USER MOD reduce.3.24.130724 H: found=0, std=0, add=523, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 525 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 107 MET CE :methyl 167:sc= -1.42 (180deg=-2.28) USER MOD Set 1.2: A 122 MET CE :methyl -168:sc= -0.302 (180deg=-0.629) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HE2:sc= -0.508 X(o=-0.51,f=-0.68) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.954 USER MOD Single : A 112 GLN : amide:sc= -0.511 K(o=-0.51,f=-3.9!) USER MOD Single : A 116 GLN : amide:sc= -2.57! C(o=-2.6!,f=-1.3!) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 135 ASN : amide:sc= 0.015 K(o=0.015,f=-9.3!) USER MOD Single : A 136 TYR OH : rot -130:sc= 0.164 USER MOD Single : A 142 MET CE :methyl -129:sc= 0 (180deg=-0.0101) USER MOD Single : A 145 GLN : amide:sc= -0.0259 K(o=-0.026,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 76 -0.189 -18.688 -6.521 1.00 10.00 N ATOM 2 CA ALA A 76 0.827 -17.692 -6.135 1.00 10.00 C ATOM 3 C ALA A 76 0.432 -16.310 -6.659 1.00 10.00 C ATOM 4 O ALA A 76 0.722 -15.997 -7.811 1.00 10.00 O ATOM 5 CB ALA A 76 2.211 -18.099 -6.658 1.00 10.00 C ATOM 0 HA ALA A 76 0.879 -17.649 -5.047 1.00 10.00 H new ATOM 0 HB1 ALA A 76 2.946 -17.351 -6.362 1.00 10.00 H new ATOM 0 HB2 ALA A 76 2.489 -19.066 -6.238 1.00 10.00 H new ATOM 0 HB3 ALA A 76 2.183 -18.170 -7.745 1.00 10.00 H new ATOM 13 N ARG A 77 -0.246 -15.504 -5.835 1.00 10.00 N ATOM 14 CA ARG A 77 -0.482 -14.087 -6.104 1.00 10.00 C ATOM 15 C ARG A 77 -0.997 -13.413 -4.846 1.00 10.00 C ATOM 16 O ARG A 77 -2.074 -12.827 -4.771 1.00 10.00 O ATOM 17 CB ARG A 77 -1.442 -13.863 -7.265 1.00 10.00 C ATOM 18 CG ARG A 77 -1.432 -12.425 -7.834 1.00 10.00 C ATOM 19 CD ARG A 77 -0.219 -12.071 -8.725 1.00 10.00 C ATOM 20 NE ARG A 77 -0.586 -11.829 -10.141 1.00 10.00 N ATOM 21 CZ ARG A 77 -0.957 -12.768 -11.028 1.00 10.00 C ATOM 22 NH1 ARG A 77 -0.867 -14.062 -10.697 1.00 10.00 N ATOM 23 NH2 ARG A 77 -1.416 -12.428 -12.235 1.00 10.00 N ATOM 0 H ARG A 77 -0.649 -15.823 -4.954 1.00 10.00 H new ATOM 0 HA ARG A 77 0.468 -13.642 -6.399 1.00 10.00 H new ATOM 0 HB2 ARG A 77 -1.193 -14.559 -8.066 1.00 10.00 H new ATOM 0 HB3 ARG A 77 -2.453 -14.104 -6.936 1.00 10.00 H new ATOM 0 HG2 ARG A 77 -2.343 -12.276 -8.414 1.00 10.00 H new ATOM 0 HG3 ARG A 77 -1.466 -11.723 -7.001 1.00 10.00 H new ATOM 0 HD2 ARG A 77 0.270 -11.182 -8.326 1.00 10.00 H new ATOM 0 HD3 ARG A 77 0.507 -12.882 -8.678 1.00 10.00 H new ATOM 0 HE ARG A 77 -0.554 -10.864 -10.471 1.00 10.00 H new ATOM 0 HH11 ARG A 77 -0.519 -14.330 -9.777 1.00 10.00 H new ATOM 0 HH12 ARG A 77 -1.147 -14.780 -11.365 1.00 10.00 H new ATOM 0 HH21 ARG A 77 -1.489 -11.444 -12.494 1.00 10.00 H new ATOM 0 HH22 ARG A 77 -1.694 -13.152 -12.898 1.00 10.00 H new ATOM 37 N ALA A 78 -0.073 -13.405 -3.910 1.00 10.00 N ATOM 38 CA ALA A 78 0.120 -12.181 -3.161 1.00 10.00 C ATOM 39 C ALA A 78 0.539 -11.077 -4.123 1.00 10.00 C ATOM 40 O ALA A 78 0.684 -11.276 -5.330 1.00 10.00 O ATOM 41 CB ALA A 78 1.215 -12.344 -2.119 1.00 10.00 C ATOM 0 H ALA A 78 0.529 -14.188 -3.657 1.00 10.00 H new ATOM 0 HA ALA A 78 -0.815 -11.934 -2.658 1.00 10.00 H new ATOM 0 HB1 ALA A 78 1.338 -11.410 -1.572 1.00 10.00 H new ATOM 0 HB2 ALA A 78 0.941 -13.138 -1.424 1.00 10.00 H new ATOM 0 HB3 ALA A 78 2.152 -12.602 -2.613 1.00 10.00 H new ATOM 47 N GLY A 79 0.757 -9.902 -3.559 1.00 10.00 N ATOM 48 CA GLY A 79 0.880 -8.688 -4.307 1.00 10.00 C ATOM 49 C GLY A 79 -0.509 -8.086 -4.254 1.00 10.00 C ATOM 50 O GLY A 79 -0.901 -7.601 -3.199 1.00 10.00 O ATOM 0 H GLY A 79 0.853 -9.775 -2.552 1.00 10.00 H new ATOM 0 HA2 GLY A 79 1.622 -8.021 -3.867 1.00 10.00 H new ATOM 0 HA3 GLY A 79 1.193 -8.881 -5.333 1.00 10.00 H new ATOM 54 N LEU A 80 -1.291 -8.171 -5.332 1.00 10.00 N ATOM 55 CA LEU A 80 -2.580 -7.519 -5.358 1.00 10.00 C ATOM 56 C LEU A 80 -3.519 -7.963 -4.252 1.00 10.00 C ATOM 57 O LEU A 80 -4.047 -7.120 -3.532 1.00 10.00 O ATOM 58 CB LEU A 80 -3.202 -7.634 -6.759 1.00 10.00 C ATOM 59 CG LEU A 80 -4.698 -7.271 -6.828 1.00 10.00 C ATOM 60 CD1 LEU A 80 -5.088 -6.705 -8.196 1.00 10.00 C ATOM 61 CD2 LEU A 80 -5.602 -8.482 -6.545 1.00 10.00 C ATOM 0 H LEU A 80 -1.050 -8.680 -6.182 1.00 10.00 H new ATOM 0 HA LEU A 80 -2.411 -6.463 -5.146 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -2.652 -6.985 -7.441 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -3.072 -8.655 -7.117 1.00 10.00 H new ATOM 0 HG LEU A 80 -4.846 -6.514 -6.058 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -6.151 -6.463 -8.200 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -4.510 -5.803 -8.395 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -4.882 -7.446 -8.968 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -6.647 -8.178 -6.605 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -5.408 -9.261 -7.282 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -5.393 -8.867 -5.547 1.00 10.00 H new ATOM 73 N GLU A 81 -3.760 -9.265 -4.131 1.00 10.00 N ATOM 74 CA GLU A 81 -4.748 -9.749 -3.180 1.00 10.00 C ATOM 75 C GLU A 81 -4.316 -9.375 -1.761 1.00 10.00 C ATOM 76 O GLU A 81 -5.099 -8.809 -0.992 1.00 10.00 O ATOM 77 CB GLU A 81 -4.961 -11.252 -3.407 1.00 10.00 C ATOM 78 CG GLU A 81 -6.195 -11.780 -2.669 1.00 10.00 C ATOM 79 CD GLU A 81 -6.640 -13.134 -3.211 1.00 10.00 C ATOM 80 OE1 GLU A 81 -5.745 -13.949 -3.526 1.00 10.00 O ATOM 81 OE2 GLU A 81 -7.871 -13.323 -3.318 1.00 10.00 O ATOM 0 H GLU A 81 -3.291 -9.992 -4.672 1.00 10.00 H new ATOM 0 HA GLU A 81 -5.718 -9.275 -3.328 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -5.068 -11.445 -4.474 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -4.079 -11.797 -3.072 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -5.973 -11.869 -1.606 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -7.011 -11.064 -2.765 1.00 10.00 H new ATOM 88 N ASP A 82 -3.033 -9.599 -1.461 1.00 10.00 N ATOM 89 CA ASP A 82 -2.447 -9.239 -0.177 1.00 10.00 C ATOM 90 C ASP A 82 -2.671 -7.766 0.079 1.00 10.00 C ATOM 91 O ASP A 82 -3.107 -7.372 1.153 1.00 10.00 O ATOM 92 CB ASP A 82 -0.948 -9.550 -0.110 1.00 10.00 C ATOM 93 CG ASP A 82 -0.641 -11.012 0.173 1.00 10.00 C ATOM 94 OD1 ASP A 82 -1.414 -11.867 -0.307 1.00 10.00 O ATOM 95 OD2 ASP A 82 0.391 -11.247 0.836 1.00 10.00 O ATOM 0 H ASP A 82 -2.375 -10.036 -2.106 1.00 10.00 H new ATOM 0 HA ASP A 82 -2.937 -9.840 0.589 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -0.484 -9.266 -1.055 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -0.492 -8.935 0.666 1.00 10.00 H new ATOM 100 N LEU A 83 -2.363 -6.943 -0.913 1.00 10.00 N ATOM 101 CA LEU A 83 -2.447 -5.514 -0.768 1.00 10.00 C ATOM 102 C LEU A 83 -3.865 -5.004 -0.635 1.00 10.00 C ATOM 103 O LEU A 83 -4.105 -4.130 0.179 1.00 10.00 O ATOM 104 CB LEU A 83 -1.724 -4.825 -1.883 1.00 10.00 C ATOM 105 CG LEU A 83 -0.222 -4.896 -1.605 1.00 10.00 C ATOM 106 CD1 LEU A 83 0.345 -4.251 -2.832 1.00 10.00 C ATOM 107 CD2 LEU A 83 0.259 -4.101 -0.381 1.00 10.00 C ATOM 0 H LEU A 83 -2.050 -7.254 -1.833 1.00 10.00 H new ATOM 0 HA LEU A 83 -1.955 -5.271 0.174 1.00 10.00 H new ATOM 0 HB2 LEU A 83 -1.956 -5.301 -2.836 1.00 10.00 H new ATOM 0 HB3 LEU A 83 -2.046 -3.787 -1.959 1.00 10.00 H new ATOM 0 HG LEU A 83 0.078 -5.922 -1.394 1.00 10.00 H new ATOM 0 HD11 LEU A 83 1.433 -4.235 -2.765 1.00 10.00 H new ATOM 0 HD12 LEU A 83 0.044 -4.818 -3.713 1.00 10.00 H new ATOM 0 HD13 LEU A 83 -0.029 -3.230 -2.912 1.00 10.00 H new ATOM 0 HD21 LEU A 83 1.337 -4.217 -0.272 1.00 10.00 H new ATOM 0 HD22 LEU A 83 0.020 -3.046 -0.515 1.00 10.00 H new ATOM 0 HD23 LEU A 83 -0.238 -4.475 0.514 1.00 10.00 H new ATOM 119 N GLN A 84 -4.820 -5.501 -1.409 1.00 10.00 N ATOM 120 CA GLN A 84 -6.191 -5.043 -1.262 1.00 10.00 C ATOM 121 C GLN A 84 -6.661 -5.344 0.164 1.00 10.00 C ATOM 122 O GLN A 84 -7.201 -4.463 0.831 1.00 10.00 O ATOM 123 CB GLN A 84 -7.049 -5.687 -2.360 1.00 10.00 C ATOM 124 CG GLN A 84 -8.346 -4.904 -2.595 1.00 10.00 C ATOM 125 CD GLN A 84 -8.856 -5.093 -4.020 1.00 10.00 C ATOM 126 OE1 GLN A 84 -9.533 -6.070 -4.321 1.00 10.00 O ATOM 127 NE2 GLN A 84 -8.513 -4.172 -4.917 1.00 10.00 N ATOM 0 H GLN A 84 -4.674 -6.207 -2.131 1.00 10.00 H new ATOM 0 HA GLN A 84 -6.281 -3.965 -1.395 1.00 10.00 H new ATOM 0 HB2 GLN A 84 -6.479 -5.734 -3.288 1.00 10.00 H new ATOM 0 HB3 GLN A 84 -7.288 -6.713 -2.081 1.00 10.00 H new ATOM 0 HG2 GLN A 84 -9.106 -5.235 -1.887 1.00 10.00 H new ATOM 0 HG3 GLN A 84 -8.173 -3.845 -2.406 1.00 10.00 H new ATOM 0 HE21 GLN A 84 -7.949 -3.370 -4.635 1.00 10.00 H new ATOM 0 HE22 GLN A 84 -8.814 -4.268 -5.887 1.00 10.00 H new ATOM 136 N VAL A 85 -6.369 -6.549 0.666 1.00 10.00 N ATOM 137 CA VAL A 85 -6.592 -6.926 2.041 1.00 10.00 C ATOM 138 C VAL A 85 -5.821 -5.988 2.991 1.00 10.00 C ATOM 139 O VAL A 85 -6.376 -5.550 3.994 1.00 10.00 O ATOM 140 CB VAL A 85 -6.200 -8.409 2.131 1.00 10.00 C ATOM 141 CG1 VAL A 85 -6.049 -8.859 3.568 1.00 10.00 C ATOM 142 CG2 VAL A 85 -7.237 -9.293 1.420 1.00 10.00 C ATOM 0 H VAL A 85 -5.962 -7.297 0.104 1.00 10.00 H new ATOM 0 HA VAL A 85 -7.629 -6.817 2.358 1.00 10.00 H new ATOM 0 HB VAL A 85 -5.236 -8.517 1.634 1.00 10.00 H new ATOM 0 HG11 VAL A 85 -5.771 -9.913 3.592 1.00 10.00 H new ATOM 0 HG12 VAL A 85 -5.273 -8.268 4.055 1.00 10.00 H new ATOM 0 HG13 VAL A 85 -6.994 -8.721 4.094 1.00 10.00 H new ATOM 0 HG21 VAL A 85 -6.938 -10.338 1.497 1.00 10.00 H new ATOM 0 HG22 VAL A 85 -8.212 -9.159 1.889 1.00 10.00 H new ATOM 0 HG23 VAL A 85 -7.298 -9.009 0.369 1.00 10.00 H new ATOM 152 N ALA A 86 -4.560 -5.666 2.674 1.00 10.00 N ATOM 153 CA ALA A 86 -3.709 -4.747 3.425 1.00 10.00 C ATOM 154 C ALA A 86 -4.416 -3.394 3.560 1.00 10.00 C ATOM 155 O ALA A 86 -4.863 -3.002 4.637 1.00 10.00 O ATOM 156 CB ALA A 86 -2.323 -4.615 2.738 1.00 10.00 C ATOM 0 H ALA A 86 -4.091 -6.056 1.856 1.00 10.00 H new ATOM 0 HA ALA A 86 -3.534 -5.138 4.427 1.00 10.00 H new ATOM 0 HB1 ALA A 86 -1.698 -3.927 3.308 1.00 10.00 H new ATOM 0 HB2 ALA A 86 -1.843 -5.593 2.697 1.00 10.00 H new ATOM 0 HB3 ALA A 86 -2.454 -4.233 1.726 1.00 10.00 H new ATOM 162 N PHE A 87 -4.529 -2.701 2.432 1.00 10.00 N ATOM 163 CA PHE A 87 -5.191 -1.433 2.217 1.00 10.00 C ATOM 164 C PHE A 87 -6.495 -1.312 2.990 1.00 10.00 C ATOM 165 O PHE A 87 -6.736 -0.300 3.644 1.00 10.00 O ATOM 166 CB PHE A 87 -5.471 -1.312 0.713 1.00 10.00 C ATOM 167 CG PHE A 87 -4.285 -1.011 -0.167 1.00 10.00 C ATOM 168 CD1 PHE A 87 -3.388 -0.018 0.236 1.00 10.00 C ATOM 169 CD2 PHE A 87 -4.131 -1.592 -1.444 1.00 10.00 C ATOM 170 CE1 PHE A 87 -2.242 0.215 -0.521 1.00 10.00 C ATOM 171 CE2 PHE A 87 -2.910 -1.440 -2.128 1.00 10.00 C ATOM 172 CZ PHE A 87 -1.890 -0.678 -1.536 1.00 10.00 C ATOM 0 H PHE A 87 -4.118 -3.052 1.567 1.00 10.00 H new ATOM 0 HA PHE A 87 -4.543 -0.634 2.577 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -5.921 -2.245 0.373 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -6.214 -0.528 0.566 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -3.581 0.563 1.126 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -4.942 -2.148 -1.892 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -1.629 1.082 -0.324 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -2.760 -1.902 -3.093 1.00 10.00 H new ATOM 0 HZ PHE A 87 -0.863 -0.779 -1.856 1.00 10.00 H new ATOM 182 N ARG A 88 -7.322 -2.356 2.923 1.00 10.00 N ATOM 183 CA ARG A 88 -8.599 -2.435 3.617 1.00 10.00 C ATOM 184 C ARG A 88 -8.519 -1.981 5.084 1.00 10.00 C ATOM 185 O ARG A 88 -9.526 -1.561 5.650 1.00 10.00 O ATOM 186 CB ARG A 88 -9.082 -3.895 3.554 1.00 10.00 C ATOM 187 CG ARG A 88 -10.565 -4.087 3.245 1.00 10.00 C ATOM 188 CD ARG A 88 -11.473 -3.750 4.432 1.00 10.00 C ATOM 189 NE ARG A 88 -12.686 -4.580 4.382 1.00 10.00 N ATOM 190 CZ ARG A 88 -13.700 -4.521 5.256 1.00 10.00 C ATOM 191 NH1 ARG A 88 -13.735 -3.544 6.167 1.00 10.00 N ATOM 192 NH2 ARG A 88 -14.663 -5.451 5.215 1.00 10.00 N ATOM 0 H ARG A 88 -7.114 -3.188 2.370 1.00 10.00 H new ATOM 0 HA ARG A 88 -9.295 -1.757 3.123 1.00 10.00 H new ATOM 0 HB2 ARG A 88 -8.500 -4.419 2.795 1.00 10.00 H new ATOM 0 HB3 ARG A 88 -8.864 -4.373 4.509 1.00 10.00 H new ATOM 0 HG2 ARG A 88 -10.838 -3.459 2.397 1.00 10.00 H new ATOM 0 HG3 ARG A 88 -10.737 -5.121 2.945 1.00 10.00 H new ATOM 0 HD2 ARG A 88 -10.942 -3.922 5.368 1.00 10.00 H new ATOM 0 HD3 ARG A 88 -11.742 -2.694 4.407 1.00 10.00 H new ATOM 0 HE ARG A 88 -12.762 -5.255 3.621 1.00 10.00 H new ATOM 0 HH11 ARG A 88 -12.991 -2.846 6.195 1.00 10.00 H new ATOM 0 HH12 ARG A 88 -14.505 -3.496 6.834 1.00 10.00 H new ATOM 0 HH21 ARG A 88 -14.621 -6.198 4.522 1.00 10.00 H new ATOM 0 HH22 ARG A 88 -15.438 -5.412 5.877 1.00 10.00 H new ATOM 206 N ALA A 89 -7.342 -2.094 5.711 1.00 10.00 N ATOM 207 CA ALA A 89 -7.079 -1.553 7.033 1.00 10.00 C ATOM 208 C ALA A 89 -7.436 -0.062 7.132 1.00 10.00 C ATOM 209 O ALA A 89 -8.097 0.318 8.098 1.00 10.00 O ATOM 210 CB ALA A 89 -5.620 -1.811 7.411 1.00 10.00 C ATOM 0 H ALA A 89 -6.540 -2.572 5.301 1.00 10.00 H new ATOM 0 HA ALA A 89 -7.724 -2.065 7.747 1.00 10.00 H new ATOM 0 HB1 ALA A 89 -5.424 -1.405 8.403 1.00 10.00 H new ATOM 0 HB2 ALA A 89 -5.429 -2.884 7.414 1.00 10.00 H new ATOM 0 HB3 ALA A 89 -4.965 -1.328 6.685 1.00 10.00 H new ATOM 216 N PHE A 90 -7.006 0.782 6.179 1.00 10.00 N ATOM 217 CA PHE A 90 -7.269 2.224 6.245 1.00 10.00 C ATOM 218 C PHE A 90 -8.116 2.750 5.082 1.00 10.00 C ATOM 219 O PHE A 90 -8.500 3.918 5.107 1.00 10.00 O ATOM 220 CB PHE A 90 -5.953 2.967 6.432 1.00 10.00 C ATOM 221 CG PHE A 90 -5.186 2.504 7.654 1.00 10.00 C ATOM 222 CD1 PHE A 90 -5.572 2.935 8.937 1.00 10.00 C ATOM 223 CD2 PHE A 90 -4.263 1.453 7.523 1.00 10.00 C ATOM 224 CE1 PHE A 90 -5.066 2.287 10.077 1.00 10.00 C ATOM 225 CE2 PHE A 90 -3.763 0.806 8.658 1.00 10.00 C ATOM 226 CZ PHE A 90 -4.178 1.207 9.939 1.00 10.00 C ATOM 0 H PHE A 90 -6.477 0.489 5.358 1.00 10.00 H new ATOM 0 HA PHE A 90 -7.896 2.418 7.116 1.00 10.00 H new ATOM 0 HB2 PHE A 90 -5.334 2.828 5.546 1.00 10.00 H new ATOM 0 HB3 PHE A 90 -6.153 4.035 6.517 1.00 10.00 H new ATOM 0 HD1 PHE A 90 -6.257 3.763 9.045 1.00 10.00 H new ATOM 0 HD2 PHE A 90 -3.938 1.143 6.541 1.00 10.00 H new ATOM 0 HE1 PHE A 90 -5.360 2.620 11.061 1.00 10.00 H new ATOM 0 HE2 PHE A 90 -3.056 -0.004 8.549 1.00 10.00 H new ATOM 0 HZ PHE A 90 -3.816 0.687 10.814 1.00 10.00 H new ATOM 236 N ASP A 91 -8.449 1.900 4.106 1.00 10.00 N ATOM 237 CA ASP A 91 -9.299 2.241 2.967 1.00 10.00 C ATOM 238 C ASP A 91 -10.705 1.649 3.133 1.00 10.00 C ATOM 239 O ASP A 91 -11.061 1.114 4.184 1.00 10.00 O ATOM 240 CB ASP A 91 -8.664 1.647 1.706 1.00 10.00 C ATOM 241 CG ASP A 91 -8.967 2.459 0.444 1.00 10.00 C ATOM 242 OD1 ASP A 91 -10.021 2.170 -0.167 1.00 10.00 O ATOM 243 OD2 ASP A 91 -8.168 3.347 0.086 1.00 10.00 O ATOM 0 H ASP A 91 -8.126 0.933 4.088 1.00 10.00 H new ATOM 0 HA ASP A 91 -9.385 3.325 2.898 1.00 10.00 H new ATOM 0 HB2 ASP A 91 -7.584 1.588 1.843 1.00 10.00 H new ATOM 0 HB3 ASP A 91 -9.024 0.627 1.570 1.00 10.00 H new ATOM 248 N GLN A 92 -11.463 1.661 2.037 1.00 10.00 N ATOM 249 CA GLN A 92 -12.513 0.711 1.734 1.00 10.00 C ATOM 250 C GLN A 92 -12.036 -0.071 0.501 1.00 10.00 C ATOM 251 O GLN A 92 -11.304 -1.060 0.614 1.00 10.00 O ATOM 252 CB GLN A 92 -13.820 1.485 1.477 1.00 10.00 C ATOM 253 CG GLN A 92 -14.518 1.883 2.782 1.00 10.00 C ATOM 254 CD GLN A 92 -15.547 0.835 3.194 1.00 10.00 C ATOM 255 OE1 GLN A 92 -15.294 -0.010 4.047 1.00 10.00 O ATOM 256 NE2 GLN A 92 -16.724 0.873 2.573 1.00 10.00 N ATOM 0 H GLN A 92 -11.351 2.367 1.310 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.714 0.015 2.549 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -13.603 2.380 0.895 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -14.493 0.871 0.879 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -13.778 2.001 3.573 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -15.008 2.849 2.657 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.906 1.587 1.868 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.444 0.188 2.802 1.00 10.00 H new ATOM 265 N ASP A 93 -12.462 0.388 -0.675 1.00 10.00 N ATOM 266 CA ASP A 93 -12.277 -0.265 -1.955 1.00 10.00 C ATOM 267 C ASP A 93 -11.913 0.811 -2.972 1.00 10.00 C ATOM 268 O ASP A 93 -12.719 1.151 -3.835 1.00 10.00 O ATOM 269 CB ASP A 93 -13.562 -1.026 -2.315 1.00 10.00 C ATOM 270 CG ASP A 93 -13.419 -1.847 -3.591 1.00 10.00 C ATOM 271 OD1 ASP A 93 -12.264 -2.077 -4.009 1.00 10.00 O ATOM 272 OD2 ASP A 93 -14.480 -2.274 -4.097 1.00 10.00 O ATOM 0 H ASP A 93 -12.969 1.269 -0.757 1.00 10.00 H new ATOM 0 HA ASP A 93 -11.471 -0.999 -1.935 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -13.832 -1.686 -1.491 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -14.380 -0.315 -2.435 1.00 10.00 H new ATOM 277 N GLY A 94 -10.744 1.447 -2.809 1.00 10.00 N ATOM 278 CA GLY A 94 -10.469 2.655 -3.548 1.00 10.00 C ATOM 279 C GLY A 94 -11.349 3.780 -3.021 1.00 10.00 C ATOM 280 O GLY A 94 -12.025 4.451 -3.798 1.00 10.00 O ATOM 0 H GLY A 94 -9.998 1.142 -2.183 1.00 10.00 H new ATOM 0 HA2 GLY A 94 -9.417 2.924 -3.449 1.00 10.00 H new ATOM 0 HA3 GLY A 94 -10.659 2.496 -4.610 1.00 10.00 H new ATOM 284 N ASP A 95 -11.270 4.040 -1.708 1.00 10.00 N ATOM 285 CA ASP A 95 -11.587 5.365 -1.177 1.00 10.00 C ATOM 286 C ASP A 95 -10.827 6.385 -2.027 1.00 10.00 C ATOM 287 O ASP A 95 -11.405 7.321 -2.578 1.00 10.00 O ATOM 288 CB ASP A 95 -11.192 5.460 0.299 1.00 10.00 C ATOM 289 CG ASP A 95 -11.563 6.826 0.856 1.00 10.00 C ATOM 290 OD1 ASP A 95 -10.763 7.761 0.647 1.00 10.00 O ATOM 291 OD2 ASP A 95 -12.650 6.912 1.468 1.00 10.00 O ATOM 0 H ASP A 95 -10.992 3.356 -1.004 1.00 10.00 H new ATOM 0 HA ASP A 95 -12.658 5.561 -1.227 1.00 10.00 H new ATOM 0 HB2 ASP A 95 -11.695 4.678 0.868 1.00 10.00 H new ATOM 0 HB3 ASP A 95 -10.120 5.294 0.407 1.00 10.00 H new ATOM 296 N GLY A 96 -9.549 6.072 -2.268 1.00 10.00 N ATOM 297 CA GLY A 96 -8.922 6.393 -3.536 1.00 10.00 C ATOM 298 C GLY A 96 -7.411 6.441 -3.413 1.00 10.00 C ATOM 299 O GLY A 96 -6.704 5.800 -4.191 1.00 10.00 O ATOM 0 H GLY A 96 -8.939 5.600 -1.600 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -9.204 5.649 -4.281 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -9.290 7.355 -3.892 1.00 10.00 H new ATOM 303 N HIS A 97 -6.920 7.222 -2.450 1.00 10.00 N ATOM 304 CA HIS A 97 -5.504 7.474 -2.251 1.00 10.00 C ATOM 305 C HIS A 97 -5.136 7.161 -0.808 1.00 10.00 C ATOM 306 O HIS A 97 -5.803 7.631 0.111 1.00 10.00 O ATOM 307 CB HIS A 97 -5.191 8.946 -2.584 1.00 10.00 C ATOM 308 CG HIS A 97 -4.320 9.122 -3.798 1.00 10.00 C ATOM 309 ND1 HIS A 97 -4.738 9.413 -5.077 1.00 10.00 N ATOM 310 CD2 HIS A 97 -2.955 9.053 -3.811 1.00 10.00 C ATOM 311 CE1 HIS A 97 -3.638 9.497 -5.847 1.00 10.00 C ATOM 312 NE2 HIS A 97 -2.531 9.264 -5.123 1.00 10.00 N ATOM 0 H HIS A 97 -7.514 7.704 -1.775 1.00 10.00 H new ATOM 0 HA HIS A 97 -4.916 6.836 -2.911 1.00 10.00 H new ATOM 0 HB2 HIS A 97 -6.128 9.481 -2.740 1.00 10.00 H new ATOM 0 HB3 HIS A 97 -4.700 9.406 -1.726 1.00 10.00 H new ATOM 0 HD1 HIS A 97 -5.702 9.541 -5.384 1.00 10.00 H new ATOM 0 HD2 HIS A 97 -2.319 8.868 -2.958 1.00 10.00 H new ATOM 0 HE1 HIS A 97 -3.644 9.721 -6.903 1.00 10.00 H new ATOM 320 N ILE A 98 -4.069 6.384 -0.627 1.00 10.00 N ATOM 321 CA ILE A 98 -3.603 5.948 0.683 1.00 10.00 C ATOM 322 C ILE A 98 -2.540 6.886 1.238 1.00 10.00 C ATOM 323 O ILE A 98 -1.971 7.706 0.514 1.00 10.00 O ATOM 324 CB ILE A 98 -3.070 4.504 0.627 1.00 10.00 C ATOM 325 CG1 ILE A 98 -1.985 4.223 -0.416 1.00 10.00 C ATOM 326 CG2 ILE A 98 -4.216 3.561 0.295 1.00 10.00 C ATOM 327 CD1 ILE A 98 -0.578 4.663 -0.007 1.00 10.00 C ATOM 0 H ILE A 98 -3.498 6.037 -1.398 1.00 10.00 H new ATOM 0 HA ILE A 98 -4.459 5.974 1.357 1.00 10.00 H new ATOM 0 HB ILE A 98 -2.625 4.351 1.610 1.00 10.00 H new ATOM 0 HG12 ILE A 98 -1.970 3.154 -0.626 1.00 10.00 H new ATOM 0 HG13 ILE A 98 -2.253 4.727 -1.345 1.00 10.00 H new ATOM 0 HG21 ILE A 98 -3.844 2.537 0.254 1.00 10.00 H new ATOM 0 HG22 ILE A 98 -4.985 3.638 1.064 1.00 10.00 H new ATOM 0 HG23 ILE A 98 -4.641 3.832 -0.671 1.00 10.00 H new ATOM 0 HD11 ILE A 98 0.124 4.425 -0.806 1.00 10.00 H new ATOM 0 HD12 ILE A 98 -0.571 5.738 0.174 1.00 10.00 H new ATOM 0 HD13 ILE A 98 -0.283 4.140 0.903 1.00 10.00 H new ATOM 339 N THR A 99 -2.220 6.699 2.517 1.00 10.00 N ATOM 340 CA THR A 99 -0.969 7.131 3.110 1.00 10.00 C ATOM 341 C THR A 99 -0.031 5.921 3.106 1.00 10.00 C ATOM 342 O THR A 99 -0.348 4.865 3.651 1.00 10.00 O ATOM 343 CB THR A 99 -1.174 7.806 4.485 1.00 10.00 C ATOM 344 OG1 THR A 99 -0.511 7.135 5.535 1.00 10.00 O ATOM 345 CG2 THR A 99 -2.649 8.029 4.837 1.00 10.00 C ATOM 0 H THR A 99 -2.840 6.233 3.179 1.00 10.00 H new ATOM 0 HA THR A 99 -0.503 7.925 2.527 1.00 10.00 H new ATOM 0 HB THR A 99 -0.713 8.788 4.378 1.00 10.00 H new ATOM 0 HG1 THR A 99 -0.674 7.606 6.379 1.00 10.00 H new ATOM 0 HG21 THR A 99 -2.722 8.506 5.814 1.00 10.00 H new ATOM 0 HG22 THR A 99 -3.110 8.670 4.085 1.00 10.00 H new ATOM 0 HG23 THR A 99 -3.166 7.070 4.862 1.00 10.00 H new ATOM 353 N VAL A 100 1.146 6.052 2.491 1.00 10.00 N ATOM 354 CA VAL A 100 2.186 5.027 2.570 1.00 10.00 C ATOM 355 C VAL A 100 2.414 4.569 4.030 1.00 10.00 C ATOM 356 O VAL A 100 2.795 3.431 4.307 1.00 10.00 O ATOM 357 CB VAL A 100 3.484 5.496 1.919 1.00 10.00 C ATOM 358 CG1 VAL A 100 3.401 5.418 0.389 1.00 10.00 C ATOM 359 CG2 VAL A 100 3.822 6.917 2.337 1.00 10.00 C ATOM 0 H VAL A 100 1.403 6.864 1.929 1.00 10.00 H new ATOM 0 HA VAL A 100 1.837 4.161 2.007 1.00 10.00 H new ATOM 0 HB VAL A 100 4.274 4.828 2.261 1.00 10.00 H new ATOM 0 HG11 VAL A 100 4.341 5.759 -0.044 1.00 10.00 H new ATOM 0 HG12 VAL A 100 3.215 4.387 0.087 1.00 10.00 H new ATOM 0 HG13 VAL A 100 2.588 6.052 0.036 1.00 10.00 H new ATOM 0 HG21 VAL A 100 4.751 7.226 1.859 1.00 10.00 H new ATOM 0 HG22 VAL A 100 3.018 7.587 2.033 1.00 10.00 H new ATOM 0 HG23 VAL A 100 3.940 6.959 3.420 1.00 10.00 H new ATOM 369 N ASP A 101 2.180 5.475 4.982 1.00 10.00 N ATOM 370 CA ASP A 101 2.274 5.201 6.413 1.00 10.00 C ATOM 371 C ASP A 101 1.151 4.280 6.898 1.00 10.00 C ATOM 372 O ASP A 101 1.405 3.302 7.606 1.00 10.00 O ATOM 373 CB ASP A 101 2.331 6.519 7.203 1.00 10.00 C ATOM 374 CG ASP A 101 3.551 6.524 8.101 1.00 10.00 C ATOM 375 OD1 ASP A 101 3.502 5.898 9.178 1.00 10.00 O ATOM 376 OD2 ASP A 101 4.600 7.018 7.621 1.00 10.00 O ATOM 0 H ASP A 101 1.915 6.438 4.773 1.00 10.00 H new ATOM 0 HA ASP A 101 3.202 4.660 6.596 1.00 10.00 H new ATOM 0 HB2 ASP A 101 2.370 7.364 6.516 1.00 10.00 H new ATOM 0 HB3 ASP A 101 1.427 6.635 7.801 1.00 10.00 H new ATOM 381 N GLU A 102 -0.087 4.554 6.475 1.00 10.00 N ATOM 382 CA GLU A 102 -1.222 3.655 6.656 1.00 10.00 C ATOM 383 C GLU A 102 -0.809 2.258 6.211 1.00 10.00 C ATOM 384 O GLU A 102 -1.040 1.274 6.900 1.00 10.00 O ATOM 385 CB GLU A 102 -2.444 4.162 5.861 1.00 10.00 C ATOM 386 CG GLU A 102 -2.836 3.272 4.665 1.00 10.00 C ATOM 387 CD GLU A 102 -3.965 3.837 3.831 1.00 10.00 C ATOM 388 OE1 GLU A 102 -4.018 5.080 3.721 1.00 10.00 O ATOM 389 OE2 GLU A 102 -4.719 3.003 3.294 1.00 10.00 O ATOM 0 H GLU A 102 -0.328 5.419 5.991 1.00 10.00 H new ATOM 0 HA GLU A 102 -1.512 3.624 7.706 1.00 10.00 H new ATOM 0 HB2 GLU A 102 -3.296 4.239 6.537 1.00 10.00 H new ATOM 0 HB3 GLU A 102 -2.234 5.168 5.497 1.00 10.00 H new ATOM 0 HG2 GLU A 102 -1.963 3.128 4.029 1.00 10.00 H new ATOM 0 HG3 GLU A 102 -3.126 2.289 5.035 1.00 10.00 H new ATOM 396 N LEU A 103 -0.177 2.190 5.043 1.00 10.00 N ATOM 397 CA LEU A 103 0.210 0.966 4.377 1.00 10.00 C ATOM 398 C LEU A 103 1.203 0.220 5.275 1.00 10.00 C ATOM 399 O LEU A 103 1.095 -0.985 5.503 1.00 10.00 O ATOM 400 CB LEU A 103 0.822 1.365 3.030 1.00 10.00 C ATOM 401 CG LEU A 103 0.005 1.007 1.786 1.00 10.00 C ATOM 402 CD1 LEU A 103 0.909 1.460 0.619 1.00 10.00 C ATOM 403 CD2 LEU A 103 -0.197 -0.506 1.674 1.00 10.00 C ATOM 0 H LEU A 103 0.087 3.025 4.519 1.00 10.00 H new ATOM 0 HA LEU A 103 -0.631 0.297 4.196 1.00 10.00 H new ATOM 0 HB2 LEU A 103 0.987 2.442 3.034 1.00 10.00 H new ATOM 0 HB3 LEU A 103 1.801 0.893 2.945 1.00 10.00 H new ATOM 0 HG LEU A 103 -0.982 1.468 1.802 1.00 10.00 H new ATOM 0 HD11 LEU A 103 0.414 1.247 -0.328 1.00 10.00 H new ATOM 0 HD12 LEU A 103 1.096 2.531 0.698 1.00 10.00 H new ATOM 0 HD13 LEU A 103 1.856 0.922 0.662 1.00 10.00 H new ATOM 0 HD21 LEU A 103 -0.781 -0.730 0.781 1.00 10.00 H new ATOM 0 HD22 LEU A 103 0.773 -0.999 1.607 1.00 10.00 H new ATOM 0 HD23 LEU A 103 -0.727 -0.868 2.555 1.00 10.00 H new ATOM 415 N ARG A 104 2.157 0.972 5.827 1.00 10.00 N ATOM 416 CA ARG A 104 3.076 0.477 6.839 1.00 10.00 C ATOM 417 C ARG A 104 2.310 -0.121 8.020 1.00 10.00 C ATOM 418 O ARG A 104 2.664 -1.201 8.489 1.00 10.00 O ATOM 419 CB ARG A 104 4.025 1.606 7.261 1.00 10.00 C ATOM 420 CG ARG A 104 5.425 1.081 7.622 1.00 10.00 C ATOM 421 CD ARG A 104 6.449 2.209 7.814 1.00 10.00 C ATOM 422 NE ARG A 104 6.385 3.225 6.738 1.00 10.00 N ATOM 423 CZ ARG A 104 6.114 4.525 6.950 1.00 10.00 C ATOM 424 NH1 ARG A 104 6.250 5.071 8.160 1.00 10.00 N ATOM 425 NH2 ARG A 104 5.656 5.298 5.965 1.00 10.00 N ATOM 0 H ARG A 104 2.310 1.949 5.578 1.00 10.00 H new ATOM 0 HA ARG A 104 3.681 -0.330 6.426 1.00 10.00 H new ATOM 0 HB2 ARG A 104 4.108 2.331 6.451 1.00 10.00 H new ATOM 0 HB3 ARG A 104 3.604 2.132 8.118 1.00 10.00 H new ATOM 0 HG2 ARG A 104 5.363 0.492 8.537 1.00 10.00 H new ATOM 0 HG3 ARG A 104 5.772 0.411 6.835 1.00 10.00 H new ATOM 0 HD2 ARG A 104 6.276 2.692 8.776 1.00 10.00 H new ATOM 0 HD3 ARG A 104 7.452 1.783 7.847 1.00 10.00 H new ATOM 0 HE ARG A 104 6.557 2.921 5.780 1.00 10.00 H new ATOM 0 HH11 ARG A 104 6.565 4.500 8.945 1.00 10.00 H new ATOM 0 HH12 ARG A 104 6.039 6.059 8.300 1.00 10.00 H new ATOM 0 HH21 ARG A 104 5.507 4.905 5.036 1.00 10.00 H new ATOM 0 HH22 ARG A 104 5.455 6.282 6.141 1.00 10.00 H new ATOM 439 N ARG A 105 1.260 0.557 8.503 1.00 10.00 N ATOM 440 CA ARG A 105 0.381 -0.044 9.500 1.00 10.00 C ATOM 441 C ARG A 105 -0.248 -1.344 8.986 1.00 10.00 C ATOM 442 O ARG A 105 -0.157 -2.377 9.644 1.00 10.00 O ATOM 443 CB ARG A 105 -0.671 0.925 10.071 1.00 10.00 C ATOM 444 CG ARG A 105 -0.184 1.710 11.297 1.00 10.00 C ATOM 445 CD ARG A 105 0.630 2.955 10.931 1.00 10.00 C ATOM 446 NE ARG A 105 1.424 3.418 12.082 1.00 10.00 N ATOM 447 CZ ARG A 105 2.624 2.925 12.428 1.00 10.00 C ATOM 448 NH1 ARG A 105 3.211 2.005 11.656 1.00 10.00 N ATOM 449 NH2 ARG A 105 3.223 3.333 13.553 1.00 10.00 N ATOM 0 H ARG A 105 1.006 1.504 8.222 1.00 10.00 H new ATOM 0 HA ARG A 105 1.021 -0.296 10.345 1.00 10.00 H new ATOM 0 HB2 ARG A 105 -0.964 1.629 9.292 1.00 10.00 H new ATOM 0 HB3 ARG A 105 -1.563 0.360 10.343 1.00 10.00 H new ATOM 0 HG2 ARG A 105 -1.045 2.009 11.894 1.00 10.00 H new ATOM 0 HG3 ARG A 105 0.425 1.056 11.921 1.00 10.00 H new ATOM 0 HD2 ARG A 105 1.291 2.730 10.094 1.00 10.00 H new ATOM 0 HD3 ARG A 105 -0.040 3.749 10.603 1.00 10.00 H new ATOM 0 HE ARG A 105 1.035 4.166 12.657 1.00 10.00 H new ATOM 0 HH11 ARG A 105 2.747 1.680 10.808 1.00 10.00 H new ATOM 0 HH12 ARG A 105 4.123 1.628 11.915 1.00 10.00 H new ATOM 0 HH21 ARG A 105 2.768 4.022 14.152 1.00 10.00 H new ATOM 0 HH22 ARG A 105 4.135 2.955 13.811 1.00 10.00 H new ATOM 463 N ALA A 106 -0.882 -1.301 7.817 1.00 10.00 N ATOM 464 CA ALA A 106 -1.609 -2.411 7.227 1.00 10.00 C ATOM 465 C ALA A 106 -0.772 -3.686 7.204 1.00 10.00 C ATOM 466 O ALA A 106 -1.246 -4.749 7.600 1.00 10.00 O ATOM 467 CB ALA A 106 -2.031 -2.044 5.810 1.00 10.00 C ATOM 0 H ALA A 106 -0.902 -0.461 7.238 1.00 10.00 H new ATOM 0 HA ALA A 106 -2.489 -2.604 7.841 1.00 10.00 H new ATOM 0 HB1 ALA A 106 -2.577 -2.876 5.366 1.00 10.00 H new ATOM 0 HB2 ALA A 106 -2.672 -1.163 5.838 1.00 10.00 H new ATOM 0 HB3 ALA A 106 -1.146 -1.830 5.211 1.00 10.00 H new ATOM 473 N MET A 107 0.480 -3.586 6.754 1.00 10.00 N ATOM 474 CA MET A 107 1.363 -4.745 6.701 1.00 10.00 C ATOM 475 C MET A 107 1.626 -5.410 8.063 1.00 10.00 C ATOM 476 O MET A 107 1.977 -6.594 8.105 1.00 10.00 O ATOM 477 CB MET A 107 2.638 -4.396 5.929 1.00 10.00 C ATOM 478 CG MET A 107 2.336 -4.581 4.439 1.00 10.00 C ATOM 479 SD MET A 107 3.589 -3.999 3.285 1.00 10.00 S ATOM 480 CE MET A 107 2.544 -2.790 2.463 1.00 10.00 C ATOM 0 H MET A 107 0.901 -2.718 6.423 1.00 10.00 H new ATOM 0 HA MET A 107 0.837 -5.525 6.150 1.00 10.00 H new ATOM 0 HB2 MET A 107 2.942 -3.370 6.134 1.00 10.00 H new ATOM 0 HB3 MET A 107 3.462 -5.040 6.237 1.00 10.00 H new ATOM 0 HG2 MET A 107 2.169 -5.642 4.254 1.00 10.00 H new ATOM 0 HG3 MET A 107 1.401 -4.068 4.214 1.00 10.00 H new ATOM 0 HE1 MET A 107 3.161 -2.131 1.852 1.00 10.00 H new ATOM 0 HE2 MET A 107 1.823 -3.304 1.827 1.00 10.00 H new ATOM 0 HE3 MET A 107 2.013 -2.200 3.210 1.00 10.00 H new ATOM 490 N ALA A 108 1.381 -4.714 9.182 1.00 10.00 N ATOM 491 CA ALA A 108 1.339 -5.364 10.489 1.00 10.00 C ATOM 492 C ALA A 108 0.288 -6.475 10.520 1.00 10.00 C ATOM 493 O ALA A 108 0.507 -7.517 11.131 1.00 10.00 O ATOM 494 CB ALA A 108 1.115 -4.337 11.605 1.00 10.00 C ATOM 0 H ALA A 108 1.211 -3.709 9.204 1.00 10.00 H new ATOM 0 HA ALA A 108 2.307 -5.832 10.666 1.00 10.00 H new ATOM 0 HB1 ALA A 108 1.088 -4.847 12.568 1.00 10.00 H new ATOM 0 HB2 ALA A 108 1.929 -3.612 11.601 1.00 10.00 H new ATOM 0 HB3 ALA A 108 0.169 -3.821 11.440 1.00 10.00 H new ATOM 500 N GLY A 109 -0.836 -6.263 9.833 1.00 10.00 N ATOM 501 CA GLY A 109 -1.874 -7.259 9.647 1.00 10.00 C ATOM 502 C GLY A 109 -1.356 -8.474 8.874 1.00 10.00 C ATOM 503 O GLY A 109 -1.626 -9.610 9.251 1.00 10.00 O ATOM 0 H GLY A 109 -1.047 -5.372 9.384 1.00 10.00 H new ATOM 0 HA2 GLY A 109 -2.251 -7.579 10.619 1.00 10.00 H new ATOM 0 HA3 GLY A 109 -2.713 -6.816 9.110 1.00 10.00 H new ATOM 507 N LEU A 110 -0.636 -8.233 7.772 1.00 10.00 N ATOM 508 CA LEU A 110 -0.186 -9.285 6.862 1.00 10.00 C ATOM 509 C LEU A 110 0.736 -10.293 7.549 1.00 10.00 C ATOM 510 O LEU A 110 0.552 -11.495 7.379 1.00 10.00 O ATOM 511 CB LEU A 110 0.501 -8.676 5.628 1.00 10.00 C ATOM 512 CG LEU A 110 -0.406 -8.577 4.389 1.00 10.00 C ATOM 513 CD1 LEU A 110 -1.773 -7.937 4.646 1.00 10.00 C ATOM 514 CD2 LEU A 110 0.300 -7.738 3.322 1.00 10.00 C ATOM 0 H LEU A 110 -0.349 -7.296 7.488 1.00 10.00 H new ATOM 0 HA LEU A 110 -1.073 -9.831 6.540 1.00 10.00 H new ATOM 0 HB2 LEU A 110 0.862 -7.679 5.881 1.00 10.00 H new ATOM 0 HB3 LEU A 110 1.375 -9.278 5.378 1.00 10.00 H new ATOM 0 HG LEU A 110 -0.586 -9.605 4.075 1.00 10.00 H new ATOM 0 HD11 LEU A 110 -2.342 -7.910 3.717 1.00 10.00 H new ATOM 0 HD12 LEU A 110 -2.316 -8.524 5.387 1.00 10.00 H new ATOM 0 HD13 LEU A 110 -1.635 -6.921 5.017 1.00 10.00 H new ATOM 0 HD21 LEU A 110 -0.335 -7.662 2.440 1.00 10.00 H new ATOM 0 HD22 LEU A 110 0.496 -6.740 3.715 1.00 10.00 H new ATOM 0 HD23 LEU A 110 1.243 -8.213 3.051 1.00 10.00 H new ATOM 526 N GLY A 111 1.748 -9.819 8.284 1.00 10.00 N ATOM 527 CA GLY A 111 2.681 -10.703 8.968 1.00 10.00 C ATOM 528 C GLY A 111 4.130 -10.228 8.919 1.00 10.00 C ATOM 529 O GLY A 111 4.964 -10.755 9.651 1.00 10.00 O ATOM 0 H GLY A 111 1.937 -8.825 8.417 1.00 10.00 H new ATOM 0 HA2 GLY A 111 2.376 -10.801 10.010 1.00 10.00 H new ATOM 0 HA3 GLY A 111 2.619 -11.696 8.523 1.00 10.00 H new ATOM 533 N GLN A 112 4.438 -9.232 8.082 1.00 10.00 N ATOM 534 CA GLN A 112 5.741 -8.583 8.037 1.00 10.00 C ATOM 535 C GLN A 112 5.565 -7.141 8.538 1.00 10.00 C ATOM 536 O GLN A 112 5.356 -6.236 7.735 1.00 10.00 O ATOM 537 CB GLN A 112 6.406 -8.758 6.651 1.00 10.00 C ATOM 538 CG GLN A 112 5.509 -8.907 5.399 1.00 10.00 C ATOM 539 CD GLN A 112 5.234 -7.605 4.657 1.00 10.00 C ATOM 540 OE1 GLN A 112 6.064 -6.707 4.642 1.00 10.00 O ATOM 541 NE2 GLN A 112 4.095 -7.519 3.978 1.00 10.00 N ATOM 0 H GLN A 112 3.774 -8.852 7.408 1.00 10.00 H new ATOM 0 HA GLN A 112 6.461 -9.055 8.706 1.00 10.00 H new ATOM 0 HB2 GLN A 112 7.057 -7.899 6.488 1.00 10.00 H new ATOM 0 HB3 GLN A 112 7.047 -9.638 6.703 1.00 10.00 H new ATOM 0 HG2 GLN A 112 5.981 -9.609 4.712 1.00 10.00 H new ATOM 0 HG3 GLN A 112 4.558 -9.346 5.700 1.00 10.00 H new ATOM 0 HE21 GLN A 112 3.423 -8.285 4.011 1.00 10.00 H new ATOM 0 HE22 GLN A 112 3.893 -6.687 3.424 1.00 10.00 H new ATOM 550 N PRO A 113 5.573 -6.920 9.869 1.00 10.00 N ATOM 551 CA PRO A 113 5.163 -5.659 10.471 1.00 10.00 C ATOM 552 C PRO A 113 6.237 -4.585 10.336 1.00 10.00 C ATOM 553 O PRO A 113 7.393 -4.821 10.677 1.00 10.00 O ATOM 554 CB PRO A 113 4.903 -5.975 11.950 1.00 10.00 C ATOM 555 CG PRO A 113 5.866 -7.127 12.228 1.00 10.00 C ATOM 556 CD PRO A 113 5.822 -7.905 10.915 1.00 10.00 C ATOM 0 HA PRO A 113 4.280 -5.261 9.971 1.00 10.00 H new ATOM 0 HB2 PRO A 113 5.107 -5.115 12.588 1.00 10.00 H new ATOM 0 HB3 PRO A 113 3.867 -6.264 12.125 1.00 10.00 H new ATOM 0 HG2 PRO A 113 6.871 -6.772 12.458 1.00 10.00 H new ATOM 0 HG3 PRO A 113 5.542 -7.735 13.073 1.00 10.00 H new ATOM 0 HD2 PRO A 113 6.762 -8.429 10.741 1.00 10.00 H new ATOM 0 HD3 PRO A 113 5.035 -8.659 10.935 1.00 10.00 H new ATOM 564 N LEU A 114 5.841 -3.394 9.870 1.00 10.00 N ATOM 565 CA LEU A 114 6.735 -2.251 9.688 1.00 10.00 C ATOM 566 C LEU A 114 7.956 -2.692 8.898 1.00 10.00 C ATOM 567 O LEU A 114 9.093 -2.618 9.366 1.00 10.00 O ATOM 568 CB LEU A 114 7.093 -1.586 11.027 1.00 10.00 C ATOM 569 CG LEU A 114 6.029 -0.563 11.442 1.00 10.00 C ATOM 570 CD1 LEU A 114 4.626 -1.165 11.358 1.00 10.00 C ATOM 571 CD2 LEU A 114 6.354 -0.061 12.849 1.00 10.00 C ATOM 0 H LEU A 114 4.876 -3.198 9.606 1.00 10.00 H new ATOM 0 HA LEU A 114 6.222 -1.479 9.114 1.00 10.00 H new ATOM 0 HB2 LEU A 114 7.189 -2.348 11.800 1.00 10.00 H new ATOM 0 HB3 LEU A 114 8.062 -1.093 10.943 1.00 10.00 H new ATOM 0 HG LEU A 114 6.042 0.283 10.755 1.00 10.00 H new ATOM 0 HD11 LEU A 114 3.891 -0.418 11.658 1.00 10.00 H new ATOM 0 HD12 LEU A 114 4.426 -1.480 10.334 1.00 10.00 H new ATOM 0 HD13 LEU A 114 4.559 -2.027 12.022 1.00 10.00 H new ATOM 0 HD21 LEU A 114 5.605 0.668 13.157 1.00 10.00 H new ATOM 0 HD22 LEU A 114 6.351 -0.900 13.544 1.00 10.00 H new ATOM 0 HD23 LEU A 114 7.338 0.408 12.850 1.00 10.00 H new ATOM 583 N PRO A 115 7.720 -3.157 7.671 1.00 10.00 N ATOM 584 CA PRO A 115 8.759 -3.752 6.882 1.00 10.00 C ATOM 585 C PRO A 115 9.498 -2.637 6.186 1.00 10.00 C ATOM 586 O PRO A 115 9.372 -2.479 4.988 1.00 10.00 O ATOM 587 CB PRO A 115 7.998 -4.642 5.913 1.00 10.00 C ATOM 588 CG PRO A 115 6.738 -3.822 5.609 1.00 10.00 C ATOM 589 CD PRO A 115 6.450 -3.160 6.950 1.00 10.00 C ATOM 0 HA PRO A 115 9.501 -4.326 7.436 1.00 10.00 H new ATOM 0 HB2 PRO A 115 8.576 -4.843 5.011 1.00 10.00 H new ATOM 0 HB3 PRO A 115 7.754 -5.607 6.358 1.00 10.00 H new ATOM 0 HG2 PRO A 115 6.911 -3.088 4.822 1.00 10.00 H new ATOM 0 HG3 PRO A 115 5.912 -4.453 5.281 1.00 10.00 H new ATOM 0 HD2 PRO A 115 6.075 -2.146 6.813 1.00 10.00 H new ATOM 0 HD3 PRO A 115 5.688 -3.710 7.502 1.00 10.00 H new ATOM 597 N GLN A 116 10.247 -1.843 6.941 1.00 10.00 N ATOM 598 CA GLN A 116 10.884 -0.626 6.497 1.00 10.00 C ATOM 599 C GLN A 116 11.443 -0.688 5.073 1.00 10.00 C ATOM 600 O GLN A 116 11.257 0.242 4.306 1.00 10.00 O ATOM 601 CB GLN A 116 11.926 -0.178 7.526 1.00 10.00 C ATOM 602 CG GLN A 116 12.923 -1.231 8.044 1.00 10.00 C ATOM 603 CD GLN A 116 12.296 -2.060 9.160 1.00 10.00 C ATOM 604 OE1 GLN A 116 12.155 -1.586 10.282 1.00 10.00 O ATOM 605 NE2 GLN A 116 11.828 -3.263 8.844 1.00 10.00 N ATOM 0 H GLN A 116 10.431 -2.046 7.924 1.00 10.00 H new ATOM 0 HA GLN A 116 10.106 0.135 6.433 1.00 10.00 H new ATOM 0 HB2 GLN A 116 12.499 0.639 7.088 1.00 10.00 H new ATOM 0 HB3 GLN A 116 11.394 0.231 8.385 1.00 10.00 H new ATOM 0 HG2 GLN A 116 13.228 -1.884 7.226 1.00 10.00 H new ATOM 0 HG3 GLN A 116 13.823 -0.738 8.411 1.00 10.00 H new ATOM 0 HE21 GLN A 116 11.961 -3.631 7.902 1.00 10.00 H new ATOM 0 HE22 GLN A 116 11.336 -3.819 9.544 1.00 10.00 H new ATOM 614 N GLU A 117 12.082 -1.801 4.729 1.00 10.00 N ATOM 615 CA GLU A 117 12.614 -2.125 3.405 1.00 10.00 C ATOM 616 C GLU A 117 11.512 -2.331 2.362 1.00 10.00 C ATOM 617 O GLU A 117 11.555 -1.749 1.283 1.00 10.00 O ATOM 618 CB GLU A 117 13.490 -3.371 3.601 1.00 10.00 C ATOM 619 CG GLU A 117 14.526 -3.591 2.502 1.00 10.00 C ATOM 620 CD GLU A 117 15.478 -4.707 2.918 1.00 10.00 C ATOM 621 OE1 GLU A 117 16.344 -4.416 3.769 1.00 10.00 O ATOM 622 OE2 GLU A 117 15.293 -5.834 2.413 1.00 10.00 O ATOM 0 H GLU A 117 12.254 -2.546 5.404 1.00 10.00 H new ATOM 0 HA GLU A 117 13.200 -1.298 3.004 1.00 10.00 H new ATOM 0 HB2 GLU A 117 14.005 -3.292 4.558 1.00 10.00 H new ATOM 0 HB3 GLU A 117 12.846 -4.248 3.657 1.00 10.00 H new ATOM 0 HG2 GLU A 117 14.030 -3.851 1.567 1.00 10.00 H new ATOM 0 HG3 GLU A 117 15.083 -2.671 2.323 1.00 10.00 H new ATOM 629 N GLU A 118 10.510 -3.142 2.686 1.00 10.00 N ATOM 630 CA GLU A 118 9.422 -3.469 1.781 1.00 10.00 C ATOM 631 C GLU A 118 8.555 -2.214 1.638 1.00 10.00 C ATOM 632 O GLU A 118 8.290 -1.757 0.528 1.00 10.00 O ATOM 633 CB GLU A 118 8.697 -4.723 2.309 1.00 10.00 C ATOM 634 CG GLU A 118 8.510 -5.833 1.265 1.00 10.00 C ATOM 635 CD GLU A 118 7.274 -5.619 0.409 1.00 10.00 C ATOM 636 OE1 GLU A 118 7.400 -4.896 -0.601 1.00 10.00 O ATOM 637 OE2 GLU A 118 6.222 -6.170 0.798 1.00 10.00 O ATOM 0 H GLU A 118 10.433 -3.595 3.597 1.00 10.00 H new ATOM 0 HA GLU A 118 9.753 -3.735 0.777 1.00 10.00 H new ATOM 0 HB2 GLU A 118 9.259 -5.125 3.152 1.00 10.00 H new ATOM 0 HB3 GLU A 118 7.718 -4.429 2.689 1.00 10.00 H new ATOM 0 HG2 GLU A 118 9.390 -5.877 0.623 1.00 10.00 H new ATOM 0 HG3 GLU A 118 8.436 -6.796 1.771 1.00 10.00 H new ATOM 644 N LEU A 119 8.183 -1.567 2.751 1.00 10.00 N ATOM 645 CA LEU A 119 7.534 -0.282 2.670 1.00 10.00 C ATOM 646 C LEU A 119 8.394 0.801 2.011 1.00 10.00 C ATOM 647 O LEU A 119 7.810 1.621 1.328 1.00 10.00 O ATOM 648 CB LEU A 119 6.973 0.160 4.026 1.00 10.00 C ATOM 649 CG LEU A 119 5.465 0.475 3.952 1.00 10.00 C ATOM 650 CD1 LEU A 119 5.049 1.479 2.878 1.00 10.00 C ATOM 651 CD2 LEU A 119 4.648 -0.806 3.801 1.00 10.00 C ATOM 0 H LEU A 119 8.324 -1.918 3.698 1.00 10.00 H new ATOM 0 HA LEU A 119 6.686 -0.419 1.999 1.00 10.00 H new ATOM 0 HB2 LEU A 119 7.144 -0.625 4.762 1.00 10.00 H new ATOM 0 HB3 LEU A 119 7.511 1.043 4.371 1.00 10.00 H new ATOM 0 HG LEU A 119 5.250 0.962 4.903 1.00 10.00 H new ATOM 0 HD11 LEU A 119 3.970 1.626 2.916 1.00 10.00 H new ATOM 0 HD12 LEU A 119 5.551 2.430 3.055 1.00 10.00 H new ATOM 0 HD13 LEU A 119 5.329 1.098 1.896 1.00 10.00 H new ATOM 0 HD21 LEU A 119 3.588 -0.558 3.751 1.00 10.00 H new ATOM 0 HD22 LEU A 119 4.944 -1.320 2.887 1.00 10.00 H new ATOM 0 HD23 LEU A 119 4.828 -1.456 4.657 1.00 10.00 H new ATOM 663 N ASP A 120 9.722 0.867 2.178 1.00 10.00 N ATOM 664 CA ASP A 120 10.567 1.821 1.447 1.00 10.00 C ATOM 665 C ASP A 120 10.420 1.583 -0.052 1.00 10.00 C ATOM 666 O ASP A 120 10.129 2.489 -0.831 1.00 10.00 O ATOM 667 CB ASP A 120 12.050 1.721 1.829 1.00 10.00 C ATOM 668 CG ASP A 120 12.892 2.633 0.940 1.00 10.00 C ATOM 669 OD1 ASP A 120 12.933 3.844 1.245 1.00 10.00 O ATOM 670 OD2 ASP A 120 13.470 2.113 -0.039 1.00 10.00 O ATOM 0 H ASP A 120 10.238 0.265 2.819 1.00 10.00 H new ATOM 0 HA ASP A 120 10.228 2.821 1.719 1.00 10.00 H new ATOM 0 HB2 ASP A 120 12.182 1.999 2.875 1.00 10.00 H new ATOM 0 HB3 ASP A 120 12.389 0.690 1.728 1.00 10.00 H new ATOM 675 N ALA A 121 10.588 0.321 -0.434 1.00 10.00 N ATOM 676 CA ALA A 121 10.441 -0.131 -1.798 1.00 10.00 C ATOM 677 C ALA A 121 9.082 0.332 -2.358 1.00 10.00 C ATOM 678 O ALA A 121 9.031 1.071 -3.344 1.00 10.00 O ATOM 679 CB ALA A 121 10.683 -1.644 -1.797 1.00 10.00 C ATOM 0 H ALA A 121 10.835 -0.425 0.216 1.00 10.00 H new ATOM 0 HA ALA A 121 11.170 0.307 -2.479 1.00 10.00 H new ATOM 0 HB1 ALA A 121 10.581 -2.029 -2.812 1.00 10.00 H new ATOM 0 HB2 ALA A 121 11.688 -1.852 -1.429 1.00 10.00 H new ATOM 0 HB3 ALA A 121 9.952 -2.129 -1.150 1.00 10.00 H new ATOM 685 N MET A 122 7.976 -0.006 -1.685 1.00 10.00 N ATOM 686 CA MET A 122 6.654 0.446 -2.064 1.00 10.00 C ATOM 687 C MET A 122 6.488 1.967 -1.954 1.00 10.00 C ATOM 688 O MET A 122 5.753 2.548 -2.741 1.00 10.00 O ATOM 689 CB MET A 122 5.620 -0.246 -1.185 1.00 10.00 C ATOM 690 CG MET A 122 5.491 -1.751 -1.437 1.00 10.00 C ATOM 691 SD MET A 122 3.899 -2.403 -0.875 1.00 10.00 S ATOM 692 CE MET A 122 4.387 -4.063 -0.389 1.00 10.00 C ATOM 0 H MET A 122 7.985 -0.605 -0.859 1.00 10.00 H new ATOM 0 HA MET A 122 6.509 0.187 -3.113 1.00 10.00 H new ATOM 0 HB2 MET A 122 5.882 -0.085 -0.139 1.00 10.00 H new ATOM 0 HB3 MET A 122 4.649 0.223 -1.347 1.00 10.00 H new ATOM 0 HG2 MET A 122 5.608 -1.951 -2.502 1.00 10.00 H new ATOM 0 HG3 MET A 122 6.298 -2.274 -0.924 1.00 10.00 H new ATOM 0 HE1 MET A 122 3.497 -4.669 -0.220 1.00 10.00 H new ATOM 0 HE2 MET A 122 4.987 -4.512 -1.180 1.00 10.00 H new ATOM 0 HE3 MET A 122 4.973 -4.016 0.529 1.00 10.00 H new ATOM 702 N ILE A 123 7.129 2.625 -0.984 1.00 10.00 N ATOM 703 CA ILE A 123 7.100 4.075 -0.807 1.00 10.00 C ATOM 704 C ILE A 123 7.597 4.693 -2.110 1.00 10.00 C ATOM 705 O ILE A 123 6.999 5.624 -2.641 1.00 10.00 O ATOM 706 CB ILE A 123 7.942 4.528 0.414 1.00 10.00 C ATOM 707 CG1 ILE A 123 7.057 4.563 1.666 1.00 10.00 C ATOM 708 CG2 ILE A 123 8.592 5.910 0.230 1.00 10.00 C ATOM 709 CD1 ILE A 123 7.850 4.468 2.976 1.00 10.00 C ATOM 0 H ILE A 123 7.697 2.149 -0.283 1.00 10.00 H new ATOM 0 HA ILE A 123 6.086 4.412 -0.592 1.00 10.00 H new ATOM 0 HB ILE A 123 8.748 3.801 0.519 1.00 10.00 H new ATOM 0 HG12 ILE A 123 6.478 5.486 1.667 1.00 10.00 H new ATOM 0 HG13 ILE A 123 6.344 3.740 1.621 1.00 10.00 H new ATOM 0 HG21 ILE A 123 9.166 6.164 1.121 1.00 10.00 H new ATOM 0 HG22 ILE A 123 9.256 5.888 -0.634 1.00 10.00 H new ATOM 0 HG23 ILE A 123 7.816 6.659 0.072 1.00 10.00 H new ATOM 0 HD11 ILE A 123 7.162 4.499 3.821 1.00 10.00 H new ATOM 0 HD12 ILE A 123 8.408 3.532 2.996 1.00 10.00 H new ATOM 0 HD13 ILE A 123 8.544 5.306 3.043 1.00 10.00 H new ATOM 721 N ARG A 124 8.702 4.151 -2.621 1.00 10.00 N ATOM 722 CA ARG A 124 9.337 4.627 -3.831 1.00 10.00 C ATOM 723 C ARG A 124 8.453 4.351 -5.049 1.00 10.00 C ATOM 724 O ARG A 124 8.316 5.224 -5.900 1.00 10.00 O ATOM 725 CB ARG A 124 10.733 4.002 -3.920 1.00 10.00 C ATOM 726 CG ARG A 124 11.697 4.810 -4.800 1.00 10.00 C ATOM 727 CD ARG A 124 13.059 4.839 -4.096 1.00 10.00 C ATOM 728 NE ARG A 124 14.102 5.457 -4.925 1.00 10.00 N ATOM 729 CZ ARG A 124 15.361 5.653 -4.505 1.00 10.00 C ATOM 730 NH1 ARG A 124 15.694 5.355 -3.243 1.00 10.00 N ATOM 731 NH2 ARG A 124 16.280 6.140 -5.347 1.00 10.00 N ATOM 0 H ARG A 124 9.181 3.358 -2.194 1.00 10.00 H new ATOM 0 HA ARG A 124 9.461 5.710 -3.810 1.00 10.00 H new ATOM 0 HB2 ARG A 124 11.151 3.916 -2.917 1.00 10.00 H new ATOM 0 HB3 ARG A 124 10.648 2.991 -4.318 1.00 10.00 H new ATOM 0 HG2 ARG A 124 11.786 4.355 -5.787 1.00 10.00 H new ATOM 0 HG3 ARG A 124 11.322 5.823 -4.948 1.00 10.00 H new ATOM 0 HD2 ARG A 124 12.970 5.389 -3.159 1.00 10.00 H new ATOM 0 HD3 ARG A 124 13.356 3.821 -3.842 1.00 10.00 H new ATOM 0 HE ARG A 124 13.856 5.753 -5.870 1.00 10.00 H new ATOM 0 HH11 ARG A 124 14.992 4.981 -2.605 1.00 10.00 H new ATOM 0 HH12 ARG A 124 16.650 5.502 -2.919 1.00 10.00 H new ATOM 0 HH21 ARG A 124 16.023 6.362 -6.309 1.00 10.00 H new ATOM 0 HH22 ARG A 124 17.237 6.289 -5.027 1.00 10.00 H new ATOM 745 N GLU A 125 7.826 3.170 -5.122 1.00 10.00 N ATOM 746 CA GLU A 125 6.811 2.910 -6.144 1.00 10.00 C ATOM 747 C GLU A 125 5.557 3.779 -5.955 1.00 10.00 C ATOM 748 O GLU A 125 4.824 4.017 -6.912 1.00 10.00 O ATOM 749 CB GLU A 125 6.429 1.427 -6.178 1.00 10.00 C ATOM 750 CG GLU A 125 7.592 0.522 -6.605 1.00 10.00 C ATOM 751 CD GLU A 125 7.105 -0.896 -6.872 1.00 10.00 C ATOM 752 OE1 GLU A 125 6.378 -1.421 -5.999 1.00 10.00 O ATOM 753 OE2 GLU A 125 7.444 -1.420 -7.956 1.00 10.00 O ATOM 0 H GLU A 125 8.003 2.388 -4.491 1.00 10.00 H new ATOM 0 HA GLU A 125 7.256 3.180 -7.102 1.00 10.00 H new ATOM 0 HB2 GLU A 125 6.082 1.123 -5.190 1.00 10.00 H new ATOM 0 HB3 GLU A 125 5.595 1.287 -6.866 1.00 10.00 H new ATOM 0 HG2 GLU A 125 8.062 0.925 -7.502 1.00 10.00 H new ATOM 0 HG3 GLU A 125 8.354 0.509 -5.825 1.00 10.00 H new ATOM 760 N ALA A 126 5.269 4.239 -4.734 1.00 10.00 N ATOM 761 CA ALA A 126 4.136 5.109 -4.455 1.00 10.00 C ATOM 762 C ALA A 126 4.452 6.540 -4.873 1.00 10.00 C ATOM 763 O ALA A 126 4.445 7.451 -4.043 1.00 10.00 O ATOM 764 CB ALA A 126 3.695 5.018 -2.987 1.00 10.00 C ATOM 0 H ALA A 126 5.824 4.013 -3.908 1.00 10.00 H new ATOM 0 HA ALA A 126 3.289 4.767 -5.049 1.00 10.00 H new ATOM 0 HB1 ALA A 126 2.847 5.682 -2.820 1.00 10.00 H new ATOM 0 HB2 ALA A 126 3.404 3.993 -2.757 1.00 10.00 H new ATOM 0 HB3 ALA A 126 4.521 5.314 -2.340 1.00 10.00 H new ATOM 770 N ASP A 127 4.696 6.747 -6.169 1.00 10.00 N ATOM 771 CA ASP A 127 5.042 8.044 -6.721 1.00 10.00 C ATOM 772 C ASP A 127 3.991 8.519 -7.723 1.00 10.00 C ATOM 773 O ASP A 127 4.323 9.141 -8.729 1.00 10.00 O ATOM 774 CB ASP A 127 6.437 7.978 -7.355 1.00 10.00 C ATOM 775 CG ASP A 127 6.503 7.124 -8.620 1.00 10.00 C ATOM 776 OD1 ASP A 127 5.603 6.272 -8.791 1.00 10.00 O ATOM 777 OD2 ASP A 127 7.467 7.334 -9.389 1.00 10.00 O ATOM 0 H ASP A 127 4.656 6.005 -6.867 1.00 10.00 H new ATOM 0 HA ASP A 127 5.062 8.777 -5.914 1.00 10.00 H new ATOM 0 HB2 ASP A 127 6.765 8.990 -7.594 1.00 10.00 H new ATOM 0 HB3 ASP A 127 7.140 7.580 -6.623 1.00 10.00 H new ATOM 782 N VAL A 128 2.709 8.276 -7.426 1.00 10.00 N ATOM 783 CA VAL A 128 1.629 8.677 -8.321 1.00 10.00 C ATOM 784 C VAL A 128 1.712 10.183 -8.611 1.00 10.00 C ATOM 785 O VAL A 128 1.632 10.600 -9.766 1.00 10.00 O ATOM 786 CB VAL A 128 0.231 8.222 -7.872 1.00 10.00 C ATOM 787 CG1 VAL A 128 -0.901 9.026 -8.528 1.00 10.00 C ATOM 788 CG2 VAL A 128 0.051 6.759 -8.315 1.00 10.00 C ATOM 0 H VAL A 128 2.400 7.805 -6.575 1.00 10.00 H new ATOM 0 HA VAL A 128 1.779 8.141 -9.258 1.00 10.00 H new ATOM 0 HB VAL A 128 0.172 8.362 -6.793 1.00 10.00 H new ATOM 0 HG11 VAL A 128 -1.863 8.658 -8.171 1.00 10.00 H new ATOM 0 HG12 VAL A 128 -0.797 10.079 -8.268 1.00 10.00 H new ATOM 0 HG13 VAL A 128 -0.848 8.912 -9.611 1.00 10.00 H new ATOM 0 HG21 VAL A 128 -0.934 6.405 -8.010 1.00 10.00 H new ATOM 0 HG22 VAL A 128 0.141 6.693 -9.399 1.00 10.00 H new ATOM 0 HG23 VAL A 128 0.819 6.141 -7.849 1.00 10.00 H new ATOM 798 N ASP A 129 1.865 10.983 -7.548 1.00 10.00 N ATOM 799 CA ASP A 129 2.057 12.426 -7.633 1.00 10.00 C ATOM 800 C ASP A 129 3.549 12.725 -7.816 1.00 10.00 C ATOM 801 O ASP A 129 4.065 12.669 -8.928 1.00 10.00 O ATOM 802 CB ASP A 129 1.481 13.131 -6.386 1.00 10.00 C ATOM 803 CG ASP A 129 -0.040 13.129 -6.338 1.00 10.00 C ATOM 804 OD1 ASP A 129 -0.598 12.031 -6.139 1.00 10.00 O ATOM 805 OD2 ASP A 129 -0.611 14.236 -6.444 1.00 10.00 O ATOM 0 H ASP A 129 1.858 10.633 -6.590 1.00 10.00 H new ATOM 0 HA ASP A 129 1.516 12.816 -8.495 1.00 10.00 H new ATOM 0 HB2 ASP A 129 1.866 12.642 -5.491 1.00 10.00 H new ATOM 0 HB3 ASP A 129 1.836 14.161 -6.364 1.00 10.00 H new ATOM 810 N GLN A 130 4.235 13.083 -6.724 1.00 10.00 N ATOM 811 CA GLN A 130 5.623 13.534 -6.717 1.00 10.00 C ATOM 812 C GLN A 130 6.110 13.687 -5.269 1.00 10.00 C ATOM 813 O GLN A 130 6.698 14.706 -4.913 1.00 10.00 O ATOM 814 CB GLN A 130 5.759 14.846 -7.520 1.00 10.00 C ATOM 815 CG GLN A 130 4.741 15.921 -7.105 1.00 10.00 C ATOM 816 CD GLN A 130 4.950 17.224 -7.871 1.00 10.00 C ATOM 817 OE1 GLN A 130 5.094 17.227 -9.088 1.00 10.00 O ATOM 818 NE2 GLN A 130 4.967 18.356 -7.171 1.00 10.00 N ATOM 0 H GLN A 130 3.821 13.064 -5.792 1.00 10.00 H new ATOM 0 HA GLN A 130 6.256 12.791 -7.202 1.00 10.00 H new ATOM 0 HB2 GLN A 130 6.767 15.240 -7.390 1.00 10.00 H new ATOM 0 HB3 GLN A 130 5.636 14.629 -8.581 1.00 10.00 H new ATOM 0 HG2 GLN A 130 3.731 15.553 -7.283 1.00 10.00 H new ATOM 0 HG3 GLN A 130 4.828 16.110 -6.035 1.00 10.00 H new ATOM 0 HE21 GLN A 130 4.845 18.331 -6.159 1.00 10.00 H new ATOM 0 HE22 GLN A 130 5.102 19.248 -7.647 1.00 10.00 H new ATOM 827 N ASP A 131 5.834 12.683 -4.426 1.00 10.00 N ATOM 828 CA ASP A 131 6.157 12.705 -3.000 1.00 10.00 C ATOM 829 C ASP A 131 6.138 11.269 -2.462 1.00 10.00 C ATOM 830 O ASP A 131 7.180 10.633 -2.326 1.00 10.00 O ATOM 831 CB ASP A 131 5.171 13.647 -2.271 1.00 10.00 C ATOM 832 CG ASP A 131 5.333 13.705 -0.755 1.00 10.00 C ATOM 833 OD1 ASP A 131 6.023 12.837 -0.189 1.00 10.00 O ATOM 834 OD2 ASP A 131 4.652 14.565 -0.151 1.00 10.00 O ATOM 0 H ASP A 131 5.374 11.823 -4.723 1.00 10.00 H new ATOM 0 HA ASP A 131 7.158 13.098 -2.824 1.00 10.00 H new ATOM 0 HB2 ASP A 131 5.290 14.653 -2.672 1.00 10.00 H new ATOM 0 HB3 ASP A 131 4.153 13.331 -2.500 1.00 10.00 H new ATOM 839 N GLY A 132 4.935 10.754 -2.201 1.00 10.00 N ATOM 840 CA GLY A 132 4.715 9.458 -1.577 1.00 10.00 C ATOM 841 C GLY A 132 3.215 9.181 -1.569 1.00 10.00 C ATOM 842 O GLY A 132 2.614 9.028 -0.506 1.00 10.00 O ATOM 0 H GLY A 132 4.068 11.243 -2.425 1.00 10.00 H new ATOM 0 HA2 GLY A 132 5.243 8.678 -2.125 1.00 10.00 H new ATOM 0 HA3 GLY A 132 5.108 9.454 -0.560 1.00 10.00 H new ATOM 846 N ARG A 133 2.601 9.220 -2.753 1.00 10.00 N ATOM 847 CA ARG A 133 1.163 9.120 -2.985 1.00 10.00 C ATOM 848 C ARG A 133 0.955 8.005 -3.996 1.00 10.00 C ATOM 849 O ARG A 133 1.784 7.820 -4.882 1.00 10.00 O ATOM 850 CB ARG A 133 0.614 10.423 -3.592 1.00 10.00 C ATOM 851 CG ARG A 133 0.003 11.398 -2.581 1.00 10.00 C ATOM 852 CD ARG A 133 1.028 11.824 -1.531 1.00 10.00 C ATOM 853 NE ARG A 133 0.569 12.977 -0.747 1.00 10.00 N ATOM 854 CZ ARG A 133 1.383 13.658 0.074 1.00 10.00 C ATOM 855 NH1 ARG A 133 2.570 13.143 0.387 1.00 10.00 N ATOM 856 NH2 ARG A 133 1.018 14.846 0.566 1.00 10.00 N ATOM 0 H ARG A 133 3.124 9.328 -3.622 1.00 10.00 H new ATOM 0 HA ARG A 133 0.649 8.930 -2.043 1.00 10.00 H new ATOM 0 HB2 ARG A 133 1.422 10.929 -4.120 1.00 10.00 H new ATOM 0 HB3 ARG A 133 -0.143 10.170 -4.334 1.00 10.00 H new ATOM 0 HG2 ARG A 133 -0.373 12.278 -3.103 1.00 10.00 H new ATOM 0 HG3 ARG A 133 -0.850 10.929 -2.090 1.00 10.00 H new ATOM 0 HD2 ARG A 133 1.229 10.988 -0.861 1.00 10.00 H new ATOM 0 HD3 ARG A 133 1.969 12.072 -2.023 1.00 10.00 H new ATOM 0 HE ARG A 133 -0.404 13.271 -0.829 1.00 10.00 H new ATOM 0 HH11 ARG A 133 2.852 12.241 0.004 1.00 10.00 H new ATOM 0 HH12 ARG A 133 3.198 13.651 1.010 1.00 10.00 H new ATOM 0 HH21 ARG A 133 0.112 15.244 0.318 1.00 10.00 H new ATOM 0 HH22 ARG A 133 1.645 15.354 1.189 1.00 10.00 H new ATOM 870 N VAL A 134 -0.147 7.271 -3.886 1.00 10.00 N ATOM 871 CA VAL A 134 -0.471 6.207 -4.799 1.00 10.00 C ATOM 872 C VAL A 134 -1.994 6.041 -4.806 1.00 10.00 C ATOM 873 O VAL A 134 -2.637 6.163 -3.762 1.00 10.00 O ATOM 874 CB VAL A 134 0.313 4.969 -4.352 1.00 10.00 C ATOM 875 CG1 VAL A 134 -0.515 4.086 -3.475 1.00 10.00 C ATOM 876 CG2 VAL A 134 0.841 4.121 -5.480 1.00 10.00 C ATOM 0 H VAL A 134 -0.840 7.408 -3.150 1.00 10.00 H new ATOM 0 HA VAL A 134 -0.183 6.405 -5.831 1.00 10.00 H new ATOM 0 HB VAL A 134 1.165 5.381 -3.811 1.00 10.00 H new ATOM 0 HG11 VAL A 134 0.071 3.217 -3.176 1.00 10.00 H new ATOM 0 HG12 VAL A 134 -0.822 4.639 -2.588 1.00 10.00 H new ATOM 0 HG13 VAL A 134 -1.399 3.757 -4.021 1.00 10.00 H new ATOM 0 HG21 VAL A 134 1.382 3.268 -5.071 1.00 10.00 H new ATOM 0 HG22 VAL A 134 0.009 3.766 -6.088 1.00 10.00 H new ATOM 0 HG23 VAL A 134 1.514 4.715 -6.098 1.00 10.00 H new ATOM 886 N ASN A 135 -2.560 5.749 -5.975 1.00 10.00 N ATOM 887 CA ASN A 135 -3.956 5.385 -6.132 1.00 10.00 C ATOM 888 C ASN A 135 -4.076 3.934 -5.675 1.00 10.00 C ATOM 889 O ASN A 135 -3.372 3.081 -6.209 1.00 10.00 O ATOM 890 CB ASN A 135 -4.342 5.571 -7.608 1.00 10.00 C ATOM 891 CG ASN A 135 -5.723 5.021 -7.971 1.00 10.00 C ATOM 892 OD1 ASN A 135 -6.075 3.894 -7.633 1.00 10.00 O ATOM 893 ND2 ASN A 135 -6.515 5.794 -8.707 1.00 10.00 N ATOM 0 H ASN A 135 -2.045 5.761 -6.855 1.00 10.00 H new ATOM 0 HA ASN A 135 -4.632 6.004 -5.541 1.00 10.00 H new ATOM 0 HB2 ASN A 135 -4.312 6.634 -7.848 1.00 10.00 H new ATOM 0 HB3 ASN A 135 -3.594 5.082 -8.232 1.00 10.00 H new ATOM 0 HD21 ASN A 135 -7.431 5.454 -9.000 1.00 10.00 H new ATOM 0 HD22 ASN A 135 -6.207 6.728 -8.979 1.00 10.00 H new ATOM 900 N TYR A 136 -4.936 3.653 -4.695 1.00 10.00 N ATOM 901 CA TYR A 136 -5.230 2.327 -4.176 1.00 10.00 C ATOM 902 C TYR A 136 -5.339 1.281 -5.292 1.00 10.00 C ATOM 903 O TYR A 136 -4.604 0.290 -5.312 1.00 10.00 O ATOM 904 CB TYR A 136 -6.502 2.477 -3.353 1.00 10.00 C ATOM 905 CG TYR A 136 -7.133 1.184 -2.906 1.00 10.00 C ATOM 906 CD1 TYR A 136 -7.945 0.426 -3.771 1.00 10.00 C ATOM 907 CD2 TYR A 136 -7.088 0.862 -1.549 1.00 10.00 C ATOM 908 CE1 TYR A 136 -8.628 -0.702 -3.293 1.00 10.00 C ATOM 909 CE2 TYR A 136 -7.931 -0.138 -1.058 1.00 10.00 C ATOM 910 CZ TYR A 136 -8.647 -0.970 -1.916 1.00 10.00 C ATOM 911 OH TYR A 136 -9.418 -1.960 -1.385 1.00 10.00 O ATOM 0 H TYR A 136 -5.469 4.383 -4.222 1.00 10.00 H new ATOM 0 HA TYR A 136 -4.421 1.950 -3.551 1.00 10.00 H new ATOM 0 HB2 TYR A 136 -6.276 3.077 -2.471 1.00 10.00 H new ATOM 0 HB3 TYR A 136 -7.232 3.035 -3.940 1.00 10.00 H new ATOM 0 HD1 TYR A 136 -8.042 0.714 -4.807 1.00 10.00 H new ATOM 0 HD2 TYR A 136 -6.410 1.379 -0.887 1.00 10.00 H new ATOM 0 HE1 TYR A 136 -9.137 -1.361 -3.981 1.00 10.00 H new ATOM 0 HE2 TYR A 136 -8.030 -0.269 0.009 1.00 10.00 H new ATOM 0 HH TYR A 136 -9.935 -1.604 -0.633 1.00 10.00 H new ATOM 921 N GLU A 137 -6.268 1.509 -6.220 1.00 10.00 N ATOM 922 CA GLU A 137 -6.681 0.511 -7.190 1.00 10.00 C ATOM 923 C GLU A 137 -5.542 0.293 -8.181 1.00 10.00 C ATOM 924 O GLU A 137 -5.101 -0.830 -8.427 1.00 10.00 O ATOM 925 CB GLU A 137 -7.961 0.986 -7.896 1.00 10.00 C ATOM 926 CG GLU A 137 -8.740 -0.202 -8.473 1.00 10.00 C ATOM 927 CD GLU A 137 -9.682 0.241 -9.586 1.00 10.00 C ATOM 928 OE1 GLU A 137 -10.536 1.106 -9.297 1.00 10.00 O ATOM 929 OE2 GLU A 137 -9.508 -0.277 -10.712 1.00 10.00 O ATOM 0 H GLU A 137 -6.755 2.400 -6.315 1.00 10.00 H new ATOM 0 HA GLU A 137 -6.901 -0.437 -6.700 1.00 10.00 H new ATOM 0 HB2 GLU A 137 -8.589 1.530 -7.191 1.00 10.00 H new ATOM 0 HB3 GLU A 137 -7.704 1.680 -8.696 1.00 10.00 H new ATOM 0 HG2 GLU A 137 -8.042 -0.945 -8.859 1.00 10.00 H new ATOM 0 HG3 GLU A 137 -9.312 -0.684 -7.680 1.00 10.00 H new ATOM 936 N GLU A 138 -5.044 1.400 -8.730 1.00 10.00 N ATOM 937 CA GLU A 138 -3.986 1.366 -9.721 1.00 10.00 C ATOM 938 C GLU A 138 -2.725 0.750 -9.105 1.00 10.00 C ATOM 939 O GLU A 138 -2.033 -0.040 -9.744 1.00 10.00 O ATOM 940 CB GLU A 138 -3.797 2.778 -10.294 1.00 10.00 C ATOM 941 CG GLU A 138 -3.257 2.781 -11.731 1.00 10.00 C ATOM 942 CD GLU A 138 -3.756 4.006 -12.488 1.00 10.00 C ATOM 943 OE1 GLU A 138 -3.309 5.116 -12.126 1.00 10.00 O ATOM 944 OE2 GLU A 138 -4.601 3.810 -13.389 1.00 10.00 O ATOM 0 H GLU A 138 -5.366 2.339 -8.497 1.00 10.00 H new ATOM 0 HA GLU A 138 -4.242 0.725 -10.565 1.00 10.00 H new ATOM 0 HB2 GLU A 138 -4.752 3.303 -10.271 1.00 10.00 H new ATOM 0 HB3 GLU A 138 -3.112 3.334 -9.654 1.00 10.00 H new ATOM 0 HG2 GLU A 138 -2.167 2.775 -11.716 1.00 10.00 H new ATOM 0 HG3 GLU A 138 -3.574 1.874 -12.246 1.00 10.00 H new ATOM 951 N PHE A 139 -2.443 1.043 -7.833 1.00 10.00 N ATOM 952 CA PHE A 139 -1.302 0.440 -7.162 1.00 10.00 C ATOM 953 C PHE A 139 -1.458 -1.065 -7.053 1.00 10.00 C ATOM 954 O PHE A 139 -0.565 -1.827 -7.428 1.00 10.00 O ATOM 955 CB PHE A 139 -1.082 1.025 -5.767 1.00 10.00 C ATOM 956 CG PHE A 139 0.204 0.586 -5.083 1.00 10.00 C ATOM 957 CD1 PHE A 139 1.298 0.071 -5.812 1.00 10.00 C ATOM 958 CD2 PHE A 139 0.287 0.655 -3.681 1.00 10.00 C ATOM 959 CE1 PHE A 139 2.398 -0.483 -5.145 1.00 10.00 C ATOM 960 CE2 PHE A 139 1.412 0.141 -3.014 1.00 10.00 C ATOM 961 CZ PHE A 139 2.448 -0.457 -3.746 1.00 10.00 C ATOM 0 H PHE A 139 -2.985 1.687 -7.257 1.00 10.00 H new ATOM 0 HA PHE A 139 -0.430 0.668 -7.775 1.00 10.00 H new ATOM 0 HB2 PHE A 139 -1.084 2.113 -5.841 1.00 10.00 H new ATOM 0 HB3 PHE A 139 -1.926 0.747 -5.135 1.00 10.00 H new ATOM 0 HD1 PHE A 139 1.287 0.104 -6.891 1.00 10.00 H new ATOM 0 HD2 PHE A 139 -0.516 1.104 -3.115 1.00 10.00 H new ATOM 0 HE1 PHE A 139 3.205 -0.929 -5.708 1.00 10.00 H new ATOM 0 HE2 PHE A 139 1.479 0.206 -1.938 1.00 10.00 H new ATOM 0 HZ PHE A 139 3.287 -0.899 -3.229 1.00 10.00 H new ATOM 971 N ALA A 140 -2.608 -1.490 -6.535 1.00 10.00 N ATOM 972 CA ALA A 140 -2.916 -2.900 -6.456 1.00 10.00 C ATOM 973 C ALA A 140 -2.727 -3.542 -7.832 1.00 10.00 C ATOM 974 O ALA A 140 -2.109 -4.596 -7.927 1.00 10.00 O ATOM 975 CB ALA A 140 -4.341 -3.054 -5.939 1.00 10.00 C ATOM 0 H ALA A 140 -3.334 -0.875 -6.167 1.00 10.00 H new ATOM 0 HA ALA A 140 -2.244 -3.411 -5.766 1.00 10.00 H new ATOM 0 HB1 ALA A 140 -4.592 -4.113 -5.873 1.00 10.00 H new ATOM 0 HB2 ALA A 140 -4.421 -2.600 -4.951 1.00 10.00 H new ATOM 0 HB3 ALA A 140 -5.031 -2.560 -6.623 1.00 10.00 H new ATOM 981 N ARG A 141 -3.188 -2.888 -8.903 1.00 10.00 N ATOM 982 CA ARG A 141 -2.935 -3.337 -10.268 1.00 10.00 C ATOM 983 C ARG A 141 -1.440 -3.585 -10.509 1.00 10.00 C ATOM 984 O ARG A 141 -1.067 -4.660 -10.978 1.00 10.00 O ATOM 985 CB ARG A 141 -3.517 -2.345 -11.284 1.00 10.00 C ATOM 986 CG ARG A 141 -3.670 -2.998 -12.659 1.00 10.00 C ATOM 987 CD ARG A 141 -4.191 -1.981 -13.682 1.00 10.00 C ATOM 988 NE ARG A 141 -4.298 -2.595 -15.014 1.00 10.00 N ATOM 989 CZ ARG A 141 -5.279 -3.423 -15.409 1.00 10.00 C ATOM 990 NH1 ARG A 141 -6.312 -3.670 -14.595 1.00 10.00 N ATOM 991 NH2 ARG A 141 -5.217 -4.001 -16.613 1.00 10.00 N ATOM 0 H ARG A 141 -3.745 -2.035 -8.844 1.00 10.00 H new ATOM 0 HA ARG A 141 -3.443 -4.291 -10.408 1.00 10.00 H new ATOM 0 HB2 ARG A 141 -4.487 -1.989 -10.936 1.00 10.00 H new ATOM 0 HB3 ARG A 141 -2.867 -1.474 -11.361 1.00 10.00 H new ATOM 0 HG2 ARG A 141 -2.710 -3.395 -12.989 1.00 10.00 H new ATOM 0 HG3 ARG A 141 -4.358 -3.841 -12.593 1.00 10.00 H new ATOM 0 HD2 ARG A 141 -5.166 -1.608 -13.368 1.00 10.00 H new ATOM 0 HD3 ARG A 141 -3.520 -1.123 -13.724 1.00 10.00 H new ATOM 0 HE ARG A 141 -3.569 -2.374 -15.692 1.00 10.00 H new ATOM 0 HH11 ARG A 141 -6.354 -3.230 -13.676 1.00 10.00 H new ATOM 0 HH12 ARG A 141 -7.058 -4.299 -14.894 1.00 10.00 H new ATOM 0 HH21 ARG A 141 -4.426 -3.813 -17.229 1.00 10.00 H new ATOM 0 HH22 ARG A 141 -5.961 -4.630 -16.916 1.00 10.00 H new ATOM 1005 N MET A 142 -0.569 -2.628 -10.172 1.00 10.00 N ATOM 1006 CA MET A 142 0.871 -2.841 -10.328 1.00 10.00 C ATOM 1007 C MET A 142 1.310 -4.097 -9.566 1.00 10.00 C ATOM 1008 O MET A 142 1.996 -4.947 -10.123 1.00 10.00 O ATOM 1009 CB MET A 142 1.711 -1.651 -9.854 1.00 10.00 C ATOM 1010 CG MET A 142 1.357 -0.296 -10.485 1.00 10.00 C ATOM 1011 SD MET A 142 1.850 -0.055 -12.210 1.00 10.00 S ATOM 1012 CE MET A 142 3.623 0.218 -11.995 1.00 10.00 C ATOM 0 H MET A 142 -0.830 -1.716 -9.797 1.00 10.00 H new ATOM 0 HA MET A 142 1.045 -2.962 -11.397 1.00 10.00 H new ATOM 0 HB2 MET A 142 1.609 -1.565 -8.772 1.00 10.00 H new ATOM 0 HB3 MET A 142 2.760 -1.865 -10.060 1.00 10.00 H new ATOM 0 HG2 MET A 142 0.278 -0.159 -10.416 1.00 10.00 H new ATOM 0 HG3 MET A 142 1.817 0.490 -9.886 1.00 10.00 H new ATOM 0 HE1 MET A 142 3.917 1.128 -12.518 1.00 10.00 H new ATOM 0 HE2 MET A 142 3.849 0.321 -10.934 1.00 10.00 H new ATOM 0 HE3 MET A 142 4.174 -0.630 -12.403 1.00 10.00 H new ATOM 1022 N LEU A 143 0.905 -4.227 -8.298 1.00 10.00 N ATOM 1023 CA LEU A 143 1.196 -5.389 -7.473 1.00 10.00 C ATOM 1024 C LEU A 143 0.411 -6.646 -7.871 1.00 10.00 C ATOM 1025 O LEU A 143 0.659 -7.727 -7.342 1.00 10.00 O ATOM 1026 CB LEU A 143 1.080 -4.975 -5.993 1.00 10.00 C ATOM 1027 CG LEU A 143 2.454 -4.621 -5.382 1.00 10.00 C ATOM 1028 CD1 LEU A 143 2.946 -5.853 -4.641 1.00 10.00 C ATOM 1029 CD2 LEU A 143 3.577 -4.176 -6.332 1.00 10.00 C ATOM 0 H LEU A 143 0.358 -3.514 -7.815 1.00 10.00 H new ATOM 0 HA LEU A 143 2.222 -5.713 -7.647 1.00 10.00 H new ATOM 0 HB2 LEU A 143 0.413 -4.117 -5.908 1.00 10.00 H new ATOM 0 HB3 LEU A 143 0.628 -5.787 -5.424 1.00 10.00 H new ATOM 0 HG LEU A 143 2.261 -3.743 -4.766 1.00 10.00 H new ATOM 0 HD11 LEU A 143 3.918 -5.644 -4.193 1.00 10.00 H new ATOM 0 HD12 LEU A 143 2.234 -6.115 -3.858 1.00 10.00 H new ATOM 0 HD13 LEU A 143 3.040 -6.684 -5.340 1.00 10.00 H new ATOM 0 HD21 LEU A 143 4.478 -3.963 -5.756 1.00 10.00 H new ATOM 0 HD22 LEU A 143 3.784 -4.971 -7.048 1.00 10.00 H new ATOM 0 HD23 LEU A 143 3.267 -3.278 -6.866 1.00 10.00 H new ATOM 1041 N ALA A 144 -0.483 -6.551 -8.850 1.00 10.00 N ATOM 1042 CA ALA A 144 -0.980 -7.696 -9.602 1.00 10.00 C ATOM 1043 C ALA A 144 0.045 -8.087 -10.663 1.00 10.00 C ATOM 1044 O ALA A 144 0.365 -9.270 -10.804 1.00 10.00 O ATOM 1045 CB ALA A 144 -2.315 -7.346 -10.255 1.00 10.00 C ATOM 0 H ALA A 144 -0.888 -5.663 -9.147 1.00 10.00 H new ATOM 0 HA ALA A 144 -1.134 -8.539 -8.928 1.00 10.00 H new ATOM 0 HB1 ALA A 144 -2.682 -8.205 -10.816 1.00 10.00 H new ATOM 0 HB2 ALA A 144 -3.038 -7.080 -9.484 1.00 10.00 H new ATOM 0 HB3 ALA A 144 -2.179 -6.502 -10.932 1.00 10.00 H new ATOM 1051 N GLN A 145 0.533 -7.061 -11.375 1.00 10.00 N ATOM 1052 CA GLN A 145 1.437 -7.120 -12.513 1.00 10.00 C ATOM 1053 C GLN A 145 0.825 -8.034 -13.586 1.00 10.00 C ATOM 1054 O GLN A 145 1.420 -9.056 -13.937 1.00 10.00 O ATOM 1055 CB GLN A 145 2.840 -7.591 -12.089 1.00 10.00 C ATOM 1056 CG GLN A 145 3.861 -7.337 -13.215 1.00 10.00 C ATOM 1057 CD GLN A 145 4.834 -8.493 -13.441 1.00 10.00 C ATOM 1058 OE1 GLN A 145 5.096 -9.301 -12.555 1.00 10.00 O ATOM 1059 NE2 GLN A 145 5.407 -8.576 -14.640 1.00 10.00 N ATOM 0 H GLN A 145 0.282 -6.099 -11.146 1.00 10.00 H new ATOM 0 HA GLN A 145 1.563 -6.121 -12.931 1.00 10.00 H new ATOM 0 HB2 GLN A 145 3.148 -7.065 -11.186 1.00 10.00 H new ATOM 0 HB3 GLN A 145 2.815 -8.653 -11.846 1.00 10.00 H new ATOM 0 HG2 GLN A 145 3.323 -7.141 -14.143 1.00 10.00 H new ATOM 0 HG3 GLN A 145 4.430 -6.437 -12.980 1.00 10.00 H new ATOM 0 HE21 GLN A 145 5.176 -7.895 -15.364 1.00 10.00 H new ATOM 0 HE22 GLN A 145 6.076 -9.320 -14.835 1.00 10.00 H new ATOM 1068 N GLU A 146 -0.361 -7.671 -14.080 1.00 10.00 N ATOM 1069 CA GLU A 146 -1.180 -8.507 -14.950 1.00 10.00 C ATOM 1070 C GLU A 146 -1.416 -9.883 -14.293 1.00 10.00 C ATOM 1071 O GLU A 146 -1.428 -10.911 -15.004 1.00 10.00 O ATOM 1072 CB GLU A 146 -0.576 -8.561 -16.368 1.00 10.00 C ATOM 1073 CG GLU A 146 -0.678 -7.229 -17.142 1.00 10.00 C ATOM 1074 CD GLU A 146 -0.008 -6.049 -16.445 1.00 10.00 C ATOM 1075 OE1 GLU A 146 1.227 -5.928 -16.583 1.00 10.00 O ATOM 1076 OE2 GLU A 146 -0.753 -5.286 -15.784 1.00 10.00 O ATOM 1077 OXT GLU A 146 -1.625 -9.908 -13.056 1.00 10.00 O ATOM 0 H GLU A 146 -0.785 -6.765 -13.879 1.00 10.00 H new ATOM 0 HA GLU A 146 -2.170 -8.070 -15.077 1.00 10.00 H new ATOM 0 HB2 GLU A 146 0.473 -8.848 -16.295 1.00 10.00 H new ATOM 0 HB3 GLU A 146 -1.081 -9.341 -16.938 1.00 10.00 H new ATOM 0 HG2 GLU A 146 -0.228 -7.358 -18.127 1.00 10.00 H new ATOM 0 HG3 GLU A 146 -1.730 -6.993 -17.301 1.00 10.00 H new TER 1084 GLU A 146