USER MOD reduce.3.24.130724 H: found=0, std=0, add=861, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 857 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 134:sc= 0.212 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 12:sc= 0.58 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 GLN : amide:sc= 0.921 K(o=0.92,f=0) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot -54:sc= 0.758 USER MOD Single : A 29 THR OG1 : rot 175:sc= 0.742 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot -8:sc= 1.07 USER MOD Single : A 34 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0177) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 86:sc= 1.22 USER MOD Single : A 43 ASN : amide:sc= 0.174 K(o=0.17,f=-1.1) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 GLN : amide:sc= -1.24 K(o=-1.2,f=0) USER MOD Single : A 53 SER OG : rot 87:sc= 1.19 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.25 USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 61 SER OG : rot 180:sc= 0.0177 USER MOD Single : A 63 SER OG : rot 71:sc= 1.2 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.474) USER MOD Single : A 73 HIS : no HD1:sc= -0.169 X(o=-0.17,f=-0.43) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0154) USER MOD Single : A 86 MET CE :methyl 170:sc= -0.545 (180deg=-0.841) USER MOD Single : A 87 GLN : amide:sc= -0.846 K(o=-0.85,f=-4.9!) USER MOD Single : A 91 ASN : amide:sc= -0.14 X(o=-0.14,f=0) USER MOD Single : A 94 HIS : no HD1:sc= -0.0348 X(o=-0.035,f=0) USER MOD Single : A 95 ASN : amide:sc= 0.082 K(o=0.082,f=-4.4!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 MET CE :methyl -155:sc= 0 (180deg=-0.268) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot -36:sc= 0.569 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -36.235 25.045 -0.066 1.00 0.00 N ATOM 2 CA GLY A 1 -35.792 24.641 -1.411 1.00 0.00 C ATOM 3 C GLY A 1 -35.044 23.327 -1.302 1.00 0.00 C ATOM 4 O GLY A 1 -34.608 22.986 -0.205 1.00 0.00 O ATOM 0 H1 GLY A 1 -36.021 26.052 0.082 1.00 0.00 H new ATOM 0 H2 GLY A 1 -37.260 24.892 0.022 1.00 0.00 H new ATOM 0 H3 GLY A 1 -35.738 24.476 0.649 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -36.650 24.534 -2.075 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -35.149 25.407 -1.843 1.00 0.00 H new ATOM 8 N SER A 2 -34.916 22.589 -2.400 1.00 0.00 N ATOM 9 CA SER A 2 -34.319 21.262 -2.422 1.00 0.00 C ATOM 10 C SER A 2 -33.826 20.978 -3.844 1.00 0.00 C ATOM 11 O SER A 2 -34.140 21.716 -4.780 1.00 0.00 O ATOM 12 CB SER A 2 -35.346 20.219 -1.931 1.00 0.00 C ATOM 13 OG SER A 2 -36.686 20.593 -2.227 1.00 0.00 O ATOM 0 H SER A 2 -35.231 22.905 -3.317 1.00 0.00 H new ATOM 0 HA SER A 2 -33.465 21.204 -1.747 1.00 0.00 H new ATOM 0 HB2 SER A 2 -35.130 19.256 -2.394 1.00 0.00 H new ATOM 0 HB3 SER A 2 -35.238 20.087 -0.854 1.00 0.00 H new ATOM 0 HG SER A 2 -37.299 19.902 -1.899 1.00 0.00 H new ATOM 19 N SER A 3 -33.025 19.930 -4.004 1.00 0.00 N ATOM 20 CA SER A 3 -32.532 19.355 -5.252 1.00 0.00 C ATOM 21 C SER A 3 -32.131 17.907 -4.916 1.00 0.00 C ATOM 22 O SER A 3 -32.390 17.457 -3.796 1.00 0.00 O ATOM 23 CB SER A 3 -31.348 20.182 -5.780 1.00 0.00 C ATOM 24 OG SER A 3 -31.755 21.506 -6.082 1.00 0.00 O ATOM 0 H SER A 3 -32.674 19.417 -3.195 1.00 0.00 H new ATOM 0 HA SER A 3 -33.282 19.365 -6.043 1.00 0.00 H new ATOM 0 HB2 SER A 3 -30.552 20.202 -5.036 1.00 0.00 H new ATOM 0 HB3 SER A 3 -30.938 19.710 -6.673 1.00 0.00 H new ATOM 0 HG SER A 3 -32.647 21.667 -5.710 1.00 0.00 H new ATOM 30 N GLY A 4 -31.512 17.171 -5.840 1.00 0.00 N ATOM 31 CA GLY A 4 -30.970 15.845 -5.579 1.00 0.00 C ATOM 32 C GLY A 4 -29.692 15.637 -6.383 1.00 0.00 C ATOM 33 O GLY A 4 -29.407 16.414 -7.296 1.00 0.00 O ATOM 0 H GLY A 4 -31.373 17.486 -6.800 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.763 15.731 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -31.704 15.084 -5.844 1.00 0.00 H new ATOM 37 N SER A 5 -28.959 14.577 -6.048 1.00 0.00 N ATOM 38 CA SER A 5 -27.715 14.162 -6.673 1.00 0.00 C ATOM 39 C SER A 5 -27.707 12.638 -6.733 1.00 0.00 C ATOM 40 O SER A 5 -28.257 11.986 -5.836 1.00 0.00 O ATOM 41 CB SER A 5 -26.530 14.662 -5.833 1.00 0.00 C ATOM 42 OG SER A 5 -26.169 15.970 -6.224 1.00 0.00 O ATOM 0 H SER A 5 -29.237 13.953 -5.290 1.00 0.00 H new ATOM 0 HA SER A 5 -27.630 14.578 -7.677 1.00 0.00 H new ATOM 0 HB2 SER A 5 -26.795 14.651 -4.776 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.680 13.991 -5.955 1.00 0.00 H new ATOM 0 HG SER A 5 -25.414 16.277 -5.680 1.00 0.00 H new ATOM 48 N SER A 6 -27.051 12.090 -7.755 1.00 0.00 N ATOM 49 CA SER A 6 -26.964 10.662 -8.019 1.00 0.00 C ATOM 50 C SER A 6 -25.537 10.334 -8.456 1.00 0.00 C ATOM 51 O SER A 6 -24.916 11.108 -9.191 1.00 0.00 O ATOM 52 CB SER A 6 -27.971 10.267 -9.106 1.00 0.00 C ATOM 53 OG SER A 6 -29.282 10.713 -8.800 1.00 0.00 O ATOM 0 H SER A 6 -26.549 12.651 -8.443 1.00 0.00 H new ATOM 0 HA SER A 6 -27.205 10.098 -7.118 1.00 0.00 H new ATOM 0 HB2 SER A 6 -27.658 10.688 -10.061 1.00 0.00 H new ATOM 0 HB3 SER A 6 -27.974 9.183 -9.221 1.00 0.00 H new ATOM 0 HG SER A 6 -29.895 10.444 -9.516 1.00 0.00 H new ATOM 59 N GLY A 7 -25.018 9.188 -8.019 1.00 0.00 N ATOM 60 CA GLY A 7 -23.663 8.726 -8.289 1.00 0.00 C ATOM 61 C GLY A 7 -23.673 7.266 -8.729 1.00 0.00 C ATOM 62 O GLY A 7 -24.739 6.690 -8.966 1.00 0.00 O ATOM 0 H GLY A 7 -25.551 8.534 -7.446 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.210 9.343 -9.066 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -23.050 8.838 -7.395 1.00 0.00 H new ATOM 66 N TYR A 8 -22.490 6.666 -8.858 1.00 0.00 N ATOM 67 CA TYR A 8 -22.279 5.370 -9.497 1.00 0.00 C ATOM 68 C TYR A 8 -21.348 4.519 -8.634 1.00 0.00 C ATOM 69 O TYR A 8 -20.514 5.058 -7.901 1.00 0.00 O ATOM 70 CB TYR A 8 -21.686 5.602 -10.896 1.00 0.00 C ATOM 71 CG TYR A 8 -22.683 6.118 -11.918 1.00 0.00 C ATOM 72 CD1 TYR A 8 -23.059 7.478 -11.953 1.00 0.00 C ATOM 73 CD2 TYR A 8 -23.266 5.214 -12.823 1.00 0.00 C ATOM 74 CE1 TYR A 8 -24.065 7.918 -12.834 1.00 0.00 C ATOM 75 CE2 TYR A 8 -24.244 5.657 -13.726 1.00 0.00 C ATOM 76 CZ TYR A 8 -24.672 6.999 -13.719 1.00 0.00 C ATOM 77 OH TYR A 8 -25.682 7.377 -14.551 1.00 0.00 O ATOM 0 H TYR A 8 -21.626 7.082 -8.510 1.00 0.00 H new ATOM 0 HA TYR A 8 -23.223 4.835 -9.599 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -20.864 6.313 -10.816 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -21.263 4.665 -11.259 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -22.571 8.186 -11.299 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -22.961 4.178 -12.823 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -24.371 8.954 -12.833 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -24.673 4.963 -14.433 1.00 0.00 H new ATOM 0 HH TYR A 8 -25.971 6.608 -15.085 1.00 0.00 H new ATOM 87 N SER A 9 -21.482 3.197 -8.728 1.00 0.00 N ATOM 88 CA SER A 9 -20.695 2.199 -8.005 1.00 0.00 C ATOM 89 C SER A 9 -20.352 1.018 -8.928 1.00 0.00 C ATOM 90 O SER A 9 -20.959 0.875 -9.994 1.00 0.00 O ATOM 91 CB SER A 9 -21.452 1.752 -6.734 1.00 0.00 C ATOM 92 OG SER A 9 -22.869 1.826 -6.837 1.00 0.00 O ATOM 0 H SER A 9 -22.177 2.772 -9.341 1.00 0.00 H new ATOM 0 HA SER A 9 -19.750 2.639 -7.685 1.00 0.00 H new ATOM 0 HB2 SER A 9 -21.170 0.725 -6.500 1.00 0.00 H new ATOM 0 HB3 SER A 9 -21.128 2.370 -5.897 1.00 0.00 H new ATOM 0 HG SER A 9 -23.274 1.526 -5.997 1.00 0.00 H new ATOM 98 N GLY A 10 -19.418 0.159 -8.512 1.00 0.00 N ATOM 99 CA GLY A 10 -18.982 -1.001 -9.283 1.00 0.00 C ATOM 100 C GLY A 10 -17.978 -0.611 -10.367 1.00 0.00 C ATOM 101 O GLY A 10 -18.367 -0.119 -11.430 1.00 0.00 O ATOM 0 H GLY A 10 -18.938 0.254 -7.617 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -18.530 -1.734 -8.615 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -19.847 -1.479 -9.743 1.00 0.00 H new ATOM 105 N SER A 11 -16.690 -0.846 -10.105 1.00 0.00 N ATOM 106 CA SER A 11 -15.582 -0.547 -11.013 1.00 0.00 C ATOM 107 C SER A 11 -14.777 -1.805 -11.333 1.00 0.00 C ATOM 108 O SER A 11 -14.436 -2.038 -12.494 1.00 0.00 O ATOM 109 CB SER A 11 -14.671 0.528 -10.407 1.00 0.00 C ATOM 110 OG SER A 11 -15.422 1.612 -9.901 1.00 0.00 O ATOM 0 H SER A 11 -16.381 -1.263 -9.227 1.00 0.00 H new ATOM 0 HA SER A 11 -16.003 -0.169 -11.945 1.00 0.00 H new ATOM 0 HB2 SER A 11 -14.073 0.092 -9.607 1.00 0.00 H new ATOM 0 HB3 SER A 11 -13.975 0.887 -11.165 1.00 0.00 H new ATOM 0 HG SER A 11 -14.815 2.281 -9.520 1.00 0.00 H new ATOM 116 N GLN A 12 -14.484 -2.633 -10.332 1.00 0.00 N ATOM 117 CA GLN A 12 -13.785 -3.903 -10.472 1.00 0.00 C ATOM 118 C GLN A 12 -14.646 -4.980 -9.814 1.00 0.00 C ATOM 119 O GLN A 12 -15.581 -4.668 -9.067 1.00 0.00 O ATOM 120 CB GLN A 12 -12.377 -3.812 -9.847 1.00 0.00 C ATOM 121 CG GLN A 12 -11.439 -2.896 -10.652 1.00 0.00 C ATOM 122 CD GLN A 12 -9.975 -3.031 -10.220 1.00 0.00 C ATOM 123 OE1 GLN A 12 -9.631 -2.988 -9.038 1.00 0.00 O ATOM 124 NE2 GLN A 12 -9.054 -3.224 -11.154 1.00 0.00 N ATOM 0 H GLN A 12 -14.738 -2.427 -9.366 1.00 0.00 H new ATOM 0 HA GLN A 12 -13.637 -4.158 -11.522 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.458 -3.438 -8.826 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -11.943 -4.810 -9.787 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -11.525 -3.134 -11.712 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.756 -1.860 -10.531 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.324 -3.262 -12.137 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -8.075 -3.335 -10.890 1.00 0.00 H new ATOM 133 N ALA A 13 -14.356 -6.245 -10.100 1.00 0.00 N ATOM 134 CA ALA A 13 -15.014 -7.396 -9.493 1.00 0.00 C ATOM 135 C ALA A 13 -14.061 -8.043 -8.478 1.00 0.00 C ATOM 136 O ALA A 13 -12.853 -7.786 -8.531 1.00 0.00 O ATOM 137 CB ALA A 13 -15.440 -8.367 -10.602 1.00 0.00 C ATOM 0 H ALA A 13 -13.639 -6.504 -10.777 1.00 0.00 H new ATOM 0 HA ALA A 13 -15.912 -7.097 -8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -15.933 -9.232 -10.159 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -16.129 -7.864 -11.281 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -14.560 -8.695 -11.156 1.00 0.00 H new ATOM 143 N PRO A 14 -14.557 -8.865 -7.535 1.00 0.00 N ATOM 144 CA PRO A 14 -13.712 -9.540 -6.565 1.00 0.00 C ATOM 145 C PRO A 14 -12.987 -10.729 -7.215 1.00 0.00 C ATOM 146 O PRO A 14 -13.301 -11.897 -6.951 1.00 0.00 O ATOM 147 CB PRO A 14 -14.645 -9.918 -5.408 1.00 0.00 C ATOM 148 CG PRO A 14 -15.976 -10.155 -6.115 1.00 0.00 C ATOM 149 CD PRO A 14 -15.963 -9.117 -7.238 1.00 0.00 C ATOM 0 HA PRO A 14 -12.903 -8.915 -6.187 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -14.300 -10.810 -4.884 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -14.716 -9.121 -4.668 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -16.050 -11.170 -6.505 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -16.821 -10.010 -5.442 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -16.488 -9.488 -8.119 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -16.467 -8.201 -6.929 1.00 0.00 H new ATOM 157 N GLY A 15 -11.965 -10.440 -8.023 1.00 0.00 N ATOM 158 CA GLY A 15 -10.933 -11.418 -8.340 1.00 0.00 C ATOM 159 C GLY A 15 -10.171 -11.775 -7.065 1.00 0.00 C ATOM 160 O GLY A 15 -10.159 -10.989 -6.109 1.00 0.00 O ATOM 0 H GLY A 15 -11.833 -9.532 -8.469 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -11.383 -12.312 -8.772 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -10.249 -11.014 -9.086 1.00 0.00 H new ATOM 164 N GLY A 16 -9.538 -12.946 -7.037 1.00 0.00 N ATOM 165 CA GLY A 16 -8.765 -13.402 -5.897 1.00 0.00 C ATOM 166 C GLY A 16 -7.293 -13.396 -6.263 1.00 0.00 C ATOM 167 O GLY A 16 -6.916 -13.936 -7.303 1.00 0.00 O ATOM 0 H GLY A 16 -9.551 -13.606 -7.814 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -8.942 -12.754 -5.039 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -9.077 -14.406 -5.608 1.00 0.00 H new ATOM 171 N ILE A 17 -6.471 -12.814 -5.389 1.00 0.00 N ATOM 172 CA ILE A 17 -5.042 -12.604 -5.585 1.00 0.00 C ATOM 173 C ILE A 17 -4.324 -13.889 -6.014 1.00 0.00 C ATOM 174 O ILE A 17 -3.349 -13.831 -6.759 1.00 0.00 O ATOM 175 CB ILE A 17 -4.439 -11.983 -4.298 1.00 0.00 C ATOM 176 CG1 ILE A 17 -2.945 -11.617 -4.424 1.00 0.00 C ATOM 177 CG2 ILE A 17 -4.600 -12.914 -3.076 1.00 0.00 C ATOM 178 CD1 ILE A 17 -2.609 -10.603 -5.517 1.00 0.00 C ATOM 0 H ILE A 17 -6.799 -12.463 -4.489 1.00 0.00 H new ATOM 0 HA ILE A 17 -4.894 -11.905 -6.408 1.00 0.00 H new ATOM 0 HB ILE A 17 -5.008 -11.065 -4.154 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -2.603 -11.222 -3.467 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -2.379 -12.530 -4.612 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -4.164 -12.439 -2.197 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -5.659 -13.102 -2.899 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -4.091 -13.858 -3.269 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -1.535 -10.415 -5.521 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -2.912 -10.999 -6.486 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -3.140 -9.671 -5.324 1.00 0.00 H new ATOM 190 N GLN A 18 -4.782 -15.054 -5.552 1.00 0.00 N ATOM 191 CA GLN A 18 -4.058 -16.287 -5.753 1.00 0.00 C ATOM 192 C GLN A 18 -4.096 -16.742 -7.209 1.00 0.00 C ATOM 193 O GLN A 18 -3.108 -17.304 -7.667 1.00 0.00 O ATOM 194 CB GLN A 18 -4.594 -17.342 -4.785 1.00 0.00 C ATOM 195 CG GLN A 18 -3.449 -18.244 -4.334 1.00 0.00 C ATOM 196 CD GLN A 18 -3.870 -19.070 -3.131 1.00 0.00 C ATOM 197 OE1 GLN A 18 -4.356 -20.193 -3.256 1.00 0.00 O ATOM 198 NE2 GLN A 18 -3.648 -18.544 -1.938 1.00 0.00 N ATOM 0 H GLN A 18 -5.655 -15.158 -5.036 1.00 0.00 H new ATOM 0 HA GLN A 18 -3.003 -16.125 -5.534 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -5.053 -16.860 -3.922 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -5.370 -17.935 -5.269 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -3.153 -18.903 -5.150 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -2.578 -17.639 -4.081 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -3.244 -17.611 -1.859 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -3.881 -19.072 -1.097 1.00 0.00 H new ATOM 207 N GLU A 19 -5.171 -16.447 -7.947 1.00 0.00 N ATOM 208 CA GLU A 19 -5.224 -16.607 -9.392 1.00 0.00 C ATOM 209 C GLU A 19 -4.179 -15.696 -10.019 1.00 0.00 C ATOM 210 O GLU A 19 -3.385 -16.155 -10.826 1.00 0.00 O ATOM 211 CB GLU A 19 -6.623 -16.270 -9.928 1.00 0.00 C ATOM 212 CG GLU A 19 -6.670 -16.282 -11.471 1.00 0.00 C ATOM 213 CD GLU A 19 -8.045 -15.910 -12.027 1.00 0.00 C ATOM 214 OE1 GLU A 19 -8.755 -15.094 -11.406 1.00 0.00 O ATOM 215 OE2 GLU A 19 -8.436 -16.461 -13.087 1.00 0.00 O ATOM 0 H GLU A 19 -6.037 -16.086 -7.546 1.00 0.00 H new ATOM 0 HA GLU A 19 -5.014 -17.645 -9.652 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.343 -16.989 -9.538 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -6.924 -15.288 -9.564 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.927 -15.585 -11.858 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.394 -17.274 -11.830 1.00 0.00 H new ATOM 222 N ILE A 20 -4.151 -14.415 -9.651 1.00 0.00 N ATOM 223 CA ILE A 20 -3.230 -13.444 -10.234 1.00 0.00 C ATOM 224 C ILE A 20 -1.793 -13.955 -10.090 1.00 0.00 C ATOM 225 O ILE A 20 -1.013 -13.971 -11.038 1.00 0.00 O ATOM 226 CB ILE A 20 -3.409 -12.071 -9.558 1.00 0.00 C ATOM 227 CG1 ILE A 20 -4.877 -11.614 -9.428 1.00 0.00 C ATOM 228 CG2 ILE A 20 -2.583 -11.025 -10.305 1.00 0.00 C ATOM 229 CD1 ILE A 20 -5.704 -11.650 -10.716 1.00 0.00 C ATOM 0 H ILE A 20 -4.768 -14.023 -8.939 1.00 0.00 H new ATOM 0 HA ILE A 20 -3.447 -13.321 -11.295 1.00 0.00 H new ATOM 0 HB ILE A 20 -3.051 -12.180 -8.534 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -5.369 -12.242 -8.685 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -4.887 -10.595 -9.041 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -2.709 -10.053 -9.828 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.531 -11.307 -10.281 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.920 -10.967 -11.340 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -6.718 -11.309 -10.507 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.247 -10.997 -11.460 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -5.736 -12.670 -11.099 1.00 0.00 H new ATOM 241 N VAL A 21 -1.455 -14.417 -8.893 1.00 0.00 N ATOM 242 CA VAL A 21 -0.154 -14.970 -8.557 1.00 0.00 C ATOM 243 C VAL A 21 0.100 -16.285 -9.297 1.00 0.00 C ATOM 244 O VAL A 21 1.244 -16.600 -9.635 1.00 0.00 O ATOM 245 CB VAL A 21 -0.133 -15.167 -7.038 1.00 0.00 C ATOM 246 CG1 VAL A 21 1.148 -15.849 -6.573 1.00 0.00 C ATOM 247 CG2 VAL A 21 -0.254 -13.826 -6.304 1.00 0.00 C ATOM 0 H VAL A 21 -2.102 -14.416 -8.105 1.00 0.00 H new ATOM 0 HA VAL A 21 0.643 -14.293 -8.865 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.987 -15.801 -6.801 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.123 -15.970 -5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.231 -16.828 -7.046 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.007 -15.238 -6.850 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.236 -13.997 -5.228 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.580 -13.182 -6.583 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.192 -13.344 -6.579 1.00 0.00 H new ATOM 257 N ALA A 22 -0.953 -17.057 -9.553 1.00 0.00 N ATOM 258 CA ALA A 22 -0.845 -18.279 -10.331 1.00 0.00 C ATOM 259 C ALA A 22 -0.373 -17.900 -11.731 1.00 0.00 C ATOM 260 O ALA A 22 0.566 -18.494 -12.266 1.00 0.00 O ATOM 261 CB ALA A 22 -2.193 -19.015 -10.405 1.00 0.00 C ATOM 0 H ALA A 22 -1.898 -16.851 -9.228 1.00 0.00 H new ATOM 0 HA ALA A 22 -0.135 -18.955 -9.855 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -2.079 -19.925 -10.994 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.522 -19.273 -9.399 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -2.935 -18.369 -10.875 1.00 0.00 H new ATOM 267 N MET A 23 -1.044 -16.906 -12.305 1.00 0.00 N ATOM 268 CA MET A 23 -0.880 -16.437 -13.664 1.00 0.00 C ATOM 269 C MET A 23 0.458 -15.703 -13.838 1.00 0.00 C ATOM 270 O MET A 23 1.014 -15.735 -14.938 1.00 0.00 O ATOM 271 CB MET A 23 -2.062 -15.522 -14.018 1.00 0.00 C ATOM 272 CG MET A 23 -3.454 -16.137 -13.786 1.00 0.00 C ATOM 273 SD MET A 23 -4.412 -16.599 -15.247 1.00 0.00 S ATOM 274 CE MET A 23 -3.337 -17.846 -16.003 1.00 0.00 C ATOM 0 H MET A 23 -1.757 -16.380 -11.799 1.00 0.00 H new ATOM 0 HA MET A 23 -0.867 -17.290 -14.342 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.983 -14.608 -13.430 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.978 -15.235 -15.066 1.00 0.00 H new ATOM 0 HG2 MET A 23 -3.331 -17.027 -13.169 1.00 0.00 H new ATOM 0 HG3 MET A 23 -4.044 -15.427 -13.207 1.00 0.00 H new ATOM 0 HE1 MET A 23 -3.801 -18.221 -16.915 1.00 0.00 H new ATOM 0 HE2 MET A 23 -2.373 -17.398 -16.243 1.00 0.00 H new ATOM 0 HE3 MET A 23 -3.190 -18.671 -15.305 1.00 0.00 H new ATOM 284 N SER A 24 0.970 -15.065 -12.780 1.00 0.00 N ATOM 285 CA SER A 24 2.057 -14.098 -12.865 1.00 0.00 C ATOM 286 C SER A 24 3.342 -14.663 -13.503 1.00 0.00 C ATOM 287 O SER A 24 3.606 -15.869 -13.406 1.00 0.00 O ATOM 288 CB SER A 24 2.287 -13.447 -11.487 1.00 0.00 C ATOM 289 OG SER A 24 2.604 -14.381 -10.476 1.00 0.00 O ATOM 0 H SER A 24 0.632 -15.212 -11.829 1.00 0.00 H new ATOM 0 HA SER A 24 1.752 -13.315 -13.559 1.00 0.00 H new ATOM 0 HB2 SER A 24 3.095 -12.719 -11.566 1.00 0.00 H new ATOM 0 HB3 SER A 24 1.391 -12.898 -11.198 1.00 0.00 H new ATOM 0 HG SER A 24 1.917 -15.079 -10.449 1.00 0.00 H new ATOM 295 N PRO A 25 4.141 -13.813 -14.178 1.00 0.00 N ATOM 296 CA PRO A 25 5.493 -14.147 -14.591 1.00 0.00 C ATOM 297 C PRO A 25 6.427 -14.107 -13.376 1.00 0.00 C ATOM 298 O PRO A 25 6.024 -13.736 -12.273 1.00 0.00 O ATOM 299 CB PRO A 25 5.860 -13.081 -15.630 1.00 0.00 C ATOM 300 CG PRO A 25 5.127 -11.841 -15.129 1.00 0.00 C ATOM 301 CD PRO A 25 3.873 -12.408 -14.458 1.00 0.00 C ATOM 0 HA PRO A 25 5.579 -15.149 -15.011 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.937 -12.920 -15.679 1.00 0.00 H new ATOM 0 HB3 PRO A 25 5.534 -13.365 -16.631 1.00 0.00 H new ATOM 0 HG2 PRO A 25 5.736 -11.273 -14.426 1.00 0.00 H new ATOM 0 HG3 PRO A 25 4.874 -11.167 -15.948 1.00 0.00 H new ATOM 0 HD2 PRO A 25 3.649 -11.867 -13.539 1.00 0.00 H new ATOM 0 HD3 PRO A 25 3.005 -12.303 -15.109 1.00 0.00 H new ATOM 309 N GLU A 26 7.700 -14.447 -13.582 1.00 0.00 N ATOM 310 CA GLU A 26 8.720 -14.225 -12.572 1.00 0.00 C ATOM 311 C GLU A 26 8.834 -12.733 -12.273 1.00 0.00 C ATOM 312 O GLU A 26 8.920 -11.909 -13.191 1.00 0.00 O ATOM 313 CB GLU A 26 10.057 -14.807 -13.049 1.00 0.00 C ATOM 314 CG GLU A 26 10.459 -15.989 -12.177 1.00 0.00 C ATOM 315 CD GLU A 26 11.524 -16.887 -12.796 1.00 0.00 C ATOM 316 OE1 GLU A 26 12.451 -16.405 -13.480 1.00 0.00 O ATOM 317 OE2 GLU A 26 11.365 -18.121 -12.660 1.00 0.00 O ATOM 0 H GLU A 26 8.043 -14.877 -14.441 1.00 0.00 H new ATOM 0 HA GLU A 26 8.442 -14.733 -11.648 1.00 0.00 H new ATOM 0 HB2 GLU A 26 9.973 -15.125 -14.088 1.00 0.00 H new ATOM 0 HB3 GLU A 26 10.830 -14.039 -13.012 1.00 0.00 H new ATOM 0 HG2 GLU A 26 10.826 -15.613 -11.222 1.00 0.00 H new ATOM 0 HG3 GLU A 26 9.573 -16.588 -11.965 1.00 0.00 H new ATOM 324 N LEU A 27 8.843 -12.398 -10.985 1.00 0.00 N ATOM 325 CA LEU A 27 8.700 -11.056 -10.447 1.00 0.00 C ATOM 326 C LEU A 27 9.875 -10.825 -9.517 1.00 0.00 C ATOM 327 O LEU A 27 9.964 -11.448 -8.460 1.00 0.00 O ATOM 328 CB LEU A 27 7.342 -10.910 -9.758 1.00 0.00 C ATOM 329 CG LEU A 27 6.510 -9.777 -10.366 1.00 0.00 C ATOM 330 CD1 LEU A 27 6.061 -10.097 -11.790 1.00 0.00 C ATOM 331 CD2 LEU A 27 5.285 -9.572 -9.491 1.00 0.00 C ATOM 0 H LEU A 27 8.957 -13.098 -10.252 1.00 0.00 H new ATOM 0 HA LEU A 27 8.716 -10.295 -11.227 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.792 -11.847 -9.839 1.00 0.00 H new ATOM 0 HB3 LEU A 27 7.493 -10.719 -8.695 1.00 0.00 H new ATOM 0 HG LEU A 27 7.125 -8.878 -10.411 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.474 -9.266 -12.182 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.936 -10.253 -12.421 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.452 -11.001 -11.785 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.674 -8.769 -9.903 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.702 -10.492 -9.460 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.599 -9.308 -8.481 1.00 0.00 H new ATOM 343 N ASP A 28 10.806 -9.979 -9.953 1.00 0.00 N ATOM 344 CA ASP A 28 12.110 -9.770 -9.330 1.00 0.00 C ATOM 345 C ASP A 28 11.911 -9.229 -7.920 1.00 0.00 C ATOM 346 O ASP A 28 11.670 -8.032 -7.734 1.00 0.00 O ATOM 347 CB ASP A 28 12.968 -8.811 -10.171 1.00 0.00 C ATOM 348 CG ASP A 28 13.544 -9.498 -11.400 1.00 0.00 C ATOM 349 OD1 ASP A 28 12.763 -10.050 -12.207 1.00 0.00 O ATOM 350 OD2 ASP A 28 14.786 -9.492 -11.530 1.00 0.00 O ATOM 0 H ASP A 28 10.667 -9.399 -10.781 1.00 0.00 H new ATOM 0 HA ASP A 28 12.640 -10.721 -9.275 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.363 -7.959 -10.481 1.00 0.00 H new ATOM 0 HB3 ASP A 28 13.781 -8.419 -9.559 1.00 0.00 H new ATOM 355 N THR A 29 11.964 -10.117 -6.927 1.00 0.00 N ATOM 356 CA THR A 29 11.550 -9.820 -5.567 1.00 0.00 C ATOM 357 C THR A 29 12.402 -8.685 -5.005 1.00 0.00 C ATOM 358 O THR A 29 11.863 -7.741 -4.436 1.00 0.00 O ATOM 359 CB THR A 29 11.590 -11.095 -4.705 1.00 0.00 C ATOM 360 OG1 THR A 29 12.873 -11.694 -4.686 1.00 0.00 O ATOM 361 CG2 THR A 29 10.609 -12.153 -5.216 1.00 0.00 C ATOM 0 H THR A 29 12.300 -11.072 -7.052 1.00 0.00 H new ATOM 0 HA THR A 29 10.516 -9.476 -5.557 1.00 0.00 H new ATOM 0 HB THR A 29 11.317 -10.769 -3.701 1.00 0.00 H new ATOM 0 HG1 THR A 29 12.870 -12.453 -4.066 1.00 0.00 H new ATOM 0 HG21 THR A 29 10.666 -13.038 -4.582 1.00 0.00 H new ATOM 0 HG22 THR A 29 9.596 -11.752 -5.190 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.866 -12.423 -6.240 1.00 0.00 H new ATOM 369 N TYR A 30 13.719 -8.745 -5.203 1.00 0.00 N ATOM 370 CA TYR A 30 14.672 -7.742 -4.786 1.00 0.00 C ATOM 371 C TYR A 30 14.332 -6.360 -5.345 1.00 0.00 C ATOM 372 O TYR A 30 14.072 -5.451 -4.556 1.00 0.00 O ATOM 373 CB TYR A 30 16.066 -8.230 -5.180 1.00 0.00 C ATOM 374 CG TYR A 30 17.172 -7.583 -4.385 1.00 0.00 C ATOM 375 CD1 TYR A 30 17.154 -7.684 -2.982 1.00 0.00 C ATOM 376 CD2 TYR A 30 18.220 -6.917 -5.042 1.00 0.00 C ATOM 377 CE1 TYR A 30 18.184 -7.098 -2.222 1.00 0.00 C ATOM 378 CE2 TYR A 30 19.265 -6.351 -4.289 1.00 0.00 C ATOM 379 CZ TYR A 30 19.247 -6.430 -2.877 1.00 0.00 C ATOM 380 OH TYR A 30 20.259 -5.852 -2.171 1.00 0.00 O ATOM 0 H TYR A 30 14.160 -9.532 -5.680 1.00 0.00 H new ATOM 0 HA TYR A 30 14.636 -7.612 -3.704 1.00 0.00 H new ATOM 0 HB2 TYR A 30 16.116 -9.311 -5.046 1.00 0.00 H new ATOM 0 HB3 TYR A 30 16.226 -8.032 -6.240 1.00 0.00 H new ATOM 0 HD1 TYR A 30 16.351 -8.211 -2.488 1.00 0.00 H new ATOM 0 HD2 TYR A 30 18.223 -6.840 -6.119 1.00 0.00 H new ATOM 0 HE1 TYR A 30 18.164 -7.158 -1.144 1.00 0.00 H new ATOM 0 HE2 TYR A 30 20.083 -5.855 -4.790 1.00 0.00 H new ATOM 0 HH TYR A 30 20.898 -5.442 -2.791 1.00 0.00 H new ATOM 390 N SER A 31 14.274 -6.220 -6.672 1.00 0.00 N ATOM 391 CA SER A 31 13.887 -4.996 -7.367 1.00 0.00 C ATOM 392 C SER A 31 12.562 -4.465 -6.822 1.00 0.00 C ATOM 393 O SER A 31 12.462 -3.266 -6.567 1.00 0.00 O ATOM 394 CB SER A 31 13.818 -5.280 -8.877 1.00 0.00 C ATOM 395 OG SER A 31 13.243 -4.218 -9.618 1.00 0.00 O ATOM 0 H SER A 31 14.503 -6.982 -7.310 1.00 0.00 H new ATOM 0 HA SER A 31 14.631 -4.219 -7.196 1.00 0.00 H new ATOM 0 HB2 SER A 31 14.824 -5.472 -9.250 1.00 0.00 H new ATOM 0 HB3 SER A 31 13.237 -6.187 -9.044 1.00 0.00 H new ATOM 0 HG SER A 31 13.227 -4.454 -10.569 1.00 0.00 H new ATOM 401 N ILE A 32 11.558 -5.320 -6.594 1.00 0.00 N ATOM 402 CA ILE A 32 10.303 -4.890 -5.985 1.00 0.00 C ATOM 403 C ILE A 32 10.608 -4.310 -4.604 1.00 0.00 C ATOM 404 O ILE A 32 10.330 -3.141 -4.372 1.00 0.00 O ATOM 405 CB ILE A 32 9.250 -6.024 -5.993 1.00 0.00 C ATOM 406 CG1 ILE A 32 8.795 -6.263 -7.442 1.00 0.00 C ATOM 407 CG2 ILE A 32 8.022 -5.675 -5.135 1.00 0.00 C ATOM 408 CD1 ILE A 32 8.032 -7.573 -7.654 1.00 0.00 C ATOM 0 H ILE A 32 11.595 -6.313 -6.824 1.00 0.00 H new ATOM 0 HA ILE A 32 9.840 -4.098 -6.573 1.00 0.00 H new ATOM 0 HB ILE A 32 9.710 -6.918 -5.571 1.00 0.00 H new ATOM 0 HG12 ILE A 32 8.161 -5.432 -7.753 1.00 0.00 H new ATOM 0 HG13 ILE A 32 9.671 -6.257 -8.091 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.309 -6.498 -5.169 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.334 -5.508 -4.104 1.00 0.00 H new ATOM 0 HG23 ILE A 32 7.552 -4.771 -5.523 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.748 -7.663 -8.702 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.668 -8.414 -7.377 1.00 0.00 H new ATOM 0 HD13 ILE A 32 7.136 -7.576 -7.034 1.00 0.00 H new ATOM 420 N THR A 33 11.199 -5.073 -3.682 1.00 0.00 N ATOM 421 CA THR A 33 11.390 -4.603 -2.310 1.00 0.00 C ATOM 422 C THR A 33 12.178 -3.298 -2.223 1.00 0.00 C ATOM 423 O THR A 33 11.862 -2.445 -1.398 1.00 0.00 O ATOM 424 CB THR A 33 12.082 -5.671 -1.466 1.00 0.00 C ATOM 425 OG1 THR A 33 13.302 -6.128 -2.016 1.00 0.00 O ATOM 426 CG2 THR A 33 11.184 -6.882 -1.262 1.00 0.00 C ATOM 0 H THR A 33 11.551 -6.014 -3.860 1.00 0.00 H new ATOM 0 HA THR A 33 10.392 -4.405 -1.919 1.00 0.00 H new ATOM 0 HB THR A 33 12.294 -5.178 -0.517 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.414 -5.758 -2.916 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.706 -7.624 -0.657 1.00 0.00 H new ATOM 0 HG22 THR A 33 10.270 -6.576 -0.752 1.00 0.00 H new ATOM 0 HG23 THR A 33 10.932 -7.315 -2.230 1.00 0.00 H new ATOM 434 N LYS A 34 13.196 -3.155 -3.070 1.00 0.00 N ATOM 435 CA LYS A 34 13.967 -1.940 -3.254 1.00 0.00 C ATOM 436 C LYS A 34 13.015 -0.841 -3.693 1.00 0.00 C ATOM 437 O LYS A 34 12.733 0.033 -2.891 1.00 0.00 O ATOM 438 CB LYS A 34 15.103 -2.199 -4.257 1.00 0.00 C ATOM 439 CG LYS A 34 16.338 -2.785 -3.554 1.00 0.00 C ATOM 440 CD LYS A 34 17.425 -3.172 -4.568 1.00 0.00 C ATOM 441 CE LYS A 34 18.858 -2.856 -4.117 1.00 0.00 C ATOM 442 NZ LYS A 34 19.110 -1.399 -4.086 1.00 0.00 N ATOM 0 H LYS A 34 13.514 -3.917 -3.668 1.00 0.00 H new ATOM 0 HA LYS A 34 14.444 -1.619 -2.328 1.00 0.00 H new ATOM 0 HB2 LYS A 34 14.760 -2.887 -5.030 1.00 0.00 H new ATOM 0 HB3 LYS A 34 15.372 -1.268 -4.755 1.00 0.00 H new ATOM 0 HG2 LYS A 34 16.738 -2.056 -2.849 1.00 0.00 H new ATOM 0 HG3 LYS A 34 16.048 -3.662 -2.976 1.00 0.00 H new ATOM 0 HD2 LYS A 34 17.349 -4.240 -4.773 1.00 0.00 H new ATOM 0 HD3 LYS A 34 17.230 -2.653 -5.506 1.00 0.00 H new ATOM 0 HE2 LYS A 34 19.029 -3.277 -3.126 1.00 0.00 H new ATOM 0 HE3 LYS A 34 19.567 -3.334 -4.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 20.123 -1.225 -3.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 18.825 -0.978 -4.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 18.560 -0.968 -3.316 1.00 0.00 H new ATOM 456 N ARG A 35 12.455 -0.903 -4.898 1.00 0.00 N ATOM 457 CA ARG A 35 11.602 0.142 -5.468 1.00 0.00 C ATOM 458 C ARG A 35 10.426 0.513 -4.564 1.00 0.00 C ATOM 459 O ARG A 35 10.027 1.669 -4.523 1.00 0.00 O ATOM 460 CB ARG A 35 11.138 -0.352 -6.841 1.00 0.00 C ATOM 461 CG ARG A 35 10.852 0.745 -7.878 1.00 0.00 C ATOM 462 CD ARG A 35 9.361 1.063 -7.939 1.00 0.00 C ATOM 463 NE ARG A 35 8.943 1.629 -9.226 1.00 0.00 N ATOM 464 CZ ARG A 35 8.680 0.959 -10.360 1.00 0.00 C ATOM 465 NH1 ARG A 35 8.913 -0.351 -10.496 1.00 0.00 N ATOM 466 NH2 ARG A 35 8.155 1.620 -11.377 1.00 0.00 N ATOM 0 H ARG A 35 12.583 -1.699 -5.522 1.00 0.00 H new ATOM 0 HA ARG A 35 12.172 1.066 -5.566 1.00 0.00 H new ATOM 0 HB2 ARG A 35 11.900 -1.019 -7.244 1.00 0.00 H new ATOM 0 HB3 ARG A 35 10.234 -0.946 -6.707 1.00 0.00 H new ATOM 0 HG2 ARG A 35 11.410 1.646 -7.623 1.00 0.00 H new ATOM 0 HG3 ARG A 35 11.199 0.422 -8.860 1.00 0.00 H new ATOM 0 HD2 ARG A 35 8.794 0.152 -7.749 1.00 0.00 H new ATOM 0 HD3 ARG A 35 9.113 1.765 -7.143 1.00 0.00 H new ATOM 0 HE ARG A 35 8.841 2.643 -9.264 1.00 0.00 H new ATOM 0 HH11 ARG A 35 9.306 -0.882 -9.719 1.00 0.00 H new ATOM 0 HH12 ARG A 35 8.697 -0.819 -11.376 1.00 0.00 H new ATOM 0 HH21 ARG A 35 7.958 2.617 -11.290 1.00 0.00 H new ATOM 0 HH22 ARG A 35 7.946 1.133 -12.249 1.00 0.00 H new ATOM 480 N VAL A 36 9.879 -0.439 -3.816 1.00 0.00 N ATOM 481 CA VAL A 36 8.836 -0.201 -2.834 1.00 0.00 C ATOM 482 C VAL A 36 9.402 0.662 -1.705 1.00 0.00 C ATOM 483 O VAL A 36 8.810 1.682 -1.366 1.00 0.00 O ATOM 484 CB VAL A 36 8.289 -1.559 -2.363 1.00 0.00 C ATOM 485 CG1 VAL A 36 7.419 -1.427 -1.115 1.00 0.00 C ATOM 486 CG2 VAL A 36 7.437 -2.242 -3.449 1.00 0.00 C ATOM 0 H VAL A 36 10.157 -1.418 -3.880 1.00 0.00 H new ATOM 0 HA VAL A 36 7.997 0.352 -3.256 1.00 0.00 H new ATOM 0 HB VAL A 36 9.169 -2.162 -2.140 1.00 0.00 H new ATOM 0 HG11 VAL A 36 7.055 -2.411 -0.819 1.00 0.00 H new ATOM 0 HG12 VAL A 36 8.009 -0.999 -0.304 1.00 0.00 H new ATOM 0 HG13 VAL A 36 6.571 -0.776 -1.330 1.00 0.00 H new ATOM 0 HG21 VAL A 36 7.070 -3.198 -3.076 1.00 0.00 H new ATOM 0 HG22 VAL A 36 6.591 -1.603 -3.703 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.046 -2.409 -4.338 1.00 0.00 H new ATOM 496 N LYS A 37 10.542 0.283 -1.116 1.00 0.00 N ATOM 497 CA LYS A 37 11.205 1.100 -0.103 1.00 0.00 C ATOM 498 C LYS A 37 11.532 2.472 -0.646 1.00 0.00 C ATOM 499 O LYS A 37 11.359 3.420 0.109 1.00 0.00 O ATOM 500 CB LYS A 37 12.496 0.440 0.380 1.00 0.00 C ATOM 501 CG LYS A 37 12.172 -0.646 1.401 1.00 0.00 C ATOM 502 CD LYS A 37 13.444 -1.325 1.918 1.00 0.00 C ATOM 503 CE LYS A 37 14.079 -2.196 0.827 1.00 0.00 C ATOM 504 NZ LYS A 37 15.548 -2.210 0.921 1.00 0.00 N ATOM 0 H LYS A 37 11.024 -0.591 -1.328 1.00 0.00 H new ATOM 0 HA LYS A 37 10.514 1.195 0.735 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.033 0.009 -0.465 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.152 1.187 0.826 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.625 -0.210 2.237 1.00 0.00 H new ATOM 0 HG3 LYS A 37 11.519 -1.391 0.947 1.00 0.00 H new ATOM 0 HD2 LYS A 37 14.157 -0.569 2.247 1.00 0.00 H new ATOM 0 HD3 LYS A 37 13.206 -1.939 2.787 1.00 0.00 H new ATOM 0 HE2 LYS A 37 13.700 -3.215 0.910 1.00 0.00 H new ATOM 0 HE3 LYS A 37 13.782 -1.824 -0.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 15.938 -2.810 0.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 15.912 -1.241 0.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 15.833 -2.589 1.847 1.00 0.00 H new ATOM 518 N GLU A 38 11.975 2.583 -1.900 1.00 0.00 N ATOM 519 CA GLU A 38 12.238 3.877 -2.520 1.00 0.00 C ATOM 520 C GLU A 38 10.981 4.732 -2.410 1.00 0.00 C ATOM 521 O GLU A 38 11.031 5.823 -1.862 1.00 0.00 O ATOM 522 CB GLU A 38 12.665 3.784 -3.992 1.00 0.00 C ATOM 523 CG GLU A 38 13.893 2.920 -4.249 1.00 0.00 C ATOM 524 CD GLU A 38 15.169 3.413 -3.588 1.00 0.00 C ATOM 525 OE1 GLU A 38 15.341 3.167 -2.375 1.00 0.00 O ATOM 526 OE2 GLU A 38 16.060 3.924 -4.312 1.00 0.00 O ATOM 0 H GLU A 38 12.159 1.784 -2.507 1.00 0.00 H new ATOM 0 HA GLU A 38 13.077 4.324 -1.987 1.00 0.00 H new ATOM 0 HB2 GLU A 38 11.832 3.388 -4.573 1.00 0.00 H new ATOM 0 HB3 GLU A 38 12.862 4.790 -4.362 1.00 0.00 H new ATOM 0 HG2 GLU A 38 13.687 1.908 -3.900 1.00 0.00 H new ATOM 0 HG3 GLU A 38 14.058 2.859 -5.325 1.00 0.00 H new ATOM 533 N VAL A 39 9.849 4.221 -2.898 1.00 0.00 N ATOM 534 CA VAL A 39 8.578 4.932 -2.947 1.00 0.00 C ATOM 535 C VAL A 39 8.052 5.252 -1.532 1.00 0.00 C ATOM 536 O VAL A 39 7.457 6.319 -1.341 1.00 0.00 O ATOM 537 CB VAL A 39 7.618 4.110 -3.843 1.00 0.00 C ATOM 538 CG1 VAL A 39 6.171 4.604 -3.843 1.00 0.00 C ATOM 539 CG2 VAL A 39 8.079 4.157 -5.308 1.00 0.00 C ATOM 0 H VAL A 39 9.794 3.276 -3.279 1.00 0.00 H new ATOM 0 HA VAL A 39 8.685 5.918 -3.399 1.00 0.00 H new ATOM 0 HB VAL A 39 7.648 3.107 -3.418 1.00 0.00 H new ATOM 0 HG11 VAL A 39 5.570 3.971 -4.496 1.00 0.00 H new ATOM 0 HG12 VAL A 39 5.772 4.562 -2.830 1.00 0.00 H new ATOM 0 HG13 VAL A 39 6.138 5.632 -4.203 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.394 3.575 -5.924 1.00 0.00 H new ATOM 0 HG22 VAL A 39 8.088 5.191 -5.654 1.00 0.00 H new ATOM 0 HG23 VAL A 39 9.083 3.739 -5.387 1.00 0.00 H new ATOM 549 N LEU A 40 8.267 4.392 -0.526 1.00 0.00 N ATOM 550 CA LEU A 40 7.876 4.680 0.861 1.00 0.00 C ATOM 551 C LEU A 40 8.780 5.736 1.476 1.00 0.00 C ATOM 552 O LEU A 40 8.279 6.615 2.169 1.00 0.00 O ATOM 553 CB LEU A 40 7.857 3.422 1.754 1.00 0.00 C ATOM 554 CG LEU A 40 6.820 2.382 1.306 1.00 0.00 C ATOM 555 CD1 LEU A 40 7.045 1.082 2.086 1.00 0.00 C ATOM 556 CD2 LEU A 40 5.395 2.901 1.514 1.00 0.00 C ATOM 0 H LEU A 40 8.714 3.483 -0.650 1.00 0.00 H new ATOM 0 HA LEU A 40 6.856 5.061 0.813 1.00 0.00 H new ATOM 0 HB2 LEU A 40 8.847 2.965 1.749 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.647 3.717 2.782 1.00 0.00 H new ATOM 0 HG LEU A 40 6.944 2.191 0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.312 0.338 1.773 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.049 0.708 1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 40 6.934 1.274 3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.681 2.144 1.188 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.237 3.118 2.571 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.250 3.811 0.931 1.00 0.00 H new ATOM 568 N THR A 41 10.082 5.669 1.222 1.00 0.00 N ATOM 569 CA THR A 41 11.061 6.634 1.681 1.00 0.00 C ATOM 570 C THR A 41 10.748 8.006 1.077 1.00 0.00 C ATOM 571 O THR A 41 10.647 8.990 1.801 1.00 0.00 O ATOM 572 CB THR A 41 12.447 6.115 1.279 1.00 0.00 C ATOM 573 OG1 THR A 41 12.726 4.876 1.905 1.00 0.00 O ATOM 574 CG2 THR A 41 13.524 7.116 1.626 1.00 0.00 C ATOM 0 H THR A 41 10.494 4.915 0.672 1.00 0.00 H new ATOM 0 HA THR A 41 11.034 6.755 2.764 1.00 0.00 H new ATOM 0 HB THR A 41 12.440 5.969 0.199 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.358 4.146 1.365 1.00 0.00 H new ATOM 0 HG21 THR A 41 14.496 6.722 1.330 1.00 0.00 H new ATOM 0 HG22 THR A 41 13.335 8.051 1.098 1.00 0.00 H new ATOM 0 HG23 THR A 41 13.519 7.299 2.701 1.00 0.00 H new ATOM 582 N ASP A 42 10.543 8.057 -0.241 1.00 0.00 N ATOM 583 CA ASP A 42 10.268 9.261 -1.020 1.00 0.00 C ATOM 584 C ASP A 42 9.071 10.008 -0.459 1.00 0.00 C ATOM 585 O ASP A 42 9.030 11.235 -0.492 1.00 0.00 O ATOM 586 CB ASP A 42 9.937 8.863 -2.471 1.00 0.00 C ATOM 587 CG ASP A 42 11.013 9.149 -3.514 1.00 0.00 C ATOM 588 OD1 ASP A 42 12.179 9.424 -3.162 1.00 0.00 O ATOM 589 OD2 ASP A 42 10.661 9.092 -4.720 1.00 0.00 O ATOM 0 H ASP A 42 10.566 7.218 -0.820 1.00 0.00 H new ATOM 0 HA ASP A 42 11.150 9.900 -0.978 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.717 7.796 -2.491 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.026 9.382 -2.769 1.00 0.00 H new ATOM 594 N ASN A 43 8.067 9.268 0.010 1.00 0.00 N ATOM 595 CA ASN A 43 6.828 9.830 0.524 1.00 0.00 C ATOM 596 C ASN A 43 6.801 9.799 2.056 1.00 0.00 C ATOM 597 O ASN A 43 5.766 10.107 2.651 1.00 0.00 O ATOM 598 CB ASN A 43 5.639 9.118 -0.127 1.00 0.00 C ATOM 599 CG ASN A 43 5.563 9.420 -1.619 1.00 0.00 C ATOM 600 OD1 ASN A 43 5.000 10.429 -2.035 1.00 0.00 O ATOM 601 ND2 ASN A 43 6.097 8.556 -2.467 1.00 0.00 N ATOM 0 H ASN A 43 8.096 8.249 0.042 1.00 0.00 H new ATOM 0 HA ASN A 43 6.758 10.884 0.257 1.00 0.00 H new ATOM 0 HB2 ASN A 43 5.729 8.042 0.025 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.714 9.432 0.357 1.00 0.00 H new ATOM 0 HD21 ASN A 43 6.042 8.727 -3.471 1.00 0.00 H new ATOM 0 HD22 ASN A 43 6.564 7.719 -2.117 1.00 0.00 H new ATOM 608 N ASN A 44 7.942 9.470 2.674 1.00 0.00 N ATOM 609 CA ASN A 44 8.256 9.385 4.095 1.00 0.00 C ATOM 610 C ASN A 44 7.150 8.691 4.880 1.00 0.00 C ATOM 611 O ASN A 44 6.372 9.310 5.613 1.00 0.00 O ATOM 612 CB ASN A 44 8.641 10.765 4.622 1.00 0.00 C ATOM 613 CG ASN A 44 10.011 11.184 4.099 1.00 0.00 C ATOM 614 OD1 ASN A 44 11.028 10.796 4.675 1.00 0.00 O ATOM 615 ND2 ASN A 44 10.075 11.915 2.996 1.00 0.00 N ATOM 0 H ASN A 44 8.762 9.229 2.117 1.00 0.00 H new ATOM 0 HA ASN A 44 9.126 8.745 4.239 1.00 0.00 H new ATOM 0 HB2 ASN A 44 7.892 11.497 4.319 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.651 10.753 5.712 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.982 12.169 2.605 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.217 12.224 2.538 1.00 0.00 H new ATOM 622 N LEU A 45 7.074 7.377 4.684 1.00 0.00 N ATOM 623 CA LEU A 45 6.017 6.491 5.159 1.00 0.00 C ATOM 624 C LEU A 45 6.597 5.376 6.010 1.00 0.00 C ATOM 625 O LEU A 45 7.529 4.684 5.589 1.00 0.00 O ATOM 626 CB LEU A 45 5.306 5.879 3.947 1.00 0.00 C ATOM 627 CG LEU A 45 4.406 6.912 3.265 1.00 0.00 C ATOM 628 CD1 LEU A 45 4.262 6.561 1.795 1.00 0.00 C ATOM 629 CD2 LEU A 45 3.026 6.999 3.910 1.00 0.00 C ATOM 0 H LEU A 45 7.790 6.874 4.159 1.00 0.00 H new ATOM 0 HA LEU A 45 5.316 7.065 5.765 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.044 5.508 3.236 1.00 0.00 H new ATOM 0 HB3 LEU A 45 4.710 5.023 4.264 1.00 0.00 H new ATOM 0 HG LEU A 45 4.878 7.888 3.380 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.621 7.295 1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.244 6.565 1.322 1.00 0.00 H new ATOM 0 HD13 LEU A 45 3.817 5.571 1.699 1.00 0.00 H new ATOM 0 HD21 LEU A 45 2.427 7.746 3.389 1.00 0.00 H new ATOM 0 HD22 LEU A 45 2.533 6.029 3.846 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.131 7.284 4.957 1.00 0.00 H new ATOM 641 N GLY A 46 5.992 5.166 7.179 1.00 0.00 N ATOM 642 CA GLY A 46 6.291 4.042 8.049 1.00 0.00 C ATOM 643 C GLY A 46 5.966 2.734 7.340 1.00 0.00 C ATOM 644 O GLY A 46 4.838 2.556 6.873 1.00 0.00 O ATOM 0 H GLY A 46 5.270 5.785 7.549 1.00 0.00 H new ATOM 0 HA2 GLY A 46 7.344 4.060 8.332 1.00 0.00 H new ATOM 0 HA3 GLY A 46 5.712 4.120 8.969 1.00 0.00 H new ATOM 648 N GLN A 47 6.923 1.800 7.299 1.00 0.00 N ATOM 649 CA GLN A 47 6.766 0.513 6.616 1.00 0.00 C ATOM 650 C GLN A 47 5.504 -0.234 7.072 1.00 0.00 C ATOM 651 O GLN A 47 4.894 -0.918 6.251 1.00 0.00 O ATOM 652 CB GLN A 47 7.987 -0.386 6.883 1.00 0.00 C ATOM 653 CG GLN A 47 9.155 -0.074 5.946 1.00 0.00 C ATOM 654 CD GLN A 47 10.460 -0.668 6.471 1.00 0.00 C ATOM 655 OE1 GLN A 47 10.998 -0.203 7.471 1.00 0.00 O ATOM 656 NE2 GLN A 47 10.999 -1.711 5.860 1.00 0.00 N ATOM 0 H GLN A 47 7.834 1.918 7.742 1.00 0.00 H new ATOM 0 HA GLN A 47 6.677 0.731 5.552 1.00 0.00 H new ATOM 0 HB2 GLN A 47 8.310 -0.259 7.916 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.699 -1.431 6.765 1.00 0.00 H new ATOM 0 HG2 GLN A 47 8.945 -0.473 4.954 1.00 0.00 H new ATOM 0 HG3 GLN A 47 9.261 1.006 5.840 1.00 0.00 H new ATOM 0 HE21 GLN A 47 10.555 -2.101 5.028 1.00 0.00 H new ATOM 0 HE22 GLN A 47 11.858 -2.125 6.221 1.00 0.00 H new ATOM 665 N ARG A 48 5.111 -0.117 8.356 1.00 0.00 N ATOM 666 CA ARG A 48 3.950 -0.828 8.904 1.00 0.00 C ATOM 667 C ARG A 48 2.738 -0.575 8.031 1.00 0.00 C ATOM 668 O ARG A 48 2.073 -1.519 7.651 1.00 0.00 O ATOM 669 CB ARG A 48 3.619 -0.410 10.352 1.00 0.00 C ATOM 670 CG ARG A 48 2.600 -1.376 11.003 1.00 0.00 C ATOM 671 CD ARG A 48 2.199 -0.951 12.423 1.00 0.00 C ATOM 672 NE ARG A 48 1.494 -2.030 13.149 1.00 0.00 N ATOM 673 CZ ARG A 48 0.565 -1.875 14.107 1.00 0.00 C ATOM 674 NH1 ARG A 48 0.233 -0.673 14.570 1.00 0.00 N ATOM 675 NH2 ARG A 48 -0.014 -2.935 14.654 1.00 0.00 N ATOM 0 H ARG A 48 5.591 0.472 9.036 1.00 0.00 H new ATOM 0 HA ARG A 48 4.207 -1.887 8.917 1.00 0.00 H new ATOM 0 HB2 ARG A 48 4.534 -0.391 10.944 1.00 0.00 H new ATOM 0 HB3 ARG A 48 3.216 0.603 10.356 1.00 0.00 H new ATOM 0 HG2 ARG A 48 1.708 -1.430 10.379 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.027 -2.379 11.036 1.00 0.00 H new ATOM 0 HD2 ARG A 48 3.091 -0.663 12.980 1.00 0.00 H new ATOM 0 HD3 ARG A 48 1.558 -0.071 12.370 1.00 0.00 H new ATOM 0 HE ARG A 48 1.738 -2.988 12.897 1.00 0.00 H new ATOM 0 HH11 ARG A 48 0.687 0.161 14.197 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -0.476 -0.585 15.298 1.00 0.00 H new ATOM 0 HH21 ARG A 48 0.245 -3.873 14.348 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.719 -2.813 15.381 1.00 0.00 H new ATOM 689 N LEU A 49 2.465 0.695 7.736 1.00 0.00 N ATOM 690 CA LEU A 49 1.290 1.169 7.027 1.00 0.00 C ATOM 691 C LEU A 49 1.180 0.437 5.690 1.00 0.00 C ATOM 692 O LEU A 49 0.123 -0.091 5.352 1.00 0.00 O ATOM 693 CB LEU A 49 1.480 2.696 6.838 1.00 0.00 C ATOM 694 CG LEU A 49 0.226 3.587 6.820 1.00 0.00 C ATOM 695 CD1 LEU A 49 0.639 5.000 6.391 1.00 0.00 C ATOM 696 CD2 LEU A 49 -0.940 3.118 5.959 1.00 0.00 C ATOM 0 H LEU A 49 3.092 1.455 8.001 1.00 0.00 H new ATOM 0 HA LEU A 49 0.367 0.976 7.573 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.130 3.052 7.637 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.013 2.852 5.900 1.00 0.00 H new ATOM 0 HG LEU A 49 -0.164 3.545 7.837 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.239 5.646 6.373 1.00 0.00 H new ATOM 0 HD12 LEU A 49 1.367 5.397 7.099 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.083 4.963 5.396 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.759 3.834 6.034 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.618 3.043 4.920 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.278 2.142 6.305 1.00 0.00 H new ATOM 708 N PHE A 50 2.271 0.404 4.925 1.00 0.00 N ATOM 709 CA PHE A 50 2.313 -0.253 3.628 1.00 0.00 C ATOM 710 C PHE A 50 1.944 -1.723 3.748 1.00 0.00 C ATOM 711 O PHE A 50 1.042 -2.189 3.047 1.00 0.00 O ATOM 712 CB PHE A 50 3.709 -0.088 3.028 1.00 0.00 C ATOM 713 CG PHE A 50 3.946 -0.937 1.798 1.00 0.00 C ATOM 714 CD1 PHE A 50 3.371 -0.568 0.568 1.00 0.00 C ATOM 715 CD2 PHE A 50 4.727 -2.108 1.892 1.00 0.00 C ATOM 716 CE1 PHE A 50 3.608 -1.346 -0.573 1.00 0.00 C ATOM 717 CE2 PHE A 50 4.960 -2.890 0.749 1.00 0.00 C ATOM 718 CZ PHE A 50 4.415 -2.489 -0.483 1.00 0.00 C ATOM 0 H PHE A 50 3.155 0.837 5.194 1.00 0.00 H new ATOM 0 HA PHE A 50 1.580 0.212 2.968 1.00 0.00 H new ATOM 0 HB2 PHE A 50 3.863 0.960 2.771 1.00 0.00 H new ATOM 0 HB3 PHE A 50 4.452 -0.343 3.784 1.00 0.00 H new ATOM 0 HD1 PHE A 50 2.749 0.312 0.504 1.00 0.00 H new ATOM 0 HD2 PHE A 50 5.146 -2.403 2.843 1.00 0.00 H new ATOM 0 HE1 PHE A 50 3.170 -1.066 -1.520 1.00 0.00 H new ATOM 0 HE2 PHE A 50 5.552 -3.791 0.816 1.00 0.00 H new ATOM 0 HZ PHE A 50 4.620 -3.068 -1.371 1.00 0.00 H new ATOM 728 N GLY A 51 2.636 -2.446 4.632 1.00 0.00 N ATOM 729 CA GLY A 51 2.342 -3.847 4.843 1.00 0.00 C ATOM 730 C GLY A 51 0.889 -4.006 5.243 1.00 0.00 C ATOM 731 O GLY A 51 0.180 -4.778 4.617 1.00 0.00 O ATOM 0 H GLY A 51 3.396 -2.079 5.204 1.00 0.00 H new ATOM 0 HA2 GLY A 51 2.543 -4.412 3.933 1.00 0.00 H new ATOM 0 HA3 GLY A 51 2.990 -4.252 5.620 1.00 0.00 H new ATOM 735 N GLU A 52 0.414 -3.250 6.221 1.00 0.00 N ATOM 736 CA GLU A 52 -0.897 -3.440 6.806 1.00 0.00 C ATOM 737 C GLU A 52 -2.044 -3.062 5.871 1.00 0.00 C ATOM 738 O GLU A 52 -3.149 -3.578 6.040 1.00 0.00 O ATOM 739 CB GLU A 52 -0.988 -2.630 8.108 1.00 0.00 C ATOM 740 CG GLU A 52 -0.623 -3.480 9.329 1.00 0.00 C ATOM 741 CD GLU A 52 -1.634 -4.616 9.503 1.00 0.00 C ATOM 742 OE1 GLU A 52 -2.718 -4.365 10.079 1.00 0.00 O ATOM 743 OE2 GLU A 52 -1.413 -5.735 9.000 1.00 0.00 O ATOM 0 H GLU A 52 0.938 -2.478 6.633 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.009 -4.506 7.004 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.320 -1.771 8.050 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -1.999 -2.240 8.225 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.379 -3.891 9.209 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.607 -2.857 10.223 1.00 0.00 H new ATOM 750 N SER A 53 -1.818 -2.183 4.898 1.00 0.00 N ATOM 751 CA SER A 53 -2.836 -1.734 3.963 1.00 0.00 C ATOM 752 C SER A 53 -2.905 -2.616 2.725 1.00 0.00 C ATOM 753 O SER A 53 -3.990 -2.852 2.199 1.00 0.00 O ATOM 754 CB SER A 53 -2.487 -0.312 3.543 1.00 0.00 C ATOM 755 OG SER A 53 -2.425 0.507 4.691 1.00 0.00 O ATOM 0 H SER A 53 -0.905 -1.758 4.738 1.00 0.00 H new ATOM 0 HA SER A 53 -3.808 -1.783 4.453 1.00 0.00 H new ATOM 0 HB2 SER A 53 -1.531 -0.299 3.020 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.236 0.070 2.849 1.00 0.00 H new ATOM 0 HG SER A 53 -1.524 0.466 5.074 1.00 0.00 H new ATOM 761 N ILE A 54 -1.748 -3.044 2.224 1.00 0.00 N ATOM 762 CA ILE A 54 -1.625 -3.713 0.936 1.00 0.00 C ATOM 763 C ILE A 54 -1.456 -5.213 1.192 1.00 0.00 C ATOM 764 O ILE A 54 -2.195 -6.048 0.667 1.00 0.00 O ATOM 765 CB ILE A 54 -0.449 -3.076 0.146 1.00 0.00 C ATOM 766 CG1 ILE A 54 -0.478 -1.532 0.100 1.00 0.00 C ATOM 767 CG2 ILE A 54 -0.387 -3.628 -1.288 1.00 0.00 C ATOM 768 CD1 ILE A 54 -1.780 -0.892 -0.392 1.00 0.00 C ATOM 0 H ILE A 54 -0.858 -2.933 2.710 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.515 -3.588 0.319 1.00 0.00 H new ATOM 0 HB ILE A 54 0.447 -3.357 0.699 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.269 -1.156 1.101 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.334 -1.194 -0.543 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.445 -3.166 -1.820 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.243 -4.708 -1.256 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.319 -3.402 -1.806 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.679 0.193 -0.380 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -1.988 -1.226 -1.409 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.600 -1.187 0.262 1.00 0.00 H new ATOM 780 N LEU A 55 -0.464 -5.572 2.003 1.00 0.00 N ATOM 781 CA LEU A 55 0.013 -6.946 2.151 1.00 0.00 C ATOM 782 C LEU A 55 -0.719 -7.716 3.247 1.00 0.00 C ATOM 783 O LEU A 55 -0.829 -8.939 3.147 1.00 0.00 O ATOM 784 CB LEU A 55 1.531 -6.932 2.392 1.00 0.00 C ATOM 785 CG LEU A 55 2.306 -6.117 1.334 1.00 0.00 C ATOM 786 CD1 LEU A 55 3.808 -6.308 1.528 1.00 0.00 C ATOM 787 CD2 LEU A 55 1.940 -6.502 -0.102 1.00 0.00 C ATOM 0 H LEU A 55 0.040 -4.905 2.587 1.00 0.00 H new ATOM 0 HA LEU A 55 -0.205 -7.478 1.225 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.732 -6.517 3.380 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.902 -7.957 2.395 1.00 0.00 H new ATOM 0 HG LEU A 55 2.026 -5.074 1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.348 -5.730 0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 55 4.093 -5.967 2.523 1.00 0.00 H new ATOM 0 HD13 LEU A 55 4.057 -7.364 1.421 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.517 -5.895 -0.800 1.00 0.00 H new ATOM 0 HD22 LEU A 55 2.166 -7.556 -0.265 1.00 0.00 H new ATOM 0 HD23 LEU A 55 0.876 -6.329 -0.265 1.00 0.00 H new ATOM 799 N GLY A 56 -1.250 -7.022 4.249 1.00 0.00 N ATOM 800 CA GLY A 56 -1.748 -7.593 5.486 1.00 0.00 C ATOM 801 C GLY A 56 -0.626 -7.938 6.468 1.00 0.00 C ATOM 802 O GLY A 56 -0.802 -8.862 7.259 1.00 0.00 O ATOM 0 H GLY A 56 -1.347 -6.007 4.215 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.434 -6.889 5.957 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.320 -8.494 5.262 1.00 0.00 H new ATOM 806 N LEU A 57 0.532 -7.264 6.416 1.00 0.00 N ATOM 807 CA LEU A 57 1.694 -7.601 7.237 1.00 0.00 C ATOM 808 C LEU A 57 2.056 -6.436 8.145 1.00 0.00 C ATOM 809 O LEU A 57 2.083 -5.294 7.692 1.00 0.00 O ATOM 810 CB LEU A 57 2.885 -7.920 6.328 1.00 0.00 C ATOM 811 CG LEU A 57 2.711 -9.210 5.510 1.00 0.00 C ATOM 812 CD1 LEU A 57 3.835 -9.247 4.480 1.00 0.00 C ATOM 813 CD2 LEU A 57 2.772 -10.467 6.383 1.00 0.00 C ATOM 0 H LEU A 57 0.685 -6.467 5.799 1.00 0.00 H new ATOM 0 HA LEU A 57 1.451 -8.468 7.851 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.043 -7.086 5.645 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.784 -8.006 6.939 1.00 0.00 H new ATOM 0 HG LEU A 57 1.728 -9.204 5.039 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.746 -10.151 3.877 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.766 -8.372 3.834 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.797 -9.245 4.992 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.644 -11.351 5.758 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.738 -10.515 6.885 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.977 -10.431 7.128 1.00 0.00 H new ATOM 825 N THR A 58 2.424 -6.735 9.389 1.00 0.00 N ATOM 826 CA THR A 58 2.844 -5.714 10.345 1.00 0.00 C ATOM 827 C THR A 58 4.309 -5.317 10.108 1.00 0.00 C ATOM 828 O THR A 58 4.987 -5.861 9.234 1.00 0.00 O ATOM 829 CB THR A 58 2.501 -6.128 11.781 1.00 0.00 C ATOM 830 OG1 THR A 58 2.551 -5.002 12.648 1.00 0.00 O ATOM 831 CG2 THR A 58 3.465 -7.197 12.271 1.00 0.00 C ATOM 0 H THR A 58 2.439 -7.685 9.760 1.00 0.00 H new ATOM 0 HA THR A 58 2.275 -4.799 10.181 1.00 0.00 H new ATOM 0 HB THR A 58 1.490 -6.534 11.786 1.00 0.00 H new ATOM 0 HG1 THR A 58 2.328 -5.282 13.560 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.207 -7.479 13.292 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.397 -8.072 11.625 1.00 0.00 H new ATOM 0 HG23 THR A 58 4.483 -6.807 12.248 1.00 0.00 H new ATOM 839 N GLN A 59 4.800 -4.346 10.885 1.00 0.00 N ATOM 840 CA GLN A 59 6.053 -3.653 10.639 1.00 0.00 C ATOM 841 C GLN A 59 7.228 -4.620 10.617 1.00 0.00 C ATOM 842 O GLN A 59 8.009 -4.569 9.671 1.00 0.00 O ATOM 843 CB GLN A 59 6.263 -2.552 11.685 1.00 0.00 C ATOM 844 CG GLN A 59 7.250 -1.469 11.216 1.00 0.00 C ATOM 845 CD GLN A 59 7.321 -0.288 12.189 1.00 0.00 C ATOM 846 OE1 GLN A 59 6.471 -0.110 13.055 1.00 0.00 O ATOM 847 NE2 GLN A 59 8.294 0.591 12.045 1.00 0.00 N ATOM 0 H GLN A 59 4.319 -4.017 11.722 1.00 0.00 H new ATOM 0 HA GLN A 59 5.998 -3.189 9.654 1.00 0.00 H new ATOM 0 HB2 GLN A 59 5.304 -2.088 11.916 1.00 0.00 H new ATOM 0 HB3 GLN A 59 6.632 -2.999 12.608 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.242 -1.907 11.107 1.00 0.00 H new ATOM 0 HG3 GLN A 59 6.950 -1.109 10.232 1.00 0.00 H new ATOM 0 HE21 GLN A 59 9.005 0.451 11.328 1.00 0.00 H new ATOM 0 HE22 GLN A 59 8.335 1.410 12.651 1.00 0.00 H new ATOM 856 N GLY A 60 7.363 -5.483 11.625 1.00 0.00 N ATOM 857 CA GLY A 60 8.434 -6.464 11.690 1.00 0.00 C ATOM 858 C GLY A 60 8.392 -7.394 10.487 1.00 0.00 C ATOM 859 O GLY A 60 9.381 -7.489 9.760 1.00 0.00 O ATOM 0 H GLY A 60 6.726 -5.517 12.421 1.00 0.00 H new ATOM 0 HA2 GLY A 60 9.397 -5.955 11.728 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.345 -7.046 12.608 1.00 0.00 H new ATOM 863 N SER A 61 7.237 -8.017 10.234 1.00 0.00 N ATOM 864 CA SER A 61 7.040 -8.977 9.160 1.00 0.00 C ATOM 865 C SER A 61 7.415 -8.359 7.816 1.00 0.00 C ATOM 866 O SER A 61 8.138 -8.960 7.022 1.00 0.00 O ATOM 867 CB SER A 61 5.569 -9.407 9.156 1.00 0.00 C ATOM 868 OG SER A 61 5.143 -9.756 10.457 1.00 0.00 O ATOM 0 H SER A 61 6.396 -7.859 10.789 1.00 0.00 H new ATOM 0 HA SER A 61 7.680 -9.845 9.320 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.950 -8.597 8.771 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.436 -10.256 8.485 1.00 0.00 H new ATOM 0 HG SER A 61 4.201 -10.026 10.432 1.00 0.00 H new ATOM 874 N VAL A 62 6.937 -7.143 7.556 1.00 0.00 N ATOM 875 CA VAL A 62 7.147 -6.475 6.291 1.00 0.00 C ATOM 876 C VAL A 62 8.568 -5.911 6.196 1.00 0.00 C ATOM 877 O VAL A 62 9.093 -5.799 5.093 1.00 0.00 O ATOM 878 CB VAL A 62 6.028 -5.429 6.102 1.00 0.00 C ATOM 879 CG1 VAL A 62 6.380 -4.005 6.548 1.00 0.00 C ATOM 880 CG2 VAL A 62 5.591 -5.419 4.638 1.00 0.00 C ATOM 0 H VAL A 62 6.392 -6.599 8.225 1.00 0.00 H new ATOM 0 HA VAL A 62 7.078 -7.177 5.460 1.00 0.00 H new ATOM 0 HB VAL A 62 5.218 -5.741 6.762 1.00 0.00 H new ATOM 0 HG11 VAL A 62 5.528 -3.348 6.373 1.00 0.00 H new ATOM 0 HG12 VAL A 62 6.625 -4.007 7.610 1.00 0.00 H new ATOM 0 HG13 VAL A 62 7.237 -3.647 5.978 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.800 -4.682 4.499 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.441 -5.163 4.006 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.219 -6.406 4.363 1.00 0.00 H new ATOM 890 N SER A 63 9.223 -5.578 7.313 1.00 0.00 N ATOM 891 CA SER A 63 10.630 -5.198 7.307 1.00 0.00 C ATOM 892 C SER A 63 11.475 -6.414 6.953 1.00 0.00 C ATOM 893 O SER A 63 12.359 -6.313 6.107 1.00 0.00 O ATOM 894 CB SER A 63 11.051 -4.619 8.656 1.00 0.00 C ATOM 895 OG SER A 63 10.264 -3.480 8.933 1.00 0.00 O ATOM 0 H SER A 63 8.792 -5.566 8.238 1.00 0.00 H new ATOM 0 HA SER A 63 10.784 -4.421 6.559 1.00 0.00 H new ATOM 0 HB2 SER A 63 10.925 -5.364 9.441 1.00 0.00 H new ATOM 0 HB3 SER A 63 12.107 -4.351 8.638 1.00 0.00 H new ATOM 0 HG SER A 63 9.345 -3.758 9.132 1.00 0.00 H new ATOM 901 N ASP A 64 11.163 -7.575 7.531 1.00 0.00 N ATOM 902 CA ASP A 64 11.785 -8.843 7.174 1.00 0.00 C ATOM 903 C ASP A 64 11.574 -9.124 5.686 1.00 0.00 C ATOM 904 O ASP A 64 12.485 -9.609 5.015 1.00 0.00 O ATOM 905 CB ASP A 64 11.217 -9.996 8.028 1.00 0.00 C ATOM 906 CG ASP A 64 12.103 -10.414 9.207 1.00 0.00 C ATOM 907 OD1 ASP A 64 13.342 -10.477 9.043 1.00 0.00 O ATOM 908 OD2 ASP A 64 11.536 -10.735 10.282 1.00 0.00 O ATOM 0 H ASP A 64 10.463 -7.658 8.268 1.00 0.00 H new ATOM 0 HA ASP A 64 12.854 -8.774 7.374 1.00 0.00 H new ATOM 0 HB2 ASP A 64 10.241 -9.700 8.412 1.00 0.00 H new ATOM 0 HB3 ASP A 64 11.058 -10.862 7.386 1.00 0.00 H new ATOM 913 N LEU A 65 10.376 -8.853 5.156 1.00 0.00 N ATOM 914 CA LEU A 65 10.056 -9.042 3.747 1.00 0.00 C ATOM 915 C LEU A 65 10.864 -8.106 2.846 1.00 0.00 C ATOM 916 O LEU A 65 11.496 -8.572 1.900 1.00 0.00 O ATOM 917 CB LEU A 65 8.536 -8.898 3.535 1.00 0.00 C ATOM 918 CG LEU A 65 8.064 -9.813 2.393 1.00 0.00 C ATOM 919 CD1 LEU A 65 8.045 -11.270 2.874 1.00 0.00 C ATOM 920 CD2 LEU A 65 6.658 -9.478 1.896 1.00 0.00 C ATOM 0 H LEU A 65 9.596 -8.492 5.705 1.00 0.00 H new ATOM 0 HA LEU A 65 10.344 -10.052 3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.009 -9.152 4.454 1.00 0.00 H new ATOM 0 HB3 LEU A 65 8.291 -7.861 3.303 1.00 0.00 H new ATOM 0 HG LEU A 65 8.766 -9.661 1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.710 -11.917 2.063 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.048 -11.565 3.182 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.363 -11.365 3.719 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.385 -10.160 1.091 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.948 -9.582 2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 65 6.637 -8.453 1.526 1.00 0.00 H new ATOM 932 N LEU A 66 10.865 -6.807 3.148 1.00 0.00 N ATOM 933 CA LEU A 66 11.482 -5.760 2.338 1.00 0.00 C ATOM 934 C LEU A 66 13.002 -5.821 2.394 1.00 0.00 C ATOM 935 O LEU A 66 13.693 -5.625 1.393 1.00 0.00 O ATOM 936 CB LEU A 66 11.014 -4.377 2.831 1.00 0.00 C ATOM 937 CG LEU A 66 9.562 -4.033 2.454 1.00 0.00 C ATOM 938 CD1 LEU A 66 9.089 -2.788 3.210 1.00 0.00 C ATOM 939 CD2 LEU A 66 9.453 -3.784 0.952 1.00 0.00 C ATOM 0 H LEU A 66 10.421 -6.444 3.992 1.00 0.00 H new ATOM 0 HA LEU A 66 11.173 -5.919 1.305 1.00 0.00 H new ATOM 0 HB2 LEU A 66 11.116 -4.336 3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 66 11.675 -3.614 2.420 1.00 0.00 H new ATOM 0 HG LEU A 66 8.930 -4.877 2.729 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.060 -2.561 2.930 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.141 -2.972 4.283 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.729 -1.943 2.956 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.421 -3.542 0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 66 10.101 -2.953 0.673 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.759 -4.680 0.412 1.00 0.00 H new ATOM 951 N SER A 67 13.529 -6.032 3.588 1.00 0.00 N ATOM 952 CA SER A 67 14.956 -6.138 3.812 1.00 0.00 C ATOM 953 C SER A 67 15.470 -7.463 3.246 1.00 0.00 C ATOM 954 O SER A 67 16.460 -7.454 2.506 1.00 0.00 O ATOM 955 CB SER A 67 15.296 -5.939 5.294 1.00 0.00 C ATOM 956 OG SER A 67 16.647 -5.542 5.397 1.00 0.00 O ATOM 0 H SER A 67 12.971 -6.135 4.436 1.00 0.00 H new ATOM 0 HA SER A 67 15.471 -5.339 3.279 1.00 0.00 H new ATOM 0 HB2 SER A 67 14.645 -5.183 5.733 1.00 0.00 H new ATOM 0 HB3 SER A 67 15.130 -6.863 5.848 1.00 0.00 H new ATOM 0 HG SER A 67 16.878 -5.409 6.340 1.00 0.00 H new ATOM 962 N ARG A 68 14.820 -8.600 3.526 1.00 0.00 N ATOM 963 CA ARG A 68 15.305 -9.909 3.089 1.00 0.00 C ATOM 964 C ARG A 68 14.210 -10.666 2.334 1.00 0.00 C ATOM 965 O ARG A 68 13.658 -11.642 2.851 1.00 0.00 O ATOM 966 CB ARG A 68 15.934 -10.675 4.266 1.00 0.00 C ATOM 967 CG ARG A 68 17.146 -9.909 4.836 1.00 0.00 C ATOM 968 CD ARG A 68 18.200 -10.848 5.421 1.00 0.00 C ATOM 969 NE ARG A 68 19.248 -10.096 6.131 1.00 0.00 N ATOM 970 CZ ARG A 68 20.461 -9.725 5.697 1.00 0.00 C ATOM 971 NH1 ARG A 68 20.870 -9.930 4.452 1.00 0.00 N ATOM 972 NH2 ARG A 68 21.286 -9.114 6.529 1.00 0.00 N ATOM 0 H ARG A 68 13.950 -8.636 4.058 1.00 0.00 H new ATOM 0 HA ARG A 68 16.113 -9.786 2.367 1.00 0.00 H new ATOM 0 HB2 ARG A 68 15.190 -10.821 5.049 1.00 0.00 H new ATOM 0 HB3 ARG A 68 16.247 -11.665 3.935 1.00 0.00 H new ATOM 0 HG2 ARG A 68 17.596 -9.307 4.047 1.00 0.00 H new ATOM 0 HG3 ARG A 68 16.807 -9.220 5.609 1.00 0.00 H new ATOM 0 HD2 ARG A 68 17.725 -11.550 6.106 1.00 0.00 H new ATOM 0 HD3 ARG A 68 18.650 -11.437 4.622 1.00 0.00 H new ATOM 0 HE ARG A 68 19.019 -9.819 7.086 1.00 0.00 H new ATOM 0 HH11 ARG A 68 20.252 -10.387 3.781 1.00 0.00 H new ATOM 0 HH12 ARG A 68 21.802 -9.631 4.166 1.00 0.00 H new ATOM 0 HH21 ARG A 68 20.997 -8.929 7.490 1.00 0.00 H new ATOM 0 HH22 ARG A 68 22.211 -8.827 6.210 1.00 0.00 H new ATOM 986 N PRO A 69 13.936 -10.288 1.072 1.00 0.00 N ATOM 987 CA PRO A 69 13.084 -11.077 0.193 1.00 0.00 C ATOM 988 C PRO A 69 13.756 -12.421 -0.093 1.00 0.00 C ATOM 989 O PRO A 69 14.965 -12.480 -0.346 1.00 0.00 O ATOM 990 CB PRO A 69 12.964 -10.265 -1.097 1.00 0.00 C ATOM 991 CG PRO A 69 14.213 -9.397 -1.116 1.00 0.00 C ATOM 992 CD PRO A 69 14.470 -9.131 0.362 1.00 0.00 C ATOM 0 HA PRO A 69 12.108 -11.277 0.634 1.00 0.00 H new ATOM 0 HB2 PRO A 69 12.918 -10.914 -1.972 1.00 0.00 H new ATOM 0 HB3 PRO A 69 12.058 -9.658 -1.102 1.00 0.00 H new ATOM 0 HG2 PRO A 69 15.053 -9.909 -1.586 1.00 0.00 H new ATOM 0 HG3 PRO A 69 14.053 -8.472 -1.670 1.00 0.00 H new ATOM 0 HD2 PRO A 69 15.535 -9.009 0.558 1.00 0.00 H new ATOM 0 HD3 PRO A 69 13.979 -8.213 0.685 1.00 0.00 H new ATOM 1000 N LYS A 70 12.976 -13.501 -0.111 1.00 0.00 N ATOM 1001 CA LYS A 70 13.392 -14.764 -0.707 1.00 0.00 C ATOM 1002 C LYS A 70 13.244 -14.676 -2.234 1.00 0.00 C ATOM 1003 O LYS A 70 12.539 -13.792 -2.730 1.00 0.00 O ATOM 1004 CB LYS A 70 12.551 -15.898 -0.102 1.00 0.00 C ATOM 1005 CG LYS A 70 13.258 -16.460 1.139 1.00 0.00 C ATOM 1006 CD LYS A 70 12.426 -17.471 1.941 1.00 0.00 C ATOM 1007 CE LYS A 70 11.507 -16.803 2.974 1.00 0.00 C ATOM 1008 NZ LYS A 70 10.225 -16.305 2.444 1.00 0.00 N ATOM 0 H LYS A 70 12.038 -13.522 0.288 1.00 0.00 H new ATOM 0 HA LYS A 70 14.440 -14.973 -0.492 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.562 -15.527 0.168 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.405 -16.688 -0.838 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.187 -16.938 0.827 1.00 0.00 H new ATOM 0 HG3 LYS A 70 13.530 -15.632 1.793 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.822 -18.063 1.254 1.00 0.00 H new ATOM 0 HD3 LYS A 70 13.097 -18.162 2.452 1.00 0.00 H new ATOM 0 HE2 LYS A 70 11.300 -17.519 3.769 1.00 0.00 H new ATOM 0 HE3 LYS A 70 12.043 -15.969 3.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.548 -16.188 3.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 10.375 -15.389 1.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.845 -16.987 1.757 1.00 0.00 H new ATOM 1022 N PRO A 71 13.886 -15.576 -2.995 1.00 0.00 N ATOM 1023 CA PRO A 71 13.742 -15.605 -4.443 1.00 0.00 C ATOM 1024 C PRO A 71 12.363 -16.133 -4.838 1.00 0.00 C ATOM 1025 O PRO A 71 11.692 -16.826 -4.064 1.00 0.00 O ATOM 1026 CB PRO A 71 14.872 -16.501 -4.954 1.00 0.00 C ATOM 1027 CG PRO A 71 15.245 -17.370 -3.773 1.00 0.00 C ATOM 1028 CD PRO A 71 14.872 -16.543 -2.543 1.00 0.00 C ATOM 0 HA PRO A 71 13.813 -14.610 -4.883 1.00 0.00 H new ATOM 0 HB2 PRO A 71 14.545 -17.105 -5.801 1.00 0.00 H new ATOM 0 HB3 PRO A 71 15.722 -15.910 -5.293 1.00 0.00 H new ATOM 0 HG2 PRO A 71 14.704 -18.316 -3.792 1.00 0.00 H new ATOM 0 HG3 PRO A 71 16.308 -17.611 -3.780 1.00 0.00 H new ATOM 0 HD2 PRO A 71 14.464 -17.177 -1.755 1.00 0.00 H new ATOM 0 HD3 PRO A 71 15.748 -16.043 -2.129 1.00 0.00 H new ATOM 1036 N TRP A 72 11.970 -15.862 -6.077 1.00 0.00 N ATOM 1037 CA TRP A 72 10.663 -16.203 -6.614 1.00 0.00 C ATOM 1038 C TRP A 72 10.383 -17.716 -6.621 1.00 0.00 C ATOM 1039 O TRP A 72 9.222 -18.105 -6.543 1.00 0.00 O ATOM 1040 CB TRP A 72 10.529 -15.577 -8.005 1.00 0.00 C ATOM 1041 CG TRP A 72 9.178 -15.723 -8.626 1.00 0.00 C ATOM 1042 CD1 TRP A 72 8.854 -16.651 -9.549 1.00 0.00 C ATOM 1043 CD2 TRP A 72 7.974 -14.917 -8.432 1.00 0.00 C ATOM 1044 NE1 TRP A 72 7.545 -16.489 -9.932 1.00 0.00 N ATOM 1045 CE2 TRP A 72 6.956 -15.430 -9.289 1.00 0.00 C ATOM 1046 CE3 TRP A 72 7.643 -13.782 -7.659 1.00 0.00 C ATOM 1047 CZ2 TRP A 72 5.683 -14.862 -9.373 1.00 0.00 C ATOM 1048 CZ3 TRP A 72 6.356 -13.211 -7.723 1.00 0.00 C ATOM 1049 CH2 TRP A 72 5.383 -13.745 -8.584 1.00 0.00 C ATOM 0 H TRP A 72 12.569 -15.386 -6.752 1.00 0.00 H new ATOM 0 HA TRP A 72 9.899 -15.791 -5.955 1.00 0.00 H new ATOM 0 HB2 TRP A 72 10.770 -14.516 -7.936 1.00 0.00 H new ATOM 0 HB3 TRP A 72 11.269 -16.030 -8.665 1.00 0.00 H new ATOM 0 HD1 TRP A 72 9.523 -17.408 -9.930 1.00 0.00 H new ATOM 0 HE1 TRP A 72 7.069 -17.083 -10.611 1.00 0.00 H new ATOM 0 HE3 TRP A 72 8.387 -13.345 -7.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 4.940 -15.279 -10.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 6.116 -12.357 -7.106 1.00 0.00 H new ATOM 0 HH2 TRP A 72 4.403 -13.294 -8.637 1.00 0.00 H new ATOM 1060 N HIS A 73 11.390 -18.597 -6.651 1.00 0.00 N ATOM 1061 CA HIS A 73 11.170 -20.043 -6.515 1.00 0.00 C ATOM 1062 C HIS A 73 10.961 -20.470 -5.054 1.00 0.00 C ATOM 1063 O HIS A 73 10.206 -21.401 -4.759 1.00 0.00 O ATOM 1064 CB HIS A 73 12.323 -20.824 -7.158 1.00 0.00 C ATOM 1065 CG HIS A 73 13.634 -20.811 -6.412 1.00 0.00 C ATOM 1066 ND1 HIS A 73 14.658 -19.908 -6.579 1.00 0.00 N ATOM 1067 CD2 HIS A 73 14.051 -21.747 -5.505 1.00 0.00 C ATOM 1068 CE1 HIS A 73 15.672 -20.300 -5.784 1.00 0.00 C ATOM 1069 NE2 HIS A 73 15.356 -21.434 -5.127 1.00 0.00 N ATOM 0 H HIS A 73 12.368 -18.333 -6.769 1.00 0.00 H new ATOM 0 HA HIS A 73 10.247 -20.281 -7.044 1.00 0.00 H new ATOM 0 HB2 HIS A 73 12.009 -21.861 -7.280 1.00 0.00 H new ATOM 0 HB3 HIS A 73 12.493 -20.423 -8.157 1.00 0.00 H new ATOM 0 HD2 HIS A 73 13.470 -22.583 -5.145 1.00 0.00 H new ATOM 0 HE1 HIS A 73 16.612 -19.776 -5.686 1.00 0.00 H new ATOM 0 HE2 HIS A 73 15.951 -21.957 -4.484 1.00 0.00 H new ATOM 1077 N LYS A 74 11.625 -19.792 -4.115 1.00 0.00 N ATOM 1078 CA LYS A 74 11.497 -20.036 -2.675 1.00 0.00 C ATOM 1079 C LYS A 74 10.150 -19.582 -2.156 1.00 0.00 C ATOM 1080 O LYS A 74 9.667 -20.086 -1.137 1.00 0.00 O ATOM 1081 CB LYS A 74 12.623 -19.301 -1.947 1.00 0.00 C ATOM 1082 CG LYS A 74 13.925 -20.107 -2.033 1.00 0.00 C ATOM 1083 CD LYS A 74 14.016 -21.146 -0.908 1.00 0.00 C ATOM 1084 CE LYS A 74 15.026 -22.233 -1.266 1.00 0.00 C ATOM 1085 NZ LYS A 74 16.428 -21.785 -1.183 1.00 0.00 N ATOM 0 H LYS A 74 12.280 -19.043 -4.338 1.00 0.00 H new ATOM 0 HA LYS A 74 11.572 -21.108 -2.490 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.768 -18.315 -2.388 1.00 0.00 H new ATOM 0 HB3 LYS A 74 12.351 -19.147 -0.903 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.981 -20.609 -2.999 1.00 0.00 H new ATOM 0 HG3 LYS A 74 14.778 -19.431 -1.975 1.00 0.00 H new ATOM 0 HD2 LYS A 74 14.311 -20.659 0.022 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.037 -21.593 -0.737 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.885 -23.083 -0.598 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.825 -22.585 -2.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 17.059 -22.571 -1.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 16.579 -20.993 -1.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 16.636 -21.475 -0.212 1.00 0.00 H new ATOM 1099 N LEU A 75 9.555 -18.610 -2.823 1.00 0.00 N ATOM 1100 CA LEU A 75 8.213 -18.161 -2.570 1.00 0.00 C ATOM 1101 C LEU A 75 7.314 -19.017 -3.450 1.00 0.00 C ATOM 1102 O LEU A 75 7.395 -18.966 -4.668 1.00 0.00 O ATOM 1103 CB LEU A 75 8.143 -16.677 -2.918 1.00 0.00 C ATOM 1104 CG LEU A 75 9.041 -15.804 -2.020 1.00 0.00 C ATOM 1105 CD1 LEU A 75 9.042 -14.425 -2.638 1.00 0.00 C ATOM 1106 CD2 LEU A 75 8.596 -15.702 -0.554 1.00 0.00 C ATOM 0 H LEU A 75 10.014 -18.100 -3.578 1.00 0.00 H new ATOM 0 HA LEU A 75 7.899 -18.264 -1.531 1.00 0.00 H new ATOM 0 HB2 LEU A 75 8.436 -16.539 -3.959 1.00 0.00 H new ATOM 0 HB3 LEU A 75 7.111 -16.337 -2.830 1.00 0.00 H new ATOM 0 HG LEU A 75 10.026 -16.270 -1.978 1.00 0.00 H new ATOM 0 HD11 LEU A 75 9.666 -13.759 -2.041 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.438 -14.481 -3.652 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.023 -14.039 -2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 75 9.292 -15.067 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.596 -15.270 -0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.584 -16.696 -0.108 1.00 0.00 H new ATOM 1118 N SER A 76 6.471 -19.833 -2.835 1.00 0.00 N ATOM 1119 CA SER A 76 5.349 -20.447 -3.550 1.00 0.00 C ATOM 1120 C SER A 76 4.232 -19.409 -3.693 1.00 0.00 C ATOM 1121 O SER A 76 4.469 -18.240 -3.415 1.00 0.00 O ATOM 1122 CB SER A 76 4.918 -21.716 -2.821 1.00 0.00 C ATOM 1123 OG SER A 76 5.785 -22.765 -3.206 1.00 0.00 O ATOM 0 H SER A 76 6.537 -20.088 -1.849 1.00 0.00 H new ATOM 0 HA SER A 76 5.633 -20.753 -4.557 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.958 -21.567 -1.742 1.00 0.00 H new ATOM 0 HB3 SER A 76 3.886 -21.965 -3.070 1.00 0.00 H new ATOM 0 HG SER A 76 5.525 -23.590 -2.746 1.00 0.00 H new ATOM 1129 N LEU A 77 3.028 -19.787 -4.131 1.00 0.00 N ATOM 1130 CA LEU A 77 1.922 -18.856 -4.377 1.00 0.00 C ATOM 1131 C LEU A 77 1.696 -17.936 -3.163 1.00 0.00 C ATOM 1132 O LEU A 77 1.888 -16.730 -3.276 1.00 0.00 O ATOM 1133 CB LEU A 77 0.666 -19.620 -4.812 1.00 0.00 C ATOM 1134 CG LEU A 77 0.824 -20.461 -6.096 1.00 0.00 C ATOM 1135 CD1 LEU A 77 -0.463 -21.245 -6.322 1.00 0.00 C ATOM 1136 CD2 LEU A 77 1.135 -19.629 -7.343 1.00 0.00 C ATOM 0 H LEU A 77 2.791 -20.759 -4.327 1.00 0.00 H new ATOM 0 HA LEU A 77 2.183 -18.196 -5.205 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.361 -20.279 -3.999 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.142 -18.904 -4.962 1.00 0.00 H new ATOM 0 HG LEU A 77 1.679 -21.121 -5.946 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.369 -21.846 -7.227 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.645 -21.899 -5.469 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.297 -20.552 -6.432 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.232 -20.288 -8.205 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.326 -18.919 -7.518 1.00 0.00 H new ATOM 0 HD23 LEU A 77 2.068 -19.086 -7.195 1.00 0.00 H new ATOM 1148 N LYS A 78 1.445 -18.474 -1.964 1.00 0.00 N ATOM 1149 CA LYS A 78 1.371 -17.703 -0.713 1.00 0.00 C ATOM 1150 C LYS A 78 2.628 -16.887 -0.380 1.00 0.00 C ATOM 1151 O LYS A 78 2.591 -15.930 0.390 1.00 0.00 O ATOM 1152 CB LYS A 78 0.980 -18.578 0.484 1.00 0.00 C ATOM 1153 CG LYS A 78 1.700 -19.924 0.660 1.00 0.00 C ATOM 1154 CD LYS A 78 1.041 -21.042 -0.162 1.00 0.00 C ATOM 1155 CE LYS A 78 1.243 -22.476 0.335 1.00 0.00 C ATOM 1156 NZ LYS A 78 0.548 -22.726 1.616 1.00 0.00 N ATOM 0 H LYS A 78 1.285 -19.473 -1.831 1.00 0.00 H new ATOM 0 HA LYS A 78 0.580 -16.978 -0.903 1.00 0.00 H new ATOM 0 HB2 LYS A 78 1.138 -17.994 1.390 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.089 -18.778 0.416 1.00 0.00 H new ATOM 0 HG2 LYS A 78 2.742 -19.819 0.359 1.00 0.00 H new ATOM 0 HG3 LYS A 78 1.699 -20.201 1.714 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.030 -20.845 -0.205 1.00 0.00 H new ATOM 0 HD3 LYS A 78 1.418 -20.980 -1.183 1.00 0.00 H new ATOM 0 HE2 LYS A 78 0.877 -23.175 -0.417 1.00 0.00 H new ATOM 0 HE3 LYS A 78 2.309 -22.669 0.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 0.656 -23.726 1.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 0.961 -22.126 2.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -0.462 -22.502 1.512 1.00 0.00 H new ATOM 1170 N GLY A 79 3.771 -17.279 -0.922 1.00 0.00 N ATOM 1171 CA GLY A 79 5.016 -16.525 -0.894 1.00 0.00 C ATOM 1172 C GLY A 79 4.975 -15.297 -1.787 1.00 0.00 C ATOM 1173 O GLY A 79 5.507 -14.252 -1.434 1.00 0.00 O ATOM 0 H GLY A 79 3.861 -18.168 -1.414 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.228 -16.218 0.130 1.00 0.00 H new ATOM 0 HA3 GLY A 79 5.835 -17.171 -1.209 1.00 0.00 H new ATOM 1177 N ARG A 80 4.423 -15.445 -2.982 1.00 0.00 N ATOM 1178 CA ARG A 80 4.457 -14.455 -4.048 1.00 0.00 C ATOM 1179 C ARG A 80 3.299 -13.479 -3.912 1.00 0.00 C ATOM 1180 O ARG A 80 3.450 -12.333 -4.312 1.00 0.00 O ATOM 1181 CB ARG A 80 4.356 -15.206 -5.376 1.00 0.00 C ATOM 1182 CG ARG A 80 5.567 -16.108 -5.640 1.00 0.00 C ATOM 1183 CD ARG A 80 5.192 -17.108 -6.738 1.00 0.00 C ATOM 1184 NE ARG A 80 6.318 -17.977 -7.086 1.00 0.00 N ATOM 1185 CZ ARG A 80 6.360 -18.866 -8.078 1.00 0.00 C ATOM 1186 NH1 ARG A 80 5.305 -19.060 -8.864 1.00 0.00 N ATOM 1187 NH2 ARG A 80 7.459 -19.592 -8.230 1.00 0.00 N ATOM 0 H ARG A 80 3.919 -16.292 -3.246 1.00 0.00 H new ATOM 0 HA ARG A 80 5.381 -13.880 -3.997 1.00 0.00 H new ATOM 0 HB2 ARG A 80 3.450 -15.812 -5.378 1.00 0.00 H new ATOM 0 HB3 ARG A 80 4.260 -14.486 -6.189 1.00 0.00 H new ATOM 0 HG2 ARG A 80 6.425 -15.511 -5.948 1.00 0.00 H new ATOM 0 HG3 ARG A 80 5.854 -16.634 -4.730 1.00 0.00 H new ATOM 0 HD2 ARG A 80 4.352 -17.717 -6.404 1.00 0.00 H new ATOM 0 HD3 ARG A 80 4.861 -16.568 -7.625 1.00 0.00 H new ATOM 0 HE ARG A 80 7.156 -17.893 -6.510 1.00 0.00 H new ATOM 0 HH11 ARG A 80 4.450 -18.525 -8.711 1.00 0.00 H new ATOM 0 HH12 ARG A 80 5.351 -19.744 -9.620 1.00 0.00 H new ATOM 0 HH21 ARG A 80 8.247 -19.463 -7.595 1.00 0.00 H new ATOM 0 HH22 ARG A 80 7.516 -20.279 -8.982 1.00 0.00 H new ATOM 1201 N GLU A 81 2.196 -13.900 -3.287 1.00 0.00 N ATOM 1202 CA GLU A 81 1.002 -13.122 -2.973 1.00 0.00 C ATOM 1203 C GLU A 81 1.322 -11.663 -2.624 1.00 0.00 C ATOM 1204 O GLU A 81 0.808 -10.769 -3.295 1.00 0.00 O ATOM 1205 CB GLU A 81 0.166 -13.835 -1.873 1.00 0.00 C ATOM 1206 CG GLU A 81 -1.273 -14.042 -2.329 1.00 0.00 C ATOM 1207 CD GLU A 81 -2.198 -14.715 -1.303 1.00 0.00 C ATOM 1208 OE1 GLU A 81 -2.576 -14.022 -0.327 1.00 0.00 O ATOM 1209 OE2 GLU A 81 -2.630 -15.875 -1.513 1.00 0.00 O ATOM 0 H GLU A 81 2.112 -14.864 -2.965 1.00 0.00 H new ATOM 0 HA GLU A 81 0.390 -13.071 -3.874 1.00 0.00 H new ATOM 0 HB2 GLU A 81 0.618 -14.798 -1.635 1.00 0.00 H new ATOM 0 HB3 GLU A 81 0.180 -13.242 -0.959 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -1.696 -13.073 -2.593 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -1.266 -14.645 -3.237 1.00 0.00 H new ATOM 1216 N PRO A 82 2.176 -11.385 -1.617 1.00 0.00 N ATOM 1217 CA PRO A 82 2.474 -10.017 -1.262 1.00 0.00 C ATOM 1218 C PRO A 82 3.293 -9.307 -2.348 1.00 0.00 C ATOM 1219 O PRO A 82 2.995 -8.161 -2.665 1.00 0.00 O ATOM 1220 CB PRO A 82 3.189 -10.084 0.093 1.00 0.00 C ATOM 1221 CG PRO A 82 3.775 -11.492 0.148 1.00 0.00 C ATOM 1222 CD PRO A 82 2.809 -12.319 -0.699 1.00 0.00 C ATOM 0 HA PRO A 82 1.569 -9.415 -1.182 1.00 0.00 H new ATOM 0 HB2 PRO A 82 3.969 -9.326 0.168 1.00 0.00 H new ATOM 0 HB3 PRO A 82 2.496 -9.910 0.916 1.00 0.00 H new ATOM 0 HG2 PRO A 82 4.787 -11.521 -0.256 1.00 0.00 H new ATOM 0 HG3 PRO A 82 3.829 -11.864 1.171 1.00 0.00 H new ATOM 0 HD2 PRO A 82 3.339 -13.101 -1.243 1.00 0.00 H new ATOM 0 HD3 PRO A 82 2.067 -12.813 -0.073 1.00 0.00 H new ATOM 1230 N PHE A 83 4.301 -9.947 -2.949 1.00 0.00 N ATOM 1231 CA PHE A 83 5.156 -9.307 -3.951 1.00 0.00 C ATOM 1232 C PHE A 83 4.380 -8.944 -5.216 1.00 0.00 C ATOM 1233 O PHE A 83 4.653 -7.896 -5.796 1.00 0.00 O ATOM 1234 CB PHE A 83 6.378 -10.169 -4.292 1.00 0.00 C ATOM 1235 CG PHE A 83 7.276 -10.455 -3.109 1.00 0.00 C ATOM 1236 CD1 PHE A 83 6.950 -11.483 -2.209 1.00 0.00 C ATOM 1237 CD2 PHE A 83 8.426 -9.677 -2.890 1.00 0.00 C ATOM 1238 CE1 PHE A 83 7.757 -11.732 -1.087 1.00 0.00 C ATOM 1239 CE2 PHE A 83 9.229 -9.927 -1.767 1.00 0.00 C ATOM 1240 CZ PHE A 83 8.908 -10.958 -0.870 1.00 0.00 C ATOM 0 H PHE A 83 4.546 -10.918 -2.755 1.00 0.00 H new ATOM 0 HA PHE A 83 5.515 -8.380 -3.505 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.037 -11.115 -4.714 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.960 -9.667 -5.065 1.00 0.00 H new ATOM 0 HD1 PHE A 83 6.071 -12.087 -2.381 1.00 0.00 H new ATOM 0 HD2 PHE A 83 8.690 -8.891 -3.582 1.00 0.00 H new ATOM 0 HE1 PHE A 83 7.493 -12.516 -0.393 1.00 0.00 H new ATOM 0 HE2 PHE A 83 10.104 -9.319 -1.591 1.00 0.00 H new ATOM 0 HZ PHE A 83 9.542 -11.155 -0.018 1.00 0.00 H new ATOM 1250 N VAL A 84 3.402 -9.756 -5.618 1.00 0.00 N ATOM 1251 CA VAL A 84 2.489 -9.407 -6.698 1.00 0.00 C ATOM 1252 C VAL A 84 1.733 -8.139 -6.304 1.00 0.00 C ATOM 1253 O VAL A 84 1.746 -7.175 -7.067 1.00 0.00 O ATOM 1254 CB VAL A 84 1.587 -10.611 -7.038 1.00 0.00 C ATOM 1255 CG1 VAL A 84 0.493 -10.286 -8.063 1.00 0.00 C ATOM 1256 CG2 VAL A 84 2.458 -11.734 -7.621 1.00 0.00 C ATOM 0 H VAL A 84 3.224 -10.671 -5.203 1.00 0.00 H new ATOM 0 HA VAL A 84 3.025 -9.182 -7.620 1.00 0.00 H new ATOM 0 HB VAL A 84 1.095 -10.904 -6.110 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.103 -11.178 -8.254 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.150 -9.498 -7.672 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.953 -9.951 -8.992 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.831 -12.591 -7.865 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.954 -11.378 -8.524 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.208 -12.031 -6.888 1.00 0.00 H new ATOM 1266 N ARG A 85 1.137 -8.078 -5.103 1.00 0.00 N ATOM 1267 CA ARG A 85 0.466 -6.855 -4.675 1.00 0.00 C ATOM 1268 C ARG A 85 1.409 -5.659 -4.677 1.00 0.00 C ATOM 1269 O ARG A 85 1.008 -4.610 -5.159 1.00 0.00 O ATOM 1270 CB ARG A 85 -0.234 -7.013 -3.321 1.00 0.00 C ATOM 1271 CG ARG A 85 -1.536 -7.817 -3.429 1.00 0.00 C ATOM 1272 CD ARG A 85 -2.379 -7.659 -2.160 1.00 0.00 C ATOM 1273 NE ARG A 85 -3.806 -7.913 -2.417 1.00 0.00 N ATOM 1274 CZ ARG A 85 -4.810 -7.632 -1.575 1.00 0.00 C ATOM 1275 NH1 ARG A 85 -4.587 -7.176 -0.346 1.00 0.00 N ATOM 1276 NH2 ARG A 85 -6.063 -7.794 -1.962 1.00 0.00 N ATOM 0 H ARG A 85 1.109 -8.844 -4.430 1.00 0.00 H new ATOM 0 HA ARG A 85 -0.313 -6.660 -5.412 1.00 0.00 H new ATOM 0 HB2 ARG A 85 0.440 -7.509 -2.622 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -0.451 -6.027 -2.910 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -2.106 -7.480 -4.294 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -1.306 -8.870 -3.590 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -2.019 -8.348 -1.396 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -2.255 -6.651 -1.764 1.00 0.00 H new ATOM 0 HE ARG A 85 -4.051 -8.339 -3.311 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -3.631 -7.031 -0.021 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -5.372 -6.971 0.272 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -6.267 -8.133 -2.902 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -6.827 -7.580 -1.321 1.00 0.00 H new ATOM 1290 N MET A 86 2.654 -5.779 -4.209 1.00 0.00 N ATOM 1291 CA MET A 86 3.623 -4.709 -4.272 1.00 0.00 C ATOM 1292 C MET A 86 3.851 -4.236 -5.704 1.00 0.00 C ATOM 1293 O MET A 86 3.847 -3.035 -5.937 1.00 0.00 O ATOM 1294 CB MET A 86 4.936 -5.195 -3.676 1.00 0.00 C ATOM 1295 CG MET A 86 4.837 -5.500 -2.181 1.00 0.00 C ATOM 1296 SD MET A 86 6.389 -5.273 -1.285 1.00 0.00 S ATOM 1297 CE MET A 86 7.126 -6.815 -1.782 1.00 0.00 C ATOM 0 H MET A 86 3.009 -6.631 -3.775 1.00 0.00 H new ATOM 0 HA MET A 86 3.237 -3.863 -3.704 1.00 0.00 H new ATOM 0 HB2 MET A 86 5.258 -6.093 -4.204 1.00 0.00 H new ATOM 0 HB3 MET A 86 5.704 -4.438 -3.837 1.00 0.00 H new ATOM 0 HG2 MET A 86 4.076 -4.858 -1.738 1.00 0.00 H new ATOM 0 HG3 MET A 86 4.501 -6.529 -2.051 1.00 0.00 H new ATOM 0 HE1 MET A 86 8.176 -6.827 -1.491 1.00 0.00 H new ATOM 0 HE2 MET A 86 6.605 -7.640 -1.296 1.00 0.00 H new ATOM 0 HE3 MET A 86 7.048 -6.924 -2.864 1.00 0.00 H new ATOM 1307 N GLN A 87 4.067 -5.148 -6.653 1.00 0.00 N ATOM 1308 CA GLN A 87 4.266 -4.799 -8.052 1.00 0.00 C ATOM 1309 C GLN A 87 3.043 -4.052 -8.607 1.00 0.00 C ATOM 1310 O GLN A 87 3.196 -2.993 -9.210 1.00 0.00 O ATOM 1311 CB GLN A 87 4.632 -6.048 -8.852 1.00 0.00 C ATOM 1312 CG GLN A 87 5.100 -5.670 -10.265 1.00 0.00 C ATOM 1313 CD GLN A 87 6.506 -5.057 -10.329 1.00 0.00 C ATOM 1314 OE1 GLN A 87 6.957 -4.271 -9.505 1.00 0.00 O ATOM 1315 NE2 GLN A 87 7.249 -5.454 -11.333 1.00 0.00 N ATOM 0 H GLN A 87 4.108 -6.150 -6.468 1.00 0.00 H new ATOM 0 HA GLN A 87 5.104 -4.108 -8.144 1.00 0.00 H new ATOM 0 HB2 GLN A 87 5.420 -6.597 -8.337 1.00 0.00 H new ATOM 0 HB3 GLN A 87 3.769 -6.712 -8.915 1.00 0.00 H new ATOM 0 HG2 GLN A 87 5.078 -6.562 -10.892 1.00 0.00 H new ATOM 0 HG3 GLN A 87 4.389 -4.962 -10.692 1.00 0.00 H new ATOM 0 HE21 GLN A 87 6.872 -6.109 -12.019 1.00 0.00 H new ATOM 0 HE22 GLN A 87 8.204 -5.108 -11.429 1.00 0.00 H new ATOM 1324 N LEU A 88 1.827 -4.565 -8.393 1.00 0.00 N ATOM 1325 CA LEU A 88 0.612 -3.907 -8.870 1.00 0.00 C ATOM 1326 C LEU A 88 0.371 -2.569 -8.167 1.00 0.00 C ATOM 1327 O LEU A 88 -0.127 -1.637 -8.799 1.00 0.00 O ATOM 1328 CB LEU A 88 -0.622 -4.813 -8.704 1.00 0.00 C ATOM 1329 CG LEU A 88 -0.883 -5.831 -9.832 1.00 0.00 C ATOM 1330 CD1 LEU A 88 -0.958 -5.170 -11.212 1.00 0.00 C ATOM 1331 CD2 LEU A 88 0.129 -6.974 -9.862 1.00 0.00 C ATOM 0 H LEU A 88 1.661 -5.437 -7.891 1.00 0.00 H new ATOM 0 HA LEU A 88 0.764 -3.712 -9.932 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.520 -5.360 -7.767 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.502 -4.177 -8.608 1.00 0.00 H new ATOM 0 HG LEU A 88 -1.858 -6.258 -9.597 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.143 -5.931 -11.970 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.769 -4.442 -11.223 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.015 -4.666 -11.426 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.113 -7.653 -10.679 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.130 -6.570 -10.011 1.00 0.00 H new ATOM 0 HD23 LEU A 88 0.094 -7.516 -8.917 1.00 0.00 H new ATOM 1343 N TRP A 89 0.728 -2.447 -6.887 1.00 0.00 N ATOM 1344 CA TRP A 89 0.640 -1.201 -6.149 1.00 0.00 C ATOM 1345 C TRP A 89 1.603 -0.216 -6.799 1.00 0.00 C ATOM 1346 O TRP A 89 1.201 0.884 -7.136 1.00 0.00 O ATOM 1347 CB TRP A 89 0.944 -1.455 -4.663 1.00 0.00 C ATOM 1348 CG TRP A 89 0.870 -0.266 -3.756 1.00 0.00 C ATOM 1349 CD1 TRP A 89 -0.247 0.188 -3.146 1.00 0.00 C ATOM 1350 CD2 TRP A 89 1.944 0.618 -3.316 1.00 0.00 C ATOM 1351 NE1 TRP A 89 0.054 1.300 -2.388 1.00 0.00 N ATOM 1352 CE2 TRP A 89 1.400 1.578 -2.410 1.00 0.00 C ATOM 1353 CE3 TRP A 89 3.327 0.698 -3.586 1.00 0.00 C ATOM 1354 CZ2 TRP A 89 2.190 2.545 -1.773 1.00 0.00 C ATOM 1355 CZ3 TRP A 89 4.133 1.667 -2.955 1.00 0.00 C ATOM 1356 CH2 TRP A 89 3.568 2.577 -2.041 1.00 0.00 C ATOM 0 H TRP A 89 1.090 -3.224 -6.334 1.00 0.00 H new ATOM 0 HA TRP A 89 -0.363 -0.776 -6.184 1.00 0.00 H new ATOM 0 HB2 TRP A 89 0.248 -2.209 -4.296 1.00 0.00 H new ATOM 0 HB3 TRP A 89 1.944 -1.881 -4.587 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -1.228 -0.254 -3.238 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -0.636 1.848 -1.875 1.00 0.00 H new ATOM 0 HE3 TRP A 89 3.774 0.007 -4.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 1.747 3.253 -1.088 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 5.190 1.712 -3.174 1.00 0.00 H new ATOM 0 HH2 TRP A 89 4.196 3.302 -1.545 1.00 0.00 H new ATOM 1367 N LEU A 90 2.854 -0.609 -7.051 1.00 0.00 N ATOM 1368 CA LEU A 90 3.829 0.240 -7.728 1.00 0.00 C ATOM 1369 C LEU A 90 3.310 0.706 -9.091 1.00 0.00 C ATOM 1370 O LEU A 90 3.521 1.859 -9.463 1.00 0.00 O ATOM 1371 CB LEU A 90 5.156 -0.503 -7.916 1.00 0.00 C ATOM 1372 CG LEU A 90 5.967 -0.640 -6.622 1.00 0.00 C ATOM 1373 CD1 LEU A 90 7.106 -1.639 -6.871 1.00 0.00 C ATOM 1374 CD2 LEU A 90 6.488 0.722 -6.138 1.00 0.00 C ATOM 0 H LEU A 90 3.217 -1.526 -6.790 1.00 0.00 H new ATOM 0 HA LEU A 90 3.991 1.115 -7.098 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.954 -1.497 -8.316 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.756 0.023 -8.658 1.00 0.00 H new ATOM 0 HG LEU A 90 5.329 -1.016 -5.823 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.696 -1.752 -5.962 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.687 -2.605 -7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.744 -1.271 -7.675 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.058 0.588 -5.219 1.00 0.00 H new ATOM 0 HD22 LEU A 90 7.130 1.159 -6.903 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.646 1.387 -5.948 1.00 0.00 H new ATOM 1386 N ASN A 91 2.665 -0.189 -9.839 1.00 0.00 N ATOM 1387 CA ASN A 91 2.112 0.080 -11.161 1.00 0.00 C ATOM 1388 C ASN A 91 1.003 1.134 -11.126 1.00 0.00 C ATOM 1389 O ASN A 91 0.945 1.965 -12.036 1.00 0.00 O ATOM 1390 CB ASN A 91 1.588 -1.237 -11.766 1.00 0.00 C ATOM 1391 CG ASN A 91 0.761 -1.029 -13.025 1.00 0.00 C ATOM 1392 OD1 ASN A 91 1.274 -1.034 -14.138 1.00 0.00 O ATOM 1393 ND2 ASN A 91 -0.545 -0.900 -12.878 1.00 0.00 N ATOM 0 H ASN A 91 2.510 -1.149 -9.530 1.00 0.00 H new ATOM 0 HA ASN A 91 2.908 0.487 -11.785 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.433 -1.885 -11.997 1.00 0.00 H new ATOM 0 HB3 ASN A 91 0.983 -1.756 -11.023 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -1.143 -0.803 -13.698 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -0.955 -0.898 -11.944 1.00 0.00 H new ATOM 1400 N ASP A 92 0.097 1.087 -10.145 1.00 0.00 N ATOM 1401 CA ASP A 92 -1.062 1.991 -10.062 1.00 0.00 C ATOM 1402 C ASP A 92 -0.595 3.437 -9.810 1.00 0.00 C ATOM 1403 O ASP A 92 0.417 3.637 -9.139 1.00 0.00 O ATOM 1404 CB ASP A 92 -2.025 1.554 -8.932 1.00 0.00 C ATOM 1405 CG ASP A 92 -3.299 0.853 -9.424 1.00 0.00 C ATOM 1406 OD1 ASP A 92 -3.864 1.245 -10.473 1.00 0.00 O ATOM 1407 OD2 ASP A 92 -3.777 -0.078 -8.732 1.00 0.00 O ATOM 0 H ASP A 92 0.145 0.416 -9.378 1.00 0.00 H new ATOM 0 HA ASP A 92 -1.593 1.943 -11.012 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -1.493 0.884 -8.256 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.308 2.432 -8.352 1.00 0.00 H new ATOM 1412 N PRO A 93 -1.308 4.467 -10.305 1.00 0.00 N ATOM 1413 CA PRO A 93 -0.950 5.870 -10.113 1.00 0.00 C ATOM 1414 C PRO A 93 -1.465 6.450 -8.784 1.00 0.00 C ATOM 1415 O PRO A 93 -0.866 7.387 -8.261 1.00 0.00 O ATOM 1416 CB PRO A 93 -1.586 6.586 -11.309 1.00 0.00 C ATOM 1417 CG PRO A 93 -2.852 5.773 -11.578 1.00 0.00 C ATOM 1418 CD PRO A 93 -2.437 4.353 -11.212 1.00 0.00 C ATOM 0 HA PRO A 93 0.131 5.996 -10.060 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -1.818 7.626 -11.078 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -0.922 6.592 -12.173 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -3.689 6.117 -10.970 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -3.164 5.846 -12.620 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -3.261 3.819 -10.739 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -2.162 3.789 -12.103 1.00 0.00 H new ATOM 1426 N HIS A 94 -2.558 5.921 -8.219 1.00 0.00 N ATOM 1427 CA HIS A 94 -3.190 6.380 -6.982 1.00 0.00 C ATOM 1428 C HIS A 94 -2.710 5.571 -5.763 1.00 0.00 C ATOM 1429 O HIS A 94 -3.322 5.613 -4.694 1.00 0.00 O ATOM 1430 CB HIS A 94 -4.711 6.286 -7.180 1.00 0.00 C ATOM 1431 CG HIS A 94 -5.254 7.347 -8.101 1.00 0.00 C ATOM 1432 ND1 HIS A 94 -5.324 8.700 -7.831 1.00 0.00 N ATOM 1433 CD2 HIS A 94 -5.755 7.144 -9.357 1.00 0.00 C ATOM 1434 CE1 HIS A 94 -5.827 9.302 -8.921 1.00 0.00 C ATOM 1435 NE2 HIS A 94 -6.114 8.393 -9.871 1.00 0.00 N ATOM 0 H HIS A 94 -3.045 5.126 -8.633 1.00 0.00 H new ATOM 0 HA HIS A 94 -2.908 7.412 -6.773 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -4.959 5.303 -7.581 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -5.203 6.368 -6.211 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -5.855 6.193 -9.859 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -5.980 10.366 -9.021 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -6.516 8.580 -10.790 1.00 0.00 H new ATOM 1443 N ASN A 95 -1.644 4.789 -5.931 1.00 0.00 N ATOM 1444 CA ASN A 95 -1.129 3.835 -4.960 1.00 0.00 C ATOM 1445 C ASN A 95 -0.598 4.510 -3.696 1.00 0.00 C ATOM 1446 O ASN A 95 -0.970 4.109 -2.590 1.00 0.00 O ATOM 1447 CB ASN A 95 -0.035 3.000 -5.635 1.00 0.00 C ATOM 1448 CG ASN A 95 1.268 3.752 -5.928 1.00 0.00 C ATOM 1449 OD1 ASN A 95 1.244 4.846 -6.488 1.00 0.00 O ATOM 1450 ND2 ASN A 95 2.418 3.238 -5.519 1.00 0.00 N ATOM 0 H ASN A 95 -1.093 4.807 -6.789 1.00 0.00 H new ATOM 0 HA ASN A 95 -1.949 3.195 -4.635 1.00 0.00 H new ATOM 0 HB2 ASN A 95 0.192 2.145 -4.999 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -0.427 2.605 -6.572 1.00 0.00 H new ATOM 0 HD21 ASN A 95 3.287 3.750 -5.668 1.00 0.00 H new ATOM 0 HD22 ASN A 95 2.434 2.330 -5.055 1.00 0.00 H new ATOM 1457 N VAL A 96 0.262 5.521 -3.830 1.00 0.00 N ATOM 1458 CA VAL A 96 0.827 6.247 -2.724 1.00 0.00 C ATOM 1459 C VAL A 96 -0.307 7.001 -2.046 1.00 0.00 C ATOM 1460 O VAL A 96 -0.401 6.976 -0.826 1.00 0.00 O ATOM 1461 CB VAL A 96 1.927 7.184 -3.246 1.00 0.00 C ATOM 1462 CG1 VAL A 96 2.468 8.005 -2.086 1.00 0.00 C ATOM 1463 CG2 VAL A 96 3.083 6.415 -3.904 1.00 0.00 C ATOM 0 H VAL A 96 0.584 5.855 -4.738 1.00 0.00 H new ATOM 0 HA VAL A 96 1.292 5.585 -1.994 1.00 0.00 H new ATOM 0 HB VAL A 96 1.485 7.827 -4.007 1.00 0.00 H new ATOM 0 HG11 VAL A 96 3.250 8.673 -2.447 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.661 8.593 -1.649 1.00 0.00 H new ATOM 0 HG13 VAL A 96 2.882 7.338 -1.330 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.835 7.121 -4.257 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.532 5.740 -3.176 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.703 5.838 -4.747 1.00 0.00 H new ATOM 1473 N GLU A 97 -1.179 7.632 -2.821 1.00 0.00 N ATOM 1474 CA GLU A 97 -2.283 8.437 -2.339 1.00 0.00 C ATOM 1475 C GLU A 97 -3.176 7.635 -1.398 1.00 0.00 C ATOM 1476 O GLU A 97 -3.447 8.073 -0.277 1.00 0.00 O ATOM 1477 CB GLU A 97 -3.060 8.913 -3.564 1.00 0.00 C ATOM 1478 CG GLU A 97 -2.353 10.093 -4.226 1.00 0.00 C ATOM 1479 CD GLU A 97 -2.742 11.358 -3.490 1.00 0.00 C ATOM 1480 OE1 GLU A 97 -3.884 11.826 -3.719 1.00 0.00 O ATOM 1481 OE2 GLU A 97 -1.963 11.807 -2.627 1.00 0.00 O ATOM 0 H GLU A 97 -1.131 7.593 -3.839 1.00 0.00 H new ATOM 0 HA GLU A 97 -1.915 9.288 -1.766 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -3.160 8.095 -4.278 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -4.068 9.205 -3.271 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -1.272 9.953 -4.195 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -2.635 10.163 -5.276 1.00 0.00 H new ATOM 1488 N LYS A 98 -3.629 6.455 -1.836 1.00 0.00 N ATOM 1489 CA LYS A 98 -4.536 5.639 -1.036 1.00 0.00 C ATOM 1490 C LYS A 98 -3.819 5.031 0.168 1.00 0.00 C ATOM 1491 O LYS A 98 -4.462 4.810 1.191 1.00 0.00 O ATOM 1492 CB LYS A 98 -5.206 4.562 -1.902 1.00 0.00 C ATOM 1493 CG LYS A 98 -6.563 4.986 -2.495 1.00 0.00 C ATOM 1494 CD LYS A 98 -6.533 5.759 -3.819 1.00 0.00 C ATOM 1495 CE LYS A 98 -6.062 7.221 -3.752 1.00 0.00 C ATOM 1496 NZ LYS A 98 -7.167 8.186 -3.579 1.00 0.00 N ATOM 0 H LYS A 98 -3.381 6.049 -2.738 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.322 6.287 -0.647 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.533 4.296 -2.717 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -5.349 3.664 -1.300 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.164 4.089 -2.640 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -7.079 5.599 -1.756 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -5.884 5.223 -4.512 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -7.536 5.743 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -5.360 7.331 -2.925 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -5.519 7.462 -4.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -6.782 9.151 -3.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -7.826 8.107 -4.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -7.672 7.980 -2.694 1.00 0.00 H new ATOM 1510 N LEU A 99 -2.501 4.817 0.096 1.00 0.00 N ATOM 1511 CA LEU A 99 -1.723 4.485 1.281 1.00 0.00 C ATOM 1512 C LEU A 99 -1.741 5.661 2.262 1.00 0.00 C ATOM 1513 O LEU A 99 -2.027 5.474 3.444 1.00 0.00 O ATOM 1514 CB LEU A 99 -0.292 4.063 0.898 1.00 0.00 C ATOM 1515 CG LEU A 99 0.560 3.676 2.116 1.00 0.00 C ATOM 1516 CD1 LEU A 99 -0.004 2.454 2.831 1.00 0.00 C ATOM 1517 CD2 LEU A 99 1.977 3.303 1.676 1.00 0.00 C ATOM 0 H LEU A 99 -1.959 4.869 -0.767 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.177 3.629 1.781 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -0.339 3.219 0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.193 4.881 0.366 1.00 0.00 H new ATOM 0 HG LEU A 99 0.558 4.539 2.781 1.00 0.00 H new ATOM 0 HD11 LEU A 99 0.625 2.211 3.687 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.016 2.668 3.174 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -0.025 1.608 2.144 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.569 3.031 2.550 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.934 2.458 0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 99 2.438 4.154 1.175 1.00 0.00 H new ATOM 1529 N ARG A 100 -1.451 6.877 1.794 1.00 0.00 N ATOM 1530 CA ARG A 100 -1.327 8.060 2.617 1.00 0.00 C ATOM 1531 C ARG A 100 -2.655 8.386 3.278 1.00 0.00 C ATOM 1532 O ARG A 100 -2.644 8.941 4.369 1.00 0.00 O ATOM 1533 CB ARG A 100 -0.836 9.242 1.751 1.00 0.00 C ATOM 1534 CG ARG A 100 0.238 10.039 2.486 1.00 0.00 C ATOM 1535 CD ARG A 100 0.552 11.354 1.760 1.00 0.00 C ATOM 1536 NE ARG A 100 1.619 12.119 2.432 1.00 0.00 N ATOM 1537 CZ ARG A 100 2.108 13.299 2.028 1.00 0.00 C ATOM 1538 NH1 ARG A 100 1.648 13.903 0.935 1.00 0.00 N ATOM 1539 NH2 ARG A 100 3.079 13.884 2.718 1.00 0.00 N ATOM 0 H ARG A 100 -1.293 7.060 0.803 1.00 0.00 H new ATOM 0 HA ARG A 100 -0.597 7.876 3.406 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -0.437 8.868 0.808 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -1.675 9.893 1.506 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -0.096 10.253 3.501 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.145 9.441 2.568 1.00 0.00 H new ATOM 0 HD2 ARG A 100 0.852 11.138 0.735 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -0.351 11.962 1.707 1.00 0.00 H new ATOM 0 HE ARG A 100 2.020 11.714 3.278 1.00 0.00 H new ATOM 0 HH11 ARG A 100 0.907 13.468 0.385 1.00 0.00 H new ATOM 0 HH12 ARG A 100 2.036 14.801 0.647 1.00 0.00 H new ATOM 0 HH21 ARG A 100 3.452 13.435 3.555 1.00 0.00 H new ATOM 0 HH22 ARG A 100 3.452 14.782 2.412 1.00 0.00 H new ATOM 1553 N ASP A 101 -3.776 8.042 2.643 1.00 0.00 N ATOM 1554 CA ASP A 101 -5.130 8.355 3.098 1.00 0.00 C ATOM 1555 C ASP A 101 -5.389 7.760 4.481 1.00 0.00 C ATOM 1556 O ASP A 101 -5.948 8.431 5.344 1.00 0.00 O ATOM 1557 CB ASP A 101 -6.145 7.828 2.073 1.00 0.00 C ATOM 1558 CG ASP A 101 -7.547 8.374 2.335 1.00 0.00 C ATOM 1559 OD1 ASP A 101 -8.184 7.979 3.333 1.00 0.00 O ATOM 1560 OD2 ASP A 101 -8.028 9.197 1.516 1.00 0.00 O ATOM 0 H ASP A 101 -3.765 7.519 1.767 1.00 0.00 H new ATOM 0 HA ASP A 101 -5.239 9.436 3.182 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -5.827 8.108 1.069 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -6.166 6.739 2.108 1.00 0.00 H new ATOM 1565 N MET A 102 -4.887 6.541 4.712 1.00 0.00 N ATOM 1566 CA MET A 102 -5.021 5.780 5.952 1.00 0.00 C ATOM 1567 C MET A 102 -4.666 6.653 7.163 1.00 0.00 C ATOM 1568 O MET A 102 -5.460 6.855 8.086 1.00 0.00 O ATOM 1569 CB MET A 102 -4.109 4.546 5.897 1.00 0.00 C ATOM 1570 CG MET A 102 -4.387 3.612 4.715 1.00 0.00 C ATOM 1571 SD MET A 102 -5.995 2.784 4.759 1.00 0.00 S ATOM 1572 CE MET A 102 -5.881 1.898 3.191 1.00 0.00 C ATOM 0 H MET A 102 -4.352 6.038 4.004 1.00 0.00 H new ATOM 0 HA MET A 102 -6.056 5.457 6.060 1.00 0.00 H new ATOM 0 HB2 MET A 102 -3.072 4.877 5.848 1.00 0.00 H new ATOM 0 HB3 MET A 102 -4.221 3.984 6.824 1.00 0.00 H new ATOM 0 HG2 MET A 102 -4.316 4.187 3.792 1.00 0.00 H new ATOM 0 HG3 MET A 102 -3.605 2.853 4.679 1.00 0.00 H new ATOM 0 HE1 MET A 102 -6.883 1.695 2.814 1.00 0.00 H new ATOM 0 HE2 MET A 102 -5.338 2.506 2.468 1.00 0.00 H new ATOM 0 HE3 MET A 102 -5.353 0.957 3.343 1.00 0.00 H new ATOM 1582 N LYS A 103 -3.438 7.175 7.167 1.00 0.00 N ATOM 1583 CA LYS A 103 -2.933 8.037 8.228 1.00 0.00 C ATOM 1584 C LYS A 103 -3.438 9.461 8.046 1.00 0.00 C ATOM 1585 O LYS A 103 -3.838 10.100 9.020 1.00 0.00 O ATOM 1586 CB LYS A 103 -1.402 7.998 8.206 1.00 0.00 C ATOM 1587 CG LYS A 103 -0.794 8.681 9.437 1.00 0.00 C ATOM 1588 CD LYS A 103 0.728 8.729 9.301 1.00 0.00 C ATOM 1589 CE LYS A 103 1.414 8.586 10.655 1.00 0.00 C ATOM 1590 NZ LYS A 103 2.879 8.695 10.534 1.00 0.00 N ATOM 0 H LYS A 103 -2.761 7.007 6.423 1.00 0.00 H new ATOM 0 HA LYS A 103 -3.293 7.680 9.193 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -1.066 6.962 8.163 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.039 8.489 7.303 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -1.192 9.691 9.538 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -1.071 8.137 10.340 1.00 0.00 H new ATOM 0 HD2 LYS A 103 1.061 7.931 8.637 1.00 0.00 H new ATOM 0 HD3 LYS A 103 1.024 9.671 8.840 1.00 0.00 H new ATOM 0 HE2 LYS A 103 1.046 9.356 11.333 1.00 0.00 H new ATOM 0 HE3 LYS A 103 1.155 7.623 11.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 3.313 8.593 11.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 3.232 7.945 9.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 3.126 9.624 10.137 1.00 0.00 H new ATOM 1604 N LYS A 104 -3.404 9.943 6.804 1.00 0.00 N ATOM 1605 CA LYS A 104 -3.433 11.331 6.382 1.00 0.00 C ATOM 1606 C LYS A 104 -2.652 12.205 7.363 1.00 0.00 C ATOM 1607 O LYS A 104 -1.542 11.803 7.728 1.00 0.00 O ATOM 1608 CB LYS A 104 -4.856 11.721 5.965 1.00 0.00 C ATOM 1609 CG LYS A 104 -5.907 11.925 7.073 1.00 0.00 C ATOM 1610 CD LYS A 104 -7.202 11.131 6.836 1.00 0.00 C ATOM 1611 CE LYS A 104 -7.266 9.832 7.655 1.00 0.00 C ATOM 1612 NZ LYS A 104 -7.701 10.086 9.047 1.00 0.00 N ATOM 0 H LYS A 104 -3.351 9.313 6.004 1.00 0.00 H new ATOM 0 HA LYS A 104 -2.879 11.513 5.461 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -4.794 12.645 5.391 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -5.229 10.951 5.290 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -5.478 11.629 8.030 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -6.147 12.986 7.145 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -8.057 11.757 7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -7.286 10.891 5.776 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -7.956 9.135 7.179 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.285 9.356 7.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -7.733 9.188 9.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -7.029 10.732 9.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -8.647 10.517 9.042 1.00 0.00 H new ATOM 1626 N LEU A 105 -3.196 13.364 7.734 1.00 0.00 N ATOM 1627 CA LEU A 105 -2.832 14.222 8.854 1.00 0.00 C ATOM 1628 C LEU A 105 -1.337 14.188 9.161 1.00 0.00 C ATOM 1629 O LEU A 105 -0.913 13.595 10.158 1.00 0.00 O ATOM 1630 CB LEU A 105 -3.713 13.875 10.072 1.00 0.00 C ATOM 1631 CG LEU A 105 -5.133 14.466 9.969 1.00 0.00 C ATOM 1632 CD1 LEU A 105 -6.103 13.684 10.855 1.00 0.00 C ATOM 1633 CD2 LEU A 105 -5.149 15.943 10.381 1.00 0.00 C ATOM 0 H LEU A 105 -3.975 13.760 7.207 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.028 15.258 8.579 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.781 12.791 10.168 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.235 14.246 10.978 1.00 0.00 H new ATOM 0 HG LEU A 105 -5.447 14.388 8.928 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -7.101 14.114 10.770 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -6.129 12.642 10.535 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -5.772 13.737 11.892 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.164 16.333 10.298 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.807 16.037 11.412 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.488 16.511 9.726 1.00 0.00 H new ATOM 1645 N SER A 106 -0.532 14.827 8.311 1.00 0.00 N ATOM 1646 CA SER A 106 0.896 15.027 8.539 1.00 0.00 C ATOM 1647 C SER A 106 1.396 16.380 7.999 1.00 0.00 C ATOM 1648 O SER A 106 2.604 16.628 8.037 1.00 0.00 O ATOM 1649 CB SER A 106 1.665 13.850 7.928 1.00 0.00 C ATOM 1650 OG SER A 106 3.027 13.886 8.321 1.00 0.00 O ATOM 0 H SER A 106 -0.861 15.226 7.432 1.00 0.00 H new ATOM 0 HA SER A 106 1.076 15.058 9.614 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.214 12.910 8.245 1.00 0.00 H new ATOM 0 HB3 SER A 106 1.593 13.887 6.841 1.00 0.00 H new ATOM 0 HG SER A 106 3.329 14.817 8.369 1.00 0.00 H new ATOM 1656 N GLY A 107 0.518 17.242 7.483 1.00 0.00 N ATOM 1657 CA GLY A 107 0.846 18.525 6.888 1.00 0.00 C ATOM 1658 C GLY A 107 0.176 18.634 5.518 1.00 0.00 C ATOM 1659 O GLY A 107 -0.987 19.032 5.468 1.00 0.00 O ATOM 0 H GLY A 107 -0.484 17.050 7.471 1.00 0.00 H new ATOM 0 HA2 GLY A 107 0.510 19.335 7.535 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.927 18.626 6.786 1.00 0.00 H new ATOM 1663 N PRO A 108 0.872 18.321 4.413 1.00 0.00 N ATOM 1664 CA PRO A 108 0.400 18.569 3.053 1.00 0.00 C ATOM 1665 C PRO A 108 -0.834 17.727 2.711 1.00 0.00 C ATOM 1666 O PRO A 108 -0.821 16.503 2.888 1.00 0.00 O ATOM 1667 CB PRO A 108 1.589 18.251 2.138 1.00 0.00 C ATOM 1668 CG PRO A 108 2.452 17.306 2.968 1.00 0.00 C ATOM 1669 CD PRO A 108 2.221 17.785 4.394 1.00 0.00 C ATOM 0 HA PRO A 108 0.073 19.601 2.929 1.00 0.00 H new ATOM 0 HB2 PRO A 108 1.264 17.782 1.209 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.135 19.154 1.865 1.00 0.00 H new ATOM 0 HG2 PRO A 108 2.150 16.267 2.839 1.00 0.00 H new ATOM 0 HG3 PRO A 108 3.503 17.370 2.687 1.00 0.00 H new ATOM 0 HD2 PRO A 108 2.327 16.965 5.105 1.00 0.00 H new ATOM 0 HD3 PRO A 108 2.949 18.546 4.674 1.00 0.00 H new ATOM 1677 N SER A 109 -1.882 18.369 2.189 1.00 0.00 N ATOM 1678 CA SER A 109 -3.164 17.764 1.834 1.00 0.00 C ATOM 1679 C SER A 109 -3.746 18.412 0.565 1.00 0.00 C ATOM 1680 O SER A 109 -3.216 19.410 0.065 1.00 0.00 O ATOM 1681 CB SER A 109 -4.093 17.886 3.048 1.00 0.00 C ATOM 1682 OG SER A 109 -3.629 17.017 4.067 1.00 0.00 O ATOM 0 H SER A 109 -1.857 19.370 1.994 1.00 0.00 H new ATOM 0 HA SER A 109 -3.041 16.708 1.592 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.110 18.915 3.408 1.00 0.00 H new ATOM 0 HB3 SER A 109 -5.115 17.629 2.769 1.00 0.00 H new ATOM 0 HG SER A 109 -4.215 17.088 4.849 1.00 0.00 H new ATOM 1688 N SER A 110 -4.812 17.832 0.001 1.00 0.00 N ATOM 1689 CA SER A 110 -5.488 18.330 -1.196 1.00 0.00 C ATOM 1690 C SER A 110 -6.993 18.341 -0.938 1.00 0.00 C ATOM 1691 O SER A 110 -7.592 17.296 -0.652 1.00 0.00 O ATOM 1692 CB SER A 110 -5.118 17.489 -2.430 1.00 0.00 C ATOM 1693 OG SER A 110 -5.453 18.171 -3.627 1.00 0.00 O ATOM 0 H SER A 110 -5.236 16.983 0.376 1.00 0.00 H new ATOM 0 HA SER A 110 -5.161 19.347 -1.411 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.050 17.270 -2.419 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.640 16.533 -2.393 1.00 0.00 H new ATOM 0 HG SER A 110 -5.207 17.618 -4.398 1.00 0.00 H new ATOM 1699 N GLY A 111 -7.606 19.517 -1.008 1.00 0.00 N ATOM 1700 CA GLY A 111 -9.043 19.709 -0.989 1.00 0.00 C ATOM 1701 C GLY A 111 -9.303 20.768 -2.024 1.00 0.00 C ATOM 1702 O GLY A 111 -9.389 20.402 -3.210 1.00 0.00 O ATOM 0 H GLY A 111 -7.091 20.394 -1.082 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -9.569 18.785 -1.228 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -9.387 20.026 -0.004 1.00 0.00 H new TER 1706 GLY A 111