USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1011 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 115 THR OG1 : rot 180:sc= 0.395 USER MOD Set 1.2: A 119 LYS NZ :NH3+ -158:sc= 0.455 (180deg=0) USER MOD Set 2.1: A 47 GLN : amide:sc= 0.209 K(o=0.21,f=-1.5!) USER MOD Set 2.2: A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 165:sc=-0.00582 (180deg=-0.226) USER MOD Single : A 1 MET N :NH3+ 133:sc= 1.38 (180deg=-0.164) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 155:sc= 1.25 (180deg=1.17) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.00515 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= 0.44 K(o=0.44,f=-0.3) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -1.39 K(o=-1.4,f=-6.6!) USER MOD Single : A 32 ASN : amide:sc=-0.00207 K(o=-0.0021,f=-0.67) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 45 LYS NZ :NH3+ -121:sc= 0.0413 (180deg=0) USER MOD Single : A 51 TYR OH : rot 5:sc= -0.0417 USER MOD Single : A 56 SER OG : rot 78:sc= 0.552 USER MOD Single : A 59 ASN : amide:sc= -0.0295 K(o=-0.029,f=-2.7!) USER MOD Single : A 60 MET CE :methyl 172:sc= -0.972 (180deg=-1.09) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 78:sc= 1.25 USER MOD Single : A 79 SER OG : rot -24:sc= 0.023 USER MOD Single : A 85 MET CE :methyl 164:sc= -0.408 (180deg=-0.906) USER MOD Single : A 87 THR OG1 : rot 100:sc= 1.29 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -166:sc=-0.00217 (180deg=-0.127) USER MOD Single : A 94 ASN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 104 SER OG : rot -59:sc= 1.28 USER MOD Single : A 106 TYR OH : rot -22:sc= 1.17 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl -144:sc= -0.125 (180deg=-0.652) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.776 -18.362 1.275 1.00 0.00 N ATOM 2 CA MET A 1 21.532 -17.906 1.906 1.00 0.00 C ATOM 3 C MET A 1 21.226 -16.492 1.445 1.00 0.00 C ATOM 4 O MET A 1 22.027 -15.584 1.676 1.00 0.00 O ATOM 5 CB MET A 1 21.568 -17.937 3.442 1.00 0.00 C ATOM 6 CG MET A 1 21.997 -19.268 4.066 1.00 0.00 C ATOM 7 SD MET A 1 23.773 -19.627 3.979 1.00 0.00 S ATOM 8 CE MET A 1 24.377 -18.426 5.197 1.00 0.00 C ATOM 0 H1 MET A 1 23.391 -18.796 1.993 1.00 0.00 H new ATOM 0 H2 MET A 1 22.555 -19.063 0.539 1.00 0.00 H new ATOM 0 H3 MET A 1 23.265 -17.551 0.845 1.00 0.00 H new ATOM 0 HA MET A 1 20.754 -18.604 1.597 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.248 -17.158 3.788 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.576 -17.684 3.816 1.00 0.00 H new ATOM 0 HG2 MET A 1 21.692 -19.275 5.113 1.00 0.00 H new ATOM 0 HG3 MET A 1 21.455 -20.074 3.571 1.00 0.00 H new ATOM 0 HE1 MET A 1 25.401 -18.674 5.476 1.00 0.00 H new ATOM 0 HE2 MET A 1 24.351 -17.425 4.765 1.00 0.00 H new ATOM 0 HE3 MET A 1 23.743 -18.456 6.083 1.00 0.00 H new ATOM 20 N ALA A 2 20.054 -16.293 0.846 1.00 0.00 N ATOM 21 CA ALA A 2 19.445 -14.994 0.607 1.00 0.00 C ATOM 22 C ALA A 2 18.071 -14.980 1.283 1.00 0.00 C ATOM 23 O ALA A 2 17.519 -16.035 1.619 1.00 0.00 O ATOM 24 CB ALA A 2 19.338 -14.750 -0.901 1.00 0.00 C ATOM 0 H ALA A 2 19.483 -17.065 0.502 1.00 0.00 H new ATOM 0 HA ALA A 2 20.052 -14.192 1.027 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.882 -13.777 -1.081 1.00 0.00 H new ATOM 0 HB2 ALA A 2 20.333 -14.771 -1.345 1.00 0.00 H new ATOM 0 HB3 ALA A 2 18.723 -15.528 -1.353 1.00 0.00 H new ATOM 30 N ASP A 3 17.515 -13.792 1.496 1.00 0.00 N ATOM 31 CA ASP A 3 16.167 -13.646 2.040 1.00 0.00 C ATOM 32 C ASP A 3 15.144 -13.907 0.940 1.00 0.00 C ATOM 33 O ASP A 3 15.445 -13.783 -0.251 1.00 0.00 O ATOM 34 CB ASP A 3 15.950 -12.230 2.595 1.00 0.00 C ATOM 35 CG ASP A 3 16.546 -12.061 3.984 1.00 0.00 C ATOM 36 OD1 ASP A 3 16.002 -12.674 4.932 1.00 0.00 O ATOM 37 OD2 ASP A 3 17.545 -11.322 4.116 1.00 0.00 O ATOM 0 H ASP A 3 17.982 -12.907 1.298 1.00 0.00 H new ATOM 0 HA ASP A 3 16.045 -14.365 2.850 1.00 0.00 H new ATOM 0 HB2 ASP A 3 16.399 -11.503 1.918 1.00 0.00 H new ATOM 0 HB3 ASP A 3 14.882 -12.015 2.631 1.00 0.00 H new ATOM 42 N LYS A 4 13.892 -14.143 1.336 1.00 0.00 N ATOM 43 CA LYS A 4 12.721 -13.987 0.471 1.00 0.00 C ATOM 44 C LYS A 4 12.570 -12.556 -0.054 1.00 0.00 C ATOM 45 O LYS A 4 11.784 -12.354 -0.979 1.00 0.00 O ATOM 46 CB LYS A 4 11.462 -14.469 1.217 1.00 0.00 C ATOM 47 CG LYS A 4 11.102 -13.664 2.482 1.00 0.00 C ATOM 48 CD LYS A 4 10.178 -14.474 3.406 1.00 0.00 C ATOM 49 CE LYS A 4 9.967 -13.785 4.758 1.00 0.00 C ATOM 50 NZ LYS A 4 8.790 -12.893 4.779 1.00 0.00 N ATOM 0 H LYS A 4 13.660 -14.452 2.280 1.00 0.00 H new ATOM 0 HA LYS A 4 12.861 -14.609 -0.413 1.00 0.00 H new ATOM 0 HB2 LYS A 4 10.616 -14.434 0.530 1.00 0.00 H new ATOM 0 HB3 LYS A 4 11.602 -15.513 1.497 1.00 0.00 H new ATOM 0 HG2 LYS A 4 12.012 -13.395 3.017 1.00 0.00 H new ATOM 0 HG3 LYS A 4 10.612 -12.733 2.198 1.00 0.00 H new ATOM 0 HD2 LYS A 4 9.214 -14.618 2.918 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.604 -15.464 3.567 1.00 0.00 H new ATOM 0 HE2 LYS A 4 9.853 -14.544 5.532 1.00 0.00 H new ATOM 0 HE3 LYS A 4 10.857 -13.207 5.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 8.701 -12.457 5.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 8.906 -12.149 4.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 7.933 -13.444 4.571 1.00 0.00 H new ATOM 64 N GLU A 5 13.313 -11.600 0.521 1.00 0.00 N ATOM 65 CA GLU A 5 13.427 -10.180 0.199 1.00 0.00 C ATOM 66 C GLU A 5 12.055 -9.594 -0.133 1.00 0.00 C ATOM 67 O GLU A 5 11.828 -9.037 -1.209 1.00 0.00 O ATOM 68 CB GLU A 5 14.530 -9.966 -0.850 1.00 0.00 C ATOM 69 CG GLU A 5 15.086 -8.537 -0.780 1.00 0.00 C ATOM 70 CD GLU A 5 16.215 -8.331 -1.786 1.00 0.00 C ATOM 71 OE1 GLU A 5 15.919 -8.071 -2.974 1.00 0.00 O ATOM 72 OE2 GLU A 5 17.406 -8.388 -1.393 1.00 0.00 O ATOM 0 H GLU A 5 13.914 -11.835 1.311 1.00 0.00 H new ATOM 0 HA GLU A 5 13.756 -9.606 1.065 1.00 0.00 H new ATOM 0 HB2 GLU A 5 15.336 -10.682 -0.687 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.131 -10.156 -1.846 1.00 0.00 H new ATOM 0 HG2 GLU A 5 14.286 -7.823 -0.977 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.452 -8.336 0.227 1.00 0.00 H new ATOM 79 N LEU A 6 11.108 -9.841 0.780 1.00 0.00 N ATOM 80 CA LEU A 6 9.697 -9.533 0.600 1.00 0.00 C ATOM 81 C LEU A 6 9.535 -8.025 0.445 1.00 0.00 C ATOM 82 O LEU A 6 9.799 -7.271 1.384 1.00 0.00 O ATOM 83 CB LEU A 6 8.858 -10.106 1.749 1.00 0.00 C ATOM 84 CG LEU A 6 7.367 -9.777 1.538 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.516 -11.039 1.654 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.877 -8.716 2.526 1.00 0.00 C ATOM 0 H LEU A 6 11.313 -10.270 1.682 1.00 0.00 H new ATOM 0 HA LEU A 6 9.325 -10.008 -0.308 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.995 -11.186 1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 6 9.198 -9.692 2.698 1.00 0.00 H new ATOM 0 HG LEU A 6 7.262 -9.371 0.532 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.467 -10.786 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.829 -11.759 0.898 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.644 -11.474 2.645 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.822 -8.511 2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.007 -9.080 3.545 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.453 -7.800 2.392 1.00 0.00 H new ATOM 98 N LYS A 7 9.159 -7.611 -0.764 1.00 0.00 N ATOM 99 CA LYS A 7 9.302 -6.239 -1.220 1.00 0.00 C ATOM 100 C LYS A 7 8.047 -5.436 -0.891 1.00 0.00 C ATOM 101 O LYS A 7 6.931 -5.954 -1.029 1.00 0.00 O ATOM 102 CB LYS A 7 9.566 -6.269 -2.732 1.00 0.00 C ATOM 103 CG LYS A 7 10.216 -4.979 -3.240 1.00 0.00 C ATOM 104 CD LYS A 7 11.736 -4.979 -3.021 1.00 0.00 C ATOM 105 CE LYS A 7 12.449 -5.568 -4.243 1.00 0.00 C ATOM 106 NZ LYS A 7 13.772 -4.952 -4.457 1.00 0.00 N ATOM 0 H LYS A 7 8.742 -8.230 -1.459 1.00 0.00 H new ATOM 0 HA LYS A 7 10.135 -5.752 -0.713 1.00 0.00 H new ATOM 0 HB2 LYS A 7 10.212 -7.115 -2.968 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.625 -6.430 -3.259 1.00 0.00 H new ATOM 0 HG2 LYS A 7 10.002 -4.859 -4.302 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.775 -4.124 -2.727 1.00 0.00 H new ATOM 0 HD2 LYS A 7 12.085 -3.962 -2.843 1.00 0.00 H new ATOM 0 HD3 LYS A 7 11.982 -5.560 -2.132 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.566 -6.644 -4.112 1.00 0.00 H new ATOM 0 HE3 LYS A 7 11.832 -5.421 -5.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.383 -5.613 -4.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.662 -4.076 -5.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 14.205 -4.732 -3.538 1.00 0.00 H new ATOM 120 N PHE A 8 8.223 -4.162 -0.535 1.00 0.00 N ATOM 121 CA PHE A 8 7.152 -3.256 -0.156 1.00 0.00 C ATOM 122 C PHE A 8 7.001 -2.185 -1.231 1.00 0.00 C ATOM 123 O PHE A 8 7.805 -1.256 -1.271 1.00 0.00 O ATOM 124 CB PHE A 8 7.501 -2.650 1.212 1.00 0.00 C ATOM 125 CG PHE A 8 6.943 -3.427 2.380 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.541 -4.616 2.831 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.787 -2.948 3.010 1.00 0.00 C ATOM 128 CE1 PHE A 8 6.966 -5.309 3.911 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.221 -3.628 4.098 1.00 0.00 C ATOM 130 CZ PHE A 8 5.819 -4.813 4.555 1.00 0.00 C ATOM 0 H PHE A 8 9.144 -3.725 -0.504 1.00 0.00 H new ATOM 0 HA PHE A 8 6.198 -3.778 -0.073 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.585 -2.594 1.309 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.124 -1.628 1.254 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.433 -4.994 2.353 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.324 -2.040 2.652 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.411 -6.233 4.250 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.334 -3.244 4.580 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.399 -5.342 5.398 1.00 0.00 H new ATOM 140 N LEU A 9 6.020 -2.303 -2.128 1.00 0.00 N ATOM 141 CA LEU A 9 5.790 -1.235 -3.097 1.00 0.00 C ATOM 142 C LEU A 9 5.131 -0.049 -2.397 1.00 0.00 C ATOM 143 O LEU A 9 4.254 -0.261 -1.557 1.00 0.00 O ATOM 144 CB LEU A 9 4.897 -1.734 -4.244 1.00 0.00 C ATOM 145 CG LEU A 9 4.851 -0.769 -5.443 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.224 -0.628 -6.120 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.832 -1.297 -6.454 1.00 0.00 C ATOM 0 H LEU A 9 5.391 -3.102 -2.203 1.00 0.00 H new ATOM 0 HA LEU A 9 6.746 -0.923 -3.517 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.259 -2.705 -4.581 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.885 -1.884 -3.868 1.00 0.00 H new ATOM 0 HG LEU A 9 4.563 0.218 -5.081 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.146 0.062 -6.961 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.947 -0.243 -5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.554 -1.603 -6.480 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.787 -0.624 -7.310 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.132 -2.290 -6.788 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.850 -1.353 -5.985 1.00 0.00 H new ATOM 159 N VAL A 10 5.502 1.171 -2.790 1.00 0.00 N ATOM 160 CA VAL A 10 4.867 2.423 -2.396 1.00 0.00 C ATOM 161 C VAL A 10 4.512 3.183 -3.692 1.00 0.00 C ATOM 162 O VAL A 10 5.394 3.766 -4.321 1.00 0.00 O ATOM 163 CB VAL A 10 5.778 3.228 -1.431 1.00 0.00 C ATOM 164 CG1 VAL A 10 4.994 4.409 -0.835 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.329 2.397 -0.246 1.00 0.00 C ATOM 0 H VAL A 10 6.290 1.316 -3.421 1.00 0.00 H new ATOM 0 HA VAL A 10 3.951 2.247 -1.832 1.00 0.00 H new ATOM 0 HB VAL A 10 6.623 3.556 -2.037 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.639 4.970 -0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.655 5.063 -1.638 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.132 4.033 -0.285 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.956 3.030 0.382 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.498 2.010 0.344 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.921 1.566 -0.629 1.00 0.00 H new ATOM 175 N VAL A 11 3.257 3.135 -4.156 1.00 0.00 N ATOM 176 CA VAL A 11 2.790 3.926 -5.304 1.00 0.00 C ATOM 177 C VAL A 11 2.636 5.371 -4.824 1.00 0.00 C ATOM 178 O VAL A 11 1.601 5.748 -4.270 1.00 0.00 O ATOM 179 CB VAL A 11 1.500 3.357 -5.940 1.00 0.00 C ATOM 180 CG1 VAL A 11 1.341 3.869 -7.366 1.00 0.00 C ATOM 181 CG2 VAL A 11 1.447 1.820 -5.946 1.00 0.00 C ATOM 0 H VAL A 11 2.534 2.545 -3.745 1.00 0.00 H new ATOM 0 HA VAL A 11 3.520 3.881 -6.112 1.00 0.00 H new ATOM 0 HB VAL A 11 0.678 3.706 -5.315 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.429 3.460 -7.800 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.282 4.957 -7.357 1.00 0.00 H new ATOM 0 HG13 VAL A 11 2.198 3.557 -7.962 1.00 0.00 H new ATOM 0 HG21 VAL A 11 0.516 1.490 -6.406 1.00 0.00 H new ATOM 0 HG22 VAL A 11 2.291 1.429 -6.514 1.00 0.00 H new ATOM 0 HG23 VAL A 11 1.497 1.450 -4.922 1.00 0.00 H new ATOM 191 N ASP A 12 3.724 6.132 -4.905 1.00 0.00 N ATOM 192 CA ASP A 12 3.908 7.387 -4.199 1.00 0.00 C ATOM 193 C ASP A 12 3.448 8.588 -5.027 1.00 0.00 C ATOM 194 O ASP A 12 4.093 8.960 -6.010 1.00 0.00 O ATOM 195 CB ASP A 12 5.374 7.526 -3.791 1.00 0.00 C ATOM 196 CG ASP A 12 5.614 8.764 -2.936 1.00 0.00 C ATOM 197 OD1 ASP A 12 4.677 9.524 -2.608 1.00 0.00 O ATOM 198 OD2 ASP A 12 6.775 8.981 -2.557 1.00 0.00 O ATOM 0 H ASP A 12 4.525 5.880 -5.484 1.00 0.00 H new ATOM 0 HA ASP A 12 3.283 7.373 -3.306 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.682 6.638 -3.238 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.996 7.577 -4.685 1.00 0.00 H new ATOM 203 N ASP A 13 2.340 9.212 -4.633 1.00 0.00 N ATOM 204 CA ASP A 13 1.854 10.450 -5.245 1.00 0.00 C ATOM 205 C ASP A 13 2.677 11.685 -4.858 1.00 0.00 C ATOM 206 O ASP A 13 2.700 12.674 -5.592 1.00 0.00 O ATOM 207 CB ASP A 13 0.402 10.702 -4.820 1.00 0.00 C ATOM 208 CG ASP A 13 -0.133 12.003 -5.423 1.00 0.00 C ATOM 209 OD1 ASP A 13 -0.114 12.126 -6.669 1.00 0.00 O ATOM 210 OD2 ASP A 13 -0.546 12.922 -4.675 1.00 0.00 O ATOM 0 H ASP A 13 1.749 8.872 -3.875 1.00 0.00 H new ATOM 0 HA ASP A 13 1.943 10.309 -6.322 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.223 9.867 -5.137 1.00 0.00 H new ATOM 0 HB3 ASP A 13 0.342 10.750 -3.733 1.00 0.00 H new ATOM 215 N PHE A 14 3.366 11.658 -3.721 1.00 0.00 N ATOM 216 CA PHE A 14 3.801 12.864 -3.027 1.00 0.00 C ATOM 217 C PHE A 14 5.320 12.973 -2.853 1.00 0.00 C ATOM 218 O PHE A 14 5.794 14.024 -2.414 1.00 0.00 O ATOM 219 CB PHE A 14 3.025 12.879 -1.698 1.00 0.00 C ATOM 220 CG PHE A 14 3.121 14.122 -0.839 1.00 0.00 C ATOM 221 CD1 PHE A 14 2.993 15.400 -1.413 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.291 13.996 0.553 1.00 0.00 C ATOM 223 CE1 PHE A 14 3.089 16.543 -0.606 1.00 0.00 C ATOM 224 CE2 PHE A 14 3.391 15.144 1.361 1.00 0.00 C ATOM 225 CZ PHE A 14 3.304 16.418 0.776 1.00 0.00 C ATOM 0 H PHE A 14 3.639 10.794 -3.253 1.00 0.00 H new ATOM 0 HA PHE A 14 3.577 13.750 -3.622 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.972 12.708 -1.923 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.366 12.033 -1.102 1.00 0.00 H new ATOM 0 HD1 PHE A 14 2.821 15.501 -2.474 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.345 13.015 1.002 1.00 0.00 H new ATOM 0 HE1 PHE A 14 2.997 17.524 -1.049 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.534 15.046 2.427 1.00 0.00 H new ATOM 0 HZ PHE A 14 3.402 17.302 1.389 1.00 0.00 H new ATOM 235 N SER A 15 6.098 11.939 -3.197 1.00 0.00 N ATOM 236 CA SER A 15 7.548 11.785 -2.988 1.00 0.00 C ATOM 237 C SER A 15 7.857 11.634 -1.489 1.00 0.00 C ATOM 238 O SER A 15 8.396 10.631 -0.998 1.00 0.00 O ATOM 239 CB SER A 15 8.339 12.921 -3.654 1.00 0.00 C ATOM 240 OG SER A 15 7.881 13.174 -4.974 1.00 0.00 O ATOM 0 H SER A 15 5.702 11.124 -3.665 1.00 0.00 H new ATOM 0 HA SER A 15 7.878 10.869 -3.478 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.247 13.828 -3.056 1.00 0.00 H new ATOM 0 HB3 SER A 15 9.397 12.662 -3.679 1.00 0.00 H new ATOM 0 HG SER A 15 8.404 13.903 -5.368 1.00 0.00 H new ATOM 246 N THR A 16 7.456 12.634 -0.714 1.00 0.00 N ATOM 247 CA THR A 16 7.456 12.627 0.727 1.00 0.00 C ATOM 248 C THR A 16 6.659 11.433 1.276 1.00 0.00 C ATOM 249 O THR A 16 6.982 10.975 2.372 1.00 0.00 O ATOM 250 CB THR A 16 6.931 13.993 1.201 1.00 0.00 C ATOM 251 OG1 THR A 16 7.716 15.009 0.606 1.00 0.00 O ATOM 252 CG2 THR A 16 6.988 14.162 2.719 1.00 0.00 C ATOM 0 H THR A 16 7.107 13.511 -1.101 1.00 0.00 H new ATOM 0 HA THR A 16 8.464 12.491 1.119 1.00 0.00 H new ATOM 0 HB THR A 16 5.884 14.060 0.904 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.391 15.886 0.898 1.00 0.00 H new ATOM 0 HG21 THR A 16 6.604 15.145 2.990 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.380 13.392 3.194 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.020 14.070 3.057 1.00 0.00 H new ATOM 260 N MET A 17 5.687 10.857 0.547 1.00 0.00 N ATOM 261 CA MET A 17 5.040 9.646 1.035 1.00 0.00 C ATOM 262 C MET A 17 6.049 8.505 1.093 1.00 0.00 C ATOM 263 O MET A 17 6.000 7.751 2.059 1.00 0.00 O ATOM 264 CB MET A 17 3.800 9.226 0.223 1.00 0.00 C ATOM 265 CG MET A 17 2.649 8.821 1.147 1.00 0.00 C ATOM 266 SD MET A 17 1.892 10.217 2.028 1.00 0.00 S ATOM 267 CE MET A 17 0.668 10.707 0.781 1.00 0.00 C ATOM 0 H MET A 17 5.347 11.202 -0.351 1.00 0.00 H new ATOM 0 HA MET A 17 4.674 9.877 2.036 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.484 10.050 -0.417 1.00 0.00 H new ATOM 0 HB3 MET A 17 4.055 8.393 -0.432 1.00 0.00 H new ATOM 0 HG2 MET A 17 1.883 8.316 0.558 1.00 0.00 H new ATOM 0 HG3 MET A 17 3.017 8.100 1.876 1.00 0.00 H new ATOM 0 HE1 MET A 17 0.098 11.561 1.147 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.179 10.980 -0.142 1.00 0.00 H new ATOM 0 HE3 MET A 17 -0.009 9.875 0.589 1.00 0.00 H new ATOM 277 N ARG A 18 6.993 8.366 0.151 1.00 0.00 N ATOM 278 CA ARG A 18 7.954 7.265 0.217 1.00 0.00 C ATOM 279 C ARG A 18 9.021 7.582 1.256 1.00 0.00 C ATOM 280 O ARG A 18 9.448 6.653 1.934 1.00 0.00 O ATOM 281 CB ARG A 18 8.525 6.977 -1.179 1.00 0.00 C ATOM 282 CG ARG A 18 9.490 5.788 -1.277 1.00 0.00 C ATOM 283 CD ARG A 18 10.257 5.839 -2.606 1.00 0.00 C ATOM 284 NE ARG A 18 11.525 6.578 -2.485 1.00 0.00 N ATOM 285 CZ ARG A 18 12.455 6.661 -3.442 1.00 0.00 C ATOM 286 NH1 ARG A 18 12.173 6.367 -4.702 1.00 0.00 N ATOM 287 NH2 ARG A 18 13.694 7.026 -3.150 1.00 0.00 N ATOM 0 H ARG A 18 7.108 8.990 -0.648 1.00 0.00 H new ATOM 0 HA ARG A 18 7.461 6.348 0.539 1.00 0.00 H new ATOM 0 HB2 ARG A 18 7.693 6.802 -1.861 1.00 0.00 H new ATOM 0 HB3 ARG A 18 9.043 7.870 -1.530 1.00 0.00 H new ATOM 0 HG2 ARG A 18 10.191 5.809 -0.443 1.00 0.00 H new ATOM 0 HG3 ARG A 18 8.935 4.853 -1.204 1.00 0.00 H new ATOM 0 HD2 ARG A 18 10.461 4.824 -2.946 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.634 6.311 -3.366 1.00 0.00 H new ATOM 0 HE ARG A 18 11.707 7.062 -1.606 1.00 0.00 H new ATOM 0 HH11 ARG A 18 11.231 6.071 -4.958 1.00 0.00 H new ATOM 0 HH12 ARG A 18 12.898 6.437 -5.417 1.00 0.00 H new ATOM 0 HH21 ARG A 18 13.947 7.247 -2.187 1.00 0.00 H new ATOM 0 HH22 ARG A 18 14.395 7.086 -3.888 1.00 0.00 H new ATOM 301 N ARG A 19 9.405 8.856 1.454 1.00 0.00 N ATOM 302 CA ARG A 19 10.247 9.243 2.600 1.00 0.00 C ATOM 303 C ARG A 19 9.602 8.711 3.880 1.00 0.00 C ATOM 304 O ARG A 19 10.242 7.959 4.618 1.00 0.00 O ATOM 305 CB ARG A 19 10.451 10.770 2.728 1.00 0.00 C ATOM 306 CG ARG A 19 11.593 11.401 1.920 1.00 0.00 C ATOM 307 CD ARG A 19 11.390 11.363 0.411 1.00 0.00 C ATOM 308 NE ARG A 19 12.320 12.272 -0.284 1.00 0.00 N ATOM 309 CZ ARG A 19 13.211 11.954 -1.236 1.00 0.00 C ATOM 310 NH1 ARG A 19 13.263 10.729 -1.744 1.00 0.00 N ATOM 311 NH2 ARG A 19 14.048 12.882 -1.680 1.00 0.00 N ATOM 0 H ARG A 19 9.148 9.629 0.841 1.00 0.00 H new ATOM 0 HA ARG A 19 11.234 8.811 2.437 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.522 11.259 2.436 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.616 11.001 3.781 1.00 0.00 H new ATOM 0 HG2 ARG A 19 11.713 12.438 2.232 1.00 0.00 H new ATOM 0 HG3 ARG A 19 12.522 10.885 2.163 1.00 0.00 H new ATOM 0 HD2 ARG A 19 11.536 10.345 0.049 1.00 0.00 H new ATOM 0 HD3 ARG A 19 10.363 11.641 0.174 1.00 0.00 H new ATOM 0 HE ARG A 19 12.282 13.254 -0.010 1.00 0.00 H new ATOM 0 HH11 ARG A 19 12.619 10.011 -1.411 1.00 0.00 H new ATOM 0 HH12 ARG A 19 13.947 10.505 -2.467 1.00 0.00 H new ATOM 0 HH21 ARG A 19 14.011 13.827 -1.298 1.00 0.00 H new ATOM 0 HH22 ARG A 19 14.729 12.651 -2.403 1.00 0.00 H new ATOM 325 N ILE A 20 8.354 9.116 4.135 1.00 0.00 N ATOM 326 CA ILE A 20 7.610 8.731 5.323 1.00 0.00 C ATOM 327 C ILE A 20 7.486 7.214 5.345 1.00 0.00 C ATOM 328 O ILE A 20 8.075 6.610 6.225 1.00 0.00 O ATOM 329 CB ILE A 20 6.276 9.515 5.440 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.471 10.834 6.221 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.183 8.753 6.208 1.00 0.00 C ATOM 332 CD1 ILE A 20 7.480 11.816 5.627 1.00 0.00 C ATOM 0 H ILE A 20 7.831 9.729 3.509 1.00 0.00 H new ATOM 0 HA ILE A 20 8.145 9.013 6.230 1.00 0.00 H new ATOM 0 HB ILE A 20 5.970 9.679 4.407 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.506 11.335 6.297 1.00 0.00 H new ATOM 0 HG13 ILE A 20 6.784 10.590 7.236 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.279 9.360 6.251 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.966 7.815 5.697 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.528 8.544 7.220 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.536 12.705 6.256 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.461 11.344 5.577 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.163 12.101 4.624 1.00 0.00 H new ATOM 344 N VAL A 21 6.744 6.583 4.433 1.00 0.00 N ATOM 345 CA VAL A 21 6.389 5.167 4.503 1.00 0.00 C ATOM 346 C VAL A 21 7.650 4.306 4.625 1.00 0.00 C ATOM 347 O VAL A 21 7.652 3.395 5.452 1.00 0.00 O ATOM 348 CB VAL A 21 5.502 4.777 3.296 1.00 0.00 C ATOM 349 CG1 VAL A 21 5.233 3.267 3.206 1.00 0.00 C ATOM 350 CG2 VAL A 21 4.131 5.472 3.375 1.00 0.00 C ATOM 0 H VAL A 21 6.366 7.052 3.610 1.00 0.00 H new ATOM 0 HA VAL A 21 5.798 4.981 5.400 1.00 0.00 H new ATOM 0 HB VAL A 21 6.063 5.095 2.417 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.606 3.060 2.339 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.179 2.734 3.105 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.723 2.934 4.110 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.526 5.182 2.516 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.624 5.174 4.293 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.270 6.553 3.372 1.00 0.00 H new ATOM 360 N ARG A 22 8.733 4.603 3.884 1.00 0.00 N ATOM 361 CA ARG A 22 9.987 3.875 4.061 1.00 0.00 C ATOM 362 C ARG A 22 10.480 4.053 5.495 1.00 0.00 C ATOM 363 O ARG A 22 10.840 3.062 6.119 1.00 0.00 O ATOM 364 CB ARG A 22 11.069 4.337 3.072 1.00 0.00 C ATOM 365 CG ARG A 22 12.338 3.458 3.124 1.00 0.00 C ATOM 366 CD ARG A 22 13.646 4.262 3.131 1.00 0.00 C ATOM 367 NE ARG A 22 14.051 4.694 4.486 1.00 0.00 N ATOM 368 CZ ARG A 22 13.791 5.854 5.102 1.00 0.00 C ATOM 369 NH1 ARG A 22 13.256 6.886 4.463 1.00 0.00 N ATOM 370 NH2 ARG A 22 14.076 5.987 6.390 1.00 0.00 N ATOM 0 H ARG A 22 8.759 5.331 3.170 1.00 0.00 H new ATOM 0 HA ARG A 22 9.793 2.821 3.860 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.662 4.321 2.061 1.00 0.00 H new ATOM 0 HB3 ARG A 22 11.338 5.370 3.291 1.00 0.00 H new ATOM 0 HG2 ARG A 22 12.301 2.834 4.017 1.00 0.00 H new ATOM 0 HG3 ARG A 22 12.339 2.786 2.266 1.00 0.00 H new ATOM 0 HD2 ARG A 22 14.441 3.656 2.696 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.530 5.140 2.495 1.00 0.00 H new ATOM 0 HE ARG A 22 14.600 4.021 5.021 1.00 0.00 H new ATOM 0 HH11 ARG A 22 13.030 6.810 3.471 1.00 0.00 H new ATOM 0 HH12 ARG A 22 13.071 7.755 4.963 1.00 0.00 H new ATOM 0 HH21 ARG A 22 14.490 5.209 6.904 1.00 0.00 H new ATOM 0 HH22 ARG A 22 13.881 6.867 6.867 1.00 0.00 H new ATOM 384 N ASN A 23 10.515 5.284 6.024 1.00 0.00 N ATOM 385 CA ASN A 23 10.892 5.519 7.418 1.00 0.00 C ATOM 386 C ASN A 23 10.019 4.714 8.373 1.00 0.00 C ATOM 387 O ASN A 23 10.559 4.049 9.243 1.00 0.00 O ATOM 388 CB ASN A 23 10.863 7.003 7.814 1.00 0.00 C ATOM 389 CG ASN A 23 11.474 7.157 9.204 1.00 0.00 C ATOM 390 OD1 ASN A 23 12.687 7.010 9.365 1.00 0.00 O ATOM 391 ND2 ASN A 23 10.683 7.459 10.220 1.00 0.00 N ATOM 0 H ASN A 23 10.286 6.131 5.504 1.00 0.00 H new ATOM 0 HA ASN A 23 11.925 5.182 7.501 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.420 7.597 7.090 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.838 7.374 7.810 1.00 0.00 H new ATOM 0 HD21 ASN A 23 11.075 7.574 11.155 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.681 7.577 10.069 1.00 0.00 H new ATOM 398 N LEU A 24 8.693 4.743 8.219 1.00 0.00 N ATOM 399 CA LEU A 24 7.759 4.070 9.125 1.00 0.00 C ATOM 400 C LEU A 24 8.017 2.567 9.145 1.00 0.00 C ATOM 401 O LEU A 24 8.008 1.941 10.205 1.00 0.00 O ATOM 402 CB LEU A 24 6.294 4.310 8.726 1.00 0.00 C ATOM 403 CG LEU A 24 5.873 5.771 8.516 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.375 5.828 8.247 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.329 6.728 9.625 1.00 0.00 C ATOM 0 H LEU A 24 8.233 5.239 7.455 1.00 0.00 H new ATOM 0 HA LEU A 24 7.927 4.494 10.115 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.097 3.762 7.804 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.655 3.878 9.496 1.00 0.00 H new ATOM 0 HG LEU A 24 6.402 6.144 7.639 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.071 6.864 8.097 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.144 5.249 7.353 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.836 5.412 9.098 1.00 0.00 H new ATOM 0 HD21 LEU A 24 5.989 7.738 9.396 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.905 6.409 10.577 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.417 6.717 9.690 1.00 0.00 H new ATOM 417 N LEU A 25 8.239 1.995 7.963 1.00 0.00 N ATOM 418 CA LEU A 25 8.616 0.604 7.785 1.00 0.00 C ATOM 419 C LEU A 25 9.954 0.332 8.466 1.00 0.00 C ATOM 420 O LEU A 25 10.073 -0.648 9.195 1.00 0.00 O ATOM 421 CB LEU A 25 8.661 0.286 6.281 1.00 0.00 C ATOM 422 CG LEU A 25 7.285 -0.151 5.759 1.00 0.00 C ATOM 423 CD1 LEU A 25 7.215 -0.010 4.237 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.982 -1.605 6.153 1.00 0.00 C ATOM 0 H LEU A 25 8.158 2.504 7.083 1.00 0.00 H new ATOM 0 HA LEU A 25 7.879 -0.049 8.251 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.998 1.165 5.732 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.389 -0.504 6.096 1.00 0.00 H new ATOM 0 HG LEU A 25 6.538 0.500 6.214 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.232 -0.325 3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.383 1.031 3.960 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.981 -0.635 3.778 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.001 -1.889 5.771 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.741 -2.263 5.729 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.988 -1.697 7.239 1.00 0.00 H new ATOM 436 N LYS A 26 10.937 1.212 8.287 1.00 0.00 N ATOM 437 CA LYS A 26 12.239 1.098 8.927 1.00 0.00 C ATOM 438 C LYS A 26 12.155 1.203 10.447 1.00 0.00 C ATOM 439 O LYS A 26 13.013 0.607 11.100 1.00 0.00 O ATOM 440 CB LYS A 26 13.179 2.178 8.383 1.00 0.00 C ATOM 441 CG LYS A 26 13.633 1.913 6.942 1.00 0.00 C ATOM 442 CD LYS A 26 15.044 1.328 6.935 1.00 0.00 C ATOM 443 CE LYS A 26 15.525 1.096 5.500 1.00 0.00 C ATOM 444 NZ LYS A 26 16.950 0.730 5.473 1.00 0.00 N ATOM 0 H LYS A 26 10.848 2.032 7.687 1.00 0.00 H new ATOM 0 HA LYS A 26 12.629 0.108 8.693 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.676 3.144 8.427 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.056 2.245 9.027 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.943 1.223 6.456 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.613 2.840 6.370 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.727 2.005 7.448 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.056 0.387 7.485 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.934 0.305 5.038 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.367 1.998 4.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.251 0.578 4.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.513 1.497 5.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.094 -0.144 6.018 1.00 0.00 H new ATOM 458 N GLU A 27 11.183 1.928 11.017 1.00 0.00 N ATOM 459 CA GLU A 27 11.057 2.062 12.464 1.00 0.00 C ATOM 460 C GLU A 27 10.861 0.668 13.062 1.00 0.00 C ATOM 461 O GLU A 27 11.689 0.222 13.857 1.00 0.00 O ATOM 462 CB GLU A 27 9.903 2.991 12.923 1.00 0.00 C ATOM 463 CG GLU A 27 9.873 4.471 12.491 1.00 0.00 C ATOM 464 CD GLU A 27 11.051 5.353 12.934 1.00 0.00 C ATOM 465 OE1 GLU A 27 12.109 4.813 13.327 1.00 0.00 O ATOM 466 OE2 GLU A 27 10.894 6.603 12.925 1.00 0.00 O ATOM 0 H GLU A 27 10.471 2.432 10.489 1.00 0.00 H new ATOM 0 HA GLU A 27 11.973 2.533 12.820 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.971 2.538 12.585 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.889 2.973 14.013 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.815 4.505 11.403 1.00 0.00 H new ATOM 0 HG3 GLU A 27 8.954 4.916 12.873 1.00 0.00 H new ATOM 473 N LEU A 28 9.768 -0.014 12.701 1.00 0.00 N ATOM 474 CA LEU A 28 9.279 -1.210 13.390 1.00 0.00 C ATOM 475 C LEU A 28 8.709 -2.283 12.460 1.00 0.00 C ATOM 476 O LEU A 28 8.208 -3.299 12.943 1.00 0.00 O ATOM 477 CB LEU A 28 8.249 -0.824 14.479 1.00 0.00 C ATOM 478 CG LEU A 28 7.118 0.149 14.089 1.00 0.00 C ATOM 479 CD1 LEU A 28 6.272 -0.272 12.881 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.200 0.351 15.296 1.00 0.00 C ATOM 0 H LEU A 28 9.189 0.257 11.906 1.00 0.00 H new ATOM 0 HA LEU A 28 10.154 -1.663 13.856 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.789 -1.742 14.845 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.794 -0.385 15.315 1.00 0.00 H new ATOM 0 HG LEU A 28 7.616 1.070 13.786 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.507 0.481 12.693 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.912 -0.366 12.004 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.795 -1.230 13.087 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.396 1.038 15.031 1.00 0.00 H new ATOM 0 HD22 LEU A 28 5.775 -0.607 15.594 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.774 0.767 16.124 1.00 0.00 H new ATOM 492 N GLY A 29 8.743 -2.080 11.148 1.00 0.00 N ATOM 493 CA GLY A 29 8.098 -2.947 10.183 1.00 0.00 C ATOM 494 C GLY A 29 9.108 -3.886 9.538 1.00 0.00 C ATOM 495 O GLY A 29 9.535 -4.861 10.156 1.00 0.00 O ATOM 0 H GLY A 29 9.230 -1.292 10.722 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.317 -3.528 10.674 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.612 -2.345 9.415 1.00 0.00 H new ATOM 499 N PHE A 30 9.406 -3.635 8.267 1.00 0.00 N ATOM 500 CA PHE A 30 10.078 -4.524 7.323 1.00 0.00 C ATOM 501 C PHE A 30 10.819 -3.640 6.315 1.00 0.00 C ATOM 502 O PHE A 30 10.704 -2.418 6.382 1.00 0.00 O ATOM 503 CB PHE A 30 9.025 -5.411 6.634 1.00 0.00 C ATOM 504 CG PHE A 30 8.429 -6.476 7.538 1.00 0.00 C ATOM 505 CD1 PHE A 30 7.344 -6.174 8.387 1.00 0.00 C ATOM 506 CD2 PHE A 30 9.008 -7.758 7.586 1.00 0.00 C ATOM 507 CE1 PHE A 30 6.909 -7.120 9.333 1.00 0.00 C ATOM 508 CE2 PHE A 30 8.537 -8.719 8.496 1.00 0.00 C ATOM 509 CZ PHE A 30 7.495 -8.397 9.383 1.00 0.00 C ATOM 0 H PHE A 30 9.167 -2.741 7.838 1.00 0.00 H new ATOM 0 HA PHE A 30 10.791 -5.182 7.819 1.00 0.00 H new ATOM 0 HB2 PHE A 30 8.222 -4.778 6.257 1.00 0.00 H new ATOM 0 HB3 PHE A 30 9.481 -5.895 5.771 1.00 0.00 H new ATOM 0 HD1 PHE A 30 6.848 -5.218 8.311 1.00 0.00 H new ATOM 0 HD2 PHE A 30 9.820 -8.005 6.918 1.00 0.00 H new ATOM 0 HE1 PHE A 30 6.120 -6.864 10.025 1.00 0.00 H new ATOM 0 HE2 PHE A 30 8.976 -9.706 8.514 1.00 0.00 H new ATOM 0 HZ PHE A 30 7.147 -9.127 10.099 1.00 0.00 H new ATOM 519 N ASN A 31 11.585 -4.217 5.387 1.00 0.00 N ATOM 520 CA ASN A 31 12.501 -3.459 4.533 1.00 0.00 C ATOM 521 C ASN A 31 12.467 -3.942 3.082 1.00 0.00 C ATOM 522 O ASN A 31 11.717 -4.851 2.735 1.00 0.00 O ATOM 523 CB ASN A 31 13.914 -3.514 5.137 1.00 0.00 C ATOM 524 CG ASN A 31 14.024 -2.594 6.336 1.00 0.00 C ATOM 525 OD1 ASN A 31 14.042 -1.386 6.156 1.00 0.00 O ATOM 526 ND2 ASN A 31 14.100 -3.119 7.546 1.00 0.00 N ATOM 0 H ASN A 31 11.588 -5.221 5.207 1.00 0.00 H new ATOM 0 HA ASN A 31 12.177 -2.419 4.500 1.00 0.00 H new ATOM 0 HB2 ASN A 31 14.147 -4.536 5.435 1.00 0.00 H new ATOM 0 HB3 ASN A 31 14.648 -3.226 4.384 1.00 0.00 H new ATOM 0 HD21 ASN A 31 14.176 -2.511 8.362 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.082 -4.132 7.664 1.00 0.00 H new ATOM 533 N ASN A 32 13.298 -3.322 2.236 1.00 0.00 N ATOM 534 CA ASN A 32 13.329 -3.373 0.778 1.00 0.00 C ATOM 535 C ASN A 32 12.012 -2.879 0.222 1.00 0.00 C ATOM 536 O ASN A 32 11.168 -3.649 -0.237 1.00 0.00 O ATOM 537 CB ASN A 32 13.782 -4.714 0.185 1.00 0.00 C ATOM 538 CG ASN A 32 15.217 -5.056 0.549 1.00 0.00 C ATOM 539 OD1 ASN A 32 15.579 -5.092 1.720 1.00 0.00 O ATOM 540 ND2 ASN A 32 16.101 -5.240 -0.412 1.00 0.00 N ATOM 0 H ASN A 32 14.035 -2.715 2.595 1.00 0.00 H new ATOM 0 HA ASN A 32 14.119 -2.695 0.454 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.122 -5.506 0.539 1.00 0.00 H new ATOM 0 HB3 ASN A 32 13.684 -4.679 -0.900 1.00 0.00 H new ATOM 0 HD21 ASN A 32 17.079 -5.411 -0.179 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.807 -5.211 -1.388 1.00 0.00 H new ATOM 547 N VAL A 33 11.846 -1.561 0.259 1.00 0.00 N ATOM 548 CA VAL A 33 10.760 -0.936 -0.464 1.00 0.00 C ATOM 549 C VAL A 33 11.143 -0.826 -1.946 1.00 0.00 C ATOM 550 O VAL A 33 12.320 -0.933 -2.317 1.00 0.00 O ATOM 551 CB VAL A 33 10.379 0.422 0.163 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.025 0.282 1.654 1.00 0.00 C ATOM 553 CG2 VAL A 33 11.485 1.475 0.025 1.00 0.00 C ATOM 0 H VAL A 33 12.445 -0.917 0.777 1.00 0.00 H new ATOM 0 HA VAL A 33 9.865 -1.553 -0.393 1.00 0.00 H new ATOM 0 HB VAL A 33 9.506 0.758 -0.396 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.763 1.259 2.059 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.179 -0.396 1.765 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.883 -0.117 2.196 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.159 2.408 0.485 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.388 1.122 0.523 1.00 0.00 H new ATOM 0 HG23 VAL A 33 11.696 1.645 -1.031 1.00 0.00 H new ATOM 563 N GLU A 34 10.158 -0.541 -2.781 1.00 0.00 N ATOM 564 CA GLU A 34 10.287 0.029 -4.113 1.00 0.00 C ATOM 565 C GLU A 34 9.211 1.109 -4.181 1.00 0.00 C ATOM 566 O GLU A 34 8.368 1.223 -3.285 1.00 0.00 O ATOM 567 CB GLU A 34 10.064 -1.022 -5.211 1.00 0.00 C ATOM 568 CG GLU A 34 11.125 -2.129 -5.243 1.00 0.00 C ATOM 569 CD GLU A 34 12.518 -1.700 -5.711 1.00 0.00 C ATOM 570 OE1 GLU A 34 12.707 -0.549 -6.164 1.00 0.00 O ATOM 571 OE2 GLU A 34 13.427 -2.563 -5.683 1.00 0.00 O ATOM 0 H GLU A 34 9.184 -0.712 -2.531 1.00 0.00 H new ATOM 0 HA GLU A 34 11.290 0.422 -4.280 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.084 -1.477 -5.070 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.047 -0.522 -6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.212 -2.552 -4.242 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.772 -2.927 -5.897 1.00 0.00 H new ATOM 578 N GLU A 35 9.188 1.872 -5.263 1.00 0.00 N ATOM 579 CA GLU A 35 8.145 2.837 -5.530 1.00 0.00 C ATOM 580 C GLU A 35 7.605 2.545 -6.923 1.00 0.00 C ATOM 581 O GLU A 35 8.291 1.943 -7.757 1.00 0.00 O ATOM 582 CB GLU A 35 8.692 4.257 -5.267 1.00 0.00 C ATOM 583 CG GLU A 35 8.391 5.385 -6.275 1.00 0.00 C ATOM 584 CD GLU A 35 9.652 6.209 -6.533 1.00 0.00 C ATOM 585 OE1 GLU A 35 10.585 5.698 -7.191 1.00 0.00 O ATOM 586 OE2 GLU A 35 9.831 7.304 -5.957 1.00 0.00 O ATOM 0 H GLU A 35 9.905 1.834 -5.987 1.00 0.00 H new ATOM 0 HA GLU A 35 7.286 2.765 -4.863 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.315 4.578 -4.296 1.00 0.00 H new ATOM 0 HB3 GLU A 35 9.776 4.179 -5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.027 4.960 -7.210 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.600 6.028 -5.888 1.00 0.00 H new ATOM 593 N ALA A 36 6.367 2.963 -7.155 1.00 0.00 N ATOM 594 CA ALA A 36 5.790 3.097 -8.475 1.00 0.00 C ATOM 595 C ALA A 36 5.364 4.545 -8.624 1.00 0.00 C ATOM 596 O ALA A 36 5.013 5.194 -7.635 1.00 0.00 O ATOM 597 CB ALA A 36 4.586 2.169 -8.634 1.00 0.00 C ATOM 0 H ALA A 36 5.725 3.224 -6.407 1.00 0.00 H new ATOM 0 HA ALA A 36 6.514 2.822 -9.242 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.167 2.285 -9.633 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.902 1.136 -8.491 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.830 2.424 -7.891 1.00 0.00 H new ATOM 603 N GLU A 37 5.367 5.031 -9.859 1.00 0.00 N ATOM 604 CA GLU A 37 4.922 6.378 -10.157 1.00 0.00 C ATOM 605 C GLU A 37 3.410 6.504 -10.012 1.00 0.00 C ATOM 606 O GLU A 37 2.909 7.598 -9.757 1.00 0.00 O ATOM 607 CB GLU A 37 5.288 6.747 -11.598 1.00 0.00 C ATOM 608 CG GLU A 37 6.786 6.637 -11.895 1.00 0.00 C ATOM 609 CD GLU A 37 7.216 7.627 -12.981 1.00 0.00 C ATOM 610 OE1 GLU A 37 6.423 7.937 -13.901 1.00 0.00 O ATOM 611 OE2 GLU A 37 8.357 8.143 -12.903 1.00 0.00 O ATOM 0 H GLU A 37 5.677 4.503 -10.675 1.00 0.00 H new ATOM 0 HA GLU A 37 5.414 7.046 -9.451 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.742 6.097 -12.281 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.960 7.767 -11.798 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.354 6.825 -10.984 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.022 5.621 -12.213 1.00 0.00 H new ATOM 618 N ASP A 38 2.674 5.422 -10.268 1.00 0.00 N ATOM 619 CA ASP A 38 1.250 5.492 -10.555 1.00 0.00 C ATOM 620 C ASP A 38 0.648 4.095 -10.438 1.00 0.00 C ATOM 621 O ASP A 38 1.370 3.115 -10.575 1.00 0.00 O ATOM 622 CB ASP A 38 1.098 6.002 -11.990 1.00 0.00 C ATOM 623 CG ASP A 38 -0.329 5.821 -12.461 1.00 0.00 C ATOM 624 OD1 ASP A 38 -1.255 6.256 -11.753 1.00 0.00 O ATOM 625 OD2 ASP A 38 -0.520 5.190 -13.524 1.00 0.00 O ATOM 0 H ASP A 38 3.053 4.475 -10.281 1.00 0.00 H new ATOM 0 HA ASP A 38 0.739 6.155 -9.857 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.374 7.055 -12.041 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.778 5.462 -12.649 1.00 0.00 H new ATOM 630 N GLY A 39 -0.657 3.967 -10.198 1.00 0.00 N ATOM 631 CA GLY A 39 -1.375 2.703 -10.233 1.00 0.00 C ATOM 632 C GLY A 39 -1.112 1.859 -11.489 1.00 0.00 C ATOM 633 O GLY A 39 -0.982 0.637 -11.376 1.00 0.00 O ATOM 0 H GLY A 39 -1.254 4.762 -9.969 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.102 2.119 -9.354 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.444 2.904 -10.162 1.00 0.00 H new ATOM 637 N VAL A 40 -1.066 2.439 -12.690 1.00 0.00 N ATOM 638 CA VAL A 40 -0.856 1.644 -13.906 1.00 0.00 C ATOM 639 C VAL A 40 0.585 1.113 -13.927 1.00 0.00 C ATOM 640 O VAL A 40 0.810 -0.048 -14.285 1.00 0.00 O ATOM 641 CB VAL A 40 -1.236 2.467 -15.156 1.00 0.00 C ATOM 642 CG1 VAL A 40 -1.104 1.633 -16.437 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.697 2.943 -15.057 1.00 0.00 C ATOM 0 H VAL A 40 -1.169 3.441 -12.848 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.512 0.773 -13.912 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.554 3.316 -15.199 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.379 2.242 -17.298 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.074 1.295 -16.546 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.765 0.769 -16.378 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.952 3.522 -15.945 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.357 2.079 -14.986 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.817 3.566 -14.171 1.00 0.00 H new ATOM 653 N ASP A 41 1.541 1.925 -13.465 1.00 0.00 N ATOM 654 CA ASP A 41 2.925 1.507 -13.261 1.00 0.00 C ATOM 655 C ASP A 41 2.975 0.412 -12.193 1.00 0.00 C ATOM 656 O ASP A 41 3.624 -0.614 -12.387 1.00 0.00 O ATOM 657 CB ASP A 41 3.795 2.713 -12.860 1.00 0.00 C ATOM 658 CG ASP A 41 5.271 2.361 -12.647 1.00 0.00 C ATOM 659 OD1 ASP A 41 5.912 1.762 -13.541 1.00 0.00 O ATOM 660 OD2 ASP A 41 5.833 2.773 -11.606 1.00 0.00 O ATOM 0 H ASP A 41 1.370 2.900 -13.221 1.00 0.00 H new ATOM 0 HA ASP A 41 3.324 1.104 -14.192 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.720 3.477 -13.634 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.398 3.148 -11.943 1.00 0.00 H new ATOM 665 N ALA A 42 2.235 0.580 -11.089 1.00 0.00 N ATOM 666 CA ALA A 42 2.237 -0.288 -9.931 1.00 0.00 C ATOM 667 C ALA A 42 1.859 -1.697 -10.330 1.00 0.00 C ATOM 668 O ALA A 42 2.562 -2.627 -9.951 1.00 0.00 O ATOM 669 CB ALA A 42 1.273 0.236 -8.868 1.00 0.00 C ATOM 0 H ALA A 42 1.592 1.365 -10.986 1.00 0.00 H new ATOM 0 HA ALA A 42 3.243 -0.301 -9.511 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.287 -0.429 -8.004 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.579 1.236 -8.561 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.264 0.275 -9.279 1.00 0.00 H new ATOM 675 N LEU A 43 0.774 -1.851 -11.098 1.00 0.00 N ATOM 676 CA LEU A 43 0.302 -3.153 -11.557 1.00 0.00 C ATOM 677 C LEU A 43 1.421 -3.911 -12.291 1.00 0.00 C ATOM 678 O LEU A 43 1.640 -5.112 -12.070 1.00 0.00 O ATOM 679 CB LEU A 43 -0.925 -2.955 -12.459 1.00 0.00 C ATOM 680 CG LEU A 43 -1.779 -4.233 -12.528 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.774 -4.299 -11.363 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.547 -4.270 -13.846 1.00 0.00 C ATOM 0 H LEU A 43 0.200 -1.071 -11.417 1.00 0.00 H new ATOM 0 HA LEU A 43 0.013 -3.758 -10.698 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.529 -2.131 -12.079 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.601 -2.677 -13.462 1.00 0.00 H new ATOM 0 HG LEU A 43 -1.109 -5.090 -12.462 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.363 -5.213 -11.439 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.229 -4.296 -10.419 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.438 -3.435 -11.402 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.150 -5.177 -13.890 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.197 -3.398 -13.913 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.843 -4.262 -14.678 1.00 0.00 H new ATOM 694 N ASN A 44 2.151 -3.186 -13.146 1.00 0.00 N ATOM 695 CA ASN A 44 3.291 -3.719 -13.874 1.00 0.00 C ATOM 696 C ASN A 44 4.423 -4.100 -12.917 1.00 0.00 C ATOM 697 O ASN A 44 5.048 -5.138 -13.124 1.00 0.00 O ATOM 698 CB ASN A 44 3.754 -2.724 -14.947 1.00 0.00 C ATOM 699 CG ASN A 44 4.910 -3.277 -15.769 1.00 0.00 C ATOM 700 OD1 ASN A 44 4.925 -4.442 -16.157 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.901 -2.462 -16.065 1.00 0.00 N ATOM 0 H ASN A 44 1.959 -2.205 -13.349 1.00 0.00 H new ATOM 0 HA ASN A 44 2.984 -4.633 -14.383 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.920 -2.487 -15.607 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.059 -1.792 -14.471 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.688 -2.797 -16.620 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.881 -1.496 -15.739 1.00 0.00 H new ATOM 708 N LYS A 45 4.671 -3.345 -11.836 1.00 0.00 N ATOM 709 CA LYS A 45 5.605 -3.788 -10.787 1.00 0.00 C ATOM 710 C LYS A 45 5.158 -5.134 -10.223 1.00 0.00 C ATOM 711 O LYS A 45 5.999 -6.008 -10.046 1.00 0.00 O ATOM 712 CB LYS A 45 5.747 -2.811 -9.605 1.00 0.00 C ATOM 713 CG LYS A 45 5.858 -1.321 -9.925 1.00 0.00 C ATOM 714 CD LYS A 45 7.156 -0.846 -10.573 1.00 0.00 C ATOM 715 CE LYS A 45 8.224 -0.637 -9.493 1.00 0.00 C ATOM 716 NZ LYS A 45 9.378 0.119 -10.007 1.00 0.00 N ATOM 0 H LYS A 45 4.244 -2.435 -11.665 1.00 0.00 H new ATOM 0 HA LYS A 45 6.575 -3.850 -11.280 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.887 -2.950 -8.950 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.631 -3.099 -9.036 1.00 0.00 H new ATOM 0 HG2 LYS A 45 5.033 -1.054 -10.585 1.00 0.00 H new ATOM 0 HG3 LYS A 45 5.718 -0.764 -8.998 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.500 -1.580 -11.302 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.985 0.085 -11.114 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.788 -0.105 -8.648 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.560 -1.605 -9.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.241 -0.451 -9.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.229 0.339 -11.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.480 1.004 -9.470 1.00 0.00 H new ATOM 730 N LEU A 46 3.865 -5.321 -9.926 1.00 0.00 N ATOM 731 CA LEU A 46 3.385 -6.567 -9.313 1.00 0.00 C ATOM 732 C LEU A 46 3.743 -7.721 -10.241 1.00 0.00 C ATOM 733 O LEU A 46 4.404 -8.671 -9.820 1.00 0.00 O ATOM 734 CB LEU A 46 1.874 -6.578 -8.993 1.00 0.00 C ATOM 735 CG LEU A 46 1.299 -5.232 -8.549 1.00 0.00 C ATOM 736 CD1 LEU A 46 -0.204 -5.319 -8.341 1.00 0.00 C ATOM 737 CD2 LEU A 46 1.962 -4.603 -7.319 1.00 0.00 C ATOM 0 H LEU A 46 3.136 -4.629 -10.099 1.00 0.00 H new ATOM 0 HA LEU A 46 3.877 -6.666 -8.345 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.333 -6.914 -9.878 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.689 -7.312 -8.209 1.00 0.00 H new ATOM 0 HG LEU A 46 1.529 -4.561 -9.376 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.585 -4.347 -8.026 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.684 -5.611 -9.275 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.423 -6.061 -7.573 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.479 -3.653 -7.091 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.861 -5.275 -6.467 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.019 -4.432 -7.523 1.00 0.00 H new ATOM 749 N GLN A 47 3.377 -7.593 -11.521 1.00 0.00 N ATOM 750 CA GLN A 47 3.720 -8.596 -12.527 1.00 0.00 C ATOM 751 C GLN A 47 5.172 -8.500 -13.035 1.00 0.00 C ATOM 752 O GLN A 47 5.513 -9.103 -14.054 1.00 0.00 O ATOM 753 CB GLN A 47 2.679 -8.616 -13.656 1.00 0.00 C ATOM 754 CG GLN A 47 1.298 -9.050 -13.121 1.00 0.00 C ATOM 755 CD GLN A 47 0.441 -9.807 -14.140 1.00 0.00 C ATOM 756 OE1 GLN A 47 0.912 -10.320 -15.152 1.00 0.00 O ATOM 757 NE2 GLN A 47 -0.852 -9.927 -13.901 1.00 0.00 N ATOM 0 H GLN A 47 2.843 -6.803 -11.882 1.00 0.00 H new ATOM 0 HA GLN A 47 3.681 -9.566 -12.031 1.00 0.00 H new ATOM 0 HB2 GLN A 47 2.605 -7.626 -14.106 1.00 0.00 H new ATOM 0 HB3 GLN A 47 3.001 -9.300 -14.441 1.00 0.00 H new ATOM 0 HG2 GLN A 47 1.442 -9.681 -12.244 1.00 0.00 H new ATOM 0 HG3 GLN A 47 0.754 -8.165 -12.791 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -1.257 -9.506 -13.065 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -1.446 -10.440 -14.553 1.00 0.00 H new ATOM 766 N ALA A 48 6.066 -7.800 -12.329 1.00 0.00 N ATOM 767 CA ALA A 48 7.497 -8.027 -12.488 1.00 0.00 C ATOM 768 C ALA A 48 7.885 -9.378 -11.880 1.00 0.00 C ATOM 769 O ALA A 48 8.917 -9.936 -12.254 1.00 0.00 O ATOM 770 CB ALA A 48 8.306 -6.910 -11.820 1.00 0.00 C ATOM 0 H ALA A 48 5.823 -7.079 -11.649 1.00 0.00 H new ATOM 0 HA ALA A 48 7.724 -8.030 -13.554 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.371 -7.103 -11.953 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.051 -5.953 -12.276 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.073 -6.878 -10.756 1.00 0.00 H new ATOM 776 N GLY A 49 7.102 -9.899 -10.932 1.00 0.00 N ATOM 777 CA GLY A 49 7.426 -11.121 -10.226 1.00 0.00 C ATOM 778 C GLY A 49 6.357 -11.395 -9.184 1.00 0.00 C ATOM 779 O GLY A 49 5.377 -12.082 -9.479 1.00 0.00 O ATOM 0 H GLY A 49 6.222 -9.475 -10.638 1.00 0.00 H new ATOM 0 HA2 GLY A 49 7.490 -11.954 -10.927 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.402 -11.031 -9.748 1.00 0.00 H new ATOM 783 N GLY A 50 6.525 -10.856 -7.977 1.00 0.00 N ATOM 784 CA GLY A 50 5.656 -11.160 -6.858 1.00 0.00 C ATOM 785 C GLY A 50 6.075 -10.374 -5.624 1.00 0.00 C ATOM 786 O GLY A 50 6.863 -10.858 -4.804 1.00 0.00 O ATOM 0 H GLY A 50 7.271 -10.196 -7.755 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.625 -10.919 -7.116 1.00 0.00 H new ATOM 0 HA3 GLY A 50 5.690 -12.228 -6.644 1.00 0.00 H new ATOM 790 N TYR A 51 5.556 -9.152 -5.508 1.00 0.00 N ATOM 791 CA TYR A 51 5.689 -8.293 -4.334 1.00 0.00 C ATOM 792 C TYR A 51 4.980 -8.915 -3.122 1.00 0.00 C ATOM 793 O TYR A 51 4.175 -9.836 -3.274 1.00 0.00 O ATOM 794 CB TYR A 51 5.106 -6.913 -4.669 1.00 0.00 C ATOM 795 CG TYR A 51 6.093 -6.003 -5.373 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.455 -6.214 -6.720 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.671 -4.940 -4.657 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.379 -5.356 -7.346 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.562 -4.061 -5.289 1.00 0.00 C ATOM 800 CZ TYR A 51 7.909 -4.254 -6.645 1.00 0.00 C ATOM 801 OH TYR A 51 8.726 -3.364 -7.271 1.00 0.00 O ATOM 0 H TYR A 51 5.013 -8.719 -6.255 1.00 0.00 H new ATOM 0 HA TYR A 51 6.742 -8.187 -4.071 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.226 -7.041 -5.299 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.772 -6.434 -3.749 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.022 -7.035 -7.272 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.427 -4.800 -3.614 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.682 -5.543 -8.366 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.984 -3.234 -4.738 1.00 0.00 H new ATOM 0 HH TYR A 51 8.785 -3.588 -8.223 1.00 0.00 H new ATOM 811 N GLY A 52 5.235 -8.397 -1.916 1.00 0.00 N ATOM 812 CA GLY A 52 4.505 -8.802 -0.717 1.00 0.00 C ATOM 813 C GLY A 52 3.481 -7.772 -0.256 1.00 0.00 C ATOM 814 O GLY A 52 2.581 -8.135 0.498 1.00 0.00 O ATOM 0 H GLY A 52 5.950 -7.689 -1.747 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.997 -9.747 -0.911 1.00 0.00 H new ATOM 0 HA3 GLY A 52 5.216 -8.982 0.089 1.00 0.00 H new ATOM 818 N PHE A 53 3.615 -6.511 -0.678 1.00 0.00 N ATOM 819 CA PHE A 53 2.792 -5.395 -0.232 1.00 0.00 C ATOM 820 C PHE A 53 2.605 -4.409 -1.372 1.00 0.00 C ATOM 821 O PHE A 53 3.557 -4.135 -2.110 1.00 0.00 O ATOM 822 CB PHE A 53 3.482 -4.673 0.932 1.00 0.00 C ATOM 823 CG PHE A 53 3.004 -5.113 2.291 1.00 0.00 C ATOM 824 CD1 PHE A 53 3.524 -6.283 2.870 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.070 -4.332 2.995 1.00 0.00 C ATOM 826 CE1 PHE A 53 3.099 -6.687 4.142 1.00 0.00 C ATOM 827 CE2 PHE A 53 1.667 -4.722 4.280 1.00 0.00 C ATOM 828 CZ PHE A 53 2.168 -5.912 4.845 1.00 0.00 C ATOM 0 H PHE A 53 4.322 -6.236 -1.360 1.00 0.00 H new ATOM 0 HA PHE A 53 1.824 -5.779 0.091 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.557 -4.839 0.864 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.318 -3.600 0.830 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.253 -6.872 2.333 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.665 -3.436 2.548 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.488 -7.594 4.580 1.00 0.00 H new ATOM 0 HE2 PHE A 53 0.973 -4.110 4.837 1.00 0.00 H new ATOM 0 HZ PHE A 53 1.833 -6.227 5.822 1.00 0.00 H new ATOM 838 N VAL A 54 1.403 -3.836 -1.458 1.00 0.00 N ATOM 839 CA VAL A 54 0.998 -2.899 -2.502 1.00 0.00 C ATOM 840 C VAL A 54 0.446 -1.661 -1.788 1.00 0.00 C ATOM 841 O VAL A 54 -0.760 -1.420 -1.724 1.00 0.00 O ATOM 842 CB VAL A 54 -0.006 -3.577 -3.463 1.00 0.00 C ATOM 843 CG1 VAL A 54 -0.084 -2.890 -4.827 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.335 -5.039 -3.730 1.00 0.00 C ATOM 0 H VAL A 54 0.663 -4.019 -0.780 1.00 0.00 H new ATOM 0 HA VAL A 54 1.829 -2.590 -3.137 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.961 -3.494 -2.945 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.805 -3.412 -5.456 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.399 -1.855 -4.696 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.896 -2.913 -5.303 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.402 -5.466 -4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.326 -5.105 -4.180 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.325 -5.592 -2.791 1.00 0.00 H new ATOM 854 N ILE A 55 1.338 -0.912 -1.147 1.00 0.00 N ATOM 855 CA ILE A 55 0.990 0.329 -0.472 1.00 0.00 C ATOM 856 C ILE A 55 0.870 1.384 -1.574 1.00 0.00 C ATOM 857 O ILE A 55 1.759 1.477 -2.421 1.00 0.00 O ATOM 858 CB ILE A 55 2.016 0.640 0.652 1.00 0.00 C ATOM 859 CG1 ILE A 55 2.373 -0.658 1.429 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.463 1.727 1.577 1.00 0.00 C ATOM 861 CD1 ILE A 55 3.192 -0.522 2.718 1.00 0.00 C ATOM 0 H ILE A 55 2.327 -1.152 -1.082 1.00 0.00 H new ATOM 0 HA ILE A 55 0.040 0.287 0.061 1.00 0.00 H new ATOM 0 HB ILE A 55 2.937 1.018 0.209 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.441 -1.166 1.677 1.00 0.00 H new ATOM 0 HG13 ILE A 55 2.922 -1.312 0.752 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.188 1.940 2.363 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.275 2.633 1.002 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.531 1.383 2.026 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.362 -1.510 3.147 1.00 0.00 H new ATOM 0 HD12 ILE A 55 4.150 -0.054 2.493 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.646 0.095 3.432 1.00 0.00 H new ATOM 873 N SER A 56 -0.217 2.154 -1.623 1.00 0.00 N ATOM 874 CA SER A 56 -0.423 3.136 -2.677 1.00 0.00 C ATOM 875 C SER A 56 -1.109 4.370 -2.117 1.00 0.00 C ATOM 876 O SER A 56 -1.866 4.267 -1.148 1.00 0.00 O ATOM 877 CB SER A 56 -1.259 2.504 -3.812 1.00 0.00 C ATOM 878 OG SER A 56 -2.605 2.244 -3.461 1.00 0.00 O ATOM 0 H SER A 56 -0.971 2.112 -0.938 1.00 0.00 H new ATOM 0 HA SER A 56 0.541 3.443 -3.083 1.00 0.00 H new ATOM 0 HB2 SER A 56 -1.242 3.169 -4.675 1.00 0.00 H new ATOM 0 HB3 SER A 56 -0.788 1.570 -4.119 1.00 0.00 H new ATOM 0 HG SER A 56 -3.117 3.079 -3.486 1.00 0.00 H new ATOM 884 N ASP A 57 -0.931 5.515 -2.774 1.00 0.00 N ATOM 885 CA ASP A 57 -1.880 6.610 -2.608 1.00 0.00 C ATOM 886 C ASP A 57 -3.236 6.145 -3.172 1.00 0.00 C ATOM 887 O ASP A 57 -3.375 5.038 -3.712 1.00 0.00 O ATOM 888 CB ASP A 57 -1.368 7.905 -3.262 1.00 0.00 C ATOM 889 CG ASP A 57 -1.976 9.138 -2.577 1.00 0.00 C ATOM 890 OD1 ASP A 57 -3.165 9.459 -2.813 1.00 0.00 O ATOM 891 OD2 ASP A 57 -1.296 9.774 -1.748 1.00 0.00 O ATOM 0 H ASP A 57 -0.157 5.705 -3.411 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.000 6.856 -1.553 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.281 7.946 -3.196 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -1.624 7.909 -4.322 1.00 0.00 H new ATOM 896 N TRP A 58 -4.258 6.980 -3.043 1.00 0.00 N ATOM 897 CA TRP A 58 -5.541 6.799 -3.683 1.00 0.00 C ATOM 898 C TRP A 58 -5.565 7.612 -4.974 1.00 0.00 C ATOM 899 O TRP A 58 -5.778 7.049 -6.048 1.00 0.00 O ATOM 900 CB TRP A 58 -6.653 7.218 -2.718 1.00 0.00 C ATOM 901 CG TRP A 58 -8.032 6.945 -3.226 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.608 7.490 -4.320 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.021 6.034 -2.681 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.862 6.953 -4.506 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.173 6.052 -3.518 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.051 5.186 -1.561 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.289 5.244 -3.278 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.152 4.350 -1.333 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.250 4.359 -2.196 1.00 0.00 C ATOM 0 H TRP A 58 -4.210 7.824 -2.473 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.705 5.752 -3.938 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -6.515 6.695 -1.772 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.558 8.284 -2.510 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.152 8.236 -4.954 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.481 7.194 -5.280 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.220 5.179 -0.871 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.160 5.302 -3.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -10.152 3.690 -0.478 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.072 3.680 -2.027 1.00 0.00 H new ATOM 920 N ASN A 59 -5.404 8.934 -4.867 1.00 0.00 N ATOM 921 CA ASN A 59 -5.826 9.882 -5.894 1.00 0.00 C ATOM 922 C ASN A 59 -4.755 9.986 -6.975 1.00 0.00 C ATOM 923 O ASN A 59 -4.028 10.980 -7.056 1.00 0.00 O ATOM 924 CB ASN A 59 -6.190 11.248 -5.274 1.00 0.00 C ATOM 925 CG ASN A 59 -7.498 11.214 -4.490 1.00 0.00 C ATOM 926 OD1 ASN A 59 -7.699 10.370 -3.624 1.00 0.00 O ATOM 927 ND2 ASN A 59 -8.422 12.122 -4.746 1.00 0.00 N ATOM 0 H ASN A 59 -4.973 9.377 -4.056 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.735 9.516 -6.371 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.384 11.568 -4.613 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.266 11.992 -6.067 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.298 12.119 -4.224 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.259 12.826 -5.466 1.00 0.00 H new ATOM 934 N MET A 60 -4.673 8.963 -7.822 1.00 0.00 N ATOM 935 CA MET A 60 -3.804 8.878 -8.989 1.00 0.00 C ATOM 936 C MET A 60 -4.639 9.019 -10.278 1.00 0.00 C ATOM 937 O MET A 60 -5.864 8.874 -10.220 1.00 0.00 O ATOM 938 CB MET A 60 -3.045 7.540 -8.948 1.00 0.00 C ATOM 939 CG MET A 60 -1.888 7.519 -7.946 1.00 0.00 C ATOM 940 SD MET A 60 -0.569 8.714 -8.297 1.00 0.00 S ATOM 941 CE MET A 60 0.798 7.939 -7.400 1.00 0.00 C ATOM 0 H MET A 60 -5.243 8.126 -7.704 1.00 0.00 H new ATOM 0 HA MET A 60 -3.077 9.690 -8.979 1.00 0.00 H new ATOM 0 HB2 MET A 60 -3.745 6.743 -8.698 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.656 7.322 -9.943 1.00 0.00 H new ATOM 0 HG2 MET A 60 -2.283 7.715 -6.949 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.458 6.517 -7.927 1.00 0.00 H new ATOM 0 HE1 MET A 60 1.726 8.466 -7.625 1.00 0.00 H new ATOM 0 HE2 MET A 60 0.604 7.987 -6.329 1.00 0.00 H new ATOM 0 HE3 MET A 60 0.889 6.897 -7.706 1.00 0.00 H new ATOM 951 N PRO A 61 -4.014 9.327 -11.432 1.00 0.00 N ATOM 952 CA PRO A 61 -4.685 9.342 -12.731 1.00 0.00 C ATOM 953 C PRO A 61 -5.058 7.927 -13.205 1.00 0.00 C ATOM 954 O PRO A 61 -4.663 6.932 -12.595 1.00 0.00 O ATOM 955 CB PRO A 61 -3.694 10.000 -13.706 1.00 0.00 C ATOM 956 CG PRO A 61 -2.462 10.385 -12.889 1.00 0.00 C ATOM 957 CD PRO A 61 -2.595 9.606 -11.591 1.00 0.00 C ATOM 0 HA PRO A 61 -5.625 9.891 -12.672 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -3.427 9.312 -14.508 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -4.138 10.879 -14.174 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -1.543 10.125 -13.414 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -2.430 11.459 -12.704 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -2.018 8.682 -11.630 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -2.215 10.184 -10.749 1.00 0.00 H new ATOM 965 N ASN A 62 -5.719 7.837 -14.365 1.00 0.00 N ATOM 966 CA ASN A 62 -6.150 6.609 -15.045 1.00 0.00 C ATOM 967 C ASN A 62 -6.785 5.626 -14.052 1.00 0.00 C ATOM 968 O ASN A 62 -7.882 5.878 -13.550 1.00 0.00 O ATOM 969 CB ASN A 62 -5.013 5.942 -15.858 1.00 0.00 C ATOM 970 CG ASN A 62 -4.478 6.755 -17.019 1.00 0.00 C ATOM 971 OD1 ASN A 62 -4.957 6.601 -18.138 1.00 0.00 O ATOM 972 ND2 ASN A 62 -3.451 7.553 -16.817 1.00 0.00 N ATOM 0 H ASN A 62 -5.984 8.672 -14.887 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.910 6.900 -15.770 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.188 5.721 -15.181 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.375 4.988 -16.241 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -3.037 8.059 -17.600 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -3.070 7.665 -15.878 1.00 0.00 H new ATOM 979 N MET A 63 -6.109 4.506 -13.781 1.00 0.00 N ATOM 980 CA MET A 63 -6.501 3.503 -12.817 1.00 0.00 C ATOM 981 C MET A 63 -5.883 3.906 -11.488 1.00 0.00 C ATOM 982 O MET A 63 -4.793 3.450 -11.126 1.00 0.00 O ATOM 983 CB MET A 63 -6.073 2.100 -13.270 1.00 0.00 C ATOM 984 CG MET A 63 -7.161 1.438 -14.112 1.00 0.00 C ATOM 985 SD MET A 63 -7.524 2.215 -15.703 1.00 0.00 S ATOM 986 CE MET A 63 -9.057 1.330 -16.063 1.00 0.00 C ATOM 0 H MET A 63 -5.236 4.274 -14.255 1.00 0.00 H new ATOM 0 HA MET A 63 -7.585 3.452 -12.718 1.00 0.00 H new ATOM 0 HB2 MET A 63 -5.151 2.167 -13.848 1.00 0.00 H new ATOM 0 HB3 MET A 63 -5.858 1.483 -12.398 1.00 0.00 H new ATOM 0 HG2 MET A 63 -6.871 0.403 -14.295 1.00 0.00 H new ATOM 0 HG3 MET A 63 -8.080 1.413 -13.526 1.00 0.00 H new ATOM 0 HE1 MET A 63 -9.455 1.666 -17.020 1.00 0.00 H new ATOM 0 HE2 MET A 63 -8.857 0.260 -16.109 1.00 0.00 H new ATOM 0 HE3 MET A 63 -9.785 1.529 -15.277 1.00 0.00 H new ATOM 996 N ASP A 64 -6.628 4.767 -10.796 1.00 0.00 N ATOM 997 CA ASP A 64 -6.373 5.241 -9.445 1.00 0.00 C ATOM 998 C ASP A 64 -6.210 4.096 -8.444 1.00 0.00 C ATOM 999 O ASP A 64 -6.409 2.931 -8.777 1.00 0.00 O ATOM 1000 CB ASP A 64 -7.477 6.221 -9.019 1.00 0.00 C ATOM 1001 CG ASP A 64 -8.878 5.634 -8.824 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.081 4.569 -8.201 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.834 6.324 -9.256 1.00 0.00 O ATOM 0 H ASP A 64 -7.476 5.174 -11.191 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.420 5.770 -9.448 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.172 6.692 -8.085 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.540 7.010 -9.768 1.00 0.00 H new ATOM 1008 N GLY A 65 -5.845 4.405 -7.198 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.515 3.398 -6.198 1.00 0.00 C ATOM 1010 C GLY A 65 -6.653 2.407 -5.933 1.00 0.00 C ATOM 1011 O GLY A 65 -6.385 1.260 -5.558 1.00 0.00 O ATOM 0 H GLY A 65 -5.771 5.364 -6.857 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.633 2.848 -6.525 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.252 3.896 -5.265 1.00 0.00 H new ATOM 1015 N LEU A 66 -7.909 2.821 -6.128 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.064 1.964 -5.909 1.00 0.00 C ATOM 1017 C LEU A 66 -9.289 1.077 -7.133 1.00 0.00 C ATOM 1018 O LEU A 66 -9.629 -0.097 -6.981 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.285 2.832 -5.545 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.449 2.148 -4.810 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.406 1.349 -5.685 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -10.978 1.226 -3.692 1.00 0.00 C ATOM 0 H LEU A 66 -8.147 3.762 -6.442 1.00 0.00 H new ATOM 0 HA LEU A 66 -8.893 1.292 -5.068 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.937 3.660 -4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.677 3.265 -6.466 1.00 0.00 H new ATOM 0 HG LEU A 66 -11.996 3.003 -4.412 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.187 0.911 -5.064 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.859 2.009 -6.425 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.858 0.555 -6.193 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -11.842 0.770 -3.208 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.342 0.445 -4.108 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.413 1.802 -2.959 1.00 0.00 H new ATOM 1034 N GLU A 67 -9.038 1.583 -8.342 1.00 0.00 N ATOM 1035 CA GLU A 67 -9.015 0.746 -9.535 1.00 0.00 C ATOM 1036 C GLU A 67 -7.838 -0.227 -9.494 1.00 0.00 C ATOM 1037 O GLU A 67 -8.023 -1.388 -9.835 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.935 1.571 -10.821 1.00 0.00 C ATOM 1039 CG GLU A 67 -10.166 2.432 -11.122 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.418 1.650 -11.534 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.518 0.411 -11.349 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.349 2.273 -12.090 1.00 0.00 O ATOM 0 H GLU A 67 -8.848 2.570 -8.517 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.954 0.192 -9.541 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.062 2.221 -10.763 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.772 0.893 -11.659 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.401 3.025 -10.238 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.915 3.132 -11.918 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.642 0.195 -9.073 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.474 -0.659 -8.828 1.00 0.00 C ATOM 1051 C LEU A 68 -5.880 -1.823 -7.928 1.00 0.00 C ATOM 1052 O LEU A 68 -5.678 -2.979 -8.305 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.332 0.171 -8.207 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.105 -0.642 -7.727 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.332 -1.278 -8.887 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -2.155 0.276 -6.946 1.00 0.00 C ATOM 0 H LEU A 68 -6.453 1.180 -8.886 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.107 -1.067 -9.770 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.997 0.903 -8.942 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.731 0.729 -7.360 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.481 -1.446 -7.094 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.482 -1.836 -8.495 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -2.989 -1.954 -9.435 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.975 -0.497 -9.558 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.291 -0.297 -6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.822 1.088 -7.592 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.676 0.689 -6.083 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.503 -1.524 -6.781 1.00 0.00 N ATOM 1069 CA LEU A 69 -7.062 -2.534 -5.887 1.00 0.00 C ATOM 1070 C LEU A 69 -7.992 -3.451 -6.664 1.00 0.00 C ATOM 1071 O LEU A 69 -7.757 -4.651 -6.687 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.771 -1.871 -4.700 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.804 -2.735 -3.937 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.428 -4.152 -3.464 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.171 -1.973 -2.670 1.00 0.00 C ATOM 0 H LEU A 69 -6.632 -0.568 -6.450 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.255 -3.142 -5.479 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.012 -1.542 -3.990 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.277 -0.976 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.581 -2.895 -4.685 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.278 -4.601 -2.950 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.160 -4.764 -4.325 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.580 -4.095 -2.782 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.900 -2.547 -2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.277 -1.819 -2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.599 -1.007 -2.938 1.00 0.00 H new ATOM 1087 N LYS A 70 -9.042 -2.934 -7.299 1.00 0.00 N ATOM 1088 CA LYS A 70 -10.017 -3.806 -7.956 1.00 0.00 C ATOM 1089 C LYS A 70 -9.370 -4.636 -9.067 1.00 0.00 C ATOM 1090 O LYS A 70 -9.723 -5.800 -9.216 1.00 0.00 O ATOM 1091 CB LYS A 70 -11.194 -2.999 -8.500 1.00 0.00 C ATOM 1092 CG LYS A 70 -12.083 -2.418 -7.392 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.125 -1.458 -7.982 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.163 -1.084 -6.921 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.033 0.036 -7.346 1.00 0.00 N ATOM 0 H LYS A 70 -9.239 -1.936 -7.373 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.395 -4.498 -7.203 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.815 -2.186 -9.119 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.797 -3.637 -9.146 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.585 -3.226 -6.860 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.467 -1.891 -6.663 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -12.633 -0.559 -8.352 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.618 -1.925 -8.835 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.780 -1.955 -6.699 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.652 -0.812 -5.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -15.717 0.249 -6.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.450 0.877 -7.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.544 -0.230 -8.212 1.00 0.00 H new ATOM 1109 N THR A 71 -8.398 -4.091 -9.798 1.00 0.00 N ATOM 1110 CA THR A 71 -7.640 -4.803 -10.815 1.00 0.00 C ATOM 1111 C THR A 71 -6.962 -6.014 -10.169 1.00 0.00 C ATOM 1112 O THR A 71 -7.062 -7.122 -10.700 1.00 0.00 O ATOM 1113 CB THR A 71 -6.603 -3.868 -11.476 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.183 -2.666 -11.950 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.945 -4.527 -12.686 1.00 0.00 C ATOM 0 H THR A 71 -8.112 -3.117 -9.693 1.00 0.00 H new ATOM 0 HA THR A 71 -8.312 -5.147 -11.601 1.00 0.00 H new ATOM 0 HB THR A 71 -5.875 -3.657 -10.693 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.330 -2.055 -11.198 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.221 -3.840 -13.126 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.436 -5.438 -12.372 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.707 -4.773 -13.425 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.292 -5.812 -9.033 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.572 -6.843 -8.303 1.00 0.00 C ATOM 1125 C ILE A 72 -6.619 -7.871 -7.830 1.00 0.00 C ATOM 1126 O ILE A 72 -6.477 -9.066 -8.076 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.814 -6.151 -7.142 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.539 -5.457 -7.671 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.351 -7.150 -6.072 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -3.016 -4.413 -6.673 1.00 0.00 C ATOM 0 H ILE A 72 -6.237 -4.897 -8.587 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.831 -7.372 -8.902 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.515 -5.438 -6.708 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.767 -6.204 -7.857 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.754 -4.975 -8.625 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.825 -6.617 -5.280 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.217 -7.661 -5.652 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.681 -7.882 -6.523 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -2.118 -3.943 -7.075 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.780 -3.654 -6.507 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.778 -4.901 -5.728 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.687 -7.405 -7.173 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.755 -8.211 -6.573 1.00 0.00 C ATOM 1144 C ARG A 73 -9.533 -9.020 -7.612 1.00 0.00 C ATOM 1145 O ARG A 73 -10.185 -10.000 -7.248 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.705 -7.286 -5.777 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.972 -7.772 -4.340 1.00 0.00 C ATOM 1148 CD ARG A 73 -11.168 -8.719 -4.184 1.00 0.00 C ATOM 1149 NE ARG A 73 -10.870 -10.138 -4.438 1.00 0.00 N ATOM 1150 CZ ARG A 73 -10.636 -11.068 -3.501 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -10.142 -10.722 -2.319 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -10.876 -12.351 -3.746 1.00 0.00 N ATOM 0 H ARG A 73 -7.837 -6.405 -7.039 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.293 -8.935 -5.902 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.277 -6.284 -5.740 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.654 -7.208 -6.308 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.079 -8.277 -3.972 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -10.132 -6.902 -3.703 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.562 -8.621 -3.172 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.957 -8.400 -4.865 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.839 -10.440 -5.412 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -9.938 -9.743 -2.118 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.967 -11.435 -1.611 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.242 -12.637 -4.654 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -10.694 -13.050 -3.026 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.516 -8.608 -8.881 1.00 0.00 N ATOM 1167 CA ALA A 74 -10.174 -9.278 -9.991 1.00 0.00 C ATOM 1168 C ALA A 74 -9.287 -10.349 -10.636 1.00 0.00 C ATOM 1169 O ALA A 74 -9.747 -11.034 -11.556 1.00 0.00 O ATOM 1170 CB ALA A 74 -10.573 -8.239 -11.046 1.00 0.00 C ATOM 0 H ALA A 74 -9.022 -7.764 -9.169 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.056 -9.781 -9.596 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -11.067 -8.738 -11.880 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -11.255 -7.513 -10.602 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -9.682 -7.726 -11.407 1.00 0.00 H new ATOM 1176 N ASP A 75 -8.016 -10.474 -10.249 1.00 0.00 N ATOM 1177 CA ASP A 75 -7.067 -11.382 -10.890 1.00 0.00 C ATOM 1178 C ASP A 75 -6.892 -12.657 -10.069 1.00 0.00 C ATOM 1179 O ASP A 75 -6.763 -12.595 -8.846 1.00 0.00 O ATOM 1180 CB ASP A 75 -5.714 -10.703 -11.071 1.00 0.00 C ATOM 1181 CG ASP A 75 -4.782 -11.675 -11.784 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -4.946 -11.835 -13.012 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -3.962 -12.334 -11.110 1.00 0.00 O ATOM 0 H ASP A 75 -7.615 -9.943 -9.476 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.469 -11.646 -11.868 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.824 -9.787 -11.652 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.299 -10.420 -10.104 1.00 0.00 H new ATOM 1188 N GLY A 76 -6.833 -13.810 -10.744 1.00 0.00 N ATOM 1189 CA GLY A 76 -6.768 -15.117 -10.105 1.00 0.00 C ATOM 1190 C GLY A 76 -5.526 -15.348 -9.237 1.00 0.00 C ATOM 1191 O GLY A 76 -5.516 -16.315 -8.465 1.00 0.00 O ATOM 0 H GLY A 76 -6.829 -13.856 -11.763 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.656 -15.248 -9.486 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.802 -15.885 -10.877 1.00 0.00 H new ATOM 1195 N ALA A 77 -4.493 -14.503 -9.340 1.00 0.00 N ATOM 1196 CA ALA A 77 -3.268 -14.576 -8.558 1.00 0.00 C ATOM 1197 C ALA A 77 -3.033 -13.298 -7.761 1.00 0.00 C ATOM 1198 O ALA A 77 -2.762 -13.390 -6.559 1.00 0.00 O ATOM 1199 CB ALA A 77 -2.075 -14.869 -9.466 1.00 0.00 C ATOM 0 H ALA A 77 -4.495 -13.723 -9.997 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.377 -15.393 -7.844 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.166 -14.921 -8.867 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.229 -15.821 -9.974 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.977 -14.075 -10.206 1.00 0.00 H new ATOM 1205 N MET A 78 -3.104 -12.116 -8.389 1.00 0.00 N ATOM 1206 CA MET A 78 -2.728 -10.873 -7.706 1.00 0.00 C ATOM 1207 C MET A 78 -3.590 -10.615 -6.478 1.00 0.00 C ATOM 1208 O MET A 78 -3.120 -10.008 -5.524 1.00 0.00 O ATOM 1209 CB MET A 78 -2.725 -9.639 -8.623 1.00 0.00 C ATOM 1210 CG MET A 78 -1.821 -9.799 -9.853 1.00 0.00 C ATOM 1211 SD MET A 78 -1.647 -8.313 -10.886 1.00 0.00 S ATOM 1212 CE MET A 78 -3.265 -8.260 -11.706 1.00 0.00 C ATOM 0 H MET A 78 -3.413 -11.996 -9.353 1.00 0.00 H new ATOM 0 HA MET A 78 -1.698 -11.030 -7.386 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.744 -9.438 -8.953 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.398 -8.771 -8.051 1.00 0.00 H new ATOM 0 HG2 MET A 78 -0.830 -10.107 -9.518 1.00 0.00 H new ATOM 0 HG3 MET A 78 -2.214 -10.607 -10.470 1.00 0.00 H new ATOM 0 HE1 MET A 78 -3.307 -7.399 -12.373 1.00 0.00 H new ATOM 0 HE2 MET A 78 -3.411 -9.173 -12.283 1.00 0.00 H new ATOM 0 HE3 MET A 78 -4.051 -8.176 -10.955 1.00 0.00 H new ATOM 1222 N SER A 79 -4.805 -11.146 -6.461 1.00 0.00 N ATOM 1223 CA SER A 79 -5.793 -10.972 -5.409 1.00 0.00 C ATOM 1224 C SER A 79 -5.328 -11.447 -4.018 1.00 0.00 C ATOM 1225 O SER A 79 -6.015 -11.158 -3.036 1.00 0.00 O ATOM 1226 CB SER A 79 -7.080 -11.674 -5.856 1.00 0.00 C ATOM 1227 OG SER A 79 -8.127 -11.394 -4.959 1.00 0.00 O ATOM 0 H SER A 79 -5.143 -11.739 -7.219 1.00 0.00 H new ATOM 0 HA SER A 79 -5.964 -9.904 -5.273 1.00 0.00 H new ATOM 0 HB2 SER A 79 -7.353 -11.344 -6.858 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.916 -12.750 -5.909 1.00 0.00 H new ATOM 0 HG SER A 79 -7.754 -11.157 -4.084 1.00 0.00 H new ATOM 1233 N ALA A 80 -4.194 -12.146 -3.894 1.00 0.00 N ATOM 1234 CA ALA A 80 -3.583 -12.445 -2.600 1.00 0.00 C ATOM 1235 C ALA A 80 -2.931 -11.214 -1.952 1.00 0.00 C ATOM 1236 O ALA A 80 -2.663 -11.231 -0.750 1.00 0.00 O ATOM 1237 CB ALA A 80 -2.514 -13.526 -2.789 1.00 0.00 C ATOM 0 H ALA A 80 -3.676 -12.519 -4.690 1.00 0.00 H new ATOM 0 HA ALA A 80 -4.379 -12.784 -1.937 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -2.054 -13.754 -1.828 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.975 -14.427 -3.194 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -1.752 -13.167 -3.480 1.00 0.00 H new ATOM 1243 N LEU A 81 -2.621 -10.174 -2.729 1.00 0.00 N ATOM 1244 CA LEU A 81 -1.819 -9.047 -2.278 1.00 0.00 C ATOM 1245 C LEU A 81 -2.594 -8.190 -1.272 1.00 0.00 C ATOM 1246 O LEU A 81 -3.712 -7.764 -1.591 1.00 0.00 O ATOM 1247 CB LEU A 81 -1.414 -8.168 -3.473 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.225 -8.714 -4.291 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.056 -7.944 -5.612 1.00 0.00 C ATOM 1250 CD2 LEU A 81 1.088 -8.623 -3.496 1.00 0.00 C ATOM 0 H LEU A 81 -2.926 -10.095 -3.699 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.928 -9.447 -1.795 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.273 -8.056 -4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.161 -7.173 -3.107 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.446 -9.759 -4.507 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.790 -8.352 -6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.962 -8.043 -6.209 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.125 -6.890 -5.399 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.907 -9.015 -4.099 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.289 -7.582 -3.244 1.00 0.00 H new ATOM 0 HD23 LEU A 81 1.000 -9.207 -2.580 1.00 0.00 H new ATOM 1262 N PRO A 82 -2.013 -7.858 -0.104 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.508 -6.790 0.745 1.00 0.00 C ATOM 1264 C PRO A 82 -2.222 -5.445 0.067 1.00 0.00 C ATOM 1265 O PRO A 82 -1.067 -5.012 -0.020 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.786 -6.950 2.084 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.462 -7.611 1.710 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.784 -8.414 0.449 1.00 0.00 C ATOM 0 HA PRO A 82 -3.585 -6.830 0.909 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.629 -5.987 2.571 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.359 -7.567 2.776 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.314 -6.869 1.522 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.099 -8.256 2.510 1.00 0.00 H new ATOM 0 HD2 PRO A 82 0.030 -8.344 -0.272 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -0.910 -9.471 0.686 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.269 -4.795 -0.441 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.198 -3.415 -0.893 1.00 0.00 C ATOM 1278 C VAL A 83 -3.563 -2.521 0.290 1.00 0.00 C ATOM 1279 O VAL A 83 -4.478 -2.857 1.060 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.067 -3.161 -2.141 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -4.005 -4.288 -3.187 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.540 -2.952 -1.796 1.00 0.00 C ATOM 0 H VAL A 83 -4.191 -5.217 -0.549 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.186 -3.178 -1.221 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.637 -2.254 -2.565 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.643 -4.034 -4.034 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.978 -4.410 -3.530 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.351 -5.220 -2.739 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.107 -2.777 -2.711 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.926 -3.839 -1.294 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.640 -2.090 -1.137 1.00 0.00 H new ATOM 1292 N LEU A 84 -2.870 -1.399 0.456 1.00 0.00 N ATOM 1293 CA LEU A 84 -2.998 -0.544 1.632 1.00 0.00 C ATOM 1294 C LEU A 84 -3.028 0.905 1.164 1.00 0.00 C ATOM 1295 O LEU A 84 -2.030 1.403 0.644 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.850 -0.855 2.607 1.00 0.00 C ATOM 1297 CG LEU A 84 -1.815 0.032 3.865 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.173 0.115 4.572 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.761 -0.514 4.834 1.00 0.00 C ATOM 0 H LEU A 84 -2.197 -1.054 -0.228 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.924 -0.730 2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.927 -1.897 2.916 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -0.903 -0.748 2.078 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.561 1.043 3.547 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.087 0.753 5.451 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.913 0.534 3.890 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.486 -0.883 4.878 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.731 0.109 5.728 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.018 -1.536 5.113 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.216 -0.505 4.352 1.00 0.00 H new ATOM 1311 N MET A 85 -4.186 1.553 1.305 1.00 0.00 N ATOM 1312 CA MET A 85 -4.372 2.938 0.877 1.00 0.00 C ATOM 1313 C MET A 85 -3.651 3.823 1.894 1.00 0.00 C ATOM 1314 O MET A 85 -3.912 3.689 3.090 1.00 0.00 O ATOM 1315 CB MET A 85 -5.869 3.316 0.793 1.00 0.00 C ATOM 1316 CG MET A 85 -6.817 2.283 0.154 1.00 0.00 C ATOM 1317 SD MET A 85 -7.116 2.387 -1.633 1.00 0.00 S ATOM 1318 CE MET A 85 -5.435 2.499 -2.285 1.00 0.00 C ATOM 0 H MET A 85 -5.018 1.132 1.718 1.00 0.00 H new ATOM 0 HA MET A 85 -3.963 3.076 -0.124 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.224 3.522 1.803 1.00 0.00 H new ATOM 0 HB3 MET A 85 -5.952 4.246 0.230 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.422 1.290 0.369 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.780 2.358 0.658 1.00 0.00 H new ATOM 0 HE1 MET A 85 -5.444 2.284 -3.354 1.00 0.00 H new ATOM 0 HE2 MET A 85 -5.047 3.504 -2.120 1.00 0.00 H new ATOM 0 HE3 MET A 85 -4.798 1.776 -1.775 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.760 4.707 1.456 1.00 0.00 N ATOM 1329 CA VAL A 86 -1.980 5.615 2.288 1.00 0.00 C ATOM 1330 C VAL A 86 -1.955 6.954 1.555 1.00 0.00 C ATOM 1331 O VAL A 86 -1.145 7.154 0.656 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.571 5.032 2.545 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.276 5.961 3.418 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.626 3.672 3.254 1.00 0.00 C ATOM 0 H VAL A 86 -2.553 4.814 0.463 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.419 5.752 3.276 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.122 4.921 1.558 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.259 5.516 3.576 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.389 6.924 2.921 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.216 6.105 4.380 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.387 3.303 3.413 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.126 3.783 4.216 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.178 2.962 2.638 1.00 0.00 H new ATOM 1344 N THR A 87 -2.887 7.844 1.888 1.00 0.00 N ATOM 1345 CA THR A 87 -3.185 9.041 1.107 1.00 0.00 C ATOM 1346 C THR A 87 -3.410 10.234 2.045 1.00 0.00 C ATOM 1347 O THR A 87 -3.221 10.143 3.265 1.00 0.00 O ATOM 1348 CB THR A 87 -4.370 8.716 0.167 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.716 9.793 -0.679 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.631 8.313 0.935 1.00 0.00 C ATOM 0 H THR A 87 -3.466 7.752 2.723 1.00 0.00 H new ATOM 0 HA THR A 87 -2.350 9.338 0.472 1.00 0.00 H new ATOM 0 HB THR A 87 -4.013 7.880 -0.435 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.332 9.646 -1.569 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.433 8.095 0.229 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.424 7.426 1.534 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.935 9.130 1.589 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.808 11.372 1.476 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.186 12.569 2.201 1.00 0.00 C ATOM 1360 C ALA A 88 -5.695 12.795 2.226 1.00 0.00 C ATOM 1361 O ALA A 88 -6.171 13.571 3.056 1.00 0.00 O ATOM 1362 CB ALA A 88 -3.456 13.774 1.606 1.00 0.00 C ATOM 0 H ALA A 88 -3.876 11.482 0.464 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.887 12.438 3.241 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.739 14.675 2.150 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.379 13.624 1.687 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.729 13.883 0.556 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.448 12.135 1.352 1.00 0.00 N ATOM 1369 CA GLU A 89 -7.889 12.255 1.260 1.00 0.00 C ATOM 1370 C GLU A 89 -8.541 11.213 2.168 1.00 0.00 C ATOM 1371 O GLU A 89 -8.349 10.011 1.973 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.259 12.041 -0.209 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.833 13.238 -1.065 1.00 0.00 C ATOM 1374 CD GLU A 89 -8.772 14.426 -0.857 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.977 14.331 -1.193 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -8.338 15.445 -0.274 1.00 0.00 O ATOM 0 H GLU A 89 -6.056 11.485 0.671 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.242 13.233 1.587 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.779 11.135 -0.580 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.335 11.891 -0.298 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.814 13.527 -0.809 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.829 12.953 -2.117 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.290 11.661 3.183 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.176 10.775 3.924 1.00 0.00 C ATOM 1385 C ALA A 90 -11.347 10.385 3.021 1.00 0.00 C ATOM 1386 O ALA A 90 -11.284 9.332 2.407 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.621 11.407 5.245 1.00 0.00 C ATOM 0 H ALA A 90 -9.296 12.629 3.504 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.645 9.866 4.204 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.281 10.719 5.773 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.747 11.616 5.861 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.152 12.337 5.043 1.00 0.00 H new ATOM 1393 N LYS A 91 -12.374 11.240 2.902 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.612 11.010 2.146 1.00 0.00 C ATOM 1395 C LYS A 91 -14.295 9.707 2.578 1.00 0.00 C ATOM 1396 O LYS A 91 -13.933 8.628 2.121 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.303 11.061 0.635 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.536 10.941 -0.276 1.00 0.00 C ATOM 1399 CD LYS A 91 -15.341 12.242 -0.345 1.00 0.00 C ATOM 1400 CE LYS A 91 -16.456 12.099 -1.386 1.00 0.00 C ATOM 1401 NZ LYS A 91 -16.870 13.402 -1.942 1.00 0.00 N ATOM 0 H LYS A 91 -12.362 12.155 3.353 1.00 0.00 H new ATOM 0 HA LYS A 91 -14.329 11.802 2.365 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.794 11.999 0.413 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.609 10.256 0.392 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.217 10.661 -1.280 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.178 10.139 0.089 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -15.768 12.470 0.632 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -14.687 13.073 -0.609 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.115 11.453 -2.195 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -17.317 11.611 -0.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -17.626 13.257 -2.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -17.220 14.011 -1.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.056 13.858 -2.402 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.339 9.773 3.414 1.00 0.00 N ATOM 1416 CA LYS A 92 -16.065 8.571 3.843 1.00 0.00 C ATOM 1417 C LYS A 92 -16.468 7.696 2.664 1.00 0.00 C ATOM 1418 O LYS A 92 -16.279 6.488 2.744 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.304 8.920 4.676 1.00 0.00 C ATOM 1420 CG LYS A 92 -16.994 8.920 6.170 1.00 0.00 C ATOM 1421 CD LYS A 92 -18.277 9.221 6.951 1.00 0.00 C ATOM 1422 CE LYS A 92 -17.993 9.134 8.448 1.00 0.00 C ATOM 1423 NZ LYS A 92 -17.821 7.730 8.873 1.00 0.00 N ATOM 0 H LYS A 92 -15.699 10.643 3.806 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.373 8.007 4.469 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.677 9.901 4.381 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -18.097 8.202 4.468 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -16.590 7.953 6.470 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -16.233 9.667 6.396 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -18.645 10.215 6.697 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -19.058 8.512 6.676 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -17.093 9.702 8.685 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -18.813 9.588 9.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -17.866 7.673 9.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -18.578 7.147 8.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -16.898 7.379 8.547 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.969 8.282 1.576 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.320 7.565 0.350 1.00 0.00 C ATOM 1439 C GLU A 93 -16.165 6.692 -0.160 1.00 0.00 C ATOM 1440 O GLU A 93 -16.407 5.586 -0.645 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.801 8.576 -0.702 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.905 7.973 -1.577 1.00 0.00 C ATOM 1443 CD GLU A 93 -19.551 9.035 -2.463 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -20.251 9.916 -1.912 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -19.378 8.993 -3.702 1.00 0.00 O ATOM 0 H GLU A 93 -17.145 9.285 1.521 1.00 0.00 H new ATOM 0 HA GLU A 93 -18.133 6.871 0.564 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -18.173 9.473 -0.207 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -16.963 8.882 -1.328 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -18.487 7.182 -2.199 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.664 7.514 -0.944 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.920 7.147 -0.001 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.713 6.415 -0.365 1.00 0.00 C ATOM 1454 C ASN A 94 -13.384 5.363 0.694 1.00 0.00 C ATOM 1455 O ASN A 94 -12.992 4.257 0.330 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.523 7.365 -0.603 1.00 0.00 C ATOM 1457 CG ASN A 94 -12.705 8.259 -1.828 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -13.703 8.186 -2.544 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -11.760 9.123 -2.136 1.00 0.00 N ATOM 0 H ASN A 94 -14.722 8.065 0.398 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.904 5.901 -1.307 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.384 7.991 0.278 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.614 6.776 -0.723 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.862 9.719 -2.958 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.926 9.196 -1.553 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.581 5.635 1.992 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.454 4.608 3.034 1.00 0.00 C ATOM 1468 C ILE A 95 -14.397 3.439 2.707 1.00 0.00 C ATOM 1469 O ILE A 95 -13.958 2.284 2.710 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.655 5.176 4.467 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.388 5.857 5.026 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -14.022 4.057 5.457 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -12.116 7.225 4.411 1.00 0.00 C ATOM 0 H ILE A 95 -13.829 6.559 2.345 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.431 4.233 3.035 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.456 5.909 4.373 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.489 5.966 6.106 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.529 5.210 4.850 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.157 4.481 6.452 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.948 3.578 5.138 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.222 3.318 5.483 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.211 7.647 4.849 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.983 7.120 3.334 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.959 7.887 4.610 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.679 3.705 2.434 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.574 2.733 1.833 1.00 0.00 C ATOM 1487 C ILE A 96 -16.025 2.088 0.568 1.00 0.00 C ATOM 1488 O ILE A 96 -15.939 0.866 0.561 1.00 0.00 O ATOM 1489 CB ILE A 96 -18.024 3.246 1.785 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.458 3.963 3.091 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -19.042 2.221 1.302 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -19.182 5.265 2.849 1.00 0.00 C ATOM 0 H ILE A 96 -16.118 4.605 2.627 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.626 1.872 2.499 1.00 0.00 H new ATOM 0 HB ILE A 96 -18.016 4.009 1.006 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.104 3.298 3.664 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -17.576 4.155 3.702 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -20.036 2.668 1.300 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.786 1.902 0.292 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.034 1.358 1.968 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.456 5.712 3.805 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -18.531 5.947 2.303 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -20.083 5.077 2.265 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.610 2.831 -0.460 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.109 2.223 -1.694 1.00 0.00 C ATOM 1506 C ALA A 97 -13.968 1.233 -1.428 1.00 0.00 C ATOM 1507 O ALA A 97 -13.995 0.132 -1.972 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.699 3.292 -2.706 1.00 0.00 C ATOM 0 H ALA A 97 -15.611 3.851 -0.463 1.00 0.00 H new ATOM 0 HA ALA A 97 -15.928 1.649 -2.127 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.331 2.812 -3.613 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.561 3.913 -2.949 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -13.912 3.914 -2.279 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.002 1.575 -0.570 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.941 0.659 -0.160 1.00 0.00 C ATOM 1516 C ALA A 98 -12.532 -0.580 0.493 1.00 0.00 C ATOM 1517 O ALA A 98 -12.210 -1.695 0.089 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.969 1.324 0.820 1.00 0.00 C ATOM 0 H ALA A 98 -12.936 2.498 -0.141 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.393 0.378 -1.059 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.193 0.612 1.103 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.510 2.191 0.345 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.511 1.643 1.710 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.347 -0.410 1.534 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.875 -1.543 2.278 1.00 0.00 C ATOM 1526 C ALA A 99 -14.800 -2.428 1.431 1.00 0.00 C ATOM 1527 O ALA A 99 -14.920 -3.626 1.697 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.610 -0.996 3.494 1.00 0.00 C ATOM 0 H ALA A 99 -13.653 0.501 1.877 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.048 -2.186 2.581 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.019 -1.823 4.074 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.916 -0.427 4.113 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.422 -0.346 3.167 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.459 -1.854 0.427 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.288 -2.530 -0.557 1.00 0.00 C ATOM 1536 C GLN A 100 -15.402 -3.326 -1.517 1.00 0.00 C ATOM 1537 O GLN A 100 -15.615 -4.529 -1.667 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.113 -1.479 -1.313 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.272 -0.903 -0.487 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.509 -1.790 -0.475 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.038 -2.147 -1.532 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -20.015 -2.133 0.700 1.00 0.00 N ATOM 0 H GLN A 100 -15.424 -0.846 0.273 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.967 -3.228 -0.066 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.456 -0.665 -1.621 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.513 -1.927 -2.223 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.935 -0.749 0.538 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.540 0.076 -0.885 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.561 -1.826 1.560 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.859 -2.704 0.745 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.408 -2.678 -2.136 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.440 -3.315 -3.015 1.00 0.00 C ATOM 1553 C ALA A 101 -12.614 -4.383 -2.289 1.00 0.00 C ATOM 1554 O ALA A 101 -12.133 -5.321 -2.925 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.529 -2.236 -3.603 1.00 0.00 C ATOM 0 H ALA A 101 -14.257 -1.674 -2.033 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.979 -3.828 -3.812 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.797 -2.699 -4.265 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.128 -1.522 -4.168 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.011 -1.717 -2.796 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.480 -4.278 -0.967 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.791 -5.240 -0.126 1.00 0.00 C ATOM 1563 C GLY A 102 -10.340 -4.842 0.120 1.00 0.00 C ATOM 1564 O GLY A 102 -9.484 -5.722 0.210 1.00 0.00 O ATOM 0 H GLY A 102 -12.863 -3.493 -0.441 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.311 -5.326 0.828 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.823 -6.223 -0.597 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.046 -3.542 0.228 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.697 -3.071 0.518 1.00 0.00 C ATOM 1570 C ALA A 103 -8.303 -3.585 1.893 1.00 0.00 C ATOM 1571 O ALA A 103 -9.143 -3.625 2.806 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.610 -1.545 0.500 1.00 0.00 C ATOM 0 H ALA A 103 -10.733 -2.796 0.117 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.022 -3.445 -0.252 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.588 -1.236 0.721 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.896 -1.176 -0.485 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.284 -1.133 1.251 1.00 0.00 H new ATOM 1578 N SER A 104 -7.024 -3.913 2.069 1.00 0.00 N ATOM 1579 CA SER A 104 -6.585 -4.513 3.312 1.00 0.00 C ATOM 1580 C SER A 104 -6.487 -3.464 4.436 1.00 0.00 C ATOM 1581 O SER A 104 -6.447 -3.830 5.614 1.00 0.00 O ATOM 1582 CB SER A 104 -5.318 -5.325 3.041 1.00 0.00 C ATOM 1583 OG SER A 104 -4.143 -4.547 3.009 1.00 0.00 O ATOM 0 H SER A 104 -6.290 -3.774 1.375 1.00 0.00 H new ATOM 0 HA SER A 104 -7.322 -5.219 3.695 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.216 -6.090 3.811 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.426 -5.843 2.088 1.00 0.00 H new ATOM 0 HG SER A 104 -4.221 -3.865 2.309 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.540 -2.167 4.101 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.657 -1.078 5.058 1.00 0.00 C ATOM 1591 C GLY A 105 -6.607 0.278 4.356 1.00 0.00 C ATOM 1592 O GLY A 105 -6.301 0.356 3.160 1.00 0.00 O ATOM 0 H GLY A 105 -6.501 -1.848 3.133 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.593 -1.172 5.608 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.850 -1.143 5.788 1.00 0.00 H new ATOM 1596 N TYR A 106 -6.874 1.343 5.116 1.00 0.00 N ATOM 1597 CA TYR A 106 -6.844 2.732 4.670 1.00 0.00 C ATOM 1598 C TYR A 106 -6.159 3.556 5.760 1.00 0.00 C ATOM 1599 O TYR A 106 -6.447 3.388 6.947 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.289 3.202 4.405 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.522 4.405 3.493 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -7.781 5.603 3.585 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.582 4.349 2.569 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.063 6.697 2.749 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.871 5.440 1.734 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.099 6.615 1.799 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.349 7.634 0.939 1.00 0.00 O ATOM 0 H TYR A 106 -7.127 1.254 6.100 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.286 2.851 3.741 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -8.837 2.359 3.984 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.744 3.428 5.370 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.984 5.680 4.310 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -10.182 3.454 2.501 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -7.483 7.604 2.836 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.693 5.377 1.036 1.00 0.00 H new ATOM 0 HH TYR A 106 -8.995 8.469 1.310 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.245 4.437 5.375 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.533 5.395 6.199 1.00 0.00 C ATOM 1619 C VAL A 107 -4.711 6.770 5.542 1.00 0.00 C ATOM 1620 O VAL A 107 -4.642 6.883 4.316 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.051 4.974 6.255 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.213 5.985 7.025 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -2.833 3.600 6.906 1.00 0.00 C ATOM 0 H VAL A 107 -4.962 4.502 4.397 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.910 5.435 7.221 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.737 4.924 5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.174 5.657 7.045 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.277 6.958 6.537 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.587 6.066 8.046 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.769 3.365 6.913 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.207 3.619 7.930 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.368 2.839 6.338 1.00 0.00 H new ATOM 1633 N VAL A 108 -4.909 7.809 6.355 1.00 0.00 N ATOM 1634 CA VAL A 108 -4.959 9.200 5.914 1.00 0.00 C ATOM 1635 C VAL A 108 -3.870 9.947 6.684 1.00 0.00 C ATOM 1636 O VAL A 108 -3.623 9.622 7.848 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.350 9.833 6.171 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.531 11.067 5.276 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.530 8.884 5.917 1.00 0.00 C ATOM 0 H VAL A 108 -5.042 7.702 7.361 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.792 9.261 4.839 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.363 10.091 7.230 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.510 11.509 5.460 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -5.755 11.798 5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.457 10.771 4.229 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.466 9.405 6.120 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.516 8.556 4.878 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.447 8.017 6.573 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.215 10.939 6.078 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.337 11.847 6.822 1.00 0.00 C ATOM 1651 C LYS A 109 -3.138 12.609 7.888 1.00 0.00 C ATOM 1652 O LYS A 109 -4.275 12.992 7.606 1.00 0.00 O ATOM 1653 CB LYS A 109 -1.585 12.779 5.856 1.00 0.00 C ATOM 1654 CG LYS A 109 -2.475 13.685 4.999 1.00 0.00 C ATOM 1655 CD LYS A 109 -2.361 15.186 5.242 1.00 0.00 C ATOM 1656 CE LYS A 109 -3.048 15.672 6.517 1.00 0.00 C ATOM 1657 NZ LYS A 109 -3.063 17.147 6.568 1.00 0.00 N ATOM 0 H LYS A 109 -3.275 11.134 5.079 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.580 11.269 7.351 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.907 13.406 6.435 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -0.969 12.170 5.194 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -2.248 13.492 3.951 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -3.513 13.392 5.159 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -1.306 15.456 5.287 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.789 15.713 4.389 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.068 15.291 6.555 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -2.528 15.278 7.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.534 17.459 7.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -2.087 17.505 6.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.579 17.518 5.745 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.558 12.920 9.061 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.240 12.504 9.529 1.00 0.00 C ATOM 1673 C PRO A 110 -1.227 11.016 9.892 1.00 0.00 C ATOM 1674 O PRO A 110 -2.132 10.515 10.569 1.00 0.00 O ATOM 1675 CB PRO A 110 -0.969 13.356 10.771 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.359 13.643 11.327 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.210 13.746 10.065 1.00 0.00 C ATOM 0 HA PRO A 110 -0.481 12.641 8.759 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.351 12.823 11.494 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.442 14.276 10.518 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.705 12.845 11.985 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.381 14.566 11.907 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.226 13.399 10.253 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.283 14.780 9.729 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.173 10.310 9.484 1.00 0.00 N ATOM 1686 CA PHE A 111 0.036 8.907 9.820 1.00 0.00 C ATOM 1687 C PHE A 111 1.508 8.631 10.096 1.00 0.00 C ATOM 1688 O PHE A 111 2.387 9.328 9.584 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.480 8.023 8.686 1.00 0.00 C ATOM 1690 CG PHE A 111 0.303 8.081 7.388 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.410 7.237 7.200 1.00 0.00 C ATOM 1692 CD2 PHE A 111 -0.103 8.927 6.342 1.00 0.00 C ATOM 1693 CE1 PHE A 111 2.147 7.301 6.007 1.00 0.00 C ATOM 1694 CE2 PHE A 111 0.638 9.003 5.154 1.00 0.00 C ATOM 1695 CZ PHE A 111 1.787 8.209 5.001 1.00 0.00 C ATOM 0 H PHE A 111 0.568 10.704 8.904 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.521 8.675 10.728 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.492 6.990 9.034 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.513 8.301 8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.694 6.539 7.973 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.995 9.525 6.454 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.995 6.648 5.863 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.327 9.668 4.362 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.392 8.298 4.111 1.00 0.00 H new ATOM 1705 N THR A 112 1.766 7.583 10.874 1.00 0.00 N ATOM 1706 CA THR A 112 3.081 7.252 11.401 1.00 0.00 C ATOM 1707 C THR A 112 3.232 5.750 11.627 1.00 0.00 C ATOM 1708 O THR A 112 2.322 4.971 11.330 1.00 0.00 O ATOM 1709 CB THR A 112 3.321 8.041 12.694 1.00 0.00 C ATOM 1710 OG1 THR A 112 2.153 8.144 13.490 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.881 9.422 12.415 1.00 0.00 C ATOM 0 H THR A 112 1.043 6.924 11.162 1.00 0.00 H new ATOM 0 HA THR A 112 3.837 7.534 10.668 1.00 0.00 H new ATOM 0 HB THR A 112 4.061 7.473 13.258 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.355 8.653 14.303 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.037 9.949 13.357 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.831 9.330 11.889 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.178 9.982 11.798 1.00 0.00 H new ATOM 1719 N ALA A 113 4.390 5.328 12.144 1.00 0.00 N ATOM 1720 CA ALA A 113 4.676 3.932 12.415 1.00 0.00 C ATOM 1721 C ALA A 113 3.643 3.343 13.378 1.00 0.00 C ATOM 1722 O ALA A 113 3.309 2.174 13.231 1.00 0.00 O ATOM 1723 CB ALA A 113 6.107 3.765 12.914 1.00 0.00 C ATOM 0 H ALA A 113 5.156 5.957 12.385 1.00 0.00 H new ATOM 0 HA ALA A 113 4.596 3.367 11.486 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.303 2.711 13.112 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.801 4.127 12.156 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.241 4.337 13.832 1.00 0.00 H new ATOM 1729 N ALA A 114 3.060 4.171 14.255 1.00 0.00 N ATOM 1730 CA ALA A 114 1.975 3.784 15.154 1.00 0.00 C ATOM 1731 C ALA A 114 0.726 3.249 14.427 1.00 0.00 C ATOM 1732 O ALA A 114 -0.008 2.446 15.007 1.00 0.00 O ATOM 1733 CB ALA A 114 1.606 4.986 16.029 1.00 0.00 C ATOM 0 H ALA A 114 3.338 5.147 14.358 1.00 0.00 H new ATOM 0 HA ALA A 114 2.339 2.956 15.762 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.797 4.709 16.705 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.475 5.293 16.611 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.283 5.812 15.395 1.00 0.00 H new ATOM 1739 N THR A 115 0.467 3.665 13.179 1.00 0.00 N ATOM 1740 CA THR A 115 -0.587 3.060 12.366 1.00 0.00 C ATOM 1741 C THR A 115 0.006 2.011 11.424 1.00 0.00 C ATOM 1742 O THR A 115 -0.672 1.032 11.133 1.00 0.00 O ATOM 1743 CB THR A 115 -1.432 4.133 11.645 1.00 0.00 C ATOM 1744 OG1 THR A 115 -2.744 3.657 11.420 1.00 0.00 O ATOM 1745 CG2 THR A 115 -0.923 4.581 10.275 1.00 0.00 C ATOM 0 H THR A 115 0.975 4.418 12.715 1.00 0.00 H new ATOM 0 HA THR A 115 -1.284 2.535 13.020 1.00 0.00 H new ATOM 0 HB THR A 115 -1.377 4.984 12.324 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.269 4.348 10.964 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.595 5.335 9.866 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.076 5.004 10.379 1.00 0.00 H new ATOM 0 HG23 THR A 115 -0.886 3.724 9.602 1.00 0.00 H new ATOM 1753 N LEU A 116 1.259 2.165 10.970 1.00 0.00 N ATOM 1754 CA LEU A 116 1.943 1.196 10.108 1.00 0.00 C ATOM 1755 C LEU A 116 1.869 -0.186 10.761 1.00 0.00 C ATOM 1756 O LEU A 116 1.375 -1.130 10.140 1.00 0.00 O ATOM 1757 CB LEU A 116 3.395 1.664 9.868 1.00 0.00 C ATOM 1758 CG LEU A 116 4.218 1.005 8.742 1.00 0.00 C ATOM 1759 CD1 LEU A 116 4.509 -0.476 8.981 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.595 1.231 7.361 1.00 0.00 C ATOM 0 H LEU A 116 1.831 2.978 11.196 1.00 0.00 H new ATOM 0 HA LEU A 116 1.460 1.127 9.133 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.367 2.736 9.671 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.943 1.526 10.800 1.00 0.00 H new ATOM 0 HG LEU A 116 5.183 1.512 8.762 1.00 0.00 H new ATOM 0 HD11 LEU A 116 5.091 -0.871 8.149 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.074 -0.591 9.906 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.570 -1.023 9.059 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.210 0.749 6.601 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.592 0.805 7.340 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.539 2.300 7.158 1.00 0.00 H new ATOM 1772 N GLU A 117 2.297 -0.274 12.023 1.00 0.00 N ATOM 1773 CA GLU A 117 2.278 -1.492 12.824 1.00 0.00 C ATOM 1774 C GLU A 117 0.859 -2.041 12.984 1.00 0.00 C ATOM 1775 O GLU A 117 0.660 -3.251 12.998 1.00 0.00 O ATOM 1776 CB GLU A 117 2.936 -1.234 14.192 1.00 0.00 C ATOM 1777 CG GLU A 117 2.145 -0.333 15.148 1.00 0.00 C ATOM 1778 CD GLU A 117 2.783 -0.240 16.531 1.00 0.00 C ATOM 1779 OE1 GLU A 117 2.814 -1.277 17.232 1.00 0.00 O ATOM 1780 OE2 GLU A 117 3.172 0.872 16.958 1.00 0.00 O ATOM 0 H GLU A 117 2.677 0.527 12.527 1.00 0.00 H new ATOM 0 HA GLU A 117 2.854 -2.254 12.299 1.00 0.00 H new ATOM 0 HB2 GLU A 117 3.104 -2.194 14.681 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.915 -0.785 14.025 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.069 0.666 14.719 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.129 -0.716 15.246 1.00 0.00 H new ATOM 1787 N GLU A 118 -0.145 -1.169 13.084 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.511 -1.603 13.311 1.00 0.00 C ATOM 1789 C GLU A 118 -2.082 -2.198 12.025 1.00 0.00 C ATOM 1790 O GLU A 118 -2.764 -3.216 12.071 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.360 -0.436 13.823 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.746 -0.951 14.229 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.690 0.159 14.666 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -4.873 1.133 13.907 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -5.359 -0.008 15.711 1.00 0.00 O ATOM 0 H GLU A 118 -0.031 -0.158 13.010 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.526 -2.378 14.077 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.872 0.036 14.676 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.456 0.325 13.049 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.189 -1.487 13.389 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.637 -1.668 15.042 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.818 -1.584 10.869 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.266 -2.126 9.590 1.00 0.00 C ATOM 1804 C LYS A 119 -1.585 -3.472 9.330 1.00 0.00 C ATOM 1805 O LYS A 119 -2.269 -4.392 8.876 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.023 -1.121 8.453 1.00 0.00 C ATOM 1807 CG LYS A 119 -2.741 0.231 8.610 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.269 0.119 8.637 1.00 0.00 C ATOM 1809 CE LYS A 119 -4.942 1.491 8.725 1.00 0.00 C ATOM 1810 NZ LYS A 119 -4.728 2.189 10.014 1.00 0.00 N ATOM 0 H LYS A 119 -1.296 -0.711 10.796 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.342 -2.299 9.629 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -0.951 -0.938 8.374 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.339 -1.575 7.514 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.404 0.706 9.531 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.448 0.885 7.789 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.611 -0.396 7.739 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.573 -0.490 9.489 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.567 2.120 7.917 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.013 1.369 8.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -5.478 2.896 10.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -4.753 1.498 10.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -3.803 2.663 10.002 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.292 -3.604 9.673 1.00 0.00 N ATOM 1825 CA LEU A 120 0.411 -4.887 9.665 1.00 0.00 C ATOM 1826 C LEU A 120 -0.358 -5.878 10.533 1.00 0.00 C ATOM 1827 O LEU A 120 -0.812 -6.897 10.026 1.00 0.00 O ATOM 1828 CB LEU A 120 1.871 -4.780 10.152 1.00 0.00 C ATOM 1829 CG LEU A 120 2.870 -4.055 9.237 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.266 -4.048 9.867 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.956 -4.659 7.834 1.00 0.00 C ATOM 0 H LEU A 120 0.291 -2.819 9.963 1.00 0.00 H new ATOM 0 HA LEU A 120 0.455 -5.231 8.632 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.868 -4.272 11.117 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.244 -5.790 10.324 1.00 0.00 H new ATOM 0 HG LEU A 120 2.495 -3.037 9.131 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.961 -3.531 9.206 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.229 -3.535 10.828 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.603 -5.074 10.016 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.679 -4.099 7.241 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.272 -5.700 7.905 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.978 -4.609 7.356 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.564 -5.567 11.812 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.251 -6.449 12.753 1.00 0.00 C ATOM 1845 C ASN A 121 -2.646 -6.848 12.264 1.00 0.00 C ATOM 1846 O ASN A 121 -3.055 -8.001 12.424 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.338 -5.768 14.121 1.00 0.00 C ATOM 1848 CG ASN A 121 -1.998 -6.685 15.137 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -1.494 -7.770 15.424 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -3.117 -6.274 15.701 1.00 0.00 N ATOM 0 H ASN A 121 -0.256 -4.688 12.227 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.670 -7.368 12.834 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.339 -5.498 14.463 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.907 -4.842 14.036 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -3.585 -6.860 16.392 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -3.515 -5.370 15.446 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.374 -5.917 11.636 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.646 -6.203 10.986 1.00 0.00 C ATOM 1859 C LYS A 122 -4.461 -7.311 9.963 1.00 0.00 C ATOM 1860 O LYS A 122 -5.077 -8.356 10.131 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.291 -4.953 10.350 1.00 0.00 C ATOM 1862 CG LYS A 122 -6.474 -4.403 11.164 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.133 -3.255 12.117 1.00 0.00 C ATOM 1864 CE LYS A 122 -6.052 -1.907 11.380 1.00 0.00 C ATOM 1865 NZ LYS A 122 -7.389 -1.330 11.093 1.00 0.00 N ATOM 0 H LYS A 122 -3.090 -4.940 11.568 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.341 -6.537 11.756 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.535 -4.174 10.247 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.633 -5.200 9.345 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.243 -4.062 10.471 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -6.906 -5.219 11.744 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.888 -3.196 12.901 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -5.181 -3.460 12.607 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.478 -1.202 11.982 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.510 -2.041 10.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.276 -0.423 10.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.930 -1.987 10.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.899 -1.174 11.986 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.681 -7.118 8.900 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.608 -8.118 7.823 1.00 0.00 C ATOM 1881 C ILE A 123 -2.894 -9.402 8.239 1.00 0.00 C ATOM 1882 O ILE A 123 -3.229 -10.477 7.732 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.992 -7.520 6.550 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.584 -6.929 6.782 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -4.007 -6.513 6.008 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.109 -5.906 5.753 1.00 0.00 C ATOM 0 H ILE A 123 -3.097 -6.294 8.757 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.636 -8.404 7.603 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.809 -8.296 5.806 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.566 -6.460 7.766 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.867 -7.750 6.807 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.617 -6.056 5.098 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.943 -7.025 5.784 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.186 -5.739 6.754 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.110 -5.561 6.018 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.084 -6.368 4.766 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -1.794 -5.058 5.740 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.947 -9.310 9.169 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.295 -10.457 9.766 1.00 0.00 C ATOM 1900 C PHE A 124 -2.347 -11.357 10.385 1.00 0.00 C ATOM 1901 O PHE A 124 -2.387 -12.546 10.082 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.276 -9.997 10.813 1.00 0.00 C ATOM 1903 CG PHE A 124 1.016 -9.358 10.307 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.365 -9.338 8.940 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.906 -8.784 11.232 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.559 -8.750 8.500 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.112 -8.200 10.799 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.433 -8.176 9.431 1.00 0.00 C ATOM 0 H PHE A 124 -1.610 -8.418 9.531 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.757 -11.018 9.002 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.770 -9.282 11.471 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.008 -10.860 11.423 1.00 0.00 H new ATOM 0 HD1 PHE A 124 0.698 -9.785 8.218 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.662 -8.791 12.284 1.00 0.00 H new ATOM 0 HE1 PHE A 124 2.803 -8.740 7.448 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.792 -7.770 11.520 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.352 -7.716 9.099 1.00 0.00 H new ATOM 1918 N GLU A 125 -3.212 -10.811 11.236 1.00 0.00 N ATOM 1919 CA GLU A 125 -4.241 -11.611 11.877 1.00 0.00 C ATOM 1920 C GLU A 125 -5.346 -11.981 10.895 1.00 0.00 C ATOM 1921 O GLU A 125 -5.797 -13.123 10.860 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.849 -10.806 13.031 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.905 -10.605 14.226 1.00 0.00 C ATOM 1924 CD GLU A 125 -3.893 -11.760 15.231 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -4.402 -12.872 14.942 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -3.422 -11.509 16.367 1.00 0.00 O ATOM 0 H GLU A 125 -3.218 -9.824 11.494 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.785 -12.530 12.244 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.155 -9.829 12.656 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.751 -11.312 13.376 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.892 -10.457 13.851 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -4.189 -9.691 14.747 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.812 -11.004 10.120 1.00 0.00 N ATOM 1934 CA LYS A 126 -7.001 -11.139 9.288 1.00 0.00 C ATOM 1935 C LYS A 126 -6.693 -12.107 8.157 1.00 0.00 C ATOM 1936 O LYS A 126 -7.185 -13.233 8.170 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.487 -9.762 8.797 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.769 -9.866 7.955 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.113 -8.525 7.295 1.00 0.00 C ATOM 1940 CE LYS A 126 -10.072 -8.685 6.106 1.00 0.00 C ATOM 1941 NZ LYS A 126 -11.383 -9.239 6.492 1.00 0.00 N ATOM 0 H LYS A 126 -5.369 -10.088 10.053 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.828 -11.550 9.867 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.669 -9.116 9.655 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.702 -9.291 8.205 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.641 -10.629 7.187 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.597 -10.185 8.588 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -9.564 -7.864 8.035 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -8.195 -8.044 6.956 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -10.219 -7.714 5.632 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -9.614 -9.336 5.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -11.986 -9.324 5.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -11.251 -10.178 6.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -11.838 -8.606 7.181 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.906 -11.665 7.173 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.610 -12.447 5.983 1.00 0.00 C ATOM 1957 C LEU A 127 -4.736 -13.658 6.326 1.00 0.00 C ATOM 1958 O LEU A 127 -4.726 -14.636 5.571 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.889 -11.592 4.921 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.370 -10.142 4.677 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.657 -9.537 3.461 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.881 -10.064 4.458 1.00 0.00 C ATOM 0 H LEU A 127 -5.457 -10.749 7.185 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.562 -12.791 5.580 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.835 -11.548 5.193 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.951 -12.124 3.972 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.125 -9.575 5.575 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -5.007 -8.517 3.304 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.581 -9.528 3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.875 -10.136 2.576 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -7.171 -9.027 4.291 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.154 -10.662 3.588 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.397 -10.448 5.338 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.989 -13.598 7.433 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.917 -14.535 7.738 1.00 0.00 C ATOM 1976 C GLY A 128 -1.611 -14.071 7.094 1.00 0.00 C ATOM 1977 O GLY A 128 -0.834 -14.915 6.636 1.00 0.00 O ATOM 0 H GLY A 128 -4.119 -12.884 8.150 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.790 -14.615 8.818 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.178 -15.529 7.373 1.00 0.00 H new ATOM 1981 N MET A 129 -1.392 -12.756 6.946 1.00 0.00 N ATOM 1982 CA MET A 129 -0.192 -12.274 6.247 1.00 0.00 C ATOM 1983 C MET A 129 1.056 -12.609 7.043 1.00 0.00 C ATOM 1984 O MET A 129 2.057 -12.974 6.385 1.00 0.00 O ATOM 1985 CB MET A 129 -0.243 -10.775 5.908 1.00 0.00 C ATOM 1986 CG MET A 129 -1.031 -10.413 4.651 1.00 0.00 C ATOM 1987 SD MET A 129 -0.576 -11.269 3.116 1.00 0.00 S ATOM 1988 CE MET A 129 -1.815 -12.594 3.099 1.00 0.00 C ATOM 1989 OXT MET A 129 1.028 -12.507 8.286 1.00 0.00 O ATOM 0 H MET A 129 -2.013 -12.024 7.291 1.00 0.00 H new ATOM 0 HA MET A 129 -0.159 -12.797 5.291 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.678 -10.243 6.754 1.00 0.00 H new ATOM 0 HB3 MET A 129 0.778 -10.411 5.793 1.00 0.00 H new ATOM 0 HG2 MET A 129 -2.086 -10.605 4.846 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.928 -9.341 4.484 1.00 0.00 H new ATOM 0 HE1 MET A 129 -1.371 -13.503 2.693 1.00 0.00 H new ATOM 0 HE2 MET A 129 -2.160 -12.782 4.116 1.00 0.00 H new ATOM 0 HE3 MET A 129 -2.660 -12.294 2.479 1.00 0.00 H new TER 1999 MET A 129