USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 761 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 138 THR OG1 : rot -100:sc= 0.459 USER MOD Set 1.2: A 140 SER OG : rot 170:sc= -1.26 USER MOD Set 2.1: A 128 ASN :FLIP amide:sc= -2.72! C(o=-9.1!,f=-7.8!) USER MOD Set 2.2: A 131 ASN : amide:sc= -2.93! C(o=-7.8!,f=-18!) USER MOD Set 2.3: A 148 ASN : amide:sc= -2.11! C(o=-7.8!,f=-8.1!) USER MOD Set 3.1: A 101 SER OG : rot -37:sc= 1.03 USER MOD Set 3.2: A 107 LYS NZ :NH3+ -172:sc= 0.981 (180deg=0) USER MOD Set 4.1: A 85 SER OG : rot -82:sc= 1.21 USER MOD Set 4.2: A 86 ASN : amide:sc= -2.66 K(o=-1.5,f=-3.3!) USER MOD Set 5.1: A 56 TYR OH : rot -103:sc= -0.87! USER MOD Set 5.2: A 118 HIS : no HE2:sc= -7.54! C(o=-8.4!,f=-16!) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 123:sc= -1.2 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -2.59 X(o=-2.6,f=-2.6) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -24:sc= 0.492 USER MOD Single : A 82 ASN : amide:sc= -3.15! C(o=-3.1!,f=-4.6!) USER MOD Single : A 87 ASN :FLIP amide:sc= -0.0483 F(o=-0.75,f=-0.048) USER MOD Single : A 89 MET CE :methyl 169:sc= 0 (180deg=-0.137) USER MOD Single : A 90 MET CE :methyl -114:sc= -1.14 (180deg=-3.74!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0362 USER MOD Single : A 93 HIS : no HD1:sc= -5.27! C(o=-5.3!,f=-6.9!) USER MOD Single : A 96 THR OG1 : rot 79:sc= 1.09 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -31:sc= 0.51 USER MOD Single : A 106 ASN : amide:sc= -0.526 K(o=-0.53,f=-1.4) USER MOD Single : A 110 TYR OH : rot 70:sc= -2.49! USER MOD Single : A 111 TYR OH : rot 70:sc= 0.00529 USER MOD Single : A 114 SER OG : rot -11:sc= 1.11 USER MOD Single : A 125 GLN : amide:sc= 0.171 X(o=0.17,f=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 HIS :FLIP no HE2:sc= -0.873 F(o=-1.6,f=-0.87) USER MOD Single : A 146 SER OG : rot 149:sc= -2.3 USER MOD Single : A 150 HIS : no HD1:sc= -11.6! C(o=-12!,f=-13!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.349 -10.121 6.960 1.00 0.00 N ATOM 14 CA PHE A 37 7.398 -9.311 6.348 1.00 0.00 C ATOM 15 C PHE A 37 8.778 -9.743 6.837 1.00 0.00 C ATOM 16 O PHE A 37 9.732 -8.965 6.792 1.00 0.00 O ATOM 17 CB PHE A 37 7.177 -7.829 6.660 1.00 0.00 C ATOM 18 CG PHE A 37 5.743 -7.394 6.547 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.163 -6.610 7.533 1.00 0.00 C ATOM 20 CD2 PHE A 37 4.974 -7.768 5.458 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.846 -6.208 7.433 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.654 -7.369 5.352 1.00 0.00 C ATOM 23 CZ PHE A 37 3.090 -6.587 6.341 1.00 0.00 C ATOM 0 HA PHE A 37 7.351 -9.460 5.269 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.531 -7.623 7.670 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.784 -7.230 5.981 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.749 -6.310 8.389 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.410 -8.379 4.682 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.407 -5.597 8.208 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.065 -7.668 4.497 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.060 -6.273 6.261 1.00 0.00 H new ATOM 33 N ALA A 38 8.880 -10.984 7.304 1.00 0.00 N ATOM 34 CA ALA A 38 10.146 -11.511 7.799 1.00 0.00 C ATOM 35 C ALA A 38 11.091 -11.842 6.650 1.00 0.00 C ATOM 36 O ALA A 38 12.289 -11.573 6.719 1.00 0.00 O ATOM 37 CB ALA A 38 9.904 -12.744 8.658 1.00 0.00 C ATOM 0 H ALA A 38 8.102 -11.642 7.350 1.00 0.00 H new ATOM 0 HA ALA A 38 10.617 -10.741 8.411 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.858 -13.127 9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.273 -12.478 9.506 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.408 -13.511 8.063 1.00 0.00 H new ATOM 43 N ASP A 39 10.539 -12.428 5.594 1.00 0.00 N ATOM 44 CA ASP A 39 11.329 -12.799 4.424 1.00 0.00 C ATOM 45 C ASP A 39 11.064 -11.854 3.252 1.00 0.00 C ATOM 46 O ASP A 39 11.545 -12.081 2.142 1.00 0.00 O ATOM 47 CB ASP A 39 11.013 -14.237 4.011 1.00 0.00 C ATOM 48 CG ASP A 39 12.111 -14.849 3.163 1.00 0.00 C ATOM 49 OD1 ASP A 39 11.848 -15.156 1.982 1.00 0.00 O ATOM 50 OD2 ASP A 39 13.235 -15.020 3.681 1.00 0.00 O ATOM 0 H ASP A 39 9.548 -12.657 5.523 1.00 0.00 H new ATOM 0 HA ASP A 39 12.382 -12.721 4.693 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.866 -14.845 4.904 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.076 -14.255 3.455 1.00 0.00 H new ATOM 55 N ALA A 40 10.298 -10.795 3.503 1.00 0.00 N ATOM 56 CA ALA A 40 9.976 -9.822 2.465 1.00 0.00 C ATOM 57 C ALA A 40 11.220 -9.063 2.016 1.00 0.00 C ATOM 58 O ALA A 40 11.994 -8.578 2.841 1.00 0.00 O ATOM 59 CB ALA A 40 8.917 -8.853 2.967 1.00 0.00 C ATOM 0 H ALA A 40 9.890 -10.590 4.415 1.00 0.00 H new ATOM 0 HA ALA A 40 9.584 -10.362 1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.684 -8.131 2.184 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.015 -9.405 3.232 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.292 -8.328 3.845 1.00 0.00 H new ATOM 65 N GLN A 41 11.404 -8.961 0.703 1.00 0.00 N ATOM 66 CA GLN A 41 12.551 -8.256 0.146 1.00 0.00 C ATOM 67 C GLN A 41 12.536 -6.791 0.565 1.00 0.00 C ATOM 68 O GLN A 41 11.552 -6.308 1.127 1.00 0.00 O ATOM 69 CB GLN A 41 12.555 -8.366 -1.380 1.00 0.00 C ATOM 70 CG GLN A 41 13.366 -9.540 -1.903 1.00 0.00 C ATOM 71 CD GLN A 41 14.645 -9.106 -2.592 1.00 0.00 C ATOM 72 OE1 GLN A 41 15.745 -9.353 -2.097 1.00 0.00 O ATOM 73 NE2 GLN A 41 14.506 -8.453 -3.740 1.00 0.00 N ATOM 0 H GLN A 41 10.773 -9.358 0.006 1.00 0.00 H new ATOM 0 HA GLN A 41 13.458 -8.719 0.534 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.528 -8.459 -1.732 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.954 -7.443 -1.801 1.00 0.00 H new ATOM 0 HG2 GLN A 41 13.612 -10.205 -1.075 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.758 -10.114 -2.602 1.00 0.00 H new ATOM 0 HE21 GLN A 41 13.574 -8.270 -4.113 1.00 0.00 H new ATOM 0 HE22 GLN A 41 15.331 -8.134 -4.249 1.00 0.00 H new ATOM 82 N THR A 42 13.629 -6.087 0.293 1.00 0.00 N ATOM 83 CA THR A 42 13.728 -4.677 0.650 1.00 0.00 C ATOM 84 C THR A 42 14.542 -3.901 -0.379 1.00 0.00 C ATOM 85 O THR A 42 15.336 -4.476 -1.126 1.00 0.00 O ATOM 86 CB THR A 42 14.354 -4.519 2.040 1.00 0.00 C ATOM 87 OG1 THR A 42 14.683 -5.782 2.592 1.00 0.00 O ATOM 88 CG2 THR A 42 13.450 -3.811 3.025 1.00 0.00 C ATOM 0 H THR A 42 14.454 -6.467 -0.171 1.00 0.00 H new ATOM 0 HA THR A 42 12.718 -4.267 0.665 1.00 0.00 H new ATOM 0 HB THR A 42 15.246 -3.912 1.886 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.083 -5.658 3.478 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.953 -3.732 3.989 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.218 -2.813 2.654 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.526 -4.377 3.143 1.00 0.00 H new ATOM 96 N ARG A 43 14.335 -2.590 -0.408 1.00 0.00 N ATOM 97 CA ARG A 43 15.042 -1.715 -1.336 1.00 0.00 C ATOM 98 C ARG A 43 14.740 -0.256 -1.015 1.00 0.00 C ATOM 99 O ARG A 43 13.735 0.049 -0.373 1.00 0.00 O ATOM 100 CB ARG A 43 14.638 -2.030 -2.779 1.00 0.00 C ATOM 101 CG ARG A 43 15.272 -1.103 -3.804 1.00 0.00 C ATOM 102 CD ARG A 43 14.830 -1.446 -5.219 1.00 0.00 C ATOM 103 NE ARG A 43 13.864 -0.482 -5.739 1.00 0.00 N ATOM 104 CZ ARG A 43 13.624 -0.295 -7.035 1.00 0.00 C ATOM 105 NH1 ARG A 43 14.274 -1.008 -7.947 1.00 0.00 N ATOM 106 NH2 ARG A 43 12.731 0.606 -7.421 1.00 0.00 N ATOM 0 H ARG A 43 13.679 -2.107 0.205 1.00 0.00 H new ATOM 0 HA ARG A 43 16.113 -1.886 -1.228 1.00 0.00 H new ATOM 0 HB2 ARG A 43 14.917 -3.058 -3.010 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.553 -1.967 -2.866 1.00 0.00 H new ATOM 0 HG2 ARG A 43 15.002 -0.071 -3.578 1.00 0.00 H new ATOM 0 HG3 ARG A 43 16.358 -1.171 -3.735 1.00 0.00 H new ATOM 0 HD2 ARG A 43 15.701 -1.476 -5.874 1.00 0.00 H new ATOM 0 HD3 ARG A 43 14.389 -2.443 -5.230 1.00 0.00 H new ATOM 0 HE ARG A 43 13.342 0.082 -5.069 1.00 0.00 H new ATOM 0 HH11 ARG A 43 14.961 -1.703 -7.656 1.00 0.00 H new ATOM 0 HH12 ARG A 43 14.086 -0.861 -8.939 1.00 0.00 H new ATOM 0 HH21 ARG A 43 12.228 1.156 -6.725 1.00 0.00 H new ATOM 0 HH22 ARG A 43 12.547 0.749 -8.414 1.00 0.00 H new ATOM 120 N LYS A 44 15.611 0.645 -1.454 1.00 0.00 N ATOM 121 CA LYS A 44 15.421 2.064 -1.196 1.00 0.00 C ATOM 122 C LYS A 44 14.452 2.684 -2.193 1.00 0.00 C ATOM 123 O LYS A 44 14.484 2.384 -3.386 1.00 0.00 O ATOM 124 CB LYS A 44 16.757 2.800 -1.232 1.00 0.00 C ATOM 125 CG LYS A 44 17.095 3.472 0.084 1.00 0.00 C ATOM 126 CD LYS A 44 18.311 4.377 -0.044 1.00 0.00 C ATOM 127 CE LYS A 44 17.909 5.837 -0.175 1.00 0.00 C ATOM 128 NZ LYS A 44 18.792 6.730 0.625 1.00 0.00 N ATOM 0 H LYS A 44 16.451 0.418 -1.987 1.00 0.00 H new ATOM 0 HA LYS A 44 14.991 2.164 -0.200 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.548 2.095 -1.488 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.731 3.551 -2.022 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.240 4.056 0.425 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.284 2.713 0.843 1.00 0.00 H new ATOM 0 HD2 LYS A 44 18.952 4.252 0.829 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.896 4.080 -0.914 1.00 0.00 H new ATOM 0 HE2 LYS A 44 17.949 6.132 -1.224 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.876 5.960 0.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 18.485 7.717 0.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 18.735 6.466 1.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 19.774 6.632 0.297 1.00 0.00 H new ATOM 142 N LEU A 45 13.588 3.550 -1.681 1.00 0.00 N ATOM 143 CA LEU A 45 12.593 4.227 -2.501 1.00 0.00 C ATOM 144 C LEU A 45 13.196 5.437 -3.208 1.00 0.00 C ATOM 145 O LEU A 45 13.883 6.251 -2.591 1.00 0.00 O ATOM 146 CB LEU A 45 11.415 4.668 -1.628 1.00 0.00 C ATOM 147 CG LEU A 45 10.142 5.068 -2.383 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.883 4.130 -3.551 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.952 5.079 -1.436 1.00 0.00 C ATOM 0 H LEU A 45 13.557 3.802 -0.693 1.00 0.00 H new ATOM 0 HA LEU A 45 12.242 3.528 -3.261 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.170 3.856 -0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.735 5.513 -1.018 1.00 0.00 H new ATOM 0 HG LEU A 45 10.283 6.072 -2.783 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.974 4.436 -4.069 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.725 4.168 -4.242 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.764 3.112 -3.180 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.054 5.365 -1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.817 4.085 -1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.131 5.796 -0.635 1.00 0.00 H new ATOM 161 N THR A 46 12.928 5.551 -4.504 1.00 0.00 N ATOM 162 CA THR A 46 13.439 6.665 -5.295 1.00 0.00 C ATOM 163 C THR A 46 12.676 7.947 -4.971 1.00 0.00 C ATOM 164 O THR A 46 11.521 7.899 -4.545 1.00 0.00 O ATOM 165 CB THR A 46 13.323 6.357 -6.788 1.00 0.00 C ATOM 166 OG1 THR A 46 11.980 6.484 -7.223 1.00 0.00 O ATOM 167 CG2 THR A 46 13.795 4.965 -7.153 1.00 0.00 C ATOM 0 H THR A 46 12.360 4.886 -5.029 1.00 0.00 H new ATOM 0 HA THR A 46 14.490 6.807 -5.043 1.00 0.00 H new ATOM 0 HB THR A 46 13.969 7.082 -7.283 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.933 7.136 -7.953 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.685 4.813 -8.227 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.843 4.852 -6.876 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.197 4.226 -6.619 1.00 0.00 H new ATOM 175 N PRO A 47 13.308 9.114 -5.174 1.00 0.00 N ATOM 176 CA PRO A 47 12.672 10.407 -4.905 1.00 0.00 C ATOM 177 C PRO A 47 11.408 10.602 -5.732 1.00 0.00 C ATOM 178 O PRO A 47 10.437 11.200 -5.270 1.00 0.00 O ATOM 179 CB PRO A 47 13.741 11.434 -5.303 1.00 0.00 C ATOM 180 CG PRO A 47 14.696 10.689 -6.173 1.00 0.00 C ATOM 181 CD PRO A 47 14.678 9.270 -5.685 1.00 0.00 C ATOM 0 HA PRO A 47 12.355 10.497 -3.866 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.299 12.276 -5.835 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.243 11.840 -4.425 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.396 10.746 -7.219 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.698 11.113 -6.105 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.892 8.564 -6.488 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.421 9.102 -4.906 1.00 0.00 H new ATOM 189 N GLU A 48 11.424 10.083 -6.955 1.00 0.00 N ATOM 190 CA GLU A 48 10.274 10.190 -7.843 1.00 0.00 C ATOM 191 C GLU A 48 9.120 9.342 -7.318 1.00 0.00 C ATOM 192 O GLU A 48 7.973 9.788 -7.283 1.00 0.00 O ATOM 193 CB GLU A 48 10.651 9.751 -9.259 1.00 0.00 C ATOM 194 CG GLU A 48 10.261 10.756 -10.331 1.00 0.00 C ATOM 195 CD GLU A 48 11.412 11.100 -11.257 1.00 0.00 C ATOM 196 OE1 GLU A 48 12.546 11.260 -10.760 1.00 0.00 O ATOM 197 OE2 GLU A 48 11.178 11.207 -12.480 1.00 0.00 O ATOM 0 H GLU A 48 12.220 9.585 -7.353 1.00 0.00 H new ATOM 0 HA GLU A 48 9.956 11.232 -7.875 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.727 9.583 -9.304 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.170 8.797 -9.475 1.00 0.00 H new ATOM 0 HG2 GLU A 48 9.436 10.353 -10.918 1.00 0.00 H new ATOM 0 HG3 GLU A 48 9.898 11.667 -9.855 1.00 0.00 H new ATOM 204 N GLU A 49 9.437 8.120 -6.903 1.00 0.00 N ATOM 205 CA GLU A 49 8.431 7.211 -6.371 1.00 0.00 C ATOM 206 C GLU A 49 7.909 7.714 -5.030 1.00 0.00 C ATOM 207 O GLU A 49 6.722 7.595 -4.730 1.00 0.00 O ATOM 208 CB GLU A 49 9.014 5.805 -6.213 1.00 0.00 C ATOM 209 CG GLU A 49 9.303 5.115 -7.536 1.00 0.00 C ATOM 210 CD GLU A 49 10.446 4.121 -7.439 1.00 0.00 C ATOM 211 OE1 GLU A 49 11.241 4.224 -6.482 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.542 3.241 -8.319 1.00 0.00 O ATOM 0 H GLU A 49 10.382 7.737 -6.925 1.00 0.00 H new ATOM 0 HA GLU A 49 7.600 7.171 -7.075 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.936 5.866 -5.635 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.318 5.194 -5.639 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.405 4.599 -7.876 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.543 5.866 -8.289 1.00 0.00 H new ATOM 219 N ARG A 50 8.806 8.284 -4.233 1.00 0.00 N ATOM 220 CA ARG A 50 8.437 8.813 -2.926 1.00 0.00 C ATOM 221 C ARG A 50 7.547 10.043 -3.081 1.00 0.00 C ATOM 222 O ARG A 50 6.652 10.282 -2.270 1.00 0.00 O ATOM 223 CB ARG A 50 9.692 9.170 -2.123 1.00 0.00 C ATOM 224 CG ARG A 50 9.902 8.296 -0.897 1.00 0.00 C ATOM 225 CD ARG A 50 10.828 8.963 0.108 1.00 0.00 C ATOM 226 NE ARG A 50 12.194 8.445 0.026 1.00 0.00 N ATOM 227 CZ ARG A 50 13.283 9.172 0.268 1.00 0.00 C ATOM 228 NH1 ARG A 50 13.179 10.444 0.635 1.00 0.00 N ATOM 229 NH2 ARG A 50 14.484 8.623 0.151 1.00 0.00 N ATOM 0 H ARG A 50 9.792 8.391 -4.469 1.00 0.00 H new ATOM 0 HA ARG A 50 7.881 8.045 -2.387 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.564 9.086 -2.772 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.628 10.212 -1.809 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.941 8.089 -0.427 1.00 0.00 H new ATOM 0 HG3 ARG A 50 10.322 7.337 -1.200 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.838 10.039 -0.067 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.442 8.807 1.115 1.00 0.00 H new ATOM 0 HE ARG A 50 12.320 7.466 -0.233 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.259 10.873 0.734 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.019 10.992 0.818 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.573 7.645 -0.124 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.319 9.179 0.336 1.00 0.00 H new ATOM 243 N SER A 51 7.801 10.818 -4.132 1.00 0.00 N ATOM 244 CA SER A 51 7.027 12.024 -4.399 1.00 0.00 C ATOM 245 C SER A 51 5.616 11.676 -4.860 1.00 0.00 C ATOM 246 O SER A 51 4.641 12.288 -4.426 1.00 0.00 O ATOM 247 CB SER A 51 7.726 12.881 -5.456 1.00 0.00 C ATOM 248 OG SER A 51 7.409 14.253 -5.293 1.00 0.00 O ATOM 0 H SER A 51 8.538 10.631 -4.812 1.00 0.00 H new ATOM 0 HA SER A 51 6.955 12.591 -3.471 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.805 12.743 -5.385 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.427 12.551 -6.451 1.00 0.00 H new ATOM 0 HG SER A 51 7.870 14.779 -5.980 1.00 0.00 H new ATOM 254 N ALA A 52 5.515 10.688 -5.738 1.00 0.00 N ATOM 255 CA ALA A 52 4.219 10.261 -6.250 1.00 0.00 C ATOM 256 C ALA A 52 3.366 9.692 -5.129 1.00 0.00 C ATOM 257 O ALA A 52 2.182 10.006 -5.011 1.00 0.00 O ATOM 258 CB ALA A 52 4.392 9.239 -7.357 1.00 0.00 C ATOM 0 H ALA A 52 6.310 10.169 -6.110 1.00 0.00 H new ATOM 0 HA ALA A 52 3.710 11.131 -6.664 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.413 8.933 -7.726 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.966 9.680 -8.173 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.922 8.369 -6.969 1.00 0.00 H new ATOM 264 N VAL A 53 3.984 8.864 -4.297 1.00 0.00 N ATOM 265 CA VAL A 53 3.296 8.261 -3.168 1.00 0.00 C ATOM 266 C VAL A 53 2.730 9.350 -2.274 1.00 0.00 C ATOM 267 O VAL A 53 1.525 9.419 -2.046 1.00 0.00 O ATOM 268 CB VAL A 53 4.243 7.362 -2.349 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.547 6.826 -1.105 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.762 6.219 -3.207 1.00 0.00 C ATOM 0 H VAL A 53 4.964 8.595 -4.385 1.00 0.00 H new ATOM 0 HA VAL A 53 2.488 7.641 -3.556 1.00 0.00 H new ATOM 0 HB VAL A 53 5.091 7.966 -2.025 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.237 6.195 -0.545 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.228 7.659 -0.479 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.677 6.240 -1.399 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.429 5.593 -2.614 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.923 5.620 -3.562 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.306 6.623 -4.061 1.00 0.00 H new ATOM 280 N GLU A 54 3.613 10.212 -1.789 1.00 0.00 N ATOM 281 CA GLU A 54 3.206 11.317 -0.933 1.00 0.00 C ATOM 282 C GLU A 54 2.096 12.123 -1.603 1.00 0.00 C ATOM 283 O GLU A 54 1.207 12.654 -0.937 1.00 0.00 O ATOM 284 CB GLU A 54 4.414 12.206 -0.602 1.00 0.00 C ATOM 285 CG GLU A 54 4.780 13.209 -1.688 1.00 0.00 C ATOM 286 CD GLU A 54 5.595 14.370 -1.155 1.00 0.00 C ATOM 287 OE1 GLU A 54 5.163 15.528 -1.329 1.00 0.00 O ATOM 288 OE2 GLU A 54 6.665 14.121 -0.562 1.00 0.00 O ATOM 0 H GLU A 54 4.615 10.167 -1.974 1.00 0.00 H new ATOM 0 HA GLU A 54 2.815 10.916 0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.207 12.749 0.320 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.276 11.568 -0.410 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.344 12.702 -2.471 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.868 13.590 -2.148 1.00 0.00 H new ATOM 295 N ASN A 55 2.150 12.191 -2.931 1.00 0.00 N ATOM 296 CA ASN A 55 1.146 12.907 -3.705 1.00 0.00 C ATOM 297 C ASN A 55 -0.161 12.123 -3.721 1.00 0.00 C ATOM 298 O ASN A 55 -1.248 12.701 -3.738 1.00 0.00 O ATOM 299 CB ASN A 55 1.636 13.125 -5.138 1.00 0.00 C ATOM 300 CG ASN A 55 2.777 14.120 -5.217 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.847 15.066 -4.433 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.677 13.909 -6.169 1.00 0.00 N ATOM 0 H ASN A 55 2.882 11.756 -3.493 1.00 0.00 H new ATOM 0 HA ASN A 55 0.975 13.877 -3.238 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.960 12.172 -5.557 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.807 13.478 -5.752 1.00 0.00 H new ATOM 0 HD21 ASN A 55 4.468 14.545 -6.273 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.578 13.111 -6.796 1.00 0.00 H new ATOM 309 N TYR A 56 -0.036 10.801 -3.716 1.00 0.00 N ATOM 310 CA TYR A 56 -1.192 9.916 -3.731 1.00 0.00 C ATOM 311 C TYR A 56 -1.884 9.908 -2.365 1.00 0.00 C ATOM 312 O TYR A 56 -3.104 10.051 -2.278 1.00 0.00 O ATOM 313 CB TYR A 56 -0.749 8.503 -4.135 1.00 0.00 C ATOM 314 CG TYR A 56 -1.645 7.395 -3.631 1.00 0.00 C ATOM 315 CD1 TYR A 56 -2.981 7.333 -4.003 1.00 0.00 C ATOM 316 CD2 TYR A 56 -1.154 6.415 -2.781 1.00 0.00 C ATOM 317 CE1 TYR A 56 -3.803 6.325 -3.538 1.00 0.00 C ATOM 318 CE2 TYR A 56 -1.966 5.404 -2.313 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.290 5.363 -2.692 1.00 0.00 C ATOM 320 OH TYR A 56 -4.102 4.359 -2.222 1.00 0.00 O ATOM 0 H TYR A 56 0.862 10.317 -3.702 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.914 10.280 -4.462 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.702 8.448 -5.223 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.261 8.333 -3.763 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.384 8.084 -4.666 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -0.117 6.445 -2.480 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -4.841 6.290 -3.835 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -1.567 4.648 -1.653 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.359 4.552 -1.296 1.00 0.00 H new ATOM 330 N LEU A 57 -1.098 9.749 -1.302 1.00 0.00 N ATOM 331 CA LEU A 57 -1.642 9.732 0.052 1.00 0.00 C ATOM 332 C LEU A 57 -2.194 11.106 0.423 1.00 0.00 C ATOM 333 O LEU A 57 -3.262 11.219 1.027 1.00 0.00 O ATOM 334 CB LEU A 57 -0.565 9.331 1.066 1.00 0.00 C ATOM 335 CG LEU A 57 0.414 8.251 0.599 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.339 7.843 1.735 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.339 7.045 0.065 1.00 0.00 C ATOM 0 H LEU A 57 -0.086 9.631 -1.353 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.448 8.998 0.078 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.005 10.221 1.335 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.058 8.982 1.973 1.00 0.00 H new ATOM 0 HG LEU A 57 1.021 8.662 -0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.028 7.074 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.905 8.711 2.073 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.748 7.451 2.562 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.373 6.287 -0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.971 6.633 0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.960 7.348 -0.778 1.00 0.00 H new ATOM 349 N GLU A 58 -1.450 12.146 0.063 1.00 0.00 N ATOM 350 CA GLU A 58 -1.851 13.519 0.358 1.00 0.00 C ATOM 351 C GLU A 58 -3.154 13.869 -0.347 1.00 0.00 C ATOM 352 O GLU A 58 -4.087 14.383 0.268 1.00 0.00 O ATOM 353 CB GLU A 58 -0.750 14.495 -0.062 1.00 0.00 C ATOM 354 CG GLU A 58 -1.075 15.949 0.246 1.00 0.00 C ATOM 355 CD GLU A 58 -0.787 16.871 -0.923 1.00 0.00 C ATOM 356 OE1 GLU A 58 -1.521 16.799 -1.931 1.00 0.00 O ATOM 357 OE2 GLU A 58 0.171 17.666 -0.830 1.00 0.00 O ATOM 0 H GLU A 58 -0.563 12.065 -0.435 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.009 13.602 1.433 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.177 14.224 0.444 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.572 14.390 -1.132 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -2.127 16.032 0.519 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.495 16.272 1.110 1.00 0.00 H new ATOM 364 N SER A 59 -3.213 13.578 -1.639 1.00 0.00 N ATOM 365 CA SER A 59 -4.408 13.851 -2.426 1.00 0.00 C ATOM 366 C SER A 59 -5.553 12.946 -1.981 1.00 0.00 C ATOM 367 O SER A 59 -6.725 13.294 -2.119 1.00 0.00 O ATOM 368 CB SER A 59 -4.125 13.644 -3.915 1.00 0.00 C ATOM 369 OG SER A 59 -4.994 14.427 -4.713 1.00 0.00 O ATOM 0 H SER A 59 -2.449 13.153 -2.164 1.00 0.00 H new ATOM 0 HA SER A 59 -4.697 14.890 -2.266 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.090 13.909 -4.132 1.00 0.00 H new ATOM 0 HB3 SER A 59 -4.244 12.591 -4.168 1.00 0.00 H new ATOM 0 HG SER A 59 -4.792 14.278 -5.660 1.00 0.00 H new ATOM 623 N SER A 78 -5.481 7.468 6.453 1.00 0.00 N ATOM 624 CA SER A 78 -4.271 8.028 5.866 1.00 0.00 C ATOM 625 C SER A 78 -3.061 7.725 6.742 1.00 0.00 C ATOM 626 O SER A 78 -3.115 7.871 7.963 1.00 0.00 O ATOM 627 CB SER A 78 -4.419 9.539 5.681 1.00 0.00 C ATOM 628 OG SER A 78 -5.224 10.103 6.702 1.00 0.00 O ATOM 0 HA SER A 78 -4.119 7.567 4.890 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.435 10.007 5.690 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.863 9.747 4.707 1.00 0.00 H new ATOM 0 HG SER A 78 -5.812 9.413 7.074 1.00 0.00 H new ATOM 634 N LEU A 79 -1.974 7.296 6.112 1.00 0.00 N ATOM 635 CA LEU A 79 -0.753 6.965 6.844 1.00 0.00 C ATOM 636 C LEU A 79 0.249 8.117 6.802 1.00 0.00 C ATOM 637 O LEU A 79 0.382 8.804 5.790 1.00 0.00 O ATOM 638 CB LEU A 79 -0.095 5.684 6.296 1.00 0.00 C ATOM 639 CG LEU A 79 -0.565 5.206 4.920 1.00 0.00 C ATOM 640 CD1 LEU A 79 -2.012 4.747 4.984 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.374 6.291 3.867 1.00 0.00 C ATOM 0 H LEU A 79 -1.911 7.169 5.102 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.043 6.790 7.880 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.982 5.847 6.250 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.266 4.880 7.012 1.00 0.00 H new ATOM 0 HG LEU A 79 0.048 4.354 4.625 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.331 4.410 3.998 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.102 3.925 5.695 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.643 5.576 5.306 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.716 5.923 2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.951 7.173 4.145 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.682 6.553 3.802 1.00 0.00 H new ATOM 653 N ALA A 80 0.957 8.314 7.911 1.00 0.00 N ATOM 654 CA ALA A 80 1.957 9.372 8.007 1.00 0.00 C ATOM 655 C ALA A 80 3.322 8.849 7.572 1.00 0.00 C ATOM 656 O ALA A 80 3.768 7.801 8.031 1.00 0.00 O ATOM 657 CB ALA A 80 2.021 9.915 9.426 1.00 0.00 C ATOM 0 H ALA A 80 0.856 7.753 8.757 1.00 0.00 H new ATOM 0 HA ALA A 80 1.669 10.185 7.341 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.772 10.703 9.480 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.048 10.320 9.705 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.289 9.111 10.112 1.00 0.00 H new ATOM 663 N LEU A 81 3.977 9.577 6.678 1.00 0.00 N ATOM 664 CA LEU A 81 5.282 9.164 6.173 1.00 0.00 C ATOM 665 C LEU A 81 6.344 9.184 7.268 1.00 0.00 C ATOM 666 O LEU A 81 6.602 10.217 7.885 1.00 0.00 O ATOM 667 CB LEU A 81 5.711 10.067 5.015 1.00 0.00 C ATOM 668 CG LEU A 81 4.834 9.978 3.765 1.00 0.00 C ATOM 669 CD1 LEU A 81 5.120 11.142 2.829 1.00 0.00 C ATOM 670 CD2 LEU A 81 5.055 8.652 3.054 1.00 0.00 C ATOM 0 H LEU A 81 3.629 10.453 6.288 1.00 0.00 H new ATOM 0 HA LEU A 81 5.187 8.138 5.818 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.717 11.100 5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.736 9.817 4.740 1.00 0.00 H new ATOM 0 HG LEU A 81 3.789 10.034 4.071 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.487 11.062 1.945 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.911 12.081 3.342 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.167 11.118 2.528 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.423 8.605 2.167 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.101 8.567 2.760 1.00 0.00 H new ATOM 0 HD23 LEU A 81 4.799 7.832 3.725 1.00 0.00 H new ATOM 682 N ASN A 82 6.965 8.028 7.490 1.00 0.00 N ATOM 683 CA ASN A 82 8.013 7.889 8.497 1.00 0.00 C ATOM 684 C ASN A 82 9.348 7.566 7.837 1.00 0.00 C ATOM 685 O ASN A 82 9.444 7.488 6.614 1.00 0.00 O ATOM 686 CB ASN A 82 7.658 6.795 9.504 1.00 0.00 C ATOM 687 CG ASN A 82 6.926 7.336 10.715 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.411 8.454 10.697 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.879 6.542 11.778 1.00 0.00 N ATOM 0 H ASN A 82 6.758 7.168 6.982 1.00 0.00 H new ATOM 0 HA ASN A 82 8.097 8.838 9.026 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.039 6.043 9.015 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.570 6.295 9.829 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.402 6.851 12.625 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.320 5.623 11.748 1.00 0.00 H new ATOM 696 N ALA A 83 10.375 7.382 8.657 1.00 0.00 N ATOM 697 CA ALA A 83 11.706 7.070 8.151 1.00 0.00 C ATOM 698 C ALA A 83 11.704 5.773 7.347 1.00 0.00 C ATOM 699 O ALA A 83 12.435 5.643 6.367 1.00 0.00 O ATOM 700 CB ALA A 83 12.705 6.981 9.293 1.00 0.00 C ATOM 0 H ALA A 83 10.312 7.443 9.673 1.00 0.00 H new ATOM 0 HA ALA A 83 12.006 7.879 7.485 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.693 6.747 8.895 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.742 7.935 9.819 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.398 6.197 9.985 1.00 0.00 H new ATOM 706 N GLU A 84 10.872 4.817 7.757 1.00 0.00 N ATOM 707 CA GLU A 84 10.781 3.547 7.057 1.00 0.00 C ATOM 708 C GLU A 84 10.148 3.746 5.684 1.00 0.00 C ATOM 709 O GLU A 84 10.318 2.921 4.789 1.00 0.00 O ATOM 710 CB GLU A 84 9.969 2.543 7.877 1.00 0.00 C ATOM 711 CG GLU A 84 10.599 1.162 7.944 1.00 0.00 C ATOM 712 CD GLU A 84 10.405 0.371 6.664 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.591 0.798 5.818 1.00 0.00 O ATOM 714 OE2 GLU A 84 11.066 -0.678 6.508 1.00 0.00 O ATOM 0 H GLU A 84 10.257 4.901 8.566 1.00 0.00 H new ATOM 0 HA GLU A 84 11.787 3.150 6.923 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.848 2.927 8.890 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.971 2.458 7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.665 1.262 8.147 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.166 0.609 8.778 1.00 0.00 H new ATOM 721 N SER A 85 9.431 4.861 5.529 1.00 0.00 N ATOM 722 CA SER A 85 8.776 5.195 4.268 1.00 0.00 C ATOM 723 C SER A 85 9.773 5.216 3.111 1.00 0.00 C ATOM 724 O SER A 85 9.380 5.184 1.946 1.00 0.00 O ATOM 725 CB SER A 85 8.080 6.554 4.377 1.00 0.00 C ATOM 726 OG SER A 85 8.997 7.616 4.173 1.00 0.00 O ATOM 0 H SER A 85 9.290 5.550 6.268 1.00 0.00 H new ATOM 0 HA SER A 85 8.034 4.423 4.064 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.278 6.615 3.641 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.619 6.652 5.360 1.00 0.00 H new ATOM 0 HG SER A 85 9.482 7.794 5.006 1.00 0.00 H new ATOM 732 N ASN A 86 11.062 5.269 3.433 1.00 0.00 N ATOM 733 CA ASN A 86 12.095 5.286 2.411 1.00 0.00 C ATOM 734 C ASN A 86 12.486 3.868 2.027 1.00 0.00 C ATOM 735 O ASN A 86 12.839 3.598 0.882 1.00 0.00 O ATOM 736 CB ASN A 86 13.324 6.043 2.908 1.00 0.00 C ATOM 737 CG ASN A 86 12.980 7.418 3.441 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.023 7.583 4.198 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.763 8.412 3.048 1.00 0.00 N ATOM 0 H ASN A 86 11.412 5.301 4.391 1.00 0.00 H new ATOM 0 HA ASN A 86 11.697 5.794 1.532 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.811 5.464 3.692 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.041 6.141 2.093 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.584 9.362 3.374 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.545 8.227 2.420 1.00 0.00 H new ATOM 746 N ASN A 87 12.419 2.962 2.994 1.00 0.00 N ATOM 747 CA ASN A 87 12.768 1.568 2.754 1.00 0.00 C ATOM 748 C ASN A 87 11.543 0.771 2.320 1.00 0.00 C ATOM 749 O ASN A 87 10.675 0.462 3.135 1.00 0.00 O ATOM 750 CB ASN A 87 13.358 0.947 4.022 1.00 0.00 C ATOM 751 CG ASN A 87 14.270 1.898 4.772 1.00 0.00 C ATOM 752 OD1 ASN A 87 13.914 2.195 6.017 1.00 0.00 O flip ATOM 753 ND2 ASN A 87 15.280 2.359 4.241 1.00 0.00 N flip ATOM 0 H ASN A 87 12.127 3.167 3.950 1.00 0.00 H new ATOM 0 HA ASN A 87 13.509 1.536 1.955 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.547 0.634 4.679 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.916 0.049 3.756 1.00 0.00 H new ATOM 0 HD21 ASN A 87 15.514 2.103 3.282 1.00 0.00 H new ATOM 0 HD22 ASN A 87 15.883 2.997 4.760 1.00 0.00 H new ATOM 760 N VAL A 88 11.485 0.433 1.036 1.00 0.00 N ATOM 761 CA VAL A 88 10.367 -0.333 0.498 1.00 0.00 C ATOM 762 C VAL A 88 10.540 -1.825 0.765 1.00 0.00 C ATOM 763 O VAL A 88 11.633 -2.371 0.620 1.00 0.00 O ATOM 764 CB VAL A 88 10.208 -0.105 -1.020 1.00 0.00 C ATOM 765 CG1 VAL A 88 9.014 -0.882 -1.558 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.069 1.379 -1.327 1.00 0.00 C ATOM 0 H VAL A 88 12.199 0.677 0.349 1.00 0.00 H new ATOM 0 HA VAL A 88 9.469 0.019 1.006 1.00 0.00 H new ATOM 0 HB VAL A 88 11.105 -0.473 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.919 -0.708 -2.630 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.160 -1.947 -1.375 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.106 -0.549 -1.055 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.958 1.519 -2.402 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.191 1.775 -0.817 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.958 1.907 -0.982 1.00 0.00 H new ATOM 776 N MET A 89 9.447 -2.472 1.153 1.00 0.00 N ATOM 777 CA MET A 89 9.455 -3.901 1.443 1.00 0.00 C ATOM 778 C MET A 89 8.633 -4.662 0.406 1.00 0.00 C ATOM 779 O MET A 89 7.481 -4.319 0.141 1.00 0.00 O ATOM 780 CB MET A 89 8.902 -4.155 2.851 1.00 0.00 C ATOM 781 CG MET A 89 9.975 -4.502 3.869 1.00 0.00 C ATOM 782 SD MET A 89 10.770 -3.041 4.566 1.00 0.00 S ATOM 783 CE MET A 89 11.477 -3.722 6.063 1.00 0.00 C ATOM 0 H MET A 89 8.538 -2.026 1.275 1.00 0.00 H new ATOM 0 HA MET A 89 10.483 -4.260 1.398 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.366 -3.268 3.188 1.00 0.00 H new ATOM 0 HB3 MET A 89 8.177 -4.968 2.807 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.531 -5.088 4.674 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.729 -5.131 3.396 1.00 0.00 H new ATOM 0 HE1 MET A 89 12.161 -2.998 6.504 1.00 0.00 H new ATOM 0 HE2 MET A 89 10.680 -3.947 6.772 1.00 0.00 H new ATOM 0 HE3 MET A 89 12.020 -4.636 5.825 1.00 0.00 H new ATOM 793 N MET A 90 9.237 -5.689 -0.185 1.00 0.00 N ATOM 794 CA MET A 90 8.562 -6.491 -1.205 1.00 0.00 C ATOM 795 C MET A 90 8.163 -7.853 -0.646 1.00 0.00 C ATOM 796 O MET A 90 8.956 -8.513 0.026 1.00 0.00 O ATOM 797 CB MET A 90 9.462 -6.682 -2.437 1.00 0.00 C ATOM 798 CG MET A 90 10.632 -5.706 -2.530 1.00 0.00 C ATOM 799 SD MET A 90 10.572 -4.680 -4.011 1.00 0.00 S ATOM 800 CE MET A 90 10.986 -3.080 -3.322 1.00 0.00 C ATOM 0 H MET A 90 10.190 -5.986 0.023 1.00 0.00 H new ATOM 0 HA MET A 90 7.662 -5.954 -1.506 1.00 0.00 H new ATOM 0 HB2 MET A 90 9.855 -7.699 -2.429 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.852 -6.583 -3.335 1.00 0.00 H new ATOM 0 HG2 MET A 90 10.634 -5.064 -1.649 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.567 -6.266 -2.519 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.127 -2.414 -3.407 1.00 0.00 H new ATOM 0 HE2 MET A 90 11.253 -3.194 -2.272 1.00 0.00 H new ATOM 0 HE3 MET A 90 11.830 -2.656 -3.867 1.00 0.00 H new ATOM 810 N LEU A 91 6.931 -8.272 -0.923 1.00 0.00 N ATOM 811 CA LEU A 91 6.445 -9.560 -0.436 1.00 0.00 C ATOM 812 C LEU A 91 5.275 -10.079 -1.253 1.00 0.00 C ATOM 813 O LEU A 91 4.392 -9.319 -1.650 1.00 0.00 O ATOM 814 CB LEU A 91 5.994 -9.443 1.020 1.00 0.00 C ATOM 815 CG LEU A 91 4.841 -8.463 1.252 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.703 -9.137 2.004 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.324 -7.232 2.004 1.00 0.00 C ATOM 0 H LEU A 91 6.256 -7.744 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 91 7.276 -10.259 -0.528 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.693 -10.429 1.374 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.845 -9.133 1.627 1.00 0.00 H new ATOM 0 HG LEU A 91 4.466 -8.145 0.279 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.895 -8.422 2.158 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.334 -9.983 1.424 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.064 -9.490 2.970 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.489 -6.549 2.158 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.731 -7.532 2.970 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.099 -6.732 1.424 1.00 0.00 H new ATOM 829 N THR A 92 5.239 -11.392 -1.443 1.00 0.00 N ATOM 830 CA THR A 92 4.135 -12.019 -2.144 1.00 0.00 C ATOM 831 C THR A 92 3.083 -12.369 -1.103 1.00 0.00 C ATOM 832 O THR A 92 3.330 -13.189 -0.219 1.00 0.00 O ATOM 833 CB THR A 92 4.599 -13.272 -2.896 1.00 0.00 C ATOM 834 OG1 THR A 92 3.570 -13.760 -3.739 1.00 0.00 O ATOM 835 CG2 THR A 92 5.018 -14.406 -1.983 1.00 0.00 C ATOM 0 H THR A 92 5.960 -12.038 -1.122 1.00 0.00 H new ATOM 0 HA THR A 92 3.724 -11.340 -2.892 1.00 0.00 H new ATOM 0 HB THR A 92 5.468 -12.953 -3.472 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.885 -14.558 -4.212 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.334 -15.259 -2.584 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.846 -14.079 -1.353 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.176 -14.697 -1.354 1.00 0.00 H new ATOM 843 N HIS A 93 1.936 -11.710 -1.165 1.00 0.00 N ATOM 844 CA HIS A 93 0.902 -11.934 -0.169 1.00 0.00 C ATOM 845 C HIS A 93 -0.474 -11.501 -0.664 1.00 0.00 C ATOM 846 O HIS A 93 -0.594 -10.611 -1.506 1.00 0.00 O ATOM 847 CB HIS A 93 1.277 -11.149 1.090 1.00 0.00 C ATOM 848 CG HIS A 93 1.110 -11.906 2.366 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.113 -12.335 2.835 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.024 -12.292 3.286 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.055 -12.951 3.992 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.343 -12.940 4.288 1.00 0.00 N ATOM 0 H HIS A 93 1.700 -11.026 -1.884 1.00 0.00 H new ATOM 0 HA HIS A 93 0.841 -13.002 0.041 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.315 -10.828 1.006 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.667 -10.247 1.135 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.090 -12.122 3.241 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.728 -13.389 4.594 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.763 -13.346 5.124 1.00 0.00 H new ATOM 861 N ALA A 94 -1.511 -12.129 -0.115 1.00 0.00 N ATOM 862 CA ALA A 94 -2.883 -11.803 -0.478 1.00 0.00 C ATOM 863 C ALA A 94 -3.383 -10.626 0.351 1.00 0.00 C ATOM 864 O ALA A 94 -3.299 -10.641 1.579 1.00 0.00 O ATOM 865 CB ALA A 94 -3.784 -13.012 -0.280 1.00 0.00 C ATOM 0 H ALA A 94 -1.424 -12.867 0.584 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.908 -11.522 -1.531 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.806 -12.753 -0.555 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.436 -13.832 -0.908 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.757 -13.319 0.766 1.00 0.00 H new ATOM 871 N ILE A 95 -3.888 -9.601 -0.325 1.00 0.00 N ATOM 872 CA ILE A 95 -4.384 -8.412 0.358 1.00 0.00 C ATOM 873 C ILE A 95 -5.854 -8.551 0.735 1.00 0.00 C ATOM 874 O ILE A 95 -6.687 -8.924 -0.091 1.00 0.00 O ATOM 875 CB ILE A 95 -4.213 -7.147 -0.508 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.939 -7.237 -1.353 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.185 -5.905 0.372 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.691 -7.509 -0.542 1.00 0.00 C ATOM 0 H ILE A 95 -3.965 -9.569 -1.342 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.788 -8.312 1.265 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.064 -7.074 -1.185 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.060 -8.027 -2.094 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.810 -6.303 -1.901 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.064 -5.020 -0.252 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.120 -5.832 0.928 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.351 -5.973 1.071 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.829 -7.559 -1.207 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.545 -6.707 0.181 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.799 -8.457 -0.015 1.00 0.00 H new ATOM 890 N THR A 96 -6.167 -8.235 1.988 1.00 0.00 N ATOM 891 CA THR A 96 -7.538 -8.309 2.476 1.00 0.00 C ATOM 892 C THR A 96 -8.208 -6.944 2.367 1.00 0.00 C ATOM 893 O THR A 96 -7.538 -5.912 2.402 1.00 0.00 O ATOM 894 CB THR A 96 -7.572 -8.800 3.925 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.312 -9.320 4.310 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.605 -9.880 4.167 1.00 0.00 C ATOM 0 H THR A 96 -5.488 -7.925 2.684 1.00 0.00 H new ATOM 0 HA THR A 96 -8.085 -9.022 1.859 1.00 0.00 H new ATOM 0 HB THR A 96 -7.836 -7.925 4.519 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.702 -8.581 4.515 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.576 -10.183 5.214 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.596 -9.495 3.928 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.387 -10.740 3.534 1.00 0.00 H new ATOM 904 N ARG A 97 -9.527 -6.941 2.224 1.00 0.00 N ATOM 905 CA ARG A 97 -10.274 -5.695 2.097 1.00 0.00 C ATOM 906 C ARG A 97 -11.232 -5.499 3.266 1.00 0.00 C ATOM 907 O ARG A 97 -12.203 -6.241 3.418 1.00 0.00 O ATOM 908 CB ARG A 97 -11.050 -5.679 0.778 1.00 0.00 C ATOM 909 CG ARG A 97 -10.864 -4.404 -0.028 1.00 0.00 C ATOM 910 CD ARG A 97 -10.746 -4.699 -1.515 1.00 0.00 C ATOM 911 NE ARG A 97 -12.053 -4.760 -2.169 1.00 0.00 N ATOM 912 CZ ARG A 97 -12.730 -3.689 -2.575 1.00 0.00 C ATOM 913 NH1 ARG A 97 -12.240 -2.471 -2.383 1.00 0.00 N ATOM 914 NH2 ARG A 97 -13.904 -3.836 -3.173 1.00 0.00 N ATOM 0 H ARG A 97 -10.101 -7.784 2.193 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.558 -4.873 2.106 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.736 -6.529 0.173 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.111 -5.812 0.990 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.707 -3.736 0.146 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.969 -3.883 0.313 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.139 -3.928 -1.990 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.226 -5.646 -1.656 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.470 -5.678 -2.323 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.338 -2.351 -1.921 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.765 -1.655 -2.697 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -14.287 -4.769 -3.321 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -14.424 -3.016 -3.485 1.00 0.00 H new ATOM 928 N TYR A 98 -10.958 -4.487 4.081 1.00 0.00 N ATOM 929 CA TYR A 98 -11.802 -4.183 5.227 1.00 0.00 C ATOM 930 C TYR A 98 -12.524 -2.858 5.018 1.00 0.00 C ATOM 931 O TYR A 98 -11.960 -1.789 5.254 1.00 0.00 O ATOM 932 CB TYR A 98 -10.961 -4.118 6.503 1.00 0.00 C ATOM 933 CG TYR A 98 -10.698 -5.470 7.127 1.00 0.00 C ATOM 934 CD1 TYR A 98 -9.779 -6.348 6.567 1.00 0.00 C ATOM 935 CD2 TYR A 98 -11.368 -5.866 8.277 1.00 0.00 C ATOM 936 CE1 TYR A 98 -9.537 -7.584 7.136 1.00 0.00 C ATOM 937 CE2 TYR A 98 -11.131 -7.100 8.852 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.214 -7.955 8.278 1.00 0.00 C ATOM 939 OH TYR A 98 -9.974 -9.184 8.846 1.00 0.00 O ATOM 0 H TYR A 98 -10.158 -3.864 3.968 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.542 -4.977 5.329 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.008 -3.641 6.275 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.469 -3.485 7.230 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -9.245 -6.060 5.673 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -12.086 -5.198 8.730 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.820 -8.256 6.688 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.661 -7.393 9.746 1.00 0.00 H new ATOM 0 HH TYR A 98 -10.531 -9.289 9.645 1.00 0.00 H new ATOM 949 N GLY A 99 -13.774 -2.933 4.575 1.00 0.00 N ATOM 950 CA GLY A 99 -14.547 -1.730 4.342 1.00 0.00 C ATOM 951 C GLY A 99 -15.174 -1.189 5.609 1.00 0.00 C ATOM 952 O GLY A 99 -15.936 -1.884 6.281 1.00 0.00 O ATOM 0 H GLY A 99 -14.264 -3.805 4.374 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.903 -0.967 3.905 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.330 -1.941 3.614 1.00 0.00 H new ATOM 956 N ILE A 100 -14.852 0.057 5.936 1.00 0.00 N ATOM 957 CA ILE A 100 -15.390 0.691 7.132 1.00 0.00 C ATOM 958 C ILE A 100 -15.832 2.128 6.862 1.00 0.00 C ATOM 959 O ILE A 100 -16.062 2.900 7.793 1.00 0.00 O ATOM 960 CB ILE A 100 -14.367 0.682 8.285 1.00 0.00 C ATOM 961 CG1 ILE A 100 -13.151 1.539 7.930 1.00 0.00 C ATOM 962 CG2 ILE A 100 -13.940 -0.743 8.602 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.263 2.970 8.411 1.00 0.00 C ATOM 0 H ILE A 100 -14.223 0.646 5.391 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.261 0.105 7.425 1.00 0.00 H new ATOM 0 HB ILE A 100 -14.840 1.107 9.170 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.258 1.087 8.363 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.017 1.537 6.848 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.218 -0.733 9.418 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -14.812 -1.327 8.896 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -13.484 -1.191 7.719 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.367 3.521 8.126 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -14.137 3.439 7.958 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -13.366 2.982 9.496 1.00 0.00 H new ATOM 975 N SER A 101 -15.950 2.483 5.587 1.00 0.00 N ATOM 976 CA SER A 101 -16.366 3.828 5.204 1.00 0.00 C ATOM 977 C SER A 101 -17.685 3.798 4.439 1.00 0.00 C ATOM 978 O SER A 101 -18.444 4.768 4.454 1.00 0.00 O ATOM 979 CB SER A 101 -15.290 4.487 4.340 1.00 0.00 C ATOM 980 OG SER A 101 -15.379 5.899 4.401 1.00 0.00 O ATOM 0 H SER A 101 -15.764 1.859 4.802 1.00 0.00 H new ATOM 0 HA SER A 101 -16.507 4.407 6.116 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.304 4.167 4.676 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.397 4.157 3.307 1.00 0.00 H new ATOM 0 HG SER A 101 -16.321 6.166 4.441 1.00 0.00 H new ATOM 986 N THR A 102 -17.948 2.683 3.768 1.00 0.00 N ATOM 987 CA THR A 102 -19.168 2.523 2.986 1.00 0.00 C ATOM 988 C THR A 102 -19.378 1.060 2.613 1.00 0.00 C ATOM 989 O THR A 102 -18.459 0.246 2.715 1.00 0.00 O ATOM 990 CB THR A 102 -19.093 3.377 1.719 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.766 4.718 2.033 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.383 3.394 0.928 1.00 0.00 C ATOM 0 H THR A 102 -17.329 1.872 3.750 1.00 0.00 H new ATOM 0 HA THR A 102 -20.012 2.852 3.592 1.00 0.00 H new ATOM 0 HB THR A 102 -18.317 2.914 1.109 1.00 0.00 H new ATOM 0 HG1 THR A 102 -19.124 4.944 2.917 1.00 0.00 H new ATOM 0 HG21 THR A 102 -20.259 4.018 0.043 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.636 2.379 0.623 1.00 0.00 H new ATOM 0 HG23 THR A 102 -21.184 3.798 1.547 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.589 0.729 2.178 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.909 -0.640 1.788 1.00 0.00 C ATOM 1002 C ASP A 103 -20.831 -0.814 0.273 1.00 0.00 C ATOM 1003 O ASP A 103 -21.446 -1.719 -0.290 1.00 0.00 O ATOM 1004 CB ASP A 103 -22.301 -1.022 2.283 1.00 0.00 C ATOM 1005 CG ASP A 103 -23.365 -0.034 1.844 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -23.795 -0.105 0.674 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -23.766 0.812 2.671 1.00 0.00 O ATOM 0 H ASP A 103 -21.363 1.387 2.087 1.00 0.00 H new ATOM 0 HA ASP A 103 -20.172 -1.299 2.248 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.556 -2.014 1.911 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.292 -1.082 3.371 1.00 0.00 H new ATOM 1012 N ASP A 104 -20.066 0.055 -0.379 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.902 -0.006 -1.826 1.00 0.00 C ATOM 1014 C ASP A 104 -18.429 0.140 -2.195 1.00 0.00 C ATOM 1015 O ASP A 104 -17.741 1.004 -1.654 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.724 1.092 -2.505 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.933 0.542 -3.234 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -21.745 -0.142 -4.262 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -23.068 0.794 -2.778 1.00 0.00 O ATOM 0 H ASP A 104 -19.550 0.810 0.072 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.260 -0.975 -2.174 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.052 1.812 -1.756 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.092 1.631 -3.211 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.925 -0.700 -3.124 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.528 -0.665 -3.565 1.00 0.00 C ATOM 1026 C PRO A 105 -15.944 0.742 -3.585 1.00 0.00 C ATOM 1027 O PRO A 105 -15.993 1.435 -4.602 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.626 -1.238 -4.971 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.705 -2.261 -4.868 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.679 -1.755 -3.828 1.00 0.00 C ATOM 0 HA PRO A 105 -15.863 -1.213 -2.898 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.875 -0.467 -5.700 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.683 -1.683 -5.288 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.201 -2.400 -5.829 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.296 -3.229 -4.578 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.585 -1.360 -4.287 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -18.986 -2.549 -3.148 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.399 1.158 -2.448 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.813 2.485 -2.325 1.00 0.00 C ATOM 1040 C ASN A 106 -13.704 2.515 -1.275 1.00 0.00 C ATOM 1041 O ASN A 106 -13.303 1.479 -0.746 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.898 3.507 -1.975 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.858 3.742 -3.125 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.533 4.437 -4.088 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -18.049 3.162 -3.029 1.00 0.00 N ATOM 0 H ASN A 106 -15.351 0.595 -1.599 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.368 2.744 -3.286 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.455 3.159 -1.105 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.429 4.451 -1.697 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.737 3.284 -3.772 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -18.275 2.594 -2.212 1.00 0.00 H new ATOM 1052 N LYS A 107 -13.212 3.719 -0.987 1.00 0.00 N ATOM 1053 CA LYS A 107 -12.140 3.920 -0.012 1.00 0.00 C ATOM 1054 C LYS A 107 -12.347 3.075 1.243 1.00 0.00 C ATOM 1055 O LYS A 107 -13.263 3.316 2.027 1.00 0.00 O ATOM 1056 CB LYS A 107 -12.046 5.411 0.346 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.333 5.709 1.660 1.00 0.00 C ATOM 1058 CD LYS A 107 -12.107 6.718 2.494 1.00 0.00 C ATOM 1059 CE LYS A 107 -12.012 6.404 3.978 1.00 0.00 C ATOM 1060 NZ LYS A 107 -13.101 7.059 4.754 1.00 0.00 N ATOM 0 H LYS A 107 -13.544 4.580 -1.421 1.00 0.00 H new ATOM 0 HA LYS A 107 -11.202 3.595 -0.463 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.527 5.932 -0.459 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -13.054 5.823 0.394 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.209 4.786 2.226 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.334 6.094 1.455 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.719 7.719 2.307 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -13.153 6.719 2.187 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.060 5.325 4.125 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -11.045 6.735 4.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -12.926 6.934 5.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -13.126 8.074 4.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -14.013 6.627 4.504 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.473 2.089 1.415 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.519 1.184 2.557 1.00 0.00 C ATOM 1076 C TRP A 108 -10.105 0.843 3.022 1.00 0.00 C ATOM 1077 O TRP A 108 -9.124 1.274 2.417 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.263 -0.091 2.186 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.715 0.129 1.902 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.543 1.046 2.480 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.512 -0.599 0.973 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.805 0.936 1.956 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.814 -0.075 1.033 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.244 -1.644 0.097 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.850 -0.567 0.247 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.270 -2.135 -0.687 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.561 -1.596 -0.607 1.00 0.00 C ATOM 0 H TRP A 108 -10.711 1.895 0.765 1.00 0.00 H new ATOM 0 HA TRP A 108 -12.047 1.680 3.371 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.792 -0.535 1.309 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.164 -0.810 2.999 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.248 1.755 3.239 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.606 1.513 2.212 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.252 -2.065 0.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.845 -0.152 0.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -15.074 -2.947 -1.372 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.343 -2.001 -1.232 1.00 0.00 H new ATOM 1098 N ARG A 109 -10.007 0.067 4.095 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.709 -0.331 4.635 1.00 0.00 C ATOM 1100 C ARG A 109 -8.346 -1.728 4.151 1.00 0.00 C ATOM 1101 O ARG A 109 -9.216 -2.586 4.015 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.745 -0.325 6.166 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.057 0.873 6.795 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.056 1.822 7.438 1.00 0.00 C ATOM 1105 NE ARG A 109 -10.081 2.262 6.494 1.00 0.00 N ATOM 1106 CZ ARG A 109 -10.842 3.340 6.673 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -10.700 4.088 7.760 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -11.748 3.670 5.762 1.00 0.00 N ATOM 0 H ARG A 109 -10.808 -0.299 4.609 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.961 0.382 4.288 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.784 -0.348 6.495 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.274 -1.236 6.534 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.345 0.531 7.546 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.487 1.406 6.034 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.532 1.328 8.285 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -8.529 2.691 7.831 1.00 0.00 H new ATOM 0 HE ARG A 109 -10.222 1.711 5.648 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -10.005 3.838 8.464 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -11.286 4.913 7.892 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.861 3.098 4.925 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.331 4.496 5.899 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.061 -1.962 3.895 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.621 -3.267 3.434 1.00 0.00 C ATOM 1124 C TYR A 110 -5.787 -3.941 4.502 1.00 0.00 C ATOM 1125 O TYR A 110 -5.364 -3.296 5.460 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.845 -3.141 2.131 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.734 -2.827 0.953 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.215 -1.539 0.748 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.094 -3.815 0.046 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -8.029 -1.245 -0.328 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.908 -3.529 -1.033 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.371 -2.242 -1.215 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.181 -1.950 -2.287 1.00 0.00 O ATOM 0 H TYR A 110 -6.318 -1.271 3.999 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.497 -3.886 3.241 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.095 -2.357 2.234 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.310 -4.071 1.940 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.948 -0.755 1.442 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.732 -4.823 0.186 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.395 -0.239 -0.473 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.180 -4.308 -1.730 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.690 -1.393 -2.926 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.579 -5.241 4.364 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.819 -5.974 5.364 1.00 0.00 C ATOM 1145 C TYR A 111 -3.892 -7.011 4.751 1.00 0.00 C ATOM 1146 O TYR A 111 -4.319 -7.884 3.997 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.774 -6.649 6.346 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.294 -5.712 7.413 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.907 -5.860 8.738 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.165 -4.674 7.092 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.372 -5.000 9.715 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.635 -3.811 8.062 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.234 -3.977 9.372 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.700 -3.120 10.343 1.00 0.00 O ATOM 0 H TYR A 111 -5.919 -5.803 3.583 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.192 -5.251 5.886 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.617 -7.065 5.795 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.262 -7.485 6.824 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.233 -6.659 9.009 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.478 -4.542 6.067 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -6.063 -5.127 10.742 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.312 -3.012 7.797 1.00 0.00 H new ATOM 0 HH TYR A 111 -6.965 -2.555 10.660 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.620 -6.919 5.116 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.611 -7.855 4.650 1.00 0.00 C ATOM 1166 C LEU A 112 -1.341 -8.875 5.746 1.00 0.00 C ATOM 1167 O LEU A 112 -0.695 -8.565 6.747 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.324 -7.113 4.286 1.00 0.00 C ATOM 1169 CG LEU A 112 0.592 -7.842 3.303 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.812 -9.281 3.743 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.008 -7.792 1.901 1.00 0.00 C ATOM 0 H LEU A 112 -2.262 -6.196 5.740 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.972 -8.365 3.757 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.589 -6.145 3.861 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.235 -6.917 5.201 1.00 0.00 H new ATOM 0 HG LEU A 112 1.559 -7.339 3.292 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.466 -9.783 3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.273 -9.293 4.731 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.146 -9.800 3.784 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.671 -8.315 1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.971 -8.272 1.897 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.096 -6.753 1.587 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.864 -10.085 5.575 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.695 -11.124 6.578 1.00 0.00 C ATOM 1185 C ASP A 113 -2.439 -10.718 7.860 1.00 0.00 C ATOM 1186 O ASP A 113 -3.638 -10.442 7.815 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.203 -11.369 6.839 1.00 0.00 C ATOM 1188 CG ASP A 113 0.054 -12.689 7.542 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.909 -13.460 7.061 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.600 -12.949 8.573 1.00 0.00 O ATOM 0 H ASP A 113 -2.404 -10.367 4.757 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.121 -12.061 6.218 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.336 -11.355 5.891 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.195 -10.555 7.444 1.00 0.00 H new ATOM 1195 N SER A 114 -1.741 -10.664 8.993 1.00 0.00 N ATOM 1196 CA SER A 114 -2.363 -10.271 10.251 1.00 0.00 C ATOM 1197 C SER A 114 -2.111 -8.793 10.548 1.00 0.00 C ATOM 1198 O SER A 114 -2.243 -8.352 11.689 1.00 0.00 O ATOM 1199 CB SER A 114 -1.829 -11.131 11.398 1.00 0.00 C ATOM 1200 OG SER A 114 -2.283 -10.650 12.652 1.00 0.00 O ATOM 0 H SER A 114 -0.748 -10.887 9.063 1.00 0.00 H new ATOM 0 HA SER A 114 -3.438 -10.425 10.159 1.00 0.00 H new ATOM 0 HB2 SER A 114 -2.151 -12.163 11.263 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.739 -11.132 11.379 1.00 0.00 H new ATOM 0 HG SER A 114 -2.696 -9.769 12.534 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.737 -8.033 9.520 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.457 -6.610 9.688 1.00 0.00 C ATOM 1208 C VAL A 115 -2.313 -5.755 8.760 1.00 0.00 C ATOM 1209 O VAL A 115 -2.758 -6.215 7.709 1.00 0.00 O ATOM 1210 CB VAL A 115 0.027 -6.297 9.422 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.351 -4.862 9.808 1.00 0.00 C ATOM 1212 CG2 VAL A 115 0.924 -7.274 10.170 1.00 0.00 C ATOM 0 H VAL A 115 -1.622 -8.378 8.567 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.700 -6.367 10.722 1.00 0.00 H new ATOM 0 HB VAL A 115 0.215 -6.412 8.354 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.404 -4.662 9.612 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.264 -4.180 9.221 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.145 -4.715 10.868 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.969 -7.036 9.969 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.734 -7.196 11.240 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.713 -8.290 9.837 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.533 -4.504 9.155 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.326 -3.575 8.358 1.00 0.00 C ATOM 1224 C GLU A 116 -2.428 -2.775 7.421 1.00 0.00 C ATOM 1225 O GLU A 116 -1.382 -2.274 7.832 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.109 -2.627 9.270 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.226 -1.682 10.069 1.00 0.00 C ATOM 1228 CD GLU A 116 -4.015 -0.831 11.044 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -5.154 -1.217 11.383 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -3.495 0.222 11.470 1.00 0.00 O ATOM 0 H GLU A 116 -2.172 -4.110 10.024 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.031 -4.151 7.759 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.799 -2.040 8.663 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.713 -3.216 9.960 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.483 -2.261 10.617 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.682 -1.032 9.383 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.834 -2.662 6.161 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.051 -1.926 5.176 1.00 0.00 C ATOM 1239 C VAL A 117 -2.930 -1.072 4.265 1.00 0.00 C ATOM 1240 O VAL A 117 -4.167 -1.173 4.273 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.205 -2.875 4.306 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.134 -3.557 5.142 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.093 -3.902 3.619 1.00 0.00 C ATOM 0 H VAL A 117 -3.697 -3.069 5.799 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.392 -1.269 5.744 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.708 -2.286 3.536 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.452 -4.223 4.509 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.520 -2.803 5.580 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.606 -4.134 5.937 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.479 -4.564 3.009 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.621 -4.488 4.371 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.817 -3.391 2.984 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.266 -0.221 3.488 1.00 0.00 N ATOM 1254 CA HIS A 118 -2.942 0.680 2.564 1.00 0.00 C ATOM 1255 C HIS A 118 -2.766 0.236 1.114 1.00 0.00 C ATOM 1256 O HIS A 118 -1.666 0.294 0.564 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.389 2.093 2.743 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.117 3.146 1.961 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -3.950 4.071 2.548 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.117 3.435 0.635 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.429 4.881 1.621 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -3.940 4.514 0.452 1.00 0.00 N ATOM 0 H HIS A 118 -1.249 -0.138 3.482 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.008 0.662 2.789 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.425 2.353 3.801 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.339 2.100 2.449 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -4.164 4.123 3.544 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.569 2.911 -0.134 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.107 5.705 1.791 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.863 -0.191 0.500 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.854 -0.629 -0.891 1.00 0.00 C ATOM 1273 C LEU A 119 -4.770 0.272 -1.717 1.00 0.00 C ATOM 1274 O LEU A 119 -5.983 0.285 -1.508 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.316 -2.083 -0.987 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.270 -2.686 -2.386 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -4.220 -4.203 -2.316 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.465 -2.223 -3.193 1.00 0.00 C ATOM 0 H LEU A 119 -4.778 -0.243 0.948 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.839 -0.561 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.696 -2.689 -0.327 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.338 -2.148 -0.614 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.363 -2.343 -2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.188 -4.613 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.329 -4.513 -1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.107 -4.573 -1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.422 -2.660 -4.191 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.383 -2.539 -2.698 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.452 -1.136 -3.272 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.208 1.058 -2.655 1.00 0.00 N ATOM 1291 CA PRO A 120 -4.995 1.973 -3.484 1.00 0.00 C ATOM 1292 C PRO A 120 -6.209 1.299 -4.122 1.00 0.00 C ATOM 1293 O PRO A 120 -6.136 0.162 -4.583 1.00 0.00 O ATOM 1294 CB PRO A 120 -4.009 2.457 -4.557 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.784 1.620 -4.396 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.778 1.136 -2.975 1.00 0.00 C ATOM 0 HA PRO A 120 -5.412 2.785 -2.889 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.431 2.343 -5.555 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.779 3.515 -4.427 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.794 0.780 -5.091 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.887 2.201 -4.611 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.288 0.167 -2.879 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.252 1.826 -2.315 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.353 2.002 -4.146 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.611 1.487 -4.711 1.00 0.00 C ATOM 1306 C PRO A 121 -8.498 0.979 -6.150 1.00 0.00 C ATOM 1307 O PRO A 121 -9.427 0.347 -6.654 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.555 2.698 -4.653 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.673 3.877 -4.423 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.529 3.361 -3.610 1.00 0.00 C ATOM 0 HA PRO A 121 -8.950 0.616 -4.150 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.117 2.803 -5.581 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.284 2.590 -3.850 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.326 4.299 -5.366 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.205 4.669 -3.896 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.633 3.968 -3.738 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.759 3.352 -2.544 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.385 1.260 -6.822 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.223 0.819 -8.208 1.00 0.00 C ATOM 1320 C PHE A 122 -6.660 -0.599 -8.301 1.00 0.00 C ATOM 1321 O PHE A 122 -6.618 -1.177 -9.388 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.347 1.782 -9.029 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.541 2.771 -8.231 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.159 3.731 -7.440 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.159 2.748 -8.289 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.409 4.644 -6.722 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.405 3.656 -7.573 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.030 4.606 -6.789 1.00 0.00 C ATOM 0 H PHE A 122 -6.595 1.781 -6.441 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.226 0.820 -8.636 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.663 1.192 -9.639 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.990 2.334 -9.715 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.237 3.765 -7.385 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.664 2.010 -8.902 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.901 5.386 -6.110 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.327 3.624 -7.626 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.441 5.318 -6.229 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.233 -1.168 -7.177 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.689 -2.520 -7.184 1.00 0.00 C ATOM 1340 C TRP A 123 -6.691 -3.526 -6.619 1.00 0.00 C ATOM 1341 O TRP A 123 -6.465 -4.733 -6.683 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.388 -2.574 -6.390 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.331 -1.663 -6.920 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.261 -1.108 -8.165 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.193 -1.195 -6.206 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.139 -0.313 -8.261 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.470 -0.353 -7.067 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.720 -1.407 -4.915 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.295 0.277 -6.669 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.560 -0.782 -4.524 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.140 0.050 -5.395 1.00 0.00 C ATOM 0 H TRP A 123 -6.253 -0.720 -6.261 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.485 -2.791 -8.220 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.594 -2.314 -5.352 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -4.011 -3.597 -6.394 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.978 -1.268 -8.957 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.854 0.217 -9.085 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.255 -2.051 -4.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.252 0.921 -7.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.184 -0.939 -3.524 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.048 0.526 -5.055 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.803 -3.030 -6.075 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.831 -3.905 -5.516 1.00 0.00 C ATOM 1364 C GLU A 124 -9.219 -4.980 -6.525 1.00 0.00 C ATOM 1365 O GLU A 124 -9.576 -6.099 -6.155 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.066 -3.096 -5.117 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.563 -2.159 -6.207 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.662 -2.776 -7.048 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -11.762 -2.425 -8.244 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -12.423 -3.610 -6.514 1.00 0.00 O ATOM 0 H GLU A 124 -8.013 -2.034 -6.010 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.424 -4.385 -4.626 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.868 -3.783 -4.848 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.834 -2.512 -4.226 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.932 -1.240 -5.751 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.729 -1.882 -6.852 1.00 0.00 H new ATOM 1377 N GLN A 125 -9.133 -4.629 -7.803 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.460 -5.556 -8.878 1.00 0.00 C ATOM 1379 C GLN A 125 -8.219 -6.327 -9.313 1.00 0.00 C ATOM 1380 O GLN A 125 -8.314 -7.446 -9.819 1.00 0.00 O ATOM 1381 CB GLN A 125 -10.047 -4.797 -10.069 1.00 0.00 C ATOM 1382 CG GLN A 125 -9.110 -3.743 -10.640 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.804 -2.417 -10.886 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.747 -2.334 -11.673 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.340 -1.371 -10.212 1.00 0.00 N ATOM 0 H GLN A 125 -8.838 -3.705 -8.120 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.201 -6.265 -8.509 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -10.301 -5.509 -10.854 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.976 -4.317 -9.761 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.278 -3.591 -9.953 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.687 -4.107 -11.577 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.556 -1.485 -9.570 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.768 -0.453 -10.337 1.00 0.00 H new ATOM 1394 N TYR A 126 -7.052 -5.719 -9.113 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.788 -6.343 -9.482 1.00 0.00 C ATOM 1396 C TYR A 126 -5.359 -7.382 -8.449 1.00 0.00 C ATOM 1397 O TYR A 126 -4.513 -8.232 -8.730 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.695 -5.283 -9.630 1.00 0.00 C ATOM 1399 CG TYR A 126 -5.070 -4.127 -10.536 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -4.303 -2.969 -10.561 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -6.183 -4.192 -11.369 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -4.633 -1.910 -11.386 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -6.518 -3.135 -12.196 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.741 -1.999 -12.201 1.00 0.00 C ATOM 1405 OH TYR A 126 -6.072 -0.946 -13.023 1.00 0.00 O ATOM 0 H TYR A 126 -6.958 -4.793 -8.696 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.935 -6.848 -10.437 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.448 -4.891 -8.643 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.794 -5.758 -10.019 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -3.434 -2.895 -9.925 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.795 -5.082 -11.370 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -4.025 -1.017 -11.392 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -7.386 -3.201 -12.835 1.00 0.00 H new ATOM 0 HH TYR A 126 -6.879 -1.170 -13.533 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.932 -7.305 -7.250 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.585 -8.237 -6.185 1.00 0.00 C ATOM 1417 C ILE A 127 -6.185 -9.620 -6.424 1.00 0.00 C ATOM 1418 O ILE A 127 -7.394 -9.767 -6.611 1.00 0.00 O ATOM 1419 CB ILE A 127 -6.032 -7.722 -4.803 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -7.504 -7.311 -4.827 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -5.159 -6.554 -4.368 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -8.183 -7.452 -3.483 1.00 0.00 C ATOM 0 H ILE A 127 -6.634 -6.611 -6.994 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.498 -8.317 -6.196 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.918 -8.531 -4.081 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.580 -6.275 -5.159 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -8.033 -7.920 -5.560 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -5.486 -6.200 -3.390 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -4.120 -6.879 -4.308 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -5.245 -5.745 -5.094 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.225 -7.144 -3.568 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -8.137 -8.492 -3.159 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.677 -6.822 -2.752 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.321 -10.630 -6.419 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.733 -12.012 -6.635 1.00 0.00 C ATOM 1436 C ASN A 128 -5.457 -12.860 -5.394 1.00 0.00 C ATOM 1437 O ASN A 128 -5.140 -12.328 -4.330 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.988 -12.593 -7.838 1.00 0.00 C ATOM 1439 CG ASN A 128 -3.493 -12.707 -7.608 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -2.785 -11.583 -7.695 1.00 0.00 O flip ATOM 1441 ND2 ASN A 128 -2.979 -13.797 -7.360 1.00 0.00 N flip ATOM 0 H ASN A 128 -4.319 -10.514 -6.266 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.805 -12.027 -6.831 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.391 -13.579 -8.067 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.169 -11.964 -8.710 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.560 -14.634 -7.303 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -1.972 -13.864 -7.212 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.566 -14.181 -5.540 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.311 -15.096 -4.427 1.00 0.00 C ATOM 1450 C ASP A 129 -3.993 -14.740 -3.749 1.00 0.00 C ATOM 1451 O ASP A 129 -3.935 -14.548 -2.534 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.272 -16.543 -4.923 1.00 0.00 C ATOM 1453 CG ASP A 129 -6.612 -17.005 -5.462 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -6.923 -16.690 -6.630 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -7.350 -17.684 -4.717 1.00 0.00 O ATOM 0 H ASP A 129 -5.828 -14.639 -6.413 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.120 -14.998 -3.703 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -4.517 -16.636 -5.704 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.967 -17.196 -4.106 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.944 -14.624 -4.554 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.627 -14.255 -4.055 1.00 0.00 C ATOM 1462 C GLU A 130 -1.049 -13.149 -4.927 1.00 0.00 C ATOM 1463 O GLU A 130 -0.977 -13.283 -6.147 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.692 -15.466 -4.049 1.00 0.00 C ATOM 1465 CG GLU A 130 0.645 -15.197 -3.377 1.00 0.00 C ATOM 1466 CD GLU A 130 1.159 -16.396 -2.603 1.00 0.00 C ATOM 1467 OE1 GLU A 130 0.443 -16.865 -1.693 1.00 0.00 O ATOM 1468 OE2 GLU A 130 2.276 -16.863 -2.905 1.00 0.00 O ATOM 0 H GLU A 130 -2.982 -14.781 -5.561 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.724 -13.897 -3.030 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.186 -16.294 -3.540 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.516 -15.784 -5.077 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.378 -14.916 -4.133 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.543 -14.348 -2.700 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.657 -12.049 -4.303 1.00 0.00 N ATOM 1476 CA ASN A 131 -0.116 -10.917 -5.041 1.00 0.00 C ATOM 1477 C ASN A 131 1.317 -10.598 -4.662 1.00 0.00 C ATOM 1478 O ASN A 131 1.793 -10.953 -3.588 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.954 -9.668 -4.783 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.412 -9.861 -5.114 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.848 -9.556 -6.222 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.177 -10.364 -4.152 1.00 0.00 N ATOM 0 H ASN A 131 -0.703 -11.916 -3.293 1.00 0.00 H new ATOM 0 HA ASN A 131 -0.144 -11.202 -6.093 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.859 -9.383 -3.735 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.558 -8.843 -5.375 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.173 -10.512 -4.317 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.769 -10.602 -3.248 1.00 0.00 H new ATOM 1489 N THR A 132 1.961 -9.854 -5.546 1.00 0.00 N ATOM 1490 CA THR A 132 3.312 -9.376 -5.333 1.00 0.00 C ATOM 1491 C THR A 132 3.190 -7.920 -4.929 1.00 0.00 C ATOM 1492 O THR A 132 2.817 -7.074 -5.747 1.00 0.00 O ATOM 1493 CB THR A 132 4.153 -9.517 -6.604 1.00 0.00 C ATOM 1494 OG1 THR A 132 3.958 -10.789 -7.196 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.636 -9.347 -6.360 1.00 0.00 C ATOM 0 H THR A 132 1.556 -9.564 -6.436 1.00 0.00 H new ATOM 0 HA THR A 132 3.815 -9.960 -4.562 1.00 0.00 H new ATOM 0 HB THR A 132 3.815 -8.719 -7.265 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.503 -10.859 -8.008 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.175 -9.459 -7.301 1.00 0.00 H new ATOM 0 HG22 THR A 132 5.826 -8.356 -5.949 1.00 0.00 H new ATOM 0 HG23 THR A 132 5.978 -10.104 -5.654 1.00 0.00 H new ATOM 1503 N VAL A 133 3.421 -7.641 -3.653 1.00 0.00 N ATOM 1504 CA VAL A 133 3.251 -6.288 -3.145 1.00 0.00 C ATOM 1505 C VAL A 133 4.528 -5.673 -2.600 1.00 0.00 C ATOM 1506 O VAL A 133 5.292 -6.309 -1.873 1.00 0.00 O ATOM 1507 CB VAL A 133 2.174 -6.238 -2.032 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.908 -5.573 -2.545 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.867 -7.631 -1.496 1.00 0.00 C ATOM 0 H VAL A 133 3.723 -8.325 -2.959 1.00 0.00 H new ATOM 0 HA VAL A 133 2.939 -5.703 -4.010 1.00 0.00 H new ATOM 0 HB VAL A 133 2.571 -5.644 -1.209 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.163 -5.547 -1.750 1.00 0.00 H new ATOM 0 HG12 VAL A 133 1.135 -4.556 -2.863 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.517 -6.139 -3.390 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.108 -7.562 -0.717 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.499 -8.260 -2.307 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.774 -8.069 -1.081 1.00 0.00 H new ATOM 1519 N GLU A 134 4.706 -4.400 -2.921 1.00 0.00 N ATOM 1520 CA GLU A 134 5.833 -3.625 -2.443 1.00 0.00 C ATOM 1521 C GLU A 134 5.285 -2.457 -1.642 1.00 0.00 C ATOM 1522 O GLU A 134 4.590 -1.595 -2.186 1.00 0.00 O ATOM 1523 CB GLU A 134 6.692 -3.115 -3.595 1.00 0.00 C ATOM 1524 CG GLU A 134 7.358 -4.222 -4.397 1.00 0.00 C ATOM 1525 CD GLU A 134 6.430 -4.836 -5.426 1.00 0.00 C ATOM 1526 OE1 GLU A 134 6.430 -4.366 -6.583 1.00 0.00 O ATOM 1527 OE2 GLU A 134 5.703 -5.791 -5.074 1.00 0.00 O ATOM 0 H GLU A 134 4.069 -3.877 -3.522 1.00 0.00 H new ATOM 0 HA GLU A 134 6.471 -4.256 -1.824 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.071 -2.518 -4.263 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.461 -2.453 -3.198 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.238 -3.822 -4.900 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.706 -5.000 -3.717 1.00 0.00 H new ATOM 1534 N LEU A 135 5.553 -2.457 -0.346 1.00 0.00 N ATOM 1535 CA LEU A 135 5.031 -1.411 0.524 1.00 0.00 C ATOM 1536 C LEU A 135 6.089 -0.834 1.452 1.00 0.00 C ATOM 1537 O LEU A 135 7.023 -1.520 1.862 1.00 0.00 O ATOM 1538 CB LEU A 135 3.875 -1.966 1.362 1.00 0.00 C ATOM 1539 CG LEU A 135 4.131 -3.339 1.991 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.923 -3.203 3.283 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.815 -4.060 2.244 1.00 0.00 C ATOM 0 H LEU A 135 6.122 -3.160 0.124 1.00 0.00 H new ATOM 0 HA LEU A 135 4.686 -0.603 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.649 -1.256 2.157 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.988 -2.032 0.732 1.00 0.00 H new ATOM 0 HG LEU A 135 4.722 -3.931 1.292 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.093 -4.191 3.711 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.882 -2.729 3.074 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.363 -2.592 3.991 1.00 0.00 H new ATOM 0 HD21 LEU A 135 3.014 -5.034 2.691 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.200 -3.468 2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.287 -4.195 1.300 1.00 0.00 H new ATOM 1553 N ILE A 136 5.895 0.428 1.810 1.00 0.00 N ATOM 1554 CA ILE A 136 6.786 1.122 2.727 1.00 0.00 C ATOM 1555 C ILE A 136 6.049 1.353 4.038 1.00 0.00 C ATOM 1556 O ILE A 136 4.895 1.766 4.032 1.00 0.00 O ATOM 1557 CB ILE A 136 7.294 2.474 2.165 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.827 2.709 0.725 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.808 2.517 2.222 1.00 0.00 C ATOM 1560 CD1 ILE A 136 6.740 4.173 0.351 1.00 0.00 C ATOM 0 H ILE A 136 5.118 0.997 1.474 1.00 0.00 H new ATOM 0 HA ILE A 136 7.666 0.496 2.877 1.00 0.00 H new ATOM 0 HB ILE A 136 6.874 3.266 2.784 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.513 2.208 0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 136 5.849 2.248 0.589 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.160 3.469 1.826 1.00 0.00 H new ATOM 0 HG22 ILE A 136 9.136 2.410 3.256 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.218 1.702 1.625 1.00 0.00 H new ATOM 0 HD11 ILE A 136 6.403 4.265 -0.682 1.00 0.00 H new ATOM 0 HD12 ILE A 136 6.032 4.675 1.010 1.00 0.00 H new ATOM 0 HD13 ILE A 136 7.722 4.634 0.455 1.00 0.00 H new ATOM 1572 N HIS A 137 6.693 1.059 5.159 1.00 0.00 N ATOM 1573 CA HIS A 137 6.048 1.208 6.456 1.00 0.00 C ATOM 1574 C HIS A 137 5.976 2.664 6.894 1.00 0.00 C ATOM 1575 O HIS A 137 6.999 3.316 7.102 1.00 0.00 O ATOM 1576 CB HIS A 137 6.765 0.350 7.495 1.00 0.00 C ATOM 1577 CG HIS A 137 6.957 -1.065 7.036 1.00 0.00 C ATOM 1578 ND1 HIS A 137 7.747 -1.577 6.063 1.00 0.00 N flip ATOM 1579 CD2 HIS A 137 6.269 -2.138 7.565 1.00 0.00 C flip ATOM 1580 CE1 HIS A 137 7.525 -2.929 6.021 1.00 0.00 C flip ATOM 1581 NE2 HIS A 137 6.630 -3.245 6.935 1.00 0.00 N flip ATOM 0 H HIS A 137 7.654 0.719 5.197 1.00 0.00 H new ATOM 0 HA HIS A 137 5.019 0.861 6.364 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.736 0.791 7.718 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.192 0.353 8.422 1.00 0.00 H new ATOM 0 HD1 HIS A 137 8.390 -1.053 5.470 1.00 0.00 H new ATOM 0 HD2 HIS A 137 5.549 -2.083 8.368 1.00 0.00 H new ATOM 0 HE1 HIS A 137 8.006 -3.623 5.348 1.00 0.00 H new ATOM 1590 N THR A 138 4.750 3.165 7.030 1.00 0.00 N ATOM 1591 CA THR A 138 4.530 4.544 7.441 1.00 0.00 C ATOM 1592 C THR A 138 4.526 4.651 8.963 1.00 0.00 C ATOM 1593 O THR A 138 5.011 3.757 9.658 1.00 0.00 O ATOM 1594 CB THR A 138 3.201 5.064 6.879 1.00 0.00 C ATOM 1595 OG1 THR A 138 2.128 4.724 7.739 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.861 4.532 5.503 1.00 0.00 C ATOM 0 H THR A 138 3.896 2.634 6.861 1.00 0.00 H new ATOM 0 HA THR A 138 5.343 5.153 7.046 1.00 0.00 H new ATOM 0 HB THR A 138 3.335 6.143 6.804 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.660 3.940 7.384 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.907 4.947 5.178 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.641 4.820 4.799 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.789 3.445 5.541 1.00 0.00 H new ATOM 1604 N ASP A 139 3.960 5.737 9.477 1.00 0.00 N ATOM 1605 CA ASP A 139 3.874 5.941 10.918 1.00 0.00 C ATOM 1606 C ASP A 139 2.737 5.109 11.500 1.00 0.00 C ATOM 1607 O ASP A 139 2.616 4.959 12.716 1.00 0.00 O ATOM 1608 CB ASP A 139 3.656 7.422 11.236 1.00 0.00 C ATOM 1609 CG ASP A 139 4.091 7.781 12.643 1.00 0.00 C ATOM 1610 OD1 ASP A 139 4.152 6.871 13.496 1.00 0.00 O ATOM 1611 OD2 ASP A 139 4.371 8.972 12.892 1.00 0.00 O ATOM 0 H ASP A 139 3.555 6.488 8.919 1.00 0.00 H new ATOM 0 HA ASP A 139 4.813 5.622 11.370 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.210 8.030 10.521 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.601 7.666 11.111 1.00 0.00 H new ATOM 1616 N SER A 140 1.907 4.568 10.613 1.00 0.00 N ATOM 1617 CA SER A 140 0.776 3.745 11.013 1.00 0.00 C ATOM 1618 C SER A 140 0.888 2.354 10.404 1.00 0.00 C ATOM 1619 O SER A 140 1.184 1.378 11.095 1.00 0.00 O ATOM 1620 CB SER A 140 -0.530 4.406 10.568 1.00 0.00 C ATOM 1621 OG SER A 140 -0.555 4.591 9.161 1.00 0.00 O ATOM 0 H SER A 140 2.000 4.688 9.604 1.00 0.00 H new ATOM 0 HA SER A 140 0.779 3.650 12.099 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.376 3.789 10.872 1.00 0.00 H new ATOM 0 HB3 SER A 140 -0.642 5.369 11.067 1.00 0.00 H new ATOM 0 HG SER A 140 -1.454 4.863 8.883 1.00 0.00 H new ATOM 1627 N LEU A 141 0.656 2.277 9.101 1.00 0.00 N ATOM 1628 CA LEU A 141 0.732 1.019 8.373 1.00 0.00 C ATOM 1629 C LEU A 141 1.531 1.194 7.087 1.00 0.00 C ATOM 1630 O LEU A 141 1.810 2.317 6.666 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.672 0.509 8.047 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.636 1.567 7.505 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -2.497 0.988 6.393 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.508 2.117 8.622 1.00 0.00 C ATOM 0 H LEU A 141 0.411 3.080 8.522 1.00 0.00 H new ATOM 0 HA LEU A 141 1.237 0.288 9.004 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.589 -0.294 7.315 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.103 0.075 8.949 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.048 2.386 7.092 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -3.176 1.756 6.021 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -1.858 0.644 5.580 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -3.075 0.149 6.780 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.187 2.868 8.218 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.086 1.306 9.065 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -1.877 2.572 9.386 1.00 0.00 H new ATOM 1646 N PRO A 142 1.936 0.085 6.453 1.00 0.00 N ATOM 1647 CA PRO A 142 2.718 0.122 5.220 1.00 0.00 C ATOM 1648 C PRO A 142 1.880 0.480 3.997 1.00 0.00 C ATOM 1649 O PRO A 142 0.830 -0.117 3.746 1.00 0.00 O ATOM 1650 CB PRO A 142 3.267 -1.307 5.085 1.00 0.00 C ATOM 1651 CG PRO A 142 2.923 -1.990 6.367 1.00 0.00 C ATOM 1652 CD PRO A 142 1.701 -1.292 6.890 1.00 0.00 C ATOM 0 HA PRO A 142 3.492 0.888 5.268 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.819 -1.821 4.234 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.345 -1.299 4.921 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.728 -3.050 6.205 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.746 -1.923 7.079 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.783 -1.704 6.470 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.618 -1.369 7.974 1.00 0.00 H new ATOM 1660 N LEU A 143 2.370 1.446 3.233 1.00 0.00 N ATOM 1661 CA LEU A 143 1.702 1.887 2.017 1.00 0.00 C ATOM 1662 C LEU A 143 2.181 1.057 0.835 1.00 0.00 C ATOM 1663 O LEU A 143 3.368 1.055 0.510 1.00 0.00 O ATOM 1664 CB LEU A 143 1.987 3.368 1.756 1.00 0.00 C ATOM 1665 CG LEU A 143 1.075 4.047 0.729 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.256 3.450 -0.657 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.371 3.937 1.152 1.00 0.00 C ATOM 0 H LEU A 143 3.237 1.944 3.437 1.00 0.00 H new ATOM 0 HA LEU A 143 0.627 1.754 2.142 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.906 3.907 2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 143 3.019 3.467 1.420 1.00 0.00 H new ATOM 0 HG LEU A 143 1.356 5.099 0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.594 3.955 -1.360 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.290 3.578 -0.976 1.00 0.00 H new ATOM 0 HD13 LEU A 143 1.014 2.388 -0.630 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.005 4.425 0.411 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.648 2.886 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.505 4.421 2.119 1.00 0.00 H new ATOM 1679 N VAL A 144 1.259 0.355 0.198 1.00 0.00 N ATOM 1680 CA VAL A 144 1.598 -0.479 -0.947 1.00 0.00 C ATOM 1681 C VAL A 144 1.862 0.385 -2.176 1.00 0.00 C ATOM 1682 O VAL A 144 0.933 0.854 -2.833 1.00 0.00 O ATOM 1683 CB VAL A 144 0.485 -1.502 -1.248 1.00 0.00 C ATOM 1684 CG1 VAL A 144 0.981 -2.557 -2.226 1.00 0.00 C ATOM 1685 CG2 VAL A 144 -0.010 -2.152 0.040 1.00 0.00 C ATOM 0 H VAL A 144 0.271 0.345 0.452 1.00 0.00 H new ATOM 0 HA VAL A 144 2.505 -1.030 -0.698 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.351 -0.975 -1.707 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.182 -3.271 -2.427 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.282 -2.077 -3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.835 -3.080 -1.795 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.795 -2.871 -0.194 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.818 -2.665 0.530 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.406 -1.385 0.706 1.00 0.00 H new ATOM 1695 N ILE A 145 3.144 0.609 -2.462 1.00 0.00 N ATOM 1696 CA ILE A 145 3.546 1.438 -3.591 1.00 0.00 C ATOM 1697 C ILE A 145 3.417 0.705 -4.922 1.00 0.00 C ATOM 1698 O ILE A 145 3.254 1.338 -5.966 1.00 0.00 O ATOM 1699 CB ILE A 145 4.997 1.937 -3.437 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.973 0.757 -3.392 1.00 0.00 C ATOM 1701 CG2 ILE A 145 5.132 2.793 -2.185 1.00 0.00 C ATOM 1702 CD1 ILE A 145 7.121 0.887 -4.369 1.00 0.00 C ATOM 0 H ILE A 145 3.921 0.226 -1.924 1.00 0.00 H new ATOM 0 HA ILE A 145 2.865 2.289 -3.593 1.00 0.00 H new ATOM 0 HB ILE A 145 5.245 2.550 -4.304 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.374 0.665 -2.383 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.428 -0.163 -3.604 1.00 0.00 H new ATOM 0 HG21 ILE A 145 6.162 3.138 -2.089 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.466 3.653 -2.259 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.865 2.202 -1.309 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.772 0.017 -4.283 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.729 0.948 -5.384 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.689 1.789 -4.144 1.00 0.00 H new ATOM 1714 N SER A 146 3.491 -0.622 -4.895 1.00 0.00 N ATOM 1715 CA SER A 146 3.381 -1.395 -6.130 1.00 0.00 C ATOM 1716 C SER A 146 2.654 -2.719 -5.919 1.00 0.00 C ATOM 1717 O SER A 146 2.551 -3.220 -4.798 1.00 0.00 O ATOM 1718 CB SER A 146 4.767 -1.645 -6.728 1.00 0.00 C ATOM 1719 OG SER A 146 5.785 -1.078 -5.921 1.00 0.00 O ATOM 0 H SER A 146 3.624 -1.177 -4.050 1.00 0.00 H new ATOM 0 HA SER A 146 2.787 -0.804 -6.827 1.00 0.00 H new ATOM 0 HB2 SER A 146 4.934 -2.717 -6.828 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.815 -1.220 -7.730 1.00 0.00 H new ATOM 0 HG SER A 146 6.600 -1.617 -5.996 1.00 0.00 H new ATOM 1725 N LEU A 147 2.155 -3.278 -7.021 1.00 0.00 N ATOM 1726 CA LEU A 147 1.435 -4.544 -6.998 1.00 0.00 C ATOM 1727 C LEU A 147 1.760 -5.343 -8.256 1.00 0.00 C ATOM 1728 O LEU A 147 2.154 -4.771 -9.270 1.00 0.00 O ATOM 1729 CB LEU A 147 -0.072 -4.287 -6.911 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.837 -5.194 -5.944 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -1.018 -4.511 -4.600 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -2.188 -5.571 -6.529 1.00 0.00 C ATOM 0 H LEU A 147 2.240 -2.865 -7.950 1.00 0.00 H new ATOM 0 HA LEU A 147 1.744 -5.117 -6.123 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.230 -3.251 -6.613 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.501 -4.401 -7.906 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.255 -6.103 -5.793 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.564 -5.172 -3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -0.041 -4.284 -4.173 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.579 -3.586 -4.734 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.720 -6.216 -5.830 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.772 -4.668 -6.706 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.042 -6.100 -7.471 1.00 0.00 H new ATOM 1744 N ASN A 148 1.617 -6.663 -8.187 1.00 0.00 N ATOM 1745 CA ASN A 148 1.922 -7.519 -9.336 1.00 0.00 C ATOM 1746 C ASN A 148 1.332 -6.971 -10.644 1.00 0.00 C ATOM 1747 O ASN A 148 0.151 -7.148 -10.935 1.00 0.00 O ATOM 1748 CB ASN A 148 1.426 -8.955 -9.090 1.00 0.00 C ATOM 1749 CG ASN A 148 -0.077 -9.120 -9.257 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.565 -9.376 -10.357 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.819 -8.987 -8.163 1.00 0.00 N ATOM 0 H ASN A 148 1.295 -7.162 -7.358 1.00 0.00 H new ATOM 0 HA ASN A 148 3.006 -7.529 -9.446 1.00 0.00 H new ATOM 0 HB2 ASN A 148 1.935 -9.629 -9.779 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.706 -9.259 -8.081 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.832 -9.098 -8.217 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.376 -8.774 -7.269 1.00 0.00 H new ATOM 1758 N GLY A 149 2.179 -6.325 -11.441 1.00 0.00 N ATOM 1759 CA GLY A 149 1.741 -5.789 -12.722 1.00 0.00 C ATOM 1760 C GLY A 149 1.012 -4.459 -12.618 1.00 0.00 C ATOM 1761 O GLY A 149 0.221 -4.113 -13.495 1.00 0.00 O ATOM 0 H GLY A 149 3.162 -6.162 -11.224 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.609 -5.666 -13.369 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.085 -6.515 -13.203 1.00 0.00 H new ATOM 1765 N HIS A 150 1.279 -3.709 -11.556 1.00 0.00 N ATOM 1766 CA HIS A 150 0.643 -2.409 -11.359 1.00 0.00 C ATOM 1767 C HIS A 150 1.476 -1.544 -10.427 1.00 0.00 C ATOM 1768 O HIS A 150 2.262 -2.056 -9.630 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.769 -2.568 -10.790 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.518 -3.726 -11.365 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.344 -3.624 -12.464 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.549 -5.022 -10.989 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.853 -4.813 -12.739 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.387 -5.678 -11.857 1.00 0.00 N ATOM 0 H HIS A 150 1.930 -3.977 -10.818 1.00 0.00 H new ATOM 0 HA HIS A 150 0.573 -1.923 -12.332 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.705 -2.688 -9.709 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.332 -1.653 -10.976 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -1.014 -5.461 -10.160 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.534 -5.038 -13.547 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.613 -6.672 -11.825 1.00 0.00 H new ATOM 1783 N THR A 151 1.306 -0.233 -10.533 1.00 0.00 N ATOM 1784 CA THR A 151 2.055 0.691 -9.698 1.00 0.00 C ATOM 1785 C THR A 151 1.214 1.902 -9.310 1.00 0.00 C ATOM 1786 O THR A 151 0.268 2.269 -10.008 1.00 0.00 O ATOM 1787 CB THR A 151 3.320 1.141 -10.421 1.00 0.00 C ATOM 1788 OG1 THR A 151 3.019 2.110 -11.409 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.053 0.001 -11.099 1.00 0.00 C ATOM 0 H THR A 151 0.660 0.211 -11.185 1.00 0.00 H new ATOM 0 HA THR A 151 2.329 0.168 -8.782 1.00 0.00 H new ATOM 0 HB THR A 151 3.964 1.560 -9.647 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.845 2.386 -11.859 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.944 0.386 -11.596 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.344 -0.739 -10.353 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.399 -0.465 -11.836 1.00 0.00 H new ATOM 1797 N LEU A 152 1.567 2.509 -8.183 1.00 0.00 N ATOM 1798 CA LEU A 152 0.852 3.673 -7.676 1.00 0.00 C ATOM 1799 C LEU A 152 1.006 4.862 -8.613 1.00 0.00 C ATOM 1800 O LEU A 152 0.072 5.640 -8.807 1.00 0.00 O ATOM 1801 CB LEU A 152 1.374 4.031 -6.284 1.00 0.00 C ATOM 1802 CG LEU A 152 0.450 3.652 -5.127 1.00 0.00 C ATOM 1803 CD1 LEU A 152 1.114 3.961 -3.795 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -0.875 4.382 -5.247 1.00 0.00 C ATOM 0 H LEU A 152 2.349 2.212 -7.600 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.208 3.427 -7.615 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.336 3.540 -6.136 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.556 5.105 -6.246 1.00 0.00 H new ATOM 0 HG LEU A 152 0.257 2.580 -5.173 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.443 3.685 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.040 3.393 -3.710 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.335 5.027 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.522 4.101 -4.416 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.701 5.458 -5.224 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.355 4.112 -6.187 1.00 0.00 H new