USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 839 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 97 THR OG1 : rot 62:sc= 1.63 USER MOD Set 1.2: A 112 LYS NZ :NH3+ -166:sc= 0.45 (180deg=0) USER MOD Set 2.1: A 73 TYR OH : rot 166:sc= 1.01 USER MOD Set 2.2: A 83 THR OG1 : rot -141:sc= 1.38 USER MOD Set 3.1: A 60 LYS NZ :NH3+ 151:sc= 2.36 (180deg=1.15) USER MOD Set 3.2: A 74 ASN : amide:sc= 1.6 K(o=4.5,f=-2.6) USER MOD Set 3.3: A 89 SER OG : rot 180:sc= 0.562 USER MOD Set 4.1: A 57 ASN : amide:sc= 0.739 K(o=3.3,f=2.1) USER MOD Set 4.2: A 72 GLN : amide:sc= 1.09 K(o=3.3,f=2.1) USER MOD Set 4.3: A 87 SER OG : rot 102:sc= 1.48 USER MOD Set 5.1: A 42 GLN : amide:sc= 0.19 X(o=0.31,f=-0.16) USER MOD Set 5.2: A 44 SER OG : rot 180:sc= 0.119 USER MOD Set 6.1: A 43 TYR OH : rot -15:sc= 0.369 USER MOD Set 6.2: A 53 THR OG1 : rot 154:sc= 0.362 USER MOD Set 7.1: A 35 THR OG1 : rot -178:sc= 0.247 USER MOD Set 7.2: A 50 LYS NZ :NH3+ -159:sc= 0.415 (180deg=0.249) USER MOD Set 8.1: A 16 GLN : amide:sc= 1.06 K(o=2.5,f=0.5) USER MOD Set 8.2: A 31 GLN : amide:sc= 1.4 K(o=2.5,f=-0.98) USER MOD Set 9.1: A 14 ASN : amide:sc= 1.09 K(o=3,f=0.65) USER MOD Set 9.2: A 29 ASN : amide:sc= 1.94 K(o=3,f=-0.54) USER MOD Set10.1: A 12 THR OG1 : rot 120:sc= 1.32 USER MOD Set10.2: A 15 SER OG : rot 101:sc= 1.78 USER MOD Set11.1: A 10 GLN : amide:sc= 0.23 K(o=0.4,f=-2.1) USER MOD Set11.2: A 26 TYR OH : rot 180:sc= 0.166 USER MOD Set12.1: A 7 THR OG1 : rot 142:sc= 1.14 USER MOD Set12.2: A 23 THR OG1 : rot 180:sc= 0.98 USER MOD Single : A 1 ASP N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0162 USER MOD Single : A 6 ASN : amide:sc= 0.547 K(o=0.55,f=-9.6!) USER MOD Single : A 8 ASN : amide:sc= -0.0195 X(o=-0.02,f=-0.33) USER MOD Single : A 9 SER OG : rot 80:sc= 0.591 USER MOD Single : A 19 LYS NZ :NH3+ 160:sc= 1.29 (180deg=1.04) USER MOD Single : A 20 SER OG : rot 76:sc= 1.28 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.215 K(o=-0.22,f=-1.1) USER MOD Single : A 30 SER OG : rot 72:sc= 1.96 USER MOD Single : A 36 SER OG : rot 69:sc= 1.33 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 67:sc= 1.91 USER MOD Single : A 47 ASN : amide:sc= -0.0763 K(o=-0.076,f=-1.4!) USER MOD Single : A 49 LYS NZ :NH3+ -161:sc= 1.25 (180deg=0.81) USER MOD Single : A 51 SER OG : rot 73:sc= 1.73 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 67:sc= 1.7 USER MOD Single : A 62 GLN : amide:sc= -0.494 X(o=-0.49,f=-0.41) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 67:sc= 1.34 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 66:sc= 1.41 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -107:sc= 0.896 USER MOD Single : A 81 SER OG : rot 71:sc= 1.79 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot -110:sc= 0.736 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 78:sc= 1.19 USER MOD Single : A 114 SER OG : rot 8:sc= 0.715 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= -0.0815 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 0.220 -3.483 1.932 1.00 0.00 N ATOM 2 CA ASP A 1 0.951 -4.218 0.875 1.00 0.00 C ATOM 3 C ASP A 1 2.126 -3.386 0.356 1.00 0.00 C ATOM 4 O ASP A 1 1.965 -2.196 0.072 1.00 0.00 O ATOM 5 CB ASP A 1 0.023 -4.602 -0.286 1.00 0.00 C ATOM 6 CG ASP A 1 0.820 -5.294 -1.398 1.00 0.00 C ATOM 7 OD1 ASP A 1 1.382 -6.383 -1.148 1.00 0.00 O ATOM 8 OD2 ASP A 1 0.886 -4.759 -2.527 1.00 0.00 O ATOM 0 H1 ASP A 1 -0.574 -4.063 2.272 1.00 0.00 H new ATOM 0 H2 ASP A 1 0.864 -3.280 2.723 1.00 0.00 H new ATOM 0 H3 ASP A 1 -0.145 -2.590 1.545 1.00 0.00 H new ATOM 0 HA ASP A 1 1.335 -5.137 1.319 1.00 0.00 H new ATOM 0 HB2 ASP A 1 -0.764 -5.265 0.073 1.00 0.00 H new ATOM 0 HB3 ASP A 1 -0.466 -3.711 -0.680 1.00 0.00 H new ATOM 15 N GLY A 2 3.309 -3.992 0.227 1.00 0.00 N ATOM 16 CA GLY A 2 4.497 -3.351 -0.321 1.00 0.00 C ATOM 17 C GLY A 2 5.595 -4.386 -0.546 1.00 0.00 C ATOM 18 O GLY A 2 5.530 -5.499 -0.013 1.00 0.00 O ATOM 0 H GLY A 2 3.466 -4.960 0.507 1.00 0.00 H new ATOM 0 HA2 GLY A 2 4.252 -2.858 -1.262 1.00 0.00 H new ATOM 0 HA3 GLY A 2 4.850 -2.578 0.361 1.00 0.00 H new ATOM 22 N THR A 3 6.604 -4.023 -1.330 1.00 0.00 N ATOM 23 CA THR A 3 7.626 -4.935 -1.826 1.00 0.00 C ATOM 24 C THR A 3 8.878 -4.880 -0.933 1.00 0.00 C ATOM 25 O THR A 3 8.851 -4.350 0.181 1.00 0.00 O ATOM 26 CB THR A 3 7.913 -4.555 -3.296 1.00 0.00 C ATOM 27 OG1 THR A 3 8.340 -3.206 -3.361 1.00 0.00 O ATOM 28 CG2 THR A 3 6.680 -4.727 -4.192 1.00 0.00 C ATOM 0 H THR A 3 6.736 -3.062 -1.646 1.00 0.00 H new ATOM 0 HA THR A 3 7.286 -5.970 -1.791 1.00 0.00 H new ATOM 0 HB THR A 3 8.691 -5.227 -3.659 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.524 -2.966 -4.293 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.932 -4.448 -5.215 1.00 0.00 H new ATOM 0 HG22 THR A 3 6.356 -5.767 -4.169 1.00 0.00 H new ATOM 0 HG23 THR A 3 5.875 -4.088 -3.829 1.00 0.00 H new ATOM 36 N CYS A 4 9.986 -5.438 -1.429 1.00 0.00 N ATOM 37 CA CYS A 4 11.310 -5.302 -0.838 1.00 0.00 C ATOM 38 C CYS A 4 11.904 -3.895 -0.990 1.00 0.00 C ATOM 39 O CYS A 4 12.926 -3.634 -0.355 1.00 0.00 O ATOM 40 CB CYS A 4 12.259 -6.268 -1.558 1.00 0.00 C ATOM 41 SG CYS A 4 11.866 -8.018 -1.357 1.00 0.00 S ATOM 0 H CYS A 4 9.981 -6.010 -2.274 1.00 0.00 H new ATOM 0 HA CYS A 4 11.204 -5.513 0.226 1.00 0.00 H new ATOM 0 HB2 CYS A 4 12.256 -6.031 -2.622 1.00 0.00 H new ATOM 0 HB3 CYS A 4 13.272 -6.095 -1.196 1.00 0.00 H new ATOM 46 N VAL A 5 11.319 -3.046 -1.858 1.00 0.00 N ATOM 47 CA VAL A 5 11.854 -1.756 -2.314 1.00 0.00 C ATOM 48 C VAL A 5 13.389 -1.849 -2.408 1.00 0.00 C ATOM 49 O VAL A 5 14.146 -1.183 -1.696 1.00 0.00 O ATOM 50 CB VAL A 5 11.279 -0.574 -1.493 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.590 0.775 -2.166 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.747 -0.660 -1.346 1.00 0.00 C ATOM 0 H VAL A 5 10.414 -3.256 -2.279 1.00 0.00 H new ATOM 0 HA VAL A 5 11.515 -1.528 -3.325 1.00 0.00 H new ATOM 0 HB VAL A 5 11.752 -0.639 -0.513 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.174 1.585 -1.567 1.00 0.00 H new ATOM 0 HG12 VAL A 5 12.670 0.901 -2.247 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.147 0.796 -3.162 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.389 0.189 -0.764 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.285 -0.643 -2.333 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.482 -1.587 -0.837 1.00 0.00 H new ATOM 62 N ASN A 6 13.827 -2.802 -3.240 1.00 0.00 N ATOM 63 CA ASN A 6 15.226 -3.148 -3.448 1.00 0.00 C ATOM 64 C ASN A 6 15.838 -2.071 -4.342 1.00 0.00 C ATOM 65 O ASN A 6 15.583 -2.052 -5.549 1.00 0.00 O ATOM 66 CB ASN A 6 15.313 -4.554 -4.081 1.00 0.00 C ATOM 67 CG ASN A 6 16.745 -5.018 -4.343 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.653 -4.228 -4.561 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.995 -6.316 -4.313 1.00 0.00 N ATOM 0 H ASN A 6 13.191 -3.368 -3.802 1.00 0.00 H new ATOM 0 HA ASN A 6 15.780 -3.183 -2.510 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.822 -5.271 -3.423 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.762 -4.555 -5.021 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.943 -6.657 -4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.240 -6.977 -4.131 1.00 0.00 H new ATOM 76 N THR A 7 16.604 -1.154 -3.753 1.00 0.00 N ATOM 77 CA THR A 7 17.335 -0.136 -4.496 1.00 0.00 C ATOM 78 C THR A 7 18.457 -0.817 -5.297 1.00 0.00 C ATOM 79 O THR A 7 18.522 -0.665 -6.518 1.00 0.00 O ATOM 80 CB THR A 7 17.885 0.912 -3.508 1.00 0.00 C ATOM 81 OG1 THR A 7 16.893 1.323 -2.589 1.00 0.00 O ATOM 82 CG2 THR A 7 18.431 2.149 -4.225 1.00 0.00 C ATOM 0 H THR A 7 16.734 -1.098 -2.743 1.00 0.00 H new ATOM 0 HA THR A 7 16.682 0.380 -5.200 1.00 0.00 H new ATOM 0 HB THR A 7 18.701 0.425 -2.974 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.298 1.453 -1.706 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.807 2.860 -3.489 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.241 1.855 -4.893 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.634 2.615 -4.805 1.00 0.00 H new ATOM 90 N ASN A 8 19.319 -1.582 -4.612 1.00 0.00 N ATOM 91 CA ASN A 8 20.413 -2.370 -5.179 1.00 0.00 C ATOM 92 C ASN A 8 20.963 -3.264 -4.064 1.00 0.00 C ATOM 93 O ASN A 8 21.925 -2.888 -3.397 1.00 0.00 O ATOM 94 CB ASN A 8 21.530 -1.472 -5.749 1.00 0.00 C ATOM 95 CG ASN A 8 22.727 -2.300 -6.220 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.578 -3.403 -6.741 1.00 0.00 O ATOM 97 ND2 ASN A 8 23.939 -1.793 -6.061 1.00 0.00 N ATOM 0 H ASN A 8 19.266 -1.670 -3.597 1.00 0.00 H new ATOM 0 HA ASN A 8 20.039 -2.968 -6.010 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.139 -0.888 -6.582 1.00 0.00 H new ATOM 0 HB3 ASN A 8 21.853 -0.763 -4.987 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.756 -2.318 -6.372 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.056 -0.877 -5.628 1.00 0.00 H new ATOM 104 N SER A 9 20.309 -4.390 -3.800 1.00 0.00 N ATOM 105 CA SER A 9 20.551 -5.260 -2.652 1.00 0.00 C ATOM 106 C SER A 9 20.360 -6.727 -3.032 1.00 0.00 C ATOM 107 O SER A 9 19.805 -7.037 -4.093 1.00 0.00 O ATOM 108 CB SER A 9 19.560 -4.896 -1.546 1.00 0.00 C ATOM 109 OG SER A 9 19.764 -3.556 -1.145 1.00 0.00 O ATOM 0 H SER A 9 19.564 -4.737 -4.405 1.00 0.00 H new ATOM 0 HA SER A 9 21.577 -5.121 -2.312 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.538 -5.027 -1.902 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.689 -5.564 -0.695 1.00 0.00 H new ATOM 0 HG SER A 9 19.334 -2.953 -1.787 1.00 0.00 H new ATOM 115 N GLN A 10 20.778 -7.626 -2.140 1.00 0.00 N ATOM 116 CA GLN A 10 20.794 -9.067 -2.350 1.00 0.00 C ATOM 117 C GLN A 10 20.086 -9.737 -1.172 1.00 0.00 C ATOM 118 O GLN A 10 20.312 -9.391 -0.011 1.00 0.00 O ATOM 119 CB GLN A 10 22.261 -9.494 -2.553 1.00 0.00 C ATOM 120 CG GLN A 10 22.684 -10.858 -1.999 1.00 0.00 C ATOM 121 CD GLN A 10 22.070 -12.076 -2.695 1.00 0.00 C ATOM 122 OE1 GLN A 10 21.085 -11.985 -3.422 1.00 0.00 O ATOM 123 NE2 GLN A 10 22.651 -13.249 -2.494 1.00 0.00 N ATOM 0 H GLN A 10 21.126 -7.357 -1.220 1.00 0.00 H new ATOM 0 HA GLN A 10 20.250 -9.379 -3.241 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.468 -9.487 -3.623 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.898 -8.735 -2.100 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.769 -10.935 -2.063 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.423 -10.897 -0.941 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.469 -13.316 -1.888 1.00 0.00 H new ATOM 0 HE22 GLN A 10 22.280 -14.086 -2.945 1.00 0.00 H new ATOM 132 N ILE A 11 19.219 -10.695 -1.493 1.00 0.00 N ATOM 133 CA ILE A 11 18.311 -11.387 -0.587 1.00 0.00 C ATOM 134 C ILE A 11 18.333 -12.853 -1.023 1.00 0.00 C ATOM 135 O ILE A 11 18.084 -13.132 -2.200 1.00 0.00 O ATOM 136 CB ILE A 11 16.893 -10.751 -0.668 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.900 -9.234 -0.348 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.905 -11.445 0.287 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.868 -8.343 -1.596 1.00 0.00 C ATOM 0 H ILE A 11 19.128 -11.028 -2.453 1.00 0.00 H new ATOM 0 HA ILE A 11 18.609 -11.305 0.458 1.00 0.00 H new ATOM 0 HB ILE A 11 16.571 -10.891 -1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 11 16.039 -8.999 0.278 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.791 -8.998 0.234 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.926 -10.974 0.203 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.824 -12.500 0.024 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.265 -11.354 1.312 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.875 -7.295 -1.295 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.743 -8.549 -2.213 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.964 -8.550 -2.168 1.00 0.00 H new ATOM 151 N THR A 12 18.677 -13.780 -0.122 1.00 0.00 N ATOM 152 CA THR A 12 18.819 -15.188 -0.511 1.00 0.00 C ATOM 153 C THR A 12 17.456 -15.839 -0.800 1.00 0.00 C ATOM 154 O THR A 12 16.401 -15.294 -0.464 1.00 0.00 O ATOM 155 CB THR A 12 19.634 -15.984 0.523 1.00 0.00 C ATOM 156 OG1 THR A 12 19.037 -15.937 1.805 1.00 0.00 O ATOM 157 CG2 THR A 12 21.077 -15.483 0.620 1.00 0.00 C ATOM 0 H THR A 12 18.859 -13.587 0.863 1.00 0.00 H new ATOM 0 HA THR A 12 19.383 -15.211 -1.443 1.00 0.00 H new ATOM 0 HB THR A 12 19.644 -17.016 0.173 1.00 0.00 H new ATOM 0 HG1 THR A 12 18.816 -16.846 2.096 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.618 -16.072 1.361 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.564 -15.585 -0.350 1.00 0.00 H new ATOM 0 HG23 THR A 12 21.079 -14.435 0.918 1.00 0.00 H new ATOM 165 N ALA A 13 17.477 -17.045 -1.382 1.00 0.00 N ATOM 166 CA ALA A 13 16.287 -17.798 -1.773 1.00 0.00 C ATOM 167 C ALA A 13 15.321 -18.078 -0.613 1.00 0.00 C ATOM 168 O ALA A 13 14.122 -18.236 -0.858 1.00 0.00 O ATOM 169 CB ALA A 13 16.732 -19.127 -2.389 1.00 0.00 C ATOM 0 H ALA A 13 18.346 -17.533 -1.598 1.00 0.00 H new ATOM 0 HA ALA A 13 15.740 -17.182 -2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.855 -19.702 -2.687 1.00 0.00 H new ATOM 0 HB2 ALA A 13 17.353 -18.933 -3.264 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.306 -19.694 -1.656 1.00 0.00 H new ATOM 175 N ASN A 14 15.821 -18.152 0.629 1.00 0.00 N ATOM 176 CA ASN A 14 14.997 -18.436 1.817 1.00 0.00 C ATOM 177 C ASN A 14 14.855 -17.210 2.728 1.00 0.00 C ATOM 178 O ASN A 14 14.209 -17.264 3.777 1.00 0.00 O ATOM 179 CB ASN A 14 15.535 -19.656 2.579 1.00 0.00 C ATOM 180 CG ASN A 14 14.484 -20.202 3.548 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.375 -20.547 3.148 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.800 -20.322 4.825 1.00 0.00 N ATOM 0 H ASN A 14 16.810 -18.017 0.840 1.00 0.00 H new ATOM 0 HA ASN A 14 13.993 -18.679 1.468 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.822 -20.434 1.872 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.434 -19.378 3.130 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.122 -20.703 5.485 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.722 -20.034 5.151 1.00 0.00 H new ATOM 189 N SER A 15 15.478 -16.096 2.347 1.00 0.00 N ATOM 190 CA SER A 15 15.240 -14.814 2.978 1.00 0.00 C ATOM 191 C SER A 15 13.925 -14.249 2.430 1.00 0.00 C ATOM 192 O SER A 15 13.431 -14.712 1.394 1.00 0.00 O ATOM 193 CB SER A 15 16.395 -13.885 2.633 1.00 0.00 C ATOM 194 OG SER A 15 17.570 -14.290 3.296 1.00 0.00 O ATOM 0 H SER A 15 16.161 -16.065 1.590 1.00 0.00 H new ATOM 0 HA SER A 15 15.171 -14.914 4.061 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.560 -13.885 1.556 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.144 -12.863 2.917 1.00 0.00 H new ATOM 0 HG SER A 15 18.148 -14.775 2.671 1.00 0.00 H new ATOM 200 N GLN A 16 13.368 -13.225 3.078 1.00 0.00 N ATOM 201 CA GLN A 16 12.188 -12.521 2.587 1.00 0.00 C ATOM 202 C GLN A 16 12.335 -11.044 2.920 1.00 0.00 C ATOM 203 O GLN A 16 12.915 -10.688 3.948 1.00 0.00 O ATOM 204 CB GLN A 16 10.898 -13.057 3.238 1.00 0.00 C ATOM 205 CG GLN A 16 10.574 -14.518 2.890 1.00 0.00 C ATOM 206 CD GLN A 16 9.308 -14.988 3.603 1.00 0.00 C ATOM 207 OE1 GLN A 16 8.234 -15.096 3.012 1.00 0.00 O ATOM 208 NE2 GLN A 16 9.405 -15.272 4.891 1.00 0.00 N ATOM 0 H GLN A 16 13.726 -12.861 3.961 1.00 0.00 H new ATOM 0 HA GLN A 16 12.113 -12.676 1.511 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.986 -12.964 4.321 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.062 -12.429 2.931 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.446 -14.618 1.812 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.412 -15.156 3.172 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.302 -15.178 5.368 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.583 -15.585 5.407 1.00 0.00 H new ATOM 217 N CYS A 17 11.749 -10.199 2.078 1.00 0.00 N ATOM 218 CA CYS A 17 11.592 -8.778 2.323 1.00 0.00 C ATOM 219 C CYS A 17 10.170 -8.382 1.920 1.00 0.00 C ATOM 220 O CYS A 17 9.716 -8.748 0.834 1.00 0.00 O ATOM 221 CB CYS A 17 12.701 -7.994 1.608 1.00 0.00 C ATOM 222 SG CYS A 17 13.260 -8.608 -0.008 1.00 0.00 S ATOM 0 H CYS A 17 11.361 -10.497 1.183 1.00 0.00 H new ATOM 0 HA CYS A 17 11.708 -8.531 3.378 1.00 0.00 H new ATOM 0 HB2 CYS A 17 12.356 -6.969 1.476 1.00 0.00 H new ATOM 0 HB3 CYS A 17 13.566 -7.956 2.270 1.00 0.00 H new ATOM 227 N VAL A 18 9.438 -7.691 2.801 1.00 0.00 N ATOM 228 CA VAL A 18 8.020 -7.377 2.602 1.00 0.00 C ATOM 229 C VAL A 18 7.748 -6.004 3.218 1.00 0.00 C ATOM 230 O VAL A 18 8.181 -5.746 4.345 1.00 0.00 O ATOM 231 CB VAL A 18 7.111 -8.458 3.246 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.668 -8.323 2.735 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.555 -9.911 2.990 1.00 0.00 C ATOM 0 H VAL A 18 9.816 -7.332 3.678 1.00 0.00 H new ATOM 0 HA VAL A 18 7.792 -7.363 1.536 1.00 0.00 H new ATOM 0 HB VAL A 18 7.187 -8.272 4.317 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.045 -9.089 3.197 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.282 -7.337 2.993 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.652 -8.447 1.652 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.861 -10.595 3.478 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.563 -10.105 1.918 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.556 -10.062 3.393 1.00 0.00 H new ATOM 243 N LYS A 19 7.022 -5.140 2.493 1.00 0.00 N ATOM 244 CA LYS A 19 6.741 -3.734 2.826 1.00 0.00 C ATOM 245 C LYS A 19 7.904 -3.040 3.544 1.00 0.00 C ATOM 246 O LYS A 19 7.699 -2.374 4.556 1.00 0.00 O ATOM 247 CB LYS A 19 5.374 -3.576 3.528 1.00 0.00 C ATOM 248 CG LYS A 19 5.161 -4.462 4.768 1.00 0.00 C ATOM 249 CD LYS A 19 3.984 -3.954 5.614 1.00 0.00 C ATOM 250 CE LYS A 19 3.577 -4.987 6.677 1.00 0.00 C ATOM 251 NZ LYS A 19 2.704 -4.397 7.725 1.00 0.00 N ATOM 0 H LYS A 19 6.592 -5.418 1.611 1.00 0.00 H new ATOM 0 HA LYS A 19 6.653 -3.193 1.884 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.255 -2.533 3.823 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.587 -3.795 2.807 1.00 0.00 H new ATOM 0 HG2 LYS A 19 4.973 -5.489 4.457 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.069 -4.473 5.371 1.00 0.00 H new ATOM 0 HD2 LYS A 19 4.259 -3.018 6.100 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.133 -3.740 4.967 1.00 0.00 H new ATOM 0 HE2 LYS A 19 3.056 -5.815 6.196 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.472 -5.400 7.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 2.186 -5.155 8.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 3.288 -3.879 8.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 2.026 -3.743 7.284 1.00 0.00 H new ATOM 265 N SER A 20 9.120 -3.219 3.040 1.00 0.00 N ATOM 266 CA SER A 20 10.374 -2.790 3.653 1.00 0.00 C ATOM 267 C SER A 20 11.289 -2.251 2.546 1.00 0.00 C ATOM 268 O SER A 20 10.899 -2.279 1.379 1.00 0.00 O ATOM 269 CB SER A 20 10.982 -3.989 4.391 1.00 0.00 C ATOM 270 OG SER A 20 10.178 -4.321 5.506 1.00 0.00 O ATOM 0 H SER A 20 9.266 -3.691 2.148 1.00 0.00 H new ATOM 0 HA SER A 20 10.226 -1.992 4.381 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.057 -4.843 3.718 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.994 -3.752 4.718 1.00 0.00 H new ATOM 0 HG SER A 20 9.374 -4.791 5.201 1.00 0.00 H new ATOM 276 N THR A 21 12.488 -1.769 2.883 1.00 0.00 N ATOM 277 CA THR A 21 13.387 -1.115 1.930 1.00 0.00 C ATOM 278 C THR A 21 14.806 -1.633 2.147 1.00 0.00 C ATOM 279 O THR A 21 15.222 -1.836 3.291 1.00 0.00 O ATOM 280 CB THR A 21 13.300 0.415 2.111 1.00 0.00 C ATOM 281 OG1 THR A 21 11.948 0.846 2.126 1.00 0.00 O ATOM 282 CG2 THR A 21 14.039 1.187 1.013 1.00 0.00 C ATOM 0 H THR A 21 12.864 -1.822 3.830 1.00 0.00 H new ATOM 0 HA THR A 21 13.095 -1.346 0.906 1.00 0.00 H new ATOM 0 HB THR A 21 13.780 0.628 3.066 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.916 1.818 2.243 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.943 2.258 1.193 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.093 0.911 1.021 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.607 0.942 0.043 1.00 0.00 H new ATOM 290 N ALA A 22 15.563 -1.829 1.066 1.00 0.00 N ATOM 291 CA ALA A 22 16.908 -2.374 1.132 1.00 0.00 C ATOM 292 C ALA A 22 17.800 -1.668 0.119 1.00 0.00 C ATOM 293 O ALA A 22 17.568 -1.782 -1.089 1.00 0.00 O ATOM 294 CB ALA A 22 16.843 -3.886 0.866 1.00 0.00 C ATOM 0 H ALA A 22 15.253 -1.611 0.119 1.00 0.00 H new ATOM 0 HA ALA A 22 17.336 -2.211 2.121 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.847 -4.307 0.913 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.215 -4.361 1.619 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.421 -4.064 -0.123 1.00 0.00 H new ATOM 300 N THR A 23 18.867 -1.030 0.597 1.00 0.00 N ATOM 301 CA THR A 23 19.877 -0.392 -0.244 1.00 0.00 C ATOM 302 C THR A 23 21.255 -0.941 0.137 1.00 0.00 C ATOM 303 O THR A 23 21.645 -0.869 1.302 1.00 0.00 O ATOM 304 CB THR A 23 19.774 1.135 -0.068 1.00 0.00 C ATOM 305 OG1 THR A 23 18.447 1.563 -0.321 1.00 0.00 O ATOM 306 CG2 THR A 23 20.707 1.902 -1.011 1.00 0.00 C ATOM 0 H THR A 23 19.057 -0.941 1.595 1.00 0.00 H new ATOM 0 HA THR A 23 19.718 -0.612 -1.300 1.00 0.00 H new ATOM 0 HB THR A 23 20.069 1.348 0.959 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.389 2.534 -0.206 1.00 0.00 H new ATOM 0 HG21 THR A 23 20.593 2.973 -0.844 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.740 1.612 -0.816 1.00 0.00 H new ATOM 0 HG23 THR A 23 20.453 1.667 -2.045 1.00 0.00 H new ATOM 314 N ASN A 24 22.001 -1.481 -0.837 1.00 0.00 N ATOM 315 CA ASN A 24 23.279 -2.179 -0.652 1.00 0.00 C ATOM 316 C ASN A 24 23.225 -3.182 0.510 1.00 0.00 C ATOM 317 O ASN A 24 24.165 -3.296 1.297 1.00 0.00 O ATOM 318 CB ASN A 24 24.439 -1.171 -0.568 1.00 0.00 C ATOM 319 CG ASN A 24 25.809 -1.853 -0.621 1.00 0.00 C ATOM 320 OD1 ASN A 24 25.984 -2.906 -1.230 1.00 0.00 O ATOM 321 ND2 ASN A 24 26.820 -1.259 -0.006 1.00 0.00 N ATOM 0 H ASN A 24 21.718 -1.441 -1.816 1.00 0.00 H new ATOM 0 HA ASN A 24 23.474 -2.792 -1.532 1.00 0.00 H new ATOM 0 HB2 ASN A 24 24.358 -0.459 -1.389 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.355 -0.601 0.357 1.00 0.00 H new ATOM 0 HD21 ASN A 24 27.751 -1.675 -0.036 1.00 0.00 H new ATOM 0 HD22 ASN A 24 26.668 -0.385 0.498 1.00 0.00 H new ATOM 328 N CYS A 25 22.089 -3.863 0.671 1.00 0.00 N ATOM 329 CA CYS A 25 21.860 -4.754 1.793 1.00 0.00 C ATOM 330 C CYS A 25 22.230 -6.163 1.353 1.00 0.00 C ATOM 331 O CYS A 25 22.089 -6.499 0.172 1.00 0.00 O ATOM 332 CB CYS A 25 20.383 -4.695 2.200 1.00 0.00 C ATOM 333 SG CYS A 25 20.029 -5.327 3.860 1.00 0.00 S ATOM 0 H CYS A 25 21.305 -3.807 0.021 1.00 0.00 H new ATOM 0 HA CYS A 25 22.465 -4.460 2.651 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.045 -3.660 2.140 1.00 0.00 H new ATOM 0 HB3 CYS A 25 19.798 -5.264 1.477 1.00 0.00 H new ATOM 338 N TYR A 26 22.628 -7.002 2.304 1.00 0.00 N ATOM 339 CA TYR A 26 22.801 -8.426 2.091 1.00 0.00 C ATOM 340 C TYR A 26 21.963 -9.098 3.166 1.00 0.00 C ATOM 341 O TYR A 26 22.117 -8.798 4.351 1.00 0.00 O ATOM 342 CB TYR A 26 24.279 -8.831 2.156 1.00 0.00 C ATOM 343 CG TYR A 26 24.575 -10.167 1.488 1.00 0.00 C ATOM 344 CD1 TYR A 26 23.987 -11.362 1.956 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.410 -10.208 0.353 1.00 0.00 C ATOM 346 CE1 TYR A 26 24.185 -12.571 1.264 1.00 0.00 C ATOM 347 CE2 TYR A 26 25.635 -11.419 -0.325 1.00 0.00 C ATOM 348 CZ TYR A 26 25.002 -12.603 0.113 1.00 0.00 C ATOM 349 OH TYR A 26 25.154 -13.754 -0.600 1.00 0.00 O ATOM 0 H TYR A 26 22.841 -6.703 3.256 1.00 0.00 H new ATOM 0 HA TYR A 26 22.476 -8.732 1.096 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.881 -8.056 1.681 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.588 -8.880 3.200 1.00 0.00 H new ATOM 0 HD1 TYR A 26 23.382 -11.348 2.850 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.881 -9.302 0.001 1.00 0.00 H new ATOM 0 HE1 TYR A 26 23.711 -13.476 1.614 1.00 0.00 H new ATOM 0 HE2 TYR A 26 26.292 -11.444 -1.181 1.00 0.00 H new ATOM 0 HH TYR A 26 25.750 -13.591 -1.361 1.00 0.00 H new ATOM 359 N ILE A 27 21.066 -9.982 2.748 1.00 0.00 N ATOM 360 CA ILE A 27 20.070 -10.611 3.592 1.00 0.00 C ATOM 361 C ILE A 27 20.241 -12.106 3.336 1.00 0.00 C ATOM 362 O ILE A 27 19.917 -12.587 2.249 1.00 0.00 O ATOM 363 CB ILE A 27 18.671 -10.044 3.236 1.00 0.00 C ATOM 364 CG1 ILE A 27 18.641 -8.508 3.418 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.562 -10.715 4.052 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.267 -7.852 3.251 1.00 0.00 C ATOM 0 H ILE A 27 21.014 -10.289 1.777 1.00 0.00 H new ATOM 0 HA ILE A 27 20.182 -10.415 4.658 1.00 0.00 H new ATOM 0 HB ILE A 27 18.482 -10.270 2.187 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.020 -8.270 4.412 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.328 -8.061 2.699 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.598 -10.290 3.773 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.559 -11.786 3.850 1.00 0.00 H new ATOM 0 HG23 ILE A 27 17.739 -10.547 5.114 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.357 -6.776 3.399 1.00 0.00 H new ATOM 0 HD12 ILE A 27 16.889 -8.050 2.248 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.576 -8.262 3.987 1.00 0.00 H new ATOM 378 N ASP A 28 20.813 -12.813 4.311 1.00 0.00 N ATOM 379 CA ASP A 28 21.142 -14.233 4.243 1.00 0.00 C ATOM 380 C ASP A 28 20.299 -14.967 5.272 1.00 0.00 C ATOM 381 O ASP A 28 20.376 -14.659 6.459 1.00 0.00 O ATOM 382 CB ASP A 28 22.630 -14.448 4.545 1.00 0.00 C ATOM 383 CG ASP A 28 22.941 -15.937 4.780 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.710 -16.757 3.866 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.450 -16.289 5.867 1.00 0.00 O ATOM 0 H ASP A 28 21.069 -12.393 5.205 1.00 0.00 H new ATOM 0 HA ASP A 28 20.936 -14.613 3.242 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.230 -14.075 3.715 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.912 -13.871 5.426 1.00 0.00 H new ATOM 390 N ASN A 29 19.478 -15.914 4.819 1.00 0.00 N ATOM 391 CA ASN A 29 18.430 -16.606 5.580 1.00 0.00 C ATOM 392 C ASN A 29 17.641 -15.682 6.531 1.00 0.00 C ATOM 393 O ASN A 29 17.204 -16.117 7.599 1.00 0.00 O ATOM 394 CB ASN A 29 19.021 -17.826 6.314 1.00 0.00 C ATOM 395 CG ASN A 29 17.929 -18.842 6.644 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.263 -19.335 5.740 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.713 -19.210 7.895 1.00 0.00 N ATOM 0 H ASN A 29 19.527 -16.240 3.854 1.00 0.00 H new ATOM 0 HA ASN A 29 17.693 -16.957 4.857 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.785 -18.295 5.693 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.511 -17.501 7.232 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.994 -19.902 8.106 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.265 -18.802 8.649 1.00 0.00 H new ATOM 404 N SER A 30 17.462 -14.409 6.171 1.00 0.00 N ATOM 405 CA SER A 30 16.941 -13.381 7.059 1.00 0.00 C ATOM 406 C SER A 30 15.620 -12.814 6.549 1.00 0.00 C ATOM 407 O SER A 30 15.302 -12.881 5.362 1.00 0.00 O ATOM 408 CB SER A 30 17.996 -12.291 7.254 1.00 0.00 C ATOM 409 OG SER A 30 19.135 -12.803 7.907 1.00 0.00 O ATOM 0 H SER A 30 17.681 -14.063 5.237 1.00 0.00 H new ATOM 0 HA SER A 30 16.725 -13.829 8.029 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.282 -11.879 6.286 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.575 -11.472 7.837 1.00 0.00 H new ATOM 0 HG SER A 30 19.630 -13.386 7.294 1.00 0.00 H new ATOM 415 N GLN A 31 14.836 -12.251 7.465 1.00 0.00 N ATOM 416 CA GLN A 31 13.458 -11.860 7.215 1.00 0.00 C ATOM 417 C GLN A 31 13.317 -10.379 7.582 1.00 0.00 C ATOM 418 O GLN A 31 13.534 -10.002 8.736 1.00 0.00 O ATOM 419 CB GLN A 31 12.514 -12.775 8.026 1.00 0.00 C ATOM 420 CG GLN A 31 12.875 -14.282 8.051 1.00 0.00 C ATOM 421 CD GLN A 31 12.919 -14.960 6.677 1.00 0.00 C ATOM 422 OE1 GLN A 31 12.024 -14.782 5.859 1.00 0.00 O ATOM 423 NE2 GLN A 31 13.925 -15.777 6.396 1.00 0.00 N ATOM 0 H GLN A 31 15.148 -12.052 8.415 1.00 0.00 H new ATOM 0 HA GLN A 31 13.184 -11.978 6.167 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.485 -12.413 9.054 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.507 -12.671 7.623 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.848 -14.399 8.529 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.149 -14.804 8.674 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.669 -15.924 7.078 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.955 -16.259 5.497 1.00 0.00 H new ATOM 432 N LEU A 32 12.996 -9.537 6.598 1.00 0.00 N ATOM 433 CA LEU A 32 12.985 -8.078 6.707 1.00 0.00 C ATOM 434 C LEU A 32 11.551 -7.610 6.465 1.00 0.00 C ATOM 435 O LEU A 32 11.102 -7.630 5.318 1.00 0.00 O ATOM 436 CB LEU A 32 13.956 -7.509 5.647 1.00 0.00 C ATOM 437 CG LEU A 32 14.031 -5.968 5.613 1.00 0.00 C ATOM 438 CD1 LEU A 32 15.066 -5.446 6.616 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.397 -5.448 4.219 1.00 0.00 C ATOM 0 H LEU A 32 12.727 -9.865 5.670 1.00 0.00 H new ATOM 0 HA LEU A 32 13.309 -7.733 7.689 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.954 -7.905 5.836 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.652 -7.868 4.664 1.00 0.00 H new ATOM 0 HG LEU A 32 13.039 -5.603 5.880 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.099 -4.357 6.572 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.788 -5.760 7.622 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.048 -5.849 6.368 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.440 -4.359 4.237 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.369 -5.845 3.926 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.643 -5.770 3.501 1.00 0.00 H new ATOM 451 N VAL A 33 10.812 -7.217 7.506 1.00 0.00 N ATOM 452 CA VAL A 33 9.378 -6.976 7.349 1.00 0.00 C ATOM 453 C VAL A 33 8.916 -5.684 8.025 1.00 0.00 C ATOM 454 O VAL A 33 9.589 -5.132 8.898 1.00 0.00 O ATOM 455 CB VAL A 33 8.568 -8.215 7.808 1.00 0.00 C ATOM 456 CG1 VAL A 33 8.856 -9.448 6.933 1.00 0.00 C ATOM 457 CG2 VAL A 33 8.790 -8.600 9.278 1.00 0.00 C ATOM 0 H VAL A 33 11.174 -7.062 8.447 1.00 0.00 H new ATOM 0 HA VAL A 33 9.182 -6.826 6.287 1.00 0.00 H new ATOM 0 HB VAL A 33 7.528 -7.908 7.695 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.267 -10.293 7.290 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.589 -9.231 5.899 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.916 -9.695 6.990 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.188 -9.476 9.520 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.844 -8.828 9.439 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.496 -7.769 9.920 1.00 0.00 H new ATOM 467 N ASP A 34 7.718 -5.245 7.626 1.00 0.00 N ATOM 468 CA ASP A 34 6.943 -4.173 8.243 1.00 0.00 C ATOM 469 C ASP A 34 7.726 -2.868 8.409 1.00 0.00 C ATOM 470 O ASP A 34 7.987 -2.415 9.517 1.00 0.00 O ATOM 471 CB ASP A 34 6.300 -4.679 9.543 1.00 0.00 C ATOM 472 CG ASP A 34 5.362 -3.632 10.138 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.501 -3.108 9.398 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.496 -3.302 11.339 1.00 0.00 O ATOM 0 H ASP A 34 7.241 -5.652 6.821 1.00 0.00 H new ATOM 0 HA ASP A 34 6.140 -3.901 7.558 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.746 -5.597 9.345 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.078 -4.926 10.265 1.00 0.00 H new ATOM 479 N THR A 35 8.082 -2.230 7.300 1.00 0.00 N ATOM 480 CA THR A 35 8.807 -0.978 7.234 1.00 0.00 C ATOM 481 C THR A 35 10.200 -1.050 7.874 1.00 0.00 C ATOM 482 O THR A 35 10.673 -0.084 8.478 1.00 0.00 O ATOM 483 CB THR A 35 7.928 0.174 7.735 1.00 0.00 C ATOM 484 OG1 THR A 35 6.531 -0.061 7.595 1.00 0.00 O ATOM 485 CG2 THR A 35 8.298 1.466 7.006 1.00 0.00 C ATOM 0 H THR A 35 7.858 -2.597 6.375 1.00 0.00 H new ATOM 0 HA THR A 35 9.027 -0.766 6.188 1.00 0.00 H new ATOM 0 HB THR A 35 8.125 0.259 8.804 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.034 0.725 7.906 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.670 2.280 7.367 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.345 1.704 7.196 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.144 1.336 5.935 1.00 0.00 H new ATOM 493 N SER A 36 10.854 -2.207 7.790 1.00 0.00 N ATOM 494 CA SER A 36 12.256 -2.291 8.139 1.00 0.00 C ATOM 495 C SER A 36 13.021 -1.672 6.971 1.00 0.00 C ATOM 496 O SER A 36 12.565 -1.702 5.823 1.00 0.00 O ATOM 497 CB SER A 36 12.669 -3.738 8.378 1.00 0.00 C ATOM 498 OG SER A 36 12.018 -4.238 9.523 1.00 0.00 O ATOM 0 H SER A 36 10.435 -3.086 7.486 1.00 0.00 H new ATOM 0 HA SER A 36 12.471 -1.760 9.066 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.415 -4.346 7.510 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.750 -3.801 8.506 1.00 0.00 H new ATOM 0 HG SER A 36 11.058 -4.322 9.343 1.00 0.00 H new ATOM 504 N ILE A 37 14.173 -1.077 7.249 1.00 0.00 N ATOM 505 CA ILE A 37 14.934 -0.323 6.268 1.00 0.00 C ATOM 506 C ILE A 37 16.403 -0.704 6.482 1.00 0.00 C ATOM 507 O ILE A 37 16.874 -0.722 7.623 1.00 0.00 O ATOM 508 CB ILE A 37 14.624 1.195 6.414 1.00 0.00 C ATOM 509 CG1 ILE A 37 13.144 1.505 6.077 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.575 2.042 5.544 1.00 0.00 C ATOM 511 CD1 ILE A 37 12.745 2.981 6.201 1.00 0.00 C ATOM 0 H ILE A 37 14.608 -1.106 8.171 1.00 0.00 H new ATOM 0 HA ILE A 37 14.667 -0.559 5.238 1.00 0.00 H new ATOM 0 HB ILE A 37 14.790 1.464 7.457 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.942 1.174 5.058 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.506 0.915 6.736 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.336 3.098 5.666 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.605 1.865 5.853 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.457 1.762 4.497 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.692 3.096 5.945 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.908 3.317 7.225 1.00 0.00 H new ATOM 0 HD13 ILE A 37 13.351 3.580 5.521 1.00 0.00 H new ATOM 523 N CYS A 38 17.132 -1.009 5.405 1.00 0.00 N ATOM 524 CA CYS A 38 18.505 -1.484 5.459 1.00 0.00 C ATOM 525 C CYS A 38 19.330 -0.633 4.506 1.00 0.00 C ATOM 526 O CYS A 38 18.909 -0.412 3.368 1.00 0.00 O ATOM 527 CB CYS A 38 18.548 -2.952 5.021 1.00 0.00 C ATOM 528 SG CYS A 38 20.204 -3.688 5.045 1.00 0.00 S ATOM 0 H CYS A 38 16.771 -0.929 4.454 1.00 0.00 H new ATOM 0 HA CYS A 38 18.903 -1.408 6.471 1.00 0.00 H new ATOM 0 HB2 CYS A 38 17.895 -3.533 5.673 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.143 -3.030 4.012 1.00 0.00 H new ATOM 533 N THR A 39 20.511 -0.210 4.949 1.00 0.00 N ATOM 534 CA THR A 39 21.415 0.630 4.189 1.00 0.00 C ATOM 535 C THR A 39 22.821 0.090 4.442 1.00 0.00 C ATOM 536 O THR A 39 23.278 0.066 5.587 1.00 0.00 O ATOM 537 CB THR A 39 21.273 2.101 4.639 1.00 0.00 C ATOM 538 OG1 THR A 39 19.919 2.464 4.854 1.00 0.00 O ATOM 539 CG2 THR A 39 21.853 3.059 3.593 1.00 0.00 C ATOM 0 H THR A 39 20.870 -0.452 5.873 1.00 0.00 H new ATOM 0 HA THR A 39 21.192 0.609 3.122 1.00 0.00 H new ATOM 0 HB THR A 39 21.825 2.182 5.576 1.00 0.00 H new ATOM 0 HG1 THR A 39 19.873 3.401 5.139 1.00 0.00 H new ATOM 0 HG21 THR A 39 21.739 4.087 3.938 1.00 0.00 H new ATOM 0 HG22 THR A 39 22.911 2.841 3.447 1.00 0.00 H new ATOM 0 HG23 THR A 39 21.323 2.932 2.649 1.00 0.00 H new ATOM 547 N ARG A 40 23.509 -0.364 3.392 1.00 0.00 N ATOM 548 CA ARG A 40 24.888 -0.875 3.416 1.00 0.00 C ATOM 549 C ARG A 40 25.183 -1.840 4.578 1.00 0.00 C ATOM 550 O ARG A 40 26.253 -1.764 5.181 1.00 0.00 O ATOM 551 CB ARG A 40 25.911 0.271 3.251 1.00 0.00 C ATOM 552 CG ARG A 40 25.898 1.339 4.359 1.00 0.00 C ATOM 553 CD ARG A 40 27.128 2.251 4.283 1.00 0.00 C ATOM 554 NE ARG A 40 28.340 1.553 4.744 1.00 0.00 N ATOM 555 CZ ARG A 40 29.593 1.720 4.309 1.00 0.00 C ATOM 556 NH1 ARG A 40 29.879 2.543 3.303 1.00 0.00 N ATOM 557 NH2 ARG A 40 30.552 1.038 4.920 1.00 0.00 N ATOM 0 H ARG A 40 23.104 -0.388 2.456 1.00 0.00 H new ATOM 0 HA ARG A 40 25.004 -1.515 2.541 1.00 0.00 H new ATOM 0 HB2 ARG A 40 26.910 -0.162 3.201 1.00 0.00 H new ATOM 0 HB3 ARG A 40 25.728 0.762 2.295 1.00 0.00 H new ATOM 0 HG2 ARG A 40 24.993 1.941 4.274 1.00 0.00 H new ATOM 0 HG3 ARG A 40 25.866 0.852 5.334 1.00 0.00 H new ATOM 0 HD2 ARG A 40 27.269 2.590 3.257 1.00 0.00 H new ATOM 0 HD3 ARG A 40 26.963 3.139 4.893 1.00 0.00 H new ATOM 0 HE ARG A 40 28.208 0.861 5.482 1.00 0.00 H new ATOM 0 HH11 ARG A 40 29.133 3.065 2.844 1.00 0.00 H new ATOM 0 HH12 ARG A 40 30.844 2.651 2.991 1.00 0.00 H new ATOM 0 HH21 ARG A 40 30.321 0.413 5.692 1.00 0.00 H new ATOM 0 HH22 ARG A 40 31.521 1.138 4.618 1.00 0.00 H new ATOM 571 N SER A 41 24.241 -2.728 4.909 1.00 0.00 N ATOM 572 CA SER A 41 24.324 -3.596 6.082 1.00 0.00 C ATOM 573 C SER A 41 24.159 -5.069 5.713 1.00 0.00 C ATOM 574 O SER A 41 23.731 -5.415 4.608 1.00 0.00 O ATOM 575 CB SER A 41 23.262 -3.188 7.104 1.00 0.00 C ATOM 576 OG SER A 41 23.426 -1.840 7.490 1.00 0.00 O ATOM 0 H SER A 41 23.391 -2.864 4.362 1.00 0.00 H new ATOM 0 HA SER A 41 25.317 -3.476 6.516 1.00 0.00 H new ATOM 0 HB2 SER A 41 22.269 -3.330 6.679 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.329 -3.832 7.981 1.00 0.00 H new ATOM 0 HG SER A 41 23.240 -1.256 6.725 1.00 0.00 H new ATOM 582 N GLN A 42 24.474 -5.929 6.679 1.00 0.00 N ATOM 583 CA GLN A 42 24.429 -7.380 6.572 1.00 0.00 C ATOM 584 C GLN A 42 23.438 -7.901 7.612 1.00 0.00 C ATOM 585 O GLN A 42 23.524 -7.538 8.788 1.00 0.00 O ATOM 586 CB GLN A 42 25.848 -7.935 6.816 1.00 0.00 C ATOM 587 CG GLN A 42 25.964 -9.471 6.885 1.00 0.00 C ATOM 588 CD GLN A 42 25.814 -10.160 5.527 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.544 -9.866 4.585 1.00 0.00 O ATOM 590 NE2 GLN A 42 24.893 -11.101 5.389 1.00 0.00 N ATOM 0 H GLN A 42 24.782 -5.615 7.600 1.00 0.00 H new ATOM 0 HA GLN A 42 24.102 -7.701 5.583 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.500 -7.575 6.020 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.225 -7.518 7.750 1.00 0.00 H new ATOM 0 HG2 GLN A 42 26.932 -9.735 7.312 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.202 -9.854 7.563 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.289 -11.342 6.174 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.788 -11.585 4.497 1.00 0.00 H new ATOM 599 N TYR A 43 22.556 -8.799 7.184 1.00 0.00 N ATOM 600 CA TYR A 43 21.671 -9.580 8.030 1.00 0.00 C ATOM 601 C TYR A 43 21.956 -11.043 7.721 1.00 0.00 C ATOM 602 O TYR A 43 22.045 -11.414 6.546 1.00 0.00 O ATOM 603 CB TYR A 43 20.203 -9.258 7.733 1.00 0.00 C ATOM 604 CG TYR A 43 19.707 -7.952 8.314 1.00 0.00 C ATOM 605 CD1 TYR A 43 19.493 -7.852 9.700 1.00 0.00 C ATOM 606 CD2 TYR A 43 19.407 -6.860 7.475 1.00 0.00 C ATOM 607 CE1 TYR A 43 18.976 -6.668 10.251 1.00 0.00 C ATOM 608 CE2 TYR A 43 18.871 -5.681 8.020 1.00 0.00 C ATOM 609 CZ TYR A 43 18.646 -5.585 9.412 1.00 0.00 C ATOM 610 OH TYR A 43 18.075 -4.475 9.955 1.00 0.00 O ATOM 0 H TYR A 43 22.436 -9.009 6.193 1.00 0.00 H new ATOM 0 HA TYR A 43 21.844 -9.351 9.081 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.063 -9.235 6.652 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.584 -10.068 8.117 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.727 -8.688 10.343 1.00 0.00 H new ATOM 0 HD2 TYR A 43 19.589 -6.929 6.413 1.00 0.00 H new ATOM 0 HE1 TYR A 43 18.831 -6.588 11.318 1.00 0.00 H new ATOM 0 HE2 TYR A 43 18.631 -4.848 7.375 1.00 0.00 H new ATOM 0 HH TYR A 43 17.750 -4.682 10.856 1.00 0.00 H new ATOM 620 N SER A 44 22.098 -11.858 8.762 1.00 0.00 N ATOM 621 CA SER A 44 22.469 -13.256 8.648 1.00 0.00 C ATOM 622 C SER A 44 21.670 -14.052 9.679 1.00 0.00 C ATOM 623 O SER A 44 21.791 -13.812 10.881 1.00 0.00 O ATOM 624 CB SER A 44 23.980 -13.393 8.867 1.00 0.00 C ATOM 625 OG SER A 44 24.709 -12.590 7.948 1.00 0.00 O ATOM 0 H SER A 44 21.955 -11.555 9.725 1.00 0.00 H new ATOM 0 HA SER A 44 22.240 -13.647 7.657 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.230 -13.101 9.887 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.273 -14.437 8.754 1.00 0.00 H new ATOM 0 HG SER A 44 25.669 -12.696 8.111 1.00 0.00 H new ATOM 631 N ASP A 45 20.850 -14.994 9.210 1.00 0.00 N ATOM 632 CA ASP A 45 19.898 -15.789 9.990 1.00 0.00 C ATOM 633 C ASP A 45 19.116 -14.953 11.021 1.00 0.00 C ATOM 634 O ASP A 45 18.947 -15.353 12.175 1.00 0.00 O ATOM 635 CB ASP A 45 20.613 -17.007 10.598 1.00 0.00 C ATOM 636 CG ASP A 45 19.609 -18.034 11.142 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.672 -18.399 10.396 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.791 -18.539 12.274 1.00 0.00 O ATOM 0 H ASP A 45 20.831 -15.237 8.220 1.00 0.00 H new ATOM 0 HA ASP A 45 19.128 -16.161 9.315 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.242 -17.476 9.841 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.272 -16.680 11.402 1.00 0.00 H new ATOM 643 N ALA A 46 18.668 -13.759 10.617 1.00 0.00 N ATOM 644 CA ALA A 46 18.105 -12.739 11.492 1.00 0.00 C ATOM 645 C ALA A 46 16.660 -12.386 11.114 1.00 0.00 C ATOM 646 O ALA A 46 16.185 -12.712 10.025 1.00 0.00 O ATOM 647 CB ALA A 46 19.008 -11.499 11.426 1.00 0.00 C ATOM 0 H ALA A 46 18.691 -13.472 9.638 1.00 0.00 H new ATOM 0 HA ALA A 46 18.067 -13.125 12.511 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.605 -10.721 12.074 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.013 -11.763 11.756 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.048 -11.132 10.400 1.00 0.00 H new ATOM 653 N ASN A 47 15.962 -11.670 11.997 1.00 0.00 N ATOM 654 CA ASN A 47 14.605 -11.174 11.767 1.00 0.00 C ATOM 655 C ASN A 47 14.542 -9.706 12.153 1.00 0.00 C ATOM 656 O ASN A 47 15.175 -9.293 13.126 1.00 0.00 O ATOM 657 CB ASN A 47 13.579 -11.968 12.583 1.00 0.00 C ATOM 658 CG ASN A 47 12.176 -11.375 12.459 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.643 -11.246 11.363 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.558 -10.982 13.560 1.00 0.00 N ATOM 0 H ASN A 47 16.333 -11.413 12.912 1.00 0.00 H new ATOM 0 HA ASN A 47 14.363 -11.296 10.711 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.567 -13.004 12.244 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.878 -11.979 13.631 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.628 -10.567 13.502 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.011 -11.094 14.467 1.00 0.00 H new ATOM 667 N VAL A 48 13.771 -8.930 11.405 1.00 0.00 N ATOM 668 CA VAL A 48 13.742 -7.478 11.499 1.00 0.00 C ATOM 669 C VAL A 48 12.293 -7.022 11.361 1.00 0.00 C ATOM 670 O VAL A 48 11.618 -7.425 10.407 1.00 0.00 O ATOM 671 CB VAL A 48 14.607 -6.849 10.383 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.001 -5.419 10.769 1.00 0.00 C ATOM 673 CG2 VAL A 48 15.879 -7.634 10.026 1.00 0.00 C ATOM 0 H VAL A 48 13.134 -9.301 10.700 1.00 0.00 H new ATOM 0 HA VAL A 48 14.147 -7.159 12.459 1.00 0.00 H new ATOM 0 HB VAL A 48 13.977 -6.867 9.494 1.00 0.00 H new ATOM 0 HG11 VAL A 48 15.610 -4.983 9.977 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.102 -4.819 10.907 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.571 -5.437 11.698 1.00 0.00 H new ATOM 0 HG21 VAL A 48 16.418 -7.113 9.234 1.00 0.00 H new ATOM 0 HG22 VAL A 48 16.516 -7.714 10.907 1.00 0.00 H new ATOM 0 HG23 VAL A 48 15.606 -8.632 9.684 1.00 0.00 H new ATOM 683 N LYS A 49 11.831 -6.163 12.275 1.00 0.00 N ATOM 684 CA LYS A 49 10.501 -5.568 12.204 1.00 0.00 C ATOM 685 C LYS A 49 10.620 -4.079 12.475 1.00 0.00 C ATOM 686 O LYS A 49 11.132 -3.682 13.526 1.00 0.00 O ATOM 687 CB LYS A 49 9.539 -6.256 13.187 1.00 0.00 C ATOM 688 CG LYS A 49 8.079 -5.887 12.869 1.00 0.00 C ATOM 689 CD LYS A 49 7.112 -6.470 13.907 1.00 0.00 C ATOM 690 CE LYS A 49 5.630 -6.245 13.560 1.00 0.00 C ATOM 691 NZ LYS A 49 5.209 -4.821 13.624 1.00 0.00 N ATOM 0 H LYS A 49 12.373 -5.863 13.085 1.00 0.00 H new ATOM 0 HA LYS A 49 10.082 -5.712 11.208 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.666 -7.337 13.131 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.780 -5.959 14.208 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.975 -4.802 12.842 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.817 -6.257 11.878 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.296 -7.540 14.003 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.321 -6.022 14.879 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.439 -6.626 12.557 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.014 -6.828 14.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.173 -4.768 13.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.641 -4.368 14.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.518 -4.329 12.762 1.00 0.00 H new ATOM 705 N LYS A 50 10.118 -3.266 11.545 1.00 0.00 N ATOM 706 CA LYS A 50 10.079 -1.807 11.598 1.00 0.00 C ATOM 707 C LYS A 50 11.348 -1.189 12.194 1.00 0.00 C ATOM 708 O LYS A 50 11.268 -0.351 13.091 1.00 0.00 O ATOM 709 CB LYS A 50 8.778 -1.392 12.313 1.00 0.00 C ATOM 710 CG LYS A 50 8.397 0.077 12.066 1.00 0.00 C ATOM 711 CD LYS A 50 6.944 0.355 12.483 1.00 0.00 C ATOM 712 CE LYS A 50 6.009 0.523 11.273 1.00 0.00 C ATOM 713 NZ LYS A 50 5.939 -0.685 10.421 1.00 0.00 N ATOM 0 H LYS A 50 9.705 -3.630 10.687 1.00 0.00 H new ATOM 0 HA LYS A 50 10.065 -1.402 10.586 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.964 -2.034 11.976 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.891 -1.557 13.385 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.069 0.728 12.625 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.527 0.316 11.010 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.584 -0.464 13.106 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.910 1.258 13.093 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.008 0.769 11.627 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.351 1.365 10.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.606 -0.421 9.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 6.883 -1.115 10.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.279 -1.369 10.842 1.00 0.00 H new ATOM 727 N SER A 51 12.523 -1.622 11.738 1.00 0.00 N ATOM 728 CA SER A 51 13.792 -1.182 12.302 1.00 0.00 C ATOM 729 C SER A 51 14.679 -0.651 11.186 1.00 0.00 C ATOM 730 O SER A 51 14.559 -1.087 10.042 1.00 0.00 O ATOM 731 CB SER A 51 14.436 -2.346 13.051 1.00 0.00 C ATOM 732 OG SER A 51 13.607 -2.739 14.131 1.00 0.00 O ATOM 0 H SER A 51 12.619 -2.286 10.969 1.00 0.00 H new ATOM 0 HA SER A 51 13.641 -0.372 13.015 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.589 -3.186 12.374 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.418 -2.053 13.422 1.00 0.00 H new ATOM 0 HG SER A 51 12.816 -3.202 13.784 1.00 0.00 H new ATOM 738 N VAL A 52 15.554 0.299 11.508 1.00 0.00 N ATOM 739 CA VAL A 52 16.321 1.056 10.525 1.00 0.00 C ATOM 740 C VAL A 52 17.788 0.771 10.819 1.00 0.00 C ATOM 741 O VAL A 52 18.246 0.992 11.941 1.00 0.00 O ATOM 742 CB VAL A 52 15.959 2.556 10.605 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.684 3.355 9.511 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.444 2.791 10.462 1.00 0.00 C ATOM 0 H VAL A 52 15.752 0.567 12.472 1.00 0.00 H new ATOM 0 HA VAL A 52 16.095 0.761 9.500 1.00 0.00 H new ATOM 0 HB VAL A 52 16.278 2.899 11.589 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.412 4.408 9.589 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.762 3.248 9.636 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.393 2.977 8.531 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.234 3.859 10.524 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.106 2.410 9.498 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.918 2.271 11.262 1.00 0.00 H new ATOM 754 N THR A 53 18.528 0.288 9.827 1.00 0.00 N ATOM 755 CA THR A 53 19.855 -0.237 10.011 1.00 0.00 C ATOM 756 C THR A 53 20.757 0.382 8.943 1.00 0.00 C ATOM 757 O THR A 53 20.415 0.383 7.754 1.00 0.00 O ATOM 758 CB THR A 53 19.663 -1.762 9.935 1.00 0.00 C ATOM 759 OG1 THR A 53 19.544 -2.313 11.227 1.00 0.00 O ATOM 760 CG2 THR A 53 20.726 -2.491 9.140 1.00 0.00 C ATOM 0 H THR A 53 18.207 0.255 8.859 1.00 0.00 H new ATOM 0 HA THR A 53 20.347 0.001 10.954 1.00 0.00 H new ATOM 0 HB THR A 53 18.735 -1.910 9.383 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.028 -3.145 11.182 1.00 0.00 H new ATOM 0 HG21 THR A 53 20.511 -3.560 9.140 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.731 -2.121 8.115 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.702 -2.317 9.593 1.00 0.00 H new ATOM 768 N THR A 54 21.905 0.898 9.378 1.00 0.00 N ATOM 769 CA THR A 54 22.872 1.580 8.542 1.00 0.00 C ATOM 770 C THR A 54 24.264 1.089 8.945 1.00 0.00 C ATOM 771 O THR A 54 24.660 1.232 10.102 1.00 0.00 O ATOM 772 CB THR A 54 22.717 3.104 8.717 1.00 0.00 C ATOM 773 OG1 THR A 54 21.374 3.500 8.480 1.00 0.00 O ATOM 774 CG2 THR A 54 23.624 3.879 7.752 1.00 0.00 C ATOM 0 H THR A 54 22.190 0.847 10.356 1.00 0.00 H new ATOM 0 HA THR A 54 22.715 1.362 7.486 1.00 0.00 H new ATOM 0 HB THR A 54 23.004 3.335 9.743 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.293 4.470 8.597 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.487 4.950 7.905 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.665 3.616 7.940 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.365 3.623 6.725 1.00 0.00 H new ATOM 782 N ASP A 55 25.016 0.560 7.979 1.00 0.00 N ATOM 783 CA ASP A 55 26.373 0.039 8.146 1.00 0.00 C ATOM 784 C ASP A 55 26.509 -0.952 9.318 1.00 0.00 C ATOM 785 O ASP A 55 27.427 -0.830 10.130 1.00 0.00 O ATOM 786 CB ASP A 55 27.375 1.206 8.205 1.00 0.00 C ATOM 787 CG ASP A 55 28.827 0.724 8.061 1.00 0.00 C ATOM 788 OD1 ASP A 55 29.121 0.025 7.063 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.694 1.123 8.870 1.00 0.00 O ATOM 0 H ASP A 55 24.682 0.480 7.019 1.00 0.00 H new ATOM 0 HA ASP A 55 26.614 -0.563 7.270 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.149 1.919 7.412 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.260 1.735 9.151 1.00 0.00 H new ATOM 794 N CYS A 56 25.593 -1.924 9.439 1.00 0.00 N ATOM 795 CA CYS A 56 25.547 -2.846 10.572 1.00 0.00 C ATOM 796 C CYS A 56 25.784 -4.291 10.132 1.00 0.00 C ATOM 797 O CYS A 56 25.668 -4.611 8.946 1.00 0.00 O ATOM 798 CB CYS A 56 24.219 -2.716 11.337 1.00 0.00 C ATOM 799 SG CYS A 56 24.020 -1.189 12.296 1.00 0.00 S ATOM 0 H CYS A 56 24.862 -2.089 8.747 1.00 0.00 H new ATOM 0 HA CYS A 56 26.356 -2.571 11.248 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.399 -2.785 10.622 1.00 0.00 H new ATOM 0 HB3 CYS A 56 24.125 -3.565 12.014 1.00 0.00 H new ATOM 804 N ASN A 57 26.070 -5.181 11.090 1.00 0.00 N ATOM 805 CA ASN A 57 26.242 -6.611 10.858 1.00 0.00 C ATOM 806 C ASN A 57 25.414 -7.290 11.929 1.00 0.00 C ATOM 807 O ASN A 57 25.742 -7.174 13.106 1.00 0.00 O ATOM 808 CB ASN A 57 27.719 -7.021 10.973 1.00 0.00 C ATOM 809 CG ASN A 57 27.865 -8.542 10.960 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.152 -9.238 10.244 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.774 -9.099 11.744 1.00 0.00 N ATOM 0 H ASN A 57 26.190 -4.916 12.068 1.00 0.00 H new ATOM 0 HA ASN A 57 25.926 -6.894 9.854 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.286 -6.590 10.147 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.142 -6.619 11.894 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.885 -10.113 11.756 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.363 -8.514 12.337 1.00 0.00 H new ATOM 818 N ILE A 58 24.329 -7.948 11.548 1.00 0.00 N ATOM 819 CA ILE A 58 23.333 -8.440 12.482 1.00 0.00 C ATOM 820 C ILE A 58 23.195 -9.932 12.213 1.00 0.00 C ATOM 821 O ILE A 58 22.707 -10.332 11.154 1.00 0.00 O ATOM 822 CB ILE A 58 22.043 -7.602 12.301 1.00 0.00 C ATOM 823 CG1 ILE A 58 22.311 -6.134 12.731 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.877 -8.218 13.091 1.00 0.00 C ATOM 825 CD1 ILE A 58 21.154 -5.153 12.517 1.00 0.00 C ATOM 0 H ILE A 58 24.115 -8.156 10.573 1.00 0.00 H new ATOM 0 HA ILE A 58 23.599 -8.328 13.533 1.00 0.00 H new ATOM 0 HB ILE A 58 21.757 -7.606 11.249 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.576 -6.128 13.788 1.00 0.00 H new ATOM 0 HG13 ILE A 58 23.179 -5.768 12.183 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.982 -7.613 12.949 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.691 -9.231 12.734 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.131 -8.248 14.151 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.453 -4.160 12.852 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.898 -5.117 11.458 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.287 -5.483 13.089 1.00 0.00 H new ATOM 837 N ASP A 59 23.653 -10.756 13.157 1.00 0.00 N ATOM 838 CA ASP A 59 23.791 -12.193 12.962 1.00 0.00 C ATOM 839 C ASP A 59 22.999 -12.924 14.040 1.00 0.00 C ATOM 840 O ASP A 59 23.053 -12.525 15.202 1.00 0.00 O ATOM 841 CB ASP A 59 25.277 -12.551 13.016 1.00 0.00 C ATOM 842 CG ASP A 59 25.488 -14.065 12.931 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.260 -14.653 11.852 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.910 -14.659 13.945 1.00 0.00 O ATOM 0 H ASP A 59 23.939 -10.439 14.083 1.00 0.00 H new ATOM 0 HA ASP A 59 23.396 -12.495 11.992 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.801 -12.062 12.195 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.711 -12.173 13.941 1.00 0.00 H new ATOM 849 N LYS A 60 22.235 -13.958 13.673 1.00 0.00 N ATOM 850 CA LYS A 60 21.368 -14.757 14.556 1.00 0.00 C ATOM 851 C LYS A 60 20.430 -13.924 15.449 1.00 0.00 C ATOM 852 O LYS A 60 19.956 -14.428 16.471 1.00 0.00 O ATOM 853 CB LYS A 60 22.220 -15.729 15.403 1.00 0.00 C ATOM 854 CG LYS A 60 23.082 -16.713 14.595 1.00 0.00 C ATOM 855 CD LYS A 60 23.828 -17.711 15.501 1.00 0.00 C ATOM 856 CE LYS A 60 24.714 -17.066 16.585 1.00 0.00 C ATOM 857 NZ LYS A 60 25.918 -16.398 16.038 1.00 0.00 N ATOM 0 H LYS A 60 22.200 -14.279 12.705 1.00 0.00 H new ATOM 0 HA LYS A 60 20.708 -15.322 13.898 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.873 -15.145 16.051 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.555 -16.300 16.051 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.448 -17.261 13.898 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.804 -16.156 13.999 1.00 0.00 H new ATOM 0 HD2 LYS A 60 23.096 -18.356 15.987 1.00 0.00 H new ATOM 0 HD3 LYS A 60 24.451 -18.351 14.876 1.00 0.00 H new ATOM 0 HE2 LYS A 60 24.124 -16.337 17.140 1.00 0.00 H new ATOM 0 HE3 LYS A 60 25.024 -17.833 17.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.192 -15.612 16.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 26.699 -17.083 15.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 25.709 -16.030 15.088 1.00 0.00 H new ATOM 871 N SER A 61 20.143 -12.672 15.093 1.00 0.00 N ATOM 872 CA SER A 61 19.463 -11.731 15.978 1.00 0.00 C ATOM 873 C SER A 61 18.036 -11.416 15.526 1.00 0.00 C ATOM 874 O SER A 61 17.646 -11.697 14.394 1.00 0.00 O ATOM 875 CB SER A 61 20.317 -10.466 16.094 1.00 0.00 C ATOM 876 OG SER A 61 21.587 -10.768 16.651 1.00 0.00 O ATOM 0 H SER A 61 20.377 -12.282 14.180 1.00 0.00 H new ATOM 0 HA SER A 61 19.355 -12.192 16.960 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.444 -10.015 15.110 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.806 -9.732 16.717 1.00 0.00 H new ATOM 0 HG SER A 61 22.098 -11.318 16.021 1.00 0.00 H new ATOM 882 N GLN A 62 17.244 -10.837 16.427 1.00 0.00 N ATOM 883 CA GLN A 62 15.849 -10.480 16.234 1.00 0.00 C ATOM 884 C GLN A 62 15.746 -9.013 16.645 1.00 0.00 C ATOM 885 O GLN A 62 16.159 -8.649 17.749 1.00 0.00 O ATOM 886 CB GLN A 62 14.931 -11.394 17.067 1.00 0.00 C ATOM 887 CG GLN A 62 14.984 -12.883 16.664 1.00 0.00 C ATOM 888 CD GLN A 62 16.215 -13.626 17.203 1.00 0.00 C ATOM 889 OE1 GLN A 62 16.456 -13.681 18.405 1.00 0.00 O ATOM 890 NE2 GLN A 62 17.023 -14.211 16.331 1.00 0.00 N ATOM 0 H GLN A 62 17.581 -10.594 17.359 1.00 0.00 H new ATOM 0 HA GLN A 62 15.524 -10.613 15.202 1.00 0.00 H new ATOM 0 HB2 GLN A 62 15.205 -11.304 18.118 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.904 -11.041 16.974 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.084 -13.380 17.025 1.00 0.00 H new ATOM 0 HG3 GLN A 62 14.974 -12.956 15.577 1.00 0.00 H new ATOM 0 HE21 GLN A 62 16.818 -14.162 15.333 1.00 0.00 H new ATOM 0 HE22 GLN A 62 17.850 -14.710 16.658 1.00 0.00 H new ATOM 899 N VAL A 63 15.211 -8.173 15.766 1.00 0.00 N ATOM 900 CA VAL A 63 15.257 -6.723 15.896 1.00 0.00 C ATOM 901 C VAL A 63 13.844 -6.164 15.706 1.00 0.00 C ATOM 902 O VAL A 63 13.155 -6.562 14.765 1.00 0.00 O ATOM 903 CB VAL A 63 16.251 -6.215 14.825 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.407 -4.698 14.886 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.648 -6.851 14.941 1.00 0.00 C ATOM 0 H VAL A 63 14.724 -8.488 14.927 1.00 0.00 H new ATOM 0 HA VAL A 63 15.595 -6.395 16.879 1.00 0.00 H new ATOM 0 HB VAL A 63 15.817 -6.513 13.871 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.112 -4.374 14.121 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.440 -4.226 14.712 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.780 -4.410 15.869 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.296 -6.451 14.161 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.073 -6.621 15.918 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.566 -7.932 14.826 1.00 0.00 H new ATOM 915 N TYR A 64 13.408 -5.252 16.583 1.00 0.00 N ATOM 916 CA TYR A 64 12.036 -4.740 16.608 1.00 0.00 C ATOM 917 C TYR A 64 12.048 -3.249 16.967 1.00 0.00 C ATOM 918 O TYR A 64 12.627 -2.895 17.993 1.00 0.00 O ATOM 919 CB TYR A 64 11.286 -5.575 17.661 1.00 0.00 C ATOM 920 CG TYR A 64 9.827 -5.235 17.914 1.00 0.00 C ATOM 921 CD1 TYR A 64 9.487 -4.203 18.811 1.00 0.00 C ATOM 922 CD2 TYR A 64 8.811 -6.029 17.349 1.00 0.00 C ATOM 923 CE1 TYR A 64 8.144 -3.979 19.157 1.00 0.00 C ATOM 924 CE2 TYR A 64 7.463 -5.798 17.678 1.00 0.00 C ATOM 925 CZ TYR A 64 7.123 -4.771 18.587 1.00 0.00 C ATOM 926 OH TYR A 64 5.823 -4.543 18.933 1.00 0.00 O ATOM 0 H TYR A 64 14.006 -4.845 17.302 1.00 0.00 H new ATOM 0 HA TYR A 64 11.544 -4.826 15.639 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.341 -6.622 17.362 1.00 0.00 H new ATOM 0 HB3 TYR A 64 11.822 -5.485 18.606 1.00 0.00 H new ATOM 0 HD1 TYR A 64 10.262 -3.582 19.234 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.068 -6.820 16.659 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.892 -3.199 19.860 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.688 -6.406 17.236 1.00 0.00 H new ATOM 0 HH TYR A 64 5.242 -5.170 18.454 1.00 0.00 H new ATOM 936 N LEU A 65 11.405 -2.368 16.184 1.00 0.00 N ATOM 937 CA LEU A 65 11.345 -0.912 16.433 1.00 0.00 C ATOM 938 C LEU A 65 12.700 -0.288 16.844 1.00 0.00 C ATOM 939 O LEU A 65 12.742 0.632 17.664 1.00 0.00 O ATOM 940 CB LEU A 65 10.220 -0.580 17.445 1.00 0.00 C ATOM 941 CG LEU A 65 8.782 -0.771 16.932 1.00 0.00 C ATOM 942 CD1 LEU A 65 7.790 -0.530 18.078 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.432 0.212 15.808 1.00 0.00 C ATOM 0 H LEU A 65 10.901 -2.650 15.343 1.00 0.00 H new ATOM 0 HA LEU A 65 11.103 -0.445 15.478 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.356 -1.203 18.329 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.338 0.456 17.764 1.00 0.00 H new ATOM 0 HG LEU A 65 8.716 -1.789 16.549 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.772 -0.666 17.713 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.984 -1.239 18.883 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.908 0.486 18.454 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.407 0.038 15.479 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.527 1.234 16.176 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.113 0.063 14.970 1.00 0.00 H new ATOM 955 N THR A 66 13.816 -0.775 16.303 1.00 0.00 N ATOM 956 CA THR A 66 15.164 -0.439 16.754 1.00 0.00 C ATOM 957 C THR A 66 15.923 0.314 15.651 1.00 0.00 C ATOM 958 O THR A 66 15.575 0.243 14.469 1.00 0.00 O ATOM 959 CB THR A 66 15.815 -1.755 17.228 1.00 0.00 C ATOM 960 OG1 THR A 66 15.200 -2.143 18.444 1.00 0.00 O ATOM 961 CG2 THR A 66 17.327 -1.739 17.475 1.00 0.00 C ATOM 0 H THR A 66 13.807 -1.429 15.521 1.00 0.00 H new ATOM 0 HA THR A 66 15.172 0.254 17.595 1.00 0.00 H new ATOM 0 HB THR A 66 15.662 -2.443 16.397 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.264 -2.380 18.276 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.652 -2.726 17.803 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.844 -1.475 16.552 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.562 -1.005 18.245 1.00 0.00 H new ATOM 969 N THR A 67 16.968 1.047 16.037 1.00 0.00 N ATOM 970 CA THR A 67 17.798 1.824 15.128 1.00 0.00 C ATOM 971 C THR A 67 19.252 1.393 15.333 1.00 0.00 C ATOM 972 O THR A 67 19.745 1.410 16.463 1.00 0.00 O ATOM 973 CB THR A 67 17.577 3.327 15.383 1.00 0.00 C ATOM 974 OG1 THR A 67 16.196 3.647 15.342 1.00 0.00 O ATOM 975 CG2 THR A 67 18.287 4.192 14.336 1.00 0.00 C ATOM 0 H THR A 67 17.264 1.116 17.011 1.00 0.00 H new ATOM 0 HA THR A 67 17.531 1.643 14.087 1.00 0.00 H new ATOM 0 HB THR A 67 17.990 3.536 16.370 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.077 4.606 15.508 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.107 5.245 14.551 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.358 3.994 14.366 1.00 0.00 H new ATOM 0 HG23 THR A 67 17.902 3.953 13.345 1.00 0.00 H new ATOM 983 N CYS A 68 19.934 1.019 14.250 1.00 0.00 N ATOM 984 CA CYS A 68 21.300 0.524 14.259 1.00 0.00 C ATOM 985 C CYS A 68 22.129 1.405 13.335 1.00 0.00 C ATOM 986 O CYS A 68 21.773 1.570 12.166 1.00 0.00 O ATOM 987 CB CYS A 68 21.320 -0.940 13.788 1.00 0.00 C ATOM 988 SG CYS A 68 22.924 -1.772 13.921 1.00 0.00 S ATOM 0 H CYS A 68 19.532 1.056 13.313 1.00 0.00 H new ATOM 0 HA CYS A 68 21.719 0.559 15.265 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.588 -1.502 14.369 1.00 0.00 H new ATOM 0 HB3 CYS A 68 20.996 -0.975 12.748 1.00 0.00 H new ATOM 993 N THR A 69 23.240 1.940 13.840 1.00 0.00 N ATOM 994 CA THR A 69 24.168 2.751 13.068 1.00 0.00 C ATOM 995 C THR A 69 25.577 2.262 13.397 1.00 0.00 C ATOM 996 O THR A 69 25.987 2.308 14.559 1.00 0.00 O ATOM 997 CB THR A 69 23.976 4.240 13.416 1.00 0.00 C ATOM 998 OG1 THR A 69 22.611 4.616 13.347 1.00 0.00 O ATOM 999 CG2 THR A 69 24.758 5.148 12.461 1.00 0.00 C ATOM 0 H THR A 69 23.521 1.817 14.813 1.00 0.00 H new ATOM 0 HA THR A 69 23.992 2.654 11.997 1.00 0.00 H new ATOM 0 HB THR A 69 24.348 4.363 14.433 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.521 5.565 13.574 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.598 6.190 12.737 1.00 0.00 H new ATOM 0 HG22 THR A 69 25.821 4.914 12.525 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.412 4.986 11.440 1.00 0.00 H new ATOM 1007 N GLY A 70 26.317 1.770 12.401 1.00 0.00 N ATOM 1008 CA GLY A 70 27.715 1.380 12.559 1.00 0.00 C ATOM 1009 C GLY A 70 27.926 0.346 13.669 1.00 0.00 C ATOM 1010 O GLY A 70 28.962 0.380 14.330 1.00 0.00 O ATOM 0 H GLY A 70 25.958 1.631 11.456 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.082 0.973 11.617 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.311 2.266 12.777 1.00 0.00 H new ATOM 1014 N SER A 71 26.946 -0.528 13.914 1.00 0.00 N ATOM 1015 CA SER A 71 26.914 -1.415 15.071 1.00 0.00 C ATOM 1016 C SER A 71 26.752 -2.873 14.642 1.00 0.00 C ATOM 1017 O SER A 71 26.503 -3.173 13.475 1.00 0.00 O ATOM 1018 CB SER A 71 25.808 -0.959 16.031 1.00 0.00 C ATOM 1019 OG SER A 71 26.087 0.343 16.505 1.00 0.00 O ATOM 0 H SER A 71 26.139 -0.638 13.300 1.00 0.00 H new ATOM 0 HA SER A 71 27.865 -1.358 15.600 1.00 0.00 H new ATOM 0 HB2 SER A 71 24.845 -0.971 15.521 1.00 0.00 H new ATOM 0 HB3 SER A 71 25.734 -1.652 16.869 1.00 0.00 H new ATOM 0 HG SER A 71 26.034 0.980 15.762 1.00 0.00 H new ATOM 1025 N GLN A 72 26.917 -3.802 15.577 1.00 0.00 N ATOM 1026 CA GLN A 72 27.013 -5.215 15.283 1.00 0.00 C ATOM 1027 C GLN A 72 26.244 -5.994 16.339 1.00 0.00 C ATOM 1028 O GLN A 72 26.457 -5.777 17.533 1.00 0.00 O ATOM 1029 CB GLN A 72 28.506 -5.565 15.230 1.00 0.00 C ATOM 1030 CG GLN A 72 28.805 -7.064 15.156 1.00 0.00 C ATOM 1031 CD GLN A 72 30.262 -7.310 14.771 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.536 -7.929 13.745 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.220 -6.825 15.548 1.00 0.00 N ATOM 0 H GLN A 72 26.988 -3.585 16.571 1.00 0.00 H new ATOM 0 HA GLN A 72 26.567 -5.478 14.324 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.950 -5.076 14.363 1.00 0.00 H new ATOM 0 HB3 GLN A 72 28.994 -5.153 16.113 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.596 -7.529 16.119 1.00 0.00 H new ATOM 0 HG3 GLN A 72 28.147 -7.535 14.425 1.00 0.00 H new ATOM 0 HE21 GLN A 72 30.978 -6.313 16.397 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.199 -6.963 15.297 1.00 0.00 H new ATOM 1042 N TYR A 73 25.369 -6.903 15.908 1.00 0.00 N ATOM 1043 CA TYR A 73 24.574 -7.744 16.800 1.00 0.00 C ATOM 1044 C TYR A 73 24.925 -9.196 16.498 1.00 0.00 C ATOM 1045 O TYR A 73 25.059 -9.561 15.329 1.00 0.00 O ATOM 1046 CB TYR A 73 23.065 -7.556 16.570 1.00 0.00 C ATOM 1047 CG TYR A 73 22.436 -6.174 16.692 1.00 0.00 C ATOM 1048 CD1 TYR A 73 23.093 -5.090 17.307 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.137 -5.986 16.177 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.491 -3.821 17.339 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.524 -4.723 16.216 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.202 -3.630 16.790 1.00 0.00 C ATOM 1053 OH TYR A 73 20.597 -2.414 16.819 1.00 0.00 O ATOM 0 H TYR A 73 25.191 -7.077 14.919 1.00 0.00 H new ATOM 0 HA TYR A 73 24.797 -7.470 17.831 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.843 -7.925 15.569 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.547 -8.209 17.272 1.00 0.00 H new ATOM 0 HD1 TYR A 73 24.064 -5.235 17.756 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.607 -6.823 15.747 1.00 0.00 H new ATOM 0 HE1 TYR A 73 23.015 -2.988 17.785 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.534 -4.590 15.806 1.00 0.00 H new ATOM 0 HH TYR A 73 19.832 -2.414 16.206 1.00 0.00 H new ATOM 1063 N ASN A 74 25.039 -10.029 17.529 1.00 0.00 N ATOM 1064 CA ASN A 74 25.315 -11.453 17.388 1.00 0.00 C ATOM 1065 C ASN A 74 24.484 -12.231 18.417 1.00 0.00 C ATOM 1066 O ASN A 74 24.798 -12.224 19.607 1.00 0.00 O ATOM 1067 CB ASN A 74 26.823 -11.683 17.583 1.00 0.00 C ATOM 1068 CG ASN A 74 27.178 -13.104 18.018 1.00 0.00 C ATOM 1069 OD1 ASN A 74 26.686 -14.089 17.473 1.00 0.00 O ATOM 1070 ND2 ASN A 74 28.042 -13.233 19.011 1.00 0.00 N ATOM 0 H ASN A 74 24.941 -9.728 18.499 1.00 0.00 H new ATOM 0 HA ASN A 74 25.038 -11.809 16.396 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.339 -11.459 16.649 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.195 -10.981 18.329 1.00 0.00 H new ATOM 0 HD21 ASN A 74 28.310 -14.162 19.336 1.00 0.00 H new ATOM 0 HD22 ASN A 74 28.440 -12.404 19.451 1.00 0.00 H new ATOM 1077 N GLY A 75 23.430 -12.911 17.968 1.00 0.00 N ATOM 1078 CA GLY A 75 22.584 -13.747 18.810 1.00 0.00 C ATOM 1079 C GLY A 75 21.811 -12.944 19.854 1.00 0.00 C ATOM 1080 O GLY A 75 21.801 -13.342 21.023 1.00 0.00 O ATOM 0 H GLY A 75 23.137 -12.894 16.991 1.00 0.00 H new ATOM 0 HA2 GLY A 75 21.879 -14.292 18.182 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.202 -14.490 19.314 1.00 0.00 H new ATOM 1084 N ILE A 76 21.196 -11.818 19.476 1.00 0.00 N ATOM 1085 CA ILE A 76 20.501 -10.943 20.423 1.00 0.00 C ATOM 1086 C ILE A 76 19.045 -10.732 20.004 1.00 0.00 C ATOM 1087 O ILE A 76 18.708 -10.801 18.826 1.00 0.00 O ATOM 1088 CB ILE A 76 21.247 -9.589 20.619 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.774 -8.464 19.662 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.781 -9.755 20.552 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.455 -7.110 19.889 1.00 0.00 C ATOM 0 H ILE A 76 21.167 -11.490 18.511 1.00 0.00 H new ATOM 0 HA ILE A 76 20.499 -11.442 21.392 1.00 0.00 H new ATOM 0 HB ILE A 76 20.979 -9.268 21.625 1.00 0.00 H new ATOM 0 HG12 ILE A 76 20.953 -8.779 18.634 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.697 -8.338 19.773 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.258 -8.785 20.694 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.108 -10.438 21.336 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.061 -10.158 19.579 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.065 -6.383 19.177 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.255 -6.768 20.904 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.531 -7.215 19.747 1.00 0.00 H new ATOM 1103 N TYR A 77 18.199 -10.395 20.969 1.00 0.00 N ATOM 1104 CA TYR A 77 16.846 -9.922 20.770 1.00 0.00 C ATOM 1105 C TYR A 77 16.889 -8.485 21.271 1.00 0.00 C ATOM 1106 O TYR A 77 17.334 -8.242 22.396 1.00 0.00 O ATOM 1107 CB TYR A 77 15.837 -10.768 21.555 1.00 0.00 C ATOM 1108 CG TYR A 77 14.486 -10.092 21.738 1.00 0.00 C ATOM 1109 CD1 TYR A 77 13.775 -9.599 20.624 1.00 0.00 C ATOM 1110 CD2 TYR A 77 13.964 -9.908 23.034 1.00 0.00 C ATOM 1111 CE1 TYR A 77 12.555 -8.924 20.803 1.00 0.00 C ATOM 1112 CE2 TYR A 77 12.738 -9.244 23.219 1.00 0.00 C ATOM 1113 CZ TYR A 77 12.026 -8.748 22.102 1.00 0.00 C ATOM 1114 OH TYR A 77 10.832 -8.110 22.263 1.00 0.00 O ATOM 0 H TYR A 77 18.455 -10.448 21.955 1.00 0.00 H new ATOM 0 HA TYR A 77 16.522 -9.991 19.731 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.692 -11.717 21.039 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.254 -10.999 22.535 1.00 0.00 H new ATOM 0 HD1 TYR A 77 14.170 -9.741 19.629 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.508 -10.279 23.890 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.021 -8.539 19.947 1.00 0.00 H new ATOM 0 HE2 TYR A 77 12.340 -9.113 24.214 1.00 0.00 H new ATOM 0 HH TYR A 77 10.608 -8.072 23.216 1.00 0.00 H new ATOM 1124 N ILE A 78 16.475 -7.529 20.447 1.00 0.00 N ATOM 1125 CA ILE A 78 16.550 -6.118 20.783 1.00 0.00 C ATOM 1126 C ILE A 78 15.266 -5.438 20.323 1.00 0.00 C ATOM 1127 O ILE A 78 14.849 -5.590 19.166 1.00 0.00 O ATOM 1128 CB ILE A 78 17.858 -5.505 20.232 1.00 0.00 C ATOM 1129 CG1 ILE A 78 17.965 -4.024 20.648 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.033 -5.686 18.713 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.379 -3.449 20.485 1.00 0.00 C ATOM 0 H ILE A 78 16.078 -7.714 19.526 1.00 0.00 H new ATOM 0 HA ILE A 78 16.608 -5.962 21.860 1.00 0.00 H new ATOM 0 HB ILE A 78 18.682 -6.060 20.680 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.269 -3.435 20.051 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.657 -3.923 21.689 1.00 0.00 H new ATOM 0 HG21 ILE A 78 18.972 -5.231 18.398 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.046 -6.749 18.472 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.205 -5.206 18.192 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.385 -2.404 20.795 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.075 -4.015 21.104 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.682 -3.519 19.440 1.00 0.00 H new ATOM 1143 N ARG A 79 14.630 -4.700 21.241 1.00 0.00 N ATOM 1144 CA ARG A 79 13.411 -3.966 20.940 1.00 0.00 C ATOM 1145 C ARG A 79 13.514 -2.512 21.367 1.00 0.00 C ATOM 1146 O ARG A 79 14.080 -2.199 22.420 1.00 0.00 O ATOM 1147 CB ARG A 79 12.162 -4.657 21.517 1.00 0.00 C ATOM 1148 CG ARG A 79 12.124 -4.780 23.050 1.00 0.00 C ATOM 1149 CD ARG A 79 10.692 -4.749 23.598 1.00 0.00 C ATOM 1150 NE ARG A 79 10.081 -3.414 23.424 1.00 0.00 N ATOM 1151 CZ ARG A 79 9.010 -2.937 24.067 1.00 0.00 C ATOM 1152 NH1 ARG A 79 8.359 -3.674 24.964 1.00 0.00 N ATOM 1153 NH2 ARG A 79 8.607 -1.703 23.789 1.00 0.00 N ATOM 0 H ARG A 79 14.949 -4.600 22.205 1.00 0.00 H new ATOM 0 HA ARG A 79 13.292 -3.971 19.857 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.280 -4.105 21.192 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.089 -5.656 21.088 1.00 0.00 H new ATOM 0 HG2 ARG A 79 12.606 -5.710 23.350 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.698 -3.966 23.493 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.088 -5.498 23.086 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.699 -5.014 24.655 1.00 0.00 H new ATOM 0 HE ARG A 79 10.521 -2.794 22.744 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.675 -4.621 25.172 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.544 -3.291 25.444 1.00 0.00 H new ATOM 0 HH21 ARG A 79 9.111 -1.145 23.100 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.793 -1.313 24.264 1.00 0.00 H new ATOM 1167 N SER A 80 12.900 -1.634 20.578 1.00 0.00 N ATOM 1168 CA SER A 80 12.686 -0.228 20.901 1.00 0.00 C ATOM 1169 C SER A 80 13.978 0.520 21.286 1.00 0.00 C ATOM 1170 O SER A 80 13.915 1.487 22.047 1.00 0.00 O ATOM 1171 CB SER A 80 11.606 -0.156 21.991 1.00 0.00 C ATOM 1172 OG SER A 80 10.508 -1.021 21.707 1.00 0.00 O ATOM 0 H SER A 80 12.525 -1.892 19.665 1.00 0.00 H new ATOM 0 HA SER A 80 12.345 0.295 20.008 1.00 0.00 H new ATOM 0 HB2 SER A 80 12.042 -0.426 22.953 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.247 0.869 22.080 1.00 0.00 H new ATOM 0 HG SER A 80 9.734 -0.487 21.431 1.00 0.00 H new ATOM 1178 N SER A 81 15.146 0.087 20.795 1.00 0.00 N ATOM 1179 CA SER A 81 16.449 0.567 21.258 1.00 0.00 C ATOM 1180 C SER A 81 17.231 1.279 20.145 1.00 0.00 C ATOM 1181 O SER A 81 16.822 1.280 18.982 1.00 0.00 O ATOM 1182 CB SER A 81 17.229 -0.631 21.814 1.00 0.00 C ATOM 1183 OG SER A 81 16.564 -1.208 22.928 1.00 0.00 O ATOM 0 H SER A 81 15.211 -0.614 20.057 1.00 0.00 H new ATOM 0 HA SER A 81 16.302 1.311 22.041 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.353 -1.381 21.033 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.228 -0.311 22.110 1.00 0.00 H new ATOM 0 HG SER A 81 15.757 -1.673 22.622 1.00 0.00 H new ATOM 1189 N THR A 82 18.374 1.871 20.499 1.00 0.00 N ATOM 1190 CA THR A 82 19.261 2.568 19.574 1.00 0.00 C ATOM 1191 C THR A 82 20.697 2.126 19.864 1.00 0.00 C ATOM 1192 O THR A 82 21.111 2.068 21.025 1.00 0.00 O ATOM 1193 CB THR A 82 19.078 4.090 19.736 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.718 4.457 19.583 1.00 0.00 O ATOM 1195 CG2 THR A 82 19.889 4.888 18.707 1.00 0.00 C ATOM 0 H THR A 82 18.714 1.877 21.461 1.00 0.00 H new ATOM 0 HA THR A 82 19.025 2.322 18.539 1.00 0.00 H new ATOM 0 HB THR A 82 19.433 4.326 20.739 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.627 5.427 19.691 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.726 5.954 18.863 1.00 0.00 H new ATOM 0 HG22 THR A 82 20.949 4.662 18.824 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.569 4.616 17.701 1.00 0.00 H new ATOM 1203 N THR A 83 21.473 1.824 18.825 1.00 0.00 N ATOM 1204 CA THR A 83 22.834 1.331 18.971 1.00 0.00 C ATOM 1205 C THR A 83 23.714 2.075 17.965 1.00 0.00 C ATOM 1206 O THR A 83 23.396 2.092 16.769 1.00 0.00 O ATOM 1207 CB THR A 83 22.847 -0.198 18.782 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.371 -0.543 17.502 1.00 0.00 O ATOM 1209 CG2 THR A 83 21.962 -0.933 19.796 1.00 0.00 C ATOM 0 H THR A 83 21.171 1.916 17.855 1.00 0.00 H new ATOM 0 HA THR A 83 23.232 1.520 19.968 1.00 0.00 H new ATOM 0 HB THR A 83 23.885 -0.499 18.922 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.824 -1.354 17.564 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.012 -2.006 19.612 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.313 -0.721 20.806 1.00 0.00 H new ATOM 0 HG23 THR A 83 20.931 -0.595 19.691 1.00 0.00 H new ATOM 1217 N THR A 84 24.794 2.697 18.440 1.00 0.00 N ATOM 1218 CA THR A 84 25.651 3.546 17.623 1.00 0.00 C ATOM 1219 C THR A 84 27.105 3.147 17.874 1.00 0.00 C ATOM 1220 O THR A 84 27.578 3.224 19.007 1.00 0.00 O ATOM 1221 CB THR A 84 25.389 5.028 17.958 1.00 0.00 C ATOM 1222 OG1 THR A 84 24.001 5.319 17.961 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.057 5.961 16.940 1.00 0.00 C ATOM 0 H THR A 84 25.098 2.623 19.411 1.00 0.00 H new ATOM 0 HA THR A 84 25.434 3.414 16.563 1.00 0.00 H new ATOM 0 HB THR A 84 25.810 5.195 18.949 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.866 6.265 18.178 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.852 6.998 17.207 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.134 5.792 16.943 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.661 5.757 15.945 1.00 0.00 H new ATOM 1231 N GLY A 85 27.831 2.731 16.835 1.00 0.00 N ATOM 1232 CA GLY A 85 29.233 2.360 16.955 1.00 0.00 C ATOM 1233 C GLY A 85 29.481 1.301 18.028 1.00 0.00 C ATOM 1234 O GLY A 85 30.400 1.499 18.814 1.00 0.00 O ATOM 0 H GLY A 85 27.459 2.643 15.889 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.588 1.986 15.995 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.820 3.249 17.187 1.00 0.00 H new ATOM 1238 N THR A 86 28.690 0.229 18.137 1.00 0.00 N ATOM 1239 CA THR A 86 28.813 -0.714 19.253 1.00 0.00 C ATOM 1240 C THR A 86 28.637 -2.162 18.778 1.00 0.00 C ATOM 1241 O THR A 86 27.913 -2.414 17.817 1.00 0.00 O ATOM 1242 CB THR A 86 27.810 -0.277 20.342 1.00 0.00 C ATOM 1243 OG1 THR A 86 28.139 -0.817 21.605 1.00 0.00 O ATOM 1244 CG2 THR A 86 26.342 -0.564 20.029 1.00 0.00 C ATOM 0 H THR A 86 27.958 -0.007 17.467 1.00 0.00 H new ATOM 0 HA THR A 86 29.814 -0.693 19.684 1.00 0.00 H new ATOM 0 HB THR A 86 27.909 0.808 20.362 1.00 0.00 H new ATOM 0 HG1 THR A 86 27.475 -1.493 21.855 1.00 0.00 H new ATOM 0 HG21 THR A 86 25.720 -0.220 20.855 1.00 0.00 H new ATOM 0 HG22 THR A 86 26.056 -0.041 19.117 1.00 0.00 H new ATOM 0 HG23 THR A 86 26.202 -1.636 19.892 1.00 0.00 H new ATOM 1252 N SER A 87 29.264 -3.120 19.459 1.00 0.00 N ATOM 1253 CA SER A 87 29.063 -4.548 19.246 1.00 0.00 C ATOM 1254 C SER A 87 28.316 -5.116 20.451 1.00 0.00 C ATOM 1255 O SER A 87 28.524 -4.673 21.586 1.00 0.00 O ATOM 1256 CB SER A 87 30.405 -5.262 19.071 1.00 0.00 C ATOM 1257 OG SER A 87 31.047 -4.899 17.868 1.00 0.00 O ATOM 0 H SER A 87 29.943 -2.917 20.193 1.00 0.00 H new ATOM 0 HA SER A 87 28.481 -4.704 18.338 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.054 -5.024 19.914 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.246 -6.340 19.085 1.00 0.00 H new ATOM 0 HG SER A 87 31.758 -4.252 18.059 1.00 0.00 H new ATOM 1263 N ILE A 88 27.447 -6.098 20.203 1.00 0.00 N ATOM 1264 CA ILE A 88 26.574 -6.709 21.191 1.00 0.00 C ATOM 1265 C ILE A 88 26.508 -8.201 20.852 1.00 0.00 C ATOM 1266 O ILE A 88 26.252 -8.566 19.700 1.00 0.00 O ATOM 1267 CB ILE A 88 25.162 -6.072 21.149 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.188 -4.524 21.104 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.333 -6.573 22.346 1.00 0.00 C ATOM 1270 CD1 ILE A 88 23.809 -3.860 21.135 1.00 0.00 C ATOM 0 H ILE A 88 27.333 -6.500 19.273 1.00 0.00 H new ATOM 0 HA ILE A 88 26.958 -6.554 22.199 1.00 0.00 H new ATOM 0 HB ILE A 88 24.694 -6.388 20.217 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.771 -4.159 21.950 1.00 0.00 H new ATOM 0 HG13 ILE A 88 25.708 -4.209 20.199 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.340 -6.124 22.315 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.242 -7.658 22.297 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.829 -6.292 23.275 1.00 0.00 H new ATOM 0 HD11 ILE A 88 23.926 -2.777 21.100 1.00 0.00 H new ATOM 0 HD12 ILE A 88 23.227 -4.190 20.275 1.00 0.00 H new ATOM 0 HD13 ILE A 88 23.291 -4.140 22.052 1.00 0.00 H new ATOM 1282 N SER A 89 26.709 -9.053 21.854 1.00 0.00 N ATOM 1283 CA SER A 89 26.675 -10.505 21.731 1.00 0.00 C ATOM 1284 C SER A 89 25.927 -11.113 22.920 1.00 0.00 C ATOM 1285 O SER A 89 25.684 -10.435 23.920 1.00 0.00 O ATOM 1286 CB SER A 89 28.107 -11.053 21.659 1.00 0.00 C ATOM 1287 OG SER A 89 28.725 -10.720 20.426 1.00 0.00 O ATOM 0 H SER A 89 26.906 -8.740 22.804 1.00 0.00 H new ATOM 0 HA SER A 89 26.149 -10.777 20.816 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.695 -10.650 22.484 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.091 -12.136 21.779 1.00 0.00 H new ATOM 0 HG SER A 89 29.636 -11.080 20.409 1.00 0.00 H new ATOM 1293 N GLY A 90 25.587 -12.400 22.823 1.00 0.00 N ATOM 1294 CA GLY A 90 25.072 -13.195 23.932 1.00 0.00 C ATOM 1295 C GLY A 90 25.728 -14.577 23.876 1.00 0.00 C ATOM 1296 O GLY A 90 26.793 -14.739 24.477 1.00 0.00 O ATOM 0 H GLY A 90 25.665 -12.926 21.953 1.00 0.00 H new ATOM 0 HA2 GLY A 90 25.291 -12.708 24.882 1.00 0.00 H new ATOM 0 HA3 GLY A 90 23.988 -13.286 23.863 1.00 0.00 H new ATOM 1300 N PRO A 91 25.190 -15.546 23.111 1.00 0.00 N ATOM 1301 CA PRO A 91 23.888 -15.501 22.453 1.00 0.00 C ATOM 1302 C PRO A 91 22.749 -15.620 23.484 1.00 0.00 C ATOM 1303 O PRO A 91 22.977 -15.961 24.647 1.00 0.00 O ATOM 1304 CB PRO A 91 23.897 -16.681 21.475 1.00 0.00 C ATOM 1305 CG PRO A 91 24.789 -17.707 22.172 1.00 0.00 C ATOM 1306 CD PRO A 91 25.828 -16.835 22.877 1.00 0.00 C ATOM 0 HA PRO A 91 23.717 -14.557 21.935 1.00 0.00 H new ATOM 0 HB2 PRO A 91 22.893 -17.070 21.305 1.00 0.00 H new ATOM 0 HB3 PRO A 91 24.297 -16.395 20.502 1.00 0.00 H new ATOM 0 HG2 PRO A 91 24.227 -18.317 22.879 1.00 0.00 H new ATOM 0 HG3 PRO A 91 25.252 -18.390 21.460 1.00 0.00 H new ATOM 0 HD2 PRO A 91 26.143 -17.289 23.817 1.00 0.00 H new ATOM 0 HD3 PRO A 91 26.721 -16.721 22.263 1.00 0.00 H new ATOM 1314 N GLY A 92 21.519 -15.325 23.057 1.00 0.00 N ATOM 1315 CA GLY A 92 20.354 -15.257 23.939 1.00 0.00 C ATOM 1316 C GLY A 92 20.302 -13.929 24.701 1.00 0.00 C ATOM 1317 O GLY A 92 19.588 -13.813 25.700 1.00 0.00 O ATOM 0 H GLY A 92 21.303 -15.125 22.080 1.00 0.00 H new ATOM 0 HA2 GLY A 92 19.444 -15.376 23.351 1.00 0.00 H new ATOM 0 HA3 GLY A 92 20.385 -16.084 24.649 1.00 0.00 H new ATOM 1321 N CYS A 93 21.073 -12.934 24.249 1.00 0.00 N ATOM 1322 CA CYS A 93 21.049 -11.581 24.780 1.00 0.00 C ATOM 1323 C CYS A 93 19.674 -10.973 24.510 1.00 0.00 C ATOM 1324 O CYS A 93 19.075 -11.236 23.468 1.00 0.00 O ATOM 1325 CB CYS A 93 22.188 -10.798 24.113 1.00 0.00 C ATOM 1326 SG CYS A 93 22.161 -8.993 24.228 1.00 0.00 S ATOM 0 H CYS A 93 21.742 -13.057 23.489 1.00 0.00 H new ATOM 0 HA CYS A 93 21.205 -11.556 25.858 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.128 -11.146 24.542 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.202 -11.065 23.056 1.00 0.00 H new ATOM 1331 N SER A 94 19.189 -10.152 25.433 1.00 0.00 N ATOM 1332 CA SER A 94 17.866 -9.558 25.415 1.00 0.00 C ATOM 1333 C SER A 94 18.013 -8.104 25.858 1.00 0.00 C ATOM 1334 O SER A 94 18.607 -7.845 26.907 1.00 0.00 O ATOM 1335 CB SER A 94 16.979 -10.348 26.381 1.00 0.00 C ATOM 1336 OG SER A 94 16.752 -11.667 25.911 1.00 0.00 O ATOM 0 H SER A 94 19.734 -9.872 26.249 1.00 0.00 H new ATOM 0 HA SER A 94 17.411 -9.586 24.425 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.451 -10.386 27.363 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.025 -9.835 26.505 1.00 0.00 H new ATOM 0 HG SER A 94 16.184 -12.148 26.548 1.00 0.00 H new ATOM 1342 N ILE A 95 17.510 -7.162 25.055 1.00 0.00 N ATOM 1343 CA ILE A 95 17.661 -5.726 25.267 1.00 0.00 C ATOM 1344 C ILE A 95 16.321 -5.058 24.958 1.00 0.00 C ATOM 1345 O ILE A 95 15.694 -5.368 23.938 1.00 0.00 O ATOM 1346 CB ILE A 95 18.801 -5.160 24.379 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.118 -5.917 24.660 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.974 -3.640 24.589 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.382 -5.340 24.024 1.00 0.00 C ATOM 0 H ILE A 95 16.973 -7.387 24.218 1.00 0.00 H new ATOM 0 HA ILE A 95 17.937 -5.521 26.301 1.00 0.00 H new ATOM 0 HB ILE A 95 18.531 -5.312 23.334 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.266 -5.956 25.739 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.001 -6.945 24.317 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.780 -3.274 23.953 1.00 0.00 H new ATOM 0 HG22 ILE A 95 18.047 -3.129 24.330 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.217 -3.442 25.633 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.239 -5.957 24.293 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.270 -5.327 22.940 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.539 -4.323 24.385 1.00 0.00 H new ATOM 1361 N SER A 96 15.923 -4.096 25.791 1.00 0.00 N ATOM 1362 CA SER A 96 14.725 -3.303 25.575 1.00 0.00 C ATOM 1363 C SER A 96 14.992 -1.844 25.925 1.00 0.00 C ATOM 1364 O SER A 96 15.663 -1.558 26.923 1.00 0.00 O ATOM 1365 CB SER A 96 13.559 -3.847 26.413 1.00 0.00 C ATOM 1366 OG SER A 96 13.337 -5.230 26.181 1.00 0.00 O ATOM 0 H SER A 96 16.431 -3.848 26.640 1.00 0.00 H new ATOM 0 HA SER A 96 14.451 -3.368 24.522 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.767 -3.686 27.471 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.652 -3.290 26.177 1.00 0.00 H new ATOM 0 HG SER A 96 12.589 -5.538 26.733 1.00 0.00 H new ATOM 1372 N THR A 97 14.418 -0.949 25.112 1.00 0.00 N ATOM 1373 CA THR A 97 14.339 0.498 25.333 1.00 0.00 C ATOM 1374 C THR A 97 15.678 1.143 25.752 1.00 0.00 C ATOM 1375 O THR A 97 15.703 2.103 26.527 1.00 0.00 O ATOM 1376 CB THR A 97 13.123 0.834 26.233 1.00 0.00 C ATOM 1377 OG1 THR A 97 13.006 -0.026 27.348 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.803 0.689 25.471 1.00 0.00 C ATOM 0 H THR A 97 13.974 -1.230 24.238 1.00 0.00 H new ATOM 0 HA THR A 97 14.152 0.980 24.374 1.00 0.00 H new ATOM 0 HB THR A 97 13.302 1.860 26.556 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.798 0.068 27.918 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.972 0.932 26.133 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.799 1.368 24.618 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.697 -0.337 25.118 1.00 0.00 H new ATOM 1386 N CYS A 98 16.801 0.628 25.241 1.00 0.00 N ATOM 1387 CA CYS A 98 18.140 1.037 25.644 1.00 0.00 C ATOM 1388 C CYS A 98 18.783 1.924 24.571 1.00 0.00 C ATOM 1389 O CYS A 98 18.349 1.947 23.417 1.00 0.00 O ATOM 1390 CB CYS A 98 18.981 -0.222 25.909 1.00 0.00 C ATOM 1391 SG CYS A 98 20.496 0.080 26.860 1.00 0.00 S ATOM 0 H CYS A 98 16.799 -0.097 24.524 1.00 0.00 H new ATOM 0 HA CYS A 98 18.086 1.629 26.557 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.369 -0.948 26.444 1.00 0.00 H new ATOM 0 HB3 CYS A 98 19.249 -0.673 24.954 1.00 0.00 H new ATOM 1396 N THR A 99 19.871 2.604 24.936 1.00 0.00 N ATOM 1397 CA THR A 99 20.740 3.329 24.021 1.00 0.00 C ATOM 1398 C THR A 99 22.155 2.845 24.341 1.00 0.00 C ATOM 1399 O THR A 99 22.524 2.817 25.519 1.00 0.00 O ATOM 1400 CB THR A 99 20.559 4.847 24.205 1.00 0.00 C ATOM 1401 OG1 THR A 99 19.197 5.205 24.049 1.00 0.00 O ATOM 1402 CG2 THR A 99 21.374 5.651 23.186 1.00 0.00 C ATOM 0 H THR A 99 20.177 2.664 25.907 1.00 0.00 H new ATOM 0 HA THR A 99 20.509 3.141 22.972 1.00 0.00 H new ATOM 0 HB THR A 99 20.910 5.081 25.210 1.00 0.00 H new ATOM 0 HG1 THR A 99 19.097 6.172 24.170 1.00 0.00 H new ATOM 0 HG21 THR A 99 21.216 6.716 23.353 1.00 0.00 H new ATOM 0 HG22 THR A 99 22.433 5.419 23.302 1.00 0.00 H new ATOM 0 HG23 THR A 99 21.054 5.391 22.177 1.00 0.00 H new ATOM 1410 N ILE A 100 22.930 2.413 23.345 1.00 0.00 N ATOM 1411 CA ILE A 100 24.211 1.737 23.571 1.00 0.00 C ATOM 1412 C ILE A 100 25.229 2.316 22.586 1.00 0.00 C ATOM 1413 O ILE A 100 24.922 2.467 21.399 1.00 0.00 O ATOM 1414 CB ILE A 100 24.047 0.200 23.426 1.00 0.00 C ATOM 1415 CG1 ILE A 100 22.875 -0.330 24.289 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.349 -0.538 23.796 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.645 -1.840 24.239 1.00 0.00 C ATOM 0 H ILE A 100 22.689 2.521 22.360 1.00 0.00 H new ATOM 0 HA ILE A 100 24.569 1.908 24.586 1.00 0.00 H new ATOM 0 HB ILE A 100 23.819 0.001 22.379 1.00 0.00 H new ATOM 0 HG12 ILE A 100 23.052 -0.042 25.325 1.00 0.00 H new ATOM 0 HG13 ILE A 100 21.960 0.169 23.971 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.203 -1.612 23.685 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.153 -0.211 23.136 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.614 -0.313 24.829 1.00 0.00 H new ATOM 0 HD11 ILE A 100 21.802 -2.101 24.879 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.430 -2.142 23.214 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.539 -2.356 24.589 1.00 0.00 H new ATOM 1429 N THR A 101 26.433 2.627 23.073 1.00 0.00 N ATOM 1430 CA THR A 101 27.480 3.268 22.289 1.00 0.00 C ATOM 1431 C THR A 101 28.836 2.668 22.670 1.00 0.00 C ATOM 1432 O THR A 101 29.138 2.553 23.857 1.00 0.00 O ATOM 1433 CB THR A 101 27.448 4.795 22.528 1.00 0.00 C ATOM 1434 OG1 THR A 101 26.134 5.320 22.430 1.00 0.00 O ATOM 1435 CG2 THR A 101 28.317 5.565 21.528 1.00 0.00 C ATOM 0 H THR A 101 26.707 2.436 24.037 1.00 0.00 H new ATOM 0 HA THR A 101 27.315 3.092 21.226 1.00 0.00 H new ATOM 0 HB THR A 101 27.838 4.928 23.537 1.00 0.00 H new ATOM 0 HG1 THR A 101 26.155 6.287 22.589 1.00 0.00 H new ATOM 0 HG21 THR A 101 28.258 6.632 21.741 1.00 0.00 H new ATOM 0 HG22 THR A 101 29.352 5.234 21.615 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.960 5.377 20.515 1.00 0.00 H new ATOM 1443 N ARG A 102 29.673 2.327 21.679 1.00 0.00 N ATOM 1444 CA ARG A 102 31.070 1.907 21.830 1.00 0.00 C ATOM 1445 C ARG A 102 31.328 0.904 22.968 1.00 0.00 C ATOM 1446 O ARG A 102 32.352 0.977 23.648 1.00 0.00 O ATOM 1447 CB ARG A 102 31.935 3.178 21.894 1.00 0.00 C ATOM 1448 CG ARG A 102 33.291 3.026 21.186 1.00 0.00 C ATOM 1449 CD ARG A 102 33.249 2.945 19.650 1.00 0.00 C ATOM 1450 NE ARG A 102 32.600 4.117 19.036 1.00 0.00 N ATOM 1451 CZ ARG A 102 32.401 4.300 17.724 1.00 0.00 C ATOM 1452 NH1 ARG A 102 32.841 3.417 16.831 1.00 0.00 N ATOM 1453 NH2 ARG A 102 31.749 5.381 17.306 1.00 0.00 N ATOM 0 H ARG A 102 29.377 2.338 20.703 1.00 0.00 H new ATOM 0 HA ARG A 102 31.356 1.316 20.960 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.387 4.005 21.442 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.105 3.441 22.938 1.00 0.00 H new ATOM 0 HG2 ARG A 102 33.921 3.870 21.468 1.00 0.00 H new ATOM 0 HG3 ARG A 102 33.776 2.126 21.564 1.00 0.00 H new ATOM 0 HD2 ARG A 102 34.266 2.856 19.267 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.716 2.042 19.352 1.00 0.00 H new ATOM 0 HE ARG A 102 32.274 4.852 19.664 1.00 0.00 H new ATOM 0 HH11 ARG A 102 33.340 2.583 17.141 1.00 0.00 H new ATOM 0 HH12 ARG A 102 32.680 3.574 15.836 1.00 0.00 H new ATOM 0 HH21 ARG A 102 31.405 6.063 17.982 1.00 0.00 H new ATOM 0 HH22 ARG A 102 31.593 5.529 16.309 1.00 0.00 H new ATOM 1467 N GLY A 103 30.411 -0.040 23.176 1.00 0.00 N ATOM 1468 CA GLY A 103 30.556 -1.110 24.152 1.00 0.00 C ATOM 1469 C GLY A 103 30.020 -0.744 25.535 1.00 0.00 C ATOM 1470 O GLY A 103 30.282 -1.481 26.486 1.00 0.00 O ATOM 0 H GLY A 103 29.532 -0.080 22.660 1.00 0.00 H new ATOM 0 HA2 GLY A 103 30.033 -1.995 23.790 1.00 0.00 H new ATOM 0 HA3 GLY A 103 31.610 -1.374 24.237 1.00 0.00 H new ATOM 1474 N VAL A 104 29.280 0.361 25.673 1.00 0.00 N ATOM 1475 CA VAL A 104 28.745 0.840 26.944 1.00 0.00 C ATOM 1476 C VAL A 104 27.250 1.123 26.747 1.00 0.00 C ATOM 1477 O VAL A 104 26.865 1.892 25.862 1.00 0.00 O ATOM 1478 CB VAL A 104 29.535 2.089 27.406 1.00 0.00 C ATOM 1479 CG1 VAL A 104 29.084 2.550 28.801 1.00 0.00 C ATOM 1480 CG2 VAL A 104 31.054 1.838 27.460 1.00 0.00 C ATOM 0 H VAL A 104 29.033 0.958 24.884 1.00 0.00 H new ATOM 0 HA VAL A 104 28.855 0.095 27.732 1.00 0.00 H new ATOM 0 HB VAL A 104 29.325 2.860 26.664 1.00 0.00 H new ATOM 0 HG11 VAL A 104 29.657 3.429 29.097 1.00 0.00 H new ATOM 0 HG12 VAL A 104 28.023 2.800 28.776 1.00 0.00 H new ATOM 0 HG13 VAL A 104 29.251 1.749 29.521 1.00 0.00 H new ATOM 0 HG21 VAL A 104 31.561 2.745 27.790 1.00 0.00 H new ATOM 0 HG22 VAL A 104 31.265 1.030 28.160 1.00 0.00 H new ATOM 0 HG23 VAL A 104 31.413 1.562 26.468 1.00 0.00 H new ATOM 1490 N ALA A 105 26.398 0.483 27.555 1.00 0.00 N ATOM 1491 CA ALA A 105 24.978 0.807 27.619 1.00 0.00 C ATOM 1492 C ALA A 105 24.793 2.086 28.440 1.00 0.00 C ATOM 1493 O ALA A 105 25.475 2.284 29.449 1.00 0.00 O ATOM 1494 CB ALA A 105 24.204 -0.356 28.250 1.00 0.00 C ATOM 0 H ALA A 105 26.678 -0.273 28.180 1.00 0.00 H new ATOM 0 HA ALA A 105 24.591 0.969 26.613 1.00 0.00 H new ATOM 0 HB1 ALA A 105 23.144 -0.106 28.294 1.00 0.00 H new ATOM 0 HB2 ALA A 105 24.340 -1.254 27.647 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.577 -0.536 29.258 1.00 0.00 H new ATOM 1500 N THR A 106 23.856 2.939 28.029 1.00 0.00 N ATOM 1501 CA THR A 106 23.506 4.151 28.764 1.00 0.00 C ATOM 1502 C THR A 106 22.800 3.729 30.067 1.00 0.00 C ATOM 1503 O THR A 106 21.883 2.906 30.005 1.00 0.00 O ATOM 1504 CB THR A 106 22.613 5.046 27.881 1.00 0.00 C ATOM 1505 OG1 THR A 106 23.215 5.235 26.614 1.00 0.00 O ATOM 1506 CG2 THR A 106 22.376 6.435 28.482 1.00 0.00 C ATOM 0 H THR A 106 23.317 2.807 27.173 1.00 0.00 H new ATOM 0 HA THR A 106 24.392 4.733 29.020 1.00 0.00 H new ATOM 0 HB THR A 106 21.657 4.529 27.802 1.00 0.00 H new ATOM 0 HG1 THR A 106 23.082 4.434 26.066 1.00 0.00 H new ATOM 0 HG21 THR A 106 21.741 7.017 27.814 1.00 0.00 H new ATOM 0 HG22 THR A 106 21.887 6.334 29.451 1.00 0.00 H new ATOM 0 HG23 THR A 106 23.331 6.944 28.609 1.00 0.00 H new ATOM 1514 N PRO A 107 23.159 4.285 31.240 1.00 0.00 N ATOM 1515 CA PRO A 107 22.602 3.886 32.535 1.00 0.00 C ATOM 1516 C PRO A 107 21.190 4.445 32.805 1.00 0.00 C ATOM 1517 O PRO A 107 20.759 4.525 33.958 1.00 0.00 O ATOM 1518 CB PRO A 107 23.636 4.367 33.561 1.00 0.00 C ATOM 1519 CG PRO A 107 24.199 5.629 32.916 1.00 0.00 C ATOM 1520 CD PRO A 107 24.228 5.255 31.437 1.00 0.00 C ATOM 0 HA PRO A 107 22.444 2.808 32.580 1.00 0.00 H new ATOM 0 HB2 PRO A 107 23.178 4.578 34.527 1.00 0.00 H new ATOM 0 HB3 PRO A 107 24.412 3.621 33.732 1.00 0.00 H new ATOM 0 HG2 PRO A 107 23.568 6.497 33.103 1.00 0.00 H new ATOM 0 HG3 PRO A 107 25.193 5.870 33.294 1.00 0.00 H new ATOM 0 HD2 PRO A 107 24.076 6.134 30.811 1.00 0.00 H new ATOM 0 HD3 PRO A 107 25.194 4.831 31.162 1.00 0.00 H new ATOM 1528 N ALA A 108 20.474 4.869 31.761 1.00 0.00 N ATOM 1529 CA ALA A 108 19.109 5.368 31.860 1.00 0.00 C ATOM 1530 C ALA A 108 18.199 4.233 32.332 1.00 0.00 C ATOM 1531 O ALA A 108 18.348 3.096 31.881 1.00 0.00 O ATOM 1532 CB ALA A 108 18.652 5.890 30.492 1.00 0.00 C ATOM 0 H ALA A 108 20.837 4.873 30.808 1.00 0.00 H new ATOM 0 HA ALA A 108 19.060 6.188 32.577 1.00 0.00 H new ATOM 0 HB1 ALA A 108 17.631 6.263 30.568 1.00 0.00 H new ATOM 0 HB2 ALA A 108 19.310 6.698 30.172 1.00 0.00 H new ATOM 0 HB3 ALA A 108 18.690 5.081 29.763 1.00 0.00 H new ATOM 1538 N ALA A 109 17.215 4.550 33.177 1.00 0.00 N ATOM 1539 CA ALA A 109 16.277 3.568 33.718 1.00 0.00 C ATOM 1540 C ALA A 109 15.440 2.883 32.626 1.00 0.00 C ATOM 1541 O ALA A 109 14.900 1.801 32.862 1.00 0.00 O ATOM 1542 CB ALA A 109 15.363 4.246 34.745 1.00 0.00 C ATOM 0 H ALA A 109 17.047 5.501 33.506 1.00 0.00 H new ATOM 0 HA ALA A 109 16.862 2.784 34.199 1.00 0.00 H new ATOM 0 HB1 ALA A 109 14.663 3.514 35.149 1.00 0.00 H new ATOM 0 HB2 ALA A 109 15.967 4.656 35.555 1.00 0.00 H new ATOM 0 HB3 ALA A 109 14.808 5.051 34.263 1.00 0.00 H new ATOM 1548 N ALA A 110 15.324 3.497 31.440 1.00 0.00 N ATOM 1549 CA ALA A 110 14.621 2.903 30.308 1.00 0.00 C ATOM 1550 C ALA A 110 15.384 1.702 29.735 1.00 0.00 C ATOM 1551 O ALA A 110 14.753 0.797 29.189 1.00 0.00 O ATOM 1552 CB ALA A 110 14.414 3.962 29.220 1.00 0.00 C ATOM 0 H ALA A 110 15.716 4.418 31.245 1.00 0.00 H new ATOM 0 HA ALA A 110 13.655 2.542 30.660 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.889 3.517 28.375 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.824 4.786 29.622 1.00 0.00 H new ATOM 0 HB3 ALA A 110 15.382 4.337 28.889 1.00 0.00 H new ATOM 1558 N CYS A 111 16.714 1.664 29.863 1.00 0.00 N ATOM 1559 CA CYS A 111 17.500 0.545 29.373 1.00 0.00 C ATOM 1560 C CYS A 111 17.226 -0.681 30.245 1.00 0.00 C ATOM 1561 O CYS A 111 17.305 -0.604 31.475 1.00 0.00 O ATOM 1562 CB CYS A 111 18.999 0.879 29.412 1.00 0.00 C ATOM 1563 SG CYS A 111 20.054 -0.451 28.775 1.00 0.00 S ATOM 0 H CYS A 111 17.263 2.401 30.304 1.00 0.00 H new ATOM 0 HA CYS A 111 17.217 0.339 28.341 1.00 0.00 H new ATOM 0 HB2 CYS A 111 19.177 1.783 28.830 1.00 0.00 H new ATOM 0 HB3 CYS A 111 19.287 1.100 30.440 1.00 0.00 H new ATOM 1568 N LYS A 112 16.979 -1.822 29.604 1.00 0.00 N ATOM 1569 CA LYS A 112 16.907 -3.139 30.230 1.00 0.00 C ATOM 1570 C LYS A 112 17.774 -4.049 29.374 1.00 0.00 C ATOM 1571 O LYS A 112 17.702 -3.978 28.145 1.00 0.00 O ATOM 1572 CB LYS A 112 15.453 -3.635 30.269 1.00 0.00 C ATOM 1573 CG LYS A 112 14.605 -2.940 31.355 1.00 0.00 C ATOM 1574 CD LYS A 112 13.130 -2.800 30.957 1.00 0.00 C ATOM 1575 CE LYS A 112 13.003 -1.707 29.886 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.617 -1.507 29.400 1.00 0.00 N ATOM 0 H LYS A 112 16.818 -1.855 28.597 1.00 0.00 H new ATOM 0 HA LYS A 112 17.256 -3.119 31.262 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.992 -3.469 29.295 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.447 -4.711 30.445 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.674 -3.508 32.283 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.018 -1.951 31.555 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.752 -3.748 30.574 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.527 -2.545 31.829 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.375 -0.767 30.293 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.642 -1.963 29.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.633 -0.939 28.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.182 -2.431 29.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 11.063 -1.011 30.127 1.00 0.00 H new ATOM 1590 N ILE A 113 18.598 -4.875 30.011 1.00 0.00 N ATOM 1591 CA ILE A 113 19.576 -5.742 29.374 1.00 0.00 C ATOM 1592 C ILE A 113 19.659 -7.033 30.193 1.00 0.00 C ATOM 1593 O ILE A 113 19.559 -6.987 31.424 1.00 0.00 O ATOM 1594 CB ILE A 113 20.909 -4.962 29.280 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.934 -5.719 28.414 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.522 -4.590 30.646 1.00 0.00 C ATOM 1597 CD1 ILE A 113 23.092 -4.845 27.914 1.00 0.00 C ATOM 0 H ILE A 113 18.600 -4.960 31.027 1.00 0.00 H new ATOM 0 HA ILE A 113 19.305 -6.029 28.358 1.00 0.00 H new ATOM 0 HB ILE A 113 20.657 -4.017 28.799 1.00 0.00 H new ATOM 0 HG12 ILE A 113 22.341 -6.548 28.992 1.00 0.00 H new ATOM 0 HG13 ILE A 113 21.421 -6.151 27.555 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.454 -4.046 30.491 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.823 -3.963 31.200 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.723 -5.498 31.214 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.771 -5.450 27.312 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.697 -4.030 27.307 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.632 -4.434 28.767 1.00 0.00 H new ATOM 1609 N SER A 114 19.816 -8.191 29.548 1.00 0.00 N ATOM 1610 CA SER A 114 20.013 -9.480 30.210 1.00 0.00 C ATOM 1611 C SER A 114 20.691 -10.451 29.242 1.00 0.00 C ATOM 1612 O SER A 114 20.369 -10.463 28.053 1.00 0.00 O ATOM 1613 CB SER A 114 18.657 -10.054 30.651 1.00 0.00 C ATOM 1614 OG SER A 114 18.053 -9.251 31.651 1.00 0.00 O ATOM 0 H SER A 114 19.809 -8.259 28.530 1.00 0.00 H new ATOM 0 HA SER A 114 20.644 -9.341 31.088 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.993 -10.124 29.789 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.795 -11.066 31.030 1.00 0.00 H new ATOM 0 HG SER A 114 18.571 -8.427 31.766 1.00 0.00 H new ATOM 1620 N GLY A 115 21.606 -11.280 29.753 1.00 0.00 N ATOM 1621 CA GLY A 115 22.268 -12.331 28.983 1.00 0.00 C ATOM 1622 C GLY A 115 23.193 -11.792 27.890 1.00 0.00 C ATOM 1623 O GLY A 115 23.396 -12.475 26.885 1.00 0.00 O ATOM 0 H GLY A 115 21.910 -11.237 30.726 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.846 -12.959 29.661 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.511 -12.968 28.526 1.00 0.00 H new ATOM 1627 N CYS A 116 23.727 -10.575 28.051 1.00 0.00 N ATOM 1628 CA CYS A 116 24.460 -9.870 27.005 1.00 0.00 C ATOM 1629 C CYS A 116 25.918 -9.634 27.388 1.00 0.00 C ATOM 1630 O CYS A 116 26.274 -9.586 28.570 1.00 0.00 O ATOM 1631 CB CYS A 116 23.798 -8.513 26.740 1.00 0.00 C ATOM 1632 SG CYS A 116 22.071 -8.568 26.209 1.00 0.00 S ATOM 0 H CYS A 116 23.659 -10.050 28.923 1.00 0.00 H new ATOM 0 HA CYS A 116 24.436 -10.495 26.112 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.859 -7.917 27.650 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.376 -7.991 25.977 1.00 0.00 H new ATOM 1637 N SER A 117 26.725 -9.396 26.359 1.00 0.00 N ATOM 1638 CA SER A 117 28.102 -8.934 26.413 1.00 0.00 C ATOM 1639 C SER A 117 28.212 -7.791 25.398 1.00 0.00 C ATOM 1640 O SER A 117 27.489 -7.782 24.396 1.00 0.00 O ATOM 1641 CB SER A 117 29.053 -10.091 26.069 1.00 0.00 C ATOM 1642 OG SER A 117 28.855 -11.196 26.940 1.00 0.00 O ATOM 0 H SER A 117 26.409 -9.531 25.399 1.00 0.00 H new ATOM 0 HA SER A 117 28.379 -8.584 27.408 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.891 -10.404 25.038 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.086 -9.750 26.140 1.00 0.00 H new ATOM 0 HG SER A 117 29.472 -11.918 26.698 1.00 0.00 H new ATOM 1648 N LEU A 118 29.096 -6.825 25.652 1.00 0.00 N ATOM 1649 CA LEU A 118 29.236 -5.611 24.850 1.00 0.00 C ATOM 1650 C LEU A 118 30.704 -5.432 24.471 1.00 0.00 C ATOM 1651 O LEU A 118 31.596 -5.837 25.222 1.00 0.00 O ATOM 1652 CB LEU A 118 28.753 -4.379 25.641 1.00 0.00 C ATOM 1653 CG LEU A 118 27.255 -4.340 25.996 1.00 0.00 C ATOM 1654 CD1 LEU A 118 26.951 -3.094 26.835 1.00 0.00 C ATOM 1655 CD2 LEU A 118 26.379 -4.312 24.742 1.00 0.00 C ATOM 0 H LEU A 118 29.747 -6.866 26.436 1.00 0.00 H new ATOM 0 HA LEU A 118 28.626 -5.706 23.952 1.00 0.00 H new ATOM 0 HB2 LEU A 118 29.326 -4.321 26.567 1.00 0.00 H new ATOM 0 HB3 LEU A 118 28.991 -3.486 25.063 1.00 0.00 H new ATOM 0 HG LEU A 118 27.028 -5.245 26.560 1.00 0.00 H new ATOM 0 HD11 LEU A 118 25.890 -3.072 27.083 1.00 0.00 H new ATOM 0 HD12 LEU A 118 27.538 -3.122 27.753 1.00 0.00 H new ATOM 0 HD13 LEU A 118 27.209 -2.201 26.266 1.00 0.00 H new ATOM 0 HD21 LEU A 118 25.329 -4.285 25.032 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.616 -3.426 24.153 1.00 0.00 H new ATOM 0 HD23 LEU A 118 26.568 -5.205 24.146 1.00 0.00 H new ATOM 1667 N SER A 119 30.948 -4.789 23.333 1.00 0.00 N ATOM 1668 CA SER A 119 32.282 -4.538 22.800 1.00 0.00 C ATOM 1669 C SER A 119 32.242 -3.315 21.873 1.00 0.00 C ATOM 1670 O SER A 119 31.169 -2.815 21.529 1.00 0.00 O ATOM 1671 CB SER A 119 32.829 -5.811 22.113 1.00 0.00 C ATOM 1672 OG SER A 119 31.815 -6.669 21.601 1.00 0.00 O ATOM 0 H SER A 119 30.204 -4.419 22.741 1.00 0.00 H new ATOM 0 HA SER A 119 32.976 -4.303 23.607 1.00 0.00 H new ATOM 0 HB2 SER A 119 33.489 -5.517 21.297 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.435 -6.367 22.829 1.00 0.00 H new ATOM 0 HG SER A 119 32.230 -7.451 21.180 1.00 0.00 H new ATOM 1678 N ALA A 120 33.414 -2.790 21.510 1.00 0.00 N ATOM 1679 CA ALA A 120 33.537 -1.617 20.652 1.00 0.00 C ATOM 1680 C ALA A 120 33.243 -1.953 19.179 1.00 0.00 C ATOM 1681 O ALA A 120 32.954 -3.098 18.815 1.00 0.00 O ATOM 1682 CB ALA A 120 34.946 -1.029 20.826 1.00 0.00 C ATOM 0 H ALA A 120 34.311 -3.173 21.808 1.00 0.00 H new ATOM 0 HA ALA A 120 32.794 -0.876 20.948 1.00 0.00 H new ATOM 0 HB1 ALA A 120 35.055 -0.150 20.190 1.00 0.00 H new ATOM 0 HB2 ALA A 120 35.095 -0.744 21.868 1.00 0.00 H new ATOM 0 HB3 ALA A 120 35.689 -1.775 20.544 1.00 0.00 H new ATOM 1688 N MET A 121 33.361 -0.933 18.330 1.00 0.00 N ATOM 1689 CA MET A 121 33.349 -0.974 16.874 1.00 0.00 C ATOM 1690 C MET A 121 34.355 0.087 16.448 1.00 0.00 C ATOM 1691 O MET A 121 35.120 -0.154 15.493 1.00 0.00 O ATOM 1692 CB MET A 121 31.961 -0.619 16.323 1.00 0.00 C ATOM 1693 CG MET A 121 30.998 -1.810 16.303 1.00 0.00 C ATOM 1694 SD MET A 121 31.376 -3.091 15.072 1.00 0.00 S ATOM 1695 CE MET A 121 30.662 -2.342 13.583 1.00 0.00 C ATOM 1696 OXT MET A 121 34.384 1.153 17.103 1.00 0.00 O ATOM 0 H MET A 121 33.477 0.020 18.674 1.00 0.00 H new ATOM 0 HA MET A 121 33.594 -1.968 16.499 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.530 0.179 16.928 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.068 -0.229 15.311 1.00 0.00 H new ATOM 0 HG2 MET A 121 30.993 -2.269 17.292 1.00 0.00 H new ATOM 0 HG3 MET A 121 29.990 -1.438 16.119 1.00 0.00 H new ATOM 0 HE1 MET A 121 30.812 -3.008 12.733 1.00 0.00 H new ATOM 0 HE2 MET A 121 29.595 -2.180 13.733 1.00 0.00 H new ATOM 0 HE3 MET A 121 31.150 -1.387 13.386 1.00 0.00 H new TER 1706 MET A 121