USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 797 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -163:sc= 0 (180deg=-0.357) USER MOD Single : A 1 MET N :NH3+ 132:sc= 0.0811 (180deg=0) USER MOD Single : A 6 SER OG : rot 72:sc= 1.24 USER MOD Single : A 8 SER OG : rot 180:sc= -0.186 USER MOD Single : A 12 LYS NZ :NH3+ 149:sc= 2.38 (180deg=2.23) USER MOD Single : A 14 LYS NZ :NH3+ 173:sc= 1.3 (180deg=1.14) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= -0.399 X(o=-0.4,f=-0.89) USER MOD Single : A 21 LYS NZ :NH3+ 170:sc= -0.0259 (180deg=-0.173) USER MOD Single : A 22 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.135 USER MOD Single : A 29 THR OG1 : rot 55:sc= 0.336! USER MOD Single : A 33 SER OG : rot 87:sc= 1.16 USER MOD Single : A 37 LYS NZ :NH3+ -163:sc= -0.045 (180deg=-0.309) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 138:sc= 1.26 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl -104:sc= -0.503 (180deg=-2.54!) USER MOD Single : A 80 ASN :FLIP amide:sc= -0.077 F(o=-1.2,f=-0.077) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= 0.277 X(o=0.28,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 158:sc= 1.22 (180deg=0.431) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 110 SER OG : rot 82:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.014 -10.768 -10.166 1.00 0.00 N ATOM 2 CA MET A 1 0.804 -11.068 -8.758 1.00 0.00 C ATOM 3 C MET A 1 -0.426 -10.322 -8.309 1.00 0.00 C ATOM 4 O MET A 1 -0.658 -9.186 -8.753 1.00 0.00 O ATOM 5 CB MET A 1 2.023 -10.628 -7.932 1.00 0.00 C ATOM 6 CG MET A 1 1.948 -10.985 -6.454 1.00 0.00 C ATOM 7 SD MET A 1 3.405 -10.449 -5.538 1.00 0.00 S ATOM 8 CE MET A 1 3.049 -11.148 -3.921 1.00 0.00 C ATOM 0 H1 MET A 1 2.009 -10.509 -10.321 1.00 0.00 H new ATOM 0 H2 MET A 1 0.781 -11.605 -10.738 1.00 0.00 H new ATOM 0 H3 MET A 1 0.402 -9.975 -10.447 1.00 0.00 H new ATOM 0 HA MET A 1 0.672 -12.140 -8.614 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.917 -11.083 -8.357 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.139 -9.548 -8.026 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.060 -10.527 -6.018 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.834 -12.064 -6.350 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.678 -10.669 -3.171 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.000 -10.981 -3.675 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.252 -12.219 -3.935 1.00 0.00 H new ATOM 20 N PHE A 2 -1.204 -10.921 -7.441 1.00 0.00 N ATOM 21 CA PHE A 2 -2.414 -10.298 -6.984 1.00 0.00 C ATOM 22 C PHE A 2 -2.100 -9.406 -5.806 1.00 0.00 C ATOM 23 O PHE A 2 -1.183 -9.693 -5.030 1.00 0.00 O ATOM 24 CB PHE A 2 -3.451 -11.355 -6.573 1.00 0.00 C ATOM 25 CG PHE A 2 -3.860 -12.303 -7.672 1.00 0.00 C ATOM 26 CD1 PHE A 2 -4.847 -11.950 -8.574 1.00 0.00 C ATOM 27 CD2 PHE A 2 -3.262 -13.549 -7.795 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.234 -12.818 -9.578 1.00 0.00 C ATOM 29 CE2 PHE A 2 -3.644 -14.419 -8.796 1.00 0.00 C ATOM 30 CZ PHE A 2 -4.629 -14.053 -9.690 1.00 0.00 C ATOM 0 H PHE A 2 -1.018 -11.840 -7.039 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.833 -9.705 -7.797 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.047 -11.936 -5.743 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.341 -10.846 -6.203 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.322 -10.983 -8.493 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -2.489 -13.841 -7.100 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -6.008 -12.530 -10.273 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -3.172 -15.387 -8.880 1.00 0.00 H new ATOM 0 HZ PHE A 2 -4.926 -14.732 -10.476 1.00 0.00 H new ATOM 40 N ALA A 3 -2.808 -8.328 -5.703 1.00 0.00 N ATOM 41 CA ALA A 3 -2.656 -7.401 -4.621 1.00 0.00 C ATOM 42 C ALA A 3 -4.018 -7.097 -4.060 1.00 0.00 C ATOM 43 O ALA A 3 -4.855 -6.511 -4.737 1.00 0.00 O ATOM 44 CB ALA A 3 -1.972 -6.128 -5.092 1.00 0.00 C ATOM 0 H ALA A 3 -3.522 -8.059 -6.380 1.00 0.00 H new ATOM 0 HA ALA A 3 -2.027 -7.841 -3.847 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.868 -5.439 -4.253 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -0.986 -6.370 -5.488 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.572 -5.660 -5.873 1.00 0.00 H new ATOM 50 N VAL A 4 -4.245 -7.508 -2.853 1.00 0.00 N ATOM 51 CA VAL A 4 -5.526 -7.330 -2.227 1.00 0.00 C ATOM 52 C VAL A 4 -5.515 -6.030 -1.443 1.00 0.00 C ATOM 53 O VAL A 4 -4.536 -5.714 -0.749 1.00 0.00 O ATOM 54 CB VAL A 4 -5.894 -8.532 -1.309 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.286 -8.360 -0.698 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.835 -9.836 -2.090 1.00 0.00 C ATOM 0 H VAL A 4 -3.551 -7.977 -2.270 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.291 -7.284 -3.002 1.00 0.00 H new ATOM 0 HB VAL A 4 -5.164 -8.563 -0.500 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.513 -9.216 -0.062 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.311 -7.448 -0.101 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -8.027 -8.293 -1.494 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -6.095 -10.666 -1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.541 -9.795 -2.920 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.827 -9.983 -2.478 1.00 0.00 H new ATOM 66 N ILE A 5 -6.560 -5.274 -1.594 1.00 0.00 N ATOM 67 CA ILE A 5 -6.680 -3.988 -0.964 1.00 0.00 C ATOM 68 C ILE A 5 -7.469 -4.105 0.348 1.00 0.00 C ATOM 69 O ILE A 5 -8.549 -4.702 0.389 1.00 0.00 O ATOM 70 CB ILE A 5 -7.394 -2.991 -1.918 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.673 -2.957 -3.280 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.436 -1.589 -1.301 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.379 -2.133 -4.337 1.00 0.00 C ATOM 0 H ILE A 5 -7.365 -5.533 -2.165 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.679 -3.618 -0.741 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.420 -3.328 -2.070 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.668 -2.559 -3.137 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.562 -3.978 -3.645 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.940 -0.906 -1.985 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.979 -1.623 -0.356 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.419 -1.239 -1.123 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.806 -2.162 -5.264 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.374 -2.542 -4.513 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.466 -1.101 -3.996 1.00 0.00 H new ATOM 85 N SER A 6 -6.901 -3.577 1.398 1.00 0.00 N ATOM 86 CA SER A 6 -7.531 -3.522 2.698 1.00 0.00 C ATOM 87 C SER A 6 -8.486 -2.320 2.779 1.00 0.00 C ATOM 88 O SER A 6 -8.205 -1.265 2.192 1.00 0.00 O ATOM 89 CB SER A 6 -6.420 -3.433 3.768 1.00 0.00 C ATOM 90 OG SER A 6 -6.821 -2.740 4.954 1.00 0.00 O ATOM 0 H SER A 6 -5.969 -3.164 1.378 1.00 0.00 H new ATOM 0 HA SER A 6 -8.128 -4.418 2.870 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.103 -4.441 4.036 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.553 -2.930 3.339 1.00 0.00 H new ATOM 0 HG SER A 6 -7.451 -3.295 5.460 1.00 0.00 H new ATOM 96 N PRO A 7 -9.636 -2.457 3.492 1.00 0.00 N ATOM 97 CA PRO A 7 -10.585 -1.354 3.696 1.00 0.00 C ATOM 98 C PRO A 7 -9.937 -0.142 4.380 1.00 0.00 C ATOM 99 O PRO A 7 -10.359 1.006 4.169 1.00 0.00 O ATOM 100 CB PRO A 7 -11.682 -1.965 4.572 1.00 0.00 C ATOM 101 CG PRO A 7 -11.584 -3.426 4.321 1.00 0.00 C ATOM 102 CD PRO A 7 -10.124 -3.703 4.112 1.00 0.00 C ATOM 0 HA PRO A 7 -10.963 -0.966 2.750 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.526 -1.731 5.625 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.666 -1.581 4.303 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -11.974 -3.996 5.165 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.167 -3.713 3.446 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -9.614 -3.913 5.052 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -9.965 -4.565 3.464 1.00 0.00 H new ATOM 110 N SER A 8 -8.892 -0.387 5.158 1.00 0.00 N ATOM 111 CA SER A 8 -8.142 0.678 5.798 1.00 0.00 C ATOM 112 C SER A 8 -7.438 1.552 4.744 1.00 0.00 C ATOM 113 O SER A 8 -7.297 2.771 4.913 1.00 0.00 O ATOM 114 CB SER A 8 -7.096 0.083 6.743 1.00 0.00 C ATOM 115 OG SER A 8 -7.690 -0.714 7.745 1.00 0.00 O ATOM 0 H SER A 8 -8.544 -1.324 5.361 1.00 0.00 H new ATOM 0 HA SER A 8 -8.838 1.297 6.364 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.389 -0.518 6.171 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.526 0.888 7.208 1.00 0.00 H new ATOM 0 HG SER A 8 -6.993 -1.079 8.329 1.00 0.00 H new ATOM 121 N ALA A 9 -7.071 0.924 3.636 1.00 0.00 N ATOM 122 CA ALA A 9 -6.295 1.545 2.577 1.00 0.00 C ATOM 123 C ALA A 9 -7.165 2.341 1.598 1.00 0.00 C ATOM 124 O ALA A 9 -6.655 2.937 0.639 1.00 0.00 O ATOM 125 CB ALA A 9 -5.501 0.473 1.837 1.00 0.00 C ATOM 0 H ALA A 9 -7.310 -0.049 3.446 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.614 2.260 3.039 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -4.918 0.937 1.041 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.830 -0.029 2.534 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.188 -0.256 1.406 1.00 0.00 H new ATOM 131 N PHE A 10 -8.460 2.357 1.834 1.00 0.00 N ATOM 132 CA PHE A 10 -9.383 3.076 0.963 1.00 0.00 C ATOM 133 C PHE A 10 -9.122 4.578 0.955 1.00 0.00 C ATOM 134 O PHE A 10 -8.572 5.138 1.901 1.00 0.00 O ATOM 135 CB PHE A 10 -10.839 2.799 1.315 1.00 0.00 C ATOM 136 CG PHE A 10 -11.311 1.390 1.080 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.515 0.449 0.440 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.567 1.013 1.498 1.00 0.00 C ATOM 139 CE1 PHE A 10 -10.969 -0.829 0.233 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.023 -0.263 1.293 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.228 -1.183 0.660 1.00 0.00 C ATOM 0 H PHE A 10 -8.903 1.882 2.620 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.198 2.697 -0.042 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.992 3.043 2.366 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.468 3.475 0.736 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.528 0.726 0.101 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.202 1.732 1.994 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.341 -1.554 -0.263 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.010 -0.544 1.630 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.590 -2.187 0.496 1.00 0.00 H new ATOM 151 N GLY A 11 -9.482 5.203 -0.138 1.00 0.00 N ATOM 152 CA GLY A 11 -9.278 6.629 -0.330 1.00 0.00 C ATOM 153 C GLY A 11 -7.909 6.912 -0.913 1.00 0.00 C ATOM 154 O GLY A 11 -7.750 7.774 -1.766 1.00 0.00 O ATOM 0 H GLY A 11 -9.929 4.739 -0.929 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.048 7.023 -0.994 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.384 7.146 0.624 1.00 0.00 H new ATOM 158 N LYS A 12 -6.943 6.120 -0.506 1.00 0.00 N ATOM 159 CA LYS A 12 -5.598 6.173 -1.038 1.00 0.00 C ATOM 160 C LYS A 12 -5.449 5.075 -2.072 1.00 0.00 C ATOM 161 O LYS A 12 -4.393 4.855 -2.661 1.00 0.00 O ATOM 162 CB LYS A 12 -4.619 6.009 0.096 1.00 0.00 C ATOM 163 CG LYS A 12 -4.632 7.188 1.043 1.00 0.00 C ATOM 164 CD LYS A 12 -3.838 6.931 2.304 1.00 0.00 C ATOM 165 CE LYS A 12 -2.356 6.630 2.051 1.00 0.00 C ATOM 166 NZ LYS A 12 -1.657 7.670 1.274 1.00 0.00 N ATOM 0 H LYS A 12 -7.071 5.410 0.215 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.398 7.130 -1.520 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -4.856 5.100 0.649 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.615 5.883 -0.309 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.226 8.062 0.534 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -5.662 7.424 1.309 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -3.916 7.801 2.955 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.284 6.092 2.838 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -1.852 6.507 3.010 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.274 5.680 1.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -0.659 7.709 1.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -1.714 7.443 0.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.104 8.593 1.448 1.00 0.00 H new ATOM 180 N LEU A 13 -6.562 4.411 -2.288 1.00 0.00 N ATOM 181 CA LEU A 13 -6.727 3.364 -3.253 1.00 0.00 C ATOM 182 C LEU A 13 -6.508 3.967 -4.653 1.00 0.00 C ATOM 183 O LEU A 13 -5.937 3.342 -5.542 1.00 0.00 O ATOM 184 CB LEU A 13 -8.167 2.851 -3.068 1.00 0.00 C ATOM 185 CG LEU A 13 -8.552 1.486 -3.631 1.00 0.00 C ATOM 186 CD1 LEU A 13 -9.933 1.122 -3.122 1.00 0.00 C ATOM 187 CD2 LEU A 13 -8.547 1.475 -5.149 1.00 0.00 C ATOM 0 H LEU A 13 -7.417 4.602 -1.765 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.021 2.542 -3.132 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.374 2.834 -1.998 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.837 3.588 -3.510 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.814 0.757 -3.298 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -10.221 0.148 -3.517 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.921 1.083 -2.033 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.651 1.873 -3.450 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -8.827 0.484 -5.507 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -9.261 2.210 -5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -7.549 1.723 -5.511 1.00 0.00 H new ATOM 199 N LYS A 14 -6.936 5.217 -4.798 1.00 0.00 N ATOM 200 CA LYS A 14 -6.802 5.975 -6.037 1.00 0.00 C ATOM 201 C LYS A 14 -5.328 6.145 -6.395 1.00 0.00 C ATOM 202 O LYS A 14 -4.951 6.113 -7.580 1.00 0.00 O ATOM 203 CB LYS A 14 -7.438 7.353 -5.848 1.00 0.00 C ATOM 204 CG LYS A 14 -8.928 7.310 -5.522 1.00 0.00 C ATOM 205 CD LYS A 14 -9.447 8.672 -5.070 1.00 0.00 C ATOM 206 CE LYS A 14 -9.416 9.743 -6.160 1.00 0.00 C ATOM 207 NZ LYS A 14 -10.392 9.481 -7.242 1.00 0.00 N ATOM 0 H LYS A 14 -7.391 5.738 -4.049 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.302 5.437 -6.843 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.916 7.876 -5.046 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.292 7.937 -6.757 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.483 6.982 -6.401 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.108 6.574 -4.739 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.471 8.559 -4.715 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.852 9.013 -4.223 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.625 10.716 -5.715 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.413 9.795 -6.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.415 10.292 -7.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.110 8.627 -7.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -11.337 9.340 -6.831 1.00 0.00 H new ATOM 221 N GLU A 15 -4.502 6.277 -5.360 1.00 0.00 N ATOM 222 CA GLU A 15 -3.090 6.496 -5.519 1.00 0.00 C ATOM 223 C GLU A 15 -2.422 5.220 -6.016 1.00 0.00 C ATOM 224 O GLU A 15 -1.927 5.181 -7.127 1.00 0.00 O ATOM 225 CB GLU A 15 -2.455 6.945 -4.190 1.00 0.00 C ATOM 226 CG GLU A 15 -3.169 8.115 -3.522 1.00 0.00 C ATOM 227 CD GLU A 15 -2.474 8.610 -2.272 1.00 0.00 C ATOM 228 OE1 GLU A 15 -2.394 7.878 -1.277 1.00 0.00 O ATOM 229 OE2 GLU A 15 -1.987 9.764 -2.272 1.00 0.00 O ATOM 0 H GLU A 15 -4.807 6.233 -4.388 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.941 7.288 -6.253 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.443 6.100 -3.502 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.417 7.223 -4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.248 8.937 -4.234 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.185 7.814 -3.268 1.00 0.00 H new ATOM 236 N ILE A 16 -2.485 4.165 -5.213 1.00 0.00 N ATOM 237 CA ILE A 16 -1.823 2.876 -5.523 1.00 0.00 C ATOM 238 C ILE A 16 -2.194 2.319 -6.901 1.00 0.00 C ATOM 239 O ILE A 16 -1.324 1.829 -7.640 1.00 0.00 O ATOM 240 CB ILE A 16 -2.105 1.799 -4.439 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.618 1.597 -4.240 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.441 2.192 -3.141 1.00 0.00 C ATOM 243 CD1 ILE A 16 -3.991 0.524 -3.249 1.00 0.00 C ATOM 0 H ILE A 16 -2.992 4.165 -4.328 1.00 0.00 H new ATOM 0 HA ILE A 16 -0.757 3.105 -5.532 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.687 0.850 -4.775 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.056 2.540 -3.914 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.067 1.354 -5.203 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.642 1.433 -2.385 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.365 2.276 -3.294 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -1.836 3.151 -2.806 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.077 0.456 -3.177 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.589 -0.433 -3.581 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.578 0.772 -2.271 1.00 0.00 H new ATOM 255 N LEU A 17 -3.461 2.448 -7.247 1.00 0.00 N ATOM 256 CA LEU A 17 -3.993 1.936 -8.486 1.00 0.00 C ATOM 257 C LEU A 17 -3.335 2.608 -9.687 1.00 0.00 C ATOM 258 O LEU A 17 -2.728 1.946 -10.521 1.00 0.00 O ATOM 259 CB LEU A 17 -5.514 2.156 -8.506 1.00 0.00 C ATOM 260 CG LEU A 17 -6.295 1.611 -9.699 1.00 0.00 C ATOM 261 CD1 LEU A 17 -6.123 0.106 -9.822 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.761 1.961 -9.542 1.00 0.00 C ATOM 0 H LEU A 17 -4.154 2.918 -6.665 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.778 0.870 -8.553 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.929 1.711 -7.602 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.698 3.229 -8.446 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.907 2.067 -10.610 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.690 -0.256 -10.680 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.068 -0.130 -9.959 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -6.488 -0.377 -8.916 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.321 1.573 -10.393 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.144 1.518 -8.623 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.874 3.044 -9.497 1.00 0.00 H new ATOM 274 N GLY A 18 -3.383 3.922 -9.717 1.00 0.00 N ATOM 275 CA GLY A 18 -2.908 4.639 -10.876 1.00 0.00 C ATOM 276 C GLY A 18 -1.437 5.001 -10.821 1.00 0.00 C ATOM 277 O GLY A 18 -0.767 5.055 -11.852 1.00 0.00 O ATOM 0 H GLY A 18 -3.741 4.508 -8.962 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -3.089 4.033 -11.764 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.492 5.552 -10.989 1.00 0.00 H new ATOM 281 N SER A 19 -0.924 5.215 -9.642 1.00 0.00 N ATOM 282 CA SER A 19 0.444 5.653 -9.486 1.00 0.00 C ATOM 283 C SER A 19 1.410 4.487 -9.649 1.00 0.00 C ATOM 284 O SER A 19 2.548 4.668 -10.103 1.00 0.00 O ATOM 285 CB SER A 19 0.643 6.363 -8.133 1.00 0.00 C ATOM 286 OG SER A 19 1.958 6.856 -7.975 1.00 0.00 O ATOM 0 H SER A 19 -1.433 5.094 -8.766 1.00 0.00 H new ATOM 0 HA SER A 19 0.662 6.375 -10.273 1.00 0.00 H new ATOM 0 HB2 SER A 19 -0.064 7.188 -8.051 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.418 5.668 -7.324 1.00 0.00 H new ATOM 0 HG SER A 19 2.039 7.299 -7.105 1.00 0.00 H new ATOM 292 N ASN A 20 0.981 3.297 -9.307 1.00 0.00 N ATOM 293 CA ASN A 20 1.860 2.170 -9.473 1.00 0.00 C ATOM 294 C ASN A 20 1.323 1.220 -10.497 1.00 0.00 C ATOM 295 O ASN A 20 2.004 0.944 -11.489 1.00 0.00 O ATOM 296 CB ASN A 20 2.126 1.414 -8.173 1.00 0.00 C ATOM 297 CG ASN A 20 3.193 0.331 -8.379 1.00 0.00 C ATOM 298 OD1 ASN A 20 4.109 0.495 -9.186 1.00 0.00 O ATOM 299 ND2 ASN A 20 3.074 -0.769 -7.683 1.00 0.00 N ATOM 0 H ASN A 20 0.059 3.088 -8.924 1.00 0.00 H new ATOM 0 HA ASN A 20 2.810 2.584 -9.810 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.454 2.112 -7.402 1.00 0.00 H new ATOM 0 HB3 ASN A 20 1.202 0.957 -7.817 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.751 -1.523 -7.800 1.00 0.00 H new ATOM 0 HD22 ASN A 20 2.304 -0.874 -7.023 1.00 0.00 H new ATOM 306 N LYS A 21 0.074 0.769 -10.291 1.00 0.00 N ATOM 307 CA LYS A 21 -0.528 -0.270 -11.109 1.00 0.00 C ATOM 308 C LYS A 21 0.405 -1.518 -10.995 1.00 0.00 C ATOM 309 O LYS A 21 0.856 -1.827 -9.888 1.00 0.00 O ATOM 310 CB LYS A 21 -0.691 0.236 -12.569 1.00 0.00 C ATOM 311 CG LYS A 21 -1.678 -0.555 -13.402 1.00 0.00 C ATOM 312 CD LYS A 21 -1.750 -0.042 -14.828 1.00 0.00 C ATOM 313 CE LYS A 21 -2.665 -0.908 -15.689 1.00 0.00 C ATOM 314 NZ LYS A 21 -4.036 -0.980 -15.146 1.00 0.00 N ATOM 0 H LYS A 21 -0.536 1.120 -9.553 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.530 -0.537 -10.773 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.008 1.278 -12.545 1.00 0.00 H new ATOM 0 HB3 LYS A 21 0.282 0.210 -13.060 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.389 -1.606 -13.408 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.666 -0.499 -12.945 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -2.114 0.985 -14.828 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.750 -0.026 -15.261 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.697 -0.505 -16.701 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.250 -1.914 -15.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -4.662 -1.432 -15.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -4.033 -1.539 -14.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.380 -0.020 -14.944 1.00 0.00 H new ATOM 328 N ASN A 22 0.631 -2.250 -12.097 1.00 0.00 N ATOM 329 CA ASN A 22 1.614 -3.377 -12.188 1.00 0.00 C ATOM 330 C ASN A 22 1.199 -4.646 -11.381 1.00 0.00 C ATOM 331 O ASN A 22 1.755 -5.730 -11.557 1.00 0.00 O ATOM 332 CB ASN A 22 3.038 -2.882 -11.805 1.00 0.00 C ATOM 333 CG ASN A 22 4.162 -3.855 -12.149 1.00 0.00 C ATOM 334 OD1 ASN A 22 4.066 -4.644 -13.097 1.00 0.00 O ATOM 335 ND2 ASN A 22 5.253 -3.776 -11.416 1.00 0.00 N ATOM 0 H ASN A 22 0.135 -2.084 -12.973 1.00 0.00 H new ATOM 0 HA ASN A 22 1.622 -3.701 -13.229 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.227 -1.935 -12.310 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.063 -2.682 -10.734 1.00 0.00 H new ATOM 0 HD21 ASN A 22 6.051 -4.376 -11.623 1.00 0.00 H new ATOM 0 HD22 ASN A 22 5.300 -3.114 -10.641 1.00 0.00 H new ATOM 342 N TYR A 23 0.228 -4.507 -10.528 1.00 0.00 N ATOM 343 CA TYR A 23 -0.319 -5.617 -9.775 1.00 0.00 C ATOM 344 C TYR A 23 -1.748 -5.857 -10.188 1.00 0.00 C ATOM 345 O TYR A 23 -2.373 -4.983 -10.793 1.00 0.00 O ATOM 346 CB TYR A 23 -0.269 -5.352 -8.264 1.00 0.00 C ATOM 347 CG TYR A 23 1.097 -5.495 -7.627 1.00 0.00 C ATOM 348 CD1 TYR A 23 1.506 -6.722 -7.123 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.964 -4.416 -7.513 1.00 0.00 C ATOM 350 CE1 TYR A 23 2.738 -6.877 -6.529 1.00 0.00 C ATOM 351 CE2 TYR A 23 3.205 -4.564 -6.919 1.00 0.00 C ATOM 352 CZ TYR A 23 3.584 -5.798 -6.427 1.00 0.00 C ATOM 353 OH TYR A 23 4.827 -5.960 -5.837 1.00 0.00 O ATOM 0 H TYR A 23 -0.218 -3.612 -10.327 1.00 0.00 H new ATOM 0 HA TYR A 23 0.288 -6.496 -9.990 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.635 -4.343 -8.076 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.956 -6.038 -7.769 1.00 0.00 H new ATOM 0 HD1 TYR A 23 0.844 -7.572 -7.198 1.00 0.00 H new ATOM 0 HD2 TYR A 23 1.666 -3.450 -7.893 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.038 -7.841 -6.145 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.874 -3.719 -6.840 1.00 0.00 H new ATOM 0 HH TYR A 23 5.306 -5.105 -5.842 1.00 0.00 H new ATOM 363 N LYS A 24 -2.260 -7.027 -9.897 1.00 0.00 N ATOM 364 CA LYS A 24 -3.651 -7.312 -10.140 1.00 0.00 C ATOM 365 C LYS A 24 -4.392 -6.994 -8.862 1.00 0.00 C ATOM 366 O LYS A 24 -4.315 -7.746 -7.889 1.00 0.00 O ATOM 367 CB LYS A 24 -3.861 -8.785 -10.525 1.00 0.00 C ATOM 368 CG LYS A 24 -5.305 -9.151 -10.888 1.00 0.00 C ATOM 369 CD LYS A 24 -5.759 -8.521 -12.209 1.00 0.00 C ATOM 370 CE LYS A 24 -5.005 -9.108 -13.398 1.00 0.00 C ATOM 371 NZ LYS A 24 -5.439 -8.525 -14.684 1.00 0.00 N ATOM 0 H LYS A 24 -1.732 -7.799 -9.490 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.020 -6.713 -10.972 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.217 -9.021 -11.372 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.539 -9.413 -9.695 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.395 -10.235 -10.957 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.970 -8.827 -10.088 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.829 -8.681 -12.341 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.600 -7.443 -12.173 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.936 -8.937 -13.267 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.155 -10.187 -13.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -4.898 -8.956 -15.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.453 -8.710 -14.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.272 -7.499 -14.674 1.00 0.00 H new ATOM 385 N PHE A 25 -5.043 -5.872 -8.844 1.00 0.00 N ATOM 386 CA PHE A 25 -5.716 -5.397 -7.661 1.00 0.00 C ATOM 387 C PHE A 25 -7.003 -6.154 -7.415 1.00 0.00 C ATOM 388 O PHE A 25 -7.883 -6.227 -8.282 1.00 0.00 O ATOM 389 CB PHE A 25 -5.962 -3.893 -7.748 1.00 0.00 C ATOM 390 CG PHE A 25 -4.702 -3.070 -7.775 1.00 0.00 C ATOM 391 CD1 PHE A 25 -4.018 -2.871 -8.956 1.00 0.00 C ATOM 392 CD2 PHE A 25 -4.200 -2.501 -6.616 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.866 -2.130 -8.990 1.00 0.00 C ATOM 394 CE2 PHE A 25 -3.040 -1.751 -6.645 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.371 -1.565 -7.835 1.00 0.00 C ATOM 0 H PHE A 25 -5.127 -5.253 -9.650 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.065 -5.583 -6.807 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.542 -3.681 -8.646 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.568 -3.584 -6.896 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -4.397 -3.306 -9.869 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -4.720 -2.645 -5.681 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -2.344 -1.988 -9.925 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -2.658 -1.311 -5.736 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.464 -0.980 -7.862 1.00 0.00 H new ATOM 405 N VAL A 26 -7.092 -6.718 -6.246 1.00 0.00 N ATOM 406 CA VAL A 26 -8.213 -7.508 -5.826 1.00 0.00 C ATOM 407 C VAL A 26 -8.854 -6.853 -4.608 1.00 0.00 C ATOM 408 O VAL A 26 -8.157 -6.415 -3.685 1.00 0.00 O ATOM 409 CB VAL A 26 -7.761 -8.953 -5.447 1.00 0.00 C ATOM 410 CG1 VAL A 26 -8.938 -9.815 -5.019 1.00 0.00 C ATOM 411 CG2 VAL A 26 -7.008 -9.614 -6.591 1.00 0.00 C ATOM 0 H VAL A 26 -6.364 -6.638 -5.536 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.927 -7.568 -6.648 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.084 -8.863 -4.597 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.584 -10.813 -4.763 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.420 -9.367 -4.150 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.655 -9.883 -5.837 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.707 -10.619 -6.296 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.654 -9.672 -7.467 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.122 -9.026 -6.832 1.00 0.00 H new ATOM 421 N ILE A 27 -10.148 -6.762 -4.614 1.00 0.00 N ATOM 422 CA ILE A 27 -10.869 -6.215 -3.505 1.00 0.00 C ATOM 423 C ILE A 27 -11.849 -7.274 -2.978 1.00 0.00 C ATOM 424 O ILE A 27 -12.320 -8.136 -3.739 1.00 0.00 O ATOM 425 CB ILE A 27 -11.609 -4.892 -3.894 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.223 -4.212 -2.669 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.672 -5.145 -4.941 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.203 -3.801 -1.636 1.00 0.00 C ATOM 0 H ILE A 27 -10.736 -7.066 -5.390 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.165 -5.953 -2.716 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.862 -4.220 -4.317 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.777 -3.331 -2.992 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.942 -4.890 -2.209 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.168 -4.207 -5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.209 -5.560 -5.837 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.406 -5.851 -4.552 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.708 -3.325 -0.795 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.665 -4.682 -1.285 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.498 -3.098 -2.080 1.00 0.00 H new ATOM 440 N THR A 28 -12.120 -7.235 -1.704 1.00 0.00 N ATOM 441 CA THR A 28 -12.970 -8.195 -1.076 1.00 0.00 C ATOM 442 C THR A 28 -14.453 -7.817 -1.171 1.00 0.00 C ATOM 443 O THR A 28 -14.817 -6.678 -1.543 1.00 0.00 O ATOM 444 CB THR A 28 -12.563 -8.341 0.389 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.469 -7.031 0.986 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.225 -9.032 0.499 1.00 0.00 C ATOM 0 H THR A 28 -11.751 -6.527 -1.069 1.00 0.00 H new ATOM 0 HA THR A 28 -12.849 -9.142 -1.602 1.00 0.00 H new ATOM 0 HB THR A 28 -13.313 -8.939 0.906 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.210 -7.118 1.927 1.00 0.00 H new ATOM 0 HG21 THR A 28 -10.950 -9.128 1.549 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.289 -10.023 0.049 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.468 -8.445 -0.022 1.00 0.00 H new ATOM 454 N THR A 29 -15.292 -8.770 -0.821 1.00 0.00 N ATOM 455 CA THR A 29 -16.720 -8.618 -0.790 1.00 0.00 C ATOM 456 C THR A 29 -17.149 -7.588 0.268 1.00 0.00 C ATOM 457 O THR A 29 -18.044 -6.752 0.035 1.00 0.00 O ATOM 458 CB THR A 29 -17.335 -9.989 -0.502 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.290 -10.863 0.012 1.00 0.00 O ATOM 460 CG2 THR A 29 -17.925 -10.587 -1.763 1.00 0.00 C ATOM 0 H THR A 29 -14.981 -9.701 -0.542 1.00 0.00 H new ATOM 0 HA THR A 29 -17.072 -8.244 -1.751 1.00 0.00 H new ATOM 0 HB THR A 29 -18.136 -9.881 0.230 1.00 0.00 H new ATOM 0 HG1 THR A 29 -15.861 -10.441 0.785 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.357 -11.562 -1.536 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.702 -9.927 -2.150 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.141 -10.703 -2.512 1.00 0.00 H new ATOM 468 N LEU A 30 -16.503 -7.628 1.412 1.00 0.00 N ATOM 469 CA LEU A 30 -16.763 -6.663 2.452 1.00 0.00 C ATOM 470 C LEU A 30 -16.113 -5.346 2.090 1.00 0.00 C ATOM 471 O LEU A 30 -16.632 -4.285 2.418 1.00 0.00 O ATOM 472 CB LEU A 30 -16.272 -7.169 3.806 1.00 0.00 C ATOM 473 CG LEU A 30 -16.956 -8.436 4.330 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.304 -8.893 5.610 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.444 -8.199 4.553 1.00 0.00 C ATOM 0 H LEU A 30 -15.792 -8.321 1.644 1.00 0.00 H new ATOM 0 HA LEU A 30 -17.839 -6.513 2.537 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.201 -7.359 3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.407 -6.375 4.541 1.00 0.00 H new ATOM 0 HG LEU A 30 -16.843 -9.217 3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -16.801 -9.794 5.970 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.251 -9.108 5.426 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.388 -8.108 6.361 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -18.906 -9.113 4.925 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.580 -7.401 5.283 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -18.912 -7.913 3.611 1.00 0.00 H new ATOM 487 N GLY A 31 -15.001 -5.434 1.361 1.00 0.00 N ATOM 488 CA GLY A 31 -14.280 -4.265 0.905 1.00 0.00 C ATOM 489 C GLY A 31 -15.148 -3.358 0.068 1.00 0.00 C ATOM 490 O GLY A 31 -15.306 -2.177 0.386 1.00 0.00 O ATOM 0 H GLY A 31 -14.582 -6.319 1.075 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -13.903 -3.713 1.766 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.414 -4.578 0.322 1.00 0.00 H new ATOM 494 N VAL A 32 -15.749 -3.913 -0.982 1.00 0.00 N ATOM 495 CA VAL A 32 -16.622 -3.122 -1.843 1.00 0.00 C ATOM 496 C VAL A 32 -17.806 -2.552 -1.066 1.00 0.00 C ATOM 497 O VAL A 32 -18.116 -1.384 -1.191 1.00 0.00 O ATOM 498 CB VAL A 32 -17.113 -3.879 -3.123 1.00 0.00 C ATOM 499 CG1 VAL A 32 -15.951 -4.217 -4.024 1.00 0.00 C ATOM 500 CG2 VAL A 32 -17.887 -5.144 -2.784 1.00 0.00 C ATOM 0 H VAL A 32 -15.650 -4.891 -1.254 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.002 -2.299 -2.199 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.791 -3.204 -3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.316 -4.742 -4.907 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.449 -3.299 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.248 -4.854 -3.487 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.206 -5.633 -3.704 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.248 -5.820 -2.216 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -18.762 -4.886 -2.188 1.00 0.00 H new ATOM 510 N SER A 33 -18.394 -3.366 -0.206 1.00 0.00 N ATOM 511 CA SER A 33 -19.553 -2.972 0.576 1.00 0.00 C ATOM 512 C SER A 33 -19.218 -1.810 1.530 1.00 0.00 C ATOM 513 O SER A 33 -19.994 -0.848 1.660 1.00 0.00 O ATOM 514 CB SER A 33 -20.060 -4.177 1.355 1.00 0.00 C ATOM 515 OG SER A 33 -20.357 -5.265 0.474 1.00 0.00 O ATOM 0 H SER A 33 -18.080 -4.321 -0.030 1.00 0.00 H new ATOM 0 HA SER A 33 -20.332 -2.620 -0.101 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.310 -4.487 2.082 1.00 0.00 H new ATOM 0 HB3 SER A 33 -20.954 -3.903 1.916 1.00 0.00 H new ATOM 0 HG SER A 33 -19.544 -5.789 0.316 1.00 0.00 H new ATOM 521 N PHE A 34 -18.053 -1.893 2.152 1.00 0.00 N ATOM 522 CA PHE A 34 -17.571 -0.878 3.066 1.00 0.00 C ATOM 523 C PHE A 34 -17.383 0.433 2.310 1.00 0.00 C ATOM 524 O PHE A 34 -17.794 1.499 2.777 1.00 0.00 O ATOM 525 CB PHE A 34 -16.248 -1.353 3.688 1.00 0.00 C ATOM 526 CG PHE A 34 -15.660 -0.460 4.743 1.00 0.00 C ATOM 527 CD1 PHE A 34 -16.128 -0.511 6.036 1.00 0.00 C ATOM 528 CD2 PHE A 34 -14.627 0.413 4.446 1.00 0.00 C ATOM 529 CE1 PHE A 34 -15.582 0.286 7.016 1.00 0.00 C ATOM 530 CE2 PHE A 34 -14.074 1.211 5.423 1.00 0.00 C ATOM 531 CZ PHE A 34 -14.554 1.147 6.711 1.00 0.00 C ATOM 0 H PHE A 34 -17.411 -2.677 2.033 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.292 -0.712 3.866 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.407 -2.340 4.123 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.515 -1.471 2.890 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -16.934 -1.185 6.285 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.250 0.469 3.435 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -15.961 0.235 8.026 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -13.266 1.885 5.179 1.00 0.00 H new ATOM 0 HZ PHE A 34 -14.124 1.771 7.480 1.00 0.00 H new ATOM 541 N ALA A 35 -16.809 0.331 1.127 1.00 0.00 N ATOM 542 CA ALA A 35 -16.573 1.480 0.282 1.00 0.00 C ATOM 543 C ALA A 35 -17.886 2.070 -0.227 1.00 0.00 C ATOM 544 O ALA A 35 -18.033 3.295 -0.300 1.00 0.00 O ATOM 545 CB ALA A 35 -15.660 1.114 -0.871 1.00 0.00 C ATOM 0 H ALA A 35 -16.494 -0.553 0.726 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.078 2.244 0.881 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -15.494 1.991 -1.496 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -14.706 0.760 -0.481 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.123 0.327 -1.466 1.00 0.00 H new ATOM 551 N ILE A 36 -18.835 1.200 -0.563 1.00 0.00 N ATOM 552 CA ILE A 36 -20.163 1.613 -1.027 1.00 0.00 C ATOM 553 C ILE A 36 -20.871 2.460 0.022 1.00 0.00 C ATOM 554 O ILE A 36 -21.284 3.583 -0.265 1.00 0.00 O ATOM 555 CB ILE A 36 -21.071 0.386 -1.417 1.00 0.00 C ATOM 556 CG1 ILE A 36 -20.541 -0.339 -2.670 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.534 0.794 -1.619 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.513 0.505 -3.930 1.00 0.00 C ATOM 0 H ILE A 36 -18.708 0.189 -0.522 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.003 2.210 -1.925 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.029 -0.307 -0.577 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -19.531 -0.696 -2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.159 -1.218 -2.852 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.123 -0.083 -1.887 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -22.923 1.224 -0.696 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -22.599 1.532 -2.419 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.126 -0.089 -4.758 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.523 0.841 -4.166 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -19.870 1.371 -3.774 1.00 0.00 H new ATOM 570 N LYS A 37 -20.956 1.960 1.248 1.00 0.00 N ATOM 571 CA LYS A 37 -21.693 2.667 2.282 1.00 0.00 C ATOM 572 C LYS A 37 -20.957 3.907 2.794 1.00 0.00 C ATOM 573 O LYS A 37 -21.532 4.736 3.495 1.00 0.00 O ATOM 574 CB LYS A 37 -22.141 1.706 3.421 1.00 0.00 C ATOM 575 CG LYS A 37 -21.041 1.001 4.238 1.00 0.00 C ATOM 576 CD LYS A 37 -20.379 1.927 5.256 1.00 0.00 C ATOM 577 CE LYS A 37 -19.437 1.169 6.173 1.00 0.00 C ATOM 578 NZ LYS A 37 -20.156 0.200 7.028 1.00 0.00 N ATOM 0 H LYS A 37 -20.531 1.082 1.546 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.604 3.049 1.820 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -22.762 2.274 4.114 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -22.776 0.937 2.981 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -21.472 0.145 4.758 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -20.282 0.612 3.559 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.828 2.708 4.733 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -21.146 2.422 5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -18.694 0.642 5.574 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -18.896 1.876 6.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -19.546 -0.082 7.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -21.023 0.640 7.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.405 -0.640 6.467 1.00 0.00 H new ATOM 592 N SER A 38 -19.700 4.022 2.452 1.00 0.00 N ATOM 593 CA SER A 38 -18.919 5.149 2.874 1.00 0.00 C ATOM 594 C SER A 38 -18.838 6.208 1.753 1.00 0.00 C ATOM 595 O SER A 38 -18.495 7.365 2.008 1.00 0.00 O ATOM 596 CB SER A 38 -17.526 4.676 3.316 1.00 0.00 C ATOM 597 OG SER A 38 -16.767 5.723 3.907 1.00 0.00 O ATOM 0 H SER A 38 -19.196 3.344 1.880 1.00 0.00 H new ATOM 0 HA SER A 38 -19.403 5.624 3.728 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.631 3.858 4.029 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.988 4.281 2.454 1.00 0.00 H new ATOM 0 HG SER A 38 -15.889 5.380 4.175 1.00 0.00 H new ATOM 603 N GLY A 39 -19.178 5.812 0.530 1.00 0.00 N ATOM 604 CA GLY A 39 -19.136 6.738 -0.585 1.00 0.00 C ATOM 605 C GLY A 39 -17.725 6.937 -1.113 1.00 0.00 C ATOM 606 O GLY A 39 -17.315 8.061 -1.421 1.00 0.00 O ATOM 0 H GLY A 39 -19.481 4.868 0.292 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.773 6.367 -1.388 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.544 7.699 -0.272 1.00 0.00 H new ATOM 610 N ILE A 40 -16.977 5.863 -1.203 1.00 0.00 N ATOM 611 CA ILE A 40 -15.591 5.929 -1.651 1.00 0.00 C ATOM 612 C ILE A 40 -15.501 5.509 -3.129 1.00 0.00 C ATOM 613 O ILE A 40 -16.421 4.848 -3.645 1.00 0.00 O ATOM 614 CB ILE A 40 -14.691 4.992 -0.775 1.00 0.00 C ATOM 615 CG1 ILE A 40 -14.945 5.279 0.707 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.203 5.196 -1.094 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.181 4.388 1.665 1.00 0.00 C ATOM 0 H ILE A 40 -17.300 4.924 -0.972 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.236 6.954 -1.546 1.00 0.00 H new ATOM 0 HB ILE A 40 -14.949 3.957 -1.002 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.684 6.317 0.912 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -16.011 5.173 0.906 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -12.603 4.533 -0.471 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -13.022 4.969 -2.145 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -12.926 6.231 -0.893 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.424 4.664 2.691 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -14.458 3.348 1.494 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.110 4.510 1.500 1.00 0.00 H new ATOM 629 N ASP A 41 -14.437 5.940 -3.818 1.00 0.00 N ATOM 630 CA ASP A 41 -14.160 5.526 -5.200 1.00 0.00 C ATOM 631 C ASP A 41 -13.821 4.051 -5.277 1.00 0.00 C ATOM 632 O ASP A 41 -12.650 3.665 -5.221 1.00 0.00 O ATOM 633 CB ASP A 41 -13.008 6.320 -5.864 1.00 0.00 C ATOM 634 CG ASP A 41 -13.395 7.667 -6.408 1.00 0.00 C ATOM 635 OD1 ASP A 41 -14.287 7.725 -7.276 1.00 0.00 O ATOM 636 OD2 ASP A 41 -12.753 8.686 -6.048 1.00 0.00 O ATOM 0 H ASP A 41 -13.745 6.584 -3.435 1.00 0.00 H new ATOM 0 HA ASP A 41 -15.080 5.737 -5.745 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -12.212 6.456 -5.132 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -12.596 5.722 -6.676 1.00 0.00 H new ATOM 641 N ILE A 42 -14.828 3.235 -5.330 1.00 0.00 N ATOM 642 CA ILE A 42 -14.633 1.815 -5.492 1.00 0.00 C ATOM 643 C ILE A 42 -15.034 1.416 -6.904 1.00 0.00 C ATOM 644 O ILE A 42 -14.420 0.559 -7.527 1.00 0.00 O ATOM 645 CB ILE A 42 -15.415 0.984 -4.421 1.00 0.00 C ATOM 646 CG1 ILE A 42 -15.148 -0.523 -4.568 1.00 0.00 C ATOM 647 CG2 ILE A 42 -16.913 1.273 -4.455 1.00 0.00 C ATOM 648 CD1 ILE A 42 -13.700 -0.923 -4.338 1.00 0.00 C ATOM 0 H ILE A 42 -15.804 3.525 -5.263 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.578 1.591 -5.337 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.041 1.299 -3.447 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -15.779 -1.063 -3.862 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.446 -0.838 -5.568 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.416 0.675 -3.695 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.084 2.331 -4.256 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.310 1.020 -5.438 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.597 -2.001 -4.460 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.063 -0.413 -5.060 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.401 -0.642 -3.328 1.00 0.00 H new ATOM 660 N ASP A 43 -16.000 2.126 -7.437 1.00 0.00 N ATOM 661 CA ASP A 43 -16.518 1.882 -8.774 1.00 0.00 C ATOM 662 C ASP A 43 -15.477 2.310 -9.789 1.00 0.00 C ATOM 663 O ASP A 43 -15.273 1.649 -10.808 1.00 0.00 O ATOM 664 CB ASP A 43 -17.841 2.646 -8.983 1.00 0.00 C ATOM 665 CG ASP A 43 -17.695 4.155 -8.882 1.00 0.00 C ATOM 666 OD1 ASP A 43 -16.962 4.632 -7.990 1.00 0.00 O ATOM 667 OD2 ASP A 43 -18.326 4.885 -9.678 1.00 0.00 O ATOM 0 H ASP A 43 -16.457 2.899 -6.954 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.726 0.820 -8.902 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -18.246 2.393 -9.963 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -18.566 2.309 -8.242 1.00 0.00 H new ATOM 672 N SER A 44 -14.796 3.399 -9.470 1.00 0.00 N ATOM 673 CA SER A 44 -13.702 3.919 -10.257 1.00 0.00 C ATOM 674 C SER A 44 -12.525 2.921 -10.246 1.00 0.00 C ATOM 675 O SER A 44 -11.764 2.821 -11.199 1.00 0.00 O ATOM 676 CB SER A 44 -13.269 5.254 -9.650 1.00 0.00 C ATOM 677 OG SER A 44 -14.401 6.101 -9.439 1.00 0.00 O ATOM 0 H SER A 44 -14.997 3.954 -8.638 1.00 0.00 H new ATOM 0 HA SER A 44 -14.016 4.065 -11.291 1.00 0.00 H new ATOM 0 HB2 SER A 44 -12.756 5.080 -8.704 1.00 0.00 H new ATOM 0 HB3 SER A 44 -12.557 5.747 -10.312 1.00 0.00 H new ATOM 0 HG SER A 44 -14.318 6.547 -8.571 1.00 0.00 H new ATOM 683 N ALA A 45 -12.421 2.165 -9.173 1.00 0.00 N ATOM 684 CA ALA A 45 -11.372 1.188 -9.021 1.00 0.00 C ATOM 685 C ALA A 45 -11.692 -0.047 -9.859 1.00 0.00 C ATOM 686 O ALA A 45 -10.859 -0.510 -10.664 1.00 0.00 O ATOM 687 CB ALA A 45 -11.215 0.828 -7.554 1.00 0.00 C ATOM 0 H ALA A 45 -13.064 2.213 -8.383 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.429 1.605 -9.373 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.421 0.089 -7.444 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.960 1.722 -6.985 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -12.151 0.414 -7.179 1.00 0.00 H new ATOM 693 N LEU A 46 -12.915 -0.549 -9.696 1.00 0.00 N ATOM 694 CA LEU A 46 -13.400 -1.722 -10.433 1.00 0.00 C ATOM 695 C LEU A 46 -13.315 -1.461 -11.934 1.00 0.00 C ATOM 696 O LEU A 46 -12.907 -2.327 -12.712 1.00 0.00 O ATOM 697 CB LEU A 46 -14.846 -2.034 -10.037 1.00 0.00 C ATOM 698 CG LEU A 46 -15.105 -2.285 -8.542 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.572 -2.575 -8.286 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.236 -3.412 -8.015 1.00 0.00 C ATOM 0 H LEU A 46 -13.600 -0.156 -9.050 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.775 -2.580 -10.183 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -15.475 -1.204 -10.358 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -15.170 -2.914 -10.593 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.838 -1.375 -8.004 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.728 -2.749 -7.221 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -17.173 -1.724 -8.607 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.871 -3.461 -8.846 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.442 -3.565 -6.956 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.456 -4.328 -8.564 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.185 -3.153 -8.146 1.00 0.00 H new ATOM 712 N ASP A 47 -13.674 -0.241 -12.301 1.00 0.00 N ATOM 713 CA ASP A 47 -13.591 0.276 -13.677 1.00 0.00 C ATOM 714 C ASP A 47 -12.190 0.084 -14.246 1.00 0.00 C ATOM 715 O ASP A 47 -12.012 -0.488 -15.327 1.00 0.00 O ATOM 716 CB ASP A 47 -13.920 1.783 -13.663 1.00 0.00 C ATOM 717 CG ASP A 47 -13.765 2.485 -15.003 1.00 0.00 C ATOM 718 OD1 ASP A 47 -12.642 2.854 -15.375 1.00 0.00 O ATOM 719 OD2 ASP A 47 -14.781 2.747 -15.672 1.00 0.00 O ATOM 0 H ASP A 47 -14.042 0.443 -11.640 1.00 0.00 H new ATOM 0 HA ASP A 47 -14.300 -0.270 -14.300 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -14.946 1.913 -13.318 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.274 2.274 -12.935 1.00 0.00 H new ATOM 724 N ARG A 48 -11.204 0.501 -13.471 1.00 0.00 N ATOM 725 CA ARG A 48 -9.813 0.517 -13.903 1.00 0.00 C ATOM 726 C ARG A 48 -9.111 -0.819 -13.778 1.00 0.00 C ATOM 727 O ARG A 48 -7.924 -0.925 -14.098 1.00 0.00 O ATOM 728 CB ARG A 48 -9.053 1.579 -13.161 1.00 0.00 C ATOM 729 CG ARG A 48 -9.552 2.952 -13.461 1.00 0.00 C ATOM 730 CD ARG A 48 -8.882 3.976 -12.603 1.00 0.00 C ATOM 731 NE ARG A 48 -9.488 5.277 -12.824 1.00 0.00 N ATOM 732 CZ ARG A 48 -9.902 6.108 -11.878 1.00 0.00 C ATOM 733 NH1 ARG A 48 -9.715 5.819 -10.601 1.00 0.00 N ATOM 734 NH2 ARG A 48 -10.508 7.228 -12.210 1.00 0.00 N ATOM 0 H ARG A 48 -11.344 0.840 -12.519 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.831 0.744 -14.969 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.129 1.394 -12.089 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.997 1.515 -13.422 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -9.375 3.183 -14.511 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.630 2.992 -13.303 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.970 3.698 -11.553 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.817 4.017 -12.834 1.00 0.00 H new ATOM 0 HE ARG A 48 -9.605 5.578 -13.792 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.249 4.951 -10.338 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -10.037 6.464 -9.880 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -10.658 7.455 -13.193 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -10.828 7.869 -11.484 1.00 0.00 H new ATOM 748 N GLY A 49 -9.800 -1.820 -13.297 1.00 0.00 N ATOM 749 CA GLY A 49 -9.207 -3.129 -13.302 1.00 0.00 C ATOM 750 C GLY A 49 -9.161 -3.810 -11.966 1.00 0.00 C ATOM 751 O GLY A 49 -8.638 -4.918 -11.863 1.00 0.00 O ATOM 0 H GLY A 49 -10.741 -1.759 -12.909 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.762 -3.760 -13.996 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -8.191 -3.049 -13.687 1.00 0.00 H new ATOM 755 N VAL A 50 -9.665 -3.178 -10.932 1.00 0.00 N ATOM 756 CA VAL A 50 -9.728 -3.852 -9.647 1.00 0.00 C ATOM 757 C VAL A 50 -10.823 -4.915 -9.715 1.00 0.00 C ATOM 758 O VAL A 50 -11.955 -4.631 -10.142 1.00 0.00 O ATOM 759 CB VAL A 50 -9.975 -2.875 -8.461 1.00 0.00 C ATOM 760 CG1 VAL A 50 -10.075 -3.624 -7.140 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.859 -1.851 -8.384 1.00 0.00 C ATOM 0 H VAL A 50 -10.029 -2.225 -10.947 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.760 -4.313 -9.452 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.922 -2.367 -8.640 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.248 -2.914 -6.331 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.903 -4.331 -7.185 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.146 -4.164 -6.957 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.044 -1.174 -7.550 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.907 -2.361 -8.233 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.823 -1.282 -9.313 1.00 0.00 H new ATOM 771 N ILE A 51 -10.478 -6.124 -9.375 1.00 0.00 N ATOM 772 CA ILE A 51 -11.406 -7.224 -9.443 1.00 0.00 C ATOM 773 C ILE A 51 -11.889 -7.600 -8.059 1.00 0.00 C ATOM 774 O ILE A 51 -11.167 -7.443 -7.077 1.00 0.00 O ATOM 775 CB ILE A 51 -10.801 -8.469 -10.157 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.519 -8.963 -9.451 1.00 0.00 C ATOM 777 CG2 ILE A 51 -10.533 -8.157 -11.624 1.00 0.00 C ATOM 778 CD1 ILE A 51 -8.899 -10.201 -10.077 1.00 0.00 C ATOM 0 H ILE A 51 -9.548 -6.378 -9.043 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.253 -6.886 -10.041 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.530 -9.277 -10.101 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.782 -8.160 -9.456 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -9.751 -9.175 -8.407 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -10.110 -9.035 -12.111 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.467 -7.884 -12.115 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.829 -7.328 -11.697 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.004 -10.481 -9.521 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.616 -11.022 -10.047 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.632 -9.990 -11.112 1.00 0.00 H new ATOM 790 N VAL A 52 -13.099 -8.075 -7.977 1.00 0.00 N ATOM 791 CA VAL A 52 -13.667 -8.463 -6.705 1.00 0.00 C ATOM 792 C VAL A 52 -13.474 -9.953 -6.534 1.00 0.00 C ATOM 793 O VAL A 52 -13.615 -10.725 -7.509 1.00 0.00 O ATOM 794 CB VAL A 52 -15.188 -8.139 -6.618 1.00 0.00 C ATOM 795 CG1 VAL A 52 -15.731 -8.412 -5.221 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.472 -6.706 -7.028 1.00 0.00 C ATOM 0 H VAL A 52 -13.719 -8.206 -8.777 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.163 -7.900 -5.919 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.701 -8.799 -7.318 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -16.795 -8.176 -5.192 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.585 -9.463 -4.973 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.202 -7.792 -4.497 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.542 -6.512 -6.956 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.935 -6.025 -6.367 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -15.143 -6.550 -8.055 1.00 0.00 H new ATOM 806 N ARG A 53 -13.106 -10.372 -5.352 1.00 0.00 N ATOM 807 CA ARG A 53 -12.949 -11.769 -5.084 1.00 0.00 C ATOM 808 C ARG A 53 -13.291 -12.099 -3.653 1.00 0.00 C ATOM 809 O ARG A 53 -12.932 -11.373 -2.727 1.00 0.00 O ATOM 810 CB ARG A 53 -11.539 -12.246 -5.443 1.00 0.00 C ATOM 811 CG ARG A 53 -11.272 -13.705 -5.124 1.00 0.00 C ATOM 812 CD ARG A 53 -9.923 -14.134 -5.633 1.00 0.00 C ATOM 813 NE ARG A 53 -9.590 -15.488 -5.218 1.00 0.00 N ATOM 814 CZ ARG A 53 -9.550 -16.562 -6.002 1.00 0.00 C ATOM 815 NH1 ARG A 53 -9.951 -16.498 -7.276 1.00 0.00 N ATOM 816 NH2 ARG A 53 -9.112 -17.711 -5.498 1.00 0.00 N ATOM 0 H ARG A 53 -12.910 -9.760 -4.560 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.653 -12.306 -5.719 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.373 -12.083 -6.508 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.814 -11.631 -4.910 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -11.323 -13.860 -4.046 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.047 -14.326 -5.572 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -9.910 -14.075 -6.721 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -9.162 -13.445 -5.267 1.00 0.00 H new ATOM 0 HE ARG A 53 -9.366 -15.627 -4.233 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -10.294 -15.617 -7.659 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -9.914 -17.330 -7.865 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -8.813 -17.760 -4.524 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -9.075 -18.544 -6.085 1.00 0.00 H new ATOM 830 N ALA A 54 -14.017 -13.166 -3.497 1.00 0.00 N ATOM 831 CA ALA A 54 -14.362 -13.688 -2.223 1.00 0.00 C ATOM 832 C ALA A 54 -13.791 -15.081 -2.139 1.00 0.00 C ATOM 833 O ALA A 54 -13.556 -15.724 -3.180 1.00 0.00 O ATOM 834 CB ALA A 54 -15.880 -13.728 -2.068 1.00 0.00 C ATOM 0 H ALA A 54 -14.392 -13.706 -4.277 1.00 0.00 H new ATOM 0 HA ALA A 54 -13.961 -13.061 -1.426 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.135 -14.130 -1.087 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -16.282 -12.719 -2.163 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.308 -14.363 -2.843 1.00 0.00 H new ATOM 998 N LEU A 65 -8.516 -7.352 14.760 1.00 0.00 N ATOM 999 CA LEU A 65 -9.029 -6.688 13.571 1.00 0.00 C ATOM 1000 C LEU A 65 -10.504 -6.979 13.326 1.00 0.00 C ATOM 1001 O LEU A 65 -10.999 -8.038 13.710 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.218 -7.118 12.359 1.00 0.00 C ATOM 1003 CG LEU A 65 -6.770 -6.678 12.360 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -6.032 -7.306 11.210 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.688 -5.161 12.274 1.00 0.00 C ATOM 0 HA LEU A 65 -8.934 -5.614 13.734 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.250 -8.205 12.288 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.699 -6.726 11.463 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.304 -7.004 13.290 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.992 -6.980 11.224 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.074 -8.391 11.300 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.495 -7.002 10.271 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.643 -4.852 12.275 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.165 -4.822 11.354 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.197 -4.720 13.131 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.238 -6.022 12.724 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.628 -6.234 12.330 1.00 0.00 C ATOM 1019 C PRO A 66 -12.723 -7.205 11.144 1.00 0.00 C ATOM 1020 O PRO A 66 -11.735 -7.395 10.401 1.00 0.00 O ATOM 1021 CB PRO A 66 -13.111 -4.837 11.904 1.00 0.00 C ATOM 1022 CG PRO A 66 -12.080 -3.890 12.415 1.00 0.00 C ATOM 1023 CD PRO A 66 -10.795 -4.652 12.419 1.00 0.00 C ATOM 0 HA PRO A 66 -13.222 -6.668 13.134 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.206 -4.767 10.820 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -14.092 -4.615 12.325 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -12.010 -3.008 11.779 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -12.331 -3.541 13.417 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -10.286 -4.595 11.457 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.101 -4.273 13.169 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.905 -7.768 10.947 1.00 0.00 N ATOM 1032 CA GLN A 67 -14.165 -8.770 9.916 1.00 0.00 C ATOM 1033 C GLN A 67 -13.803 -8.275 8.505 1.00 0.00 C ATOM 1034 O GLN A 67 -13.234 -9.030 7.716 1.00 0.00 O ATOM 1035 CB GLN A 67 -15.630 -9.244 9.977 1.00 0.00 C ATOM 1036 CG GLN A 67 -15.996 -10.277 8.925 1.00 0.00 C ATOM 1037 CD GLN A 67 -17.456 -10.679 8.975 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -17.826 -11.629 9.658 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -18.292 -9.957 8.279 1.00 0.00 N ATOM 0 H GLN A 67 -14.727 -7.540 11.507 1.00 0.00 H new ATOM 0 HA GLN A 67 -13.513 -9.619 10.124 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -15.823 -9.664 10.964 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.284 -8.380 9.864 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -15.768 -9.878 7.937 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -15.376 -11.163 9.062 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -17.949 -9.174 7.722 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -19.288 -10.176 8.292 1.00 0.00 H new ATOM 1048 N TYR A 68 -14.100 -7.016 8.195 1.00 0.00 N ATOM 1049 CA TYR A 68 -13.773 -6.478 6.868 1.00 0.00 C ATOM 1050 C TYR A 68 -12.258 -6.461 6.581 1.00 0.00 C ATOM 1051 O TYR A 68 -11.833 -6.756 5.457 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.468 -5.116 6.561 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.381 -4.065 7.652 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.174 -3.513 8.024 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.525 -3.626 8.303 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.098 -2.566 9.016 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.457 -2.676 9.297 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.239 -2.152 9.649 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.159 -1.211 10.646 1.00 0.00 O ATOM 0 H TYR A 68 -14.557 -6.357 8.826 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.202 -7.185 6.158 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -14.031 -4.704 5.651 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.520 -5.307 6.351 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.270 -3.831 7.526 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.485 -4.036 8.025 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.142 -2.150 9.296 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.356 -2.346 9.796 1.00 0.00 H new ATOM 0 HH TYR A 68 -15.056 -1.025 10.993 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.452 -6.179 7.602 1.00 0.00 N ATOM 1070 CA GLU A 69 -9.998 -6.179 7.438 1.00 0.00 C ATOM 1071 C GLU A 69 -9.520 -7.621 7.377 1.00 0.00 C ATOM 1072 O GLU A 69 -8.629 -7.971 6.603 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.293 -5.474 8.606 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.688 -4.021 8.834 1.00 0.00 C ATOM 1075 CD GLU A 69 -9.464 -3.130 7.631 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -8.399 -3.219 6.982 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -10.316 -2.281 7.357 1.00 0.00 O ATOM 0 H GLU A 69 -11.775 -5.950 8.542 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.756 -5.640 6.522 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.494 -6.034 9.519 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.217 -5.517 8.436 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.741 -3.980 9.113 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.119 -3.628 9.676 1.00 0.00 H new ATOM 1084 N SER A 70 -10.161 -8.450 8.183 1.00 0.00 N ATOM 1085 CA SER A 70 -9.865 -9.858 8.277 1.00 0.00 C ATOM 1086 C SER A 70 -10.067 -10.537 6.914 1.00 0.00 C ATOM 1087 O SER A 70 -9.209 -11.299 6.462 1.00 0.00 O ATOM 1088 CB SER A 70 -10.769 -10.482 9.348 1.00 0.00 C ATOM 1089 OG SER A 70 -10.471 -11.837 9.589 1.00 0.00 O ATOM 0 H SER A 70 -10.916 -8.151 8.800 1.00 0.00 H new ATOM 0 HA SER A 70 -8.823 -10.002 8.563 1.00 0.00 H new ATOM 0 HB2 SER A 70 -10.666 -9.921 10.277 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.810 -10.393 9.036 1.00 0.00 H new ATOM 0 HG SER A 70 -11.073 -12.187 10.279 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.176 -10.216 6.238 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.470 -10.786 4.932 1.00 0.00 C ATOM 1097 C GLU A 71 -10.395 -10.400 3.914 1.00 0.00 C ATOM 1098 O GLU A 71 -9.987 -11.227 3.093 1.00 0.00 O ATOM 1099 CB GLU A 71 -12.871 -10.389 4.442 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.235 -11.011 3.101 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.647 -10.748 2.671 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -14.907 -9.731 1.994 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -15.523 -11.598 2.942 1.00 0.00 O ATOM 0 H GLU A 71 -11.881 -9.563 6.580 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.461 -11.871 5.036 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.608 -10.689 5.187 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.926 -9.304 4.359 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.556 -10.629 2.338 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.077 -12.088 3.157 1.00 0.00 H new ATOM 1110 N ALA A 72 -9.904 -9.161 4.011 1.00 0.00 N ATOM 1111 CA ALA A 72 -8.840 -8.684 3.129 1.00 0.00 C ATOM 1112 C ALA A 72 -7.594 -9.541 3.302 1.00 0.00 C ATOM 1113 O ALA A 72 -6.968 -9.956 2.325 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.532 -7.218 3.400 1.00 0.00 C ATOM 0 H ALA A 72 -10.227 -8.473 4.691 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.178 -8.769 2.096 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.738 -6.884 2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.427 -6.620 3.227 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.211 -7.099 4.435 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.279 -9.849 4.546 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.145 -10.693 4.853 1.00 0.00 C ATOM 1122 C ILE A 73 -6.403 -12.124 4.381 1.00 0.00 C ATOM 1123 O ILE A 73 -5.549 -12.728 3.769 1.00 0.00 O ATOM 1124 CB ILE A 73 -5.803 -10.689 6.370 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.507 -9.260 6.840 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.607 -11.601 6.657 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.175 -9.152 8.311 1.00 0.00 C ATOM 0 H ILE A 73 -7.797 -9.524 5.363 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.287 -10.283 4.321 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.664 -11.070 6.920 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.674 -8.863 6.260 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.372 -8.632 6.626 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.384 -11.584 7.724 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -4.845 -12.620 6.352 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.739 -11.249 6.099 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.978 -8.110 8.564 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.016 -9.517 8.901 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.291 -9.751 8.529 1.00 0.00 H new ATOM 1139 N MET A 74 -7.605 -12.635 4.638 1.00 0.00 N ATOM 1140 CA MET A 74 -7.973 -14.010 4.261 1.00 0.00 C ATOM 1141 C MET A 74 -7.902 -14.243 2.757 1.00 0.00 C ATOM 1142 O MET A 74 -7.407 -15.276 2.316 1.00 0.00 O ATOM 1143 CB MET A 74 -9.353 -14.394 4.787 1.00 0.00 C ATOM 1144 CG MET A 74 -9.526 -14.438 6.315 1.00 0.00 C ATOM 1145 SD MET A 74 -8.582 -15.744 7.186 1.00 0.00 S ATOM 1146 CE MET A 74 -6.935 -15.033 7.334 1.00 0.00 C ATOM 0 H MET A 74 -8.349 -12.119 5.108 1.00 0.00 H new ATOM 0 HA MET A 74 -7.232 -14.655 4.732 1.00 0.00 H new ATOM 0 HB2 MET A 74 -10.079 -13.688 4.383 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.607 -15.376 4.388 1.00 0.00 H new ATOM 0 HG2 MET A 74 -9.233 -13.471 6.723 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.585 -14.571 6.538 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.272 -15.497 6.604 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.984 -13.960 7.150 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.551 -15.211 8.338 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.381 -13.293 1.972 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.310 -13.423 0.520 1.00 0.00 C ATOM 1158 C VAL A 75 -6.851 -13.331 0.052 1.00 0.00 C ATOM 1159 O VAL A 75 -6.404 -14.111 -0.791 1.00 0.00 O ATOM 1160 CB VAL A 75 -9.221 -12.392 -0.218 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -9.049 -12.480 -1.734 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.679 -12.644 0.142 1.00 0.00 C ATOM 0 H VAL A 75 -8.818 -12.434 2.306 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.697 -14.407 0.256 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.925 -11.393 0.102 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.697 -11.749 -2.217 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -8.011 -12.273 -1.995 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -9.316 -13.481 -2.073 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.311 -11.922 -0.375 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.959 -13.653 -0.159 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.812 -12.537 1.219 1.00 0.00 H new ATOM 1172 N ALA A 76 -6.092 -12.426 0.654 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.676 -12.293 0.337 1.00 0.00 C ATOM 1174 C ALA A 76 -3.927 -13.562 0.735 1.00 0.00 C ATOM 1175 O ALA A 76 -2.976 -13.970 0.082 1.00 0.00 O ATOM 1176 CB ALA A 76 -4.078 -11.082 1.033 1.00 0.00 C ATOM 0 H ALA A 76 -6.431 -11.775 1.362 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.576 -12.149 -0.739 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -3.020 -11.003 0.781 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.597 -10.181 0.706 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.187 -11.192 2.112 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.396 -14.174 1.790 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.860 -15.400 2.327 1.00 0.00 C ATOM 1184 C PHE A 77 -4.128 -16.567 1.376 1.00 0.00 C ATOM 1185 O PHE A 77 -3.233 -17.367 1.104 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.494 -15.655 3.708 1.00 0.00 C ATOM 1187 CG PHE A 77 -4.005 -16.865 4.444 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.847 -16.812 5.187 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.724 -18.047 4.417 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -2.408 -17.914 5.887 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -4.285 -19.151 5.111 1.00 0.00 C ATOM 1192 CZ PHE A 77 -3.126 -19.081 5.848 1.00 0.00 C ATOM 0 H PHE A 77 -5.192 -13.820 2.320 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.779 -15.312 2.438 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.319 -14.779 4.333 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.573 -15.744 3.579 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.276 -15.896 5.221 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.639 -18.104 3.846 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.498 -17.859 6.466 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.850 -20.071 5.077 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.782 -19.946 6.396 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.343 -16.645 0.844 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.701 -17.753 -0.030 1.00 0.00 C ATOM 1204 C GLU A 78 -5.061 -17.624 -1.413 1.00 0.00 C ATOM 1205 O GLU A 78 -4.790 -18.631 -2.073 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.242 -18.010 -0.064 1.00 0.00 C ATOM 1207 CG GLU A 78 -8.132 -16.949 -0.720 1.00 0.00 C ATOM 1208 CD GLU A 78 -8.313 -17.115 -2.215 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -8.376 -18.275 -2.711 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -8.492 -16.132 -2.904 1.00 0.00 O ATOM 0 H GLU A 78 -6.086 -15.964 1.000 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.274 -18.658 0.403 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.412 -18.955 -0.580 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.582 -18.143 0.963 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -9.112 -16.971 -0.244 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.705 -15.965 -0.526 1.00 0.00 H new ATOM 1217 N LEU A 79 -4.787 -16.394 -1.826 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.138 -16.123 -3.115 1.00 0.00 C ATOM 1219 C LEU A 79 -2.636 -16.121 -3.001 1.00 0.00 C ATOM 1220 O LEU A 79 -1.936 -16.246 -4.022 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.542 -14.751 -3.643 1.00 0.00 C ATOM 1222 CG LEU A 79 -5.977 -14.571 -4.052 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.229 -13.133 -4.462 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.310 -15.513 -5.184 1.00 0.00 C ATOM 0 H LEU A 79 -5.004 -15.556 -1.286 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.460 -16.918 -3.788 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.314 -14.012 -2.875 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.913 -14.521 -4.503 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.621 -14.803 -3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.272 -13.016 -4.756 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.012 -12.472 -3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.584 -12.876 -5.302 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.351 -15.378 -5.476 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.664 -15.301 -6.036 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.155 -16.542 -4.859 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.152 -15.960 -1.773 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.723 -15.731 -1.478 1.00 0.00 C ATOM 1238 C ASN A 80 -0.352 -14.426 -2.183 1.00 0.00 C ATOM 1239 O ASN A 80 0.624 -14.320 -2.927 1.00 0.00 O ATOM 1240 CB ASN A 80 0.173 -16.899 -1.952 1.00 0.00 C ATOM 1241 CG ASN A 80 1.619 -16.776 -1.474 1.00 0.00 C ATOM 1242 OD1 ASN A 80 1.807 -16.321 -0.269 1.00 0.00 O flip ATOM 1243 ND2 ASN A 80 2.563 -17.145 -2.172 1.00 0.00 N flip ATOM 0 H ASN A 80 -2.739 -15.983 -0.939 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.561 -15.668 -0.402 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.244 -17.839 -1.591 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.159 -16.941 -3.041 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.393 -17.498 -3.114 1.00 0.00 H new ATOM 0 HD22 ASN A 80 3.515 -17.098 -1.809 1.00 0.00 H new ATOM 1250 N ALA A 81 -1.185 -13.450 -1.956 1.00 0.00 N ATOM 1251 CA ALA A 81 -1.123 -12.185 -2.636 1.00 0.00 C ATOM 1252 C ALA A 81 -0.370 -11.146 -1.842 1.00 0.00 C ATOM 1253 O ALA A 81 0.068 -11.393 -0.724 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.533 -11.700 -2.925 1.00 0.00 C ATOM 0 H ALA A 81 -1.944 -13.512 -1.277 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.578 -12.332 -3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.489 -10.741 -3.441 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.046 -12.427 -3.554 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.077 -11.584 -1.988 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.229 -10.000 -2.438 1.00 0.00 N ATOM 1261 CA LEU A 82 0.412 -8.867 -1.839 1.00 0.00 C ATOM 1262 C LEU A 82 -0.702 -8.117 -1.130 1.00 0.00 C ATOM 1263 O LEU A 82 -1.739 -7.860 -1.733 1.00 0.00 O ATOM 1264 CB LEU A 82 1.029 -8.006 -2.987 1.00 0.00 C ATOM 1265 CG LEU A 82 2.067 -6.906 -2.648 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.495 -5.793 -1.788 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.300 -7.512 -2.007 1.00 0.00 C ATOM 0 H LEU A 82 -0.567 -9.822 -3.384 1.00 0.00 H new ATOM 0 HA LEU A 82 1.210 -9.125 -1.143 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.499 -8.692 -3.692 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.204 -7.525 -3.513 1.00 0.00 H new ATOM 0 HG LEU A 82 2.353 -6.444 -3.593 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.271 -5.054 -1.585 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.668 -5.316 -2.313 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.135 -6.209 -0.847 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.016 -6.723 -1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.017 -8.025 -1.088 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.755 -8.225 -2.695 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.541 -7.808 0.122 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.598 -7.102 0.805 1.00 0.00 C ATOM 1281 C LEU A 83 -1.242 -5.645 0.965 1.00 0.00 C ATOM 1282 O LEU A 83 -0.227 -5.299 1.589 1.00 0.00 O ATOM 1283 CB LEU A 83 -1.937 -7.725 2.166 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.104 -7.061 2.929 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.416 -7.209 2.173 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.236 -7.627 4.321 1.00 0.00 C ATOM 0 H LEU A 83 0.283 -8.023 0.683 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.490 -7.186 0.185 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.177 -8.777 2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.047 -7.688 2.795 1.00 0.00 H new ATOM 0 HG LEU A 83 -2.875 -5.998 3.009 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.217 -6.731 2.737 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.328 -6.735 1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.644 -8.267 2.044 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.066 -7.141 4.834 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.424 -8.699 4.262 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.314 -7.451 4.874 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.046 -4.804 0.391 1.00 0.00 N ATOM 1299 CA ILE A 84 -1.855 -3.395 0.513 1.00 0.00 C ATOM 1300 C ILE A 84 -2.718 -2.937 1.660 1.00 0.00 C ATOM 1301 O ILE A 84 -3.963 -2.967 1.577 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.255 -2.650 -0.782 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.513 -3.253 -1.985 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -1.924 -1.159 -0.645 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -1.925 -2.678 -3.319 1.00 0.00 C ATOM 0 H ILE A 84 -2.851 -5.076 -0.174 1.00 0.00 H new ATOM 0 HA ILE A 84 -0.802 -3.175 0.689 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.327 -2.760 -0.943 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.442 -3.099 -1.851 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.681 -4.330 -1.999 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.207 -0.638 -1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.475 -0.740 0.197 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.854 -1.038 -0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.354 -3.158 -4.114 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.989 -2.855 -3.479 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.730 -1.606 -3.329 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.091 -2.562 2.729 1.00 0.00 N ATOM 1318 CA ALA A 85 -2.801 -2.200 3.908 1.00 0.00 C ATOM 1319 C ALA A 85 -2.390 -0.838 4.377 1.00 0.00 C ATOM 1320 O ALA A 85 -1.474 -0.232 3.831 1.00 0.00 O ATOM 1321 CB ALA A 85 -2.594 -3.245 4.991 1.00 0.00 C ATOM 0 H ALA A 85 -1.076 -2.499 2.807 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.866 -2.161 3.677 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -3.143 -2.954 5.887 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -2.958 -4.210 4.639 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.532 -3.321 5.225 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.073 -0.354 5.372 1.00 0.00 N ATOM 1328 CA GLU A 86 -2.783 0.941 5.906 1.00 0.00 C ATOM 1329 C GLU A 86 -2.506 0.784 7.401 1.00 0.00 C ATOM 1330 O GLU A 86 -1.409 1.087 7.875 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.984 1.853 5.666 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.653 3.317 5.438 1.00 0.00 C ATOM 1333 CD GLU A 86 -2.884 3.955 6.563 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -3.446 4.106 7.671 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -1.717 4.358 6.352 1.00 0.00 O ATOM 0 H GLU A 86 -3.841 -0.842 5.833 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.912 1.384 5.423 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -4.533 1.483 4.800 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -4.653 1.778 6.523 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.074 3.409 4.519 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.581 3.869 5.287 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.504 0.282 8.132 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.363 0.056 9.564 1.00 0.00 C ATOM 1344 C ASP A 87 -2.294 -0.981 9.854 1.00 0.00 C ATOM 1345 O ASP A 87 -2.228 -2.039 9.207 1.00 0.00 O ATOM 1346 CB ASP A 87 -4.687 -0.338 10.226 1.00 0.00 C ATOM 1347 CG ASP A 87 -4.505 -0.719 11.690 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -4.444 0.172 12.562 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -4.388 -1.914 11.992 1.00 0.00 O ATOM 0 H ASP A 87 -4.415 0.026 7.752 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.053 1.006 9.999 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.390 0.492 10.153 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.127 -1.176 9.686 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.492 -0.668 10.838 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.330 -1.445 11.238 1.00 0.00 C ATOM 1356 C LYS A 88 -0.673 -2.884 11.624 1.00 0.00 C ATOM 1357 O LYS A 88 0.083 -3.797 11.325 1.00 0.00 O ATOM 1358 CB LYS A 88 0.340 -0.759 12.416 1.00 0.00 C ATOM 1359 CG LYS A 88 0.790 0.668 12.139 1.00 0.00 C ATOM 1360 CD LYS A 88 1.242 1.370 13.416 1.00 0.00 C ATOM 1361 CE LYS A 88 0.078 1.574 14.371 1.00 0.00 C ATOM 1362 NZ LYS A 88 0.483 2.218 15.636 1.00 0.00 N ATOM 0 H LYS A 88 -1.629 0.166 11.410 1.00 0.00 H new ATOM 0 HA LYS A 88 0.336 -1.496 10.377 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -0.352 -0.752 13.258 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.206 -1.348 12.719 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.608 0.659 11.418 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.028 1.227 11.685 1.00 0.00 H new ATOM 0 HD2 LYS A 88 2.017 0.779 13.904 1.00 0.00 H new ATOM 0 HD3 LYS A 88 1.685 2.334 13.167 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.682 2.185 13.885 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -0.380 0.609 14.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -0.349 2.333 16.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 1.189 1.625 16.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 0.895 3.151 15.434 1.00 0.00 H new ATOM 1376 N ASP A 89 -1.826 -3.093 12.240 1.00 0.00 N ATOM 1377 CA ASP A 89 -2.169 -4.421 12.743 1.00 0.00 C ATOM 1378 C ASP A 89 -2.608 -5.306 11.609 1.00 0.00 C ATOM 1379 O ASP A 89 -2.367 -6.514 11.619 1.00 0.00 O ATOM 1380 CB ASP A 89 -3.239 -4.346 13.824 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.426 -5.649 14.567 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.505 -6.042 15.311 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.486 -6.277 14.466 1.00 0.00 O ATOM 0 H ASP A 89 -2.532 -2.375 12.404 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.279 -4.854 13.198 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.973 -3.564 14.536 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.186 -4.055 13.369 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.214 -4.686 10.600 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.608 -5.388 9.382 1.00 0.00 C ATOM 1390 C VAL A 90 -2.343 -5.903 8.697 1.00 0.00 C ATOM 1391 O VAL A 90 -2.269 -7.056 8.266 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.389 -4.459 8.402 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -4.864 -5.228 7.174 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.571 -3.807 9.096 1.00 0.00 C ATOM 0 H VAL A 90 -3.444 -3.692 10.603 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.272 -6.210 9.651 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.702 -3.678 8.076 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.405 -4.554 6.510 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.003 -5.642 6.649 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.524 -6.038 7.485 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.098 -3.165 8.391 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.249 -4.578 9.461 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.216 -3.209 9.935 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.338 -5.042 8.658 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.040 -5.369 8.098 1.00 0.00 C ATOM 1406 C ILE A 91 0.612 -6.494 8.920 1.00 0.00 C ATOM 1407 O ILE A 91 1.061 -7.514 8.369 1.00 0.00 O ATOM 1408 CB ILE A 91 0.885 -4.115 8.096 1.00 0.00 C ATOM 1409 CG1 ILE A 91 0.247 -2.982 7.285 1.00 0.00 C ATOM 1410 CG2 ILE A 91 2.263 -4.460 7.539 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.994 -1.667 7.352 1.00 0.00 C ATOM 0 H ILE A 91 -1.403 -4.090 9.017 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.177 -5.703 7.070 1.00 0.00 H new ATOM 0 HB ILE A 91 1.008 -3.779 9.126 1.00 0.00 H new ATOM 0 HG12 ILE A 91 0.176 -3.293 6.243 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.771 -2.826 7.641 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.892 -3.570 7.547 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.721 -5.234 8.155 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.162 -4.823 6.516 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.474 -0.922 6.750 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.042 -1.328 8.387 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.005 -1.803 6.967 1.00 0.00 H new ATOM 1423 N ASN A 92 0.623 -6.309 10.230 1.00 0.00 N ATOM 1424 CA ASN A 92 1.201 -7.265 11.174 1.00 0.00 C ATOM 1425 C ASN A 92 0.570 -8.653 11.085 1.00 0.00 C ATOM 1426 O ASN A 92 1.279 -9.647 10.908 1.00 0.00 O ATOM 1427 CB ASN A 92 1.145 -6.725 12.619 1.00 0.00 C ATOM 1428 CG ASN A 92 1.463 -7.790 13.659 1.00 0.00 C ATOM 1429 OD1 ASN A 92 2.630 -8.053 13.978 1.00 0.00 O ATOM 1430 ND2 ASN A 92 0.427 -8.365 14.238 1.00 0.00 N ATOM 0 H ASN A 92 0.227 -5.482 10.678 1.00 0.00 H new ATOM 0 HA ASN A 92 2.246 -7.382 10.886 1.00 0.00 H new ATOM 0 HB2 ASN A 92 1.851 -5.901 12.722 1.00 0.00 H new ATOM 0 HB3 ASN A 92 0.152 -6.320 12.812 1.00 0.00 H new ATOM 0 HD21 ASN A 92 0.573 -9.053 14.977 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -0.520 -8.122 13.947 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.749 -8.729 11.172 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.430 -10.022 11.154 1.00 0.00 C ATOM 1439 C LYS A 93 -1.251 -10.736 9.838 1.00 0.00 C ATOM 1440 O LYS A 93 -1.146 -11.963 9.800 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.914 -9.903 11.518 1.00 0.00 C ATOM 1442 CG LYS A 93 -3.171 -9.451 12.952 1.00 0.00 C ATOM 1443 CD LYS A 93 -2.527 -10.390 13.979 1.00 0.00 C ATOM 1444 CE LYS A 93 -3.085 -11.810 13.910 1.00 0.00 C ATOM 1445 NZ LYS A 93 -2.465 -12.693 14.918 1.00 0.00 N ATOM 0 H LYS A 93 -1.367 -7.922 11.255 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.955 -10.628 11.926 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.389 -9.198 10.836 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.394 -10.869 11.362 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.780 -8.443 13.089 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.245 -9.403 13.129 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.450 -10.419 13.814 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.685 -9.990 14.981 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.164 -11.784 14.064 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.915 -12.219 12.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -3.092 -13.502 15.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -1.551 -13.038 14.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.316 -12.162 15.800 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.173 -9.978 8.770 1.00 0.00 N ATOM 1460 CA ALA A 94 -0.963 -10.547 7.468 1.00 0.00 C ATOM 1461 C ALA A 94 0.408 -11.190 7.386 1.00 0.00 C ATOM 1462 O ALA A 94 0.533 -12.341 6.960 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.120 -9.500 6.403 1.00 0.00 C ATOM 0 H ALA A 94 -1.253 -8.961 8.782 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.716 -11.318 7.303 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.957 -9.950 5.424 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.126 -9.083 6.448 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.391 -8.706 6.563 1.00 0.00 H new ATOM 1469 N LYS A 95 1.435 -10.481 7.850 1.00 0.00 N ATOM 1470 CA LYS A 95 2.783 -11.018 7.792 1.00 0.00 C ATOM 1471 C LYS A 95 3.007 -12.138 8.799 1.00 0.00 C ATOM 1472 O LYS A 95 3.924 -12.948 8.634 1.00 0.00 O ATOM 1473 CB LYS A 95 3.877 -9.943 7.847 1.00 0.00 C ATOM 1474 CG LYS A 95 3.848 -9.024 9.058 1.00 0.00 C ATOM 1475 CD LYS A 95 5.038 -8.068 9.053 1.00 0.00 C ATOM 1476 CE LYS A 95 5.052 -7.180 7.812 1.00 0.00 C ATOM 1477 NZ LYS A 95 6.233 -6.303 7.768 1.00 0.00 N ATOM 0 H LYS A 95 1.358 -9.551 8.262 1.00 0.00 H new ATOM 0 HA LYS A 95 2.875 -11.467 6.803 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.847 -10.438 7.815 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.802 -9.330 6.949 1.00 0.00 H new ATOM 0 HG2 LYS A 95 2.919 -8.453 9.063 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.860 -9.620 9.971 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.005 -7.443 9.946 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.964 -8.641 9.099 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.033 -7.806 6.920 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.148 -6.571 7.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 6.200 -5.719 6.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.239 -5.687 8.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.096 -6.883 7.759 1.00 0.00 H new ATOM 1491 N GLU A 96 2.177 -12.193 9.838 1.00 0.00 N ATOM 1492 CA GLU A 96 2.179 -13.337 10.748 1.00 0.00 C ATOM 1493 C GLU A 96 1.762 -14.579 9.987 1.00 0.00 C ATOM 1494 O GLU A 96 2.325 -15.659 10.155 1.00 0.00 O ATOM 1495 CB GLU A 96 1.228 -13.146 11.934 1.00 0.00 C ATOM 1496 CG GLU A 96 1.705 -12.207 13.028 1.00 0.00 C ATOM 1497 CD GLU A 96 0.757 -12.199 14.211 1.00 0.00 C ATOM 1498 OE1 GLU A 96 0.161 -13.265 14.534 1.00 0.00 O ATOM 1499 OE2 GLU A 96 0.590 -11.150 14.858 1.00 0.00 O ATOM 0 H GLU A 96 1.500 -11.466 10.070 1.00 0.00 H new ATOM 0 HA GLU A 96 3.190 -13.436 11.143 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.276 -12.775 11.554 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.035 -14.122 12.380 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.698 -12.509 13.360 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.796 -11.197 12.627 1.00 0.00 H new ATOM 1506 N LEU A 97 0.800 -14.395 9.109 1.00 0.00 N ATOM 1507 CA LEU A 97 0.265 -15.470 8.312 1.00 0.00 C ATOM 1508 C LEU A 97 1.125 -15.723 7.073 1.00 0.00 C ATOM 1509 O LEU A 97 0.868 -16.651 6.302 1.00 0.00 O ATOM 1510 CB LEU A 97 -1.179 -15.164 7.926 1.00 0.00 C ATOM 1511 CG LEU A 97 -2.165 -15.019 9.094 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.537 -14.644 8.584 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -2.238 -16.305 9.909 1.00 0.00 C ATOM 0 H LEU A 97 0.367 -13.489 8.929 1.00 0.00 H new ATOM 0 HA LEU A 97 0.280 -16.382 8.908 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.193 -14.241 7.347 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.536 -15.958 7.270 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.803 -14.223 9.744 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.223 -14.545 9.425 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.480 -13.696 8.049 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.899 -15.420 7.909 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.943 -16.176 10.730 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.571 -17.123 9.270 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.252 -16.538 10.311 1.00 0.00 H new ATOM 1525 N GLY A 98 2.143 -14.902 6.889 1.00 0.00 N ATOM 1526 CA GLY A 98 3.078 -15.091 5.796 1.00 0.00 C ATOM 1527 C GLY A 98 2.706 -14.311 4.566 1.00 0.00 C ATOM 1528 O GLY A 98 3.263 -14.527 3.487 1.00 0.00 O ATOM 0 H GLY A 98 2.343 -14.097 7.483 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.075 -14.793 6.122 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.128 -16.151 5.547 1.00 0.00 H new ATOM 1532 N VAL A 99 1.763 -13.433 4.710 1.00 0.00 N ATOM 1533 CA VAL A 99 1.323 -12.607 3.624 1.00 0.00 C ATOM 1534 C VAL A 99 2.119 -11.317 3.657 1.00 0.00 C ATOM 1535 O VAL A 99 2.192 -10.652 4.698 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.194 -12.296 3.733 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.668 -11.417 2.585 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -1.006 -13.581 3.788 1.00 0.00 C ATOM 0 H VAL A 99 1.272 -13.266 5.589 1.00 0.00 H new ATOM 0 HA VAL A 99 1.484 -13.133 2.683 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.349 -11.746 4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.734 -11.220 2.694 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.121 -10.474 2.599 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.488 -11.927 1.638 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.066 -13.339 3.864 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.831 -14.161 2.882 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.704 -14.165 4.657 1.00 0.00 H new ATOM 1548 N ASN A 100 2.740 -10.978 2.558 1.00 0.00 N ATOM 1549 CA ASN A 100 3.534 -9.772 2.504 1.00 0.00 C ATOM 1550 C ASN A 100 2.635 -8.559 2.421 1.00 0.00 C ATOM 1551 O ASN A 100 2.132 -8.196 1.344 1.00 0.00 O ATOM 1552 CB ASN A 100 4.523 -9.774 1.335 1.00 0.00 C ATOM 1553 CG ASN A 100 5.483 -8.578 1.375 1.00 0.00 C ATOM 1554 OD1 ASN A 100 5.104 -7.485 0.762 1.00 0.00 O flip ATOM 1555 ND2 ASN A 100 6.556 -8.647 1.967 1.00 0.00 N flip ATOM 0 H ASN A 100 2.714 -11.514 1.691 1.00 0.00 H new ATOM 0 HA ASN A 100 4.120 -9.732 3.422 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.099 -10.699 1.353 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.970 -9.761 0.396 1.00 0.00 H new ATOM 0 HD21 ASN A 100 6.825 -9.512 2.436 1.00 0.00 H new ATOM 0 HD22 ASN A 100 7.179 -7.839 1.990 1.00 0.00 H new ATOM 1562 N ALA A 101 2.375 -7.988 3.552 1.00 0.00 N ATOM 1563 CA ALA A 101 1.597 -6.797 3.637 1.00 0.00 C ATOM 1564 C ALA A 101 2.517 -5.621 3.777 1.00 0.00 C ATOM 1565 O ALA A 101 3.585 -5.728 4.404 1.00 0.00 O ATOM 1566 CB ALA A 101 0.651 -6.862 4.813 1.00 0.00 C ATOM 0 H ALA A 101 2.701 -8.340 4.452 1.00 0.00 H new ATOM 0 HA ALA A 101 1.002 -6.691 2.730 1.00 0.00 H new ATOM 0 HB1 ALA A 101 0.066 -5.943 4.861 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.019 -7.713 4.694 1.00 0.00 H new ATOM 0 HB3 ALA A 101 1.223 -6.976 5.734 1.00 0.00 H new ATOM 1572 N ILE A 102 2.142 -4.538 3.176 1.00 0.00 N ATOM 1573 CA ILE A 102 2.890 -3.312 3.238 1.00 0.00 C ATOM 1574 C ILE A 102 1.954 -2.126 3.346 1.00 0.00 C ATOM 1575 O ILE A 102 0.787 -2.224 2.928 1.00 0.00 O ATOM 1576 CB ILE A 102 3.883 -3.132 2.019 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.270 -3.524 0.645 1.00 0.00 C ATOM 1578 CG2 ILE A 102 5.190 -3.851 2.249 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.203 -2.591 0.115 1.00 0.00 C ATOM 0 H ILE A 102 1.292 -4.474 2.616 1.00 0.00 H new ATOM 0 HA ILE A 102 3.507 -3.365 4.135 1.00 0.00 H new ATOM 0 HB ILE A 102 4.081 -2.061 1.970 1.00 0.00 H new ATOM 0 HG12 ILE A 102 4.074 -3.581 -0.088 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.844 -4.524 0.729 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.843 -3.702 1.389 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.671 -3.454 3.143 1.00 0.00 H new ATOM 0 HG23 ILE A 102 5.001 -4.916 2.381 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.844 -2.957 -0.847 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.373 -2.550 0.820 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.622 -1.593 -0.010 1.00 0.00 H new ATOM 1591 N PRO A 103 2.407 -1.027 3.960 1.00 0.00 N ATOM 1592 CA PRO A 103 1.646 0.200 3.971 1.00 0.00 C ATOM 1593 C PRO A 103 1.625 0.811 2.568 1.00 0.00 C ATOM 1594 O PRO A 103 2.508 0.522 1.732 1.00 0.00 O ATOM 1595 CB PRO A 103 2.382 1.112 4.960 1.00 0.00 C ATOM 1596 CG PRO A 103 3.742 0.527 5.127 1.00 0.00 C ATOM 1597 CD PRO A 103 3.668 -0.920 4.720 1.00 0.00 C ATOM 0 HA PRO A 103 0.607 0.049 4.263 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.440 2.132 4.580 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.857 1.157 5.914 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.467 1.061 4.512 1.00 0.00 H new ATOM 0 HG3 PRO A 103 4.073 0.617 6.161 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.525 -1.205 4.109 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.664 -1.577 5.590 1.00 0.00 H new ATOM 1605 N ILE A 104 0.665 1.660 2.333 1.00 0.00 N ATOM 1606 CA ILE A 104 0.408 2.251 1.024 1.00 0.00 C ATOM 1607 C ILE A 104 1.625 2.950 0.426 1.00 0.00 C ATOM 1608 O ILE A 104 1.942 2.759 -0.755 1.00 0.00 O ATOM 1609 CB ILE A 104 -0.794 3.207 1.103 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.034 2.399 1.480 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -0.998 3.967 -0.209 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.268 3.218 1.640 1.00 0.00 C ATOM 0 H ILE A 104 0.017 1.976 3.054 1.00 0.00 H new ATOM 0 HA ILE A 104 0.174 1.430 0.347 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.605 3.961 1.867 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.209 1.644 0.714 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.839 1.869 2.412 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.856 4.632 -0.114 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.107 4.554 -0.432 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.177 3.257 -1.017 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.103 2.570 1.908 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.115 3.956 2.427 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.490 3.728 0.703 1.00 0.00 H new ATOM 1624 N GLU A 105 2.324 3.703 1.238 1.00 0.00 N ATOM 1625 CA GLU A 105 3.499 4.436 0.793 1.00 0.00 C ATOM 1626 C GLU A 105 4.617 3.508 0.309 1.00 0.00 C ATOM 1627 O GLU A 105 5.441 3.908 -0.504 1.00 0.00 O ATOM 1628 CB GLU A 105 4.007 5.407 1.862 1.00 0.00 C ATOM 1629 CG GLU A 105 3.153 6.666 2.080 1.00 0.00 C ATOM 1630 CD GLU A 105 1.690 6.393 2.337 1.00 0.00 C ATOM 1631 OE1 GLU A 105 1.371 5.646 3.288 1.00 0.00 O ATOM 1632 OE2 GLU A 105 0.848 6.885 1.560 1.00 0.00 O ATOM 0 H GLU A 105 2.101 3.830 2.225 1.00 0.00 H new ATOM 0 HA GLU A 105 3.182 5.029 -0.065 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.079 4.871 2.808 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.017 5.717 1.594 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.559 7.224 2.924 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.242 7.306 1.202 1.00 0.00 H new ATOM 1639 N GLU A 106 4.617 2.262 0.772 1.00 0.00 N ATOM 1640 CA GLU A 106 5.600 1.286 0.321 1.00 0.00 C ATOM 1641 C GLU A 106 5.229 0.767 -1.049 1.00 0.00 C ATOM 1642 O GLU A 106 6.093 0.468 -1.865 1.00 0.00 O ATOM 1643 CB GLU A 106 5.748 0.128 1.300 1.00 0.00 C ATOM 1644 CG GLU A 106 6.401 0.512 2.605 1.00 0.00 C ATOM 1645 CD GLU A 106 7.779 1.070 2.402 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.724 0.298 2.179 1.00 0.00 O ATOM 1647 OE2 GLU A 106 7.943 2.288 2.475 1.00 0.00 O ATOM 0 H GLU A 106 3.950 1.906 1.457 1.00 0.00 H new ATOM 0 HA GLU A 106 6.563 1.793 0.268 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.762 -0.289 1.507 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.335 -0.661 0.829 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.783 1.250 3.116 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.456 -0.362 3.254 1.00 0.00 H new ATOM 1654 N LEU A 107 3.937 0.689 -1.315 1.00 0.00 N ATOM 1655 CA LEU A 107 3.461 0.267 -2.621 1.00 0.00 C ATOM 1656 C LEU A 107 3.758 1.400 -3.598 1.00 0.00 C ATOM 1657 O LEU A 107 4.172 1.171 -4.726 1.00 0.00 O ATOM 1658 CB LEU A 107 1.945 -0.086 -2.560 1.00 0.00 C ATOM 1659 CG LEU A 107 1.304 -0.829 -3.772 1.00 0.00 C ATOM 1660 CD1 LEU A 107 1.153 0.052 -4.995 1.00 0.00 C ATOM 1661 CD2 LEU A 107 2.095 -2.087 -4.116 1.00 0.00 C ATOM 0 H LEU A 107 3.200 0.912 -0.646 1.00 0.00 H new ATOM 0 HA LEU A 107 3.967 -0.639 -2.955 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.783 -0.698 -1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.394 0.843 -2.412 1.00 0.00 H new ATOM 0 HG LEU A 107 0.298 -1.112 -3.462 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.701 -0.523 -5.804 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.515 0.903 -4.754 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.133 0.411 -5.308 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.630 -2.589 -4.964 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.119 -1.814 -4.373 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.103 -2.758 -3.257 1.00 0.00 H new ATOM 1673 N LEU A 108 3.594 2.626 -3.122 1.00 0.00 N ATOM 1674 CA LEU A 108 3.929 3.814 -3.901 1.00 0.00 C ATOM 1675 C LEU A 108 5.439 3.857 -4.152 1.00 0.00 C ATOM 1676 O LEU A 108 5.894 4.245 -5.222 1.00 0.00 O ATOM 1677 CB LEU A 108 3.476 5.080 -3.172 1.00 0.00 C ATOM 1678 CG LEU A 108 1.983 5.189 -2.863 1.00 0.00 C ATOM 1679 CD1 LEU A 108 1.706 6.448 -2.067 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.159 5.181 -4.145 1.00 0.00 C ATOM 0 H LEU A 108 3.228 2.827 -2.192 1.00 0.00 H new ATOM 0 HA LEU A 108 3.409 3.767 -4.858 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.025 5.148 -2.233 1.00 0.00 H new ATOM 0 HB3 LEU A 108 3.764 5.942 -3.773 1.00 0.00 H new ATOM 0 HG LEU A 108 1.692 4.323 -2.268 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.639 6.516 -1.852 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.263 6.416 -1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.016 7.319 -2.644 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.100 5.260 -3.898 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.449 6.026 -4.769 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.337 4.252 -4.686 1.00 0.00 H new ATOM 1692 N ALA A 109 6.206 3.407 -3.170 1.00 0.00 N ATOM 1693 CA ALA A 109 7.662 3.325 -3.280 1.00 0.00 C ATOM 1694 C ALA A 109 8.083 2.150 -4.172 1.00 0.00 C ATOM 1695 O ALA A 109 9.252 2.002 -4.522 1.00 0.00 O ATOM 1696 CB ALA A 109 8.294 3.203 -1.901 1.00 0.00 C ATOM 0 H ALA A 109 5.840 3.088 -2.273 1.00 0.00 H new ATOM 0 HA ALA A 109 8.018 4.244 -3.745 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.378 3.143 -2.001 1.00 0.00 H new ATOM 0 HB2 ALA A 109 8.033 4.076 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.925 2.303 -1.410 1.00 0.00 H new ATOM 1702 N SER A 110 7.121 1.318 -4.524 1.00 0.00 N ATOM 1703 CA SER A 110 7.348 0.208 -5.417 1.00 0.00 C ATOM 1704 C SER A 110 6.994 0.616 -6.849 1.00 0.00 C ATOM 1705 O SER A 110 7.024 -0.201 -7.780 1.00 0.00 O ATOM 1706 CB SER A 110 6.552 -1.010 -4.956 1.00 0.00 C ATOM 1707 OG SER A 110 6.938 -1.375 -3.628 1.00 0.00 O ATOM 0 H SER A 110 6.159 1.397 -4.195 1.00 0.00 H new ATOM 0 HA SER A 110 8.402 -0.068 -5.400 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.485 -0.789 -4.985 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.724 -1.845 -5.635 1.00 0.00 H new ATOM 0 HG SER A 110 6.469 -0.806 -2.983 1.00 0.00 H new