USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 872 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 96 ASN : amide:sc= -4.31! C(o=-5.6!,f=-7.1!) USER MOD Set 1.2: A 98 HIS :FLIP no HD1:sc= -1.25 F(o=-6.5,f=-5.6) USER MOD Set 2.1: A 52 TYR OH : rot -166:sc= -0.741 USER MOD Set 2.2: A 75 MET CE :methyl -173:sc= -0.924 (180deg=-1.02) USER MOD Set 3.1: A 53 SER OG : rot -160:sc= 0 USER MOD Set 3.2: A 68 ASN : amide:sc= -0.105 X(o=-2,f=-2.1) USER MOD Set 3.3: A 93 MET CE :methyl 142:sc= -1.9 (180deg=-3.73!) USER MOD Set 3.4: A 95 GLN : amide:sc= 0 X(o=-2,f=-2.1) USER MOD Set 3.5: A 100 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 35 LYS NZ :NH3+ 133:sc= 1.29 (180deg=0) USER MOD Set 4.2: A 76 GLN : amide:sc= 1.02 K(o=2.3,f=-11!) USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.0842 (180deg=0) 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 -57:sc= 0.149 USER MOD Single : A 9 HIS : no HD1:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.0269 USER MOD Single : A 14 THR OG1 : rot 35:sc= 0.48 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -165:sc= 0.664 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot -139:sc= 0.0958 USER MOD Single : A 43 SER OG : rot 120:sc= -0.0136 USER MOD Single : A 46 HIS : no HD1:sc= -0.193 K(o=-0.19,f=-0.7) USER MOD Single : A 49 ASN :FLIP amide:sc= -0.354 F(o=-1.4,f=-0.35) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 105:sc= 0.945 USER MOD Single : A 58 LYS NZ :NH3+ 159:sc= -0.0734 (180deg=-0.374) USER MOD Single : A 69 THR OG1 : rot 130:sc= 1.22 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0706 USER MOD Single : A 80 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 81 ASN : amide:sc= -0.48 X(o=-0.48,f=-0.49) USER MOD Single : A 83 MET CE :methyl -155:sc= -0.5 (180deg=-1.66!) USER MOD Single : A 86 THR OG1 : rot -140:sc= -0.771 USER MOD Single : A 88 TYR OH : rot 30:sc= 0.0366 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot -72:sc= 1.38 USER MOD Single : A 104 SER OG : rot -110:sc= -1.41 USER MOD Single : A 111 THR OG1 : rot -158:sc= 1.18 USER MOD Single : A 112 GLN : amide:sc= 0.00305 K(o=0.003,f=-1.4) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 73:sc= 0.0887 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 32.684 25.590 -40.864 1.00 0.00 N ATOM 2 CA GLY A 1 32.283 24.729 -39.767 1.00 0.00 C ATOM 3 C GLY A 1 31.272 23.682 -40.191 1.00 0.00 C ATOM 4 O GLY A 1 30.967 23.547 -41.376 1.00 0.00 O ATOM 0 H1 GLY A 1 33.715 25.533 -40.991 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.210 25.283 -41.737 1.00 0.00 H new ATOM 0 H3 GLY A 1 32.415 26.572 -40.651 1.00 0.00 H new ATOM 0 HA2 GLY A 1 33.163 24.234 -39.357 1.00 0.00 H new ATOM 0 HA3 GLY A 1 31.858 25.337 -38.968 1.00 0.00 H new ATOM 8 N SER A 2 30.751 22.937 -39.220 1.00 0.00 N ATOM 9 CA SER A 2 29.772 21.893 -39.500 1.00 0.00 C ATOM 10 C SER A 2 28.391 22.293 -38.991 1.00 0.00 C ATOM 11 O SER A 2 28.260 22.901 -37.928 1.00 0.00 O ATOM 12 CB SER A 2 30.203 20.575 -38.855 1.00 0.00 C ATOM 13 OG SER A 2 30.125 20.648 -37.442 1.00 0.00 O ATOM 0 H SER A 2 30.991 23.037 -38.234 1.00 0.00 H new ATOM 0 HA SER A 2 29.718 21.760 -40.581 1.00 0.00 H new ATOM 0 HB2 SER A 2 29.568 19.766 -39.216 1.00 0.00 H new ATOM 0 HB3 SER A 2 31.224 20.337 -39.154 1.00 0.00 H new ATOM 0 HG SER A 2 30.404 19.792 -37.054 1.00 0.00 H new ATOM 19 N SER A 3 27.361 21.948 -39.758 1.00 0.00 N ATOM 20 CA SER A 3 25.989 22.274 -39.387 1.00 0.00 C ATOM 21 C SER A 3 25.331 21.106 -38.657 1.00 0.00 C ATOM 22 O SER A 3 25.386 19.965 -39.112 1.00 0.00 O ATOM 23 CB SER A 3 25.175 22.636 -40.631 1.00 0.00 C ATOM 24 OG SER A 3 24.066 23.450 -40.295 1.00 0.00 O ATOM 0 H SER A 3 27.451 21.443 -40.640 1.00 0.00 H new ATOM 0 HA SER A 3 26.014 23.132 -38.715 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.810 23.159 -41.346 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.827 21.726 -41.120 1.00 0.00 H new ATOM 0 HG SER A 3 23.563 23.669 -41.107 1.00 0.00 H new ATOM 30 N GLY A 4 24.709 21.403 -37.520 1.00 0.00 N ATOM 31 CA GLY A 4 24.050 20.369 -36.744 1.00 0.00 C ATOM 32 C GLY A 4 23.133 19.506 -37.589 1.00 0.00 C ATOM 33 O GLY A 4 22.780 19.875 -38.709 1.00 0.00 O ATOM 0 H GLY A 4 24.650 22.341 -37.123 1.00 0.00 H new ATOM 0 HA2 GLY A 4 24.803 19.739 -36.271 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.473 20.832 -35.944 1.00 0.00 H new ATOM 37 N SER A 5 22.748 18.352 -37.052 1.00 0.00 N ATOM 38 CA SER A 5 21.872 17.431 -37.766 1.00 0.00 C ATOM 39 C SER A 5 20.422 17.612 -37.328 1.00 0.00 C ATOM 40 O SER A 5 19.700 16.638 -37.113 1.00 0.00 O ATOM 41 CB SER A 5 22.312 15.986 -37.527 1.00 0.00 C ATOM 42 OG SER A 5 23.481 15.680 -38.267 1.00 0.00 O ATOM 0 H SER A 5 23.029 18.033 -36.125 1.00 0.00 H new ATOM 0 HA SER A 5 21.943 17.653 -38.831 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.499 15.831 -36.465 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.509 15.306 -37.812 1.00 0.00 H new ATOM 0 HG SER A 5 23.743 14.751 -38.096 1.00 0.00 H new ATOM 48 N SER A 6 20.001 18.866 -37.198 1.00 0.00 N ATOM 49 CA SER A 6 18.638 19.177 -36.782 1.00 0.00 C ATOM 50 C SER A 6 18.323 18.536 -35.433 1.00 0.00 C ATOM 51 O SER A 6 17.227 18.021 -35.220 1.00 0.00 O ATOM 52 CB SER A 6 17.639 18.694 -37.835 1.00 0.00 C ATOM 53 OG SER A 6 16.364 19.280 -37.634 1.00 0.00 O ATOM 0 H SER A 6 20.584 19.684 -37.375 1.00 0.00 H new ATOM 0 HA SER A 6 18.552 20.259 -36.680 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.005 18.945 -38.831 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.555 17.608 -37.790 1.00 0.00 H new ATOM 0 HG SER A 6 16.050 19.077 -36.728 1.00 0.00 H new ATOM 59 N GLY A 7 19.294 18.573 -34.526 1.00 0.00 N ATOM 60 CA GLY A 7 19.102 17.994 -33.210 1.00 0.00 C ATOM 61 C GLY A 7 19.991 18.631 -32.160 1.00 0.00 C ATOM 62 O GLY A 7 20.883 19.413 -32.486 1.00 0.00 O ATOM 0 H GLY A 7 20.210 18.994 -34.679 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.059 18.107 -32.915 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.306 16.924 -33.254 1.00 0.00 H new ATOM 66 N GLU A 8 19.745 18.298 -30.897 1.00 0.00 N ATOM 67 CA GLU A 8 20.529 18.846 -29.796 1.00 0.00 C ATOM 68 C GLU A 8 20.613 17.853 -28.640 1.00 0.00 C ATOM 69 O GLU A 8 19.607 17.270 -28.234 1.00 0.00 O ATOM 70 CB GLU A 8 19.917 20.161 -29.310 1.00 0.00 C ATOM 71 CG GLU A 8 18.546 19.997 -28.676 1.00 0.00 C ATOM 72 CD GLU A 8 18.623 19.636 -27.205 1.00 0.00 C ATOM 73 OE1 GLU A 8 19.348 20.331 -26.462 1.00 0.00 O ATOM 74 OE2 GLU A 8 17.960 18.660 -26.797 1.00 0.00 O ATOM 0 H GLU A 8 19.010 17.652 -30.611 1.00 0.00 H new ATOM 0 HA GLU A 8 21.538 19.037 -30.162 1.00 0.00 H new ATOM 0 HB2 GLU A 8 20.590 20.619 -28.586 1.00 0.00 H new ATOM 0 HB3 GLU A 8 19.839 20.849 -30.152 1.00 0.00 H new ATOM 0 HG2 GLU A 8 17.984 20.924 -28.790 1.00 0.00 H new ATOM 0 HG3 GLU A 8 17.994 19.222 -29.208 1.00 0.00 H new ATOM 81 N HIS A 9 21.820 17.665 -28.116 1.00 0.00 N ATOM 82 CA HIS A 9 22.036 16.742 -27.007 1.00 0.00 C ATOM 83 C HIS A 9 21.046 17.010 -25.877 1.00 0.00 C ATOM 84 O HIS A 9 20.458 18.088 -25.796 1.00 0.00 O ATOM 85 CB HIS A 9 23.468 16.865 -26.485 1.00 0.00 C ATOM 86 CG HIS A 9 23.698 18.087 -25.650 1.00 0.00 C ATOM 87 ND1 HIS A 9 24.084 19.300 -26.181 1.00 0.00 N ATOM 88 CD2 HIS A 9 23.594 18.279 -24.314 1.00 0.00 C ATOM 89 CE1 HIS A 9 24.208 20.185 -25.208 1.00 0.00 C ATOM 90 NE2 HIS A 9 23.916 19.591 -24.065 1.00 0.00 N ATOM 0 H HIS A 9 22.663 18.139 -28.441 1.00 0.00 H new ATOM 0 HA HIS A 9 21.877 15.728 -27.374 1.00 0.00 H new ATOM 0 HB2 HIS A 9 23.708 15.981 -25.894 1.00 0.00 H new ATOM 0 HB3 HIS A 9 24.155 16.879 -27.331 1.00 0.00 H new ATOM 0 HD2 HIS A 9 23.311 17.539 -23.581 1.00 0.00 H new ATOM 0 HE1 HIS A 9 24.499 21.218 -25.327 1.00 0.00 H new ATOM 0 HE2 HIS A 9 23.928 20.034 -23.147 1.00 0.00 H new ATOM 99 N ALA A 10 20.866 16.021 -25.008 1.00 0.00 N ATOM 100 CA ALA A 10 19.948 16.150 -23.882 1.00 0.00 C ATOM 101 C ALA A 10 20.693 16.533 -22.608 1.00 0.00 C ATOM 102 O ALA A 10 21.816 16.094 -22.361 1.00 0.00 O ATOM 103 CB ALA A 10 19.179 14.854 -23.677 1.00 0.00 C ATOM 0 H ALA A 10 21.344 15.121 -25.062 1.00 0.00 H new ATOM 0 HA ALA A 10 19.240 16.947 -24.111 1.00 0.00 H new ATOM 0 HB1 ALA A 10 18.498 14.965 -22.833 1.00 0.00 H new ATOM 0 HB2 ALA A 10 18.608 14.623 -24.577 1.00 0.00 H new ATOM 0 HB3 ALA A 10 19.879 14.044 -23.474 1.00 0.00 H new ATOM 109 N PRO A 11 20.055 17.372 -21.778 1.00 0.00 N ATOM 110 CA PRO A 11 20.639 17.832 -20.515 1.00 0.00 C ATOM 111 C PRO A 11 20.729 16.718 -19.478 1.00 0.00 C ATOM 112 O PRO A 11 20.098 15.671 -19.621 1.00 0.00 O ATOM 113 CB PRO A 11 19.666 18.918 -20.049 1.00 0.00 C ATOM 114 CG PRO A 11 18.368 18.563 -20.687 1.00 0.00 C ATOM 115 CD PRO A 11 18.714 17.935 -22.009 1.00 0.00 C ATOM 0 HA PRO A 11 21.663 18.184 -20.644 1.00 0.00 H new ATOM 0 HB2 PRO A 11 19.582 18.934 -18.962 1.00 0.00 H new ATOM 0 HB3 PRO A 11 20.001 19.908 -20.357 1.00 0.00 H new ATOM 0 HG2 PRO A 11 17.803 17.871 -20.063 1.00 0.00 H new ATOM 0 HG3 PRO A 11 17.747 19.448 -20.826 1.00 0.00 H new ATOM 0 HD2 PRO A 11 17.997 17.163 -22.287 1.00 0.00 H new ATOM 0 HD3 PRO A 11 18.720 18.670 -22.814 1.00 0.00 H new ATOM 123 N ALA A 12 21.516 16.950 -18.432 1.00 0.00 N ATOM 124 CA ALA A 12 21.686 15.967 -17.370 1.00 0.00 C ATOM 125 C ALA A 12 21.316 16.556 -16.013 1.00 0.00 C ATOM 126 O ALA A 12 22.142 16.607 -15.100 1.00 0.00 O ATOM 127 CB ALA A 12 23.117 15.452 -17.352 1.00 0.00 C ATOM 0 H ALA A 12 22.046 17.811 -18.298 1.00 0.00 H new ATOM 0 HA ALA A 12 21.014 15.132 -17.570 1.00 0.00 H new ATOM 0 HB1 ALA A 12 23.230 14.718 -16.554 1.00 0.00 H new ATOM 0 HB2 ALA A 12 23.348 14.985 -18.309 1.00 0.00 H new ATOM 0 HB3 ALA A 12 23.801 16.283 -17.180 1.00 0.00 H new ATOM 133 N THR A 13 20.070 17.001 -15.885 1.00 0.00 N ATOM 134 CA THR A 13 19.592 17.588 -14.640 1.00 0.00 C ATOM 135 C THR A 13 18.896 16.546 -13.772 1.00 0.00 C ATOM 136 O THR A 13 17.805 16.783 -13.253 1.00 0.00 O ATOM 137 CB THR A 13 18.617 18.752 -14.906 1.00 0.00 C ATOM 138 OG1 THR A 13 17.835 18.479 -16.073 1.00 0.00 O ATOM 139 CG2 THR A 13 19.373 20.059 -15.090 1.00 0.00 C ATOM 0 H THR A 13 19.373 16.966 -16.629 1.00 0.00 H new ATOM 0 HA THR A 13 20.467 17.969 -14.114 1.00 0.00 H new ATOM 0 HB THR A 13 17.958 18.850 -14.043 1.00 0.00 H new ATOM 0 HG1 THR A 13 17.217 19.222 -16.234 1.00 0.00 H new ATOM 0 HG21 THR A 13 18.664 20.866 -15.276 1.00 0.00 H new ATOM 0 HG22 THR A 13 19.944 20.279 -14.188 1.00 0.00 H new ATOM 0 HG23 THR A 13 20.053 19.970 -15.937 1.00 0.00 H new ATOM 147 N THR A 14 19.534 15.390 -13.618 1.00 0.00 N ATOM 148 CA THR A 14 18.977 14.311 -12.813 1.00 0.00 C ATOM 149 C THR A 14 19.245 14.536 -11.329 1.00 0.00 C ATOM 150 O THR A 14 20.396 14.630 -10.904 1.00 0.00 O ATOM 151 CB THR A 14 19.556 12.944 -13.226 1.00 0.00 C ATOM 152 OG1 THR A 14 20.973 12.931 -13.024 1.00 0.00 O ATOM 153 CG2 THR A 14 19.244 12.644 -14.685 1.00 0.00 C ATOM 0 H THR A 14 20.438 15.177 -14.041 1.00 0.00 H new ATOM 0 HA THR A 14 17.901 14.310 -12.989 1.00 0.00 H new ATOM 0 HB THR A 14 19.094 12.176 -12.606 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.195 13.458 -12.228 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.662 11.674 -14.955 1.00 0.00 H new ATOM 0 HG22 THR A 14 18.164 12.626 -14.830 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.682 13.416 -15.317 1.00 0.00 H new ATOM 161 N GLY A 15 18.175 14.621 -10.545 1.00 0.00 N ATOM 162 CA GLY A 15 18.318 14.834 -9.117 1.00 0.00 C ATOM 163 C GLY A 15 17.892 13.626 -8.305 1.00 0.00 C ATOM 164 O GLY A 15 17.415 12.627 -8.843 1.00 0.00 O ATOM 0 H GLY A 15 17.212 14.546 -10.873 1.00 0.00 H new ATOM 0 HA2 GLY A 15 19.357 15.072 -8.891 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.721 15.696 -8.820 1.00 0.00 H new ATOM 168 N PRO A 16 18.066 13.709 -6.978 1.00 0.00 N ATOM 169 CA PRO A 16 17.704 12.623 -6.062 1.00 0.00 C ATOM 170 C PRO A 16 16.194 12.437 -5.952 1.00 0.00 C ATOM 171 O PRO A 16 15.429 13.392 -6.094 1.00 0.00 O ATOM 172 CB PRO A 16 18.286 13.079 -4.722 1.00 0.00 C ATOM 173 CG PRO A 16 18.349 14.564 -4.823 1.00 0.00 C ATOM 174 CD PRO A 16 18.629 14.870 -6.268 1.00 0.00 C ATOM 0 HA PRO A 16 18.085 11.660 -6.401 1.00 0.00 H new ATOM 0 HB2 PRO A 16 17.656 12.765 -3.889 1.00 0.00 H new ATOM 0 HB3 PRO A 16 19.274 12.651 -4.553 1.00 0.00 H new ATOM 0 HG2 PRO A 16 17.411 15.017 -4.503 1.00 0.00 H new ATOM 0 HG3 PRO A 16 19.132 14.966 -4.180 1.00 0.00 H new ATOM 0 HD2 PRO A 16 18.155 15.801 -6.581 1.00 0.00 H new ATOM 0 HD3 PRO A 16 19.697 14.977 -6.456 1.00 0.00 H new ATOM 182 N LEU A 17 15.772 11.204 -5.696 1.00 0.00 N ATOM 183 CA LEU A 17 14.353 10.893 -5.565 1.00 0.00 C ATOM 184 C LEU A 17 13.954 10.774 -4.097 1.00 0.00 C ATOM 185 O LEU A 17 14.782 10.516 -3.223 1.00 0.00 O ATOM 186 CB LEU A 17 14.025 9.593 -6.301 1.00 0.00 C ATOM 187 CG LEU A 17 13.847 9.705 -7.815 1.00 0.00 C ATOM 188 CD1 LEU A 17 14.146 8.375 -8.488 1.00 0.00 C ATOM 189 CD2 LEU A 17 12.438 10.172 -8.153 1.00 0.00 C ATOM 0 H LEU A 17 16.392 10.403 -5.575 1.00 0.00 H new ATOM 0 HA LEU A 17 13.785 11.709 -6.012 1.00 0.00 H new ATOM 0 HB2 LEU A 17 14.821 8.875 -6.101 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.109 9.180 -5.877 1.00 0.00 H new ATOM 0 HG LEU A 17 14.554 10.445 -8.191 1.00 0.00 H new ATOM 0 HD11 LEU A 17 14.014 8.475 -9.565 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.174 8.082 -8.274 1.00 0.00 H new ATOM 0 HD13 LEU A 17 13.465 7.614 -8.108 1.00 0.00 H new ATOM 0 HD21 LEU A 17 12.329 10.246 -9.235 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.714 9.456 -7.764 1.00 0.00 H new ATOM 0 HD23 LEU A 17 12.261 11.149 -7.703 1.00 0.00 H new ATOM 201 N PRO A 18 12.656 10.966 -3.819 1.00 0.00 N ATOM 202 CA PRO A 18 12.118 10.882 -2.458 1.00 0.00 C ATOM 203 C PRO A 18 12.124 9.456 -1.918 1.00 0.00 C ATOM 204 O PRO A 18 12.760 8.570 -2.489 1.00 0.00 O ATOM 205 CB PRO A 18 10.682 11.389 -2.613 1.00 0.00 C ATOM 206 CG PRO A 18 10.336 11.117 -4.036 1.00 0.00 C ATOM 207 CD PRO A 18 11.614 11.278 -4.811 1.00 0.00 C ATOM 0 HA PRO A 18 12.714 11.456 -1.748 1.00 0.00 H new ATOM 0 HB2 PRO A 18 10.004 10.871 -1.935 1.00 0.00 H new ATOM 0 HB3 PRO A 18 10.611 12.452 -2.385 1.00 0.00 H new ATOM 0 HG2 PRO A 18 9.932 10.111 -4.154 1.00 0.00 H new ATOM 0 HG3 PRO A 18 9.574 11.810 -4.392 1.00 0.00 H new ATOM 0 HD2 PRO A 18 11.655 10.600 -5.664 1.00 0.00 H new ATOM 0 HD3 PRO A 18 11.722 12.290 -5.203 1.00 0.00 H new ATOM 215 N SER A 19 11.412 9.242 -0.817 1.00 0.00 N ATOM 216 CA SER A 19 11.339 7.923 -0.198 1.00 0.00 C ATOM 217 C SER A 19 9.889 7.473 -0.050 1.00 0.00 C ATOM 218 O SER A 19 8.970 8.292 -0.045 1.00 0.00 O ATOM 219 CB SER A 19 12.023 7.940 1.170 1.00 0.00 C ATOM 220 OG SER A 19 12.154 6.628 1.690 1.00 0.00 O ATOM 0 H SER A 19 10.877 9.964 -0.335 1.00 0.00 H new ATOM 0 HA SER A 19 11.856 7.215 -0.845 1.00 0.00 H new ATOM 0 HB2 SER A 19 13.007 8.400 1.082 1.00 0.00 H new ATOM 0 HB3 SER A 19 11.445 8.553 1.862 1.00 0.00 H new ATOM 0 HG SER A 19 12.596 6.665 2.564 1.00 0.00 H new ATOM 226 N ALA A 20 9.692 6.164 0.072 1.00 0.00 N ATOM 227 CA ALA A 20 8.355 5.604 0.223 1.00 0.00 C ATOM 228 C ALA A 20 7.773 5.934 1.593 1.00 0.00 C ATOM 229 O ALA A 20 8.496 6.154 2.565 1.00 0.00 O ATOM 230 CB ALA A 20 8.387 4.097 0.010 1.00 0.00 C ATOM 0 H ALA A 20 10.441 5.472 0.069 1.00 0.00 H new ATOM 0 HA ALA A 20 7.712 6.054 -0.534 1.00 0.00 H new ATOM 0 HB1 ALA A 20 7.382 3.692 0.126 1.00 0.00 H new ATOM 0 HB2 ALA A 20 8.753 3.879 -0.993 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.049 3.640 0.745 1.00 0.00 H new ATOM 236 N PRO A 21 6.434 5.970 1.675 1.00 0.00 N ATOM 237 CA PRO A 21 5.726 6.273 2.922 1.00 0.00 C ATOM 238 C PRO A 21 5.856 5.154 3.949 1.00 0.00 C ATOM 239 O PRO A 21 6.098 3.999 3.596 1.00 0.00 O ATOM 240 CB PRO A 21 4.269 6.422 2.475 1.00 0.00 C ATOM 241 CG PRO A 21 4.170 5.609 1.230 1.00 0.00 C ATOM 242 CD PRO A 21 5.510 5.718 0.557 1.00 0.00 C ATOM 0 HA PRO A 21 6.128 7.158 3.414 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.581 6.061 3.240 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.017 7.466 2.287 1.00 0.00 H new ATOM 0 HG2 PRO A 21 3.932 4.570 1.460 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.377 5.982 0.582 1.00 0.00 H new ATOM 0 HD2 PRO A 21 5.767 4.804 0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 21 5.529 6.529 -0.171 1.00 0.00 H new ATOM 250 N ARG A 22 5.694 5.503 5.221 1.00 0.00 N ATOM 251 CA ARG A 22 5.794 4.527 6.300 1.00 0.00 C ATOM 252 C ARG A 22 4.423 4.243 6.905 1.00 0.00 C ATOM 253 O ARG A 22 3.422 4.838 6.507 1.00 0.00 O ATOM 254 CB ARG A 22 6.748 5.031 7.385 1.00 0.00 C ATOM 255 CG ARG A 22 7.931 5.814 6.840 1.00 0.00 C ATOM 256 CD ARG A 22 9.046 4.889 6.377 1.00 0.00 C ATOM 257 NE ARG A 22 8.690 4.173 5.154 1.00 0.00 N ATOM 258 CZ ARG A 22 9.286 3.053 4.759 1.00 0.00 C ATOM 259 NH1 ARG A 22 10.260 2.524 5.486 1.00 0.00 N ATOM 260 NH2 ARG A 22 8.906 2.460 3.634 1.00 0.00 N ATOM 0 H ARG A 22 5.493 6.454 5.530 1.00 0.00 H new ATOM 0 HA ARG A 22 6.187 3.600 5.882 1.00 0.00 H new ATOM 0 HB2 ARG A 22 6.194 5.663 8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 22 7.119 4.179 7.955 1.00 0.00 H new ATOM 0 HG2 ARG A 22 7.604 6.437 6.007 1.00 0.00 H new ATOM 0 HG3 ARG A 22 8.310 6.485 7.610 1.00 0.00 H new ATOM 0 HD2 ARG A 22 9.952 5.470 6.206 1.00 0.00 H new ATOM 0 HD3 ARG A 22 9.272 4.171 7.165 1.00 0.00 H new ATOM 0 HE ARG A 22 7.944 4.553 4.572 1.00 0.00 H new ATOM 0 HH11 ARG A 22 10.554 2.977 6.351 1.00 0.00 H new ATOM 0 HH12 ARG A 22 10.715 1.664 5.180 1.00 0.00 H new ATOM 0 HH21 ARG A 22 8.156 2.864 3.073 1.00 0.00 H new ATOM 0 HH22 ARG A 22 9.364 1.600 3.331 1.00 0.00 H new ATOM 274 N ASP A 23 4.385 3.330 7.869 1.00 0.00 N ATOM 275 CA ASP A 23 3.137 2.967 8.530 1.00 0.00 C ATOM 276 C ASP A 23 2.054 2.644 7.506 1.00 0.00 C ATOM 277 O ASP A 23 0.910 3.080 7.638 1.00 0.00 O ATOM 278 CB ASP A 23 2.671 4.101 9.444 1.00 0.00 C ATOM 279 CG ASP A 23 3.538 4.243 10.680 1.00 0.00 C ATOM 280 OD1 ASP A 23 4.778 4.194 10.543 1.00 0.00 O ATOM 281 OD2 ASP A 23 2.976 4.401 11.784 1.00 0.00 O ATOM 0 H ASP A 23 5.204 2.828 8.210 1.00 0.00 H new ATOM 0 HA ASP A 23 3.319 2.077 9.132 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.680 5.039 8.888 1.00 0.00 H new ATOM 0 HB3 ASP A 23 1.640 3.919 9.746 1.00 0.00 H new ATOM 286 N VAL A 24 2.422 1.877 6.485 1.00 0.00 N ATOM 287 CA VAL A 24 1.482 1.495 5.438 1.00 0.00 C ATOM 288 C VAL A 24 0.526 0.412 5.925 1.00 0.00 C ATOM 289 O VAL A 24 0.902 -0.755 6.044 1.00 0.00 O ATOM 290 CB VAL A 24 2.216 0.990 4.181 1.00 0.00 C ATOM 291 CG1 VAL A 24 1.219 0.530 3.129 1.00 0.00 C ATOM 292 CG2 VAL A 24 3.128 2.073 3.626 1.00 0.00 C ATOM 0 H VAL A 24 3.365 1.508 6.361 1.00 0.00 H new ATOM 0 HA VAL A 24 0.913 2.389 5.183 1.00 0.00 H new ATOM 0 HB VAL A 24 2.833 0.136 4.460 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.756 0.177 2.249 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.612 -0.280 3.533 1.00 0.00 H new ATOM 0 HG13 VAL A 24 0.574 1.363 2.850 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.639 1.699 2.738 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.535 2.948 3.362 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.866 2.349 4.380 1.00 0.00 H new ATOM 302 N VAL A 25 -0.712 0.805 6.206 1.00 0.00 N ATOM 303 CA VAL A 25 -1.723 -0.133 6.679 1.00 0.00 C ATOM 304 C VAL A 25 -3.063 0.113 5.995 1.00 0.00 C ATOM 305 O VAL A 25 -3.211 1.054 5.216 1.00 0.00 O ATOM 306 CB VAL A 25 -1.912 -0.032 8.204 1.00 0.00 C ATOM 307 CG1 VAL A 25 -0.571 -0.130 8.916 1.00 0.00 C ATOM 308 CG2 VAL A 25 -2.624 1.261 8.569 1.00 0.00 C ATOM 0 H VAL A 25 -1.039 1.767 6.114 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.369 -1.133 6.429 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.533 -0.866 8.531 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -0.724 -0.057 9.993 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -0.103 -1.086 8.680 1.00 0.00 H new ATOM 0 HG13 VAL A 25 0.077 0.682 8.586 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.749 1.315 9.650 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -2.032 2.111 8.229 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.602 1.285 8.089 1.00 0.00 H new ATOM 318 N ALA A 26 -4.038 -0.740 6.292 1.00 0.00 N ATOM 319 CA ALA A 26 -5.368 -0.615 5.708 1.00 0.00 C ATOM 320 C ALA A 26 -6.378 -0.131 6.742 1.00 0.00 C ATOM 321 O ALA A 26 -6.786 -0.885 7.626 1.00 0.00 O ATOM 322 CB ALA A 26 -5.811 -1.944 5.115 1.00 0.00 C ATOM 0 H ALA A 26 -3.932 -1.525 6.934 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.320 0.127 4.911 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.806 -1.836 4.683 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.109 -2.248 4.339 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.836 -2.702 5.898 1.00 0.00 H new ATOM 328 N SER A 27 -6.778 1.131 6.627 1.00 0.00 N ATOM 329 CA SER A 27 -7.738 1.717 7.556 1.00 0.00 C ATOM 330 C SER A 27 -9.050 0.939 7.543 1.00 0.00 C ATOM 331 O SER A 27 -9.802 0.951 8.518 1.00 0.00 O ATOM 332 CB SER A 27 -7.997 3.182 7.198 1.00 0.00 C ATOM 333 OG SER A 27 -9.222 3.633 7.751 1.00 0.00 O ATOM 0 H SER A 27 -6.452 1.768 5.900 1.00 0.00 H new ATOM 0 HA SER A 27 -7.314 1.665 8.559 1.00 0.00 H new ATOM 0 HB2 SER A 27 -7.178 3.800 7.567 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.020 3.296 6.114 1.00 0.00 H new ATOM 0 HG SER A 27 -9.364 4.572 7.509 1.00 0.00 H new ATOM 339 N LEU A 28 -9.319 0.264 6.431 1.00 0.00 N ATOM 340 CA LEU A 28 -10.541 -0.521 6.289 1.00 0.00 C ATOM 341 C LEU A 28 -10.429 -1.496 5.121 1.00 0.00 C ATOM 342 O LEU A 28 -9.723 -1.236 4.147 1.00 0.00 O ATOM 343 CB LEU A 28 -11.743 0.402 6.085 1.00 0.00 C ATOM 344 CG LEU A 28 -12.949 -0.213 5.375 1.00 0.00 C ATOM 345 CD1 LEU A 28 -14.226 0.518 5.760 1.00 0.00 C ATOM 346 CD2 LEU A 28 -12.752 -0.186 3.866 1.00 0.00 C ATOM 0 H LEU A 28 -8.708 0.244 5.615 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.683 -1.095 7.205 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -12.067 0.764 7.061 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -11.415 1.271 5.515 1.00 0.00 H new ATOM 0 HG LEU A 28 -13.040 -1.252 5.691 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -15.073 0.066 5.245 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -14.376 0.446 6.837 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -14.145 1.567 5.474 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -13.621 -0.628 3.378 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -12.634 0.845 3.533 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -11.860 -0.756 3.605 1.00 0.00 H new ATOM 358 N VAL A 29 -11.133 -2.619 5.225 1.00 0.00 N ATOM 359 CA VAL A 29 -11.116 -3.631 4.176 1.00 0.00 C ATOM 360 C VAL A 29 -12.530 -3.976 3.722 1.00 0.00 C ATOM 361 O VAL A 29 -13.268 -4.666 4.426 1.00 0.00 O ATOM 362 CB VAL A 29 -10.412 -4.917 4.649 1.00 0.00 C ATOM 363 CG1 VAL A 29 -10.633 -6.044 3.651 1.00 0.00 C ATOM 364 CG2 VAL A 29 -8.927 -4.664 4.860 1.00 0.00 C ATOM 0 H VAL A 29 -11.722 -2.850 6.025 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.562 -3.209 3.338 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.845 -5.218 5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -10.129 -6.944 4.001 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.701 -6.240 3.555 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.228 -5.756 2.681 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.445 -5.583 5.194 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -8.477 -4.338 3.922 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -8.794 -3.889 5.615 1.00 0.00 H new ATOM 374 N SER A 30 -12.901 -3.493 2.541 1.00 0.00 N ATOM 375 CA SER A 30 -14.229 -3.747 1.994 1.00 0.00 C ATOM 376 C SER A 30 -14.232 -5.014 1.144 1.00 0.00 C ATOM 377 O SER A 30 -13.178 -5.530 0.771 1.00 0.00 O ATOM 378 CB SER A 30 -14.695 -2.556 1.155 1.00 0.00 C ATOM 379 OG SER A 30 -15.835 -2.890 0.383 1.00 0.00 O ATOM 0 H SER A 30 -12.301 -2.924 1.944 1.00 0.00 H new ATOM 0 HA SER A 30 -14.918 -3.887 2.827 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.928 -1.716 1.809 1.00 0.00 H new ATOM 0 HB3 SER A 30 -13.888 -2.233 0.497 1.00 0.00 H new ATOM 0 HG SER A 30 -15.975 -2.208 -0.306 1.00 0.00 H new ATOM 385 N THR A 31 -15.427 -5.513 0.841 1.00 0.00 N ATOM 386 CA THR A 31 -15.570 -6.720 0.036 1.00 0.00 C ATOM 387 C THR A 31 -15.332 -6.427 -1.441 1.00 0.00 C ATOM 388 O THR A 31 -15.037 -7.331 -2.222 1.00 0.00 O ATOM 389 CB THR A 31 -16.967 -7.346 0.206 1.00 0.00 C ATOM 390 OG1 THR A 31 -17.977 -6.389 -0.133 1.00 0.00 O ATOM 391 CG2 THR A 31 -17.175 -7.826 1.634 1.00 0.00 C ATOM 0 H THR A 31 -16.310 -5.099 1.141 1.00 0.00 H new ATOM 0 HA THR A 31 -14.819 -7.426 0.389 1.00 0.00 H new ATOM 0 HB THR A 31 -17.040 -8.204 -0.463 1.00 0.00 H new ATOM 0 HG1 THR A 31 -18.862 -6.795 -0.024 1.00 0.00 H new ATOM 0 HG21 THR A 31 -18.168 -8.264 1.730 1.00 0.00 H new ATOM 0 HG22 THR A 31 -16.423 -8.576 1.879 1.00 0.00 H new ATOM 0 HG23 THR A 31 -17.083 -6.983 2.318 1.00 0.00 H new ATOM 399 N ARG A 32 -15.462 -5.159 -1.817 1.00 0.00 N ATOM 400 CA ARG A 32 -15.262 -4.748 -3.201 1.00 0.00 C ATOM 401 C ARG A 32 -14.092 -3.776 -3.315 1.00 0.00 C ATOM 402 O ARG A 32 -13.712 -3.372 -4.415 1.00 0.00 O ATOM 403 CB ARG A 32 -16.534 -4.100 -3.752 1.00 0.00 C ATOM 404 CG ARG A 32 -17.682 -5.078 -3.943 1.00 0.00 C ATOM 405 CD ARG A 32 -18.723 -4.533 -4.908 1.00 0.00 C ATOM 406 NE ARG A 32 -18.294 -4.652 -6.299 1.00 0.00 N ATOM 407 CZ ARG A 32 -19.101 -4.455 -7.336 1.00 0.00 C ATOM 408 NH1 ARG A 32 -20.372 -4.132 -7.139 1.00 0.00 N ATOM 409 NH2 ARG A 32 -18.637 -4.582 -8.573 1.00 0.00 N ATOM 0 H ARG A 32 -15.705 -4.399 -1.182 1.00 0.00 H new ATOM 0 HA ARG A 32 -15.032 -5.637 -3.789 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -16.851 -3.308 -3.074 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -16.307 -3.628 -4.708 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -17.296 -6.025 -4.320 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -18.149 -5.285 -2.980 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -19.661 -5.070 -4.771 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -18.919 -3.486 -4.677 1.00 0.00 H new ATOM 0 HE ARG A 32 -17.322 -4.900 -6.484 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -20.732 -4.034 -6.190 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -20.989 -3.981 -7.937 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -17.660 -4.831 -8.728 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -19.257 -4.431 -9.368 1.00 0.00 H new ATOM 423 N PHE A 33 -13.526 -3.402 -2.173 1.00 0.00 N ATOM 424 CA PHE A 33 -12.400 -2.475 -2.144 1.00 0.00 C ATOM 425 C PHE A 33 -11.662 -2.556 -0.811 1.00 0.00 C ATOM 426 O PHE A 33 -12.032 -3.335 0.069 1.00 0.00 O ATOM 427 CB PHE A 33 -12.884 -1.044 -2.386 1.00 0.00 C ATOM 428 CG PHE A 33 -13.400 -0.369 -1.148 1.00 0.00 C ATOM 429 CD1 PHE A 33 -12.535 0.292 -0.291 1.00 0.00 C ATOM 430 CD2 PHE A 33 -14.751 -0.395 -0.840 1.00 0.00 C ATOM 431 CE1 PHE A 33 -13.006 0.915 0.849 1.00 0.00 C ATOM 432 CE2 PHE A 33 -15.228 0.227 0.298 1.00 0.00 C ATOM 433 CZ PHE A 33 -14.355 0.881 1.145 1.00 0.00 C ATOM 0 H PHE A 33 -13.828 -3.727 -1.254 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.709 -2.757 -2.939 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.063 -0.456 -2.796 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.673 -1.058 -3.138 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -11.479 0.321 -0.517 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -15.439 -0.907 -1.497 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -12.321 1.428 1.508 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -16.284 0.202 0.525 1.00 0.00 H new ATOM 0 HZ PHE A 33 -14.726 1.365 2.037 1.00 0.00 H new ATOM 443 N ILE A 34 -10.617 -1.748 -0.670 1.00 0.00 N ATOM 444 CA ILE A 34 -9.828 -1.728 0.555 1.00 0.00 C ATOM 445 C ILE A 34 -9.254 -0.339 0.816 1.00 0.00 C ATOM 446 O ILE A 34 -8.584 0.239 -0.039 1.00 0.00 O ATOM 447 CB ILE A 34 -8.673 -2.745 0.498 1.00 0.00 C ATOM 448 CG1 ILE A 34 -9.211 -4.142 0.178 1.00 0.00 C ATOM 449 CG2 ILE A 34 -7.910 -2.755 1.814 1.00 0.00 C ATOM 450 CD1 ILE A 34 -8.126 -5.152 -0.125 1.00 0.00 C ATOM 0 H ILE A 34 -10.297 -1.099 -1.389 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.501 -2.000 1.368 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.986 -2.449 -0.295 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.802 -4.497 1.022 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -9.884 -4.076 -0.677 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.097 -3.479 1.758 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.500 -1.763 2.005 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.585 -3.030 2.624 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.580 -6.119 -0.343 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.550 -4.819 -0.988 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.466 -5.247 0.737 1.00 0.00 H new ATOM 462 N LYS A 35 -9.520 0.190 2.006 1.00 0.00 N ATOM 463 CA LYS A 35 -9.028 1.510 2.383 1.00 0.00 C ATOM 464 C LYS A 35 -7.600 1.428 2.912 1.00 0.00 C ATOM 465 O LYS A 35 -7.315 0.676 3.845 1.00 0.00 O ATOM 466 CB LYS A 35 -9.940 2.133 3.442 1.00 0.00 C ATOM 467 CG LYS A 35 -9.681 3.612 3.675 1.00 0.00 C ATOM 468 CD LYS A 35 -10.150 4.451 2.498 1.00 0.00 C ATOM 469 CE LYS A 35 -9.483 5.818 2.488 1.00 0.00 C ATOM 470 NZ LYS A 35 -10.238 6.810 3.303 1.00 0.00 N ATOM 0 H LYS A 35 -10.073 -0.275 2.726 1.00 0.00 H new ATOM 0 HA LYS A 35 -9.031 2.139 1.493 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -10.979 1.998 3.140 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -9.809 1.597 4.382 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -10.195 3.934 4.581 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.616 3.775 3.838 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -9.928 3.930 1.567 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -11.232 4.573 2.545 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.467 5.729 2.873 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -9.404 6.176 1.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -9.579 7.327 3.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -10.722 7.481 2.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -10.942 6.315 3.887 1.00 0.00 H new ATOM 484 N LEU A 36 -6.706 2.206 2.311 1.00 0.00 N ATOM 485 CA LEU A 36 -5.306 2.222 2.723 1.00 0.00 C ATOM 486 C LEU A 36 -4.975 3.506 3.476 1.00 0.00 C ATOM 487 O LEU A 36 -5.658 4.520 3.328 1.00 0.00 O ATOM 488 CB LEU A 36 -4.394 2.083 1.503 1.00 0.00 C ATOM 489 CG LEU A 36 -4.012 0.655 1.110 1.00 0.00 C ATOM 490 CD1 LEU A 36 -3.241 -0.020 2.233 1.00 0.00 C ATOM 491 CD2 LEU A 36 -5.253 -0.150 0.753 1.00 0.00 C ATOM 0 H LEU A 36 -6.925 2.834 1.537 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.139 1.377 3.392 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.885 2.554 0.651 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.479 2.644 1.693 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.368 0.700 0.232 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.978 -1.035 1.935 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.332 0.544 2.441 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.860 -0.054 3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.962 -1.163 0.476 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.922 -0.187 1.612 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.765 0.323 -0.085 1.00 0.00 H new ATOM 503 N THR A 37 -3.920 3.457 4.284 1.00 0.00 N ATOM 504 CA THR A 37 -3.497 4.616 5.059 1.00 0.00 C ATOM 505 C THR A 37 -2.023 4.518 5.436 1.00 0.00 C ATOM 506 O THR A 37 -1.574 3.499 5.960 1.00 0.00 O ATOM 507 CB THR A 37 -4.334 4.769 6.343 1.00 0.00 C ATOM 508 OG1 THR A 37 -4.489 3.496 6.981 1.00 0.00 O ATOM 509 CG2 THR A 37 -5.703 5.355 6.031 1.00 0.00 C ATOM 0 H THR A 37 -3.343 2.627 4.418 1.00 0.00 H new ATOM 0 HA THR A 37 -3.650 5.491 4.427 1.00 0.00 H new ATOM 0 HB THR A 37 -3.809 5.450 7.013 1.00 0.00 H new ATOM 0 HG1 THR A 37 -5.021 3.602 7.797 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.275 5.453 6.953 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.583 6.336 5.572 1.00 0.00 H new ATOM 0 HG23 THR A 37 -6.233 4.696 5.344 1.00 0.00 H new ATOM 517 N TRP A 38 -1.277 5.582 5.166 1.00 0.00 N ATOM 518 CA TRP A 38 0.148 5.615 5.478 1.00 0.00 C ATOM 519 C TRP A 38 0.575 7.008 5.928 1.00 0.00 C ATOM 520 O TRP A 38 -0.172 7.975 5.778 1.00 0.00 O ATOM 521 CB TRP A 38 0.968 5.186 4.260 1.00 0.00 C ATOM 522 CG TRP A 38 0.729 6.040 3.052 1.00 0.00 C ATOM 523 CD1 TRP A 38 1.366 7.205 2.733 1.00 0.00 C ATOM 524 CD2 TRP A 38 -0.216 5.797 2.003 1.00 0.00 C ATOM 525 NE1 TRP A 38 0.874 7.701 1.549 1.00 0.00 N ATOM 526 CE2 TRP A 38 -0.096 6.855 1.081 1.00 0.00 C ATOM 527 CE3 TRP A 38 -1.149 4.787 1.753 1.00 0.00 C ATOM 528 CZ2 TRP A 38 -0.876 6.930 -0.070 1.00 0.00 C ATOM 529 CZ3 TRP A 38 -1.922 4.864 0.610 1.00 0.00 C ATOM 530 CH2 TRP A 38 -1.781 5.928 -0.290 1.00 0.00 C ATOM 0 H TRP A 38 -1.634 6.433 4.732 1.00 0.00 H new ATOM 0 HA TRP A 38 0.331 4.917 6.295 1.00 0.00 H new ATOM 0 HB2 TRP A 38 2.027 5.218 4.515 1.00 0.00 H new ATOM 0 HB3 TRP A 38 0.730 4.151 4.017 1.00 0.00 H new ATOM 0 HD1 TRP A 38 2.142 7.669 3.324 1.00 0.00 H new ATOM 0 HE1 TRP A 38 1.182 8.560 1.093 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -1.264 3.962 2.440 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.770 7.750 -0.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -2.648 4.090 0.407 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -2.399 5.958 -1.175 1.00 0.00 H new ATOM 541 N ARG A 39 1.780 7.104 6.480 1.00 0.00 N ATOM 542 CA ARG A 39 2.305 8.379 6.952 1.00 0.00 C ATOM 543 C ARG A 39 3.263 8.985 5.931 1.00 0.00 C ATOM 544 O ARG A 39 3.519 8.398 4.878 1.00 0.00 O ATOM 545 CB ARG A 39 3.021 8.195 8.292 1.00 0.00 C ATOM 546 CG ARG A 39 2.075 8.048 9.473 1.00 0.00 C ATOM 547 CD ARG A 39 2.816 7.623 10.730 1.00 0.00 C ATOM 548 NE ARG A 39 1.910 7.419 11.857 1.00 0.00 N ATOM 549 CZ ARG A 39 1.353 8.412 12.541 1.00 0.00 C ATOM 550 NH1 ARG A 39 1.607 9.671 12.214 1.00 0.00 N ATOM 551 NH2 ARG A 39 0.538 8.146 13.554 1.00 0.00 N ATOM 0 H ARG A 39 2.411 6.314 6.611 1.00 0.00 H new ATOM 0 HA ARG A 39 1.466 9.061 7.086 1.00 0.00 H new ATOM 0 HB2 ARG A 39 3.658 7.312 8.236 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.675 9.050 8.465 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.565 8.995 9.652 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.307 7.312 9.236 1.00 0.00 H new ATOM 0 HD2 ARG A 39 3.364 6.701 10.534 1.00 0.00 H new ATOM 0 HD3 ARG A 39 3.553 8.382 10.990 1.00 0.00 H new ATOM 0 HE ARG A 39 1.693 6.462 12.134 1.00 0.00 H new ATOM 0 HH11 ARG A 39 2.232 9.880 11.435 1.00 0.00 H new ATOM 0 HH12 ARG A 39 1.178 10.431 12.741 1.00 0.00 H new ATOM 0 HH21 ARG A 39 0.339 7.178 13.808 1.00 0.00 H new ATOM 0 HH22 ARG A 39 0.111 8.909 14.079 1.00 0.00 H new ATOM 565 N THR A 40 3.789 10.164 6.247 1.00 0.00 N ATOM 566 CA THR A 40 4.717 10.850 5.357 1.00 0.00 C ATOM 567 C THR A 40 6.069 10.147 5.323 1.00 0.00 C ATOM 568 O THR A 40 6.546 9.618 6.327 1.00 0.00 O ATOM 569 CB THR A 40 4.924 12.316 5.783 1.00 0.00 C ATOM 570 OG1 THR A 40 4.784 12.437 7.203 1.00 0.00 O ATOM 571 CG2 THR A 40 3.923 13.228 5.090 1.00 0.00 C ATOM 0 H THR A 40 3.588 10.664 7.113 1.00 0.00 H new ATOM 0 HA THR A 40 4.274 10.827 4.361 1.00 0.00 H new ATOM 0 HB THR A 40 5.929 12.618 5.490 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.284 13.253 7.414 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.089 14.258 5.407 1.00 0.00 H new ATOM 0 HG22 THR A 40 4.052 13.155 4.010 1.00 0.00 H new ATOM 0 HG23 THR A 40 2.910 12.925 5.356 1.00 0.00 H new ATOM 579 N PRO A 41 6.703 10.139 4.141 1.00 0.00 N ATOM 580 CA PRO A 41 8.010 9.505 3.948 1.00 0.00 C ATOM 581 C PRO A 41 9.131 10.259 4.656 1.00 0.00 C ATOM 582 O PRO A 41 9.074 11.480 4.802 1.00 0.00 O ATOM 583 CB PRO A 41 8.208 9.553 2.431 1.00 0.00 C ATOM 584 CG PRO A 41 7.379 10.704 1.978 1.00 0.00 C ATOM 585 CD PRO A 41 6.193 10.750 2.902 1.00 0.00 C ATOM 0 HA PRO A 41 8.039 8.498 4.363 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.257 9.695 2.173 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.887 8.624 1.960 1.00 0.00 H new ATOM 0 HG2 PRO A 41 7.945 11.634 2.023 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.063 10.574 0.943 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.852 11.772 3.068 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.347 10.194 2.498 1.00 0.00 H new ATOM 593 N ALA A 42 10.148 9.525 5.094 1.00 0.00 N ATOM 594 CA ALA A 42 11.283 10.125 5.784 1.00 0.00 C ATOM 595 C ALA A 42 11.856 11.292 4.986 1.00 0.00 C ATOM 596 O ALA A 42 12.292 12.292 5.557 1.00 0.00 O ATOM 597 CB ALA A 42 12.359 9.080 6.039 1.00 0.00 C ATOM 0 H ALA A 42 10.209 8.513 4.983 1.00 0.00 H new ATOM 0 HA ALA A 42 10.932 10.510 6.741 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.200 9.543 6.555 1.00 0.00 H new ATOM 0 HB2 ALA A 42 11.950 8.280 6.656 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.698 8.668 5.089 1.00 0.00 H new ATOM 603 N SER A 43 11.852 11.157 3.664 1.00 0.00 N ATOM 604 CA SER A 43 12.375 12.199 2.788 1.00 0.00 C ATOM 605 C SER A 43 11.478 13.432 2.814 1.00 0.00 C ATOM 606 O SER A 43 11.960 14.563 2.887 1.00 0.00 O ATOM 607 CB SER A 43 12.500 11.675 1.356 1.00 0.00 C ATOM 608 OG SER A 43 12.642 12.742 0.433 1.00 0.00 O ATOM 0 H SER A 43 11.493 10.337 3.176 1.00 0.00 H new ATOM 0 HA SER A 43 13.363 12.483 3.151 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.360 11.010 1.283 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.619 11.086 1.103 1.00 0.00 H new ATOM 0 HG SER A 43 13.493 12.651 -0.044 1.00 0.00 H new ATOM 614 N ASP A 44 10.170 13.206 2.753 1.00 0.00 N ATOM 615 CA ASP A 44 9.204 14.298 2.771 1.00 0.00 C ATOM 616 C ASP A 44 8.243 14.154 3.947 1.00 0.00 C ATOM 617 O ASP A 44 7.310 13.351 3.924 1.00 0.00 O ATOM 618 CB ASP A 44 8.420 14.334 1.458 1.00 0.00 C ATOM 619 CG ASP A 44 9.109 15.168 0.395 1.00 0.00 C ATOM 620 OD1 ASP A 44 9.937 14.608 -0.354 1.00 0.00 O ATOM 621 OD2 ASP A 44 8.820 16.380 0.313 1.00 0.00 O ATOM 0 H ASP A 44 9.755 12.276 2.691 1.00 0.00 H new ATOM 0 HA ASP A 44 9.752 15.234 2.885 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.288 13.317 1.089 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.424 14.737 1.644 1.00 0.00 H new ATOM 626 N PRO A 45 8.475 14.949 5.002 1.00 0.00 N ATOM 627 CA PRO A 45 7.641 14.929 6.207 1.00 0.00 C ATOM 628 C PRO A 45 6.249 15.499 5.959 1.00 0.00 C ATOM 629 O PRO A 45 5.320 15.254 6.729 1.00 0.00 O ATOM 630 CB PRO A 45 8.414 15.814 7.188 1.00 0.00 C ATOM 631 CG PRO A 45 9.216 16.725 6.325 1.00 0.00 C ATOM 632 CD PRO A 45 9.568 15.931 5.098 1.00 0.00 C ATOM 0 HA PRO A 45 7.472 13.915 6.568 1.00 0.00 H new ATOM 0 HB2 PRO A 45 7.737 16.374 7.834 1.00 0.00 H new ATOM 0 HB3 PRO A 45 9.055 15.218 7.838 1.00 0.00 H new ATOM 0 HG2 PRO A 45 8.646 17.616 6.063 1.00 0.00 H new ATOM 0 HG3 PRO A 45 10.114 17.062 6.842 1.00 0.00 H new ATOM 0 HD2 PRO A 45 9.619 16.563 4.211 1.00 0.00 H new ATOM 0 HD3 PRO A 45 10.538 15.444 5.199 1.00 0.00 H new ATOM 640 N HIS A 46 6.111 16.262 4.879 1.00 0.00 N ATOM 641 CA HIS A 46 4.830 16.867 4.529 1.00 0.00 C ATOM 642 C HIS A 46 4.255 16.229 3.267 1.00 0.00 C ATOM 643 O HIS A 46 3.043 16.223 3.061 1.00 0.00 O ATOM 644 CB HIS A 46 4.993 18.373 4.325 1.00 0.00 C ATOM 645 CG HIS A 46 6.349 18.767 3.825 1.00 0.00 C ATOM 646 ND1 HIS A 46 6.853 18.353 2.611 1.00 0.00 N ATOM 647 CD2 HIS A 46 7.306 19.544 4.383 1.00 0.00 C ATOM 648 CE1 HIS A 46 8.063 18.856 2.444 1.00 0.00 C ATOM 649 NE2 HIS A 46 8.361 19.584 3.505 1.00 0.00 N ATOM 0 H HIS A 46 6.870 16.476 4.232 1.00 0.00 H new ATOM 0 HA HIS A 46 4.136 16.693 5.351 1.00 0.00 H new ATOM 0 HB2 HIS A 46 4.239 18.719 3.618 1.00 0.00 H new ATOM 0 HB3 HIS A 46 4.801 18.882 5.270 1.00 0.00 H new ATOM 0 HD2 HIS A 46 7.250 20.040 5.341 1.00 0.00 H new ATOM 0 HE1 HIS A 46 8.700 18.699 1.586 1.00 0.00 H new ATOM 0 HE2 HIS A 46 9.233 20.093 3.649 1.00 0.00 H new ATOM 658 N GLY A 47 5.135 15.695 2.426 1.00 0.00 N ATOM 659 CA GLY A 47 4.696 15.063 1.195 1.00 0.00 C ATOM 660 C GLY A 47 3.478 15.741 0.599 1.00 0.00 C ATOM 661 O GLY A 47 2.629 15.086 -0.006 1.00 0.00 O ATOM 0 H GLY A 47 6.144 15.689 2.575 1.00 0.00 H new ATOM 0 HA2 GLY A 47 5.510 15.082 0.470 1.00 0.00 H new ATOM 0 HA3 GLY A 47 4.466 14.015 1.390 1.00 0.00 H new ATOM 665 N ASP A 48 3.391 17.055 0.770 1.00 0.00 N ATOM 666 CA ASP A 48 2.268 17.822 0.245 1.00 0.00 C ATOM 667 C ASP A 48 2.528 18.248 -1.197 1.00 0.00 C ATOM 668 O ASP A 48 1.596 18.530 -1.949 1.00 0.00 O ATOM 669 CB ASP A 48 2.011 19.053 1.115 1.00 0.00 C ATOM 670 CG ASP A 48 0.777 19.820 0.684 1.00 0.00 C ATOM 671 OD1 ASP A 48 -0.325 19.497 1.175 1.00 0.00 O ATOM 672 OD2 ASP A 48 0.912 20.745 -0.144 1.00 0.00 O ATOM 0 H ASP A 48 4.085 17.612 1.268 1.00 0.00 H new ATOM 0 HA ASP A 48 1.384 17.184 0.263 1.00 0.00 H new ATOM 0 HB2 ASP A 48 1.898 18.743 2.154 1.00 0.00 H new ATOM 0 HB3 ASP A 48 2.878 19.712 1.072 1.00 0.00 H new ATOM 677 N ASN A 49 3.801 18.294 -1.574 1.00 0.00 N ATOM 678 CA ASN A 49 4.184 18.688 -2.925 1.00 0.00 C ATOM 679 C ASN A 49 4.499 17.464 -3.780 1.00 0.00 C ATOM 680 O ASN A 49 5.195 17.562 -4.791 1.00 0.00 O ATOM 681 CB ASN A 49 5.397 19.620 -2.883 1.00 0.00 C ATOM 682 CG ASN A 49 6.348 19.280 -1.752 1.00 0.00 C ATOM 683 OD1 ASN A 49 6.762 18.020 -1.686 1.00 0.00 O flip ATOM 684 ND2 ASN A 49 6.707 20.140 -0.948 1.00 0.00 N flip ATOM 0 H ASN A 49 4.585 18.063 -0.964 1.00 0.00 H new ATOM 0 HA ASN A 49 3.343 19.217 -3.374 1.00 0.00 H new ATOM 0 HB2 ASN A 49 5.930 19.561 -3.832 1.00 0.00 H new ATOM 0 HB3 ASN A 49 5.057 20.650 -2.771 1.00 0.00 H new ATOM 0 HD21 ASN A 49 6.364 21.096 -1.037 1.00 0.00 H new ATOM 0 HD22 ASN A 49 7.348 19.896 -0.193 1.00 0.00 H new ATOM 691 N LEU A 50 3.981 16.312 -3.367 1.00 0.00 N ATOM 692 CA LEU A 50 4.206 15.068 -4.095 1.00 0.00 C ATOM 693 C LEU A 50 3.000 14.142 -3.976 1.00 0.00 C ATOM 694 O LEU A 50 2.413 14.003 -2.902 1.00 0.00 O ATOM 695 CB LEU A 50 5.457 14.365 -3.568 1.00 0.00 C ATOM 696 CG LEU A 50 5.697 14.462 -2.061 1.00 0.00 C ATOM 697 CD1 LEU A 50 5.004 13.320 -1.335 1.00 0.00 C ATOM 698 CD2 LEU A 50 7.189 14.462 -1.757 1.00 0.00 C ATOM 0 H LEU A 50 3.403 16.214 -2.532 1.00 0.00 H new ATOM 0 HA LEU A 50 4.351 15.313 -5.147 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.398 13.311 -3.839 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.325 14.778 -4.081 1.00 0.00 H new ATOM 0 HG LEU A 50 5.274 15.401 -1.705 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.186 13.406 -0.264 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.932 13.365 -1.525 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.397 12.369 -1.695 1.00 0.00 H new ATOM 0 HD21 LEU A 50 7.341 14.532 -0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 50 7.636 13.539 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.660 15.315 -2.246 1.00 0.00 H new ATOM 710 N THR A 51 2.634 13.508 -5.086 1.00 0.00 N ATOM 711 CA THR A 51 1.499 12.594 -5.106 1.00 0.00 C ATOM 712 C THR A 51 1.907 11.201 -4.641 1.00 0.00 C ATOM 713 O THR A 51 3.093 10.909 -4.488 1.00 0.00 O ATOM 714 CB THR A 51 0.884 12.493 -6.514 1.00 0.00 C ATOM 715 OG1 THR A 51 1.068 13.726 -7.219 1.00 0.00 O ATOM 716 CG2 THR A 51 -0.599 12.165 -6.435 1.00 0.00 C ATOM 0 H THR A 51 3.108 13.611 -5.983 1.00 0.00 H new ATOM 0 HA THR A 51 0.755 12.999 -4.421 1.00 0.00 H new ATOM 0 HB THR A 51 1.389 11.690 -7.050 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.676 13.653 -8.114 1.00 0.00 H new ATOM 0 HG21 THR A 51 -1.011 12.099 -7.442 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.734 11.212 -5.924 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.116 12.949 -5.882 1.00 0.00 H new ATOM 724 N TYR A 52 0.917 10.344 -4.417 1.00 0.00 N ATOM 725 CA TYR A 52 1.173 8.981 -3.968 1.00 0.00 C ATOM 726 C TYR A 52 0.468 7.969 -4.866 1.00 0.00 C ATOM 727 O TYR A 52 -0.719 8.106 -5.163 1.00 0.00 O ATOM 728 CB TYR A 52 0.710 8.804 -2.521 1.00 0.00 C ATOM 729 CG TYR A 52 1.567 9.541 -1.516 1.00 0.00 C ATOM 730 CD1 TYR A 52 2.866 9.126 -1.245 1.00 0.00 C ATOM 731 CD2 TYR A 52 1.079 10.650 -0.838 1.00 0.00 C ATOM 732 CE1 TYR A 52 3.652 9.796 -0.328 1.00 0.00 C ATOM 733 CE2 TYR A 52 1.859 11.327 0.080 1.00 0.00 C ATOM 734 CZ TYR A 52 3.145 10.896 0.331 1.00 0.00 C ATOM 735 OH TYR A 52 3.924 11.566 1.246 1.00 0.00 O ATOM 0 H TYR A 52 -0.070 10.569 -4.539 1.00 0.00 H new ATOM 0 HA TYR A 52 2.247 8.803 -4.024 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -0.319 9.152 -2.433 1.00 0.00 H new ATOM 0 HB3 TYR A 52 0.710 7.742 -2.276 1.00 0.00 H new ATOM 0 HD1 TYR A 52 3.267 8.266 -1.760 1.00 0.00 H new ATOM 0 HD2 TYR A 52 0.072 10.989 -1.031 1.00 0.00 H new ATOM 0 HE1 TYR A 52 4.659 9.460 -0.128 1.00 0.00 H new ATOM 0 HE2 TYR A 52 1.464 12.189 0.598 1.00 0.00 H new ATOM 0 HH TYR A 52 3.361 12.165 1.779 1.00 0.00 H new ATOM 745 N SER A 53 1.208 6.953 -5.296 1.00 0.00 N ATOM 746 CA SER A 53 0.657 5.918 -6.164 1.00 0.00 C ATOM 747 C SER A 53 0.503 4.601 -5.409 1.00 0.00 C ATOM 748 O SER A 53 1.353 4.235 -4.597 1.00 0.00 O ATOM 749 CB SER A 53 1.554 5.717 -7.387 1.00 0.00 C ATOM 750 OG SER A 53 1.252 6.660 -8.401 1.00 0.00 O ATOM 0 H SER A 53 2.191 6.824 -5.058 1.00 0.00 H new ATOM 0 HA SER A 53 -0.329 6.244 -6.496 1.00 0.00 H new ATOM 0 HB2 SER A 53 2.600 5.814 -7.095 1.00 0.00 H new ATOM 0 HB3 SER A 53 1.424 4.707 -7.775 1.00 0.00 H new ATOM 0 HG SER A 53 1.588 6.334 -9.262 1.00 0.00 H new ATOM 756 N VAL A 54 -0.587 3.892 -5.684 1.00 0.00 N ATOM 757 CA VAL A 54 -0.853 2.615 -5.032 1.00 0.00 C ATOM 758 C VAL A 54 -1.023 1.500 -6.058 1.00 0.00 C ATOM 759 O VAL A 54 -1.959 1.515 -6.858 1.00 0.00 O ATOM 760 CB VAL A 54 -2.116 2.686 -4.153 1.00 0.00 C ATOM 761 CG1 VAL A 54 -2.454 1.312 -3.594 1.00 0.00 C ATOM 762 CG2 VAL A 54 -1.928 3.696 -3.031 1.00 0.00 C ATOM 0 H VAL A 54 -1.300 4.180 -6.354 1.00 0.00 H new ATOM 0 HA VAL A 54 0.008 2.396 -4.400 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.951 3.016 -4.771 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -3.349 1.381 -2.975 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.633 0.619 -4.416 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.622 0.950 -2.990 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.830 3.733 -2.420 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.082 3.398 -2.411 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.737 4.681 -3.457 1.00 0.00 H new ATOM 772 N PHE A 55 -0.112 0.533 -6.029 1.00 0.00 N ATOM 773 CA PHE A 55 -0.160 -0.591 -6.957 1.00 0.00 C ATOM 774 C PHE A 55 -0.690 -1.844 -6.266 1.00 0.00 C ATOM 775 O PHE A 55 -0.116 -2.314 -5.284 1.00 0.00 O ATOM 776 CB PHE A 55 1.230 -0.863 -7.535 1.00 0.00 C ATOM 777 CG PHE A 55 1.911 0.367 -8.064 1.00 0.00 C ATOM 778 CD1 PHE A 55 2.613 1.207 -7.214 1.00 0.00 C ATOM 779 CD2 PHE A 55 1.848 0.684 -9.411 1.00 0.00 C ATOM 780 CE1 PHE A 55 3.240 2.339 -7.698 1.00 0.00 C ATOM 781 CE2 PHE A 55 2.474 1.815 -9.901 1.00 0.00 C ATOM 782 CZ PHE A 55 3.170 2.644 -9.043 1.00 0.00 C ATOM 0 H PHE A 55 0.668 0.505 -5.373 1.00 0.00 H new ATOM 0 HA PHE A 55 -0.839 -0.330 -7.769 1.00 0.00 H new ATOM 0 HB2 PHE A 55 1.855 -1.310 -6.762 1.00 0.00 H new ATOM 0 HB3 PHE A 55 1.144 -1.595 -8.338 1.00 0.00 H new ATOM 0 HD1 PHE A 55 2.671 0.974 -6.161 1.00 0.00 H new ATOM 0 HD2 PHE A 55 1.304 0.040 -10.086 1.00 0.00 H new ATOM 0 HE1 PHE A 55 3.784 2.985 -7.025 1.00 0.00 H new ATOM 0 HE2 PHE A 55 2.419 2.050 -10.954 1.00 0.00 H new ATOM 0 HZ PHE A 55 3.658 3.529 -9.423 1.00 0.00 H new ATOM 792 N TYR A 56 -1.789 -2.379 -6.787 1.00 0.00 N ATOM 793 CA TYR A 56 -2.399 -3.575 -6.219 1.00 0.00 C ATOM 794 C TYR A 56 -2.469 -4.694 -7.254 1.00 0.00 C ATOM 795 O TYR A 56 -2.665 -4.445 -8.444 1.00 0.00 O ATOM 796 CB TYR A 56 -3.802 -3.259 -5.698 1.00 0.00 C ATOM 797 CG TYR A 56 -4.625 -2.415 -6.645 1.00 0.00 C ATOM 798 CD1 TYR A 56 -4.380 -1.054 -6.784 1.00 0.00 C ATOM 799 CD2 TYR A 56 -5.646 -2.977 -7.401 1.00 0.00 C ATOM 800 CE1 TYR A 56 -5.129 -0.278 -7.648 1.00 0.00 C ATOM 801 CE2 TYR A 56 -6.399 -2.209 -8.268 1.00 0.00 C ATOM 802 CZ TYR A 56 -6.137 -0.861 -8.388 1.00 0.00 C ATOM 803 OH TYR A 56 -6.886 -0.092 -9.249 1.00 0.00 O ATOM 0 H TYR A 56 -2.275 -2.003 -7.601 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.777 -3.910 -5.389 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -4.329 -4.194 -5.507 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -3.717 -2.740 -4.743 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.591 -0.595 -6.207 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -5.855 -4.033 -7.309 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -4.927 0.779 -7.743 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.189 -2.662 -8.849 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.553 -0.655 -9.694 1.00 0.00 H new ATOM 813 N THR A 57 -2.308 -5.930 -6.792 1.00 0.00 N ATOM 814 CA THR A 57 -2.352 -7.088 -7.675 1.00 0.00 C ATOM 815 C THR A 57 -2.510 -8.380 -6.880 1.00 0.00 C ATOM 816 O THR A 57 -1.932 -8.534 -5.805 1.00 0.00 O ATOM 817 CB THR A 57 -1.081 -7.184 -8.540 1.00 0.00 C ATOM 818 OG1 THR A 57 -1.071 -8.420 -9.262 1.00 0.00 O ATOM 819 CG2 THR A 57 0.169 -7.084 -7.679 1.00 0.00 C ATOM 0 H THR A 57 -2.146 -6.154 -5.810 1.00 0.00 H new ATOM 0 HA THR A 57 -3.216 -6.956 -8.326 1.00 0.00 H new ATOM 0 HB THR A 57 -1.085 -6.352 -9.245 1.00 0.00 H new ATOM 0 HG1 THR A 57 -1.290 -8.251 -10.202 1.00 0.00 H new ATOM 0 HG21 THR A 57 1.053 -7.154 -8.312 1.00 0.00 H new ATOM 0 HG22 THR A 57 0.174 -6.129 -7.154 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.177 -7.897 -6.953 1.00 0.00 H new ATOM 827 N LYS A 58 -3.297 -9.307 -7.417 1.00 0.00 N ATOM 828 CA LYS A 58 -3.530 -10.587 -6.760 1.00 0.00 C ATOM 829 C LYS A 58 -2.212 -11.298 -6.469 1.00 0.00 C ATOM 830 O LYS A 58 -1.384 -11.477 -7.362 1.00 0.00 O ATOM 831 CB LYS A 58 -4.420 -11.476 -7.631 1.00 0.00 C ATOM 832 CG LYS A 58 -5.082 -12.609 -6.867 1.00 0.00 C ATOM 833 CD LYS A 58 -6.409 -13.004 -7.493 1.00 0.00 C ATOM 834 CE LYS A 58 -6.219 -14.032 -8.598 1.00 0.00 C ATOM 835 NZ LYS A 58 -5.786 -15.351 -8.061 1.00 0.00 N ATOM 0 H LYS A 58 -3.784 -9.195 -8.306 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.035 -10.394 -5.813 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.192 -10.861 -8.093 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.820 -11.895 -8.439 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.417 -13.472 -6.847 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.243 -12.306 -5.832 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.068 -13.410 -6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.899 -12.119 -7.898 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -7.153 -14.152 -9.146 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.477 -13.668 -9.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.005 -16.096 -8.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.761 -15.334 -7.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.289 -15.546 -7.172 1.00 0.00 H new ATOM 849 N GLU A 59 -2.025 -11.700 -5.216 1.00 0.00 N ATOM 850 CA GLU A 59 -0.807 -12.392 -4.810 1.00 0.00 C ATOM 851 C GLU A 59 -0.325 -13.335 -5.908 1.00 0.00 C ATOM 852 O GLU A 59 0.870 -13.597 -6.036 1.00 0.00 O ATOM 853 CB GLU A 59 -1.047 -13.176 -3.518 1.00 0.00 C ATOM 854 CG GLU A 59 0.204 -13.355 -2.674 1.00 0.00 C ATOM 855 CD GLU A 59 0.067 -14.471 -1.657 1.00 0.00 C ATOM 856 OE1 GLU A 59 0.054 -15.650 -2.069 1.00 0.00 O ATOM 857 OE2 GLU A 59 -0.028 -14.166 -0.450 1.00 0.00 O ATOM 0 H GLU A 59 -2.701 -11.559 -4.465 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.035 -11.643 -4.634 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.804 -12.662 -2.926 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -1.450 -14.157 -3.768 1.00 0.00 H new ATOM 0 HG2 GLU A 59 1.051 -13.566 -3.327 1.00 0.00 H new ATOM 0 HG3 GLU A 59 0.425 -12.422 -2.156 1.00 0.00 H new ATOM 864 N GLY A 60 -1.266 -13.843 -6.699 1.00 0.00 N ATOM 865 CA GLY A 60 -0.918 -14.752 -7.776 1.00 0.00 C ATOM 866 C GLY A 60 -0.633 -14.027 -9.077 1.00 0.00 C ATOM 867 O GLY A 60 0.305 -14.373 -9.795 1.00 0.00 O ATOM 0 H GLY A 60 -2.262 -13.641 -6.613 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -0.042 -15.333 -7.488 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -1.734 -15.459 -7.929 1.00 0.00 H new ATOM 871 N ILE A 61 -1.446 -13.021 -9.382 1.00 0.00 N ATOM 872 CA ILE A 61 -1.276 -12.248 -10.606 1.00 0.00 C ATOM 873 C ILE A 61 -0.010 -11.399 -10.549 1.00 0.00 C ATOM 874 O ILE A 61 0.442 -11.013 -9.471 1.00 0.00 O ATOM 875 CB ILE A 61 -2.485 -11.329 -10.863 1.00 0.00 C ATOM 876 CG1 ILE A 61 -3.728 -12.162 -11.183 1.00 0.00 C ATOM 877 CG2 ILE A 61 -2.183 -10.361 -11.997 1.00 0.00 C ATOM 878 CD1 ILE A 61 -3.835 -12.551 -12.641 1.00 0.00 C ATOM 0 H ILE A 61 -2.228 -12.723 -8.799 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.194 -12.965 -11.423 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.681 -10.751 -9.960 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -3.717 -13.066 -10.574 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.617 -11.598 -10.900 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.047 -9.718 -12.167 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.321 -9.748 -11.732 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.964 -10.922 -12.906 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.739 -13.140 -12.795 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.878 -11.652 -13.255 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.964 -13.142 -12.925 1.00 0.00 H new ATOM 890 N ALA A 62 0.555 -11.111 -11.716 1.00 0.00 N ATOM 891 CA ALA A 62 1.767 -10.305 -11.800 1.00 0.00 C ATOM 892 C ALA A 62 1.447 -8.877 -12.228 1.00 0.00 C ATOM 893 O ALA A 62 2.203 -7.949 -11.941 1.00 0.00 O ATOM 894 CB ALA A 62 2.757 -10.939 -12.765 1.00 0.00 C ATOM 0 H ALA A 62 0.193 -11.424 -12.617 1.00 0.00 H new ATOM 0 HA ALA A 62 2.218 -10.267 -10.809 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.657 -10.326 -12.818 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.018 -11.938 -12.415 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.307 -11.008 -13.755 1.00 0.00 H new ATOM 900 N ARG A 63 0.324 -8.708 -12.918 1.00 0.00 N ATOM 901 CA ARG A 63 -0.094 -7.393 -13.387 1.00 0.00 C ATOM 902 C ARG A 63 -0.766 -6.604 -12.267 1.00 0.00 C ATOM 903 O ARG A 63 -1.679 -7.099 -11.608 1.00 0.00 O ATOM 904 CB ARG A 63 -1.051 -7.532 -14.573 1.00 0.00 C ATOM 905 CG ARG A 63 -1.942 -6.318 -14.782 1.00 0.00 C ATOM 906 CD ARG A 63 -2.409 -6.212 -16.225 1.00 0.00 C ATOM 907 NE ARG A 63 -3.018 -4.915 -16.509 1.00 0.00 N ATOM 908 CZ ARG A 63 -4.283 -4.620 -16.232 1.00 0.00 C ATOM 909 NH1 ARG A 63 -5.069 -5.525 -15.666 1.00 0.00 N ATOM 910 NH2 ARG A 63 -4.764 -3.418 -16.521 1.00 0.00 N ATOM 0 H ARG A 63 -0.313 -9.466 -13.165 1.00 0.00 H new ATOM 0 HA ARG A 63 0.795 -6.850 -13.707 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.471 -7.706 -15.479 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.678 -8.411 -14.422 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.807 -6.382 -14.122 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -1.398 -5.414 -14.507 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.562 -6.369 -16.893 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -3.129 -7.004 -16.432 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.440 -4.196 -16.944 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.703 -6.450 -15.442 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.040 -5.296 -15.454 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.162 -2.719 -16.956 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.736 -3.193 -16.308 1.00 0.00 H new ATOM 924 N GLU A 64 -0.307 -5.373 -12.060 1.00 0.00 N ATOM 925 CA GLU A 64 -0.863 -4.517 -11.018 1.00 0.00 C ATOM 926 C GLU A 64 -1.318 -3.181 -11.598 1.00 0.00 C ATOM 927 O GLU A 64 -0.792 -2.721 -12.612 1.00 0.00 O ATOM 928 CB GLU A 64 0.170 -4.281 -9.915 1.00 0.00 C ATOM 929 CG GLU A 64 1.340 -3.415 -10.351 1.00 0.00 C ATOM 930 CD GLU A 64 2.229 -4.103 -11.368 1.00 0.00 C ATOM 931 OE1 GLU A 64 3.060 -4.941 -10.959 1.00 0.00 O ATOM 932 OE2 GLU A 64 2.094 -3.804 -12.573 1.00 0.00 O ATOM 0 H GLU A 64 0.447 -4.947 -12.599 1.00 0.00 H new ATOM 0 HA GLU A 64 -1.729 -5.023 -10.592 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.322 -3.811 -9.063 1.00 0.00 H new ATOM 0 HB3 GLU A 64 0.549 -5.244 -9.572 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.961 -2.486 -10.776 1.00 0.00 H new ATOM 0 HG3 GLU A 64 1.934 -3.147 -9.477 1.00 0.00 H new ATOM 939 N ARG A 65 -2.299 -2.564 -10.948 1.00 0.00 N ATOM 940 CA ARG A 65 -2.826 -1.282 -11.400 1.00 0.00 C ATOM 941 C ARG A 65 -2.517 -0.180 -10.390 1.00 0.00 C ATOM 942 O ARG A 65 -2.641 -0.379 -9.181 1.00 0.00 O ATOM 943 CB ARG A 65 -4.337 -1.376 -11.620 1.00 0.00 C ATOM 944 CG ARG A 65 -4.736 -2.389 -12.681 1.00 0.00 C ATOM 945 CD ARG A 65 -6.098 -2.066 -13.275 1.00 0.00 C ATOM 946 NE ARG A 65 -6.683 -3.216 -13.959 1.00 0.00 N ATOM 947 CZ ARG A 65 -7.934 -3.247 -14.406 1.00 0.00 C ATOM 948 NH1 ARG A 65 -8.726 -2.196 -14.243 1.00 0.00 N ATOM 949 NH2 ARG A 65 -8.394 -4.331 -15.018 1.00 0.00 N ATOM 0 H ARG A 65 -2.745 -2.931 -10.107 1.00 0.00 H new ATOM 0 HA ARG A 65 -2.343 -1.032 -12.344 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.817 -1.641 -10.678 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -4.716 -0.395 -11.906 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -3.987 -2.403 -13.472 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -4.756 -3.387 -12.243 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.770 -1.735 -12.483 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.000 -1.238 -13.977 1.00 0.00 H new ATOM 0 HE ARG A 65 -6.100 -4.040 -14.101 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.375 -1.361 -13.774 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -9.686 -2.222 -14.587 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -7.787 -5.141 -15.145 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -9.354 -4.354 -15.361 1.00 0.00 H new ATOM 963 N VAL A 66 -2.112 0.981 -10.894 1.00 0.00 N ATOM 964 CA VAL A 66 -1.786 2.114 -10.037 1.00 0.00 C ATOM 965 C VAL A 66 -2.974 3.059 -9.898 1.00 0.00 C ATOM 966 O VAL A 66 -3.694 3.312 -10.863 1.00 0.00 O ATOM 967 CB VAL A 66 -0.579 2.901 -10.582 1.00 0.00 C ATOM 968 CG1 VAL A 66 -0.980 3.716 -11.802 1.00 0.00 C ATOM 969 CG2 VAL A 66 0.005 3.798 -9.501 1.00 0.00 C ATOM 0 H VAL A 66 -2.002 1.162 -11.892 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.533 1.707 -9.058 1.00 0.00 H new ATOM 0 HB VAL A 66 0.189 2.189 -10.886 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.115 4.265 -12.173 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.347 3.048 -12.581 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.766 4.420 -11.527 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.857 4.346 -9.904 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.754 4.504 -9.164 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.332 3.188 -8.659 1.00 0.00 H new ATOM 979 N GLU A 67 -3.172 3.578 -8.690 1.00 0.00 N ATOM 980 CA GLU A 67 -4.274 4.496 -8.425 1.00 0.00 C ATOM 981 C GLU A 67 -3.764 5.797 -7.812 1.00 0.00 C ATOM 982 O GLU A 67 -3.411 5.844 -6.635 1.00 0.00 O ATOM 983 CB GLU A 67 -5.295 3.845 -7.490 1.00 0.00 C ATOM 984 CG GLU A 67 -6.707 4.379 -7.663 1.00 0.00 C ATOM 985 CD GLU A 67 -6.942 5.666 -6.896 1.00 0.00 C ATOM 986 OE1 GLU A 67 -6.289 6.680 -7.222 1.00 0.00 O ATOM 987 OE2 GLU A 67 -7.779 5.659 -5.969 1.00 0.00 O ATOM 0 H GLU A 67 -2.584 3.379 -7.880 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.757 4.727 -9.375 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.299 2.769 -7.663 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.981 4.001 -6.458 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.899 4.551 -8.722 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -7.420 3.626 -7.328 1.00 0.00 H new ATOM 994 N ASN A 68 -3.728 6.851 -8.621 1.00 0.00 N ATOM 995 CA ASN A 68 -3.260 8.153 -8.160 1.00 0.00 C ATOM 996 C ASN A 68 -4.266 8.785 -7.203 1.00 0.00 C ATOM 997 O ASN A 68 -5.444 8.931 -7.531 1.00 0.00 O ATOM 998 CB ASN A 68 -3.017 9.082 -9.351 1.00 0.00 C ATOM 999 CG ASN A 68 -2.321 8.380 -10.500 1.00 0.00 C ATOM 1000 OD1 ASN A 68 -2.848 8.310 -11.611 1.00 0.00 O ATOM 1001 ND2 ASN A 68 -1.130 7.854 -10.238 1.00 0.00 N ATOM 0 H ASN A 68 -4.017 6.829 -9.599 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.321 8.006 -7.626 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.970 9.481 -9.697 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.414 9.931 -9.029 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -0.614 7.368 -10.972 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -0.731 7.936 -9.303 1.00 0.00 H new ATOM 1008 N THR A 69 -3.794 9.160 -6.018 1.00 0.00 N ATOM 1009 CA THR A 69 -4.651 9.776 -5.014 1.00 0.00 C ATOM 1010 C THR A 69 -5.334 11.023 -5.564 1.00 0.00 C ATOM 1011 O THR A 69 -4.672 11.946 -6.040 1.00 0.00 O ATOM 1012 CB THR A 69 -3.854 10.155 -3.751 1.00 0.00 C ATOM 1013 OG1 THR A 69 -2.826 11.094 -4.085 1.00 0.00 O ATOM 1014 CG2 THR A 69 -3.234 8.922 -3.112 1.00 0.00 C ATOM 0 H THR A 69 -2.822 9.047 -5.731 1.00 0.00 H new ATOM 0 HA THR A 69 -5.408 9.038 -4.749 1.00 0.00 H new ATOM 0 HB THR A 69 -4.541 10.608 -3.036 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.864 11.854 -3.467 1.00 0.00 H new ATOM 0 HG21 THR A 69 -2.676 9.215 -2.222 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.021 8.222 -2.833 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.559 8.444 -3.822 1.00 0.00 H new ATOM 1022 N SER A 70 -6.661 11.044 -5.495 1.00 0.00 N ATOM 1023 CA SER A 70 -7.434 12.178 -5.989 1.00 0.00 C ATOM 1024 C SER A 70 -6.684 13.487 -5.762 1.00 0.00 C ATOM 1025 O SER A 70 -6.694 14.377 -6.612 1.00 0.00 O ATOM 1026 CB SER A 70 -8.798 12.232 -5.299 1.00 0.00 C ATOM 1027 OG SER A 70 -9.560 11.072 -5.585 1.00 0.00 O ATOM 0 H SER A 70 -7.223 10.289 -5.102 1.00 0.00 H new ATOM 0 HA SER A 70 -7.582 12.046 -7.061 1.00 0.00 H new ATOM 0 HB2 SER A 70 -8.661 12.324 -4.222 1.00 0.00 H new ATOM 0 HB3 SER A 70 -9.341 13.118 -5.628 1.00 0.00 H new ATOM 0 HG SER A 70 -10.427 11.130 -5.131 1.00 0.00 H new ATOM 1033 N HIS A 71 -6.035 13.597 -4.607 1.00 0.00 N ATOM 1034 CA HIS A 71 -5.278 14.796 -4.266 1.00 0.00 C ATOM 1035 C HIS A 71 -3.857 14.440 -3.840 1.00 0.00 C ATOM 1036 O HIS A 71 -3.611 13.410 -3.213 1.00 0.00 O ATOM 1037 CB HIS A 71 -5.981 15.567 -3.148 1.00 0.00 C ATOM 1038 CG HIS A 71 -7.432 15.824 -3.418 1.00 0.00 C ATOM 1039 ND1 HIS A 71 -7.880 16.888 -4.172 1.00 0.00 N ATOM 1040 CD2 HIS A 71 -8.538 15.147 -3.030 1.00 0.00 C ATOM 1041 CE1 HIS A 71 -9.199 16.855 -4.236 1.00 0.00 C ATOM 1042 NE2 HIS A 71 -9.623 15.808 -3.551 1.00 0.00 N ATOM 0 H HIS A 71 -6.018 12.870 -3.892 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.224 15.426 -5.154 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.887 15.008 -2.217 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.473 16.520 -3.000 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.563 14.254 -2.424 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.824 17.563 -4.759 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -10.598 15.535 -3.429 1.00 0.00 H new ATOM 1051 N PRO A 72 -2.899 15.312 -4.187 1.00 0.00 N ATOM 1052 CA PRO A 72 -1.486 15.110 -3.851 1.00 0.00 C ATOM 1053 C PRO A 72 -1.219 15.261 -2.357 1.00 0.00 C ATOM 1054 O PRO A 72 -1.593 16.263 -1.748 1.00 0.00 O ATOM 1055 CB PRO A 72 -0.774 16.214 -4.636 1.00 0.00 C ATOM 1056 CG PRO A 72 -1.803 17.277 -4.815 1.00 0.00 C ATOM 1057 CD PRO A 72 -3.120 16.561 -4.935 1.00 0.00 C ATOM 0 HA PRO A 72 -1.147 14.105 -4.100 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.093 16.590 -4.093 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -0.413 15.847 -5.597 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.807 17.963 -3.968 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.599 17.872 -5.706 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.935 17.146 -4.509 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -3.378 16.366 -5.976 1.00 0.00 H new ATOM 1065 N GLY A 73 -0.569 14.260 -1.772 1.00 0.00 N ATOM 1066 CA GLY A 73 -0.262 14.301 -0.354 1.00 0.00 C ATOM 1067 C GLY A 73 -1.192 13.430 0.466 1.00 0.00 C ATOM 1068 O GLY A 73 -0.856 13.030 1.580 1.00 0.00 O ATOM 0 H GLY A 73 -0.249 13.421 -2.255 1.00 0.00 H new ATOM 0 HA2 GLY A 73 0.767 13.976 -0.199 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -0.328 15.330 -0.001 1.00 0.00 H new ATOM 1072 N GLU A 74 -2.366 13.136 -0.086 1.00 0.00 N ATOM 1073 CA GLU A 74 -3.348 12.308 0.604 1.00 0.00 C ATOM 1074 C GLU A 74 -2.675 11.121 1.287 1.00 0.00 C ATOM 1075 O GLU A 74 -2.023 10.305 0.636 1.00 0.00 O ATOM 1076 CB GLU A 74 -4.410 11.811 -0.379 1.00 0.00 C ATOM 1077 CG GLU A 74 -5.711 11.399 0.288 1.00 0.00 C ATOM 1078 CD GLU A 74 -6.708 10.811 -0.692 1.00 0.00 C ATOM 1079 OE1 GLU A 74 -6.270 10.269 -1.729 1.00 0.00 O ATOM 1080 OE2 GLU A 74 -7.924 10.891 -0.422 1.00 0.00 O ATOM 0 H GLU A 74 -2.659 13.459 -1.008 1.00 0.00 H new ATOM 0 HA GLU A 74 -3.829 12.919 1.368 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -4.617 12.597 -1.105 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -4.011 10.962 -0.933 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -5.499 10.668 1.068 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -6.155 12.266 0.776 1.00 0.00 H new ATOM 1087 N MET A 75 -2.838 11.032 2.603 1.00 0.00 N ATOM 1088 CA MET A 75 -2.247 9.945 3.374 1.00 0.00 C ATOM 1089 C MET A 75 -3.203 8.759 3.462 1.00 0.00 C ATOM 1090 O MET A 75 -3.101 7.936 4.371 1.00 0.00 O ATOM 1091 CB MET A 75 -1.884 10.427 4.780 1.00 0.00 C ATOM 1092 CG MET A 75 -0.713 11.396 4.806 1.00 0.00 C ATOM 1093 SD MET A 75 0.877 10.560 4.965 1.00 0.00 S ATOM 1094 CE MET A 75 1.436 10.569 3.264 1.00 0.00 C ATOM 0 H MET A 75 -3.374 11.699 3.157 1.00 0.00 H new ATOM 0 HA MET A 75 -1.340 9.622 2.863 1.00 0.00 H new ATOM 0 HB2 MET A 75 -2.754 10.909 5.226 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.645 9.564 5.401 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.717 11.990 3.892 1.00 0.00 H new ATOM 0 HG3 MET A 75 -0.839 12.090 5.637 1.00 0.00 H new ATOM 0 HE1 MET A 75 2.348 9.978 3.178 1.00 0.00 H new ATOM 0 HE2 MET A 75 0.664 10.141 2.625 1.00 0.00 H new ATOM 0 HE3 MET A 75 1.637 11.594 2.953 1.00 0.00 H new ATOM 1104 N GLN A 76 -4.129 8.679 2.512 1.00 0.00 N ATOM 1105 CA GLN A 76 -5.102 7.594 2.485 1.00 0.00 C ATOM 1106 C GLN A 76 -5.850 7.568 1.156 1.00 0.00 C ATOM 1107 O GLN A 76 -6.259 8.608 0.641 1.00 0.00 O ATOM 1108 CB GLN A 76 -6.095 7.742 3.639 1.00 0.00 C ATOM 1109 CG GLN A 76 -7.011 8.947 3.503 1.00 0.00 C ATOM 1110 CD GLN A 76 -7.919 9.129 4.704 1.00 0.00 C ATOM 1111 OE1 GLN A 76 -8.812 8.318 4.950 1.00 0.00 O ATOM 1112 NE2 GLN A 76 -7.694 10.197 5.460 1.00 0.00 N ATOM 0 H GLN A 76 -4.226 9.352 1.752 1.00 0.00 H new ATOM 0 HA GLN A 76 -4.563 6.653 2.597 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.703 6.839 3.702 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -5.542 7.820 4.575 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -6.407 9.844 3.370 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -7.620 8.836 2.606 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -6.943 10.843 5.219 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -8.272 10.371 6.282 1.00 0.00 H new ATOM 1121 N VAL A 77 -6.025 6.371 0.604 1.00 0.00 N ATOM 1122 CA VAL A 77 -6.724 6.208 -0.665 1.00 0.00 C ATOM 1123 C VAL A 77 -7.569 4.939 -0.668 1.00 0.00 C ATOM 1124 O VAL A 77 -7.349 4.031 0.133 1.00 0.00 O ATOM 1125 CB VAL A 77 -5.737 6.158 -1.847 1.00 0.00 C ATOM 1126 CG1 VAL A 77 -4.985 4.836 -1.859 1.00 0.00 C ATOM 1127 CG2 VAL A 77 -6.471 6.376 -3.162 1.00 0.00 C ATOM 0 H VAL A 77 -5.692 5.500 1.016 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.375 7.074 -0.782 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.010 6.961 -1.726 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.293 4.819 -2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.428 4.726 -0.929 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.695 4.015 -1.956 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.759 6.338 -3.987 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.221 5.596 -3.294 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.959 7.351 -3.149 1.00 0.00 H new ATOM 1137 N THR A 78 -8.538 4.883 -1.576 1.00 0.00 N ATOM 1138 CA THR A 78 -9.418 3.726 -1.684 1.00 0.00 C ATOM 1139 C THR A 78 -9.172 2.968 -2.984 1.00 0.00 C ATOM 1140 O THR A 78 -9.060 3.569 -4.052 1.00 0.00 O ATOM 1141 CB THR A 78 -10.900 4.139 -1.617 1.00 0.00 C ATOM 1142 OG1 THR A 78 -11.160 4.835 -0.393 1.00 0.00 O ATOM 1143 CG2 THR A 78 -11.806 2.921 -1.715 1.00 0.00 C ATOM 0 H THR A 78 -8.733 5.626 -2.247 1.00 0.00 H new ATOM 0 HA THR A 78 -9.191 3.076 -0.839 1.00 0.00 H new ATOM 0 HB THR A 78 -11.109 4.797 -2.460 1.00 0.00 H new ATOM 0 HG1 THR A 78 -12.104 5.096 -0.359 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.848 3.238 -1.665 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.627 2.409 -2.661 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.593 2.242 -0.889 1.00 0.00 H new ATOM 1151 N ILE A 79 -9.090 1.645 -2.885 1.00 0.00 N ATOM 1152 CA ILE A 79 -8.859 0.806 -4.054 1.00 0.00 C ATOM 1153 C ILE A 79 -10.075 -0.063 -4.356 1.00 0.00 C ATOM 1154 O ILE A 79 -10.215 -1.160 -3.816 1.00 0.00 O ATOM 1155 CB ILE A 79 -7.629 -0.102 -3.862 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -6.437 0.717 -3.361 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -7.283 -0.808 -5.164 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -5.972 1.770 -4.342 1.00 0.00 C ATOM 0 H ILE A 79 -9.180 1.132 -2.008 1.00 0.00 H new ATOM 0 HA ILE A 79 -8.677 1.478 -4.893 1.00 0.00 H new ATOM 0 HB ILE A 79 -7.867 -0.858 -3.114 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.708 1.201 -2.423 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -5.608 0.043 -3.145 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -6.412 -1.446 -5.012 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -8.128 -1.418 -5.483 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.061 -0.067 -5.932 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.125 2.311 -3.920 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.670 1.291 -5.273 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -6.786 2.467 -4.540 1.00 0.00 H new ATOM 1170 N GLN A 80 -10.951 0.435 -5.222 1.00 0.00 N ATOM 1171 CA GLN A 80 -12.155 -0.297 -5.597 1.00 0.00 C ATOM 1172 C GLN A 80 -11.878 -1.242 -6.761 1.00 0.00 C ATOM 1173 O GLN A 80 -10.764 -1.292 -7.281 1.00 0.00 O ATOM 1174 CB GLN A 80 -13.274 0.677 -5.971 1.00 0.00 C ATOM 1175 CG GLN A 80 -13.582 1.695 -4.884 1.00 0.00 C ATOM 1176 CD GLN A 80 -14.720 2.624 -5.261 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -15.557 2.290 -6.100 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -14.757 3.797 -4.641 1.00 0.00 N ATOM 0 H GLN A 80 -10.850 1.342 -5.677 1.00 0.00 H new ATOM 0 HA GLN A 80 -12.471 -0.890 -4.739 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -12.996 1.205 -6.883 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -14.178 0.111 -6.194 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -13.835 1.171 -3.962 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -12.688 2.285 -4.680 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.043 4.033 -3.952 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -15.500 4.463 -4.853 1.00 0.00 H new ATOM 1187 N ASN A 81 -12.899 -1.991 -7.165 1.00 0.00 N ATOM 1188 CA ASN A 81 -12.765 -2.936 -8.268 1.00 0.00 C ATOM 1189 C ASN A 81 -11.935 -4.146 -7.849 1.00 0.00 C ATOM 1190 O ASN A 81 -11.067 -4.604 -8.592 1.00 0.00 O ATOM 1191 CB ASN A 81 -12.119 -2.254 -9.475 1.00 0.00 C ATOM 1192 CG ASN A 81 -12.653 -0.853 -9.702 1.00 0.00 C ATOM 1193 OD1 ASN A 81 -11.903 0.123 -9.666 1.00 0.00 O ATOM 1194 ND2 ASN A 81 -13.956 -0.748 -9.937 1.00 0.00 N ATOM 0 H ASN A 81 -13.828 -1.962 -6.745 1.00 0.00 H new ATOM 0 HA ASN A 81 -13.762 -3.279 -8.544 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -11.040 -2.209 -9.329 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -12.295 -2.856 -10.366 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -14.373 0.169 -10.097 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -14.540 -1.584 -9.958 1.00 0.00 H new ATOM 1201 N LEU A 82 -12.209 -4.659 -6.654 1.00 0.00 N ATOM 1202 CA LEU A 82 -11.489 -5.817 -6.136 1.00 0.00 C ATOM 1203 C LEU A 82 -12.442 -6.979 -5.874 1.00 0.00 C ATOM 1204 O LEU A 82 -13.659 -6.801 -5.844 1.00 0.00 O ATOM 1205 CB LEU A 82 -10.750 -5.448 -4.848 1.00 0.00 C ATOM 1206 CG LEU A 82 -9.845 -4.218 -4.922 1.00 0.00 C ATOM 1207 CD1 LEU A 82 -9.205 -3.944 -3.570 1.00 0.00 C ATOM 1208 CD2 LEU A 82 -8.778 -4.405 -5.991 1.00 0.00 C ATOM 0 H LEU A 82 -12.924 -4.291 -6.026 1.00 0.00 H new ATOM 0 HA LEU A 82 -10.764 -6.129 -6.888 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.489 -5.284 -4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.145 -6.302 -4.543 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.456 -3.357 -5.193 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.564 -3.065 -3.642 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -9.984 -3.766 -2.828 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -8.608 -4.805 -3.269 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.143 -3.520 -6.030 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.170 -5.277 -5.750 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.255 -4.552 -6.960 1.00 0.00 H new ATOM 1220 N MET A 83 -11.879 -8.168 -5.684 1.00 0.00 N ATOM 1221 CA MET A 83 -12.680 -9.358 -5.421 1.00 0.00 C ATOM 1222 C MET A 83 -12.618 -9.740 -3.945 1.00 0.00 C ATOM 1223 O MET A 83 -11.562 -9.704 -3.314 1.00 0.00 O ATOM 1224 CB MET A 83 -12.194 -10.525 -6.282 1.00 0.00 C ATOM 1225 CG MET A 83 -12.411 -11.886 -5.640 1.00 0.00 C ATOM 1226 SD MET A 83 -12.110 -13.249 -6.781 1.00 0.00 S ATOM 1227 CE MET A 83 -13.173 -12.788 -8.147 1.00 0.00 C ATOM 0 H MET A 83 -10.873 -8.333 -5.707 1.00 0.00 H new ATOM 0 HA MET A 83 -13.715 -9.133 -5.677 1.00 0.00 H new ATOM 0 HB2 MET A 83 -12.711 -10.498 -7.241 1.00 0.00 H new ATOM 0 HB3 MET A 83 -11.132 -10.395 -6.489 1.00 0.00 H new ATOM 0 HG2 MET A 83 -11.751 -11.986 -4.778 1.00 0.00 H new ATOM 0 HG3 MET A 83 -13.433 -11.949 -5.267 1.00 0.00 H new ATOM 0 HE1 MET A 83 -13.451 -13.680 -8.709 1.00 0.00 H new ATOM 0 HE2 MET A 83 -14.072 -12.306 -7.762 1.00 0.00 H new ATOM 0 HE3 MET A 83 -12.644 -12.097 -8.803 1.00 0.00 H new ATOM 1237 N PRO A 84 -13.776 -10.114 -3.381 1.00 0.00 N ATOM 1238 CA PRO A 84 -13.879 -10.509 -1.973 1.00 0.00 C ATOM 1239 C PRO A 84 -13.199 -11.845 -1.695 1.00 0.00 C ATOM 1240 O PRO A 84 -13.086 -12.692 -2.581 1.00 0.00 O ATOM 1241 CB PRO A 84 -15.389 -10.620 -1.745 1.00 0.00 C ATOM 1242 CG PRO A 84 -15.955 -10.904 -3.094 1.00 0.00 C ATOM 1243 CD PRO A 84 -15.074 -10.180 -4.074 1.00 0.00 C ATOM 0 HA PRO A 84 -13.386 -9.796 -1.313 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -15.626 -11.417 -1.040 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.796 -9.697 -1.331 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -15.965 -11.975 -3.295 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -16.986 -10.557 -3.166 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -14.998 -10.717 -5.019 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -15.459 -9.186 -4.302 1.00 0.00 H new ATOM 1251 N ALA A 85 -12.747 -12.028 -0.459 1.00 0.00 N ATOM 1252 CA ALA A 85 -12.080 -13.263 -0.064 1.00 0.00 C ATOM 1253 C ALA A 85 -10.842 -13.515 -0.917 1.00 0.00 C ATOM 1254 O ALA A 85 -10.492 -14.662 -1.199 1.00 0.00 O ATOM 1255 CB ALA A 85 -13.042 -14.438 -0.165 1.00 0.00 C ATOM 0 H ALA A 85 -12.830 -11.337 0.286 1.00 0.00 H new ATOM 0 HA ALA A 85 -11.759 -13.159 0.973 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -12.531 -15.353 0.133 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.894 -14.268 0.493 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.391 -14.535 -1.193 1.00 0.00 H new ATOM 1261 N THR A 86 -10.182 -12.437 -1.328 1.00 0.00 N ATOM 1262 CA THR A 86 -8.984 -12.541 -2.151 1.00 0.00 C ATOM 1263 C THR A 86 -7.929 -11.529 -1.719 1.00 0.00 C ATOM 1264 O THR A 86 -8.197 -10.329 -1.651 1.00 0.00 O ATOM 1265 CB THR A 86 -9.306 -12.325 -3.642 1.00 0.00 C ATOM 1266 OG1 THR A 86 -10.107 -13.406 -4.132 1.00 0.00 O ATOM 1267 CG2 THR A 86 -8.029 -12.221 -4.462 1.00 0.00 C ATOM 0 H THR A 86 -10.458 -11.481 -1.104 1.00 0.00 H new ATOM 0 HA THR A 86 -8.593 -13.549 -2.013 1.00 0.00 H new ATOM 0 HB THR A 86 -9.859 -11.391 -3.740 1.00 0.00 H new ATOM 0 HG1 THR A 86 -9.812 -13.649 -5.035 1.00 0.00 H new ATOM 0 HG21 THR A 86 -8.282 -12.069 -5.511 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.435 -11.379 -4.106 1.00 0.00 H new ATOM 0 HG23 THR A 86 -7.453 -13.141 -4.357 1.00 0.00 H new ATOM 1275 N VAL A 87 -6.729 -12.020 -1.427 1.00 0.00 N ATOM 1276 CA VAL A 87 -5.633 -11.157 -1.003 1.00 0.00 C ATOM 1277 C VAL A 87 -5.212 -10.212 -2.122 1.00 0.00 C ATOM 1278 O VAL A 87 -5.459 -10.477 -3.299 1.00 0.00 O ATOM 1279 CB VAL A 87 -4.411 -11.982 -0.556 1.00 0.00 C ATOM 1280 CG1 VAL A 87 -4.527 -12.354 0.915 1.00 0.00 C ATOM 1281 CG2 VAL A 87 -4.263 -13.225 -1.419 1.00 0.00 C ATOM 0 H VAL A 87 -6.491 -13.011 -1.476 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.998 -10.574 -0.158 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.517 -11.372 -0.682 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.655 -12.936 1.213 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.580 -11.447 1.517 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -5.429 -12.946 1.071 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.395 -13.796 -1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.158 -13.840 -1.327 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -4.130 -12.931 -2.460 1.00 0.00 H new ATOM 1291 N TYR A 88 -4.575 -9.108 -1.748 1.00 0.00 N ATOM 1292 CA TYR A 88 -4.121 -8.121 -2.721 1.00 0.00 C ATOM 1293 C TYR A 88 -2.868 -7.406 -2.227 1.00 0.00 C ATOM 1294 O TYR A 88 -2.895 -6.716 -1.207 1.00 0.00 O ATOM 1295 CB TYR A 88 -5.228 -7.102 -2.999 1.00 0.00 C ATOM 1296 CG TYR A 88 -6.311 -7.619 -3.918 1.00 0.00 C ATOM 1297 CD1 TYR A 88 -6.042 -7.903 -5.251 1.00 0.00 C ATOM 1298 CD2 TYR A 88 -7.604 -7.825 -3.452 1.00 0.00 C ATOM 1299 CE1 TYR A 88 -7.029 -8.375 -6.094 1.00 0.00 C ATOM 1300 CE2 TYR A 88 -8.597 -8.298 -4.288 1.00 0.00 C ATOM 1301 CZ TYR A 88 -8.305 -8.571 -5.608 1.00 0.00 C ATOM 1302 OH TYR A 88 -9.290 -9.043 -6.444 1.00 0.00 O ATOM 0 H TYR A 88 -4.361 -8.874 -0.778 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.878 -8.644 -3.646 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -5.679 -6.801 -2.053 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -4.785 -6.209 -3.440 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -5.044 -7.752 -5.635 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -7.836 -7.612 -2.419 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -6.803 -8.589 -7.128 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -9.597 -8.453 -3.910 1.00 0.00 H new ATOM 0 HH TYR A 88 -8.889 -9.614 -7.132 1.00 0.00 H new ATOM 1312 N ILE A 89 -1.771 -7.575 -2.957 1.00 0.00 N ATOM 1313 CA ILE A 89 -0.507 -6.945 -2.595 1.00 0.00 C ATOM 1314 C ILE A 89 -0.505 -5.466 -2.964 1.00 0.00 C ATOM 1315 O ILE A 89 -0.305 -5.104 -4.124 1.00 0.00 O ATOM 1316 CB ILE A 89 0.684 -7.636 -3.285 1.00 0.00 C ATOM 1317 CG1 ILE A 89 0.465 -9.149 -3.335 1.00 0.00 C ATOM 1318 CG2 ILE A 89 1.980 -7.307 -2.559 1.00 0.00 C ATOM 1319 CD1 ILE A 89 0.161 -9.761 -1.985 1.00 0.00 C ATOM 0 H ILE A 89 -1.732 -8.143 -3.803 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.401 -7.048 -1.515 1.00 0.00 H new ATOM 0 HB ILE A 89 0.758 -7.265 -4.307 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -0.357 -9.367 -4.017 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.355 -9.623 -3.748 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.813 -7.802 -3.058 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.140 -6.229 -2.570 1.00 0.00 H new ATOM 0 HG23 ILE A 89 1.917 -7.654 -1.527 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.017 -10.836 -2.097 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.993 -9.575 -1.305 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.746 -9.314 -1.579 1.00 0.00 H new ATOM 1331 N PHE A 90 -0.728 -4.613 -1.969 1.00 0.00 N ATOM 1332 CA PHE A 90 -0.752 -3.172 -2.188 1.00 0.00 C ATOM 1333 C PHE A 90 0.636 -2.569 -1.989 1.00 0.00 C ATOM 1334 O PHE A 90 1.343 -2.911 -1.042 1.00 0.00 O ATOM 1335 CB PHE A 90 -1.750 -2.506 -1.238 1.00 0.00 C ATOM 1336 CG PHE A 90 -3.173 -2.923 -1.475 1.00 0.00 C ATOM 1337 CD1 PHE A 90 -3.667 -4.094 -0.923 1.00 0.00 C ATOM 1338 CD2 PHE A 90 -4.016 -2.145 -2.252 1.00 0.00 C ATOM 1339 CE1 PHE A 90 -4.976 -4.480 -1.139 1.00 0.00 C ATOM 1340 CE2 PHE A 90 -5.326 -2.526 -2.471 1.00 0.00 C ATOM 1341 CZ PHE A 90 -5.807 -3.696 -1.915 1.00 0.00 C ATOM 0 H PHE A 90 -0.895 -4.895 -1.003 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.064 -2.991 -3.217 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -1.476 -2.745 -0.210 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.674 -1.424 -1.345 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.021 -4.712 -0.317 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.645 -1.231 -2.691 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.349 -5.394 -0.701 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -5.974 -1.910 -3.077 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.830 -3.997 -2.087 1.00 0.00 H new ATOM 1351 N ARG A 91 1.019 -1.671 -2.891 1.00 0.00 N ATOM 1352 CA ARG A 91 2.322 -1.021 -2.817 1.00 0.00 C ATOM 1353 C ARG A 91 2.187 0.489 -2.985 1.00 0.00 C ATOM 1354 O ARG A 91 1.745 0.971 -4.028 1.00 0.00 O ATOM 1355 CB ARG A 91 3.257 -1.583 -3.889 1.00 0.00 C ATOM 1356 CG ARG A 91 3.374 -3.098 -3.862 1.00 0.00 C ATOM 1357 CD ARG A 91 4.624 -3.574 -4.585 1.00 0.00 C ATOM 1358 NE ARG A 91 4.739 -5.029 -4.581 1.00 0.00 N ATOM 1359 CZ ARG A 91 3.979 -5.829 -5.321 1.00 0.00 C ATOM 1360 NH1 ARG A 91 3.055 -5.316 -6.121 1.00 0.00 N ATOM 1361 NH2 ARG A 91 4.144 -7.144 -5.262 1.00 0.00 N ATOM 0 H ARG A 91 0.445 -1.377 -3.682 1.00 0.00 H new ATOM 0 HA ARG A 91 2.745 -1.223 -1.833 1.00 0.00 H new ATOM 0 HB2 ARG A 91 2.899 -1.272 -4.870 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.248 -1.148 -3.759 1.00 0.00 H new ATOM 0 HG2 ARG A 91 3.396 -3.444 -2.829 1.00 0.00 H new ATOM 0 HG3 ARG A 91 2.493 -3.540 -4.327 1.00 0.00 H new ATOM 0 HD2 ARG A 91 4.606 -3.215 -5.614 1.00 0.00 H new ATOM 0 HD3 ARG A 91 5.504 -3.140 -4.111 1.00 0.00 H new ATOM 0 HE ARG A 91 5.442 -5.455 -3.977 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.926 -4.305 -6.169 1.00 0.00 H new ATOM 0 HH12 ARG A 91 2.473 -5.932 -6.688 1.00 0.00 H new ATOM 0 HH21 ARG A 91 4.855 -7.542 -4.648 1.00 0.00 H new ATOM 0 HH22 ARG A 91 3.560 -7.757 -5.831 1.00 0.00 H new ATOM 1375 N VAL A 92 2.571 1.232 -1.951 1.00 0.00 N ATOM 1376 CA VAL A 92 2.494 2.687 -1.984 1.00 0.00 C ATOM 1377 C VAL A 92 3.825 3.299 -2.406 1.00 0.00 C ATOM 1378 O VAL A 92 4.886 2.716 -2.182 1.00 0.00 O ATOM 1379 CB VAL A 92 2.090 3.259 -0.612 1.00 0.00 C ATOM 1380 CG1 VAL A 92 1.552 4.674 -0.761 1.00 0.00 C ATOM 1381 CG2 VAL A 92 1.065 2.358 0.060 1.00 0.00 C ATOM 0 H VAL A 92 2.939 0.849 -1.080 1.00 0.00 H new ATOM 0 HA VAL A 92 1.730 2.947 -2.717 1.00 0.00 H new ATOM 0 HB VAL A 92 2.976 3.298 0.021 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.272 5.062 0.218 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.321 5.312 -1.197 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.677 4.664 -1.411 1.00 0.00 H new ATOM 0 HG21 VAL A 92 0.791 2.777 1.028 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.177 2.285 -0.568 1.00 0.00 H new ATOM 0 HG23 VAL A 92 1.491 1.365 0.202 1.00 0.00 H new ATOM 1391 N MET A 93 3.761 4.477 -3.017 1.00 0.00 N ATOM 1392 CA MET A 93 4.963 5.169 -3.469 1.00 0.00 C ATOM 1393 C MET A 93 4.706 6.665 -3.615 1.00 0.00 C ATOM 1394 O MET A 93 3.601 7.084 -3.958 1.00 0.00 O ATOM 1395 CB MET A 93 5.440 4.589 -4.802 1.00 0.00 C ATOM 1396 CG MET A 93 6.712 5.237 -5.326 1.00 0.00 C ATOM 1397 SD MET A 93 7.504 4.264 -6.621 1.00 0.00 S ATOM 1398 CE MET A 93 6.117 3.958 -7.711 1.00 0.00 C ATOM 0 H MET A 93 2.891 4.972 -3.211 1.00 0.00 H new ATOM 0 HA MET A 93 5.740 5.023 -2.719 1.00 0.00 H new ATOM 0 HB2 MET A 93 5.609 3.519 -4.683 1.00 0.00 H new ATOM 0 HB3 MET A 93 4.650 4.707 -5.544 1.00 0.00 H new ATOM 0 HG2 MET A 93 6.477 6.228 -5.714 1.00 0.00 H new ATOM 0 HG3 MET A 93 7.411 5.375 -4.501 1.00 0.00 H new ATOM 0 HE1 MET A 93 6.451 4.008 -8.747 1.00 0.00 H new ATOM 0 HE2 MET A 93 5.707 2.968 -7.509 1.00 0.00 H new ATOM 0 HE3 MET A 93 5.347 4.711 -7.541 1.00 0.00 H new ATOM 1408 N ALA A 94 5.733 7.466 -3.352 1.00 0.00 N ATOM 1409 CA ALA A 94 5.618 8.915 -3.455 1.00 0.00 C ATOM 1410 C ALA A 94 6.104 9.409 -4.814 1.00 0.00 C ATOM 1411 O ALA A 94 6.920 8.756 -5.465 1.00 0.00 O ATOM 1412 CB ALA A 94 6.401 9.588 -2.337 1.00 0.00 C ATOM 0 H ALA A 94 6.655 7.135 -3.066 1.00 0.00 H new ATOM 0 HA ALA A 94 4.565 9.179 -3.356 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.306 10.670 -2.427 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.007 9.268 -1.373 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.452 9.309 -2.410 1.00 0.00 H new ATOM 1418 N GLN A 95 5.598 10.563 -5.235 1.00 0.00 N ATOM 1419 CA GLN A 95 5.980 11.142 -6.518 1.00 0.00 C ATOM 1420 C GLN A 95 6.015 12.665 -6.439 1.00 0.00 C ATOM 1421 O GLN A 95 5.033 13.298 -6.053 1.00 0.00 O ATOM 1422 CB GLN A 95 5.007 10.698 -7.611 1.00 0.00 C ATOM 1423 CG GLN A 95 5.433 9.425 -8.325 1.00 0.00 C ATOM 1424 CD GLN A 95 4.254 8.609 -8.816 1.00 0.00 C ATOM 1425 OE1 GLN A 95 3.233 9.159 -9.231 1.00 0.00 O ATOM 1426 NE2 GLN A 95 4.388 7.289 -8.772 1.00 0.00 N ATOM 0 H GLN A 95 4.923 11.116 -4.707 1.00 0.00 H new ATOM 0 HA GLN A 95 6.980 10.787 -6.766 1.00 0.00 H new ATOM 0 HB2 GLN A 95 4.023 10.545 -7.169 1.00 0.00 H new ATOM 0 HB3 GLN A 95 4.906 11.499 -8.343 1.00 0.00 H new ATOM 0 HG2 GLN A 95 6.069 9.683 -9.172 1.00 0.00 H new ATOM 0 HG3 GLN A 95 6.034 8.817 -7.649 1.00 0.00 H new ATOM 0 HE21 GLN A 95 5.252 6.875 -8.421 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.627 6.688 -9.090 1.00 0.00 H new ATOM 1435 N ASN A 96 7.152 13.245 -6.806 1.00 0.00 N ATOM 1436 CA ASN A 96 7.315 14.694 -6.776 1.00 0.00 C ATOM 1437 C ASN A 96 7.726 15.224 -8.147 1.00 0.00 C ATOM 1438 O ASN A 96 7.811 14.470 -9.116 1.00 0.00 O ATOM 1439 CB ASN A 96 8.360 15.089 -5.730 1.00 0.00 C ATOM 1440 CG ASN A 96 9.778 14.847 -6.210 1.00 0.00 C ATOM 1441 OD1 ASN A 96 10.510 15.788 -6.519 1.00 0.00 O ATOM 1442 ND2 ASN A 96 10.173 13.581 -6.274 1.00 0.00 N ATOM 0 H ASN A 96 7.974 12.734 -7.128 1.00 0.00 H new ATOM 0 HA ASN A 96 6.356 15.137 -6.507 1.00 0.00 H new ATOM 0 HB2 ASN A 96 8.239 16.143 -5.479 1.00 0.00 H new ATOM 0 HB3 ASN A 96 8.187 14.522 -4.815 1.00 0.00 H new ATOM 0 HD21 ASN A 96 11.117 13.357 -6.589 1.00 0.00 H new ATOM 0 HD22 ASN A 96 9.533 12.833 -6.008 1.00 0.00 H new ATOM 1449 N LYS A 97 7.980 16.526 -8.220 1.00 0.00 N ATOM 1450 CA LYS A 97 8.384 17.159 -9.470 1.00 0.00 C ATOM 1451 C LYS A 97 9.286 16.234 -10.281 1.00 0.00 C ATOM 1452 O LYS A 97 9.271 16.258 -11.512 1.00 0.00 O ATOM 1453 CB LYS A 97 9.109 18.477 -9.188 1.00 0.00 C ATOM 1454 CG LYS A 97 10.316 18.324 -8.279 1.00 0.00 C ATOM 1455 CD LYS A 97 10.921 19.673 -7.923 1.00 0.00 C ATOM 1456 CE LYS A 97 12.028 19.532 -6.891 1.00 0.00 C ATOM 1457 NZ LYS A 97 12.857 20.766 -6.794 1.00 0.00 N ATOM 0 H LYS A 97 7.913 17.164 -7.427 1.00 0.00 H new ATOM 0 HA LYS A 97 7.485 17.364 -10.052 1.00 0.00 H new ATOM 0 HB2 LYS A 97 9.430 18.915 -10.133 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.408 19.177 -8.733 1.00 0.00 H new ATOM 0 HG2 LYS A 97 10.022 17.804 -7.367 1.00 0.00 H new ATOM 0 HG3 LYS A 97 11.067 17.706 -8.771 1.00 0.00 H new ATOM 0 HD2 LYS A 97 11.318 20.143 -8.822 1.00 0.00 H new ATOM 0 HD3 LYS A 97 10.143 20.331 -7.536 1.00 0.00 H new ATOM 0 HE2 LYS A 97 11.591 19.311 -5.917 1.00 0.00 H new ATOM 0 HE3 LYS A 97 12.664 18.687 -7.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 13.601 20.629 -6.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 13.295 20.963 -7.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 12.255 21.568 -6.518 1.00 0.00 H new ATOM 1471 N HIS A 98 10.070 15.418 -9.583 1.00 0.00 N ATOM 1472 CA HIS A 98 10.978 14.483 -10.239 1.00 0.00 C ATOM 1473 C HIS A 98 10.208 13.314 -10.845 1.00 0.00 C ATOM 1474 O HIS A 98 10.117 13.183 -12.065 1.00 0.00 O ATOM 1475 CB HIS A 98 12.017 13.965 -9.245 1.00 0.00 C ATOM 1476 CG HIS A 98 12.811 15.051 -8.588 1.00 0.00 C ATOM 1477 ND1 HIS A 98 13.260 15.175 -7.317 1.00 0.00 N flip ATOM 1478 CD2 HIS A 98 13.232 16.184 -9.253 1.00 0.00 C flip ATOM 1479 CE1 HIS A 98 13.938 16.367 -7.238 1.00 0.00 C flip ATOM 1480 NE2 HIS A 98 13.907 16.956 -8.420 1.00 0.00 N flip ATOM 0 H HIS A 98 10.095 15.385 -8.564 1.00 0.00 H new ATOM 0 HA HIS A 98 11.489 15.014 -11.042 1.00 0.00 H new ATOM 0 HB2 HIS A 98 11.512 13.380 -8.476 1.00 0.00 H new ATOM 0 HB3 HIS A 98 12.699 13.290 -9.763 1.00 0.00 H new ATOM 0 HD2 HIS A 98 13.040 16.405 -10.292 1.00 0.00 H new ATOM 0 HE1 HIS A 98 14.418 16.759 -6.354 1.00 0.00 H new ATOM 0 HE2 HIS A 98 14.332 17.854 -8.650 1.00 0.00 H new ATOM 1489 N GLY A 99 9.656 12.465 -9.983 1.00 0.00 N ATOM 1490 CA GLY A 99 8.902 11.317 -10.452 1.00 0.00 C ATOM 1491 C GLY A 99 8.738 10.255 -9.383 1.00 0.00 C ATOM 1492 O GLY A 99 8.616 10.570 -8.199 1.00 0.00 O ATOM 0 H GLY A 99 9.718 12.552 -8.969 1.00 0.00 H new ATOM 0 HA2 GLY A 99 7.918 11.645 -10.788 1.00 0.00 H new ATOM 0 HA3 GLY A 99 9.406 10.884 -11.316 1.00 0.00 H new ATOM 1496 N SER A 100 8.734 8.993 -9.800 1.00 0.00 N ATOM 1497 CA SER A 100 8.578 7.881 -8.870 1.00 0.00 C ATOM 1498 C SER A 100 9.886 7.599 -8.137 1.00 0.00 C ATOM 1499 O SER A 100 10.894 7.252 -8.752 1.00 0.00 O ATOM 1500 CB SER A 100 8.117 6.626 -9.615 1.00 0.00 C ATOM 1501 OG SER A 100 7.033 6.916 -10.479 1.00 0.00 O ATOM 0 H SER A 100 8.837 8.715 -10.776 1.00 0.00 H new ATOM 0 HA SER A 100 7.822 8.157 -8.135 1.00 0.00 H new ATOM 0 HB2 SER A 100 8.946 6.216 -10.192 1.00 0.00 H new ATOM 0 HB3 SER A 100 7.820 5.862 -8.897 1.00 0.00 H new ATOM 0 HG SER A 100 6.758 6.099 -10.944 1.00 0.00 H new ATOM 1507 N GLY A 101 9.861 7.750 -6.816 1.00 0.00 N ATOM 1508 CA GLY A 101 11.050 7.508 -6.019 1.00 0.00 C ATOM 1509 C GLY A 101 11.164 6.064 -5.571 1.00 0.00 C ATOM 1510 O GLY A 101 11.295 5.161 -6.395 1.00 0.00 O ATOM 0 H GLY A 101 9.039 8.035 -6.284 1.00 0.00 H new ATOM 0 HA2 GLY A 101 11.933 7.776 -6.599 1.00 0.00 H new ATOM 0 HA3 GLY A 101 11.035 8.157 -5.143 1.00 0.00 H new ATOM 1514 N GLU A 102 11.114 5.848 -4.260 1.00 0.00 N ATOM 1515 CA GLU A 102 11.215 4.503 -3.704 1.00 0.00 C ATOM 1516 C GLU A 102 9.832 3.934 -3.403 1.00 0.00 C ATOM 1517 O GLU A 102 9.004 4.589 -2.769 1.00 0.00 O ATOM 1518 CB GLU A 102 12.062 4.516 -2.431 1.00 0.00 C ATOM 1519 CG GLU A 102 12.290 3.136 -1.837 1.00 0.00 C ATOM 1520 CD GLU A 102 13.142 3.174 -0.583 1.00 0.00 C ATOM 1521 OE1 GLU A 102 14.115 3.957 -0.551 1.00 0.00 O ATOM 1522 OE2 GLU A 102 12.839 2.420 0.365 1.00 0.00 O ATOM 0 H GLU A 102 11.004 6.586 -3.564 1.00 0.00 H new ATOM 0 HA GLU A 102 11.697 3.866 -4.445 1.00 0.00 H new ATOM 0 HB2 GLU A 102 13.027 4.971 -2.652 1.00 0.00 H new ATOM 0 HB3 GLU A 102 11.575 5.147 -1.687 1.00 0.00 H new ATOM 0 HG2 GLU A 102 11.327 2.681 -1.604 1.00 0.00 H new ATOM 0 HG3 GLU A 102 12.771 2.500 -2.580 1.00 0.00 H new ATOM 1529 N SER A 103 9.589 2.710 -3.861 1.00 0.00 N ATOM 1530 CA SER A 103 8.305 2.054 -3.645 1.00 0.00 C ATOM 1531 C SER A 103 8.267 1.371 -2.281 1.00 0.00 C ATOM 1532 O SER A 103 9.127 0.549 -1.962 1.00 0.00 O ATOM 1533 CB SER A 103 8.040 1.028 -4.749 1.00 0.00 C ATOM 1534 OG SER A 103 8.441 1.525 -6.014 1.00 0.00 O ATOM 0 H SER A 103 10.265 2.153 -4.384 1.00 0.00 H new ATOM 0 HA SER A 103 7.526 2.816 -3.673 1.00 0.00 H new ATOM 0 HB2 SER A 103 8.578 0.106 -4.530 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.979 0.780 -4.772 1.00 0.00 H new ATOM 0 HG SER A 103 7.816 2.222 -6.305 1.00 0.00 H new ATOM 1540 N SER A 104 7.265 1.717 -1.480 1.00 0.00 N ATOM 1541 CA SER A 104 7.116 1.142 -0.149 1.00 0.00 C ATOM 1542 C SER A 104 7.031 -0.380 -0.221 1.00 0.00 C ATOM 1543 O SER A 104 6.966 -0.958 -1.306 1.00 0.00 O ATOM 1544 CB SER A 104 5.867 1.701 0.535 1.00 0.00 C ATOM 1545 OG SER A 104 5.429 0.846 1.576 1.00 0.00 O ATOM 0 H SER A 104 6.544 2.393 -1.730 1.00 0.00 H new ATOM 0 HA SER A 104 7.994 1.413 0.437 1.00 0.00 H new ATOM 0 HB2 SER A 104 6.082 2.690 0.939 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.070 1.823 -0.199 1.00 0.00 H new ATOM 0 HG SER A 104 4.587 0.417 1.315 1.00 0.00 H new ATOM 1551 N ALA A 105 7.032 -1.023 0.942 1.00 0.00 N ATOM 1552 CA ALA A 105 6.953 -2.476 1.012 1.00 0.00 C ATOM 1553 C ALA A 105 5.551 -2.967 0.666 1.00 0.00 C ATOM 1554 O ALA A 105 4.550 -2.310 0.949 1.00 0.00 O ATOM 1555 CB ALA A 105 7.357 -2.961 2.396 1.00 0.00 C ATOM 0 H ALA A 105 7.087 -0.560 1.849 1.00 0.00 H new ATOM 0 HA ALA A 105 7.646 -2.888 0.278 1.00 0.00 H new ATOM 0 HB1 ALA A 105 7.293 -4.048 2.433 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.380 -2.650 2.606 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.687 -2.532 3.142 1.00 0.00 H new ATOM 1561 N PRO A 106 5.476 -4.150 0.039 1.00 0.00 N ATOM 1562 CA PRO A 106 4.201 -4.756 -0.360 1.00 0.00 C ATOM 1563 C PRO A 106 3.385 -5.228 0.838 1.00 0.00 C ATOM 1564 O PRO A 106 3.872 -5.991 1.673 1.00 0.00 O ATOM 1565 CB PRO A 106 4.628 -5.948 -1.220 1.00 0.00 C ATOM 1566 CG PRO A 106 5.997 -6.290 -0.741 1.00 0.00 C ATOM 1567 CD PRO A 106 6.629 -4.989 -0.330 1.00 0.00 C ATOM 0 HA PRO A 106 3.558 -4.047 -0.881 1.00 0.00 H new ATOM 0 HB2 PRO A 106 3.945 -6.789 -1.099 1.00 0.00 H new ATOM 0 HB3 PRO A 106 4.632 -5.691 -2.279 1.00 0.00 H new ATOM 0 HG2 PRO A 106 5.955 -6.985 0.097 1.00 0.00 H new ATOM 0 HG3 PRO A 106 6.576 -6.774 -1.528 1.00 0.00 H new ATOM 0 HD2 PRO A 106 7.313 -5.122 0.508 1.00 0.00 H new ATOM 0 HD3 PRO A 106 7.204 -4.547 -1.144 1.00 0.00 H new ATOM 1575 N LEU A 107 2.140 -4.771 0.917 1.00 0.00 N ATOM 1576 CA LEU A 107 1.254 -5.148 2.013 1.00 0.00 C ATOM 1577 C LEU A 107 0.252 -6.206 1.564 1.00 0.00 C ATOM 1578 O LEU A 107 -0.337 -6.101 0.488 1.00 0.00 O ATOM 1579 CB LEU A 107 0.513 -3.918 2.542 1.00 0.00 C ATOM 1580 CG LEU A 107 -0.492 -4.172 3.665 1.00 0.00 C ATOM 1581 CD1 LEU A 107 0.224 -4.597 4.938 1.00 0.00 C ATOM 1582 CD2 LEU A 107 -1.337 -2.932 3.915 1.00 0.00 C ATOM 0 H LEU A 107 1.721 -4.139 0.235 1.00 0.00 H new ATOM 0 HA LEU A 107 1.864 -5.569 2.812 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.251 -3.199 2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -0.013 -3.450 1.710 1.00 0.00 H new ATOM 0 HG LEU A 107 -1.153 -4.982 3.357 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -0.508 -4.773 5.726 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.784 -5.513 4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 107 0.910 -3.809 5.250 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -2.047 -3.131 4.718 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.690 -2.102 4.200 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -1.880 -2.673 3.006 1.00 0.00 H new ATOM 1594 N ARG A 108 0.060 -7.223 2.397 1.00 0.00 N ATOM 1595 CA ARG A 108 -0.872 -8.300 2.086 1.00 0.00 C ATOM 1596 C ARG A 108 -2.211 -8.079 2.785 1.00 0.00 C ATOM 1597 O ARG A 108 -2.336 -8.290 3.991 1.00 0.00 O ATOM 1598 CB ARG A 108 -0.284 -9.649 2.504 1.00 0.00 C ATOM 1599 CG ARG A 108 -1.218 -10.823 2.259 1.00 0.00 C ATOM 1600 CD ARG A 108 -0.643 -12.117 2.812 1.00 0.00 C ATOM 1601 NE ARG A 108 -0.834 -12.228 4.256 1.00 0.00 N ATOM 1602 CZ ARG A 108 -0.128 -13.045 5.030 1.00 0.00 C ATOM 1603 NH1 ARG A 108 0.810 -13.818 4.501 1.00 0.00 N ATOM 1604 NH2 ARG A 108 -0.360 -13.089 6.335 1.00 0.00 N ATOM 0 H ARG A 108 0.537 -7.324 3.293 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.039 -8.302 1.009 1.00 0.00 H new ATOM 0 HB2 ARG A 108 0.645 -9.815 1.959 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -0.030 -9.613 3.563 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -2.183 -10.624 2.724 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -1.396 -10.931 1.189 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -1.117 -12.965 2.317 1.00 0.00 H new ATOM 0 HD3 ARG A 108 0.421 -12.168 2.582 1.00 0.00 H new ATOM 0 HE ARG A 108 -1.548 -11.646 4.694 1.00 0.00 H new ATOM 0 HH11 ARG A 108 0.991 -13.786 3.498 1.00 0.00 H new ATOM 0 HH12 ARG A 108 1.351 -14.444 5.097 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -1.081 -12.495 6.745 1.00 0.00 H new ATOM 0 HH22 ARG A 108 0.182 -13.717 6.929 1.00 0.00 H new ATOM 1618 N VAL A 109 -3.209 -7.652 2.018 1.00 0.00 N ATOM 1619 CA VAL A 109 -4.538 -7.402 2.563 1.00 0.00 C ATOM 1620 C VAL A 109 -5.564 -8.361 1.970 1.00 0.00 C ATOM 1621 O VAL A 109 -5.655 -8.512 0.752 1.00 0.00 O ATOM 1622 CB VAL A 109 -4.991 -5.954 2.296 1.00 0.00 C ATOM 1623 CG1 VAL A 109 -6.390 -5.722 2.847 1.00 0.00 C ATOM 1624 CG2 VAL A 109 -4.002 -4.968 2.897 1.00 0.00 C ATOM 0 H VAL A 109 -3.122 -7.472 1.018 1.00 0.00 H new ATOM 0 HA VAL A 109 -4.474 -7.562 3.639 1.00 0.00 H new ATOM 0 HB VAL A 109 -5.020 -5.793 1.218 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -6.693 -4.694 2.649 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -7.089 -6.406 2.365 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -6.392 -5.900 3.922 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.337 -3.950 2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -3.939 -5.126 3.974 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -3.020 -5.120 2.450 1.00 0.00 H new ATOM 1634 N GLU A 110 -6.335 -9.007 2.840 1.00 0.00 N ATOM 1635 CA GLU A 110 -7.354 -9.953 2.401 1.00 0.00 C ATOM 1636 C GLU A 110 -8.753 -9.382 2.615 1.00 0.00 C ATOM 1637 O GLU A 110 -9.112 -8.983 3.723 1.00 0.00 O ATOM 1638 CB GLU A 110 -7.211 -11.277 3.154 1.00 0.00 C ATOM 1639 CG GLU A 110 -8.100 -12.384 2.613 1.00 0.00 C ATOM 1640 CD GLU A 110 -8.028 -13.650 3.445 1.00 0.00 C ATOM 1641 OE1 GLU A 110 -7.981 -13.541 4.688 1.00 0.00 O ATOM 1642 OE2 GLU A 110 -8.019 -14.749 2.853 1.00 0.00 O ATOM 0 H GLU A 110 -6.273 -8.892 3.852 1.00 0.00 H new ATOM 0 HA GLU A 110 -7.212 -10.133 1.335 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -6.172 -11.602 3.107 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -7.447 -11.114 4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -9.132 -12.033 2.581 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -7.808 -12.611 1.588 1.00 0.00 H new ATOM 1649 N THR A 111 -9.541 -9.346 1.544 1.00 0.00 N ATOM 1650 CA THR A 111 -10.900 -8.823 1.613 1.00 0.00 C ATOM 1651 C THR A 111 -11.803 -9.744 2.424 1.00 0.00 C ATOM 1652 O THR A 111 -11.353 -10.758 2.956 1.00 0.00 O ATOM 1653 CB THR A 111 -11.502 -8.639 0.207 1.00 0.00 C ATOM 1654 OG1 THR A 111 -11.152 -9.750 -0.625 1.00 0.00 O ATOM 1655 CG2 THR A 111 -11.009 -7.348 -0.428 1.00 0.00 C ATOM 0 H THR A 111 -9.261 -9.673 0.619 1.00 0.00 H new ATOM 0 HA THR A 111 -10.841 -7.852 2.105 1.00 0.00 H new ATOM 0 HB THR A 111 -12.586 -8.586 0.304 1.00 0.00 H new ATOM 0 HG1 THR A 111 -11.225 -9.489 -1.567 1.00 0.00 H new ATOM 0 HG21 THR A 111 -11.447 -7.240 -1.420 1.00 0.00 H new ATOM 0 HG22 THR A 111 -11.303 -6.502 0.193 1.00 0.00 H new ATOM 0 HG23 THR A 111 -9.923 -7.376 -0.513 1.00 0.00 H new ATOM 1663 N GLN A 112 -13.080 -9.385 2.513 1.00 0.00 N ATOM 1664 CA GLN A 112 -14.046 -10.181 3.260 1.00 0.00 C ATOM 1665 C GLN A 112 -14.972 -10.940 2.316 1.00 0.00 C ATOM 1666 O GLN A 112 -15.354 -10.449 1.253 1.00 0.00 O ATOM 1667 CB GLN A 112 -14.868 -9.285 4.188 1.00 0.00 C ATOM 1668 CG GLN A 112 -14.133 -8.030 4.630 1.00 0.00 C ATOM 1669 CD GLN A 112 -13.108 -8.305 5.713 1.00 0.00 C ATOM 1670 OE1 GLN A 112 -12.916 -9.449 6.125 1.00 0.00 O ATOM 1671 NE2 GLN A 112 -12.443 -7.254 6.179 1.00 0.00 N ATOM 0 H GLN A 112 -13.469 -8.549 2.077 1.00 0.00 H new ATOM 0 HA GLN A 112 -13.495 -10.906 3.860 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -15.788 -8.997 3.680 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -15.156 -9.857 5.070 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.636 -7.583 3.769 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -14.855 -7.300 4.996 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -12.635 -6.324 5.808 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -11.740 -7.377 6.908 1.00 0.00 H new ATOM 1680 N PRO A 113 -15.343 -12.168 2.709 1.00 0.00 N ATOM 1681 CA PRO A 113 -16.229 -13.021 1.912 1.00 0.00 C ATOM 1682 C PRO A 113 -17.660 -12.495 1.873 1.00 0.00 C ATOM 1683 O PRO A 113 -18.429 -12.694 2.812 1.00 0.00 O ATOM 1684 CB PRO A 113 -16.174 -14.367 2.639 1.00 0.00 C ATOM 1685 CG PRO A 113 -15.819 -14.024 4.044 1.00 0.00 C ATOM 1686 CD PRO A 113 -14.926 -12.817 3.964 1.00 0.00 C ATOM 0 HA PRO A 113 -15.916 -13.071 0.869 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -17.132 -14.884 2.588 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -15.431 -15.028 2.193 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.712 -13.810 4.631 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.309 -14.855 4.531 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -15.062 -12.158 4.822 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -13.873 -13.097 3.941 1.00 0.00 H new ATOM 1694 N GLU A 114 -18.009 -11.823 0.780 1.00 0.00 N ATOM 1695 CA GLU A 114 -19.348 -11.269 0.620 1.00 0.00 C ATOM 1696 C GLU A 114 -20.257 -12.247 -0.119 1.00 0.00 C ATOM 1697 O GLU A 114 -19.795 -13.048 -0.931 1.00 0.00 O ATOM 1698 CB GLU A 114 -19.287 -9.940 -0.137 1.00 0.00 C ATOM 1699 CG GLU A 114 -18.960 -10.096 -1.613 1.00 0.00 C ATOM 1700 CD GLU A 114 -20.198 -10.288 -2.467 1.00 0.00 C ATOM 1701 OE1 GLU A 114 -21.066 -9.390 -2.464 1.00 0.00 O ATOM 1702 OE2 GLU A 114 -20.299 -11.336 -3.139 1.00 0.00 O ATOM 0 H GLU A 114 -17.383 -11.649 -0.007 1.00 0.00 H new ATOM 0 HA GLU A 114 -19.762 -11.095 1.613 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -20.245 -9.430 -0.037 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -18.536 -9.301 0.328 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -18.419 -9.214 -1.957 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -18.295 -10.950 -1.746 1.00 0.00 H new ATOM 1709 N SER A 115 -21.553 -12.174 0.169 1.00 0.00 N ATOM 1710 CA SER A 115 -22.527 -13.055 -0.463 1.00 0.00 C ATOM 1711 C SER A 115 -22.270 -14.510 -0.086 1.00 0.00 C ATOM 1712 O SER A 115 -22.341 -15.404 -0.928 1.00 0.00 O ATOM 1713 CB SER A 115 -22.479 -12.895 -1.984 1.00 0.00 C ATOM 1714 OG SER A 115 -23.719 -13.247 -2.574 1.00 0.00 O ATOM 0 H SER A 115 -21.952 -11.514 0.836 1.00 0.00 H new ATOM 0 HA SER A 115 -23.518 -12.775 -0.106 1.00 0.00 H new ATOM 0 HB2 SER A 115 -22.232 -11.864 -2.237 1.00 0.00 H new ATOM 0 HB3 SER A 115 -21.687 -13.522 -2.394 1.00 0.00 H new ATOM 0 HG SER A 115 -23.662 -13.135 -3.546 1.00 0.00 H new ATOM 1720 N GLY A 116 -21.970 -14.740 1.189 1.00 0.00 N ATOM 1721 CA GLY A 116 -21.706 -16.088 1.658 1.00 0.00 C ATOM 1722 C GLY A 116 -22.825 -16.630 2.525 1.00 0.00 C ATOM 1723 O GLY A 116 -23.622 -15.880 3.088 1.00 0.00 O ATOM 0 H GLY A 116 -21.905 -14.017 1.905 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -21.563 -16.746 0.801 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -20.775 -16.096 2.225 1.00 0.00 H new ATOM 1727 N PRO A 117 -22.896 -17.965 2.640 1.00 0.00 N ATOM 1728 CA PRO A 117 -23.923 -18.636 3.442 1.00 0.00 C ATOM 1729 C PRO A 117 -23.723 -18.420 4.938 1.00 0.00 C ATOM 1730 O PRO A 117 -24.478 -18.945 5.757 1.00 0.00 O ATOM 1731 CB PRO A 117 -23.741 -20.114 3.086 1.00 0.00 C ATOM 1732 CG PRO A 117 -22.319 -20.228 2.657 1.00 0.00 C ATOM 1733 CD PRO A 117 -21.980 -18.921 1.996 1.00 0.00 C ATOM 0 HA PRO A 117 -24.921 -18.252 3.231 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -23.949 -20.756 3.942 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -24.420 -20.416 2.289 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -21.668 -20.414 3.511 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -22.185 -21.061 1.967 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -20.937 -18.648 2.156 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -22.136 -18.963 0.918 1.00 0.00 H new ATOM 1741 N SER A 118 -22.703 -17.644 5.288 1.00 0.00 N ATOM 1742 CA SER A 118 -22.402 -17.361 6.687 1.00 0.00 C ATOM 1743 C SER A 118 -23.685 -17.243 7.505 1.00 0.00 C ATOM 1744 O SER A 118 -24.420 -16.263 7.390 1.00 0.00 O ATOM 1745 CB SER A 118 -21.589 -16.071 6.804 1.00 0.00 C ATOM 1746 OG SER A 118 -20.286 -16.239 6.273 1.00 0.00 O ATOM 0 H SER A 118 -22.071 -17.200 4.622 1.00 0.00 H new ATOM 0 HA SER A 118 -21.814 -18.190 7.082 1.00 0.00 H new ATOM 0 HB2 SER A 118 -22.100 -15.266 6.275 1.00 0.00 H new ATOM 0 HB3 SER A 118 -21.523 -15.773 7.850 1.00 0.00 H new ATOM 0 HG SER A 118 -19.787 -15.400 6.358 1.00 0.00 H new ATOM 1752 N SER A 119 -23.946 -18.251 8.332 1.00 0.00 N ATOM 1753 CA SER A 119 -25.141 -18.264 9.167 1.00 0.00 C ATOM 1754 C SER A 119 -24.784 -18.557 10.621 1.00 0.00 C ATOM 1755 O SER A 119 -23.669 -18.979 10.926 1.00 0.00 O ATOM 1756 CB SER A 119 -26.137 -19.306 8.654 1.00 0.00 C ATOM 1757 OG SER A 119 -26.958 -18.767 7.632 1.00 0.00 O ATOM 0 H SER A 119 -23.346 -19.069 8.441 1.00 0.00 H new ATOM 0 HA SER A 119 -25.601 -17.277 9.116 1.00 0.00 H new ATOM 0 HB2 SER A 119 -25.597 -20.173 8.272 1.00 0.00 H new ATOM 0 HB3 SER A 119 -26.759 -19.656 9.478 1.00 0.00 H new ATOM 0 HG SER A 119 -26.432 -18.662 6.812 1.00 0.00 H new ATOM 1763 N GLY A 120 -25.741 -18.331 11.516 1.00 0.00 N ATOM 1764 CA GLY A 120 -25.510 -18.576 12.928 1.00 0.00 C ATOM 1765 C GLY A 120 -24.424 -17.686 13.500 1.00 0.00 C ATOM 1766 O GLY A 120 -23.490 -17.305 12.796 1.00 0.00 O ATOM 0 H GLY A 120 -26.672 -17.983 11.288 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -26.437 -18.413 13.478 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -25.233 -19.620 13.072 1.00 0.00 H new TER 1770 GLY A 120