USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 706 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 20 LYS NZ :NH3+ -176:sc= 1.4 (180deg=0.582) USER MOD Set 1.2: A 88 THR OG1 : rot -93:sc= 2.08 USER MOD Set 2.1: A 77 THR OG1 : rot 84:sc= 1.19 USER MOD Set 2.2: A 80 GLN : amide:sc= 1.16 K(o=2.4,f=-5.4!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 41:sc= -0.036 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0.605 K(o=0.61,f=-5.9!) USER MOD Single : A 35 THR OG1 : rot -145:sc= 1.04 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HE2:sc= 0.862 K(o=0.86,f=-2.7!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.0658 K(o=-0.066,f=-1.6!) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= -0.0032 X(o=-0.0032,f=-0.019) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 88:sc= 0.965 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 93 HIS : no HD1:sc= -0.0546 X(o=-0.055,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 33.329 42.952 18.197 1.00 0.00 N ATOM 2 CA LYS A 9 33.664 41.594 18.497 1.00 0.00 C ATOM 3 C LYS A 9 32.712 40.914 19.421 1.00 0.00 C ATOM 4 O LYS A 9 32.396 39.769 19.103 1.00 0.00 O ATOM 5 CB LYS A 9 35.137 41.404 18.897 1.00 0.00 C ATOM 6 CG LYS A 9 36.069 41.871 17.777 1.00 0.00 C ATOM 7 CD LYS A 9 37.484 41.287 17.837 1.00 0.00 C ATOM 8 CE LYS A 9 38.293 41.723 16.614 1.00 0.00 C ATOM 9 NZ LYS A 9 39.555 40.963 16.478 1.00 0.00 N ATOM 0 HA LYS A 9 33.544 41.071 17.548 1.00 0.00 H new ATOM 0 HB2 LYS A 9 35.346 41.965 19.808 1.00 0.00 H new ATOM 0 HB3 LYS A 9 35.326 40.354 19.119 1.00 0.00 H new ATOM 0 HG2 LYS A 9 35.622 41.608 16.818 1.00 0.00 H new ATOM 0 HG3 LYS A 9 36.138 42.958 17.810 1.00 0.00 H new ATOM 0 HD2 LYS A 9 37.983 41.618 18.748 1.00 0.00 H new ATOM 0 HD3 LYS A 9 37.434 40.199 17.879 1.00 0.00 H new ATOM 0 HE2 LYS A 9 37.691 41.588 15.715 1.00 0.00 H new ATOM 0 HE3 LYS A 9 38.518 42.787 16.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 40.070 41.292 15.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 40.143 41.112 17.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 39.341 39.950 16.379 1.00 0.00 H new ATOM 23 N PRO A 10 32.181 41.401 20.503 1.00 0.00 N ATOM 24 CA PRO A 10 30.943 40.901 21.027 1.00 0.00 C ATOM 25 C PRO A 10 29.777 41.392 20.240 1.00 0.00 C ATOM 26 O PRO A 10 29.932 42.144 19.280 1.00 0.00 O ATOM 27 CB PRO A 10 30.927 41.430 22.459 1.00 0.00 C ATOM 28 CG PRO A 10 31.622 42.796 22.343 1.00 0.00 C ATOM 29 CD PRO A 10 32.681 42.539 21.258 1.00 0.00 C ATOM 0 HA PRO A 10 30.869 39.815 20.980 1.00 0.00 H new ATOM 0 HB2 PRO A 10 29.910 41.528 22.840 1.00 0.00 H new ATOM 0 HB3 PRO A 10 31.459 40.765 23.139 1.00 0.00 H new ATOM 0 HG2 PRO A 10 30.925 43.582 22.052 1.00 0.00 H new ATOM 0 HG3 PRO A 10 32.074 43.103 23.286 1.00 0.00 H new ATOM 0 HD2 PRO A 10 32.809 43.412 20.617 1.00 0.00 H new ATOM 0 HD3 PRO A 10 33.654 42.322 21.700 1.00 0.00 H new ATOM 37 N GLY A 11 28.557 40.983 20.628 1.00 0.00 N ATOM 38 CA GLY A 11 27.389 41.112 19.811 1.00 0.00 C ATOM 39 C GLY A 11 26.785 39.765 19.615 1.00 0.00 C ATOM 40 O GLY A 11 26.380 39.135 20.590 1.00 0.00 O ATOM 0 H GLY A 11 28.376 40.551 21.534 1.00 0.00 H new ATOM 0 HA2 GLY A 11 26.671 41.782 20.284 1.00 0.00 H new ATOM 0 HA3 GLY A 11 27.649 41.552 18.848 1.00 0.00 H new ATOM 44 N ASP A 12 26.671 39.289 18.362 1.00 0.00 N ATOM 45 CA ASP A 12 25.994 38.063 18.072 1.00 0.00 C ATOM 46 C ASP A 12 26.910 36.906 17.874 1.00 0.00 C ATOM 47 O ASP A 12 26.884 35.971 18.672 1.00 0.00 O ATOM 48 CB ASP A 12 25.055 38.277 16.873 1.00 0.00 C ATOM 49 CG ASP A 12 23.841 37.364 16.967 1.00 0.00 C ATOM 50 OD1 ASP A 12 23.126 37.433 18.002 1.00 0.00 O ATOM 51 OD2 ASP A 12 23.567 36.598 16.005 1.00 0.00 O ATOM 0 H ASP A 12 27.052 39.760 17.541 1.00 0.00 H new ATOM 0 HA ASP A 12 25.404 37.792 18.948 1.00 0.00 H new ATOM 0 HB2 ASP A 12 24.731 39.317 16.840 1.00 0.00 H new ATOM 0 HB3 ASP A 12 25.592 38.081 15.945 1.00 0.00 H new ATOM 56 N THR A 13 27.780 36.894 16.848 1.00 0.00 N ATOM 57 CA THR A 13 28.676 35.809 16.586 1.00 0.00 C ATOM 58 C THR A 13 30.099 36.240 16.485 1.00 0.00 C ATOM 59 O THR A 13 30.409 37.373 16.123 1.00 0.00 O ATOM 60 CB THR A 13 28.358 34.985 15.373 1.00 0.00 C ATOM 61 OG1 THR A 13 28.123 35.778 14.220 1.00 0.00 O ATOM 62 CG2 THR A 13 27.084 34.160 15.617 1.00 0.00 C ATOM 0 H THR A 13 27.863 37.661 16.181 1.00 0.00 H new ATOM 0 HA THR A 13 28.528 35.179 17.463 1.00 0.00 H new ATOM 0 HB THR A 13 29.227 34.350 15.201 1.00 0.00 H new ATOM 0 HG1 THR A 13 27.922 35.196 13.458 1.00 0.00 H new ATOM 0 HG21 THR A 13 26.861 33.565 14.731 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.237 33.498 16.470 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.250 34.831 15.823 1.00 0.00 H new ATOM 70 N PHE A 14 31.046 35.322 16.746 1.00 0.00 N ATOM 71 CA PHE A 14 32.435 35.548 16.491 1.00 0.00 C ATOM 72 C PHE A 14 33.070 34.268 16.071 1.00 0.00 C ATOM 73 O PHE A 14 32.753 33.178 16.543 1.00 0.00 O ATOM 74 CB PHE A 14 33.227 36.215 17.629 1.00 0.00 C ATOM 75 CG PHE A 14 33.012 35.604 18.970 1.00 0.00 C ATOM 76 CD1 PHE A 14 33.592 34.404 19.307 1.00 0.00 C ATOM 77 CD2 PHE A 14 32.305 36.301 19.922 1.00 0.00 C ATOM 78 CE1 PHE A 14 33.486 33.906 20.584 1.00 0.00 C ATOM 79 CE2 PHE A 14 32.188 35.798 21.196 1.00 0.00 C ATOM 80 CZ PHE A 14 32.773 34.600 21.533 1.00 0.00 C ATOM 0 H PHE A 14 30.843 34.404 17.142 1.00 0.00 H new ATOM 0 HA PHE A 14 32.473 36.285 15.689 1.00 0.00 H new ATOM 0 HB2 PHE A 14 34.290 36.171 17.390 1.00 0.00 H new ATOM 0 HB3 PHE A 14 32.954 37.269 17.676 1.00 0.00 H new ATOM 0 HD1 PHE A 14 34.137 33.846 18.560 1.00 0.00 H new ATOM 0 HD2 PHE A 14 31.842 37.243 19.669 1.00 0.00 H new ATOM 0 HE1 PHE A 14 33.962 32.971 20.841 1.00 0.00 H new ATOM 0 HE2 PHE A 14 31.631 36.349 21.939 1.00 0.00 H new ATOM 0 HZ PHE A 14 32.673 34.208 22.534 1.00 0.00 H new ATOM 90 N GLU A 15 34.009 34.373 15.113 1.00 0.00 N ATOM 91 CA GLU A 15 34.872 33.319 14.680 1.00 0.00 C ATOM 92 C GLU A 15 36.157 33.442 15.425 1.00 0.00 C ATOM 93 O GLU A 15 36.768 34.509 15.452 1.00 0.00 O ATOM 94 CB GLU A 15 35.154 33.421 13.173 1.00 0.00 C ATOM 95 CG GLU A 15 33.910 33.425 12.281 1.00 0.00 C ATOM 96 CD GLU A 15 34.202 33.945 10.881 1.00 0.00 C ATOM 97 OE1 GLU A 15 35.397 34.120 10.524 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.225 34.237 10.141 1.00 0.00 O ATOM 0 H GLU A 15 34.174 35.246 14.612 1.00 0.00 H new ATOM 0 HA GLU A 15 34.393 32.359 14.873 1.00 0.00 H new ATOM 0 HB2 GLU A 15 35.720 34.333 12.985 1.00 0.00 H new ATOM 0 HB3 GLU A 15 35.790 32.586 12.880 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.511 32.413 12.214 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.138 34.042 12.741 1.00 0.00 H new ATOM 105 N VAL A 16 36.604 32.359 16.086 1.00 0.00 N ATOM 106 CA VAL A 16 37.758 32.350 16.931 1.00 0.00 C ATOM 107 C VAL A 16 38.750 31.392 16.366 1.00 0.00 C ATOM 108 O VAL A 16 38.483 30.195 16.271 1.00 0.00 O ATOM 109 CB VAL A 16 37.389 32.001 18.342 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.536 31.410 19.178 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.928 33.294 19.035 1.00 0.00 C ATOM 0 H VAL A 16 36.142 31.452 16.029 1.00 0.00 H new ATOM 0 HA VAL A 16 38.201 33.345 16.964 1.00 0.00 H new ATOM 0 HB VAL A 16 36.618 31.233 18.282 1.00 0.00 H new ATOM 0 HG11 VAL A 16 38.177 31.188 20.183 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.892 30.493 18.710 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.353 32.129 19.235 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.651 33.075 20.066 1.00 0.00 H new ATOM 0 HG22 VAL A 16 37.739 34.022 19.023 1.00 0.00 H new ATOM 0 HG23 VAL A 16 36.066 33.702 18.507 1.00 0.00 H new ATOM 121 N GLU A 17 39.946 31.861 15.967 1.00 0.00 N ATOM 122 CA GLU A 17 41.039 31.000 15.630 1.00 0.00 C ATOM 123 C GLU A 17 41.982 30.952 16.782 1.00 0.00 C ATOM 124 O GLU A 17 42.931 31.727 16.897 1.00 0.00 O ATOM 125 CB GLU A 17 41.750 31.403 14.328 1.00 0.00 C ATOM 126 CG GLU A 17 40.885 31.092 13.105 1.00 0.00 C ATOM 127 CD GLU A 17 41.629 31.335 11.799 1.00 0.00 C ATOM 128 OE1 GLU A 17 41.998 32.508 11.524 1.00 0.00 O ATOM 129 OE2 GLU A 17 41.835 30.354 11.035 1.00 0.00 O ATOM 0 H GLU A 17 40.159 32.855 15.877 1.00 0.00 H new ATOM 0 HA GLU A 17 40.641 30.004 15.436 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.981 32.468 14.352 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.699 30.872 14.250 1.00 0.00 H new ATOM 0 HG2 GLU A 17 40.558 30.053 13.148 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.987 31.710 13.130 1.00 0.00 H new ATOM 136 N LEU A 18 41.717 30.011 17.705 1.00 0.00 N ATOM 137 CA LEU A 18 42.419 29.867 18.942 1.00 0.00 C ATOM 138 C LEU A 18 43.498 28.849 18.806 1.00 0.00 C ATOM 139 O LEU A 18 43.312 27.783 18.220 1.00 0.00 O ATOM 140 CB LEU A 18 41.443 29.404 20.037 1.00 0.00 C ATOM 141 CG LEU A 18 42.027 29.213 21.447 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.575 30.530 22.022 1.00 0.00 C ATOM 143 CD2 LEU A 18 40.945 28.635 22.374 1.00 0.00 C ATOM 0 H LEU A 18 40.979 29.318 17.583 1.00 0.00 H new ATOM 0 HA LEU A 18 42.856 30.829 19.208 1.00 0.00 H new ATOM 0 HB2 LEU A 18 40.633 30.130 20.100 1.00 0.00 H new ATOM 0 HB3 LEU A 18 41.000 28.459 19.721 1.00 0.00 H new ATOM 0 HG LEU A 18 42.863 28.518 21.378 1.00 0.00 H new ATOM 0 HD11 LEU A 18 42.978 30.352 23.019 1.00 0.00 H new ATOM 0 HD12 LEU A 18 43.365 30.909 21.374 1.00 0.00 H new ATOM 0 HD13 LEU A 18 41.771 31.263 22.082 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.357 28.499 23.374 1.00 0.00 H new ATOM 0 HD22 LEU A 18 40.100 29.322 22.420 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.609 27.673 21.986 1.00 0.00 H new ATOM 155 N ALA A 19 44.694 29.115 19.364 1.00 0.00 N ATOM 156 CA ALA A 19 45.751 28.157 19.446 1.00 0.00 C ATOM 157 C ALA A 19 45.783 27.603 20.829 1.00 0.00 C ATOM 158 O ALA A 19 45.770 28.342 21.812 1.00 0.00 O ATOM 159 CB ALA A 19 47.105 28.765 19.047 1.00 0.00 C ATOM 0 H ALA A 19 44.931 30.021 19.769 1.00 0.00 H new ATOM 0 HA ALA A 19 45.562 27.351 18.737 1.00 0.00 H new ATOM 0 HB1 ALA A 19 47.882 28.004 19.123 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.052 29.129 18.021 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.342 29.594 19.714 1.00 0.00 H new ATOM 165 N LYS A 20 45.788 26.265 20.960 1.00 0.00 N ATOM 166 CA LYS A 20 45.851 25.618 22.233 1.00 0.00 C ATOM 167 C LYS A 20 47.177 25.761 22.897 1.00 0.00 C ATOM 168 O LYS A 20 48.228 25.607 22.276 1.00 0.00 O ATOM 169 CB LYS A 20 45.532 24.115 22.157 1.00 0.00 C ATOM 170 CG LYS A 20 44.164 23.831 21.534 1.00 0.00 C ATOM 171 CD LYS A 20 43.524 22.526 22.011 1.00 0.00 C ATOM 172 CE LYS A 20 44.171 21.249 21.472 1.00 0.00 C ATOM 173 NZ LYS A 20 43.452 20.055 21.969 1.00 0.00 N ATOM 0 H LYS A 20 45.748 25.622 20.169 1.00 0.00 H new ATOM 0 HA LYS A 20 45.090 26.129 22.822 1.00 0.00 H new ATOM 0 HB2 LYS A 20 46.304 23.613 21.573 1.00 0.00 H new ATOM 0 HB3 LYS A 20 45.565 23.690 23.160 1.00 0.00 H new ATOM 0 HG2 LYS A 20 43.493 24.658 21.763 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.270 23.797 20.450 1.00 0.00 H new ATOM 0 HD2 LYS A 20 43.558 22.500 23.100 1.00 0.00 H new ATOM 0 HD3 LYS A 20 42.472 22.530 21.725 1.00 0.00 H new ATOM 0 HE2 LYS A 20 44.159 21.260 20.382 1.00 0.00 H new ATOM 0 HE3 LYS A 20 45.216 21.206 21.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 43.944 19.196 21.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 43.426 20.073 23.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 42.480 20.056 21.598 1.00 0.00 H new ATOM 187 N THR A 21 47.178 26.051 24.211 1.00 0.00 N ATOM 188 CA THR A 21 48.359 26.106 25.014 1.00 0.00 C ATOM 189 C THR A 21 48.378 24.909 25.901 1.00 0.00 C ATOM 190 O THR A 21 47.440 24.669 26.659 1.00 0.00 O ATOM 191 CB THR A 21 48.500 27.358 25.830 1.00 0.00 C ATOM 192 OG1 THR A 21 47.300 27.723 26.495 1.00 0.00 O ATOM 193 CG2 THR A 21 48.842 28.499 24.857 1.00 0.00 C ATOM 0 H THR A 21 46.325 26.254 24.732 1.00 0.00 H new ATOM 0 HA THR A 21 49.209 26.115 24.332 1.00 0.00 H new ATOM 0 HB THR A 21 49.265 27.182 26.586 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.864 26.919 26.847 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.953 29.430 25.413 1.00 0.00 H new ATOM 0 HG22 THR A 21 49.775 28.270 24.342 1.00 0.00 H new ATOM 0 HG23 THR A 21 48.041 28.606 24.126 1.00 0.00 H new ATOM 201 N ASP A 22 49.435 24.086 25.787 1.00 0.00 N ATOM 202 CA ASP A 22 49.614 22.848 26.479 1.00 0.00 C ATOM 203 C ASP A 22 48.491 21.886 26.289 1.00 0.00 C ATOM 204 O ASP A 22 47.933 21.323 27.230 1.00 0.00 O ATOM 205 CB ASP A 22 50.017 23.102 27.941 1.00 0.00 C ATOM 206 CG ASP A 22 50.654 21.869 28.566 1.00 0.00 C ATOM 207 OD1 ASP A 22 51.584 21.310 27.928 1.00 0.00 O ATOM 208 OD2 ASP A 22 50.228 21.432 29.669 1.00 0.00 O ATOM 0 H ASP A 22 50.217 24.301 25.169 1.00 0.00 H new ATOM 0 HA ASP A 22 50.451 22.324 26.018 1.00 0.00 H new ATOM 0 HB2 ASP A 22 50.716 23.937 27.987 1.00 0.00 H new ATOM 0 HB3 ASP A 22 49.138 23.390 28.517 1.00 0.00 H new ATOM 213 N GLY A 23 48.088 21.675 25.023 1.00 0.00 N ATOM 214 CA GLY A 23 47.113 20.713 24.615 1.00 0.00 C ATOM 215 C GLY A 23 45.684 20.999 24.926 1.00 0.00 C ATOM 216 O GLY A 23 44.798 20.278 24.468 1.00 0.00 O ATOM 0 H GLY A 23 48.466 22.208 24.239 1.00 0.00 H new ATOM 0 HA2 GLY A 23 47.202 20.583 23.536 1.00 0.00 H new ATOM 0 HA3 GLY A 23 47.371 19.759 25.074 1.00 0.00 H new ATOM 220 N SER A 24 45.382 22.030 25.736 1.00 0.00 N ATOM 221 CA SER A 24 44.083 22.254 26.289 1.00 0.00 C ATOM 222 C SER A 24 43.552 23.588 25.890 1.00 0.00 C ATOM 223 O SER A 24 44.310 24.498 25.561 1.00 0.00 O ATOM 224 CB SER A 24 44.140 22.136 27.821 1.00 0.00 C ATOM 225 OG SER A 24 42.858 21.951 28.402 1.00 0.00 O ATOM 0 H SER A 24 46.067 22.732 26.015 1.00 0.00 H new ATOM 0 HA SER A 24 43.407 21.495 25.897 1.00 0.00 H new ATOM 0 HB2 SER A 24 44.783 21.299 28.094 1.00 0.00 H new ATOM 0 HB3 SER A 24 44.596 23.036 28.234 1.00 0.00 H new ATOM 0 HG SER A 24 42.947 21.880 29.375 1.00 0.00 H new ATOM 231 N LEU A 25 42.218 23.765 25.894 1.00 0.00 N ATOM 232 CA LEU A 25 41.558 24.966 25.484 1.00 0.00 C ATOM 233 C LEU A 25 41.296 25.855 26.652 1.00 0.00 C ATOM 234 O LEU A 25 41.769 26.989 26.699 1.00 0.00 O ATOM 235 CB LEU A 25 40.250 24.649 24.739 1.00 0.00 C ATOM 236 CG LEU A 25 40.469 23.946 23.390 1.00 0.00 C ATOM 237 CD1 LEU A 25 39.259 23.097 22.963 1.00 0.00 C ATOM 238 CD2 LEU A 25 40.821 24.941 22.271 1.00 0.00 C ATOM 0 H LEU A 25 41.570 23.037 26.197 1.00 0.00 H new ATOM 0 HA LEU A 25 42.220 25.493 24.797 1.00 0.00 H new ATOM 0 HB2 LEU A 25 39.625 24.019 25.371 1.00 0.00 H new ATOM 0 HB3 LEU A 25 39.702 25.576 24.572 1.00 0.00 H new ATOM 0 HG LEU A 25 41.316 23.278 23.544 1.00 0.00 H new ATOM 0 HD11 LEU A 25 39.467 22.623 22.004 1.00 0.00 H new ATOM 0 HD12 LEU A 25 39.070 22.330 23.714 1.00 0.00 H new ATOM 0 HD13 LEU A 25 38.381 23.736 22.869 1.00 0.00 H new ATOM 0 HD21 LEU A 25 40.967 24.400 21.336 1.00 0.00 H new ATOM 0 HD22 LEU A 25 40.008 25.658 22.153 1.00 0.00 H new ATOM 0 HD23 LEU A 25 41.737 25.471 22.530 1.00 0.00 H new ATOM 250 N GLY A 26 40.525 25.420 27.663 1.00 0.00 N ATOM 251 CA GLY A 26 40.289 26.130 28.883 1.00 0.00 C ATOM 252 C GLY A 26 38.826 26.303 29.113 1.00 0.00 C ATOM 253 O GLY A 26 38.380 27.360 29.554 1.00 0.00 O ATOM 0 H GLY A 26 40.039 24.524 27.628 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.733 25.587 29.718 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.774 27.105 28.843 1.00 0.00 H new ATOM 257 N ILE A 27 38.025 25.274 28.788 1.00 0.00 N ATOM 258 CA ILE A 27 36.610 25.399 28.620 1.00 0.00 C ATOM 259 C ILE A 27 35.859 24.385 29.411 1.00 0.00 C ATOM 260 O ILE A 27 36.247 23.221 29.511 1.00 0.00 O ATOM 261 CB ILE A 27 36.257 25.276 27.168 1.00 0.00 C ATOM 262 CG1 ILE A 27 36.696 23.946 26.532 1.00 0.00 C ATOM 263 CG2 ILE A 27 36.874 26.466 26.414 1.00 0.00 C ATOM 264 CD1 ILE A 27 36.395 23.868 25.037 1.00 0.00 C ATOM 0 H ILE A 27 38.371 24.326 28.637 1.00 0.00 H new ATOM 0 HA ILE A 27 36.321 26.383 28.990 1.00 0.00 H new ATOM 0 HB ILE A 27 35.170 25.286 27.092 1.00 0.00 H new ATOM 0 HG12 ILE A 27 37.766 23.811 26.688 1.00 0.00 H new ATOM 0 HG13 ILE A 27 36.193 23.124 27.041 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.627 26.393 25.355 1.00 0.00 H new ATOM 0 HG22 ILE A 27 36.476 27.398 26.816 1.00 0.00 H new ATOM 0 HG23 ILE A 27 37.957 26.452 26.536 1.00 0.00 H new ATOM 0 HD11 ILE A 27 36.729 22.906 24.648 1.00 0.00 H new ATOM 0 HD12 ILE A 27 35.322 23.972 24.876 1.00 0.00 H new ATOM 0 HD13 ILE A 27 36.919 24.670 24.518 1.00 0.00 H new ATOM 276 N SER A 28 34.719 24.791 29.998 1.00 0.00 N ATOM 277 CA SER A 28 33.739 23.909 30.550 1.00 0.00 C ATOM 278 C SER A 28 32.479 24.117 29.782 1.00 0.00 C ATOM 279 O SER A 28 31.950 25.227 29.772 1.00 0.00 O ATOM 280 CB SER A 28 33.499 24.173 32.046 1.00 0.00 C ATOM 281 OG SER A 28 32.612 23.229 32.626 1.00 0.00 O ATOM 0 H SER A 28 34.470 25.776 30.092 1.00 0.00 H new ATOM 0 HA SER A 28 34.089 22.880 30.471 1.00 0.00 H new ATOM 0 HB2 SER A 28 34.452 24.145 32.575 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.093 25.176 32.175 1.00 0.00 H new ATOM 0 HG SER A 28 32.491 23.435 33.576 1.00 0.00 H new ATOM 287 N VAL A 29 31.976 23.088 29.078 1.00 0.00 N ATOM 288 CA VAL A 29 30.771 23.144 28.308 1.00 0.00 C ATOM 289 C VAL A 29 29.682 22.361 28.956 1.00 0.00 C ATOM 290 O VAL A 29 29.925 21.523 29.822 1.00 0.00 O ATOM 291 CB VAL A 29 30.944 22.722 26.879 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.938 23.674 26.194 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.408 21.261 26.747 1.00 0.00 C ATOM 0 H VAL A 29 32.429 22.175 29.043 1.00 0.00 H new ATOM 0 HA VAL A 29 30.489 24.197 28.283 1.00 0.00 H new ATOM 0 HB VAL A 29 29.973 22.779 26.388 1.00 0.00 H new ATOM 0 HG11 VAL A 29 32.070 23.375 25.154 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.552 24.693 26.232 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.898 23.630 26.709 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.517 21.008 25.692 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.366 21.137 27.251 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.670 20.602 27.204 1.00 0.00 H new ATOM 303 N THR A 30 28.417 22.633 28.587 1.00 0.00 N ATOM 304 CA THR A 30 27.270 21.985 29.144 1.00 0.00 C ATOM 305 C THR A 30 26.149 21.916 28.165 1.00 0.00 C ATOM 306 O THR A 30 26.039 22.741 27.260 1.00 0.00 O ATOM 307 CB THR A 30 26.791 22.667 30.391 1.00 0.00 C ATOM 308 OG1 THR A 30 25.845 21.907 31.129 1.00 0.00 O ATOM 309 CG2 THR A 30 26.183 24.057 30.140 1.00 0.00 C ATOM 0 H THR A 30 28.185 23.327 27.877 1.00 0.00 H new ATOM 0 HA THR A 30 27.587 20.973 29.397 1.00 0.00 H new ATOM 0 HB THR A 30 27.705 22.773 30.976 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.576 22.406 31.928 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.859 24.489 31.087 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.932 24.704 29.683 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.327 23.964 29.472 1.00 0.00 H new ATOM 317 N GLY A 31 25.236 20.944 28.334 1.00 0.00 N ATOM 318 CA GLY A 31 23.996 20.894 27.624 1.00 0.00 C ATOM 319 C GLY A 31 23.797 19.620 26.879 1.00 0.00 C ATOM 320 O GLY A 31 23.920 18.527 27.428 1.00 0.00 O ATOM 0 H GLY A 31 25.364 20.169 28.985 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.176 21.027 28.329 1.00 0.00 H new ATOM 0 HA3 GLY A 31 23.952 21.728 26.923 1.00 0.00 H new ATOM 324 N GLY A 32 23.437 19.736 25.588 1.00 0.00 N ATOM 325 CA GLY A 32 23.186 18.625 24.723 1.00 0.00 C ATOM 326 C GLY A 32 21.818 18.739 24.145 1.00 0.00 C ATOM 327 O GLY A 32 21.314 19.838 23.921 1.00 0.00 O ATOM 0 H GLY A 32 23.316 20.639 25.129 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.928 18.598 23.925 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.281 17.691 25.277 1.00 0.00 H new ATOM 331 N VAL A 33 21.193 17.577 23.879 1.00 0.00 N ATOM 332 CA VAL A 33 19.825 17.440 23.489 1.00 0.00 C ATOM 333 C VAL A 33 19.183 16.495 24.446 1.00 0.00 C ATOM 334 O VAL A 33 18.079 16.689 24.953 1.00 0.00 O ATOM 335 CB VAL A 33 19.688 16.887 22.101 1.00 0.00 C ATOM 336 CG1 VAL A 33 18.217 16.612 21.746 1.00 0.00 C ATOM 337 CG2 VAL A 33 20.272 17.876 21.078 1.00 0.00 C ATOM 0 H VAL A 33 21.674 16.680 23.941 1.00 0.00 H new ATOM 0 HA VAL A 33 19.353 18.423 23.500 1.00 0.00 H new ATOM 0 HB VAL A 33 20.237 15.946 22.068 1.00 0.00 H new ATOM 0 HG11 VAL A 33 18.156 16.212 20.734 1.00 0.00 H new ATOM 0 HG12 VAL A 33 17.803 15.888 22.448 1.00 0.00 H new ATOM 0 HG13 VAL A 33 17.649 17.540 21.805 1.00 0.00 H new ATOM 0 HG21 VAL A 33 20.168 17.465 20.074 1.00 0.00 H new ATOM 0 HG22 VAL A 33 19.736 18.823 21.140 1.00 0.00 H new ATOM 0 HG23 VAL A 33 21.327 18.042 21.294 1.00 0.00 H new ATOM 347 N ASN A 34 19.887 15.385 24.730 1.00 0.00 N ATOM 348 CA ASN A 34 19.434 14.248 25.469 1.00 0.00 C ATOM 349 C ASN A 34 19.323 14.444 26.942 1.00 0.00 C ATOM 350 O ASN A 34 18.702 13.635 27.631 1.00 0.00 O ATOM 351 CB ASN A 34 20.354 13.064 25.131 1.00 0.00 C ATOM 352 CG ASN A 34 21.834 13.340 25.361 1.00 0.00 C ATOM 353 OD1 ASN A 34 22.421 14.276 24.822 1.00 0.00 O ATOM 354 ND2 ASN A 34 22.483 12.474 26.185 1.00 0.00 N ATOM 0 H ASN A 34 20.851 15.276 24.416 1.00 0.00 H new ATOM 0 HA ASN A 34 18.406 14.057 25.161 1.00 0.00 H new ATOM 0 HB2 ASN A 34 20.058 12.205 25.733 1.00 0.00 H new ATOM 0 HB3 ASN A 34 20.205 12.789 24.087 1.00 0.00 H new ATOM 0 HD21 ASN A 34 23.479 12.593 26.368 1.00 0.00 H new ATOM 0 HD22 ASN A 34 21.973 11.705 26.620 1.00 0.00 H new ATOM 361 N THR A 35 19.923 15.515 27.493 1.00 0.00 N ATOM 362 CA THR A 35 20.038 15.800 28.890 1.00 0.00 C ATOM 363 C THR A 35 18.833 16.498 29.420 1.00 0.00 C ATOM 364 O THR A 35 17.723 15.970 29.391 1.00 0.00 O ATOM 365 CB THR A 35 21.304 16.554 29.168 1.00 0.00 C ATOM 366 OG1 THR A 35 21.403 17.705 28.344 1.00 0.00 O ATOM 367 CG2 THR A 35 22.512 15.665 28.826 1.00 0.00 C ATOM 0 H THR A 35 20.360 16.235 26.917 1.00 0.00 H new ATOM 0 HA THR A 35 20.093 14.852 29.425 1.00 0.00 H new ATOM 0 HB THR A 35 21.293 16.841 30.220 1.00 0.00 H new ATOM 0 HG1 THR A 35 22.342 17.860 28.111 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.434 16.211 29.027 1.00 0.00 H new ATOM 0 HG22 THR A 35 22.484 14.762 29.437 1.00 0.00 H new ATOM 0 HG23 THR A 35 22.475 15.391 27.772 1.00 0.00 H new ATOM 375 N SER A 36 18.972 17.723 29.960 1.00 0.00 N ATOM 376 CA SER A 36 17.892 18.523 30.448 1.00 0.00 C ATOM 377 C SER A 36 17.357 19.425 29.388 1.00 0.00 C ATOM 378 O SER A 36 16.149 19.626 29.279 1.00 0.00 O ATOM 379 CB SER A 36 18.280 19.348 31.686 1.00 0.00 C ATOM 380 OG SER A 36 19.438 20.146 31.495 1.00 0.00 O ATOM 0 H SER A 36 19.880 18.176 30.061 1.00 0.00 H new ATOM 0 HA SER A 36 17.111 17.823 30.745 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.445 19.993 31.959 1.00 0.00 H new ATOM 0 HB3 SER A 36 18.448 18.672 32.525 1.00 0.00 H new ATOM 0 HG SER A 36 19.630 20.646 32.316 1.00 0.00 H new ATOM 386 N VAL A 37 18.237 19.991 28.544 1.00 0.00 N ATOM 387 CA VAL A 37 17.895 20.911 27.504 1.00 0.00 C ATOM 388 C VAL A 37 17.401 20.215 26.282 1.00 0.00 C ATOM 389 O VAL A 37 18.091 20.002 25.287 1.00 0.00 O ATOM 390 CB VAL A 37 19.004 21.894 27.272 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.353 21.211 26.990 1.00 0.00 C ATOM 392 CG2 VAL A 37 18.639 22.924 26.190 1.00 0.00 C ATOM 0 H VAL A 37 19.237 19.797 28.589 1.00 0.00 H new ATOM 0 HA VAL A 37 17.044 21.509 27.829 1.00 0.00 H new ATOM 0 HB VAL A 37 19.131 22.442 28.206 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.119 21.970 26.830 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.631 20.589 27.841 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.267 20.589 26.099 1.00 0.00 H new ATOM 0 HG21 VAL A 37 19.469 23.617 26.053 1.00 0.00 H new ATOM 0 HG22 VAL A 37 18.437 22.409 25.251 1.00 0.00 H new ATOM 0 HG23 VAL A 37 17.752 23.477 26.499 1.00 0.00 H new ATOM 402 N ARG A 38 16.111 19.838 26.307 1.00 0.00 N ATOM 403 CA ARG A 38 15.440 19.084 25.295 1.00 0.00 C ATOM 404 C ARG A 38 15.373 19.749 23.962 1.00 0.00 C ATOM 405 O ARG A 38 15.328 19.099 22.919 1.00 0.00 O ATOM 406 CB ARG A 38 14.028 18.687 25.760 1.00 0.00 C ATOM 407 CG ARG A 38 13.036 19.837 25.950 1.00 0.00 C ATOM 408 CD ARG A 38 11.669 19.356 26.442 1.00 0.00 C ATOM 409 NE ARG A 38 10.758 20.533 26.503 1.00 0.00 N ATOM 410 CZ ARG A 38 9.503 20.476 27.036 1.00 0.00 C ATOM 411 NH1 ARG A 38 9.001 19.334 27.589 1.00 0.00 N ATOM 412 NH2 ARG A 38 8.690 21.569 26.955 1.00 0.00 N ATOM 0 H ARG A 38 15.497 20.076 27.086 1.00 0.00 H new ATOM 0 HA ARG A 38 16.053 18.194 25.150 1.00 0.00 H new ATOM 0 HB2 ARG A 38 13.611 17.990 25.034 1.00 0.00 H new ATOM 0 HB3 ARG A 38 14.116 18.149 26.704 1.00 0.00 H new ATOM 0 HG2 ARG A 38 13.445 20.551 26.665 1.00 0.00 H new ATOM 0 HG3 ARG A 38 12.913 20.366 25.005 1.00 0.00 H new ATOM 0 HD2 ARG A 38 11.267 18.598 25.769 1.00 0.00 H new ATOM 0 HD3 ARG A 38 11.759 18.894 27.425 1.00 0.00 H new ATOM 0 HE ARG A 38 11.088 21.423 26.129 1.00 0.00 H new ATOM 0 HH11 ARG A 38 9.569 18.487 27.613 1.00 0.00 H new ATOM 0 HH12 ARG A 38 8.058 19.328 27.978 1.00 0.00 H new ATOM 0 HH21 ARG A 38 9.022 22.419 26.499 1.00 0.00 H new ATOM 0 HH22 ARG A 38 7.750 21.536 27.350 1.00 0.00 H new ATOM 426 N HIS A 39 15.404 21.093 23.932 1.00 0.00 N ATOM 427 CA HIS A 39 15.420 21.859 22.725 1.00 0.00 C ATOM 428 C HIS A 39 16.666 21.687 21.926 1.00 0.00 C ATOM 429 O HIS A 39 16.631 21.637 20.698 1.00 0.00 O ATOM 430 CB HIS A 39 15.244 23.358 23.021 1.00 0.00 C ATOM 431 CG HIS A 39 14.724 24.126 21.843 1.00 0.00 C ATOM 432 ND1 HIS A 39 15.503 24.811 20.932 1.00 0.00 N ATOM 433 CD2 HIS A 39 13.446 24.236 21.390 1.00 0.00 C ATOM 434 CE1 HIS A 39 14.665 25.300 19.980 1.00 0.00 C ATOM 435 NE2 HIS A 39 13.411 24.960 20.216 1.00 0.00 N ATOM 0 H HIS A 39 15.418 21.666 24.776 1.00 0.00 H new ATOM 0 HA HIS A 39 14.585 21.479 22.137 1.00 0.00 H new ATOM 0 HB2 HIS A 39 14.559 23.480 23.860 1.00 0.00 H new ATOM 0 HB3 HIS A 39 16.202 23.778 23.328 1.00 0.00 H new ATOM 0 HD2 HIS A 39 12.580 23.816 21.880 1.00 0.00 H new ATOM 0 HE1 HIS A 39 14.985 25.893 19.136 1.00 0.00 H new ATOM 0 HE2 HIS A 39 12.592 25.185 19.651 1.00 0.00 H new ATOM 443 N GLY A 40 17.823 21.562 22.602 1.00 0.00 N ATOM 444 CA GLY A 40 19.099 21.382 21.984 1.00 0.00 C ATOM 445 C GLY A 40 19.962 22.593 22.060 1.00 0.00 C ATOM 446 O GLY A 40 19.745 23.563 21.336 1.00 0.00 O ATOM 0 H GLY A 40 17.870 21.588 23.621 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.612 20.547 22.461 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.954 21.112 20.938 1.00 0.00 H new ATOM 450 N GLY A 41 20.994 22.564 22.923 1.00 0.00 N ATOM 451 CA GLY A 41 21.967 23.609 22.994 1.00 0.00 C ATOM 452 C GLY A 41 23.184 23.248 23.773 1.00 0.00 C ATOM 453 O GLY A 41 23.098 22.822 24.924 1.00 0.00 O ATOM 0 H GLY A 41 21.155 21.802 23.582 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.264 23.885 21.982 1.00 0.00 H new ATOM 0 HA3 GLY A 41 21.508 24.490 23.443 1.00 0.00 H new ATOM 457 N ILE A 42 24.376 23.449 23.183 1.00 0.00 N ATOM 458 CA ILE A 42 25.654 23.332 23.815 1.00 0.00 C ATOM 459 C ILE A 42 26.069 24.698 24.245 1.00 0.00 C ATOM 460 O ILE A 42 26.187 25.599 23.418 1.00 0.00 O ATOM 461 CB ILE A 42 26.702 22.767 22.902 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.273 21.452 22.229 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.040 22.581 23.638 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.119 20.264 23.177 1.00 0.00 C ATOM 0 H ILE A 42 24.451 23.710 22.200 1.00 0.00 H new ATOM 0 HA ILE A 42 25.562 22.646 24.657 1.00 0.00 H new ATOM 0 HB ILE A 42 26.834 23.501 22.107 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.324 21.615 21.718 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.007 21.196 21.465 1.00 0.00 H new ATOM 0 HG21 ILE A 42 28.779 22.170 22.951 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.387 23.545 24.011 1.00 0.00 H new ATOM 0 HG23 ILE A 42 27.903 21.896 24.475 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.814 19.384 22.611 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.071 20.067 23.671 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.362 20.493 23.927 1.00 0.00 H new ATOM 476 N TYR A 43 26.285 24.922 25.553 1.00 0.00 N ATOM 477 CA TYR A 43 26.575 26.214 26.094 1.00 0.00 C ATOM 478 C TYR A 43 27.870 26.187 26.832 1.00 0.00 C ATOM 479 O TYR A 43 28.304 25.155 27.343 1.00 0.00 O ATOM 480 CB TYR A 43 25.475 26.670 27.068 1.00 0.00 C ATOM 481 CG TYR A 43 24.455 27.498 26.366 1.00 0.00 C ATOM 482 CD1 TYR A 43 23.418 26.930 25.664 1.00 0.00 C ATOM 483 CD2 TYR A 43 24.539 28.869 26.441 1.00 0.00 C ATOM 484 CE1 TYR A 43 22.464 27.718 25.064 1.00 0.00 C ATOM 485 CE2 TYR A 43 23.590 29.666 25.847 1.00 0.00 C ATOM 486 CZ TYR A 43 22.546 29.087 25.165 1.00 0.00 C ATOM 487 OH TYR A 43 21.548 29.902 24.590 1.00 0.00 O ATOM 0 H TYR A 43 26.257 24.183 26.255 1.00 0.00 H new ATOM 0 HA TYR A 43 26.630 26.911 25.258 1.00 0.00 H new ATOM 0 HB2 TYR A 43 24.997 25.799 27.517 1.00 0.00 H new ATOM 0 HB3 TYR A 43 25.919 27.244 27.881 1.00 0.00 H new ATOM 0 HD1 TYR A 43 23.352 25.855 25.583 1.00 0.00 H new ATOM 0 HD2 TYR A 43 25.361 29.325 26.973 1.00 0.00 H new ATOM 0 HE1 TYR A 43 21.653 27.263 24.515 1.00 0.00 H new ATOM 0 HE2 TYR A 43 23.664 30.741 25.916 1.00 0.00 H new ATOM 0 HH TYR A 43 21.760 30.844 24.755 1.00 0.00 H new ATOM 497 N VAL A 44 28.536 27.351 26.936 1.00 0.00 N ATOM 498 CA VAL A 44 29.676 27.557 27.774 1.00 0.00 C ATOM 499 C VAL A 44 29.259 27.706 29.198 1.00 0.00 C ATOM 500 O VAL A 44 28.510 28.609 29.564 1.00 0.00 O ATOM 501 CB VAL A 44 30.534 28.706 27.333 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.829 28.757 28.160 1.00 0.00 C ATOM 503 CG2 VAL A 44 30.861 28.537 25.840 1.00 0.00 C ATOM 0 H VAL A 44 28.268 28.185 26.413 1.00 0.00 H new ATOM 0 HA VAL A 44 30.299 26.667 27.682 1.00 0.00 H new ATOM 0 HB VAL A 44 29.997 29.642 27.487 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.440 29.596 27.828 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.583 28.883 29.214 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.384 27.828 28.025 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.485 29.367 25.508 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.395 27.599 25.688 1.00 0.00 H new ATOM 0 HG23 VAL A 44 29.936 28.525 25.264 1.00 0.00 H new ATOM 513 N LYS A 45 29.737 26.805 30.075 1.00 0.00 N ATOM 514 CA LYS A 45 29.389 26.749 31.460 1.00 0.00 C ATOM 515 C LYS A 45 30.302 27.614 32.260 1.00 0.00 C ATOM 516 O LYS A 45 29.852 28.405 33.088 1.00 0.00 O ATOM 517 CB LYS A 45 29.455 25.297 31.962 1.00 0.00 C ATOM 518 CG LYS A 45 28.637 25.040 33.229 1.00 0.00 C ATOM 519 CD LYS A 45 28.726 23.595 33.721 1.00 0.00 C ATOM 520 CE LYS A 45 27.515 23.181 34.557 1.00 0.00 C ATOM 521 NZ LYS A 45 27.607 21.775 35.014 1.00 0.00 N ATOM 0 H LYS A 45 30.400 26.079 29.803 1.00 0.00 H new ATOM 0 HA LYS A 45 28.370 27.117 31.580 1.00 0.00 H new ATOM 0 HB2 LYS A 45 29.101 24.634 31.173 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.496 25.037 32.155 1.00 0.00 H new ATOM 0 HG2 LYS A 45 28.982 25.708 34.018 1.00 0.00 H new ATOM 0 HG3 LYS A 45 27.593 25.288 33.036 1.00 0.00 H new ATOM 0 HD2 LYS A 45 28.815 22.928 32.863 1.00 0.00 H new ATOM 0 HD3 LYS A 45 29.632 23.473 34.315 1.00 0.00 H new ATOM 0 HE2 LYS A 45 27.431 23.838 35.423 1.00 0.00 H new ATOM 0 HE3 LYS A 45 26.607 23.312 33.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 26.765 21.537 35.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 27.661 21.145 34.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 28.459 21.655 35.598 1.00 0.00 H new ATOM 535 N ALA A 46 31.620 27.505 32.014 1.00 0.00 N ATOM 536 CA ALA A 46 32.610 28.305 32.667 1.00 0.00 C ATOM 537 C ALA A 46 33.864 28.338 31.862 1.00 0.00 C ATOM 538 O ALA A 46 34.078 27.493 30.994 1.00 0.00 O ATOM 539 CB ALA A 46 32.920 27.764 34.073 1.00 0.00 C ATOM 0 H ALA A 46 32.008 26.842 31.343 1.00 0.00 H new ATOM 0 HA ALA A 46 32.211 29.315 32.761 1.00 0.00 H new ATOM 0 HB1 ALA A 46 33.676 28.391 34.546 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.011 27.774 34.675 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.293 26.743 33.996 1.00 0.00 H new ATOM 545 N ILE A 47 34.742 29.323 32.117 1.00 0.00 N ATOM 546 CA ILE A 47 36.020 29.451 31.488 1.00 0.00 C ATOM 547 C ILE A 47 37.108 29.321 32.497 1.00 0.00 C ATOM 548 O ILE A 47 37.078 29.934 33.562 1.00 0.00 O ATOM 549 CB ILE A 47 36.072 30.667 30.612 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.725 30.359 29.254 1.00 0.00 C ATOM 551 CG2 ILE A 47 36.724 31.897 31.265 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.813 29.570 28.315 1.00 0.00 C ATOM 0 H ILE A 47 34.553 30.064 32.792 1.00 0.00 H new ATOM 0 HA ILE A 47 36.187 28.626 30.795 1.00 0.00 H new ATOM 0 HB ILE A 47 35.029 30.938 30.451 1.00 0.00 H new ATOM 0 HG12 ILE A 47 37.009 31.295 28.773 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.643 29.794 29.419 1.00 0.00 H new ATOM 0 HG21 ILE A 47 36.719 32.729 30.561 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.164 32.174 32.158 1.00 0.00 H new ATOM 0 HG23 ILE A 47 37.752 31.661 31.540 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.332 29.385 27.374 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.550 28.619 28.778 1.00 0.00 H new ATOM 0 HD13 ILE A 47 34.906 30.143 28.122 1.00 0.00 H new ATOM 564 N ILE A 48 38.077 28.418 32.256 1.00 0.00 N ATOM 565 CA ILE A 48 39.084 28.003 33.182 1.00 0.00 C ATOM 566 C ILE A 48 40.232 28.929 33.402 1.00 0.00 C ATOM 567 O ILE A 48 40.928 29.170 32.417 1.00 0.00 O ATOM 568 CB ILE A 48 39.585 26.619 32.894 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.524 25.626 33.398 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.903 26.231 33.584 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.537 25.198 32.313 1.00 0.00 C ATOM 0 H ILE A 48 38.161 27.948 31.355 1.00 0.00 H new ATOM 0 HA ILE A 48 38.539 28.019 34.126 1.00 0.00 H new ATOM 0 HB ILE A 48 39.770 26.591 31.820 1.00 0.00 H new ATOM 0 HG12 ILE A 48 39.023 24.742 33.796 1.00 0.00 H new ATOM 0 HG13 ILE A 48 37.974 26.079 34.222 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.172 25.212 33.307 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.693 26.913 33.270 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.779 26.292 34.665 1.00 0.00 H new ATOM 0 HD11 ILE A 48 36.815 24.498 32.733 1.00 0.00 H new ATOM 0 HD12 ILE A 48 37.013 26.074 31.932 1.00 0.00 H new ATOM 0 HD13 ILE A 48 38.078 24.716 31.499 1.00 0.00 H new ATOM 583 N PRO A 49 40.570 29.417 34.557 1.00 0.00 N ATOM 584 CA PRO A 49 41.679 30.306 34.748 1.00 0.00 C ATOM 585 C PRO A 49 43.006 29.831 34.264 1.00 0.00 C ATOM 586 O PRO A 49 43.465 28.766 34.674 1.00 0.00 O ATOM 587 CB PRO A 49 41.713 30.560 36.253 1.00 0.00 C ATOM 588 CG PRO A 49 40.230 30.499 36.651 1.00 0.00 C ATOM 589 CD PRO A 49 39.721 29.372 35.738 1.00 0.00 C ATOM 0 HA PRO A 49 41.518 31.196 34.140 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.302 29.806 36.776 1.00 0.00 H new ATOM 0 HB3 PRO A 49 42.154 31.529 36.488 1.00 0.00 H new ATOM 0 HG2 PRO A 49 40.097 30.265 37.707 1.00 0.00 H new ATOM 0 HG3 PRO A 49 39.715 31.442 36.466 1.00 0.00 H new ATOM 0 HD2 PRO A 49 39.789 28.404 36.234 1.00 0.00 H new ATOM 0 HD3 PRO A 49 38.674 29.522 35.475 1.00 0.00 H new ATOM 597 N LYS A 50 43.627 30.608 33.358 1.00 0.00 N ATOM 598 CA LYS A 50 44.871 30.396 32.685 1.00 0.00 C ATOM 599 C LYS A 50 44.765 29.479 31.517 1.00 0.00 C ATOM 600 O LYS A 50 45.767 28.962 31.024 1.00 0.00 O ATOM 601 CB LYS A 50 46.071 30.110 33.605 1.00 0.00 C ATOM 602 CG LYS A 50 47.023 31.290 33.802 1.00 0.00 C ATOM 603 CD LYS A 50 47.804 31.681 32.545 1.00 0.00 C ATOM 604 CE LYS A 50 48.905 32.707 32.818 1.00 0.00 C ATOM 605 NZ LYS A 50 49.537 33.146 31.553 1.00 0.00 N ATOM 0 H LYS A 50 43.203 31.488 33.065 1.00 0.00 H new ATOM 0 HA LYS A 50 45.112 31.371 32.262 1.00 0.00 H new ATOM 0 HB2 LYS A 50 45.697 29.796 34.580 1.00 0.00 H new ATOM 0 HB3 LYS A 50 46.634 29.272 33.195 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.450 32.152 34.143 1.00 0.00 H new ATOM 0 HG3 LYS A 50 47.730 31.044 34.594 1.00 0.00 H new ATOM 0 HD2 LYS A 50 48.249 30.787 32.108 1.00 0.00 H new ATOM 0 HD3 LYS A 50 47.113 32.087 31.806 1.00 0.00 H new ATOM 0 HE2 LYS A 50 48.486 33.568 33.339 1.00 0.00 H new ATOM 0 HE3 LYS A 50 49.658 32.273 33.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 50.281 33.842 31.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 49.955 32.325 31.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 48.819 33.580 30.938 1.00 0.00 H new ATOM 619 N GLY A 51 43.555 29.258 30.974 1.00 0.00 N ATOM 620 CA GLY A 51 43.379 28.514 29.765 1.00 0.00 C ATOM 621 C GLY A 51 43.575 29.362 28.556 1.00 0.00 C ATOM 622 O GLY A 51 43.410 30.581 28.598 1.00 0.00 O ATOM 0 H GLY A 51 42.685 29.601 31.380 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.085 27.684 29.744 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.378 28.082 29.747 1.00 0.00 H new ATOM 626 N ALA A 52 43.911 28.746 27.408 1.00 0.00 N ATOM 627 CA ALA A 52 43.971 29.354 26.116 1.00 0.00 C ATOM 628 C ALA A 52 42.781 30.181 25.767 1.00 0.00 C ATOM 629 O ALA A 52 42.889 31.370 25.470 1.00 0.00 O ATOM 630 CB ALA A 52 44.209 28.296 25.026 1.00 0.00 C ATOM 0 H ALA A 52 44.157 27.756 27.383 1.00 0.00 H new ATOM 0 HA ALA A 52 44.815 30.042 26.164 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.251 28.781 24.051 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.151 27.783 25.217 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.393 27.573 25.036 1.00 0.00 H new ATOM 636 N ALA A 53 41.595 29.550 25.825 1.00 0.00 N ATOM 637 CA ALA A 53 40.292 30.088 25.585 1.00 0.00 C ATOM 638 C ALA A 53 39.917 31.150 26.559 1.00 0.00 C ATOM 639 O ALA A 53 39.523 32.246 26.166 1.00 0.00 O ATOM 640 CB ALA A 53 39.260 28.950 25.650 1.00 0.00 C ATOM 0 H ALA A 53 41.547 28.560 26.065 1.00 0.00 H new ATOM 0 HA ALA A 53 40.305 30.549 24.597 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.263 29.352 25.468 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.494 28.203 24.892 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.290 28.487 26.637 1.00 0.00 H new ATOM 646 N GLU A 54 40.061 30.846 27.861 1.00 0.00 N ATOM 647 CA GLU A 54 39.903 31.776 28.936 1.00 0.00 C ATOM 648 C GLU A 54 40.553 33.105 28.756 1.00 0.00 C ATOM 649 O GLU A 54 39.926 34.163 28.760 1.00 0.00 O ATOM 650 CB GLU A 54 40.455 31.184 30.245 1.00 0.00 C ATOM 651 CG GLU A 54 40.241 32.038 31.495 1.00 0.00 C ATOM 652 CD GLU A 54 41.411 32.831 32.063 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.597 32.572 31.728 1.00 0.00 O ATOM 654 OE2 GLU A 54 41.138 33.710 32.923 1.00 0.00 O ATOM 0 H GLU A 54 40.299 29.907 28.179 1.00 0.00 H new ATOM 0 HA GLU A 54 38.827 31.946 28.962 1.00 0.00 H new ATOM 0 HB2 GLU A 54 39.991 30.211 30.407 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.524 31.011 30.123 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.441 32.745 31.276 1.00 0.00 H new ATOM 0 HG3 GLU A 54 39.877 31.380 32.284 1.00 0.00 H new ATOM 661 N SER A 55 41.886 33.065 28.583 1.00 0.00 N ATOM 662 CA SER A 55 42.735 34.213 28.512 1.00 0.00 C ATOM 663 C SER A 55 42.520 35.034 27.288 1.00 0.00 C ATOM 664 O SER A 55 42.686 36.252 27.319 1.00 0.00 O ATOM 665 CB SER A 55 44.199 33.755 28.618 1.00 0.00 C ATOM 666 OG SER A 55 45.146 34.813 28.592 1.00 0.00 O ATOM 0 H SER A 55 42.397 32.187 28.488 1.00 0.00 H new ATOM 0 HA SER A 55 42.481 34.866 29.347 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.325 33.193 29.543 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.414 33.071 27.797 1.00 0.00 H new ATOM 0 HG SER A 55 46.051 34.444 28.665 1.00 0.00 H new ATOM 672 N ASP A 56 42.115 34.420 26.161 1.00 0.00 N ATOM 673 CA ASP A 56 41.925 35.068 24.900 1.00 0.00 C ATOM 674 C ASP A 56 40.885 36.135 24.921 1.00 0.00 C ATOM 675 O ASP A 56 41.169 37.285 24.593 1.00 0.00 O ATOM 676 CB ASP A 56 41.656 34.015 23.812 1.00 0.00 C ATOM 677 CG ASP A 56 41.883 34.596 22.424 1.00 0.00 C ATOM 678 OD1 ASP A 56 43.062 34.671 21.985 1.00 0.00 O ATOM 679 OD2 ASP A 56 40.886 35.030 21.786 1.00 0.00 O ATOM 0 H ASP A 56 41.910 33.421 26.128 1.00 0.00 H new ATOM 0 HA ASP A 56 42.850 35.595 24.665 1.00 0.00 H new ATOM 0 HB2 ASP A 56 42.310 33.156 23.962 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.631 33.654 23.896 1.00 0.00 H new ATOM 684 N GLY A 57 39.644 35.829 25.340 1.00 0.00 N ATOM 685 CA GLY A 57 38.719 36.842 25.742 1.00 0.00 C ATOM 686 C GLY A 57 37.550 37.069 24.846 1.00 0.00 C ATOM 687 O GLY A 57 36.701 37.917 25.120 1.00 0.00 O ATOM 0 H GLY A 57 39.281 34.878 25.400 1.00 0.00 H new ATOM 0 HA2 GLY A 57 38.344 36.588 26.734 1.00 0.00 H new ATOM 0 HA3 GLY A 57 39.263 37.782 25.838 1.00 0.00 H new ATOM 691 N ARG A 58 37.420 36.303 23.749 1.00 0.00 N ATOM 692 CA ARG A 58 36.189 36.225 23.024 1.00 0.00 C ATOM 693 C ARG A 58 35.200 35.396 23.769 1.00 0.00 C ATOM 694 O ARG A 58 34.103 35.859 24.077 1.00 0.00 O ATOM 695 CB ARG A 58 36.386 35.712 21.588 1.00 0.00 C ATOM 696 CG ARG A 58 37.237 36.587 20.665 1.00 0.00 C ATOM 697 CD ARG A 58 36.655 37.937 20.240 1.00 0.00 C ATOM 698 NE ARG A 58 36.784 38.917 21.354 1.00 0.00 N ATOM 699 CZ ARG A 58 37.941 39.562 21.687 1.00 0.00 C ATOM 700 NH1 ARG A 58 39.086 39.484 20.948 1.00 0.00 N ATOM 701 NH2 ARG A 58 38.005 40.317 22.822 1.00 0.00 N ATOM 0 H ARG A 58 38.172 35.734 23.361 1.00 0.00 H new ATOM 0 HA ARG A 58 35.795 37.238 22.936 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.842 34.723 21.638 1.00 0.00 H new ATOM 0 HB3 ARG A 58 35.404 35.588 21.132 1.00 0.00 H new ATOM 0 HG2 ARG A 58 38.190 36.772 21.161 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.453 36.014 19.763 1.00 0.00 H new ATOM 0 HD2 ARG A 58 37.177 38.306 19.357 1.00 0.00 H new ATOM 0 HD3 ARG A 58 35.607 37.821 19.966 1.00 0.00 H new ATOM 0 HE ARG A 58 35.951 39.121 21.906 1.00 0.00 H new ATOM 0 HH11 ARG A 58 39.107 38.921 20.097 1.00 0.00 H new ATOM 0 HH12 ARG A 58 39.921 39.988 21.246 1.00 0.00 H new ATOM 0 HH21 ARG A 58 37.187 40.401 23.425 1.00 0.00 H new ATOM 0 HH22 ARG A 58 38.871 40.797 23.067 1.00 0.00 H new ATOM 715 N ILE A 59 35.569 34.152 24.124 1.00 0.00 N ATOM 716 CA ILE A 59 34.714 33.175 24.724 1.00 0.00 C ATOM 717 C ILE A 59 34.501 33.415 26.178 1.00 0.00 C ATOM 718 O ILE A 59 35.456 33.576 26.937 1.00 0.00 O ATOM 719 CB ILE A 59 35.252 31.787 24.541 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.948 31.615 23.179 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.095 30.791 24.730 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.463 30.200 22.922 1.00 0.00 C ATOM 0 H ILE A 59 36.519 33.809 23.984 1.00 0.00 H new ATOM 0 HA ILE A 59 33.756 33.271 24.212 1.00 0.00 H new ATOM 0 HB ILE A 59 36.021 31.593 25.288 1.00 0.00 H new ATOM 0 HG12 ILE A 59 35.249 31.886 22.388 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.784 32.312 23.118 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.466 29.774 24.601 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.680 30.901 25.732 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.319 30.991 23.991 1.00 0.00 H new ATOM 0 HD11 ILE A 59 36.940 30.159 21.943 1.00 0.00 H new ATOM 0 HD12 ILE A 59 37.188 29.931 23.691 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.629 29.499 22.949 1.00 0.00 H new ATOM 734 N HIS A 60 33.236 33.457 26.634 1.00 0.00 N ATOM 735 CA HIS A 60 32.876 33.623 28.008 1.00 0.00 C ATOM 736 C HIS A 60 31.769 32.717 28.424 1.00 0.00 C ATOM 737 O HIS A 60 31.131 32.005 27.649 1.00 0.00 O ATOM 738 CB HIS A 60 32.473 35.084 28.270 1.00 0.00 C ATOM 739 CG HIS A 60 33.557 35.933 28.865 1.00 0.00 C ATOM 740 ND1 HIS A 60 34.891 35.860 28.523 1.00 0.00 N ATOM 741 CD2 HIS A 60 33.473 36.914 29.804 1.00 0.00 C ATOM 742 CE1 HIS A 60 35.544 36.792 29.267 1.00 0.00 C ATOM 743 NE2 HIS A 60 34.718 37.455 30.055 1.00 0.00 N ATOM 0 H HIS A 60 32.428 33.371 26.017 1.00 0.00 H new ATOM 0 HA HIS A 60 33.751 33.361 28.602 1.00 0.00 H new ATOM 0 HB2 HIS A 60 32.153 35.533 27.330 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.612 35.096 28.939 1.00 0.00 H new ATOM 0 HD1 HIS A 60 35.309 35.227 27.841 1.00 0.00 H new ATOM 0 HD2 HIS A 60 32.559 37.226 30.286 1.00 0.00 H new ATOM 0 HE1 HIS A 60 36.608 36.968 29.219 1.00 0.00 H new ATOM 751 N LYS A 61 31.485 32.711 29.739 1.00 0.00 N ATOM 752 CA LYS A 61 30.375 32.054 30.357 1.00 0.00 C ATOM 753 C LYS A 61 29.052 32.462 29.807 1.00 0.00 C ATOM 754 O LYS A 61 28.682 33.635 29.795 1.00 0.00 O ATOM 755 CB LYS A 61 30.405 32.361 31.864 1.00 0.00 C ATOM 756 CG LYS A 61 29.179 31.945 32.681 1.00 0.00 C ATOM 757 CD LYS A 61 29.280 32.462 34.118 1.00 0.00 C ATOM 758 CE LYS A 61 27.914 32.511 34.807 1.00 0.00 C ATOM 759 NZ LYS A 61 28.044 33.062 36.173 1.00 0.00 N ATOM 0 H LYS A 61 32.072 33.199 30.416 1.00 0.00 H new ATOM 0 HA LYS A 61 30.481 30.988 30.153 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.280 31.872 32.292 1.00 0.00 H new ATOM 0 HB3 LYS A 61 30.547 33.434 31.989 1.00 0.00 H new ATOM 0 HG2 LYS A 61 28.275 32.335 32.213 1.00 0.00 H new ATOM 0 HG3 LYS A 61 29.092 30.858 32.686 1.00 0.00 H new ATOM 0 HD2 LYS A 61 29.951 31.819 34.688 1.00 0.00 H new ATOM 0 HD3 LYS A 61 29.720 33.459 34.114 1.00 0.00 H new ATOM 0 HE2 LYS A 61 27.228 33.125 34.224 1.00 0.00 H new ATOM 0 HE3 LYS A 61 27.486 31.510 34.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 27.109 33.089 36.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 28.683 32.460 36.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 28.432 34.026 36.123 1.00 0.00 H new ATOM 773 N GLY A 62 28.268 31.474 29.337 1.00 0.00 N ATOM 774 CA GLY A 62 26.961 31.696 28.801 1.00 0.00 C ATOM 775 C GLY A 62 26.933 31.840 27.318 1.00 0.00 C ATOM 776 O GLY A 62 25.877 32.117 26.752 1.00 0.00 O ATOM 0 H GLY A 62 28.551 30.494 29.330 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.316 30.866 29.088 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.542 32.596 29.252 1.00 0.00 H new ATOM 780 N ASP A 63 28.073 31.669 26.623 1.00 0.00 N ATOM 781 CA ASP A 63 28.078 31.679 25.194 1.00 0.00 C ATOM 782 C ASP A 63 27.614 30.380 24.630 1.00 0.00 C ATOM 783 O ASP A 63 27.570 29.359 25.315 1.00 0.00 O ATOM 784 CB ASP A 63 29.469 32.060 24.659 1.00 0.00 C ATOM 785 CG ASP A 63 29.825 33.497 25.012 1.00 0.00 C ATOM 786 OD1 ASP A 63 28.896 34.313 25.248 1.00 0.00 O ATOM 787 OD2 ASP A 63 31.046 33.810 24.991 1.00 0.00 O ATOM 0 H ASP A 63 28.988 31.524 27.050 1.00 0.00 H new ATOM 0 HA ASP A 63 27.369 32.438 24.865 1.00 0.00 H new ATOM 0 HB2 ASP A 63 30.218 31.385 25.075 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.491 31.933 23.577 1.00 0.00 H new ATOM 792 N ARG A 64 27.222 30.350 23.344 1.00 0.00 N ATOM 793 CA ARG A 64 26.622 29.210 22.724 1.00 0.00 C ATOM 794 C ARG A 64 27.432 28.745 21.562 1.00 0.00 C ATOM 795 O ARG A 64 27.699 29.497 20.626 1.00 0.00 O ATOM 796 CB ARG A 64 25.201 29.577 22.264 1.00 0.00 C ATOM 797 CG ARG A 64 24.423 28.454 21.574 1.00 0.00 C ATOM 798 CD ARG A 64 23.023 28.911 21.161 1.00 0.00 C ATOM 799 NE ARG A 64 22.317 27.725 20.599 1.00 0.00 N ATOM 800 CZ ARG A 64 21.008 27.429 20.847 1.00 0.00 C ATOM 801 NH1 ARG A 64 20.176 28.260 21.541 1.00 0.00 N ATOM 802 NH2 ARG A 64 20.520 26.231 20.414 1.00 0.00 N ATOM 0 H ARG A 64 27.326 31.146 22.715 1.00 0.00 H new ATOM 0 HA ARG A 64 26.578 28.397 23.448 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.631 29.910 23.132 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.266 30.424 21.581 1.00 0.00 H new ATOM 0 HG2 ARG A 64 24.971 28.118 20.694 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.344 27.599 22.246 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.481 29.310 22.018 1.00 0.00 H new ATOM 0 HD3 ARG A 64 23.082 29.709 20.421 1.00 0.00 H new ATOM 0 HE ARG A 64 22.844 27.097 19.992 1.00 0.00 H new ATOM 0 HH11 ARG A 64 20.526 29.148 21.900 1.00 0.00 H new ATOM 0 HH12 ARG A 64 19.205 27.993 21.700 1.00 0.00 H new ATOM 0 HH21 ARG A 64 21.130 25.581 19.918 1.00 0.00 H new ATOM 0 HH22 ARG A 64 19.545 25.985 20.586 1.00 0.00 H new ATOM 816 N VAL A 65 27.864 27.471 21.553 1.00 0.00 N ATOM 817 CA VAL A 65 28.783 26.966 20.581 1.00 0.00 C ATOM 818 C VAL A 65 28.094 26.570 19.320 1.00 0.00 C ATOM 819 O VAL A 65 27.144 25.788 19.350 1.00 0.00 O ATOM 820 CB VAL A 65 29.593 25.821 21.113 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.780 25.539 20.177 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.118 26.162 22.517 1.00 0.00 C ATOM 0 H VAL A 65 27.567 26.776 22.238 1.00 0.00 H new ATOM 0 HA VAL A 65 29.467 27.784 20.353 1.00 0.00 H new ATOM 0 HB VAL A 65 28.960 24.936 21.168 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.363 24.706 20.570 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.408 25.285 19.184 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.411 26.425 20.112 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.706 25.327 22.898 1.00 0.00 H new ATOM 0 HG22 VAL A 65 30.744 27.053 22.465 1.00 0.00 H new ATOM 0 HG23 VAL A 65 29.277 26.349 23.185 1.00 0.00 H new ATOM 832 N LEU A 66 28.515 27.096 18.156 1.00 0.00 N ATOM 833 CA LEU A 66 27.877 26.824 16.906 1.00 0.00 C ATOM 834 C LEU A 66 28.643 25.849 16.080 1.00 0.00 C ATOM 835 O LEU A 66 28.068 24.921 15.514 1.00 0.00 O ATOM 836 CB LEU A 66 27.643 28.097 16.076 1.00 0.00 C ATOM 837 CG LEU A 66 26.772 29.175 16.743 1.00 0.00 C ATOM 838 CD1 LEU A 66 26.599 30.357 15.774 1.00 0.00 C ATOM 839 CD2 LEU A 66 25.398 28.655 17.196 1.00 0.00 C ATOM 0 H LEU A 66 29.316 27.724 18.082 1.00 0.00 H new ATOM 0 HA LEU A 66 26.912 26.390 17.168 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.612 28.535 15.836 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.178 27.813 15.132 1.00 0.00 H new ATOM 0 HG LEU A 66 27.290 29.494 17.648 1.00 0.00 H new ATOM 0 HD11 LEU A 66 25.982 31.124 16.242 1.00 0.00 H new ATOM 0 HD12 LEU A 66 27.576 30.775 15.532 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.116 30.011 14.860 1.00 0.00 H new ATOM 0 HD21 LEU A 66 24.836 29.467 17.658 1.00 0.00 H new ATOM 0 HD22 LEU A 66 24.849 28.278 16.333 1.00 0.00 H new ATOM 0 HD23 LEU A 66 25.534 27.851 17.919 1.00 0.00 H new ATOM 851 N ALA A 67 29.976 25.993 15.973 1.00 0.00 N ATOM 852 CA ALA A 67 30.765 25.120 15.161 1.00 0.00 C ATOM 853 C ALA A 67 32.150 24.955 15.687 1.00 0.00 C ATOM 854 O ALA A 67 32.776 25.900 16.164 1.00 0.00 O ATOM 855 CB ALA A 67 30.875 25.621 13.711 1.00 0.00 C ATOM 0 H ALA A 67 30.510 26.718 16.452 1.00 0.00 H new ATOM 0 HA ALA A 67 30.245 24.163 15.186 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.483 24.927 13.131 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.879 25.685 13.272 1.00 0.00 H new ATOM 0 HB3 ALA A 67 31.340 26.607 13.701 1.00 0.00 H new ATOM 861 N VAL A 68 32.669 23.718 15.600 1.00 0.00 N ATOM 862 CA VAL A 68 34.019 23.404 15.954 1.00 0.00 C ATOM 863 C VAL A 68 34.769 23.019 14.725 1.00 0.00 C ATOM 864 O VAL A 68 34.473 22.011 14.084 1.00 0.00 O ATOM 865 CB VAL A 68 34.135 22.293 16.955 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.598 22.172 17.415 1.00 0.00 C ATOM 867 CG2 VAL A 68 33.216 22.525 18.166 1.00 0.00 C ATOM 0 H VAL A 68 32.135 22.912 15.274 1.00 0.00 H new ATOM 0 HA VAL A 68 34.435 24.298 16.418 1.00 0.00 H new ATOM 0 HB VAL A 68 33.820 21.366 16.477 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.685 21.365 18.143 1.00 0.00 H new ATOM 0 HG12 VAL A 68 36.233 21.956 16.556 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.914 23.109 17.873 1.00 0.00 H new ATOM 0 HG21 VAL A 68 33.327 21.700 18.870 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.489 23.460 18.656 1.00 0.00 H new ATOM 0 HG23 VAL A 68 32.180 22.580 17.831 1.00 0.00 H new ATOM 877 N ASN A 69 35.785 23.808 14.335 1.00 0.00 N ATOM 878 CA ASN A 69 36.740 23.525 13.309 1.00 0.00 C ATOM 879 C ASN A 69 36.159 23.266 11.963 1.00 0.00 C ATOM 880 O ASN A 69 36.577 22.359 11.244 1.00 0.00 O ATOM 881 CB ASN A 69 37.717 22.434 13.781 1.00 0.00 C ATOM 882 CG ASN A 69 39.104 22.554 13.169 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.555 23.613 12.734 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.847 21.415 13.189 1.00 0.00 N ATOM 0 H ASN A 69 35.951 24.715 14.772 1.00 0.00 H new ATOM 0 HA ASN A 69 37.307 24.442 13.148 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.803 22.479 14.867 1.00 0.00 H new ATOM 0 HB3 ASN A 69 37.303 21.456 13.535 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.804 21.424 12.837 1.00 0.00 H new ATOM 0 HD22 ASN A 69 39.447 20.551 13.556 1.00 0.00 H new ATOM 891 N GLY A 70 35.150 24.058 11.561 1.00 0.00 N ATOM 892 CA GLY A 70 34.446 23.900 10.325 1.00 0.00 C ATOM 893 C GLY A 70 33.164 23.153 10.461 1.00 0.00 C ATOM 894 O GLY A 70 32.258 23.320 9.646 1.00 0.00 O ATOM 0 H GLY A 70 34.810 24.841 12.119 1.00 0.00 H new ATOM 0 HA2 GLY A 70 34.241 24.885 9.905 1.00 0.00 H new ATOM 0 HA3 GLY A 70 35.088 23.378 9.615 1.00 0.00 H new ATOM 898 N VAL A 71 33.026 22.286 11.480 1.00 0.00 N ATOM 899 CA VAL A 71 31.910 21.407 11.637 1.00 0.00 C ATOM 900 C VAL A 71 30.880 22.027 12.517 1.00 0.00 C ATOM 901 O VAL A 71 31.096 22.216 13.713 1.00 0.00 O ATOM 902 CB VAL A 71 32.293 20.063 12.184 1.00 0.00 C ATOM 903 CG1 VAL A 71 31.088 19.108 12.189 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.428 19.469 11.335 1.00 0.00 C ATOM 0 H VAL A 71 33.719 22.194 12.223 1.00 0.00 H new ATOM 0 HA VAL A 71 31.503 21.247 10.639 1.00 0.00 H new ATOM 0 HB VAL A 71 32.631 20.189 13.213 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.392 18.141 12.590 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.295 19.525 12.810 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.721 18.980 11.171 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.707 18.493 11.732 1.00 0.00 H new ATOM 0 HG22 VAL A 71 33.092 19.359 10.304 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.292 20.133 11.366 1.00 0.00 H new ATOM 914 N SER A 72 29.700 22.382 11.978 1.00 0.00 N ATOM 915 CA SER A 72 28.652 22.919 12.788 1.00 0.00 C ATOM 916 C SER A 72 27.947 21.881 13.591 1.00 0.00 C ATOM 917 O SER A 72 27.703 20.755 13.160 1.00 0.00 O ATOM 918 CB SER A 72 27.655 23.851 12.078 1.00 0.00 C ATOM 919 OG SER A 72 26.949 23.239 11.010 1.00 0.00 O ATOM 0 H SER A 72 29.473 22.298 10.987 1.00 0.00 H new ATOM 0 HA SER A 72 29.195 23.572 13.472 1.00 0.00 H new ATOM 0 HB2 SER A 72 26.936 24.221 12.809 1.00 0.00 H new ATOM 0 HB3 SER A 72 28.194 24.717 11.694 1.00 0.00 H new ATOM 0 HG SER A 72 26.335 23.889 10.609 1.00 0.00 H new ATOM 925 N LEU A 73 27.608 22.233 14.844 1.00 0.00 N ATOM 926 CA LEU A 73 27.137 21.322 15.840 1.00 0.00 C ATOM 927 C LEU A 73 25.666 21.098 15.751 1.00 0.00 C ATOM 928 O LEU A 73 24.949 21.037 16.747 1.00 0.00 O ATOM 929 CB LEU A 73 27.481 21.830 17.251 1.00 0.00 C ATOM 930 CG LEU A 73 28.985 21.969 17.542 1.00 0.00 C ATOM 931 CD1 LEU A 73 29.172 22.565 18.948 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.742 20.635 17.433 1.00 0.00 C ATOM 0 H LEU A 73 27.665 23.195 15.177 1.00 0.00 H new ATOM 0 HA LEU A 73 27.641 20.373 15.654 1.00 0.00 H new ATOM 0 HB2 LEU A 73 27.007 22.800 17.397 1.00 0.00 H new ATOM 0 HB3 LEU A 73 27.046 21.149 17.982 1.00 0.00 H new ATOM 0 HG LEU A 73 29.407 22.630 16.785 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.236 22.667 19.162 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.698 23.545 18.994 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.715 21.906 19.686 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.798 20.797 17.649 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.330 19.923 18.149 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.635 20.237 16.424 1.00 0.00 H new ATOM 944 N GLU A 74 25.131 20.957 14.525 1.00 0.00 N ATOM 945 CA GLU A 74 23.737 20.769 14.265 1.00 0.00 C ATOM 946 C GLU A 74 23.276 19.404 14.646 1.00 0.00 C ATOM 947 O GLU A 74 23.804 18.386 14.202 1.00 0.00 O ATOM 948 CB GLU A 74 23.393 21.078 12.798 1.00 0.00 C ATOM 949 CG GLU A 74 24.269 20.372 11.762 1.00 0.00 C ATOM 950 CD GLU A 74 23.833 20.636 10.327 1.00 0.00 C ATOM 951 OE1 GLU A 74 22.754 21.243 10.091 1.00 0.00 O ATOM 952 OE2 GLU A 74 24.576 20.214 9.401 1.00 0.00 O ATOM 0 H GLU A 74 25.696 20.975 13.676 1.00 0.00 H new ATOM 0 HA GLU A 74 23.200 21.479 14.893 1.00 0.00 H new ATOM 0 HB2 GLU A 74 22.353 20.803 12.619 1.00 0.00 H new ATOM 0 HB3 GLU A 74 23.469 22.154 12.642 1.00 0.00 H new ATOM 0 HG2 GLU A 74 25.302 20.698 11.887 1.00 0.00 H new ATOM 0 HG3 GLU A 74 24.248 19.298 11.949 1.00 0.00 H new ATOM 959 N GLY A 75 22.285 19.343 15.555 1.00 0.00 N ATOM 960 CA GLY A 75 21.691 18.140 16.046 1.00 0.00 C ATOM 961 C GLY A 75 22.551 17.309 16.935 1.00 0.00 C ATOM 962 O GLY A 75 22.231 16.153 17.204 1.00 0.00 O ATOM 0 H GLY A 75 21.877 20.181 15.969 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.783 18.401 16.590 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.388 17.532 15.193 1.00 0.00 H new ATOM 966 N ALA A 76 23.696 17.840 17.398 1.00 0.00 N ATOM 967 CA ALA A 76 24.615 17.121 18.225 1.00 0.00 C ATOM 968 C ALA A 76 24.168 16.903 19.629 1.00 0.00 C ATOM 969 O ALA A 76 23.528 17.747 20.254 1.00 0.00 O ATOM 970 CB ALA A 76 26.014 17.762 18.202 1.00 0.00 C ATOM 0 H ALA A 76 23.991 18.794 17.192 1.00 0.00 H new ATOM 0 HA ALA A 76 24.658 16.129 17.776 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.687 17.190 18.841 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.397 17.763 17.181 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.951 18.787 18.567 1.00 0.00 H new ATOM 976 N THR A 77 24.502 15.730 20.196 1.00 0.00 N ATOM 977 CA THR A 77 24.273 15.369 21.560 1.00 0.00 C ATOM 978 C THR A 77 25.439 15.709 22.424 1.00 0.00 C ATOM 979 O THR A 77 26.440 16.264 21.973 1.00 0.00 O ATOM 980 CB THR A 77 23.823 13.948 21.726 1.00 0.00 C ATOM 981 OG1 THR A 77 24.425 13.080 20.777 1.00 0.00 O ATOM 982 CG2 THR A 77 22.313 13.883 21.437 1.00 0.00 C ATOM 0 H THR A 77 24.961 14.988 19.668 1.00 0.00 H new ATOM 0 HA THR A 77 23.436 15.977 21.904 1.00 0.00 H new ATOM 0 HB THR A 77 24.092 13.641 22.737 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.308 12.804 21.100 1.00 0.00 H new ATOM 0 HG21 THR A 77 21.964 12.857 21.552 1.00 0.00 H new ATOM 0 HG22 THR A 77 21.781 14.528 22.136 1.00 0.00 H new ATOM 0 HG23 THR A 77 22.123 14.218 20.417 1.00 0.00 H new ATOM 990 N HIS A 78 25.339 15.441 23.738 1.00 0.00 N ATOM 991 CA HIS A 78 26.244 15.874 24.757 1.00 0.00 C ATOM 992 C HIS A 78 27.668 15.472 24.576 1.00 0.00 C ATOM 993 O HIS A 78 28.567 16.311 24.618 1.00 0.00 O ATOM 994 CB HIS A 78 25.720 15.349 26.105 1.00 0.00 C ATOM 995 CG HIS A 78 26.484 15.745 27.333 1.00 0.00 C ATOM 996 ND1 HIS A 78 27.125 14.848 28.163 1.00 0.00 N ATOM 997 CD2 HIS A 78 26.600 16.958 27.939 1.00 0.00 C ATOM 998 CE1 HIS A 78 27.591 15.560 29.225 1.00 0.00 C ATOM 999 NE2 HIS A 78 27.290 16.842 29.129 1.00 0.00 N ATOM 0 H HIS A 78 24.572 14.883 24.113 1.00 0.00 H new ATOM 0 HA HIS A 78 26.266 16.963 24.707 1.00 0.00 H new ATOM 0 HB2 HIS A 78 24.690 15.687 26.223 1.00 0.00 H new ATOM 0 HB3 HIS A 78 25.695 14.260 26.058 1.00 0.00 H new ATOM 0 HD2 HIS A 78 26.207 17.883 27.544 1.00 0.00 H new ATOM 0 HE1 HIS A 78 28.141 15.128 30.048 1.00 0.00 H new ATOM 0 HE2 HIS A 78 27.518 17.585 29.790 1.00 0.00 H new ATOM 1007 N LYS A 79 27.928 14.169 24.371 1.00 0.00 N ATOM 1008 CA LYS A 79 29.227 13.616 24.141 1.00 0.00 C ATOM 1009 C LYS A 79 29.961 14.177 22.973 1.00 0.00 C ATOM 1010 O LYS A 79 31.165 14.426 23.031 1.00 0.00 O ATOM 1011 CB LYS A 79 29.121 12.090 23.987 1.00 0.00 C ATOM 1012 CG LYS A 79 30.406 11.335 24.335 1.00 0.00 C ATOM 1013 CD LYS A 79 30.462 10.910 25.804 1.00 0.00 C ATOM 1014 CE LYS A 79 30.130 9.442 26.079 1.00 0.00 C ATOM 1015 NZ LYS A 79 28.812 9.053 25.531 1.00 0.00 N ATOM 0 H LYS A 79 27.192 13.463 24.365 1.00 0.00 H new ATOM 0 HA LYS A 79 29.813 13.894 25.017 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.315 11.727 24.625 1.00 0.00 H new ATOM 0 HB3 LYS A 79 28.843 11.858 22.959 1.00 0.00 H new ATOM 0 HG2 LYS A 79 30.486 10.451 23.702 1.00 0.00 H new ATOM 0 HG3 LYS A 79 31.266 11.967 24.111 1.00 0.00 H new ATOM 0 HD2 LYS A 79 31.462 11.116 26.186 1.00 0.00 H new ATOM 0 HD3 LYS A 79 29.770 11.533 26.371 1.00 0.00 H new ATOM 0 HE2 LYS A 79 30.903 8.809 25.644 1.00 0.00 H new ATOM 0 HE3 LYS A 79 30.141 9.264 27.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 28.631 8.051 25.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 28.069 9.638 25.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 28.808 9.196 24.501 1.00 0.00 H new ATOM 1029 N GLN A 80 29.250 14.413 21.855 1.00 0.00 N ATOM 1030 CA GLN A 80 29.765 14.798 20.578 1.00 0.00 C ATOM 1031 C GLN A 80 30.575 16.048 20.624 1.00 0.00 C ATOM 1032 O GLN A 80 31.719 16.089 20.174 1.00 0.00 O ATOM 1033 CB GLN A 80 28.604 15.006 19.591 1.00 0.00 C ATOM 1034 CG GLN A 80 28.018 13.740 18.963 1.00 0.00 C ATOM 1035 CD GLN A 80 27.581 12.674 19.958 1.00 0.00 C ATOM 1036 OE1 GLN A 80 27.008 12.944 21.013 1.00 0.00 O ATOM 1037 NE2 GLN A 80 27.840 11.386 19.609 1.00 0.00 N ATOM 0 H GLN A 80 28.234 14.327 21.846 1.00 0.00 H new ATOM 0 HA GLN A 80 30.421 13.990 20.254 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.803 15.534 20.110 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.949 15.659 18.789 1.00 0.00 H new ATOM 0 HG2 GLN A 80 27.160 14.019 18.351 1.00 0.00 H new ATOM 0 HG3 GLN A 80 28.760 13.308 18.292 1.00 0.00 H new ATOM 0 HE21 GLN A 80 28.316 11.182 18.730 1.00 0.00 H new ATOM 0 HE22 GLN A 80 27.558 10.624 20.226 1.00 0.00 H new ATOM 1046 N ALA A 81 30.004 17.108 21.225 1.00 0.00 N ATOM 1047 CA ALA A 81 30.613 18.377 21.471 1.00 0.00 C ATOM 1048 C ALA A 81 31.848 18.301 22.300 1.00 0.00 C ATOM 1049 O ALA A 81 32.828 18.985 22.011 1.00 0.00 O ATOM 1050 CB ALA A 81 29.552 19.224 22.195 1.00 0.00 C ATOM 0 H ALA A 81 29.043 17.072 21.564 1.00 0.00 H new ATOM 0 HA ALA A 81 30.931 18.808 20.522 1.00 0.00 H new ATOM 0 HB1 ALA A 81 29.960 20.211 22.411 1.00 0.00 H new ATOM 0 HB2 ALA A 81 28.672 19.326 21.559 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.271 18.735 23.128 1.00 0.00 H new ATOM 1056 N VAL A 82 31.883 17.435 23.329 1.00 0.00 N ATOM 1057 CA VAL A 82 33.012 17.214 24.178 1.00 0.00 C ATOM 1058 C VAL A 82 34.122 16.567 23.422 1.00 0.00 C ATOM 1059 O VAL A 82 35.246 17.064 23.386 1.00 0.00 O ATOM 1060 CB VAL A 82 32.683 16.381 25.381 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.934 16.121 26.236 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.633 17.125 26.224 1.00 0.00 C ATOM 0 H VAL A 82 31.080 16.859 23.581 1.00 0.00 H new ATOM 0 HA VAL A 82 33.323 18.197 24.530 1.00 0.00 H new ATOM 0 HB VAL A 82 32.295 15.419 25.047 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.664 15.515 27.101 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.678 15.593 25.640 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.348 17.071 26.574 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.384 16.530 27.103 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.035 18.088 26.539 1.00 0.00 H new ATOM 0 HG23 VAL A 82 30.735 17.285 25.628 1.00 0.00 H new ATOM 1072 N GLU A 83 33.841 15.439 22.745 1.00 0.00 N ATOM 1073 CA GLU A 83 34.819 14.704 22.004 1.00 0.00 C ATOM 1074 C GLU A 83 35.429 15.475 20.885 1.00 0.00 C ATOM 1075 O GLU A 83 36.631 15.399 20.633 1.00 0.00 O ATOM 1076 CB GLU A 83 34.231 13.411 21.412 1.00 0.00 C ATOM 1077 CG GLU A 83 33.839 12.372 22.464 1.00 0.00 C ATOM 1078 CD GLU A 83 33.515 11.037 21.811 1.00 0.00 C ATOM 1079 OE1 GLU A 83 32.686 10.984 20.863 1.00 0.00 O ATOM 1080 OE2 GLU A 83 34.124 10.016 22.230 1.00 0.00 O ATOM 0 H GLU A 83 32.909 15.027 22.712 1.00 0.00 H new ATOM 0 HA GLU A 83 35.595 14.478 22.735 1.00 0.00 H new ATOM 0 HB2 GLU A 83 33.352 13.662 20.818 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.960 12.969 20.733 1.00 0.00 H new ATOM 0 HG2 GLU A 83 34.654 12.245 23.177 1.00 0.00 H new ATOM 0 HG3 GLU A 83 32.975 12.726 23.027 1.00 0.00 H new ATOM 1087 N THR A 84 34.596 16.276 20.198 1.00 0.00 N ATOM 1088 CA THR A 84 34.938 17.156 19.124 1.00 0.00 C ATOM 1089 C THR A 84 35.809 18.283 19.560 1.00 0.00 C ATOM 1090 O THR A 84 36.769 18.624 18.871 1.00 0.00 O ATOM 1091 CB THR A 84 33.689 17.667 18.469 1.00 0.00 C ATOM 1092 OG1 THR A 84 33.019 16.597 17.820 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.913 18.755 17.405 1.00 0.00 C ATOM 0 H THR A 84 33.600 16.310 20.413 1.00 0.00 H new ATOM 0 HA THR A 84 35.518 16.582 18.401 1.00 0.00 H new ATOM 0 HB THR A 84 33.112 18.108 19.281 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.414 16.157 18.454 1.00 0.00 H new ATOM 0 HG21 THR A 84 32.953 19.060 16.989 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.401 19.616 17.862 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.544 18.361 16.609 1.00 0.00 H new ATOM 1101 N LEU A 85 35.565 18.889 20.737 1.00 0.00 N ATOM 1102 CA LEU A 85 36.452 19.848 21.317 1.00 0.00 C ATOM 1103 C LEU A 85 37.759 19.265 21.730 1.00 0.00 C ATOM 1104 O LEU A 85 38.813 19.858 21.505 1.00 0.00 O ATOM 1105 CB LEU A 85 35.822 20.510 22.554 1.00 0.00 C ATOM 1106 CG LEU A 85 34.703 21.514 22.229 1.00 0.00 C ATOM 1107 CD1 LEU A 85 33.860 21.780 23.488 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.243 22.826 21.635 1.00 0.00 C ATOM 0 H LEU A 85 34.732 18.708 21.297 1.00 0.00 H new ATOM 0 HA LEU A 85 36.630 20.583 20.531 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.420 19.732 23.204 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.603 21.022 23.116 1.00 0.00 H new ATOM 0 HG LEU A 85 34.070 21.069 21.461 1.00 0.00 H new ATOM 0 HD11 LEU A 85 33.069 22.492 23.252 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.417 20.846 23.833 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.496 22.191 24.272 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.412 23.499 21.424 1.00 0.00 H new ATOM 0 HD22 LEU A 85 35.919 23.297 22.348 1.00 0.00 H new ATOM 0 HD23 LEU A 85 35.781 22.613 20.711 1.00 0.00 H new ATOM 1120 N ARG A 86 37.766 18.069 22.345 1.00 0.00 N ATOM 1121 CA ARG A 86 38.967 17.424 22.777 1.00 0.00 C ATOM 1122 C ARG A 86 39.852 16.957 21.673 1.00 0.00 C ATOM 1123 O ARG A 86 41.062 17.171 21.725 1.00 0.00 O ATOM 1124 CB ARG A 86 38.687 16.305 23.793 1.00 0.00 C ATOM 1125 CG ARG A 86 38.192 16.846 25.136 1.00 0.00 C ATOM 1126 CD ARG A 86 38.320 15.853 26.291 1.00 0.00 C ATOM 1127 NE ARG A 86 39.755 15.787 26.684 1.00 0.00 N ATOM 1128 CZ ARG A 86 40.331 16.605 27.612 1.00 0.00 C ATOM 1129 NH1 ARG A 86 39.629 17.586 28.251 1.00 0.00 N ATOM 1130 NH2 ARG A 86 41.657 16.479 27.910 1.00 0.00 N ATOM 0 H ARG A 86 36.919 17.538 22.547 1.00 0.00 H new ATOM 0 HA ARG A 86 39.534 18.206 23.283 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.942 15.623 23.382 1.00 0.00 H new ATOM 0 HB3 ARG A 86 39.597 15.726 23.951 1.00 0.00 H new ATOM 0 HG2 ARG A 86 38.753 17.748 25.382 1.00 0.00 H new ATOM 0 HG3 ARG A 86 37.147 17.138 25.035 1.00 0.00 H new ATOM 0 HD2 ARG A 86 37.708 16.170 27.135 1.00 0.00 H new ATOM 0 HD3 ARG A 86 37.962 14.869 25.989 1.00 0.00 H new ATOM 0 HE ARG A 86 40.343 15.087 26.232 1.00 0.00 H new ATOM 0 HH11 ARG A 86 38.641 17.726 28.040 1.00 0.00 H new ATOM 0 HH12 ARG A 86 40.093 18.179 28.939 1.00 0.00 H new ATOM 0 HH21 ARG A 86 42.221 15.772 27.438 1.00 0.00 H new ATOM 0 HH22 ARG A 86 42.084 17.092 28.604 1.00 0.00 H new ATOM 1144 N ASN A 87 39.308 16.352 20.602 1.00 0.00 N ATOM 1145 CA ASN A 87 40.051 15.895 19.469 1.00 0.00 C ATOM 1146 C ASN A 87 40.242 16.977 18.462 1.00 0.00 C ATOM 1147 O ASN A 87 39.891 16.870 17.288 1.00 0.00 O ATOM 1148 CB ASN A 87 39.373 14.652 18.870 1.00 0.00 C ATOM 1149 CG ASN A 87 40.262 13.865 17.918 1.00 0.00 C ATOM 1150 OD1 ASN A 87 41.443 14.143 17.713 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.665 12.808 17.306 1.00 0.00 N ATOM 0 H ASN A 87 38.307 16.174 20.522 1.00 0.00 H new ATOM 0 HA ASN A 87 41.051 15.610 19.797 1.00 0.00 H new ATOM 0 HB2 ASN A 87 39.056 13.997 19.681 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.473 14.961 18.339 1.00 0.00 H new ATOM 0 HD21 ASN A 87 40.198 12.225 16.660 1.00 0.00 H new ATOM 0 HD22 ASN A 87 38.684 12.598 17.492 1.00 0.00 H new ATOM 1158 N THR A 88 40.851 18.089 18.912 1.00 0.00 N ATOM 1159 CA THR A 88 41.251 19.239 18.162 1.00 0.00 C ATOM 1160 C THR A 88 42.700 19.141 17.831 1.00 0.00 C ATOM 1161 O THR A 88 43.435 18.352 18.424 1.00 0.00 O ATOM 1162 CB THR A 88 41.013 20.521 18.903 1.00 0.00 C ATOM 1163 OG1 THR A 88 41.166 20.375 20.308 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.569 20.988 18.655 1.00 0.00 C ATOM 0 H THR A 88 41.085 18.190 19.900 1.00 0.00 H new ATOM 0 HA THR A 88 40.644 19.256 17.257 1.00 0.00 H new ATOM 0 HB THR A 88 41.749 21.237 18.538 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.296 20.173 20.713 1.00 0.00 H new ATOM 0 HG21 THR A 88 39.391 21.920 19.192 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.417 21.149 17.588 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.874 20.227 19.010 1.00 0.00 H new ATOM 1172 N GLY A 89 43.170 19.944 16.860 1.00 0.00 N ATOM 1173 CA GLY A 89 44.557 20.141 16.575 1.00 0.00 C ATOM 1174 C GLY A 89 45.074 21.357 17.263 1.00 0.00 C ATOM 1175 O GLY A 89 44.497 21.839 18.237 1.00 0.00 O ATOM 0 H GLY A 89 42.556 20.480 16.247 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.126 19.268 16.895 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.701 20.238 15.499 1.00 0.00 H new ATOM 1179 N GLN A 90 46.207 21.908 16.793 1.00 0.00 N ATOM 1180 CA GLN A 90 46.895 23.000 17.408 1.00 0.00 C ATOM 1181 C GLN A 90 46.143 24.283 17.324 1.00 0.00 C ATOM 1182 O GLN A 90 45.921 24.953 18.333 1.00 0.00 O ATOM 1183 CB GLN A 90 48.286 23.137 16.764 1.00 0.00 C ATOM 1184 CG GLN A 90 49.242 24.128 17.429 1.00 0.00 C ATOM 1185 CD GLN A 90 50.539 24.216 16.640 1.00 0.00 C ATOM 1186 OE1 GLN A 90 50.578 24.031 15.424 1.00 0.00 O ATOM 1187 NE2 GLN A 90 51.675 24.532 17.319 1.00 0.00 N ATOM 0 H GLN A 90 46.665 21.576 15.944 1.00 0.00 H new ATOM 0 HA GLN A 90 46.992 22.781 18.471 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.759 22.155 16.758 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.154 23.433 15.723 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.776 25.111 17.487 1.00 0.00 H new ATOM 0 HG3 GLN A 90 49.450 23.813 18.452 1.00 0.00 H new ATOM 0 HE21 GLN A 90 51.641 24.685 18.327 1.00 0.00 H new ATOM 0 HE22 GLN A 90 52.561 24.616 16.820 1.00 0.00 H new ATOM 1196 N VAL A 91 45.715 24.665 16.107 1.00 0.00 N ATOM 1197 CA VAL A 91 44.929 25.830 15.845 1.00 0.00 C ATOM 1198 C VAL A 91 43.514 25.434 15.598 1.00 0.00 C ATOM 1199 O VAL A 91 43.186 24.673 14.688 1.00 0.00 O ATOM 1200 CB VAL A 91 45.447 26.646 14.698 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.604 27.918 14.505 1.00 0.00 C ATOM 1202 CG2 VAL A 91 46.910 27.035 14.977 1.00 0.00 C ATOM 0 H VAL A 91 45.929 24.133 15.263 1.00 0.00 H new ATOM 0 HA VAL A 91 44.993 26.465 16.729 1.00 0.00 H new ATOM 0 HB VAL A 91 45.384 26.051 13.787 1.00 0.00 H new ATOM 0 HG11 VAL A 91 44.999 28.493 13.668 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.570 27.641 14.299 1.00 0.00 H new ATOM 0 HG13 VAL A 91 44.645 28.522 15.411 1.00 0.00 H new ATOM 0 HG21 VAL A 91 47.293 27.629 14.147 1.00 0.00 H new ATOM 0 HG22 VAL A 91 46.962 27.619 15.896 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.512 26.133 15.086 1.00 0.00 H new ATOM 1212 N VAL A 92 42.605 25.949 16.443 1.00 0.00 N ATOM 1213 CA VAL A 92 41.238 25.562 16.611 1.00 0.00 C ATOM 1214 C VAL A 92 40.335 26.650 16.141 1.00 0.00 C ATOM 1215 O VAL A 92 40.232 27.714 16.749 1.00 0.00 O ATOM 1216 CB VAL A 92 41.006 25.269 18.063 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.536 24.905 18.333 1.00 0.00 C ATOM 1218 CG2 VAL A 92 41.892 24.068 18.432 1.00 0.00 C ATOM 0 H VAL A 92 42.854 26.713 17.071 1.00 0.00 H new ATOM 0 HA VAL A 92 41.023 24.672 16.019 1.00 0.00 H new ATOM 0 HB VAL A 92 41.247 26.151 18.656 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.401 24.698 19.395 1.00 0.00 H new ATOM 0 HG12 VAL A 92 38.896 25.737 18.041 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.268 24.021 17.754 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.752 23.822 19.485 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.616 23.210 17.819 1.00 0.00 H new ATOM 0 HG23 VAL A 92 42.938 24.319 18.254 1.00 0.00 H new ATOM 1228 N HIS A 93 39.629 26.430 15.017 1.00 0.00 N ATOM 1229 CA HIS A 93 38.755 27.399 14.434 1.00 0.00 C ATOM 1230 C HIS A 93 37.346 27.259 14.899 1.00 0.00 C ATOM 1231 O HIS A 93 36.572 26.469 14.360 1.00 0.00 O ATOM 1232 CB HIS A 93 38.765 27.259 12.902 1.00 0.00 C ATOM 1233 CG HIS A 93 38.086 28.366 12.153 1.00 0.00 C ATOM 1234 ND1 HIS A 93 37.643 28.235 10.853 1.00 0.00 N ATOM 1235 CD2 HIS A 93 37.869 29.667 12.487 1.00 0.00 C ATOM 1236 CE1 HIS A 93 37.177 29.453 10.466 1.00 0.00 C ATOM 1237 NE2 HIS A 93 37.302 30.348 11.429 1.00 0.00 N ATOM 0 H HIS A 93 39.668 25.552 14.499 1.00 0.00 H new ATOM 0 HA HIS A 93 39.125 28.375 14.746 1.00 0.00 H new ATOM 0 HB2 HIS A 93 39.800 27.197 12.566 1.00 0.00 H new ATOM 0 HB3 HIS A 93 38.287 26.316 12.637 1.00 0.00 H new ATOM 0 HD2 HIS A 93 38.107 30.105 13.445 1.00 0.00 H new ATOM 0 HE1 HIS A 93 36.757 29.662 9.493 1.00 0.00 H new ATOM 0 HE2 HIS A 93 37.036 31.332 11.398 1.00 0.00 H new ATOM 1245 N LEU A 94 36.901 28.029 15.908 1.00 0.00 N ATOM 1246 CA LEU A 94 35.542 28.015 16.350 1.00 0.00 C ATOM 1247 C LEU A 94 34.690 28.993 15.618 1.00 0.00 C ATOM 1248 O LEU A 94 35.155 29.998 15.081 1.00 0.00 O ATOM 1249 CB LEU A 94 35.401 28.341 17.847 1.00 0.00 C ATOM 1250 CG LEU A 94 36.307 27.519 18.780 1.00 0.00 C ATOM 1251 CD1 LEU A 94 36.053 27.927 20.241 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.086 26.005 18.617 1.00 0.00 C ATOM 0 H LEU A 94 37.497 28.674 16.427 1.00 0.00 H new ATOM 0 HA LEU A 94 35.209 26.997 16.150 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.617 29.399 17.995 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.363 28.184 18.142 1.00 0.00 H new ATOM 0 HG LEU A 94 37.341 27.731 18.506 1.00 0.00 H new ATOM 0 HD11 LEU A 94 36.696 27.343 20.899 1.00 0.00 H new ATOM 0 HD12 LEU A 94 36.273 28.987 20.366 1.00 0.00 H new ATOM 0 HD13 LEU A 94 35.009 27.740 20.495 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.747 25.466 19.295 1.00 0.00 H new ATOM 0 HD22 LEU A 94 35.049 25.761 18.850 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.305 25.714 17.590 1.00 0.00 H new ATOM 1264 N LEU A 95 33.369 28.739 15.596 1.00 0.00 N ATOM 1265 CA LEU A 95 32.374 29.740 15.369 1.00 0.00 C ATOM 1266 C LEU A 95 31.425 29.614 16.510 1.00 0.00 C ATOM 1267 O LEU A 95 30.960 28.521 16.830 1.00 0.00 O ATOM 1268 CB LEU A 95 31.610 29.533 14.049 1.00 0.00 C ATOM 1269 CG LEU A 95 30.408 30.460 13.800 1.00 0.00 C ATOM 1270 CD1 LEU A 95 30.788 31.947 13.699 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.679 30.012 12.522 1.00 0.00 C ATOM 0 H LEU A 95 32.981 27.807 15.741 1.00 0.00 H new ATOM 0 HA LEU A 95 32.841 30.722 15.297 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.313 29.656 13.225 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.258 28.502 14.016 1.00 0.00 H new ATOM 0 HG LEU A 95 29.753 30.374 14.667 1.00 0.00 H new ATOM 0 HD11 LEU A 95 29.891 32.541 13.523 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.258 32.266 14.629 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.485 32.089 12.873 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.826 30.666 12.341 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.363 30.065 11.675 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.330 28.986 12.643 1.00 0.00 H new ATOM 1283 N LEU A 96 31.103 30.726 17.197 1.00 0.00 N ATOM 1284 CA LEU A 96 30.157 30.633 18.265 1.00 0.00 C ATOM 1285 C LEU A 96 29.404 31.906 18.448 1.00 0.00 C ATOM 1286 O LEU A 96 29.726 32.937 17.860 1.00 0.00 O ATOM 1287 CB LEU A 96 30.805 30.086 19.547 1.00 0.00 C ATOM 1288 CG LEU A 96 31.760 31.021 20.307 1.00 0.00 C ATOM 1289 CD1 LEU A 96 30.984 31.796 21.386 1.00 0.00 C ATOM 1290 CD2 LEU A 96 32.891 30.198 20.947 1.00 0.00 C ATOM 0 H LEU A 96 31.482 31.657 17.022 1.00 0.00 H new ATOM 0 HA LEU A 96 29.402 29.897 17.991 1.00 0.00 H new ATOM 0 HB2 LEU A 96 30.008 29.791 20.229 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.354 29.181 19.288 1.00 0.00 H new ATOM 0 HG LEU A 96 32.197 31.736 19.610 1.00 0.00 H new ATOM 0 HD11 LEU A 96 31.666 32.457 21.921 1.00 0.00 H new ATOM 0 HD12 LEU A 96 30.200 32.389 20.915 1.00 0.00 H new ATOM 0 HD13 LEU A 96 30.536 31.093 22.088 1.00 0.00 H new ATOM 0 HD21 LEU A 96 33.566 30.864 21.485 1.00 0.00 H new ATOM 0 HD22 LEU A 96 32.466 29.474 21.642 1.00 0.00 H new ATOM 0 HD23 LEU A 96 33.444 29.672 20.168 1.00 0.00 H new ATOM 1302 N GLU A 97 28.320 31.834 19.242 1.00 0.00 N ATOM 1303 CA GLU A 97 27.381 32.892 19.452 1.00 0.00 C ATOM 1304 C GLU A 97 27.523 33.445 20.828 1.00 0.00 C ATOM 1305 O GLU A 97 27.421 32.723 21.819 1.00 0.00 O ATOM 1306 CB GLU A 97 25.963 32.352 19.198 1.00 0.00 C ATOM 1307 CG GLU A 97 24.866 33.412 19.094 1.00 0.00 C ATOM 1308 CD GLU A 97 23.517 32.786 18.772 1.00 0.00 C ATOM 1309 OE1 GLU A 97 22.959 32.056 19.635 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.974 33.021 17.660 1.00 0.00 O ATOM 0 H GLU A 97 28.087 30.991 19.766 1.00 0.00 H new ATOM 0 HA GLU A 97 27.574 33.709 18.757 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.973 31.772 18.275 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.705 31.664 20.003 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.799 33.961 20.033 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.128 34.134 18.320 1.00 0.00 H new ATOM 1317 N LYS A 98 27.772 34.762 20.942 1.00 0.00 N ATOM 1318 CA LYS A 98 27.965 35.464 22.172 1.00 0.00 C ATOM 1319 C LYS A 98 26.666 35.741 22.849 1.00 0.00 C ATOM 1320 O LYS A 98 25.678 36.134 22.232 1.00 0.00 O ATOM 1321 CB LYS A 98 28.681 36.804 21.934 1.00 0.00 C ATOM 1322 CG LYS A 98 29.088 37.613 23.167 1.00 0.00 C ATOM 1323 CD LYS A 98 30.215 36.980 23.985 1.00 0.00 C ATOM 1324 CE LYS A 98 30.123 37.071 25.509 1.00 0.00 C ATOM 1325 NZ LYS A 98 30.728 38.322 26.020 1.00 0.00 N ATOM 0 H LYS A 98 27.843 35.371 20.127 1.00 0.00 H new ATOM 0 HA LYS A 98 28.577 34.823 22.807 1.00 0.00 H new ATOM 0 HB2 LYS A 98 29.579 36.607 21.349 1.00 0.00 H new ATOM 0 HB3 LYS A 98 28.032 37.429 21.320 1.00 0.00 H new ATOM 0 HG2 LYS A 98 29.399 38.608 22.849 1.00 0.00 H new ATOM 0 HG3 LYS A 98 28.216 37.741 23.808 1.00 0.00 H new ATOM 0 HD2 LYS A 98 30.275 35.926 23.715 1.00 0.00 H new ATOM 0 HD3 LYS A 98 31.153 37.442 23.677 1.00 0.00 H new ATOM 0 HE2 LYS A 98 29.078 37.021 25.814 1.00 0.00 H new ATOM 0 HE3 LYS A 98 30.627 36.214 25.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 30.647 38.349 27.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 31.732 38.358 25.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 30.231 39.140 25.613 1.00 0.00 H new ATOM 1339 N GLY A 99 26.639 35.578 24.183 1.00 0.00 N ATOM 1340 CA GLY A 99 25.615 36.117 25.024 1.00 0.00 C ATOM 1341 C GLY A 99 26.074 37.443 25.525 1.00 0.00 C ATOM 1342 O GLY A 99 26.836 37.517 26.487 1.00 0.00 O ATOM 0 H GLY A 99 27.351 35.055 24.693 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.683 36.222 24.468 1.00 0.00 H new ATOM 0 HA3 GLY A 99 25.415 35.444 25.858 1.00 0.00 H new ATOM 1346 N GLN A 100 25.679 38.554 24.877 1.00 0.00 N ATOM 1347 CA GLN A 100 26.296 39.827 25.085 1.00 0.00 C ATOM 1348 C GLN A 100 26.132 40.426 26.440 1.00 0.00 C ATOM 1349 O GLN A 100 27.028 41.116 26.925 1.00 0.00 O ATOM 1350 CB GLN A 100 25.892 40.826 23.989 1.00 0.00 C ATOM 1351 CG GLN A 100 24.418 41.236 23.982 1.00 0.00 C ATOM 1352 CD GLN A 100 24.121 42.171 22.818 1.00 0.00 C ATOM 1353 OE1 GLN A 100 25.009 42.770 22.212 1.00 0.00 O ATOM 1354 NE2 GLN A 100 22.809 42.320 22.498 1.00 0.00 N ATOM 0 H GLN A 100 24.919 38.568 24.197 1.00 0.00 H new ATOM 0 HA GLN A 100 27.363 39.613 25.018 1.00 0.00 H new ATOM 0 HB2 GLN A 100 26.500 41.724 24.098 1.00 0.00 H new ATOM 0 HB3 GLN A 100 26.135 40.392 23.019 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.790 40.348 23.910 1.00 0.00 H new ATOM 0 HG3 GLN A 100 24.169 41.728 24.922 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.096 41.810 23.019 1.00 0.00 H new ATOM 0 HE22 GLN A 100 22.537 42.942 21.737 1.00 0.00 H new ATOM 1363 N VAL A 101 24.998 40.164 27.114 1.00 0.00 N ATOM 1364 CA VAL A 101 24.702 40.584 28.448 1.00 0.00 C ATOM 1365 C VAL A 101 24.837 39.439 29.392 1.00 0.00 C ATOM 1366 O VAL A 101 24.713 38.295 28.954 1.00 0.00 O ATOM 1367 CB VAL A 101 23.325 41.170 28.557 1.00 0.00 C ATOM 1368 CG1 VAL A 101 23.341 42.584 27.951 1.00 0.00 C ATOM 1369 CG2 VAL A 101 22.285 40.288 27.847 1.00 0.00 C ATOM 0 H VAL A 101 24.239 39.623 26.699 1.00 0.00 H new ATOM 0 HA VAL A 101 25.420 41.361 28.711 1.00 0.00 H new ATOM 0 HB VAL A 101 23.040 41.221 29.608 1.00 0.00 H new ATOM 0 HG11 VAL A 101 22.346 43.022 28.024 1.00 0.00 H new ATOM 0 HG12 VAL A 101 24.052 43.205 28.496 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.637 42.528 26.904 1.00 0.00 H new ATOM 0 HG21 VAL A 101 21.298 40.740 27.944 1.00 0.00 H new ATOM 0 HG22 VAL A 101 22.542 40.201 26.791 1.00 0.00 H new ATOM 0 HG23 VAL A 101 22.277 39.297 28.302 1.00 0.00 H new ATOM 1379 N PRO A 102 25.110 39.603 30.653 1.00 0.00 N ATOM 1380 CA PRO A 102 25.035 38.536 31.608 1.00 0.00 C ATOM 1381 C PRO A 102 23.633 38.196 31.982 1.00 0.00 C ATOM 1382 O PRO A 102 23.437 37.146 32.650 1.00 0.00 O ATOM 1383 CB PRO A 102 25.823 39.059 32.807 1.00 0.00 C ATOM 1384 CG PRO A 102 25.603 40.579 32.768 1.00 0.00 C ATOM 1385 CD PRO A 102 25.526 40.859 31.259 1.00 0.00 C ATOM 1386 OXT PRO A 102 22.674 38.938 31.638 1.00 0.00 O ATOM 0 HA PRO A 102 25.438 37.606 31.207 1.00 0.00 H new ATOM 0 HB2 PRO A 102 25.461 38.628 33.740 1.00 0.00 H new ATOM 0 HB3 PRO A 102 26.881 38.807 32.729 1.00 0.00 H new ATOM 0 HG2 PRO A 102 24.688 40.871 33.283 1.00 0.00 H new ATOM 0 HG3 PRO A 102 26.422 41.121 33.241 1.00 0.00 H new ATOM 0 HD2 PRO A 102 24.813 41.654 31.043 1.00 0.00 H new ATOM 0 HD3 PRO A 102 26.491 41.182 30.870 1.00 0.00 H new TER 1394 PRO A 102