USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1025 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 18 SER OG : rot 145:sc= 0.685 USER MOD Set 1.2: A 83 TYR OH : rot 180:sc= -0.264 USER MOD Set 1.3: A 87 MET CE :methyl -166:sc=-0.00394 (180deg=-0.0283) USER MOD Set 2.1: A 61 SER OG : rot 149:sc= 0.0013 USER MOD Set 2.2: A 64 HIS : no HD1:sc= -0.0126 X(o=-0.011,f=-0.023) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0393) USER MOD Single : A 2 GLN : amide:sc= -2.13 K(o=-2.1,f=-3.7!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= -2.14 K(o=-2.1,f=-7!) USER MOD Single : A 11 THR OG1 : rot 180:sc= -1.07 USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 21 GLN : amide:sc= -0.0125 K(o=-0.012,f=-2.8!) USER MOD Single : A 27 THR OG1 : rot -85:sc= 0.188 USER MOD Single : A 29 SER OG : rot -51:sc= 0.268 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 165:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.349 X(o=-0.35,f=-0.058) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.033 X(o=-0.033,f=-0.48) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.125 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot -130:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -153:sc= 0.247 (180deg=0.0305) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc=-0.00285 K(o=-0.0029,f=-0.6) USER MOD Single : A 79 SER OG : rot -47:sc= 1.17 USER MOD Single : A 81 MET CE :methyl -160:sc= -0.234 (180deg=-0.982) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0.0192 USER MOD Single : A 88 THR OG1 : rot 94:sc= 1.27 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HD1:sc= -0.439 X(o=-0.44,f=0.013) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -0.101 X(o=-0.1,f=-0.1) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ -155:sc=-0.00419 (180deg=-0.587) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.151 X(o=-0.15,f=-0.017) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.352 -5.024 -3.036 1.00 1.53 N ATOM 2 CA MET A 1 3.329 -6.027 -3.308 1.00 42.52 C ATOM 3 C MET A 1 2.061 -5.376 -3.853 1.00 4.04 C ATOM 4 O MET A 1 1.478 -5.853 -4.825 1.00 74.02 O ATOM 5 CB MET A 1 3.007 -6.815 -2.038 1.00 35.24 C ATOM 6 CG MET A 1 2.717 -8.286 -2.292 1.00 43.31 C ATOM 7 SD MET A 1 2.718 -9.266 -0.779 1.00 0.23 S ATOM 8 CE MET A 1 3.573 -10.740 -1.330 1.00 43.33 C ATOM 0 H1 MET A 1 5.233 -5.496 -2.747 1.00 1.53 H new ATOM 0 H2 MET A 1 4.525 -4.463 -3.894 1.00 1.53 H new ATOM 0 H3 MET A 1 4.029 -4.397 -2.272 1.00 1.53 H new ATOM 0 HA MET A 1 3.718 -6.711 -4.062 1.00 42.52 H new ATOM 0 HB2 MET A 1 3.846 -6.733 -1.347 1.00 35.24 H new ATOM 0 HB3 MET A 1 2.145 -6.362 -1.548 1.00 35.24 H new ATOM 0 HG2 MET A 1 1.748 -8.382 -2.782 1.00 43.31 H new ATOM 0 HG3 MET A 1 3.462 -8.686 -2.980 1.00 43.31 H new ATOM 0 HE1 MET A 1 3.653 -11.445 -0.503 1.00 43.33 H new ATOM 0 HE2 MET A 1 3.016 -11.200 -2.146 1.00 43.33 H new ATOM 0 HE3 MET A 1 4.571 -10.473 -1.677 1.00 43.33 H new ATOM 18 N GLN A 2 1.642 -4.286 -3.219 1.00 11.34 N ATOM 19 CA GLN A 2 0.443 -3.572 -3.640 1.00 14.50 C ATOM 20 C GLN A 2 0.742 -2.652 -4.819 1.00 65.34 C ATOM 21 O GLN A 2 0.564 -1.437 -4.734 1.00 62.04 O ATOM 22 CB GLN A 2 -0.128 -2.758 -2.476 1.00 64.55 C ATOM 23 CG GLN A 2 -0.166 -3.521 -1.162 1.00 70.52 C ATOM 24 CD GLN A 2 -0.641 -4.951 -1.331 1.00 73.11 C ATOM 25 OE1 GLN A 2 -1.454 -5.248 -2.207 1.00 41.03 O ATOM 26 NE2 GLN A 2 -0.136 -5.846 -0.491 1.00 24.51 N ATOM 0 H GLN A 2 2.115 -3.878 -2.412 1.00 11.34 H new ATOM 0 HA GLN A 2 -0.295 -4.309 -3.956 1.00 14.50 H new ATOM 0 HB2 GLN A 2 0.470 -1.856 -2.346 1.00 64.55 H new ATOM 0 HB3 GLN A 2 -1.138 -2.436 -2.729 1.00 64.55 H new ATOM 0 HG2 GLN A 2 0.830 -3.523 -0.718 1.00 70.52 H new ATOM 0 HG3 GLN A 2 -0.825 -3.003 -0.465 1.00 70.52 H new ATOM 0 HE21 GLN A 2 0.535 -5.556 0.220 1.00 24.51 H new ATOM 0 HE22 GLN A 2 -0.419 -6.824 -0.557 1.00 24.51 H new ATOM 35 N LYS A 3 1.199 -3.240 -5.920 1.00 25.11 N ATOM 36 CA LYS A 3 1.524 -2.475 -7.118 1.00 71.11 C ATOM 37 C LYS A 3 1.937 -3.400 -8.259 1.00 11.23 C ATOM 38 O LYS A 3 2.437 -4.500 -8.029 1.00 1.03 O ATOM 39 CB LYS A 3 2.647 -1.478 -6.823 1.00 61.42 C ATOM 40 CG LYS A 3 3.902 -2.125 -6.262 1.00 12.52 C ATOM 41 CD LYS A 3 4.646 -1.181 -5.332 1.00 25.41 C ATOM 42 CE LYS A 3 3.868 -0.935 -4.048 1.00 44.44 C ATOM 43 NZ LYS A 3 4.740 -0.399 -2.966 1.00 54.41 N ATOM 0 H LYS A 3 1.353 -4.245 -6.007 1.00 25.11 H new ATOM 0 HA LYS A 3 0.632 -1.928 -7.422 1.00 71.11 H new ATOM 0 HB2 LYS A 3 2.901 -0.947 -7.741 1.00 61.42 H new ATOM 0 HB3 LYS A 3 2.284 -0.734 -6.114 1.00 61.42 H new ATOM 0 HG2 LYS A 3 3.634 -3.033 -5.722 1.00 12.52 H new ATOM 0 HG3 LYS A 3 4.557 -2.422 -7.081 1.00 12.52 H new ATOM 0 HD2 LYS A 3 5.623 -1.600 -5.092 1.00 25.41 H new ATOM 0 HD3 LYS A 3 4.822 -0.232 -5.839 1.00 25.41 H new ATOM 0 HE2 LYS A 3 3.058 -0.233 -4.243 1.00 44.44 H new ATOM 0 HE3 LYS A 3 3.409 -1.867 -3.717 1.00 44.44 H new ATOM 0 HZ1 LYS A 3 4.173 -0.245 -2.108 1.00 54.41 H new ATOM 0 HZ2 LYS A 3 5.499 -1.080 -2.762 1.00 54.41 H new ATOM 0 HZ3 LYS A 3 5.158 0.503 -3.272 1.00 54.41 H new ATOM 57 N GLY A 4 1.725 -2.945 -9.490 1.00 43.40 N ATOM 58 CA GLY A 4 2.083 -3.743 -10.648 1.00 32.33 C ATOM 59 C GLY A 4 0.868 -4.249 -11.400 1.00 63.35 C ATOM 60 O GLY A 4 0.955 -5.221 -12.153 1.00 41.51 O ATOM 0 H GLY A 4 1.312 -2.038 -9.706 1.00 43.40 H new ATOM 0 HA2 GLY A 4 2.700 -3.147 -11.320 1.00 32.33 H new ATOM 0 HA3 GLY A 4 2.688 -4.591 -10.328 1.00 32.33 H new ATOM 64 N LEU A 5 -0.268 -3.592 -11.197 1.00 41.42 N ATOM 65 CA LEU A 5 -1.507 -3.981 -11.862 1.00 22.35 C ATOM 66 C LEU A 5 -2.245 -2.759 -12.398 1.00 1.02 C ATOM 67 O LEU A 5 -2.014 -1.637 -11.949 1.00 43.22 O ATOM 68 CB LEU A 5 -2.407 -4.751 -10.894 1.00 13.03 C ATOM 69 CG LEU A 5 -2.253 -6.272 -10.899 1.00 71.32 C ATOM 70 CD1 LEU A 5 -2.535 -6.832 -12.285 1.00 32.44 C ATOM 71 CD2 LEU A 5 -0.859 -6.669 -10.435 1.00 40.34 C ATOM 0 H LEU A 5 -0.357 -2.787 -10.577 1.00 41.42 H new ATOM 0 HA LEU A 5 -1.252 -4.625 -12.703 1.00 22.35 H new ATOM 0 HB2 LEU A 5 -2.213 -4.390 -9.884 1.00 13.03 H new ATOM 0 HB3 LEU A 5 -3.445 -4.510 -11.125 1.00 13.03 H new ATOM 0 HG LEU A 5 -2.979 -6.694 -10.204 1.00 71.32 H new ATOM 0 HD11 LEU A 5 -2.421 -7.916 -12.270 1.00 32.44 H new ATOM 0 HD12 LEU A 5 -3.553 -6.579 -12.579 1.00 32.44 H new ATOM 0 HD13 LEU A 5 -1.833 -6.403 -13.000 1.00 32.44 H new ATOM 0 HD21 LEU A 5 -0.768 -7.755 -10.445 1.00 40.34 H new ATOM 0 HD22 LEU A 5 -0.116 -6.236 -11.105 1.00 40.34 H new ATOM 0 HD23 LEU A 5 -0.694 -6.300 -9.423 1.00 40.34 H new ATOM 83 N GLU A 6 -3.135 -2.986 -13.359 1.00 11.12 N ATOM 84 CA GLU A 6 -3.908 -1.902 -13.955 1.00 20.45 C ATOM 85 C GLU A 6 -5.279 -1.785 -13.294 1.00 43.13 C ATOM 86 O GLU A 6 -5.999 -2.774 -13.156 1.00 54.32 O ATOM 87 CB GLU A 6 -4.072 -2.130 -15.459 1.00 30.33 C ATOM 88 CG GLU A 6 -2.798 -2.589 -16.147 1.00 44.44 C ATOM 89 CD GLU A 6 -3.008 -2.900 -17.616 1.00 61.05 C ATOM 90 OE1 GLU A 6 -3.487 -4.011 -17.925 1.00 64.14 O ATOM 91 OE2 GLU A 6 -2.694 -2.032 -18.457 1.00 43.52 O ATOM 0 H GLU A 6 -3.339 -3.910 -13.741 1.00 11.12 H new ATOM 0 HA GLU A 6 -3.365 -0.971 -13.794 1.00 20.45 H new ATOM 0 HB2 GLU A 6 -4.852 -2.874 -15.622 1.00 30.33 H new ATOM 0 HB3 GLU A 6 -4.413 -1.205 -15.923 1.00 30.33 H new ATOM 0 HG2 GLU A 6 -2.037 -1.815 -16.049 1.00 44.44 H new ATOM 0 HG3 GLU A 6 -2.417 -3.477 -15.642 1.00 44.44 H new ATOM 98 N ILE A 7 -5.631 -0.570 -12.888 1.00 50.22 N ATOM 99 CA ILE A 7 -6.915 -0.323 -12.243 1.00 44.32 C ATOM 100 C ILE A 7 -7.490 1.025 -12.663 1.00 53.52 C ATOM 101 O ILE A 7 -6.751 1.974 -12.924 1.00 24.32 O ATOM 102 CB ILE A 7 -6.790 -0.359 -10.709 1.00 22.44 C ATOM 103 CG1 ILE A 7 -5.454 0.244 -10.269 1.00 72.12 C ATOM 104 CG2 ILE A 7 -6.925 -1.787 -10.200 1.00 52.13 C ATOM 105 CD1 ILE A 7 -4.331 -0.767 -10.191 1.00 52.51 C ATOM 0 H ILE A 7 -5.046 0.259 -12.994 1.00 50.22 H new ATOM 0 HA ILE A 7 -7.588 -1.119 -12.563 1.00 44.32 H new ATOM 0 HB ILE A 7 -7.595 0.237 -10.280 1.00 22.44 H new ATOM 0 HG12 ILE A 7 -5.174 1.033 -10.966 1.00 72.12 H new ATOM 0 HG13 ILE A 7 -5.580 0.711 -9.292 1.00 72.12 H new ATOM 0 HG21 ILE A 7 -6.834 -1.796 -9.114 1.00 52.13 H new ATOM 0 HG22 ILE A 7 -7.899 -2.185 -10.486 1.00 52.13 H new ATOM 0 HG23 ILE A 7 -6.139 -2.404 -10.635 1.00 52.13 H new ATOM 0 HD11 ILE A 7 -3.415 -0.269 -9.873 1.00 52.51 H new ATOM 0 HD12 ILE A 7 -4.590 -1.544 -9.472 1.00 52.51 H new ATOM 0 HD13 ILE A 7 -4.178 -1.217 -11.172 1.00 52.51 H new ATOM 117 N ALA A 8 -8.816 1.103 -12.725 1.00 4.42 N ATOM 118 CA ALA A 8 -9.491 2.336 -13.109 1.00 13.50 C ATOM 119 C ALA A 8 -10.319 2.892 -11.955 1.00 24.34 C ATOM 120 O ALA A 8 -10.864 2.137 -11.149 1.00 62.00 O ATOM 121 CB ALA A 8 -10.373 2.098 -14.326 1.00 2.11 C ATOM 0 H ALA A 8 -9.443 0.327 -12.514 1.00 4.42 H new ATOM 0 HA ALA A 8 -8.729 3.073 -13.364 1.00 13.50 H new ATOM 0 HB1 ALA A 8 -10.871 3.027 -14.602 1.00 2.11 H new ATOM 0 HB2 ALA A 8 -9.759 1.754 -15.159 1.00 2.11 H new ATOM 0 HB3 ALA A 8 -11.121 1.341 -14.091 1.00 2.11 H new ATOM 127 N PHE A 9 -10.408 4.216 -11.880 1.00 23.53 N ATOM 128 CA PHE A 9 -11.168 4.872 -10.822 1.00 45.03 C ATOM 129 C PHE A 9 -12.198 5.833 -11.409 1.00 24.21 C ATOM 130 O PHE A 9 -11.907 6.570 -12.350 1.00 54.15 O ATOM 131 CB PHE A 9 -10.226 5.628 -9.882 1.00 61.33 C ATOM 132 CG PHE A 9 -10.784 5.819 -8.501 1.00 52.11 C ATOM 133 CD1 PHE A 9 -11.283 4.742 -7.786 1.00 10.52 C ATOM 134 CD2 PHE A 9 -10.811 7.076 -7.918 1.00 64.14 C ATOM 135 CE1 PHE A 9 -11.797 4.915 -6.514 1.00 51.14 C ATOM 136 CE2 PHE A 9 -11.323 7.255 -6.647 1.00 71.43 C ATOM 137 CZ PHE A 9 -11.818 6.173 -5.945 1.00 11.11 C ATOM 0 H PHE A 9 -9.964 4.855 -12.539 1.00 23.53 H new ATOM 0 HA PHE A 9 -11.695 4.103 -10.256 1.00 45.03 H new ATOM 0 HB2 PHE A 9 -9.283 5.086 -9.812 1.00 61.33 H new ATOM 0 HB3 PHE A 9 -10.002 6.604 -10.313 1.00 61.33 H new ATOM 0 HD1 PHE A 9 -11.270 3.756 -8.227 1.00 10.52 H new ATOM 0 HD2 PHE A 9 -10.427 7.926 -8.463 1.00 64.14 H new ATOM 0 HE1 PHE A 9 -12.182 4.067 -5.966 1.00 51.14 H new ATOM 0 HE2 PHE A 9 -11.336 8.239 -6.203 1.00 71.43 H new ATOM 0 HZ PHE A 9 -12.221 6.311 -4.952 1.00 11.11 H new ATOM 147 N GLN A 10 -13.401 5.817 -10.845 1.00 71.02 N ATOM 148 CA GLN A 10 -14.475 6.686 -11.313 1.00 62.40 C ATOM 149 C GLN A 10 -14.794 7.761 -10.280 1.00 12.11 C ATOM 150 O GLN A 10 -15.236 7.460 -9.170 1.00 43.32 O ATOM 151 CB GLN A 10 -15.729 5.864 -11.616 1.00 20.24 C ATOM 152 CG GLN A 10 -16.913 6.704 -12.066 1.00 41.21 C ATOM 153 CD GLN A 10 -16.781 7.176 -13.501 1.00 15.13 C ATOM 154 OE1 GLN A 10 -16.768 6.371 -14.432 1.00 53.14 O ATOM 155 NE2 GLN A 10 -16.683 8.487 -13.686 1.00 54.33 N ATOM 0 H GLN A 10 -13.657 5.213 -10.064 1.00 71.02 H new ATOM 0 HA GLN A 10 -14.140 7.175 -12.228 1.00 62.40 H new ATOM 0 HB2 GLN A 10 -15.496 5.134 -12.391 1.00 20.24 H new ATOM 0 HB3 GLN A 10 -16.010 5.303 -10.725 1.00 20.24 H new ATOM 0 HG2 GLN A 10 -17.828 6.121 -11.962 1.00 41.21 H new ATOM 0 HG3 GLN A 10 -17.010 7.569 -11.410 1.00 41.21 H new ATOM 0 HE21 GLN A 10 -16.698 9.118 -12.885 1.00 54.33 H new ATOM 0 HE22 GLN A 10 -16.592 8.864 -14.630 1.00 54.33 H new ATOM 164 N THR A 11 -14.568 9.017 -10.651 1.00 43.42 N ATOM 165 CA THR A 11 -14.830 10.138 -9.757 1.00 23.23 C ATOM 166 C THR A 11 -15.692 11.195 -10.437 1.00 74.50 C ATOM 167 O THR A 11 -15.785 11.238 -11.664 1.00 61.52 O ATOM 168 CB THR A 11 -13.520 10.792 -9.277 1.00 32.43 C ATOM 169 OG1 THR A 11 -13.803 12.040 -8.634 1.00 65.15 O ATOM 170 CG2 THR A 11 -12.570 11.019 -10.443 1.00 22.14 C ATOM 0 H THR A 11 -14.204 9.284 -11.566 1.00 43.42 H new ATOM 0 HA THR A 11 -15.364 9.736 -8.896 1.00 23.23 H new ATOM 0 HB THR A 11 -13.042 10.118 -8.566 1.00 32.43 H new ATOM 0 HG1 THR A 11 -12.966 12.449 -8.330 1.00 65.15 H new ATOM 0 HG21 THR A 11 -11.652 11.482 -10.080 1.00 22.14 H new ATOM 0 HG22 THR A 11 -12.334 10.063 -10.911 1.00 22.14 H new ATOM 0 HG23 THR A 11 -13.042 11.675 -11.175 1.00 22.14 H new ATOM 178 N ILE A 12 -16.321 12.045 -9.633 1.00 53.33 N ATOM 179 CA ILE A 12 -17.175 13.103 -10.159 1.00 40.32 C ATOM 180 C ILE A 12 -17.396 14.199 -9.121 1.00 64.54 C ATOM 181 O ILE A 12 -16.892 14.117 -8.002 1.00 14.12 O ATOM 182 CB ILE A 12 -18.542 12.553 -10.607 1.00 50.20 C ATOM 183 CG1 ILE A 12 -18.956 11.374 -9.724 1.00 10.31 C ATOM 184 CG2 ILE A 12 -18.491 12.135 -12.069 1.00 34.21 C ATOM 185 CD1 ILE A 12 -19.038 11.720 -8.254 1.00 11.34 C ATOM 0 H ILE A 12 -16.256 12.022 -8.615 1.00 53.33 H new ATOM 0 HA ILE A 12 -16.660 13.523 -11.023 1.00 40.32 H new ATOM 0 HB ILE A 12 -19.287 13.341 -10.501 1.00 50.20 H new ATOM 0 HG12 ILE A 12 -19.926 11.004 -10.057 1.00 10.31 H new ATOM 0 HG13 ILE A 12 -18.242 10.561 -9.858 1.00 10.31 H new ATOM 0 HG21 ILE A 12 -19.464 11.748 -12.371 1.00 34.21 H new ATOM 0 HG22 ILE A 12 -18.236 12.997 -12.685 1.00 34.21 H new ATOM 0 HG23 ILE A 12 -17.736 11.360 -12.200 1.00 34.21 H new ATOM 0 HD11 ILE A 12 -19.337 10.837 -7.689 1.00 11.34 H new ATOM 0 HD12 ILE A 12 -18.063 12.061 -7.906 1.00 11.34 H new ATOM 0 HD13 ILE A 12 -19.773 12.511 -8.107 1.00 11.34 H new ATOM 197 N ASN A 13 -18.153 15.222 -9.501 1.00 51.44 N ATOM 198 CA ASN A 13 -18.442 16.334 -8.603 1.00 51.30 C ATOM 199 C ASN A 13 -18.929 15.827 -7.249 1.00 53.21 C ATOM 200 O ASN A 13 -20.074 15.397 -7.111 1.00 3.44 O ATOM 201 CB ASN A 13 -19.493 17.258 -9.223 1.00 22.15 C ATOM 202 CG ASN A 13 -18.912 18.156 -10.298 1.00 24.42 C ATOM 203 OD1 ASN A 13 -17.850 17.872 -10.852 1.00 24.41 O ATOM 204 ND2 ASN A 13 -19.607 19.246 -10.598 1.00 14.25 N ATOM 0 H ASN A 13 -18.578 15.304 -10.425 1.00 51.44 H new ATOM 0 HA ASN A 13 -17.520 16.895 -8.451 1.00 51.30 H new ATOM 0 HB2 ASN A 13 -20.295 16.656 -9.651 1.00 22.15 H new ATOM 0 HB3 ASN A 13 -19.938 17.873 -8.441 1.00 22.15 H new ATOM 0 HD21 ASN A 13 -19.265 19.888 -11.313 1.00 14.25 H new ATOM 0 HD22 ASN A 13 -20.483 19.442 -10.113 1.00 14.25 H new ATOM 211 N GLY A 14 -18.051 15.881 -6.252 1.00 14.51 N ATOM 212 CA GLY A 14 -18.411 15.425 -4.922 1.00 5.32 C ATOM 213 C GLY A 14 -17.247 15.490 -3.953 1.00 24.21 C ATOM 214 O GLY A 14 -16.687 16.561 -3.713 1.00 33.20 O ATOM 0 H GLY A 14 -17.098 16.232 -6.341 1.00 14.51 H new ATOM 0 HA2 GLY A 14 -19.231 16.034 -4.542 1.00 5.32 H new ATOM 0 HA3 GLY A 14 -18.776 14.399 -4.979 1.00 5.32 H new ATOM 218 N LEU A 15 -16.881 14.342 -3.393 1.00 10.13 N ATOM 219 CA LEU A 15 -15.776 14.272 -2.442 1.00 55.23 C ATOM 220 C LEU A 15 -14.719 13.277 -2.909 1.00 20.13 C ATOM 221 O LEU A 15 -13.967 12.731 -2.101 1.00 42.21 O ATOM 222 CB LEU A 15 -16.293 13.874 -1.059 1.00 1.25 C ATOM 223 CG LEU A 15 -16.793 15.017 -0.174 1.00 43.23 C ATOM 224 CD1 LEU A 15 -17.802 15.872 -0.926 1.00 24.41 C ATOM 225 CD2 LEU A 15 -17.404 14.471 1.108 1.00 5.51 C ATOM 0 H LEU A 15 -17.333 13.447 -3.581 1.00 10.13 H new ATOM 0 HA LEU A 15 -15.317 15.259 -2.381 1.00 55.23 H new ATOM 0 HB2 LEU A 15 -17.106 13.160 -1.189 1.00 1.25 H new ATOM 0 HB3 LEU A 15 -15.494 13.355 -0.530 1.00 1.25 H new ATOM 0 HG LEU A 15 -15.942 15.644 0.092 1.00 43.23 H new ATOM 0 HD11 LEU A 15 -18.147 16.680 -0.281 1.00 24.41 H new ATOM 0 HD12 LEU A 15 -17.332 16.293 -1.815 1.00 24.41 H new ATOM 0 HD13 LEU A 15 -18.652 15.257 -1.222 1.00 24.41 H new ATOM 0 HD21 LEU A 15 -17.754 15.298 1.725 1.00 5.51 H new ATOM 0 HD22 LEU A 15 -18.244 13.821 0.863 1.00 5.51 H new ATOM 0 HD23 LEU A 15 -16.653 13.902 1.656 1.00 5.51 H new ATOM 237 N ASP A 16 -14.666 13.047 -4.216 1.00 11.10 N ATOM 238 CA ASP A 16 -13.698 12.120 -4.791 1.00 33.12 C ATOM 239 C ASP A 16 -12.489 12.869 -5.342 1.00 52.12 C ATOM 240 O ASP A 16 -11.403 12.305 -5.469 1.00 11.01 O ATOM 241 CB ASP A 16 -14.350 11.292 -5.899 1.00 63.44 C ATOM 242 CG ASP A 16 -15.099 10.089 -5.360 1.00 12.55 C ATOM 243 OD1 ASP A 16 -15.692 10.202 -4.266 1.00 41.34 O ATOM 244 OD2 ASP A 16 -15.092 9.036 -6.030 1.00 33.52 O ATOM 0 H ASP A 16 -15.282 13.490 -4.898 1.00 11.10 H new ATOM 0 HA ASP A 16 -13.358 11.451 -4.000 1.00 33.12 H new ATOM 0 HB2 ASP A 16 -15.038 11.922 -6.462 1.00 63.44 H new ATOM 0 HB3 ASP A 16 -13.583 10.956 -6.596 1.00 63.44 H new ATOM 249 N GLU A 17 -12.687 14.142 -5.669 1.00 41.50 N ATOM 250 CA GLU A 17 -11.613 14.968 -6.209 1.00 25.53 C ATOM 251 C GLU A 17 -10.362 14.869 -5.340 1.00 11.34 C ATOM 252 O GLU A 17 -9.255 14.681 -5.845 1.00 14.15 O ATOM 253 CB GLU A 17 -12.062 16.426 -6.311 1.00 53.54 C ATOM 254 CG GLU A 17 -12.672 16.967 -5.029 1.00 2.21 C ATOM 255 CD GLU A 17 -13.313 18.328 -5.216 1.00 51.45 C ATOM 256 OE1 GLU A 17 -14.197 18.453 -6.090 1.00 4.51 O ATOM 257 OE2 GLU A 17 -12.931 19.269 -4.489 1.00 21.22 O ATOM 0 H GLU A 17 -13.581 14.624 -5.570 1.00 41.50 H new ATOM 0 HA GLU A 17 -11.373 14.600 -7.206 1.00 25.53 H new ATOM 0 HB2 GLU A 17 -11.206 17.043 -6.584 1.00 53.54 H new ATOM 0 HB3 GLU A 17 -12.791 16.517 -7.117 1.00 53.54 H new ATOM 0 HG2 GLU A 17 -13.421 16.264 -4.663 1.00 2.21 H new ATOM 0 HG3 GLU A 17 -11.898 17.036 -4.264 1.00 2.21 H new ATOM 264 N SER A 18 -10.547 14.999 -4.030 1.00 33.13 N ATOM 265 CA SER A 18 -9.435 14.929 -3.090 1.00 4.42 C ATOM 266 C SER A 18 -8.719 13.586 -3.194 1.00 2.12 C ATOM 267 O SER A 18 -7.489 13.521 -3.171 1.00 1.23 O ATOM 268 CB SER A 18 -9.933 15.145 -1.660 1.00 33.14 C ATOM 269 OG SER A 18 -9.857 16.512 -1.294 1.00 32.24 O ATOM 0 H SER A 18 -11.457 15.153 -3.596 1.00 33.13 H new ATOM 0 HA SER A 18 -8.728 15.719 -3.344 1.00 4.42 H new ATOM 0 HB2 SER A 18 -10.963 14.799 -1.574 1.00 33.14 H new ATOM 0 HB3 SER A 18 -9.338 14.547 -0.970 1.00 33.14 H new ATOM 0 HG SER A 18 -10.610 16.736 -0.708 1.00 32.24 H new ATOM 275 N LEU A 19 -9.497 12.516 -3.308 1.00 70.44 N ATOM 276 CA LEU A 19 -8.939 11.172 -3.416 1.00 50.02 C ATOM 277 C LEU A 19 -8.098 11.031 -4.681 1.00 53.42 C ATOM 278 O LEU A 19 -7.075 10.347 -4.686 1.00 73.34 O ATOM 279 CB LEU A 19 -10.060 10.131 -3.417 1.00 52.50 C ATOM 280 CG LEU A 19 -9.624 8.674 -3.262 1.00 3.32 C ATOM 281 CD1 LEU A 19 -9.065 8.142 -4.572 1.00 44.01 C ATOM 282 CD2 LEU A 19 -8.595 8.541 -2.148 1.00 13.40 C ATOM 0 H LEU A 19 -10.516 12.552 -3.328 1.00 70.44 H new ATOM 0 HA LEU A 19 -8.295 11.003 -2.553 1.00 50.02 H new ATOM 0 HB2 LEU A 19 -10.751 10.370 -2.609 1.00 52.50 H new ATOM 0 HB3 LEU A 19 -10.615 10.226 -4.350 1.00 52.50 H new ATOM 0 HG LEU A 19 -10.498 8.080 -2.996 1.00 3.32 H new ATOM 0 HD11 LEU A 19 -8.760 7.104 -4.442 1.00 44.01 H new ATOM 0 HD12 LEU A 19 -9.831 8.201 -5.345 1.00 44.01 H new ATOM 0 HD13 LEU A 19 -8.203 8.739 -4.869 1.00 44.01 H new ATOM 0 HD21 LEU A 19 -8.296 7.497 -2.052 1.00 13.40 H new ATOM 0 HD22 LEU A 19 -7.722 9.148 -2.385 1.00 13.40 H new ATOM 0 HD23 LEU A 19 -9.030 8.882 -1.208 1.00 13.40 H new ATOM 294 N VAL A 20 -8.536 11.686 -5.752 1.00 42.21 N ATOM 295 CA VAL A 20 -7.822 11.637 -7.023 1.00 10.25 C ATOM 296 C VAL A 20 -6.483 12.360 -6.929 1.00 10.11 C ATOM 297 O VAL A 20 -5.436 11.790 -7.235 1.00 35.42 O ATOM 298 CB VAL A 20 -8.653 12.264 -8.158 1.00 31.02 C ATOM 299 CG1 VAL A 20 -8.009 11.985 -9.508 1.00 14.35 C ATOM 300 CG2 VAL A 20 -10.082 11.743 -8.122 1.00 1.24 C ATOM 0 H VAL A 20 -9.381 12.257 -5.765 1.00 42.21 H new ATOM 0 HA VAL A 20 -7.649 10.585 -7.248 1.00 10.25 H new ATOM 0 HB VAL A 20 -8.680 13.344 -8.011 1.00 31.02 H new ATOM 0 HG11 VAL A 20 -8.610 12.436 -10.298 1.00 14.35 H new ATOM 0 HG12 VAL A 20 -7.006 12.411 -9.528 1.00 14.35 H new ATOM 0 HG13 VAL A 20 -7.949 10.908 -9.667 1.00 14.35 H new ATOM 0 HG21 VAL A 20 -10.655 12.196 -8.931 1.00 1.24 H new ATOM 0 HG22 VAL A 20 -10.078 10.660 -8.243 1.00 1.24 H new ATOM 0 HG23 VAL A 20 -10.539 11.999 -7.166 1.00 1.24 H new ATOM 310 N GLN A 21 -6.525 13.619 -6.504 1.00 22.45 N ATOM 311 CA GLN A 21 -5.314 14.420 -6.370 1.00 21.22 C ATOM 312 C GLN A 21 -4.398 13.846 -5.294 1.00 2.23 C ATOM 313 O GLN A 21 -3.182 14.035 -5.334 1.00 55.41 O ATOM 314 CB GLN A 21 -5.670 15.869 -6.034 1.00 33.25 C ATOM 315 CG GLN A 21 -6.400 16.592 -7.154 1.00 72.51 C ATOM 316 CD GLN A 21 -5.458 17.130 -8.212 1.00 63.15 C ATOM 317 OE1 GLN A 21 -4.641 18.011 -7.943 1.00 21.13 O ATOM 318 NE2 GLN A 21 -5.566 16.602 -9.426 1.00 31.40 N ATOM 0 H GLN A 21 -7.384 14.106 -6.247 1.00 22.45 H new ATOM 0 HA GLN A 21 -4.785 14.395 -7.323 1.00 21.22 H new ATOM 0 HB2 GLN A 21 -6.291 15.883 -5.138 1.00 33.25 H new ATOM 0 HB3 GLN A 21 -4.756 16.413 -5.797 1.00 33.25 H new ATOM 0 HG2 GLN A 21 -7.111 15.909 -7.619 1.00 72.51 H new ATOM 0 HG3 GLN A 21 -6.977 17.416 -6.734 1.00 72.51 H new ATOM 0 HE21 GLN A 21 -6.257 15.874 -9.606 1.00 31.40 H new ATOM 0 HE22 GLN A 21 -4.958 16.925 -10.179 1.00 31.40 H new ATOM 327 N ALA A 22 -4.989 13.145 -4.332 1.00 73.02 N ATOM 328 CA ALA A 22 -4.226 12.543 -3.246 1.00 72.52 C ATOM 329 C ALA A 22 -3.570 11.241 -3.693 1.00 24.30 C ATOM 330 O ALA A 22 -2.362 11.055 -3.533 1.00 15.33 O ATOM 331 CB ALA A 22 -5.124 12.297 -2.043 1.00 14.12 C ATOM 0 H ALA A 22 -5.994 12.980 -4.283 1.00 73.02 H new ATOM 0 HA ALA A 22 -3.437 13.238 -2.960 1.00 72.52 H new ATOM 0 HB1 ALA A 22 -4.541 11.847 -1.240 1.00 14.12 H new ATOM 0 HB2 ALA A 22 -5.542 13.244 -1.701 1.00 14.12 H new ATOM 0 HB3 ALA A 22 -5.933 11.624 -2.325 1.00 14.12 H new ATOM 337 N LEU A 23 -4.371 10.341 -4.253 1.00 41.41 N ATOM 338 CA LEU A 23 -3.867 9.055 -4.723 1.00 15.31 C ATOM 339 C LEU A 23 -2.792 9.247 -5.787 1.00 43.41 C ATOM 340 O LEU A 23 -1.832 8.480 -5.860 1.00 14.24 O ATOM 341 CB LEU A 23 -5.013 8.212 -5.286 1.00 23.24 C ATOM 342 CG LEU A 23 -5.370 8.458 -6.752 1.00 21.41 C ATOM 343 CD1 LEU A 23 -4.492 7.615 -7.664 1.00 20.43 C ATOM 344 CD2 LEU A 23 -6.841 8.159 -7.000 1.00 33.12 C ATOM 0 H LEU A 23 -5.372 10.478 -4.393 1.00 41.41 H new ATOM 0 HA LEU A 23 -3.423 8.534 -3.875 1.00 15.31 H new ATOM 0 HB2 LEU A 23 -4.755 7.160 -5.167 1.00 23.24 H new ATOM 0 HB3 LEU A 23 -5.902 8.393 -4.681 1.00 23.24 H new ATOM 0 HG LEU A 23 -5.190 9.509 -6.978 1.00 21.41 H new ATOM 0 HD11 LEU A 23 -4.761 7.803 -8.703 1.00 20.43 H new ATOM 0 HD12 LEU A 23 -3.446 7.877 -7.506 1.00 20.43 H new ATOM 0 HD13 LEU A 23 -4.639 6.559 -7.437 1.00 20.43 H new ATOM 0 HD21 LEU A 23 -7.077 8.340 -8.049 1.00 33.12 H new ATOM 0 HD22 LEU A 23 -7.047 7.117 -6.756 1.00 33.12 H new ATOM 0 HD23 LEU A 23 -7.455 8.806 -6.373 1.00 33.12 H new ATOM 356 N ALA A 24 -2.958 10.278 -6.610 1.00 2.04 N ATOM 357 CA ALA A 24 -1.999 10.574 -7.667 1.00 31.30 C ATOM 358 C ALA A 24 -0.645 10.967 -7.086 1.00 51.11 C ATOM 359 O ALA A 24 0.399 10.543 -7.578 1.00 64.42 O ATOM 360 CB ALA A 24 -2.531 11.679 -8.567 1.00 44.14 C ATOM 0 H ALA A 24 -3.748 10.922 -6.565 1.00 2.04 H new ATOM 0 HA ALA A 24 -1.861 9.671 -8.262 1.00 31.30 H new ATOM 0 HB1 ALA A 24 -1.805 11.890 -9.352 1.00 44.14 H new ATOM 0 HB2 ALA A 24 -3.471 11.360 -9.018 1.00 44.14 H new ATOM 0 HB3 ALA A 24 -2.699 12.580 -7.977 1.00 44.14 H new ATOM 366 N GLY A 25 -0.671 11.782 -6.036 1.00 0.31 N ATOM 367 CA GLY A 25 0.561 12.220 -5.406 1.00 60.11 C ATOM 368 C GLY A 25 1.292 11.087 -4.713 1.00 12.33 C ATOM 369 O GLY A 25 2.494 10.904 -4.906 1.00 32.11 O ATOM 0 H GLY A 25 -1.523 12.147 -5.610 1.00 0.31 H new ATOM 0 HA2 GLY A 25 1.213 12.662 -6.159 1.00 60.11 H new ATOM 0 HA3 GLY A 25 0.336 13.001 -4.680 1.00 60.11 H new ATOM 373 N VAL A 26 0.565 10.325 -3.901 1.00 4.51 N ATOM 374 CA VAL A 26 1.152 9.205 -3.176 1.00 0.05 C ATOM 375 C VAL A 26 1.700 8.155 -4.136 1.00 3.43 C ATOM 376 O VAL A 26 2.751 7.561 -3.891 1.00 12.24 O ATOM 377 CB VAL A 26 0.124 8.542 -2.240 1.00 73.11 C ATOM 378 CG1 VAL A 26 -1.073 8.039 -3.033 1.00 32.02 C ATOM 379 CG2 VAL A 26 0.769 7.409 -1.457 1.00 63.41 C ATOM 0 H VAL A 26 -0.431 10.463 -3.729 1.00 4.51 H new ATOM 0 HA VAL A 26 1.970 9.608 -2.579 1.00 0.05 H new ATOM 0 HB VAL A 26 -0.229 9.289 -1.529 1.00 73.11 H new ATOM 0 HG11 VAL A 26 -1.789 7.574 -2.355 1.00 32.02 H new ATOM 0 HG12 VAL A 26 -1.549 8.876 -3.544 1.00 32.02 H new ATOM 0 HG13 VAL A 26 -0.740 7.306 -3.768 1.00 32.02 H new ATOM 0 HG21 VAL A 26 0.028 6.952 -0.801 1.00 63.41 H new ATOM 0 HG22 VAL A 26 1.151 6.659 -2.150 1.00 63.41 H new ATOM 0 HG23 VAL A 26 1.591 7.802 -0.858 1.00 63.41 H new ATOM 389 N THR A 27 0.982 7.931 -5.232 1.00 2.22 N ATOM 390 CA THR A 27 1.396 6.953 -6.230 1.00 33.34 C ATOM 391 C THR A 27 2.693 7.376 -6.910 1.00 33.42 C ATOM 392 O THR A 27 3.655 6.611 -6.962 1.00 23.31 O ATOM 393 CB THR A 27 0.309 6.751 -7.302 1.00 70.44 C ATOM 394 OG1 THR A 27 -0.170 8.020 -7.760 1.00 44.22 O ATOM 395 CG2 THR A 27 -0.851 5.935 -6.751 1.00 65.31 C ATOM 0 H THR A 27 0.111 8.414 -5.451 1.00 2.22 H new ATOM 0 HA THR A 27 1.556 6.012 -5.703 1.00 33.34 H new ATOM 0 HB THR A 27 0.751 6.207 -8.137 1.00 70.44 H new ATOM 0 HG1 THR A 27 -0.875 8.340 -7.159 1.00 44.22 H new ATOM 0 HG21 THR A 27 -1.606 5.806 -7.527 1.00 65.31 H new ATOM 0 HG22 THR A 27 -0.489 4.958 -6.431 1.00 65.31 H new ATOM 0 HG23 THR A 27 -1.290 6.456 -5.900 1.00 65.31 H new ATOM 403 N ALA A 28 2.711 8.599 -7.430 1.00 24.44 N ATOM 404 CA ALA A 28 3.892 9.124 -8.104 1.00 71.12 C ATOM 405 C ALA A 28 5.101 9.125 -7.175 1.00 32.53 C ATOM 406 O ALA A 28 6.217 8.819 -7.593 1.00 24.42 O ATOM 407 CB ALA A 28 3.622 10.529 -8.623 1.00 70.41 C ATOM 0 H ALA A 28 1.922 9.244 -7.397 1.00 24.44 H new ATOM 0 HA ALA A 28 4.117 8.473 -8.948 1.00 71.12 H new ATOM 0 HB1 ALA A 28 4.512 10.909 -9.124 1.00 70.41 H new ATOM 0 HB2 ALA A 28 2.792 10.503 -9.329 1.00 70.41 H new ATOM 0 HB3 ALA A 28 3.368 11.183 -7.788 1.00 70.41 H new ATOM 413 N SER A 29 4.871 9.471 -5.912 1.00 75.22 N ATOM 414 CA SER A 29 5.942 9.516 -4.924 1.00 61.43 C ATOM 415 C SER A 29 6.349 8.108 -4.500 1.00 64.34 C ATOM 416 O SER A 29 7.511 7.856 -4.179 1.00 32.12 O ATOM 417 CB SER A 29 5.503 10.322 -3.701 1.00 31.15 C ATOM 418 OG SER A 29 4.866 9.492 -2.745 1.00 22.24 O ATOM 0 H SER A 29 3.952 9.724 -5.549 1.00 75.22 H new ATOM 0 HA SER A 29 6.804 10.003 -5.381 1.00 61.43 H new ATOM 0 HB2 SER A 29 6.370 10.804 -3.249 1.00 31.15 H new ATOM 0 HB3 SER A 29 4.822 11.115 -4.010 1.00 31.15 H new ATOM 0 HG SER A 29 4.158 8.974 -3.182 1.00 22.24 H new ATOM 424 N ASP A 30 5.385 7.194 -4.503 1.00 22.03 N ATOM 425 CA ASP A 30 5.642 5.810 -4.120 1.00 11.53 C ATOM 426 C ASP A 30 6.265 5.033 -5.275 1.00 51.42 C ATOM 427 O ASP A 30 6.832 3.958 -5.080 1.00 4.44 O ATOM 428 CB ASP A 30 4.345 5.133 -3.674 1.00 0.32 C ATOM 429 CG ASP A 30 4.558 3.690 -3.260 1.00 51.33 C ATOM 430 OD1 ASP A 30 4.962 3.458 -2.102 1.00 5.23 O ATOM 431 OD2 ASP A 30 4.319 2.793 -4.095 1.00 50.01 O ATOM 0 H ASP A 30 4.418 7.386 -4.766 1.00 22.03 H new ATOM 0 HA ASP A 30 6.346 5.814 -3.288 1.00 11.53 H new ATOM 0 HB2 ASP A 30 3.917 5.688 -2.839 1.00 0.32 H new ATOM 0 HB3 ASP A 30 3.620 5.171 -4.487 1.00 0.32 H new ATOM 436 N PHE A 31 6.154 5.584 -6.480 1.00 20.14 N ATOM 437 CA PHE A 31 6.705 4.941 -7.667 1.00 55.54 C ATOM 438 C PHE A 31 7.862 5.755 -8.239 1.00 53.50 C ATOM 439 O PHE A 31 7.743 6.406 -9.277 1.00 52.33 O ATOM 440 CB PHE A 31 5.616 4.766 -8.729 1.00 25.23 C ATOM 441 CG PHE A 31 4.616 3.698 -8.390 1.00 55.31 C ATOM 442 CD1 PHE A 31 5.023 2.391 -8.175 1.00 53.43 C ATOM 443 CD2 PHE A 31 3.268 4.002 -8.286 1.00 33.20 C ATOM 444 CE1 PHE A 31 4.104 1.407 -7.864 1.00 54.34 C ATOM 445 CE2 PHE A 31 2.344 3.022 -7.975 1.00 31.21 C ATOM 446 CZ PHE A 31 2.763 1.723 -7.763 1.00 13.02 C ATOM 0 H PHE A 31 5.688 6.473 -6.660 1.00 20.14 H new ATOM 0 HA PHE A 31 7.082 3.960 -7.377 1.00 55.54 H new ATOM 0 HB2 PHE A 31 5.093 5.713 -8.862 1.00 25.23 H new ATOM 0 HB3 PHE A 31 6.085 4.524 -9.683 1.00 25.23 H new ATOM 0 HD1 PHE A 31 6.070 2.139 -8.251 1.00 53.43 H new ATOM 0 HD2 PHE A 31 2.935 5.016 -8.450 1.00 33.20 H new ATOM 0 HE1 PHE A 31 4.434 0.392 -7.700 1.00 54.34 H new ATOM 0 HE2 PHE A 31 1.296 3.272 -7.898 1.00 31.21 H new ATOM 0 HZ PHE A 31 2.043 0.956 -7.519 1.00 13.02 H new ATOM 456 N PRO A 32 9.009 5.720 -7.545 1.00 61.54 N ATOM 457 CA PRO A 32 10.210 6.448 -7.964 1.00 64.22 C ATOM 458 C PRO A 32 10.838 5.856 -9.222 1.00 0.33 C ATOM 459 O PRO A 32 11.621 6.516 -9.906 1.00 12.24 O ATOM 460 CB PRO A 32 11.155 6.290 -6.770 1.00 41.11 C ATOM 461 CG PRO A 32 10.711 5.037 -6.099 1.00 31.34 C ATOM 462 CD PRO A 32 9.222 4.965 -6.299 1.00 63.31 C ATOM 0 HA PRO A 32 9.990 7.485 -8.217 1.00 64.22 H new ATOM 0 HB2 PRO A 32 12.193 6.219 -7.094 1.00 41.11 H new ATOM 0 HB3 PRO A 32 11.089 7.145 -6.097 1.00 41.11 H new ATOM 0 HG2 PRO A 32 11.205 4.167 -6.531 1.00 31.34 H new ATOM 0 HG3 PRO A 32 10.962 5.052 -5.038 1.00 31.34 H new ATOM 0 HD2 PRO A 32 8.878 3.935 -6.390 1.00 63.31 H new ATOM 0 HD3 PRO A 32 8.682 5.409 -5.463 1.00 63.31 H new ATOM 470 N ASP A 33 10.489 4.610 -9.521 1.00 65.10 N ATOM 471 CA ASP A 33 11.018 3.930 -10.698 1.00 32.10 C ATOM 472 C ASP A 33 10.486 4.567 -11.978 1.00 72.20 C ATOM 473 O ASP A 33 10.977 4.289 -13.073 1.00 73.30 O ATOM 474 CB ASP A 33 10.652 2.445 -10.662 1.00 44.14 C ATOM 475 CG ASP A 33 9.166 2.219 -10.466 1.00 3.11 C ATOM 476 OD1 ASP A 33 8.389 3.176 -10.664 1.00 51.52 O ATOM 477 OD2 ASP A 33 8.780 1.085 -10.115 1.00 24.32 O ATOM 0 H ASP A 33 9.842 4.050 -8.965 1.00 65.10 H new ATOM 0 HA ASP A 33 12.103 4.029 -10.688 1.00 32.10 H new ATOM 0 HB2 ASP A 33 10.969 1.973 -11.592 1.00 44.14 H new ATOM 0 HB3 ASP A 33 11.200 1.958 -9.855 1.00 44.14 H new ATOM 482 N LEU A 34 9.479 5.421 -11.833 1.00 42.43 N ATOM 483 CA LEU A 34 8.879 6.098 -12.978 1.00 61.32 C ATOM 484 C LEU A 34 8.198 5.097 -13.906 1.00 64.15 C ATOM 485 O LEU A 34 7.876 5.416 -15.051 1.00 12.52 O ATOM 486 CB LEU A 34 9.943 6.882 -13.748 1.00 4.14 C ATOM 487 CG LEU A 34 10.950 7.659 -12.898 1.00 13.00 C ATOM 488 CD1 LEU A 34 11.895 8.455 -13.785 1.00 13.14 C ATOM 489 CD2 LEU A 34 10.228 8.579 -11.924 1.00 33.51 C ATOM 0 H LEU A 34 9.061 5.661 -10.934 1.00 42.43 H new ATOM 0 HA LEU A 34 8.125 6.791 -12.605 1.00 61.32 H new ATOM 0 HB2 LEU A 34 10.493 6.185 -14.380 1.00 4.14 H new ATOM 0 HB3 LEU A 34 9.439 7.585 -14.411 1.00 4.14 H new ATOM 0 HG LEU A 34 11.539 6.945 -12.323 1.00 13.00 H new ATOM 0 HD11 LEU A 34 12.604 9.001 -13.163 1.00 13.14 H new ATOM 0 HD12 LEU A 34 12.437 7.775 -14.442 1.00 13.14 H new ATOM 0 HD13 LEU A 34 11.322 9.160 -14.387 1.00 13.14 H new ATOM 0 HD21 LEU A 34 10.960 9.124 -11.328 1.00 33.51 H new ATOM 0 HD22 LEU A 34 9.613 9.287 -12.480 1.00 33.51 H new ATOM 0 HD23 LEU A 34 9.593 7.986 -11.266 1.00 33.51 H new ATOM 501 N ASP A 35 7.981 3.886 -13.405 1.00 64.02 N ATOM 502 CA ASP A 35 7.336 2.839 -14.188 1.00 73.22 C ATOM 503 C ASP A 35 5.817 2.952 -14.099 1.00 30.42 C ATOM 504 O ASP A 35 5.090 2.205 -14.755 1.00 12.40 O ATOM 505 CB ASP A 35 7.786 1.460 -13.705 1.00 24.53 C ATOM 506 CG ASP A 35 9.281 1.255 -13.851 1.00 64.32 C ATOM 507 OD1 ASP A 35 9.922 2.054 -14.565 1.00 2.34 O ATOM 508 OD2 ASP A 35 9.810 0.294 -13.253 1.00 45.31 O ATOM 0 H ASP A 35 8.242 3.605 -12.460 1.00 64.02 H new ATOM 0 HA ASP A 35 7.632 2.964 -15.230 1.00 73.22 H new ATOM 0 HB2 ASP A 35 7.506 1.335 -12.659 1.00 24.53 H new ATOM 0 HB3 ASP A 35 7.260 0.691 -14.270 1.00 24.53 H new ATOM 513 N ILE A 36 5.345 3.888 -13.282 1.00 65.14 N ATOM 514 CA ILE A 36 3.914 4.098 -13.108 1.00 33.24 C ATOM 515 C ILE A 36 3.302 4.764 -14.335 1.00 72.12 C ATOM 516 O ILE A 36 3.691 5.869 -14.715 1.00 33.41 O ATOM 517 CB ILE A 36 3.619 4.962 -11.868 1.00 13.43 C ATOM 518 CG1 ILE A 36 2.123 5.271 -11.778 1.00 52.35 C ATOM 519 CG2 ILE A 36 4.429 6.249 -11.914 1.00 50.24 C ATOM 520 CD1 ILE A 36 1.734 6.017 -10.521 1.00 34.40 C ATOM 0 H ILE A 36 5.933 4.513 -12.730 1.00 65.14 H new ATOM 0 HA ILE A 36 3.465 3.114 -12.971 1.00 33.24 H new ATOM 0 HB ILE A 36 3.910 4.404 -10.978 1.00 13.43 H new ATOM 0 HG12 ILE A 36 1.829 5.861 -12.646 1.00 52.35 H new ATOM 0 HG13 ILE A 36 1.564 4.336 -11.824 1.00 52.35 H new ATOM 0 HG21 ILE A 36 4.209 6.849 -11.031 1.00 50.24 H new ATOM 0 HG22 ILE A 36 5.492 6.009 -11.935 1.00 50.24 H new ATOM 0 HG23 ILE A 36 4.167 6.812 -12.810 1.00 50.24 H new ATOM 0 HD11 ILE A 36 0.660 6.202 -10.525 1.00 34.40 H new ATOM 0 HD12 ILE A 36 1.996 5.420 -9.648 1.00 34.40 H new ATOM 0 HD13 ILE A 36 2.266 6.968 -10.483 1.00 34.40 H new ATOM 532 N LYS A 37 2.340 4.085 -14.952 1.00 1.51 N ATOM 533 CA LYS A 37 1.670 4.611 -16.136 1.00 3.45 C ATOM 534 C LYS A 37 0.211 4.940 -15.834 1.00 65.34 C ATOM 535 O LYS A 37 -0.688 4.162 -16.152 1.00 73.41 O ATOM 536 CB LYS A 37 1.751 3.602 -17.283 1.00 54.10 C ATOM 537 CG LYS A 37 3.172 3.271 -17.703 1.00 61.42 C ATOM 538 CD LYS A 37 3.956 4.524 -18.054 1.00 24.10 C ATOM 539 CE LYS A 37 3.314 5.279 -19.208 1.00 21.33 C ATOM 540 NZ LYS A 37 4.250 6.265 -19.814 1.00 40.45 N ATOM 0 H LYS A 37 2.007 3.169 -14.651 1.00 1.51 H new ATOM 0 HA LYS A 37 2.177 5.529 -16.433 1.00 3.45 H new ATOM 0 HB2 LYS A 37 1.246 2.683 -16.984 1.00 54.10 H new ATOM 0 HB3 LYS A 37 1.210 3.998 -18.143 1.00 54.10 H new ATOM 0 HG2 LYS A 37 3.676 2.739 -16.896 1.00 61.42 H new ATOM 0 HG3 LYS A 37 3.152 2.601 -18.562 1.00 61.42 H new ATOM 0 HD2 LYS A 37 4.015 5.174 -17.181 1.00 24.10 H new ATOM 0 HD3 LYS A 37 4.978 4.253 -18.319 1.00 24.10 H new ATOM 0 HE2 LYS A 37 2.990 4.570 -19.970 1.00 21.33 H new ATOM 0 HE3 LYS A 37 2.422 5.795 -18.853 1.00 21.33 H new ATOM 0 HZ1 LYS A 37 3.775 6.759 -20.597 1.00 40.45 H new ATOM 0 HZ2 LYS A 37 4.540 6.957 -19.093 1.00 40.45 H new ATOM 0 HZ3 LYS A 37 5.090 5.769 -20.176 1.00 40.45 H new ATOM 554 N TYR A 38 -0.015 6.096 -15.222 1.00 15.14 N ATOM 555 CA TYR A 38 -1.365 6.527 -14.877 1.00 73.41 C ATOM 556 C TYR A 38 -1.687 7.875 -15.515 1.00 23.31 C ATOM 557 O TYR A 38 -0.799 8.565 -16.014 1.00 72.12 O ATOM 558 CB TYR A 38 -1.522 6.618 -13.358 1.00 41.13 C ATOM 559 CG TYR A 38 -1.019 7.919 -12.775 1.00 0.21 C ATOM 560 CD1 TYR A 38 0.329 8.253 -12.831 1.00 32.03 C ATOM 561 CD2 TYR A 38 -1.891 8.814 -12.167 1.00 42.13 C ATOM 562 CE1 TYR A 38 0.793 9.440 -12.299 1.00 2.35 C ATOM 563 CE2 TYR A 38 -1.436 10.004 -11.634 1.00 5.22 C ATOM 564 CZ TYR A 38 -0.093 10.313 -11.702 1.00 21.34 C ATOM 565 OH TYR A 38 0.365 11.497 -11.170 1.00 72.41 O ATOM 0 H TYR A 38 0.719 6.752 -14.954 1.00 15.14 H new ATOM 0 HA TYR A 38 -2.065 5.786 -15.264 1.00 73.41 H new ATOM 0 HB2 TYR A 38 -2.575 6.498 -13.102 1.00 41.13 H new ATOM 0 HB3 TYR A 38 -0.985 5.790 -12.895 1.00 41.13 H new ATOM 0 HD1 TYR A 38 1.025 7.573 -13.299 1.00 32.03 H new ATOM 0 HD2 TYR A 38 -2.943 8.575 -12.110 1.00 42.13 H new ATOM 0 HE1 TYR A 38 1.844 9.684 -12.350 1.00 2.35 H new ATOM 0 HE2 TYR A 38 -2.128 10.689 -11.166 1.00 5.22 H new ATOM 0 HH TYR A 38 -0.393 12.097 -11.006 1.00 72.41 H new ATOM 575 N ASN A 39 -2.964 8.243 -15.493 1.00 64.10 N ATOM 576 CA ASN A 39 -3.404 9.508 -16.069 1.00 11.43 C ATOM 577 C ASN A 39 -4.850 9.807 -15.685 1.00 33.53 C ATOM 578 O ASN A 39 -5.622 8.897 -15.379 1.00 61.10 O ATOM 579 CB ASN A 39 -3.266 9.475 -17.592 1.00 44.30 C ATOM 580 CG ASN A 39 -3.004 10.849 -18.179 1.00 13.12 C ATOM 581 OD1 ASN A 39 -3.713 11.296 -19.081 1.00 12.13 O ATOM 582 ND2 ASN A 39 -1.982 11.526 -17.668 1.00 72.21 N ATOM 0 H ASN A 39 -3.712 7.683 -15.083 1.00 64.10 H new ATOM 0 HA ASN A 39 -2.769 10.300 -15.671 1.00 11.43 H new ATOM 0 HB2 ASN A 39 -2.451 8.805 -17.866 1.00 44.30 H new ATOM 0 HB3 ASN A 39 -4.177 9.064 -18.028 1.00 44.30 H new ATOM 0 HD21 ASN A 39 -1.758 12.456 -18.023 1.00 72.21 H new ATOM 0 HD22 ASN A 39 -1.421 11.116 -16.921 1.00 72.21 H new ATOM 589 N ILE A 40 -5.210 11.085 -15.704 1.00 1.55 N ATOM 590 CA ILE A 40 -6.563 11.503 -15.359 1.00 53.02 C ATOM 591 C ILE A 40 -7.229 12.227 -16.525 1.00 62.51 C ATOM 592 O ILE A 40 -6.722 13.237 -17.014 1.00 20.35 O ATOM 593 CB ILE A 40 -6.571 12.425 -14.126 1.00 14.14 C ATOM 594 CG1 ILE A 40 -5.146 12.637 -13.611 1.00 12.10 C ATOM 595 CG2 ILE A 40 -7.453 11.840 -13.033 1.00 34.02 C ATOM 596 CD1 ILE A 40 -5.081 13.413 -12.314 1.00 72.11 C ATOM 0 H ILE A 40 -4.583 11.850 -15.955 1.00 1.55 H new ATOM 0 HA ILE A 40 -7.123 10.597 -15.128 1.00 53.02 H new ATOM 0 HB ILE A 40 -6.980 13.393 -14.417 1.00 14.14 H new ATOM 0 HG12 ILE A 40 -4.672 11.666 -13.468 1.00 12.10 H new ATOM 0 HG13 ILE A 40 -4.569 13.165 -14.370 1.00 12.10 H new ATOM 0 HG21 ILE A 40 -7.448 12.503 -12.168 1.00 34.02 H new ATOM 0 HG22 ILE A 40 -8.472 11.736 -13.405 1.00 34.02 H new ATOM 0 HG23 ILE A 40 -7.071 10.861 -12.742 1.00 34.02 H new ATOM 0 HD11 ILE A 40 -4.041 13.525 -12.009 1.00 72.11 H new ATOM 0 HD12 ILE A 40 -5.525 14.398 -12.457 1.00 72.11 H new ATOM 0 HD13 ILE A 40 -5.630 12.876 -11.541 1.00 72.11 H new ATOM 608 N PHE A 41 -8.368 11.704 -16.966 1.00 33.13 N ATOM 609 CA PHE A 41 -9.105 12.300 -18.074 1.00 42.21 C ATOM 610 C PHE A 41 -10.575 12.486 -17.712 1.00 54.43 C ATOM 611 O PHE A 41 -11.110 11.781 -16.856 1.00 11.25 O ATOM 612 CB PHE A 41 -8.982 11.427 -19.324 1.00 71.24 C ATOM 613 CG PHE A 41 -9.074 9.955 -19.039 1.00 0.02 C ATOM 614 CD1 PHE A 41 -10.244 9.404 -18.540 1.00 43.34 C ATOM 615 CD2 PHE A 41 -7.991 9.122 -19.269 1.00 41.23 C ATOM 616 CE1 PHE A 41 -10.330 8.051 -18.276 1.00 74.41 C ATOM 617 CE2 PHE A 41 -8.072 7.767 -19.007 1.00 40.52 C ATOM 618 CZ PHE A 41 -9.244 7.231 -18.511 1.00 22.11 C ATOM 0 H PHE A 41 -8.801 10.868 -16.573 1.00 33.13 H new ATOM 0 HA PHE A 41 -8.673 13.280 -18.280 1.00 42.21 H new ATOM 0 HB2 PHE A 41 -9.767 11.702 -20.028 1.00 71.24 H new ATOM 0 HB3 PHE A 41 -8.029 11.636 -19.811 1.00 71.24 H new ATOM 0 HD1 PHE A 41 -11.098 10.040 -18.356 1.00 43.34 H new ATOM 0 HD2 PHE A 41 -7.072 9.536 -19.658 1.00 41.23 H new ATOM 0 HE1 PHE A 41 -11.247 7.634 -17.886 1.00 74.41 H new ATOM 0 HE2 PHE A 41 -7.220 7.129 -19.190 1.00 40.52 H new ATOM 0 HZ PHE A 41 -9.311 6.173 -18.307 1.00 22.11 H new ATOM 628 N LEU A 42 -11.224 13.441 -18.370 1.00 61.15 N ATOM 629 CA LEU A 42 -12.633 13.722 -18.119 1.00 32.40 C ATOM 630 C LEU A 42 -13.478 13.415 -19.351 1.00 60.43 C ATOM 631 O LEU A 42 -13.232 13.947 -20.434 1.00 15.12 O ATOM 632 CB LEU A 42 -12.817 15.185 -17.712 1.00 73.40 C ATOM 633 CG LEU A 42 -14.190 15.794 -18.001 1.00 22.03 C ATOM 634 CD1 LEU A 42 -15.279 15.031 -17.262 1.00 45.11 C ATOM 635 CD2 LEU A 42 -14.212 17.266 -17.615 1.00 23.23 C ATOM 0 H LEU A 42 -10.796 14.034 -19.082 1.00 61.15 H new ATOM 0 HA LEU A 42 -12.966 13.080 -17.304 1.00 32.40 H new ATOM 0 HB2 LEU A 42 -12.621 15.272 -16.643 1.00 73.40 H new ATOM 0 HB3 LEU A 42 -12.062 15.782 -18.224 1.00 73.40 H new ATOM 0 HG LEU A 42 -14.383 15.716 -19.071 1.00 22.03 H new ATOM 0 HD11 LEU A 42 -16.249 15.479 -17.480 1.00 45.11 H new ATOM 0 HD12 LEU A 42 -15.279 13.990 -17.587 1.00 45.11 H new ATOM 0 HD13 LEU A 42 -15.091 15.076 -16.189 1.00 45.11 H new ATOM 0 HD21 LEU A 42 -15.196 17.683 -17.827 1.00 23.23 H new ATOM 0 HD22 LEU A 42 -13.997 17.366 -16.551 1.00 23.23 H new ATOM 0 HD23 LEU A 42 -13.458 17.804 -18.190 1.00 23.23 H new ATOM 647 N VAL A 43 -14.476 12.554 -19.179 1.00 21.51 N ATOM 648 CA VAL A 43 -15.360 12.178 -20.276 1.00 22.11 C ATOM 649 C VAL A 43 -16.705 12.886 -20.165 1.00 34.24 C ATOM 650 O VAL A 43 -17.267 13.006 -19.076 1.00 2.24 O ATOM 651 CB VAL A 43 -15.594 10.656 -20.312 1.00 12.01 C ATOM 652 CG1 VAL A 43 -14.391 9.917 -19.747 1.00 62.31 C ATOM 653 CG2 VAL A 43 -16.859 10.294 -19.549 1.00 12.05 C ATOM 0 H VAL A 43 -14.693 12.104 -18.290 1.00 21.51 H new ATOM 0 HA VAL A 43 -14.867 12.484 -21.199 1.00 22.11 H new ATOM 0 HB VAL A 43 -15.723 10.350 -21.350 1.00 12.01 H new ATOM 0 HG11 VAL A 43 -14.575 8.843 -19.781 1.00 62.31 H new ATOM 0 HG12 VAL A 43 -13.508 10.153 -20.340 1.00 62.31 H new ATOM 0 HG13 VAL A 43 -14.227 10.225 -18.714 1.00 62.31 H new ATOM 0 HG21 VAL A 43 -17.009 9.215 -19.585 1.00 12.05 H new ATOM 0 HG22 VAL A 43 -16.762 10.613 -18.511 1.00 12.05 H new ATOM 0 HG23 VAL A 43 -17.714 10.794 -20.004 1.00 12.05 H new ATOM 663 N ASP A 44 -17.218 13.352 -21.298 1.00 43.10 N ATOM 664 CA ASP A 44 -18.499 14.047 -21.329 1.00 13.32 C ATOM 665 C ASP A 44 -19.374 13.524 -22.464 1.00 12.12 C ATOM 666 O ASP A 44 -19.130 13.816 -23.635 1.00 61.33 O ATOM 667 CB ASP A 44 -18.283 15.553 -21.487 1.00 51.15 C ATOM 668 CG ASP A 44 -19.569 16.293 -21.801 1.00 61.30 C ATOM 669 OD1 ASP A 44 -20.639 15.842 -21.342 1.00 50.11 O ATOM 670 OD2 ASP A 44 -19.505 17.322 -22.506 1.00 70.31 O ATOM 0 H ASP A 44 -16.766 13.261 -22.208 1.00 43.10 H new ATOM 0 HA ASP A 44 -19.009 13.858 -20.385 1.00 13.32 H new ATOM 0 HB2 ASP A 44 -17.852 15.953 -20.570 1.00 51.15 H new ATOM 0 HB3 ASP A 44 -17.561 15.732 -22.283 1.00 51.15 H new ATOM 675 N LEU A 45 -20.393 12.749 -22.109 1.00 53.41 N ATOM 676 CA LEU A 45 -21.305 12.184 -23.098 1.00 22.11 C ATOM 677 C LEU A 45 -22.680 11.932 -22.489 1.00 74.11 C ATOM 678 O LEU A 45 -22.813 11.764 -21.277 1.00 4.05 O ATOM 679 CB LEU A 45 -20.736 10.879 -23.658 1.00 45.30 C ATOM 680 CG LEU A 45 -20.630 10.792 -25.181 1.00 1.20 C ATOM 681 CD1 LEU A 45 -22.013 10.800 -25.813 1.00 41.13 C ATOM 682 CD2 LEU A 45 -19.787 11.937 -25.723 1.00 42.14 C ATOM 0 H LEU A 45 -20.609 12.497 -21.144 1.00 53.41 H new ATOM 0 HA LEU A 45 -21.414 12.904 -23.909 1.00 22.11 H new ATOM 0 HB2 LEU A 45 -19.743 10.728 -23.235 1.00 45.30 H new ATOM 0 HB3 LEU A 45 -21.359 10.055 -23.310 1.00 45.30 H new ATOM 0 HG LEU A 45 -20.140 9.853 -25.439 1.00 1.20 H new ATOM 0 HD11 LEU A 45 -21.918 10.737 -26.897 1.00 41.13 H new ATOM 0 HD12 LEU A 45 -22.584 9.946 -25.449 1.00 41.13 H new ATOM 0 HD13 LEU A 45 -22.529 11.722 -25.547 1.00 41.13 H new ATOM 0 HD21 LEU A 45 -19.722 11.859 -26.808 1.00 42.14 H new ATOM 0 HD22 LEU A 45 -20.248 12.887 -25.454 1.00 42.14 H new ATOM 0 HD23 LEU A 45 -18.786 11.886 -25.295 1.00 42.14 H new ATOM 694 N TYR A 46 -23.701 11.905 -23.338 1.00 74.44 N ATOM 695 CA TYR A 46 -25.067 11.673 -22.884 1.00 54.02 C ATOM 696 C TYR A 46 -25.545 12.813 -21.990 1.00 41.21 C ATOM 697 O TYR A 46 -26.282 12.597 -21.029 1.00 23.11 O ATOM 698 CB TYR A 46 -25.158 10.346 -22.129 1.00 70.23 C ATOM 699 CG TYR A 46 -24.594 9.172 -22.898 1.00 4.33 C ATOM 700 CD1 TYR A 46 -25.300 8.601 -23.949 1.00 71.11 C ATOM 701 CD2 TYR A 46 -23.355 8.634 -22.572 1.00 42.22 C ATOM 702 CE1 TYR A 46 -24.789 7.528 -24.654 1.00 1.23 C ATOM 703 CE2 TYR A 46 -22.835 7.563 -23.272 1.00 72.32 C ATOM 704 CZ TYR A 46 -23.556 7.013 -24.312 1.00 0.02 C ATOM 705 OH TYR A 46 -23.042 5.945 -25.011 1.00 34.44 O ATOM 0 H TYR A 46 -23.609 12.041 -24.345 1.00 74.44 H new ATOM 0 HA TYR A 46 -25.712 11.629 -23.762 1.00 54.02 H new ATOM 0 HB2 TYR A 46 -24.626 10.439 -21.182 1.00 70.23 H new ATOM 0 HB3 TYR A 46 -26.202 10.145 -21.889 1.00 70.23 H new ATOM 0 HD1 TYR A 46 -26.265 9.003 -24.220 1.00 71.11 H new ATOM 0 HD2 TYR A 46 -22.789 9.061 -21.757 1.00 42.22 H new ATOM 0 HE1 TYR A 46 -25.352 7.095 -25.468 1.00 1.23 H new ATOM 0 HE2 TYR A 46 -21.869 7.158 -23.007 1.00 72.32 H new ATOM 0 HH TYR A 46 -22.165 5.706 -24.644 1.00 34.44 H new ATOM 715 N GLY A 47 -25.119 14.030 -22.316 1.00 11.15 N ATOM 716 CA GLY A 47 -25.513 15.188 -21.534 1.00 24.55 C ATOM 717 C GLY A 47 -24.963 15.147 -20.121 1.00 54.13 C ATOM 718 O GLY A 47 -25.344 15.959 -19.278 1.00 24.41 O ATOM 0 H GLY A 47 -24.509 14.235 -23.107 1.00 11.15 H new ATOM 0 HA2 GLY A 47 -25.164 16.094 -22.030 1.00 24.55 H new ATOM 0 HA3 GLY A 47 -26.601 15.244 -21.496 1.00 24.55 H new ATOM 722 N GLN A 48 -24.068 14.199 -19.863 1.00 52.21 N ATOM 723 CA GLN A 48 -23.468 14.055 -18.542 1.00 11.40 C ATOM 724 C GLN A 48 -21.953 13.915 -18.645 1.00 1.34 C ATOM 725 O GLN A 48 -21.441 13.220 -19.522 1.00 42.24 O ATOM 726 CB GLN A 48 -24.057 12.842 -17.821 1.00 23.43 C ATOM 727 CG GLN A 48 -25.564 12.914 -17.638 1.00 52.24 C ATOM 728 CD GLN A 48 -25.987 14.046 -16.723 1.00 55.22 C ATOM 729 OE1 GLN A 48 -25.323 14.337 -15.728 1.00 33.42 O ATOM 730 NE2 GLN A 48 -27.098 14.693 -17.056 1.00 54.00 N ATOM 0 H GLN A 48 -23.743 13.520 -20.551 1.00 52.21 H new ATOM 0 HA GLN A 48 -23.693 14.954 -17.968 1.00 11.40 H new ATOM 0 HB2 GLN A 48 -23.811 11.941 -18.383 1.00 23.43 H new ATOM 0 HB3 GLN A 48 -23.585 12.747 -16.843 1.00 23.43 H new ATOM 0 HG2 GLN A 48 -26.039 13.042 -18.611 1.00 52.24 H new ATOM 0 HG3 GLN A 48 -25.922 11.969 -17.230 1.00 52.24 H new ATOM 0 HE21 GLN A 48 -27.618 14.418 -17.890 1.00 54.00 H new ATOM 0 HE22 GLN A 48 -27.432 15.464 -16.478 1.00 54.00 H new ATOM 739 N LYS A 49 -21.240 14.580 -17.742 1.00 42.41 N ATOM 740 CA LYS A 49 -19.783 14.530 -17.729 1.00 44.24 C ATOM 741 C LYS A 49 -19.271 13.904 -16.436 1.00 71.53 C ATOM 742 O LYS A 49 -19.692 14.282 -15.343 1.00 31.12 O ATOM 743 CB LYS A 49 -19.202 15.937 -17.891 1.00 61.25 C ATOM 744 CG LYS A 49 -19.901 16.985 -17.043 1.00 21.11 C ATOM 745 CD LYS A 49 -20.722 17.936 -17.897 1.00 12.54 C ATOM 746 CE LYS A 49 -20.036 19.286 -18.045 1.00 63.43 C ATOM 747 NZ LYS A 49 -21.000 20.362 -18.407 1.00 24.50 N ATOM 0 H LYS A 49 -21.648 15.160 -17.009 1.00 42.41 H new ATOM 0 HA LYS A 49 -19.459 13.911 -18.565 1.00 44.24 H new ATOM 0 HB2 LYS A 49 -18.144 15.916 -17.629 1.00 61.25 H new ATOM 0 HB3 LYS A 49 -19.265 16.229 -18.939 1.00 61.25 H new ATOM 0 HG2 LYS A 49 -20.550 16.494 -16.318 1.00 21.11 H new ATOM 0 HG3 LYS A 49 -19.160 17.550 -16.477 1.00 21.11 H new ATOM 0 HD2 LYS A 49 -20.881 17.497 -18.882 1.00 12.54 H new ATOM 0 HD3 LYS A 49 -21.705 18.074 -17.447 1.00 12.54 H new ATOM 0 HE2 LYS A 49 -19.538 19.544 -17.111 1.00 63.43 H new ATOM 0 HE3 LYS A 49 -19.263 19.218 -18.811 1.00 63.43 H new ATOM 0 HZ1 LYS A 49 -20.493 21.266 -18.498 1.00 24.50 H new ATOM 0 HZ2 LYS A 49 -21.457 20.128 -19.311 1.00 24.50 H new ATOM 0 HZ3 LYS A 49 -21.723 20.444 -17.664 1.00 24.50 H new ATOM 761 N TYR A 50 -18.361 12.945 -16.568 1.00 42.25 N ATOM 762 CA TYR A 50 -17.793 12.266 -15.410 1.00 63.33 C ATOM 763 C TYR A 50 -16.271 12.206 -15.506 1.00 12.33 C ATOM 764 O TYR A 50 -15.703 12.268 -16.596 1.00 42.11 O ATOM 765 CB TYR A 50 -18.363 10.851 -15.292 1.00 40.30 C ATOM 766 CG TYR A 50 -19.870 10.795 -15.402 1.00 61.14 C ATOM 767 CD1 TYR A 50 -20.497 10.830 -16.642 1.00 1.40 C ATOM 768 CD2 TYR A 50 -20.667 10.707 -14.268 1.00 23.03 C ATOM 769 CE1 TYR A 50 -21.873 10.780 -16.748 1.00 34.21 C ATOM 770 CE2 TYR A 50 -22.044 10.654 -14.364 1.00 43.41 C ATOM 771 CZ TYR A 50 -22.642 10.691 -15.606 1.00 53.32 C ATOM 772 OH TYR A 50 -24.014 10.641 -15.706 1.00 62.54 O ATOM 0 H TYR A 50 -18.001 12.621 -17.466 1.00 42.25 H new ATOM 0 HA TYR A 50 -18.061 12.835 -14.520 1.00 63.33 H new ATOM 0 HB2 TYR A 50 -17.927 10.226 -16.071 1.00 40.30 H new ATOM 0 HB3 TYR A 50 -18.061 10.425 -14.335 1.00 40.30 H new ATOM 0 HD1 TYR A 50 -19.898 10.897 -17.538 1.00 1.40 H new ATOM 0 HD2 TYR A 50 -20.202 10.680 -13.294 1.00 23.03 H new ATOM 0 HE1 TYR A 50 -22.344 10.810 -17.719 1.00 34.21 H new ATOM 0 HE2 TYR A 50 -22.649 10.584 -13.472 1.00 43.41 H new ATOM 0 HH TYR A 50 -24.405 10.579 -14.810 1.00 62.54 H new ATOM 782 N PHE A 51 -15.617 12.085 -14.355 1.00 51.52 N ATOM 783 CA PHE A 51 -14.161 12.018 -14.307 1.00 32.20 C ATOM 784 C PHE A 51 -13.691 10.585 -14.072 1.00 2.44 C ATOM 785 O PHE A 51 -14.185 9.897 -13.179 1.00 14.24 O ATOM 786 CB PHE A 51 -13.623 12.931 -13.203 1.00 53.04 C ATOM 787 CG PHE A 51 -13.725 14.393 -13.532 1.00 54.04 C ATOM 788 CD1 PHE A 51 -14.962 14.995 -13.695 1.00 54.35 C ATOM 789 CD2 PHE A 51 -12.584 15.165 -13.679 1.00 70.11 C ATOM 790 CE1 PHE A 51 -15.060 16.341 -13.998 1.00 21.51 C ATOM 791 CE2 PHE A 51 -12.675 16.510 -13.981 1.00 53.41 C ATOM 792 CZ PHE A 51 -13.915 17.099 -14.142 1.00 24.31 C ATOM 0 H PHE A 51 -16.072 12.031 -13.444 1.00 51.52 H new ATOM 0 HA PHE A 51 -13.774 12.356 -15.268 1.00 32.20 H new ATOM 0 HB2 PHE A 51 -14.171 12.735 -12.281 1.00 53.04 H new ATOM 0 HB3 PHE A 51 -12.579 12.681 -13.013 1.00 53.04 H new ATOM 0 HD1 PHE A 51 -15.861 14.406 -13.584 1.00 54.35 H new ATOM 0 HD2 PHE A 51 -11.612 14.710 -13.556 1.00 70.11 H new ATOM 0 HE1 PHE A 51 -16.031 16.798 -14.122 1.00 21.51 H new ATOM 0 HE2 PHE A 51 -11.778 17.101 -14.091 1.00 53.41 H new ATOM 0 HZ PHE A 51 -13.988 18.150 -14.380 1.00 24.31 H new ATOM 802 N ARG A 52 -12.733 10.143 -14.880 1.00 2.34 N ATOM 803 CA ARG A 52 -12.196 8.793 -14.761 1.00 74.22 C ATOM 804 C ARG A 52 -10.673 8.804 -14.844 1.00 22.21 C ATOM 805 O ARG A 52 -10.087 9.609 -15.568 1.00 64.12 O ATOM 806 CB ARG A 52 -12.771 7.895 -15.859 1.00 21.05 C ATOM 807 CG ARG A 52 -14.220 7.501 -15.626 1.00 55.25 C ATOM 808 CD ARG A 52 -14.871 6.992 -16.903 1.00 43.34 C ATOM 809 NE ARG A 52 -16.293 7.318 -16.961 1.00 11.41 N ATOM 810 CZ ARG A 52 -17.075 7.019 -17.992 1.00 63.24 C ATOM 811 NH1 ARG A 52 -16.575 6.389 -19.046 1.00 45.15 N ATOM 812 NH2 ARG A 52 -18.360 7.349 -17.970 1.00 62.34 N ATOM 0 H ARG A 52 -12.313 10.700 -15.624 1.00 2.34 H new ATOM 0 HA ARG A 52 -12.486 8.398 -13.788 1.00 74.22 H new ATOM 0 HB2 ARG A 52 -12.693 8.410 -16.816 1.00 21.05 H new ATOM 0 HB3 ARG A 52 -12.165 6.992 -15.933 1.00 21.05 H new ATOM 0 HG2 ARG A 52 -14.269 6.729 -14.858 1.00 55.25 H new ATOM 0 HG3 ARG A 52 -14.776 8.360 -15.250 1.00 55.25 H new ATOM 0 HD2 ARG A 52 -14.365 7.425 -17.765 1.00 43.34 H new ATOM 0 HD3 ARG A 52 -14.744 5.911 -16.969 1.00 43.34 H new ATOM 0 HE ARG A 52 -16.709 7.802 -16.165 1.00 11.41 H new ATOM 0 HH11 ARG A 52 -15.588 6.133 -19.066 1.00 45.15 H new ATOM 0 HH12 ARG A 52 -17.177 6.160 -19.837 1.00 45.15 H new ATOM 0 HH21 ARG A 52 -18.748 7.833 -17.161 1.00 62.34 H new ATOM 0 HH22 ARG A 52 -18.959 7.119 -18.763 1.00 62.34 H new ATOM 826 N ILE A 53 -10.038 7.906 -14.097 1.00 55.15 N ATOM 827 CA ILE A 53 -8.584 7.813 -14.087 1.00 61.52 C ATOM 828 C ILE A 53 -8.119 6.422 -14.508 1.00 14.25 C ATOM 829 O ILE A 53 -8.672 5.412 -14.070 1.00 11.22 O ATOM 830 CB ILE A 53 -8.009 8.134 -12.695 1.00 41.52 C ATOM 831 CG1 ILE A 53 -8.015 6.883 -11.815 1.00 23.00 C ATOM 832 CG2 ILE A 53 -8.804 9.253 -12.039 1.00 52.55 C ATOM 833 CD1 ILE A 53 -6.752 6.058 -11.930 1.00 31.24 C ATOM 0 H ILE A 53 -10.508 7.233 -13.491 1.00 55.15 H new ATOM 0 HA ILE A 53 -8.216 8.549 -14.802 1.00 61.52 H new ATOM 0 HB ILE A 53 -6.978 8.467 -12.813 1.00 41.52 H new ATOM 0 HG12 ILE A 53 -8.152 7.180 -10.775 1.00 23.00 H new ATOM 0 HG13 ILE A 53 -8.870 6.263 -12.084 1.00 23.00 H new ATOM 0 HG21 ILE A 53 -8.386 9.469 -11.056 1.00 52.55 H new ATOM 0 HG22 ILE A 53 -8.753 10.148 -12.659 1.00 52.55 H new ATOM 0 HG23 ILE A 53 -9.844 8.945 -11.931 1.00 52.55 H new ATOM 0 HD11 ILE A 53 -6.826 5.187 -11.279 1.00 31.24 H new ATOM 0 HD12 ILE A 53 -6.624 5.730 -12.962 1.00 31.24 H new ATOM 0 HD13 ILE A 53 -5.895 6.662 -11.632 1.00 31.24 H new ATOM 845 N LEU A 54 -7.100 6.377 -15.358 1.00 3.23 N ATOM 846 CA LEU A 54 -6.558 5.110 -15.837 1.00 12.14 C ATOM 847 C LEU A 54 -5.138 4.896 -15.323 1.00 32.34 C ATOM 848 O LEU A 54 -4.229 5.663 -15.641 1.00 32.24 O ATOM 849 CB LEU A 54 -6.570 5.073 -17.366 1.00 13.22 C ATOM 850 CG LEU A 54 -6.675 3.687 -18.003 1.00 1.11 C ATOM 851 CD1 LEU A 54 -6.432 3.769 -19.502 1.00 73.00 C ATOM 852 CD2 LEU A 54 -5.690 2.726 -17.353 1.00 72.22 C ATOM 0 H LEU A 54 -6.632 7.203 -15.730 1.00 3.23 H new ATOM 0 HA LEU A 54 -7.188 4.306 -15.455 1.00 12.14 H new ATOM 0 HB2 LEU A 54 -7.407 5.677 -17.718 1.00 13.22 H new ATOM 0 HB3 LEU A 54 -5.659 5.549 -17.728 1.00 13.22 H new ATOM 0 HG LEU A 54 -7.684 3.308 -17.839 1.00 1.11 H new ATOM 0 HD11 LEU A 54 -6.511 2.773 -19.938 1.00 73.00 H new ATOM 0 HD12 LEU A 54 -7.176 4.424 -19.956 1.00 73.00 H new ATOM 0 HD13 LEU A 54 -5.435 4.169 -19.688 1.00 73.00 H new ATOM 0 HD21 LEU A 54 -5.778 1.744 -17.819 1.00 72.22 H new ATOM 0 HD22 LEU A 54 -4.675 3.100 -17.486 1.00 72.22 H new ATOM 0 HD23 LEU A 54 -5.910 2.644 -16.289 1.00 72.22 H new ATOM 864 N PHE A 55 -4.954 3.847 -14.528 1.00 33.33 N ATOM 865 CA PHE A 55 -3.644 3.530 -13.970 1.00 54.24 C ATOM 866 C PHE A 55 -3.201 2.130 -14.384 1.00 72.04 C ATOM 867 O PHE A 55 -3.900 1.148 -14.136 1.00 12.35 O ATOM 868 CB PHE A 55 -3.677 3.637 -12.444 1.00 64.14 C ATOM 869 CG PHE A 55 -2.515 2.963 -11.772 1.00 31.22 C ATOM 870 CD1 PHE A 55 -1.238 3.066 -12.298 1.00 5.12 C ATOM 871 CD2 PHE A 55 -2.701 2.225 -10.614 1.00 11.24 C ATOM 872 CE1 PHE A 55 -0.166 2.447 -11.681 1.00 54.41 C ATOM 873 CE2 PHE A 55 -1.634 1.605 -9.992 1.00 62.33 C ATOM 874 CZ PHE A 55 -0.365 1.715 -10.527 1.00 72.23 C ATOM 0 H PHE A 55 -5.696 3.202 -14.256 1.00 33.33 H new ATOM 0 HA PHE A 55 -2.926 4.250 -14.362 1.00 54.24 H new ATOM 0 HB2 PHE A 55 -3.690 4.690 -12.161 1.00 64.14 H new ATOM 0 HB3 PHE A 55 -4.604 3.197 -12.077 1.00 64.14 H new ATOM 0 HD1 PHE A 55 -1.077 3.637 -13.201 1.00 5.12 H new ATOM 0 HD2 PHE A 55 -3.691 2.133 -10.193 1.00 11.24 H new ATOM 0 HE1 PHE A 55 0.825 2.536 -12.101 1.00 54.41 H new ATOM 0 HE2 PHE A 55 -1.792 1.035 -9.088 1.00 62.33 H new ATOM 0 HZ PHE A 55 0.470 1.229 -10.044 1.00 72.23 H new ATOM 884 N GLN A 56 -2.036 2.048 -15.018 1.00 24.13 N ATOM 885 CA GLN A 56 -1.500 0.769 -15.468 1.00 24.45 C ATOM 886 C GLN A 56 -0.019 0.647 -15.123 1.00 41.41 C ATOM 887 O GLN A 56 0.692 1.649 -15.033 1.00 74.42 O ATOM 888 CB GLN A 56 -1.699 0.610 -16.976 1.00 32.02 C ATOM 889 CG GLN A 56 -1.577 1.915 -17.746 1.00 72.22 C ATOM 890 CD GLN A 56 -1.754 1.729 -19.240 1.00 54.22 C ATOM 891 OE1 GLN A 56 -2.845 1.409 -19.713 1.00 35.34 O ATOM 892 NE2 GLN A 56 -0.680 1.930 -19.994 1.00 4.24 N ATOM 0 H GLN A 56 -1.445 2.852 -15.232 1.00 24.13 H new ATOM 0 HA GLN A 56 -2.041 -0.024 -14.952 1.00 24.45 H new ATOM 0 HB2 GLN A 56 -0.964 -0.098 -17.359 1.00 32.02 H new ATOM 0 HB3 GLN A 56 -2.683 0.179 -17.161 1.00 32.02 H new ATOM 0 HG2 GLN A 56 -2.324 2.620 -17.380 1.00 72.22 H new ATOM 0 HG3 GLN A 56 -0.600 2.357 -17.552 1.00 72.22 H new ATOM 0 HE21 GLN A 56 0.205 2.194 -19.561 1.00 4.24 H new ATOM 0 HE22 GLN A 56 -0.740 1.820 -21.006 1.00 4.24 H new ATOM 901 N SER A 57 0.440 -0.585 -14.931 1.00 20.21 N ATOM 902 CA SER A 57 1.836 -0.837 -14.592 1.00 72.00 C ATOM 903 C SER A 57 2.558 -1.531 -15.743 1.00 53.32 C ATOM 904 O SER A 57 1.932 -1.977 -16.705 1.00 43.13 O ATOM 905 CB SER A 57 1.929 -1.693 -13.327 1.00 41.51 C ATOM 906 OG SER A 57 1.413 -1.000 -12.204 1.00 2.23 O ATOM 0 H SER A 57 -0.134 -1.425 -15.004 1.00 20.21 H new ATOM 0 HA SER A 57 2.319 0.123 -14.409 1.00 72.00 H new ATOM 0 HB2 SER A 57 1.376 -2.621 -13.471 1.00 41.51 H new ATOM 0 HB3 SER A 57 2.968 -1.966 -13.144 1.00 41.51 H new ATOM 0 HG SER A 57 2.058 -1.044 -11.467 1.00 2.23 H new ATOM 912 N LYS A 58 3.879 -1.618 -15.638 1.00 3.24 N ATOM 913 CA LYS A 58 4.689 -2.258 -16.668 1.00 2.45 C ATOM 914 C LYS A 58 4.976 -3.712 -16.308 1.00 63.05 C ATOM 915 O LYS A 58 5.083 -4.570 -17.185 1.00 40.44 O ATOM 916 CB LYS A 58 6.005 -1.498 -16.856 1.00 35.51 C ATOM 917 CG LYS A 58 6.706 -1.813 -18.166 1.00 23.34 C ATOM 918 CD LYS A 58 6.062 -1.084 -19.333 1.00 3.13 C ATOM 919 CE LYS A 58 6.493 0.374 -19.385 1.00 30.10 C ATOM 920 NZ LYS A 58 5.572 1.195 -20.219 1.00 30.22 N ATOM 0 H LYS A 58 4.413 -1.253 -14.849 1.00 3.24 H new ATOM 0 HA LYS A 58 4.128 -2.237 -17.602 1.00 2.45 H new ATOM 0 HB2 LYS A 58 5.807 -0.427 -16.808 1.00 35.51 H new ATOM 0 HB3 LYS A 58 6.674 -1.736 -16.029 1.00 35.51 H new ATOM 0 HG2 LYS A 58 7.756 -1.531 -18.095 1.00 23.34 H new ATOM 0 HG3 LYS A 58 6.676 -2.888 -18.346 1.00 23.34 H new ATOM 0 HD2 LYS A 58 6.333 -1.578 -20.266 1.00 3.13 H new ATOM 0 HD3 LYS A 58 4.977 -1.141 -19.245 1.00 3.13 H new ATOM 0 HE2 LYS A 58 6.526 0.779 -18.374 1.00 30.10 H new ATOM 0 HE3 LYS A 58 7.504 0.440 -19.788 1.00 30.10 H new ATOM 0 HZ1 LYS A 58 5.900 2.182 -20.229 1.00 30.22 H new ATOM 0 HZ2 LYS A 58 5.560 0.824 -21.191 1.00 30.22 H new ATOM 0 HZ3 LYS A 58 4.612 1.153 -19.820 1.00 30.22 H new ATOM 934 N LYS A 59 5.099 -3.984 -15.014 1.00 1.13 N ATOM 935 CA LYS A 59 5.371 -5.335 -14.537 1.00 51.14 C ATOM 936 C LYS A 59 4.108 -6.190 -14.577 1.00 25.01 C ATOM 937 O LYS A 59 4.148 -7.387 -14.290 1.00 61.43 O ATOM 938 CB LYS A 59 5.927 -5.293 -13.112 1.00 60.13 C ATOM 939 CG LYS A 59 7.420 -5.563 -13.034 1.00 12.43 C ATOM 940 CD LYS A 59 8.133 -4.512 -12.200 1.00 0.51 C ATOM 941 CE LYS A 59 8.392 -3.246 -13.002 1.00 45.51 C ATOM 942 NZ LYS A 59 9.830 -2.857 -12.976 1.00 71.43 N ATOM 0 H LYS A 59 5.015 -3.286 -14.275 1.00 1.13 H new ATOM 0 HA LYS A 59 6.114 -5.784 -15.196 1.00 51.14 H new ATOM 0 HB2 LYS A 59 5.720 -4.314 -12.679 1.00 60.13 H new ATOM 0 HB3 LYS A 59 5.401 -6.029 -12.504 1.00 60.13 H new ATOM 0 HG2 LYS A 59 7.590 -6.549 -12.602 1.00 12.43 H new ATOM 0 HG3 LYS A 59 7.841 -5.578 -14.039 1.00 12.43 H new ATOM 0 HD2 LYS A 59 7.531 -4.272 -11.323 1.00 0.51 H new ATOM 0 HD3 LYS A 59 9.079 -4.914 -11.837 1.00 0.51 H new ATOM 0 HE2 LYS A 59 8.076 -3.399 -14.034 1.00 45.51 H new ATOM 0 HE3 LYS A 59 7.788 -2.432 -12.601 1.00 45.51 H new ATOM 0 HZ1 LYS A 59 9.914 -1.829 -13.108 1.00 71.43 H new ATOM 0 HZ2 LYS A 59 10.245 -3.123 -12.060 1.00 71.43 H new ATOM 0 HZ3 LYS A 59 10.336 -3.347 -13.741 1.00 71.43 H new ATOM 956 N LEU A 60 2.990 -5.569 -14.935 1.00 31.23 N ATOM 957 CA LEU A 60 1.715 -6.274 -15.013 1.00 62.14 C ATOM 958 C LEU A 60 1.870 -7.597 -15.756 1.00 74.33 C ATOM 959 O LEU A 60 2.366 -7.634 -16.882 1.00 25.41 O ATOM 960 CB LEU A 60 0.670 -5.403 -15.713 1.00 3.45 C ATOM 961 CG LEU A 60 0.725 -5.384 -17.241 1.00 23.35 C ATOM 962 CD1 LEU A 60 -0.431 -4.574 -17.807 1.00 23.34 C ATOM 963 CD2 LEU A 60 2.057 -4.824 -17.720 1.00 35.04 C ATOM 0 H LEU A 60 2.940 -4.579 -15.176 1.00 31.23 H new ATOM 0 HA LEU A 60 1.382 -6.485 -13.997 1.00 62.14 H new ATOM 0 HB2 LEU A 60 -0.320 -5.744 -15.409 1.00 3.45 H new ATOM 0 HB3 LEU A 60 0.779 -4.380 -15.353 1.00 3.45 H new ATOM 0 HG LEU A 60 0.634 -6.409 -17.601 1.00 23.35 H new ATOM 0 HD11 LEU A 60 -0.375 -4.572 -18.896 1.00 23.34 H new ATOM 0 HD12 LEU A 60 -1.375 -5.019 -17.493 1.00 23.34 H new ATOM 0 HD13 LEU A 60 -0.372 -3.550 -17.439 1.00 23.34 H new ATOM 0 HD21 LEU A 60 2.078 -4.818 -18.810 1.00 35.04 H new ATOM 0 HD22 LEU A 60 2.178 -3.806 -17.349 1.00 35.04 H new ATOM 0 HD23 LEU A 60 2.869 -5.446 -17.345 1.00 35.04 H new ATOM 975 N SER A 61 1.439 -8.681 -15.119 1.00 74.54 N ATOM 976 CA SER A 61 1.530 -10.007 -15.719 1.00 64.51 C ATOM 977 C SER A 61 0.148 -10.527 -16.104 1.00 3.51 C ATOM 978 O SER A 61 -0.850 -10.197 -15.464 1.00 62.10 O ATOM 979 CB SER A 61 2.203 -10.983 -14.751 1.00 13.20 C ATOM 980 OG SER A 61 1.714 -10.811 -13.432 1.00 51.51 O ATOM 0 H SER A 61 1.023 -8.667 -14.188 1.00 74.54 H new ATOM 0 HA SER A 61 2.134 -9.928 -16.623 1.00 64.51 H new ATOM 0 HB2 SER A 61 2.023 -12.007 -15.078 1.00 13.20 H new ATOM 0 HB3 SER A 61 3.282 -10.829 -14.765 1.00 13.20 H new ATOM 0 HG SER A 61 1.736 -11.670 -12.960 1.00 51.51 H new ATOM 986 N GLU A 62 0.100 -11.340 -17.154 1.00 71.30 N ATOM 987 CA GLU A 62 -1.160 -11.904 -17.625 1.00 24.41 C ATOM 988 C GLU A 62 -1.681 -12.958 -16.652 1.00 54.10 C ATOM 989 O GLU A 62 -2.882 -13.034 -16.386 1.00 43.22 O ATOM 990 CB GLU A 62 -0.980 -12.521 -19.014 1.00 32.23 C ATOM 991 CG GLU A 62 -0.593 -11.513 -20.082 1.00 54.42 C ATOM 992 CD GLU A 62 -1.506 -10.301 -20.099 1.00 24.42 C ATOM 993 OE1 GLU A 62 -2.563 -10.363 -20.760 1.00 32.43 O ATOM 994 OE2 GLU A 62 -1.161 -9.291 -19.450 1.00 32.30 O ATOM 0 H GLU A 62 0.918 -11.623 -17.694 1.00 71.30 H new ATOM 0 HA GLU A 62 -1.890 -11.097 -17.685 1.00 24.41 H new ATOM 0 HB2 GLU A 62 -0.214 -13.295 -18.962 1.00 32.23 H new ATOM 0 HB3 GLU A 62 -1.908 -13.011 -19.308 1.00 32.23 H new ATOM 0 HG2 GLU A 62 0.434 -11.188 -19.914 1.00 54.42 H new ATOM 0 HG3 GLU A 62 -0.619 -11.996 -21.059 1.00 54.42 H new ATOM 1001 N LEU A 63 -0.772 -13.769 -16.124 1.00 64.43 N ATOM 1002 CA LEU A 63 -1.138 -14.820 -15.181 1.00 15.21 C ATOM 1003 C LEU A 63 -1.179 -14.281 -13.755 1.00 1.25 C ATOM 1004 O LEU A 63 -1.110 -13.071 -13.535 1.00 30.15 O ATOM 1005 CB LEU A 63 -0.148 -15.982 -15.271 1.00 73.31 C ATOM 1006 CG LEU A 63 0.124 -16.524 -16.675 1.00 22.44 C ATOM 1007 CD1 LEU A 63 1.620 -16.662 -16.913 1.00 30.14 C ATOM 1008 CD2 LEU A 63 -0.575 -17.861 -16.875 1.00 62.11 C ATOM 0 H LEU A 63 0.225 -13.719 -16.333 1.00 64.43 H new ATOM 0 HA LEU A 63 -2.133 -15.179 -15.443 1.00 15.21 H new ATOM 0 HB2 LEU A 63 0.799 -15.661 -14.837 1.00 73.31 H new ATOM 0 HB3 LEU A 63 -0.520 -16.799 -14.653 1.00 73.31 H new ATOM 0 HG LEU A 63 -0.275 -15.816 -17.401 1.00 22.44 H new ATOM 0 HD11 LEU A 63 1.795 -17.049 -17.917 1.00 30.14 H new ATOM 0 HD12 LEU A 63 2.096 -15.687 -16.812 1.00 30.14 H new ATOM 0 HD13 LEU A 63 2.043 -17.350 -16.181 1.00 30.14 H new ATOM 0 HD21 LEU A 63 -0.371 -18.232 -17.879 1.00 62.11 H new ATOM 0 HD22 LEU A 63 -0.206 -18.578 -16.141 1.00 62.11 H new ATOM 0 HD23 LEU A 63 -1.650 -17.732 -16.748 1.00 62.11 H new ATOM 1020 N HIS A 64 -1.289 -15.187 -12.788 1.00 0.31 N ATOM 1021 CA HIS A 64 -1.335 -14.802 -11.382 1.00 35.34 C ATOM 1022 C HIS A 64 -2.574 -13.960 -11.089 1.00 64.03 C ATOM 1023 O HIS A 64 -2.497 -12.747 -10.895 1.00 50.43 O ATOM 1024 CB HIS A 64 -0.075 -14.026 -11.001 1.00 45.34 C ATOM 1025 CG HIS A 64 1.194 -14.698 -11.428 1.00 2.24 C ATOM 1026 ND1 HIS A 64 2.064 -14.151 -12.347 1.00 54.55 N ATOM 1027 CD2 HIS A 64 1.740 -15.879 -11.053 1.00 13.41 C ATOM 1028 CE1 HIS A 64 3.088 -14.966 -12.521 1.00 70.35 C ATOM 1029 NE2 HIS A 64 2.916 -16.022 -11.747 1.00 31.30 N ATOM 0 H HIS A 64 -1.348 -16.192 -12.952 1.00 0.31 H new ATOM 0 HA HIS A 64 -1.386 -15.712 -10.784 1.00 35.34 H new ATOM 0 HB2 HIS A 64 -0.120 -13.034 -11.450 1.00 45.34 H new ATOM 0 HB3 HIS A 64 -0.057 -13.887 -9.920 1.00 45.34 H new ATOM 0 HD2 HIS A 64 1.327 -16.578 -10.341 1.00 13.41 H new ATOM 0 HE1 HIS A 64 3.924 -14.798 -13.184 1.00 70.35 H new ATOM 0 HE2 HIS A 64 3.553 -16.815 -11.676 1.00 31.30 H new ATOM 1037 N PRO A 65 -3.743 -14.617 -11.057 1.00 43.44 N ATOM 1038 CA PRO A 65 -5.019 -13.948 -10.790 1.00 13.42 C ATOM 1039 C PRO A 65 -5.134 -13.474 -9.345 1.00 21.01 C ATOM 1040 O PRO A 65 -5.794 -12.475 -9.061 1.00 5.04 O ATOM 1041 CB PRO A 65 -6.057 -15.035 -11.080 1.00 52.31 C ATOM 1042 CG PRO A 65 -5.331 -16.318 -10.866 1.00 75.03 C ATOM 1043 CD PRO A 65 -3.908 -16.063 -11.280 1.00 14.14 C ATOM 0 HA PRO A 65 -5.142 -13.049 -11.395 1.00 13.42 H new ATOM 0 HB2 PRO A 65 -6.916 -14.950 -10.414 1.00 52.31 H new ATOM 0 HB3 PRO A 65 -6.435 -14.959 -12.099 1.00 52.31 H new ATOM 0 HG2 PRO A 65 -5.384 -16.627 -9.822 1.00 75.03 H new ATOM 0 HG3 PRO A 65 -5.772 -17.119 -11.459 1.00 75.03 H new ATOM 0 HD2 PRO A 65 -3.205 -16.645 -10.683 1.00 14.14 H new ATOM 0 HD3 PRO A 65 -3.739 -16.331 -12.323 1.00 14.14 H new ATOM 1051 N GLU A 66 -4.487 -14.198 -8.437 1.00 0.25 N ATOM 1052 CA GLU A 66 -4.518 -13.850 -7.021 1.00 23.33 C ATOM 1053 C GLU A 66 -4.022 -12.424 -6.800 1.00 30.03 C ATOM 1054 O GLU A 66 -4.420 -11.760 -5.843 1.00 44.44 O ATOM 1055 CB GLU A 66 -3.663 -14.830 -6.214 1.00 0.33 C ATOM 1056 CG GLU A 66 -4.447 -15.601 -5.165 1.00 50.03 C ATOM 1057 CD GLU A 66 -4.916 -14.721 -4.023 1.00 52.31 C ATOM 1058 OE1 GLU A 66 -4.229 -13.722 -3.724 1.00 24.03 O ATOM 1059 OE2 GLU A 66 -5.970 -15.030 -3.429 1.00 22.31 O ATOM 0 H GLU A 66 -3.936 -15.028 -8.656 1.00 0.25 H new ATOM 0 HA GLU A 66 -5.551 -13.914 -6.680 1.00 23.33 H new ATOM 0 HB2 GLU A 66 -3.194 -15.538 -6.897 1.00 0.33 H new ATOM 0 HB3 GLU A 66 -2.860 -14.280 -5.724 1.00 0.33 H new ATOM 0 HG2 GLU A 66 -5.311 -16.071 -5.635 1.00 50.03 H new ATOM 0 HG3 GLU A 66 -3.825 -16.403 -4.769 1.00 50.03 H new ATOM 1066 N GLU A 67 -3.151 -11.962 -7.691 1.00 50.43 N ATOM 1067 CA GLU A 67 -2.600 -10.615 -7.593 1.00 20.24 C ATOM 1068 C GLU A 67 -3.644 -9.570 -7.976 1.00 33.54 C ATOM 1069 O GLU A 67 -3.756 -8.525 -7.335 1.00 35.55 O ATOM 1070 CB GLU A 67 -1.370 -10.476 -8.492 1.00 70.32 C ATOM 1071 CG GLU A 67 -0.269 -11.474 -8.175 1.00 44.05 C ATOM 1072 CD GLU A 67 0.468 -11.142 -6.892 1.00 42.24 C ATOM 1073 OE1 GLU A 67 1.286 -10.198 -6.904 1.00 72.23 O ATOM 1074 OE2 GLU A 67 0.226 -11.826 -5.876 1.00 63.20 O ATOM 0 H GLU A 67 -2.812 -12.500 -8.488 1.00 50.43 H new ATOM 0 HA GLU A 67 -2.305 -10.446 -6.557 1.00 20.24 H new ATOM 0 HB2 GLU A 67 -1.674 -10.601 -9.531 1.00 70.32 H new ATOM 0 HB3 GLU A 67 -0.972 -9.466 -8.396 1.00 70.32 H new ATOM 0 HG2 GLU A 67 -0.701 -12.472 -8.094 1.00 44.05 H new ATOM 0 HG3 GLU A 67 0.441 -11.500 -9.001 1.00 44.05 H new ATOM 1081 N ARG A 68 -4.406 -9.861 -9.025 1.00 42.14 N ATOM 1082 CA ARG A 68 -5.440 -8.947 -9.496 1.00 4.24 C ATOM 1083 C ARG A 68 -6.419 -8.611 -8.375 1.00 35.51 C ATOM 1084 O ARG A 68 -6.671 -7.442 -8.084 1.00 42.22 O ATOM 1085 CB ARG A 68 -6.192 -9.559 -10.679 1.00 4.41 C ATOM 1086 CG ARG A 68 -5.921 -8.858 -12.000 1.00 71.14 C ATOM 1087 CD ARG A 68 -5.578 -9.853 -13.098 1.00 44.31 C ATOM 1088 NE ARG A 68 -6.500 -10.985 -13.119 1.00 42.01 N ATOM 1089 CZ ARG A 68 -6.318 -12.067 -13.867 1.00 64.42 C ATOM 1090 NH1 ARG A 68 -5.253 -12.164 -14.651 1.00 63.10 N ATOM 1091 NH2 ARG A 68 -7.202 -13.056 -13.832 1.00 24.43 N ATOM 0 H ARG A 68 -4.327 -10.723 -9.565 1.00 42.14 H new ATOM 0 HA ARG A 68 -4.956 -8.026 -9.821 1.00 4.24 H new ATOM 0 HB2 ARG A 68 -5.915 -10.609 -10.771 1.00 4.41 H new ATOM 0 HB3 ARG A 68 -7.262 -9.528 -10.474 1.00 4.41 H new ATOM 0 HG2 ARG A 68 -6.797 -8.279 -12.293 1.00 71.14 H new ATOM 0 HG3 ARG A 68 -5.099 -8.152 -11.877 1.00 71.14 H new ATOM 0 HD2 ARG A 68 -5.601 -9.349 -14.064 1.00 44.31 H new ATOM 0 HD3 ARG A 68 -4.561 -10.217 -12.953 1.00 44.31 H new ATOM 0 HE ARG A 68 -7.329 -10.942 -12.527 1.00 42.01 H new ATOM 0 HH11 ARG A 68 -4.571 -11.406 -14.681 1.00 63.10 H new ATOM 0 HH12 ARG A 68 -5.116 -12.996 -15.224 1.00 63.10 H new ATOM 0 HH21 ARG A 68 -8.022 -12.986 -13.230 1.00 24.43 H new ATOM 0 HH22 ARG A 68 -7.061 -13.887 -14.407 1.00 24.43 H new ATOM 1105 N LYS A 69 -6.971 -9.646 -7.749 1.00 42.20 N ATOM 1106 CA LYS A 69 -7.923 -9.463 -6.660 1.00 3.22 C ATOM 1107 C LYS A 69 -7.258 -8.790 -5.463 1.00 44.03 C ATOM 1108 O LYS A 69 -7.865 -7.959 -4.788 1.00 51.42 O ATOM 1109 CB LYS A 69 -8.512 -10.811 -6.238 1.00 42.20 C ATOM 1110 CG LYS A 69 -7.463 -11.834 -5.837 1.00 34.00 C ATOM 1111 CD LYS A 69 -8.004 -13.251 -5.927 1.00 71.24 C ATOM 1112 CE LYS A 69 -8.153 -13.700 -7.373 1.00 52.42 C ATOM 1113 NZ LYS A 69 -9.348 -14.567 -7.564 1.00 74.23 N ATOM 0 H LYS A 69 -6.775 -10.620 -7.978 1.00 42.20 H new ATOM 0 HA LYS A 69 -8.726 -8.818 -7.017 1.00 3.22 H new ATOM 0 HB2 LYS A 69 -9.193 -10.655 -5.402 1.00 42.20 H new ATOM 0 HB3 LYS A 69 -9.104 -11.213 -7.060 1.00 42.20 H new ATOM 0 HG2 LYS A 69 -6.591 -11.735 -6.483 1.00 34.00 H new ATOM 0 HG3 LYS A 69 -7.130 -11.635 -4.819 1.00 34.00 H new ATOM 0 HD2 LYS A 69 -7.334 -13.931 -5.401 1.00 71.24 H new ATOM 0 HD3 LYS A 69 -8.971 -13.305 -5.427 1.00 71.24 H new ATOM 0 HE2 LYS A 69 -8.232 -12.825 -8.019 1.00 52.42 H new ATOM 0 HE3 LYS A 69 -7.258 -14.242 -7.679 1.00 52.42 H new ATOM 0 HZ1 LYS A 69 -9.414 -14.852 -8.562 1.00 74.23 H new ATOM 0 HZ2 LYS A 69 -9.261 -15.414 -6.967 1.00 74.23 H new ATOM 0 HZ3 LYS A 69 -10.205 -14.041 -7.296 1.00 74.23 H new ATOM 1127 N LYS A 70 -6.006 -9.153 -5.206 1.00 64.54 N ATOM 1128 CA LYS A 70 -5.256 -8.584 -4.093 1.00 50.51 C ATOM 1129 C LYS A 70 -5.205 -7.062 -4.194 1.00 21.42 C ATOM 1130 O LYS A 70 -5.558 -6.356 -3.250 1.00 14.52 O ATOM 1131 CB LYS A 70 -3.835 -9.151 -4.064 1.00 72.43 C ATOM 1132 CG LYS A 70 -3.080 -8.836 -2.785 1.00 1.31 C ATOM 1133 CD LYS A 70 -3.094 -10.013 -1.824 1.00 14.31 C ATOM 1134 CE LYS A 70 -4.400 -10.081 -1.046 1.00 62.33 C ATOM 1135 NZ LYS A 70 -4.361 -11.128 0.012 1.00 5.12 N ATOM 0 H LYS A 70 -5.489 -9.840 -5.755 1.00 64.54 H new ATOM 0 HA LYS A 70 -5.766 -8.854 -3.168 1.00 50.51 H new ATOM 0 HB2 LYS A 70 -3.882 -10.233 -4.191 1.00 72.43 H new ATOM 0 HB3 LYS A 70 -3.277 -8.754 -4.912 1.00 72.43 H new ATOM 0 HG2 LYS A 70 -2.050 -8.574 -3.025 1.00 1.31 H new ATOM 0 HG3 LYS A 70 -3.526 -7.966 -2.303 1.00 1.31 H new ATOM 0 HD2 LYS A 70 -2.951 -10.940 -2.380 1.00 14.31 H new ATOM 0 HD3 LYS A 70 -2.259 -9.927 -1.129 1.00 14.31 H new ATOM 0 HE2 LYS A 70 -4.602 -9.112 -0.590 1.00 62.33 H new ATOM 0 HE3 LYS A 70 -5.221 -10.288 -1.732 1.00 62.33 H new ATOM 0 HZ1 LYS A 70 -5.269 -11.143 0.519 1.00 5.12 H new ATOM 0 HZ2 LYS A 70 -4.193 -12.057 -0.425 1.00 5.12 H new ATOM 0 HZ3 LYS A 70 -3.594 -10.917 0.681 1.00 5.12 H new ATOM 1149 N VAL A 71 -4.764 -6.564 -5.345 1.00 21.33 N ATOM 1150 CA VAL A 71 -4.669 -5.127 -5.569 1.00 53.14 C ATOM 1151 C VAL A 71 -6.052 -4.490 -5.645 1.00 75.20 C ATOM 1152 O VAL A 71 -6.240 -3.339 -5.250 1.00 63.30 O ATOM 1153 CB VAL A 71 -3.899 -4.811 -6.865 1.00 52.13 C ATOM 1154 CG1 VAL A 71 -2.462 -5.299 -6.765 1.00 40.20 C ATOM 1155 CG2 VAL A 71 -4.599 -5.431 -8.065 1.00 60.21 C ATOM 0 H VAL A 71 -4.467 -7.135 -6.136 1.00 21.33 H new ATOM 0 HA VAL A 71 -4.126 -4.710 -4.721 1.00 53.14 H new ATOM 0 HB VAL A 71 -3.881 -3.730 -7.002 1.00 52.13 H new ATOM 0 HG11 VAL A 71 -1.934 -5.067 -7.690 1.00 40.20 H new ATOM 0 HG12 VAL A 71 -1.967 -4.803 -5.930 1.00 40.20 H new ATOM 0 HG13 VAL A 71 -2.454 -6.377 -6.603 1.00 40.20 H new ATOM 0 HG21 VAL A 71 -4.041 -5.198 -8.972 1.00 60.21 H new ATOM 0 HG22 VAL A 71 -4.649 -6.512 -7.938 1.00 60.21 H new ATOM 0 HG23 VAL A 71 -5.608 -5.028 -8.146 1.00 60.21 H new ATOM 1165 N ARG A 72 -7.019 -5.247 -6.155 1.00 1.23 N ATOM 1166 CA ARG A 72 -8.386 -4.756 -6.283 1.00 21.31 C ATOM 1167 C ARG A 72 -8.940 -4.329 -4.927 1.00 5.32 C ATOM 1168 O ARG A 72 -9.416 -3.206 -4.767 1.00 1.50 O ATOM 1169 CB ARG A 72 -9.282 -5.835 -6.895 1.00 10.34 C ATOM 1170 CG ARG A 72 -9.892 -5.435 -8.228 1.00 62.44 C ATOM 1171 CD ARG A 72 -9.146 -6.068 -9.393 1.00 52.33 C ATOM 1172 NE ARG A 72 -9.491 -7.477 -9.564 1.00 12.51 N ATOM 1173 CZ ARG A 72 -10.664 -7.895 -10.026 1.00 60.23 C ATOM 1174 NH1 ARG A 72 -11.599 -7.018 -10.363 1.00 11.30 N ATOM 1175 NH2 ARG A 72 -10.903 -9.194 -10.153 1.00 60.23 N ATOM 0 H ARG A 72 -6.881 -6.202 -6.486 1.00 1.23 H new ATOM 0 HA ARG A 72 -8.373 -3.887 -6.941 1.00 21.31 H new ATOM 0 HB2 ARG A 72 -8.699 -6.746 -7.031 1.00 10.34 H new ATOM 0 HB3 ARG A 72 -10.083 -6.071 -6.194 1.00 10.34 H new ATOM 0 HG2 ARG A 72 -10.939 -5.738 -8.256 1.00 62.44 H new ATOM 0 HG3 ARG A 72 -9.872 -4.350 -8.328 1.00 62.44 H new ATOM 0 HD2 ARG A 72 -9.377 -5.525 -10.309 1.00 52.33 H new ATOM 0 HD3 ARG A 72 -8.072 -5.975 -9.229 1.00 52.33 H new ATOM 0 HE ARG A 72 -8.793 -8.178 -9.315 1.00 12.51 H new ATOM 0 HH11 ARG A 72 -11.419 -6.019 -10.268 1.00 11.30 H new ATOM 0 HH12 ARG A 72 -12.499 -7.343 -10.717 1.00 11.30 H new ATOM 0 HH21 ARG A 72 -10.186 -9.872 -9.896 1.00 60.23 H new ATOM 0 HH22 ARG A 72 -11.804 -9.514 -10.508 1.00 60.23 H new ATOM 1189 N GLU A 73 -8.873 -5.233 -3.954 1.00 52.25 N ATOM 1190 CA GLU A 73 -9.369 -4.949 -2.613 1.00 53.30 C ATOM 1191 C GLU A 73 -8.466 -3.947 -1.900 1.00 23.25 C ATOM 1192 O GLU A 73 -8.934 -3.112 -1.126 1.00 12.12 O ATOM 1193 CB GLU A 73 -9.464 -6.239 -1.796 1.00 63.12 C ATOM 1194 CG GLU A 73 -8.151 -6.998 -1.703 1.00 5.34 C ATOM 1195 CD GLU A 73 -7.262 -6.490 -0.583 1.00 71.25 C ATOM 1196 OE1 GLU A 73 -7.752 -5.704 0.253 1.00 11.35 O ATOM 1197 OE2 GLU A 73 -6.076 -6.880 -0.545 1.00 33.41 O ATOM 0 H GLU A 73 -8.480 -6.167 -4.070 1.00 52.25 H new ATOM 0 HA GLU A 73 -10.364 -4.513 -2.706 1.00 53.30 H new ATOM 0 HB2 GLU A 73 -9.807 -5.998 -0.790 1.00 63.12 H new ATOM 0 HB3 GLU A 73 -10.218 -6.887 -2.242 1.00 63.12 H new ATOM 0 HG2 GLU A 73 -8.358 -8.057 -1.546 1.00 5.34 H new ATOM 0 HG3 GLU A 73 -7.619 -6.914 -2.651 1.00 5.34 H new ATOM 1204 N LYS A 74 -7.167 -4.038 -2.165 1.00 1.51 N ATOM 1205 CA LYS A 74 -6.196 -3.140 -1.550 1.00 64.43 C ATOM 1206 C LYS A 74 -6.463 -1.693 -1.950 1.00 41.11 C ATOM 1207 O LYS A 74 -6.582 -0.814 -1.096 1.00 35.42 O ATOM 1208 CB LYS A 74 -4.775 -3.539 -1.956 1.00 3.42 C ATOM 1209 CG LYS A 74 -3.743 -3.305 -0.866 1.00 31.33 C ATOM 1210 CD LYS A 74 -3.764 -1.867 -0.377 1.00 41.31 C ATOM 1211 CE LYS A 74 -3.414 -0.894 -1.493 1.00 2.02 C ATOM 1212 NZ LYS A 74 -2.460 0.154 -1.036 1.00 12.54 N ATOM 0 H LYS A 74 -6.762 -4.725 -2.802 1.00 1.51 H new ATOM 0 HA LYS A 74 -6.296 -3.223 -0.468 1.00 64.43 H new ATOM 0 HB2 LYS A 74 -4.767 -4.594 -2.232 1.00 3.42 H new ATOM 0 HB3 LYS A 74 -4.488 -2.975 -2.844 1.00 3.42 H new ATOM 0 HG2 LYS A 74 -3.937 -3.977 -0.030 1.00 31.33 H new ATOM 0 HG3 LYS A 74 -2.750 -3.547 -1.246 1.00 31.33 H new ATOM 0 HD2 LYS A 74 -4.752 -1.630 0.017 1.00 41.31 H new ATOM 0 HD3 LYS A 74 -3.057 -1.750 0.444 1.00 41.31 H new ATOM 0 HE2 LYS A 74 -2.979 -1.442 -2.329 1.00 2.02 H new ATOM 0 HE3 LYS A 74 -4.324 -0.421 -1.861 1.00 2.02 H new ATOM 0 HZ1 LYS A 74 -2.247 0.797 -1.825 1.00 12.54 H new ATOM 0 HZ2 LYS A 74 -2.885 0.693 -0.255 1.00 12.54 H new ATOM 0 HZ3 LYS A 74 -1.581 -0.296 -0.708 1.00 12.54 H new ATOM 1226 N PHE A 75 -6.557 -1.452 -3.254 1.00 1.55 N ATOM 1227 CA PHE A 75 -6.811 -0.110 -3.766 1.00 62.23 C ATOM 1228 C PHE A 75 -8.225 0.346 -3.420 1.00 73.32 C ATOM 1229 O PHE A 75 -8.459 1.522 -3.143 1.00 14.14 O ATOM 1230 CB PHE A 75 -6.608 -0.074 -5.282 1.00 42.05 C ATOM 1231 CG PHE A 75 -7.888 0.068 -6.055 1.00 42.24 C ATOM 1232 CD1 PHE A 75 -8.408 1.322 -6.335 1.00 33.43 C ATOM 1233 CD2 PHE A 75 -8.570 -1.051 -6.503 1.00 72.41 C ATOM 1234 CE1 PHE A 75 -9.586 1.455 -7.045 1.00 13.10 C ATOM 1235 CE2 PHE A 75 -9.749 -0.924 -7.214 1.00 64.13 C ATOM 1236 CZ PHE A 75 -10.257 0.331 -7.486 1.00 64.05 C ATOM 0 H PHE A 75 -6.461 -2.168 -3.975 1.00 1.55 H new ATOM 0 HA PHE A 75 -6.103 0.572 -3.295 1.00 62.23 H new ATOM 0 HB2 PHE A 75 -5.948 0.756 -5.532 1.00 42.05 H new ATOM 0 HB3 PHE A 75 -6.103 -0.988 -5.595 1.00 42.05 H new ATOM 0 HD1 PHE A 75 -7.887 2.205 -5.995 1.00 33.43 H new ATOM 0 HD2 PHE A 75 -8.176 -2.035 -6.294 1.00 72.41 H new ATOM 0 HE1 PHE A 75 -9.982 2.438 -7.255 1.00 13.10 H new ATOM 0 HE2 PHE A 75 -10.272 -1.805 -7.556 1.00 64.13 H new ATOM 0 HZ PHE A 75 -11.177 0.433 -8.042 1.00 64.05 H new ATOM 1246 N ASP A 76 -9.164 -0.594 -3.440 1.00 13.34 N ATOM 1247 CA ASP A 76 -10.556 -0.290 -3.128 1.00 11.04 C ATOM 1248 C ASP A 76 -10.685 0.284 -1.720 1.00 43.11 C ATOM 1249 O ASP A 76 -11.310 1.325 -1.519 1.00 65.03 O ATOM 1250 CB ASP A 76 -11.417 -1.547 -3.259 1.00 63.55 C ATOM 1251 CG ASP A 76 -12.781 -1.385 -2.619 1.00 52.01 C ATOM 1252 OD1 ASP A 76 -13.477 -0.402 -2.948 1.00 73.12 O ATOM 1253 OD2 ASP A 76 -13.153 -2.240 -1.788 1.00 63.30 O ATOM 0 H ASP A 76 -8.987 -1.572 -3.669 1.00 13.34 H new ATOM 0 HA ASP A 76 -10.906 0.457 -3.840 1.00 11.04 H new ATOM 0 HB2 ASP A 76 -11.541 -1.790 -4.314 1.00 63.55 H new ATOM 0 HB3 ASP A 76 -10.900 -2.388 -2.797 1.00 63.55 H new ATOM 1258 N GLU A 77 -10.090 -0.403 -0.750 1.00 10.34 N ATOM 1259 CA GLU A 77 -10.140 0.039 0.639 1.00 34.22 C ATOM 1260 C GLU A 77 -9.334 1.320 0.832 1.00 32.04 C ATOM 1261 O GLU A 77 -9.821 2.291 1.410 1.00 22.34 O ATOM 1262 CB GLU A 77 -9.608 -1.056 1.566 1.00 61.55 C ATOM 1263 CG GLU A 77 -10.436 -2.330 1.541 1.00 61.23 C ATOM 1264 CD GLU A 77 -9.610 -3.569 1.829 1.00 1.32 C ATOM 1265 OE1 GLU A 77 -8.488 -3.424 2.357 1.00 23.43 O ATOM 1266 OE2 GLU A 77 -10.087 -4.683 1.527 1.00 43.33 O ATOM 0 H GLU A 77 -9.568 -1.267 -0.900 1.00 10.34 H new ATOM 0 HA GLU A 77 -11.181 0.244 0.891 1.00 34.22 H new ATOM 0 HB2 GLU A 77 -8.583 -1.294 1.283 1.00 61.55 H new ATOM 0 HB3 GLU A 77 -9.576 -0.673 2.586 1.00 61.55 H new ATOM 0 HG2 GLU A 77 -11.237 -2.253 2.276 1.00 61.23 H new ATOM 0 HG3 GLU A 77 -10.909 -2.432 0.564 1.00 61.23 H new ATOM 1273 N ASN A 78 -8.098 1.313 0.344 1.00 1.44 N ATOM 1274 CA ASN A 78 -7.223 2.474 0.464 1.00 62.10 C ATOM 1275 C ASN A 78 -7.924 3.737 -0.027 1.00 31.12 C ATOM 1276 O ASN A 78 -7.755 4.815 0.543 1.00 25.31 O ATOM 1277 CB ASN A 78 -5.934 2.251 -0.330 1.00 53.15 C ATOM 1278 CG ASN A 78 -4.840 3.228 0.056 1.00 34.44 C ATOM 1279 OD1 ASN A 78 -4.651 3.530 1.235 1.00 54.33 O ATOM 1280 ND2 ASN A 78 -4.114 3.726 -0.937 1.00 62.21 N ATOM 0 H ASN A 78 -7.680 0.517 -0.138 1.00 1.44 H new ATOM 0 HA ASN A 78 -6.975 2.604 1.518 1.00 62.10 H new ATOM 0 HB2 ASN A 78 -5.582 1.232 -0.167 1.00 53.15 H new ATOM 0 HB3 ASN A 78 -6.145 2.348 -1.395 1.00 53.15 H new ATOM 0 HD21 ASN A 78 -3.364 4.388 -0.738 1.00 62.21 H new ATOM 0 HD22 ASN A 78 -4.306 3.447 -1.899 1.00 62.21 H new ATOM 1287 N SER A 79 -8.713 3.595 -1.087 1.00 42.23 N ATOM 1288 CA SER A 79 -9.438 4.725 -1.657 1.00 63.22 C ATOM 1289 C SER A 79 -10.639 5.092 -0.791 1.00 41.12 C ATOM 1290 O SER A 79 -10.918 6.270 -0.566 1.00 34.34 O ATOM 1291 CB SER A 79 -9.900 4.397 -3.078 1.00 74.41 C ATOM 1292 OG SER A 79 -10.985 3.484 -3.063 1.00 43.44 O ATOM 0 H SER A 79 -8.867 2.709 -1.569 1.00 42.23 H new ATOM 0 HA SER A 79 -8.762 5.579 -1.691 1.00 63.22 H new ATOM 0 HB2 SER A 79 -10.198 5.313 -3.587 1.00 74.41 H new ATOM 0 HB3 SER A 79 -9.071 3.973 -3.645 1.00 74.41 H new ATOM 0 HG SER A 79 -10.785 2.749 -2.447 1.00 43.44 H new ATOM 1298 N ARG A 80 -11.346 4.075 -0.309 1.00 3.21 N ATOM 1299 CA ARG A 80 -12.518 4.290 0.531 1.00 24.23 C ATOM 1300 C ARG A 80 -12.112 4.802 1.910 1.00 23.12 C ATOM 1301 O ARG A 80 -12.957 5.218 2.702 1.00 22.32 O ATOM 1302 CB ARG A 80 -13.315 2.992 0.672 1.00 53.01 C ATOM 1303 CG ARG A 80 -12.938 2.175 1.897 1.00 52.10 C ATOM 1304 CD ARG A 80 -13.841 2.494 3.078 1.00 30.45 C ATOM 1305 NE ARG A 80 -14.178 1.299 3.847 1.00 31.44 N ATOM 1306 CZ ARG A 80 -15.144 1.259 4.759 1.00 41.34 C ATOM 1307 NH1 ARG A 80 -15.865 2.343 5.013 1.00 65.21 N ATOM 1308 NH2 ARG A 80 -15.391 0.134 5.417 1.00 1.12 N ATOM 0 H ARG A 80 -11.128 3.094 -0.486 1.00 3.21 H new ATOM 0 HA ARG A 80 -13.144 5.043 0.052 1.00 24.23 H new ATOM 0 HB2 ARG A 80 -14.377 3.231 0.718 1.00 53.01 H new ATOM 0 HB3 ARG A 80 -13.164 2.384 -0.220 1.00 53.01 H new ATOM 0 HG2 ARG A 80 -13.006 1.113 1.662 1.00 52.10 H new ATOM 0 HG3 ARG A 80 -11.901 2.377 2.165 1.00 52.10 H new ATOM 0 HD2 ARG A 80 -13.347 3.216 3.728 1.00 30.45 H new ATOM 0 HD3 ARG A 80 -14.756 2.964 2.718 1.00 30.45 H new ATOM 0 HE ARG A 80 -13.642 0.448 3.675 1.00 31.44 H new ATOM 0 HH11 ARG A 80 -15.679 3.209 4.508 1.00 65.21 H new ATOM 0 HH12 ARG A 80 -16.606 2.310 5.713 1.00 65.21 H new ATOM 0 HH21 ARG A 80 -14.839 -0.702 5.223 1.00 1.12 H new ATOM 0 HH22 ARG A 80 -16.133 0.105 6.117 1.00 1.12 H new ATOM 1322 N MET A 81 -10.813 4.768 2.190 1.00 62.34 N ATOM 1323 CA MET A 81 -10.295 5.229 3.473 1.00 71.05 C ATOM 1324 C MET A 81 -10.968 6.531 3.894 1.00 54.20 C ATOM 1325 O MET A 81 -11.445 7.293 3.054 1.00 52.34 O ATOM 1326 CB MET A 81 -8.780 5.427 3.394 1.00 71.30 C ATOM 1327 CG MET A 81 -7.999 4.124 3.334 1.00 34.22 C ATOM 1328 SD MET A 81 -8.153 3.152 4.845 1.00 1.23 S ATOM 1329 CE MET A 81 -7.517 4.308 6.057 1.00 61.21 C ATOM 0 H MET A 81 -10.100 4.426 1.546 1.00 62.34 H new ATOM 0 HA MET A 81 -10.516 4.468 4.221 1.00 71.05 H new ATOM 0 HB2 MET A 81 -8.545 6.023 2.512 1.00 71.30 H new ATOM 0 HB3 MET A 81 -8.451 5.999 4.262 1.00 71.30 H new ATOM 0 HG2 MET A 81 -8.351 3.533 2.489 1.00 34.22 H new ATOM 0 HG3 MET A 81 -6.947 4.344 3.153 1.00 34.22 H new ATOM 0 HE1 MET A 81 -7.214 3.766 6.953 1.00 61.21 H new ATOM 0 HE2 MET A 81 -6.657 4.834 5.642 1.00 61.21 H new ATOM 0 HE3 MET A 81 -8.293 5.029 6.315 1.00 61.21 H new ATOM 1339 N GLN A 82 -11.004 6.779 5.199 1.00 25.44 N ATOM 1340 CA GLN A 82 -11.620 7.988 5.731 1.00 42.52 C ATOM 1341 C GLN A 82 -10.897 9.234 5.227 1.00 34.31 C ATOM 1342 O GLN A 82 -9.739 9.167 4.815 1.00 51.42 O ATOM 1343 CB GLN A 82 -11.609 7.962 7.260 1.00 14.02 C ATOM 1344 CG GLN A 82 -12.446 6.841 7.855 1.00 62.30 C ATOM 1345 CD GLN A 82 -12.149 6.607 9.323 1.00 15.22 C ATOM 1346 OE1 GLN A 82 -12.269 7.517 10.145 1.00 73.52 O ATOM 1347 NE2 GLN A 82 -11.760 5.384 9.662 1.00 70.44 N ATOM 0 H GLN A 82 -10.613 6.158 5.908 1.00 25.44 H new ATOM 0 HA GLN A 82 -12.652 8.022 5.383 1.00 42.52 H new ATOM 0 HB2 GLN A 82 -10.580 7.859 7.606 1.00 14.02 H new ATOM 0 HB3 GLN A 82 -11.977 8.917 7.634 1.00 14.02 H new ATOM 0 HG2 GLN A 82 -13.503 7.079 7.736 1.00 62.30 H new ATOM 0 HG3 GLN A 82 -12.262 5.921 7.300 1.00 62.30 H new ATOM 0 HE21 GLN A 82 -11.674 4.660 8.949 1.00 70.44 H new ATOM 0 HE22 GLN A 82 -11.547 5.168 10.636 1.00 70.44 H new ATOM 1356 N TYR A 83 -11.589 10.367 5.263 1.00 44.42 N ATOM 1357 CA TYR A 83 -11.014 11.628 4.807 1.00 22.42 C ATOM 1358 C TYR A 83 -9.833 12.036 5.683 1.00 61.25 C ATOM 1359 O TYR A 83 -8.860 12.616 5.201 1.00 52.41 O ATOM 1360 CB TYR A 83 -12.075 12.729 4.817 1.00 41.32 C ATOM 1361 CG TYR A 83 -12.094 13.562 3.555 1.00 11.52 C ATOM 1362 CD1 TYR A 83 -11.094 14.493 3.299 1.00 73.35 C ATOM 1363 CD2 TYR A 83 -13.112 13.420 2.621 1.00 52.55 C ATOM 1364 CE1 TYR A 83 -11.108 15.257 2.148 1.00 61.24 C ATOM 1365 CE2 TYR A 83 -13.133 14.179 1.466 1.00 11.13 C ATOM 1366 CZ TYR A 83 -12.129 15.096 1.234 1.00 31.04 C ATOM 1367 OH TYR A 83 -12.147 15.855 0.087 1.00 71.45 O ATOM 0 H TYR A 83 -12.548 10.439 5.603 1.00 44.42 H new ATOM 0 HA TYR A 83 -10.655 11.487 3.787 1.00 22.42 H new ATOM 0 HB2 TYR A 83 -13.056 12.275 4.958 1.00 41.32 H new ATOM 0 HB3 TYR A 83 -11.900 13.383 5.671 1.00 41.32 H new ATOM 0 HD1 TYR A 83 -10.293 14.621 4.012 1.00 73.35 H new ATOM 0 HD2 TYR A 83 -13.901 12.704 2.800 1.00 52.55 H new ATOM 0 HE1 TYR A 83 -10.324 15.977 1.965 1.00 61.24 H new ATOM 0 HE2 TYR A 83 -13.931 14.055 0.749 1.00 11.13 H new ATOM 0 HH TYR A 83 -12.932 15.618 -0.450 1.00 71.45 H new ATOM 1377 N SER A 84 -9.926 11.727 6.972 1.00 61.10 N ATOM 1378 CA SER A 84 -8.868 12.064 7.917 1.00 65.40 C ATOM 1379 C SER A 84 -7.529 11.492 7.460 1.00 70.40 C ATOM 1380 O SER A 84 -6.531 12.207 7.382 1.00 50.13 O ATOM 1381 CB SER A 84 -9.212 11.535 9.311 1.00 61.24 C ATOM 1382 OG SER A 84 -10.596 11.675 9.582 1.00 62.45 O ATOM 0 H SER A 84 -10.723 11.244 7.386 1.00 61.10 H new ATOM 0 HA SER A 84 -8.785 13.150 7.959 1.00 65.40 H new ATOM 0 HB2 SER A 84 -8.928 10.485 9.385 1.00 61.24 H new ATOM 0 HB3 SER A 84 -8.635 12.075 10.061 1.00 61.24 H new ATOM 0 HG SER A 84 -10.791 11.328 10.478 1.00 62.45 H new ATOM 1388 N GLU A 85 -7.518 10.197 7.160 1.00 65.43 N ATOM 1389 CA GLU A 85 -6.302 9.528 6.711 1.00 22.24 C ATOM 1390 C GLU A 85 -5.943 9.948 5.289 1.00 62.31 C ATOM 1391 O GLU A 85 -4.767 10.068 4.943 1.00 43.10 O ATOM 1392 CB GLU A 85 -6.474 8.009 6.778 1.00 34.13 C ATOM 1393 CG GLU A 85 -5.232 7.276 7.254 1.00 64.51 C ATOM 1394 CD GLU A 85 -5.539 6.228 8.306 1.00 32.02 C ATOM 1395 OE1 GLU A 85 -6.299 6.539 9.247 1.00 32.23 O ATOM 1396 OE2 GLU A 85 -5.020 5.098 8.189 1.00 14.32 O ATOM 0 H GLU A 85 -8.336 9.591 7.220 1.00 65.43 H new ATOM 0 HA GLU A 85 -5.490 9.824 7.375 1.00 22.24 H new ATOM 0 HB2 GLU A 85 -7.302 7.775 7.447 1.00 34.13 H new ATOM 0 HB3 GLU A 85 -6.748 7.639 5.790 1.00 34.13 H new ATOM 0 HG2 GLU A 85 -4.748 6.799 6.402 1.00 64.51 H new ATOM 0 HG3 GLU A 85 -4.523 7.997 7.661 1.00 64.51 H new ATOM 1403 N LEU A 86 -6.964 10.169 4.468 1.00 22.33 N ATOM 1404 CA LEU A 86 -6.758 10.575 3.082 1.00 25.14 C ATOM 1405 C LEU A 86 -6.078 11.939 3.010 1.00 72.40 C ATOM 1406 O LEU A 86 -5.204 12.164 2.174 1.00 24.40 O ATOM 1407 CB LEU A 86 -8.094 10.618 2.339 1.00 65.34 C ATOM 1408 CG LEU A 86 -8.092 10.041 0.922 1.00 0.43 C ATOM 1409 CD1 LEU A 86 -7.207 10.874 0.008 1.00 3.11 C ATOM 1410 CD2 LEU A 86 -7.632 8.591 0.937 1.00 23.02 C ATOM 0 H LEU A 86 -7.943 10.074 4.738 1.00 22.33 H new ATOM 0 HA LEU A 86 -6.108 9.840 2.606 1.00 25.14 H new ATOM 0 HB2 LEU A 86 -8.833 10.077 2.929 1.00 65.34 H new ATOM 0 HB3 LEU A 86 -8.425 11.655 2.287 1.00 65.34 H new ATOM 0 HG LEU A 86 -9.111 10.074 0.536 1.00 0.43 H new ATOM 0 HD11 LEU A 86 -7.218 10.449 -0.996 1.00 3.11 H new ATOM 0 HD12 LEU A 86 -7.581 11.897 -0.027 1.00 3.11 H new ATOM 0 HD13 LEU A 86 -6.186 10.874 0.391 1.00 3.11 H new ATOM 0 HD21 LEU A 86 -7.637 8.197 -0.079 1.00 23.02 H new ATOM 0 HD22 LEU A 86 -6.622 8.534 1.343 1.00 23.02 H new ATOM 0 HD23 LEU A 86 -8.307 8.002 1.558 1.00 23.02 H new ATOM 1422 N MET A 87 -6.486 12.845 3.893 1.00 64.50 N ATOM 1423 CA MET A 87 -5.913 14.185 3.931 1.00 54.40 C ATOM 1424 C MET A 87 -4.588 14.190 4.686 1.00 32.34 C ATOM 1425 O MET A 87 -3.682 14.961 4.368 1.00 32.21 O ATOM 1426 CB MET A 87 -6.891 15.162 4.587 1.00 32.13 C ATOM 1427 CG MET A 87 -7.728 15.946 3.590 1.00 52.21 C ATOM 1428 SD MET A 87 -6.744 17.095 2.609 1.00 10.30 S ATOM 1429 CE MET A 87 -6.939 16.396 0.972 1.00 63.33 C ATOM 0 H MET A 87 -7.210 12.676 4.591 1.00 64.50 H new ATOM 0 HA MET A 87 -5.726 14.502 2.905 1.00 54.40 H new ATOM 0 HB2 MET A 87 -7.555 14.608 5.250 1.00 32.13 H new ATOM 0 HB3 MET A 87 -6.331 15.861 5.208 1.00 32.13 H new ATOM 0 HG2 MET A 87 -8.239 15.251 2.924 1.00 52.21 H new ATOM 0 HG3 MET A 87 -8.500 16.500 4.125 1.00 52.21 H new ATOM 0 HE1 MET A 87 -6.202 16.835 0.299 1.00 63.33 H new ATOM 0 HE2 MET A 87 -6.792 15.317 1.017 1.00 63.33 H new ATOM 0 HE3 MET A 87 -7.942 16.610 0.602 1.00 63.33 H new ATOM 1439 N THR A 88 -4.481 13.324 5.690 1.00 60.24 N ATOM 1440 CA THR A 88 -3.267 13.229 6.491 1.00 14.21 C ATOM 1441 C THR A 88 -2.109 12.673 5.671 1.00 1.11 C ATOM 1442 O THR A 88 -1.019 13.245 5.649 1.00 1.14 O ATOM 1443 CB THR A 88 -3.480 12.337 7.729 1.00 41.50 C ATOM 1444 OG1 THR A 88 -4.415 12.953 8.622 1.00 42.32 O ATOM 1445 CG2 THR A 88 -2.164 12.094 8.453 1.00 53.30 C ATOM 0 H THR A 88 -5.221 12.679 5.967 1.00 60.24 H new ATOM 0 HA THR A 88 -3.024 14.240 6.818 1.00 14.21 H new ATOM 0 HB THR A 88 -3.876 11.378 7.395 1.00 41.50 H new ATOM 0 HG1 THR A 88 -5.316 12.614 8.437 1.00 42.32 H new ATOM 0 HG21 THR A 88 -2.339 11.462 9.324 1.00 53.30 H new ATOM 0 HG22 THR A 88 -1.464 11.599 7.780 1.00 53.30 H new ATOM 0 HG23 THR A 88 -1.745 13.047 8.775 1.00 53.30 H new ATOM 1453 N LYS A 89 -2.351 11.554 4.996 1.00 12.53 N ATOM 1454 CA LYS A 89 -1.329 10.921 4.172 1.00 22.11 C ATOM 1455 C LYS A 89 -0.986 11.790 2.966 1.00 10.15 C ATOM 1456 O LYS A 89 -0.008 11.536 2.264 1.00 62.55 O ATOM 1457 CB LYS A 89 -1.804 9.544 3.703 1.00 62.11 C ATOM 1458 CG LYS A 89 -0.831 8.423 4.025 1.00 32.41 C ATOM 1459 CD LYS A 89 -1.012 7.919 5.448 1.00 44.55 C ATOM 1460 CE LYS A 89 -0.226 8.762 6.441 1.00 41.14 C ATOM 1461 NZ LYS A 89 -0.246 8.171 7.807 1.00 11.34 N ATOM 0 H LYS A 89 -3.247 11.067 5.004 1.00 12.53 H new ATOM 0 HA LYS A 89 -0.431 10.802 4.779 1.00 22.11 H new ATOM 0 HB2 LYS A 89 -2.766 9.323 4.166 1.00 62.11 H new ATOM 0 HB3 LYS A 89 -1.968 9.573 2.626 1.00 62.11 H new ATOM 0 HG2 LYS A 89 -0.978 7.600 3.325 1.00 32.41 H new ATOM 0 HG3 LYS A 89 0.191 8.777 3.891 1.00 32.41 H new ATOM 0 HD2 LYS A 89 -2.070 7.938 5.710 1.00 44.55 H new ATOM 0 HD3 LYS A 89 -0.686 6.881 5.512 1.00 44.55 H new ATOM 0 HE2 LYS A 89 0.805 8.856 6.101 1.00 41.14 H new ATOM 0 HE3 LYS A 89 -0.644 9.768 6.474 1.00 41.14 H new ATOM 0 HZ1 LYS A 89 0.300 8.774 8.454 1.00 11.34 H new ATOM 0 HZ2 LYS A 89 -1.228 8.104 8.142 1.00 11.34 H new ATOM 0 HZ3 LYS A 89 0.176 7.221 7.780 1.00 11.34 H new ATOM 1475 N TYR A 90 -1.796 12.817 2.734 1.00 21.01 N ATOM 1476 CA TYR A 90 -1.579 13.723 1.613 1.00 44.33 C ATOM 1477 C TYR A 90 -0.840 14.980 2.063 1.00 22.12 C ATOM 1478 O TYR A 90 0.111 15.421 1.417 1.00 70.24 O ATOM 1479 CB TYR A 90 -2.914 14.105 0.972 1.00 11.33 C ATOM 1480 CG TYR A 90 -2.801 15.217 -0.046 1.00 71.15 C ATOM 1481 CD1 TYR A 90 -2.187 15.001 -1.274 1.00 53.30 C ATOM 1482 CD2 TYR A 90 -3.309 16.483 0.219 1.00 73.35 C ATOM 1483 CE1 TYR A 90 -2.081 16.014 -2.207 1.00 52.33 C ATOM 1484 CE2 TYR A 90 -3.209 17.501 -0.709 1.00 51.34 C ATOM 1485 CZ TYR A 90 -2.594 17.262 -1.921 1.00 2.35 C ATOM 1486 OH TYR A 90 -2.491 18.274 -2.848 1.00 74.41 O ATOM 0 H TYR A 90 -2.609 13.043 3.307 1.00 21.01 H new ATOM 0 HA TYR A 90 -0.964 13.206 0.876 1.00 44.33 H new ATOM 0 HB2 TYR A 90 -3.341 13.225 0.491 1.00 11.33 H new ATOM 0 HB3 TYR A 90 -3.609 14.409 1.754 1.00 11.33 H new ATOM 0 HD1 TYR A 90 -1.786 14.025 -1.503 1.00 53.30 H new ATOM 0 HD2 TYR A 90 -3.790 16.674 1.167 1.00 73.35 H new ATOM 0 HE1 TYR A 90 -1.599 15.830 -3.156 1.00 52.33 H new ATOM 0 HE2 TYR A 90 -3.610 18.479 -0.487 1.00 51.34 H new ATOM 0 HH TYR A 90 -2.903 19.088 -2.491 1.00 74.41 H new ATOM 1496 N HIS A 91 -1.284 15.552 3.178 1.00 51.13 N ATOM 1497 CA HIS A 91 -0.665 16.758 3.717 1.00 33.32 C ATOM 1498 C HIS A 91 0.422 16.405 4.728 1.00 61.24 C ATOM 1499 O HIS A 91 1.591 16.743 4.540 1.00 12.41 O ATOM 1500 CB HIS A 91 -1.720 17.647 4.376 1.00 54.14 C ATOM 1501 CG HIS A 91 -2.135 18.811 3.530 1.00 50.35 C ATOM 1502 ND1 HIS A 91 -2.620 19.990 4.056 1.00 31.34 N ATOM 1503 CD2 HIS A 91 -2.133 18.974 2.186 1.00 53.22 C ATOM 1504 CE1 HIS A 91 -2.900 20.826 3.073 1.00 14.43 C ATOM 1505 NE2 HIS A 91 -2.614 20.235 1.928 1.00 64.42 N ATOM 0 H HIS A 91 -2.069 15.200 3.725 1.00 51.13 H new ATOM 0 HA HIS A 91 -0.206 17.302 2.891 1.00 33.32 H new ATOM 0 HB2 HIS A 91 -2.599 17.044 4.607 1.00 54.14 H new ATOM 0 HB3 HIS A 91 -1.330 18.018 5.324 1.00 54.14 H new ATOM 0 HD2 HIS A 91 -1.813 18.248 1.453 1.00 53.22 H new ATOM 0 HE1 HIS A 91 -3.296 21.824 3.187 1.00 14.43 H new ATOM 0 HE2 HIS A 91 -2.731 20.647 1.002 1.00 64.42 H new ATOM 1513 N ASP A 92 0.029 15.724 5.798 1.00 22.24 N ATOM 1514 CA ASP A 92 0.970 15.325 6.838 1.00 23.25 C ATOM 1515 C ASP A 92 2.170 14.599 6.237 1.00 53.23 C ATOM 1516 O ASP A 92 3.254 14.579 6.821 1.00 32.22 O ATOM 1517 CB ASP A 92 0.278 14.427 7.865 1.00 1.23 C ATOM 1518 CG ASP A 92 0.450 14.932 9.285 1.00 62.34 C ATOM 1519 OD1 ASP A 92 0.074 16.092 9.552 1.00 42.52 O ATOM 1520 OD2 ASP A 92 0.960 14.166 10.128 1.00 30.54 O ATOM 0 H ASP A 92 -0.935 15.437 5.968 1.00 22.24 H new ATOM 0 HA ASP A 92 1.326 16.227 7.336 1.00 23.25 H new ATOM 0 HB2 ASP A 92 -0.785 14.364 7.631 1.00 1.23 H new ATOM 0 HB3 ASP A 92 0.681 13.417 7.790 1.00 1.23 H new ATOM 1525 N LEU A 93 1.968 14.004 5.066 1.00 22.35 N ATOM 1526 CA LEU A 93 3.033 13.275 4.385 1.00 11.42 C ATOM 1527 C LEU A 93 3.667 14.132 3.294 1.00 74.02 C ATOM 1528 O LEU A 93 4.793 13.879 2.866 1.00 70.41 O ATOM 1529 CB LEU A 93 2.486 11.981 3.781 1.00 42.05 C ATOM 1530 CG LEU A 93 3.079 10.682 4.328 1.00 74.12 C ATOM 1531 CD1 LEU A 93 4.578 10.633 4.079 1.00 21.31 C ATOM 1532 CD2 LEU A 93 2.778 10.543 5.813 1.00 74.51 C ATOM 0 H LEU A 93 1.077 14.012 4.569 1.00 22.35 H new ATOM 0 HA LEU A 93 3.800 13.029 5.120 1.00 11.42 H new ATOM 0 HB2 LEU A 93 1.407 11.958 3.937 1.00 42.05 H new ATOM 0 HB3 LEU A 93 2.652 12.008 2.704 1.00 42.05 H new ATOM 0 HG LEU A 93 2.617 9.845 3.804 1.00 74.12 H new ATOM 0 HD11 LEU A 93 4.982 9.701 4.475 1.00 21.31 H new ATOM 0 HD12 LEU A 93 4.771 10.686 3.007 1.00 21.31 H new ATOM 0 HD13 LEU A 93 5.057 11.477 4.576 1.00 21.31 H new ATOM 0 HD21 LEU A 93 3.207 9.613 6.186 1.00 74.51 H new ATOM 0 HD22 LEU A 93 3.212 11.385 6.353 1.00 74.51 H new ATOM 0 HD23 LEU A 93 1.699 10.531 5.966 1.00 74.51 H new ATOM 1544 N LYS A 94 2.937 15.149 2.848 1.00 35.23 N ATOM 1545 CA LYS A 94 3.427 16.046 1.809 1.00 2.33 C ATOM 1546 C LYS A 94 4.812 16.581 2.162 1.00 53.15 C ATOM 1547 O LYS A 94 5.592 16.943 1.280 1.00 33.13 O ATOM 1548 CB LYS A 94 2.454 17.211 1.611 1.00 22.13 C ATOM 1549 CG LYS A 94 3.108 18.577 1.730 1.00 61.32 C ATOM 1550 CD LYS A 94 3.144 19.054 3.172 1.00 44.22 C ATOM 1551 CE LYS A 94 1.747 19.345 3.698 1.00 23.42 C ATOM 1552 NZ LYS A 94 1.440 20.802 3.682 1.00 62.30 N ATOM 0 H LYS A 94 2.003 15.372 3.191 1.00 35.23 H new ATOM 0 HA LYS A 94 3.500 15.480 0.880 1.00 2.33 H new ATOM 0 HB2 LYS A 94 1.991 17.124 0.628 1.00 22.13 H new ATOM 0 HB3 LYS A 94 1.654 17.135 2.348 1.00 22.13 H new ATOM 0 HG2 LYS A 94 4.123 18.531 1.336 1.00 61.32 H new ATOM 0 HG3 LYS A 94 2.562 19.297 1.121 1.00 61.32 H new ATOM 0 HD2 LYS A 94 3.618 18.296 3.795 1.00 44.22 H new ATOM 0 HD3 LYS A 94 3.756 19.953 3.244 1.00 44.22 H new ATOM 0 HE2 LYS A 94 1.013 18.813 3.093 1.00 23.42 H new ATOM 0 HE3 LYS A 94 1.656 18.966 4.716 1.00 23.42 H new ATOM 0 HZ1 LYS A 94 0.479 20.958 4.048 1.00 62.30 H new ATOM 0 HZ2 LYS A 94 2.125 21.308 4.280 1.00 62.30 H new ATOM 0 HZ3 LYS A 94 1.502 21.159 2.707 1.00 62.30 H new ATOM 1566 N LYS A 95 5.112 16.627 3.455 1.00 14.21 N ATOM 1567 CA LYS A 95 6.403 17.115 3.925 1.00 71.13 C ATOM 1568 C LYS A 95 7.534 16.214 3.439 1.00 20.02 C ATOM 1569 O LYS A 95 8.607 16.693 3.073 1.00 53.20 O ATOM 1570 CB LYS A 95 6.417 17.191 5.453 1.00 25.21 C ATOM 1571 CG LYS A 95 5.286 18.023 6.032 1.00 62.14 C ATOM 1572 CD LYS A 95 5.367 19.470 5.574 1.00 65.53 C ATOM 1573 CE LYS A 95 6.579 20.174 6.165 1.00 14.24 C ATOM 1574 NZ LYS A 95 6.448 21.656 6.093 1.00 22.15 N ATOM 0 H LYS A 95 4.478 16.332 4.197 1.00 14.21 H new ATOM 0 HA LYS A 95 6.557 18.114 3.517 1.00 71.13 H new ATOM 0 HB2 LYS A 95 6.358 16.181 5.859 1.00 25.21 H new ATOM 0 HB3 LYS A 95 7.369 17.611 5.779 1.00 25.21 H new ATOM 0 HG2 LYS A 95 4.329 17.598 5.730 1.00 62.14 H new ATOM 0 HG3 LYS A 95 5.324 17.982 7.121 1.00 62.14 H new ATOM 0 HD2 LYS A 95 5.419 19.506 4.486 1.00 65.53 H new ATOM 0 HD3 LYS A 95 4.459 19.997 5.868 1.00 65.53 H new ATOM 0 HE2 LYS A 95 6.705 19.870 7.204 1.00 14.24 H new ATOM 0 HE3 LYS A 95 7.477 19.862 5.631 1.00 14.24 H new ATOM 0 HZ1 LYS A 95 7.293 22.100 6.505 1.00 22.15 H new ATOM 0 HZ2 LYS A 95 6.353 21.948 5.099 1.00 22.15 H new ATOM 0 HZ3 LYS A 95 5.606 21.956 6.624 1.00 22.15 H new ATOM 1588 N GLN A 96 7.286 14.908 3.438 1.00 55.30 N ATOM 1589 CA GLN A 96 8.284 13.942 2.996 1.00 32.43 C ATOM 1590 C GLN A 96 7.858 13.277 1.691 1.00 1.41 C ATOM 1591 O GLN A 96 8.244 12.145 1.405 1.00 74.32 O ATOM 1592 CB GLN A 96 8.507 12.879 4.074 1.00 44.22 C ATOM 1593 CG GLN A 96 8.981 13.449 5.401 1.00 13.22 C ATOM 1594 CD GLN A 96 10.231 14.295 5.261 1.00 62.53 C ATOM 1595 OE1 GLN A 96 10.188 15.516 5.407 1.00 41.42 O ATOM 1596 NE2 GLN A 96 11.355 13.647 4.976 1.00 71.03 N ATOM 0 H GLN A 96 6.403 14.495 3.738 1.00 55.30 H new ATOM 0 HA GLN A 96 9.218 14.476 2.822 1.00 32.43 H new ATOM 0 HB2 GLN A 96 7.576 12.334 4.234 1.00 44.22 H new ATOM 0 HB3 GLN A 96 9.241 12.158 3.715 1.00 44.22 H new ATOM 0 HG2 GLN A 96 8.185 14.053 5.837 1.00 13.22 H new ATOM 0 HG3 GLN A 96 9.177 12.631 6.094 1.00 13.22 H new ATOM 0 HE21 GLN A 96 11.345 12.633 4.863 1.00 71.03 H new ATOM 0 HE22 GLN A 96 12.228 14.163 4.870 1.00 71.03 H new ATOM 1605 N GLY A 97 7.060 13.991 0.902 1.00 33.45 N ATOM 1606 CA GLY A 97 6.594 13.454 -0.363 1.00 24.51 C ATOM 1607 C GLY A 97 6.542 14.504 -1.454 1.00 62.15 C ATOM 1608 O GLY A 97 7.049 15.613 -1.284 1.00 52.13 O ATOM 0 H GLY A 97 6.728 14.931 1.117 1.00 33.45 H new ATOM 0 HA2 GLY A 97 7.252 12.643 -0.675 1.00 24.51 H new ATOM 0 HA3 GLY A 97 5.601 13.025 -0.228 1.00 24.51 H new ATOM 1612 N LYS A 98 5.929 14.155 -2.581 1.00 24.25 N ATOM 1613 CA LYS A 98 5.813 15.075 -3.706 1.00 33.24 C ATOM 1614 C LYS A 98 4.574 14.761 -4.539 1.00 22.10 C ATOM 1615 O LYS A 98 4.451 13.671 -5.099 1.00 24.04 O ATOM 1616 CB LYS A 98 7.064 15.000 -4.584 1.00 13.21 C ATOM 1617 CG LYS A 98 7.387 13.596 -5.064 1.00 72.02 C ATOM 1618 CD LYS A 98 7.150 13.449 -6.558 1.00 41.30 C ATOM 1619 CE LYS A 98 7.745 12.155 -7.092 1.00 40.52 C ATOM 1620 NZ LYS A 98 8.904 12.408 -7.992 1.00 25.01 N ATOM 0 H LYS A 98 5.505 13.241 -2.739 1.00 24.25 H new ATOM 0 HA LYS A 98 5.716 16.085 -3.309 1.00 33.24 H new ATOM 0 HB2 LYS A 98 6.930 15.649 -5.449 1.00 13.21 H new ATOM 0 HB3 LYS A 98 7.915 15.388 -4.024 1.00 13.21 H new ATOM 0 HG2 LYS A 98 8.427 13.362 -4.835 1.00 72.02 H new ATOM 0 HG3 LYS A 98 6.772 12.876 -4.525 1.00 72.02 H new ATOM 0 HD2 LYS A 98 6.079 13.470 -6.761 1.00 41.30 H new ATOM 0 HD3 LYS A 98 7.590 14.297 -7.083 1.00 41.30 H new ATOM 0 HE2 LYS A 98 8.063 11.530 -6.258 1.00 40.52 H new ATOM 0 HE3 LYS A 98 6.979 11.599 -7.633 1.00 40.52 H new ATOM 0 HZ1 LYS A 98 9.281 11.502 -8.335 1.00 25.01 H new ATOM 0 HZ2 LYS A 98 8.596 12.983 -8.802 1.00 25.01 H new ATOM 0 HZ3 LYS A 98 9.645 12.916 -7.469 1.00 25.01 H new ATOM 1634 N ILE A 99 3.661 15.722 -4.618 1.00 54.40 N ATOM 1635 CA ILE A 99 2.434 15.548 -5.385 1.00 54.44 C ATOM 1636 C ILE A 99 2.282 16.643 -6.436 1.00 2.53 C ATOM 1637 O ILE A 99 2.630 17.800 -6.198 1.00 12.44 O ATOM 1638 CB ILE A 99 1.193 15.553 -4.473 1.00 2.25 C ATOM 1639 CG1 ILE A 99 -0.084 15.460 -5.310 1.00 62.51 C ATOM 1640 CG2 ILE A 99 1.176 16.806 -3.609 1.00 20.41 C ATOM 1641 CD1 ILE A 99 -0.699 16.805 -5.626 1.00 34.32 C ATOM 0 H ILE A 99 3.747 16.629 -4.160 1.00 54.40 H new ATOM 0 HA ILE A 99 2.507 14.580 -5.880 1.00 54.44 H new ATOM 0 HB ILE A 99 1.239 14.683 -3.818 1.00 2.25 H new ATOM 0 HG12 ILE A 99 0.140 14.944 -6.243 1.00 62.51 H new ATOM 0 HG13 ILE A 99 -0.815 14.852 -4.777 1.00 62.51 H new ATOM 0 HG21 ILE A 99 0.293 16.795 -2.970 1.00 20.41 H new ATOM 0 HG22 ILE A 99 2.072 16.833 -2.989 1.00 20.41 H new ATOM 0 HG23 ILE A 99 1.150 17.688 -4.248 1.00 20.41 H new ATOM 0 HD11 ILE A 99 -1.600 16.662 -6.222 1.00 34.32 H new ATOM 0 HD12 ILE A 99 -0.955 17.315 -4.697 1.00 34.32 H new ATOM 0 HD13 ILE A 99 0.015 17.409 -6.187 1.00 34.32 H new ATOM 1653 N LYS A 100 1.759 16.271 -7.599 1.00 42.41 N ATOM 1654 CA LYS A 100 1.558 17.221 -8.687 1.00 13.43 C ATOM 1655 C LYS A 100 0.110 17.201 -9.166 1.00 73.41 C ATOM 1656 O LYS A 100 -0.642 16.276 -8.859 1.00 74.50 O ATOM 1657 CB LYS A 100 2.496 16.901 -9.852 1.00 65.20 C ATOM 1658 CG LYS A 100 3.896 17.466 -9.679 1.00 73.20 C ATOM 1659 CD LYS A 100 4.959 16.429 -10.000 1.00 3.13 C ATOM 1660 CE LYS A 100 5.110 15.418 -8.873 1.00 54.13 C ATOM 1661 NZ LYS A 100 5.458 14.064 -9.386 1.00 50.11 N ATOM 0 H LYS A 100 1.466 15.318 -7.813 1.00 42.41 H new ATOM 0 HA LYS A 100 1.784 18.219 -8.311 1.00 13.43 H new ATOM 0 HB2 LYS A 100 2.562 15.819 -9.968 1.00 65.20 H new ATOM 0 HB3 LYS A 100 2.066 17.295 -10.773 1.00 65.20 H new ATOM 0 HG2 LYS A 100 4.023 18.332 -10.329 1.00 73.20 H new ATOM 0 HG3 LYS A 100 4.024 17.815 -8.654 1.00 73.20 H new ATOM 0 HD2 LYS A 100 4.696 15.911 -10.922 1.00 3.13 H new ATOM 0 HD3 LYS A 100 5.913 16.926 -10.174 1.00 3.13 H new ATOM 0 HE2 LYS A 100 5.884 15.755 -8.184 1.00 54.13 H new ATOM 0 HE3 LYS A 100 4.180 15.364 -8.307 1.00 54.13 H new ATOM 0 HZ1 LYS A 100 5.148 13.344 -8.703 1.00 50.11 H new ATOM 0 HZ2 LYS A 100 4.982 13.905 -10.297 1.00 50.11 H new ATOM 0 HZ3 LYS A 100 6.487 13.996 -9.517 1.00 50.11 H new ATOM 1675 N ASP A 101 -0.274 18.224 -9.921 1.00 5.43 N ATOM 1676 CA ASP A 101 -1.631 18.322 -10.445 1.00 1.12 C ATOM 1677 C ASP A 101 -1.616 18.559 -11.952 1.00 2.33 C ATOM 1678 O ASP A 101 -1.744 19.694 -12.413 1.00 34.43 O ATOM 1679 CB ASP A 101 -2.390 19.451 -9.746 1.00 33.22 C ATOM 1680 CG ASP A 101 -1.670 20.781 -9.844 1.00 63.00 C ATOM 1681 OD1 ASP A 101 -0.641 20.950 -9.157 1.00 64.24 O ATOM 1682 OD2 ASP A 101 -2.135 21.654 -10.607 1.00 33.42 O ATOM 0 H ASP A 101 0.336 18.998 -10.184 1.00 5.43 H new ATOM 0 HA ASP A 101 -2.139 17.378 -10.249 1.00 1.12 H new ATOM 0 HB2 ASP A 101 -3.382 19.545 -10.187 1.00 33.22 H new ATOM 0 HB3 ASP A 101 -2.531 19.194 -8.696 1.00 33.22 H new ATOM 1687 N ARG A 102 -1.457 17.482 -12.714 1.00 1.14 N ATOM 1688 CA ARG A 102 -1.423 17.573 -14.168 1.00 44.42 C ATOM 1689 C ARG A 102 -2.813 17.862 -14.728 1.00 23.42 C ATOM 1690 O ARG A 102 -3.832 17.620 -14.080 1.00 43.15 O ATOM 1691 CB ARG A 102 -0.878 16.276 -14.769 1.00 50.33 C ATOM 1692 CG ARG A 102 0.640 16.196 -14.772 1.00 12.52 C ATOM 1693 CD ARG A 102 1.231 16.865 -16.003 1.00 73.44 C ATOM 1694 NE ARG A 102 2.688 16.768 -16.032 1.00 53.43 N ATOM 1695 CZ ARG A 102 3.433 17.207 -17.041 1.00 23.44 C ATOM 1696 NH1 ARG A 102 2.862 17.769 -18.097 1.00 32.33 N ATOM 1697 NH2 ARG A 102 4.754 17.083 -16.993 1.00 53.54 N ATOM 0 H ARG A 102 -1.350 16.536 -12.348 1.00 1.14 H new ATOM 0 HA ARG A 102 -0.763 18.397 -14.440 1.00 44.42 H new ATOM 0 HB2 ARG A 102 -1.277 15.430 -14.209 1.00 50.33 H new ATOM 0 HB3 ARG A 102 -1.240 16.180 -15.792 1.00 50.33 H new ATOM 0 HG2 ARG A 102 1.032 16.673 -13.874 1.00 12.52 H new ATOM 0 HG3 ARG A 102 0.950 15.152 -14.740 1.00 12.52 H new ATOM 0 HD2 ARG A 102 0.819 16.403 -16.900 1.00 73.44 H new ATOM 0 HD3 ARG A 102 0.937 17.914 -16.022 1.00 73.44 H new ATOM 0 HE ARG A 102 3.159 16.340 -15.235 1.00 53.43 H new ATOM 0 HH11 ARG A 102 1.847 17.866 -18.137 1.00 32.33 H new ATOM 0 HH12 ARG A 102 3.437 18.105 -18.870 1.00 32.33 H new ATOM 0 HH21 ARG A 102 5.197 16.651 -16.182 1.00 53.54 H new ATOM 0 HH22 ARG A 102 5.326 17.420 -17.767 1.00 53.54 H new ATOM 1711 N PRO A 103 -2.857 18.391 -15.959 1.00 40.14 N ATOM 1712 CA PRO A 103 -4.116 18.724 -16.633 1.00 64.33 C ATOM 1713 C PRO A 103 -4.905 17.482 -17.032 1.00 72.25 C ATOM 1714 O PRO A 103 -4.329 16.465 -17.419 1.00 62.00 O ATOM 1715 CB PRO A 103 -3.660 19.491 -17.877 1.00 71.53 C ATOM 1716 CG PRO A 103 -2.277 19.002 -18.138 1.00 1.43 C ATOM 1717 CD PRO A 103 -1.682 18.705 -16.789 1.00 43.31 C ATOM 0 HA PRO A 103 -4.787 19.292 -15.988 1.00 64.33 H new ATOM 0 HB2 PRO A 103 -4.316 19.295 -18.725 1.00 71.53 H new ATOM 0 HB3 PRO A 103 -3.674 20.567 -17.706 1.00 71.53 H new ATOM 0 HG2 PRO A 103 -2.290 18.110 -18.764 1.00 1.43 H new ATOM 0 HG3 PRO A 103 -1.690 19.754 -18.666 1.00 1.43 H new ATOM 0 HD2 PRO A 103 -0.986 17.868 -16.833 1.00 43.31 H new ATOM 0 HD3 PRO A 103 -1.130 19.559 -16.397 1.00 43.31 H new ATOM 1725 N VAL A 104 -6.228 17.571 -16.937 1.00 11.11 N ATOM 1726 CA VAL A 104 -7.097 16.455 -17.290 1.00 31.22 C ATOM 1727 C VAL A 104 -7.294 16.367 -18.799 1.00 40.40 C ATOM 1728 O VAL A 104 -7.522 17.377 -19.466 1.00 64.34 O ATOM 1729 CB VAL A 104 -8.474 16.578 -16.610 1.00 4.41 C ATOM 1730 CG1 VAL A 104 -9.243 17.764 -17.173 1.00 70.40 C ATOM 1731 CG2 VAL A 104 -9.266 15.291 -16.775 1.00 34.43 C ATOM 0 H VAL A 104 -6.721 18.405 -16.618 1.00 11.11 H new ATOM 0 HA VAL A 104 -6.606 15.548 -16.937 1.00 31.22 H new ATOM 0 HB VAL A 104 -8.320 16.748 -15.544 1.00 4.41 H new ATOM 0 HG11 VAL A 104 -10.213 17.835 -16.681 1.00 70.40 H new ATOM 0 HG12 VAL A 104 -8.679 18.680 -16.997 1.00 70.40 H new ATOM 0 HG13 VAL A 104 -9.389 17.628 -18.245 1.00 70.40 H new ATOM 0 HG21 VAL A 104 -10.236 15.396 -16.289 1.00 34.43 H new ATOM 0 HG22 VAL A 104 -9.412 15.087 -17.836 1.00 34.43 H new ATOM 0 HG23 VAL A 104 -8.719 14.466 -16.319 1.00 34.43 H new ATOM 1741 N LYS A 105 -7.205 15.154 -19.332 1.00 74.43 N ATOM 1742 CA LYS A 105 -7.375 14.932 -20.763 1.00 74.14 C ATOM 1743 C LYS A 105 -8.843 14.695 -21.107 1.00 4.42 C ATOM 1744 O LYS A 105 -9.555 14.003 -20.381 1.00 10.24 O ATOM 1745 CB LYS A 105 -6.535 13.737 -21.219 1.00 30.45 C ATOM 1746 CG LYS A 105 -5.045 14.026 -21.273 1.00 1.14 C ATOM 1747 CD LYS A 105 -4.658 14.717 -22.569 1.00 42.22 C ATOM 1748 CE LYS A 105 -3.165 15.002 -22.625 1.00 2.33 C ATOM 1749 NZ LYS A 105 -2.851 16.144 -23.528 1.00 73.21 N ATOM 0 H LYS A 105 -7.016 14.308 -18.794 1.00 74.43 H new ATOM 0 HA LYS A 105 -7.037 15.827 -21.286 1.00 74.14 H new ATOM 0 HB2 LYS A 105 -6.710 12.901 -20.542 1.00 30.45 H new ATOM 0 HB3 LYS A 105 -6.872 13.423 -22.207 1.00 30.45 H new ATOM 0 HG2 LYS A 105 -4.764 14.654 -20.427 1.00 1.14 H new ATOM 0 HG3 LYS A 105 -4.489 13.094 -21.177 1.00 1.14 H new ATOM 0 HD2 LYS A 105 -4.942 14.091 -23.415 1.00 42.22 H new ATOM 0 HD3 LYS A 105 -5.212 15.651 -22.664 1.00 42.22 H new ATOM 0 HE2 LYS A 105 -2.799 15.221 -21.622 1.00 2.33 H new ATOM 0 HE3 LYS A 105 -2.638 14.112 -22.969 1.00 2.33 H new ATOM 0 HZ1 LYS A 105 -1.824 16.306 -23.538 1.00 73.21 H new ATOM 0 HZ2 LYS A 105 -3.177 15.925 -24.491 1.00 73.21 H new ATOM 0 HZ3 LYS A 105 -3.333 17.000 -23.186 1.00 73.21 H new ATOM 1763 N GLU A 106 -9.286 15.274 -22.218 1.00 73.25 N ATOM 1764 CA GLU A 106 -10.669 15.124 -22.657 1.00 41.31 C ATOM 1765 C GLU A 106 -10.899 13.746 -23.270 1.00 34.25 C ATOM 1766 O GLU A 106 -10.066 13.242 -24.023 1.00 34.41 O ATOM 1767 CB GLU A 106 -11.025 16.212 -23.673 1.00 35.22 C ATOM 1768 CG GLU A 106 -10.208 16.142 -24.952 1.00 2.05 C ATOM 1769 CD GLU A 106 -10.357 17.385 -25.808 1.00 24.33 C ATOM 1770 OE1 GLU A 106 -11.484 17.917 -25.889 1.00 63.43 O ATOM 1771 OE2 GLU A 106 -9.347 17.825 -26.396 1.00 30.01 O ATOM 0 H GLU A 106 -8.709 15.851 -22.830 1.00 73.25 H new ATOM 0 HA GLU A 106 -11.314 15.226 -21.784 1.00 41.31 H new ATOM 0 HB2 GLU A 106 -12.083 16.132 -23.923 1.00 35.22 H new ATOM 0 HB3 GLU A 106 -10.880 17.189 -23.212 1.00 35.22 H new ATOM 0 HG2 GLU A 106 -9.157 16.003 -24.700 1.00 2.05 H new ATOM 0 HG3 GLU A 106 -10.516 15.269 -25.528 1.00 2.05 H new ATOM 1778 N VAL A 107 -12.036 13.141 -22.940 1.00 31.32 N ATOM 1779 CA VAL A 107 -12.378 11.821 -23.457 1.00 23.01 C ATOM 1780 C VAL A 107 -13.503 11.907 -24.482 1.00 33.45 C ATOM 1781 O VAL A 107 -14.454 12.671 -24.313 1.00 70.11 O ATOM 1782 CB VAL A 107 -12.801 10.867 -22.324 1.00 62.33 C ATOM 1783 CG1 VAL A 107 -13.714 9.774 -22.860 1.00 3.14 C ATOM 1784 CG2 VAL A 107 -11.577 10.267 -21.649 1.00 20.24 C ATOM 0 H VAL A 107 -12.736 13.544 -22.317 1.00 31.32 H new ATOM 0 HA VAL A 107 -11.482 11.427 -23.938 1.00 23.01 H new ATOM 0 HB VAL A 107 -13.355 11.438 -21.579 1.00 62.33 H new ATOM 0 HG11 VAL A 107 -14.003 9.109 -22.046 1.00 3.14 H new ATOM 0 HG12 VAL A 107 -14.606 10.225 -23.294 1.00 3.14 H new ATOM 0 HG13 VAL A 107 -13.188 9.203 -23.625 1.00 3.14 H new ATOM 0 HG21 VAL A 107 -11.894 9.596 -20.851 1.00 20.24 H new ATOM 0 HG22 VAL A 107 -10.994 9.710 -22.382 1.00 20.24 H new ATOM 0 HG23 VAL A 107 -10.965 11.065 -21.230 1.00 20.24 H new ATOM 1794 N HIS A 108 -13.390 11.117 -25.545 1.00 23.33 N ATOM 1795 CA HIS A 108 -14.399 11.102 -26.598 1.00 11.15 C ATOM 1796 C HIS A 108 -15.015 9.714 -26.740 1.00 75.30 C ATOM 1797 O HIS A 108 -14.603 8.770 -26.066 1.00 55.14 O ATOM 1798 CB HIS A 108 -13.785 11.539 -27.928 1.00 12.32 C ATOM 1799 CG HIS A 108 -14.631 12.516 -28.685 1.00 44.43 C ATOM 1800 ND1 HIS A 108 -14.906 12.389 -30.031 1.00 5.25 N ATOM 1801 CD2 HIS A 108 -15.265 13.641 -28.278 1.00 24.32 C ATOM 1802 CE1 HIS A 108 -15.671 13.394 -30.418 1.00 44.02 C ATOM 1803 NE2 HIS A 108 -15.903 14.168 -29.373 1.00 74.33 N ATOM 0 H HIS A 108 -12.610 10.479 -25.700 1.00 23.33 H new ATOM 0 HA HIS A 108 -15.187 11.803 -26.323 1.00 11.15 H new ATOM 0 HB2 HIS A 108 -12.809 11.986 -27.739 1.00 12.32 H new ATOM 0 HB3 HIS A 108 -13.618 10.659 -28.548 1.00 12.32 H new ATOM 0 HD2 HIS A 108 -15.268 14.048 -27.278 1.00 24.32 H new ATOM 0 HE1 HIS A 108 -16.043 13.555 -31.419 1.00 44.02 H new ATOM 0 HE2 HIS A 108 -16.465 15.019 -29.379 1.00 74.33 H new ATOM 1811 N GLU A 109 -16.005 9.598 -27.621 1.00 3.15 N ATOM 1812 CA GLU A 109 -16.678 8.325 -27.849 1.00 52.11 C ATOM 1813 C GLU A 109 -15.856 7.434 -28.776 1.00 34.54 C ATOM 1814 O GLU A 109 -14.992 7.913 -29.509 1.00 14.01 O ATOM 1815 CB GLU A 109 -18.067 8.558 -28.447 1.00 72.21 C ATOM 1816 CG GLU A 109 -18.759 9.801 -27.913 1.00 74.42 C ATOM 1817 CD GLU A 109 -20.207 9.897 -28.354 1.00 41.23 C ATOM 1818 OE1 GLU A 109 -20.918 8.873 -28.281 1.00 53.21 O ATOM 1819 OE2 GLU A 109 -20.628 10.996 -28.773 1.00 33.43 O ATOM 0 H GLU A 109 -16.358 10.369 -28.187 1.00 3.15 H new ATOM 0 HA GLU A 109 -16.784 7.821 -26.888 1.00 52.11 H new ATOM 0 HB2 GLU A 109 -17.978 8.639 -29.530 1.00 72.21 H new ATOM 0 HB3 GLU A 109 -18.692 7.689 -28.243 1.00 72.21 H new ATOM 0 HG2 GLU A 109 -18.714 9.798 -26.824 1.00 74.42 H new ATOM 0 HG3 GLU A 109 -18.220 10.686 -28.252 1.00 74.42 H new ATOM 1826 N GLU A 110 -16.133 6.134 -28.735 1.00 64.20 N ATOM 1827 CA GLU A 110 -15.418 5.175 -29.570 1.00 0.23 C ATOM 1828 C GLU A 110 -13.939 5.126 -29.198 1.00 2.44 C ATOM 1829 O GLU A 110 -13.074 4.989 -30.063 1.00 50.12 O ATOM 1830 CB GLU A 110 -15.572 5.539 -31.048 1.00 65.41 C ATOM 1831 CG GLU A 110 -15.510 4.339 -31.979 1.00 42.42 C ATOM 1832 CD GLU A 110 -16.117 4.625 -33.339 1.00 65.12 C ATOM 1833 OE1 GLU A 110 -17.160 5.310 -33.391 1.00 4.03 O ATOM 1834 OE2 GLU A 110 -15.549 4.164 -34.351 1.00 72.43 O ATOM 0 H GLU A 110 -16.846 5.721 -28.134 1.00 64.20 H new ATOM 0 HA GLU A 110 -15.850 4.189 -29.399 1.00 0.23 H new ATOM 0 HB2 GLU A 110 -16.524 6.050 -31.191 1.00 65.41 H new ATOM 0 HB3 GLU A 110 -14.787 6.244 -31.324 1.00 65.41 H new ATOM 0 HG2 GLU A 110 -14.471 4.035 -32.106 1.00 42.42 H new ATOM 0 HG3 GLU A 110 -16.034 3.500 -31.520 1.00 42.42 H new ATOM 1841 N TYR A 111 -13.656 5.240 -27.905 1.00 12.42 N ATOM 1842 CA TYR A 111 -12.282 5.212 -27.417 1.00 53.44 C ATOM 1843 C TYR A 111 -12.233 4.801 -25.949 1.00 54.20 C ATOM 1844 O TYR A 111 -11.336 5.205 -25.209 1.00 52.31 O ATOM 1845 CB TYR A 111 -11.627 6.583 -27.597 1.00 14.13 C ATOM 1846 CG TYR A 111 -10.116 6.537 -27.598 1.00 31.41 C ATOM 1847 CD1 TYR A 111 -9.428 5.679 -28.447 1.00 53.05 C ATOM 1848 CD2 TYR A 111 -9.376 7.351 -26.750 1.00 0.32 C ATOM 1849 CE1 TYR A 111 -8.048 5.633 -28.451 1.00 63.22 C ATOM 1850 CE2 TYR A 111 -7.995 7.313 -26.748 1.00 30.12 C ATOM 1851 CZ TYR A 111 -7.336 6.452 -27.600 1.00 24.32 C ATOM 1852 OH TYR A 111 -5.960 6.410 -27.602 1.00 31.35 O ATOM 0 H TYR A 111 -14.360 5.353 -27.176 1.00 12.42 H new ATOM 0 HA TYR A 111 -11.731 4.474 -28.000 1.00 53.44 H new ATOM 0 HB2 TYR A 111 -11.969 7.019 -28.535 1.00 14.13 H new ATOM 0 HB3 TYR A 111 -11.961 7.244 -26.797 1.00 14.13 H new ATOM 0 HD1 TYR A 111 -9.982 5.037 -29.115 1.00 53.05 H new ATOM 0 HD2 TYR A 111 -9.889 8.025 -26.081 1.00 0.32 H new ATOM 0 HE1 TYR A 111 -7.529 4.959 -29.117 1.00 63.22 H new ATOM 0 HE2 TYR A 111 -7.435 7.954 -26.083 1.00 30.12 H new ATOM 0 HH TYR A 111 -5.612 7.049 -26.946 1.00 31.35 H new ATOM 1862 N ASP A 112 -13.204 3.995 -25.535 1.00 32.51 N ATOM 1863 CA ASP A 112 -13.273 3.526 -24.156 1.00 24.33 C ATOM 1864 C ASP A 112 -11.937 2.933 -23.716 1.00 54.23 C ATOM 1865 O ASP A 112 -11.293 2.201 -24.469 1.00 34.44 O ATOM 1866 CB ASP A 112 -14.382 2.484 -24.003 1.00 60.11 C ATOM 1867 CG ASP A 112 -15.665 2.899 -24.696 1.00 31.22 C ATOM 1868 OD1 ASP A 112 -16.194 3.981 -24.367 1.00 11.41 O ATOM 1869 OD2 ASP A 112 -16.140 2.141 -25.568 1.00 1.45 O ATOM 0 H ASP A 112 -13.955 3.653 -26.135 1.00 32.51 H new ATOM 0 HA ASP A 112 -13.499 4.381 -23.519 1.00 24.33 H new ATOM 0 HB2 ASP A 112 -14.042 1.533 -24.413 1.00 60.11 H new ATOM 0 HB3 ASP A 112 -14.581 2.322 -22.944 1.00 60.11 H new ATOM 1874 N LEU A 113 -11.526 3.256 -22.495 1.00 33.41 N ATOM 1875 CA LEU A 113 -10.267 2.756 -21.955 1.00 5.11 C ATOM 1876 C LEU A 113 -10.386 1.287 -21.564 1.00 71.52 C ATOM 1877 O LEU A 113 -10.070 0.397 -22.354 1.00 31.41 O ATOM 1878 CB LEU A 113 -9.845 3.586 -20.741 1.00 23.31 C ATOM 1879 CG LEU A 113 -9.737 5.095 -20.964 1.00 30.43 C ATOM 1880 CD1 LEU A 113 -9.293 5.394 -22.387 1.00 64.41 C ATOM 1881 CD2 LEU A 113 -11.065 5.774 -20.664 1.00 12.12 C ATOM 0 H LEU A 113 -12.046 3.862 -21.860 1.00 33.41 H new ATOM 0 HA LEU A 113 -9.507 2.845 -22.731 1.00 5.11 H new ATOM 0 HB2 LEU A 113 -10.560 3.408 -19.938 1.00 23.31 H new ATOM 0 HB3 LEU A 113 -8.879 3.220 -20.394 1.00 23.31 H new ATOM 0 HG LEU A 113 -8.986 5.491 -20.281 1.00 30.43 H new ATOM 0 HD11 LEU A 113 -9.222 6.473 -22.527 1.00 64.41 H new ATOM 0 HD12 LEU A 113 -8.319 4.940 -22.567 1.00 64.41 H new ATOM 0 HD13 LEU A 113 -10.020 4.984 -23.089 1.00 64.41 H new ATOM 0 HD21 LEU A 113 -10.970 6.847 -20.828 1.00 12.12 H new ATOM 0 HD22 LEU A 113 -11.836 5.373 -21.323 1.00 12.12 H new ATOM 0 HD23 LEU A 113 -11.342 5.589 -19.626 1.00 12.12 H new ATOM 1893 N TRP A 114 -10.846 1.040 -20.343 1.00 1.21 N ATOM 1894 CA TRP A 114 -11.009 -0.322 -19.848 1.00 75.13 C ATOM 1895 C TRP A 114 -12.414 -0.840 -20.135 1.00 74.30 C ATOM 1896 O TRP A 114 -12.645 -2.049 -20.167 1.00 3.40 O ATOM 1897 CB TRP A 114 -10.728 -0.378 -18.346 1.00 35.41 C ATOM 1898 CG TRP A 114 -9.267 -0.400 -18.015 1.00 63.24 C ATOM 1899 CD1 TRP A 114 -8.615 0.409 -17.129 1.00 22.31 C ATOM 1900 CD2 TRP A 114 -8.276 -1.273 -18.569 1.00 20.12 C ATOM 1901 NE1 TRP A 114 -7.278 0.091 -17.098 1.00 12.20 N ATOM 1902 CE2 TRP A 114 -7.045 -0.938 -17.972 1.00 10.24 C ATOM 1903 CE3 TRP A 114 -8.309 -2.306 -19.509 1.00 30.41 C ATOM 1904 CZ2 TRP A 114 -5.861 -1.599 -18.286 1.00 42.02 C ATOM 1905 CZ3 TRP A 114 -7.133 -2.961 -19.820 1.00 62.43 C ATOM 1906 CH2 TRP A 114 -5.922 -2.607 -19.210 1.00 54.41 C ATOM 0 H TRP A 114 -11.113 1.765 -19.677 1.00 1.21 H new ATOM 0 HA TRP A 114 -10.294 -0.959 -20.368 1.00 75.13 H new ATOM 0 HB2 TRP A 114 -11.189 0.485 -17.865 1.00 35.41 H new ATOM 0 HB3 TRP A 114 -11.201 -1.267 -17.928 1.00 35.41 H new ATOM 0 HD1 TRP A 114 -9.081 1.185 -16.539 1.00 22.31 H new ATOM 0 HE1 TRP A 114 -6.574 0.547 -16.518 1.00 12.20 H new ATOM 0 HE3 TRP A 114 -9.237 -2.587 -19.984 1.00 30.41 H new ATOM 0 HZ2 TRP A 114 -4.927 -1.326 -17.817 1.00 42.02 H new ATOM 0 HZ3 TRP A 114 -7.147 -3.760 -20.546 1.00 62.43 H new ATOM 0 HH2 TRP A 114 -5.020 -3.139 -19.474 1.00 54.41 H new ATOM 1917 N GLU A 115 -13.350 0.081 -20.343 1.00 43.40 N ATOM 1918 CA GLU A 115 -14.732 -0.285 -20.626 1.00 54.25 C ATOM 1919 C GLU A 115 -15.162 -1.483 -19.784 1.00 44.41 C ATOM 1920 O GLU A 115 -15.414 -2.567 -20.310 1.00 53.54 O ATOM 1921 CB GLU A 115 -14.904 -0.605 -22.113 1.00 10.11 C ATOM 1922 CG GLU A 115 -13.883 -1.597 -22.644 1.00 32.34 C ATOM 1923 CD GLU A 115 -14.131 -1.971 -24.092 1.00 73.01 C ATOM 1924 OE1 GLU A 115 -13.718 -1.200 -24.983 1.00 74.24 O ATOM 1925 OE2 GLU A 115 -14.739 -3.035 -24.334 1.00 24.31 O ATOM 0 H GLU A 115 -13.176 1.086 -20.321 1.00 43.40 H new ATOM 0 HA GLU A 115 -15.365 0.564 -20.368 1.00 54.25 H new ATOM 0 HB2 GLU A 115 -15.905 -1.004 -22.277 1.00 10.11 H new ATOM 0 HB3 GLU A 115 -14.832 0.320 -22.686 1.00 10.11 H new ATOM 0 HG2 GLU A 115 -12.884 -1.171 -22.549 1.00 32.34 H new ATOM 0 HG3 GLU A 115 -13.905 -2.498 -22.031 1.00 32.34 H new ATOM 1932 N ASP A 116 -15.241 -1.279 -18.474 1.00 0.21 N ATOM 1933 CA ASP A 116 -15.640 -2.341 -17.558 1.00 2.24 C ATOM 1934 C ASP A 116 -15.610 -1.852 -16.113 1.00 11.31 C ATOM 1935 O ASP A 116 -16.628 -1.824 -15.420 1.00 44.21 O ATOM 1936 CB ASP A 116 -14.721 -3.553 -17.718 1.00 33.34 C ATOM 1937 CG ASP A 116 -14.522 -4.304 -16.416 1.00 25.03 C ATOM 1938 OD1 ASP A 116 -15.529 -4.589 -15.734 1.00 63.33 O ATOM 1939 OD2 ASP A 116 -13.358 -4.607 -16.079 1.00 31.13 O ATOM 0 H ASP A 116 -15.034 -0.388 -18.022 1.00 0.21 H new ATOM 0 HA ASP A 116 -16.661 -2.634 -17.803 1.00 2.24 H new ATOM 0 HB2 ASP A 116 -15.141 -4.228 -18.463 1.00 33.34 H new ATOM 0 HB3 ASP A 116 -13.753 -3.224 -18.096 1.00 33.34 H new ATOM 1944 N PRO A 117 -14.416 -1.457 -15.646 1.00 33.53 N ATOM 1945 CA PRO A 117 -14.225 -0.963 -14.279 1.00 50.10 C ATOM 1946 C PRO A 117 -14.871 0.401 -14.061 1.00 4.24 C ATOM 1947 O PRO A 117 -15.786 0.542 -13.249 1.00 52.03 O ATOM 1948 CB PRO A 117 -12.703 -0.861 -14.148 1.00 73.52 C ATOM 1949 CG PRO A 117 -12.214 -0.686 -15.544 1.00 61.33 C ATOM 1950 CD PRO A 117 -13.161 -1.464 -16.416 1.00 11.32 C ATOM 0 HA PRO A 117 -14.687 -1.618 -13.540 1.00 50.10 H new ATOM 0 HB2 PRO A 117 -12.415 -0.018 -13.519 1.00 73.52 H new ATOM 0 HB3 PRO A 117 -12.284 -1.758 -13.691 1.00 73.52 H new ATOM 0 HG2 PRO A 117 -12.202 0.367 -15.824 1.00 61.33 H new ATOM 0 HG3 PRO A 117 -11.194 -1.055 -15.649 1.00 61.33 H new ATOM 0 HD2 PRO A 117 -13.286 -0.995 -17.392 1.00 11.32 H new ATOM 0 HD3 PRO A 117 -12.803 -2.478 -16.593 1.00 11.32 H new ATOM 1958 N ILE A 118 -14.388 1.402 -14.789 1.00 53.30 N ATOM 1959 CA ILE A 118 -14.920 2.755 -14.675 1.00 73.42 C ATOM 1960 C ILE A 118 -16.165 2.930 -15.539 1.00 1.24 C ATOM 1961 O ILE A 118 -16.869 3.934 -15.433 1.00 15.05 O ATOM 1962 CB ILE A 118 -13.873 3.808 -15.083 1.00 72.45 C ATOM 1963 CG1 ILE A 118 -13.001 3.276 -16.223 1.00 1.23 C ATOM 1964 CG2 ILE A 118 -13.015 4.193 -13.888 1.00 33.25 C ATOM 1965 CD1 ILE A 118 -13.793 2.816 -17.426 1.00 72.02 C ATOM 0 H ILE A 118 -13.630 1.302 -15.464 1.00 53.30 H new ATOM 0 HA ILE A 118 -15.183 2.904 -13.628 1.00 73.42 H new ATOM 0 HB ILE A 118 -14.393 4.699 -15.434 1.00 72.45 H new ATOM 0 HG12 ILE A 118 -12.306 4.057 -16.533 1.00 1.23 H new ATOM 0 HG13 ILE A 118 -12.402 2.444 -15.853 1.00 1.23 H new ATOM 0 HG21 ILE A 118 -12.280 4.938 -14.193 1.00 33.25 H new ATOM 0 HG22 ILE A 118 -13.648 4.608 -13.104 1.00 33.25 H new ATOM 0 HG23 ILE A 118 -12.501 3.310 -13.510 1.00 33.25 H new ATOM 0 HD11 ILE A 118 -13.110 2.452 -18.194 1.00 72.02 H new ATOM 0 HD12 ILE A 118 -14.469 2.013 -17.131 1.00 72.02 H new ATOM 0 HD13 ILE A 118 -14.372 3.651 -17.821 1.00 72.02 H new ATOM 1977 N TRP A 119 -16.430 1.947 -16.391 1.00 42.12 N ATOM 1978 CA TRP A 119 -17.591 1.992 -17.272 1.00 54.23 C ATOM 1979 C TRP A 119 -18.863 1.623 -16.516 1.00 62.21 C ATOM 1980 O TRP A 119 -19.946 2.114 -16.831 1.00 34.13 O ATOM 1981 CB TRP A 119 -17.395 1.046 -18.458 1.00 30.33 C ATOM 1982 CG TRP A 119 -18.133 1.475 -19.689 1.00 55.12 C ATOM 1983 CD1 TRP A 119 -18.125 2.716 -20.259 1.00 45.04 C ATOM 1984 CD2 TRP A 119 -18.991 0.665 -20.501 1.00 25.33 C ATOM 1985 NE1 TRP A 119 -18.925 2.726 -21.377 1.00 25.15 N ATOM 1986 CE2 TRP A 119 -19.466 1.479 -21.547 1.00 15.43 C ATOM 1987 CE3 TRP A 119 -19.401 -0.670 -20.447 1.00 64.10 C ATOM 1988 CZ2 TRP A 119 -20.332 1.002 -22.527 1.00 63.43 C ATOM 1989 CZ3 TRP A 119 -20.260 -1.143 -21.421 1.00 5.22 C ATOM 1990 CH2 TRP A 119 -20.717 -0.309 -22.450 1.00 60.21 C ATOM 0 H TRP A 119 -15.857 1.109 -16.491 1.00 42.12 H new ATOM 0 HA TRP A 119 -17.694 3.012 -17.643 1.00 54.23 H new ATOM 0 HB2 TRP A 119 -16.331 0.977 -18.686 1.00 30.33 H new ATOM 0 HB3 TRP A 119 -17.726 0.047 -18.175 1.00 30.33 H new ATOM 0 HD1 TRP A 119 -17.571 3.565 -19.886 1.00 45.04 H new ATOM 0 HE1 TRP A 119 -19.089 3.531 -21.982 1.00 25.15 H new ATOM 0 HE3 TRP A 119 -19.053 -1.320 -19.658 1.00 64.10 H new ATOM 0 HZ2 TRP A 119 -20.687 1.644 -23.320 1.00 63.43 H new ATOM 0 HZ3 TRP A 119 -20.584 -2.173 -21.388 1.00 5.22 H new ATOM 0 HH2 TRP A 119 -21.386 -0.709 -23.197 1.00 60.21 H new ATOM 2001 N GLN A 120 -18.722 0.756 -15.519 1.00 33.42 N ATOM 2002 CA GLN A 120 -19.861 0.321 -14.719 1.00 13.12 C ATOM 2003 C GLN A 120 -20.059 1.233 -13.513 1.00 11.43 C ATOM 2004 O GLN A 120 -21.001 2.025 -13.469 1.00 3.44 O ATOM 2005 CB GLN A 120 -19.664 -1.123 -14.254 1.00 40.22 C ATOM 2006 CG GLN A 120 -20.192 -2.156 -15.237 1.00 2.41 C ATOM 2007 CD GLN A 120 -20.245 -3.550 -14.645 1.00 75.30 C ATOM 2008 OE1 GLN A 120 -21.162 -3.883 -13.893 1.00 21.11 O ATOM 2009 NE2 GLN A 120 -19.261 -4.375 -14.982 1.00 70.13 N ATOM 0 H GLN A 120 -17.831 0.341 -15.246 1.00 33.42 H new ATOM 0 HA GLN A 120 -20.753 0.375 -15.343 1.00 13.12 H new ATOM 0 HB2 GLN A 120 -18.601 -1.301 -14.089 1.00 40.22 H new ATOM 0 HB3 GLN A 120 -20.163 -1.258 -13.294 1.00 40.22 H new ATOM 0 HG2 GLN A 120 -21.191 -1.865 -15.562 1.00 2.41 H new ATOM 0 HG3 GLN A 120 -19.558 -2.166 -16.124 1.00 2.41 H new ATOM 0 HE21 GLN A 120 -18.521 -4.057 -15.608 1.00 70.13 H new ATOM 0 HE22 GLN A 120 -19.245 -5.326 -14.615 1.00 70.13 H new ATOM 2018 N TYR A 121 -19.166 1.116 -12.536 1.00 52.32 N ATOM 2019 CA TYR A 121 -19.244 1.929 -11.328 1.00 32.41 C ATOM 2020 C TYR A 121 -17.905 2.597 -11.033 1.00 62.12 C ATOM 2021 O TYR A 121 -17.725 3.789 -11.284 1.00 20.03 O ATOM 2022 CB TYR A 121 -19.671 1.069 -10.137 1.00 22.21 C ATOM 2023 CG TYR A 121 -19.747 1.833 -8.835 1.00 0.34 C ATOM 2024 CD1 TYR A 121 -20.179 3.153 -8.805 1.00 52.32 C ATOM 2025 CD2 TYR A 121 -19.388 1.235 -7.633 1.00 65.21 C ATOM 2026 CE1 TYR A 121 -20.250 3.856 -7.618 1.00 24.43 C ATOM 2027 CE2 TYR A 121 -19.456 1.929 -6.441 1.00 31.03 C ATOM 2028 CZ TYR A 121 -19.887 3.239 -6.438 1.00 53.22 C ATOM 2029 OH TYR A 121 -19.957 3.935 -5.253 1.00 73.11 O ATOM 0 H TYR A 121 -18.380 0.466 -12.557 1.00 52.32 H new ATOM 0 HA TYR A 121 -19.989 2.708 -11.492 1.00 32.41 H new ATOM 0 HB2 TYR A 121 -20.646 0.629 -10.348 1.00 22.21 H new ATOM 0 HB3 TYR A 121 -18.967 0.244 -10.024 1.00 22.21 H new ATOM 0 HD1 TYR A 121 -20.465 3.638 -9.727 1.00 52.32 H new ATOM 0 HD2 TYR A 121 -19.050 0.209 -7.631 1.00 65.21 H new ATOM 0 HE1 TYR A 121 -20.587 4.882 -7.613 1.00 24.43 H new ATOM 0 HE2 TYR A 121 -19.173 1.448 -5.516 1.00 31.03 H new ATOM 0 HH TYR A 121 -19.668 3.357 -4.516 1.00 73.11 H new ATOM 2039 N ILE A 122 -16.968 1.820 -10.500 1.00 60.33 N ATOM 2040 CA ILE A 122 -15.644 2.335 -10.173 1.00 33.31 C ATOM 2041 C ILE A 122 -14.562 1.615 -10.970 1.00 23.21 C ATOM 2042 O ILE A 122 -13.514 2.186 -11.271 1.00 3.21 O ATOM 2043 CB ILE A 122 -15.340 2.191 -8.670 1.00 13.31 C ATOM 2044 CG1 ILE A 122 -16.370 2.964 -7.843 1.00 42.41 C ATOM 2045 CG2 ILE A 122 -13.933 2.681 -8.365 1.00 65.02 C ATOM 2046 CD1 ILE A 122 -16.340 2.624 -6.370 1.00 34.43 C ATOM 0 H ILE A 122 -17.101 0.832 -10.285 1.00 60.33 H new ATOM 0 HA ILE A 122 -15.643 3.393 -10.436 1.00 33.31 H new ATOM 0 HB ILE A 122 -15.403 1.137 -8.401 1.00 13.31 H new ATOM 0 HG12 ILE A 122 -16.193 4.033 -7.965 1.00 42.41 H new ATOM 0 HG13 ILE A 122 -17.366 2.759 -8.235 1.00 42.41 H new ATOM 0 HG21 ILE A 122 -13.733 2.573 -7.299 1.00 65.02 H new ATOM 0 HG22 ILE A 122 -13.212 2.092 -8.931 1.00 65.02 H new ATOM 0 HG23 ILE A 122 -13.844 3.730 -8.646 1.00 65.02 H new ATOM 0 HD11 ILE A 122 -17.096 3.209 -5.846 1.00 34.43 H new ATOM 0 HD12 ILE A 122 -16.547 1.562 -6.237 1.00 34.43 H new ATOM 0 HD13 ILE A 122 -15.356 2.856 -5.963 1.00 34.43 H new TER 2058 ILE A 122