATOM 0 HA LYS A 25 9.150 -3.578 -3.512 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.562 -3.115 -1.989 1.00 0.00 H new ATOM 0 HB3 LYS A 25 8.129 -3.306 -1.227 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.957 -1.302 -2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.319 -1.074 -3.158 1.00 0.00 H new ATOM 0 HD2 LYS A 25 6.525 -1.001 -0.753 1.00 0.00 H new ATOM 0 HD3 LYS A 25 8.194 -1.110 -0.229 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.606 0.989 -1.717 1.00 0.00 H new ATOM 0 HE3 LYS A 25 6.862 1.148 -1.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 7.816 2.466 -0.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 6.835 1.246 0.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.525 1.091 0.695 1.00 0.00 H new ATOM 361 N GLY A 26 7.829 -6.146 -4.055 1.00 0.00 N ATOM 362 CA GLY A 26 7.769 -7.603 -3.957 1.00 0.00 C ATOM 363 C GLY A 26 6.699 -8.118 -2.984 1.00 0.00 C ATOM 364 O GLY A 26 6.741 -9.287 -2.583 1.00 0.00 O ATOM 0 H GLY A 26 7.634 -5.801 -4.995 1.00 0.00 H new ATOM 0 HA2 GLY A 26 7.575 -8.016 -4.947 1.00 0.00 H new ATOM 0 HA3 GLY A 26 8.743 -7.976 -3.641 1.00 0.00 H new ATOM 368 N LEU A 27 5.759 -7.268 -2.555 1.00 0.00 N ATOM 369 CA LEU A 27 4.857 -7.552 -1.443 1.00 0.00 C ATOM 370 C LEU A 27 3.830 -8.579 -1.892 1.00 0.00 C ATOM 371 O LEU A 27 3.132 -8.364 -2.893 1.00 0.00 O ATOM 372 CB LEU A 27 4.152 -6.267 -0.952 1.00 0.00 C ATOM 373 CG LEU A 27 5.127 -5.179 -0.461 1.00 0.00 C ATOM 374 CD1 LEU A 27 4.488 -3.797 -0.303 1.00 0.00 C ATOM 375 CD2 LEU A 27 5.725 -5.576 0.880 1.00 0.00 C ATOM 0 H LEU A 27 5.605 -6.353 -2.979 1.00 0.00 H new ATOM 0 HA LEU A 27 5.437 -7.947 -0.609 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.547 -5.862 -1.763 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.469 -6.524 -0.142 1.00 0.00 H new ATOM 0 HG LEU A 27 5.890 -5.104 -1.235 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.238 -3.087 0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.094 -3.466 -1.264 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.676 -3.852 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.412 -4.799 1.216 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.927 -5.697 1.613 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.265 -6.517 0.773 1.00 0.00 H new ATOM 387 N THR A 28 3.712 -9.687 -1.162 1.00 0.00 N ATOM 388 CA THR A 28 2.560 -10.560 -1.326 1.00 0.00 C ATOM 389 C THR A 28 1.300 -9.823 -0.849 1.00 0.00 C ATOM 390 O THR A 28 1.372 -8.760 -0.219 1.00 0.00 O ATOM 391 CB THR A 28 2.770 -11.894 -0.590 1.00 0.00 C ATOM 392 OG1 THR A 28 2.857 -11.685 0.801 1.00 0.00 O ATOM 393 CG2 THR A 28 4.002 -12.648 -1.097 1.00 0.00 C ATOM 0 H THR A 28 4.389 -9.995 -0.464 1.00 0.00 H new ATOM 0 HA THR A 28 2.434 -10.808 -2.380 1.00 0.00 H new ATOM 0 HB THR A 28 1.901 -12.517 -0.801 1.00 0.00 H new ATOM 0 HG1 THR A 28 3.780 -11.460 1.041 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.108 -13.583 -0.547 1.00 0.00 H new ATOM 0 HG22 THR A 28 3.885 -12.863 -2.159 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.891 -12.036 -0.946 1.00 0.00 H new ATOM 401 N GLN A 29 0.123 -10.393 -1.105 1.00 0.00 N ATOM 402 CA GLN A 29 -1.106 -9.887 -0.499 1.00 0.00 C ATOM 403 C GLN A 29 -1.048 -10.030 1.025 1.00 0.00 C ATOM 404 O GLN A 29 -1.568 -9.179 1.739 1.00 0.00 O ATOM 405 CB GLN A 29 -2.318 -10.608 -1.105 1.00 0.00 C ATOM 406 CG GLN A 29 -2.473 -10.171 -2.567 1.00 0.00 C ATOM 407 CD GLN A 29 -3.585 -10.904 -3.303 1.00 0.00 C ATOM 408 OE1 GLN A 29 -3.602 -12.129 -3.370 1.00 0.00 O ATOM 409 NE2 GLN A 29 -4.514 -10.190 -3.903 1.00 0.00 N ATOM 0 H GLN A 29 -0.004 -11.196 -1.721 1.00 0.00 H new ATOM 0 HA GLN A 29 -1.211 -8.824 -0.716 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -2.183 -11.688 -1.046 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.220 -10.369 -0.542 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -2.671 -9.100 -2.599 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -1.531 -10.337 -3.090 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.493 -9.172 -3.843 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.255 -10.655 -4.428 1.00 0.00 H new ATOM 418 N LYS A 30 -0.374 -11.067 1.531 1.00 0.00 N ATOM 419 CA LYS A 30 -0.211 -11.299 2.958 1.00 0.00 C ATOM 420 C LYS A 30 0.759 -10.290 3.571 1.00 0.00 C ATOM 421 O LYS A 30 0.509 -9.816 4.674 1.00 0.00 O ATOM 422 CB LYS A 30 0.233 -12.749 3.193 1.00 0.00 C ATOM 423 CG LYS A 30 -0.907 -13.783 3.102 1.00 0.00 C ATOM 424 CD LYS A 30 -1.508 -14.024 1.709 1.00 0.00 C ATOM 425 CE LYS A 30 -2.605 -15.078 1.879 1.00 0.00 C ATOM 426 NZ LYS A 30 -3.322 -15.393 0.631 1.00 0.00 N ATOM 0 H LYS A 30 0.077 -11.774 0.950 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.167 -11.152 3.460 1.00 0.00 H new ATOM 0 HB2 LYS A 30 1.000 -13.005 2.462 1.00 0.00 H new ATOM 0 HB3 LYS A 30 0.695 -12.820 4.178 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.535 -14.735 3.482 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -1.709 -13.466 3.769 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.918 -13.101 1.300 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.744 -14.370 1.012 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -2.161 -15.992 2.273 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -3.322 -14.727 2.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.049 -16.112 0.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -3.775 -14.532 0.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.649 -15.758 -0.073 1.00 0.00 H new ATOM 440 N ASP A 31 1.815 -9.891 2.856 1.00 0.00 N ATOM 441 CA ASP A 31 2.738 -8.845 3.313 1.00 0.00 C ATOM 442 C ASP A 31 1.962 -7.548 3.517 1.00 0.00 C ATOM 443 O ASP A 31 2.190 -6.814 4.477 1.00 0.00 O ATOM 444 CB ASP A 31 3.862 -8.582 2.300 1.00 0.00 C ATOM 445 CG ASP A 31 4.994 -9.602 2.363 1.00 0.00 C ATOM 446 OD1 ASP A 31 5.849 -9.506 3.285 1.00 0.00 O ATOM 447 OD2 ASP A 31 5.069 -10.441 1.441 1.00 0.00 O ATOM 0 H ASP A 31 2.055 -10.283 1.945 1.00 0.00 H new ATOM 0 HA ASP A 31 3.189 -9.189 4.244 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.441 -8.582 1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.271 -7.587 2.475 1.00 0.00 H new ATOM 452 N LEU A 32 1.033 -7.257 2.603 1.00 0.00 N ATOM 453 CA LEU A 32 0.165 -6.093 2.686 1.00 0.00 C ATOM 454 C LEU A 32 -0.774 -6.202 3.882 1.00 0.00 C ATOM 455 O LEU A 32 -0.909 -5.258 4.657 1.00 0.00 O ATOM 456 CB LEU A 32 -0.642 -5.962 1.389 1.00 0.00 C ATOM 457 CG LEU A 32 -0.818 -4.509 0.930 1.00 0.00 C ATOM 458 CD1 LEU A 32 -1.527 -3.591 1.933 1.00 0.00 C ATOM 459 CD2 LEU A 32 0.555 -3.926 0.569 1.00 0.00 C ATOM 0 H LEU A 32 0.865 -7.833 1.778 1.00 0.00 H new ATOM 0 HA LEU A 32 0.782 -5.204 2.820 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.145 -6.527 0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.624 -6.412 1.533 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.478 -4.547 0.063 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.603 -2.587 1.516 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.526 -3.976 2.135 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.957 -3.557 2.861 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.437 -2.893 0.242 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.205 -3.958 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.999 -4.513 -0.235 1.00 0.00 H new ATOM 471 N ALA A 33 -1.407 -7.362 4.034 1.00 0.00 N ATOM 472 CA ALA A 33 -2.306 -7.670 5.131 1.00 0.00 C ATOM 473 C ALA A 33 -1.629 -7.390 6.472 1.00 0.00 C ATOM 474 O ALA A 33 -2.205 -6.690 7.301 1.00 0.00 O ATOM 475 CB ALA A 33 -2.763 -9.123 5.013 1.00 0.00 C ATOM 0 H ALA A 33 -1.302 -8.133 3.375 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.186 -7.029 5.080 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -3.439 -9.360 5.835 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.281 -9.266 4.065 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -1.896 -9.782 5.055 1.00 0.00 H new ATOM 481 N THR A 34 -0.392 -7.856 6.651 1.00 0.00 N ATOM 482 CA THR A 34 0.458 -7.554 7.795 1.00 0.00 C ATOM 483 C THR A 34 0.696 -6.050 7.921 1.00 0.00 C ATOM 484 O THR A 34 0.488 -5.477 8.991 1.00 0.00 O ATOM 485 CB THR A 34 1.771 -8.334 7.626 1.00 0.00 C ATOM 486 OG1 THR A 34 1.484 -9.712 7.581 1.00 0.00 O ATOM 487 CG2 THR A 34 2.781 -8.113 8.752 1.00 0.00 C ATOM 0 H THR A 34 0.058 -8.476 5.977 1.00 0.00 H new ATOM 0 HA THR A 34 -0.028 -7.861 8.721 1.00 0.00 H new ATOM 0 HB THR A 34 2.221 -7.965 6.704 1.00 0.00 H new ATOM 0 HG1 THR A 34 1.159 -9.949 6.687 1.00 0.00 H new ATOM 0 HG21 THR A 34 3.679 -8.699 8.556 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.042 -7.056 8.804 1.00 0.00 H new ATOM 0 HG23 THR A 34 2.343 -8.426 9.700 1.00 0.00 H new ATOM 495 N LYS A 35 1.080 -5.376 6.833 1.00 0.00 N ATOM 496 CA LYS A 35 1.346 -3.946 6.832 1.00 0.00 C ATOM 497 C LYS A 35 0.157 -3.104 7.286 1.00 0.00 C ATOM 498 O LYS A 35 0.388 -1.994 7.763 1.00 0.00 O ATOM 499 CB LYS A 35 1.799 -3.523 5.439 1.00 0.00 C ATOM 500 CG LYS A 35 3.295 -3.791 5.243 1.00 0.00 C ATOM 501 CD LYS A 35 3.691 -3.777 3.763 1.00 0.00 C ATOM 502 CE LYS A 35 5.206 -3.621 3.583 1.00 0.00 C ATOM 503 NZ LYS A 35 6.009 -4.741 4.137 1.00 0.00 N ATOM 0 H LYS A 35 1.214 -5.817 5.923 1.00 0.00 H new ATOM 0 HA LYS A 35 2.135 -3.763 7.562 1.00 0.00 H new ATOM 0 HB2 LYS A 35 1.227 -4.066 4.686 1.00 0.00 H new ATOM 0 HB3 LYS A 35 1.594 -2.463 5.292 1.00 0.00 H new ATOM 0 HG2 LYS A 35 3.872 -3.038 5.780 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.550 -4.757 5.678 1.00 0.00 H new ATOM 0 HD2 LYS A 35 3.362 -4.702 3.289 1.00 0.00 H new ATOM 0 HD3 LYS A 35 3.178 -2.959 3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 35 5.425 -3.524 2.520 1.00 0.00 H new ATOM 0 HE3 LYS A 35 5.522 -2.693 4.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.020 -4.557 3.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 5.832 -4.823 5.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 5.738 -5.628 3.667 1.00 0.00 H new ATOM 517 N ILE A 36 -1.077 -3.596 7.205 1.00 0.00 N ATOM 518 CA ILE A 36 -2.249 -2.905 7.740 1.00 0.00 C ATOM 519 C ILE A 36 -2.903 -3.683 8.889 1.00 0.00 C ATOM 520 O ILE A 36 -3.967 -3.281 9.355 1.00 0.00 O ATOM 521 CB ILE A 36 -3.212 -2.539 6.602 1.00 0.00 C ATOM 522 CG1 ILE A 36 -3.851 -3.763 5.923 1.00 0.00 C ATOM 523 CG2 ILE A 36 -2.527 -1.633 5.564 1.00 0.00 C ATOM 524 CD1 ILE A 36 -5.063 -3.303 5.123 1.00 0.00 C ATOM 0 H ILE A 36 -1.294 -4.490 6.764 1.00 0.00 H new ATOM 0 HA ILE A 36 -1.930 -1.967 8.194 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.028 -1.986 7.067 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.129 -4.251 5.268 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.149 -4.497 6.672 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.233 -1.390 4.770 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -2.194 -0.714 6.047 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -1.668 -2.152 5.139 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -5.525 -4.162 4.636 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.784 -2.834 5.792 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.748 -2.584 4.367 1.00 0.00 H new ATOM 536 N ASN A 37 -2.278 -4.756 9.371 1.00 0.00 N ATOM 537 CA ASN A 37 -2.829 -5.734 10.316 1.00 0.00 C ATOM 538 C ASN A 37 -4.325 -6.001 10.064 1.00 0.00 C ATOM 539 O ASN A 37 -5.200 -5.532 10.797 1.00 0.00 O ATOM 540 CB ASN A 37 -2.532 -5.307 11.762 1.00 0.00 C ATOM 541 CG ASN A 37 -3.055 -6.319 12.776 1.00 0.00 C ATOM 542 OD1 ASN A 37 -2.588 -7.454 12.844 1.00 0.00 O ATOM 543 ND2 ASN A 37 -4.033 -5.954 13.583 1.00 0.00 N ATOM 0 H ASN A 37 -1.321 -4.981 9.100 1.00 0.00 H new ATOM 0 HA ASN A 37 -2.331 -6.689 10.151 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -1.456 -5.188 11.891 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -2.986 -4.335 11.953 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -4.404 -6.614 14.266 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -4.418 -5.011 13.524 1.00 0.00 H new ATOM 550 N GLU A 38 -4.637 -6.706 8.980 1.00 0.00 N ATOM 551 CA GLU A 38 -5.961 -7.210 8.647 1.00 0.00 C ATOM 552 C GLU A 38 -5.839 -8.594 7.995 1.00 0.00 C ATOM 553 O GLU A 38 -4.730 -9.110 7.817 1.00 0.00 O ATOM 554 CB GLU A 38 -6.641 -6.201 7.709 1.00 0.00 C ATOM 555 CG GLU A 38 -7.958 -5.686 8.277 1.00 0.00 C ATOM 556 CD GLU A 38 -9.097 -6.701 8.180 1.00 0.00 C ATOM 557 OE1 GLU A 38 -9.014 -7.756 8.851 1.00 0.00 O ATOM 558 OE2 GLU A 38 -10.058 -6.470 7.413 1.00 0.00 O ATOM 0 H GLU A 38 -3.939 -6.952 8.278 1.00 0.00 H new ATOM 0 HA GLU A 38 -6.569 -7.323 9.544 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -5.969 -5.361 7.533 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.823 -6.671 6.743 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.813 -5.412 9.322 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.244 -4.778 7.747 1.00 0.00 H new ATOM 565 N LYS A 39 -6.962 -9.211 7.615 1.00 0.00 N ATOM 566 CA LYS A 39 -6.950 -10.451 6.854 1.00 0.00 C ATOM 567 C LYS A 39 -6.419 -10.189 5.447 1.00 0.00 C ATOM 568 O LYS A 39 -6.798 -9.207 4.812 1.00 0.00 O ATOM 569 CB LYS A 39 -8.355 -11.073 6.755 1.00 0.00 C ATOM 570 CG LYS A 39 -8.951 -11.438 8.116 1.00 0.00 C ATOM 571 CD LYS A 39 -8.195 -12.547 8.852 1.00 0.00 C ATOM 572 CE LYS A 39 -8.842 -12.738 10.222 1.00 0.00 C ATOM 573 NZ LYS A 39 -8.200 -13.796 11.021 1.00 0.00 N ATOM 0 H LYS A 39 -7.897 -8.863 7.828 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.301 -11.153 7.378 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.020 -10.372 6.251 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -8.306 -11.968 6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.969 -10.547 8.744 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -9.986 -11.750 7.976 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.232 -13.475 8.282 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.143 -12.282 8.962 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.798 -11.798 10.772 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.896 -12.981 10.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -8.682 -13.879 11.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.264 -14.701 10.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.200 -13.556 11.176 1.00 0.00 H new ATOM 587 N PRO A 40 -5.658 -11.127 4.875 1.00 0.00 N ATOM 588 CA PRO A 40 -5.274 -11.077 3.473 1.00 0.00 C ATOM 589 C PRO A 40 -6.467 -11.326 2.537 1.00 0.00 C ATOM 590 O PRO A 40 -6.359 -11.082 1.331 1.00 0.00 O ATOM 591 CB PRO A 40 -4.169 -12.120 3.352 1.00 0.00 C ATOM 592 CG PRO A 40 -4.535 -13.156 4.408 1.00 0.00 C ATOM 593 CD PRO A 40 -5.181 -12.334 5.519 1.00 0.00 C ATOM 0 HA PRO A 40 -4.921 -10.093 3.165 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -4.139 -12.558 2.354 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -3.187 -11.687 3.539 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -5.223 -13.904 4.013 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -3.655 -13.690 4.766 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.000 -12.880 5.987 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -4.463 -12.102 6.305 1.00 0.00 H new ATOM 601 N GLN A 41 -7.608 -11.755 3.086 1.00 0.00 N ATOM 602 CA GLN A 41 -8.880 -11.844 2.394 1.00 0.00 C ATOM 603 C GLN A 41 -9.332 -10.466 1.914 1.00 0.00 C ATOM 604 O GLN A 41 -9.849 -10.356 0.801 1.00 0.00 O ATOM 605 CB GLN A 41 -9.940 -12.445 3.338 1.00 0.00 C ATOM 606 CG GLN A 41 -10.973 -13.302 2.591 1.00 0.00 C ATOM 607 CD GLN A 41 -10.353 -14.592 2.060 1.00 0.00 C ATOM 608 OE1 GLN A 41 -9.701 -15.327 2.799 1.00 0.00 O ATOM 609 NE2 GLN A 41 -10.481 -14.874 0.778 1.00 0.00 N ATOM 0 H GLN A 41 -7.664 -12.058 4.058 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.760 -12.488 1.523 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.445 -13.055 4.094 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.453 -11.639 3.864 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -11.799 -13.543 3.260 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.390 -12.730 1.762 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.024 -14.259 0.172 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.037 -15.708 0.392 1.00 0.00 H new ATOM 618 N VAL A 42 -9.185 -9.415 2.733 1.00 0.00 N ATOM 619 CA VAL A 42 -9.687 -8.107 2.327 1.00 0.00 C ATOM 620 C VAL A 42 -8.752 -7.477 1.301 1.00 0.00 C ATOM 621 O VAL A 42 -9.229 -6.729 0.461 1.00 0.00 O ATOM 622 CB VAL A 42 -10.030 -7.184 3.514 1.00 0.00 C ATOM 623 CG1 VAL A 42 -11.041 -7.877 4.441 1.00 0.00 C ATOM 624 CG2 VAL A 42 -8.832 -6.695 4.338 1.00 0.00 C ATOM 0 H VAL A 42 -8.738 -9.446 3.649 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.649 -8.258 1.836 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.454 -6.288 3.060 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.278 -7.219 5.277 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -11.951 -8.100 3.885 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -10.611 -8.804 4.820 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.184 -6.054 5.146 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -8.305 -7.552 4.758 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.155 -6.131 3.696 1.00 0.00 H new ATOM 634 N ILE A 43 -7.456 -7.808 1.302 1.00 0.00 N ATOM 635 CA ILE A 43 -6.502 -7.316 0.309 1.00 0.00 C ATOM 636 C ILE A 43 -6.911 -7.821 -1.076 1.00 0.00 C ATOM 637 O ILE A 43 -7.003 -7.039 -2.022 1.00 0.00 O ATOM 638 CB ILE A 43 -5.062 -7.734 0.686 1.00 0.00 C ATOM 639 CG1 ILE A 43 -4.693 -7.331 2.130 1.00 0.00 C ATOM 640 CG2 ILE A 43 -4.038 -7.178 -0.319 1.00 0.00 C ATOM 641 CD1 ILE A 43 -4.877 -5.850 2.473 1.00 0.00 C ATOM 0 H ILE A 43 -7.040 -8.428 1.997 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.516 -6.226 0.289 1.00 0.00 H new ATOM 0 HB ILE A 43 -5.029 -8.823 0.639 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.297 -7.922 2.818 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -3.652 -7.600 2.308 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.035 -7.489 -0.026 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -4.261 -7.561 -1.315 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.092 -6.089 -0.329 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.589 -5.678 3.510 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.251 -5.244 1.817 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.922 -5.572 2.336 1.00 0.00 H new ATOM 653 N ALA A 44 -7.213 -9.119 -1.183 1.00 0.00 N ATOM 654 CA ALA A 44 -7.700 -9.718 -2.417 1.00 0.00 C ATOM 655 C ALA A 44 -8.935 -8.978 -2.930 1.00 0.00 C ATOM 656 O ALA A 44 -9.081 -8.743 -4.133 1.00 0.00 O ATOM 657 CB ALA A 44 -8.034 -11.191 -2.163 1.00 0.00 C ATOM 0 H ALA A 44 -7.124 -9.780 -0.411 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.923 -9.644 -3.178 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.399 -11.645 -3.084 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -7.138 -11.715 -1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -8.803 -11.262 -1.393 1.00 0.00 H new ATOM 663 N ASP A 45 -9.838 -8.635 -2.018 1.00 0.00 N ATOM 664 CA ASP A 45 -11.120 -8.050 -2.360 1.00 0.00 C ATOM 665 C ASP A 45 -10.982 -6.572 -2.686 1.00 0.00 C ATOM 666 O ASP A 45 -11.690 -6.096 -3.570 1.00 0.00 O ATOM 667 CB ASP A 45 -12.115 -8.305 -1.229 1.00 0.00 C ATOM 668 CG ASP A 45 -12.720 -9.708 -1.313 1.00 0.00 C ATOM 669 OD1 ASP A 45 -12.173 -10.597 -2.013 1.00 0.00 O ATOM 670 OD2 ASP A 45 -13.694 -9.971 -0.580 1.00 0.00 O ATOM 0 H ASP A 45 -9.696 -8.758 -1.015 1.00 0.00 H new ATOM 0 HA ASP A 45 -11.503 -8.526 -3.262 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -11.614 -8.182 -0.269 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -12.912 -7.562 -1.271 1.00 0.00 H new ATOM 675 N TYR A 46 -10.056 -5.855 -2.048 1.00 0.00 N ATOM 676 CA TYR A 46 -9.651 -4.510 -2.431 1.00 0.00 C ATOM 677 C TYR A 46 -9.124 -4.524 -3.866 1.00 0.00 C ATOM 678 O TYR A 46 -9.472 -3.643 -4.651 1.00 0.00 O ATOM 679 CB TYR A 46 -8.564 -3.995 -1.473 1.00 0.00 C ATOM 680 CG TYR A 46 -9.032 -2.991 -0.435 1.00 0.00 C ATOM 681 CD1 TYR A 46 -9.222 -1.641 -0.789 1.00 0.00 C ATOM 682 CD2 TYR A 46 -9.229 -3.393 0.899 1.00 0.00 C ATOM 683 CE1 TYR A 46 -9.640 -0.707 0.177 1.00 0.00 C ATOM 684 CE2 TYR A 46 -9.654 -2.469 1.868 1.00 0.00 C ATOM 685 CZ TYR A 46 -9.885 -1.123 1.503 1.00 0.00 C ATOM 686 OH TYR A 46 -10.346 -0.219 2.411 1.00 0.00 O ATOM 0 H TYR A 46 -9.557 -6.206 -1.231 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.512 -3.844 -2.372 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.125 -4.849 -0.956 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -7.770 -3.538 -2.064 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.046 -1.322 -1.806 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -9.052 -4.421 1.180 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.773 0.329 -0.097 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -9.804 -2.786 2.889 1.00 0.00 H new ATOM 0 HH TYR A 46 -10.691 -0.692 3.197 1.00 0.00 H new ATOM 696 N GLU A 47 -8.304 -5.521 -4.210 1.00 0.00 N ATOM 697 CA GLU A 47 -7.700 -5.645 -5.527 1.00 0.00 C ATOM 698 C GLU A 47 -8.735 -5.820 -6.628 1.00 0.00 C ATOM 699 O GLU A 47 -8.542 -5.263 -7.707 1.00 0.00 O ATOM 700 CB GLU A 47 -6.687 -6.795 -5.554 1.00 0.00 C ATOM 701 CG GLU A 47 -5.288 -6.222 -5.370 1.00 0.00 C ATOM 702 CD GLU A 47 -4.260 -7.329 -5.228 1.00 0.00 C ATOM 703 OE1 GLU A 47 -3.990 -8.082 -6.193 1.00 0.00 O ATOM 704 OE2 GLU A 47 -3.683 -7.480 -4.137 1.00 0.00 O ATOM 0 H GLU A 47 -8.042 -6.270 -3.570 1.00 0.00 H new ATOM 0 HA GLU A 47 -7.178 -4.709 -5.724 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -6.908 -7.511 -4.763 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -6.753 -7.334 -6.499 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.034 -5.593 -6.223 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -5.266 -5.585 -4.486 1.00 0.00 H new ATOM 711 N SER A 48 -9.790 -6.607 -6.409 1.00 0.00 N ATOM 712 CA SER A 48 -10.853 -6.731 -7.398 1.00 0.00 C ATOM 713 C SER A 48 -11.863 -5.589 -7.322 1.00 0.00 C ATOM 714 O SER A 48 -12.527 -5.307 -8.321 1.00 0.00 O ATOM 715 CB SER A 48 -11.588 -8.049 -7.224 1.00 0.00 C ATOM 716 OG SER A 48 -10.770 -9.115 -7.684 1.00 0.00 O ATOM 0 H SER A 48 -9.927 -7.161 -5.564 1.00 0.00 H new ATOM 0 HA SER A 48 -10.371 -6.691 -8.375 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.843 -8.199 -6.175 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.525 -8.030 -7.780 1.00 0.00 H new ATOM 0 HG SER A 48 -11.245 -9.965 -7.569 1.00 0.00 H new ATOM 722 N GLY A 49 -12.015 -4.954 -6.160 1.00 0.00 N ATOM 723 CA GLY A 49 -12.941 -3.846 -5.965 1.00 0.00 C ATOM 724 C GLY A 49 -14.144 -4.218 -5.109 1.00 0.00 C ATOM 725 O GLY A 49 -15.069 -3.428 -4.942 1.00 0.00 O ATOM 0 H GLY A 49 -11.491 -5.200 -5.320 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -12.412 -3.016 -5.497 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -13.288 -3.495 -6.937 1.00 0.00 H new ATOM 729 N ARG A 50 -14.167 -5.443 -4.604 1.00 0.00 N ATOM 730 CA ARG A 50 -15.262 -6.018 -3.855 1.00 0.00 C ATOM 731 C ARG A 50 -15.399 -5.296 -2.527 1.00 0.00 C ATOM 732 O ARG A 50 -16.465 -4.752 -2.276 1.00 0.00 O ATOM 733 CB ARG A 50 -14.988 -7.513 -3.676 1.00 0.00 C ATOM 734 CG ARG A 50 -14.976 -8.262 -5.012 1.00 0.00 C ATOM 735 CD ARG A 50 -16.399 -8.510 -5.527 1.00 0.00 C ATOM 736 NE ARG A 50 -16.442 -9.683 -6.405 1.00 0.00 N ATOM 737 CZ ARG A 50 -16.235 -9.751 -7.721 1.00 0.00 C ATOM 738 NH1 ARG A 50 -16.008 -8.655 -8.441 1.00 0.00 N ATOM 739 NH2 ARG A 50 -16.264 -10.947 -8.292 1.00 0.00 N ATOM 0 H ARG A 50 -13.384 -6.088 -4.713 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.208 -5.902 -4.385 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.028 -7.648 -3.177 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -15.749 -7.945 -3.026 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -14.416 -7.686 -5.749 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.460 -9.214 -4.892 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -17.074 -8.657 -4.684 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -16.752 -7.632 -6.069 1.00 0.00 H new ATOM 0 HE ARG A 50 -16.660 -10.568 -5.947 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -15.990 -7.742 -7.987 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.852 -8.728 -9.446 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -16.440 -11.778 -7.727 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -16.110 -11.037 -9.296 1.00 0.00 H new ATOM 753 N ALA A 51 -14.351 -5.283 -1.699 1.00 0.00 N ATOM 754 CA ALA A 51 -14.410 -4.703 -0.362 1.00 0.00 C ATOM 755 C ALA A 51 -14.766 -3.218 -0.454 1.00 0.00 C ATOM 756 O ALA A 51 -14.242 -2.521 -1.325 1.00 0.00 O ATOM 757 CB ALA A 51 -13.059 -4.882 0.344 1.00 0.00 C ATOM 0 H ALA A 51 -13.440 -5.675 -1.940 1.00 0.00 H new ATOM 0 HA ALA A 51 -15.180 -5.214 0.216 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -13.110 -4.447 1.342 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -12.827 -5.944 0.423 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -12.279 -4.382 -0.231 1.00 0.00 H new ATOM 763 N ILE A 52 -15.571 -2.714 0.492 1.00 0.00 N ATOM 764 CA ILE A 52 -15.879 -1.290 0.559 1.00 0.00 C ATOM 765 C ILE A 52 -14.583 -0.573 0.961 1.00 0.00 C ATOM 766 O ILE A 52 -13.986 -0.931 1.982 1.00 0.00 O ATOM 767 CB ILE A 52 -17.040 -0.989 1.530 1.00 0.00 C ATOM 768 CG1 ILE A 52 -18.330 -1.483 0.844 1.00 0.00 C ATOM 769 CG2 ILE A 52 -17.120 0.519 1.840 1.00 0.00 C ATOM 770 CD1 ILE A 52 -19.642 -0.978 1.425 1.00 0.00 C ATOM 0 H ILE A 52 -16.017 -3.275 1.217 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.226 -0.930 -0.409 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.891 -1.495 2.484 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -18.289 -1.196 -0.207 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -18.339 -2.572 0.877 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -17.946 0.706 2.526 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -16.187 0.846 2.298 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -17.284 1.072 0.915 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -20.475 -1.394 0.858 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -19.721 -1.287 2.467 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.671 0.110 1.366 1.00 0.00 H new ATOM 782 N PRO A 53 -14.145 0.442 0.198 1.00 0.00 N ATOM 783 CA PRO A 53 -12.984 1.238 0.544 1.00 0.00 C ATOM 784 C PRO A 53 -13.340 2.100 1.764 1.00 0.00 C ATOM 785 O PRO A 53 -14.254 2.924 1.695 1.00 0.00 O ATOM 786 CB PRO A 53 -12.665 2.029 -0.731 1.00 0.00 C ATOM 787 CG PRO A 53 -14.016 2.205 -1.421 1.00 0.00 C ATOM 788 CD PRO A 53 -14.785 0.953 -1.009 1.00 0.00 C ATOM 0 HA PRO A 53 -12.100 0.672 0.839 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.210 2.992 -0.497 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.962 1.490 -1.367 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.520 3.114 -1.092 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.909 2.274 -2.504 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -15.833 1.188 -0.821 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.763 0.207 -1.803 1.00 0.00 H new ATOM 796 N ASN A 54 -12.659 1.894 2.896 1.00 0.00 N ATOM 797 CA ASN A 54 -12.854 2.655 4.132 1.00 0.00 C ATOM 798 C ASN A 54 -11.571 3.430 4.395 1.00 0.00 C ATOM 799 O ASN A 54 -10.510 2.818 4.465 1.00 0.00 O ATOM 800 CB ASN A 54 -13.164 1.725 5.329 1.00 0.00 C ATOM 801 CG ASN A 54 -13.421 2.488 6.636 1.00 0.00 C ATOM 802 OD1 ASN A 54 -13.008 3.626 6.818 1.00 0.00 O ATOM 803 ND2 ASN A 54 -14.116 1.922 7.604 1.00 0.00 N ATOM 0 H ASN A 54 -11.940 1.176 2.979 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.706 3.326 4.019 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -14.038 1.118 5.092 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.329 1.039 5.474 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -14.294 2.432 8.469 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -14.476 0.975 7.487 1.00 0.00 H new ATOM 810 N ASN A 55 -11.658 4.747 4.588 1.00 0.00 N ATOM 811 CA ASN A 55 -10.553 5.632 4.952 1.00 0.00 C ATOM 812 C ASN A 55 -9.650 5.082 6.062 1.00 0.00 C ATOM 813 O ASN A 55 -8.428 5.231 5.976 1.00 0.00 O ATOM 814 CB ASN A 55 -11.075 7.027 5.312 1.00 0.00 C ATOM 815 CG ASN A 55 -11.386 7.208 6.793 1.00 0.00 C ATOM 816 OD1 ASN A 55 -10.547 7.676 7.560 1.00 0.00 O ATOM 817 ND2 ASN A 55 -12.588 6.883 7.218 1.00 0.00 N ATOM 0 H ASN A 55 -12.541 5.247 4.490 1.00 0.00 H new ATOM 0 HA ASN A 55 -9.920 5.699 4.067 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -10.335 7.769 5.013 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -11.978 7.226 4.734 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -12.836 7.018 8.198 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -13.272 6.496 6.567 1.00 0.00 H new ATOM 824 N GLN A 56 -10.221 4.411 7.070 1.00 0.00 N ATOM 825 CA GLN A 56 -9.463 3.805 8.157 1.00 0.00 C ATOM 826 C GLN A 56 -8.443 2.790 7.646 1.00 0.00 C ATOM 827 O GLN A 56 -7.423 2.595 8.296 1.00 0.00 O ATOM 828 CB GLN A 56 -10.395 3.082 9.138 1.00 0.00 C ATOM 829 CG GLN A 56 -10.972 3.968 10.244 1.00 0.00 C ATOM 830 CD GLN A 56 -11.513 3.069 11.353 1.00 0.00 C ATOM 831 OE1 GLN A 56 -12.442 2.300 11.130 1.00 0.00 O ATOM 832 NE2 GLN A 56 -10.958 3.112 12.548 1.00 0.00 N ATOM 0 H GLN A 56 -11.229 4.276 7.149 1.00 0.00 H new ATOM 0 HA GLN A 56 -8.942 4.621 8.657 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -11.219 2.642 8.577 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -9.848 2.260 9.599 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -10.203 4.633 10.637 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -11.767 4.600 9.847 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -10.186 3.753 12.729 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -11.301 2.504 13.292 1.00 0.00 H new ATOM 841 N VAL A 57 -8.739 2.080 6.562 1.00 0.00 N ATOM 842 CA VAL A 57 -7.842 1.134 5.916 1.00 0.00 C ATOM 843 C VAL A 57 -7.088 1.838 4.786 1.00 0.00 C ATOM 844 O VAL A 57 -5.874 1.700 4.732 1.00 0.00 O ATOM 845 CB VAL A 57 -8.678 -0.063 5.421 1.00 0.00 C ATOM 846 CG1 VAL A 57 -7.818 -1.026 4.604 1.00 0.00 C ATOM 847 CG2 VAL A 57 -9.326 -0.802 6.599 1.00 0.00 C ATOM 0 H VAL A 57 -9.643 2.152 6.094 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.091 0.757 6.610 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.469 0.326 4.779 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.430 -1.862 4.266 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.408 -0.504 3.740 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -7.002 -1.400 5.223 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.910 -1.642 6.224 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.549 -1.170 7.269 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.979 -0.119 7.142 1.00 0.00 H new ATOM 857 N LEU A 58 -7.744 2.613 3.911 1.00 0.00 N ATOM 858 CA LEU A 58 -7.096 3.314 2.796 1.00 0.00 C ATOM 859 C LEU A 58 -5.848 4.058 3.265 1.00 0.00 C ATOM 860 O LEU A 58 -4.792 3.890 2.669 1.00 0.00 O ATOM 861 CB LEU A 58 -8.038 4.320 2.118 1.00 0.00 C ATOM 862 CG LEU A 58 -9.228 3.712 1.359 1.00 0.00 C ATOM 863 CD1 LEU A 58 -10.225 4.830 1.044 1.00 0.00 C ATOM 864 CD2 LEU A 58 -8.795 3.044 0.049 1.00 0.00 C ATOM 0 H LEU A 58 -8.750 2.772 3.959 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.822 2.546 2.073 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.424 4.998 2.879 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.456 4.922 1.421 1.00 0.00 H new ATOM 0 HG LEU A 58 -9.679 2.945 1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -11.077 4.416 0.505 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -10.569 5.283 1.974 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.740 5.588 0.429 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -9.668 2.628 -0.453 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.322 3.783 -0.597 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.086 2.245 0.265 1.00 0.00 H new ATOM 876 N GLY A 59 -5.942 4.844 4.343 1.00 0.00 N ATOM 877 CA GLY A 59 -4.807 5.589 4.883 1.00 0.00 C ATOM 878 C GLY A 59 -3.643 4.688 5.308 1.00 0.00 C ATOM 879 O GLY A 59 -2.482 5.095 5.227 1.00 0.00 O ATOM 0 H GLY A 59 -6.809 4.979 4.863 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.455 6.297 4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -5.139 6.173 5.742 1.00 0.00 H new ATOM 883 N LYS A 60 -3.936 3.467 5.761 1.00 0.00 N ATOM 884 CA LYS A 60 -2.954 2.445 6.115 1.00 0.00 C ATOM 885 C LYS A 60 -2.354 1.860 4.847 1.00 0.00 C ATOM 886 O LYS A 60 -1.144 1.684 4.786 1.00 0.00 O ATOM 887 CB LYS A 60 -3.607 1.331 6.953 1.00 0.00 C ATOM 888 CG LYS A 60 -4.229 1.860 8.250 1.00 0.00 C ATOM 889 CD LYS A 60 -5.118 0.838 8.939 1.00 0.00 C ATOM 890 CE LYS A 60 -4.480 -0.477 9.312 1.00 0.00 C ATOM 891 NZ LYS A 60 -4.456 -0.760 10.763 1.00 0.00 N ATOM 0 H LYS A 60 -4.897 3.154 5.895 1.00 0.00 H new ATOM 0 HA LYS A 60 -2.166 2.904 6.712 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -4.377 0.838 6.359 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.859 0.576 7.194 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -3.434 2.161 8.932 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -4.814 2.753 8.029 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -5.517 1.292 9.846 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -5.966 0.631 8.287 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -5.015 -1.281 8.807 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -3.457 -0.489 8.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -4.293 -1.776 10.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -3.691 -0.215 11.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -5.367 -0.488 11.185 1.00 0.00 H new ATOM 905 N ILE A 61 -3.171 1.570 3.829 1.00 0.00 N ATOM 906 CA ILE A 61 -2.691 1.087 2.539 1.00 0.00 C ATOM 907 C ILE A 61 -1.742 2.130 1.949 1.00 0.00 C ATOM 908 O ILE A 61 -0.730 1.748 1.365 1.00 0.00 O ATOM 909 CB ILE A 61 -3.847 0.732 1.579 1.00 0.00 C ATOM 910 CG1 ILE A 61 -4.710 -0.410 2.156 1.00 0.00 C ATOM 911 CG2 ILE A 61 -3.314 0.293 0.200 1.00 0.00 C ATOM 912 CD1 ILE A 61 -5.927 -0.724 1.282 1.00 0.00 C ATOM 0 H ILE A 61 -4.185 1.665 3.881 1.00 0.00 H new ATOM 0 HA ILE A 61 -2.147 0.154 2.686 1.00 0.00 H new ATOM 0 HB ILE A 61 -4.452 1.631 1.464 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.099 -1.307 2.258 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.046 -0.137 3.157 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.152 0.050 -0.453 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.734 1.104 -0.241 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.679 -0.585 0.318 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.500 -1.534 1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -6.555 0.163 1.201 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.594 -1.025 0.289 1.00 0.00 H new ATOM 924 N GLU A 62 -2.001 3.430 2.128 1.00 0.00 N ATOM 925 CA GLU A 62 -1.060 4.420 1.622 1.00 0.00 C ATOM 926 C GLU A 62 0.318 4.207 2.259 1.00 0.00 C ATOM 927 O GLU A 62 1.314 4.149 1.545 1.00 0.00 O ATOM 928 CB GLU A 62 -1.497 5.888 1.830 1.00 0.00 C ATOM 929 CG GLU A 62 -2.891 6.270 1.315 1.00 0.00 C ATOM 930 CD GLU A 62 -3.080 7.776 1.115 1.00 0.00 C ATOM 931 OE1 GLU A 62 -2.673 8.576 1.988 1.00 0.00 O ATOM 932 OE2 GLU A 62 -3.667 8.179 0.079 1.00 0.00 O ATOM 0 H GLU A 62 -2.823 3.806 2.601 1.00 0.00 H new ATOM 0 HA GLU A 62 -1.024 4.263 0.544 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.456 6.108 2.897 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.766 6.533 1.343 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.071 5.761 0.368 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.641 5.909 2.019 1.00 0.00 H new ATOM 939 N ARG A 63 0.397 4.011 3.583 1.00 0.00 N ATOM 940 CA ARG A 63 1.664 3.687 4.252 1.00 0.00 C ATOM 941 C ARG A 63 2.195 2.304 3.873 1.00 0.00 C ATOM 942 O ARG A 63 3.401 2.067 3.989 1.00 0.00 O ATOM 943 CB ARG A 63 1.525 3.793 5.783 1.00 0.00 C ATOM 944 CG ARG A 63 1.260 5.241 6.209 1.00 0.00 C ATOM 945 CD ARG A 63 1.616 5.500 7.683 1.00 0.00 C ATOM 946 NE ARG A 63 1.552 6.936 8.004 1.00 0.00 N ATOM 947 CZ ARG A 63 1.193 7.501 9.165 1.00 0.00 C ATOM 948 NH1 ARG A 63 0.854 6.766 10.220 1.00 0.00 N ATOM 949 NH2 ARG A 63 1.193 8.819 9.285 1.00 0.00 N ATOM 0 H ARG A 63 -0.404 4.071 4.212 1.00 0.00 H new ATOM 0 HA ARG A 63 2.389 4.423 3.905 1.00 0.00 H new ATOM 0 HB2 ARG A 63 0.710 3.155 6.123 1.00 0.00 H new ATOM 0 HB3 ARG A 63 2.435 3.430 6.261 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.839 5.914 5.576 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.208 5.477 6.047 1.00 0.00 H new ATOM 0 HD2 ARG A 63 0.930 4.950 8.327 1.00 0.00 H new ATOM 0 HD3 ARG A 63 2.618 5.123 7.889 1.00 0.00 H new ATOM 0 HE ARG A 63 1.812 7.576 7.254 1.00 0.00 H new ATOM 0 HH11 ARG A 63 0.864 5.748 10.157 1.00 0.00 H new ATOM 0 HH12 ARG A 63 0.584 7.220 11.093 1.00 0.00 H new ATOM 0 HH21 ARG A 63 1.466 9.403 8.495 1.00 0.00 H new ATOM 0 HH22 ARG A 63 0.920 9.251 10.168 1.00 0.00 H new ATOM 963 N ALA A 64 1.333 1.397 3.428 1.00 0.00 N ATOM 964 CA ALA A 64 1.683 0.039 3.060 1.00 0.00 C ATOM 965 C ALA A 64 2.556 -0.005 1.801 1.00 0.00 C ATOM 966 O ALA A 64 3.462 -0.836 1.742 1.00 0.00 O ATOM 967 CB ALA A 64 0.408 -0.787 2.866 1.00 0.00 C ATOM 0 H ALA A 64 0.340 1.598 3.311 1.00 0.00 H new ATOM 0 HA ALA A 64 2.272 -0.391 3.870 1.00 0.00 H new ATOM 0 HB1 ALA A 64 0.674 -1.807 2.589 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.162 -0.800 3.795 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.197 -0.343 2.075 1.00 0.00 H new ATOM 973 N ILE A 65 2.318 0.867 0.813 1.00 0.00 N ATOM 974 CA ILE A 65 3.051 0.885 -0.465 1.00 0.00 C ATOM 975 C ILE A 65 3.793 2.210 -0.700 1.00 0.00 C ATOM 976 O ILE A 65 4.744 2.255 -1.483 1.00 0.00 O ATOM 977 CB ILE A 65 2.099 0.563 -1.632 1.00 0.00 C ATOM 978 CG1 ILE A 65 0.873 1.502 -1.710 1.00 0.00 C ATOM 979 CG2 ILE A 65 1.655 -0.897 -1.480 1.00 0.00 C ATOM 980 CD1 ILE A 65 0.129 1.416 -3.043 1.00 0.00 C ATOM 0 H ILE A 65 1.602 1.591 0.877 1.00 0.00 H new ATOM 0 HA ILE A 65 3.816 0.110 -0.413 1.00 0.00 H new ATOM 0 HB ILE A 65 2.637 0.720 -2.567 1.00 0.00 H new ATOM 0 HG12 ILE A 65 0.185 1.257 -0.901 1.00 0.00 H new ATOM 0 HG13 ILE A 65 1.200 2.529 -1.550 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.978 -1.158 -2.293 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.529 -1.548 -1.512 1.00 0.00 H new ATOM 0 HG23 ILE A 65 1.143 -1.024 -0.526 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -0.720 2.100 -3.031 1.00 0.00 H new ATOM 0 HD12 ILE A 65 0.804 1.689 -3.854 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.228 0.397 -3.195 1.00 0.00 H new ATOM 992 N GLY A 66 3.390 3.280 -0.017 1.00 0.00 N ATOM 993 CA GLY A 66 3.935 4.625 -0.153 1.00 0.00 C ATOM 994 C GLY A 66 3.415 5.365 -1.375 1.00 0.00 C ATOM 995 O GLY A 66 4.121 6.234 -1.887 1.00 0.00 O ATOM 0 H GLY A 66 2.643 3.229 0.675 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.693 5.200 0.741 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.022 4.565 -0.209 1.00 0.00 H new ATOM 999 N LEU A 67 2.193 5.068 -1.821 1.00 0.00 N ATOM 1000 CA LEU A 67 1.496 5.836 -2.846 1.00 0.00 C ATOM 1001 C LEU A 67 0.140 6.270 -2.291 1.00 0.00 C ATOM 1002 O LEU A 67 -0.296 5.764 -1.258 1.00 0.00 O ATOM 1003 CB LEU A 67 1.313 5.032 -4.147 1.00 0.00 C ATOM 1004 CG LEU A 67 2.585 4.474 -4.817 1.00 0.00 C ATOM 1005 CD1 LEU A 67 2.153 3.679 -6.053 1.00 0.00 C ATOM 1006 CD2 LEU A 67 3.621 5.532 -5.236 1.00 0.00 C ATOM 0 H LEU A 67 1.655 4.275 -1.473 1.00 0.00 H new ATOM 0 HA LEU A 67 2.099 6.708 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.648 4.195 -3.936 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.803 5.670 -4.869 1.00 0.00 H new ATOM 0 HG LEU A 67 3.087 3.860 -4.070 1.00 0.00 H new ATOM 0 HD11 LEU A 67 3.034 3.271 -6.549 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.497 2.863 -5.750 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.621 4.336 -6.741 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.478 5.040 -5.697 1.00 0.00 H new ATOM 0 HD22 LEU A 67 3.170 6.220 -5.951 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.951 6.086 -4.357 1.00 0.00 H new ATOM 1018 N LYS A 68 -0.517 7.212 -2.966 1.00 0.00 N ATOM 1019 CA LYS A 68 -1.851 7.696 -2.652 1.00 0.00 C ATOM 1020 C LYS A 68 -2.880 6.664 -3.065 1.00 0.00 C ATOM 1021 O LYS A 68 -2.748 6.075 -4.140 1.00 0.00 O ATOM 1022 CB LYS A 68 -2.138 8.987 -3.425 1.00 0.00 C ATOM 1023 CG LYS A 68 -1.465 10.191 -2.770 1.00 0.00 C ATOM 1024 CD LYS A 68 -1.935 11.480 -3.450 1.00 0.00 C ATOM 1025 CE LYS A 68 -1.601 12.670 -2.561 1.00 0.00 C ATOM 1026 NZ LYS A 68 -2.688 12.943 -1.599 1.00 0.00 N ATOM 0 H LYS A 68 -0.113 7.675 -3.780 1.00 0.00 H new ATOM 0 HA LYS A 68 -1.906 7.881 -1.579 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -1.785 8.885 -4.451 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.214 9.152 -3.474 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -1.706 10.221 -1.707 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -0.382 10.101 -2.849 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -1.451 11.590 -4.421 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -3.009 11.438 -3.632 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.675 12.474 -2.021 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.429 13.551 -3.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -2.431 13.759 -1.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -3.565 13.153 -2.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -2.834 12.109 -0.994 1.00 0.00 H new ATOM 1040 N LEU A 69 -3.941 6.531 -2.267 1.00 0.00 N ATOM 1041 CA LEU A 69 -5.083 5.650 -2.510 1.00 0.00 C ATOM 1042 C LEU A 69 -6.387 6.466 -2.568 1.00 0.00 C ATOM 1043 O LEU A 69 -7.470 5.876 -2.574 1.00 0.00 O ATOM 1044 CB LEU A 69 -5.153 4.541 -1.439 1.00 0.00 C ATOM 1045 CG LEU A 69 -4.172 3.360 -1.573 1.00 0.00 C ATOM 1046 CD1 LEU A 69 -4.565 2.396 -2.684 1.00 0.00 C ATOM 1047 CD2 LEU A 69 -2.699 3.679 -1.804 1.00 0.00 C ATOM 0 H LEU A 69 -4.031 7.057 -1.398 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.952 5.164 -3.477 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.992 5.003 -0.465 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.166 4.138 -1.437 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.262 2.930 -0.575 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.840 1.584 -2.734 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.554 1.987 -2.478 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -4.582 2.926 -3.636 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.133 2.750 -1.878 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.590 4.245 -2.729 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.320 4.270 -0.970 1.00 0.00 H new ATOM 1059 N ARG A 70 -6.324 7.806 -2.599 1.00 0.00 N ATOM 1060 CA ARG A 70 -7.489 8.680 -2.746 1.00 0.00 C ATOM 1061 C ARG A 70 -7.195 9.823 -3.713 1.00 0.00 C ATOM 1062 O ARG A 70 -6.035 10.175 -3.935 1.00 0.00 O ATOM 1063 CB ARG A 70 -7.936 9.236 -1.381 1.00 0.00 C ATOM 1064 CG ARG A 70 -8.955 8.324 -0.684 1.00 0.00 C ATOM 1065 CD ARG A 70 -9.592 9.074 0.494 1.00 0.00 C ATOM 1066 NE ARG A 70 -10.853 8.470 0.956 1.00 0.00 N ATOM 1067 CZ ARG A 70 -12.078 8.794 0.512 1.00 0.00 C ATOM 1068 NH1 ARG A 70 -12.254 9.473 -0.620 1.00 0.00 N ATOM 1069 NH2 ARG A 70 -13.137 8.443 1.225 1.00 0.00 N ATOM 0 H ARG A 70 -5.445 8.318 -2.521 1.00 0.00 H new ATOM 0 HA ARG A 70 -8.303 8.082 -3.157 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -7.064 9.360 -0.739 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -8.373 10.225 -1.520 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -9.725 8.014 -1.391 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -8.465 7.417 -0.329 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -8.885 9.101 1.323 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -9.778 10.107 0.200 1.00 0.00 H new ATOM 0 HE ARG A 70 -10.791 7.746 1.672 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -11.447 9.760 -1.173 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -13.196 9.706 -0.934 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -13.016 7.933 2.100 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -14.073 8.683 0.899 1.00 0.00 H new ATOM 1083 N GLY A 71 -8.265 10.462 -4.188 1.00 0.00 N ATOM 1084 CA GLY A 71 -8.244 11.494 -5.207 1.00 0.00 C ATOM 1085 C GLY A 71 -8.104 10.881 -6.596 1.00 0.00 C ATOM 1086 O GLY A 71 -7.967 9.667 -6.751 1.00 0.00 O ATOM 0 H GLY A 71 -9.207 10.260 -3.854 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -9.161 12.082 -5.155 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.416 12.178 -5.021 1.00 0.00 H new ATOM 1090 N LYS A 72 -8.114 11.724 -7.632 1.00 0.00 N ATOM 1091 CA LYS A 72 -7.628 11.298 -8.947 1.00 0.00 C ATOM 1092 C LYS A 72 -6.113 11.104 -8.927 1.00 0.00 C ATOM 1093 O LYS A 72 -5.608 10.353 -9.755 1.00 0.00 O ATOM 1094 CB LYS A 72 -8.041 12.286 -10.044 1.00 0.00 C ATOM 1095 CG LYS A 72 -9.549 12.230 -10.325 1.00 0.00 C ATOM 1096 CD LYS A 72 -9.892 13.007 -11.600 1.00 0.00 C ATOM 1097 CE LYS A 72 -11.394 12.931 -11.876 1.00 0.00 C ATOM 1098 NZ LYS A 72 -11.760 13.632 -13.122 1.00 0.00 N ATOM 0 H LYS A 72 -8.446 12.687 -7.589 1.00 0.00 H new ATOM 0 HA LYS A 72 -8.092 10.339 -9.178 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.765 13.297 -9.745 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.492 12.063 -10.959 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.866 11.192 -10.429 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -10.097 12.647 -9.480 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -9.587 14.048 -11.494 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -9.338 12.597 -12.445 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -11.698 11.887 -11.944 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -11.940 13.368 -11.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -12.786 13.558 -13.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -11.493 14.634 -13.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -11.259 13.199 -13.924 1.00 0.00 H new ATOM 1112 N ASP A 73 -5.422 11.721 -7.962 1.00 0.00 N ATOM 1113 CA ASP A 73 -3.974 11.720 -7.725 1.00 0.00 C ATOM 1114 C ASP A 73 -3.488 10.348 -7.230 1.00 0.00 C ATOM 1115 O ASP A 73 -2.416 10.264 -6.632 1.00 0.00 O ATOM 1116 CB ASP A 73 -3.553 12.787 -6.670 1.00 0.00 C ATOM 1117 CG ASP A 73 -4.175 14.189 -6.745 1.00 0.00 C ATOM 1118 OD1 ASP A 73 -5.292 14.367 -7.290 1.00 0.00 O ATOM 1119 OD2 ASP A 73 -3.621 15.129 -6.129 1.00 0.00 O ATOM 0 H ASP A 73 -5.906 12.285 -7.264 1.00 0.00 H new ATOM 0 HA ASP A 73 -3.515 11.957 -8.685 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -3.774 12.380 -5.683 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -2.471 12.903 -6.732 1.00 0.00 H new ATOM 1124 N ILE A 74 -4.284 9.285 -7.372 1.00 0.00 N ATOM 1125 CA ILE A 74 -3.919 7.949 -6.954 1.00 0.00 C ATOM 1126 C ILE A 74 -2.615 7.539 -7.647 1.00 0.00 C ATOM 1127 O ILE A 74 -2.314 8.001 -8.752 1.00 0.00 O ATOM 1128 CB ILE A 74 -5.116 7.016 -7.241 1.00 0.00 C ATOM 1129 CG1 ILE A 74 -5.203 5.977 -6.121 1.00 0.00 C ATOM 1130 CG2 ILE A 74 -5.196 6.533 -8.697 1.00 0.00 C ATOM 1131 CD1 ILE A 74 -6.379 5.014 -6.234 1.00 0.00 C ATOM 0 H ILE A 74 -5.213 9.340 -7.789 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.716 7.889 -5.885 1.00 0.00 H new ATOM 0 HB ILE A 74 -6.056 7.566 -7.199 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -4.279 5.400 -6.107 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -5.268 6.498 -5.166 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.063 5.883 -8.818 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.292 7.392 -9.361 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -4.290 5.980 -8.947 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -6.359 4.315 -5.398 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.313 5.576 -6.215 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -6.308 4.461 -7.171 1.00 0.00 H new ATOM 1143 N GLY A 75 -1.825 6.681 -7.006 1.00 0.00 N ATOM 1144 CA GLY A 75 -0.569 6.217 -7.581 1.00 0.00 C ATOM 1145 C GLY A 75 0.537 7.279 -7.611 1.00 0.00 C ATOM 1146 O GLY A 75 1.691 6.921 -7.859 1.00 0.00 O ATOM 0 H GLY A 75 -2.035 6.293 -6.086 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.217 5.357 -7.011 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -0.753 5.871 -8.598 1.00 0.00 H new ATOM 1150 N LYS A 76 0.261 8.546 -7.267 1.00 0.00 N ATOM 1151 CA LYS A 76 1.298 9.473 -6.841 1.00 0.00 C ATOM 1152 C LYS A 76 1.926 8.895 -5.579 1.00 0.00 C ATOM 1153 O LYS A 76 1.224 8.255 -4.801 1.00 0.00 O ATOM 1154 CB LYS A 76 0.700 10.826 -6.445 1.00 0.00 C ATOM 1155 CG LYS A 76 0.251 11.725 -7.597 1.00 0.00 C ATOM 1156 CD LYS A 76 1.399 12.395 -8.358 1.00 0.00 C ATOM 1157 CE LYS A 76 2.294 13.228 -7.430 1.00 0.00 C ATOM 1158 NZ LYS A 76 3.495 13.744 -8.106 1.00 0.00 N ATOM 0 H LYS A 76 -0.678 8.945 -7.279 1.00 0.00 H new ATOM 0 HA LYS A 76 2.008 9.610 -7.657 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.157 10.646 -5.796 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.439 11.368 -5.854 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -0.336 11.132 -8.298 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -0.408 12.498 -7.203 1.00 0.00 H new ATOM 0 HD2 LYS A 76 2.000 11.632 -8.853 1.00 0.00 H new ATOM 0 HD3 LYS A 76 0.991 13.036 -9.140 1.00 0.00 H new ATOM 0 HE2 LYS A 76 1.719 14.064 -7.033 1.00 0.00 H new ATOM 0 HE3 LYS A 76 2.596 12.617 -6.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 4.061 14.298 -7.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 4.062 12.948 -8.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 3.212 14.351 -8.902 1.00 0.00 H new ATOM 1172 N PRO A 77 3.206 9.152 -5.322 1.00 0.00 N ATOM 1173 CA PRO A 77 3.839 8.831 -4.063 1.00 0.00 C ATOM 1174 C PRO A 77 3.271 9.700 -2.943 1.00 0.00 C ATOM 1175 O PRO A 77 2.792 10.811 -3.182 1.00 0.00 O ATOM 1176 CB PRO A 77 5.337 9.025 -4.295 1.00 0.00 C ATOM 1177 CG PRO A 77 5.441 9.909 -5.542 1.00 0.00 C ATOM 1178 CD PRO A 77 4.044 9.962 -6.157 1.00 0.00 C ATOM 0 HA PRO A 77 3.649 7.807 -3.740 1.00 0.00 H new ATOM 0 HB2 PRO A 77 5.810 9.500 -3.435 1.00 0.00 H new ATOM 0 HB3 PRO A 77 5.839 8.069 -4.447 1.00 0.00 H new ATOM 0 HG2 PRO A 77 5.787 10.909 -5.280 1.00 0.00 H new ATOM 0 HG3 PRO A 77 6.161 9.497 -6.250 1.00 0.00 H new ATOM 0 HD2 PRO A 77 3.676 10.987 -6.199 1.00 0.00 H new ATOM 0 HD3 PRO A 77 4.055 9.585 -7.180 1.00 0.00 H new ATOM 1186 N ILE A 78 3.355 9.189 -1.716 1.00 0.00 N ATOM 1187 CA ILE A 78 3.177 9.979 -0.510 1.00 0.00 C ATOM 1188 C ILE A 78 4.582 10.250 0.040 1.00 0.00 C ATOM 1189 O ILE A 78 5.436 9.360 0.000 1.00 0.00 O ATOM 1190 CB ILE A 78 2.280 9.255 0.525 1.00 0.00 C ATOM 1191 CG1 ILE A 78 2.770 7.873 1.004 1.00 0.00 C ATOM 1192 CG2 ILE A 78 0.869 9.079 -0.052 1.00 0.00 C ATOM 1193 CD1 ILE A 78 2.210 7.459 2.371 1.00 0.00 C ATOM 0 H ILE A 78 3.551 8.205 -1.535 1.00 0.00 H new ATOM 0 HA ILE A 78 2.662 10.914 -0.730 1.00 0.00 H new ATOM 0 HB ILE A 78 2.307 9.904 1.401 1.00 0.00 H new ATOM 0 HG12 ILE A 78 2.491 7.122 0.265 1.00 0.00 H new ATOM 0 HG13 ILE A 78 3.859 7.881 1.055 1.00 0.00 H new ATOM 0 HG21 ILE A 78 0.239 8.570 0.677 1.00 0.00 H new ATOM 0 HG22 ILE A 78 0.444 10.057 -0.279 1.00 0.00 H new ATOM 0 HG23 ILE A 78 0.921 8.485 -0.965 1.00 0.00 H new ATOM 0 HD11 ILE A 78 2.599 6.477 2.641 1.00 0.00 H new ATOM 0 HD12 ILE A 78 2.511 8.188 3.123 1.00 0.00 H new ATOM 0 HD13 ILE A 78 1.122 7.417 2.321 1.00 0.00 H new ATOM 1205 N GLU A 79 4.802 11.429 0.622 1.00 0.00 N ATOM 1206 CA GLU A 79 5.950 11.745 1.479 1.00 0.00 C ATOM 1207 C GLU A 79 7.304 11.391 0.848 1.00 0.00 C ATOM 1208 O GLU A 79 8.242 11.008 1.549 1.00 0.00 O ATOM 1209 CB GLU A 79 5.738 11.123 2.872 1.00 0.00 C ATOM 1210 CG GLU A 79 4.622 11.828 3.649 1.00 0.00 C ATOM 1211 CD GLU A 79 4.181 11.009 4.852 1.00 0.00 C ATOM 1212 OE1 GLU A 79 4.792 11.135 5.935 1.00 0.00 O ATOM 1213 OE2 GLU A 79 3.189 10.247 4.732 1.00 0.00 O ATOM 0 H GLU A 79 4.166 12.218 0.507 1.00 0.00 H new ATOM 0 HA GLU A 79 5.999 12.828 1.595 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.494 10.066 2.764 1.00 0.00 H new ATOM 0 HB3 GLU A 79 6.667 11.179 3.440 1.00 0.00 H new ATOM 0 HG2 GLU A 79 4.970 12.806 3.981 1.00 0.00 H new ATOM 0 HG3 GLU A 79 3.770 11.999 2.991 1.00 0.00 H new ATOM 1220 N LYS A 80 7.444 11.534 -0.471 1.00 0.00 N ATOM 1221 CA LYS A 80 8.698 11.313 -1.175 1.00 0.00 C ATOM 1222 C LYS A 80 9.120 12.639 -1.793 1.00 0.00 C ATOM 1223 O LYS A 80 9.134 12.815 -3.012 1.00 0.00 O ATOM 1224 CB LYS A 80 8.554 10.137 -2.153 1.00 0.00 C ATOM 1225 CG LYS A 80 9.942 9.599 -2.512 1.00 0.00 C ATOM 1226 CD LYS A 80 9.871 8.404 -3.464 1.00 0.00 C ATOM 1227 CE LYS A 80 11.281 7.827 -3.612 1.00 0.00 C ATOM 1228 NZ LYS A 80 11.368 6.824 -4.687 1.00 0.00 N ATOM 0 H LYS A 80 6.677 11.810 -1.084 1.00 0.00 H new ATOM 0 HA LYS A 80 9.506 11.007 -0.510 1.00 0.00 H new ATOM 0 HB2 LYS A 80 7.951 9.348 -1.703 1.00 0.00 H new ATOM 0 HB3 LYS A 80 8.034 10.461 -3.054 1.00 0.00 H new ATOM 0 HG2 LYS A 80 10.530 10.393 -2.972 1.00 0.00 H new ATOM 0 HG3 LYS A 80 10.462 9.305 -1.601 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.190 7.648 -3.075 1.00 0.00 H new ATOM 0 HD3 LYS A 80 9.483 8.713 -4.434 1.00 0.00 H new ATOM 0 HE2 LYS A 80 11.982 8.636 -3.816 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.585 7.372 -2.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 12.342 6.463 -4.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 10.720 6.037 -4.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 11.104 7.262 -5.593 1.00 0.00 H new ATOM 1242 N GLY A 81 9.456 13.597 -0.939 1.00 0.00 N ATOM 1243 CA GLY A 81 9.901 14.931 -1.307 1.00 0.00 C ATOM 1244 C GLY A 81 9.606 15.915 -0.174 1.00 0.00 C ATOM 1245 O GLY A 81 8.932 15.543 0.797 1.00 0.00 O ATOM 0 H GLY A 81 9.424 13.458 0.071 1.00 0.00 H new ATOM 0 HA2 GLY A 81 10.970 14.920 -1.521 1.00 0.00 H new ATOM 0 HA3 GLY A 81 9.397 15.252 -2.219 1.00 0.00 H new ATOM 1249 N PRO A 82 10.101 17.156 -0.267 1.00 0.00 N ATOM 1250 CA PRO A 82 9.905 18.185 0.745 1.00 0.00 C ATOM 1251 C PRO A 82 8.481 18.754 0.679 1.00 0.00 C ATOM 1252 O PRO A 82 8.194 19.657 -0.117 1.00 0.00 O ATOM 1253 CB PRO A 82 10.990 19.226 0.457 1.00 0.00 C ATOM 1254 CG PRO A 82 11.229 19.104 -1.044 1.00 0.00 C ATOM 1255 CD PRO A 82 11.010 17.619 -1.306 1.00 0.00 C ATOM 0 HA PRO A 82 9.998 17.807 1.763 1.00 0.00 H new ATOM 0 HB2 PRO A 82 10.663 20.229 0.729 1.00 0.00 H new ATOM 0 HB3 PRO A 82 11.899 19.023 1.024 1.00 0.00 H new ATOM 0 HG2 PRO A 82 10.535 19.721 -1.615 1.00 0.00 H new ATOM 0 HG3 PRO A 82 12.236 19.418 -1.319 1.00 0.00 H new ATOM 0 HD2 PRO A 82 10.585 17.456 -2.297 1.00 0.00 H new ATOM 0 HD3 PRO A 82 11.953 17.074 -1.270 1.00 0.00 H new ATOM 1263 N ARG A 83 7.556 18.227 1.489 1.00 0.00 N ATOM 1264 CA ARG A 83 6.234 18.825 1.657 1.00 0.00 C ATOM 1265 C ARG A 83 5.604 18.334 2.956 1.00 0.00 C ATOM 1266 O ARG A 83 5.629 17.129 3.219 1.00 0.00 O ATOM 1267 CB ARG A 83 5.323 18.434 0.472 1.00 0.00 C ATOM 1268 CG ARG A 83 4.178 19.441 0.278 1.00 0.00 C ATOM 1269 CD ARG A 83 2.923 18.818 -0.340 1.00 0.00 C ATOM 1270 NE ARG A 83 3.171 18.095 -1.597 1.00 0.00 N ATOM 1271 CZ ARG A 83 2.363 17.184 -2.155 1.00 0.00 C ATOM 1272 NH1 ARG A 83 1.161 16.937 -1.646 1.00 0.00 N ATOM 1273 NH2 ARG A 83 2.747 16.524 -3.232 1.00 0.00 N ATOM 0 H ARG A 83 7.704 17.382 2.040 1.00 0.00 H new ATOM 0 HA ARG A 83 6.342 19.909 1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 83 5.917 18.378 -0.440 1.00 0.00 H new ATOM 0 HB3 ARG A 83 4.909 17.441 0.644 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.921 19.879 1.243 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.523 20.255 -0.360 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.478 18.132 0.380 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.192 19.605 -0.524 1.00 0.00 H new ATOM 0 HE ARG A 83 4.039 18.307 -2.089 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.843 17.444 -0.820 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.556 16.241 -2.081 1.00 0.00 H new ATOM 0 HH21 ARG A 83 3.663 16.707 -3.643 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.128 15.831 -3.653 1.00 0.00 H new ATOM 1287 N ALA A 84 4.897 19.211 3.662 1.00 0.00 N ATOM 1288 CA ALA A 84 3.758 18.868 4.500 1.00 0.00 C ATOM 1289 C ALA A 84 2.724 19.969 4.298 1.00 0.00 C ATOM 1290 O ALA A 84 3.092 21.142 4.261 1.00 0.00 O ATOM 1291 CB ALA A 84 4.169 18.780 5.969 1.00 0.00 C ATOM 0 H ALA A 84 5.109 20.209 3.665 1.00 0.00 H new ATOM 0 HA ALA A 84 3.354 17.893 4.226 1.00 0.00 H new ATOM 0 HB1 ALA A 84 3.300 18.522 6.575 1.00 0.00 H new ATOM 0 HB2 ALA A 84 4.934 18.013 6.087 1.00 0.00 H new ATOM 0 HB3 ALA A 84 4.566 19.742 6.294 1.00 0.00 H new ATOM 1297 N LYS A 85 1.450 19.615 4.122 1.00 0.00 N ATOM 1298 CA LYS A 85 0.377 20.609 4.094 1.00 0.00 C ATOM 1299 C LYS A 85 0.094 21.135 5.498 1.00 0.00 C ATOM 1300 O LYS A 85 0.538 20.549 6.487 1.00 0.00 O ATOM 1301 CB LYS A 85 -0.907 20.027 3.485 1.00 0.00 C ATOM 1302 CG LYS A 85 -1.440 18.753 4.167 1.00 0.00 C ATOM 1303 CD LYS A 85 -2.942 18.549 3.937 1.00 0.00 C ATOM 1304 CE LYS A 85 -3.395 18.822 2.497 1.00 0.00 C ATOM 1305 NZ LYS A 85 -4.860 18.737 2.369 1.00 0.00 N ATOM 0 H LYS A 85 1.137 18.652 3.997 1.00 0.00 H new ATOM 0 HA LYS A 85 0.710 21.435 3.466 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.684 20.790 3.520 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.723 19.807 2.433 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -0.897 17.887 3.788 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -1.244 18.809 5.238 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -3.204 17.524 4.201 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -3.495 19.203 4.611 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -3.058 19.812 2.190 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -2.927 18.103 1.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -5.134 18.927 1.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -5.177 17.784 2.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -5.304 19.440 2.993 1.00 0.00 H new ATOM 1319 N SER A 86 -0.764 22.146 5.568 1.00 0.00 N ATOM 1320 CA SER A 86 -1.498 22.518 6.767 1.00 0.00 C ATOM 1321 C SER A 86 -3.002 22.453 6.457 1.00 0.00 C ATOM 1322 O SER A 86 -3.411 22.185 5.318 1.00 0.00 O ATOM 1323 CB SER A 86 -1.045 23.909 7.236 1.00 0.00 C ATOM 1324 OG SER A 86 0.371 23.986 7.303 1.00 0.00 O ATOM 0 H SER A 86 -0.973 22.745 4.769 1.00 0.00 H new ATOM 0 HA SER A 86 -1.295 21.828 7.586 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.422 24.669 6.551 1.00 0.00 H new ATOM 0 HB3 SER A 86 -1.471 24.123 8.216 1.00 0.00 H new ATOM 0 HG SER A 86 0.636 24.881 7.602 1.00 0.00 H new ATOM 1330 N GLY A 87 -3.838 22.695 7.458 1.00 0.00 N ATOM 1331 CA GLY A 87 -5.286 22.667 7.351 1.00 0.00 C ATOM 1332 C GLY A 87 -5.855 22.584 8.756 1.00 0.00 C ATOM 1333 O GLY A 87 -6.183 23.632 9.316 1.00 0.00 O ATOM 0 H GLY A 87 -3.513 22.924 8.397 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -5.649 23.561 6.844 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -5.608 21.812 6.757 1.00 0.00 H new ATOM 1337 N PRO A 88 -5.917 21.386 9.358 1.00 0.00 N ATOM 1338 CA PRO A 88 -6.325 21.230 10.740 1.00 0.00 C ATOM 1339 C PRO A 88 -5.220 21.803 11.634 1.00 0.00 C ATOM 1340 O PRO A 88 -4.205 21.147 11.864 1.00 0.00 O ATOM 1341 CB PRO A 88 -6.550 19.726 10.925 1.00 0.00 C ATOM 1342 CG PRO A 88 -5.609 19.073 9.912 1.00 0.00 C ATOM 1343 CD PRO A 88 -5.474 20.111 8.798 1.00 0.00 C ATOM 0 HA PRO A 88 -7.238 21.763 11.006 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -6.318 19.412 11.943 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -7.588 19.453 10.736 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -4.642 18.841 10.359 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -6.019 18.136 9.535 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.442 20.177 8.453 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -6.081 19.835 7.936 1.00 0.00 H new ATOM 1351 N SER A 89 -5.371 23.045 12.093 1.00 0.00 N ATOM 1352 CA SER A 89 -4.466 23.639 13.064 1.00 0.00 C ATOM 1353 C SER A 89 -4.537 22.802 14.338 1.00 0.00 C ATOM 1354 O SER A 89 -5.548 22.845 15.040 1.00 0.00 O ATOM 1355 CB SER A 89 -4.861 25.092 13.334 1.00 0.00 C ATOM 1356 OG SER A 89 -4.818 25.840 12.133 1.00 0.00 O ATOM 0 H SER A 89 -6.126 23.664 11.799 1.00 0.00 H new ATOM 0 HA SER A 89 -3.444 23.647 12.685 1.00 0.00 H new ATOM 0 HB2 SER A 89 -5.864 25.131 13.760 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.185 25.530 14.069 1.00 0.00 H new ATOM 0 HG SER A 89 -5.074 26.768 12.316 1.00 0.00 H new ATOM 1362 N SER A 90 -3.477 22.046 14.628 1.00 0.00 N ATOM 1363 CA SER A 90 -3.432 21.016 15.657 1.00 0.00 C ATOM 1364 C SER A 90 -4.403 19.860 15.372 1.00 0.00 C ATOM 1365 O SER A 90 -5.264 19.910 14.486 1.00 0.00 O ATOM 1366 CB SER A 90 -3.664 21.644 17.048 1.00 0.00 C ATOM 1367 OG SER A 90 -2.467 21.691 17.798 1.00 0.00 O ATOM 0 H SER A 90 -2.592 22.142 14.130 1.00 0.00 H new ATOM 0 HA SER A 90 -2.436 20.573 15.646 1.00 0.00 H new ATOM 0 HB2 SER A 90 -4.062 22.652 16.932 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.412 21.066 17.590 1.00 0.00 H new ATOM 0 HG SER A 90 -2.645 22.095 18.673 1.00 0.00 H new ATOM 1373 N GLY A 91 -4.256 18.804 16.165 1.00 0.00 N ATOM 1374 CA GLY A 91 -5.177 17.694 16.290 1.00 0.00 C ATOM 1375 C GLY A 91 -5.478 17.546 17.765 1.00 0.00 C ATOM 1376 O GLY A 91 -4.628 17.954 18.593 1.00 0.00 O ATOM 0 H GLY A 91 -3.442 18.700 16.770 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -6.090 17.883 15.725 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -4.738 16.780 15.890 1.00 0.00 H new TER 1380 GLY A 91