USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1030 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: B 14 TYR OH : rot 180:sc= 0.0211 USER MOD Set 1.2: B 35 SER OG : rot 170:sc= -1.49! USER MOD Set 2.1: A 14 TYR OH : rot 180:sc= 0.0171 USER MOD Set 2.2: A 35 SER OG : rot 172:sc= -1.52! USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.664 USER MOD Single : A 8 THR OG1 : rot -140:sc= -0.212 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -108:sc= 1.22 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -2.51 K(o=-2.5,f=-0.69) USER MOD Single : A 21 GLN : amide:sc= -4.4! C(o=-4.4!,f=-7.6!) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 27 TYR OH : rot 180:sc= -0.862 USER MOD Single : A 30 THR OG1 : rot 3:sc= -2.97! USER MOD Single : A 31 SER OG : rot 180:sc= 0.0122 USER MOD Single : A 32 SER OG : rot 180:sc= -0.11 USER MOD Single : A 33 GLN : amide:sc= -1.09 K(o=-1.1,f=-3.5) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 147:sc= -1.93! USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -3.63! C(o=-3.6!,f=-8.2!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 TYR OH : rot 179:sc= -1.23! USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 29:sc= 0.772 USER MOD Single : B 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot 180:sc= -0.658 USER MOD Single : B 8 THR OG1 : rot 167:sc= -0.0947! USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot -97:sc= 1.28 USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= -2.67 K(o=-2.7,f=-0.7) USER MOD Single : B 21 GLN : amide:sc= -4.35! C(o=-4.4!,f=-7.6!) USER MOD Single : B 22 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : B 27 TYR OH : rot 180:sc= -0.867 USER MOD Single : B 30 THR OG1 : rot 2:sc= -2.8! USER MOD Single : B 31 SER OG : rot 180:sc= 0.0117 USER MOD Single : B 32 SER OG : rot 180:sc= -0.0887 USER MOD Single : B 33 GLN : amide:sc= -1.4 K(o=-1.4,f=-3.8) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 THR OG1 : rot 140:sc= -1.94! USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -3.01 K(o=-3,f=-7.2!) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 TYR OH : rot 176:sc= -1.19! USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD Single : B 68 SER OG : rot 31:sc= 0.785 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 63.438 1.414 -8.012 1.00 0.00 N ATOM 2 CA SER A 1 63.147 2.666 -8.766 1.00 0.00 C ATOM 3 C SER A 1 61.875 3.311 -8.216 1.00 0.00 C ATOM 4 O SER A 1 61.924 4.214 -7.405 1.00 0.00 O ATOM 5 CB SER A 1 62.950 2.333 -10.246 1.00 0.00 C ATOM 6 OG SER A 1 64.213 2.046 -10.835 1.00 0.00 O ATOM 0 H1 SER A 1 64.304 0.976 -8.387 1.00 0.00 H new ATOM 0 H2 SER A 1 63.572 1.638 -7.005 1.00 0.00 H new ATOM 0 H3 SER A 1 62.642 0.753 -8.117 1.00 0.00 H new ATOM 0 HA SER A 1 63.981 3.359 -8.655 1.00 0.00 H new ATOM 0 HB2 SER A 1 62.283 1.477 -10.353 1.00 0.00 H new ATOM 0 HB3 SER A 1 62.478 3.171 -10.760 1.00 0.00 H new ATOM 0 HG SER A 1 64.090 1.830 -11.783 1.00 0.00 H new ATOM 14 N LEU A 2 60.734 2.855 -8.653 1.00 0.00 N ATOM 15 CA LEU A 2 59.458 3.442 -8.159 1.00 0.00 C ATOM 16 C LEU A 2 59.359 4.896 -8.623 1.00 0.00 C ATOM 17 O LEU A 2 59.396 5.815 -7.829 1.00 0.00 O ATOM 18 CB LEU A 2 59.428 3.389 -6.628 1.00 0.00 C ATOM 19 CG LEU A 2 59.912 2.017 -6.152 1.00 0.00 C ATOM 20 CD1 LEU A 2 60.484 2.140 -4.738 1.00 0.00 C ATOM 21 CD2 LEU A 2 58.735 1.038 -6.142 1.00 0.00 C ATOM 0 H LEU A 2 60.630 2.100 -9.332 1.00 0.00 H new ATOM 0 HA LEU A 2 58.617 2.874 -8.555 1.00 0.00 H new ATOM 0 HB2 LEU A 2 60.062 4.173 -6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 2 58.416 3.574 -6.267 1.00 0.00 H new ATOM 0 HG LEU A 2 60.686 1.650 -6.826 1.00 0.00 H new ATOM 0 HD11 LEU A 2 60.829 1.163 -4.399 1.00 0.00 H new ATOM 0 HD12 LEU A 2 61.321 2.838 -4.744 1.00 0.00 H new ATOM 0 HD13 LEU A 2 59.710 2.506 -4.063 1.00 0.00 H new ATOM 0 HD21 LEU A 2 59.078 0.060 -5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 2 57.962 1.405 -5.467 1.00 0.00 H new ATOM 0 HD23 LEU A 2 58.326 0.950 -7.149 1.00 0.00 H new ATOM 33 N ALA A 3 59.239 5.109 -9.904 1.00 0.00 N ATOM 34 CA ALA A 3 59.144 6.504 -10.421 1.00 0.00 C ATOM 35 C ALA A 3 57.828 6.682 -11.181 1.00 0.00 C ATOM 36 O ALA A 3 56.827 7.087 -10.623 1.00 0.00 O ATOM 37 CB ALA A 3 60.316 6.775 -11.367 1.00 0.00 C ATOM 0 H ALA A 3 59.203 4.379 -10.615 1.00 0.00 H new ATOM 0 HA ALA A 3 59.177 7.203 -9.585 1.00 0.00 H new ATOM 0 HB1 ALA A 3 60.249 7.795 -11.747 1.00 0.00 H new ATOM 0 HB2 ALA A 3 61.255 6.649 -10.828 1.00 0.00 H new ATOM 0 HB3 ALA A 3 60.280 6.074 -12.201 1.00 0.00 H new ATOM 43 N ALA A 4 57.823 6.389 -12.453 1.00 0.00 N ATOM 44 CA ALA A 4 56.574 6.547 -13.252 1.00 0.00 C ATOM 45 C ALA A 4 55.568 5.464 -12.859 1.00 0.00 C ATOM 46 O ALA A 4 55.929 4.336 -12.588 1.00 0.00 O ATOM 47 CB ALA A 4 56.904 6.423 -14.741 1.00 0.00 C ATOM 0 H ALA A 4 58.630 6.047 -12.974 1.00 0.00 H new ATOM 0 HA ALA A 4 56.141 7.527 -13.054 1.00 0.00 H new ATOM 0 HB1 ALA A 4 55.992 6.538 -15.327 1.00 0.00 H new ATOM 0 HB2 ALA A 4 57.616 7.199 -15.022 1.00 0.00 H new ATOM 0 HB3 ALA A 4 57.339 5.443 -14.937 1.00 0.00 H new ATOM 53 N ASP A 5 54.307 5.799 -12.829 1.00 0.00 N ATOM 54 CA ASP A 5 53.273 4.792 -12.458 1.00 0.00 C ATOM 55 C ASP A 5 53.574 4.233 -11.067 1.00 0.00 C ATOM 56 O ASP A 5 54.463 4.697 -10.383 1.00 0.00 O ATOM 57 CB ASP A 5 53.282 3.652 -13.477 1.00 0.00 C ATOM 58 CG ASP A 5 53.112 4.226 -14.885 1.00 0.00 C ATOM 59 OD1 ASP A 5 52.910 5.425 -14.992 1.00 0.00 O ATOM 60 OD2 ASP A 5 53.186 3.459 -15.830 1.00 0.00 O ATOM 0 H ASP A 5 53.948 6.729 -13.046 1.00 0.00 H new ATOM 0 HA ASP A 5 52.293 5.268 -12.452 1.00 0.00 H new ATOM 0 HB2 ASP A 5 54.218 3.097 -13.409 1.00 0.00 H new ATOM 0 HB3 ASP A 5 52.478 2.949 -13.260 1.00 0.00 H new ATOM 65 N THR A 6 52.835 3.240 -10.649 1.00 0.00 N ATOM 66 CA THR A 6 53.065 2.637 -9.305 1.00 0.00 C ATOM 67 C THR A 6 52.398 3.510 -8.232 1.00 0.00 C ATOM 68 O THR A 6 52.314 4.714 -8.377 1.00 0.00 O ATOM 69 CB THR A 6 54.584 2.502 -9.053 1.00 0.00 C ATOM 70 OG1 THR A 6 54.844 1.251 -8.435 1.00 0.00 O ATOM 71 CG2 THR A 6 55.105 3.629 -8.149 1.00 0.00 C ATOM 0 H THR A 6 52.077 2.818 -11.185 1.00 0.00 H new ATOM 0 HA THR A 6 52.622 1.642 -9.260 1.00 0.00 H new ATOM 0 HB THR A 6 55.097 2.569 -10.012 1.00 0.00 H new ATOM 0 HG1 THR A 6 55.806 1.159 -8.274 1.00 0.00 H new ATOM 0 HG21 THR A 6 56.176 3.504 -7.992 1.00 0.00 H new ATOM 0 HG22 THR A 6 54.918 4.592 -8.624 1.00 0.00 H new ATOM 0 HG23 THR A 6 54.591 3.592 -7.189 1.00 0.00 H new ATOM 79 N PRO A 7 51.944 2.870 -7.186 1.00 0.00 N ATOM 80 CA PRO A 7 51.275 3.552 -6.065 1.00 0.00 C ATOM 81 C PRO A 7 52.309 4.217 -5.154 1.00 0.00 C ATOM 82 O PRO A 7 53.241 3.589 -4.692 1.00 0.00 O ATOM 83 CB PRO A 7 50.552 2.418 -5.335 1.00 0.00 C ATOM 84 CG PRO A 7 51.289 1.111 -5.720 1.00 0.00 C ATOM 85 CD PRO A 7 52.054 1.405 -7.024 1.00 0.00 C ATOM 0 HA PRO A 7 50.598 4.344 -6.385 1.00 0.00 H new ATOM 0 HB2 PRO A 7 50.575 2.574 -4.256 1.00 0.00 H new ATOM 0 HB3 PRO A 7 49.503 2.374 -5.629 1.00 0.00 H new ATOM 0 HG2 PRO A 7 51.974 0.805 -4.929 1.00 0.00 H new ATOM 0 HG3 PRO A 7 50.581 0.294 -5.862 1.00 0.00 H new ATOM 0 HD2 PRO A 7 53.095 1.089 -6.955 1.00 0.00 H new ATOM 0 HD3 PRO A 7 51.616 0.877 -7.871 1.00 0.00 H new ATOM 93 N THR A 8 52.153 5.485 -4.892 1.00 0.00 N ATOM 94 CA THR A 8 53.126 6.190 -4.012 1.00 0.00 C ATOM 95 C THR A 8 52.840 5.838 -2.550 1.00 0.00 C ATOM 96 O THR A 8 51.788 6.141 -2.024 1.00 0.00 O ATOM 97 CB THR A 8 52.988 7.701 -4.206 1.00 0.00 C ATOM 98 OG1 THR A 8 53.152 8.018 -5.581 1.00 0.00 O ATOM 99 CG2 THR A 8 54.056 8.424 -3.382 1.00 0.00 C ATOM 0 H THR A 8 51.393 6.064 -5.250 1.00 0.00 H new ATOM 0 HA THR A 8 54.139 5.880 -4.270 1.00 0.00 H new ATOM 0 HB THR A 8 52.000 8.021 -3.875 1.00 0.00 H new ATOM 0 HG1 THR A 8 53.676 8.842 -5.667 1.00 0.00 H new ATOM 0 HG21 THR A 8 53.956 9.500 -3.521 1.00 0.00 H new ATOM 0 HG22 THR A 8 53.928 8.181 -2.327 1.00 0.00 H new ATOM 0 HG23 THR A 8 55.046 8.106 -3.710 1.00 0.00 H new ATOM 107 N ALA A 9 53.770 5.204 -1.889 1.00 0.00 N ATOM 108 CA ALA A 9 53.548 4.841 -0.461 1.00 0.00 C ATOM 109 C ALA A 9 53.501 6.117 0.382 1.00 0.00 C ATOM 110 O ALA A 9 53.897 7.177 -0.062 1.00 0.00 O ATOM 111 CB ALA A 9 54.694 3.948 0.022 1.00 0.00 C ATOM 0 H ALA A 9 54.671 4.923 -2.275 1.00 0.00 H new ATOM 0 HA ALA A 9 52.605 4.303 -0.361 1.00 0.00 H new ATOM 0 HB1 ALA A 9 54.532 3.682 1.067 1.00 0.00 H new ATOM 0 HB2 ALA A 9 54.728 3.041 -0.582 1.00 0.00 H new ATOM 0 HB3 ALA A 9 55.638 4.484 -0.074 1.00 0.00 H new ATOM 117 N CYS A 10 53.017 6.027 1.591 1.00 0.00 N ATOM 118 CA CYS A 10 52.943 7.241 2.455 1.00 0.00 C ATOM 119 C CYS A 10 53.006 6.830 3.928 1.00 0.00 C ATOM 120 O CYS A 10 52.091 6.226 4.451 1.00 0.00 O ATOM 121 CB CYS A 10 51.623 7.971 2.193 1.00 0.00 C ATOM 122 SG CYS A 10 51.487 8.380 0.435 1.00 0.00 S ATOM 0 H CYS A 10 52.670 5.168 2.018 1.00 0.00 H new ATOM 0 HA CYS A 10 53.781 7.899 2.225 1.00 0.00 H new ATOM 0 HB2 CYS A 10 50.784 7.345 2.496 1.00 0.00 H new ATOM 0 HB3 CYS A 10 51.575 8.880 2.792 1.00 0.00 H new ATOM 127 N CYS A 11 54.072 7.161 4.608 1.00 0.00 N ATOM 128 CA CYS A 11 54.174 6.793 6.049 1.00 0.00 C ATOM 129 C CYS A 11 53.310 7.754 6.868 1.00 0.00 C ATOM 130 O CYS A 11 53.743 8.826 7.244 1.00 0.00 O ATOM 131 CB CYS A 11 55.630 6.901 6.511 1.00 0.00 C ATOM 132 SG CYS A 11 56.430 5.278 6.389 1.00 0.00 S ATOM 0 H CYS A 11 54.872 7.668 4.229 1.00 0.00 H new ATOM 0 HA CYS A 11 53.830 5.768 6.189 1.00 0.00 H new ATOM 0 HB2 CYS A 11 56.163 7.627 5.898 1.00 0.00 H new ATOM 0 HB3 CYS A 11 55.670 7.261 7.539 1.00 0.00 H new ATOM 137 N PHE A 12 52.089 7.386 7.139 1.00 0.00 N ATOM 138 CA PHE A 12 51.199 8.285 7.924 1.00 0.00 C ATOM 139 C PHE A 12 51.116 7.806 9.375 1.00 0.00 C ATOM 140 O PHE A 12 50.422 8.385 10.186 1.00 0.00 O ATOM 141 CB PHE A 12 49.799 8.279 7.306 1.00 0.00 C ATOM 142 CG PHE A 12 49.803 9.094 6.034 1.00 0.00 C ATOM 143 CD1 PHE A 12 50.451 10.334 5.999 1.00 0.00 C ATOM 144 CD2 PHE A 12 49.157 8.608 4.891 1.00 0.00 C ATOM 145 CE1 PHE A 12 50.454 11.089 4.820 1.00 0.00 C ATOM 146 CE2 PHE A 12 49.161 9.362 3.711 1.00 0.00 C ATOM 147 CZ PHE A 12 49.809 10.602 3.677 1.00 0.00 C ATOM 0 H PHE A 12 51.669 6.502 6.851 1.00 0.00 H new ATOM 0 HA PHE A 12 51.607 9.296 7.905 1.00 0.00 H new ATOM 0 HB2 PHE A 12 49.489 7.256 7.093 1.00 0.00 H new ATOM 0 HB3 PHE A 12 49.077 8.691 8.011 1.00 0.00 H new ATOM 0 HD1 PHE A 12 50.949 10.708 6.881 1.00 0.00 H new ATOM 0 HD2 PHE A 12 48.656 7.652 4.919 1.00 0.00 H new ATOM 0 HE1 PHE A 12 50.953 12.046 4.792 1.00 0.00 H new ATOM 0 HE2 PHE A 12 48.665 8.987 2.828 1.00 0.00 H new ATOM 0 HZ PHE A 12 49.811 11.184 2.767 1.00 0.00 H new ATOM 157 N SER A 13 51.813 6.755 9.714 1.00 0.00 N ATOM 158 CA SER A 13 51.756 6.259 11.118 1.00 0.00 C ATOM 159 C SER A 13 52.956 5.353 11.404 1.00 0.00 C ATOM 160 O SER A 13 53.052 4.254 10.894 1.00 0.00 O ATOM 161 CB SER A 13 50.463 5.468 11.329 1.00 0.00 C ATOM 162 OG SER A 13 49.999 4.984 10.076 1.00 0.00 O ATOM 0 H SER A 13 52.414 6.223 9.085 1.00 0.00 H new ATOM 0 HA SER A 13 51.781 7.112 11.797 1.00 0.00 H new ATOM 0 HB2 SER A 13 50.639 4.636 12.011 1.00 0.00 H new ATOM 0 HB3 SER A 13 49.706 6.103 11.790 1.00 0.00 H new ATOM 0 HG SER A 13 49.172 4.475 10.208 1.00 0.00 H new ATOM 168 N TYR A 14 53.863 5.799 12.229 1.00 0.00 N ATOM 169 CA TYR A 14 55.048 4.958 12.564 1.00 0.00 C ATOM 170 C TYR A 14 54.833 4.361 13.956 1.00 0.00 C ATOM 171 O TYR A 14 53.913 4.726 14.658 1.00 0.00 O ATOM 172 CB TYR A 14 56.335 5.803 12.549 1.00 0.00 C ATOM 173 CG TYR A 14 56.074 7.142 11.893 1.00 0.00 C ATOM 174 CD1 TYR A 14 55.570 7.194 10.588 1.00 0.00 C ATOM 175 CD2 TYR A 14 56.329 8.328 12.592 1.00 0.00 C ATOM 176 CE1 TYR A 14 55.323 8.431 9.980 1.00 0.00 C ATOM 177 CE2 TYR A 14 56.084 9.565 11.984 1.00 0.00 C ATOM 178 CZ TYR A 14 55.580 9.617 10.679 1.00 0.00 C ATOM 179 OH TYR A 14 55.336 10.836 10.080 1.00 0.00 O ATOM 0 H TYR A 14 53.835 6.710 12.686 1.00 0.00 H new ATOM 0 HA TYR A 14 55.157 4.166 11.823 1.00 0.00 H new ATOM 0 HB2 TYR A 14 56.692 5.953 13.568 1.00 0.00 H new ATOM 0 HB3 TYR A 14 57.120 5.273 12.010 1.00 0.00 H new ATOM 0 HD1 TYR A 14 55.371 6.279 10.050 1.00 0.00 H new ATOM 0 HD2 TYR A 14 56.715 8.289 13.600 1.00 0.00 H new ATOM 0 HE1 TYR A 14 54.935 8.470 8.973 1.00 0.00 H new ATOM 0 HE2 TYR A 14 56.284 10.480 12.522 1.00 0.00 H new ATOM 0 HH TYR A 14 55.567 11.558 10.701 1.00 0.00 H new ATOM 189 N THR A 15 55.658 3.438 14.362 1.00 0.00 N ATOM 190 CA THR A 15 55.468 2.824 15.706 1.00 0.00 C ATOM 191 C THR A 15 56.412 3.478 16.716 1.00 0.00 C ATOM 192 O THR A 15 57.617 3.408 16.587 1.00 0.00 O ATOM 193 CB THR A 15 55.770 1.327 15.630 1.00 0.00 C ATOM 194 OG1 THR A 15 55.893 0.803 16.945 1.00 0.00 O ATOM 195 CG2 THR A 15 57.077 1.105 14.867 1.00 0.00 C ATOM 0 H THR A 15 56.450 3.084 13.826 1.00 0.00 H new ATOM 0 HA THR A 15 54.437 2.976 16.025 1.00 0.00 H new ATOM 0 HB THR A 15 54.958 0.819 15.110 1.00 0.00 H new ATOM 0 HG1 THR A 15 56.834 0.600 17.130 1.00 0.00 H new ATOM 0 HG21 THR A 15 57.291 0.037 14.814 1.00 0.00 H new ATOM 0 HG22 THR A 15 56.982 1.507 13.858 1.00 0.00 H new ATOM 0 HG23 THR A 15 57.891 1.613 15.384 1.00 0.00 H new ATOM 203 N SER A 16 55.871 4.103 17.730 1.00 0.00 N ATOM 204 CA SER A 16 56.742 4.747 18.753 1.00 0.00 C ATOM 205 C SER A 16 57.869 3.778 19.113 1.00 0.00 C ATOM 206 O SER A 16 59.020 4.154 19.205 1.00 0.00 O ATOM 207 CB SER A 16 55.917 5.066 20.002 1.00 0.00 C ATOM 208 OG SER A 16 55.944 6.469 20.235 1.00 0.00 O ATOM 0 H SER A 16 54.868 4.194 17.892 1.00 0.00 H new ATOM 0 HA SER A 16 57.160 5.673 18.359 1.00 0.00 H new ATOM 0 HB2 SER A 16 54.890 4.727 19.870 1.00 0.00 H new ATOM 0 HB3 SER A 16 56.320 4.534 20.864 1.00 0.00 H new ATOM 0 HG SER A 16 55.415 6.678 21.033 1.00 0.00 H new ATOM 214 N ARG A 17 57.544 2.527 19.300 1.00 0.00 N ATOM 215 CA ARG A 17 58.593 1.525 19.635 1.00 0.00 C ATOM 216 C ARG A 17 59.165 0.960 18.335 1.00 0.00 C ATOM 217 O ARG A 17 58.524 0.983 17.303 1.00 0.00 O ATOM 218 CB ARG A 17 57.978 0.393 20.461 1.00 0.00 C ATOM 219 CG ARG A 17 58.951 -0.011 21.570 1.00 0.00 C ATOM 220 CD ARG A 17 59.084 1.133 22.578 1.00 0.00 C ATOM 221 NE ARG A 17 59.520 0.588 23.893 1.00 0.00 N ATOM 222 CZ ARG A 17 60.147 1.356 24.742 1.00 0.00 C ATOM 223 NH1 ARG A 17 61.446 1.477 24.676 1.00 0.00 N ATOM 224 NH2 ARG A 17 59.476 2.002 25.656 1.00 0.00 N ATOM 0 H ARG A 17 56.596 2.157 19.235 1.00 0.00 H new ATOM 0 HA ARG A 17 59.386 1.997 20.215 1.00 0.00 H new ATOM 0 HB2 ARG A 17 57.031 0.716 20.893 1.00 0.00 H new ATOM 0 HB3 ARG A 17 57.762 -0.463 19.822 1.00 0.00 H new ATOM 0 HG2 ARG A 17 58.594 -0.911 22.071 1.00 0.00 H new ATOM 0 HG3 ARG A 17 59.926 -0.249 21.144 1.00 0.00 H new ATOM 0 HD2 ARG A 17 59.806 1.866 22.219 1.00 0.00 H new ATOM 0 HD3 ARG A 17 58.131 1.650 22.685 1.00 0.00 H new ATOM 0 HE ARG A 17 59.329 -0.385 24.130 1.00 0.00 H new ATOM 0 HH11 ARG A 17 61.970 0.972 23.961 1.00 0.00 H new ATOM 0 HH12 ARG A 17 61.937 2.077 25.339 1.00 0.00 H new ATOM 0 HH21 ARG A 17 58.462 1.907 25.707 1.00 0.00 H new ATOM 0 HH22 ARG A 17 59.966 2.602 26.320 1.00 0.00 H new ATOM 238 N GLN A 18 60.369 0.463 18.368 1.00 0.00 N ATOM 239 CA GLN A 18 60.983 -0.086 17.132 1.00 0.00 C ATOM 240 C GLN A 18 60.612 -1.545 16.927 1.00 0.00 C ATOM 241 O GLN A 18 59.664 -2.068 17.480 1.00 0.00 O ATOM 242 CB GLN A 18 62.493 0.010 17.217 1.00 0.00 C ATOM 243 CG GLN A 18 62.908 1.160 18.139 1.00 0.00 C ATOM 244 CD GLN A 18 63.269 0.603 19.519 1.00 0.00 C ATOM 245 OE1 GLN A 18 64.034 1.204 20.248 1.00 0.00 O ATOM 246 NE2 GLN A 18 62.745 -0.526 19.912 1.00 0.00 N ATOM 0 H GLN A 18 60.955 0.414 19.202 1.00 0.00 H new ATOM 0 HA GLN A 18 60.606 0.501 16.294 1.00 0.00 H new ATOM 0 HB2 GLN A 18 62.902 -0.929 17.591 1.00 0.00 H new ATOM 0 HB3 GLN A 18 62.910 0.166 16.222 1.00 0.00 H new ATOM 0 HG2 GLN A 18 63.760 1.691 17.715 1.00 0.00 H new ATOM 0 HG3 GLN A 18 62.095 1.881 18.227 1.00 0.00 H new ATOM 0 HE21 GLN A 18 62.103 -1.031 19.301 1.00 0.00 H new ATOM 0 HE22 GLN A 18 62.977 -0.904 20.831 1.00 0.00 H new ATOM 255 N ILE A 19 61.395 -2.188 16.123 1.00 0.00 N ATOM 256 CA ILE A 19 61.215 -3.608 15.803 1.00 0.00 C ATOM 257 C ILE A 19 62.600 -4.112 15.413 1.00 0.00 C ATOM 258 O ILE A 19 63.147 -3.692 14.415 1.00 0.00 O ATOM 259 CB ILE A 19 60.259 -3.780 14.620 1.00 0.00 C ATOM 260 CG1 ILE A 19 60.107 -2.461 13.856 1.00 0.00 C ATOM 261 CG2 ILE A 19 58.888 -4.224 15.130 1.00 0.00 C ATOM 262 CD1 ILE A 19 59.018 -2.619 12.793 1.00 0.00 C ATOM 0 H ILE A 19 62.192 -1.758 15.654 1.00 0.00 H new ATOM 0 HA ILE A 19 60.792 -4.154 16.646 1.00 0.00 H new ATOM 0 HB ILE A 19 60.669 -4.534 13.949 1.00 0.00 H new ATOM 0 HG12 ILE A 19 59.847 -1.656 14.544 1.00 0.00 H new ATOM 0 HG13 ILE A 19 61.052 -2.187 13.388 1.00 0.00 H new ATOM 0 HG21 ILE A 19 58.208 -4.346 14.287 1.00 0.00 H new ATOM 0 HG22 ILE A 19 58.986 -5.173 15.658 1.00 0.00 H new ATOM 0 HG23 ILE A 19 58.491 -3.470 15.810 1.00 0.00 H new ATOM 0 HD11 ILE A 19 58.905 -1.683 12.246 1.00 0.00 H new ATOM 0 HD12 ILE A 19 59.298 -3.413 12.100 1.00 0.00 H new ATOM 0 HD13 ILE A 19 58.074 -2.874 13.274 1.00 0.00 H new ATOM 274 N PRO A 20 63.139 -4.961 16.222 1.00 0.00 N ATOM 275 CA PRO A 20 64.485 -5.503 16.005 1.00 0.00 C ATOM 276 C PRO A 20 64.518 -6.387 14.761 1.00 0.00 C ATOM 277 O PRO A 20 63.506 -6.866 14.297 1.00 0.00 O ATOM 278 CB PRO A 20 64.772 -6.268 17.299 1.00 0.00 C ATOM 279 CG PRO A 20 63.397 -6.542 17.950 1.00 0.00 C ATOM 280 CD PRO A 20 62.447 -5.485 17.409 1.00 0.00 C ATOM 0 HA PRO A 20 65.243 -4.743 15.814 1.00 0.00 H new ATOM 0 HB2 PRO A 20 65.298 -7.200 17.092 1.00 0.00 H new ATOM 0 HB3 PRO A 20 65.408 -5.684 17.964 1.00 0.00 H new ATOM 0 HG2 PRO A 20 63.044 -7.544 17.705 1.00 0.00 H new ATOM 0 HG3 PRO A 20 63.463 -6.485 19.036 1.00 0.00 H new ATOM 0 HD2 PRO A 20 61.479 -5.913 17.150 1.00 0.00 H new ATOM 0 HD3 PRO A 20 62.263 -4.700 18.143 1.00 0.00 H new ATOM 288 N GLN A 21 65.677 -6.574 14.197 1.00 0.00 N ATOM 289 CA GLN A 21 65.778 -7.397 12.964 1.00 0.00 C ATOM 290 C GLN A 21 65.118 -8.758 13.197 1.00 0.00 C ATOM 291 O GLN A 21 64.726 -9.434 12.266 1.00 0.00 O ATOM 292 CB GLN A 21 67.254 -7.591 12.606 1.00 0.00 C ATOM 293 CG GLN A 21 67.833 -6.270 12.092 1.00 0.00 C ATOM 294 CD GLN A 21 69.051 -6.555 11.214 1.00 0.00 C ATOM 295 OE1 GLN A 21 69.303 -5.852 10.255 1.00 0.00 O ATOM 296 NE2 GLN A 21 69.824 -7.567 11.501 1.00 0.00 N ATOM 0 H GLN A 21 66.559 -6.192 14.538 1.00 0.00 H new ATOM 0 HA GLN A 21 65.269 -6.891 12.144 1.00 0.00 H new ATOM 0 HB2 GLN A 21 67.810 -7.928 13.481 1.00 0.00 H new ATOM 0 HB3 GLN A 21 67.356 -8.365 11.846 1.00 0.00 H new ATOM 0 HG2 GLN A 21 67.079 -5.728 11.522 1.00 0.00 H new ATOM 0 HG3 GLN A 21 68.117 -5.634 12.931 1.00 0.00 H new ATOM 0 HE21 GLN A 21 69.613 -8.158 12.306 1.00 0.00 H new ATOM 0 HE22 GLN A 21 70.639 -7.767 10.921 1.00 0.00 H new ATOM 305 N ASN A 22 64.986 -9.166 14.429 1.00 0.00 N ATOM 306 CA ASN A 22 64.342 -10.482 14.710 1.00 0.00 C ATOM 307 C ASN A 22 62.850 -10.385 14.393 1.00 0.00 C ATOM 308 O ASN A 22 62.253 -11.299 13.860 1.00 0.00 O ATOM 309 CB ASN A 22 64.530 -10.839 16.188 1.00 0.00 C ATOM 310 CG ASN A 22 66.007 -11.131 16.459 1.00 0.00 C ATOM 311 OD1 ASN A 22 66.786 -10.226 16.684 1.00 0.00 O ATOM 312 ND2 ASN A 22 66.426 -12.366 16.450 1.00 0.00 N ATOM 0 H ASN A 22 65.295 -8.648 15.251 1.00 0.00 H new ATOM 0 HA ASN A 22 64.800 -11.255 14.093 1.00 0.00 H new ATOM 0 HB2 ASN A 22 64.189 -10.017 16.818 1.00 0.00 H new ATOM 0 HB3 ASN A 22 63.924 -11.708 16.443 1.00 0.00 H new ATOM 0 HD21 ASN A 22 67.408 -12.573 16.632 1.00 0.00 H new ATOM 0 HD22 ASN A 22 65.772 -13.125 16.261 1.00 0.00 H new ATOM 319 N PHE A 23 62.244 -9.276 14.718 1.00 0.00 N ATOM 320 CA PHE A 23 60.791 -9.098 14.440 1.00 0.00 C ATOM 321 C PHE A 23 60.603 -8.552 13.023 1.00 0.00 C ATOM 322 O PHE A 23 59.493 -8.354 12.568 1.00 0.00 O ATOM 323 CB PHE A 23 60.209 -8.099 15.441 1.00 0.00 C ATOM 324 CG PHE A 23 59.094 -8.748 16.222 1.00 0.00 C ATOM 325 CD1 PHE A 23 57.871 -9.024 15.600 1.00 0.00 C ATOM 326 CD2 PHE A 23 59.281 -9.065 17.571 1.00 0.00 C ATOM 327 CE1 PHE A 23 56.836 -9.622 16.328 1.00 0.00 C ATOM 328 CE2 PHE A 23 58.249 -9.662 18.299 1.00 0.00 C ATOM 329 CZ PHE A 23 57.024 -9.941 17.679 1.00 0.00 C ATOM 0 H PHE A 23 62.697 -8.480 15.167 1.00 0.00 H new ATOM 0 HA PHE A 23 60.283 -10.058 14.532 1.00 0.00 H new ATOM 0 HB2 PHE A 23 60.989 -7.755 16.121 1.00 0.00 H new ATOM 0 HB3 PHE A 23 59.834 -7.221 14.916 1.00 0.00 H new ATOM 0 HD1 PHE A 23 57.726 -8.776 14.559 1.00 0.00 H new ATOM 0 HD2 PHE A 23 60.224 -8.848 18.050 1.00 0.00 H new ATOM 0 HE1 PHE A 23 55.893 -9.837 15.848 1.00 0.00 H new ATOM 0 HE2 PHE A 23 58.396 -9.909 19.340 1.00 0.00 H new ATOM 0 HZ PHE A 23 56.226 -10.401 18.242 1.00 0.00 H new ATOM 339 N ILE A 24 61.674 -8.293 12.322 1.00 0.00 N ATOM 340 CA ILE A 24 61.544 -7.747 10.941 1.00 0.00 C ATOM 341 C ILE A 24 62.229 -8.682 9.949 1.00 0.00 C ATOM 342 O ILE A 24 62.951 -9.589 10.313 1.00 0.00 O ATOM 343 CB ILE A 24 62.197 -6.350 10.887 1.00 0.00 C ATOM 344 CG1 ILE A 24 61.122 -5.286 11.052 1.00 0.00 C ATOM 345 CG2 ILE A 24 62.917 -6.096 9.549 1.00 0.00 C ATOM 346 CD1 ILE A 24 61.815 -3.960 11.303 1.00 0.00 C ATOM 0 H ILE A 24 62.631 -8.436 12.645 1.00 0.00 H new ATOM 0 HA ILE A 24 60.490 -7.666 10.676 1.00 0.00 H new ATOM 0 HB ILE A 24 62.931 -6.304 11.691 1.00 0.00 H new ATOM 0 HG12 ILE A 24 60.501 -5.229 10.158 1.00 0.00 H new ATOM 0 HG13 ILE A 24 60.462 -5.535 11.883 1.00 0.00 H new ATOM 0 HG21 ILE A 24 63.361 -5.100 9.558 1.00 0.00 H new ATOM 0 HG22 ILE A 24 63.700 -6.841 9.410 1.00 0.00 H new ATOM 0 HG23 ILE A 24 62.200 -6.166 8.731 1.00 0.00 H new ATOM 0 HD11 ILE A 24 61.067 -3.176 11.426 1.00 0.00 H new ATOM 0 HD12 ILE A 24 62.419 -4.030 12.208 1.00 0.00 H new ATOM 0 HD13 ILE A 24 62.458 -3.719 10.456 1.00 0.00 H new ATOM 358 N ALA A 25 62.015 -8.436 8.693 1.00 0.00 N ATOM 359 CA ALA A 25 62.651 -9.262 7.644 1.00 0.00 C ATOM 360 C ALA A 25 63.001 -8.351 6.469 1.00 0.00 C ATOM 361 O ALA A 25 64.130 -8.300 6.023 1.00 0.00 O ATOM 362 CB ALA A 25 61.678 -10.350 7.184 1.00 0.00 C ATOM 0 H ALA A 25 61.417 -7.686 8.345 1.00 0.00 H new ATOM 0 HA ALA A 25 63.551 -9.740 8.032 1.00 0.00 H new ATOM 0 HB1 ALA A 25 62.150 -10.957 6.411 1.00 0.00 H new ATOM 0 HB2 ALA A 25 61.413 -10.983 8.031 1.00 0.00 H new ATOM 0 HB3 ALA A 25 60.777 -9.886 6.782 1.00 0.00 H new ATOM 368 N ALA A 26 62.039 -7.618 5.974 1.00 0.00 N ATOM 369 CA ALA A 26 62.319 -6.696 4.840 1.00 0.00 C ATOM 370 C ALA A 26 62.353 -5.253 5.339 1.00 0.00 C ATOM 371 O ALA A 26 62.490 -4.988 6.517 1.00 0.00 O ATOM 372 CB ALA A 26 61.233 -6.844 3.775 1.00 0.00 C ATOM 0 H ALA A 26 61.075 -7.619 6.306 1.00 0.00 H new ATOM 0 HA ALA A 26 63.287 -6.948 4.407 1.00 0.00 H new ATOM 0 HB1 ALA A 26 61.441 -6.167 2.946 1.00 0.00 H new ATOM 0 HB2 ALA A 26 61.219 -7.871 3.410 1.00 0.00 H new ATOM 0 HB3 ALA A 26 60.263 -6.599 4.208 1.00 0.00 H new ATOM 378 N TYR A 27 62.192 -4.322 4.441 1.00 0.00 N ATOM 379 CA TYR A 27 62.170 -2.886 4.829 1.00 0.00 C ATOM 380 C TYR A 27 61.717 -2.074 3.609 1.00 0.00 C ATOM 381 O TYR A 27 61.447 -2.621 2.559 1.00 0.00 O ATOM 382 CB TYR A 27 63.569 -2.439 5.328 1.00 0.00 C ATOM 383 CG TYR A 27 64.140 -1.331 4.465 1.00 0.00 C ATOM 384 CD1 TYR A 27 64.387 -1.548 3.102 1.00 0.00 C ATOM 385 CD2 TYR A 27 64.415 -0.086 5.038 1.00 0.00 C ATOM 386 CE1 TYR A 27 64.911 -0.516 2.315 1.00 0.00 C ATOM 387 CE2 TYR A 27 64.939 0.946 4.251 1.00 0.00 C ATOM 388 CZ TYR A 27 65.187 0.732 2.889 1.00 0.00 C ATOM 389 OH TYR A 27 65.703 1.750 2.114 1.00 0.00 O ATOM 0 H TYR A 27 62.073 -4.498 3.443 1.00 0.00 H new ATOM 0 HA TYR A 27 61.474 -2.721 5.651 1.00 0.00 H new ATOM 0 HB2 TYR A 27 63.496 -2.096 6.360 1.00 0.00 H new ATOM 0 HB3 TYR A 27 64.248 -3.292 5.323 1.00 0.00 H new ATOM 0 HD1 TYR A 27 64.173 -2.510 2.660 1.00 0.00 H new ATOM 0 HD2 TYR A 27 64.223 0.080 6.088 1.00 0.00 H new ATOM 0 HE1 TYR A 27 65.103 -0.682 1.265 1.00 0.00 H new ATOM 0 HE2 TYR A 27 65.152 1.908 4.694 1.00 0.00 H new ATOM 0 HH TYR A 27 65.835 2.548 2.668 1.00 0.00 H new ATOM 399 N PHE A 28 61.631 -0.780 3.732 1.00 0.00 N ATOM 400 CA PHE A 28 61.191 0.044 2.570 1.00 0.00 C ATOM 401 C PHE A 28 61.629 1.499 2.772 1.00 0.00 C ATOM 402 O PHE A 28 62.493 1.787 3.577 1.00 0.00 O ATOM 403 CB PHE A 28 59.666 -0.035 2.470 1.00 0.00 C ATOM 404 CG PHE A 28 59.277 -1.233 1.636 1.00 0.00 C ATOM 405 CD1 PHE A 28 59.274 -1.144 0.240 1.00 0.00 C ATOM 406 CD2 PHE A 28 58.925 -2.434 2.263 1.00 0.00 C ATOM 407 CE1 PHE A 28 58.919 -2.258 -0.529 1.00 0.00 C ATOM 408 CE2 PHE A 28 58.572 -3.547 1.496 1.00 0.00 C ATOM 409 CZ PHE A 28 58.568 -3.460 0.097 1.00 0.00 C ATOM 0 H PHE A 28 61.845 -0.258 4.582 1.00 0.00 H new ATOM 0 HA PHE A 28 61.642 -0.331 1.651 1.00 0.00 H new ATOM 0 HB2 PHE A 28 59.229 -0.114 3.466 1.00 0.00 H new ATOM 0 HB3 PHE A 28 59.273 0.877 2.021 1.00 0.00 H new ATOM 0 HD1 PHE A 28 59.545 -0.217 -0.244 1.00 0.00 H new ATOM 0 HD2 PHE A 28 58.926 -2.500 3.341 1.00 0.00 H new ATOM 0 HE1 PHE A 28 58.916 -2.190 -1.607 1.00 0.00 H new ATOM 0 HE2 PHE A 28 58.302 -4.474 1.981 1.00 0.00 H new ATOM 0 HZ PHE A 28 58.294 -4.319 -0.497 1.00 0.00 H new ATOM 419 N GLU A 29 61.055 2.417 2.041 1.00 0.00 N ATOM 420 CA GLU A 29 61.452 3.843 2.191 1.00 0.00 C ATOM 421 C GLU A 29 60.477 4.737 1.417 1.00 0.00 C ATOM 422 O GLU A 29 60.657 5.000 0.245 1.00 0.00 O ATOM 423 CB GLU A 29 62.860 4.017 1.634 1.00 0.00 C ATOM 424 CG GLU A 29 62.937 3.367 0.252 1.00 0.00 C ATOM 425 CD GLU A 29 64.016 4.060 -0.582 1.00 0.00 C ATOM 426 OE1 GLU A 29 65.087 4.298 -0.048 1.00 0.00 O ATOM 427 OE2 GLU A 29 63.753 4.339 -1.741 1.00 0.00 O ATOM 0 H GLU A 29 60.329 2.239 1.347 1.00 0.00 H new ATOM 0 HA GLU A 29 61.429 4.126 3.243 1.00 0.00 H new ATOM 0 HB2 GLU A 29 63.109 5.076 1.565 1.00 0.00 H new ATOM 0 HB3 GLU A 29 63.588 3.561 2.305 1.00 0.00 H new ATOM 0 HG2 GLU A 29 63.165 2.306 0.350 1.00 0.00 H new ATOM 0 HG3 GLU A 29 61.972 3.441 -0.250 1.00 0.00 H new ATOM 434 N THR A 30 59.445 5.205 2.063 1.00 0.00 N ATOM 435 CA THR A 30 58.460 6.079 1.364 1.00 0.00 C ATOM 436 C THR A 30 59.185 7.279 0.750 1.00 0.00 C ATOM 437 O THR A 30 60.158 7.771 1.286 1.00 0.00 O ATOM 438 CB THR A 30 57.412 6.565 2.368 1.00 0.00 C ATOM 439 OG1 THR A 30 58.057 7.237 3.439 1.00 0.00 O ATOM 440 CG2 THR A 30 56.638 5.363 2.909 1.00 0.00 C ATOM 0 H THR A 30 59.241 5.020 3.045 1.00 0.00 H new ATOM 0 HA THR A 30 57.968 5.515 0.572 1.00 0.00 H new ATOM 0 HB THR A 30 56.723 7.251 1.875 1.00 0.00 H new ATOM 0 HG1 THR A 30 59.021 7.279 3.266 1.00 0.00 H new ATOM 0 HG21 THR A 30 55.890 5.704 3.625 1.00 0.00 H new ATOM 0 HG22 THR A 30 56.144 4.848 2.085 1.00 0.00 H new ATOM 0 HG23 THR A 30 57.328 4.679 3.403 1.00 0.00 H new ATOM 448 N SER A 31 58.720 7.752 -0.376 1.00 0.00 N ATOM 449 CA SER A 31 59.383 8.916 -1.028 1.00 0.00 C ATOM 450 C SER A 31 58.761 10.218 -0.517 1.00 0.00 C ATOM 451 O SER A 31 58.157 10.257 0.537 1.00 0.00 O ATOM 452 CB SER A 31 59.197 8.827 -2.543 1.00 0.00 C ATOM 453 OG SER A 31 58.846 7.494 -2.897 1.00 0.00 O ATOM 0 H SER A 31 57.909 7.381 -0.872 1.00 0.00 H new ATOM 0 HA SER A 31 60.446 8.904 -0.788 1.00 0.00 H new ATOM 0 HB2 SER A 31 58.419 9.518 -2.866 1.00 0.00 H new ATOM 0 HB3 SER A 31 60.115 9.121 -3.051 1.00 0.00 H new ATOM 0 HG SER A 31 58.724 7.435 -3.868 1.00 0.00 H new ATOM 459 N SER A 32 58.906 11.284 -1.256 1.00 0.00 N ATOM 460 CA SER A 32 58.325 12.584 -0.815 1.00 0.00 C ATOM 461 C SER A 32 56.795 12.525 -0.934 1.00 0.00 C ATOM 462 O SER A 32 56.158 11.688 -0.326 1.00 0.00 O ATOM 463 CB SER A 32 58.884 13.707 -1.691 1.00 0.00 C ATOM 464 OG SER A 32 58.396 14.955 -1.220 1.00 0.00 O ATOM 0 H SER A 32 59.402 11.311 -2.147 1.00 0.00 H new ATOM 0 HA SER A 32 58.590 12.778 0.224 1.00 0.00 H new ATOM 0 HB2 SER A 32 59.974 13.696 -1.665 1.00 0.00 H new ATOM 0 HB3 SER A 32 58.588 13.556 -2.729 1.00 0.00 H new ATOM 0 HG SER A 32 58.753 15.677 -1.778 1.00 0.00 H new ATOM 470 N GLN A 33 56.192 13.398 -1.704 1.00 0.00 N ATOM 471 CA GLN A 33 54.708 13.368 -1.841 1.00 0.00 C ATOM 472 C GLN A 33 54.067 13.406 -0.452 1.00 0.00 C ATOM 473 O GLN A 33 53.780 14.458 0.081 1.00 0.00 O ATOM 474 CB GLN A 33 54.290 12.085 -2.562 1.00 0.00 C ATOM 475 CG GLN A 33 54.449 12.272 -4.072 1.00 0.00 C ATOM 476 CD GLN A 33 53.623 13.477 -4.529 1.00 0.00 C ATOM 477 OE1 GLN A 33 52.632 13.817 -3.914 1.00 0.00 O ATOM 478 NE2 GLN A 33 53.993 14.142 -5.588 1.00 0.00 N ATOM 0 H GLN A 33 56.664 14.126 -2.240 1.00 0.00 H new ATOM 0 HA GLN A 33 54.377 14.233 -2.417 1.00 0.00 H new ATOM 0 HB2 GLN A 33 54.901 11.249 -2.222 1.00 0.00 H new ATOM 0 HB3 GLN A 33 53.255 11.841 -2.322 1.00 0.00 H new ATOM 0 HG2 GLN A 33 55.499 12.422 -4.322 1.00 0.00 H new ATOM 0 HG3 GLN A 33 54.122 11.374 -4.596 1.00 0.00 H new ATOM 0 HE21 GLN A 33 54.825 13.857 -6.104 1.00 0.00 H new ATOM 0 HE22 GLN A 33 53.450 14.947 -5.900 1.00 0.00 H new ATOM 487 N CYS A 34 53.843 12.264 0.138 1.00 0.00 N ATOM 488 CA CYS A 34 53.226 12.233 1.491 1.00 0.00 C ATOM 489 C CYS A 34 54.300 12.547 2.541 1.00 0.00 C ATOM 490 O CYS A 34 55.046 13.497 2.405 1.00 0.00 O ATOM 491 CB CYS A 34 52.637 10.844 1.747 1.00 0.00 C ATOM 492 SG CYS A 34 51.518 10.399 0.397 1.00 0.00 S ATOM 0 H CYS A 34 54.061 11.351 -0.260 1.00 0.00 H new ATOM 0 HA CYS A 34 52.431 12.976 1.554 1.00 0.00 H new ATOM 0 HB2 CYS A 34 53.437 10.108 1.827 1.00 0.00 H new ATOM 0 HB3 CYS A 34 52.100 10.835 2.695 1.00 0.00 H new ATOM 497 N SER A 35 54.391 11.765 3.587 1.00 0.00 N ATOM 498 CA SER A 35 55.421 12.040 4.625 1.00 0.00 C ATOM 499 C SER A 35 56.812 11.701 4.074 1.00 0.00 C ATOM 500 O SER A 35 57.544 12.587 3.688 1.00 0.00 O ATOM 501 CB SER A 35 55.123 11.202 5.874 1.00 0.00 C ATOM 502 OG SER A 35 55.803 11.763 6.989 1.00 0.00 O ATOM 0 H SER A 35 53.799 10.953 3.764 1.00 0.00 H new ATOM 0 HA SER A 35 55.399 13.096 4.894 1.00 0.00 H new ATOM 0 HB2 SER A 35 54.050 11.178 6.062 1.00 0.00 H new ATOM 0 HB3 SER A 35 55.443 10.171 5.719 1.00 0.00 H new ATOM 0 HG SER A 35 55.509 11.316 7.810 1.00 0.00 H new ATOM 508 N LYS A 36 57.166 10.424 4.041 1.00 0.00 N ATOM 509 CA LYS A 36 58.506 9.970 3.521 1.00 0.00 C ATOM 510 C LYS A 36 59.329 9.310 4.642 1.00 0.00 C ATOM 511 O LYS A 36 59.929 8.277 4.424 1.00 0.00 O ATOM 512 CB LYS A 36 59.312 11.129 2.926 1.00 0.00 C ATOM 513 CG LYS A 36 60.655 10.610 2.408 1.00 0.00 C ATOM 514 CD LYS A 36 61.770 11.027 3.371 1.00 0.00 C ATOM 515 CE LYS A 36 62.947 10.058 3.242 1.00 0.00 C ATOM 516 NZ LYS A 36 64.059 10.506 4.129 1.00 0.00 N ATOM 0 H LYS A 36 56.565 9.664 4.361 1.00 0.00 H new ATOM 0 HA LYS A 36 58.308 9.245 2.732 1.00 0.00 H new ATOM 0 HB2 LYS A 36 58.753 11.594 2.114 1.00 0.00 H new ATOM 0 HB3 LYS A 36 59.475 11.897 3.682 1.00 0.00 H new ATOM 0 HG2 LYS A 36 60.626 9.524 2.316 1.00 0.00 H new ATOM 0 HG3 LYS A 36 60.852 11.009 1.413 1.00 0.00 H new ATOM 0 HD2 LYS A 36 62.096 12.043 3.148 1.00 0.00 H new ATOM 0 HD3 LYS A 36 61.398 11.029 4.396 1.00 0.00 H new ATOM 0 HE2 LYS A 36 62.634 9.050 3.514 1.00 0.00 H new ATOM 0 HE3 LYS A 36 63.287 10.017 2.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 64.859 9.848 4.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 64.363 11.460 3.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 63.731 10.523 5.116 1.00 0.00 H new ATOM 530 N PRO A 37 59.352 9.919 5.808 1.00 0.00 N ATOM 531 CA PRO A 37 60.114 9.389 6.950 1.00 0.00 C ATOM 532 C PRO A 37 59.322 8.284 7.650 1.00 0.00 C ATOM 533 O PRO A 37 58.363 8.547 8.348 1.00 0.00 O ATOM 534 CB PRO A 37 60.271 10.600 7.873 1.00 0.00 C ATOM 535 CG PRO A 37 59.132 11.580 7.504 1.00 0.00 C ATOM 536 CD PRO A 37 58.633 11.175 6.105 1.00 0.00 C ATOM 0 HA PRO A 37 61.068 8.951 6.659 1.00 0.00 H new ATOM 0 HB2 PRO A 37 60.204 10.302 8.919 1.00 0.00 H new ATOM 0 HB3 PRO A 37 61.246 11.068 7.737 1.00 0.00 H new ATOM 0 HG2 PRO A 37 58.324 11.526 8.233 1.00 0.00 H new ATOM 0 HG3 PRO A 37 59.492 12.609 7.503 1.00 0.00 H new ATOM 0 HD2 PRO A 37 57.553 11.026 6.096 1.00 0.00 H new ATOM 0 HD3 PRO A 37 58.855 11.944 5.366 1.00 0.00 H new ATOM 544 N GLY A 38 59.711 7.052 7.477 1.00 0.00 N ATOM 545 CA GLY A 38 58.968 5.953 8.150 1.00 0.00 C ATOM 546 C GLY A 38 59.155 4.633 7.398 1.00 0.00 C ATOM 547 O GLY A 38 58.870 3.577 7.922 1.00 0.00 O ATOM 0 H GLY A 38 60.503 6.761 6.904 1.00 0.00 H new ATOM 0 HA2 GLY A 38 59.319 5.845 9.176 1.00 0.00 H new ATOM 0 HA3 GLY A 38 57.908 6.202 8.200 1.00 0.00 H new ATOM 551 N VAL A 39 59.628 4.680 6.180 1.00 0.00 N ATOM 552 CA VAL A 39 59.831 3.417 5.404 1.00 0.00 C ATOM 553 C VAL A 39 58.655 2.464 5.624 1.00 0.00 C ATOM 554 O VAL A 39 57.614 2.836 6.123 1.00 0.00 O ATOM 555 CB VAL A 39 61.115 2.720 5.870 1.00 0.00 C ATOM 556 CG1 VAL A 39 62.300 3.675 5.744 1.00 0.00 C ATOM 557 CG2 VAL A 39 60.957 2.275 7.329 1.00 0.00 C ATOM 0 H VAL A 39 59.883 5.536 5.688 1.00 0.00 H new ATOM 0 HA VAL A 39 59.905 3.672 4.347 1.00 0.00 H new ATOM 0 HB VAL A 39 61.297 1.846 5.245 1.00 0.00 H new ATOM 0 HG11 VAL A 39 63.209 3.173 6.077 1.00 0.00 H new ATOM 0 HG12 VAL A 39 62.413 3.979 4.703 1.00 0.00 H new ATOM 0 HG13 VAL A 39 62.125 4.556 6.362 1.00 0.00 H new ATOM 0 HG21 VAL A 39 61.870 1.780 7.659 1.00 0.00 H new ATOM 0 HG22 VAL A 39 60.769 3.146 7.957 1.00 0.00 H new ATOM 0 HG23 VAL A 39 60.119 1.582 7.409 1.00 0.00 H new ATOM 567 N ILE A 40 58.838 1.225 5.271 1.00 0.00 N ATOM 568 CA ILE A 40 57.770 0.210 5.471 1.00 0.00 C ATOM 569 C ILE A 40 58.465 -1.110 5.802 1.00 0.00 C ATOM 570 O ILE A 40 59.390 -1.518 5.130 1.00 0.00 O ATOM 571 CB ILE A 40 56.911 0.084 4.200 1.00 0.00 C ATOM 572 CG1 ILE A 40 55.772 1.102 4.264 1.00 0.00 C ATOM 573 CG2 ILE A 40 56.319 -1.327 4.095 1.00 0.00 C ATOM 574 CD1 ILE A 40 55.954 2.138 3.156 1.00 0.00 C ATOM 0 H ILE A 40 59.694 0.868 4.847 1.00 0.00 H new ATOM 0 HA ILE A 40 57.100 0.497 6.281 1.00 0.00 H new ATOM 0 HB ILE A 40 57.537 0.272 3.327 1.00 0.00 H new ATOM 0 HG12 ILE A 40 54.812 0.598 4.151 1.00 0.00 H new ATOM 0 HG13 ILE A 40 55.762 1.592 5.237 1.00 0.00 H new ATOM 0 HG21 ILE A 40 55.714 -1.401 3.191 1.00 0.00 H new ATOM 0 HG22 ILE A 40 57.126 -2.058 4.052 1.00 0.00 H new ATOM 0 HG23 ILE A 40 55.695 -1.526 4.967 1.00 0.00 H new ATOM 0 HD11 ILE A 40 55.143 2.865 3.200 1.00 0.00 H new ATOM 0 HD12 ILE A 40 56.907 2.650 3.289 1.00 0.00 H new ATOM 0 HD13 ILE A 40 55.942 1.640 2.187 1.00 0.00 H new ATOM 586 N PHE A 41 58.057 -1.763 6.849 1.00 0.00 N ATOM 587 CA PHE A 41 58.736 -3.030 7.229 1.00 0.00 C ATOM 588 C PHE A 41 57.868 -4.236 6.884 1.00 0.00 C ATOM 589 O PHE A 41 56.672 -4.134 6.700 1.00 0.00 O ATOM 590 CB PHE A 41 59.014 -3.025 8.732 1.00 0.00 C ATOM 591 CG PHE A 41 60.194 -2.130 9.020 1.00 0.00 C ATOM 592 CD1 PHE A 41 61.416 -2.352 8.373 1.00 0.00 C ATOM 593 CD2 PHE A 41 60.066 -1.079 9.934 1.00 0.00 C ATOM 594 CE1 PHE A 41 62.509 -1.520 8.642 1.00 0.00 C ATOM 595 CE2 PHE A 41 61.160 -0.249 10.201 1.00 0.00 C ATOM 596 CZ PHE A 41 62.380 -0.470 9.555 1.00 0.00 C ATOM 0 H PHE A 41 57.288 -1.478 7.456 1.00 0.00 H new ATOM 0 HA PHE A 41 59.671 -3.102 6.673 1.00 0.00 H new ATOM 0 HB2 PHE A 41 58.136 -2.674 9.274 1.00 0.00 H new ATOM 0 HB3 PHE A 41 59.219 -4.038 9.079 1.00 0.00 H new ATOM 0 HD1 PHE A 41 61.515 -3.164 7.668 1.00 0.00 H new ATOM 0 HD2 PHE A 41 59.124 -0.908 10.433 1.00 0.00 H new ATOM 0 HE1 PHE A 41 63.452 -1.690 8.144 1.00 0.00 H new ATOM 0 HE2 PHE A 41 61.062 0.563 10.906 1.00 0.00 H new ATOM 0 HZ PHE A 41 63.224 0.172 9.762 1.00 0.00 H new ATOM 606 N LEU A 42 58.482 -5.380 6.803 1.00 0.00 N ATOM 607 CA LEU A 42 57.743 -6.621 6.480 1.00 0.00 C ATOM 608 C LEU A 42 57.914 -7.609 7.630 1.00 0.00 C ATOM 609 O LEU A 42 58.557 -8.631 7.496 1.00 0.00 O ATOM 610 CB LEU A 42 58.325 -7.225 5.210 1.00 0.00 C ATOM 611 CG LEU A 42 57.724 -6.532 3.992 1.00 0.00 C ATOM 612 CD1 LEU A 42 58.341 -7.121 2.726 1.00 0.00 C ATOM 613 CD2 LEU A 42 56.208 -6.748 3.973 1.00 0.00 C ATOM 0 H LEU A 42 59.483 -5.506 6.950 1.00 0.00 H new ATOM 0 HA LEU A 42 56.685 -6.402 6.334 1.00 0.00 H new ATOM 0 HB2 LEU A 42 59.409 -7.114 5.206 1.00 0.00 H new ATOM 0 HB3 LEU A 42 58.114 -8.294 5.174 1.00 0.00 H new ATOM 0 HG LEU A 42 57.933 -5.463 4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 42 57.915 -6.630 1.851 1.00 0.00 H new ATOM 0 HD12 LEU A 42 59.420 -6.965 2.741 1.00 0.00 H new ATOM 0 HD13 LEU A 42 58.129 -8.189 2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 42 55.781 -6.252 3.102 1.00 0.00 H new ATOM 0 HD22 LEU A 42 55.993 -7.816 3.924 1.00 0.00 H new ATOM 0 HD23 LEU A 42 55.770 -6.331 4.879 1.00 0.00 H new ATOM 625 N THR A 43 57.356 -7.298 8.761 1.00 0.00 N ATOM 626 CA THR A 43 57.484 -8.201 9.937 1.00 0.00 C ATOM 627 C THR A 43 57.154 -9.639 9.532 1.00 0.00 C ATOM 628 O THR A 43 56.883 -9.932 8.385 1.00 0.00 O ATOM 629 CB THR A 43 56.515 -7.747 11.031 1.00 0.00 C ATOM 630 OG1 THR A 43 55.186 -8.072 10.647 1.00 0.00 O ATOM 631 CG2 THR A 43 56.637 -6.236 11.227 1.00 0.00 C ATOM 0 H THR A 43 56.812 -6.451 8.925 1.00 0.00 H new ATOM 0 HA THR A 43 58.508 -8.161 10.309 1.00 0.00 H new ATOM 0 HB THR A 43 56.757 -8.252 11.966 1.00 0.00 H new ATOM 0 HG1 THR A 43 54.659 -8.290 11.444 1.00 0.00 H new ATOM 0 HG21 THR A 43 55.947 -5.913 12.006 1.00 0.00 H new ATOM 0 HG22 THR A 43 57.657 -5.988 11.521 1.00 0.00 H new ATOM 0 HG23 THR A 43 56.394 -5.727 10.294 1.00 0.00 H new ATOM 639 N LYS A 44 57.171 -10.538 10.475 1.00 0.00 N ATOM 640 CA LYS A 44 56.863 -11.961 10.161 1.00 0.00 C ATOM 641 C LYS A 44 55.348 -12.152 10.113 1.00 0.00 C ATOM 642 O LYS A 44 54.838 -12.968 9.371 1.00 0.00 O ATOM 643 CB LYS A 44 57.461 -12.861 11.243 1.00 0.00 C ATOM 644 CG LYS A 44 58.854 -12.346 11.614 1.00 0.00 C ATOM 645 CD LYS A 44 59.711 -12.229 10.351 1.00 0.00 C ATOM 646 CE LYS A 44 60.965 -13.089 10.509 1.00 0.00 C ATOM 647 NZ LYS A 44 60.938 -14.190 9.505 1.00 0.00 N ATOM 0 H LYS A 44 57.386 -10.348 11.454 1.00 0.00 H new ATOM 0 HA LYS A 44 57.292 -12.225 9.194 1.00 0.00 H new ATOM 0 HB2 LYS A 44 56.817 -12.869 12.123 1.00 0.00 H new ATOM 0 HB3 LYS A 44 57.524 -13.888 10.884 1.00 0.00 H new ATOM 0 HG2 LYS A 44 58.775 -11.375 12.104 1.00 0.00 H new ATOM 0 HG3 LYS A 44 59.326 -13.024 12.325 1.00 0.00 H new ATOM 0 HD2 LYS A 44 59.141 -12.553 9.480 1.00 0.00 H new ATOM 0 HD3 LYS A 44 59.989 -11.189 10.181 1.00 0.00 H new ATOM 0 HE2 LYS A 44 61.858 -12.479 10.372 1.00 0.00 H new ATOM 0 HE3 LYS A 44 61.012 -13.502 11.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 61.790 -14.777 9.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 60.093 -14.777 9.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 60.912 -13.786 8.547 1.00 0.00 H new ATOM 661 N ARG A 45 54.625 -11.398 10.892 1.00 0.00 N ATOM 662 CA ARG A 45 53.143 -11.530 10.881 1.00 0.00 C ATOM 663 C ARG A 45 52.598 -10.971 9.565 1.00 0.00 C ATOM 664 O ARG A 45 51.421 -11.059 9.282 1.00 0.00 O ATOM 665 CB ARG A 45 52.552 -10.748 12.055 1.00 0.00 C ATOM 666 CG ARG A 45 51.059 -11.057 12.175 1.00 0.00 C ATOM 667 CD ARG A 45 50.647 -11.033 13.647 1.00 0.00 C ATOM 668 NE ARG A 45 49.507 -10.091 13.826 1.00 0.00 N ATOM 669 CZ ARG A 45 48.393 -10.511 14.361 1.00 0.00 C ATOM 670 NH1 ARG A 45 47.787 -11.556 13.871 1.00 0.00 N ATOM 671 NH2 ARG A 45 47.886 -9.883 15.387 1.00 0.00 N ATOM 0 H ARG A 45 54.995 -10.698 11.534 1.00 0.00 H new ATOM 0 HA ARG A 45 52.867 -12.580 10.974 1.00 0.00 H new ATOM 0 HB2 ARG A 45 53.065 -11.016 12.979 1.00 0.00 H new ATOM 0 HB3 ARG A 45 52.702 -9.679 11.906 1.00 0.00 H new ATOM 0 HG2 ARG A 45 50.479 -10.325 11.613 1.00 0.00 H new ATOM 0 HG3 ARG A 45 50.844 -12.034 11.743 1.00 0.00 H new ATOM 0 HD2 ARG A 45 50.361 -12.033 13.972 1.00 0.00 H new ATOM 0 HD3 ARG A 45 51.489 -10.725 14.267 1.00 0.00 H new ATOM 0 HE ARG A 45 49.597 -9.119 13.531 1.00 0.00 H new ATOM 0 HH11 ARG A 45 48.183 -12.046 13.069 1.00 0.00 H new ATOM 0 HH12 ARG A 45 46.916 -11.884 14.290 1.00 0.00 H new ATOM 0 HH21 ARG A 45 48.360 -9.065 15.770 1.00 0.00 H new ATOM 0 HH22 ARG A 45 47.015 -10.210 15.806 1.00 0.00 H new ATOM 685 N SER A 46 53.450 -10.394 8.757 1.00 0.00 N ATOM 686 CA SER A 46 52.986 -9.832 7.458 1.00 0.00 C ATOM 687 C SER A 46 52.285 -8.497 7.705 1.00 0.00 C ATOM 688 O SER A 46 51.182 -8.272 7.247 1.00 0.00 O ATOM 689 CB SER A 46 52.010 -10.807 6.796 1.00 0.00 C ATOM 690 OG SER A 46 51.964 -10.553 5.398 1.00 0.00 O ATOM 0 H SER A 46 54.447 -10.289 8.943 1.00 0.00 H new ATOM 0 HA SER A 46 53.843 -9.678 6.802 1.00 0.00 H new ATOM 0 HB2 SER A 46 52.324 -11.834 6.980 1.00 0.00 H new ATOM 0 HB3 SER A 46 51.016 -10.695 7.230 1.00 0.00 H new ATOM 0 HG SER A 46 51.340 -11.178 4.972 1.00 0.00 H new ATOM 696 N ARG A 47 52.912 -7.604 8.425 1.00 0.00 N ATOM 697 CA ARG A 47 52.265 -6.287 8.690 1.00 0.00 C ATOM 698 C ARG A 47 53.223 -5.147 8.326 1.00 0.00 C ATOM 699 O ARG A 47 54.349 -5.098 8.779 1.00 0.00 O ATOM 700 CB ARG A 47 51.875 -6.194 10.174 1.00 0.00 C ATOM 701 CG ARG A 47 53.079 -5.748 11.015 1.00 0.00 C ATOM 702 CD ARG A 47 52.671 -5.659 12.487 1.00 0.00 C ATOM 703 NE ARG A 47 52.646 -7.025 13.080 1.00 0.00 N ATOM 704 CZ ARG A 47 52.838 -7.184 14.361 1.00 0.00 C ATOM 705 NH1 ARG A 47 54.033 -7.038 14.864 1.00 0.00 N ATOM 706 NH2 ARG A 47 51.833 -7.487 15.138 1.00 0.00 N ATOM 0 H ARG A 47 53.836 -7.729 8.838 1.00 0.00 H new ATOM 0 HA ARG A 47 51.368 -6.199 8.077 1.00 0.00 H new ATOM 0 HB2 ARG A 47 51.055 -5.487 10.298 1.00 0.00 H new ATOM 0 HB3 ARG A 47 51.517 -7.162 10.524 1.00 0.00 H new ATOM 0 HG2 ARG A 47 53.900 -6.455 10.897 1.00 0.00 H new ATOM 0 HG3 ARG A 47 53.440 -4.780 10.668 1.00 0.00 H new ATOM 0 HD2 ARG A 47 53.372 -5.027 13.032 1.00 0.00 H new ATOM 0 HD3 ARG A 47 51.689 -5.195 12.576 1.00 0.00 H new ATOM 0 HE ARG A 47 52.479 -7.836 12.485 1.00 0.00 H new ATOM 0 HH11 ARG A 47 54.817 -6.800 14.256 1.00 0.00 H new ATOM 0 HH12 ARG A 47 54.184 -7.162 15.865 1.00 0.00 H new ATOM 0 HH21 ARG A 47 50.899 -7.599 14.743 1.00 0.00 H new ATOM 0 HH22 ARG A 47 51.982 -7.612 16.139 1.00 0.00 H new ATOM 720 N GLN A 48 52.774 -4.225 7.518 1.00 0.00 N ATOM 721 CA GLN A 48 53.644 -3.079 7.130 1.00 0.00 C ATOM 722 C GLN A 48 53.791 -2.143 8.331 1.00 0.00 C ATOM 723 O GLN A 48 52.814 -1.754 8.941 1.00 0.00 O ATOM 724 CB GLN A 48 52.989 -2.323 5.971 1.00 0.00 C ATOM 725 CG GLN A 48 53.735 -1.014 5.722 1.00 0.00 C ATOM 726 CD GLN A 48 52.791 0.167 5.960 1.00 0.00 C ATOM 727 OE1 GLN A 48 52.252 0.726 5.026 1.00 0.00 O ATOM 728 NE2 GLN A 48 52.570 0.575 7.180 1.00 0.00 N ATOM 0 H GLN A 48 51.840 -4.216 7.109 1.00 0.00 H new ATOM 0 HA GLN A 48 54.625 -3.440 6.821 1.00 0.00 H new ATOM 0 HB2 GLN A 48 53.002 -2.937 5.070 1.00 0.00 H new ATOM 0 HB3 GLN A 48 51.944 -2.118 6.202 1.00 0.00 H new ATOM 0 HG2 GLN A 48 54.597 -0.943 6.385 1.00 0.00 H new ATOM 0 HG3 GLN A 48 54.115 -0.989 4.701 1.00 0.00 H new ATOM 0 HE21 GLN A 48 53.022 0.106 7.965 1.00 0.00 H new ATOM 0 HE22 GLN A 48 51.945 1.363 7.349 1.00 0.00 H new ATOM 737 N VAL A 49 54.995 -1.786 8.695 1.00 0.00 N ATOM 738 CA VAL A 49 55.156 -0.890 9.877 1.00 0.00 C ATOM 739 C VAL A 49 56.152 0.240 9.587 1.00 0.00 C ATOM 740 O VAL A 49 57.346 0.025 9.524 1.00 0.00 O ATOM 741 CB VAL A 49 55.665 -1.710 11.062 1.00 0.00 C ATOM 742 CG1 VAL A 49 55.586 -0.868 12.337 1.00 0.00 C ATOM 743 CG2 VAL A 49 54.799 -2.961 11.224 1.00 0.00 C ATOM 0 H VAL A 49 55.859 -2.070 8.234 1.00 0.00 H new ATOM 0 HA VAL A 49 54.187 -0.446 10.105 1.00 0.00 H new ATOM 0 HB VAL A 49 56.700 -2.003 10.884 1.00 0.00 H new ATOM 0 HG11 VAL A 49 55.949 -1.453 13.182 1.00 0.00 H new ATOM 0 HG12 VAL A 49 56.201 0.025 12.222 1.00 0.00 H new ATOM 0 HG13 VAL A 49 54.551 -0.575 12.516 1.00 0.00 H new ATOM 0 HG21 VAL A 49 55.161 -3.547 12.069 1.00 0.00 H new ATOM 0 HG22 VAL A 49 53.765 -2.667 11.403 1.00 0.00 H new ATOM 0 HG23 VAL A 49 54.854 -3.561 10.316 1.00 0.00 H new ATOM 753 N CYS A 50 55.671 1.450 9.444 1.00 0.00 N ATOM 754 CA CYS A 50 56.589 2.595 9.203 1.00 0.00 C ATOM 755 C CYS A 50 57.492 2.743 10.420 1.00 0.00 C ATOM 756 O CYS A 50 57.480 1.924 11.318 1.00 0.00 O ATOM 757 CB CYS A 50 55.780 3.887 9.014 1.00 0.00 C ATOM 758 SG CYS A 50 55.166 3.994 7.312 1.00 0.00 S ATOM 0 H CYS A 50 54.680 1.690 9.485 1.00 0.00 H new ATOM 0 HA CYS A 50 57.179 2.415 8.305 1.00 0.00 H new ATOM 0 HB2 CYS A 50 54.943 3.907 9.713 1.00 0.00 H new ATOM 0 HB3 CYS A 50 56.404 4.752 9.239 1.00 0.00 H new ATOM 763 N ALA A 51 58.272 3.776 10.461 1.00 0.00 N ATOM 764 CA ALA A 51 59.176 3.971 11.626 1.00 0.00 C ATOM 765 C ALA A 51 59.535 5.448 11.767 1.00 0.00 C ATOM 766 O ALA A 51 58.944 6.308 11.145 1.00 0.00 O ATOM 767 CB ALA A 51 60.452 3.158 11.417 1.00 0.00 C ATOM 0 H ALA A 51 58.326 4.496 9.741 1.00 0.00 H new ATOM 0 HA ALA A 51 58.669 3.638 12.532 1.00 0.00 H new ATOM 0 HB1 ALA A 51 61.117 3.299 12.269 1.00 0.00 H new ATOM 0 HB2 ALA A 51 60.199 2.102 11.324 1.00 0.00 H new ATOM 0 HB3 ALA A 51 60.952 3.493 10.508 1.00 0.00 H new ATOM 773 N ASP A 52 60.504 5.745 12.584 1.00 0.00 N ATOM 774 CA ASP A 52 60.916 7.160 12.775 1.00 0.00 C ATOM 775 C ASP A 52 61.671 7.636 11.529 1.00 0.00 C ATOM 776 O ASP A 52 62.033 6.838 10.686 1.00 0.00 O ATOM 777 CB ASP A 52 61.830 7.250 14.000 1.00 0.00 C ATOM 778 CG ASP A 52 61.210 8.186 15.041 1.00 0.00 C ATOM 779 OD1 ASP A 52 60.051 8.530 14.884 1.00 0.00 O ATOM 780 OD2 ASP A 52 61.907 8.543 15.977 1.00 0.00 O ATOM 0 H ASP A 52 61.031 5.064 13.131 1.00 0.00 H new ATOM 0 HA ASP A 52 60.039 7.789 12.928 1.00 0.00 H new ATOM 0 HB2 ASP A 52 61.976 6.259 14.430 1.00 0.00 H new ATOM 0 HB3 ASP A 52 62.813 7.618 13.706 1.00 0.00 H new ATOM 785 N PRO A 53 61.885 8.923 11.451 1.00 0.00 N ATOM 786 CA PRO A 53 62.597 9.541 10.318 1.00 0.00 C ATOM 787 C PRO A 53 64.101 9.292 10.444 1.00 0.00 C ATOM 788 O PRO A 53 64.754 8.886 9.503 1.00 0.00 O ATOM 789 CB PRO A 53 62.269 11.031 10.457 1.00 0.00 C ATOM 790 CG PRO A 53 61.872 11.253 11.935 1.00 0.00 C ATOM 791 CD PRO A 53 61.445 9.880 12.485 1.00 0.00 C ATOM 0 HA PRO A 53 62.303 9.139 9.349 1.00 0.00 H new ATOM 0 HB2 PRO A 53 63.129 11.645 10.189 1.00 0.00 H new ATOM 0 HB3 PRO A 53 61.455 11.314 9.789 1.00 0.00 H new ATOM 0 HG2 PRO A 53 62.709 11.656 12.505 1.00 0.00 H new ATOM 0 HG3 PRO A 53 61.057 11.973 12.014 1.00 0.00 H new ATOM 0 HD2 PRO A 53 61.915 9.672 13.446 1.00 0.00 H new ATOM 0 HD3 PRO A 53 60.367 9.831 12.640 1.00 0.00 H new ATOM 799 N SER A 54 64.653 9.527 11.601 1.00 0.00 N ATOM 800 CA SER A 54 66.111 9.298 11.791 1.00 0.00 C ATOM 801 C SER A 54 66.317 8.139 12.768 1.00 0.00 C ATOM 802 O SER A 54 66.939 8.290 13.800 1.00 0.00 O ATOM 803 CB SER A 54 66.761 10.563 12.354 1.00 0.00 C ATOM 804 OG SER A 54 67.597 11.142 11.361 1.00 0.00 O ATOM 0 H SER A 54 64.156 9.868 12.424 1.00 0.00 H new ATOM 0 HA SER A 54 66.569 9.055 10.832 1.00 0.00 H new ATOM 0 HB2 SER A 54 65.994 11.274 12.660 1.00 0.00 H new ATOM 0 HB3 SER A 54 67.345 10.322 13.242 1.00 0.00 H new ATOM 0 HG SER A 54 68.014 11.954 11.717 1.00 0.00 H new ATOM 810 N GLU A 55 65.805 6.981 12.448 1.00 0.00 N ATOM 811 CA GLU A 55 65.981 5.816 13.363 1.00 0.00 C ATOM 812 C GLU A 55 67.303 5.144 13.066 1.00 0.00 C ATOM 813 O GLU A 55 67.835 5.212 11.976 1.00 0.00 O ATOM 814 CB GLU A 55 64.838 4.797 13.201 1.00 0.00 C ATOM 815 CG GLU A 55 63.718 5.377 12.332 1.00 0.00 C ATOM 816 CD GLU A 55 63.987 5.049 10.863 1.00 0.00 C ATOM 817 OE1 GLU A 55 65.136 5.125 10.461 1.00 0.00 O ATOM 818 OE2 GLU A 55 63.039 4.728 10.164 1.00 0.00 O ATOM 0 H GLU A 55 65.275 6.792 11.597 1.00 0.00 H new ATOM 0 HA GLU A 55 65.965 6.181 14.390 1.00 0.00 H new ATOM 0 HB2 GLU A 55 65.220 3.882 12.748 1.00 0.00 H new ATOM 0 HB3 GLU A 55 64.443 4.527 14.180 1.00 0.00 H new ATOM 0 HG2 GLU A 55 62.756 4.964 12.637 1.00 0.00 H new ATOM 0 HG3 GLU A 55 63.659 6.457 12.469 1.00 0.00 H new ATOM 825 N GLU A 56 67.838 4.519 14.056 1.00 0.00 N ATOM 826 CA GLU A 56 69.142 3.844 13.909 1.00 0.00 C ATOM 827 C GLU A 56 68.919 2.358 13.637 1.00 0.00 C ATOM 828 O GLU A 56 69.687 1.711 12.955 1.00 0.00 O ATOM 829 CB GLU A 56 69.894 4.046 15.213 1.00 0.00 C ATOM 830 CG GLU A 56 71.193 3.239 15.199 1.00 0.00 C ATOM 831 CD GLU A 56 70.930 1.842 15.762 1.00 0.00 C ATOM 832 OE1 GLU A 56 70.318 1.754 16.814 1.00 0.00 O ATOM 833 OE2 GLU A 56 71.345 0.883 15.131 1.00 0.00 O ATOM 0 H GLU A 56 67.420 4.444 14.983 1.00 0.00 H new ATOM 0 HA GLU A 56 69.713 4.253 13.076 1.00 0.00 H new ATOM 0 HB2 GLU A 56 70.115 5.104 15.355 1.00 0.00 H new ATOM 0 HB3 GLU A 56 69.272 3.735 16.053 1.00 0.00 H new ATOM 0 HG2 GLU A 56 71.578 3.166 14.182 1.00 0.00 H new ATOM 0 HG3 GLU A 56 71.955 3.745 15.793 1.00 0.00 H new ATOM 840 N TRP A 57 67.866 1.825 14.174 1.00 0.00 N ATOM 841 CA TRP A 57 67.547 0.389 13.975 1.00 0.00 C ATOM 842 C TRP A 57 67.030 0.154 12.552 1.00 0.00 C ATOM 843 O TRP A 57 67.106 -0.945 12.037 1.00 0.00 O ATOM 844 CB TRP A 57 66.496 -0.012 15.005 1.00 0.00 C ATOM 845 CG TRP A 57 65.333 0.934 14.986 1.00 0.00 C ATOM 846 CD1 TRP A 57 65.260 2.113 15.649 1.00 0.00 C ATOM 847 CD2 TRP A 57 64.066 0.782 14.304 1.00 0.00 C ATOM 848 NE1 TRP A 57 64.025 2.682 15.419 1.00 0.00 N ATOM 849 CE2 TRP A 57 63.250 1.896 14.597 1.00 0.00 C ATOM 850 CE3 TRP A 57 63.558 -0.210 13.473 1.00 0.00 C ATOM 851 CZ2 TRP A 57 61.964 2.013 14.079 1.00 0.00 C ATOM 852 CZ3 TRP A 57 62.263 -0.106 12.944 1.00 0.00 C ATOM 853 CH2 TRP A 57 61.463 1.004 13.250 1.00 0.00 C ATOM 0 H TRP A 57 67.198 2.333 14.754 1.00 0.00 H new ATOM 0 HA TRP A 57 68.442 -0.219 14.107 1.00 0.00 H new ATOM 0 HB2 TRP A 57 66.149 -1.024 14.799 1.00 0.00 H new ATOM 0 HB3 TRP A 57 66.943 -0.024 15.999 1.00 0.00 H new ATOM 0 HD1 TRP A 57 66.043 2.539 16.259 1.00 0.00 H new ATOM 0 HE1 TRP A 57 63.723 3.575 15.810 1.00 0.00 H new ATOM 0 HE3 TRP A 57 64.166 -1.069 13.232 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 61.358 2.875 14.315 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 61.881 -0.883 12.299 1.00 0.00 H new ATOM 0 HH2 TRP A 57 60.464 1.080 12.847 1.00 0.00 H new ATOM 864 N VAL A 58 66.533 1.169 11.894 1.00 0.00 N ATOM 865 CA VAL A 58 66.055 0.967 10.495 1.00 0.00 C ATOM 866 C VAL A 58 67.258 1.053 9.560 1.00 0.00 C ATOM 867 O VAL A 58 67.275 0.467 8.498 1.00 0.00 O ATOM 868 CB VAL A 58 65.039 2.040 10.101 1.00 0.00 C ATOM 869 CG1 VAL A 58 64.552 1.764 8.674 1.00 0.00 C ATOM 870 CG2 VAL A 58 63.850 1.997 11.060 1.00 0.00 C ATOM 0 H VAL A 58 66.438 2.117 12.259 1.00 0.00 H new ATOM 0 HA VAL A 58 65.571 -0.007 10.422 1.00 0.00 H new ATOM 0 HB VAL A 58 65.506 3.024 10.150 1.00 0.00 H new ATOM 0 HG11 VAL A 58 63.827 2.524 8.384 1.00 0.00 H new ATOM 0 HG12 VAL A 58 65.399 1.790 7.989 1.00 0.00 H new ATOM 0 HG13 VAL A 58 64.083 0.781 8.633 1.00 0.00 H new ATOM 0 HG21 VAL A 58 63.127 2.762 10.778 1.00 0.00 H new ATOM 0 HG22 VAL A 58 63.378 1.016 11.010 1.00 0.00 H new ATOM 0 HG23 VAL A 58 64.196 2.182 12.077 1.00 0.00 H new ATOM 880 N GLN A 59 68.271 1.776 9.957 1.00 0.00 N ATOM 881 CA GLN A 59 69.486 1.891 9.105 1.00 0.00 C ATOM 882 C GLN A 59 70.070 0.499 8.913 1.00 0.00 C ATOM 883 O GLN A 59 70.572 0.157 7.860 1.00 0.00 O ATOM 884 CB GLN A 59 70.517 2.775 9.805 1.00 0.00 C ATOM 885 CG GLN A 59 69.923 4.163 10.052 1.00 0.00 C ATOM 886 CD GLN A 59 70.376 5.115 8.943 1.00 0.00 C ATOM 887 OE1 GLN A 59 71.434 5.708 9.030 1.00 0.00 O ATOM 888 NE2 GLN A 59 69.616 5.288 7.896 1.00 0.00 N ATOM 0 H GLN A 59 68.308 2.292 10.836 1.00 0.00 H new ATOM 0 HA GLN A 59 69.228 2.331 8.142 1.00 0.00 H new ATOM 0 HB2 GLN A 59 70.816 2.323 10.751 1.00 0.00 H new ATOM 0 HB3 GLN A 59 71.415 2.857 9.193 1.00 0.00 H new ATOM 0 HG2 GLN A 59 68.835 4.106 10.075 1.00 0.00 H new ATOM 0 HG3 GLN A 59 70.243 4.540 11.023 1.00 0.00 H new ATOM 0 HE21 GLN A 59 68.728 4.791 7.822 1.00 0.00 H new ATOM 0 HE22 GLN A 59 69.910 5.920 7.151 1.00 0.00 H new ATOM 897 N LYS A 60 69.998 -0.307 9.931 1.00 0.00 N ATOM 898 CA LYS A 60 70.533 -1.686 9.826 1.00 0.00 C ATOM 899 C LYS A 60 69.622 -2.488 8.904 1.00 0.00 C ATOM 900 O LYS A 60 70.079 -3.230 8.059 1.00 0.00 O ATOM 901 CB LYS A 60 70.564 -2.330 11.215 1.00 0.00 C ATOM 902 CG LYS A 60 70.826 -3.835 11.086 1.00 0.00 C ATOM 903 CD LYS A 60 72.213 -4.163 11.641 1.00 0.00 C ATOM 904 CE LYS A 60 72.616 -5.573 11.203 1.00 0.00 C ATOM 905 NZ LYS A 60 73.907 -5.514 10.463 1.00 0.00 N ATOM 0 H LYS A 60 69.590 -0.068 10.835 1.00 0.00 H new ATOM 0 HA LYS A 60 71.546 -1.668 9.423 1.00 0.00 H new ATOM 0 HB2 LYS A 60 71.342 -1.867 11.823 1.00 0.00 H new ATOM 0 HB3 LYS A 60 69.616 -2.159 11.726 1.00 0.00 H new ATOM 0 HG2 LYS A 60 70.064 -4.395 11.629 1.00 0.00 H new ATOM 0 HG3 LYS A 60 70.760 -4.138 10.041 1.00 0.00 H new ATOM 0 HD2 LYS A 60 72.942 -3.436 11.281 1.00 0.00 H new ATOM 0 HD3 LYS A 60 72.206 -4.096 12.729 1.00 0.00 H new ATOM 0 HE2 LYS A 60 72.713 -6.222 12.074 1.00 0.00 H new ATOM 0 HE3 LYS A 60 71.841 -6.004 10.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 74.181 -6.472 10.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 73.799 -4.909 9.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 74.644 -5.120 11.082 1.00 0.00 H new ATOM 919 N TYR A 61 68.332 -2.363 9.068 1.00 0.00 N ATOM 920 CA TYR A 61 67.410 -3.149 8.196 1.00 0.00 C ATOM 921 C TYR A 61 67.502 -2.608 6.770 1.00 0.00 C ATOM 922 O TYR A 61 67.121 -3.258 5.817 1.00 0.00 O ATOM 923 CB TYR A 61 65.965 -3.043 8.695 1.00 0.00 C ATOM 924 CG TYR A 61 65.896 -3.162 10.188 1.00 0.00 C ATOM 925 CD1 TYR A 61 67.013 -3.524 10.948 1.00 0.00 C ATOM 926 CD2 TYR A 61 64.695 -2.875 10.817 1.00 0.00 C ATOM 927 CE1 TYR A 61 66.919 -3.593 12.329 1.00 0.00 C ATOM 928 CE2 TYR A 61 64.599 -2.954 12.194 1.00 0.00 C ATOM 929 CZ TYR A 61 65.710 -3.309 12.961 1.00 0.00 C ATOM 930 OH TYR A 61 65.613 -3.376 14.334 1.00 0.00 O ATOM 0 H TYR A 61 67.881 -1.761 9.757 1.00 0.00 H new ATOM 0 HA TYR A 61 67.703 -4.199 8.222 1.00 0.00 H new ATOM 0 HB2 TYR A 61 65.539 -2.089 8.384 1.00 0.00 H new ATOM 0 HB3 TYR A 61 65.361 -3.826 8.237 1.00 0.00 H new ATOM 0 HD1 TYR A 61 67.949 -3.750 10.459 1.00 0.00 H new ATOM 0 HD2 TYR A 61 63.834 -2.590 10.231 1.00 0.00 H new ATOM 0 HE1 TYR A 61 67.783 -3.867 12.916 1.00 0.00 H new ATOM 0 HE2 TYR A 61 63.658 -2.740 12.679 1.00 0.00 H new ATOM 0 HH TYR A 61 64.705 -3.132 14.610 1.00 0.00 H new ATOM 940 N VAL A 62 68.022 -1.423 6.623 1.00 0.00 N ATOM 941 CA VAL A 62 68.167 -0.823 5.272 1.00 0.00 C ATOM 942 C VAL A 62 69.274 -1.557 4.523 1.00 0.00 C ATOM 943 O VAL A 62 69.342 -1.519 3.312 1.00 0.00 O ATOM 944 CB VAL A 62 68.530 0.656 5.407 1.00 0.00 C ATOM 945 CG1 VAL A 62 68.848 1.233 4.026 1.00 0.00 C ATOM 946 CG2 VAL A 62 67.349 1.415 6.018 1.00 0.00 C ATOM 0 H VAL A 62 68.356 -0.840 7.390 1.00 0.00 H new ATOM 0 HA VAL A 62 67.229 -0.912 4.723 1.00 0.00 H new ATOM 0 HB VAL A 62 69.403 0.759 6.052 1.00 0.00 H new ATOM 0 HG11 VAL A 62 69.107 2.287 4.123 1.00 0.00 H new ATOM 0 HG12 VAL A 62 69.688 0.692 3.590 1.00 0.00 H new ATOM 0 HG13 VAL A 62 67.976 1.131 3.380 1.00 0.00 H new ATOM 0 HG21 VAL A 62 67.606 2.470 6.115 1.00 0.00 H new ATOM 0 HG22 VAL A 62 66.477 1.312 5.372 1.00 0.00 H new ATOM 0 HG23 VAL A 62 67.123 1.004 7.002 1.00 0.00 H new ATOM 956 N SER A 63 70.136 -2.239 5.239 1.00 0.00 N ATOM 957 CA SER A 63 71.232 -2.996 4.566 1.00 0.00 C ATOM 958 C SER A 63 70.633 -3.699 3.353 1.00 0.00 C ATOM 959 O SER A 63 71.073 -3.527 2.234 1.00 0.00 O ATOM 960 CB SER A 63 71.813 -4.031 5.530 1.00 0.00 C ATOM 961 OG SER A 63 72.544 -5.001 4.792 1.00 0.00 O ATOM 0 H SER A 63 70.126 -2.302 6.257 1.00 0.00 H new ATOM 0 HA SER A 63 72.032 -2.321 4.260 1.00 0.00 H new ATOM 0 HB2 SER A 63 72.463 -3.544 6.256 1.00 0.00 H new ATOM 0 HB3 SER A 63 71.012 -4.512 6.092 1.00 0.00 H new ATOM 0 HG SER A 63 72.919 -5.665 5.407 1.00 0.00 H new ATOM 967 N ASP A 64 69.592 -4.451 3.570 1.00 0.00 N ATOM 968 CA ASP A 64 68.910 -5.127 2.442 1.00 0.00 C ATOM 969 C ASP A 64 67.785 -4.203 1.987 1.00 0.00 C ATOM 970 O ASP A 64 66.642 -4.362 2.369 1.00 0.00 O ATOM 971 CB ASP A 64 68.326 -6.457 2.911 1.00 0.00 C ATOM 972 CG ASP A 64 69.457 -7.464 3.129 1.00 0.00 C ATOM 973 OD1 ASP A 64 70.589 -7.031 3.269 1.00 0.00 O ATOM 974 OD2 ASP A 64 69.173 -8.649 3.149 1.00 0.00 O ATOM 0 H ASP A 64 69.184 -4.625 4.488 1.00 0.00 H new ATOM 0 HA ASP A 64 69.607 -5.329 1.628 1.00 0.00 H new ATOM 0 HB2 ASP A 64 67.768 -6.315 3.837 1.00 0.00 H new ATOM 0 HB3 ASP A 64 67.623 -6.839 2.171 1.00 0.00 H new ATOM 979 N LEU A 65 68.114 -3.208 1.212 1.00 0.00 N ATOM 980 CA LEU A 65 67.089 -2.231 0.763 1.00 0.00 C ATOM 981 C LEU A 65 65.871 -2.942 0.181 1.00 0.00 C ATOM 982 O LEU A 65 65.733 -4.147 0.264 1.00 0.00 O ATOM 983 CB LEU A 65 67.700 -1.312 -0.283 1.00 0.00 C ATOM 984 CG LEU A 65 68.879 -0.576 0.344 1.00 0.00 C ATOM 985 CD1 LEU A 65 70.069 -0.602 -0.613 1.00 0.00 C ATOM 986 CD2 LEU A 65 68.474 0.868 0.632 1.00 0.00 C ATOM 0 H LEU A 65 69.058 -3.030 0.869 1.00 0.00 H new ATOM 0 HA LEU A 65 66.760 -1.649 1.623 1.00 0.00 H new ATOM 0 HB2 LEU A 65 68.030 -1.889 -1.147 1.00 0.00 H new ATOM 0 HB3 LEU A 65 66.957 -0.600 -0.641 1.00 0.00 H new ATOM 0 HG LEU A 65 69.163 -1.065 1.276 1.00 0.00 H new ATOM 0 HD11 LEU A 65 70.910 -0.075 -0.162 1.00 0.00 H new ATOM 0 HD12 LEU A 65 70.353 -1.635 -0.813 1.00 0.00 H new ATOM 0 HD13 LEU A 65 69.795 -0.114 -1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 65 69.314 1.399 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 65 68.190 1.359 -0.299 1.00 0.00 H new ATOM 0 HD23 LEU A 65 67.629 0.878 1.320 1.00 0.00 H new ATOM 998 N GLU A 66 64.978 -2.197 -0.406 1.00 0.00 N ATOM 999 CA GLU A 66 63.760 -2.810 -0.988 1.00 0.00 C ATOM 1000 C GLU A 66 64.158 -3.858 -2.023 1.00 0.00 C ATOM 1001 O GLU A 66 65.308 -4.239 -2.130 1.00 0.00 O ATOM 1002 CB GLU A 66 62.913 -1.720 -1.650 1.00 0.00 C ATOM 1003 CG GLU A 66 62.548 -0.654 -0.610 1.00 0.00 C ATOM 1004 CD GLU A 66 62.400 0.706 -1.299 1.00 0.00 C ATOM 1005 OE1 GLU A 66 63.218 1.009 -2.150 1.00 0.00 O ATOM 1006 OE2 GLU A 66 61.471 1.420 -0.960 1.00 0.00 O ATOM 0 H GLU A 66 65.043 -1.184 -0.507 1.00 0.00 H new ATOM 0 HA GLU A 66 63.180 -3.291 -0.200 1.00 0.00 H new ATOM 0 HB2 GLU A 66 63.464 -1.266 -2.474 1.00 0.00 H new ATOM 0 HB3 GLU A 66 62.008 -2.155 -2.074 1.00 0.00 H new ATOM 0 HG2 GLU A 66 61.618 -0.923 -0.110 1.00 0.00 H new ATOM 0 HG3 GLU A 66 63.319 -0.602 0.158 1.00 0.00 H new ATOM 1013 N LEU A 67 63.210 -4.328 -2.779 1.00 0.00 N ATOM 1014 CA LEU A 67 63.506 -5.360 -3.816 1.00 0.00 C ATOM 1015 C LEU A 67 64.830 -5.033 -4.512 1.00 0.00 C ATOM 1016 O LEU A 67 65.715 -5.861 -4.603 1.00 0.00 O ATOM 1017 CB LEU A 67 62.378 -5.381 -4.851 1.00 0.00 C ATOM 1018 CG LEU A 67 62.308 -6.760 -5.508 1.00 0.00 C ATOM 1019 CD1 LEU A 67 60.846 -7.124 -5.770 1.00 0.00 C ATOM 1020 CD2 LEU A 67 63.070 -6.733 -6.834 1.00 0.00 C ATOM 0 H LEU A 67 62.233 -4.041 -2.725 1.00 0.00 H new ATOM 0 HA LEU A 67 63.583 -6.337 -3.338 1.00 0.00 H new ATOM 0 HB2 LEU A 67 61.427 -5.147 -4.372 1.00 0.00 H new ATOM 0 HB3 LEU A 67 62.551 -4.615 -5.607 1.00 0.00 H new ATOM 0 HG LEU A 67 62.756 -7.501 -4.846 1.00 0.00 H new ATOM 0 HD11 LEU A 67 60.794 -8.107 -6.238 1.00 0.00 H new ATOM 0 HD12 LEU A 67 60.301 -7.143 -4.826 1.00 0.00 H new ATOM 0 HD13 LEU A 67 60.399 -6.382 -6.432 1.00 0.00 H new ATOM 0 HD21 LEU A 67 63.020 -7.716 -7.302 1.00 0.00 H new ATOM 0 HD22 LEU A 67 62.622 -5.992 -7.496 1.00 0.00 H new ATOM 0 HD23 LEU A 67 64.112 -6.471 -6.650 1.00 0.00 H new ATOM 1032 N SER A 68 64.975 -3.833 -5.003 1.00 0.00 N ATOM 1033 CA SER A 68 66.244 -3.462 -5.691 1.00 0.00 C ATOM 1034 C SER A 68 66.414 -1.941 -5.669 1.00 0.00 C ATOM 1035 O SER A 68 65.456 -1.200 -5.561 1.00 0.00 O ATOM 1036 CB SER A 68 66.202 -3.950 -7.139 1.00 0.00 C ATOM 1037 OG SER A 68 66.676 -5.289 -7.197 1.00 0.00 O ATOM 0 H SER A 68 64.272 -3.095 -4.958 1.00 0.00 H new ATOM 0 HA SER A 68 67.084 -3.928 -5.175 1.00 0.00 H new ATOM 0 HB2 SER A 68 65.184 -3.895 -7.524 1.00 0.00 H new ATOM 0 HB3 SER A 68 66.816 -3.307 -7.770 1.00 0.00 H new ATOM 0 HG SER A 68 66.488 -5.740 -6.347 1.00 0.00 H new ATOM 1043 N ALA A 69 67.627 -1.471 -5.769 1.00 0.00 N ATOM 1044 CA ALA A 69 67.862 0.000 -5.755 1.00 0.00 C ATOM 1045 C ALA A 69 69.070 0.332 -6.634 1.00 0.00 C ATOM 1046 O ALA A 69 69.653 1.385 -6.433 1.00 0.00 O ATOM 1047 CB ALA A 69 68.135 0.457 -4.320 1.00 0.00 C ATOM 1048 OXT ALA A 69 69.393 -0.474 -7.491 1.00 0.00 O ATOM 0 H ALA A 69 68.466 -2.043 -5.860 1.00 0.00 H new ATOM 0 HA ALA A 69 66.981 0.513 -6.140 1.00 0.00 H new ATOM 0 HB1 ALA A 69 68.307 1.533 -4.307 1.00 0.00 H new ATOM 0 HB2 ALA A 69 67.276 0.220 -3.693 1.00 0.00 H new ATOM 0 HB3 ALA A 69 69.017 -0.056 -3.936 1.00 0.00 H new TER 1054 ALA A 69 ATOM 1055 N SER B 1 39.259 -2.583 3.511 1.00 0.00 N ATOM 1056 CA SER B 1 39.335 -1.563 4.595 1.00 0.00 C ATOM 1057 C SER B 1 40.448 -0.563 4.277 1.00 0.00 C ATOM 1058 O SER B 1 40.207 0.505 3.753 1.00 0.00 O ATOM 1059 CB SER B 1 39.635 -2.254 5.925 1.00 0.00 C ATOM 1060 OG SER B 1 38.467 -2.925 6.379 1.00 0.00 O ATOM 0 H1 SER B 1 38.502 -3.263 3.727 1.00 0.00 H new ATOM 0 H2 SER B 1 39.055 -2.113 2.606 1.00 0.00 H new ATOM 0 H3 SER B 1 40.167 -3.085 3.443 1.00 0.00 H new ATOM 0 HA SER B 1 38.383 -1.037 4.666 1.00 0.00 H new ATOM 0 HB2 SER B 1 40.452 -2.965 5.803 1.00 0.00 H new ATOM 0 HB3 SER B 1 39.958 -1.521 6.664 1.00 0.00 H new ATOM 0 HG SER B 1 38.656 -3.371 7.231 1.00 0.00 H new ATOM 1068 N LEU B 2 41.666 -0.902 4.595 1.00 0.00 N ATOM 1069 CA LEU B 2 42.796 0.028 4.317 1.00 0.00 C ATOM 1070 C LEU B 2 42.636 1.285 5.173 1.00 0.00 C ATOM 1071 O LEU B 2 42.405 2.367 4.671 1.00 0.00 O ATOM 1072 CB LEU B 2 42.788 0.413 2.834 1.00 0.00 C ATOM 1073 CG LEU B 2 42.553 -0.835 1.980 1.00 0.00 C ATOM 1074 CD1 LEU B 2 41.925 -0.428 0.644 1.00 0.00 C ATOM 1075 CD2 LEU B 2 43.891 -1.533 1.722 1.00 0.00 C ATOM 0 H LEU B 2 41.928 -1.784 5.036 1.00 0.00 H new ATOM 0 HA LEU B 2 43.740 -0.460 4.558 1.00 0.00 H new ATOM 0 HB2 LEU B 2 42.007 1.149 2.643 1.00 0.00 H new ATOM 0 HB3 LEU B 2 43.736 0.878 2.564 1.00 0.00 H new ATOM 0 HG LEU B 2 41.882 -1.515 2.505 1.00 0.00 H new ATOM 0 HD11 LEU B 2 41.757 -1.316 0.035 1.00 0.00 H new ATOM 0 HD12 LEU B 2 40.974 0.072 0.826 1.00 0.00 H new ATOM 0 HD13 LEU B 2 42.596 0.251 0.118 1.00 0.00 H new ATOM 0 HD21 LEU B 2 43.726 -2.422 1.114 1.00 0.00 H new ATOM 0 HD22 LEU B 2 44.561 -0.853 1.196 1.00 0.00 H new ATOM 0 HD23 LEU B 2 44.340 -1.822 2.672 1.00 0.00 H new ATOM 1087 N ALA B 3 42.753 1.149 6.466 1.00 0.00 N ATOM 1088 CA ALA B 3 42.603 2.334 7.356 1.00 0.00 C ATOM 1089 C ALA B 3 43.885 2.535 8.166 1.00 0.00 C ATOM 1090 O ALA B 3 44.776 3.260 7.768 1.00 0.00 O ATOM 1091 CB ALA B 3 41.430 2.105 8.312 1.00 0.00 C ATOM 0 H ALA B 3 42.946 0.269 6.944 1.00 0.00 H new ATOM 0 HA ALA B 3 42.415 3.220 6.750 1.00 0.00 H new ATOM 0 HB1 ALA B 3 41.318 2.971 8.965 1.00 0.00 H new ATOM 0 HB2 ALA B 3 40.515 1.963 7.737 1.00 0.00 H new ATOM 0 HB3 ALA B 3 41.621 1.218 8.916 1.00 0.00 H new ATOM 1097 N ALA B 4 43.983 1.903 9.305 1.00 0.00 N ATOM 1098 CA ALA B 4 45.204 2.061 10.145 1.00 0.00 C ATOM 1099 C ALA B 4 46.382 1.339 9.487 1.00 0.00 C ATOM 1100 O ALA B 4 46.229 0.285 8.901 1.00 0.00 O ATOM 1101 CB ALA B 4 44.949 1.463 11.530 1.00 0.00 C ATOM 0 H ALA B 4 43.269 1.284 9.690 1.00 0.00 H new ATOM 0 HA ALA B 4 45.440 3.121 10.242 1.00 0.00 H new ATOM 0 HB1 ALA B 4 45.841 1.578 12.146 1.00 0.00 H new ATOM 0 HB2 ALA B 4 44.114 1.981 12.002 1.00 0.00 H new ATOM 0 HB3 ALA B 4 44.710 0.404 11.431 1.00 0.00 H new ATOM 1107 N ASP B 5 47.557 1.899 9.582 1.00 0.00 N ATOM 1108 CA ASP B 5 48.749 1.248 8.967 1.00 0.00 C ATOM 1109 C ASP B 5 48.515 1.057 7.469 1.00 0.00 C ATOM 1110 O ASP B 5 47.535 1.519 6.921 1.00 0.00 O ATOM 1111 CB ASP B 5 48.982 -0.114 9.624 1.00 0.00 C ATOM 1112 CG ASP B 5 49.086 0.064 11.140 1.00 0.00 C ATOM 1113 OD1 ASP B 5 49.065 1.199 11.586 1.00 0.00 O ATOM 1114 OD2 ASP B 5 49.184 -0.938 11.829 1.00 0.00 O ATOM 0 H ASP B 5 47.743 2.781 10.060 1.00 0.00 H new ATOM 0 HA ASP B 5 49.624 1.880 9.118 1.00 0.00 H new ATOM 0 HB2 ASP B 5 48.163 -0.792 9.382 1.00 0.00 H new ATOM 0 HB3 ASP B 5 49.895 -0.566 9.236 1.00 0.00 H new ATOM 1119 N THR B 6 49.412 0.377 6.806 1.00 0.00 N ATOM 1120 CA THR B 6 49.257 0.144 5.341 1.00 0.00 C ATOM 1121 C THR B 6 49.718 1.392 4.573 1.00 0.00 C ATOM 1122 O THR B 6 49.581 2.500 5.054 1.00 0.00 O ATOM 1123 CB THR B 6 47.784 -0.196 5.026 1.00 0.00 C ATOM 1124 OG1 THR B 6 47.742 -1.249 4.074 1.00 0.00 O ATOM 1125 CG2 THR B 6 47.036 1.021 4.464 1.00 0.00 C ATOM 0 H THR B 6 50.251 -0.030 7.220 1.00 0.00 H new ATOM 0 HA THR B 6 49.875 -0.697 5.028 1.00 0.00 H new ATOM 0 HB THR B 6 47.297 -0.498 5.953 1.00 0.00 H new ATOM 0 HG1 THR B 6 46.809 -1.470 3.872 1.00 0.00 H new ATOM 0 HG21 THR B 6 46.002 0.747 4.253 1.00 0.00 H new ATOM 0 HG22 THR B 6 47.055 1.829 5.195 1.00 0.00 H new ATOM 0 HG23 THR B 6 47.519 1.352 3.544 1.00 0.00 H new ATOM 1133 N PRO B 7 50.252 1.167 3.400 1.00 0.00 N ATOM 1134 CA PRO B 7 50.747 2.249 2.533 1.00 0.00 C ATOM 1135 C PRO B 7 49.580 2.938 1.822 1.00 0.00 C ATOM 1136 O PRO B 7 48.768 2.303 1.180 1.00 0.00 O ATOM 1137 CB PRO B 7 51.645 1.522 1.530 1.00 0.00 C ATOM 1138 CG PRO B 7 51.177 0.047 1.515 1.00 0.00 C ATOM 1139 CD PRO B 7 50.410 -0.186 2.831 1.00 0.00 C ATOM 0 HA PRO B 7 51.274 3.031 3.080 1.00 0.00 H new ATOM 0 HB2 PRO B 7 51.560 1.967 0.539 1.00 0.00 H new ATOM 0 HB3 PRO B 7 52.692 1.594 1.823 1.00 0.00 H new ATOM 0 HG2 PRO B 7 50.537 -0.148 0.654 1.00 0.00 H new ATOM 0 HG3 PRO B 7 52.029 -0.629 1.438 1.00 0.00 H new ATOM 0 HD2 PRO B 7 49.444 -0.658 2.651 1.00 0.00 H new ATOM 0 HD3 PRO B 7 50.964 -0.840 3.505 1.00 0.00 H new ATOM 1147 N THR B 8 49.492 4.235 1.931 1.00 0.00 N ATOM 1148 CA THR B 8 48.377 4.963 1.262 1.00 0.00 C ATOM 1149 C THR B 8 48.678 5.095 -0.232 1.00 0.00 C ATOM 1150 O THR B 8 49.640 5.725 -0.627 1.00 0.00 O ATOM 1151 CB THR B 8 48.237 6.357 1.877 1.00 0.00 C ATOM 1152 OG1 THR B 8 48.059 6.239 3.281 1.00 0.00 O ATOM 1153 CG2 THR B 8 47.029 7.069 1.264 1.00 0.00 C ATOM 0 H THR B 8 50.143 4.821 2.453 1.00 0.00 H new ATOM 0 HA THR B 8 47.448 4.409 1.399 1.00 0.00 H new ATOM 0 HB THR B 8 49.138 6.936 1.673 1.00 0.00 H new ATOM 0 HG1 THR B 8 48.171 7.118 3.700 1.00 0.00 H new ATOM 0 HG21 THR B 8 46.930 8.062 1.703 1.00 0.00 H new ATOM 0 HG22 THR B 8 47.169 7.161 0.187 1.00 0.00 H new ATOM 0 HG23 THR B 8 46.126 6.492 1.465 1.00 0.00 H new ATOM 1161 N ALA B 9 47.863 4.512 -1.067 1.00 0.00 N ATOM 1162 CA ALA B 9 48.105 4.611 -2.534 1.00 0.00 C ATOM 1163 C ALA B 9 47.888 6.058 -2.982 1.00 0.00 C ATOM 1164 O ALA B 9 47.316 6.858 -2.268 1.00 0.00 O ATOM 1165 CB ALA B 9 47.131 3.693 -3.276 1.00 0.00 C ATOM 0 H ALA B 9 47.041 3.972 -0.797 1.00 0.00 H new ATOM 0 HA ALA B 9 49.127 4.307 -2.759 1.00 0.00 H new ATOM 0 HB1 ALA B 9 47.308 3.766 -4.349 1.00 0.00 H new ATOM 0 HB2 ALA B 9 47.283 2.663 -2.952 1.00 0.00 H new ATOM 0 HB3 ALA B 9 46.107 3.995 -3.056 1.00 0.00 H new ATOM 1171 N CYS B 10 48.343 6.404 -4.156 1.00 0.00 N ATOM 1172 CA CYS B 10 48.164 7.803 -4.641 1.00 0.00 C ATOM 1173 C CYS B 10 48.134 7.819 -6.172 1.00 0.00 C ATOM 1174 O CYS B 10 49.129 7.567 -6.821 1.00 0.00 O ATOM 1175 CB CYS B 10 49.334 8.664 -4.154 1.00 0.00 C ATOM 1176 SG CYS B 10 49.444 8.581 -2.349 1.00 0.00 S ATOM 0 H CYS B 10 48.830 5.780 -4.799 1.00 0.00 H new ATOM 0 HA CYS B 10 47.226 8.200 -4.254 1.00 0.00 H new ATOM 0 HB2 CYS B 10 50.265 8.316 -4.601 1.00 0.00 H new ATOM 0 HB3 CYS B 10 49.195 9.697 -4.472 1.00 0.00 H new ATOM 1181 N CYS B 11 47.005 8.122 -6.755 1.00 0.00 N ATOM 1182 CA CYS B 11 46.930 8.162 -8.243 1.00 0.00 C ATOM 1183 C CYS B 11 47.575 9.457 -8.738 1.00 0.00 C ATOM 1184 O CYS B 11 46.940 10.491 -8.807 1.00 0.00 O ATOM 1185 CB CYS B 11 45.467 8.119 -8.692 1.00 0.00 C ATOM 1186 SG CYS B 11 44.986 6.409 -9.051 1.00 0.00 S ATOM 0 H CYS B 11 46.136 8.342 -6.268 1.00 0.00 H new ATOM 0 HA CYS B 11 47.455 7.301 -8.657 1.00 0.00 H new ATOM 0 HB2 CYS B 11 44.826 8.531 -7.913 1.00 0.00 H new ATOM 0 HB3 CYS B 11 45.331 8.739 -9.578 1.00 0.00 H new ATOM 1191 N PHE B 12 48.835 9.414 -9.074 1.00 0.00 N ATOM 1192 CA PHE B 12 49.517 10.649 -9.552 1.00 0.00 C ATOM 1193 C PHE B 12 49.644 10.620 -11.077 1.00 0.00 C ATOM 1194 O PHE B 12 50.194 11.523 -11.676 1.00 0.00 O ATOM 1195 CB PHE B 12 50.912 10.730 -8.928 1.00 0.00 C ATOM 1196 CG PHE B 12 50.795 11.139 -7.479 1.00 0.00 C ATOM 1197 CD1 PHE B 12 49.929 12.175 -7.112 1.00 0.00 C ATOM 1198 CD2 PHE B 12 51.554 10.481 -6.504 1.00 0.00 C ATOM 1199 CE1 PHE B 12 49.822 12.554 -5.768 1.00 0.00 C ATOM 1200 CE2 PHE B 12 51.447 10.860 -5.161 1.00 0.00 C ATOM 1201 CZ PHE B 12 50.581 11.896 -4.793 1.00 0.00 C ATOM 0 H PHE B 12 49.420 8.579 -9.038 1.00 0.00 H new ATOM 0 HA PHE B 12 48.930 11.519 -9.259 1.00 0.00 H new ATOM 0 HB2 PHE B 12 51.412 9.765 -9.005 1.00 0.00 H new ATOM 0 HB3 PHE B 12 51.523 11.450 -9.472 1.00 0.00 H new ATOM 0 HD1 PHE B 12 49.343 12.682 -7.865 1.00 0.00 H new ATOM 0 HD2 PHE B 12 52.222 9.681 -6.788 1.00 0.00 H new ATOM 0 HE1 PHE B 12 49.154 13.354 -5.484 1.00 0.00 H new ATOM 0 HE2 PHE B 12 52.033 10.353 -4.409 1.00 0.00 H new ATOM 0 HZ PHE B 12 50.498 12.188 -3.756 1.00 0.00 H new ATOM 1211 N SER B 13 49.144 9.595 -11.715 1.00 0.00 N ATOM 1212 CA SER B 13 49.250 9.534 -13.200 1.00 0.00 C ATOM 1213 C SER B 13 48.232 8.536 -13.758 1.00 0.00 C ATOM 1214 O SER B 13 48.358 7.341 -13.580 1.00 0.00 O ATOM 1215 CB SER B 13 50.660 9.090 -13.595 1.00 0.00 C ATOM 1216 OG SER B 13 51.245 8.369 -12.517 1.00 0.00 O ATOM 0 H SER B 13 48.671 8.805 -11.276 1.00 0.00 H new ATOM 0 HA SER B 13 49.047 10.523 -13.610 1.00 0.00 H new ATOM 0 HB2 SER B 13 50.620 8.465 -14.487 1.00 0.00 H new ATOM 0 HB3 SER B 13 51.271 9.958 -13.841 1.00 0.00 H new ATOM 0 HG SER B 13 52.148 8.082 -12.767 1.00 0.00 H new ATOM 1222 N TYR B 14 47.233 9.019 -14.446 1.00 0.00 N ATOM 1223 CA TYR B 14 46.215 8.099 -15.032 1.00 0.00 C ATOM 1224 C TYR B 14 46.495 7.968 -16.529 1.00 0.00 C ATOM 1225 O TYR B 14 47.311 8.682 -17.077 1.00 0.00 O ATOM 1226 CB TYR B 14 44.795 8.650 -14.808 1.00 0.00 C ATOM 1227 CG TYR B 14 44.823 9.775 -13.797 1.00 0.00 C ATOM 1228 CD1 TYR B 14 45.348 9.551 -12.517 1.00 0.00 C ATOM 1229 CD2 TYR B 14 44.330 11.040 -14.139 1.00 0.00 C ATOM 1230 CE1 TYR B 14 45.377 10.592 -11.581 1.00 0.00 C ATOM 1231 CE2 TYR B 14 44.360 12.080 -13.202 1.00 0.00 C ATOM 1232 CZ TYR B 14 44.884 11.856 -11.923 1.00 0.00 C ATOM 1233 OH TYR B 14 44.914 12.882 -11.000 1.00 0.00 O ATOM 0 H TYR B 14 47.077 10.011 -14.628 1.00 0.00 H new ATOM 0 HA TYR B 14 46.277 7.124 -14.548 1.00 0.00 H new ATOM 0 HB2 TYR B 14 44.384 9.010 -15.751 1.00 0.00 H new ATOM 0 HB3 TYR B 14 44.139 7.853 -14.458 1.00 0.00 H new ATOM 0 HD1 TYR B 14 45.730 8.576 -12.253 1.00 0.00 H new ATOM 0 HD2 TYR B 14 43.927 11.214 -15.126 1.00 0.00 H new ATOM 0 HE1 TYR B 14 45.780 10.419 -10.594 1.00 0.00 H new ATOM 0 HE2 TYR B 14 43.979 13.055 -13.466 1.00 0.00 H new ATOM 0 HH TYR B 14 44.534 13.692 -11.399 1.00 0.00 H new ATOM 1243 N THR B 15 45.845 7.059 -17.199 1.00 0.00 N ATOM 1244 CA THR B 15 46.104 6.894 -18.656 1.00 0.00 C ATOM 1245 C THR B 15 45.025 7.616 -19.464 1.00 0.00 C ATOM 1246 O THR B 15 43.858 7.290 -19.387 1.00 0.00 O ATOM 1247 CB THR B 15 46.089 5.406 -19.011 1.00 0.00 C ATOM 1248 OG1 THR B 15 46.026 5.259 -20.422 1.00 0.00 O ATOM 1249 CG2 THR B 15 44.870 4.740 -18.373 1.00 0.00 C ATOM 0 H THR B 15 45.149 6.426 -16.804 1.00 0.00 H new ATOM 0 HA THR B 15 47.078 7.321 -18.895 1.00 0.00 H new ATOM 0 HB THR B 15 46.997 4.933 -18.636 1.00 0.00 H new ATOM 0 HG1 THR B 15 45.096 5.117 -20.695 1.00 0.00 H new ATOM 0 HG21 THR B 15 44.860 3.680 -18.627 1.00 0.00 H new ATOM 0 HG22 THR B 15 44.918 4.854 -17.290 1.00 0.00 H new ATOM 0 HG23 THR B 15 43.961 5.211 -18.747 1.00 0.00 H new ATOM 1257 N SER B 16 45.409 8.591 -20.246 1.00 0.00 N ATOM 1258 CA SER B 16 44.403 9.322 -21.067 1.00 0.00 C ATOM 1259 C SER B 16 43.466 8.301 -21.712 1.00 0.00 C ATOM 1260 O SER B 16 42.262 8.465 -21.722 1.00 0.00 O ATOM 1261 CB SER B 16 45.115 10.127 -22.155 1.00 0.00 C ATOM 1262 OG SER B 16 44.822 11.509 -21.985 1.00 0.00 O ATOM 0 H SER B 16 46.372 8.911 -20.350 1.00 0.00 H new ATOM 0 HA SER B 16 43.833 10.005 -20.438 1.00 0.00 H new ATOM 0 HB2 SER B 16 46.191 9.962 -22.100 1.00 0.00 H new ATOM 0 HB3 SER B 16 44.791 9.793 -23.141 1.00 0.00 H new ATOM 0 HG SER B 16 45.278 12.028 -22.680 1.00 0.00 H new ATOM 1268 N ARG B 17 44.012 7.237 -22.237 1.00 0.00 N ATOM 1269 CA ARG B 17 43.158 6.191 -22.864 1.00 0.00 C ATOM 1270 C ARG B 17 42.741 5.186 -21.789 1.00 0.00 C ATOM 1271 O ARG B 17 43.398 5.040 -20.778 1.00 0.00 O ATOM 1272 CB ARG B 17 43.946 5.472 -23.961 1.00 0.00 C ATOM 1273 CG ARG B 17 43.033 5.221 -25.162 1.00 0.00 C ATOM 1274 CD ARG B 17 42.660 6.556 -25.809 1.00 0.00 C ATOM 1275 NE ARG B 17 42.294 6.331 -27.235 1.00 0.00 N ATOM 1276 CZ ARG B 17 41.509 7.175 -27.848 1.00 0.00 C ATOM 1277 NH1 ARG B 17 40.213 7.027 -27.781 1.00 0.00 N ATOM 1278 NH2 ARG B 17 42.019 8.165 -28.527 1.00 0.00 N ATOM 0 H ARG B 17 45.014 7.048 -22.258 1.00 0.00 H new ATOM 0 HA ARG B 17 42.274 6.651 -23.305 1.00 0.00 H new ATOM 0 HB2 ARG B 17 44.804 6.074 -24.262 1.00 0.00 H new ATOM 0 HB3 ARG B 17 44.337 4.527 -23.583 1.00 0.00 H new ATOM 0 HG2 ARG B 17 43.536 4.582 -25.887 1.00 0.00 H new ATOM 0 HG3 ARG B 17 42.133 4.695 -24.844 1.00 0.00 H new ATOM 0 HD2 ARG B 17 41.825 7.010 -25.275 1.00 0.00 H new ATOM 0 HD3 ARG B 17 43.497 7.251 -25.742 1.00 0.00 H new ATOM 0 HE ARG B 17 42.657 5.518 -27.733 1.00 0.00 H new ATOM 0 HH11 ARG B 17 39.815 6.252 -27.250 1.00 0.00 H new ATOM 0 HH12 ARG B 17 39.599 7.686 -28.260 1.00 0.00 H new ATOM 0 HH21 ARG B 17 43.031 8.280 -28.579 1.00 0.00 H new ATOM 0 HH22 ARG B 17 41.406 8.824 -29.006 1.00 0.00 H new ATOM 1292 N GLN B 18 41.650 4.504 -21.989 1.00 0.00 N ATOM 1293 CA GLN B 18 41.186 3.524 -20.973 1.00 0.00 C ATOM 1294 C GLN B 18 41.827 2.163 -21.178 1.00 0.00 C ATOM 1295 O GLN B 18 42.838 2.003 -21.833 1.00 0.00 O ATOM 1296 CB GLN B 18 39.684 3.357 -21.063 1.00 0.00 C ATOM 1297 CG GLN B 18 39.034 4.620 -21.635 1.00 0.00 C ATOM 1298 CD GLN B 18 38.741 4.417 -23.123 1.00 0.00 C ATOM 1299 OE1 GLN B 18 37.855 5.043 -23.671 1.00 0.00 O ATOM 1300 NE2 GLN B 18 39.453 3.561 -23.805 1.00 0.00 N ATOM 0 H GLN B 18 41.058 4.584 -22.816 1.00 0.00 H new ATOM 0 HA GLN B 18 41.473 3.911 -19.995 1.00 0.00 H new ATOM 0 HB2 GLN B 18 39.445 2.501 -21.694 1.00 0.00 H new ATOM 0 HB3 GLN B 18 39.276 3.148 -20.074 1.00 0.00 H new ATOM 0 HG2 GLN B 18 38.111 4.841 -21.099 1.00 0.00 H new ATOM 0 HG3 GLN B 18 39.695 5.476 -21.498 1.00 0.00 H new ATOM 0 HE21 GLN B 18 40.197 3.035 -23.345 1.00 0.00 H new ATOM 0 HE22 GLN B 18 39.266 3.418 -24.797 1.00 0.00 H new ATOM 1309 N ILE B 19 41.203 1.186 -20.607 1.00 0.00 N ATOM 1310 CA ILE B 19 41.653 -0.208 -20.695 1.00 0.00 C ATOM 1311 C ILE B 19 40.399 -1.050 -20.495 1.00 0.00 C ATOM 1312 O ILE B 19 39.814 -1.038 -19.435 1.00 0.00 O ATOM 1313 CB ILE B 19 42.661 -0.524 -19.587 1.00 0.00 C ATOM 1314 CG1 ILE B 19 42.587 0.531 -18.479 1.00 0.00 C ATOM 1315 CG2 ILE B 19 44.074 -0.542 -20.167 1.00 0.00 C ATOM 1316 CD1 ILE B 19 43.718 0.288 -17.477 1.00 0.00 C ATOM 0 H ILE B 19 40.355 1.310 -20.055 1.00 0.00 H new ATOM 0 HA ILE B 19 42.144 -0.407 -21.648 1.00 0.00 H new ATOM 0 HB ILE B 19 42.420 -1.500 -19.167 1.00 0.00 H new ATOM 0 HG12 ILE B 19 42.671 1.530 -18.906 1.00 0.00 H new ATOM 0 HG13 ILE B 19 41.622 0.480 -17.975 1.00 0.00 H new ATOM 0 HG21 ILE B 19 44.789 -0.767 -19.376 1.00 0.00 H new ATOM 0 HG22 ILE B 19 44.139 -1.305 -20.943 1.00 0.00 H new ATOM 0 HG23 ILE B 19 44.303 0.433 -20.597 1.00 0.00 H new ATOM 0 HD11 ILE B 19 43.670 1.036 -16.686 1.00 0.00 H new ATOM 0 HD12 ILE B 19 43.612 -0.706 -17.043 1.00 0.00 H new ATOM 0 HD13 ILE B 19 44.678 0.361 -17.988 1.00 0.00 H new ATOM 1328 N PRO B 20 40.004 -1.723 -21.525 1.00 0.00 N ATOM 1329 CA PRO B 20 38.789 -2.547 -21.500 1.00 0.00 C ATOM 1330 C PRO B 20 38.958 -3.734 -20.556 1.00 0.00 C ATOM 1331 O PRO B 20 40.055 -4.126 -20.222 1.00 0.00 O ATOM 1332 CB PRO B 20 38.610 -2.958 -22.963 1.00 0.00 C ATOM 1333 CG PRO B 20 39.991 -2.775 -23.632 1.00 0.00 C ATOM 1334 CD PRO B 20 40.745 -1.755 -22.793 1.00 0.00 C ATOM 0 HA PRO B 20 37.909 -2.027 -21.120 1.00 0.00 H new ATOM 0 HB2 PRO B 20 38.274 -3.992 -23.039 1.00 0.00 H new ATOM 0 HB3 PRO B 20 37.856 -2.341 -23.451 1.00 0.00 H new ATOM 0 HG2 PRO B 20 40.531 -3.721 -23.671 1.00 0.00 H new ATOM 0 HG3 PRO B 20 39.881 -2.428 -24.659 1.00 0.00 H new ATOM 0 HD2 PRO B 20 41.783 -2.051 -22.642 1.00 0.00 H new ATOM 0 HD3 PRO B 20 40.759 -0.776 -23.272 1.00 0.00 H new ATOM 1342 N GLN B 21 37.873 -4.285 -20.095 1.00 0.00 N ATOM 1343 CA GLN B 21 37.964 -5.424 -19.146 1.00 0.00 C ATOM 1344 C GLN B 21 38.858 -6.518 -19.737 1.00 0.00 C ATOM 1345 O GLN B 21 39.397 -7.341 -19.024 1.00 0.00 O ATOM 1346 CB GLN B 21 36.560 -5.985 -18.892 1.00 0.00 C ATOM 1347 CG GLN B 21 35.762 -4.993 -18.041 1.00 0.00 C ATOM 1348 CD GLN B 21 34.645 -5.736 -17.308 1.00 0.00 C ATOM 1349 OE1 GLN B 21 34.297 -5.390 -16.196 1.00 0.00 O ATOM 1350 NE2 GLN B 21 34.066 -6.753 -17.886 1.00 0.00 N ATOM 0 H GLN B 21 36.925 -3.995 -20.335 1.00 0.00 H new ATOM 0 HA GLN B 21 38.395 -5.081 -18.205 1.00 0.00 H new ATOM 0 HB2 GLN B 21 36.050 -6.161 -19.839 1.00 0.00 H new ATOM 0 HB3 GLN B 21 36.627 -6.946 -18.383 1.00 0.00 H new ATOM 0 HG2 GLN B 21 36.419 -4.502 -17.323 1.00 0.00 H new ATOM 0 HG3 GLN B 21 35.340 -4.212 -18.673 1.00 0.00 H new ATOM 0 HE21 GLN B 21 34.358 -7.043 -18.819 1.00 0.00 H new ATOM 0 HE22 GLN B 21 33.322 -7.257 -17.405 1.00 0.00 H new ATOM 1359 N ASN B 22 39.026 -6.530 -21.032 1.00 0.00 N ATOM 1360 CA ASN B 22 39.894 -7.569 -21.657 1.00 0.00 C ATOM 1361 C ASN B 22 41.352 -7.288 -21.289 1.00 0.00 C ATOM 1362 O ASN B 22 42.123 -8.188 -21.021 1.00 0.00 O ATOM 1363 CB ASN B 22 39.732 -7.526 -23.177 1.00 0.00 C ATOM 1364 CG ASN B 22 38.328 -8.002 -23.556 1.00 0.00 C ATOM 1365 OD1 ASN B 22 37.387 -7.233 -23.534 1.00 0.00 O ATOM 1366 ND2 ASN B 22 38.146 -9.246 -23.904 1.00 0.00 N ATOM 0 H ASN B 22 38.602 -5.868 -21.682 1.00 0.00 H new ATOM 0 HA ASN B 22 39.606 -8.556 -21.294 1.00 0.00 H new ATOM 0 HB2 ASN B 22 39.894 -6.512 -23.542 1.00 0.00 H new ATOM 0 HB3 ASN B 22 40.482 -8.159 -23.651 1.00 0.00 H new ATOM 0 HD21 ASN B 22 37.214 -9.573 -24.158 1.00 0.00 H new ATOM 0 HD22 ASN B 22 38.936 -9.891 -23.922 1.00 0.00 H new ATOM 1373 N PHE B 23 41.730 -6.041 -21.274 1.00 0.00 N ATOM 1374 CA PHE B 23 43.132 -5.680 -20.923 1.00 0.00 C ATOM 1375 C PHE B 23 43.259 -5.527 -19.404 1.00 0.00 C ATOM 1376 O PHE B 23 44.326 -5.263 -18.887 1.00 0.00 O ATOM 1377 CB PHE B 23 43.488 -4.349 -21.589 1.00 0.00 C ATOM 1378 CG PHE B 23 44.680 -4.531 -22.493 1.00 0.00 C ATOM 1379 CD1 PHE B 23 45.951 -4.739 -21.945 1.00 0.00 C ATOM 1380 CD2 PHE B 23 44.514 -4.488 -23.881 1.00 0.00 C ATOM 1381 CE1 PHE B 23 47.058 -4.903 -22.787 1.00 0.00 C ATOM 1382 CE2 PHE B 23 45.617 -4.652 -24.723 1.00 0.00 C ATOM 1383 CZ PHE B 23 46.891 -4.860 -24.178 1.00 0.00 C ATOM 0 H PHE B 23 41.124 -5.250 -21.491 1.00 0.00 H new ATOM 0 HA PHE B 23 43.806 -6.464 -21.269 1.00 0.00 H new ATOM 0 HB2 PHE B 23 42.638 -3.981 -22.163 1.00 0.00 H new ATOM 0 HB3 PHE B 23 43.708 -3.599 -20.829 1.00 0.00 H new ATOM 0 HD1 PHE B 23 46.078 -4.773 -20.873 1.00 0.00 H new ATOM 0 HD2 PHE B 23 43.533 -4.328 -24.302 1.00 0.00 H new ATOM 0 HE1 PHE B 23 48.039 -5.062 -22.365 1.00 0.00 H new ATOM 0 HE2 PHE B 23 45.487 -4.618 -25.795 1.00 0.00 H new ATOM 0 HZ PHE B 23 47.743 -4.987 -24.829 1.00 0.00 H new ATOM 1393 N ILE B 24 42.179 -5.682 -18.686 1.00 0.00 N ATOM 1394 CA ILE B 24 42.247 -5.531 -17.204 1.00 0.00 C ATOM 1395 C ILE B 24 41.779 -6.818 -16.531 1.00 0.00 C ATOM 1396 O ILE B 24 41.228 -7.704 -17.153 1.00 0.00 O ATOM 1397 CB ILE B 24 41.349 -4.353 -16.774 1.00 0.00 C ATOM 1398 CG1 ILE B 24 42.202 -3.104 -16.608 1.00 0.00 C ATOM 1399 CG2 ILE B 24 40.635 -4.624 -15.436 1.00 0.00 C ATOM 1400 CD1 ILE B 24 41.266 -1.915 -16.492 1.00 0.00 C ATOM 0 H ILE B 24 41.257 -5.906 -19.060 1.00 0.00 H new ATOM 0 HA ILE B 24 43.275 -5.332 -16.903 1.00 0.00 H new ATOM 0 HB ILE B 24 40.595 -4.221 -17.550 1.00 0.00 H new ATOM 0 HG12 ILE B 24 42.829 -3.185 -15.720 1.00 0.00 H new ATOM 0 HG13 ILE B 24 42.871 -2.982 -17.460 1.00 0.00 H new ATOM 0 HG21 ILE B 24 40.015 -3.767 -15.175 1.00 0.00 H new ATOM 0 HG22 ILE B 24 40.008 -5.510 -15.531 1.00 0.00 H new ATOM 0 HG23 ILE B 24 41.377 -4.787 -14.654 1.00 0.00 H new ATOM 0 HD11 ILE B 24 41.850 -1.003 -16.372 1.00 0.00 H new ATOM 0 HD12 ILE B 24 40.659 -1.841 -17.394 1.00 0.00 H new ATOM 0 HD13 ILE B 24 40.616 -2.047 -15.627 1.00 0.00 H new ATOM 1412 N ALA B 25 41.981 -6.899 -15.252 1.00 0.00 N ATOM 1413 CA ALA B 25 41.541 -8.091 -14.493 1.00 0.00 C ATOM 1414 C ALA B 25 41.066 -7.628 -13.120 1.00 0.00 C ATOM 1415 O ALA B 25 39.961 -7.915 -12.702 1.00 0.00 O ATOM 1416 CB ALA B 25 42.713 -9.062 -14.336 1.00 0.00 C ATOM 0 H ALA B 25 42.439 -6.179 -14.693 1.00 0.00 H new ATOM 0 HA ALA B 25 40.734 -8.600 -15.019 1.00 0.00 H new ATOM 0 HB1 ALA B 25 42.387 -9.939 -13.777 1.00 0.00 H new ATOM 0 HB2 ALA B 25 43.065 -9.370 -15.321 1.00 0.00 H new ATOM 0 HB3 ALA B 25 43.524 -8.570 -13.799 1.00 0.00 H new ATOM 1422 N ALA B 26 41.889 -6.896 -12.416 1.00 0.00 N ATOM 1423 CA ALA B 26 41.476 -6.400 -11.074 1.00 0.00 C ATOM 1424 C ALA B 26 41.159 -4.908 -11.147 1.00 0.00 C ATOM 1425 O ALA B 26 40.941 -4.353 -12.206 1.00 0.00 O ATOM 1426 CB ALA B 26 42.602 -6.636 -10.068 1.00 0.00 C ATOM 0 H ALA B 26 42.826 -6.622 -12.712 1.00 0.00 H new ATOM 0 HA ALA B 26 40.586 -6.940 -10.753 1.00 0.00 H new ATOM 0 HB1 ALA B 26 42.296 -6.272 -9.087 1.00 0.00 H new ATOM 0 HB2 ALA B 26 42.818 -7.703 -10.008 1.00 0.00 H new ATOM 0 HB3 ALA B 26 43.496 -6.102 -10.391 1.00 0.00 H new ATOM 1432 N TYR B 27 41.171 -4.253 -10.020 1.00 0.00 N ATOM 1433 CA TYR B 27 40.914 -2.789 -9.987 1.00 0.00 C ATOM 1434 C TYR B 27 41.246 -2.282 -8.577 1.00 0.00 C ATOM 1435 O TYR B 27 41.644 -3.042 -7.718 1.00 0.00 O ATOM 1436 CB TYR B 27 39.443 -2.489 -10.373 1.00 0.00 C ATOM 1437 CG TYR B 27 38.702 -1.795 -9.248 1.00 0.00 C ATOM 1438 CD1 TYR B 27 38.541 -2.428 -8.007 1.00 0.00 C ATOM 1439 CD2 TYR B 27 38.183 -0.514 -9.453 1.00 0.00 C ATOM 1440 CE1 TYR B 27 37.858 -1.775 -6.973 1.00 0.00 C ATOM 1441 CE2 TYR B 27 37.500 0.138 -8.420 1.00 0.00 C ATOM 1442 CZ TYR B 27 37.337 -0.492 -7.180 1.00 0.00 C ATOM 1443 OH TYR B 27 36.664 0.152 -6.161 1.00 0.00 O ATOM 0 H TYR B 27 41.350 -4.677 -9.110 1.00 0.00 H new ATOM 0 HA TYR B 27 41.542 -2.272 -10.713 1.00 0.00 H new ATOM 0 HB2 TYR B 27 39.421 -1.863 -11.265 1.00 0.00 H new ATOM 0 HB3 TYR B 27 38.935 -3.420 -10.624 1.00 0.00 H new ATOM 0 HD1 TYR B 27 38.943 -3.418 -7.849 1.00 0.00 H new ATOM 0 HD2 TYR B 27 38.309 -0.027 -10.409 1.00 0.00 H new ATOM 0 HE1 TYR B 27 37.733 -2.261 -6.017 1.00 0.00 H new ATOM 0 HE2 TYR B 27 37.098 1.128 -8.579 1.00 0.00 H new ATOM 0 HH TYR B 27 36.368 1.034 -6.470 1.00 0.00 H new ATOM 1453 N PHE B 28 41.085 -1.012 -8.329 1.00 0.00 N ATOM 1454 CA PHE B 28 41.400 -0.481 -6.972 1.00 0.00 C ATOM 1455 C PHE B 28 40.692 0.863 -6.767 1.00 0.00 C ATOM 1456 O PHE B 28 39.767 1.199 -7.478 1.00 0.00 O ATOM 1457 CB PHE B 28 42.915 -0.299 -6.862 1.00 0.00 C ATOM 1458 CG PHE B 28 43.544 -1.588 -6.391 1.00 0.00 C ATOM 1459 CD1 PHE B 28 43.574 -1.896 -5.027 1.00 0.00 C ATOM 1460 CD2 PHE B 28 44.095 -2.477 -7.322 1.00 0.00 C ATOM 1461 CE1 PHE B 28 44.154 -3.094 -4.593 1.00 0.00 C ATOM 1462 CE2 PHE B 28 44.673 -3.674 -6.889 1.00 0.00 C ATOM 1463 CZ PHE B 28 44.703 -3.984 -5.524 1.00 0.00 C ATOM 0 H PHE B 28 40.751 -0.322 -9.002 1.00 0.00 H new ATOM 0 HA PHE B 28 41.055 -1.176 -6.206 1.00 0.00 H new ATOM 0 HB2 PHE B 28 43.329 -0.012 -7.829 1.00 0.00 H new ATOM 0 HB3 PHE B 28 43.146 0.507 -6.165 1.00 0.00 H new ATOM 0 HD1 PHE B 28 43.150 -1.210 -4.309 1.00 0.00 H new ATOM 0 HD2 PHE B 28 44.073 -2.238 -8.375 1.00 0.00 H new ATOM 0 HE1 PHE B 28 44.178 -3.332 -3.540 1.00 0.00 H new ATOM 0 HE2 PHE B 28 45.097 -4.360 -7.608 1.00 0.00 H new ATOM 0 HZ PHE B 28 45.149 -4.909 -5.189 1.00 0.00 H new ATOM 1473 N GLU B 29 41.108 1.629 -5.794 1.00 0.00 N ATOM 1474 CA GLU B 29 40.448 2.939 -5.546 1.00 0.00 C ATOM 1475 C GLU B 29 41.263 3.745 -4.529 1.00 0.00 C ATOM 1476 O GLU B 29 41.073 3.631 -3.335 1.00 0.00 O ATOM 1477 CB GLU B 29 39.050 2.683 -4.996 1.00 0.00 C ATOM 1478 CG GLU B 29 39.137 1.669 -3.855 1.00 0.00 C ATOM 1479 CD GLU B 29 37.975 1.885 -2.886 1.00 0.00 C ATOM 1480 OE1 GLU B 29 36.863 2.060 -3.356 1.00 0.00 O ATOM 1481 OE2 GLU B 29 38.215 1.872 -1.690 1.00 0.00 O ATOM 0 H GLU B 29 41.876 1.403 -5.162 1.00 0.00 H new ATOM 0 HA GLU B 29 40.385 3.505 -6.475 1.00 0.00 H new ATOM 0 HB2 GLU B 29 38.611 3.614 -4.638 1.00 0.00 H new ATOM 0 HB3 GLU B 29 38.399 2.306 -5.785 1.00 0.00 H new ATOM 0 HG2 GLU B 29 39.107 0.655 -4.253 1.00 0.00 H new ATOM 0 HG3 GLU B 29 40.086 1.778 -3.330 1.00 0.00 H new ATOM 1488 N THR B 30 42.170 4.561 -4.993 1.00 0.00 N ATOM 1489 CA THR B 30 42.995 5.371 -4.052 1.00 0.00 C ATOM 1490 C THR B 30 42.079 6.194 -3.142 1.00 0.00 C ATOM 1491 O THR B 30 41.015 6.625 -3.542 1.00 0.00 O ATOM 1492 CB THR B 30 43.904 6.307 -4.854 1.00 0.00 C ATOM 1493 OG1 THR B 30 43.113 7.120 -5.708 1.00 0.00 O ATOM 1494 CG2 THR B 30 44.872 5.473 -5.692 1.00 0.00 C ATOM 0 H THR B 30 42.375 4.702 -5.982 1.00 0.00 H new ATOM 0 HA THR B 30 43.606 4.709 -3.439 1.00 0.00 H new ATOM 0 HB THR B 30 44.467 6.944 -4.172 1.00 0.00 H new ATOM 0 HG1 THR B 30 42.165 6.920 -5.564 1.00 0.00 H new ATOM 0 HG21 THR B 30 45.521 6.135 -6.265 1.00 0.00 H new ATOM 0 HG22 THR B 30 45.478 4.850 -5.035 1.00 0.00 H new ATOM 0 HG23 THR B 30 44.308 4.838 -6.375 1.00 0.00 H new ATOM 1502 N SER B 31 42.482 6.410 -1.918 1.00 0.00 N ATOM 1503 CA SER B 31 41.634 7.198 -0.981 1.00 0.00 C ATOM 1504 C SER B 31 41.988 8.683 -1.091 1.00 0.00 C ATOM 1505 O SER B 31 42.541 9.130 -2.076 1.00 0.00 O ATOM 1506 CB SER B 31 41.879 6.723 0.452 1.00 0.00 C ATOM 1507 OG SER B 31 42.484 5.435 0.424 1.00 0.00 O ATOM 0 H SER B 31 43.362 6.074 -1.528 1.00 0.00 H new ATOM 0 HA SER B 31 40.585 7.055 -1.239 1.00 0.00 H new ATOM 0 HB2 SER B 31 42.524 7.429 0.976 1.00 0.00 H new ATOM 0 HB3 SER B 31 40.938 6.683 1.000 1.00 0.00 H new ATOM 0 HG SER B 31 42.644 5.129 1.341 1.00 0.00 H new ATOM 1513 N SER B 32 41.670 9.452 -0.084 1.00 0.00 N ATOM 1514 CA SER B 32 41.985 10.908 -0.128 1.00 0.00 C ATOM 1515 C SER B 32 43.503 11.106 0.005 1.00 0.00 C ATOM 1516 O SER B 32 44.265 10.608 -0.798 1.00 0.00 O ATOM 1517 CB SER B 32 41.253 11.615 1.015 1.00 0.00 C ATOM 1518 OG SER B 32 41.487 13.013 0.927 1.00 0.00 O ATOM 0 H SER B 32 41.206 9.134 0.767 1.00 0.00 H new ATOM 0 HA SER B 32 41.657 11.333 -1.077 1.00 0.00 H new ATOM 0 HB2 SER B 32 40.184 11.409 0.960 1.00 0.00 H new ATOM 0 HB3 SER B 32 41.602 11.236 1.976 1.00 0.00 H new ATOM 0 HG SER B 32 41.018 13.470 1.657 1.00 0.00 H new ATOM 1524 N GLN B 33 43.955 11.823 1.005 1.00 0.00 N ATOM 1525 CA GLN B 33 45.422 12.035 1.163 1.00 0.00 C ATOM 1526 C GLN B 33 46.002 12.580 -0.144 1.00 0.00 C ATOM 1527 O GLN B 33 46.072 13.774 -0.353 1.00 0.00 O ATOM 1528 CB GLN B 33 46.094 10.702 1.503 1.00 0.00 C ATOM 1529 CG GLN B 33 45.947 10.425 3.000 1.00 0.00 C ATOM 1530 CD GLN B 33 46.548 11.585 3.797 1.00 0.00 C ATOM 1531 OE1 GLN B 33 47.441 12.263 3.327 1.00 0.00 O ATOM 1532 NE2 GLN B 33 46.095 11.845 4.992 1.00 0.00 N ATOM 0 H GLN B 33 43.372 12.268 1.714 1.00 0.00 H new ATOM 0 HA GLN B 33 45.603 12.750 1.966 1.00 0.00 H new ATOM 0 HB2 GLN B 33 45.640 9.896 0.927 1.00 0.00 H new ATOM 0 HB3 GLN B 33 47.149 10.734 1.230 1.00 0.00 H new ATOM 0 HG2 GLN B 33 44.895 10.301 3.256 1.00 0.00 H new ATOM 0 HG3 GLN B 33 46.450 9.493 3.259 1.00 0.00 H new ATOM 0 HE21 GLN B 33 45.346 11.277 5.388 1.00 0.00 H new ATOM 0 HE22 GLN B 33 46.490 12.616 5.531 1.00 0.00 H new ATOM 1541 N CYS B 34 46.416 11.712 -1.025 1.00 0.00 N ATOM 1542 CA CYS B 34 46.986 12.178 -2.319 1.00 0.00 C ATOM 1543 C CYS B 34 45.843 12.568 -3.263 1.00 0.00 C ATOM 1544 O CYS B 34 44.937 13.285 -2.882 1.00 0.00 O ATOM 1545 CB CYS B 34 47.817 11.053 -2.941 1.00 0.00 C ATOM 1546 SG CYS B 34 49.039 10.464 -1.744 1.00 0.00 S ATOM 0 H CYS B 34 46.384 10.700 -0.904 1.00 0.00 H new ATOM 0 HA CYS B 34 47.626 13.045 -2.152 1.00 0.00 H new ATOM 0 HB2 CYS B 34 47.167 10.233 -3.245 1.00 0.00 H new ATOM 0 HB3 CYS B 34 48.318 11.412 -3.840 1.00 0.00 H new ATOM 1551 N SER B 35 45.866 12.109 -4.488 1.00 0.00 N ATOM 1552 CA SER B 35 44.773 12.467 -5.432 1.00 0.00 C ATOM 1553 C SER B 35 43.486 11.732 -5.030 1.00 0.00 C ATOM 1554 O SER B 35 42.615 12.322 -4.428 1.00 0.00 O ATOM 1555 CB SER B 35 45.182 12.085 -6.858 1.00 0.00 C ATOM 1556 OG SER B 35 44.376 12.798 -7.786 1.00 0.00 O ATOM 0 H SER B 35 46.593 11.504 -4.871 1.00 0.00 H new ATOM 0 HA SER B 35 44.592 13.541 -5.394 1.00 0.00 H new ATOM 0 HB2 SER B 35 46.235 12.316 -7.021 1.00 0.00 H new ATOM 0 HB3 SER B 35 45.065 11.012 -7.007 1.00 0.00 H new ATOM 0 HG SER B 35 44.733 12.677 -8.690 1.00 0.00 H new ATOM 1562 N LYS B 36 43.378 10.455 -5.367 1.00 0.00 N ATOM 1563 CA LYS B 36 42.162 9.630 -5.027 1.00 0.00 C ATOM 1564 C LYS B 36 41.443 9.172 -6.308 1.00 0.00 C ATOM 1565 O LYS B 36 41.053 8.025 -6.403 1.00 0.00 O ATOM 1566 CB LYS B 36 41.173 10.404 -4.150 1.00 0.00 C ATOM 1567 CG LYS B 36 39.965 9.520 -3.830 1.00 0.00 C ATOM 1568 CD LYS B 36 38.764 9.975 -4.663 1.00 0.00 C ATOM 1569 CE LYS B 36 37.793 8.806 -4.841 1.00 0.00 C ATOM 1570 NZ LYS B 36 36.590 9.269 -5.592 1.00 0.00 N ATOM 0 H LYS B 36 44.099 9.943 -5.874 1.00 0.00 H new ATOM 0 HA LYS B 36 42.515 8.763 -4.469 1.00 0.00 H new ATOM 0 HB2 LYS B 36 41.660 10.719 -3.227 1.00 0.00 H new ATOM 0 HB3 LYS B 36 40.848 11.309 -4.664 1.00 0.00 H new ATOM 0 HG2 LYS B 36 40.197 8.477 -4.046 1.00 0.00 H new ATOM 0 HG3 LYS B 36 39.728 9.580 -2.768 1.00 0.00 H new ATOM 0 HD2 LYS B 36 38.261 10.807 -4.171 1.00 0.00 H new ATOM 0 HD3 LYS B 36 39.098 10.335 -5.636 1.00 0.00 H new ATOM 0 HE2 LYS B 36 38.280 7.993 -5.379 1.00 0.00 H new ATOM 0 HE3 LYS B 36 37.498 8.413 -3.868 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 35.930 8.475 -5.713 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 36.121 10.031 -5.061 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 36.879 9.624 -6.526 1.00 0.00 H new ATOM 1584 N PRO B 37 41.271 10.068 -7.255 1.00 0.00 N ATOM 1585 CA PRO B 37 40.586 9.747 -8.518 1.00 0.00 C ATOM 1586 C PRO B 37 41.549 9.052 -9.481 1.00 0.00 C ATOM 1587 O PRO B 37 42.420 9.674 -10.056 1.00 0.00 O ATOM 1588 CB PRO B 37 40.180 11.116 -9.066 1.00 0.00 C ATOM 1589 CG PRO B 37 41.127 12.148 -8.410 1.00 0.00 C ATOM 1590 CD PRO B 37 41.735 11.468 -7.170 1.00 0.00 C ATOM 0 HA PRO B 37 39.739 9.074 -8.385 1.00 0.00 H new ATOM 0 HB2 PRO B 37 40.270 11.142 -10.152 1.00 0.00 H new ATOM 0 HB3 PRO B 37 39.140 11.337 -8.827 1.00 0.00 H new ATOM 0 HG2 PRO B 37 41.909 12.453 -9.106 1.00 0.00 H new ATOM 0 HG3 PRO B 37 40.582 13.049 -8.129 1.00 0.00 H new ATOM 0 HD2 PRO B 37 42.823 11.527 -7.178 1.00 0.00 H new ATOM 0 HD3 PRO B 37 41.396 11.944 -6.250 1.00 0.00 H new ATOM 1598 N GLY B 38 41.401 7.771 -9.672 1.00 0.00 N ATOM 1599 CA GLY B 38 42.314 7.064 -10.610 1.00 0.00 C ATOM 1600 C GLY B 38 42.398 5.575 -10.264 1.00 0.00 C ATOM 1601 O GLY B 38 42.859 4.783 -11.056 1.00 0.00 O ATOM 0 H GLY B 38 40.694 7.188 -9.224 1.00 0.00 H new ATOM 0 HA2 GLY B 38 41.958 7.185 -11.633 1.00 0.00 H new ATOM 0 HA3 GLY B 38 43.308 7.510 -10.564 1.00 0.00 H new ATOM 1605 N VAL B 39 41.963 5.188 -9.094 1.00 0.00 N ATOM 1606 CA VAL B 39 42.021 3.744 -8.708 1.00 0.00 C ATOM 1607 C VAL B 39 43.346 3.129 -9.161 1.00 0.00 C ATOM 1608 O VAL B 39 44.286 3.813 -9.511 1.00 0.00 O ATOM 1609 CB VAL B 39 40.877 2.978 -9.383 1.00 0.00 C ATOM 1610 CG1 VAL B 39 39.539 3.621 -9.022 1.00 0.00 C ATOM 1611 CG2 VAL B 39 41.069 2.998 -10.903 1.00 0.00 C ATOM 0 H VAL B 39 41.569 5.809 -8.387 1.00 0.00 H new ATOM 0 HA VAL B 39 41.932 3.675 -7.624 1.00 0.00 H new ATOM 0 HB VAL B 39 40.882 1.945 -9.034 1.00 0.00 H new ATOM 0 HG11 VAL B 39 38.730 3.073 -9.504 1.00 0.00 H new ATOM 0 HG12 VAL B 39 39.402 3.594 -7.941 1.00 0.00 H new ATOM 0 HG13 VAL B 39 39.529 4.656 -9.363 1.00 0.00 H new ATOM 0 HG21 VAL B 39 40.254 2.453 -11.380 1.00 0.00 H new ATOM 0 HG22 VAL B 39 41.071 4.029 -11.256 1.00 0.00 H new ATOM 0 HG23 VAL B 39 42.018 2.526 -11.156 1.00 0.00 H new ATOM 1621 N ILE B 40 43.409 1.828 -9.176 1.00 0.00 N ATOM 1622 CA ILE B 40 44.641 1.129 -9.627 1.00 0.00 C ATOM 1623 C ILE B 40 44.193 -0.150 -10.333 1.00 0.00 C ATOM 1624 O ILE B 40 43.379 -0.896 -9.824 1.00 0.00 O ATOM 1625 CB ILE B 40 45.546 0.813 -8.424 1.00 0.00 C ATOM 1626 CG1 ILE B 40 46.474 2.004 -8.171 1.00 0.00 C ATOM 1627 CG2 ILE B 40 46.394 -0.433 -8.706 1.00 0.00 C ATOM 1628 CD1 ILE B 40 46.136 2.633 -6.821 1.00 0.00 C ATOM 0 H ILE B 40 42.648 1.212 -8.891 1.00 0.00 H new ATOM 0 HA ILE B 40 45.222 1.752 -10.306 1.00 0.00 H new ATOM 0 HB ILE B 40 44.923 0.626 -7.550 1.00 0.00 H new ATOM 0 HG12 ILE B 40 47.514 1.678 -8.182 1.00 0.00 H new ATOM 0 HG13 ILE B 40 46.363 2.741 -8.966 1.00 0.00 H new ATOM 0 HG21 ILE B 40 47.029 -0.643 -7.845 1.00 0.00 H new ATOM 0 HG22 ILE B 40 45.739 -1.285 -8.891 1.00 0.00 H new ATOM 0 HG23 ILE B 40 47.018 -0.258 -9.583 1.00 0.00 H new ATOM 0 HD11 ILE B 40 46.796 3.481 -6.639 1.00 0.00 H new ATOM 0 HD12 ILE B 40 45.101 2.974 -6.827 1.00 0.00 H new ATOM 0 HD13 ILE B 40 46.270 1.894 -6.031 1.00 0.00 H new ATOM 1640 N PHE B 41 44.683 -0.394 -11.512 1.00 0.00 N ATOM 1641 CA PHE B 41 44.242 -1.608 -12.250 1.00 0.00 C ATOM 1642 C PHE B 41 45.327 -2.678 -12.237 1.00 0.00 C ATOM 1643 O PHE B 41 46.490 -2.411 -12.003 1.00 0.00 O ATOM 1644 CB PHE B 41 43.922 -1.232 -13.696 1.00 0.00 C ATOM 1645 CG PHE B 41 42.588 -0.530 -13.749 1.00 0.00 C ATOM 1646 CD1 PHE B 41 41.448 -1.149 -13.219 1.00 0.00 C ATOM 1647 CD2 PHE B 41 42.490 0.740 -14.325 1.00 0.00 C ATOM 1648 CE1 PHE B 41 40.211 -0.496 -13.268 1.00 0.00 C ATOM 1649 CE2 PHE B 41 41.253 1.391 -14.374 1.00 0.00 C ATOM 1650 CZ PHE B 41 40.115 0.774 -13.846 1.00 0.00 C ATOM 0 H PHE B 41 45.366 0.190 -11.996 1.00 0.00 H new ATOM 0 HA PHE B 41 43.355 -2.008 -11.759 1.00 0.00 H new ATOM 0 HB2 PHE B 41 44.702 -0.584 -14.096 1.00 0.00 H new ATOM 0 HB3 PHE B 41 43.900 -2.126 -14.319 1.00 0.00 H new ATOM 0 HD1 PHE B 41 41.524 -2.130 -12.773 1.00 0.00 H new ATOM 0 HD2 PHE B 41 43.369 1.218 -14.732 1.00 0.00 H new ATOM 0 HE1 PHE B 41 39.332 -0.972 -12.860 1.00 0.00 H new ATOM 0 HE2 PHE B 41 41.177 2.372 -14.820 1.00 0.00 H new ATOM 0 HZ PHE B 41 39.161 1.279 -13.884 1.00 0.00 H new ATOM 1660 N LEU B 42 44.939 -3.893 -12.496 1.00 0.00 N ATOM 1661 CA LEU B 42 45.906 -5.013 -12.517 1.00 0.00 C ATOM 1662 C LEU B 42 45.887 -5.652 -13.903 1.00 0.00 C ATOM 1663 O LEU B 42 45.449 -6.772 -14.077 1.00 0.00 O ATOM 1664 CB LEU B 42 45.485 -6.047 -11.483 1.00 0.00 C ATOM 1665 CG LEU B 42 45.985 -5.624 -10.105 1.00 0.00 C ATOM 1666 CD1 LEU B 42 45.526 -6.650 -9.070 1.00 0.00 C ATOM 1667 CD2 LEU B 42 47.514 -5.550 -10.112 1.00 0.00 C ATOM 0 H LEU B 42 43.975 -4.158 -12.697 1.00 0.00 H new ATOM 0 HA LEU B 42 46.908 -4.650 -12.289 1.00 0.00 H new ATOM 0 HB2 LEU B 42 44.399 -6.145 -11.473 1.00 0.00 H new ATOM 0 HB3 LEU B 42 45.891 -7.024 -11.744 1.00 0.00 H new ATOM 0 HG LEU B 42 45.581 -4.643 -9.854 1.00 0.00 H new ATOM 0 HD11 LEU B 42 45.880 -6.354 -8.082 1.00 0.00 H new ATOM 0 HD12 LEU B 42 44.437 -6.700 -9.065 1.00 0.00 H new ATOM 0 HD13 LEU B 42 45.933 -7.629 -9.323 1.00 0.00 H new ATOM 0 HD21 LEU B 42 47.868 -5.248 -9.126 1.00 0.00 H new ATOM 0 HD22 LEU B 42 47.925 -6.529 -10.361 1.00 0.00 H new ATOM 0 HD23 LEU B 42 47.840 -4.821 -10.854 1.00 0.00 H new ATOM 1679 N THR B 43 46.344 -4.938 -14.888 1.00 0.00 N ATOM 1680 CA THR B 43 46.351 -5.481 -16.274 1.00 0.00 C ATOM 1681 C THR B 43 46.955 -6.888 -16.282 1.00 0.00 C ATOM 1682 O THR B 43 47.309 -7.435 -15.256 1.00 0.00 O ATOM 1683 CB THR B 43 47.184 -4.566 -17.172 1.00 0.00 C ATOM 1684 OG1 THR B 43 48.561 -4.731 -16.862 1.00 0.00 O ATOM 1685 CG2 THR B 43 46.777 -3.111 -16.937 1.00 0.00 C ATOM 0 H THR B 43 46.717 -3.993 -14.794 1.00 0.00 H new ATOM 0 HA THR B 43 45.327 -5.530 -16.645 1.00 0.00 H new ATOM 0 HB THR B 43 47.012 -4.824 -18.217 1.00 0.00 H new ATOM 0 HG1 THR B 43 49.086 -4.726 -17.690 1.00 0.00 H new ATOM 0 HG21 THR B 43 47.371 -2.459 -17.577 1.00 0.00 H new ATOM 0 HG22 THR B 43 45.720 -2.986 -17.173 1.00 0.00 H new ATOM 0 HG23 THR B 43 46.949 -2.849 -15.893 1.00 0.00 H new ATOM 1693 N LYS B 44 47.076 -7.472 -17.438 1.00 0.00 N ATOM 1694 CA LYS B 44 47.653 -8.843 -17.530 1.00 0.00 C ATOM 1695 C LYS B 44 49.177 -8.753 -17.503 1.00 0.00 C ATOM 1696 O LYS B 44 49.853 -9.633 -17.009 1.00 0.00 O ATOM 1697 CB LYS B 44 47.200 -9.497 -18.836 1.00 0.00 C ATOM 1698 CG LYS B 44 45.725 -9.169 -19.080 1.00 0.00 C ATOM 1699 CD LYS B 44 44.900 -9.572 -17.856 1.00 0.00 C ATOM 1700 CE LYS B 44 43.823 -10.573 -18.278 1.00 0.00 C ATOM 1701 NZ LYS B 44 44.085 -11.886 -17.626 1.00 0.00 N ATOM 0 H LYS B 44 46.799 -7.059 -18.329 1.00 0.00 H new ATOM 0 HA LYS B 44 47.310 -9.443 -16.687 1.00 0.00 H new ATOM 0 HB2 LYS B 44 47.807 -9.136 -19.666 1.00 0.00 H new ATOM 0 HB3 LYS B 44 47.341 -10.577 -18.784 1.00 0.00 H new ATOM 0 HG2 LYS B 44 45.607 -8.103 -19.276 1.00 0.00 H new ATOM 0 HG3 LYS B 44 45.366 -9.697 -19.963 1.00 0.00 H new ATOM 0 HD2 LYS B 44 45.546 -10.014 -17.097 1.00 0.00 H new ATOM 0 HD3 LYS B 44 44.439 -8.692 -17.408 1.00 0.00 H new ATOM 0 HE2 LYS B 44 42.837 -10.204 -17.995 1.00 0.00 H new ATOM 0 HE3 LYS B 44 43.821 -10.687 -19.362 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 43.354 -12.568 -17.912 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 45.019 -12.238 -17.917 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 44.065 -11.770 -16.593 1.00 0.00 H new ATOM 1715 N ARG B 45 49.724 -7.688 -18.020 1.00 0.00 N ATOM 1716 CA ARG B 45 51.203 -7.539 -18.012 1.00 0.00 C ATOM 1717 C ARG B 45 51.674 -7.279 -16.579 1.00 0.00 C ATOM 1718 O ARG B 45 52.857 -7.222 -16.306 1.00 0.00 O ATOM 1719 CB ARG B 45 51.604 -6.362 -18.905 1.00 0.00 C ATOM 1720 CG ARG B 45 53.124 -6.341 -19.071 1.00 0.00 C ATOM 1721 CD ARG B 45 53.478 -5.827 -20.467 1.00 0.00 C ATOM 1722 NE ARG B 45 54.418 -4.677 -20.346 1.00 0.00 N ATOM 1723 CZ ARG B 45 55.573 -4.713 -20.951 1.00 0.00 C ATOM 1724 NH1 ARG B 45 56.378 -5.722 -20.761 1.00 0.00 N ATOM 1725 NH2 ARG B 45 55.924 -3.740 -21.747 1.00 0.00 N ATOM 0 H ARG B 45 49.211 -6.917 -18.447 1.00 0.00 H new ATOM 0 HA ARG B 45 51.665 -8.451 -18.390 1.00 0.00 H new ATOM 0 HB2 ARG B 45 51.123 -6.450 -19.879 1.00 0.00 H new ATOM 0 HB3 ARG B 45 51.263 -5.425 -18.465 1.00 0.00 H new ATOM 0 HG2 ARG B 45 53.575 -5.702 -18.312 1.00 0.00 H new ATOM 0 HG3 ARG B 45 53.530 -7.342 -18.927 1.00 0.00 H new ATOM 0 HD2 ARG B 45 53.934 -6.623 -21.055 1.00 0.00 H new ATOM 0 HD3 ARG B 45 52.575 -5.519 -20.993 1.00 0.00 H new ATOM 0 HE ARG B 45 54.158 -3.862 -19.790 1.00 0.00 H new ATOM 0 HH11 ARG B 45 56.104 -6.483 -20.139 1.00 0.00 H new ATOM 0 HH12 ARG B 45 57.281 -5.750 -21.234 1.00 0.00 H new ATOM 0 HH21 ARG B 45 55.295 -2.951 -21.896 1.00 0.00 H new ATOM 0 HH22 ARG B 45 56.827 -3.769 -22.220 1.00 0.00 H new ATOM 1739 N SER B 46 50.755 -7.124 -15.662 1.00 0.00 N ATOM 1740 CA SER B 46 51.147 -6.871 -14.248 1.00 0.00 C ATOM 1741 C SER B 46 51.579 -5.414 -14.091 1.00 0.00 C ATOM 1742 O SER B 46 52.634 -5.126 -13.563 1.00 0.00 O ATOM 1743 CB SER B 46 52.306 -7.793 -13.865 1.00 0.00 C ATOM 1744 OG SER B 46 52.347 -7.939 -12.450 1.00 0.00 O ATOM 0 H SER B 46 49.750 -7.162 -15.833 1.00 0.00 H new ATOM 0 HA SER B 46 50.297 -7.069 -13.595 1.00 0.00 H new ATOM 0 HB2 SER B 46 52.182 -8.767 -14.339 1.00 0.00 H new ATOM 0 HB3 SER B 46 53.248 -7.380 -14.226 1.00 0.00 H new ATOM 0 HG SER B 46 53.088 -8.531 -12.204 1.00 0.00 H new ATOM 1750 N ARG B 47 50.776 -4.489 -14.546 1.00 0.00 N ATOM 1751 CA ARG B 47 51.157 -3.054 -14.415 1.00 0.00 C ATOM 1752 C ARG B 47 50.015 -2.263 -13.766 1.00 0.00 C ATOM 1753 O ARG B 47 48.886 -2.300 -14.214 1.00 0.00 O ATOM 1754 CB ARG B 47 51.478 -2.477 -15.803 1.00 0.00 C ATOM 1755 CG ARG B 47 50.188 -2.046 -16.512 1.00 0.00 C ATOM 1756 CD ARG B 47 50.527 -1.472 -17.889 1.00 0.00 C ATOM 1757 NE ARG B 47 50.787 -2.587 -18.842 1.00 0.00 N ATOM 1758 CZ ARG B 47 50.590 -2.414 -20.120 1.00 0.00 C ATOM 1759 NH1 ARG B 47 49.373 -2.357 -20.589 1.00 0.00 N ATOM 1760 NH2 ARG B 47 51.609 -2.293 -20.927 1.00 0.00 N ATOM 0 H ARG B 47 49.879 -4.664 -14.999 1.00 0.00 H new ATOM 0 HA ARG B 47 52.040 -2.974 -13.781 1.00 0.00 H new ATOM 0 HB2 ARG B 47 52.149 -1.624 -15.703 1.00 0.00 H new ATOM 0 HB3 ARG B 47 51.999 -3.223 -16.403 1.00 0.00 H new ATOM 0 HG2 ARG B 47 49.517 -2.898 -16.617 1.00 0.00 H new ATOM 0 HG3 ARG B 47 49.664 -1.300 -15.914 1.00 0.00 H new ATOM 0 HD2 ARG B 47 49.704 -0.855 -18.250 1.00 0.00 H new ATOM 0 HD3 ARG B 47 51.403 -0.827 -17.820 1.00 0.00 H new ATOM 0 HE ARG B 47 51.119 -3.487 -18.495 1.00 0.00 H new ATOM 0 HH11 ARG B 47 48.578 -2.448 -19.957 1.00 0.00 H new ATOM 0 HH12 ARG B 47 49.217 -2.222 -21.588 1.00 0.00 H new ATOM 0 HH21 ARG B 47 52.559 -2.334 -20.558 1.00 0.00 H new ATOM 0 HH22 ARG B 47 51.455 -2.158 -21.926 1.00 0.00 H new ATOM 1774 N GLN B 48 50.310 -1.537 -12.721 1.00 0.00 N ATOM 1775 CA GLN B 48 49.254 -0.729 -12.046 1.00 0.00 C ATOM 1776 C GLN B 48 48.899 0.460 -12.939 1.00 0.00 C ATOM 1777 O GLN B 48 49.768 1.180 -13.392 1.00 0.00 O ATOM 1778 CB GLN B 48 49.792 -0.221 -10.707 1.00 0.00 C ATOM 1779 CG GLN B 48 48.823 0.802 -10.118 1.00 0.00 C ATOM 1780 CD GLN B 48 49.522 2.157 -9.991 1.00 0.00 C ATOM 1781 OE1 GLN B 48 49.977 2.522 -8.924 1.00 0.00 O ATOM 1782 NE2 GLN B 48 49.627 2.925 -11.041 1.00 0.00 N ATOM 0 H GLN B 48 51.239 -1.469 -12.305 1.00 0.00 H new ATOM 0 HA GLN B 48 48.367 -1.338 -11.873 1.00 0.00 H new ATOM 0 HB2 GLN B 48 49.921 -1.054 -10.016 1.00 0.00 H new ATOM 0 HB3 GLN B 48 50.774 0.232 -10.847 1.00 0.00 H new ATOM 0 HG2 GLN B 48 47.943 0.894 -10.755 1.00 0.00 H new ATOM 0 HG3 GLN B 48 48.475 0.468 -9.141 1.00 0.00 H new ATOM 0 HE21 GLN B 48 49.246 2.620 -11.936 1.00 0.00 H new ATOM 0 HE22 GLN B 48 50.090 3.831 -10.966 1.00 0.00 H new ATOM 1791 N VAL B 49 47.640 0.674 -13.217 1.00 0.00 N ATOM 1792 CA VAL B 49 47.279 1.820 -14.102 1.00 0.00 C ATOM 1793 C VAL B 49 46.099 2.615 -13.528 1.00 0.00 C ATOM 1794 O VAL B 49 44.967 2.172 -13.557 1.00 0.00 O ATOM 1795 CB VAL B 49 46.895 1.286 -15.482 1.00 0.00 C ATOM 1796 CG1 VAL B 49 46.778 2.451 -16.466 1.00 0.00 C ATOM 1797 CG2 VAL B 49 47.973 0.315 -15.969 1.00 0.00 C ATOM 0 H VAL B 49 46.858 0.115 -12.876 1.00 0.00 H new ATOM 0 HA VAL B 49 48.141 2.483 -14.173 1.00 0.00 H new ATOM 0 HB VAL B 49 45.938 0.767 -15.418 1.00 0.00 H new ATOM 0 HG11 VAL B 49 46.504 2.070 -17.450 1.00 0.00 H new ATOM 0 HG12 VAL B 49 46.012 3.145 -16.119 1.00 0.00 H new ATOM 0 HG13 VAL B 49 47.734 2.970 -16.531 1.00 0.00 H new ATOM 0 HG21 VAL B 49 47.701 -0.067 -16.953 1.00 0.00 H new ATOM 0 HG22 VAL B 49 48.929 0.835 -16.033 1.00 0.00 H new ATOM 0 HG23 VAL B 49 48.058 -0.516 -15.268 1.00 0.00 H new ATOM 1807 N CYS B 50 46.351 3.804 -13.041 1.00 0.00 N ATOM 1808 CA CYS B 50 45.243 4.644 -12.507 1.00 0.00 C ATOM 1809 C CYS B 50 44.292 4.956 -13.656 1.00 0.00 C ATOM 1810 O CYS B 50 44.429 4.440 -14.747 1.00 0.00 O ATOM 1811 CB CYS B 50 45.802 5.958 -11.945 1.00 0.00 C ATOM 1812 SG CYS B 50 46.438 5.695 -10.267 1.00 0.00 S ATOM 0 H CYS B 50 47.278 4.227 -12.991 1.00 0.00 H new ATOM 0 HA CYS B 50 44.725 4.112 -11.709 1.00 0.00 H new ATOM 0 HB2 CYS B 50 46.598 6.329 -12.590 1.00 0.00 H new ATOM 0 HB3 CYS B 50 45.021 6.719 -11.932 1.00 0.00 H new ATOM 1817 N ALA B 51 43.333 5.793 -13.423 1.00 0.00 N ATOM 1818 CA ALA B 51 42.374 6.135 -14.507 1.00 0.00 C ATOM 1819 C ALA B 51 41.742 7.499 -14.235 1.00 0.00 C ATOM 1820 O ALA B 51 42.181 8.244 -13.382 1.00 0.00 O ATOM 1821 CB ALA B 51 41.278 5.072 -14.566 1.00 0.00 C ATOM 0 H ALA B 51 43.167 6.258 -12.530 1.00 0.00 H new ATOM 0 HA ALA B 51 42.906 6.171 -15.458 1.00 0.00 H new ATOM 0 HB1 ALA B 51 40.573 5.320 -15.360 1.00 0.00 H new ATOM 0 HB2 ALA B 51 41.725 4.099 -14.769 1.00 0.00 H new ATOM 0 HB3 ALA B 51 40.752 5.038 -13.612 1.00 0.00 H new ATOM 1827 N ASP B 52 40.710 7.827 -14.959 1.00 0.00 N ATOM 1828 CA ASP B 52 40.037 9.135 -14.753 1.00 0.00 C ATOM 1829 C ASP B 52 39.245 9.091 -13.441 1.00 0.00 C ATOM 1830 O ASP B 52 39.063 8.035 -12.866 1.00 0.00 O ATOM 1831 CB ASP B 52 39.085 9.393 -15.924 1.00 0.00 C ATOM 1832 CG ASP B 52 39.487 10.682 -16.644 1.00 0.00 C ATOM 1833 OD1 ASP B 52 40.567 11.179 -16.370 1.00 0.00 O ATOM 1834 OD2 ASP B 52 38.708 11.149 -17.459 1.00 0.00 O ATOM 0 H ASP B 52 40.303 7.241 -15.688 1.00 0.00 H new ATOM 0 HA ASP B 52 40.776 9.934 -14.701 1.00 0.00 H new ATOM 0 HB2 ASP B 52 39.113 8.554 -16.619 1.00 0.00 H new ATOM 0 HB3 ASP B 52 38.060 9.473 -15.561 1.00 0.00 H new ATOM 1839 N PRO B 53 38.797 10.241 -13.009 1.00 0.00 N ATOM 1840 CA PRO B 53 38.018 10.372 -11.765 1.00 0.00 C ATOM 1841 C PRO B 53 36.583 9.892 -11.992 1.00 0.00 C ATOM 1842 O PRO B 53 36.046 9.124 -11.219 1.00 0.00 O ATOM 1843 CB PRO B 53 38.058 11.875 -11.472 1.00 0.00 C ATOM 1844 CG PRO B 53 38.363 12.573 -12.818 1.00 0.00 C ATOM 1845 CD PRO B 53 39.021 11.515 -13.721 1.00 0.00 C ATOM 0 HA PRO B 53 38.412 9.777 -10.941 1.00 0.00 H new ATOM 0 HB2 PRO B 53 37.107 12.217 -11.064 1.00 0.00 H new ATOM 0 HB3 PRO B 53 38.824 12.106 -10.732 1.00 0.00 H new ATOM 0 HG2 PRO B 53 37.449 12.956 -13.272 1.00 0.00 H new ATOM 0 HG3 PRO B 53 39.027 13.425 -12.671 1.00 0.00 H new ATOM 0 HD2 PRO B 53 38.569 11.502 -14.713 1.00 0.00 H new ATOM 0 HD3 PRO B 53 40.084 11.713 -13.857 1.00 0.00 H new ATOM 1853 N SER B 54 35.963 10.334 -13.049 1.00 0.00 N ATOM 1854 CA SER B 54 34.567 9.899 -13.329 1.00 0.00 C ATOM 1855 C SER B 54 34.551 9.045 -14.597 1.00 0.00 C ATOM 1856 O SER B 54 33.881 9.361 -15.560 1.00 0.00 O ATOM 1857 CB SER B 54 33.677 11.126 -13.529 1.00 0.00 C ATOM 1858 OG SER B 54 32.778 11.237 -12.433 1.00 0.00 O ATOM 0 H SER B 54 36.363 10.978 -13.732 1.00 0.00 H new ATOM 0 HA SER B 54 34.191 9.315 -12.489 1.00 0.00 H new ATOM 0 HB2 SER B 54 34.289 12.025 -13.605 1.00 0.00 H new ATOM 0 HB3 SER B 54 33.121 11.038 -14.463 1.00 0.00 H new ATOM 0 HG SER B 54 32.207 12.024 -12.557 1.00 0.00 H new ATOM 1864 N GLU B 55 35.279 7.960 -14.605 1.00 0.00 N ATOM 1865 CA GLU B 55 35.295 7.088 -15.815 1.00 0.00 C ATOM 1866 C GLU B 55 34.130 6.125 -15.750 1.00 0.00 C ATOM 1867 O GLU B 55 33.628 5.782 -14.697 1.00 0.00 O ATOM 1868 CB GLU B 55 36.612 6.297 -15.920 1.00 0.00 C ATOM 1869 CG GLU B 55 37.632 6.808 -14.896 1.00 0.00 C ATOM 1870 CD GLU B 55 37.471 6.037 -13.585 1.00 0.00 C ATOM 1871 OE1 GLU B 55 36.341 5.780 -13.205 1.00 0.00 O ATOM 1872 OE2 GLU B 55 38.483 5.715 -12.983 1.00 0.00 O ATOM 0 H GLU B 55 35.860 7.641 -13.830 1.00 0.00 H new ATOM 0 HA GLU B 55 35.211 7.723 -16.697 1.00 0.00 H new ATOM 0 HB2 GLU B 55 36.420 5.237 -15.752 1.00 0.00 H new ATOM 0 HB3 GLU B 55 37.020 6.392 -16.926 1.00 0.00 H new ATOM 0 HG2 GLU B 55 38.644 6.683 -15.282 1.00 0.00 H new ATOM 0 HG3 GLU B 55 37.486 7.874 -14.723 1.00 0.00 H new ATOM 1879 N GLU B 56 33.690 5.714 -16.889 1.00 0.00 N ATOM 1880 CA GLU B 56 32.540 4.794 -16.969 1.00 0.00 C ATOM 1881 C GLU B 56 33.044 3.359 -17.122 1.00 0.00 C ATOM 1882 O GLU B 56 32.431 2.415 -16.667 1.00 0.00 O ATOM 1883 CB GLU B 56 31.725 5.210 -18.181 1.00 0.00 C ATOM 1884 CG GLU B 56 30.600 4.203 -18.424 1.00 0.00 C ATOM 1885 CD GLU B 56 31.100 3.095 -19.352 1.00 0.00 C ATOM 1886 OE1 GLU B 56 31.686 3.422 -20.371 1.00 0.00 O ATOM 1887 OE2 GLU B 56 30.891 1.938 -19.027 1.00 0.00 O ATOM 0 H GLU B 56 34.087 5.982 -17.790 1.00 0.00 H new ATOM 0 HA GLU B 56 31.928 4.838 -16.068 1.00 0.00 H new ATOM 0 HB2 GLU B 56 31.307 6.204 -18.025 1.00 0.00 H new ATOM 0 HB3 GLU B 56 32.368 5.269 -19.059 1.00 0.00 H new ATOM 0 HG2 GLU B 56 30.268 3.777 -17.477 1.00 0.00 H new ATOM 0 HG3 GLU B 56 29.739 4.703 -18.868 1.00 0.00 H new ATOM 1894 N TRP B 57 34.161 3.205 -17.762 1.00 0.00 N ATOM 1895 CA TRP B 57 34.748 1.858 -17.967 1.00 0.00 C ATOM 1896 C TRP B 57 35.342 1.333 -16.655 1.00 0.00 C ATOM 1897 O TRP B 57 35.488 0.141 -16.472 1.00 0.00 O ATOM 1898 CB TRP B 57 35.822 1.965 -19.044 1.00 0.00 C ATOM 1899 CG TRP B 57 36.789 3.070 -18.731 1.00 0.00 C ATOM 1900 CD1 TRP B 57 36.622 4.378 -19.033 1.00 0.00 C ATOM 1901 CD2 TRP B 57 38.083 2.972 -18.090 1.00 0.00 C ATOM 1902 NE1 TRP B 57 37.736 5.080 -18.623 1.00 0.00 N ATOM 1903 CE2 TRP B 57 38.668 4.254 -18.038 1.00 0.00 C ATOM 1904 CE3 TRP B 57 38.792 1.898 -17.560 1.00 0.00 C ATOM 1905 CZ2 TRP B 57 39.925 4.460 -17.477 1.00 0.00 C ATOM 1906 CZ3 TRP B 57 40.060 2.090 -16.991 1.00 0.00 C ATOM 1907 CH2 TRP B 57 40.630 3.370 -16.953 1.00 0.00 C ATOM 0 H TRP B 57 34.704 3.971 -18.160 1.00 0.00 H new ATOM 0 HA TRP B 57 33.978 1.155 -18.285 1.00 0.00 H new ATOM 0 HB2 TRP B 57 36.358 1.019 -19.123 1.00 0.00 H new ATOM 0 HB3 TRP B 57 35.355 2.149 -20.012 1.00 0.00 H new ATOM 0 HD1 TRP B 57 35.756 4.804 -19.517 1.00 0.00 H new ATOM 0 HE1 TRP B 57 37.854 6.086 -18.739 1.00 0.00 H new ATOM 0 HE3 TRP B 57 38.362 0.908 -17.587 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 40.352 5.451 -17.446 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 40.599 1.249 -16.581 1.00 0.00 H new ATOM 0 HH2 TRP B 57 41.609 3.515 -16.521 1.00 0.00 H new ATOM 1918 N VAL B 58 35.662 2.199 -15.726 1.00 0.00 N ATOM 1919 CA VAL B 58 36.210 1.704 -14.430 1.00 0.00 C ATOM 1920 C VAL B 58 35.042 1.297 -13.537 1.00 0.00 C ATOM 1921 O VAL B 58 35.166 0.444 -12.683 1.00 0.00 O ATOM 1922 CB VAL B 58 37.021 2.793 -13.727 1.00 0.00 C ATOM 1923 CG1 VAL B 58 37.594 2.223 -12.424 1.00 0.00 C ATOM 1924 CG2 VAL B 58 38.167 3.244 -14.630 1.00 0.00 C ATOM 0 H VAL B 58 35.569 3.211 -15.808 1.00 0.00 H new ATOM 0 HA VAL B 58 36.867 0.856 -14.622 1.00 0.00 H new ATOM 0 HB VAL B 58 36.379 3.646 -13.509 1.00 0.00 H new ATOM 0 HG11 VAL B 58 38.175 2.992 -11.915 1.00 0.00 H new ATOM 0 HG12 VAL B 58 36.778 1.898 -11.779 1.00 0.00 H new ATOM 0 HG13 VAL B 58 38.238 1.373 -12.651 1.00 0.00 H new ATOM 0 HG21 VAL B 58 38.743 4.020 -14.126 1.00 0.00 H new ATOM 0 HG22 VAL B 58 38.815 2.395 -14.848 1.00 0.00 H new ATOM 0 HG23 VAL B 58 37.762 3.640 -15.562 1.00 0.00 H new ATOM 1934 N GLN B 59 33.900 1.899 -13.739 1.00 0.00 N ATOM 1935 CA GLN B 59 32.711 1.542 -12.917 1.00 0.00 C ATOM 1936 C GLN B 59 32.402 0.068 -13.139 1.00 0.00 C ATOM 1937 O GLN B 59 32.007 -0.644 -12.238 1.00 0.00 O ATOM 1938 CB GLN B 59 31.514 2.377 -13.365 1.00 0.00 C ATOM 1939 CG GLN B 59 31.830 3.865 -13.197 1.00 0.00 C ATOM 1940 CD GLN B 59 31.242 4.366 -11.876 1.00 0.00 C ATOM 1941 OE1 GLN B 59 30.091 4.750 -11.817 1.00 0.00 O ATOM 1942 NE2 GLN B 59 31.988 4.376 -10.806 1.00 0.00 N ATOM 0 H GLN B 59 33.741 2.623 -14.439 1.00 0.00 H new ATOM 0 HA GLN B 59 32.911 1.735 -11.863 1.00 0.00 H new ATOM 0 HB2 GLN B 59 31.278 2.161 -14.407 1.00 0.00 H new ATOM 0 HB3 GLN B 59 30.635 2.114 -12.777 1.00 0.00 H new ATOM 0 HG2 GLN B 59 32.909 4.022 -13.210 1.00 0.00 H new ATOM 0 HG3 GLN B 59 31.415 4.432 -14.030 1.00 0.00 H new ATOM 0 HE21 GLN B 59 32.954 4.054 -10.855 1.00 0.00 H new ATOM 0 HE22 GLN B 59 31.605 4.706 -9.920 1.00 0.00 H new ATOM 1951 N LYS B 60 32.592 -0.392 -14.341 1.00 0.00 N ATOM 1952 CA LYS B 60 32.327 -1.819 -14.640 1.00 0.00 C ATOM 1953 C LYS B 60 33.399 -2.662 -13.961 1.00 0.00 C ATOM 1954 O LYS B 60 33.113 -3.685 -13.371 1.00 0.00 O ATOM 1955 CB LYS B 60 32.374 -2.041 -16.155 1.00 0.00 C ATOM 1956 CG LYS B 60 32.400 -3.543 -16.462 1.00 0.00 C ATOM 1957 CD LYS B 60 31.082 -3.956 -17.119 1.00 0.00 C ATOM 1958 CE LYS B 60 30.962 -5.480 -17.105 1.00 0.00 C ATOM 1959 NZ LYS B 60 29.705 -5.874 -16.408 1.00 0.00 N ATOM 0 H LYS B 60 32.921 0.163 -15.131 1.00 0.00 H new ATOM 0 HA LYS B 60 31.342 -2.105 -14.272 1.00 0.00 H new ATOM 0 HB2 LYS B 60 31.506 -1.580 -16.626 1.00 0.00 H new ATOM 0 HB3 LYS B 60 33.258 -1.560 -16.575 1.00 0.00 H new ATOM 0 HG2 LYS B 60 33.235 -3.775 -17.123 1.00 0.00 H new ATOM 0 HG3 LYS B 60 32.553 -4.109 -15.543 1.00 0.00 H new ATOM 0 HD2 LYS B 60 30.242 -3.509 -16.587 1.00 0.00 H new ATOM 0 HD3 LYS B 60 31.043 -3.587 -18.144 1.00 0.00 H new ATOM 0 HE2 LYS B 60 30.961 -5.865 -18.125 1.00 0.00 H new ATOM 0 HE3 LYS B 60 31.823 -5.918 -16.600 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 29.624 -6.911 -16.399 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 29.724 -5.519 -15.431 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 28.889 -5.467 -16.908 1.00 0.00 H new ATOM 1973 N TYR B 61 34.638 -2.258 -14.053 1.00 0.00 N ATOM 1974 CA TYR B 61 35.715 -3.069 -13.415 1.00 0.00 C ATOM 1975 C TYR B 61 35.567 -2.979 -11.897 1.00 0.00 C ATOM 1976 O TYR B 61 36.091 -3.788 -11.157 1.00 0.00 O ATOM 1977 CB TYR B 61 37.100 -2.560 -13.830 1.00 0.00 C ATOM 1978 CG TYR B 61 37.144 -2.240 -15.294 1.00 0.00 C ATOM 1979 CD1 TYR B 61 36.091 -2.577 -16.151 1.00 0.00 C ATOM 1980 CD2 TYR B 61 38.251 -1.569 -15.788 1.00 0.00 C ATOM 1981 CE1 TYR B 61 36.155 -2.236 -17.494 1.00 0.00 C ATOM 1982 CE2 TYR B 61 38.319 -1.238 -17.129 1.00 0.00 C ATOM 1983 CZ TYR B 61 37.271 -1.566 -17.991 1.00 0.00 C ATOM 1984 OH TYR B 61 37.335 -1.224 -19.325 1.00 0.00 O ATOM 0 H TYR B 61 34.948 -1.414 -14.535 1.00 0.00 H new ATOM 0 HA TYR B 61 35.621 -4.105 -13.742 1.00 0.00 H new ATOM 0 HB2 TYR B 61 37.351 -1.670 -13.253 1.00 0.00 H new ATOM 0 HB3 TYR B 61 37.852 -3.314 -13.597 1.00 0.00 H new ATOM 0 HD1 TYR B 61 35.229 -3.102 -15.767 1.00 0.00 H new ATOM 0 HD2 TYR B 61 39.062 -1.304 -15.125 1.00 0.00 H new ATOM 0 HE1 TYR B 61 35.339 -2.490 -18.155 1.00 0.00 H new ATOM 0 HE2 TYR B 61 39.188 -0.723 -17.512 1.00 0.00 H new ATOM 0 HH TYR B 61 38.150 -0.706 -19.491 1.00 0.00 H new ATOM 1994 N VAL B 62 34.840 -2.002 -11.435 1.00 0.00 N ATOM 1995 CA VAL B 62 34.628 -1.842 -9.973 1.00 0.00 C ATOM 1996 C VAL B 62 33.699 -2.951 -9.488 1.00 0.00 C ATOM 1997 O VAL B 62 33.661 -3.269 -8.316 1.00 0.00 O ATOM 1998 CB VAL B 62 33.992 -0.480 -9.695 1.00 0.00 C ATOM 1999 CG1 VAL B 62 33.614 -0.384 -8.215 1.00 0.00 C ATOM 2000 CG2 VAL B 62 34.993 0.625 -10.040 1.00 0.00 C ATOM 0 H VAL B 62 34.379 -1.301 -12.015 1.00 0.00 H new ATOM 0 HA VAL B 62 35.582 -1.903 -9.449 1.00 0.00 H new ATOM 0 HB VAL B 62 33.096 -0.364 -10.304 1.00 0.00 H new ATOM 0 HG11 VAL B 62 33.161 0.587 -8.018 1.00 0.00 H new ATOM 0 HG12 VAL B 62 32.903 -1.173 -7.969 1.00 0.00 H new ATOM 0 HG13 VAL B 62 34.509 -0.498 -7.603 1.00 0.00 H new ATOM 0 HG21 VAL B 62 34.543 1.598 -9.843 1.00 0.00 H new ATOM 0 HG22 VAL B 62 35.888 0.509 -9.429 1.00 0.00 H new ATOM 0 HG23 VAL B 62 35.262 0.556 -11.094 1.00 0.00 H new ATOM 2010 N SER B 63 32.958 -3.554 -10.387 1.00 0.00 N ATOM 2011 CA SER B 63 32.044 -4.659 -9.980 1.00 0.00 C ATOM 2012 C SER B 63 32.800 -5.551 -9.001 1.00 0.00 C ATOM 2013 O SER B 63 32.370 -5.787 -7.889 1.00 0.00 O ATOM 2014 CB SER B 63 31.636 -5.472 -11.210 1.00 0.00 C ATOM 2015 OG SER B 63 31.122 -6.729 -10.793 1.00 0.00 O ATOM 0 H SER B 63 32.949 -3.327 -11.381 1.00 0.00 H new ATOM 0 HA SER B 63 31.144 -4.258 -9.515 1.00 0.00 H new ATOM 0 HB2 SER B 63 30.884 -4.931 -11.784 1.00 0.00 H new ATOM 0 HB3 SER B 63 32.495 -5.617 -11.866 1.00 0.00 H new ATOM 0 HG SER B 63 30.858 -7.252 -11.579 1.00 0.00 H new ATOM 2021 N ASP B 64 33.955 -6.003 -9.396 1.00 0.00 N ATOM 2022 CA ASP B 64 34.784 -6.829 -8.487 1.00 0.00 C ATOM 2023 C ASP B 64 35.731 -5.875 -7.765 1.00 0.00 C ATOM 2024 O ASP B 64 36.871 -5.705 -8.149 1.00 0.00 O ATOM 2025 CB ASP B 64 35.591 -7.840 -9.298 1.00 0.00 C ATOM 2026 CG ASP B 64 34.661 -8.939 -9.817 1.00 0.00 C ATOM 2027 OD1 ASP B 64 33.464 -8.703 -9.857 1.00 0.00 O ATOM 2028 OD2 ASP B 64 35.161 -9.995 -10.164 1.00 0.00 O ATOM 0 H ASP B 64 34.361 -5.833 -10.316 1.00 0.00 H new ATOM 0 HA ASP B 64 34.162 -7.378 -7.779 1.00 0.00 H new ATOM 0 HB2 ASP B 64 36.084 -7.342 -10.133 1.00 0.00 H new ATOM 0 HB3 ASP B 64 36.375 -8.275 -8.679 1.00 0.00 H new ATOM 2033 N LEU B 65 35.246 -5.218 -6.750 1.00 0.00 N ATOM 2034 CA LEU B 65 36.085 -4.233 -6.019 1.00 0.00 C ATOM 2035 C LEU B 65 37.432 -4.839 -5.632 1.00 0.00 C ATOM 2036 O LEU B 65 37.787 -5.924 -6.047 1.00 0.00 O ATOM 2037 CB LEU B 65 35.346 -3.778 -4.771 1.00 0.00 C ATOM 2038 CG LEU B 65 34.032 -3.128 -5.193 1.00 0.00 C ATOM 2039 CD1 LEU B 65 32.898 -3.644 -4.311 1.00 0.00 C ATOM 2040 CD2 LEU B 65 34.153 -1.612 -5.054 1.00 0.00 C ATOM 0 H LEU B 65 34.296 -5.323 -6.393 1.00 0.00 H new ATOM 0 HA LEU B 65 36.274 -3.381 -6.672 1.00 0.00 H new ATOM 0 HB2 LEU B 65 35.154 -4.627 -4.114 1.00 0.00 H new ATOM 0 HB3 LEU B 65 35.954 -3.070 -4.208 1.00 0.00 H new ATOM 0 HG LEU B 65 33.815 -3.379 -6.231 1.00 0.00 H new ATOM 0 HD11 LEU B 65 31.960 -3.178 -4.614 1.00 0.00 H new ATOM 0 HD12 LEU B 65 32.817 -4.726 -4.418 1.00 0.00 H new ATOM 0 HD13 LEU B 65 33.106 -3.397 -3.270 1.00 0.00 H new ATOM 0 HD21 LEU B 65 33.216 -1.143 -5.355 1.00 0.00 H new ATOM 0 HD22 LEU B 65 34.369 -1.358 -4.016 1.00 0.00 H new ATOM 0 HD23 LEU B 65 34.960 -1.251 -5.692 1.00 0.00 H new ATOM 2052 N GLU B 66 38.187 -4.135 -4.837 1.00 0.00 N ATOM 2053 CA GLU B 66 39.516 -4.647 -4.424 1.00 0.00 C ATOM 2054 C GLU B 66 39.350 -5.999 -3.734 1.00 0.00 C ATOM 2055 O GLU B 66 38.295 -6.603 -3.766 1.00 0.00 O ATOM 2056 CB GLU B 66 40.164 -3.648 -3.462 1.00 0.00 C ATOM 2057 CG GLU B 66 40.293 -2.285 -4.150 1.00 0.00 C ATOM 2058 CD GLU B 66 40.206 -1.172 -3.104 1.00 0.00 C ATOM 2059 OE1 GLU B 66 39.372 -1.278 -2.220 1.00 0.00 O ATOM 2060 OE2 GLU B 66 40.976 -0.230 -3.205 1.00 0.00 O ATOM 0 H GLU B 66 37.937 -3.223 -4.455 1.00 0.00 H new ATOM 0 HA GLU B 66 40.152 -4.770 -5.301 1.00 0.00 H new ATOM 0 HB2 GLU B 66 39.562 -3.555 -2.558 1.00 0.00 H new ATOM 0 HB3 GLU B 66 41.147 -4.007 -3.156 1.00 0.00 H new ATOM 0 HG2 GLU B 66 41.242 -2.224 -4.683 1.00 0.00 H new ATOM 0 HG3 GLU B 66 39.503 -2.164 -4.891 1.00 0.00 H new ATOM 2067 N LEU B 67 40.393 -6.476 -3.120 1.00 0.00 N ATOM 2068 CA LEU B 67 40.324 -7.795 -2.422 1.00 0.00 C ATOM 2069 C LEU B 67 38.985 -7.930 -1.695 1.00 0.00 C ATOM 2070 O LEU B 67 38.274 -8.901 -1.862 1.00 0.00 O ATOM 2071 CB LEU B 67 41.467 -7.893 -1.409 1.00 0.00 C ATOM 2072 CG LEU B 67 41.813 -9.364 -1.166 1.00 0.00 C ATOM 2073 CD1 LEU B 67 43.324 -9.507 -0.981 1.00 0.00 C ATOM 2074 CD2 LEU B 67 41.100 -9.853 0.097 1.00 0.00 C ATOM 0 H LEU B 67 41.298 -6.009 -3.069 1.00 0.00 H new ATOM 0 HA LEU B 67 40.414 -8.596 -3.156 1.00 0.00 H new ATOM 0 HB2 LEU B 67 42.342 -7.360 -1.780 1.00 0.00 H new ATOM 0 HB3 LEU B 67 41.178 -7.417 -0.472 1.00 0.00 H new ATOM 0 HG LEU B 67 41.491 -9.959 -2.021 1.00 0.00 H new ATOM 0 HD11 LEU B 67 43.572 -10.554 -0.808 1.00 0.00 H new ATOM 0 HD12 LEU B 67 43.835 -9.157 -1.878 1.00 0.00 H new ATOM 0 HD13 LEU B 67 43.644 -8.912 -0.125 1.00 0.00 H new ATOM 0 HD21 LEU B 67 41.346 -10.901 0.271 1.00 0.00 H new ATOM 0 HD22 LEU B 67 41.423 -9.258 0.951 1.00 0.00 H new ATOM 0 HD23 LEU B 67 40.022 -9.749 -0.030 1.00 0.00 H new ATOM 2086 N SER B 68 38.634 -6.966 -0.889 1.00 0.00 N ATOM 2087 CA SER B 68 37.340 -7.046 -0.154 1.00 0.00 C ATOM 2088 C SER B 68 36.890 -5.640 0.249 1.00 0.00 C ATOM 2089 O SER B 68 37.689 -4.733 0.377 1.00 0.00 O ATOM 2090 CB SER B 68 37.516 -7.904 1.099 1.00 0.00 C ATOM 2091 OG SER B 68 37.301 -9.270 0.765 1.00 0.00 O ATOM 0 H SER B 68 39.186 -6.128 -0.708 1.00 0.00 H new ATOM 0 HA SER B 68 36.586 -7.496 -0.799 1.00 0.00 H new ATOM 0 HB2 SER B 68 38.518 -7.771 1.508 1.00 0.00 H new ATOM 0 HB3 SER B 68 36.812 -7.591 1.870 1.00 0.00 H new ATOM 0 HG SER B 68 37.574 -9.427 -0.163 1.00 0.00 H new ATOM 2097 N ALA B 69 35.613 -5.453 0.449 1.00 0.00 N ATOM 2098 CA ALA B 69 35.109 -4.108 0.843 1.00 0.00 C ATOM 2099 C ALA B 69 33.887 -4.269 1.750 1.00 0.00 C ATOM 2100 O ALA B 69 33.112 -3.330 1.841 1.00 0.00 O ATOM 2101 CB ALA B 69 34.712 -3.326 -0.411 1.00 0.00 C ATOM 2102 OXT ALA B 69 33.747 -5.328 2.339 1.00 0.00 O ATOM 0 H ALA B 69 34.898 -6.174 0.356 1.00 0.00 H new ATOM 0 HA ALA B 69 35.891 -3.568 1.377 1.00 0.00 H new ATOM 0 HB1 ALA B 69 34.343 -2.341 -0.124 1.00 0.00 H new ATOM 0 HB2 ALA B 69 35.581 -3.213 -1.060 1.00 0.00 H new ATOM 0 HB3 ALA B 69 33.929 -3.866 -0.944 1.00 0.00 H new TER 2108 ALA B 69