USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 737 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 61 ASN : amide:sc= -4.5! C(o=-12!,f=-14!) USER MOD Set 1.2: A 73 GLN : amide:sc= -7.56! C(o=-12!,f=-13!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 2:sc= 0.849 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : A 30 HIS : no HD1:sc= -1.85 K(o=-1.9,f=-0.53) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= -0.037 USER MOD Single : A 38 THR OG1 : rot 55:sc= 0.202! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -4.12! C(o=-4.1!,f=-8!) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.738 K(o=-0.74,f=0.023) USER MOD Single : A 48 THR OG1 : rot -67:sc= 0.987 USER MOD Single : A 49 THR OG1 : rot 4:sc= -0.0682! USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 79:sc= 1.1 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.658 USER MOD Single : A 62 THR OG1 : rot 31:sc= 0.107 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc=-0.00633 X(o=-0.0063,f=0) USER MOD Single : A 69 THR OG1 : rot 149:sc= -0.823 USER MOD Single : A 74 SER OG : rot 143:sc= -0.495 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -5.81! C(o=-5.8!,f=-8.3!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -1.57! K(o=-1.6!,f=-0.25) USER MOD Single : A 95 THR OG1 : rot 139:sc= 1.04 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.123 USER MOD Single : A 98 ASN : amide:sc= -8.49! C(o=-8.5!,f=-10!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= -0.0232 X(o=-0.023,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.806 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -4.26! C(o=-4.3!,f=-3.3!) USER MOD Single : A 115 TYR OH : rot -69:sc= 0.457 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -0.321 X(o=-0.32,f=-0.078) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.141 K(o=-0.14,f=-0.73) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= -0.0132 X(o=-0.013,f=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 1.249 26.229 46.732 1.00 0.00 N ATOM 2 CA GLY A 15 1.772 25.315 45.732 1.00 0.00 C ATOM 3 C GLY A 15 1.204 25.633 44.347 1.00 0.00 C ATOM 4 O GLY A 15 0.114 26.193 44.234 1.00 0.00 O ATOM 0 HA2 GLY A 15 2.860 25.382 45.707 1.00 0.00 H new ATOM 0 HA3 GLY A 15 1.522 24.290 46.005 1.00 0.00 H new ATOM 8 N SER A 16 1.966 25.262 43.330 1.00 0.00 N ATOM 9 CA SER A 16 1.552 25.500 41.957 1.00 0.00 C ATOM 10 C SER A 16 1.950 24.314 41.077 1.00 0.00 C ATOM 11 O SER A 16 2.904 23.601 41.384 1.00 0.00 O ATOM 12 CB SER A 16 2.162 26.794 41.414 1.00 0.00 C ATOM 13 OG SER A 16 1.332 27.405 40.431 1.00 0.00 O ATOM 0 H SER A 16 2.869 24.798 43.428 1.00 0.00 H new ATOM 0 HA SER A 16 0.467 25.607 41.941 1.00 0.00 H new ATOM 0 HB2 SER A 16 2.323 27.491 42.236 1.00 0.00 H new ATOM 0 HB3 SER A 16 3.139 26.580 40.981 1.00 0.00 H new ATOM 0 HG SER A 16 1.756 28.229 40.111 1.00 0.00 H new ATOM 18 N GLY A 17 1.199 24.140 40.000 1.00 0.00 N ATOM 19 CA GLY A 17 1.461 23.053 39.072 1.00 0.00 C ATOM 20 C GLY A 17 0.614 23.196 37.806 1.00 0.00 C ATOM 21 O GLY A 17 -0.074 24.199 37.625 1.00 0.00 O ATOM 0 H GLY A 17 0.409 24.734 39.749 1.00 0.00 H new ATOM 0 HA2 GLY A 17 2.518 23.043 38.807 1.00 0.00 H new ATOM 0 HA3 GLY A 17 1.244 22.099 39.553 1.00 0.00 H new ATOM 25 N MET A 18 0.693 22.177 36.962 1.00 0.00 N ATOM 26 CA MET A 18 -0.058 22.176 35.718 1.00 0.00 C ATOM 27 C MET A 18 -0.609 20.782 35.412 1.00 0.00 C ATOM 28 O MET A 18 0.138 19.805 35.396 1.00 0.00 O ATOM 29 CB MET A 18 0.850 22.630 34.574 1.00 0.00 C ATOM 30 CG MET A 18 0.441 24.014 34.064 1.00 0.00 C ATOM 31 SD MET A 18 1.028 24.248 32.395 1.00 0.00 S ATOM 32 CE MET A 18 2.761 24.530 32.713 1.00 0.00 C ATOM 0 H MET A 18 1.265 21.347 37.115 1.00 0.00 H new ATOM 0 HA MET A 18 -0.898 22.863 35.821 1.00 0.00 H new ATOM 0 HB2 MET A 18 1.885 22.656 34.915 1.00 0.00 H new ATOM 0 HB3 MET A 18 0.801 21.909 33.758 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.644 24.116 34.094 1.00 0.00 H new ATOM 0 HG3 MET A 18 0.852 24.786 34.714 1.00 0.00 H new ATOM 0 HE1 MET A 18 3.282 24.696 31.770 1.00 0.00 H new ATOM 0 HE2 MET A 18 2.876 25.407 33.350 1.00 0.00 H new ATOM 0 HE3 MET A 18 3.185 23.660 33.214 1.00 0.00 H new ATOM 40 N LYS A 19 -1.913 20.735 35.175 1.00 0.00 N ATOM 41 CA LYS A 19 -2.572 19.478 34.869 1.00 0.00 C ATOM 42 C LYS A 19 -2.482 19.212 33.365 1.00 0.00 C ATOM 43 O LYS A 19 -3.496 19.217 32.668 1.00 0.00 O ATOM 44 CB LYS A 19 -4.004 19.479 35.409 1.00 0.00 C ATOM 45 CG LYS A 19 -4.036 19.049 36.877 1.00 0.00 C ATOM 46 CD LYS A 19 -5.280 18.209 37.176 1.00 0.00 C ATOM 47 CE LYS A 19 -4.894 16.797 37.622 1.00 0.00 C ATOM 48 NZ LYS A 19 -6.008 15.853 37.377 1.00 0.00 N ATOM 0 H LYS A 19 -2.529 21.548 35.189 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.067 18.652 35.369 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -4.434 20.476 35.309 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.621 18.805 34.815 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -3.140 18.474 37.111 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -4.025 19.930 37.518 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.870 18.692 37.955 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.909 18.154 36.287 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.006 16.469 37.082 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.639 16.801 38.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -5.729 14.900 37.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -6.846 16.159 37.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -6.232 15.837 36.362 1.00 0.00 H new ATOM 58 N GLU A 20 -1.259 18.986 32.908 1.00 0.00 N ATOM 59 CA GLU A 20 -1.024 18.719 31.499 1.00 0.00 C ATOM 60 C GLU A 20 -1.456 17.293 31.150 1.00 0.00 C ATOM 61 O GLU A 20 -1.774 16.502 32.037 1.00 0.00 O ATOM 62 CB GLU A 20 0.444 18.951 31.134 1.00 0.00 C ATOM 63 CG GLU A 20 0.754 20.446 31.040 1.00 0.00 C ATOM 64 CD GLU A 20 0.573 20.955 29.608 1.00 0.00 C ATOM 65 OE1 GLU A 20 1.079 20.268 28.694 1.00 0.00 O ATOM 66 OE2 GLU A 20 -0.067 22.019 29.460 1.00 0.00 O ATOM 0 H GLU A 20 -0.420 18.982 33.488 1.00 0.00 H new ATOM 0 HA GLU A 20 -1.625 19.414 30.913 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.087 18.489 31.883 1.00 0.00 H new ATOM 0 HB3 GLU A 20 0.667 18.469 30.182 1.00 0.00 H new ATOM 0 HG2 GLU A 20 0.099 21.000 31.712 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.777 20.630 31.369 1.00 0.00 H new ATOM 71 N THR A 21 -1.454 17.008 29.856 1.00 0.00 N ATOM 72 CA THR A 21 -1.841 15.691 29.378 1.00 0.00 C ATOM 73 C THR A 21 -1.155 15.384 28.047 1.00 0.00 C ATOM 74 O THR A 21 -1.758 15.529 26.985 1.00 0.00 O ATOM 75 CB THR A 21 -3.368 15.648 29.300 1.00 0.00 C ATOM 76 OG1 THR A 21 -3.784 15.514 30.656 1.00 0.00 O ATOM 77 CG2 THR A 21 -3.884 14.375 28.625 1.00 0.00 C ATOM 0 H THR A 21 -1.190 17.667 29.123 1.00 0.00 H new ATOM 0 HA THR A 21 -1.514 14.909 30.063 1.00 0.00 H new ATOM 0 HB THR A 21 -3.727 16.521 28.754 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.998 15.519 31.241 1.00 0.00 H new ATOM 0 HG21 THR A 21 -4.973 14.395 28.595 1.00 0.00 H new ATOM 0 HG22 THR A 21 -3.494 14.319 27.609 1.00 0.00 H new ATOM 0 HG23 THR A 21 -3.552 13.504 29.190 1.00 0.00 H new ATOM 85 N ALA A 22 0.099 14.964 28.147 1.00 0.00 N ATOM 86 CA ALA A 22 0.873 14.635 26.963 1.00 0.00 C ATOM 87 C ALA A 22 0.491 13.232 26.482 1.00 0.00 C ATOM 88 O ALA A 22 1.347 12.357 26.368 1.00 0.00 O ATOM 89 CB ALA A 22 2.365 14.755 27.280 1.00 0.00 C ATOM 0 H ALA A 22 0.597 14.844 29.029 1.00 0.00 H new ATOM 0 HA ALA A 22 0.653 15.332 26.155 1.00 0.00 H new ATOM 0 HB1 ALA A 22 2.947 14.508 26.392 1.00 0.00 H new ATOM 0 HB2 ALA A 22 2.590 15.776 27.589 1.00 0.00 H new ATOM 0 HB3 ALA A 22 2.622 14.067 28.085 1.00 0.00 H new ATOM 95 N ALA A 23 -0.795 13.065 26.212 1.00 0.00 N ATOM 96 CA ALA A 23 -1.301 11.785 25.746 1.00 0.00 C ATOM 97 C ALA A 23 -2.754 11.950 25.294 1.00 0.00 C ATOM 98 O ALA A 23 -3.340 13.020 25.454 1.00 0.00 O ATOM 99 CB ALA A 23 -1.151 10.743 26.855 1.00 0.00 C ATOM 0 H ALA A 23 -1.502 13.794 26.307 1.00 0.00 H new ATOM 0 HA ALA A 23 -0.727 11.434 24.889 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -1.531 9.783 26.506 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.098 10.643 27.120 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.717 11.060 27.731 1.00 0.00 H new ATOM 105 N ALA A 24 -3.292 10.875 24.738 1.00 0.00 N ATOM 106 CA ALA A 24 -4.665 10.887 24.261 1.00 0.00 C ATOM 107 C ALA A 24 -4.797 11.905 23.126 1.00 0.00 C ATOM 108 O ALA A 24 -4.261 13.008 23.211 1.00 0.00 O ATOM 109 CB ALA A 24 -5.608 11.189 25.427 1.00 0.00 C ATOM 0 H ALA A 24 -2.803 9.990 24.607 1.00 0.00 H new ATOM 0 HA ALA A 24 -4.941 9.911 23.863 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -6.638 11.198 25.069 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.497 10.422 26.193 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -5.363 12.163 25.851 1.00 0.00 H new ATOM 115 N LYS A 25 -5.514 11.497 22.089 1.00 0.00 N ATOM 116 CA LYS A 25 -5.724 12.359 20.939 1.00 0.00 C ATOM 117 C LYS A 25 -6.631 13.525 21.338 1.00 0.00 C ATOM 118 O LYS A 25 -7.120 13.577 22.466 1.00 0.00 O ATOM 119 CB LYS A 25 -6.249 11.549 19.751 1.00 0.00 C ATOM 120 CG LYS A 25 -7.731 11.215 19.928 1.00 0.00 C ATOM 121 CD LYS A 25 -7.915 10.019 20.865 1.00 0.00 C ATOM 122 CE LYS A 25 -9.124 9.178 20.451 1.00 0.00 C ATOM 123 NZ LYS A 25 -9.578 8.332 21.576 1.00 0.00 N ATOM 0 H LYS A 25 -5.957 10.581 22.022 1.00 0.00 H new ATOM 0 HA LYS A 25 -4.779 12.790 20.609 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.107 12.114 18.830 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.674 10.628 19.652 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.257 12.081 20.330 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.176 10.994 18.958 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.017 9.402 20.853 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.046 10.371 21.888 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.935 9.831 20.129 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.863 8.550 19.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.399 7.768 21.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.808 7.696 21.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.847 8.936 22.378 1.00 0.00 H new ATOM 133 N PHE A 26 -6.830 14.430 20.392 1.00 0.00 N ATOM 134 CA PHE A 26 -7.670 15.591 20.631 1.00 0.00 C ATOM 135 C PHE A 26 -8.969 15.504 19.826 1.00 0.00 C ATOM 136 O PHE A 26 -9.095 14.664 18.936 1.00 0.00 O ATOM 137 CB PHE A 26 -6.880 16.817 20.171 1.00 0.00 C ATOM 138 CG PHE A 26 -5.741 17.212 21.113 1.00 0.00 C ATOM 139 CD1 PHE A 26 -6.012 17.557 22.401 1.00 0.00 C ATOM 140 CD2 PHE A 26 -4.458 17.220 20.663 1.00 0.00 C ATOM 141 CE1 PHE A 26 -4.954 17.924 23.275 1.00 0.00 C ATOM 142 CE2 PHE A 26 -3.400 17.587 21.537 1.00 0.00 C ATOM 143 CZ PHE A 26 -3.671 17.931 22.825 1.00 0.00 C ATOM 0 H PHE A 26 -6.424 14.383 19.458 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.932 15.649 21.687 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -6.468 16.621 19.181 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -7.563 17.660 20.070 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.031 17.552 22.759 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -4.243 16.947 19.640 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.169 18.198 24.297 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -2.381 17.593 21.179 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.867 18.210 23.490 1.00 0.00 H new ATOM 152 N GLU A 27 -9.899 16.383 20.167 1.00 0.00 N ATOM 153 CA GLU A 27 -11.182 16.416 19.486 1.00 0.00 C ATOM 154 C GLU A 27 -11.567 17.858 19.148 1.00 0.00 C ATOM 155 O GLU A 27 -11.535 18.732 20.013 1.00 0.00 O ATOM 156 CB GLU A 27 -12.267 15.743 20.328 1.00 0.00 C ATOM 157 CG GLU A 27 -12.349 16.371 21.721 1.00 0.00 C ATOM 158 CD GLU A 27 -13.802 16.475 22.192 1.00 0.00 C ATOM 159 OE1 GLU A 27 -14.553 15.510 21.930 1.00 0.00 O ATOM 160 OE2 GLU A 27 -14.127 17.515 22.803 1.00 0.00 O ATOM 0 H GLU A 27 -9.790 17.078 20.906 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.091 15.857 18.555 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.230 15.835 19.827 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -12.054 14.678 20.417 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -11.776 15.771 22.428 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -11.897 17.363 21.704 1.00 0.00 H new ATOM 165 N ARG A 28 -11.922 18.062 17.888 1.00 0.00 N ATOM 166 CA ARG A 28 -12.312 19.383 17.424 1.00 0.00 C ATOM 167 C ARG A 28 -11.331 20.437 17.941 1.00 0.00 C ATOM 168 O ARG A 28 -11.628 21.151 18.897 1.00 0.00 O ATOM 169 CB ARG A 28 -13.724 19.736 17.895 1.00 0.00 C ATOM 170 CG ARG A 28 -14.779 19.150 16.952 1.00 0.00 C ATOM 171 CD ARG A 28 -16.188 19.558 17.386 1.00 0.00 C ATOM 172 NE ARG A 28 -17.102 18.398 17.292 1.00 0.00 N ATOM 173 CZ ARG A 28 -18.399 18.435 17.624 1.00 0.00 C ATOM 174 NH1 ARG A 28 -18.944 19.574 18.073 1.00 0.00 N ATOM 175 NH2 ARG A 28 -19.152 17.333 17.506 1.00 0.00 N ATOM 0 H ARG A 28 -11.948 17.334 17.174 1.00 0.00 H new ATOM 0 HA ARG A 28 -12.297 19.371 16.334 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -13.881 19.355 18.904 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -13.835 20.819 17.943 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -14.594 19.494 15.934 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -14.698 18.063 16.941 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -16.168 19.934 18.409 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -16.551 20.370 16.755 1.00 0.00 H new ATOM 0 HE ARG A 28 -16.720 17.515 16.953 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -18.371 20.413 18.162 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -19.932 19.602 18.326 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -18.737 16.466 17.163 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -20.140 17.361 17.759 1.00 0.00 H new ATOM 186 N GLN A 29 -10.182 20.501 17.285 1.00 0.00 N ATOM 187 CA GLN A 29 -9.156 21.457 17.666 1.00 0.00 C ATOM 188 C GLN A 29 -8.862 22.412 16.507 1.00 0.00 C ATOM 189 O GLN A 29 -8.770 23.622 16.703 1.00 0.00 O ATOM 190 CB GLN A 29 -7.883 20.741 18.122 1.00 0.00 C ATOM 191 CG GLN A 29 -6.781 21.747 18.463 1.00 0.00 C ATOM 192 CD GLN A 29 -5.772 21.143 19.443 1.00 0.00 C ATOM 193 OE1 GLN A 29 -5.309 20.025 19.286 1.00 0.00 O ATOM 194 NE2 GLN A 29 -5.457 21.943 20.457 1.00 0.00 N ATOM 0 H GLN A 29 -9.939 19.907 16.492 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.527 22.042 18.507 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.101 20.125 18.994 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.537 20.070 17.336 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.269 22.054 17.551 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.224 22.643 18.897 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.882 22.868 20.528 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.790 21.632 21.164 1.00 0.00 H new ATOM 201 N HIS A 30 -8.724 21.831 15.324 1.00 0.00 N ATOM 202 CA HIS A 30 -8.444 22.614 14.134 1.00 0.00 C ATOM 203 C HIS A 30 -9.629 23.534 13.834 1.00 0.00 C ATOM 204 O HIS A 30 -10.552 23.646 14.639 1.00 0.00 O ATOM 205 CB HIS A 30 -8.087 21.705 12.956 1.00 0.00 C ATOM 206 CG HIS A 30 -9.186 20.748 12.564 1.00 0.00 C ATOM 207 ND1 HIS A 30 -9.060 19.850 11.518 1.00 0.00 N ATOM 208 CD2 HIS A 30 -10.430 20.555 13.089 1.00 0.00 C ATOM 209 CE1 HIS A 30 -10.185 19.155 11.426 1.00 0.00 C ATOM 210 NE2 HIS A 30 -11.032 19.594 12.401 1.00 0.00 N ATOM 0 H HIS A 30 -8.801 20.826 15.165 1.00 0.00 H new ATOM 0 HA HIS A 30 -7.573 23.245 14.308 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -7.835 22.325 12.096 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -7.194 21.133 13.209 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -10.853 21.094 13.924 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -10.394 18.378 10.706 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -11.974 19.241 12.573 1.00 0.00 H new ATOM 217 N MET A 31 -9.565 24.170 12.673 1.00 0.00 N ATOM 218 CA MET A 31 -10.621 25.076 12.256 1.00 0.00 C ATOM 219 C MET A 31 -10.423 25.520 10.805 1.00 0.00 C ATOM 220 O MET A 31 -10.762 26.647 10.446 1.00 0.00 O ATOM 221 CB MET A 31 -10.631 26.303 13.170 1.00 0.00 C ATOM 222 CG MET A 31 -11.827 26.269 14.122 1.00 0.00 C ATOM 223 SD MET A 31 -11.431 27.138 15.631 1.00 0.00 S ATOM 224 CE MET A 31 -12.187 28.717 15.287 1.00 0.00 C ATOM 0 H MET A 31 -8.797 24.075 12.008 1.00 0.00 H new ATOM 0 HA MET A 31 -11.574 24.551 12.327 1.00 0.00 H new ATOM 0 HB2 MET A 31 -9.706 26.340 13.745 1.00 0.00 H new ATOM 0 HB3 MET A 31 -10.668 27.210 12.566 1.00 0.00 H new ATOM 0 HG2 MET A 31 -12.694 26.726 13.646 1.00 0.00 H new ATOM 0 HG3 MET A 31 -12.094 25.236 14.347 1.00 0.00 H new ATOM 0 HE1 MET A 31 -12.033 29.386 16.133 1.00 0.00 H new ATOM 0 HE2 MET A 31 -11.735 29.150 14.395 1.00 0.00 H new ATOM 0 HE3 MET A 31 -13.256 28.580 15.122 1.00 0.00 H new ATOM 232 N ASP A 32 -9.874 24.612 10.012 1.00 0.00 N ATOM 233 CA ASP A 32 -9.626 24.896 8.609 1.00 0.00 C ATOM 234 C ASP A 32 -9.888 23.635 7.784 1.00 0.00 C ATOM 235 O ASP A 32 -9.367 23.493 6.679 1.00 0.00 O ATOM 236 CB ASP A 32 -8.173 25.318 8.381 1.00 0.00 C ATOM 237 CG ASP A 32 -7.979 26.784 7.987 1.00 0.00 C ATOM 238 OD1 ASP A 32 -7.893 27.614 8.917 1.00 0.00 O ATOM 239 OD2 ASP A 32 -7.922 27.041 6.765 1.00 0.00 O ATOM 0 H ASP A 32 -9.594 23.679 10.314 1.00 0.00 H new ATOM 0 HA ASP A 32 -10.288 25.707 8.307 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.607 25.124 9.292 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.746 24.688 7.601 1.00 0.00 H new ATOM 243 N SER A 33 -10.695 22.751 8.352 1.00 0.00 N ATOM 244 CA SER A 33 -11.031 21.506 7.683 1.00 0.00 C ATOM 245 C SER A 33 -12.462 21.094 8.035 1.00 0.00 C ATOM 246 O SER A 33 -12.980 21.468 9.086 1.00 0.00 O ATOM 247 CB SER A 33 -10.051 20.394 8.062 1.00 0.00 C ATOM 248 OG SER A 33 -8.700 20.846 8.047 1.00 0.00 O ATOM 0 H SER A 33 -11.126 22.872 9.268 1.00 0.00 H new ATOM 0 HA SER A 33 -10.958 21.665 6.607 1.00 0.00 H new ATOM 0 HB2 SER A 33 -10.296 20.017 9.055 1.00 0.00 H new ATOM 0 HB3 SER A 33 -10.162 19.561 7.368 1.00 0.00 H new ATOM 0 HG SER A 33 -8.105 20.108 8.296 1.00 0.00 H new ATOM 253 N PRO A 34 -13.077 20.308 7.110 1.00 0.00 N ATOM 254 CA PRO A 34 -14.438 19.841 7.312 1.00 0.00 C ATOM 255 C PRO A 34 -14.484 18.717 8.349 1.00 0.00 C ATOM 256 O PRO A 34 -13.542 18.539 9.119 1.00 0.00 O ATOM 257 CB PRO A 34 -14.911 19.399 5.937 1.00 0.00 C ATOM 258 CG PRO A 34 -13.652 19.200 5.108 1.00 0.00 C ATOM 259 CD PRO A 34 -12.496 19.845 5.854 1.00 0.00 C ATOM 0 HA PRO A 34 -15.092 20.615 7.714 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -15.487 18.476 6.000 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -15.560 20.150 5.487 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -13.461 18.138 4.953 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -13.769 19.650 4.122 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -11.691 19.132 6.030 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -12.071 20.672 5.286 1.00 0.00 H new ATOM 264 N ASP A 35 -15.590 17.987 8.335 1.00 0.00 N ATOM 265 CA ASP A 35 -15.771 16.885 9.265 1.00 0.00 C ATOM 266 C ASP A 35 -14.462 16.102 9.382 1.00 0.00 C ATOM 267 O ASP A 35 -13.800 15.839 8.379 1.00 0.00 O ATOM 268 CB ASP A 35 -16.855 15.923 8.774 1.00 0.00 C ATOM 269 CG ASP A 35 -18.140 16.593 8.284 1.00 0.00 C ATOM 270 OD1 ASP A 35 -18.112 17.113 7.148 1.00 0.00 O ATOM 271 OD2 ASP A 35 -19.122 16.570 9.058 1.00 0.00 O ATOM 0 H ASP A 35 -16.370 18.137 7.695 1.00 0.00 H new ATOM 0 HA ASP A 35 -16.067 17.301 10.228 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -16.445 15.321 7.963 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -17.106 15.238 9.584 1.00 0.00 H new ATOM 275 N LEU A 36 -14.127 15.752 10.615 1.00 0.00 N ATOM 276 CA LEU A 36 -12.909 15.003 10.876 1.00 0.00 C ATOM 277 C LEU A 36 -13.248 13.519 11.022 1.00 0.00 C ATOM 278 O LEU A 36 -12.977 12.915 12.059 1.00 0.00 O ATOM 279 CB LEU A 36 -12.171 15.587 12.083 1.00 0.00 C ATOM 280 CG LEU A 36 -10.872 14.882 12.479 1.00 0.00 C ATOM 281 CD1 LEU A 36 -9.676 15.474 11.731 1.00 0.00 C ATOM 282 CD2 LEU A 36 -10.673 14.913 13.996 1.00 0.00 C ATOM 0 H LEU A 36 -14.678 15.973 11.445 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.220 15.091 10.036 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -11.945 16.633 11.875 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -12.846 15.571 12.939 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.948 13.835 12.185 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -8.766 14.955 12.031 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.824 15.356 10.657 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -9.585 16.533 11.971 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.743 14.405 14.251 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.627 15.948 14.336 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.507 14.408 14.483 1.00 0.00 H new ATOM 293 N GLY A 37 -13.837 12.973 9.968 1.00 0.00 N ATOM 294 CA GLY A 37 -14.216 11.571 9.965 1.00 0.00 C ATOM 295 C GLY A 37 -12.986 10.670 9.827 1.00 0.00 C ATOM 296 O GLY A 37 -12.677 10.200 8.733 1.00 0.00 O ATOM 0 H GLY A 37 -14.061 13.477 9.110 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -14.745 11.332 10.888 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -14.906 11.379 9.143 1.00 0.00 H new ATOM 300 N THR A 38 -12.319 10.457 10.950 1.00 0.00 N ATOM 301 CA THR A 38 -11.131 9.622 10.969 1.00 0.00 C ATOM 302 C THR A 38 -10.192 10.006 9.823 1.00 0.00 C ATOM 303 O THR A 38 -10.423 10.996 9.132 1.00 0.00 O ATOM 304 CB THR A 38 -11.580 8.160 10.923 1.00 0.00 C ATOM 305 OG1 THR A 38 -10.361 7.421 10.954 1.00 0.00 O ATOM 306 CG2 THR A 38 -12.210 7.782 9.580 1.00 0.00 C ATOM 0 H THR A 38 -12.579 10.849 11.855 1.00 0.00 H new ATOM 0 HA THR A 38 -10.556 9.772 11.883 1.00 0.00 H new ATOM 0 HB THR A 38 -12.295 7.975 11.724 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.835 7.691 11.736 1.00 0.00 H new ATOM 0 HG21 THR A 38 -12.511 6.735 9.601 1.00 0.00 H new ATOM 0 HG22 THR A 38 -13.085 8.407 9.400 1.00 0.00 H new ATOM 0 HG23 THR A 38 -11.484 7.935 8.782 1.00 0.00 H new ATOM 314 N THR A 39 -9.152 9.202 9.659 1.00 0.00 N ATOM 315 CA THR A 39 -8.177 9.444 8.608 1.00 0.00 C ATOM 316 C THR A 39 -8.622 8.781 7.304 1.00 0.00 C ATOM 317 O THR A 39 -8.336 7.606 7.072 1.00 0.00 O ATOM 318 CB THR A 39 -6.815 8.956 9.106 1.00 0.00 C ATOM 319 OG1 THR A 39 -6.376 9.989 9.985 1.00 0.00 O ATOM 320 CG2 THR A 39 -5.760 8.935 7.998 1.00 0.00 C ATOM 0 H THR A 39 -8.963 8.382 10.236 1.00 0.00 H new ATOM 0 HA THR A 39 -8.094 10.507 8.382 1.00 0.00 H new ATOM 0 HB THR A 39 -6.919 7.956 9.527 1.00 0.00 H new ATOM 0 HG1 THR A 39 -5.500 9.753 10.355 1.00 0.00 H new ATOM 0 HG21 THR A 39 -4.813 8.581 8.404 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.084 8.268 7.200 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.631 9.941 7.600 1.00 0.00 H new ATOM 328 N LEU A 40 -9.313 9.560 6.486 1.00 0.00 N ATOM 329 CA LEU A 40 -9.800 9.063 5.210 1.00 0.00 C ATOM 330 C LEU A 40 -8.689 8.268 4.521 1.00 0.00 C ATOM 331 O LEU A 40 -7.508 8.555 4.706 1.00 0.00 O ATOM 332 CB LEU A 40 -10.350 10.210 4.362 1.00 0.00 C ATOM 333 CG LEU A 40 -9.328 11.245 3.887 1.00 0.00 C ATOM 334 CD1 LEU A 40 -9.673 11.753 2.486 1.00 0.00 C ATOM 335 CD2 LEU A 40 -9.195 12.388 4.896 1.00 0.00 C ATOM 0 H LEU A 40 -9.548 10.533 6.682 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.636 8.380 5.361 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -10.840 9.785 3.486 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -11.118 10.726 4.939 1.00 0.00 H new ATOM 0 HG LEU A 40 -8.354 10.759 3.822 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.931 12.487 2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.675 10.917 1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.659 12.217 2.500 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.463 13.109 4.534 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.160 12.880 5.017 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.868 11.989 5.856 1.00 0.00 H new ATOM 346 N LEU A 41 -9.108 7.281 3.741 1.00 0.00 N ATOM 347 CA LEU A 41 -8.163 6.442 3.024 1.00 0.00 C ATOM 348 C LEU A 41 -8.025 6.951 1.587 1.00 0.00 C ATOM 349 O LEU A 41 -7.436 6.280 0.741 1.00 0.00 O ATOM 350 CB LEU A 41 -8.574 4.972 3.118 1.00 0.00 C ATOM 351 CG LEU A 41 -10.052 4.670 2.857 1.00 0.00 C ATOM 352 CD1 LEU A 41 -10.212 3.416 1.996 1.00 0.00 C ATOM 353 CD2 LEU A 41 -10.830 4.565 4.171 1.00 0.00 C ATOM 0 H LEU A 41 -10.089 7.044 3.590 1.00 0.00 H new ATOM 0 HA LEU A 41 -7.175 6.503 3.481 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.976 4.402 2.407 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -8.319 4.607 4.113 1.00 0.00 H new ATOM 0 HG LEU A 41 -10.477 5.502 2.296 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -11.271 3.224 1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.712 3.565 1.039 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.767 2.563 2.509 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.877 4.350 3.958 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -10.411 3.763 4.779 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.756 5.507 4.714 1.00 0.00 H new ATOM 364 N GLU A 42 -8.577 8.133 1.356 1.00 0.00 N ATOM 365 CA GLU A 42 -8.522 8.740 0.037 1.00 0.00 C ATOM 366 C GLU A 42 -7.792 10.083 0.101 1.00 0.00 C ATOM 367 O GLU A 42 -8.005 10.949 -0.747 1.00 0.00 O ATOM 368 CB GLU A 42 -9.926 8.905 -0.549 1.00 0.00 C ATOM 369 CG GLU A 42 -9.950 8.522 -2.030 1.00 0.00 C ATOM 370 CD GLU A 42 -11.369 8.163 -2.480 1.00 0.00 C ATOM 371 OE1 GLU A 42 -11.990 7.329 -1.788 1.00 0.00 O ATOM 372 OE2 GLU A 42 -11.799 8.733 -3.506 1.00 0.00 O ATOM 0 H GLU A 42 -9.065 8.687 2.060 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.964 8.077 -0.624 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -10.630 8.282 0.003 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -10.254 9.938 -0.431 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.573 9.350 -2.630 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -9.285 7.676 -2.201 1.00 0.00 H new ATOM 377 N GLN A 43 -6.948 10.214 1.113 1.00 0.00 N ATOM 378 CA GLN A 43 -6.185 11.437 1.298 1.00 0.00 C ATOM 379 C GLN A 43 -5.726 11.985 -0.055 1.00 0.00 C ATOM 380 O GLN A 43 -6.254 12.988 -0.534 1.00 0.00 O ATOM 381 CB GLN A 43 -4.994 11.205 2.228 1.00 0.00 C ATOM 382 CG GLN A 43 -4.724 12.439 3.092 1.00 0.00 C ATOM 383 CD GLN A 43 -5.825 12.627 4.138 1.00 0.00 C ATOM 384 OE1 GLN A 43 -6.711 13.454 4.002 1.00 0.00 O ATOM 385 NE2 GLN A 43 -5.720 11.816 5.186 1.00 0.00 N ATOM 0 H GLN A 43 -6.775 9.493 1.814 1.00 0.00 H new ATOM 0 HA GLN A 43 -6.831 12.178 1.768 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -5.190 10.345 2.868 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -4.108 10.969 1.638 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -3.759 12.336 3.589 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -4.664 13.324 2.459 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -4.953 11.146 5.237 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -6.407 11.864 5.939 1.00 0.00 H new ATOM 392 N TYR A 44 -4.748 11.304 -0.632 1.00 0.00 N ATOM 393 CA TYR A 44 -4.211 11.710 -1.920 1.00 0.00 C ATOM 394 C TYR A 44 -4.893 10.954 -3.062 1.00 0.00 C ATOM 395 O TYR A 44 -5.635 10.002 -2.825 1.00 0.00 O ATOM 396 CB TYR A 44 -2.727 11.341 -1.895 1.00 0.00 C ATOM 397 CG TYR A 44 -1.931 12.039 -0.789 1.00 0.00 C ATOM 398 CD1 TYR A 44 -1.492 13.334 -0.968 1.00 0.00 C ATOM 399 CD2 TYR A 44 -1.654 11.372 0.386 1.00 0.00 C ATOM 400 CE1 TYR A 44 -0.743 13.991 0.072 1.00 0.00 C ATOM 401 CE2 TYR A 44 -0.905 12.028 1.427 1.00 0.00 C ATOM 402 CZ TYR A 44 -0.487 13.305 1.219 1.00 0.00 C ATOM 403 OH TYR A 44 0.221 13.925 2.201 1.00 0.00 O ATOM 0 H TYR A 44 -4.313 10.473 -0.231 1.00 0.00 H new ATOM 0 HA TYR A 44 -4.374 12.775 -2.084 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -2.633 10.262 -1.771 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -2.285 11.590 -2.860 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -1.710 13.856 -1.888 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -1.999 10.358 0.526 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -0.393 15.005 -0.055 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -0.681 11.517 2.352 1.00 0.00 H new ATOM 0 HH TYR A 44 0.327 13.316 2.962 1.00 0.00 H new ATOM 412 N CYS A 45 -4.618 11.407 -4.277 1.00 0.00 N ATOM 413 CA CYS A 45 -5.195 10.784 -5.456 1.00 0.00 C ATOM 414 C CYS A 45 -6.715 10.957 -5.395 1.00 0.00 C ATOM 415 O CYS A 45 -7.343 10.609 -4.397 1.00 0.00 O ATOM 416 CB CYS A 45 -4.794 9.312 -5.573 1.00 0.00 C ATOM 417 SG CYS A 45 -3.182 8.894 -4.814 1.00 0.00 S ATOM 0 H CYS A 45 -4.003 12.198 -4.470 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.809 11.270 -6.352 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -5.568 8.701 -5.108 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -4.764 9.041 -6.628 1.00 0.00 H new ATOM 421 N HIS A 46 -7.260 11.495 -6.477 1.00 0.00 N ATOM 422 CA HIS A 46 -8.693 11.720 -6.559 1.00 0.00 C ATOM 423 C HIS A 46 -9.071 12.096 -7.993 1.00 0.00 C ATOM 424 O HIS A 46 -8.656 13.139 -8.495 1.00 0.00 O ATOM 425 CB HIS A 46 -9.140 12.765 -5.533 1.00 0.00 C ATOM 426 CG HIS A 46 -10.595 12.659 -5.144 1.00 0.00 C ATOM 427 ND1 HIS A 46 -11.203 13.546 -4.273 1.00 0.00 N ATOM 428 CD2 HIS A 46 -11.554 11.764 -5.516 1.00 0.00 C ATOM 429 CE1 HIS A 46 -12.472 13.191 -4.134 1.00 0.00 C ATOM 430 NE2 HIS A 46 -12.688 12.086 -4.904 1.00 0.00 N ATOM 0 H HIS A 46 -6.735 11.781 -7.303 1.00 0.00 H new ATOM 0 HA HIS A 46 -9.224 10.802 -6.309 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -8.527 12.666 -4.637 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -8.954 13.760 -5.938 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -11.415 10.934 -6.193 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -13.207 13.689 -3.519 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -13.574 11.589 -4.995 1.00 0.00 H new ATOM 437 N ARG A 47 -9.856 11.226 -8.612 1.00 0.00 N ATOM 438 CA ARG A 47 -10.296 11.455 -9.977 1.00 0.00 C ATOM 439 C ARG A 47 -11.790 11.782 -10.007 1.00 0.00 C ATOM 440 O ARG A 47 -12.368 11.966 -11.077 1.00 0.00 O ATOM 441 CB ARG A 47 -10.033 10.228 -10.853 1.00 0.00 C ATOM 442 CG ARG A 47 -10.859 9.030 -10.381 1.00 0.00 C ATOM 443 CD ARG A 47 -10.730 7.857 -11.356 1.00 0.00 C ATOM 444 NE ARG A 47 -11.243 8.248 -12.688 1.00 0.00 N ATOM 445 CZ ARG A 47 -11.041 7.540 -13.808 1.00 0.00 C ATOM 446 NH1 ARG A 47 -10.334 6.402 -13.763 1.00 0.00 N ATOM 447 NH2 ARG A 47 -11.543 7.970 -14.972 1.00 0.00 N ATOM 0 H ARG A 47 -10.198 10.361 -8.193 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.728 12.298 -10.370 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.279 10.458 -11.890 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -8.973 9.977 -10.825 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -10.526 8.722 -9.390 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -11.906 9.319 -10.290 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.687 7.551 -11.434 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -11.286 6.998 -10.980 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.784 9.110 -12.758 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -9.950 6.075 -12.876 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -10.180 5.863 -14.615 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -12.079 8.837 -15.007 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.389 7.431 -15.824 1.00 0.00 H new ATOM 458 N THR A 48 -12.373 11.844 -8.818 1.00 0.00 N ATOM 459 CA THR A 48 -13.789 12.146 -8.694 1.00 0.00 C ATOM 460 C THR A 48 -14.605 11.286 -9.662 1.00 0.00 C ATOM 461 O THR A 48 -15.430 11.802 -10.413 1.00 0.00 O ATOM 462 CB THR A 48 -13.974 13.649 -8.914 1.00 0.00 C ATOM 463 OG1 THR A 48 -15.384 13.841 -8.832 1.00 0.00 O ATOM 464 CG2 THR A 48 -13.621 14.079 -10.339 1.00 0.00 C ATOM 0 H THR A 48 -11.890 11.690 -7.933 1.00 0.00 H new ATOM 0 HA THR A 48 -14.159 11.901 -7.699 1.00 0.00 H new ATOM 0 HB THR A 48 -13.355 14.199 -8.205 1.00 0.00 H new ATOM 0 HG1 THR A 48 -15.819 13.403 -9.593 1.00 0.00 H new ATOM 0 HG21 THR A 48 -13.770 15.154 -10.442 1.00 0.00 H new ATOM 0 HG22 THR A 48 -12.579 13.835 -10.545 1.00 0.00 H new ATOM 0 HG23 THR A 48 -14.263 13.555 -11.047 1.00 0.00 H new ATOM 472 N THR A 49 -14.345 9.987 -9.612 1.00 0.00 N ATOM 473 CA THR A 49 -15.045 9.051 -10.475 1.00 0.00 C ATOM 474 C THR A 49 -15.250 9.657 -11.865 1.00 0.00 C ATOM 475 O THR A 49 -14.506 10.548 -12.274 1.00 0.00 O ATOM 476 CB THR A 49 -16.351 8.657 -9.784 1.00 0.00 C ATOM 477 OG1 THR A 49 -17.138 9.844 -9.828 1.00 0.00 O ATOM 478 CG2 THR A 49 -16.166 8.388 -8.289 1.00 0.00 C ATOM 0 H THR A 49 -13.660 9.561 -8.988 1.00 0.00 H new ATOM 0 HA THR A 49 -14.459 8.146 -10.634 1.00 0.00 H new ATOM 0 HB THR A 49 -16.761 7.769 -10.264 1.00 0.00 H new ATOM 0 HG1 THR A 49 -16.662 10.534 -10.335 1.00 0.00 H new ATOM 0 HG21 THR A 49 -17.124 8.112 -7.848 1.00 0.00 H new ATOM 0 HG22 THR A 49 -15.455 7.573 -8.151 1.00 0.00 H new ATOM 0 HG23 THR A 49 -15.787 9.286 -7.802 1.00 0.00 H new ATOM 486 N ILE A 50 -16.263 9.151 -12.553 1.00 0.00 N ATOM 487 CA ILE A 50 -16.575 9.631 -13.888 1.00 0.00 C ATOM 488 C ILE A 50 -17.473 10.866 -13.783 1.00 0.00 C ATOM 489 O ILE A 50 -17.084 11.957 -14.196 1.00 0.00 O ATOM 490 CB ILE A 50 -17.173 8.506 -14.736 1.00 0.00 C ATOM 491 CG1 ILE A 50 -16.082 7.554 -15.231 1.00 0.00 C ATOM 492 CG2 ILE A 50 -18.007 9.071 -15.887 1.00 0.00 C ATOM 493 CD1 ILE A 50 -14.894 8.332 -15.802 1.00 0.00 C ATOM 0 H ILE A 50 -16.878 8.413 -12.211 1.00 0.00 H new ATOM 0 HA ILE A 50 -15.666 9.939 -14.405 1.00 0.00 H new ATOM 0 HB ILE A 50 -17.846 7.924 -14.107 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -15.746 6.921 -14.409 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -16.490 6.893 -15.996 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -18.420 8.251 -16.474 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -18.820 9.675 -15.485 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -17.376 9.690 -16.524 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -14.133 7.632 -16.147 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.229 8.945 -16.639 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -14.473 8.973 -15.028 1.00 0.00 H new ATOM 504 N GLY A 51 -18.657 10.651 -13.229 1.00 0.00 N ATOM 505 CA GLY A 51 -19.613 11.734 -13.065 1.00 0.00 C ATOM 506 C GLY A 51 -20.838 11.268 -12.274 1.00 0.00 C ATOM 507 O GLY A 51 -20.874 10.139 -11.788 1.00 0.00 O ATOM 0 H GLY A 51 -18.976 9.744 -12.888 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -19.138 12.568 -12.549 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -19.925 12.100 -14.043 1.00 0.00 H new ATOM 511 N ASN A 52 -21.809 12.163 -12.169 1.00 0.00 N ATOM 512 CA ASN A 52 -23.031 11.859 -11.446 1.00 0.00 C ATOM 513 C ASN A 52 -22.680 11.165 -10.128 1.00 0.00 C ATOM 514 O ASN A 52 -23.475 10.392 -9.597 1.00 0.00 O ATOM 515 CB ASN A 52 -23.928 10.915 -12.251 1.00 0.00 C ATOM 516 CG ASN A 52 -24.526 11.631 -13.464 1.00 0.00 C ATOM 517 OD1 ASN A 52 -23.866 11.876 -14.460 1.00 0.00 O ATOM 518 ND2 ASN A 52 -25.810 11.949 -13.326 1.00 0.00 N ATOM 0 H ASN A 52 -21.774 13.099 -12.573 1.00 0.00 H new ATOM 0 HA ASN A 52 -23.559 12.796 -11.269 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -23.350 10.052 -12.582 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -24.729 10.538 -11.615 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -26.301 12.427 -14.081 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -26.304 11.714 -12.465 1.00 0.00 H new ATOM 524 N PHE A 53 -21.487 11.469 -9.637 1.00 0.00 N ATOM 525 CA PHE A 53 -21.020 10.884 -8.391 1.00 0.00 C ATOM 526 C PHE A 53 -21.305 9.381 -8.349 1.00 0.00 C ATOM 527 O PHE A 53 -22.388 8.962 -7.945 1.00 0.00 O ATOM 528 CB PHE A 53 -21.790 11.569 -7.260 1.00 0.00 C ATOM 529 CG PHE A 53 -21.583 13.083 -7.194 1.00 0.00 C ATOM 530 CD1 PHE A 53 -20.404 13.626 -7.596 1.00 0.00 C ATOM 531 CD2 PHE A 53 -22.580 13.886 -6.733 1.00 0.00 C ATOM 532 CE1 PHE A 53 -20.212 15.033 -7.536 1.00 0.00 C ATOM 533 CE2 PHE A 53 -22.389 15.291 -6.672 1.00 0.00 C ATOM 534 CZ PHE A 53 -21.209 15.835 -7.074 1.00 0.00 C ATOM 0 H PHE A 53 -20.830 12.112 -10.079 1.00 0.00 H new ATOM 0 HA PHE A 53 -19.943 11.025 -8.294 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -22.853 11.363 -7.382 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -21.487 11.129 -6.310 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -19.613 12.988 -7.961 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -23.517 13.454 -6.413 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -19.276 15.465 -7.857 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -23.181 15.928 -6.306 1.00 0.00 H new ATOM 0 HZ PHE A 53 -21.063 16.904 -7.026 1.00 0.00 H new ATOM 543 N SER A 54 -20.312 8.612 -8.774 1.00 0.00 N ATOM 544 CA SER A 54 -20.442 7.165 -8.789 1.00 0.00 C ATOM 545 C SER A 54 -21.127 6.716 -10.082 1.00 0.00 C ATOM 546 O SER A 54 -22.081 5.940 -10.046 1.00 0.00 O ATOM 547 CB SER A 54 -21.226 6.668 -7.573 1.00 0.00 C ATOM 548 OG SER A 54 -20.792 5.379 -7.148 1.00 0.00 O ATOM 0 H SER A 54 -19.415 8.964 -9.110 1.00 0.00 H new ATOM 0 HA SER A 54 -19.443 6.732 -8.744 1.00 0.00 H new ATOM 0 HB2 SER A 54 -21.112 7.377 -6.753 1.00 0.00 H new ATOM 0 HB3 SER A 54 -22.288 6.631 -7.817 1.00 0.00 H new ATOM 0 HG SER A 54 -21.316 5.098 -6.369 1.00 0.00 H new ATOM 553 N GLY A 55 -20.614 7.223 -11.193 1.00 0.00 N ATOM 554 CA GLY A 55 -21.164 6.882 -12.494 1.00 0.00 C ATOM 555 C GLY A 55 -21.049 5.381 -12.764 1.00 0.00 C ATOM 556 O GLY A 55 -21.407 4.565 -11.915 1.00 0.00 O ATOM 0 H GLY A 55 -19.824 7.867 -11.219 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -22.210 7.184 -12.540 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -20.638 7.436 -13.271 1.00 0.00 H new ATOM 560 N PRO A 56 -20.535 5.052 -13.979 1.00 0.00 N ATOM 561 CA PRO A 56 -20.369 3.662 -14.370 1.00 0.00 C ATOM 562 C PRO A 56 -19.173 3.031 -13.655 1.00 0.00 C ATOM 563 O PRO A 56 -19.338 2.345 -12.649 1.00 0.00 O ATOM 564 CB PRO A 56 -20.207 3.696 -15.881 1.00 0.00 C ATOM 565 CG PRO A 56 -19.825 5.127 -16.228 1.00 0.00 C ATOM 566 CD PRO A 56 -20.101 5.992 -15.009 1.00 0.00 C ATOM 0 HA PRO A 56 -21.219 3.041 -14.087 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -19.437 2.996 -16.207 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -21.132 3.407 -16.380 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -18.773 5.184 -16.506 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -20.401 5.479 -17.084 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -19.209 6.535 -14.699 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -20.871 6.735 -15.217 1.00 0.00 H new ATOM 571 N TYR A 57 -17.994 3.286 -14.204 1.00 0.00 N ATOM 572 CA TYR A 57 -16.770 2.752 -13.632 1.00 0.00 C ATOM 573 C TYR A 57 -16.929 1.270 -13.285 1.00 0.00 C ATOM 574 O TYR A 57 -18.003 0.698 -13.465 1.00 0.00 O ATOM 575 CB TYR A 57 -16.526 3.541 -12.345 1.00 0.00 C ATOM 576 CG TYR A 57 -16.815 2.753 -11.065 1.00 0.00 C ATOM 577 CD1 TYR A 57 -15.827 1.973 -10.499 1.00 0.00 C ATOM 578 CD2 TYR A 57 -18.062 2.820 -10.480 1.00 0.00 C ATOM 579 CE1 TYR A 57 -16.099 1.229 -9.296 1.00 0.00 C ATOM 580 CE2 TYR A 57 -18.333 2.078 -9.276 1.00 0.00 C ATOM 581 CZ TYR A 57 -17.338 1.319 -8.744 1.00 0.00 C ATOM 582 OH TYR A 57 -17.595 0.617 -7.607 1.00 0.00 O ATOM 0 H TYR A 57 -17.861 3.856 -15.039 1.00 0.00 H new ATOM 0 HA TYR A 57 -15.945 2.841 -14.339 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -15.488 3.875 -12.327 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -17.148 4.436 -12.356 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -14.851 1.921 -10.958 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -18.835 3.429 -10.925 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -15.336 0.614 -8.843 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -19.304 2.123 -8.806 1.00 0.00 H new ATOM 0 HH TYR A 57 -18.520 0.778 -7.325 1.00 0.00 H new ATOM 591 N THR A 58 -15.844 0.690 -12.792 1.00 0.00 N ATOM 592 CA THR A 58 -15.849 -0.713 -12.418 1.00 0.00 C ATOM 593 C THR A 58 -14.418 -1.239 -12.299 1.00 0.00 C ATOM 594 O THR A 58 -14.173 -2.237 -11.623 1.00 0.00 O ATOM 595 CB THR A 58 -16.692 -1.473 -13.444 1.00 0.00 C ATOM 596 OG1 THR A 58 -17.928 -1.706 -12.774 1.00 0.00 O ATOM 597 CG2 THR A 58 -16.150 -2.875 -13.724 1.00 0.00 C ATOM 0 H THR A 58 -14.955 1.168 -12.643 1.00 0.00 H new ATOM 0 HA THR A 58 -16.298 -0.858 -11.435 1.00 0.00 H new ATOM 0 HB THR A 58 -16.729 -0.906 -14.374 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.470 -0.890 -12.793 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.785 -3.371 -14.458 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.134 -2.802 -14.113 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.144 -3.454 -12.800 1.00 0.00 H new ATOM 605 N TYR A 59 -13.508 -0.544 -12.966 1.00 0.00 N ATOM 606 CA TYR A 59 -12.107 -0.928 -12.944 1.00 0.00 C ATOM 607 C TYR A 59 -11.449 -0.521 -11.625 1.00 0.00 C ATOM 608 O TYR A 59 -12.047 0.191 -10.821 1.00 0.00 O ATOM 609 CB TYR A 59 -11.442 -0.163 -14.090 1.00 0.00 C ATOM 610 CG TYR A 59 -11.822 1.318 -14.153 1.00 0.00 C ATOM 611 CD1 TYR A 59 -11.140 2.238 -13.382 1.00 0.00 C ATOM 612 CD2 TYR A 59 -12.846 1.734 -14.980 1.00 0.00 C ATOM 613 CE1 TYR A 59 -11.497 3.632 -13.441 1.00 0.00 C ATOM 614 CE2 TYR A 59 -13.203 3.127 -15.039 1.00 0.00 C ATOM 615 CZ TYR A 59 -12.511 4.008 -14.267 1.00 0.00 C ATOM 616 OH TYR A 59 -12.848 5.324 -14.322 1.00 0.00 O ATOM 0 H TYR A 59 -13.714 0.284 -13.525 1.00 0.00 H new ATOM 0 HA TYR A 59 -12.003 -2.008 -13.047 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -10.360 -0.246 -13.989 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -11.711 -0.637 -15.034 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.339 1.912 -12.735 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -13.379 1.014 -15.583 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -10.972 4.362 -12.843 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -14.002 3.465 -15.682 1.00 0.00 H new ATOM 0 HH TYR A 59 -13.587 5.446 -14.954 1.00 0.00 H new ATOM 625 N CYS A 60 -10.223 -0.992 -11.443 1.00 0.00 N ATOM 626 CA CYS A 60 -9.476 -0.687 -10.235 1.00 0.00 C ATOM 627 C CYS A 60 -9.797 0.751 -9.823 1.00 0.00 C ATOM 628 O CYS A 60 -9.794 1.655 -10.656 1.00 0.00 O ATOM 629 CB CYS A 60 -7.974 -0.902 -10.429 1.00 0.00 C ATOM 630 SG CYS A 60 -7.524 -2.478 -11.242 1.00 0.00 S ATOM 0 H CYS A 60 -9.729 -1.582 -12.112 1.00 0.00 H new ATOM 0 HA CYS A 60 -9.774 -1.368 -9.438 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.577 -0.078 -11.021 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.486 -0.859 -9.455 1.00 0.00 H new ATOM 634 N ASN A 61 -10.067 0.919 -8.536 1.00 0.00 N ATOM 635 CA ASN A 61 -10.389 2.231 -8.002 1.00 0.00 C ATOM 636 C ASN A 61 -9.156 2.811 -7.306 1.00 0.00 C ATOM 637 O ASN A 61 -8.072 2.233 -7.372 1.00 0.00 O ATOM 638 CB ASN A 61 -11.517 2.145 -6.972 1.00 0.00 C ATOM 639 CG ASN A 61 -12.372 3.414 -6.986 1.00 0.00 C ATOM 640 OD1 ASN A 61 -13.161 3.651 -7.886 1.00 0.00 O ATOM 641 ND2 ASN A 61 -12.170 4.213 -5.943 1.00 0.00 N ATOM 0 H ASN A 61 -10.069 0.167 -7.847 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.705 2.864 -8.831 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.143 1.278 -7.185 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.096 1.997 -5.978 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -12.691 5.086 -5.861 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -11.494 3.953 -5.225 1.00 0.00 H new ATOM 647 N THR A 62 -9.363 3.946 -6.656 1.00 0.00 N ATOM 648 CA THR A 62 -8.282 4.611 -5.949 1.00 0.00 C ATOM 649 C THR A 62 -8.329 4.267 -4.458 1.00 0.00 C ATOM 650 O THR A 62 -9.398 4.274 -3.850 1.00 0.00 O ATOM 651 CB THR A 62 -8.385 6.111 -6.230 1.00 0.00 C ATOM 652 OG1 THR A 62 -7.236 6.664 -5.592 1.00 0.00 O ATOM 653 CG2 THR A 62 -9.563 6.764 -5.504 1.00 0.00 C ATOM 0 H THR A 62 -10.263 4.422 -6.604 1.00 0.00 H new ATOM 0 HA THR A 62 -7.309 4.266 -6.300 1.00 0.00 H new ATOM 0 HB THR A 62 -8.485 6.272 -7.303 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.509 6.006 -5.599 1.00 0.00 H new ATOM 0 HG21 THR A 62 -9.590 7.828 -5.738 1.00 0.00 H new ATOM 0 HG22 THR A 62 -10.494 6.298 -5.828 1.00 0.00 H new ATOM 0 HG23 THR A 62 -9.446 6.632 -4.428 1.00 0.00 H new ATOM 661 N THR A 63 -7.156 3.977 -3.914 1.00 0.00 N ATOM 662 CA THR A 63 -7.050 3.632 -2.507 1.00 0.00 C ATOM 663 C THR A 63 -5.585 3.431 -2.115 1.00 0.00 C ATOM 664 O THR A 63 -4.738 3.182 -2.973 1.00 0.00 O ATOM 665 CB THR A 63 -7.921 2.398 -2.255 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.272 2.497 -0.877 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.127 1.094 -2.345 1.00 0.00 C ATOM 0 H THR A 63 -6.272 3.974 -4.422 1.00 0.00 H new ATOM 0 HA THR A 63 -7.415 4.441 -1.874 1.00 0.00 H new ATOM 0 HB THR A 63 -8.738 2.376 -2.976 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.839 1.737 -0.628 1.00 0.00 H new ATOM 0 HG21 THR A 63 -7.791 0.250 -2.158 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.692 1.001 -3.340 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.331 1.101 -1.601 1.00 0.00 H new ATOM 675 N LEU A 64 -5.330 3.547 -0.821 1.00 0.00 N ATOM 676 CA LEU A 64 -3.981 3.381 -0.305 1.00 0.00 C ATOM 677 C LEU A 64 -3.904 2.083 0.501 1.00 0.00 C ATOM 678 O LEU A 64 -4.913 1.408 0.696 1.00 0.00 O ATOM 679 CB LEU A 64 -3.552 4.621 0.483 1.00 0.00 C ATOM 680 CG LEU A 64 -4.476 5.041 1.627 1.00 0.00 C ATOM 681 CD1 LEU A 64 -3.834 4.750 2.985 1.00 0.00 C ATOM 682 CD2 LEU A 64 -4.887 6.508 1.490 1.00 0.00 C ATOM 0 H LEU A 64 -6.035 3.754 -0.113 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.268 3.290 -1.125 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.558 4.441 0.893 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.464 5.456 -0.212 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.387 4.445 1.567 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.512 5.058 3.781 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.634 3.682 3.072 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.898 5.302 3.071 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.544 6.781 2.316 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.998 7.138 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.413 6.652 0.546 1.00 0.00 H new ATOM 693 N ASP A 65 -2.695 1.773 0.947 1.00 0.00 N ATOM 694 CA ASP A 65 -2.473 0.567 1.728 1.00 0.00 C ATOM 695 C ASP A 65 -1.881 0.947 3.087 1.00 0.00 C ATOM 696 O ASP A 65 -1.991 2.095 3.516 1.00 0.00 O ATOM 697 CB ASP A 65 -1.485 -0.368 1.027 1.00 0.00 C ATOM 698 CG ASP A 65 -1.745 -1.860 1.241 1.00 0.00 C ATOM 699 OD1 ASP A 65 -1.813 -2.261 2.423 1.00 0.00 O ATOM 700 OD2 ASP A 65 -1.870 -2.567 0.217 1.00 0.00 O ATOM 0 H ASP A 65 -1.860 2.335 0.783 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.430 0.059 1.845 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.508 -0.160 -0.043 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.479 -0.136 1.375 1.00 0.00 H new ATOM 704 N GLN A 66 -1.269 -0.038 3.726 1.00 0.00 N ATOM 705 CA GLN A 66 -0.660 0.178 5.028 1.00 0.00 C ATOM 706 C GLN A 66 0.757 0.731 4.866 1.00 0.00 C ATOM 707 O GLN A 66 1.453 0.964 5.853 1.00 0.00 O ATOM 708 CB GLN A 66 -0.656 -1.110 5.852 1.00 0.00 C ATOM 709 CG GLN A 66 -1.864 -1.167 6.788 1.00 0.00 C ATOM 710 CD GLN A 66 -1.706 -2.285 7.820 1.00 0.00 C ATOM 711 OE1 GLN A 66 -1.399 -3.421 7.501 1.00 0.00 O ATOM 712 NE2 GLN A 66 -1.933 -1.900 9.073 1.00 0.00 N ATOM 0 H GLN A 66 -1.181 -0.989 3.367 1.00 0.00 H new ATOM 0 HA GLN A 66 -1.256 0.913 5.569 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.667 -1.972 5.185 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.263 -1.170 6.435 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.979 -0.210 7.298 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.772 -1.330 6.207 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -2.187 -0.932 9.271 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -1.853 -2.573 9.836 1.00 0.00 H new ATOM 719 N ILE A 67 1.144 0.924 3.613 1.00 0.00 N ATOM 720 CA ILE A 67 2.466 1.445 3.309 1.00 0.00 C ATOM 721 C ILE A 67 2.328 2.812 2.637 1.00 0.00 C ATOM 722 O ILE A 67 3.079 3.133 1.717 1.00 0.00 O ATOM 723 CB ILE A 67 3.264 0.431 2.486 1.00 0.00 C ATOM 724 CG1 ILE A 67 2.332 -0.496 1.705 1.00 0.00 C ATOM 725 CG2 ILE A 67 4.238 -0.348 3.371 1.00 0.00 C ATOM 726 CD1 ILE A 67 3.097 -1.253 0.617 1.00 0.00 C ATOM 0 H ILE A 67 0.565 0.729 2.797 1.00 0.00 H new ATOM 0 HA ILE A 67 3.037 1.597 4.225 1.00 0.00 H new ATOM 0 HB ILE A 67 3.860 0.978 1.755 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.865 -1.206 2.387 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.530 0.086 1.252 1.00 0.00 H new ATOM 0 HG21 ILE A 67 4.792 -1.062 2.761 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.935 0.345 3.843 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.682 -0.883 4.141 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.411 -1.905 0.077 1.00 0.00 H new ATOM 0 HD12 ILE A 67 3.543 -0.541 -0.077 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.883 -1.853 1.075 1.00 0.00 H new ATOM 737 N GLY A 68 1.363 3.580 3.122 1.00 0.00 N ATOM 738 CA GLY A 68 1.118 4.906 2.579 1.00 0.00 C ATOM 739 C GLY A 68 1.364 4.934 1.069 1.00 0.00 C ATOM 740 O GLY A 68 2.066 5.811 0.567 1.00 0.00 O ATOM 0 H GLY A 68 0.742 3.310 3.885 1.00 0.00 H new ATOM 0 HA2 GLY A 68 0.091 5.205 2.789 1.00 0.00 H new ATOM 0 HA3 GLY A 68 1.768 5.630 3.070 1.00 0.00 H new ATOM 744 N THR A 69 0.772 3.965 0.387 1.00 0.00 N ATOM 745 CA THR A 69 0.918 3.867 -1.055 1.00 0.00 C ATOM 746 C THR A 69 -0.426 4.108 -1.745 1.00 0.00 C ATOM 747 O THR A 69 -1.150 3.161 -2.049 1.00 0.00 O ATOM 748 CB THR A 69 1.530 2.503 -1.378 1.00 0.00 C ATOM 749 OG1 THR A 69 1.114 1.671 -0.298 1.00 0.00 O ATOM 750 CG2 THR A 69 3.057 2.507 -1.277 1.00 0.00 C ATOM 0 H THR A 69 0.190 3.240 0.807 1.00 0.00 H new ATOM 0 HA THR A 69 1.587 4.638 -1.437 1.00 0.00 H new ATOM 0 HB THR A 69 1.233 2.201 -2.383 1.00 0.00 H new ATOM 0 HG1 THR A 69 1.010 0.750 -0.616 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.440 1.515 -1.516 1.00 0.00 H new ATOM 0 HG22 THR A 69 3.466 3.233 -1.980 1.00 0.00 H new ATOM 0 HG23 THR A 69 3.354 2.776 -0.263 1.00 0.00 H new ATOM 758 N CYS A 70 -0.720 5.380 -1.970 1.00 0.00 N ATOM 759 CA CYS A 70 -1.965 5.757 -2.618 1.00 0.00 C ATOM 760 C CYS A 70 -1.870 5.378 -4.097 1.00 0.00 C ATOM 761 O CYS A 70 -1.012 5.884 -4.818 1.00 0.00 O ATOM 762 CB CYS A 70 -2.274 7.244 -2.428 1.00 0.00 C ATOM 763 SG CYS A 70 -3.863 7.795 -3.148 1.00 0.00 S ATOM 0 H CYS A 70 -0.118 6.163 -1.715 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.795 5.220 -2.159 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -2.278 7.466 -1.361 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -1.468 7.828 -2.872 1.00 0.00 H new ATOM 767 N TRP A 71 -2.766 4.490 -4.506 1.00 0.00 N ATOM 768 CA TRP A 71 -2.795 4.038 -5.886 1.00 0.00 C ATOM 769 C TRP A 71 -4.070 4.579 -6.535 1.00 0.00 C ATOM 770 O TRP A 71 -5.174 4.296 -6.073 1.00 0.00 O ATOM 771 CB TRP A 71 -2.683 2.515 -5.966 1.00 0.00 C ATOM 772 CG TRP A 71 -1.529 1.931 -5.149 1.00 0.00 C ATOM 773 CD1 TRP A 71 -1.587 1.315 -3.960 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.131 1.934 -5.512 1.00 0.00 C ATOM 775 NE1 TRP A 71 -0.336 0.922 -3.532 1.00 0.00 N ATOM 776 CE2 TRP A 71 0.579 1.310 -4.505 1.00 0.00 C ATOM 777 CE3 TRP A 71 0.512 2.445 -6.652 1.00 0.00 C ATOM 778 CZ2 TRP A 71 1.967 1.141 -4.538 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.900 2.269 -6.669 1.00 0.00 C ATOM 780 CH2 TRP A 71 2.629 1.644 -5.664 1.00 0.00 C ATOM 0 H TRP A 71 -3.477 4.072 -3.905 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.936 4.422 -6.436 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.618 2.074 -5.621 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.559 2.225 -7.009 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -2.499 1.147 -3.406 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -0.121 0.436 -2.661 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.023 2.935 -7.452 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 2.499 0.649 -3.738 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.443 2.645 -7.523 1.00 0.00 H new ATOM 0 HH2 TRP A 71 3.701 1.547 -5.752 1.00 0.00 H new ATOM 790 N PRO A 72 -3.871 5.369 -7.624 1.00 0.00 N ATOM 791 CA PRO A 72 -4.992 5.952 -8.340 1.00 0.00 C ATOM 792 C PRO A 72 -5.706 4.900 -9.191 1.00 0.00 C ATOM 793 O PRO A 72 -5.102 3.907 -9.595 1.00 0.00 O ATOM 794 CB PRO A 72 -4.389 7.074 -9.169 1.00 0.00 C ATOM 795 CG PRO A 72 -2.899 6.782 -9.244 1.00 0.00 C ATOM 796 CD PRO A 72 -2.578 5.725 -8.200 1.00 0.00 C ATOM 0 HA PRO A 72 -5.762 6.337 -7.672 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -4.832 7.105 -10.165 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -4.574 8.044 -8.707 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -2.629 6.430 -10.239 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.323 7.688 -9.059 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -2.093 4.859 -8.650 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.899 6.112 -7.440 1.00 0.00 H new ATOM 801 N GLN A 73 -6.984 5.151 -9.438 1.00 0.00 N ATOM 802 CA GLN A 73 -7.787 4.238 -10.233 1.00 0.00 C ATOM 803 C GLN A 73 -6.953 3.657 -11.378 1.00 0.00 C ATOM 804 O GLN A 73 -6.030 4.304 -11.869 1.00 0.00 O ATOM 805 CB GLN A 73 -9.042 4.933 -10.766 1.00 0.00 C ATOM 806 CG GLN A 73 -9.937 5.403 -9.618 1.00 0.00 C ATOM 807 CD GLN A 73 -11.373 4.910 -9.807 1.00 0.00 C ATOM 808 OE1 GLN A 73 -11.640 3.948 -10.508 1.00 0.00 O ATOM 809 NE2 GLN A 73 -12.280 5.623 -9.144 1.00 0.00 N ATOM 0 H GLN A 73 -7.483 5.974 -9.101 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.111 3.418 -9.593 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.756 5.786 -11.382 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.597 4.248 -11.408 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.544 5.034 -8.671 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -9.926 6.492 -9.566 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -11.988 6.417 -8.575 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -13.268 5.375 -9.205 1.00 0.00 H new ATOM 816 N SER A 74 -7.310 2.443 -11.769 1.00 0.00 N ATOM 817 CA SER A 74 -6.607 1.768 -12.847 1.00 0.00 C ATOM 818 C SER A 74 -7.499 0.686 -13.457 1.00 0.00 C ATOM 819 O SER A 74 -8.560 0.374 -12.917 1.00 0.00 O ATOM 820 CB SER A 74 -5.295 1.156 -12.351 1.00 0.00 C ATOM 821 OG SER A 74 -4.698 1.938 -11.319 1.00 0.00 O ATOM 0 H SER A 74 -8.076 1.909 -11.359 1.00 0.00 H new ATOM 0 HA SER A 74 -6.366 2.506 -13.612 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.482 0.148 -11.980 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.599 1.064 -13.185 1.00 0.00 H new ATOM 0 HG SER A 74 -4.290 1.345 -10.654 1.00 0.00 H new ATOM 826 N ALA A 75 -7.037 0.142 -14.574 1.00 0.00 N ATOM 827 CA ALA A 75 -7.781 -0.899 -15.263 1.00 0.00 C ATOM 828 C ALA A 75 -7.576 -2.231 -14.538 1.00 0.00 C ATOM 829 O ALA A 75 -6.566 -2.426 -13.865 1.00 0.00 O ATOM 830 CB ALA A 75 -7.340 -0.957 -16.727 1.00 0.00 C ATOM 0 H ALA A 75 -6.157 0.403 -15.019 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.849 -0.680 -15.253 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.898 -1.738 -17.244 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.534 0.004 -17.204 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.274 -1.179 -16.777 1.00 0.00 H new ATOM 836 N PRO A 76 -8.577 -3.136 -14.706 1.00 0.00 N ATOM 837 CA PRO A 76 -8.517 -4.444 -14.076 1.00 0.00 C ATOM 838 C PRO A 76 -7.524 -5.356 -14.800 1.00 0.00 C ATOM 839 O PRO A 76 -7.327 -5.230 -16.008 1.00 0.00 O ATOM 840 CB PRO A 76 -9.943 -4.967 -14.118 1.00 0.00 C ATOM 841 CG PRO A 76 -10.658 -4.144 -15.177 1.00 0.00 C ATOM 842 CD PRO A 76 -9.789 -2.940 -15.497 1.00 0.00 C ATOM 0 HA PRO A 76 -8.153 -4.400 -13.049 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -9.963 -6.028 -14.369 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.427 -4.860 -13.147 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.829 -4.741 -16.073 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.636 -3.824 -14.816 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.562 -2.887 -16.562 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.289 -2.009 -15.231 1.00 0.00 H new ATOM 847 N GLY A 77 -6.925 -6.253 -14.031 1.00 0.00 N ATOM 848 CA GLY A 77 -5.957 -7.187 -14.585 1.00 0.00 C ATOM 849 C GLY A 77 -4.654 -6.472 -14.947 1.00 0.00 C ATOM 850 O GLY A 77 -3.874 -6.970 -15.759 1.00 0.00 O ATOM 0 H GLY A 77 -7.090 -6.354 -13.030 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.754 -7.978 -13.863 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.373 -7.665 -15.472 1.00 0.00 H new ATOM 854 N ALA A 78 -4.456 -5.317 -14.329 1.00 0.00 N ATOM 855 CA ALA A 78 -3.261 -4.530 -14.577 1.00 0.00 C ATOM 856 C ALA A 78 -2.189 -4.901 -13.550 1.00 0.00 C ATOM 857 O ALA A 78 -2.269 -5.952 -12.915 1.00 0.00 O ATOM 858 CB ALA A 78 -3.612 -3.041 -14.542 1.00 0.00 C ATOM 0 H ALA A 78 -5.104 -4.907 -13.656 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.858 -4.746 -15.567 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.715 -2.451 -14.728 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.355 -2.824 -15.310 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.017 -2.786 -13.563 1.00 0.00 H new ATOM 864 N LEU A 79 -1.212 -4.016 -13.416 1.00 0.00 N ATOM 865 CA LEU A 79 -0.126 -4.236 -12.476 1.00 0.00 C ATOM 866 C LEU A 79 0.641 -2.929 -12.272 1.00 0.00 C ATOM 867 O LEU A 79 1.367 -2.485 -13.159 1.00 0.00 O ATOM 868 CB LEU A 79 0.755 -5.400 -12.938 1.00 0.00 C ATOM 869 CG LEU A 79 0.344 -6.789 -12.449 1.00 0.00 C ATOM 870 CD1 LEU A 79 -0.061 -7.686 -13.619 1.00 0.00 C ATOM 871 CD2 LEU A 79 1.449 -7.419 -11.598 1.00 0.00 C ATOM 0 H LEU A 79 -1.150 -3.145 -13.943 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.519 -4.530 -11.503 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.767 -5.410 -14.028 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.777 -5.209 -12.609 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.533 -6.681 -11.810 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.349 -8.668 -13.242 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.904 -7.238 -14.146 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.780 -7.792 -14.304 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.132 -8.406 -11.263 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.358 -7.512 -12.193 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.646 -6.787 -10.732 1.00 0.00 H new ATOM 882 N VAL A 80 0.451 -2.347 -11.097 1.00 0.00 N ATOM 883 CA VAL A 80 1.115 -1.098 -10.765 1.00 0.00 C ATOM 884 C VAL A 80 2.501 -1.398 -10.192 1.00 0.00 C ATOM 885 O VAL A 80 2.838 -0.941 -9.100 1.00 0.00 O ATOM 886 CB VAL A 80 0.240 -0.277 -9.814 1.00 0.00 C ATOM 887 CG1 VAL A 80 1.024 0.898 -9.225 1.00 0.00 C ATOM 888 CG2 VAL A 80 -1.029 0.208 -10.517 1.00 0.00 C ATOM 0 H VAL A 80 -0.153 -2.717 -10.363 1.00 0.00 H new ATOM 0 HA VAL A 80 1.258 -0.492 -11.660 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.061 -0.926 -8.991 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.380 1.465 -8.553 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.884 0.521 -8.671 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.368 1.546 -10.031 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.632 0.788 -9.819 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.757 0.832 -11.368 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.603 -0.651 -10.865 1.00 0.00 H new ATOM 898 N GLU A 81 3.267 -2.165 -10.954 1.00 0.00 N ATOM 899 CA GLU A 81 4.610 -2.532 -10.536 1.00 0.00 C ATOM 900 C GLU A 81 5.578 -1.375 -10.785 1.00 0.00 C ATOM 901 O GLU A 81 5.423 -0.626 -11.748 1.00 0.00 O ATOM 902 CB GLU A 81 5.077 -3.802 -11.249 1.00 0.00 C ATOM 903 CG GLU A 81 3.983 -4.871 -11.239 1.00 0.00 C ATOM 904 CD GLU A 81 4.107 -5.794 -12.453 1.00 0.00 C ATOM 905 OE1 GLU A 81 3.760 -5.326 -13.560 1.00 0.00 O ATOM 906 OE2 GLU A 81 4.546 -6.946 -12.249 1.00 0.00 O ATOM 0 H GLU A 81 2.984 -2.542 -11.858 1.00 0.00 H new ATOM 0 HA GLU A 81 4.593 -2.741 -9.466 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.350 -3.566 -12.277 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.972 -4.188 -10.762 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.051 -5.458 -10.323 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.003 -4.394 -11.239 1.00 0.00 H new ATOM 911 N ARG A 82 6.559 -1.264 -9.900 1.00 0.00 N ATOM 912 CA ARG A 82 7.552 -0.210 -10.011 1.00 0.00 C ATOM 913 C ARG A 82 8.786 -0.554 -9.175 1.00 0.00 C ATOM 914 O ARG A 82 8.687 -0.737 -7.962 1.00 0.00 O ATOM 915 CB ARG A 82 6.987 1.133 -9.545 1.00 0.00 C ATOM 916 CG ARG A 82 5.814 1.569 -10.427 1.00 0.00 C ATOM 917 CD ARG A 82 5.419 3.018 -10.135 1.00 0.00 C ATOM 918 NE ARG A 82 3.945 3.155 -10.152 1.00 0.00 N ATOM 919 CZ ARG A 82 3.201 3.122 -11.266 1.00 0.00 C ATOM 920 NH1 ARG A 82 3.787 2.957 -12.460 1.00 0.00 N ATOM 921 NH2 ARG A 82 1.870 3.253 -11.186 1.00 0.00 N ATOM 0 H ARG A 82 6.687 -1.887 -9.103 1.00 0.00 H new ATOM 0 HA ARG A 82 7.831 -0.128 -11.061 1.00 0.00 H new ATOM 0 HB2 ARG A 82 6.658 1.054 -8.509 1.00 0.00 H new ATOM 0 HB3 ARG A 82 7.770 1.891 -9.574 1.00 0.00 H new ATOM 0 HG2 ARG A 82 6.086 1.467 -11.477 1.00 0.00 H new ATOM 0 HG3 ARG A 82 4.961 0.913 -10.254 1.00 0.00 H new ATOM 0 HD2 ARG A 82 5.809 3.321 -9.163 1.00 0.00 H new ATOM 0 HD3 ARG A 82 5.863 3.681 -10.878 1.00 0.00 H new ATOM 0 HE ARG A 82 3.466 3.282 -9.260 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.800 2.856 -12.521 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.220 2.932 -13.307 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.424 3.378 -10.277 1.00 0.00 H new ATOM 0 HH22 ARG A 82 1.303 3.228 -12.034 1.00 0.00 H new ATOM 932 N PRO A 83 9.951 -0.635 -9.874 1.00 0.00 N ATOM 933 CA PRO A 83 11.202 -0.953 -9.208 1.00 0.00 C ATOM 934 C PRO A 83 11.721 0.247 -8.413 1.00 0.00 C ATOM 935 O PRO A 83 11.325 1.383 -8.667 1.00 0.00 O ATOM 936 CB PRO A 83 12.144 -1.378 -10.324 1.00 0.00 C ATOM 937 CG PRO A 83 11.536 -0.841 -11.610 1.00 0.00 C ATOM 938 CD PRO A 83 10.105 -0.424 -11.310 1.00 0.00 C ATOM 0 HA PRO A 83 11.095 -1.748 -8.469 1.00 0.00 H new ATOM 0 HB2 PRO A 83 13.144 -0.974 -10.166 1.00 0.00 H new ATOM 0 HB3 PRO A 83 12.241 -2.463 -10.361 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.112 0.008 -11.979 1.00 0.00 H new ATOM 0 HG3 PRO A 83 11.556 -1.603 -12.389 1.00 0.00 H new ATOM 0 HD2 PRO A 83 9.932 0.618 -11.578 1.00 0.00 H new ATOM 0 HD3 PRO A 83 9.391 -1.022 -11.877 1.00 0.00 H new ATOM 943 N CYS A 84 12.602 -0.046 -7.467 1.00 0.00 N ATOM 944 CA CYS A 84 13.180 0.994 -6.634 1.00 0.00 C ATOM 945 C CYS A 84 13.860 2.018 -7.545 1.00 0.00 C ATOM 946 O CYS A 84 14.367 1.666 -8.609 1.00 0.00 O ATOM 947 CB CYS A 84 14.149 0.417 -5.601 1.00 0.00 C ATOM 948 SG CYS A 84 13.678 -1.221 -4.937 1.00 0.00 S ATOM 0 H CYS A 84 12.929 -0.989 -7.259 1.00 0.00 H new ATOM 0 HA CYS A 84 12.392 1.485 -6.062 1.00 0.00 H new ATOM 0 HB2 CYS A 84 15.137 0.339 -6.055 1.00 0.00 H new ATOM 0 HB3 CYS A 84 14.234 1.119 -4.771 1.00 0.00 H new ATOM 952 N PRO A 85 13.846 3.297 -7.084 1.00 0.00 N ATOM 953 CA PRO A 85 14.455 4.374 -7.845 1.00 0.00 C ATOM 954 C PRO A 85 15.981 4.319 -7.749 1.00 0.00 C ATOM 955 O PRO A 85 16.533 3.455 -7.068 1.00 0.00 O ATOM 956 CB PRO A 85 13.869 5.649 -7.261 1.00 0.00 C ATOM 957 CG PRO A 85 13.316 5.267 -5.897 1.00 0.00 C ATOM 958 CD PRO A 85 13.254 3.750 -5.829 1.00 0.00 C ATOM 0 HA PRO A 85 14.243 4.306 -8.912 1.00 0.00 H new ATOM 0 HB2 PRO A 85 14.631 6.423 -7.171 1.00 0.00 H new ATOM 0 HB3 PRO A 85 13.084 6.048 -7.903 1.00 0.00 H new ATOM 0 HG2 PRO A 85 13.952 5.659 -5.103 1.00 0.00 H new ATOM 0 HG3 PRO A 85 12.325 5.697 -5.753 1.00 0.00 H new ATOM 0 HD2 PRO A 85 13.807 3.369 -4.970 1.00 0.00 H new ATOM 0 HD3 PRO A 85 12.227 3.400 -5.727 1.00 0.00 H new ATOM 963 N GLU A 86 16.619 5.251 -8.441 1.00 0.00 N ATOM 964 CA GLU A 86 18.071 5.319 -8.442 1.00 0.00 C ATOM 965 C GLU A 86 18.574 5.966 -7.151 1.00 0.00 C ATOM 966 O GLU A 86 18.162 7.073 -6.807 1.00 0.00 O ATOM 967 CB GLU A 86 18.583 6.075 -9.670 1.00 0.00 C ATOM 968 CG GLU A 86 18.559 7.586 -9.433 1.00 0.00 C ATOM 969 CD GLU A 86 18.663 8.350 -10.755 1.00 0.00 C ATOM 970 OE1 GLU A 86 17.880 8.013 -11.668 1.00 0.00 O ATOM 971 OE2 GLU A 86 19.524 9.254 -10.821 1.00 0.00 O ATOM 0 H GLU A 86 16.158 5.965 -9.005 1.00 0.00 H new ATOM 0 HA GLU A 86 18.463 4.303 -8.492 1.00 0.00 H new ATOM 0 HB2 GLU A 86 19.599 5.756 -9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 86 17.968 5.829 -10.535 1.00 0.00 H new ATOM 0 HG2 GLU A 86 17.638 7.863 -8.920 1.00 0.00 H new ATOM 0 HG3 GLU A 86 19.385 7.868 -8.780 1.00 0.00 H new ATOM 976 N TYR A 87 19.456 5.249 -6.471 1.00 0.00 N ATOM 977 CA TYR A 87 20.019 5.740 -5.225 1.00 0.00 C ATOM 978 C TYR A 87 21.148 4.830 -4.737 1.00 0.00 C ATOM 979 O TYR A 87 22.239 5.303 -4.421 1.00 0.00 O ATOM 980 CB TYR A 87 18.879 5.709 -4.206 1.00 0.00 C ATOM 981 CG TYR A 87 18.875 6.894 -3.238 1.00 0.00 C ATOM 982 CD1 TYR A 87 19.596 6.827 -2.063 1.00 0.00 C ATOM 983 CD2 TYR A 87 18.153 8.030 -3.540 1.00 0.00 C ATOM 984 CE1 TYR A 87 19.594 7.941 -1.152 1.00 0.00 C ATOM 985 CE2 TYR A 87 18.151 9.146 -2.630 1.00 0.00 C ATOM 986 CZ TYR A 87 18.871 9.046 -1.480 1.00 0.00 C ATOM 987 OH TYR A 87 18.869 10.099 -0.620 1.00 0.00 O ATOM 0 H TYR A 87 19.795 4.331 -6.760 1.00 0.00 H new ATOM 0 HA TYR A 87 20.433 6.739 -5.359 1.00 0.00 H new ATOM 0 HB2 TYR A 87 17.929 5.686 -4.740 1.00 0.00 H new ATOM 0 HB3 TYR A 87 18.944 4.785 -3.632 1.00 0.00 H new ATOM 0 HD1 TYR A 87 20.162 5.938 -1.827 1.00 0.00 H new ATOM 0 HD2 TYR A 87 17.589 8.082 -4.459 1.00 0.00 H new ATOM 0 HE1 TYR A 87 20.154 7.901 -0.229 1.00 0.00 H new ATOM 0 HE2 TYR A 87 17.591 10.042 -2.855 1.00 0.00 H new ATOM 0 HH TYR A 87 18.312 10.818 -0.984 1.00 0.00 H new ATOM 996 N PHE A 88 20.847 3.541 -4.691 1.00 0.00 N ATOM 997 CA PHE A 88 21.823 2.560 -4.247 1.00 0.00 C ATOM 998 C PHE A 88 22.470 1.851 -5.439 1.00 0.00 C ATOM 999 O PHE A 88 23.674 1.599 -5.437 1.00 0.00 O ATOM 1000 CB PHE A 88 21.071 1.530 -3.403 1.00 0.00 C ATOM 1001 CG PHE A 88 19.949 0.809 -4.155 1.00 0.00 C ATOM 1002 CD1 PHE A 88 20.247 -0.207 -5.007 1.00 0.00 C ATOM 1003 CD2 PHE A 88 18.656 1.186 -3.971 1.00 0.00 C ATOM 1004 CE1 PHE A 88 19.206 -0.876 -5.705 1.00 0.00 C ATOM 1005 CE2 PHE A 88 17.615 0.518 -4.669 1.00 0.00 C ATOM 1006 CZ PHE A 88 17.912 -0.499 -5.522 1.00 0.00 C ATOM 0 H PHE A 88 19.941 3.153 -4.954 1.00 0.00 H new ATOM 0 HA PHE A 88 22.613 3.052 -3.679 1.00 0.00 H new ATOM 0 HB2 PHE A 88 21.781 0.790 -3.034 1.00 0.00 H new ATOM 0 HB3 PHE A 88 20.648 2.029 -2.531 1.00 0.00 H new ATOM 0 HD1 PHE A 88 21.275 -0.506 -5.153 1.00 0.00 H new ATOM 0 HD2 PHE A 88 18.420 1.994 -3.294 1.00 0.00 H new ATOM 0 HE1 PHE A 88 19.442 -1.684 -6.381 1.00 0.00 H new ATOM 0 HE2 PHE A 88 16.588 0.817 -4.523 1.00 0.00 H new ATOM 0 HZ PHE A 88 17.121 -1.007 -6.054 1.00 0.00 H new ATOM 1015 N ASN A 89 21.642 1.550 -6.427 1.00 0.00 N ATOM 1016 CA ASN A 89 22.117 0.875 -7.623 1.00 0.00 C ATOM 1017 C ASN A 89 22.586 1.918 -8.640 1.00 0.00 C ATOM 1018 O ASN A 89 22.233 3.092 -8.538 1.00 0.00 O ATOM 1019 CB ASN A 89 21.003 0.051 -8.270 1.00 0.00 C ATOM 1020 CG ASN A 89 19.723 0.876 -8.413 1.00 0.00 C ATOM 1021 OD1 ASN A 89 19.745 2.090 -8.535 1.00 0.00 O ATOM 1022 ND2 ASN A 89 18.607 0.152 -8.390 1.00 0.00 N ATOM 0 H ASN A 89 20.644 1.761 -6.424 1.00 0.00 H new ATOM 0 HA ASN A 89 22.933 0.213 -7.335 1.00 0.00 H new ATOM 0 HB2 ASN A 89 21.327 -0.298 -9.251 1.00 0.00 H new ATOM 0 HB3 ASN A 89 20.804 -0.835 -7.667 1.00 0.00 H new ATOM 0 HD21 ASN A 89 17.700 0.610 -8.477 1.00 0.00 H new ATOM 0 HD22 ASN A 89 18.659 -0.861 -8.285 1.00 0.00 H new ATOM 1028 N GLY A 90 23.374 1.452 -9.598 1.00 0.00 N ATOM 1029 CA GLY A 90 23.894 2.330 -10.632 1.00 0.00 C ATOM 1030 C GLY A 90 22.944 2.390 -11.830 1.00 0.00 C ATOM 1031 O GLY A 90 23.381 2.322 -12.977 1.00 0.00 O ATOM 0 H GLY A 90 23.665 0.478 -9.680 1.00 0.00 H new ATOM 0 HA2 GLY A 90 24.036 3.331 -10.226 1.00 0.00 H new ATOM 0 HA3 GLY A 90 24.872 1.976 -10.957 1.00 0.00 H new ATOM 1035 N ILE A 91 21.662 2.516 -11.521 1.00 0.00 N ATOM 1036 CA ILE A 91 20.646 2.586 -12.557 1.00 0.00 C ATOM 1037 C ILE A 91 20.119 4.019 -12.653 1.00 0.00 C ATOM 1038 O ILE A 91 20.676 4.931 -12.044 1.00 0.00 O ATOM 1039 CB ILE A 91 19.554 1.544 -12.308 1.00 0.00 C ATOM 1040 CG1 ILE A 91 18.938 1.070 -13.626 1.00 0.00 C ATOM 1041 CG2 ILE A 91 18.496 2.080 -11.342 1.00 0.00 C ATOM 1042 CD1 ILE A 91 18.798 -0.454 -13.648 1.00 0.00 C ATOM 0 H ILE A 91 21.304 2.571 -10.568 1.00 0.00 H new ATOM 0 HA ILE A 91 21.075 2.338 -13.528 1.00 0.00 H new ATOM 0 HB ILE A 91 20.012 0.675 -11.835 1.00 0.00 H new ATOM 0 HG12 ILE A 91 17.959 1.531 -13.761 1.00 0.00 H new ATOM 0 HG13 ILE A 91 19.561 1.394 -14.460 1.00 0.00 H new ATOM 0 HG21 ILE A 91 17.731 1.320 -11.182 1.00 0.00 H new ATOM 0 HG22 ILE A 91 18.965 2.329 -10.390 1.00 0.00 H new ATOM 0 HG23 ILE A 91 18.037 2.974 -11.765 1.00 0.00 H new ATOM 0 HD11 ILE A 91 18.358 -0.765 -14.595 1.00 0.00 H new ATOM 0 HD12 ILE A 91 19.781 -0.911 -13.537 1.00 0.00 H new ATOM 0 HD13 ILE A 91 18.155 -0.772 -12.827 1.00 0.00 H new ATOM 1053 N LYS A 92 19.052 4.173 -13.423 1.00 0.00 N ATOM 1054 CA LYS A 92 18.443 5.480 -13.606 1.00 0.00 C ATOM 1055 C LYS A 92 16.921 5.326 -13.653 1.00 0.00 C ATOM 1056 O LYS A 92 16.299 5.585 -14.682 1.00 0.00 O ATOM 1057 CB LYS A 92 19.029 6.176 -14.836 1.00 0.00 C ATOM 1058 CG LYS A 92 19.860 7.396 -14.431 1.00 0.00 C ATOM 1059 CD LYS A 92 19.260 8.682 -15.003 1.00 0.00 C ATOM 1060 CE LYS A 92 20.346 9.730 -15.253 1.00 0.00 C ATOM 1061 NZ LYS A 92 20.782 9.697 -16.668 1.00 0.00 N ATOM 0 H LYS A 92 18.593 3.414 -13.928 1.00 0.00 H new ATOM 0 HA LYS A 92 18.672 6.129 -12.761 1.00 0.00 H new ATOM 0 HB2 LYS A 92 19.652 5.476 -15.393 1.00 0.00 H new ATOM 0 HB3 LYS A 92 18.223 6.485 -15.502 1.00 0.00 H new ATOM 0 HG2 LYS A 92 19.907 7.464 -13.344 1.00 0.00 H new ATOM 0 HG3 LYS A 92 20.883 7.278 -14.787 1.00 0.00 H new ATOM 0 HD2 LYS A 92 18.741 8.462 -15.936 1.00 0.00 H new ATOM 0 HD3 LYS A 92 18.518 9.080 -14.311 1.00 0.00 H new ATOM 0 HE2 LYS A 92 19.967 10.722 -15.006 1.00 0.00 H new ATOM 0 HE3 LYS A 92 21.198 9.543 -14.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 21.519 10.414 -16.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 21.163 8.756 -16.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 19.970 9.898 -17.286 1.00 0.00 H new ATOM 1071 N TYR A 93 16.365 4.907 -12.526 1.00 0.00 N ATOM 1072 CA TYR A 93 14.928 4.717 -12.426 1.00 0.00 C ATOM 1073 C TYR A 93 14.225 6.029 -12.075 1.00 0.00 C ATOM 1074 O TYR A 93 14.761 6.845 -11.327 1.00 0.00 O ATOM 1075 CB TYR A 93 14.714 3.717 -11.287 1.00 0.00 C ATOM 1076 CG TYR A 93 14.846 2.253 -11.711 1.00 0.00 C ATOM 1077 CD1 TYR A 93 14.238 1.812 -12.869 1.00 0.00 C ATOM 1078 CD2 TYR A 93 15.573 1.373 -10.936 1.00 0.00 C ATOM 1079 CE1 TYR A 93 14.362 0.434 -13.268 1.00 0.00 C ATOM 1080 CE2 TYR A 93 15.697 -0.005 -11.335 1.00 0.00 C ATOM 1081 CZ TYR A 93 15.086 -0.406 -12.481 1.00 0.00 C ATOM 1082 OH TYR A 93 15.202 -1.707 -12.858 1.00 0.00 O ATOM 0 H TYR A 93 16.884 4.694 -11.674 1.00 0.00 H new ATOM 0 HA TYR A 93 14.520 4.366 -13.374 1.00 0.00 H new ATOM 0 HB2 TYR A 93 15.436 3.922 -10.497 1.00 0.00 H new ATOM 0 HB3 TYR A 93 13.723 3.873 -10.861 1.00 0.00 H new ATOM 0 HD1 TYR A 93 13.669 2.501 -13.476 1.00 0.00 H new ATOM 0 HD2 TYR A 93 16.049 1.718 -10.030 1.00 0.00 H new ATOM 0 HE1 TYR A 93 13.891 0.076 -14.171 1.00 0.00 H new ATOM 0 HE2 TYR A 93 16.263 -0.704 -10.737 1.00 0.00 H new ATOM 0 HH TYR A 93 15.747 -2.190 -12.203 1.00 0.00 H new ATOM 1091 N ASN A 94 13.034 6.193 -12.634 1.00 0.00 N ATOM 1092 CA ASN A 94 12.251 7.392 -12.390 1.00 0.00 C ATOM 1093 C ASN A 94 11.107 7.062 -11.430 1.00 0.00 C ATOM 1094 O ASN A 94 10.615 7.938 -10.720 1.00 0.00 O ATOM 1095 CB ASN A 94 11.642 7.925 -13.688 1.00 0.00 C ATOM 1096 CG ASN A 94 12.724 8.474 -14.618 1.00 0.00 C ATOM 1097 OD1 ASN A 94 12.732 9.636 -14.988 1.00 0.00 O ATOM 1098 ND2 ASN A 94 13.637 7.574 -14.975 1.00 0.00 N ATOM 0 H ASN A 94 12.593 5.515 -13.255 1.00 0.00 H new ATOM 0 HA ASN A 94 12.913 8.147 -11.966 1.00 0.00 H new ATOM 0 HB2 ASN A 94 11.096 7.127 -14.191 1.00 0.00 H new ATOM 0 HB3 ASN A 94 10.921 8.710 -13.460 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.402 7.842 -15.594 1.00 0.00 H new ATOM 0 HD22 ASN A 94 13.572 6.617 -14.629 1.00 0.00 H new ATOM 1104 N THR A 95 10.715 5.797 -11.440 1.00 0.00 N ATOM 1105 CA THR A 95 9.637 5.341 -10.579 1.00 0.00 C ATOM 1106 C THR A 95 9.751 5.983 -9.195 1.00 0.00 C ATOM 1107 O THR A 95 10.825 5.990 -8.596 1.00 0.00 O ATOM 1108 CB THR A 95 9.676 3.812 -10.543 1.00 0.00 C ATOM 1109 OG1 THR A 95 11.065 3.499 -10.511 1.00 0.00 O ATOM 1110 CG2 THR A 95 9.182 3.183 -11.847 1.00 0.00 C ATOM 0 H THR A 95 11.124 5.073 -12.031 1.00 0.00 H new ATOM 0 HA THR A 95 8.665 5.648 -10.966 1.00 0.00 H new ATOM 0 HB THR A 95 9.067 3.454 -9.713 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.220 2.765 -9.881 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.230 2.097 -11.768 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.152 3.488 -12.031 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.811 3.515 -12.673 1.00 0.00 H new ATOM 1118 N THR A 96 8.628 6.510 -8.728 1.00 0.00 N ATOM 1119 CA THR A 96 8.589 7.153 -7.426 1.00 0.00 C ATOM 1120 C THR A 96 9.304 6.294 -6.384 1.00 0.00 C ATOM 1121 O THR A 96 10.290 6.726 -5.788 1.00 0.00 O ATOM 1122 CB THR A 96 7.124 7.434 -7.082 1.00 0.00 C ATOM 1123 OG1 THR A 96 6.532 6.140 -7.005 1.00 0.00 O ATOM 1124 CG2 THR A 96 6.374 8.120 -8.225 1.00 0.00 C ATOM 0 H THR A 96 7.739 6.505 -9.228 1.00 0.00 H new ATOM 0 HA THR A 96 9.124 8.103 -7.438 1.00 0.00 H new ATOM 0 HB THR A 96 7.074 8.059 -6.190 1.00 0.00 H new ATOM 0 HG1 THR A 96 5.581 6.228 -6.784 1.00 0.00 H new ATOM 0 HG21 THR A 96 5.340 8.296 -7.928 1.00 0.00 H new ATOM 0 HG22 THR A 96 6.853 9.072 -8.455 1.00 0.00 H new ATOM 0 HG23 THR A 96 6.394 7.482 -9.108 1.00 0.00 H new ATOM 1132 N ARG A 97 8.781 5.091 -6.194 1.00 0.00 N ATOM 1133 CA ARG A 97 9.357 4.166 -5.234 1.00 0.00 C ATOM 1134 C ARG A 97 9.127 2.722 -5.682 1.00 0.00 C ATOM 1135 O ARG A 97 8.379 2.474 -6.626 1.00 0.00 O ATOM 1136 CB ARG A 97 8.748 4.364 -3.843 1.00 0.00 C ATOM 1137 CG ARG A 97 7.223 4.251 -3.893 1.00 0.00 C ATOM 1138 CD ARG A 97 6.572 5.137 -2.829 1.00 0.00 C ATOM 1139 NE ARG A 97 6.028 6.363 -3.456 1.00 0.00 N ATOM 1140 CZ ARG A 97 5.200 7.217 -2.839 1.00 0.00 C ATOM 1141 NH1 ARG A 97 4.815 6.984 -1.577 1.00 0.00 N ATOM 1142 NH2 ARG A 97 4.755 8.304 -3.486 1.00 0.00 N ATOM 0 H ARG A 97 7.963 4.736 -6.690 1.00 0.00 H new ATOM 0 HA ARG A 97 10.427 4.368 -5.182 1.00 0.00 H new ATOM 0 HB2 ARG A 97 9.149 3.619 -3.156 1.00 0.00 H new ATOM 0 HB3 ARG A 97 9.032 5.342 -3.453 1.00 0.00 H new ATOM 0 HG2 ARG A 97 6.866 4.541 -4.881 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.926 3.214 -3.739 1.00 0.00 H new ATOM 0 HD2 ARG A 97 5.774 4.590 -2.327 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.305 5.403 -2.067 1.00 0.00 H new ATOM 0 HE ARG A 97 6.300 6.570 -4.417 1.00 0.00 H new ATOM 0 HH11 ARG A 97 5.152 6.156 -1.085 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.185 7.634 -1.108 1.00 0.00 H new ATOM 0 HH21 ARG A 97 5.047 8.480 -4.447 1.00 0.00 H new ATOM 0 HH22 ARG A 97 4.125 8.954 -3.017 1.00 0.00 H new ATOM 1153 N ASN A 98 9.785 1.808 -4.986 1.00 0.00 N ATOM 1154 CA ASN A 98 9.662 0.395 -5.301 1.00 0.00 C ATOM 1155 C ASN A 98 8.208 -0.042 -5.104 1.00 0.00 C ATOM 1156 O ASN A 98 7.438 0.636 -4.427 1.00 0.00 O ATOM 1157 CB ASN A 98 10.539 -0.454 -4.379 1.00 0.00 C ATOM 1158 CG ASN A 98 9.890 -0.619 -3.004 1.00 0.00 C ATOM 1159 OD1 ASN A 98 8.958 -1.385 -2.816 1.00 0.00 O ATOM 1160 ND2 ASN A 98 10.431 0.139 -2.055 1.00 0.00 N ATOM 0 H ASN A 98 10.406 2.018 -4.204 1.00 0.00 H new ATOM 0 HA ASN A 98 9.980 0.251 -6.334 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.703 -1.434 -4.828 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.517 0.014 -4.269 1.00 0.00 H new ATOM 0 HD21 ASN A 98 10.068 0.101 -1.103 1.00 0.00 H new ATOM 0 HD22 ASN A 98 11.209 0.759 -2.279 1.00 0.00 H new ATOM 1166 N ALA A 99 7.877 -1.173 -5.711 1.00 0.00 N ATOM 1167 CA ALA A 99 6.530 -1.708 -5.612 1.00 0.00 C ATOM 1168 C ALA A 99 6.406 -2.938 -6.513 1.00 0.00 C ATOM 1169 O ALA A 99 7.381 -3.354 -7.138 1.00 0.00 O ATOM 1170 CB ALA A 99 5.519 -0.618 -5.972 1.00 0.00 C ATOM 0 H ALA A 99 8.518 -1.733 -6.273 1.00 0.00 H new ATOM 0 HA ALA A 99 6.318 -2.025 -4.591 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.509 -1.020 -5.898 1.00 0.00 H new ATOM 0 HB2 ALA A 99 5.628 0.220 -5.284 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.699 -0.277 -6.991 1.00 0.00 H new ATOM 1176 N TYR A 100 5.201 -3.486 -6.552 1.00 0.00 N ATOM 1177 CA TYR A 100 4.938 -4.660 -7.366 1.00 0.00 C ATOM 1178 C TYR A 100 3.591 -5.289 -7.003 1.00 0.00 C ATOM 1179 O TYR A 100 3.533 -6.448 -6.596 1.00 0.00 O ATOM 1180 CB TYR A 100 6.055 -5.655 -7.045 1.00 0.00 C ATOM 1181 CG TYR A 100 6.951 -5.990 -8.238 1.00 0.00 C ATOM 1182 CD1 TYR A 100 6.402 -6.528 -9.385 1.00 0.00 C ATOM 1183 CD2 TYR A 100 8.310 -5.755 -8.168 1.00 0.00 C ATOM 1184 CE1 TYR A 100 7.246 -6.843 -10.508 1.00 0.00 C ATOM 1185 CE2 TYR A 100 9.154 -6.071 -9.292 1.00 0.00 C ATOM 1186 CZ TYR A 100 8.581 -6.599 -10.406 1.00 0.00 C ATOM 1187 OH TYR A 100 9.378 -6.897 -11.466 1.00 0.00 O ATOM 0 H TYR A 100 4.395 -3.138 -6.032 1.00 0.00 H new ATOM 0 HA TYR A 100 4.906 -4.394 -8.423 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.671 -5.247 -6.244 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.610 -6.576 -6.668 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.339 -6.713 -9.440 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.740 -5.334 -7.271 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.829 -7.264 -11.411 1.00 0.00 H new ATOM 0 HE2 TYR A 100 10.218 -5.892 -9.251 1.00 0.00 H new ATOM 0 HH TYR A 100 10.307 -6.669 -11.251 1.00 0.00 H new ATOM 1196 N ARG A 101 2.542 -4.496 -7.163 1.00 0.00 N ATOM 1197 CA ARG A 101 1.199 -4.960 -6.856 1.00 0.00 C ATOM 1198 C ARG A 101 0.506 -5.455 -8.128 1.00 0.00 C ATOM 1199 O ARG A 101 1.009 -5.252 -9.232 1.00 0.00 O ATOM 1200 CB ARG A 101 0.361 -3.846 -6.227 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.407 -4.360 -5.008 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.797 -3.726 -4.928 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.193 -3.551 -3.513 1.00 0.00 N ATOM 1204 CZ ARG A 101 -3.067 -2.629 -3.086 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -3.641 -1.793 -3.961 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -3.366 -2.543 -1.782 1.00 0.00 N ATOM 0 H ARG A 101 2.594 -3.535 -7.501 1.00 0.00 H new ATOM 0 HA ARG A 101 1.286 -5.779 -6.142 1.00 0.00 H new ATOM 0 HB2 ARG A 101 1.009 -3.021 -5.932 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.340 -3.453 -6.964 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.501 -5.445 -5.064 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.152 -4.135 -4.100 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.795 -2.761 -5.436 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.523 -4.356 -5.442 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.775 -4.171 -2.819 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -3.413 -1.858 -4.953 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.306 -1.092 -3.635 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.928 -3.179 -1.115 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -4.031 -1.841 -1.456 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.638 -6.092 -7.930 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.406 -6.616 -9.046 1.00 0.00 C ATOM 1219 C GLU A 102 -2.876 -6.212 -8.917 1.00 0.00 C ATOM 1220 O GLU A 102 -3.368 -5.994 -7.810 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.262 -8.136 -9.146 1.00 0.00 C ATOM 1222 CG GLU A 102 -1.607 -8.807 -7.815 1.00 0.00 C ATOM 1223 CD GLU A 102 -0.926 -10.172 -7.697 1.00 0.00 C ATOM 1224 OE1 GLU A 102 -1.214 -11.027 -8.563 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -0.133 -10.331 -6.744 1.00 0.00 O ATOM 0 H GLU A 102 -1.052 -6.257 -7.013 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.011 -6.185 -9.966 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.917 -8.516 -9.930 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.241 -8.390 -9.432 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -1.294 -8.168 -6.989 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.687 -8.927 -7.733 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.537 -6.125 -10.062 1.00 0.00 N ATOM 1231 CA CYS A 103 -4.940 -5.751 -10.090 1.00 0.00 C ATOM 1232 C CYS A 103 -5.737 -6.918 -10.675 1.00 0.00 C ATOM 1233 O CYS A 103 -5.400 -7.432 -11.741 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.166 -4.456 -10.874 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.048 -3.145 -9.952 1.00 0.00 S ATOM 0 H CYS A 103 -3.126 -6.307 -10.978 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.284 -5.549 -9.076 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.199 -4.068 -11.194 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -5.731 -4.688 -11.777 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.778 -7.304 -9.954 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.626 -8.402 -10.388 1.00 0.00 C ATOM 1241 C LEU A 104 -8.434 -7.963 -11.611 1.00 0.00 C ATOM 1242 O LEU A 104 -8.539 -6.770 -11.895 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.487 -8.905 -9.229 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.985 -10.162 -8.516 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -8.916 -10.547 -7.364 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.791 -11.313 -9.505 1.00 0.00 C ATOM 0 H LEU A 104 -7.055 -6.876 -9.071 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.019 -9.254 -10.695 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.575 -8.105 -8.494 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.490 -9.102 -9.607 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.009 -9.942 -8.082 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.537 -11.444 -6.874 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -8.960 -9.730 -6.643 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -9.915 -10.742 -7.753 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.434 -12.194 -8.972 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.741 -11.541 -9.988 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.060 -11.024 -10.260 1.00 0.00 H new ATOM 1257 N GLU A 105 -8.987 -8.950 -12.301 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.782 -8.680 -13.487 1.00 0.00 C ATOM 1259 C GLU A 105 -11.201 -8.265 -13.090 1.00 0.00 C ATOM 1260 O GLU A 105 -12.042 -8.016 -13.952 1.00 0.00 O ATOM 1261 CB GLU A 105 -9.807 -9.893 -14.418 1.00 0.00 C ATOM 1262 CG GLU A 105 -9.932 -9.460 -15.880 1.00 0.00 C ATOM 1263 CD GLU A 105 -9.630 -10.625 -16.825 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -8.464 -11.074 -16.817 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -10.572 -11.039 -17.534 1.00 0.00 O ATOM 0 H GLU A 105 -8.900 -9.938 -12.061 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.321 -7.856 -14.031 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.896 -10.477 -14.285 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.643 -10.541 -14.154 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.939 -9.087 -16.068 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.245 -8.638 -16.079 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.422 -8.203 -11.785 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.723 -7.822 -11.264 1.00 0.00 C ATOM 1272 C ASN A 106 -12.707 -6.335 -10.902 1.00 0.00 C ATOM 1273 O ASN A 106 -13.714 -5.793 -10.447 1.00 0.00 O ATOM 1274 CB ASN A 106 -13.063 -8.612 -9.999 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.488 -9.166 -10.066 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -15.379 -8.747 -9.344 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -14.654 -10.129 -10.968 1.00 0.00 N ATOM 0 H ASN A 106 -10.722 -8.410 -11.073 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.468 -8.032 -12.032 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.355 -9.432 -9.877 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.960 -7.969 -9.125 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.569 -10.564 -11.088 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -13.866 -10.433 -11.540 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.555 -5.718 -11.118 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.396 -4.305 -10.820 1.00 0.00 C ATOM 1285 C GLY A 107 -11.111 -4.087 -9.332 1.00 0.00 C ATOM 1286 O GLY A 107 -11.807 -3.318 -8.670 1.00 0.00 O ATOM 0 H GLY A 107 -10.723 -6.171 -11.496 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.580 -3.894 -11.414 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.300 -3.766 -11.104 1.00 0.00 H new ATOM 1290 N THR A 108 -10.087 -4.776 -8.851 1.00 0.00 N ATOM 1291 CA THR A 108 -9.703 -4.667 -7.454 1.00 0.00 C ATOM 1292 C THR A 108 -8.185 -4.804 -7.307 1.00 0.00 C ATOM 1293 O THR A 108 -7.485 -5.069 -8.282 1.00 0.00 O ATOM 1294 CB THR A 108 -10.486 -5.717 -6.664 1.00 0.00 C ATOM 1295 OG1 THR A 108 -9.507 -6.323 -5.825 1.00 0.00 O ATOM 1296 CG2 THR A 108 -10.981 -6.866 -7.548 1.00 0.00 C ATOM 0 H THR A 108 -9.512 -5.412 -9.403 1.00 0.00 H new ATOM 0 HA THR A 108 -9.951 -3.685 -7.051 1.00 0.00 H new ATOM 0 HB THR A 108 -11.336 -5.242 -6.174 1.00 0.00 H new ATOM 0 HG1 THR A 108 -9.930 -7.016 -5.276 1.00 0.00 H new ATOM 0 HG21 THR A 108 -11.530 -7.583 -6.938 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.637 -6.471 -8.324 1.00 0.00 H new ATOM 0 HG23 THR A 108 -10.128 -7.362 -8.012 1.00 0.00 H new ATOM 1304 N TRP A 109 -7.723 -4.616 -6.079 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.303 -4.715 -5.792 1.00 0.00 C ATOM 1306 C TRP A 109 -6.071 -5.997 -4.990 1.00 0.00 C ATOM 1307 O TRP A 109 -6.979 -6.813 -4.840 1.00 0.00 O ATOM 1308 CB TRP A 109 -5.799 -3.461 -5.073 1.00 0.00 C ATOM 1309 CG TRP A 109 -5.842 -2.194 -5.931 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.611 -1.110 -5.763 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -5.046 -1.923 -7.103 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.370 -0.163 -6.737 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.387 -0.673 -7.578 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -4.069 -2.707 -7.740 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.801 -0.097 -8.711 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -3.492 -2.117 -8.872 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.826 -0.860 -9.363 1.00 0.00 C ATOM 0 H TRP A 109 -8.307 -4.396 -5.272 1.00 0.00 H new ATOM 0 HA TRP A 109 -5.727 -4.772 -6.715 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -6.399 -3.302 -4.177 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.774 -3.630 -4.744 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.329 -0.992 -4.965 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.828 0.744 -6.824 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -3.785 -3.687 -7.385 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.086 0.883 -9.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -2.735 -2.678 -9.400 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -3.335 -0.474 -10.244 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.849 -6.136 -4.495 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.486 -7.304 -3.711 1.00 0.00 C ATOM 1329 C ALA A 110 -4.433 -6.924 -2.231 1.00 0.00 C ATOM 1330 O ALA A 110 -4.668 -5.770 -1.873 1.00 0.00 O ATOM 1331 CB ALA A 110 -3.156 -7.865 -4.218 1.00 0.00 C ATOM 0 H ALA A 110 -4.098 -5.458 -4.622 1.00 0.00 H new ATOM 0 HA ALA A 110 -5.234 -8.089 -3.822 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.883 -8.741 -3.630 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -3.256 -8.148 -5.266 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.380 -7.106 -4.120 1.00 0.00 H new ATOM 1337 N SER A 111 -4.123 -7.916 -1.408 1.00 0.00 N ATOM 1338 CA SER A 111 -4.035 -7.700 0.025 1.00 0.00 C ATOM 1339 C SER A 111 -2.993 -6.623 0.331 1.00 0.00 C ATOM 1340 O SER A 111 -3.269 -5.675 1.064 1.00 0.00 O ATOM 1341 CB SER A 111 -3.688 -8.997 0.758 1.00 0.00 C ATOM 1342 OG SER A 111 -4.646 -10.022 0.511 1.00 0.00 O ATOM 0 H SER A 111 -3.930 -8.872 -1.708 1.00 0.00 H new ATOM 0 HA SER A 111 -5.010 -7.364 0.379 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.702 -9.339 0.443 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.631 -8.804 1.829 1.00 0.00 H new ATOM 0 HG SER A 111 -4.388 -10.834 0.995 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.814 -6.804 -0.249 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.729 -5.860 -0.049 1.00 0.00 C ATOM 1349 C ARG A 112 0.314 -6.006 -1.159 1.00 0.00 C ATOM 1350 O ARG A 112 0.425 -7.066 -1.774 1.00 0.00 O ATOM 1351 CB ARG A 112 -0.054 -6.075 1.307 1.00 0.00 C ATOM 1352 CG ARG A 112 -0.438 -4.971 2.293 1.00 0.00 C ATOM 1353 CD ARG A 112 0.777 -4.508 3.100 1.00 0.00 C ATOM 1354 NE ARG A 112 1.115 -5.519 4.128 1.00 0.00 N ATOM 1355 CZ ARG A 112 2.130 -5.398 4.994 1.00 0.00 C ATOM 1356 NH1 ARG A 112 2.913 -4.310 4.962 1.00 0.00 N ATOM 1357 NH2 ARG A 112 2.364 -6.365 5.892 1.00 0.00 N ATOM 0 H ARG A 112 -1.588 -7.591 -0.857 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.154 -4.857 -0.075 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -0.343 -7.045 1.711 1.00 0.00 H new ATOM 0 HB3 ARG A 112 1.028 -6.093 1.179 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.862 -4.126 1.751 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.211 -5.336 2.970 1.00 0.00 H new ATOM 0 HD2 ARG A 112 1.628 -4.353 2.436 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.565 -3.550 3.575 1.00 0.00 H new ATOM 0 HE ARG A 112 0.539 -6.359 4.180 1.00 0.00 H new ATOM 0 HH11 ARG A 112 2.736 -3.574 4.278 1.00 0.00 H new ATOM 0 HH12 ARG A 112 3.686 -4.218 5.621 1.00 0.00 H new ATOM 0 HH21 ARG A 112 1.769 -7.193 5.916 1.00 0.00 H new ATOM 0 HH22 ARG A 112 3.137 -6.273 6.551 1.00 0.00 H new ATOM 1368 N VAL A 113 1.052 -4.929 -1.381 1.00 0.00 N ATOM 1369 CA VAL A 113 2.081 -4.924 -2.405 1.00 0.00 C ATOM 1370 C VAL A 113 3.207 -5.876 -1.995 1.00 0.00 C ATOM 1371 O VAL A 113 3.547 -5.969 -0.816 1.00 0.00 O ATOM 1372 CB VAL A 113 2.567 -3.495 -2.654 1.00 0.00 C ATOM 1373 CG1 VAL A 113 3.248 -3.377 -4.019 1.00 0.00 C ATOM 1374 CG2 VAL A 113 1.416 -2.495 -2.526 1.00 0.00 C ATOM 0 H VAL A 113 0.957 -4.052 -0.868 1.00 0.00 H new ATOM 0 HA VAL A 113 1.679 -5.284 -3.352 1.00 0.00 H new ATOM 0 HB VAL A 113 3.306 -3.254 -1.890 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.584 -2.351 -4.171 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.105 -4.049 -4.057 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.541 -3.647 -4.803 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.788 -1.487 -2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.644 -2.734 -3.257 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.995 -2.551 -1.522 1.00 0.00 H new ATOM 1384 N ASN A 114 3.756 -6.556 -2.990 1.00 0.00 N ATOM 1385 CA ASN A 114 4.836 -7.497 -2.748 1.00 0.00 C ATOM 1386 C ASN A 114 5.916 -6.819 -1.903 1.00 0.00 C ATOM 1387 O ASN A 114 6.225 -7.274 -0.802 1.00 0.00 O ATOM 1388 CB ASN A 114 5.478 -7.950 -4.060 1.00 0.00 C ATOM 1389 CG ASN A 114 6.980 -8.183 -3.884 1.00 0.00 C ATOM 1390 OD1 ASN A 114 7.418 -9.153 -3.286 1.00 0.00 O ATOM 1391 ND2 ASN A 114 7.743 -7.245 -4.437 1.00 0.00 N ATOM 0 H ASN A 114 3.473 -6.474 -3.966 1.00 0.00 H new ATOM 0 HA ASN A 114 4.419 -8.363 -2.234 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.002 -8.868 -4.404 1.00 0.00 H new ATOM 0 HB3 ASN A 114 5.311 -7.197 -4.830 1.00 0.00 H new ATOM 0 HD21 ASN A 114 8.759 -7.312 -4.375 1.00 0.00 H new ATOM 0 HD22 ASN A 114 7.312 -6.459 -4.923 1.00 0.00 H new ATOM 1397 N TYR A 115 6.461 -5.742 -2.449 1.00 0.00 N ATOM 1398 CA TYR A 115 7.500 -4.996 -1.758 1.00 0.00 C ATOM 1399 C TYR A 115 8.408 -5.933 -0.959 1.00 0.00 C ATOM 1400 O TYR A 115 8.757 -5.639 0.183 1.00 0.00 O ATOM 1401 CB TYR A 115 6.774 -4.059 -0.791 1.00 0.00 C ATOM 1402 CG TYR A 115 6.864 -2.580 -1.170 1.00 0.00 C ATOM 1403 CD1 TYR A 115 6.153 -2.102 -2.252 1.00 0.00 C ATOM 1404 CD2 TYR A 115 7.656 -1.725 -0.432 1.00 0.00 C ATOM 1405 CE1 TYR A 115 6.237 -0.710 -2.610 1.00 0.00 C ATOM 1406 CE2 TYR A 115 7.740 -0.333 -0.790 1.00 0.00 C ATOM 1407 CZ TYR A 115 7.026 0.106 -1.862 1.00 0.00 C ATOM 1408 OH TYR A 115 7.106 1.421 -2.201 1.00 0.00 O ATOM 0 H TYR A 115 6.203 -5.368 -3.362 1.00 0.00 H new ATOM 0 HA TYR A 115 8.125 -4.458 -2.470 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.724 -4.347 -0.742 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.188 -4.193 0.208 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.534 -2.772 -2.830 1.00 0.00 H new ATOM 0 HD2 TYR A 115 8.213 -2.100 0.414 1.00 0.00 H new ATOM 0 HE1 TYR A 115 5.685 -0.323 -3.454 1.00 0.00 H new ATOM 0 HE2 TYR A 115 8.356 0.347 -0.221 1.00 0.00 H new ATOM 0 HH TYR A 115 7.591 1.512 -3.048 1.00 0.00 H new ATOM 1417 N SER A 116 8.764 -7.041 -1.591 1.00 0.00 N ATOM 1418 CA SER A 116 9.625 -8.023 -0.954 1.00 0.00 C ATOM 1419 C SER A 116 10.868 -8.266 -1.813 1.00 0.00 C ATOM 1420 O SER A 116 11.733 -9.060 -1.447 1.00 0.00 O ATOM 1421 CB SER A 116 8.879 -9.338 -0.715 1.00 0.00 C ATOM 1422 OG SER A 116 9.219 -9.925 0.538 1.00 0.00 O ATOM 0 H SER A 116 8.472 -7.281 -2.538 1.00 0.00 H new ATOM 0 HA SER A 116 9.933 -7.630 0.015 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.805 -9.157 -0.751 1.00 0.00 H new ATOM 0 HB3 SER A 116 9.111 -10.038 -1.518 1.00 0.00 H new ATOM 0 HG SER A 116 8.721 -10.761 0.653 1.00 0.00 H new ATOM 1427 N HIS A 117 10.916 -7.568 -2.937 1.00 0.00 N ATOM 1428 CA HIS A 117 12.038 -7.698 -3.851 1.00 0.00 C ATOM 1429 C HIS A 117 12.418 -6.321 -4.397 1.00 0.00 C ATOM 1430 O HIS A 117 12.520 -6.136 -5.609 1.00 0.00 O ATOM 1431 CB HIS A 117 11.725 -8.709 -4.956 1.00 0.00 C ATOM 1432 CG HIS A 117 12.170 -10.117 -4.645 1.00 0.00 C ATOM 1433 ND1 HIS A 117 11.472 -10.952 -3.788 1.00 0.00 N ATOM 1434 CD2 HIS A 117 13.246 -10.830 -5.083 1.00 0.00 C ATOM 1435 CE1 HIS A 117 12.109 -12.111 -3.722 1.00 0.00 C ATOM 1436 NE2 HIS A 117 13.209 -12.033 -4.525 1.00 0.00 N ATOM 0 H HIS A 117 10.196 -6.910 -3.236 1.00 0.00 H new ATOM 0 HA HIS A 117 12.903 -8.089 -3.316 1.00 0.00 H new ATOM 0 HB2 HIS A 117 10.650 -8.711 -5.139 1.00 0.00 H new ATOM 0 HB3 HIS A 117 12.205 -8.383 -5.879 1.00 0.00 H new ATOM 0 HD2 HIS A 117 14.001 -10.475 -5.769 1.00 0.00 H new ATOM 0 HE1 HIS A 117 11.810 -12.967 -3.136 1.00 0.00 H new ATOM 0 HE2 HIS A 117 13.891 -12.777 -4.672 1.00 0.00 H new ATOM 1443 N CYS A 118 12.617 -5.389 -3.477 1.00 0.00 N ATOM 1444 CA CYS A 118 12.982 -4.033 -3.852 1.00 0.00 C ATOM 1445 C CYS A 118 14.408 -4.056 -4.408 1.00 0.00 C ATOM 1446 O CYS A 118 15.324 -3.506 -3.800 1.00 0.00 O ATOM 1447 CB CYS A 118 12.845 -3.065 -2.674 1.00 0.00 C ATOM 1448 SG CYS A 118 13.352 -1.343 -3.034 1.00 0.00 S ATOM 0 H CYS A 118 12.532 -5.546 -2.473 1.00 0.00 H new ATOM 0 HA CYS A 118 12.299 -3.668 -4.619 1.00 0.00 H new ATOM 0 HB2 CYS A 118 11.806 -3.062 -2.343 1.00 0.00 H new ATOM 0 HB3 CYS A 118 13.443 -3.439 -1.843 1.00 0.00 H new ATOM 1452 N GLU A 119 14.550 -4.700 -5.557 1.00 0.00 N ATOM 1453 CA GLU A 119 15.848 -4.802 -6.202 1.00 0.00 C ATOM 1454 C GLU A 119 16.896 -5.302 -5.207 1.00 0.00 C ATOM 1455 O GLU A 119 17.616 -4.507 -4.605 1.00 0.00 O ATOM 1456 CB GLU A 119 16.265 -3.461 -6.811 1.00 0.00 C ATOM 1457 CG GLU A 119 15.605 -3.249 -8.175 1.00 0.00 C ATOM 1458 CD GLU A 119 16.237 -4.154 -9.235 1.00 0.00 C ATOM 1459 OE1 GLU A 119 17.461 -4.013 -9.446 1.00 0.00 O ATOM 1460 OE2 GLU A 119 15.482 -4.967 -9.811 1.00 0.00 O ATOM 0 H GLU A 119 13.788 -5.156 -6.058 1.00 0.00 H new ATOM 0 HA GLU A 119 15.773 -5.524 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.986 -2.650 -6.138 1.00 0.00 H new ATOM 0 HB3 GLU A 119 17.349 -3.428 -6.919 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.538 -3.457 -8.103 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.707 -2.206 -8.474 1.00 0.00 H new ATOM 1465 N PRO A 120 16.953 -6.654 -5.062 1.00 0.00 N ATOM 1466 CA PRO A 120 17.901 -7.270 -4.151 1.00 0.00 C ATOM 1467 C PRO A 120 19.317 -7.240 -4.730 1.00 0.00 C ATOM 1468 O PRO A 120 19.928 -8.286 -4.939 1.00 0.00 O ATOM 1469 CB PRO A 120 17.379 -8.681 -3.933 1.00 0.00 C ATOM 1470 CG PRO A 120 16.423 -8.954 -5.084 1.00 0.00 C ATOM 1471 CD PRO A 120 16.116 -7.627 -5.759 1.00 0.00 C ATOM 0 HA PRO A 120 17.979 -6.738 -3.203 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.196 -9.403 -3.924 1.00 0.00 H new ATOM 0 HB3 PRO A 120 16.869 -8.765 -2.973 1.00 0.00 H new ATOM 0 HG2 PRO A 120 16.870 -9.649 -5.795 1.00 0.00 H new ATOM 0 HG3 PRO A 120 15.507 -9.417 -4.718 1.00 0.00 H new ATOM 0 HD2 PRO A 120 16.350 -7.660 -6.823 1.00 0.00 H new ATOM 0 HD3 PRO A 120 15.059 -7.374 -5.673 1.00 0.00 H new ATOM 1476 N ILE A 121 19.797 -6.028 -4.973 1.00 0.00 N ATOM 1477 CA ILE A 121 21.128 -5.848 -5.524 1.00 0.00 C ATOM 1478 C ILE A 121 21.391 -6.926 -6.578 1.00 0.00 C ATOM 1479 O ILE A 121 22.019 -7.942 -6.288 1.00 0.00 O ATOM 1480 CB ILE A 121 22.172 -5.816 -4.405 1.00 0.00 C ATOM 1481 CG1 ILE A 121 22.267 -4.421 -3.784 1.00 0.00 C ATOM 1482 CG2 ILE A 121 23.529 -6.314 -4.907 1.00 0.00 C ATOM 1483 CD1 ILE A 121 22.596 -3.369 -4.846 1.00 0.00 C ATOM 0 H ILE A 121 19.287 -5.162 -4.798 1.00 0.00 H new ATOM 0 HA ILE A 121 21.203 -4.884 -6.028 1.00 0.00 H new ATOM 0 HB ILE A 121 21.850 -6.498 -3.618 1.00 0.00 H new ATOM 0 HG12 ILE A 121 21.324 -4.170 -3.299 1.00 0.00 H new ATOM 0 HG13 ILE A 121 23.035 -4.415 -3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 121 24.253 -6.281 -4.093 1.00 0.00 H new ATOM 0 HG22 ILE A 121 23.431 -7.339 -5.264 1.00 0.00 H new ATOM 0 HG23 ILE A 121 23.871 -5.677 -5.722 1.00 0.00 H new ATOM 0 HD11 ILE A 121 22.658 -2.387 -4.378 1.00 0.00 H new ATOM 0 HD12 ILE A 121 23.551 -3.609 -5.313 1.00 0.00 H new ATOM 0 HD13 ILE A 121 21.814 -3.361 -5.605 1.00 0.00 H new ATOM 1494 N LEU A 122 20.895 -6.666 -7.779 1.00 0.00 N ATOM 1495 CA LEU A 122 21.067 -7.602 -8.878 1.00 0.00 C ATOM 1496 C LEU A 122 21.272 -6.823 -10.177 1.00 0.00 C ATOM 1497 O LEU A 122 20.338 -6.210 -10.692 1.00 0.00 O ATOM 1498 CB LEU A 122 19.899 -8.589 -8.929 1.00 0.00 C ATOM 1499 CG LEU A 122 19.502 -9.086 -10.322 1.00 0.00 C ATOM 1500 CD1 LEU A 122 20.540 -10.067 -10.870 1.00 0.00 C ATOM 1501 CD2 LEU A 122 18.095 -9.687 -10.308 1.00 0.00 C ATOM 0 H LEU A 122 20.374 -5.821 -8.015 1.00 0.00 H new ATOM 0 HA LEU A 122 21.960 -8.209 -8.726 1.00 0.00 H new ATOM 0 HB2 LEU A 122 20.152 -9.453 -8.315 1.00 0.00 H new ATOM 0 HB3 LEU A 122 19.030 -8.117 -8.472 1.00 0.00 H new ATOM 0 HG LEU A 122 19.480 -8.231 -10.998 1.00 0.00 H new ATOM 0 HD11 LEU A 122 20.234 -10.405 -11.860 1.00 0.00 H new ATOM 0 HD12 LEU A 122 21.508 -9.571 -10.939 1.00 0.00 H new ATOM 0 HD13 LEU A 122 20.618 -10.925 -10.202 1.00 0.00 H new ATOM 0 HD21 LEU A 122 17.837 -10.032 -11.309 1.00 0.00 H new ATOM 0 HD22 LEU A 122 18.065 -10.528 -9.615 1.00 0.00 H new ATOM 0 HD23 LEU A 122 17.379 -8.929 -9.990 1.00 0.00 H new ATOM 1512 N ASP A 123 22.501 -6.872 -10.673 1.00 0.00 N ATOM 1513 CA ASP A 123 22.839 -6.179 -11.904 1.00 0.00 C ATOM 1514 C ASP A 123 24.264 -6.553 -12.319 1.00 0.00 C ATOM 1515 O ASP A 123 25.158 -5.709 -12.313 1.00 0.00 O ATOM 1516 CB ASP A 123 22.786 -4.661 -11.714 1.00 0.00 C ATOM 1517 CG ASP A 123 22.846 -3.845 -13.006 1.00 0.00 C ATOM 1518 OD1 ASP A 123 23.506 -4.328 -13.952 1.00 0.00 O ATOM 1519 OD2 ASP A 123 22.232 -2.756 -13.019 1.00 0.00 O ATOM 0 H ASP A 123 23.274 -7.381 -10.244 1.00 0.00 H new ATOM 0 HA ASP A 123 22.117 -6.473 -12.666 1.00 0.00 H new ATOM 0 HB2 ASP A 123 21.867 -4.408 -11.185 1.00 0.00 H new ATOM 0 HB3 ASP A 123 23.616 -4.361 -11.074 1.00 0.00 H new ATOM 1523 N ASP A 124 24.429 -7.819 -12.671 1.00 0.00 N ATOM 1524 CA ASP A 124 25.730 -8.317 -13.089 1.00 0.00 C ATOM 1525 C ASP A 124 25.573 -9.730 -13.653 1.00 0.00 C ATOM 1526 O ASP A 124 24.526 -10.355 -13.490 1.00 0.00 O ATOM 1527 CB ASP A 124 26.699 -8.384 -11.906 1.00 0.00 C ATOM 1528 CG ASP A 124 28.153 -8.044 -12.242 1.00 0.00 C ATOM 1529 OD1 ASP A 124 28.517 -8.217 -13.426 1.00 0.00 O ATOM 1530 OD2 ASP A 124 28.866 -7.618 -11.309 1.00 0.00 O ATOM 0 H ASP A 124 23.684 -8.516 -12.676 1.00 0.00 H new ATOM 0 HA ASP A 124 26.127 -7.636 -13.842 1.00 0.00 H new ATOM 0 HB2 ASP A 124 26.351 -7.700 -11.132 1.00 0.00 H new ATOM 0 HB3 ASP A 124 26.665 -9.388 -11.484 1.00 0.00 H new ATOM 1534 N LYS A 125 26.630 -10.192 -14.304 1.00 0.00 N ATOM 1535 CA LYS A 125 26.624 -11.520 -14.894 1.00 0.00 C ATOM 1536 C LYS A 125 28.052 -12.069 -14.920 1.00 0.00 C ATOM 1537 O LYS A 125 28.669 -12.156 -15.980 1.00 0.00 O ATOM 1538 CB LYS A 125 25.950 -11.494 -16.268 1.00 0.00 C ATOM 1539 CG LYS A 125 25.557 -12.904 -16.713 1.00 0.00 C ATOM 1540 CD LYS A 125 24.246 -12.884 -17.502 1.00 0.00 C ATOM 1541 CE LYS A 125 24.498 -13.139 -18.989 1.00 0.00 C ATOM 1542 NZ LYS A 125 23.216 -13.289 -19.713 1.00 0.00 N ATOM 0 H LYS A 125 27.497 -9.671 -14.436 1.00 0.00 H new ATOM 0 HA LYS A 125 26.030 -12.203 -14.287 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.064 -10.861 -16.230 1.00 0.00 H new ATOM 0 HB3 LYS A 125 26.626 -11.053 -17.000 1.00 0.00 H new ATOM 0 HG2 LYS A 125 26.350 -13.329 -17.329 1.00 0.00 H new ATOM 0 HG3 LYS A 125 25.451 -13.548 -15.840 1.00 0.00 H new ATOM 0 HD2 LYS A 125 23.569 -13.642 -17.109 1.00 0.00 H new ATOM 0 HD3 LYS A 125 23.754 -11.920 -17.373 1.00 0.00 H new ATOM 0 HE2 LYS A 125 25.068 -12.313 -19.414 1.00 0.00 H new ATOM 0 HE3 LYS A 125 25.100 -14.039 -19.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 23.405 -13.462 -20.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 22.686 -14.092 -19.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 22.655 -12.419 -19.610 1.00 0.00 H new ATOM 1552 N GLN A 126 28.536 -12.428 -13.739 1.00 0.00 N ATOM 1553 CA GLN A 126 29.879 -12.965 -13.612 1.00 0.00 C ATOM 1554 C GLN A 126 29.842 -14.494 -13.622 1.00 0.00 C ATOM 1555 O GLN A 126 29.324 -15.113 -12.693 1.00 0.00 O ATOM 1556 CB GLN A 126 30.563 -12.442 -12.349 1.00 0.00 C ATOM 1557 CG GLN A 126 29.793 -12.863 -11.094 1.00 0.00 C ATOM 1558 CD GLN A 126 30.628 -13.809 -10.230 1.00 0.00 C ATOM 1559 OE1 GLN A 126 31.835 -13.678 -10.108 1.00 0.00 O ATOM 1560 NE2 GLN A 126 29.921 -14.769 -9.641 1.00 0.00 N ATOM 0 H GLN A 126 28.021 -12.357 -12.862 1.00 0.00 H new ATOM 0 HA GLN A 126 30.465 -12.629 -14.467 1.00 0.00 H new ATOM 0 HB2 GLN A 126 31.583 -12.823 -12.299 1.00 0.00 H new ATOM 0 HB3 GLN A 126 30.630 -11.355 -12.391 1.00 0.00 H new ATOM 0 HG2 GLN A 126 29.523 -11.980 -10.515 1.00 0.00 H new ATOM 0 HG3 GLN A 126 28.863 -13.353 -11.381 1.00 0.00 H new ATOM 0 HE21 GLN A 126 28.913 -14.821 -9.785 1.00 0.00 H new ATOM 0 HE22 GLN A 126 30.387 -15.453 -9.045 1.00 0.00 H new ATOM 1567 N ARG A 127 30.397 -15.062 -14.685 1.00 0.00 N ATOM 1568 CA ARG A 127 30.433 -16.507 -14.828 1.00 0.00 C ATOM 1569 C ARG A 127 31.165 -16.895 -16.114 1.00 0.00 C ATOM 1570 O ARG A 127 31.326 -16.071 -17.013 1.00 0.00 O ATOM 1571 CB ARG A 127 29.020 -17.093 -14.856 1.00 0.00 C ATOM 1572 CG ARG A 127 28.168 -16.417 -15.932 1.00 0.00 C ATOM 1573 CD ARG A 127 27.324 -17.445 -16.689 1.00 0.00 C ATOM 1574 NE ARG A 127 26.088 -17.741 -15.931 1.00 0.00 N ATOM 1575 CZ ARG A 127 25.101 -18.527 -16.381 1.00 0.00 C ATOM 1576 NH1 ARG A 127 25.198 -19.101 -17.587 1.00 0.00 N ATOM 1577 NH2 ARG A 127 24.016 -18.739 -15.624 1.00 0.00 N ATOM 0 H ARG A 127 30.825 -14.547 -15.454 1.00 0.00 H new ATOM 0 HA ARG A 127 30.965 -16.912 -13.967 1.00 0.00 H new ATOM 0 HB2 ARG A 127 29.071 -18.165 -15.047 1.00 0.00 H new ATOM 0 HB3 ARG A 127 28.550 -16.965 -13.881 1.00 0.00 H new ATOM 0 HG2 ARG A 127 27.516 -15.674 -15.472 1.00 0.00 H new ATOM 0 HG3 ARG A 127 28.813 -15.885 -16.631 1.00 0.00 H new ATOM 0 HD2 ARG A 127 27.071 -17.063 -17.678 1.00 0.00 H new ATOM 0 HD3 ARG A 127 27.897 -18.360 -16.838 1.00 0.00 H new ATOM 0 HE ARG A 127 25.981 -17.320 -15.008 1.00 0.00 H new ATOM 0 HH11 ARG A 127 26.024 -18.940 -18.164 1.00 0.00 H new ATOM 0 HH12 ARG A 127 24.446 -19.699 -17.929 1.00 0.00 H new ATOM 0 HH21 ARG A 127 23.942 -18.302 -14.705 1.00 0.00 H new ATOM 0 HH22 ARG A 127 23.264 -19.337 -15.966 1.00 0.00 H new ATOM 1588 N LYS A 128 31.590 -18.149 -16.159 1.00 0.00 N ATOM 1589 CA LYS A 128 32.302 -18.655 -17.321 1.00 0.00 C ATOM 1590 C LYS A 128 32.583 -20.148 -17.130 1.00 0.00 C ATOM 1591 O LYS A 128 33.394 -20.528 -16.289 1.00 0.00 O ATOM 1592 CB LYS A 128 33.558 -17.823 -17.585 1.00 0.00 C ATOM 1593 CG LYS A 128 34.319 -18.350 -18.804 1.00 0.00 C ATOM 1594 CD LYS A 128 33.574 -18.020 -20.099 1.00 0.00 C ATOM 1595 CE LYS A 128 34.527 -17.445 -21.149 1.00 0.00 C ATOM 1596 NZ LYS A 128 34.161 -16.047 -21.470 1.00 0.00 N ATOM 0 H LYS A 128 31.455 -18.829 -15.411 1.00 0.00 H new ATOM 0 HA LYS A 128 31.688 -18.556 -18.216 1.00 0.00 H new ATOM 0 HB2 LYS A 128 33.281 -16.781 -17.747 1.00 0.00 H new ATOM 0 HB3 LYS A 128 34.206 -17.848 -16.709 1.00 0.00 H new ATOM 0 HG2 LYS A 128 35.317 -17.912 -18.832 1.00 0.00 H new ATOM 0 HG3 LYS A 128 34.447 -19.429 -18.719 1.00 0.00 H new ATOM 0 HD2 LYS A 128 33.098 -18.920 -20.489 1.00 0.00 H new ATOM 0 HD3 LYS A 128 32.779 -17.303 -19.893 1.00 0.00 H new ATOM 0 HE2 LYS A 128 35.551 -17.483 -20.779 1.00 0.00 H new ATOM 0 HE3 LYS A 128 34.492 -18.053 -22.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 34.817 -15.672 -22.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 33.191 -16.019 -21.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 34.218 -15.467 -20.609 1.00 0.00 H new ATOM 1606 N TYR A 129 31.894 -20.953 -17.927 1.00 0.00 N ATOM 1607 CA TYR A 129 32.058 -22.395 -17.856 1.00 0.00 C ATOM 1608 C TYR A 129 31.700 -23.053 -19.190 1.00 0.00 C ATOM 1609 O TYR A 129 30.754 -22.638 -19.857 1.00 0.00 O ATOM 1610 CB TYR A 129 31.081 -22.879 -16.783 1.00 0.00 C ATOM 1611 CG TYR A 129 29.609 -22.769 -17.186 1.00 0.00 C ATOM 1612 CD1 TYR A 129 29.056 -23.700 -18.042 1.00 0.00 C ATOM 1613 CD2 TYR A 129 28.835 -21.737 -16.694 1.00 0.00 C ATOM 1614 CE1 TYR A 129 27.671 -23.596 -18.421 1.00 0.00 C ATOM 1615 CE2 TYR A 129 27.450 -21.634 -17.073 1.00 0.00 C ATOM 1616 CZ TYR A 129 26.936 -22.568 -17.918 1.00 0.00 C ATOM 1617 OH TYR A 129 25.628 -22.469 -18.276 1.00 0.00 O ATOM 0 H TYR A 129 31.222 -20.634 -18.624 1.00 0.00 H new ATOM 0 HA TYR A 129 33.092 -22.653 -17.626 1.00 0.00 H new ATOM 0 HB2 TYR A 129 31.305 -23.919 -16.545 1.00 0.00 H new ATOM 0 HB3 TYR A 129 31.242 -22.302 -15.873 1.00 0.00 H new ATOM 0 HD1 TYR A 129 29.662 -24.506 -18.427 1.00 0.00 H new ATOM 0 HD2 TYR A 129 29.268 -21.008 -16.025 1.00 0.00 H new ATOM 0 HE1 TYR A 129 27.226 -24.318 -19.090 1.00 0.00 H new ATOM 0 HE2 TYR A 129 26.833 -20.833 -16.695 1.00 0.00 H new ATOM 0 HH TYR A 129 25.228 -21.688 -17.840 1.00 0.00 H new ATOM 1626 N ASP A 130 32.475 -24.069 -19.539 1.00 0.00 N ATOM 1627 CA ASP A 130 32.251 -24.789 -20.781 1.00 0.00 C ATOM 1628 C ASP A 130 33.341 -25.849 -20.955 1.00 0.00 C ATOM 1629 O ASP A 130 34.359 -25.816 -20.266 1.00 0.00 O ATOM 1630 CB ASP A 130 32.313 -23.845 -21.984 1.00 0.00 C ATOM 1631 CG ASP A 130 30.974 -23.601 -22.684 1.00 0.00 C ATOM 1632 OD1 ASP A 130 30.095 -24.480 -22.550 1.00 0.00 O ATOM 1633 OD2 ASP A 130 30.861 -22.541 -23.337 1.00 0.00 O ATOM 0 H ASP A 130 33.259 -24.411 -18.983 1.00 0.00 H new ATOM 0 HA ASP A 130 31.263 -25.246 -20.732 1.00 0.00 H new ATOM 0 HB2 ASP A 130 32.714 -22.886 -21.654 1.00 0.00 H new ATOM 0 HB3 ASP A 130 33.017 -24.252 -22.710 1.00 0.00 H new ATOM 1637 N LEU A 131 33.089 -26.765 -21.879 1.00 0.00 N ATOM 1638 CA LEU A 131 34.035 -27.832 -22.152 1.00 0.00 C ATOM 1639 C LEU A 131 33.665 -28.512 -23.471 1.00 0.00 C ATOM 1640 O LEU A 131 32.607 -29.128 -23.581 1.00 0.00 O ATOM 1641 CB LEU A 131 34.115 -28.795 -20.966 1.00 0.00 C ATOM 1642 CG LEU A 131 35.064 -29.984 -21.128 1.00 0.00 C ATOM 1643 CD1 LEU A 131 36.493 -29.602 -20.736 1.00 0.00 C ATOM 1644 CD2 LEU A 131 34.560 -31.199 -20.347 1.00 0.00 C ATOM 0 H LEU A 131 32.243 -26.790 -22.448 1.00 0.00 H new ATOM 0 HA LEU A 131 35.040 -27.427 -22.272 1.00 0.00 H new ATOM 0 HB2 LEU A 131 34.420 -28.230 -20.085 1.00 0.00 H new ATOM 0 HB3 LEU A 131 33.114 -29.179 -20.768 1.00 0.00 H new ATOM 0 HG LEU A 131 35.083 -30.265 -22.181 1.00 0.00 H new ATOM 0 HD11 LEU A 131 37.147 -30.465 -20.860 1.00 0.00 H new ATOM 0 HD12 LEU A 131 36.840 -28.789 -21.373 1.00 0.00 H new ATOM 0 HD13 LEU A 131 36.511 -29.280 -19.695 1.00 0.00 H new ATOM 0 HD21 LEU A 131 35.253 -32.030 -20.479 1.00 0.00 H new ATOM 0 HD22 LEU A 131 34.492 -30.948 -19.288 1.00 0.00 H new ATOM 0 HD23 LEU A 131 33.575 -31.486 -20.716 1.00 0.00 H new ATOM 1655 N HIS A 132 34.559 -28.376 -24.440 1.00 0.00 N ATOM 1656 CA HIS A 132 34.339 -28.969 -25.750 1.00 0.00 C ATOM 1657 C HIS A 132 35.647 -28.961 -26.543 1.00 0.00 C ATOM 1658 O HIS A 132 36.640 -28.385 -26.102 1.00 0.00 O ATOM 1659 CB HIS A 132 33.196 -28.263 -26.482 1.00 0.00 C ATOM 1660 CG HIS A 132 33.629 -27.049 -27.269 1.00 0.00 C ATOM 1661 ND1 HIS A 132 33.710 -25.784 -26.713 1.00 0.00 N ATOM 1662 CD2 HIS A 132 34.004 -26.922 -28.574 1.00 0.00 C ATOM 1663 CE1 HIS A 132 34.117 -24.941 -27.651 1.00 0.00 C ATOM 1664 NE2 HIS A 132 34.297 -25.647 -28.804 1.00 0.00 N ATOM 0 H HIS A 132 35.436 -27.865 -24.345 1.00 0.00 H new ATOM 0 HA HIS A 132 34.031 -30.008 -25.635 1.00 0.00 H new ATOM 0 HB2 HIS A 132 32.719 -28.972 -27.159 1.00 0.00 H new ATOM 0 HB3 HIS A 132 32.443 -27.962 -25.754 1.00 0.00 H new ATOM 0 HD2 HIS A 132 34.054 -27.722 -29.298 1.00 0.00 H new ATOM 0 HE1 HIS A 132 34.278 -23.881 -27.525 1.00 0.00 H new ATOM 0 HE2 HIS A 132 34.606 -25.260 -29.696 1.00 0.00 H new ATOM 1672 N TYR A 133 35.604 -29.606 -27.700 1.00 0.00 N ATOM 1673 CA TYR A 133 36.773 -29.680 -28.558 1.00 0.00 C ATOM 1674 C TYR A 133 37.050 -28.331 -29.226 1.00 0.00 C ATOM 1675 O TYR A 133 37.393 -27.361 -28.552 1.00 0.00 O ATOM 1676 CB TYR A 133 36.438 -30.710 -29.639 1.00 0.00 C ATOM 1677 CG TYR A 133 37.270 -30.566 -30.915 1.00 0.00 C ATOM 1678 CD1 TYR A 133 38.648 -30.612 -30.850 1.00 0.00 C ATOM 1679 CD2 TYR A 133 36.643 -30.392 -32.132 1.00 0.00 C ATOM 1680 CE1 TYR A 133 39.430 -30.477 -32.051 1.00 0.00 C ATOM 1681 CE2 TYR A 133 37.425 -30.256 -33.332 1.00 0.00 C ATOM 1682 CZ TYR A 133 38.780 -30.305 -33.233 1.00 0.00 C ATOM 1683 OH TYR A 133 39.519 -30.178 -34.368 1.00 0.00 O ATOM 0 H TYR A 133 34.778 -30.082 -28.062 1.00 0.00 H new ATOM 0 HA TYR A 133 37.656 -29.952 -27.980 1.00 0.00 H new ATOM 0 HB2 TYR A 133 36.586 -31.710 -29.232 1.00 0.00 H new ATOM 0 HB3 TYR A 133 35.382 -30.623 -29.894 1.00 0.00 H new ATOM 0 HD1 TYR A 133 39.139 -30.749 -29.898 1.00 0.00 H new ATOM 0 HD2 TYR A 133 35.565 -30.358 -32.184 1.00 0.00 H new ATOM 0 HE1 TYR A 133 40.509 -30.512 -32.014 1.00 0.00 H new ATOM 0 HE2 TYR A 133 36.946 -30.118 -34.290 1.00 0.00 H new ATOM 0 HH TYR A 133 38.922 -30.063 -35.136 1.00 0.00 H new TER 1692 TYR A 133