USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 900 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 75 GLN : amide:sc=-0.00215 X(o=-0.24,f=-0.24) USER MOD Set 1.2: A 93 ASN : amide:sc= -0.235 K(o=-0.24,f=-2.5!) USER MOD Set 2.1: A 9 SER OG : rot 180:sc= 0.143 USER MOD Set 2.2: A 11 LYS NZ :NH3+ -160:sc= 0.145 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -171:sc= -0.0239 (180deg=-0.118) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc=-0.00416 USER MOD Single : A 12 TYR OH : rot 130:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.794 USER MOD Single : A 18 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ -140:sc= -0.0165 (180deg=-0.578) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= -0.151 X(o=-0.15,f=0) USER MOD Single : A 33 GLN : amide:sc= -2.36 K(o=-2.4,f=-3.6!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN :FLIP amide:sc= -2.31! F(o=-3.8,f=-2.3!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 168:sc= 0.259 USER MOD Single : A 53 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00243) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= -0.246 K(o=-0.25,f=-1.5!) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0393 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -0.332 X(o=-0.33,f=-0.42) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= -0.0198 X(o=-0.02,f=-0.0012) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -176:sc= -0.0499 (180deg=-0.125) USER MOD Single : A 83 LYS NZ :NH3+ -116:sc= -0.779 (180deg=-3.67!) USER MOD Single : A 89 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0842) USER MOD Single : A 91 ASN : amide:sc= -1.27 K(o=-1.3,f=-4.9!) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0.32) USER MOD Single : A 101 LYS NZ :NH3+ 173:sc= 0.29 (180deg=0.235) USER MOD Single : A 102 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0829) USER MOD Single : A 104 TYR OH : rot 36:sc= 0.0652 USER MOD Single : A 106 LYS NZ :NH3+ 179:sc= -0.659 (180deg=-0.68) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot -13:sc= 0.692 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.194 21.284 -5.398 1.00 0.00 N ATOM 2 CA GLY A 1 20.217 22.407 -5.393 1.00 0.00 C ATOM 3 C GLY A 1 18.783 21.931 -5.517 1.00 0.00 C ATOM 4 O GLY A 1 17.862 22.577 -5.017 1.00 0.00 O ATOM 0 H1 GLY A 1 22.140 21.645 -5.159 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.908 20.572 -4.696 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.218 20.849 -6.342 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.329 22.977 -4.471 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.444 23.085 -6.216 1.00 0.00 H new ATOM 10 N SER A 2 18.594 20.797 -6.184 1.00 0.00 N ATOM 11 CA SER A 2 17.262 20.235 -6.372 1.00 0.00 C ATOM 12 C SER A 2 16.687 19.744 -5.047 1.00 0.00 C ATOM 13 O SER A 2 17.301 19.909 -3.993 1.00 0.00 O ATOM 14 CB SER A 2 17.309 19.083 -7.377 1.00 0.00 C ATOM 15 OG SER A 2 18.033 17.980 -6.857 1.00 0.00 O ATOM 0 H SER A 2 19.346 20.250 -6.603 1.00 0.00 H new ATOM 0 HA SER A 2 16.615 21.021 -6.760 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.294 18.771 -7.625 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.773 19.423 -8.303 1.00 0.00 H new ATOM 0 HG SER A 2 18.047 17.257 -7.518 1.00 0.00 H new ATOM 21 N SER A 3 15.503 19.142 -5.108 1.00 0.00 N ATOM 22 CA SER A 3 14.846 18.628 -3.913 1.00 0.00 C ATOM 23 C SER A 3 15.432 17.280 -3.506 1.00 0.00 C ATOM 24 O SER A 3 15.773 16.458 -4.356 1.00 0.00 O ATOM 25 CB SER A 3 13.341 18.491 -4.154 1.00 0.00 C ATOM 26 OG SER A 3 13.053 17.356 -4.953 1.00 0.00 O ATOM 0 H SER A 3 14.980 18.999 -5.972 1.00 0.00 H new ATOM 0 HA SER A 3 15.015 19.336 -3.102 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.823 18.408 -3.199 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.965 19.389 -4.644 1.00 0.00 H new ATOM 0 HG SER A 3 12.085 17.290 -5.091 1.00 0.00 H new ATOM 32 N GLY A 4 15.546 17.061 -2.200 1.00 0.00 N ATOM 33 CA GLY A 4 16.093 15.811 -1.704 1.00 0.00 C ATOM 34 C GLY A 4 15.035 14.736 -1.550 1.00 0.00 C ATOM 35 O GLY A 4 14.942 13.825 -2.373 1.00 0.00 O ATOM 0 H GLY A 4 15.270 17.726 -1.477 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.867 15.460 -2.387 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.573 15.985 -0.741 1.00 0.00 H new ATOM 39 N SER A 5 14.237 14.841 -0.493 1.00 0.00 N ATOM 40 CA SER A 5 13.180 13.870 -0.233 1.00 0.00 C ATOM 41 C SER A 5 11.841 14.566 -0.015 1.00 0.00 C ATOM 42 O SER A 5 10.952 14.505 -0.864 1.00 0.00 O ATOM 43 CB SER A 5 13.530 13.019 0.989 1.00 0.00 C ATOM 44 OG SER A 5 14.219 11.839 0.609 1.00 0.00 O ATOM 0 H SER A 5 14.302 15.589 0.198 1.00 0.00 H new ATOM 0 HA SER A 5 13.094 13.223 -1.106 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.147 13.599 1.675 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.619 12.755 1.525 1.00 0.00 H new ATOM 0 HG SER A 5 14.433 11.313 1.408 1.00 0.00 H new ATOM 50 N SER A 6 11.704 15.228 1.130 1.00 0.00 N ATOM 51 CA SER A 6 10.473 15.937 1.459 1.00 0.00 C ATOM 52 C SER A 6 9.289 14.978 1.505 1.00 0.00 C ATOM 53 O SER A 6 8.548 14.843 0.531 1.00 0.00 O ATOM 54 CB SER A 6 10.208 17.044 0.438 1.00 0.00 C ATOM 55 OG SER A 6 8.892 17.555 0.569 1.00 0.00 O ATOM 0 H SER A 6 12.430 15.288 1.844 1.00 0.00 H new ATOM 0 HA SER A 6 10.594 16.384 2.446 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.929 17.850 0.575 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.352 16.655 -0.570 1.00 0.00 H new ATOM 0 HG SER A 6 8.748 18.262 -0.094 1.00 0.00 H new ATOM 61 N GLY A 7 9.116 14.313 2.643 1.00 0.00 N ATOM 62 CA GLY A 7 8.020 13.374 2.794 1.00 0.00 C ATOM 63 C GLY A 7 8.384 12.196 3.677 1.00 0.00 C ATOM 64 O GLY A 7 9.547 12.015 4.035 1.00 0.00 O ATOM 0 H GLY A 7 9.715 14.408 3.463 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.159 13.890 3.219 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.720 13.009 1.812 1.00 0.00 H new ATOM 68 N ILE A 8 7.385 11.392 4.028 1.00 0.00 N ATOM 69 CA ILE A 8 7.604 10.225 4.874 1.00 0.00 C ATOM 70 C ILE A 8 7.032 8.966 4.231 1.00 0.00 C ATOM 71 O ILE A 8 6.111 9.037 3.418 1.00 0.00 O ATOM 72 CB ILE A 8 6.970 10.412 6.267 1.00 0.00 C ATOM 73 CG1 ILE A 8 7.405 11.745 6.877 1.00 0.00 C ATOM 74 CG2 ILE A 8 7.349 9.256 7.182 1.00 0.00 C ATOM 75 CD1 ILE A 8 6.288 12.477 7.590 1.00 0.00 C ATOM 0 H ILE A 8 6.416 11.528 3.739 1.00 0.00 H new ATOM 0 HA ILE A 8 8.682 10.114 4.987 1.00 0.00 H new ATOM 0 HB ILE A 8 5.886 10.422 6.156 1.00 0.00 H new ATOM 0 HG12 ILE A 8 8.218 11.565 7.581 1.00 0.00 H new ATOM 0 HG13 ILE A 8 7.802 12.384 6.088 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.894 9.403 8.161 1.00 0.00 H new ATOM 0 HG22 ILE A 8 6.992 8.320 6.753 1.00 0.00 H new ATOM 0 HG23 ILE A 8 8.433 9.216 7.288 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.669 13.413 7.998 1.00 0.00 H new ATOM 0 HD12 ILE A 8 5.484 12.688 6.885 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.906 11.857 8.401 1.00 0.00 H new ATOM 87 N SER A 9 7.583 7.815 4.602 1.00 0.00 N ATOM 88 CA SER A 9 7.126 6.540 4.061 1.00 0.00 C ATOM 89 C SER A 9 7.417 5.400 5.033 1.00 0.00 C ATOM 90 O SER A 9 8.221 5.547 5.954 1.00 0.00 O ATOM 91 CB SER A 9 7.800 6.263 2.716 1.00 0.00 C ATOM 92 OG SER A 9 9.169 5.938 2.888 1.00 0.00 O ATOM 0 H SER A 9 8.346 7.739 5.275 1.00 0.00 H new ATOM 0 HA SER A 9 6.048 6.601 3.914 1.00 0.00 H new ATOM 0 HB2 SER A 9 7.289 5.443 2.212 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.709 7.138 2.073 1.00 0.00 H new ATOM 0 HG SER A 9 9.576 5.764 2.014 1.00 0.00 H new ATOM 98 N LEU A 10 6.757 4.267 4.821 1.00 0.00 N ATOM 99 CA LEU A 10 6.945 3.101 5.678 1.00 0.00 C ATOM 100 C LEU A 10 8.112 2.249 5.190 1.00 0.00 C ATOM 101 O LEU A 10 8.457 2.269 4.009 1.00 0.00 O ATOM 102 CB LEU A 10 5.667 2.261 5.719 1.00 0.00 C ATOM 103 CG LEU A 10 4.654 2.676 6.787 1.00 0.00 C ATOM 104 CD1 LEU A 10 3.306 2.021 6.527 1.00 0.00 C ATOM 105 CD2 LEU A 10 5.165 2.315 8.174 1.00 0.00 C ATOM 0 H LEU A 10 6.087 4.131 4.064 1.00 0.00 H new ATOM 0 HA LEU A 10 7.172 3.454 6.684 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.185 2.313 4.743 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.940 1.219 5.885 1.00 0.00 H new ATOM 0 HG LEU A 10 4.525 3.757 6.738 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.598 2.328 7.297 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.935 2.328 5.549 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.418 0.937 6.548 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.432 2.617 8.922 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.323 1.238 8.235 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.107 2.831 8.360 1.00 0.00 H new ATOM 117 N LYS A 11 8.717 1.502 6.109 1.00 0.00 N ATOM 118 CA LYS A 11 9.845 0.641 5.772 1.00 0.00 C ATOM 119 C LYS A 11 9.655 -0.756 6.352 1.00 0.00 C ATOM 120 O LYS A 11 9.611 -0.933 7.569 1.00 0.00 O ATOM 121 CB LYS A 11 11.149 1.249 6.291 1.00 0.00 C ATOM 122 CG LYS A 11 11.350 2.699 5.884 1.00 0.00 C ATOM 123 CD LYS A 11 11.421 2.850 4.372 1.00 0.00 C ATOM 124 CE LYS A 11 12.539 3.794 3.957 1.00 0.00 C ATOM 125 NZ LYS A 11 12.103 5.218 3.988 1.00 0.00 N ATOM 0 H LYS A 11 8.445 1.476 7.092 1.00 0.00 H new ATOM 0 HA LYS A 11 9.897 0.559 4.686 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.164 1.181 7.379 1.00 0.00 H new ATOM 0 HB3 LYS A 11 11.987 0.658 5.923 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.531 3.304 6.273 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.268 3.080 6.332 1.00 0.00 H new ATOM 0 HD2 LYS A 11 11.580 1.873 3.915 1.00 0.00 H new ATOM 0 HD3 LYS A 11 10.469 3.226 3.998 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.392 3.661 4.622 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.875 3.539 2.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 12.740 5.789 3.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 11.132 5.292 3.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 12.131 5.569 4.967 1.00 0.00 H new ATOM 139 N TYR A 12 9.545 -1.747 5.472 1.00 0.00 N ATOM 140 CA TYR A 12 9.361 -3.129 5.899 1.00 0.00 C ATOM 141 C TYR A 12 10.020 -4.093 4.917 1.00 0.00 C ATOM 142 O TYR A 12 9.924 -3.918 3.702 1.00 0.00 O ATOM 143 CB TYR A 12 7.871 -3.451 6.029 1.00 0.00 C ATOM 144 CG TYR A 12 7.277 -3.033 7.356 1.00 0.00 C ATOM 145 CD1 TYR A 12 7.495 -3.784 8.503 1.00 0.00 C ATOM 146 CD2 TYR A 12 6.499 -1.886 7.460 1.00 0.00 C ATOM 147 CE1 TYR A 12 6.954 -3.406 9.718 1.00 0.00 C ATOM 148 CE2 TYR A 12 5.955 -1.501 8.671 1.00 0.00 C ATOM 149 CZ TYR A 12 6.185 -2.264 9.796 1.00 0.00 C ATOM 150 OH TYR A 12 5.646 -1.884 11.003 1.00 0.00 O ATOM 0 H TYR A 12 9.580 -1.618 4.461 1.00 0.00 H new ATOM 0 HA TYR A 12 9.836 -3.250 6.872 1.00 0.00 H new ATOM 0 HB2 TYR A 12 7.329 -2.954 5.225 1.00 0.00 H new ATOM 0 HB3 TYR A 12 7.726 -4.523 5.897 1.00 0.00 H new ATOM 0 HD1 TYR A 12 8.097 -4.679 8.445 1.00 0.00 H new ATOM 0 HD2 TYR A 12 6.317 -1.286 6.581 1.00 0.00 H new ATOM 0 HE1 TYR A 12 7.133 -4.002 10.601 1.00 0.00 H new ATOM 0 HE2 TYR A 12 5.353 -0.607 8.736 1.00 0.00 H new ATOM 0 HH TYR A 12 5.850 -0.940 11.170 1.00 0.00 H new ATOM 160 N THR A 13 10.689 -5.108 5.453 1.00 0.00 N ATOM 161 CA THR A 13 11.367 -6.099 4.624 1.00 0.00 C ATOM 162 C THR A 13 10.483 -7.322 4.404 1.00 0.00 C ATOM 163 O THR A 13 9.556 -7.577 5.173 1.00 0.00 O ATOM 164 CB THR A 13 12.687 -6.519 5.272 1.00 0.00 C ATOM 165 OG1 THR A 13 12.527 -6.690 6.669 1.00 0.00 O ATOM 166 CG2 THR A 13 13.804 -5.522 5.056 1.00 0.00 C ATOM 0 H THR A 13 10.777 -5.266 6.457 1.00 0.00 H new ATOM 0 HA THR A 13 11.574 -5.645 3.655 1.00 0.00 H new ATOM 0 HB THR A 13 12.961 -7.456 4.788 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.382 -6.960 7.065 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.711 -5.881 5.541 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.986 -5.405 3.988 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.521 -4.560 5.483 1.00 0.00 H new ATOM 174 N ALA A 14 10.778 -8.076 3.350 1.00 0.00 N ATOM 175 CA ALA A 14 10.010 -9.274 3.028 1.00 0.00 C ATOM 176 C ALA A 14 10.048 -10.277 4.177 1.00 0.00 C ATOM 177 O ALA A 14 9.029 -10.872 4.527 1.00 0.00 O ATOM 178 CB ALA A 14 10.539 -9.911 1.752 1.00 0.00 C ATOM 0 H ALA A 14 11.543 -7.879 2.705 1.00 0.00 H new ATOM 0 HA ALA A 14 8.972 -8.980 2.872 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.957 -10.804 1.523 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.454 -9.202 0.929 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.585 -10.185 1.889 1.00 0.00 H new ATOM 184 N ALA A 15 11.229 -10.459 4.758 1.00 0.00 N ATOM 185 CA ALA A 15 11.399 -11.390 5.867 1.00 0.00 C ATOM 186 C ALA A 15 10.637 -10.920 7.102 1.00 0.00 C ATOM 187 O ALA A 15 10.170 -11.730 7.901 1.00 0.00 O ATOM 188 CB ALA A 15 12.875 -11.563 6.189 1.00 0.00 C ATOM 0 H ALA A 15 12.082 -9.974 4.479 1.00 0.00 H new ATOM 0 HA ALA A 15 10.989 -12.354 5.565 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.987 -12.261 7.019 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.395 -11.953 5.314 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.303 -10.599 6.465 1.00 0.00 H new ATOM 194 N ARG A 16 10.515 -9.604 7.249 1.00 0.00 N ATOM 195 CA ARG A 16 9.809 -9.025 8.386 1.00 0.00 C ATOM 196 C ARG A 16 8.318 -9.339 8.317 1.00 0.00 C ATOM 197 O ARG A 16 7.712 -9.740 9.310 1.00 0.00 O ATOM 198 CB ARG A 16 10.022 -7.511 8.428 1.00 0.00 C ATOM 199 CG ARG A 16 9.527 -6.862 9.711 1.00 0.00 C ATOM 200 CD ARG A 16 10.265 -7.392 10.929 1.00 0.00 C ATOM 201 NE ARG A 16 10.932 -6.326 11.673 1.00 0.00 N ATOM 202 CZ ARG A 16 11.347 -6.448 12.932 1.00 0.00 C ATOM 203 NH1 ARG A 16 11.167 -7.585 13.591 1.00 0.00 N ATOM 204 NH2 ARG A 16 11.944 -5.428 13.533 1.00 0.00 N ATOM 0 H ARG A 16 10.896 -8.920 6.595 1.00 0.00 H new ATOM 0 HA ARG A 16 10.213 -9.467 9.297 1.00 0.00 H new ATOM 0 HB2 ARG A 16 11.085 -7.299 8.310 1.00 0.00 H new ATOM 0 HB3 ARG A 16 9.510 -7.057 7.580 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.659 -5.782 9.647 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.459 -7.047 9.824 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.561 -7.905 11.584 1.00 0.00 H new ATOM 0 HD3 ARG A 16 11.003 -8.130 10.613 1.00 0.00 H new ATOM 0 HE ARG A 16 11.089 -5.436 11.200 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.708 -8.373 13.133 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.487 -7.672 14.555 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.085 -4.551 13.031 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.263 -5.520 14.498 1.00 0.00 H new ATOM 218 N LEU A 17 7.733 -9.154 7.138 1.00 0.00 N ATOM 219 CA LEU A 17 6.313 -9.418 6.940 1.00 0.00 C ATOM 220 C LEU A 17 6.022 -10.913 7.017 1.00 0.00 C ATOM 221 O LEU A 17 4.962 -11.326 7.486 1.00 0.00 O ATOM 222 CB LEU A 17 5.853 -8.867 5.589 1.00 0.00 C ATOM 223 CG LEU A 17 5.848 -7.341 5.480 1.00 0.00 C ATOM 224 CD1 LEU A 17 5.724 -6.910 4.027 1.00 0.00 C ATOM 225 CD2 LEU A 17 4.719 -6.752 6.311 1.00 0.00 C ATOM 0 H LEU A 17 8.220 -8.822 6.306 1.00 0.00 H new ATOM 0 HA LEU A 17 5.762 -8.917 7.736 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.501 -9.270 4.810 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.846 -9.234 5.388 1.00 0.00 H new ATOM 0 HG LEU A 17 6.794 -6.965 5.869 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.722 -5.822 3.969 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.567 -7.302 3.458 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.794 -7.297 3.611 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.730 -5.666 6.222 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.764 -7.136 5.952 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.852 -7.032 7.356 1.00 0.00 H new ATOM 237 N HIS A 18 6.971 -11.720 6.554 1.00 0.00 N ATOM 238 CA HIS A 18 6.818 -13.170 6.571 1.00 0.00 C ATOM 239 C HIS A 18 6.682 -13.686 8.000 1.00 0.00 C ATOM 240 O HIS A 18 5.820 -14.515 8.291 1.00 0.00 O ATOM 241 CB HIS A 18 8.012 -13.837 5.886 1.00 0.00 C ATOM 242 CG HIS A 18 7.863 -15.319 5.735 1.00 0.00 C ATOM 243 ND1 HIS A 18 8.902 -16.204 5.933 1.00 0.00 N ATOM 244 CD2 HIS A 18 6.788 -16.072 5.403 1.00 0.00 C ATOM 245 CE1 HIS A 18 8.473 -17.436 5.728 1.00 0.00 C ATOM 246 NE2 HIS A 18 7.194 -17.384 5.407 1.00 0.00 N ATOM 0 H HIS A 18 7.855 -11.394 6.162 1.00 0.00 H new ATOM 0 HA HIS A 18 5.908 -13.421 6.026 1.00 0.00 H new ATOM 0 HB2 HIS A 18 8.151 -13.392 4.901 1.00 0.00 H new ATOM 0 HB3 HIS A 18 8.914 -13.627 6.461 1.00 0.00 H new ATOM 0 HD2 HIS A 18 5.796 -15.709 5.177 1.00 0.00 H new ATOM 0 HE1 HIS A 18 9.068 -18.334 5.809 1.00 0.00 H new ATOM 0 HE2 HIS A 18 6.603 -18.188 5.196 1.00 0.00 H new ATOM 255 N GLU A 19 7.539 -13.190 8.886 1.00 0.00 N ATOM 256 CA GLU A 19 7.515 -13.601 10.285 1.00 0.00 C ATOM 257 C GLU A 19 6.227 -13.147 10.962 1.00 0.00 C ATOM 258 O GLU A 19 5.620 -13.893 11.731 1.00 0.00 O ATOM 259 CB GLU A 19 8.725 -13.030 11.027 1.00 0.00 C ATOM 260 CG GLU A 19 10.054 -13.587 10.544 1.00 0.00 C ATOM 261 CD GLU A 19 10.305 -15.000 11.031 1.00 0.00 C ATOM 262 OE1 GLU A 19 10.810 -15.157 12.163 1.00 0.00 O ATOM 263 OE2 GLU A 19 9.997 -15.950 10.281 1.00 0.00 O ATOM 0 H GLU A 19 8.259 -12.503 8.660 1.00 0.00 H new ATOM 0 HA GLU A 19 7.558 -14.690 10.319 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.732 -11.946 10.913 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.619 -13.238 12.092 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.075 -13.573 9.454 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.861 -12.940 10.887 1.00 0.00 H new ATOM 270 N LYS A 20 5.814 -11.916 10.673 1.00 0.00 N ATOM 271 CA LYS A 20 4.598 -11.361 11.254 1.00 0.00 C ATOM 272 C LYS A 20 3.372 -12.157 10.815 1.00 0.00 C ATOM 273 O LYS A 20 2.392 -12.262 11.552 1.00 0.00 O ATOM 274 CB LYS A 20 4.439 -9.894 10.851 1.00 0.00 C ATOM 275 CG LYS A 20 5.558 -8.999 11.359 1.00 0.00 C ATOM 276 CD LYS A 20 5.562 -7.653 10.650 1.00 0.00 C ATOM 277 CE LYS A 20 5.723 -6.505 11.633 1.00 0.00 C ATOM 278 NZ LYS A 20 7.080 -6.483 12.247 1.00 0.00 N ATOM 0 H LYS A 20 6.305 -11.285 10.040 1.00 0.00 H new ATOM 0 HA LYS A 20 4.681 -11.426 12.339 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.397 -9.827 9.764 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.487 -9.523 11.231 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.444 -8.846 12.432 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.518 -9.494 11.208 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.373 -7.627 9.922 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.632 -7.530 10.095 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.542 -5.560 11.120 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.971 -6.591 12.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.001 -6.241 13.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 7.521 -7.420 12.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 7.667 -5.772 11.766 1.00 0.00 H new ATOM 292 N GLY A 21 3.436 -12.715 9.610 1.00 0.00 N ATOM 293 CA GLY A 21 2.324 -13.494 9.095 1.00 0.00 C ATOM 294 C GLY A 21 1.673 -12.852 7.884 1.00 0.00 C ATOM 295 O GLY A 21 0.989 -13.524 7.111 1.00 0.00 O ATOM 0 H GLY A 21 4.236 -12.642 8.982 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.676 -14.490 8.828 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.578 -13.619 9.880 1.00 0.00 H new ATOM 299 N VAL A 22 1.884 -11.549 7.716 1.00 0.00 N ATOM 300 CA VAL A 22 1.312 -10.819 6.591 1.00 0.00 C ATOM 301 C VAL A 22 1.712 -11.451 5.261 1.00 0.00 C ATOM 302 O VAL A 22 0.870 -11.986 4.540 1.00 0.00 O ATOM 303 CB VAL A 22 1.751 -9.344 6.598 1.00 0.00 C ATOM 304 CG1 VAL A 22 0.989 -8.553 5.545 1.00 0.00 C ATOM 305 CG2 VAL A 22 1.556 -8.734 7.978 1.00 0.00 C ATOM 0 H VAL A 22 2.447 -10.978 8.346 1.00 0.00 H new ATOM 0 HA VAL A 22 0.229 -10.869 6.701 1.00 0.00 H new ATOM 0 HB VAL A 22 2.812 -9.300 6.354 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.314 -7.513 5.566 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.186 -8.975 4.560 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.080 -8.604 5.754 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.872 -7.691 7.963 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.503 -8.790 8.255 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.153 -9.283 8.706 1.00 0.00 H new ATOM 315 N LEU A 23 3.000 -11.383 4.944 1.00 0.00 N ATOM 316 CA LEU A 23 3.511 -11.947 3.700 1.00 0.00 C ATOM 317 C LEU A 23 3.499 -13.472 3.749 1.00 0.00 C ATOM 318 O LEU A 23 3.670 -14.070 4.811 1.00 0.00 O ATOM 319 CB LEU A 23 4.931 -11.445 3.431 1.00 0.00 C ATOM 320 CG LEU A 23 5.371 -11.499 1.967 1.00 0.00 C ATOM 321 CD1 LEU A 23 4.989 -10.215 1.248 1.00 0.00 C ATOM 322 CD2 LEU A 23 6.869 -11.741 1.871 1.00 0.00 C ATOM 0 H LEU A 23 3.709 -10.943 5.531 1.00 0.00 H new ATOM 0 HA LEU A 23 2.859 -11.622 2.889 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.008 -10.415 3.780 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.628 -12.036 4.026 1.00 0.00 H new ATOM 0 HG LEU A 23 4.857 -12.329 1.482 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.310 -10.271 0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.908 -10.084 1.288 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.475 -9.368 1.732 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.165 -11.777 0.823 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.401 -10.932 2.371 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.116 -12.688 2.350 1.00 0.00 H new ATOM 334 N LEU A 24 3.294 -14.096 2.593 1.00 0.00 N ATOM 335 CA LEU A 24 3.260 -15.551 2.506 1.00 0.00 C ATOM 336 C LEU A 24 4.529 -16.088 1.853 1.00 0.00 C ATOM 337 O LEU A 24 5.333 -16.761 2.498 1.00 0.00 O ATOM 338 CB LEU A 24 2.032 -16.006 1.712 1.00 0.00 C ATOM 339 CG LEU A 24 0.709 -15.380 2.154 1.00 0.00 C ATOM 340 CD1 LEU A 24 -0.227 -15.215 0.966 1.00 0.00 C ATOM 341 CD2 LEU A 24 0.055 -16.227 3.236 1.00 0.00 C ATOM 0 H LEU A 24 3.149 -13.617 1.704 1.00 0.00 H new ATOM 0 HA LEU A 24 3.199 -15.949 3.519 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.192 -15.774 0.659 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.948 -17.090 1.791 1.00 0.00 H new ATOM 0 HG LEU A 24 0.916 -14.393 2.567 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.163 -14.768 1.300 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.239 -14.568 0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.428 -16.190 0.523 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.886 -15.767 3.539 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.139 -17.227 2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 24 0.720 -16.294 4.097 1.00 0.00 H new ATOM 353 N GLU A 25 4.704 -15.786 0.570 1.00 0.00 N ATOM 354 CA GLU A 25 5.877 -16.239 -0.169 1.00 0.00 C ATOM 355 C GLU A 25 6.094 -15.388 -1.416 1.00 0.00 C ATOM 356 O GLU A 25 5.307 -14.490 -1.713 1.00 0.00 O ATOM 357 CB GLU A 25 5.723 -17.710 -0.561 1.00 0.00 C ATOM 358 CG GLU A 25 5.897 -18.671 0.605 1.00 0.00 C ATOM 359 CD GLU A 25 6.127 -20.099 0.152 1.00 0.00 C ATOM 360 OE1 GLU A 25 7.218 -20.383 -0.386 1.00 0.00 O ATOM 361 OE2 GLU A 25 5.217 -20.935 0.336 1.00 0.00 O ATOM 0 H GLU A 25 4.049 -15.230 0.021 1.00 0.00 H new ATOM 0 HA GLU A 25 6.748 -16.133 0.478 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.737 -17.859 -1.000 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.455 -17.951 -1.332 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.740 -18.347 1.216 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.011 -18.633 1.238 1.00 0.00 H new ATOM 368 N ILE A 26 7.168 -15.678 -2.142 1.00 0.00 N ATOM 369 CA ILE A 26 7.490 -14.941 -3.358 1.00 0.00 C ATOM 370 C ILE A 26 7.887 -15.888 -4.486 1.00 0.00 C ATOM 371 O ILE A 26 8.903 -16.578 -4.402 1.00 0.00 O ATOM 372 CB ILE A 26 8.634 -13.936 -3.120 1.00 0.00 C ATOM 373 CG1 ILE A 26 8.351 -13.094 -1.874 1.00 0.00 C ATOM 374 CG2 ILE A 26 8.817 -13.044 -4.339 1.00 0.00 C ATOM 375 CD1 ILE A 26 9.512 -12.216 -1.462 1.00 0.00 C ATOM 0 H ILE A 26 7.830 -16.418 -1.909 1.00 0.00 H new ATOM 0 HA ILE A 26 6.591 -14.395 -3.644 1.00 0.00 H new ATOM 0 HB ILE A 26 9.558 -14.491 -2.958 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.479 -12.466 -2.060 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.096 -13.757 -1.047 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.628 -12.340 -4.156 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.059 -13.658 -5.206 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.895 -12.494 -4.529 1.00 0.00 H new ATOM 0 HD11 ILE A 26 9.241 -11.648 -0.572 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.380 -12.839 -1.244 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.753 -11.528 -2.272 1.00 0.00 H new ATOM 387 N GLU A 27 7.078 -15.916 -5.540 1.00 0.00 N ATOM 388 CA GLU A 27 7.344 -16.779 -6.685 1.00 0.00 C ATOM 389 C GLU A 27 8.486 -16.224 -7.531 1.00 0.00 C ATOM 390 O GLU A 27 8.277 -15.780 -8.660 1.00 0.00 O ATOM 391 CB GLU A 27 6.083 -16.930 -7.539 1.00 0.00 C ATOM 392 CG GLU A 27 5.112 -17.973 -7.011 1.00 0.00 C ATOM 393 CD GLU A 27 5.539 -19.389 -7.343 1.00 0.00 C ATOM 394 OE1 GLU A 27 5.567 -19.735 -8.543 1.00 0.00 O ATOM 395 OE2 GLU A 27 5.847 -20.152 -6.404 1.00 0.00 O ATOM 0 H GLU A 27 6.233 -15.351 -5.625 1.00 0.00 H new ATOM 0 HA GLU A 27 7.639 -17.759 -6.311 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.575 -15.967 -7.595 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.372 -17.197 -8.555 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.025 -17.868 -5.930 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.123 -17.788 -7.430 1.00 0.00 H new ATOM 402 N ASP A 28 9.693 -16.251 -6.976 1.00 0.00 N ATOM 403 CA ASP A 28 10.869 -15.751 -7.679 1.00 0.00 C ATOM 404 C ASP A 28 12.132 -15.967 -6.850 1.00 0.00 C ATOM 405 O ASP A 28 13.088 -16.590 -7.310 1.00 0.00 O ATOM 406 CB ASP A 28 10.705 -14.265 -7.999 1.00 0.00 C ATOM 407 CG ASP A 28 11.583 -13.821 -9.153 1.00 0.00 C ATOM 408 OD1 ASP A 28 11.253 -14.151 -10.312 1.00 0.00 O ATOM 409 OD2 ASP A 28 12.601 -13.145 -8.898 1.00 0.00 O ATOM 0 H ASP A 28 9.883 -16.614 -6.042 1.00 0.00 H new ATOM 0 HA ASP A 28 10.967 -16.308 -8.611 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.662 -14.061 -8.241 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.948 -13.677 -7.114 1.00 0.00 H new ATOM 414 N LEU A 29 12.127 -15.448 -5.627 1.00 0.00 N ATOM 415 CA LEU A 29 13.273 -15.583 -4.734 1.00 0.00 C ATOM 416 C LEU A 29 12.973 -16.566 -3.608 1.00 0.00 C ATOM 417 O LEU A 29 11.894 -17.156 -3.556 1.00 0.00 O ATOM 418 CB LEU A 29 13.654 -14.221 -4.150 1.00 0.00 C ATOM 419 CG LEU A 29 13.655 -13.064 -5.152 1.00 0.00 C ATOM 420 CD1 LEU A 29 13.898 -11.743 -4.440 1.00 0.00 C ATOM 421 CD2 LEU A 29 14.705 -13.294 -6.228 1.00 0.00 C ATOM 0 H LEU A 29 11.343 -14.930 -5.231 1.00 0.00 H new ATOM 0 HA LEU A 29 14.111 -15.969 -5.315 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.961 -13.982 -3.343 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.646 -14.298 -3.706 1.00 0.00 H new ATOM 0 HG LEU A 29 12.677 -13.020 -5.631 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.895 -10.932 -5.168 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.110 -11.575 -3.706 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.863 -11.774 -3.935 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.692 -12.462 -6.932 1.00 0.00 H new ATOM 0 HD22 LEU A 29 15.690 -13.364 -5.766 1.00 0.00 H new ATOM 0 HD23 LEU A 29 14.486 -14.221 -6.758 1.00 0.00 H new ATOM 433 N GLN A 30 13.936 -16.739 -2.709 1.00 0.00 N ATOM 434 CA GLN A 30 13.777 -17.651 -1.581 1.00 0.00 C ATOM 435 C GLN A 30 13.693 -16.884 -0.266 1.00 0.00 C ATOM 436 O GLN A 30 13.873 -15.667 -0.233 1.00 0.00 O ATOM 437 CB GLN A 30 14.941 -18.643 -1.532 1.00 0.00 C ATOM 438 CG GLN A 30 15.008 -19.563 -2.739 1.00 0.00 C ATOM 439 CD GLN A 30 16.380 -20.181 -2.926 1.00 0.00 C ATOM 440 OE1 GLN A 30 16.668 -21.255 -2.397 1.00 0.00 O ATOM 441 NE2 GLN A 30 17.237 -19.502 -3.680 1.00 0.00 N ATOM 0 H GLN A 30 14.836 -16.259 -2.739 1.00 0.00 H new ATOM 0 HA GLN A 30 12.845 -18.200 -1.720 1.00 0.00 H new ATOM 0 HB2 GLN A 30 15.877 -18.089 -1.456 1.00 0.00 H new ATOM 0 HB3 GLN A 30 14.854 -19.248 -0.629 1.00 0.00 H new ATOM 0 HG2 GLN A 30 14.268 -20.356 -2.628 1.00 0.00 H new ATOM 0 HG3 GLN A 30 14.741 -19.001 -3.634 1.00 0.00 H new ATOM 0 HE21 GLN A 30 16.956 -18.616 -4.099 1.00 0.00 H new ATOM 0 HE22 GLN A 30 18.176 -19.867 -3.840 1.00 0.00 H new ATOM 450 N VAL A 31 13.418 -17.604 0.817 1.00 0.00 N ATOM 451 CA VAL A 31 13.309 -16.993 2.136 1.00 0.00 C ATOM 452 C VAL A 31 14.596 -16.268 2.518 1.00 0.00 C ATOM 453 O VAL A 31 14.571 -15.290 3.264 1.00 0.00 O ATOM 454 CB VAL A 31 12.987 -18.042 3.216 1.00 0.00 C ATOM 455 CG1 VAL A 31 12.671 -17.367 4.542 1.00 0.00 C ATOM 456 CG2 VAL A 31 11.833 -18.929 2.773 1.00 0.00 C ATOM 0 H VAL A 31 13.266 -18.613 0.806 1.00 0.00 H new ATOM 0 HA VAL A 31 12.492 -16.273 2.082 1.00 0.00 H new ATOM 0 HB VAL A 31 13.866 -18.671 3.356 1.00 0.00 H new ATOM 0 HG11 VAL A 31 12.446 -18.125 5.292 1.00 0.00 H new ATOM 0 HG12 VAL A 31 13.531 -16.780 4.866 1.00 0.00 H new ATOM 0 HG13 VAL A 31 11.809 -16.711 4.420 1.00 0.00 H new ATOM 0 HG21 VAL A 31 11.620 -19.664 3.549 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.948 -18.316 2.601 1.00 0.00 H new ATOM 0 HG23 VAL A 31 12.103 -19.443 1.851 1.00 0.00 H new ATOM 466 N ASN A 32 15.719 -16.755 2.001 1.00 0.00 N ATOM 467 CA ASN A 32 17.017 -16.151 2.287 1.00 0.00 C ATOM 468 C ASN A 32 17.167 -14.811 1.575 1.00 0.00 C ATOM 469 O ASN A 32 17.881 -13.925 2.044 1.00 0.00 O ATOM 470 CB ASN A 32 18.143 -17.095 1.864 1.00 0.00 C ATOM 471 CG ASN A 32 19.513 -16.572 2.253 1.00 0.00 C ATOM 472 OD1 ASN A 32 20.031 -16.892 3.322 1.00 0.00 O ATOM 473 ND2 ASN A 32 20.106 -15.763 1.383 1.00 0.00 N ATOM 0 H ASN A 32 15.758 -17.565 1.382 1.00 0.00 H new ATOM 0 HA ASN A 32 17.079 -15.977 3.361 1.00 0.00 H new ATOM 0 HB2 ASN A 32 17.986 -18.071 2.322 1.00 0.00 H new ATOM 0 HB3 ASN A 32 18.106 -17.240 0.784 1.00 0.00 H new ATOM 0 HD21 ASN A 32 21.029 -15.380 1.590 1.00 0.00 H new ATOM 0 HD22 ASN A 32 19.639 -15.524 0.508 1.00 0.00 H new ATOM 480 N GLN A 33 16.488 -14.669 0.441 1.00 0.00 N ATOM 481 CA GLN A 33 16.546 -13.437 -0.337 1.00 0.00 C ATOM 482 C GLN A 33 15.607 -12.375 0.233 1.00 0.00 C ATOM 483 O GLN A 33 15.755 -11.187 -0.053 1.00 0.00 O ATOM 484 CB GLN A 33 16.188 -13.716 -1.797 1.00 0.00 C ATOM 485 CG GLN A 33 17.176 -14.630 -2.503 1.00 0.00 C ATOM 486 CD GLN A 33 17.239 -14.380 -3.997 1.00 0.00 C ATOM 487 OE1 GLN A 33 17.444 -13.249 -4.440 1.00 0.00 O ATOM 488 NE2 GLN A 33 17.060 -15.436 -4.782 1.00 0.00 N ATOM 0 H GLN A 33 15.891 -15.393 0.040 1.00 0.00 H new ATOM 0 HA GLN A 33 17.566 -13.056 -0.282 1.00 0.00 H new ATOM 0 HB2 GLN A 33 15.196 -14.166 -1.839 1.00 0.00 H new ATOM 0 HB3 GLN A 33 16.132 -12.770 -2.336 1.00 0.00 H new ATOM 0 HG2 GLN A 33 18.167 -14.488 -2.073 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.896 -15.668 -2.324 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.893 -16.354 -4.371 1.00 0.00 H new ATOM 0 HE22 GLN A 33 17.090 -15.329 -5.796 1.00 0.00 H new ATOM 497 N PHE A 34 14.641 -12.806 1.041 1.00 0.00 N ATOM 498 CA PHE A 34 13.681 -11.887 1.646 1.00 0.00 C ATOM 499 C PHE A 34 14.387 -10.712 2.317 1.00 0.00 C ATOM 500 O PHE A 34 13.834 -9.617 2.415 1.00 0.00 O ATOM 501 CB PHE A 34 12.814 -12.626 2.670 1.00 0.00 C ATOM 502 CG PHE A 34 11.607 -13.293 2.072 1.00 0.00 C ATOM 503 CD1 PHE A 34 11.678 -13.904 0.829 1.00 0.00 C ATOM 504 CD2 PHE A 34 10.401 -13.309 2.755 1.00 0.00 C ATOM 505 CE1 PHE A 34 10.568 -14.518 0.281 1.00 0.00 C ATOM 506 CE2 PHE A 34 9.288 -13.922 2.210 1.00 0.00 C ATOM 507 CZ PHE A 34 9.372 -14.527 0.972 1.00 0.00 C ATOM 0 H PHE A 34 14.503 -13.785 1.292 1.00 0.00 H new ATOM 0 HA PHE A 34 13.046 -11.495 0.851 1.00 0.00 H new ATOM 0 HB2 PHE A 34 13.422 -13.378 3.172 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.487 -11.920 3.433 1.00 0.00 H new ATOM 0 HD1 PHE A 34 12.610 -13.900 0.284 1.00 0.00 H new ATOM 0 HD2 PHE A 34 10.330 -12.837 3.724 1.00 0.00 H new ATOM 0 HE1 PHE A 34 10.636 -14.991 -0.688 1.00 0.00 H new ATOM 0 HE2 PHE A 34 8.354 -13.928 2.752 1.00 0.00 H new ATOM 0 HZ PHE A 34 8.504 -15.007 0.544 1.00 0.00 H new ATOM 517 N LYS A 35 15.612 -10.947 2.778 1.00 0.00 N ATOM 518 CA LYS A 35 16.392 -9.907 3.438 1.00 0.00 C ATOM 519 C LYS A 35 16.737 -8.783 2.466 1.00 0.00 C ATOM 520 O LYS A 35 16.876 -7.626 2.862 1.00 0.00 O ATOM 521 CB LYS A 35 17.673 -10.501 4.032 1.00 0.00 C ATOM 522 CG LYS A 35 17.745 -10.396 5.547 1.00 0.00 C ATOM 523 CD LYS A 35 19.128 -9.963 6.011 1.00 0.00 C ATOM 524 CE LYS A 35 19.173 -9.764 7.518 1.00 0.00 C ATOM 525 NZ LYS A 35 19.870 -8.502 7.891 1.00 0.00 N ATOM 0 H LYS A 35 16.085 -11.848 2.706 1.00 0.00 H new ATOM 0 HA LYS A 35 15.787 -9.489 4.243 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.745 -11.550 3.745 1.00 0.00 H new ATOM 0 HB3 LYS A 35 18.534 -9.992 3.599 1.00 0.00 H new ATOM 0 HG2 LYS A 35 17.002 -9.681 5.899 1.00 0.00 H new ATOM 0 HG3 LYS A 35 17.496 -11.359 5.992 1.00 0.00 H new ATOM 0 HD2 LYS A 35 19.862 -10.714 5.720 1.00 0.00 H new ATOM 0 HD3 LYS A 35 19.406 -9.035 5.512 1.00 0.00 H new ATOM 0 HE2 LYS A 35 18.157 -9.748 7.913 1.00 0.00 H new ATOM 0 HE3 LYS A 35 19.681 -10.610 7.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 19.879 -8.403 8.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 20.848 -8.528 7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 19.371 -7.692 7.471 1.00 0.00 H new ATOM 539 N ASN A 36 16.877 -9.131 1.190 1.00 0.00 N ATOM 540 CA ASN A 36 17.206 -8.151 0.162 1.00 0.00 C ATOM 541 C ASN A 36 15.953 -7.696 -0.580 1.00 0.00 C ATOM 542 O ASN A 36 15.998 -7.411 -1.777 1.00 0.00 O ATOM 543 CB ASN A 36 18.216 -8.737 -0.828 1.00 0.00 C ATOM 544 CG ASN A 36 17.671 -9.946 -1.564 1.00 0.00 C ATOM 545 OD1 ASN A 36 18.317 -11.091 -1.379 1.00 0.00 O flip ATOM 546 ND2 ASN A 36 16.680 -9.852 -2.287 1.00 0.00 N flip ATOM 0 H ASN A 36 16.768 -10.084 0.844 1.00 0.00 H new ATOM 0 HA ASN A 36 17.649 -7.284 0.652 1.00 0.00 H new ATOM 0 HB2 ASN A 36 18.498 -7.972 -1.551 1.00 0.00 H new ATOM 0 HB3 ASN A 36 19.123 -9.019 -0.293 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.215 -8.951 -2.400 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.324 -10.675 -2.773 1.00 0.00 H new ATOM 553 N VAL A 37 14.838 -7.631 0.138 1.00 0.00 N ATOM 554 CA VAL A 37 13.572 -7.210 -0.450 1.00 0.00 C ATOM 555 C VAL A 37 12.787 -6.325 0.511 1.00 0.00 C ATOM 556 O VAL A 37 12.151 -6.815 1.443 1.00 0.00 O ATOM 557 CB VAL A 37 12.703 -8.421 -0.839 1.00 0.00 C ATOM 558 CG1 VAL A 37 11.484 -7.973 -1.629 1.00 0.00 C ATOM 559 CG2 VAL A 37 13.521 -9.431 -1.632 1.00 0.00 C ATOM 0 H VAL A 37 14.785 -7.865 1.129 1.00 0.00 H new ATOM 0 HA VAL A 37 13.814 -6.642 -1.348 1.00 0.00 H new ATOM 0 HB VAL A 37 12.356 -8.905 0.074 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.883 -8.843 -1.895 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.888 -7.291 -1.023 1.00 0.00 H new ATOM 0 HG13 VAL A 37 11.806 -7.464 -2.537 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.892 -10.280 -1.899 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.899 -8.961 -2.540 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.359 -9.777 -1.026 1.00 0.00 H new ATOM 569 N ILE A 38 12.839 -5.017 0.280 1.00 0.00 N ATOM 570 CA ILE A 38 12.134 -4.062 1.127 1.00 0.00 C ATOM 571 C ILE A 38 10.948 -3.444 0.394 1.00 0.00 C ATOM 572 O ILE A 38 11.021 -3.166 -0.803 1.00 0.00 O ATOM 573 CB ILE A 38 13.074 -2.939 1.610 1.00 0.00 C ATOM 574 CG1 ILE A 38 12.347 -2.022 2.597 1.00 0.00 C ATOM 575 CG2 ILE A 38 13.606 -2.140 0.428 1.00 0.00 C ATOM 576 CD1 ILE A 38 13.280 -1.193 3.453 1.00 0.00 C ATOM 0 H ILE A 38 13.362 -4.594 -0.487 1.00 0.00 H new ATOM 0 HA ILE A 38 11.769 -4.615 1.992 1.00 0.00 H new ATOM 0 HB ILE A 38 13.921 -3.395 2.123 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.687 -1.355 2.042 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.715 -2.628 3.246 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.267 -1.352 0.789 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.160 -2.801 -0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 38 12.772 -1.694 -0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.695 -0.568 4.128 1.00 0.00 H new ATOM 0 HD12 ILE A 38 13.923 -1.853 4.035 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.895 -0.560 2.813 1.00 0.00 H new ATOM 588 N PHE A 39 9.855 -3.232 1.121 1.00 0.00 N ATOM 589 CA PHE A 39 8.652 -2.646 0.541 1.00 0.00 C ATOM 590 C PHE A 39 8.468 -1.207 1.013 1.00 0.00 C ATOM 591 O PHE A 39 8.323 -0.949 2.207 1.00 0.00 O ATOM 592 CB PHE A 39 7.424 -3.479 0.914 1.00 0.00 C ATOM 593 CG PHE A 39 7.343 -4.787 0.179 1.00 0.00 C ATOM 594 CD1 PHE A 39 7.247 -4.815 -1.203 1.00 0.00 C ATOM 595 CD2 PHE A 39 7.361 -5.987 0.871 1.00 0.00 C ATOM 596 CE1 PHE A 39 7.173 -6.017 -1.882 1.00 0.00 C ATOM 597 CE2 PHE A 39 7.287 -7.192 0.197 1.00 0.00 C ATOM 598 CZ PHE A 39 7.193 -7.206 -1.180 1.00 0.00 C ATOM 0 H PHE A 39 9.778 -3.457 2.113 1.00 0.00 H new ATOM 0 HA PHE A 39 8.764 -2.643 -0.543 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.439 -3.674 1.986 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.525 -2.899 0.708 1.00 0.00 H new ATOM 0 HD1 PHE A 39 7.230 -3.887 -1.756 1.00 0.00 H new ATOM 0 HD2 PHE A 39 7.434 -5.981 1.949 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.100 -6.026 -2.959 1.00 0.00 H new ATOM 0 HE2 PHE A 39 7.303 -8.121 0.747 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.135 -8.146 -1.708 1.00 0.00 H new ATOM 608 N GLU A 40 8.474 -0.274 0.066 1.00 0.00 N ATOM 609 CA GLU A 40 8.308 1.139 0.385 1.00 0.00 C ATOM 610 C GLU A 40 6.878 1.595 0.116 1.00 0.00 C ATOM 611 O GLU A 40 6.452 1.690 -1.035 1.00 0.00 O ATOM 612 CB GLU A 40 9.287 1.986 -0.429 1.00 0.00 C ATOM 613 CG GLU A 40 9.371 3.431 0.034 1.00 0.00 C ATOM 614 CD GLU A 40 8.610 4.379 -0.871 1.00 0.00 C ATOM 615 OE1 GLU A 40 7.430 4.094 -1.170 1.00 0.00 O ATOM 616 OE2 GLU A 40 9.191 5.405 -1.280 1.00 0.00 O ATOM 0 H GLU A 40 8.592 -0.471 -0.928 1.00 0.00 H new ATOM 0 HA GLU A 40 8.518 1.272 1.446 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.278 1.536 -0.372 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.988 1.966 -1.477 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.977 3.507 1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 40 10.417 3.735 0.075 1.00 0.00 H new ATOM 623 N ILE A 41 6.140 1.878 1.185 1.00 0.00 N ATOM 624 CA ILE A 41 4.761 2.325 1.065 1.00 0.00 C ATOM 625 C ILE A 41 4.642 3.821 1.333 1.00 0.00 C ATOM 626 O ILE A 41 4.854 4.280 2.455 1.00 0.00 O ATOM 627 CB ILE A 41 3.836 1.568 2.038 1.00 0.00 C ATOM 628 CG1 ILE A 41 4.065 0.059 1.931 1.00 0.00 C ATOM 629 CG2 ILE A 41 2.379 1.912 1.760 1.00 0.00 C ATOM 630 CD1 ILE A 41 4.260 -0.618 3.270 1.00 0.00 C ATOM 0 H ILE A 41 6.477 1.805 2.145 1.00 0.00 H new ATOM 0 HA ILE A 41 4.451 2.115 0.042 1.00 0.00 H new ATOM 0 HB ILE A 41 4.074 1.878 3.055 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.213 -0.395 1.424 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.941 -0.124 1.309 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.738 1.370 2.455 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.227 2.984 1.888 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.127 1.629 0.738 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.417 -1.686 3.118 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.129 -0.191 3.770 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.375 -0.466 3.887 1.00 0.00 H new ATOM 642 N SER A 42 4.299 4.579 0.295 1.00 0.00 N ATOM 643 CA SER A 42 4.152 6.024 0.422 1.00 0.00 C ATOM 644 C SER A 42 2.730 6.390 0.847 1.00 0.00 C ATOM 645 O SER A 42 1.759 5.949 0.231 1.00 0.00 O ATOM 646 CB SER A 42 4.492 6.709 -0.903 1.00 0.00 C ATOM 647 OG SER A 42 5.859 7.081 -0.950 1.00 0.00 O ATOM 0 H SER A 42 4.118 4.217 -0.641 1.00 0.00 H new ATOM 0 HA SER A 42 4.843 6.370 1.191 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.266 6.038 -1.731 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.867 7.593 -1.030 1.00 0.00 H new ATOM 0 HG SER A 42 6.051 7.515 -1.807 1.00 0.00 H new ATOM 653 N PRO A 43 2.585 7.205 1.908 1.00 0.00 N ATOM 654 CA PRO A 43 1.270 7.624 2.404 1.00 0.00 C ATOM 655 C PRO A 43 0.613 8.661 1.500 1.00 0.00 C ATOM 656 O PRO A 43 1.295 9.431 0.824 1.00 0.00 O ATOM 657 CB PRO A 43 1.588 8.228 3.772 1.00 0.00 C ATOM 658 CG PRO A 43 2.984 8.729 3.645 1.00 0.00 C ATOM 659 CD PRO A 43 3.684 7.782 2.707 1.00 0.00 C ATOM 0 HA PRO A 43 0.563 6.795 2.442 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.898 9.035 4.019 1.00 0.00 H new ATOM 0 HB3 PRO A 43 1.504 7.483 4.563 1.00 0.00 H new ATOM 0 HG2 PRO A 43 2.999 9.746 3.254 1.00 0.00 H new ATOM 0 HG3 PRO A 43 3.479 8.753 4.616 1.00 0.00 H new ATOM 0 HD2 PRO A 43 4.406 8.302 2.078 1.00 0.00 H new ATOM 0 HD3 PRO A 43 4.231 7.012 3.250 1.00 0.00 H new ATOM 667 N THR A 44 -0.716 8.676 1.492 1.00 0.00 N ATOM 668 CA THR A 44 -1.466 9.620 0.671 1.00 0.00 C ATOM 669 C THR A 44 -2.294 10.560 1.540 1.00 0.00 C ATOM 670 O THR A 44 -2.747 10.185 2.622 1.00 0.00 O ATOM 671 CB THR A 44 -2.379 8.869 -0.301 1.00 0.00 C ATOM 672 OG1 THR A 44 -2.844 7.663 0.278 1.00 0.00 O ATOM 673 CG2 THR A 44 -1.701 8.518 -1.609 1.00 0.00 C ATOM 0 H THR A 44 -1.296 8.045 2.045 1.00 0.00 H new ATOM 0 HA THR A 44 -0.752 10.215 0.102 1.00 0.00 H new ATOM 0 HB THR A 44 -3.203 9.551 -0.509 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.566 7.293 -0.272 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.403 7.987 -2.252 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.373 9.431 -2.106 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.838 7.882 -1.412 1.00 0.00 H new ATOM 681 N GLU A 45 -2.488 11.785 1.060 1.00 0.00 N ATOM 682 CA GLU A 45 -3.262 12.780 1.793 1.00 0.00 C ATOM 683 C GLU A 45 -4.687 12.293 2.031 1.00 0.00 C ATOM 684 O GLU A 45 -5.234 12.451 3.123 1.00 0.00 O ATOM 685 CB GLU A 45 -3.283 14.104 1.025 1.00 0.00 C ATOM 686 CG GLU A 45 -2.242 15.102 1.505 1.00 0.00 C ATOM 687 CD GLU A 45 -1.131 15.318 0.495 1.00 0.00 C ATOM 688 OE1 GLU A 45 -1.298 16.175 -0.397 1.00 0.00 O ATOM 689 OE2 GLU A 45 -0.094 14.629 0.599 1.00 0.00 O ATOM 0 H GLU A 45 -2.120 12.112 0.167 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.786 12.936 2.761 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.120 13.903 -0.034 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -4.273 14.552 1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.728 16.055 1.715 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.812 14.750 2.443 1.00 0.00 H new ATOM 696 N GLU A 46 -5.284 11.699 1.002 1.00 0.00 N ATOM 697 CA GLU A 46 -6.646 11.189 1.098 1.00 0.00 C ATOM 698 C GLU A 46 -6.690 9.912 1.933 1.00 0.00 C ATOM 699 O GLU A 46 -5.655 9.321 2.238 1.00 0.00 O ATOM 700 CB GLU A 46 -7.213 10.922 -0.299 1.00 0.00 C ATOM 701 CG GLU A 46 -8.575 11.555 -0.533 1.00 0.00 C ATOM 702 CD GLU A 46 -8.697 12.182 -1.908 1.00 0.00 C ATOM 703 OE1 GLU A 46 -8.192 13.310 -2.094 1.00 0.00 O ATOM 704 OE2 GLU A 46 -9.298 11.546 -2.799 1.00 0.00 O ATOM 0 H GLU A 46 -4.845 11.559 0.092 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.258 11.945 1.591 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.513 11.299 -1.045 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.291 9.845 -0.451 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.349 10.797 -0.413 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.753 12.316 0.227 1.00 0.00 H new ATOM 711 N VAL A 47 -7.897 9.491 2.300 1.00 0.00 N ATOM 712 CA VAL A 47 -8.076 8.285 3.099 1.00 0.00 C ATOM 713 C VAL A 47 -8.759 7.186 2.289 1.00 0.00 C ATOM 714 O VAL A 47 -9.699 7.448 1.539 1.00 0.00 O ATOM 715 CB VAL A 47 -8.904 8.570 4.369 1.00 0.00 C ATOM 716 CG1 VAL A 47 -10.302 9.049 4.005 1.00 0.00 C ATOM 717 CG2 VAL A 47 -8.968 7.334 5.254 1.00 0.00 C ATOM 0 H VAL A 47 -8.765 9.968 2.056 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.082 7.948 3.394 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.410 9.364 4.929 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.868 9.244 4.916 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.232 9.965 3.418 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -10.809 8.282 3.420 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.556 7.554 6.145 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.435 6.517 4.704 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.959 7.044 5.548 1.00 0.00 H new ATOM 727 N GLY A 48 -8.278 5.958 2.447 1.00 0.00 N ATOM 728 CA GLY A 48 -8.854 4.839 1.724 1.00 0.00 C ATOM 729 C GLY A 48 -7.930 4.305 0.647 1.00 0.00 C ATOM 730 O GLY A 48 -7.968 3.119 0.321 1.00 0.00 O ATOM 0 H GLY A 48 -7.501 5.717 3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.088 4.039 2.426 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.795 5.150 1.270 1.00 0.00 H new ATOM 734 N ASP A 49 -7.097 5.182 0.096 1.00 0.00 N ATOM 735 CA ASP A 49 -6.158 4.791 -0.949 1.00 0.00 C ATOM 736 C ASP A 49 -4.736 4.719 -0.402 1.00 0.00 C ATOM 737 O ASP A 49 -4.329 5.551 0.410 1.00 0.00 O ATOM 738 CB ASP A 49 -6.224 5.780 -2.116 1.00 0.00 C ATOM 739 CG ASP A 49 -6.757 5.142 -3.384 1.00 0.00 C ATOM 740 OD1 ASP A 49 -7.991 5.152 -3.580 1.00 0.00 O ATOM 741 OD2 ASP A 49 -5.942 4.631 -4.181 1.00 0.00 O ATOM 0 H ASP A 49 -7.053 6.167 0.356 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.438 3.800 -1.307 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -6.860 6.621 -1.840 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.229 6.182 -2.305 1.00 0.00 H new ATOM 746 N PHE A 50 -3.984 3.720 -0.851 1.00 0.00 N ATOM 747 CA PHE A 50 -2.607 3.539 -0.407 1.00 0.00 C ATOM 748 C PHE A 50 -1.664 3.407 -1.600 1.00 0.00 C ATOM 749 O PHE A 50 -2.063 2.950 -2.671 1.00 0.00 O ATOM 750 CB PHE A 50 -2.494 2.303 0.487 1.00 0.00 C ATOM 751 CG PHE A 50 -3.409 2.338 1.678 1.00 0.00 C ATOM 752 CD1 PHE A 50 -3.357 3.392 2.577 1.00 0.00 C ATOM 753 CD2 PHE A 50 -4.319 1.318 1.899 1.00 0.00 C ATOM 754 CE1 PHE A 50 -4.198 3.426 3.673 1.00 0.00 C ATOM 755 CE2 PHE A 50 -5.161 1.347 2.993 1.00 0.00 C ATOM 756 CZ PHE A 50 -5.101 2.402 3.882 1.00 0.00 C ATOM 0 H PHE A 50 -4.305 3.023 -1.523 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.318 4.420 0.166 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.715 1.415 -0.105 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.465 2.207 0.833 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.652 4.195 2.419 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.371 0.490 1.208 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.149 4.253 4.366 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -5.866 0.545 3.153 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.758 2.426 4.738 1.00 0.00 H new ATOM 766 N GLU A 51 -0.412 3.808 -1.405 1.00 0.00 N ATOM 767 CA GLU A 51 0.587 3.733 -2.465 1.00 0.00 C ATOM 768 C GLU A 51 1.605 2.635 -2.175 1.00 0.00 C ATOM 769 O GLU A 51 2.495 2.804 -1.341 1.00 0.00 O ATOM 770 CB GLU A 51 1.300 5.078 -2.620 1.00 0.00 C ATOM 771 CG GLU A 51 1.646 5.421 -4.060 1.00 0.00 C ATOM 772 CD GLU A 51 1.921 6.898 -4.256 1.00 0.00 C ATOM 773 OE1 GLU A 51 0.972 7.701 -4.126 1.00 0.00 O ATOM 774 OE2 GLU A 51 3.084 7.253 -4.541 1.00 0.00 O ATOM 0 H GLU A 51 -0.065 4.188 -0.524 1.00 0.00 H new ATOM 0 HA GLU A 51 0.075 3.493 -3.397 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.667 5.865 -2.210 1.00 0.00 H new ATOM 0 HB3 GLU A 51 2.215 5.065 -2.028 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.521 4.848 -4.366 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.824 5.119 -4.709 1.00 0.00 H new ATOM 781 N VAL A 52 1.469 1.510 -2.869 1.00 0.00 N ATOM 782 CA VAL A 52 2.377 0.384 -2.687 1.00 0.00 C ATOM 783 C VAL A 52 3.428 0.341 -3.791 1.00 0.00 C ATOM 784 O VAL A 52 3.098 0.369 -4.977 1.00 0.00 O ATOM 785 CB VAL A 52 1.616 -0.955 -2.667 1.00 0.00 C ATOM 786 CG1 VAL A 52 2.546 -2.094 -2.279 1.00 0.00 C ATOM 787 CG2 VAL A 52 0.429 -0.880 -1.719 1.00 0.00 C ATOM 0 H VAL A 52 0.738 1.354 -3.563 1.00 0.00 H new ATOM 0 HA VAL A 52 2.869 0.528 -1.725 1.00 0.00 H new ATOM 0 HB VAL A 52 1.239 -1.152 -3.671 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.990 -3.031 -2.271 1.00 0.00 H new ATOM 0 HG12 VAL A 52 3.360 -2.162 -3.001 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.956 -1.907 -1.287 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -0.097 -1.835 -1.718 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.781 -0.659 -0.712 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.250 -0.093 -2.047 1.00 0.00 H new ATOM 797 N LYS A 53 4.694 0.274 -3.393 1.00 0.00 N ATOM 798 CA LYS A 53 5.794 0.226 -4.349 1.00 0.00 C ATOM 799 C LYS A 53 6.836 -0.805 -3.930 1.00 0.00 C ATOM 800 O LYS A 53 6.945 -1.150 -2.754 1.00 0.00 O ATOM 801 CB LYS A 53 6.446 1.605 -4.475 1.00 0.00 C ATOM 802 CG LYS A 53 7.420 1.713 -5.638 1.00 0.00 C ATOM 803 CD LYS A 53 8.192 3.022 -5.597 1.00 0.00 C ATOM 804 CE LYS A 53 9.553 2.845 -4.946 1.00 0.00 C ATOM 805 NZ LYS A 53 10.167 4.152 -4.579 1.00 0.00 N ATOM 0 H LYS A 53 4.984 0.252 -2.415 1.00 0.00 H new ATOM 0 HA LYS A 53 5.389 -0.068 -5.317 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.666 2.357 -4.594 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.972 1.835 -3.549 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.118 0.876 -5.608 1.00 0.00 H new ATOM 0 HG3 LYS A 53 6.875 1.640 -6.579 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.319 3.403 -6.610 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.618 3.767 -5.046 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.451 2.228 -4.053 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.215 2.311 -5.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.102 3.989 -4.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.272 4.738 -5.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.556 4.643 -3.895 1.00 0.00 H new ATOM 819 N ALA A 54 7.599 -1.295 -4.901 1.00 0.00 N ATOM 820 CA ALA A 54 8.634 -2.287 -4.634 1.00 0.00 C ATOM 821 C ALA A 54 10.024 -1.666 -4.713 1.00 0.00 C ATOM 822 O ALA A 54 10.555 -1.447 -5.802 1.00 0.00 O ATOM 823 CB ALA A 54 8.515 -3.447 -5.611 1.00 0.00 C ATOM 0 H ALA A 54 7.520 -1.021 -5.880 1.00 0.00 H new ATOM 0 HA ALA A 54 8.491 -2.663 -3.621 1.00 0.00 H new ATOM 0 HB1 ALA A 54 9.293 -4.181 -5.401 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.537 -3.915 -5.503 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.630 -3.078 -6.630 1.00 0.00 H new ATOM 829 N LYS A 55 10.607 -1.385 -3.553 1.00 0.00 N ATOM 830 CA LYS A 55 11.937 -0.789 -3.490 1.00 0.00 C ATOM 831 C LYS A 55 12.970 -1.692 -4.159 1.00 0.00 C ATOM 832 O LYS A 55 13.209 -2.814 -3.714 1.00 0.00 O ATOM 833 CB LYS A 55 12.332 -0.525 -2.035 1.00 0.00 C ATOM 834 CG LYS A 55 12.450 0.952 -1.695 1.00 0.00 C ATOM 835 CD LYS A 55 13.557 1.620 -2.496 1.00 0.00 C ATOM 836 CE LYS A 55 13.323 3.116 -2.629 1.00 0.00 C ATOM 837 NZ LYS A 55 14.150 3.895 -1.667 1.00 0.00 N ATOM 0 H LYS A 55 10.180 -1.560 -2.643 1.00 0.00 H new ATOM 0 HA LYS A 55 11.911 0.159 -4.027 1.00 0.00 H new ATOM 0 HB2 LYS A 55 11.593 -0.983 -1.378 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.285 -1.013 -1.832 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.502 1.450 -1.897 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.650 1.067 -0.630 1.00 0.00 H new ATOM 0 HD2 LYS A 55 14.517 1.442 -2.011 1.00 0.00 H new ATOM 0 HD3 LYS A 55 13.613 1.170 -3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 55 13.556 3.431 -3.646 1.00 0.00 H new ATOM 0 HE3 LYS A 55 12.268 3.335 -2.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 13.961 4.910 -1.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 13.910 3.613 -0.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 15.157 3.706 -1.843 1.00 0.00 H new ATOM 851 N PHE A 56 13.580 -1.192 -5.230 1.00 0.00 N ATOM 852 CA PHE A 56 14.588 -1.952 -5.959 1.00 0.00 C ATOM 853 C PHE A 56 15.552 -1.019 -6.685 1.00 0.00 C ATOM 854 O PHE A 56 16.766 -1.091 -6.490 1.00 0.00 O ATOM 855 CB PHE A 56 13.917 -2.897 -6.960 1.00 0.00 C ATOM 856 CG PHE A 56 14.227 -4.347 -6.715 1.00 0.00 C ATOM 857 CD1 PHE A 56 13.562 -5.052 -5.725 1.00 0.00 C ATOM 858 CD2 PHE A 56 15.181 -5.003 -7.476 1.00 0.00 C ATOM 859 CE1 PHE A 56 13.844 -6.386 -5.497 1.00 0.00 C ATOM 860 CE2 PHE A 56 15.467 -6.337 -7.253 1.00 0.00 C ATOM 861 CZ PHE A 56 14.797 -7.029 -6.262 1.00 0.00 C ATOM 0 H PHE A 56 13.393 -0.265 -5.611 1.00 0.00 H new ATOM 0 HA PHE A 56 15.157 -2.541 -5.240 1.00 0.00 H new ATOM 0 HB2 PHE A 56 12.838 -2.752 -6.917 1.00 0.00 H new ATOM 0 HB3 PHE A 56 14.235 -2.631 -7.968 1.00 0.00 H new ATOM 0 HD1 PHE A 56 12.815 -4.554 -5.125 1.00 0.00 H new ATOM 0 HD2 PHE A 56 15.707 -4.466 -8.252 1.00 0.00 H new ATOM 0 HE1 PHE A 56 13.320 -6.925 -4.722 1.00 0.00 H new ATOM 0 HE2 PHE A 56 16.213 -6.838 -7.852 1.00 0.00 H new ATOM 0 HZ PHE A 56 15.018 -8.071 -6.086 1.00 0.00 H new ATOM 871 N MET A 57 15.005 -0.144 -7.521 1.00 0.00 N ATOM 872 CA MET A 57 15.816 0.804 -8.276 1.00 0.00 C ATOM 873 C MET A 57 15.156 2.178 -8.309 1.00 0.00 C ATOM 874 O MET A 57 15.794 3.192 -8.023 1.00 0.00 O ATOM 875 CB MET A 57 16.037 0.297 -9.702 1.00 0.00 C ATOM 876 CG MET A 57 16.835 -0.995 -9.771 1.00 0.00 C ATOM 877 SD MET A 57 18.613 -0.719 -9.660 1.00 0.00 S ATOM 878 CE MET A 57 19.221 -1.968 -10.791 1.00 0.00 C ATOM 0 H MET A 57 14.002 -0.071 -7.693 1.00 0.00 H new ATOM 0 HA MET A 57 16.781 0.896 -7.778 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.069 0.142 -10.178 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.555 1.065 -10.276 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.522 -1.654 -8.961 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.608 -1.508 -10.706 1.00 0.00 H new ATOM 0 HE1 MET A 57 20.309 -1.924 -10.831 1.00 0.00 H new ATOM 0 HE2 MET A 57 18.911 -2.954 -10.445 1.00 0.00 H new ATOM 0 HE3 MET A 57 18.813 -1.788 -11.786 1.00 0.00 H new ATOM 888 N GLY A 58 13.875 2.206 -8.661 1.00 0.00 N ATOM 889 CA GLY A 58 13.149 3.461 -8.725 1.00 0.00 C ATOM 890 C GLY A 58 13.540 4.297 -9.927 1.00 0.00 C ATOM 891 O GLY A 58 14.003 5.429 -9.781 1.00 0.00 O ATOM 0 H GLY A 58 13.326 1.381 -8.903 1.00 0.00 H new ATOM 0 HA2 GLY A 58 12.079 3.257 -8.761 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.334 4.031 -7.814 1.00 0.00 H new ATOM 895 N VAL A 59 13.357 3.739 -11.119 1.00 0.00 N ATOM 896 CA VAL A 59 13.694 4.441 -12.352 1.00 0.00 C ATOM 897 C VAL A 59 12.461 5.094 -12.968 1.00 0.00 C ATOM 898 O VAL A 59 12.546 6.166 -13.564 1.00 0.00 O ATOM 899 CB VAL A 59 14.328 3.491 -13.385 1.00 0.00 C ATOM 900 CG1 VAL A 59 15.747 3.127 -12.976 1.00 0.00 C ATOM 901 CG2 VAL A 59 13.476 2.241 -13.553 1.00 0.00 C ATOM 0 H VAL A 59 12.977 2.803 -11.257 1.00 0.00 H new ATOM 0 HA VAL A 59 14.417 5.213 -12.088 1.00 0.00 H new ATOM 0 HB VAL A 59 14.373 4.005 -14.345 1.00 0.00 H new ATOM 0 HG11 VAL A 59 16.179 2.455 -13.718 1.00 0.00 H new ATOM 0 HG12 VAL A 59 16.351 4.032 -12.912 1.00 0.00 H new ATOM 0 HG13 VAL A 59 15.730 2.632 -12.005 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.939 1.581 -14.287 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.398 1.723 -12.597 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.480 2.523 -13.896 1.00 0.00 H new ATOM 911 N GLN A 60 11.314 4.437 -12.820 1.00 0.00 N ATOM 912 CA GLN A 60 10.063 4.953 -13.362 1.00 0.00 C ATOM 913 C GLN A 60 9.107 5.350 -12.243 1.00 0.00 C ATOM 914 O GLN A 60 9.324 5.011 -11.079 1.00 0.00 O ATOM 915 CB GLN A 60 9.405 3.908 -14.265 1.00 0.00 C ATOM 916 CG GLN A 60 10.347 3.323 -15.305 1.00 0.00 C ATOM 917 CD GLN A 60 10.135 3.917 -16.683 1.00 0.00 C ATOM 918 OE1 GLN A 60 9.023 4.306 -17.039 1.00 0.00 O ATOM 919 NE2 GLN A 60 11.203 3.988 -17.469 1.00 0.00 N ATOM 0 H GLN A 60 11.226 3.547 -12.329 1.00 0.00 H new ATOM 0 HA GLN A 60 10.291 5.841 -13.952 1.00 0.00 H new ATOM 0 HB2 GLN A 60 9.013 3.100 -13.647 1.00 0.00 H new ATOM 0 HB3 GLN A 60 8.554 4.362 -14.772 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.377 3.495 -14.994 1.00 0.00 H new ATOM 0 HG3 GLN A 60 10.204 2.243 -15.353 1.00 0.00 H new ATOM 0 HE21 GLN A 60 12.106 3.654 -17.133 1.00 0.00 H new ATOM 0 HE22 GLN A 60 11.120 4.377 -18.408 1.00 0.00 H new ATOM 928 N MET A 61 8.049 6.071 -12.600 1.00 0.00 N ATOM 929 CA MET A 61 7.061 6.514 -11.624 1.00 0.00 C ATOM 930 C MET A 61 5.847 5.591 -11.620 1.00 0.00 C ATOM 931 O MET A 61 4.724 6.026 -11.363 1.00 0.00 O ATOM 932 CB MET A 61 6.626 7.950 -11.924 1.00 0.00 C ATOM 933 CG MET A 61 6.413 8.794 -10.678 1.00 0.00 C ATOM 934 SD MET A 61 5.631 10.379 -11.037 1.00 0.00 S ATOM 935 CE MET A 61 5.846 11.225 -9.473 1.00 0.00 C ATOM 0 H MET A 61 7.854 6.361 -13.558 1.00 0.00 H new ATOM 0 HA MET A 61 7.522 6.480 -10.637 1.00 0.00 H new ATOM 0 HB2 MET A 61 7.380 8.426 -12.550 1.00 0.00 H new ATOM 0 HB3 MET A 61 5.701 7.928 -12.500 1.00 0.00 H new ATOM 0 HG2 MET A 61 5.795 8.241 -9.970 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.374 8.969 -10.194 1.00 0.00 H new ATOM 0 HE1 MET A 61 5.412 12.223 -9.536 1.00 0.00 H new ATOM 0 HE2 MET A 61 5.348 10.662 -8.683 1.00 0.00 H new ATOM 0 HE3 MET A 61 6.909 11.305 -9.246 1.00 0.00 H new ATOM 945 N GLU A 62 6.079 4.314 -11.907 1.00 0.00 N ATOM 946 CA GLU A 62 5.003 3.330 -11.935 1.00 0.00 C ATOM 947 C GLU A 62 4.826 2.676 -10.568 1.00 0.00 C ATOM 948 O GLU A 62 5.417 1.634 -10.286 1.00 0.00 O ATOM 949 CB GLU A 62 5.290 2.261 -12.994 1.00 0.00 C ATOM 950 CG GLU A 62 4.077 1.900 -13.838 1.00 0.00 C ATOM 951 CD GLU A 62 3.610 0.476 -13.610 1.00 0.00 C ATOM 952 OE1 GLU A 62 4.462 -0.437 -13.619 1.00 0.00 O ATOM 953 OE2 GLU A 62 2.392 0.273 -13.423 1.00 0.00 O ATOM 0 H GLU A 62 7.002 3.937 -12.123 1.00 0.00 H new ATOM 0 HA GLU A 62 4.078 3.847 -12.191 1.00 0.00 H new ATOM 0 HB2 GLU A 62 6.086 2.615 -13.649 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.659 1.362 -12.500 1.00 0.00 H new ATOM 0 HG2 GLU A 62 3.262 2.587 -13.608 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.320 2.034 -14.892 1.00 0.00 H new ATOM 960 N THR A 63 4.008 3.296 -9.723 1.00 0.00 N ATOM 961 CA THR A 63 3.754 2.773 -8.386 1.00 0.00 C ATOM 962 C THR A 63 2.450 1.984 -8.350 1.00 0.00 C ATOM 963 O THR A 63 1.445 2.399 -8.927 1.00 0.00 O ATOM 964 CB THR A 63 3.699 3.917 -7.370 1.00 0.00 C ATOM 965 OG1 THR A 63 3.248 5.111 -7.983 1.00 0.00 O ATOM 966 CG2 THR A 63 5.037 4.207 -6.724 1.00 0.00 C ATOM 0 H THR A 63 3.511 4.160 -9.940 1.00 0.00 H new ATOM 0 HA THR A 63 4.572 2.102 -8.124 1.00 0.00 H new ATOM 0 HB THR A 63 3.005 3.585 -6.597 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.218 5.829 -7.317 1.00 0.00 H new ATOM 0 HG21 THR A 63 4.928 5.028 -6.015 1.00 0.00 H new ATOM 0 HG22 THR A 63 5.388 3.318 -6.199 1.00 0.00 H new ATOM 0 HG23 THR A 63 5.759 4.484 -7.492 1.00 0.00 H new ATOM 974 N PHE A 64 2.472 0.844 -7.667 1.00 0.00 N ATOM 975 CA PHE A 64 1.290 -0.003 -7.556 1.00 0.00 C ATOM 976 C PHE A 64 0.292 0.585 -6.565 1.00 0.00 C ATOM 977 O PHE A 64 0.625 0.837 -5.408 1.00 0.00 O ATOM 978 CB PHE A 64 1.687 -1.415 -7.121 1.00 0.00 C ATOM 979 CG PHE A 64 0.546 -2.391 -7.144 1.00 0.00 C ATOM 980 CD1 PHE A 64 0.173 -3.014 -8.325 1.00 0.00 C ATOM 981 CD2 PHE A 64 -0.154 -2.686 -5.985 1.00 0.00 C ATOM 982 CE1 PHE A 64 -0.877 -3.912 -8.350 1.00 0.00 C ATOM 983 CE2 PHE A 64 -1.206 -3.583 -6.004 1.00 0.00 C ATOM 984 CZ PHE A 64 -1.567 -4.197 -7.187 1.00 0.00 C ATOM 0 H PHE A 64 3.295 0.486 -7.182 1.00 0.00 H new ATOM 0 HA PHE A 64 0.816 -0.053 -8.536 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.479 -1.779 -7.775 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.099 -1.374 -6.113 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.709 -2.795 -9.236 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.125 -2.210 -5.057 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.158 -4.390 -9.277 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.745 -3.803 -5.094 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.388 -4.899 -7.203 1.00 0.00 H new ATOM 994 N MET A 65 -0.935 0.803 -7.028 1.00 0.00 N ATOM 995 CA MET A 65 -1.983 1.362 -6.182 1.00 0.00 C ATOM 996 C MET A 65 -2.849 0.258 -5.585 1.00 0.00 C ATOM 997 O MET A 65 -2.989 -0.818 -6.166 1.00 0.00 O ATOM 998 CB MET A 65 -2.852 2.331 -6.984 1.00 0.00 C ATOM 999 CG MET A 65 -2.359 3.768 -6.942 1.00 0.00 C ATOM 1000 SD MET A 65 -2.701 4.664 -8.469 1.00 0.00 S ATOM 1001 CE MET A 65 -2.782 6.347 -7.863 1.00 0.00 C ATOM 0 H MET A 65 -1.228 0.601 -7.984 1.00 0.00 H new ATOM 0 HA MET A 65 -1.505 1.904 -5.366 1.00 0.00 H new ATOM 0 HB2 MET A 65 -2.889 1.999 -8.021 1.00 0.00 H new ATOM 0 HB3 MET A 65 -3.872 2.294 -6.600 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.832 4.286 -6.108 1.00 0.00 H new ATOM 0 HG3 MET A 65 -1.285 3.774 -6.754 1.00 0.00 H new ATOM 0 HE1 MET A 65 -2.988 7.023 -8.693 1.00 0.00 H new ATOM 0 HE2 MET A 65 -3.577 6.429 -7.122 1.00 0.00 H new ATOM 0 HE3 MET A 65 -1.830 6.615 -7.405 1.00 0.00 H new ATOM 1011 N LEU A 66 -3.429 0.532 -4.420 1.00 0.00 N ATOM 1012 CA LEU A 66 -4.283 -0.438 -3.745 1.00 0.00 C ATOM 1013 C LEU A 66 -5.504 0.244 -3.136 1.00 0.00 C ATOM 1014 O LEU A 66 -5.387 1.284 -2.488 1.00 0.00 O ATOM 1015 CB LEU A 66 -3.497 -1.170 -2.656 1.00 0.00 C ATOM 1016 CG LEU A 66 -4.254 -2.305 -1.964 1.00 0.00 C ATOM 1017 CD1 LEU A 66 -4.150 -3.587 -2.774 1.00 0.00 C ATOM 1018 CD2 LEU A 66 -3.723 -2.518 -0.555 1.00 0.00 C ATOM 0 H LEU A 66 -3.323 1.417 -3.925 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.625 -1.162 -4.485 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.587 -1.577 -3.097 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.190 -0.446 -1.902 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.306 -2.027 -1.896 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.694 -4.383 -2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.579 -3.428 -3.763 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.102 -3.870 -2.874 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.273 -3.329 -0.078 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.665 -2.775 -0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.850 -1.603 0.024 1.00 0.00 H new ATOM 1030 N HIS A 67 -6.674 -0.348 -3.349 1.00 0.00 N ATOM 1031 CA HIS A 67 -7.917 0.201 -2.820 1.00 0.00 C ATOM 1032 C HIS A 67 -8.409 -0.616 -1.630 1.00 0.00 C ATOM 1033 O HIS A 67 -8.149 -1.816 -1.537 1.00 0.00 O ATOM 1034 CB HIS A 67 -8.989 0.236 -3.913 1.00 0.00 C ATOM 1035 CG HIS A 67 -9.658 1.568 -4.052 1.00 0.00 C ATOM 1036 ND1 HIS A 67 -10.348 1.949 -5.183 1.00 0.00 N ATOM 1037 CD2 HIS A 67 -9.741 2.612 -3.193 1.00 0.00 C ATOM 1038 CE1 HIS A 67 -10.826 3.170 -5.014 1.00 0.00 C ATOM 1039 NE2 HIS A 67 -10.472 3.594 -3.816 1.00 0.00 N ATOM 0 H HIS A 67 -6.788 -1.209 -3.885 1.00 0.00 H new ATOM 0 HA HIS A 67 -7.722 1.219 -2.481 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -8.534 -0.034 -4.866 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -9.744 -0.520 -3.695 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -9.312 2.663 -2.203 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -11.408 3.726 -5.734 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -10.704 4.504 -3.417 1.00 0.00 H new ATOM 1048 N TYR A 68 -9.122 0.040 -0.721 1.00 0.00 N ATOM 1049 CA TYR A 68 -9.650 -0.625 0.465 1.00 0.00 C ATOM 1050 C TYR A 68 -10.756 -1.607 0.090 1.00 0.00 C ATOM 1051 O TYR A 68 -10.898 -2.662 0.707 1.00 0.00 O ATOM 1052 CB TYR A 68 -10.183 0.405 1.460 1.00 0.00 C ATOM 1053 CG TYR A 68 -10.526 -0.180 2.812 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -9.570 -0.853 3.562 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -11.807 -0.060 3.337 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -9.880 -1.390 4.796 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -12.125 -0.594 4.572 1.00 0.00 C ATOM 1058 CZ TYR A 68 -11.159 -1.257 5.297 1.00 0.00 C ATOM 1059 OH TYR A 68 -11.470 -1.791 6.526 1.00 0.00 O ATOM 0 H TYR A 68 -9.348 1.033 -0.783 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.836 -1.181 0.931 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.438 1.190 1.591 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -11.072 0.876 1.041 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.568 -0.958 3.174 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -12.567 0.459 2.771 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -9.125 -1.911 5.366 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -13.125 -0.492 4.966 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.411 -1.609 6.733 1.00 0.00 H new ATOM 1069 N GLN A 69 -11.537 -1.252 -0.925 1.00 0.00 N ATOM 1070 CA GLN A 69 -12.630 -2.102 -1.382 1.00 0.00 C ATOM 1071 C GLN A 69 -12.096 -3.388 -2.007 1.00 0.00 C ATOM 1072 O GLN A 69 -12.661 -4.464 -1.813 1.00 0.00 O ATOM 1073 CB GLN A 69 -13.499 -1.352 -2.394 1.00 0.00 C ATOM 1074 CG GLN A 69 -14.656 -0.598 -1.761 1.00 0.00 C ATOM 1075 CD GLN A 69 -15.922 -0.668 -2.592 1.00 0.00 C ATOM 1076 OE1 GLN A 69 -16.096 0.092 -3.545 1.00 0.00 O ATOM 1077 NE2 GLN A 69 -16.815 -1.584 -2.234 1.00 0.00 N ATOM 0 H GLN A 69 -11.433 -0.382 -1.447 1.00 0.00 H new ATOM 0 HA GLN A 69 -13.238 -2.365 -0.516 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -12.875 -0.648 -2.945 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -13.893 -2.063 -3.120 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -14.853 -1.008 -0.770 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -14.373 0.446 -1.624 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -16.629 -2.193 -1.437 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -17.686 -1.678 -2.756 1.00 0.00 H new ATOM 1086 N ASP A 70 -11.005 -3.267 -2.755 1.00 0.00 N ATOM 1087 CA ASP A 70 -10.395 -4.419 -3.408 1.00 0.00 C ATOM 1088 C ASP A 70 -9.965 -5.462 -2.381 1.00 0.00 C ATOM 1089 O ASP A 70 -10.064 -6.664 -2.624 1.00 0.00 O ATOM 1090 CB ASP A 70 -9.189 -3.980 -4.241 1.00 0.00 C ATOM 1091 CG ASP A 70 -9.594 -3.228 -5.494 1.00 0.00 C ATOM 1092 OD1 ASP A 70 -10.472 -3.729 -6.228 1.00 0.00 O ATOM 1093 OD2 ASP A 70 -9.033 -2.140 -5.741 1.00 0.00 O ATOM 0 H ASP A 70 -10.525 -2.383 -2.924 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.139 -4.868 -4.066 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.543 -3.347 -3.633 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.605 -4.857 -4.520 1.00 0.00 H new ATOM 1098 N LEU A 71 -9.487 -4.994 -1.234 1.00 0.00 N ATOM 1099 CA LEU A 71 -9.041 -5.885 -0.170 1.00 0.00 C ATOM 1100 C LEU A 71 -10.223 -6.615 0.460 1.00 0.00 C ATOM 1101 O LEU A 71 -10.167 -7.823 0.693 1.00 0.00 O ATOM 1102 CB LEU A 71 -8.283 -5.098 0.900 1.00 0.00 C ATOM 1103 CG LEU A 71 -6.935 -4.531 0.453 1.00 0.00 C ATOM 1104 CD1 LEU A 71 -6.246 -3.820 1.607 1.00 0.00 C ATOM 1105 CD2 LEU A 71 -6.050 -5.639 -0.098 1.00 0.00 C ATOM 0 H LEU A 71 -9.398 -4.001 -1.017 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.372 -6.625 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.912 -4.275 1.238 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.120 -5.748 1.760 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.111 -3.804 -0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.288 -3.423 1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.875 -3.002 1.958 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.080 -4.525 2.422 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.094 -5.219 -0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.881 -6.388 0.676 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.540 -6.105 -0.953 1.00 0.00 H new ATOM 1117 N LEU A 72 -11.293 -5.874 0.733 1.00 0.00 N ATOM 1118 CA LEU A 72 -12.488 -6.452 1.336 1.00 0.00 C ATOM 1119 C LEU A 72 -13.168 -7.422 0.375 1.00 0.00 C ATOM 1120 O LEU A 72 -13.807 -8.386 0.799 1.00 0.00 O ATOM 1121 CB LEU A 72 -13.465 -5.346 1.740 1.00 0.00 C ATOM 1122 CG LEU A 72 -12.973 -4.424 2.857 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -13.980 -3.313 3.114 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -12.717 -5.218 4.129 1.00 0.00 C ATOM 0 H LEU A 72 -11.356 -4.873 0.546 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.186 -7.004 2.226 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.688 -4.740 0.862 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.401 -5.807 2.056 1.00 0.00 H new ATOM 0 HG LEU A 72 -12.034 -3.970 2.540 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -13.613 -2.667 3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.115 -2.727 2.205 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.935 -3.748 3.410 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.368 -4.546 4.913 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -13.641 -5.700 4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.959 -5.977 3.937 1.00 0.00 H new ATOM 1136 N GLN A 73 -13.026 -7.161 -0.920 1.00 0.00 N ATOM 1137 CA GLN A 73 -13.625 -8.009 -1.942 1.00 0.00 C ATOM 1138 C GLN A 73 -13.094 -9.435 -1.846 1.00 0.00 C ATOM 1139 O GLN A 73 -13.809 -10.396 -2.131 1.00 0.00 O ATOM 1140 CB GLN A 73 -13.343 -7.439 -3.332 1.00 0.00 C ATOM 1141 CG GLN A 73 -14.007 -8.218 -4.454 1.00 0.00 C ATOM 1142 CD GLN A 73 -15.509 -8.013 -4.495 1.00 0.00 C ATOM 1143 OE1 GLN A 73 -15.997 -7.015 -5.025 1.00 0.00 O ATOM 1144 NE2 GLN A 73 -16.251 -8.962 -3.934 1.00 0.00 N ATOM 0 H GLN A 73 -12.500 -6.367 -1.286 1.00 0.00 H new ATOM 0 HA GLN A 73 -14.702 -8.031 -1.777 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.684 -6.404 -3.368 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.266 -7.425 -3.498 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -13.576 -7.913 -5.408 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -13.792 -9.280 -4.332 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -15.804 -9.773 -3.506 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -17.268 -8.880 -3.932 1.00 0.00 H new ATOM 1153 N LEU A 74 -11.834 -9.565 -1.444 1.00 0.00 N ATOM 1154 CA LEU A 74 -11.205 -10.874 -1.310 1.00 0.00 C ATOM 1155 C LEU A 74 -11.573 -11.521 0.021 1.00 0.00 C ATOM 1156 O LEU A 74 -11.676 -12.744 0.120 1.00 0.00 O ATOM 1157 CB LEU A 74 -9.685 -10.746 -1.426 1.00 0.00 C ATOM 1158 CG LEU A 74 -9.187 -10.084 -2.712 1.00 0.00 C ATOM 1159 CD1 LEU A 74 -7.808 -9.479 -2.502 1.00 0.00 C ATOM 1160 CD2 LEU A 74 -9.163 -11.089 -3.853 1.00 0.00 C ATOM 0 H LEU A 74 -11.228 -8.780 -1.205 1.00 0.00 H new ATOM 0 HA LEU A 74 -11.572 -11.510 -2.115 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -9.318 -10.173 -0.575 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -9.245 -11.741 -1.354 1.00 0.00 H new ATOM 0 HG LEU A 74 -9.876 -9.281 -2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.470 -9.013 -3.428 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -7.857 -8.728 -1.714 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.107 -10.262 -2.214 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -8.806 -10.601 -4.760 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.497 -11.913 -3.598 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -10.169 -11.474 -4.020 1.00 0.00 H new ATOM 1172 N GLN A 75 -11.768 -10.694 1.042 1.00 0.00 N ATOM 1173 CA GLN A 75 -12.124 -11.186 2.368 1.00 0.00 C ATOM 1174 C GLN A 75 -13.588 -11.614 2.414 1.00 0.00 C ATOM 1175 O GLN A 75 -13.954 -12.523 3.157 1.00 0.00 O ATOM 1176 CB GLN A 75 -11.859 -10.110 3.422 1.00 0.00 C ATOM 1177 CG GLN A 75 -11.286 -10.657 4.719 1.00 0.00 C ATOM 1178 CD GLN A 75 -11.522 -9.733 5.897 1.00 0.00 C ATOM 1179 OE1 GLN A 75 -12.663 -9.492 6.292 1.00 0.00 O ATOM 1180 NE2 GLN A 75 -10.442 -9.209 6.465 1.00 0.00 N ATOM 0 H GLN A 75 -11.686 -9.679 0.977 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.504 -12.056 2.585 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.168 -9.373 3.012 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.791 -9.587 3.638 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -11.734 -11.628 4.929 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -10.215 -10.819 4.599 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -9.515 -9.436 6.105 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -10.539 -8.579 7.262 1.00 0.00 H new ATOM 1189 N TYR A 76 -14.418 -10.953 1.615 1.00 0.00 N ATOM 1190 CA TYR A 76 -15.842 -11.268 1.566 1.00 0.00 C ATOM 1191 C TYR A 76 -16.106 -12.448 0.637 1.00 0.00 C ATOM 1192 O TYR A 76 -16.943 -13.303 0.927 1.00 0.00 O ATOM 1193 CB TYR A 76 -16.639 -10.048 1.100 1.00 0.00 C ATOM 1194 CG TYR A 76 -18.124 -10.158 1.367 1.00 0.00 C ATOM 1195 CD1 TYR A 76 -18.597 -10.568 2.607 1.00 0.00 C ATOM 1196 CD2 TYR A 76 -19.052 -9.852 0.379 1.00 0.00 C ATOM 1197 CE1 TYR A 76 -19.952 -10.670 2.855 1.00 0.00 C ATOM 1198 CE2 TYR A 76 -20.409 -9.950 0.620 1.00 0.00 C ATOM 1199 CZ TYR A 76 -20.854 -10.360 1.859 1.00 0.00 C ATOM 1200 OH TYR A 76 -22.205 -10.461 2.102 1.00 0.00 O ATOM 0 H TYR A 76 -14.131 -10.197 0.993 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.164 -11.541 2.571 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -16.253 -9.160 1.600 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -16.480 -9.907 0.031 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -17.894 -10.811 3.390 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -18.707 -9.532 -0.593 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -20.303 -10.991 3.824 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -21.117 -9.707 -0.158 1.00 0.00 H new ATOM 0 HH TYR A 76 -22.702 -10.206 1.297 1.00 0.00 H new ATOM 1210 N GLU A 77 -15.387 -12.489 -0.479 1.00 0.00 N ATOM 1211 CA GLU A 77 -15.543 -13.566 -1.451 1.00 0.00 C ATOM 1212 C GLU A 77 -15.039 -14.888 -0.883 1.00 0.00 C ATOM 1213 O GLU A 77 -15.798 -15.847 -0.746 1.00 0.00 O ATOM 1214 CB GLU A 77 -14.791 -13.231 -2.740 1.00 0.00 C ATOM 1215 CG GLU A 77 -15.633 -12.481 -3.759 1.00 0.00 C ATOM 1216 CD GLU A 77 -16.096 -13.366 -4.899 1.00 0.00 C ATOM 1217 OE1 GLU A 77 -16.193 -14.595 -4.695 1.00 0.00 O ATOM 1218 OE2 GLU A 77 -16.362 -12.832 -5.996 1.00 0.00 O ATOM 0 H GLU A 77 -14.690 -11.789 -0.734 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.605 -13.669 -1.675 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -13.914 -12.632 -2.494 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.429 -14.155 -3.190 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.503 -12.052 -3.261 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -15.054 -11.650 -4.162 1.00 0.00 H new ATOM 1225 N GLY A 78 -13.752 -14.931 -0.554 1.00 0.00 N ATOM 1226 CA GLY A 78 -13.167 -16.140 -0.004 1.00 0.00 C ATOM 1227 C GLY A 78 -11.740 -16.357 -0.469 1.00 0.00 C ATOM 1228 O GLY A 78 -11.366 -17.466 -0.850 1.00 0.00 O ATOM 0 H GLY A 78 -13.104 -14.150 -0.658 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.187 -16.087 1.085 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -13.774 -16.998 -0.293 1.00 0.00 H new ATOM 1232 N VAL A 79 -10.942 -15.295 -0.439 1.00 0.00 N ATOM 1233 CA VAL A 79 -9.549 -15.374 -0.861 1.00 0.00 C ATOM 1234 C VAL A 79 -8.624 -14.754 0.181 1.00 0.00 C ATOM 1235 O VAL A 79 -8.733 -13.569 0.497 1.00 0.00 O ATOM 1236 CB VAL A 79 -9.330 -14.665 -2.211 1.00 0.00 C ATOM 1237 CG1 VAL A 79 -7.924 -14.927 -2.730 1.00 0.00 C ATOM 1238 CG2 VAL A 79 -10.372 -15.114 -3.224 1.00 0.00 C ATOM 0 H VAL A 79 -11.236 -14.370 -0.127 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.311 -16.432 -0.972 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.442 -13.591 -2.060 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.788 -14.418 -3.684 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.195 -14.552 -2.012 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.780 -15.999 -2.866 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.202 -14.603 -4.172 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.294 -16.191 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.368 -14.870 -2.854 1.00 0.00 H new ATOM 1248 N ALA A 80 -7.712 -15.562 0.711 1.00 0.00 N ATOM 1249 CA ALA A 80 -6.767 -15.094 1.717 1.00 0.00 C ATOM 1250 C ALA A 80 -5.435 -14.705 1.083 1.00 0.00 C ATOM 1251 O ALA A 80 -4.752 -13.798 1.557 1.00 0.00 O ATOM 1252 CB ALA A 80 -6.556 -16.161 2.780 1.00 0.00 C ATOM 0 H ALA A 80 -7.608 -16.545 0.460 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.188 -14.205 2.188 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.848 -15.798 3.525 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.507 -16.386 3.263 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.162 -17.065 2.315 1.00 0.00 H new ATOM 1258 N VAL A 81 -5.074 -15.398 0.007 1.00 0.00 N ATOM 1259 CA VAL A 81 -3.824 -15.125 -0.691 1.00 0.00 C ATOM 1260 C VAL A 81 -4.032 -14.120 -1.820 1.00 0.00 C ATOM 1261 O VAL A 81 -4.992 -14.220 -2.584 1.00 0.00 O ATOM 1262 CB VAL A 81 -3.214 -16.414 -1.275 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -1.821 -16.145 -1.822 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.179 -17.511 -0.222 1.00 0.00 C ATOM 0 H VAL A 81 -5.629 -16.151 -0.399 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.137 -14.706 0.044 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.843 -16.752 -2.099 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.406 -17.067 -2.230 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.878 -15.393 -2.609 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.179 -15.782 -1.019 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.745 -18.414 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.574 -17.184 0.624 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.193 -17.722 0.118 1.00 0.00 H new ATOM 1274 N MET A 82 -3.127 -13.153 -1.918 1.00 0.00 N ATOM 1275 CA MET A 82 -3.210 -12.129 -2.954 1.00 0.00 C ATOM 1276 C MET A 82 -1.962 -12.140 -3.830 1.00 0.00 C ATOM 1277 O MET A 82 -0.847 -12.304 -3.336 1.00 0.00 O ATOM 1278 CB MET A 82 -3.392 -10.748 -2.322 1.00 0.00 C ATOM 1279 CG MET A 82 -3.540 -9.628 -3.339 1.00 0.00 C ATOM 1280 SD MET A 82 -4.367 -8.177 -2.661 1.00 0.00 S ATOM 1281 CE MET A 82 -2.973 -7.273 -1.992 1.00 0.00 C ATOM 0 H MET A 82 -2.327 -13.056 -1.293 1.00 0.00 H new ATOM 0 HA MET A 82 -4.074 -12.350 -3.581 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.274 -10.764 -1.681 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.536 -10.535 -1.682 1.00 0.00 H new ATOM 0 HG2 MET A 82 -2.554 -9.342 -3.704 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.103 -9.994 -4.197 1.00 0.00 H new ATOM 0 HE1 MET A 82 -3.331 -6.383 -1.475 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.431 -7.907 -1.290 1.00 0.00 H new ATOM 0 HE3 MET A 82 -2.307 -6.978 -2.803 1.00 0.00 H new ATOM 1291 N LYS A 83 -2.159 -11.963 -5.132 1.00 0.00 N ATOM 1292 CA LYS A 83 -1.048 -11.952 -6.077 1.00 0.00 C ATOM 1293 C LYS A 83 -0.540 -10.532 -6.304 1.00 0.00 C ATOM 1294 O LYS A 83 -1.186 -9.731 -6.980 1.00 0.00 O ATOM 1295 CB LYS A 83 -1.477 -12.572 -7.408 1.00 0.00 C ATOM 1296 CG LYS A 83 -0.350 -12.671 -8.424 1.00 0.00 C ATOM 1297 CD LYS A 83 -0.165 -14.096 -8.918 1.00 0.00 C ATOM 1298 CE LYS A 83 0.240 -15.031 -7.787 1.00 0.00 C ATOM 1299 NZ LYS A 83 -0.917 -15.811 -7.266 1.00 0.00 N ATOM 0 H LYS A 83 -3.076 -11.825 -5.557 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.237 -12.544 -5.653 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -1.877 -13.569 -7.223 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.286 -11.978 -7.832 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.563 -12.017 -9.270 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.578 -12.318 -7.974 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.092 -14.449 -9.369 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.596 -14.116 -9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.009 -15.717 -8.142 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.680 -14.450 -6.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.094 -15.549 -6.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -1.762 -15.602 -7.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -0.704 -16.827 -7.323 1.00 0.00 H new ATOM 1313 N LEU A 84 0.621 -10.227 -5.735 1.00 0.00 N ATOM 1314 CA LEU A 84 1.216 -8.902 -5.875 1.00 0.00 C ATOM 1315 C LEU A 84 2.483 -8.963 -6.723 1.00 0.00 C ATOM 1316 O LEU A 84 3.328 -9.839 -6.532 1.00 0.00 O ATOM 1317 CB LEU A 84 1.537 -8.316 -4.498 1.00 0.00 C ATOM 1318 CG LEU A 84 0.404 -7.512 -3.857 1.00 0.00 C ATOM 1319 CD1 LEU A 84 0.766 -7.129 -2.430 1.00 0.00 C ATOM 1320 CD2 LEU A 84 0.098 -6.273 -4.684 1.00 0.00 C ATOM 0 H LEU A 84 1.169 -10.878 -5.173 1.00 0.00 H new ATOM 0 HA LEU A 84 0.495 -8.257 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.808 -9.131 -3.827 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.412 -7.673 -4.589 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.490 -8.134 -3.829 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.050 -6.558 -1.988 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.936 -8.032 -1.843 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.672 -6.523 -2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.710 -5.712 -4.214 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.988 -5.646 -4.743 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.203 -6.571 -5.688 1.00 0.00 H new ATOM 1332 N PHE A 85 2.608 -8.028 -7.660 1.00 0.00 N ATOM 1333 CA PHE A 85 3.772 -7.976 -8.537 1.00 0.00 C ATOM 1334 C PHE A 85 3.912 -9.266 -9.341 1.00 0.00 C ATOM 1335 O PHE A 85 5.001 -9.600 -9.807 1.00 0.00 O ATOM 1336 CB PHE A 85 5.041 -7.732 -7.720 1.00 0.00 C ATOM 1337 CG PHE A 85 5.012 -6.453 -6.932 1.00 0.00 C ATOM 1338 CD1 PHE A 85 4.910 -5.229 -7.575 1.00 0.00 C ATOM 1339 CD2 PHE A 85 5.089 -6.474 -5.548 1.00 0.00 C ATOM 1340 CE1 PHE A 85 4.884 -4.051 -6.853 1.00 0.00 C ATOM 1341 CE2 PHE A 85 5.064 -5.299 -4.821 1.00 0.00 C ATOM 1342 CZ PHE A 85 4.961 -4.086 -5.474 1.00 0.00 C ATOM 0 H PHE A 85 1.918 -7.297 -7.831 1.00 0.00 H new ATOM 0 HA PHE A 85 3.631 -7.150 -9.234 1.00 0.00 H new ATOM 0 HB2 PHE A 85 5.189 -8.567 -7.036 1.00 0.00 H new ATOM 0 HB3 PHE A 85 5.899 -7.715 -8.393 1.00 0.00 H new ATOM 0 HD1 PHE A 85 4.850 -5.196 -8.653 1.00 0.00 H new ATOM 0 HD2 PHE A 85 5.169 -7.419 -5.032 1.00 0.00 H new ATOM 0 HE1 PHE A 85 4.804 -3.104 -7.366 1.00 0.00 H new ATOM 0 HE2 PHE A 85 5.125 -5.329 -3.743 1.00 0.00 H new ATOM 0 HZ PHE A 85 4.941 -3.167 -4.908 1.00 0.00 H new ATOM 1352 N ASP A 86 2.806 -9.987 -9.503 1.00 0.00 N ATOM 1353 CA ASP A 86 2.809 -11.239 -10.252 1.00 0.00 C ATOM 1354 C ASP A 86 3.874 -12.197 -9.724 1.00 0.00 C ATOM 1355 O ASP A 86 4.363 -13.060 -10.453 1.00 0.00 O ATOM 1356 CB ASP A 86 3.047 -10.967 -11.739 1.00 0.00 C ATOM 1357 CG ASP A 86 1.783 -10.538 -12.457 1.00 0.00 C ATOM 1358 OD1 ASP A 86 1.280 -9.432 -12.165 1.00 0.00 O ATOM 1359 OD2 ASP A 86 1.297 -11.306 -13.313 1.00 0.00 O ATOM 0 H ASP A 86 1.896 -9.725 -9.125 1.00 0.00 H new ATOM 0 HA ASP A 86 1.833 -11.707 -10.123 1.00 0.00 H new ATOM 0 HB2 ASP A 86 3.804 -10.191 -11.847 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.443 -11.866 -12.211 1.00 0.00 H new ATOM 1364 N ARG A 87 4.229 -12.042 -8.452 1.00 0.00 N ATOM 1365 CA ARG A 87 5.236 -12.894 -7.830 1.00 0.00 C ATOM 1366 C ARG A 87 5.028 -12.971 -6.321 1.00 0.00 C ATOM 1367 O ARG A 87 4.629 -14.009 -5.792 1.00 0.00 O ATOM 1368 CB ARG A 87 6.639 -12.369 -8.136 1.00 0.00 C ATOM 1369 CG ARG A 87 7.054 -12.550 -9.587 1.00 0.00 C ATOM 1370 CD ARG A 87 8.441 -11.983 -9.846 1.00 0.00 C ATOM 1371 NE ARG A 87 8.503 -11.240 -11.103 1.00 0.00 N ATOM 1372 CZ ARG A 87 9.639 -10.899 -11.707 1.00 0.00 C ATOM 1373 NH1 ARG A 87 10.808 -11.230 -11.174 1.00 0.00 N ATOM 1374 NH2 ARG A 87 9.605 -10.223 -12.848 1.00 0.00 N ATOM 0 H ARG A 87 3.834 -11.334 -7.832 1.00 0.00 H new ATOM 0 HA ARG A 87 5.132 -13.897 -8.245 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.684 -11.310 -7.883 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.357 -12.881 -7.495 1.00 0.00 H new ATOM 0 HG2 ARG A 87 7.040 -13.610 -9.841 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.331 -12.057 -10.237 1.00 0.00 H new ATOM 0 HD2 ARG A 87 8.724 -11.327 -9.023 1.00 0.00 H new ATOM 0 HD3 ARG A 87 9.166 -12.796 -9.869 1.00 0.00 H new ATOM 0 HE ARG A 87 7.624 -10.967 -11.543 1.00 0.00 H new ATOM 0 HH11 ARG A 87 10.840 -11.749 -10.296 1.00 0.00 H new ATOM 0 HH12 ARG A 87 11.675 -10.966 -11.642 1.00 0.00 H new ATOM 0 HH21 ARG A 87 8.709 -9.965 -13.261 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.475 -9.961 -13.312 1.00 0.00 H new ATOM 1388 N ALA A 88 5.300 -11.866 -5.635 1.00 0.00 N ATOM 1389 CA ALA A 88 5.143 -11.809 -4.187 1.00 0.00 C ATOM 1390 C ALA A 88 3.692 -12.049 -3.782 1.00 0.00 C ATOM 1391 O ALA A 88 2.766 -11.605 -4.460 1.00 0.00 O ATOM 1392 CB ALA A 88 5.625 -10.467 -3.657 1.00 0.00 C ATOM 0 H ALA A 88 5.630 -10.999 -6.058 1.00 0.00 H new ATOM 0 HA ALA A 88 5.751 -12.601 -3.749 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.502 -10.438 -2.574 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.678 -10.334 -3.906 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.041 -9.666 -4.110 1.00 0.00 H new ATOM 1398 N LYS A 89 3.503 -12.753 -2.670 1.00 0.00 N ATOM 1399 CA LYS A 89 2.166 -13.052 -2.173 1.00 0.00 C ATOM 1400 C LYS A 89 1.985 -12.524 -0.753 1.00 0.00 C ATOM 1401 O LYS A 89 2.934 -12.478 0.028 1.00 0.00 O ATOM 1402 CB LYS A 89 1.912 -14.561 -2.205 1.00 0.00 C ATOM 1403 CG LYS A 89 1.400 -15.063 -3.546 1.00 0.00 C ATOM 1404 CD LYS A 89 1.614 -16.559 -3.697 1.00 0.00 C ATOM 1405 CE LYS A 89 1.121 -17.058 -5.046 1.00 0.00 C ATOM 1406 NZ LYS A 89 1.907 -18.227 -5.528 1.00 0.00 N ATOM 0 H LYS A 89 4.259 -13.127 -2.097 1.00 0.00 H new ATOM 0 HA LYS A 89 1.444 -12.556 -2.822 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.838 -15.082 -1.961 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.189 -14.816 -1.431 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.338 -14.835 -3.640 1.00 0.00 H new ATOM 0 HG3 LYS A 89 1.912 -14.538 -4.352 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.674 -16.789 -3.588 1.00 0.00 H new ATOM 0 HD3 LYS A 89 1.090 -17.085 -2.899 1.00 0.00 H new ATOM 0 HE2 LYS A 89 0.070 -17.335 -4.968 1.00 0.00 H new ATOM 0 HE3 LYS A 89 1.185 -16.252 -5.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 1.694 -18.399 -6.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 2.923 -18.031 -5.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 1.655 -19.068 -4.971 1.00 0.00 H new ATOM 1420 N VAL A 90 0.760 -12.126 -0.427 1.00 0.00 N ATOM 1421 CA VAL A 90 0.457 -11.601 0.899 1.00 0.00 C ATOM 1422 C VAL A 90 -0.932 -12.035 1.358 1.00 0.00 C ATOM 1423 O VAL A 90 -1.821 -12.273 0.542 1.00 0.00 O ATOM 1424 CB VAL A 90 0.535 -10.063 0.925 1.00 0.00 C ATOM 1425 CG1 VAL A 90 0.434 -9.547 2.352 1.00 0.00 C ATOM 1426 CG2 VAL A 90 1.819 -9.584 0.266 1.00 0.00 C ATOM 0 H VAL A 90 -0.038 -12.157 -1.062 1.00 0.00 H new ATOM 0 HA VAL A 90 1.206 -12.008 1.579 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.307 -9.664 0.360 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.491 -8.458 2.350 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.516 -9.860 2.786 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.254 -9.952 2.944 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.858 -8.495 0.293 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.677 -9.991 0.802 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.844 -9.922 -0.770 1.00 0.00 H new ATOM 1436 N ASN A 91 -1.110 -12.132 2.671 1.00 0.00 N ATOM 1437 CA ASN A 91 -2.390 -12.535 3.241 1.00 0.00 C ATOM 1438 C ASN A 91 -3.337 -11.345 3.343 1.00 0.00 C ATOM 1439 O ASN A 91 -3.072 -10.389 4.071 1.00 0.00 O ATOM 1440 CB ASN A 91 -2.183 -13.156 4.623 1.00 0.00 C ATOM 1441 CG ASN A 91 -3.246 -14.182 4.962 1.00 0.00 C ATOM 1442 OD1 ASN A 91 -4.008 -14.612 4.095 1.00 0.00 O ATOM 1443 ND2 ASN A 91 -3.303 -14.581 6.227 1.00 0.00 N ATOM 0 H ASN A 91 -0.384 -11.937 3.360 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.837 -13.277 2.580 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -1.201 -13.628 4.663 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -2.189 -12.368 5.377 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -3.998 -15.270 6.513 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.652 -14.198 6.912 1.00 0.00 H new ATOM 1450 N VAL A 92 -4.441 -11.408 2.606 1.00 0.00 N ATOM 1451 CA VAL A 92 -5.428 -10.334 2.613 1.00 0.00 C ATOM 1452 C VAL A 92 -6.053 -10.172 3.994 1.00 0.00 C ATOM 1453 O VAL A 92 -6.441 -9.071 4.386 1.00 0.00 O ATOM 1454 CB VAL A 92 -6.545 -10.589 1.583 1.00 0.00 C ATOM 1455 CG1 VAL A 92 -7.469 -9.385 1.485 1.00 0.00 C ATOM 1456 CG2 VAL A 92 -5.952 -10.927 0.220 1.00 0.00 C ATOM 0 H VAL A 92 -4.675 -12.191 1.996 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.901 -9.418 2.345 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.133 -11.443 1.920 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.251 -9.585 0.752 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.923 -9.195 2.458 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -6.896 -8.511 1.175 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.757 -11.104 -0.493 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.337 -10.096 -0.125 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.337 -11.823 0.303 1.00 0.00 H new ATOM 1466 N ASN A 93 -6.149 -11.275 4.729 1.00 0.00 N ATOM 1467 CA ASN A 93 -6.729 -11.255 6.067 1.00 0.00 C ATOM 1468 C ASN A 93 -5.865 -10.441 7.024 1.00 0.00 C ATOM 1469 O ASN A 93 -6.377 -9.656 7.823 1.00 0.00 O ATOM 1470 CB ASN A 93 -6.891 -12.682 6.596 1.00 0.00 C ATOM 1471 CG ASN A 93 -8.152 -12.853 7.420 1.00 0.00 C ATOM 1472 OD1 ASN A 93 -8.955 -11.928 7.547 1.00 0.00 O ATOM 1473 ND2 ASN A 93 -8.334 -14.040 7.986 1.00 0.00 N ATOM 0 H ASN A 93 -5.833 -12.194 4.421 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.710 -10.784 6.003 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -6.911 -13.378 5.757 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.025 -12.942 7.204 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.165 -14.213 8.552 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -7.643 -14.779 7.855 1.00 0.00 H new ATOM 1480 N LEU A 94 -4.552 -10.632 6.941 1.00 0.00 N ATOM 1481 CA LEU A 94 -3.618 -9.915 7.801 1.00 0.00 C ATOM 1482 C LEU A 94 -3.204 -8.586 7.175 1.00 0.00 C ATOM 1483 O LEU A 94 -2.854 -7.640 7.881 1.00 0.00 O ATOM 1484 CB LEU A 94 -2.379 -10.772 8.069 1.00 0.00 C ATOM 1485 CG LEU A 94 -2.620 -12.005 8.942 1.00 0.00 C ATOM 1486 CD1 LEU A 94 -1.411 -12.926 8.909 1.00 0.00 C ATOM 1487 CD2 LEU A 94 -2.940 -11.592 10.371 1.00 0.00 C ATOM 0 H LEU A 94 -4.111 -11.278 6.286 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.122 -9.708 8.745 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.967 -11.097 7.113 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.622 -10.150 8.547 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.476 -12.549 8.542 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.600 -13.798 9.536 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.227 -13.249 7.884 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.537 -12.393 9.284 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.109 -12.482 10.978 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.104 -11.026 10.782 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.837 -10.972 10.379 1.00 0.00 H new ATOM 1499 N LEU A 95 -3.244 -8.521 5.848 1.00 0.00 N ATOM 1500 CA LEU A 95 -2.871 -7.307 5.129 1.00 0.00 C ATOM 1501 C LEU A 95 -3.710 -6.118 5.590 1.00 0.00 C ATOM 1502 O LEU A 95 -3.181 -5.040 5.857 1.00 0.00 O ATOM 1503 CB LEU A 95 -3.036 -7.510 3.623 1.00 0.00 C ATOM 1504 CG LEU A 95 -2.655 -6.305 2.761 1.00 0.00 C ATOM 1505 CD1 LEU A 95 -1.147 -6.114 2.749 1.00 0.00 C ATOM 1506 CD2 LEU A 95 -3.185 -6.474 1.345 1.00 0.00 C ATOM 0 H LEU A 95 -3.531 -9.295 5.248 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.825 -7.094 5.347 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.428 -8.362 3.318 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.075 -7.770 3.419 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.110 -5.414 3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.894 -5.252 2.131 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.793 -5.947 3.766 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.671 -7.005 2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.905 -5.608 0.746 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.759 -7.375 0.902 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.271 -6.561 1.371 1.00 0.00 H new ATOM 1518 N ILE A 96 -5.020 -6.325 5.678 1.00 0.00 N ATOM 1519 CA ILE A 96 -5.931 -5.270 6.106 1.00 0.00 C ATOM 1520 C ILE A 96 -5.745 -4.951 7.585 1.00 0.00 C ATOM 1521 O ILE A 96 -5.888 -3.803 8.007 1.00 0.00 O ATOM 1522 CB ILE A 96 -7.402 -5.658 5.857 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -7.594 -6.124 4.412 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -8.322 -4.487 6.168 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -8.754 -7.079 4.235 1.00 0.00 C ATOM 0 H ILE A 96 -5.474 -7.212 5.459 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.692 -4.388 5.512 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.660 -6.482 6.522 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.750 -5.253 3.775 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.679 -6.609 4.070 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.356 -4.779 5.987 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.204 -4.199 7.213 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.066 -3.643 5.528 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.831 -7.368 3.187 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.590 -7.967 4.845 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.678 -6.591 4.546 1.00 0.00 H new ATOM 1537 N PHE A 97 -5.424 -5.974 8.370 1.00 0.00 N ATOM 1538 CA PHE A 97 -5.218 -5.805 9.804 1.00 0.00 C ATOM 1539 C PHE A 97 -4.054 -4.858 10.080 1.00 0.00 C ATOM 1540 O PHE A 97 -4.088 -4.077 11.030 1.00 0.00 O ATOM 1541 CB PHE A 97 -4.957 -7.159 10.466 1.00 0.00 C ATOM 1542 CG PHE A 97 -5.496 -7.259 11.864 1.00 0.00 C ATOM 1543 CD1 PHE A 97 -4.927 -6.527 12.894 1.00 0.00 C ATOM 1544 CD2 PHE A 97 -6.571 -8.085 12.148 1.00 0.00 C ATOM 1545 CE1 PHE A 97 -5.421 -6.618 14.181 1.00 0.00 C ATOM 1546 CE2 PHE A 97 -7.069 -8.181 13.433 1.00 0.00 C ATOM 1547 CZ PHE A 97 -6.493 -7.445 14.451 1.00 0.00 C ATOM 0 H PHE A 97 -5.301 -6.930 8.037 1.00 0.00 H new ATOM 0 HA PHE A 97 -6.124 -5.370 10.226 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.404 -7.944 9.856 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -3.883 -7.343 10.486 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -4.088 -5.878 12.688 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -7.025 -8.661 11.355 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -4.969 -6.043 14.975 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -7.907 -8.830 13.642 1.00 0.00 H new ATOM 0 HZ PHE A 97 -6.881 -7.517 15.456 1.00 0.00 H new ATOM 1557 N LEU A 98 -3.025 -4.936 9.243 1.00 0.00 N ATOM 1558 CA LEU A 98 -1.849 -4.087 9.397 1.00 0.00 C ATOM 1559 C LEU A 98 -2.177 -2.633 9.073 1.00 0.00 C ATOM 1560 O LEU A 98 -1.779 -1.721 9.796 1.00 0.00 O ATOM 1561 CB LEU A 98 -0.717 -4.580 8.493 1.00 0.00 C ATOM 1562 CG LEU A 98 0.602 -3.820 8.636 1.00 0.00 C ATOM 1563 CD1 LEU A 98 1.478 -4.465 9.699 1.00 0.00 C ATOM 1564 CD2 LEU A 98 1.333 -3.768 7.302 1.00 0.00 C ATOM 0 H LEU A 98 -2.981 -5.578 8.452 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.527 -4.143 10.437 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.536 -5.634 8.704 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.046 -4.515 7.456 1.00 0.00 H new ATOM 0 HG LEU A 98 0.379 -2.800 8.948 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.412 -3.910 9.786 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.957 -4.452 10.657 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.693 -5.496 9.417 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.270 -3.224 7.421 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.543 -4.782 6.963 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.710 -3.261 6.565 1.00 0.00 H new ATOM 1576 N LEU A 99 -2.907 -2.427 7.981 1.00 0.00 N ATOM 1577 CA LEU A 99 -3.288 -1.083 7.561 1.00 0.00 C ATOM 1578 C LEU A 99 -4.313 -0.481 8.518 1.00 0.00 C ATOM 1579 O LEU A 99 -4.324 0.727 8.750 1.00 0.00 O ATOM 1580 CB LEU A 99 -3.857 -1.114 6.140 1.00 0.00 C ATOM 1581 CG LEU A 99 -3.033 -1.914 5.130 1.00 0.00 C ATOM 1582 CD1 LEU A 99 -3.942 -2.594 4.118 1.00 0.00 C ATOM 1583 CD2 LEU A 99 -2.032 -1.010 4.426 1.00 0.00 C ATOM 0 H LEU A 99 -3.246 -3.172 7.372 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.395 -0.458 7.576 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.863 -1.531 6.177 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.950 -0.089 5.780 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.482 -2.685 5.668 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.338 -3.158 3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.621 -3.272 4.636 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.520 -1.840 3.584 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.454 -1.595 3.711 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.564 -0.217 3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.360 -0.569 5.162 1.00 0.00 H new ATOM 1595 N ASN A 100 -5.170 -1.333 9.069 1.00 0.00 N ATOM 1596 CA ASN A 100 -6.200 -0.886 10.001 1.00 0.00 C ATOM 1597 C ASN A 100 -5.584 -0.204 11.220 1.00 0.00 C ATOM 1598 O ASN A 100 -6.233 0.604 11.884 1.00 0.00 O ATOM 1599 CB ASN A 100 -7.060 -2.070 10.448 1.00 0.00 C ATOM 1600 CG ASN A 100 -8.524 -1.701 10.591 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -8.860 -0.646 11.129 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -9.403 -2.571 10.108 1.00 0.00 N ATOM 0 H ASN A 100 -5.173 -2.337 8.887 1.00 0.00 H new ATOM 0 HA ASN A 100 -6.827 -0.160 9.483 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.961 -2.880 9.725 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.688 -2.446 11.401 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -10.402 -2.377 10.175 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -9.079 -3.433 9.670 1.00 0.00 H new ATOM 1609 N LYS A 101 -4.329 -0.533 11.511 1.00 0.00 N ATOM 1610 CA LYS A 101 -3.633 0.049 12.654 1.00 0.00 C ATOM 1611 C LYS A 101 -2.508 0.977 12.202 1.00 0.00 C ATOM 1612 O LYS A 101 -2.120 1.894 12.925 1.00 0.00 O ATOM 1613 CB LYS A 101 -3.071 -1.057 13.550 1.00 0.00 C ATOM 1614 CG LYS A 101 -3.852 -1.251 14.839 1.00 0.00 C ATOM 1615 CD LYS A 101 -5.197 -1.912 14.583 1.00 0.00 C ATOM 1616 CE LYS A 101 -5.804 -2.453 15.867 1.00 0.00 C ATOM 1617 NZ LYS A 101 -6.553 -3.720 15.636 1.00 0.00 N ATOM 0 H LYS A 101 -3.774 -1.198 10.972 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.353 0.639 13.221 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.064 -1.995 12.994 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.035 -0.824 13.794 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -3.271 -1.863 15.529 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -4.006 -0.286 15.321 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -5.879 -1.190 14.133 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -5.074 -2.724 13.867 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -5.014 -2.626 16.597 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -6.475 -1.707 16.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -6.850 -4.119 16.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -7.392 -3.526 15.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -5.940 -4.401 15.144 1.00 0.00 H new ATOM 1631 N LYS A 102 -1.983 0.731 11.004 1.00 0.00 N ATOM 1632 CA LYS A 102 -0.898 1.545 10.465 1.00 0.00 C ATOM 1633 C LYS A 102 -1.423 2.867 9.911 1.00 0.00 C ATOM 1634 O LYS A 102 -1.316 3.909 10.559 1.00 0.00 O ATOM 1635 CB LYS A 102 -0.153 0.778 9.371 1.00 0.00 C ATOM 1636 CG LYS A 102 0.743 -0.326 9.905 1.00 0.00 C ATOM 1637 CD LYS A 102 1.960 0.240 10.618 1.00 0.00 C ATOM 1638 CE LYS A 102 2.640 -0.811 11.481 1.00 0.00 C ATOM 1639 NZ LYS A 102 1.863 -1.103 12.717 1.00 0.00 N ATOM 0 H LYS A 102 -2.291 -0.023 10.390 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.208 1.767 11.279 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.880 0.344 8.684 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.452 1.479 8.795 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.177 -0.955 10.592 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.066 -0.964 9.082 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.668 0.622 9.883 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.659 1.083 11.240 1.00 0.00 H new ATOM 0 HE2 LYS A 102 2.764 -1.728 10.905 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.638 -0.467 11.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.453 -1.649 13.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 1.576 -0.210 13.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.016 -1.655 12.472 1.00 0.00 H new ATOM 1653 N PHE A 103 -1.985 2.820 8.707 1.00 0.00 N ATOM 1654 CA PHE A 103 -2.519 4.017 8.065 1.00 0.00 C ATOM 1655 C PHE A 103 -3.816 4.467 8.729 1.00 0.00 C ATOM 1656 O PHE A 103 -4.021 5.658 8.967 1.00 0.00 O ATOM 1657 CB PHE A 103 -2.759 3.757 6.577 1.00 0.00 C ATOM 1658 CG PHE A 103 -1.493 3.639 5.777 1.00 0.00 C ATOM 1659 CD1 PHE A 103 -0.655 4.731 5.616 1.00 0.00 C ATOM 1660 CD2 PHE A 103 -1.141 2.435 5.186 1.00 0.00 C ATOM 1661 CE1 PHE A 103 0.511 4.625 4.882 1.00 0.00 C ATOM 1662 CE2 PHE A 103 0.024 2.324 4.451 1.00 0.00 C ATOM 1663 CZ PHE A 103 0.850 3.420 4.298 1.00 0.00 C ATOM 0 H PHE A 103 -2.083 1.967 8.156 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.784 4.814 8.177 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.337 2.839 6.465 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -3.364 4.566 6.168 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.916 5.676 6.069 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.784 1.575 5.301 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.156 5.483 4.765 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.288 1.381 3.997 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.760 3.335 3.722 1.00 0.00 H new ATOM 1673 N TYR A 104 -4.691 3.510 9.025 1.00 0.00 N ATOM 1674 CA TYR A 104 -5.970 3.813 9.659 1.00 0.00 C ATOM 1675 C TYR A 104 -5.766 4.573 10.967 1.00 0.00 C ATOM 1676 O TYR A 104 -5.131 4.073 11.895 1.00 0.00 O ATOM 1677 CB TYR A 104 -6.752 2.523 9.917 1.00 0.00 C ATOM 1678 CG TYR A 104 -8.014 2.405 9.093 1.00 0.00 C ATOM 1679 CD1 TYR A 104 -7.989 1.834 7.827 1.00 0.00 C ATOM 1680 CD2 TYR A 104 -9.231 2.863 9.582 1.00 0.00 C ATOM 1681 CE1 TYR A 104 -9.140 1.724 7.071 1.00 0.00 C ATOM 1682 CE2 TYR A 104 -10.387 2.756 8.833 1.00 0.00 C ATOM 1683 CZ TYR A 104 -10.336 2.187 7.578 1.00 0.00 C ATOM 1684 OH TYR A 104 -11.485 2.078 6.829 1.00 0.00 O ATOM 0 H TYR A 104 -4.538 2.519 8.836 1.00 0.00 H new ATOM 0 HA TYR A 104 -6.542 4.447 8.981 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -6.108 1.669 9.705 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -7.012 2.471 10.974 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -7.054 1.470 7.427 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -9.274 3.310 10.564 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -9.103 1.278 6.088 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -11.325 3.116 9.228 1.00 0.00 H new ATOM 0 HH TYR A 104 -11.464 1.243 6.317 1.00 0.00 H new ATOM 1694 N GLY A 105 -6.312 5.784 11.032 1.00 0.00 N ATOM 1695 CA GLY A 105 -6.180 6.593 12.229 1.00 0.00 C ATOM 1696 C GLY A 105 -7.071 7.820 12.199 1.00 0.00 C ATOM 1697 O GLY A 105 -8.093 7.870 12.883 1.00 0.00 O ATOM 0 H GLY A 105 -6.843 6.219 10.277 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.428 5.989 13.102 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.141 6.904 12.341 1.00 0.00 H new ATOM 1701 N LYS A 106 -6.682 8.811 11.403 1.00 0.00 N ATOM 1702 CA LYS A 106 -7.454 10.044 11.287 1.00 0.00 C ATOM 1703 C LYS A 106 -7.586 10.735 12.640 1.00 0.00 C ATOM 1704 O LYS A 106 -8.586 11.398 12.915 1.00 0.00 O ATOM 1705 CB LYS A 106 -8.841 9.750 10.713 1.00 0.00 C ATOM 1706 CG LYS A 106 -8.902 9.827 9.197 1.00 0.00 C ATOM 1707 CD LYS A 106 -10.311 10.120 8.709 1.00 0.00 C ATOM 1708 CE LYS A 106 -10.303 10.734 7.319 1.00 0.00 C ATOM 1709 NZ LYS A 106 -11.657 10.722 6.698 1.00 0.00 N ATOM 0 H LYS A 106 -5.839 8.785 10.830 1.00 0.00 H new ATOM 0 HA LYS A 106 -6.922 10.713 10.610 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.153 8.755 11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.556 10.457 11.133 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.225 10.605 8.844 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -8.557 8.886 8.770 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -10.892 9.198 8.697 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.804 10.799 9.405 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -9.940 11.760 7.378 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -9.608 10.185 6.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.612 11.165 5.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.987 9.740 6.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -12.319 11.253 7.299 1.00 0.00 H new ATOM 1723 N SER A 107 -6.571 10.574 13.482 1.00 0.00 N ATOM 1724 CA SER A 107 -6.574 11.182 14.808 1.00 0.00 C ATOM 1725 C SER A 107 -5.486 12.245 14.922 1.00 0.00 C ATOM 1726 O SER A 107 -5.778 13.436 15.028 1.00 0.00 O ATOM 1727 CB SER A 107 -6.371 10.111 15.882 1.00 0.00 C ATOM 1728 OG SER A 107 -6.457 10.670 17.182 1.00 0.00 O ATOM 0 H SER A 107 -5.736 10.028 13.270 1.00 0.00 H new ATOM 0 HA SER A 107 -7.541 11.661 14.959 1.00 0.00 H new ATOM 0 HB2 SER A 107 -7.123 9.330 15.768 1.00 0.00 H new ATOM 0 HB3 SER A 107 -5.398 9.638 15.750 1.00 0.00 H new ATOM 0 HG SER A 107 -6.326 9.965 17.850 1.00 0.00 H new ATOM 1734 N GLY A 108 -4.231 11.807 14.901 1.00 0.00 N ATOM 1735 CA GLY A 108 -3.120 12.734 15.003 1.00 0.00 C ATOM 1736 C GLY A 108 -2.084 12.289 16.019 1.00 0.00 C ATOM 1737 O GLY A 108 -2.239 12.540 17.215 1.00 0.00 O ATOM 0 H GLY A 108 -3.964 10.826 14.815 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.646 12.837 14.027 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -3.497 13.719 15.280 1.00 0.00 H new ATOM 1741 N PRO A 109 -1.006 11.619 15.573 1.00 0.00 N ATOM 1742 CA PRO A 109 0.054 11.143 16.467 1.00 0.00 C ATOM 1743 C PRO A 109 0.562 12.237 17.399 1.00 0.00 C ATOM 1744 O PRO A 109 0.748 12.011 18.596 1.00 0.00 O ATOM 1745 CB PRO A 109 1.158 10.704 15.506 1.00 0.00 C ATOM 1746 CG PRO A 109 0.444 10.346 14.249 1.00 0.00 C ATOM 1747 CD PRO A 109 -0.737 11.274 14.163 1.00 0.00 C ATOM 0 HA PRO A 109 -0.296 10.349 17.127 1.00 0.00 H new ATOM 0 HB2 PRO A 109 1.878 11.505 15.338 1.00 0.00 H new ATOM 0 HB3 PRO A 109 1.713 9.854 15.902 1.00 0.00 H new ATOM 0 HG2 PRO A 109 1.096 10.463 13.383 1.00 0.00 H new ATOM 0 HG3 PRO A 109 0.121 9.305 14.267 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -0.510 12.159 13.569 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -1.595 10.790 13.697 1.00 0.00 H new ATOM 1755 N SER A 110 0.784 13.425 16.845 1.00 0.00 N ATOM 1756 CA SER A 110 1.270 14.556 17.627 1.00 0.00 C ATOM 1757 C SER A 110 2.617 14.237 18.267 1.00 0.00 C ATOM 1758 O SER A 110 3.001 13.073 18.382 1.00 0.00 O ATOM 1759 CB SER A 110 0.255 14.929 18.708 1.00 0.00 C ATOM 1760 OG SER A 110 -0.805 15.701 18.169 1.00 0.00 O ATOM 0 H SER A 110 0.635 13.629 15.857 1.00 0.00 H new ATOM 0 HA SER A 110 1.400 15.402 16.952 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.146 14.023 19.163 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.752 15.490 19.499 1.00 0.00 H new ATOM 0 HG SER A 110 -1.441 15.925 18.880 1.00 0.00 H new ATOM 1766 N SER A 111 3.331 15.277 18.682 1.00 0.00 N ATOM 1767 CA SER A 111 4.635 15.108 19.312 1.00 0.00 C ATOM 1768 C SER A 111 5.056 16.379 20.041 1.00 0.00 C ATOM 1769 O SER A 111 5.560 17.321 19.430 1.00 0.00 O ATOM 1770 CB SER A 111 5.685 14.736 18.264 1.00 0.00 C ATOM 1771 OG SER A 111 5.344 13.530 17.604 1.00 0.00 O ATOM 0 H SER A 111 3.028 16.247 18.593 1.00 0.00 H new ATOM 0 HA SER A 111 4.557 14.302 20.041 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.775 15.540 17.534 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.659 14.629 18.742 1.00 0.00 H new ATOM 0 HG SER A 111 4.629 13.078 18.098 1.00 0.00 H new ATOM 1777 N GLY A 112 4.846 16.398 21.354 1.00 0.00 N ATOM 1778 CA GLY A 112 5.210 17.559 22.146 1.00 0.00 C ATOM 1779 C GLY A 112 4.004 18.373 22.572 1.00 0.00 C ATOM 1780 O GLY A 112 3.313 18.918 21.685 1.00 0.00 O ATOM 1781 OXT GLY A 112 3.749 18.464 23.791 1.00 0.00 O ATOM 0 H GLY A 112 4.431 15.631 21.883 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.756 17.234 23.032 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.885 18.191 21.569 1.00 0.00 H new TER 1785 GLY A 112