USER MOD reduce.3.24.130724 H: found=0, std=0, add=1003, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1001 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 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 14 THR OG1 : rot 92:sc= -0.503 USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.1 (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 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.11 X(o=-0.11,f=-0.028) USER MOD Single : A 13 TYR OH : rot 180:sc= -0.803 USER MOD Single : A 15 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0187) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0.648 K(o=0.65,f=0) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.148 K(o=-0.15,f=-7.9!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -130:sc= 0.689 (180deg=0.0064) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 0:sc= 0.67 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.176 X(o=-0.18,f=-0.38) USER MOD Single : A 58 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.0024) USER MOD Single : A 63 LYS NZ :NH3+ -164:sc= -0.0775 (180deg=-0.334) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 75 THR OG1 : rot -53:sc= 1.28 USER MOD Single : A 76 THR OG1 : rot 117:sc= 1.24 USER MOD Single : A 78 TYR OH : rot 170:sc= -0.297 USER MOD Single : A 82 LYS NZ :NH3+ 148:sc= -0.071 (180deg=-1.02) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 SER OG : rot -85:sc= 1.09 USER MOD Single : A 97 ASN : amide:sc= 1.09 K(o=1.1,f=-0.0052) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0.794 K(o=0.79,f=-0.22) USER MOD Single : A 118 SER OG : rot 139:sc= 1.17 USER MOD Single : A 119 SER OG : rot -42:sc= 0.155 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.911 12.927 -19.723 1.00 0.00 N ATOM 2 CA GLY A 1 -4.311 12.826 -19.318 1.00 0.00 C ATOM 3 C GLY A 1 -4.456 12.329 -17.893 1.00 0.00 C ATOM 4 O GLY A 1 -3.463 12.014 -17.231 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.720 13.887 -20.076 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.298 12.730 -18.906 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.717 12.236 -20.476 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.787 13.802 -19.412 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.836 12.150 -19.993 1.00 0.00 H new ATOM 8 N SER A 2 -5.699 12.234 -17.417 1.00 0.00 N ATOM 9 CA SER A 2 -6.033 11.457 -16.224 1.00 0.00 C ATOM 10 C SER A 2 -5.869 9.958 -16.532 1.00 0.00 C ATOM 11 O SER A 2 -5.620 9.583 -17.684 1.00 0.00 O ATOM 12 CB SER A 2 -7.466 11.806 -15.797 1.00 0.00 C ATOM 13 OG SER A 2 -7.795 11.275 -14.527 1.00 0.00 O ATOM 0 H SER A 2 -6.501 12.694 -17.848 1.00 0.00 H new ATOM 0 HA SER A 2 -5.363 11.698 -15.398 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.582 12.890 -15.776 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.167 11.425 -16.540 1.00 0.00 H new ATOM 0 HG SER A 2 -8.714 11.524 -14.297 1.00 0.00 H new ATOM 19 N SER A 3 -6.030 9.108 -15.517 1.00 0.00 N ATOM 20 CA SER A 3 -5.953 7.659 -15.646 1.00 0.00 C ATOM 21 C SER A 3 -7.284 7.047 -15.187 1.00 0.00 C ATOM 22 O SER A 3 -8.132 6.712 -16.021 1.00 0.00 O ATOM 23 CB SER A 3 -4.721 7.109 -14.905 1.00 0.00 C ATOM 24 OG SER A 3 -3.554 7.902 -15.091 1.00 0.00 O ATOM 0 H SER A 3 -6.221 9.418 -14.564 1.00 0.00 H new ATOM 0 HA SER A 3 -5.810 7.373 -16.688 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.944 7.046 -13.840 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.521 6.094 -15.249 1.00 0.00 H new ATOM 0 HG SER A 3 -2.807 7.505 -14.597 1.00 0.00 H new ATOM 30 N GLY A 4 -7.503 6.931 -13.877 1.00 0.00 N ATOM 31 CA GLY A 4 -8.628 6.231 -13.275 1.00 0.00 C ATOM 32 C GLY A 4 -8.600 6.456 -11.767 1.00 0.00 C ATOM 33 O GLY A 4 -9.206 7.419 -11.290 1.00 0.00 O ATOM 0 H GLY A 4 -6.876 7.339 -13.184 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.566 6.596 -13.693 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.572 5.166 -13.498 1.00 0.00 H new ATOM 37 N SER A 5 -7.866 5.616 -11.036 1.00 0.00 N ATOM 38 CA SER A 5 -7.777 5.613 -9.570 1.00 0.00 C ATOM 39 C SER A 5 -6.326 5.690 -9.060 1.00 0.00 C ATOM 40 O SER A 5 -6.110 5.738 -7.846 1.00 0.00 O ATOM 41 CB SER A 5 -8.481 4.363 -9.019 1.00 0.00 C ATOM 42 OG SER A 5 -9.756 4.196 -9.617 1.00 0.00 O ATOM 0 H SER A 5 -7.293 4.889 -11.464 1.00 0.00 H new ATOM 0 HA SER A 5 -8.277 6.511 -9.206 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.868 3.482 -9.208 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.590 4.449 -7.938 1.00 0.00 H new ATOM 0 HG SER A 5 -10.185 3.394 -9.253 1.00 0.00 H new ATOM 48 N SER A 6 -5.334 5.699 -9.959 1.00 0.00 N ATOM 49 CA SER A 6 -3.946 5.966 -9.617 1.00 0.00 C ATOM 50 C SER A 6 -3.738 7.479 -9.459 1.00 0.00 C ATOM 51 O SER A 6 -4.507 8.302 -9.972 1.00 0.00 O ATOM 52 CB SER A 6 -3.029 5.353 -10.685 1.00 0.00 C ATOM 53 OG SER A 6 -3.301 5.900 -11.964 1.00 0.00 O ATOM 0 H SER A 6 -5.482 5.518 -10.952 1.00 0.00 H new ATOM 0 HA SER A 6 -3.691 5.503 -8.664 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.987 5.535 -10.422 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.167 4.272 -10.711 1.00 0.00 H new ATOM 0 HG SER A 6 -2.703 5.495 -12.627 1.00 0.00 H new ATOM 59 N GLY A 7 -2.639 7.872 -8.825 1.00 0.00 N ATOM 60 CA GLY A 7 -2.125 9.236 -8.805 1.00 0.00 C ATOM 61 C GLY A 7 -0.684 9.218 -8.309 1.00 0.00 C ATOM 62 O GLY A 7 -0.186 8.162 -7.921 1.00 0.00 O ATOM 0 H GLY A 7 -2.060 7.224 -8.291 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.174 9.671 -9.803 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.739 9.860 -8.155 1.00 0.00 H new ATOM 66 N SER A 8 -0.001 10.363 -8.346 1.00 0.00 N ATOM 67 CA SER A 8 1.394 10.449 -7.935 1.00 0.00 C ATOM 68 C SER A 8 1.584 10.011 -6.483 1.00 0.00 C ATOM 69 O SER A 8 0.666 10.084 -5.673 1.00 0.00 O ATOM 70 CB SER A 8 1.875 11.885 -8.090 1.00 0.00 C ATOM 71 OG SER A 8 1.657 12.400 -9.387 1.00 0.00 O ATOM 0 H SER A 8 -0.399 11.248 -8.660 1.00 0.00 H new ATOM 0 HA SER A 8 1.974 9.779 -8.570 1.00 0.00 H new ATOM 0 HB2 SER A 8 1.362 12.515 -7.363 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.939 11.933 -7.859 1.00 0.00 H new ATOM 0 HG SER A 8 1.982 13.324 -9.431 1.00 0.00 H new ATOM 77 N ALA A 9 2.800 9.624 -6.123 1.00 0.00 N ATOM 78 CA ALA A 9 3.106 9.019 -4.838 1.00 0.00 C ATOM 79 C ALA A 9 2.631 9.818 -3.623 1.00 0.00 C ATOM 80 O ALA A 9 1.828 9.315 -2.831 1.00 0.00 O ATOM 81 CB ALA A 9 4.601 8.758 -4.787 1.00 0.00 C ATOM 0 H ALA A 9 3.615 9.724 -6.728 1.00 0.00 H new ATOM 0 HA ALA A 9 2.543 8.088 -4.769 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.858 8.303 -3.831 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.880 8.084 -5.597 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.139 9.700 -4.897 1.00 0.00 H new ATOM 87 N LYS A 10 3.098 11.062 -3.458 1.00 0.00 N ATOM 88 CA LYS A 10 2.697 11.848 -2.293 1.00 0.00 C ATOM 89 C LYS A 10 1.185 12.116 -2.303 1.00 0.00 C ATOM 90 O LYS A 10 0.654 12.406 -1.237 1.00 0.00 O ATOM 91 CB LYS A 10 3.449 13.196 -2.190 1.00 0.00 C ATOM 92 CG LYS A 10 4.487 13.265 -1.049 1.00 0.00 C ATOM 93 CD LYS A 10 4.871 14.685 -0.632 1.00 0.00 C ATOM 94 CE LYS A 10 3.811 15.415 0.199 1.00 0.00 C ATOM 95 NZ LYS A 10 3.834 15.087 1.644 1.00 0.00 N ATOM 0 H LYS A 10 3.736 11.533 -4.099 1.00 0.00 H new ATOM 0 HA LYS A 10 2.962 11.248 -1.422 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.955 13.389 -3.136 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.720 13.994 -2.050 1.00 0.00 H new ATOM 0 HG2 LYS A 10 4.090 12.739 -0.181 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.387 12.734 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.797 14.643 -0.059 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.077 15.270 -1.529 1.00 0.00 H new ATOM 0 HE2 LYS A 10 3.950 16.490 0.080 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.825 15.175 -0.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 3.088 15.621 2.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 3.670 14.068 1.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 4.760 15.341 2.043 1.00 0.00 H new ATOM 109 N ASN A 11 0.496 12.055 -3.455 1.00 0.00 N ATOM 110 CA ASN A 11 -0.945 12.318 -3.580 1.00 0.00 C ATOM 111 C ASN A 11 -1.706 11.482 -2.563 1.00 0.00 C ATOM 112 O ASN A 11 -2.609 12.001 -1.912 1.00 0.00 O ATOM 113 CB ASN A 11 -1.477 11.980 -4.990 1.00 0.00 C ATOM 114 CG ASN A 11 -2.888 12.455 -5.331 1.00 0.00 C ATOM 115 OD1 ASN A 11 -3.257 12.440 -6.505 1.00 0.00 O ATOM 116 ND2 ASN A 11 -3.725 12.857 -4.391 1.00 0.00 N ATOM 0 H ASN A 11 0.936 11.816 -4.344 1.00 0.00 H new ATOM 0 HA ASN A 11 -1.097 13.382 -3.401 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -0.790 12.405 -5.722 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -1.445 10.898 -5.114 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -4.669 13.152 -4.641 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -3.427 12.872 -3.416 1.00 0.00 H new ATOM 123 N ALA A 12 -1.343 10.204 -2.468 1.00 0.00 N ATOM 124 CA ALA A 12 -1.924 9.236 -1.567 1.00 0.00 C ATOM 125 C ALA A 12 -1.405 9.478 -0.141 1.00 0.00 C ATOM 126 O ALA A 12 -2.198 9.777 0.754 1.00 0.00 O ATOM 127 CB ALA A 12 -1.612 7.847 -2.136 1.00 0.00 C ATOM 0 H ALA A 12 -0.603 9.807 -3.047 1.00 0.00 H new ATOM 0 HA ALA A 12 -3.008 9.326 -1.490 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.035 7.083 -1.483 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.047 7.755 -3.131 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -0.532 7.714 -2.199 1.00 0.00 H new ATOM 133 N TYR A 13 -0.080 9.448 0.060 1.00 0.00 N ATOM 134 CA TYR A 13 0.554 9.569 1.379 1.00 0.00 C ATOM 135 C TYR A 13 0.070 10.793 2.161 1.00 0.00 C ATOM 136 O TYR A 13 -0.279 10.665 3.331 1.00 0.00 O ATOM 137 CB TYR A 13 2.078 9.638 1.220 1.00 0.00 C ATOM 138 CG TYR A 13 2.842 9.886 2.510 1.00 0.00 C ATOM 139 CD1 TYR A 13 2.891 8.888 3.493 1.00 0.00 C ATOM 140 CD2 TYR A 13 3.464 11.128 2.750 1.00 0.00 C ATOM 141 CE1 TYR A 13 3.586 9.107 4.692 1.00 0.00 C ATOM 142 CE2 TYR A 13 4.147 11.365 3.957 1.00 0.00 C ATOM 143 CZ TYR A 13 4.188 10.355 4.944 1.00 0.00 C ATOM 144 OH TYR A 13 4.750 10.561 6.164 1.00 0.00 O ATOM 0 H TYR A 13 0.590 9.337 -0.701 1.00 0.00 H new ATOM 0 HA TYR A 13 0.269 8.685 1.949 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.426 8.703 0.782 1.00 0.00 H new ATOM 0 HB3 TYR A 13 2.320 10.431 0.513 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.391 7.945 3.327 1.00 0.00 H new ATOM 0 HD2 TYR A 13 3.416 11.904 2.001 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.660 8.316 5.424 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.637 12.312 4.128 1.00 0.00 H new ATOM 0 HH TYR A 13 5.130 11.464 6.201 1.00 0.00 H new ATOM 154 N THR A 14 0.030 11.970 1.527 1.00 0.00 N ATOM 155 CA THR A 14 -0.457 13.200 2.134 1.00 0.00 C ATOM 156 C THR A 14 -1.814 12.986 2.826 1.00 0.00 C ATOM 157 O THR A 14 -2.015 13.452 3.950 1.00 0.00 O ATOM 158 CB THR A 14 -0.538 14.272 1.030 1.00 0.00 C ATOM 159 OG1 THR A 14 0.761 14.693 0.652 1.00 0.00 O ATOM 160 CG2 THR A 14 -1.317 15.516 1.436 1.00 0.00 C ATOM 0 H THR A 14 0.341 12.090 0.563 1.00 0.00 H new ATOM 0 HA THR A 14 0.228 13.530 2.915 1.00 0.00 H new ATOM 0 HB THR A 14 -1.065 13.791 0.206 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.075 14.150 -0.101 1.00 0.00 H new ATOM 0 HG21 THR A 14 -1.330 16.224 0.607 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.339 15.238 1.692 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.840 15.978 2.300 1.00 0.00 H new ATOM 168 N LYS A 15 -2.762 12.342 2.138 1.00 0.00 N ATOM 169 CA LYS A 15 -4.129 12.179 2.617 1.00 0.00 C ATOM 170 C LYS A 15 -4.200 11.169 3.761 1.00 0.00 C ATOM 171 O LYS A 15 -4.973 11.366 4.697 1.00 0.00 O ATOM 172 CB LYS A 15 -5.022 11.745 1.456 1.00 0.00 C ATOM 173 CG LYS A 15 -5.101 12.740 0.287 1.00 0.00 C ATOM 174 CD LYS A 15 -5.657 14.124 0.667 1.00 0.00 C ATOM 175 CE LYS A 15 -5.652 15.081 -0.529 1.00 0.00 C ATOM 176 NZ LYS A 15 -6.611 14.680 -1.576 1.00 0.00 N ATOM 0 H LYS A 15 -2.596 11.917 1.226 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.481 13.134 3.006 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.659 10.790 1.076 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -6.029 11.575 1.837 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -4.104 12.866 -0.135 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.727 12.313 -0.496 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -6.674 14.017 1.044 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -5.060 14.547 1.475 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -5.893 16.087 -0.186 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.649 15.120 -0.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.644 15.411 -2.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -6.310 13.777 -1.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -7.556 14.569 -1.157 1.00 0.00 H new ATOM 190 N LEU A 16 -3.352 10.139 3.728 1.00 0.00 N ATOM 191 CA LEU A 16 -3.207 9.101 4.745 1.00 0.00 C ATOM 192 C LEU A 16 -2.932 9.666 6.148 1.00 0.00 C ATOM 193 O LEU A 16 -3.175 8.998 7.152 1.00 0.00 O ATOM 194 CB LEU A 16 -2.052 8.198 4.290 1.00 0.00 C ATOM 195 CG LEU A 16 -2.165 6.713 4.641 1.00 0.00 C ATOM 196 CD1 LEU A 16 -0.879 6.062 4.136 1.00 0.00 C ATOM 197 CD2 LEU A 16 -2.417 6.313 6.094 1.00 0.00 C ATOM 0 H LEU A 16 -2.713 10.001 2.945 1.00 0.00 H new ATOM 0 HA LEU A 16 -4.143 8.550 4.835 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.957 8.286 3.208 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.128 8.581 4.724 1.00 0.00 H new ATOM 0 HG LEU A 16 -3.082 6.368 4.164 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.900 4.995 4.358 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.797 6.207 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.022 6.519 4.630 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.470 5.227 6.168 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.603 6.680 6.719 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -3.358 6.746 6.433 1.00 0.00 H new ATOM 209 N GLY A 17 -2.398 10.886 6.223 1.00 0.00 N ATOM 210 CA GLY A 17 -1.989 11.535 7.459 1.00 0.00 C ATOM 211 C GLY A 17 -2.748 12.817 7.748 1.00 0.00 C ATOM 212 O GLY A 17 -2.206 13.690 8.430 1.00 0.00 O ATOM 0 H GLY A 17 -2.235 11.463 5.398 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.132 10.842 8.288 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.923 11.756 7.409 1.00 0.00 H new ATOM 216 N THR A 18 -3.961 12.949 7.221 1.00 0.00 N ATOM 217 CA THR A 18 -4.876 14.038 7.537 1.00 0.00 C ATOM 218 C THR A 18 -6.304 13.476 7.604 1.00 0.00 C ATOM 219 O THR A 18 -7.096 13.937 8.423 1.00 0.00 O ATOM 220 CB THR A 18 -4.642 15.197 6.539 1.00 0.00 C ATOM 221 OG1 THR A 18 -5.323 16.387 6.868 1.00 0.00 O ATOM 222 CG2 THR A 18 -5.042 14.837 5.113 1.00 0.00 C ATOM 0 H THR A 18 -4.343 12.286 6.547 1.00 0.00 H new ATOM 0 HA THR A 18 -4.695 14.475 8.519 1.00 0.00 H new ATOM 0 HB THR A 18 -3.567 15.366 6.608 1.00 0.00 H new ATOM 0 HG1 THR A 18 -5.127 17.073 6.196 1.00 0.00 H new ATOM 0 HG21 THR A 18 -4.856 15.688 4.457 1.00 0.00 H new ATOM 0 HG22 THR A 18 -4.455 13.983 4.775 1.00 0.00 H new ATOM 0 HG23 THR A 18 -6.102 14.583 5.086 1.00 0.00 H new ATOM 230 N ASP A 19 -6.636 12.434 6.829 1.00 0.00 N ATOM 231 CA ASP A 19 -7.736 11.531 7.155 1.00 0.00 C ATOM 232 C ASP A 19 -7.210 10.533 8.183 1.00 0.00 C ATOM 233 O ASP A 19 -6.364 9.702 7.849 1.00 0.00 O ATOM 234 CB ASP A 19 -8.200 10.730 5.932 1.00 0.00 C ATOM 235 CG ASP A 19 -9.432 9.858 6.232 1.00 0.00 C ATOM 236 OD1 ASP A 19 -10.033 9.991 7.328 1.00 0.00 O ATOM 237 OD2 ASP A 19 -9.875 9.116 5.322 1.00 0.00 O ATOM 0 H ASP A 19 -6.149 12.199 5.964 1.00 0.00 H new ATOM 0 HA ASP A 19 -8.577 12.120 7.522 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.434 11.417 5.119 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.384 10.095 5.587 1.00 0.00 H new ATOM 242 N ASP A 20 -7.696 10.575 9.420 1.00 0.00 N ATOM 243 CA ASP A 20 -7.319 9.566 10.407 1.00 0.00 C ATOM 244 C ASP A 20 -7.746 8.156 9.962 1.00 0.00 C ATOM 245 O ASP A 20 -7.097 7.165 10.311 1.00 0.00 O ATOM 246 CB ASP A 20 -7.937 9.906 11.767 1.00 0.00 C ATOM 247 CG ASP A 20 -7.466 8.911 12.824 1.00 0.00 C ATOM 248 OD1 ASP A 20 -6.331 9.059 13.332 1.00 0.00 O ATOM 249 OD2 ASP A 20 -8.216 7.962 13.141 1.00 0.00 O ATOM 0 H ASP A 20 -8.343 11.286 9.761 1.00 0.00 H new ATOM 0 HA ASP A 20 -6.233 9.570 10.496 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.657 10.918 12.059 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -9.024 9.885 11.696 1.00 0.00 H new ATOM 254 N ASN A 21 -8.849 8.052 9.209 1.00 0.00 N ATOM 255 CA ASN A 21 -9.464 6.778 8.827 1.00 0.00 C ATOM 256 C ASN A 21 -8.720 6.145 7.660 1.00 0.00 C ATOM 257 O ASN A 21 -8.907 4.958 7.387 1.00 0.00 O ATOM 258 CB ASN A 21 -10.927 6.958 8.383 1.00 0.00 C ATOM 259 CG ASN A 21 -11.788 7.657 9.415 1.00 0.00 C ATOM 260 OD1 ASN A 21 -12.306 7.029 10.333 1.00 0.00 O ATOM 261 ND2 ASN A 21 -11.918 8.966 9.309 1.00 0.00 N ATOM 0 H ASN A 21 -9.345 8.865 8.843 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.417 6.143 9.712 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.949 7.529 7.455 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -11.356 5.980 8.166 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -12.461 9.482 10.001 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -11.476 9.461 8.535 1.00 0.00 H new ATOM 268 N ALA A 22 -7.945 6.936 6.920 1.00 0.00 N ATOM 269 CA ALA A 22 -7.226 6.475 5.753 1.00 0.00 C ATOM 270 C ALA A 22 -6.154 5.468 6.168 1.00 0.00 C ATOM 271 O ALA A 22 -5.706 5.479 7.312 1.00 0.00 O ATOM 272 CB ALA A 22 -6.623 7.680 5.046 1.00 0.00 C ATOM 0 H ALA A 22 -7.803 7.925 7.124 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.901 5.968 5.063 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.077 7.348 4.163 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.419 8.362 4.746 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.941 8.195 5.722 1.00 0.00 H new ATOM 278 N GLN A 23 -5.757 4.569 5.266 1.00 0.00 N ATOM 279 CA GLN A 23 -4.949 3.391 5.596 1.00 0.00 C ATOM 280 C GLN A 23 -3.976 3.051 4.461 1.00 0.00 C ATOM 281 O GLN A 23 -4.007 3.687 3.410 1.00 0.00 O ATOM 282 CB GLN A 23 -5.889 2.202 5.837 1.00 0.00 C ATOM 283 CG GLN A 23 -6.674 2.232 7.165 1.00 0.00 C ATOM 284 CD GLN A 23 -5.923 1.614 8.339 1.00 0.00 C ATOM 285 OE1 GLN A 23 -4.696 1.616 8.390 1.00 0.00 O ATOM 286 NE2 GLN A 23 -6.651 1.037 9.284 1.00 0.00 N ATOM 0 H GLN A 23 -5.989 4.638 4.275 1.00 0.00 H new ATOM 0 HA GLN A 23 -4.364 3.605 6.490 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.603 2.154 5.015 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -5.301 1.285 5.804 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.920 3.266 7.407 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.617 1.703 7.030 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -7.669 1.047 9.221 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -6.193 0.582 10.074 1.00 0.00 H new ATOM 295 N LEU A 24 -3.147 2.013 4.644 1.00 0.00 N ATOM 296 CA LEU A 24 -2.196 1.522 3.647 1.00 0.00 C ATOM 297 C LEU A 24 -2.318 0.007 3.500 1.00 0.00 C ATOM 298 O LEU A 24 -2.244 -0.697 4.513 1.00 0.00 O ATOM 299 CB LEU A 24 -0.779 1.909 4.093 1.00 0.00 C ATOM 300 CG LEU A 24 0.302 1.993 3.004 1.00 0.00 C ATOM 301 CD1 LEU A 24 0.671 0.659 2.345 1.00 0.00 C ATOM 302 CD2 LEU A 24 -0.079 3.007 1.932 1.00 0.00 C ATOM 0 H LEU A 24 -3.122 1.481 5.514 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.410 1.970 2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.834 2.878 4.590 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.451 1.186 4.840 1.00 0.00 H new ATOM 0 HG LEU A 24 1.196 2.318 3.536 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.441 0.826 1.592 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.047 -0.029 3.102 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.212 0.230 1.872 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.703 3.046 1.174 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.019 2.710 1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.194 3.991 2.386 1.00 0.00 H new ATOM 314 N LEU A 25 -2.474 -0.487 2.268 1.00 0.00 N ATOM 315 CA LEU A 25 -2.473 -1.907 1.919 1.00 0.00 C ATOM 316 C LEU A 25 -1.322 -2.202 0.979 1.00 0.00 C ATOM 317 O LEU A 25 -1.399 -2.026 -0.233 1.00 0.00 O ATOM 318 CB LEU A 25 -3.816 -2.399 1.334 1.00 0.00 C ATOM 319 CG LEU A 25 -4.190 -3.830 1.748 1.00 0.00 C ATOM 320 CD1 LEU A 25 -3.345 -4.900 1.070 1.00 0.00 C ATOM 321 CD2 LEU A 25 -4.087 -4.043 3.254 1.00 0.00 C ATOM 0 H LEU A 25 -2.610 0.116 1.457 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.339 -2.465 2.846 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.609 -1.721 1.651 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.768 -2.347 0.246 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.225 -3.937 1.422 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.665 -5.885 1.410 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.469 -4.831 -0.011 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.296 -4.751 1.325 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.361 -5.070 3.496 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.064 -3.855 3.579 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.762 -3.357 3.766 1.00 0.00 H new ATOM 333 N ASP A 26 -0.223 -2.632 1.572 1.00 0.00 N ATOM 334 CA ASP A 26 0.982 -2.997 0.858 1.00 0.00 C ATOM 335 C ASP A 26 0.756 -4.358 0.196 1.00 0.00 C ATOM 336 O ASP A 26 0.706 -5.385 0.887 1.00 0.00 O ATOM 337 CB ASP A 26 2.112 -2.985 1.881 1.00 0.00 C ATOM 338 CG ASP A 26 3.467 -2.791 1.249 1.00 0.00 C ATOM 339 OD1 ASP A 26 3.712 -3.281 0.137 1.00 0.00 O ATOM 340 OD2 ASP A 26 4.312 -2.187 1.959 1.00 0.00 O ATOM 0 H ASP A 26 -0.144 -2.739 2.583 1.00 0.00 H new ATOM 0 HA ASP A 26 1.244 -2.307 0.056 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.935 -2.188 2.603 1.00 0.00 H new ATOM 0 HB3 ASP A 26 2.105 -3.924 2.435 1.00 0.00 H new ATOM 345 N ILE A 27 0.497 -4.352 -1.115 1.00 0.00 N ATOM 346 CA ILE A 27 0.241 -5.546 -1.918 1.00 0.00 C ATOM 347 C ILE A 27 1.530 -6.125 -2.514 1.00 0.00 C ATOM 348 O ILE A 27 1.447 -7.040 -3.346 1.00 0.00 O ATOM 349 CB ILE A 27 -0.837 -5.325 -3.005 1.00 0.00 C ATOM 350 CG1 ILE A 27 -0.426 -4.353 -4.130 1.00 0.00 C ATOM 351 CG2 ILE A 27 -2.179 -4.965 -2.349 1.00 0.00 C ATOM 352 CD1 ILE A 27 -1.329 -4.469 -5.370 1.00 0.00 C ATOM 0 H ILE A 27 0.459 -3.491 -1.660 1.00 0.00 H new ATOM 0 HA ILE A 27 -0.164 -6.287 -1.229 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.955 -6.272 -3.531 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.462 -3.331 -3.753 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.607 -4.551 -4.417 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.932 -4.811 -3.122 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.493 -5.777 -1.693 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.065 -4.051 -1.766 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.995 -3.763 -6.130 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.274 -5.483 -5.767 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.359 -4.244 -5.093 1.00 0.00 H new ATOM 364 N ARG A 28 2.705 -5.593 -2.158 1.00 0.00 N ATOM 365 CA ARG A 28 3.970 -6.124 -2.650 1.00 0.00 C ATOM 366 C ARG A 28 4.171 -7.539 -2.125 1.00 0.00 C ATOM 367 O ARG A 28 3.549 -7.953 -1.143 1.00 0.00 O ATOM 368 CB ARG A 28 5.138 -5.214 -2.253 1.00 0.00 C ATOM 369 CG ARG A 28 4.917 -3.798 -2.800 1.00 0.00 C ATOM 370 CD ARG A 28 6.074 -2.847 -2.503 1.00 0.00 C ATOM 371 NE ARG A 28 6.108 -2.605 -1.065 1.00 0.00 N ATOM 372 CZ ARG A 28 7.116 -2.796 -0.220 1.00 0.00 C ATOM 373 NH1 ARG A 28 8.335 -3.147 -0.604 1.00 0.00 N ATOM 374 NH2 ARG A 28 6.882 -2.638 1.066 1.00 0.00 N ATOM 0 H ARG A 28 2.800 -4.795 -1.530 1.00 0.00 H new ATOM 0 HA ARG A 28 3.940 -6.157 -3.739 1.00 0.00 H new ATOM 0 HB2 ARG A 28 5.231 -5.182 -1.167 1.00 0.00 H new ATOM 0 HB3 ARG A 28 6.072 -5.620 -2.641 1.00 0.00 H new ATOM 0 HG2 ARG A 28 4.768 -3.852 -3.878 1.00 0.00 H new ATOM 0 HG3 ARG A 28 4.001 -3.390 -2.372 1.00 0.00 H new ATOM 0 HD2 ARG A 28 7.017 -3.279 -2.838 1.00 0.00 H new ATOM 0 HD3 ARG A 28 5.943 -1.909 -3.043 1.00 0.00 H new ATOM 0 HE ARG A 28 5.247 -2.242 -0.655 1.00 0.00 H new ATOM 0 HH11 ARG A 28 8.538 -3.284 -1.594 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.070 -3.280 0.091 1.00 0.00 H new ATOM 0 HH21 ARG A 28 5.950 -2.377 1.386 1.00 0.00 H new ATOM 0 HH22 ARG A 28 7.633 -2.777 1.742 1.00 0.00 H new ATOM 388 N ALA A 29 5.029 -8.285 -2.822 1.00 0.00 N ATOM 389 CA ALA A 29 5.351 -9.664 -2.516 1.00 0.00 C ATOM 390 C ALA A 29 5.806 -9.798 -1.062 1.00 0.00 C ATOM 391 O ALA A 29 6.443 -8.908 -0.507 1.00 0.00 O ATOM 392 CB ALA A 29 6.424 -10.157 -3.490 1.00 0.00 C ATOM 0 H ALA A 29 5.529 -7.929 -3.637 1.00 0.00 H new ATOM 0 HA ALA A 29 4.463 -10.284 -2.634 1.00 0.00 H new ATOM 0 HB1 ALA A 29 6.671 -11.195 -3.265 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.049 -10.087 -4.511 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.318 -9.541 -3.389 1.00 0.00 H new ATOM 398 N THR A 30 5.535 -10.941 -0.444 1.00 0.00 N ATOM 399 CA THR A 30 5.995 -11.237 0.903 1.00 0.00 C ATOM 400 C THR A 30 7.532 -11.161 1.005 1.00 0.00 C ATOM 401 O THR A 30 8.059 -10.702 2.022 1.00 0.00 O ATOM 402 CB THR A 30 5.431 -12.601 1.319 1.00 0.00 C ATOM 403 OG1 THR A 30 4.018 -12.613 1.144 1.00 0.00 O ATOM 404 CG2 THR A 30 5.796 -12.887 2.770 1.00 0.00 C ATOM 0 H THR A 30 4.987 -11.691 -0.867 1.00 0.00 H new ATOM 0 HA THR A 30 5.626 -10.484 1.600 1.00 0.00 H new ATOM 0 HB THR A 30 5.864 -13.380 0.691 1.00 0.00 H new ATOM 0 HG1 THR A 30 3.663 -13.487 1.409 1.00 0.00 H new ATOM 0 HG21 THR A 30 5.394 -13.857 3.062 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.881 -12.897 2.877 1.00 0.00 H new ATOM 0 HG23 THR A 30 5.375 -12.112 3.411 1.00 0.00 H new ATOM 412 N ALA A 31 8.246 -11.579 -0.044 1.00 0.00 N ATOM 413 CA ALA A 31 9.694 -11.474 -0.126 1.00 0.00 C ATOM 414 C ALA A 31 10.151 -10.018 -0.204 1.00 0.00 C ATOM 415 O ALA A 31 11.273 -9.706 0.192 1.00 0.00 O ATOM 416 CB ALA A 31 10.173 -12.226 -1.366 1.00 0.00 C ATOM 0 H ALA A 31 7.823 -12.005 -0.868 1.00 0.00 H new ATOM 0 HA ALA A 31 10.123 -11.909 0.777 1.00 0.00 H new ATOM 0 HB1 ALA A 31 11.258 -12.154 -1.438 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.883 -13.274 -1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 31 9.720 -11.787 -2.255 1.00 0.00 H new ATOM 422 N ASP A 32 9.302 -9.117 -0.696 1.00 0.00 N ATOM 423 CA ASP A 32 9.647 -7.717 -0.918 1.00 0.00 C ATOM 424 C ASP A 32 9.922 -7.036 0.413 1.00 0.00 C ATOM 425 O ASP A 32 10.840 -6.230 0.523 1.00 0.00 O ATOM 426 CB ASP A 32 8.542 -6.993 -1.703 1.00 0.00 C ATOM 427 CG ASP A 32 9.143 -6.035 -2.721 1.00 0.00 C ATOM 428 OD1 ASP A 32 9.844 -6.546 -3.624 1.00 0.00 O ATOM 429 OD2 ASP A 32 8.859 -4.826 -2.630 1.00 0.00 O ATOM 0 H ASP A 32 8.342 -9.344 -0.955 1.00 0.00 H new ATOM 0 HA ASP A 32 10.553 -7.670 -1.522 1.00 0.00 H new ATOM 0 HB2 ASP A 32 7.912 -7.723 -2.211 1.00 0.00 H new ATOM 0 HB3 ASP A 32 7.900 -6.444 -1.014 1.00 0.00 H new ATOM 434 N PHE A 33 9.229 -7.447 1.480 1.00 0.00 N ATOM 435 CA PHE A 33 9.510 -6.952 2.824 1.00 0.00 C ATOM 436 C PHE A 33 10.874 -7.420 3.345 1.00 0.00 C ATOM 437 O PHE A 33 11.311 -6.945 4.392 1.00 0.00 O ATOM 438 CB PHE A 33 8.389 -7.395 3.773 1.00 0.00 C ATOM 439 CG PHE A 33 7.009 -7.031 3.267 1.00 0.00 C ATOM 440 CD1 PHE A 33 6.637 -5.683 3.185 1.00 0.00 C ATOM 441 CD2 PHE A 33 6.136 -8.021 2.781 1.00 0.00 C ATOM 442 CE1 PHE A 33 5.409 -5.326 2.617 1.00 0.00 C ATOM 443 CE2 PHE A 33 4.922 -7.659 2.169 1.00 0.00 C ATOM 444 CZ PHE A 33 4.563 -6.304 2.072 1.00 0.00 C ATOM 0 H PHE A 33 8.467 -8.124 1.434 1.00 0.00 H new ATOM 0 HA PHE A 33 9.549 -5.864 2.780 1.00 0.00 H new ATOM 0 HB2 PHE A 33 8.445 -8.474 3.915 1.00 0.00 H new ATOM 0 HB3 PHE A 33 8.545 -6.937 4.750 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.300 -4.917 3.561 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.399 -9.064 2.878 1.00 0.00 H new ATOM 0 HE1 PHE A 33 5.110 -4.288 2.598 1.00 0.00 H new ATOM 0 HE2 PHE A 33 4.267 -8.422 1.774 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.644 -6.018 1.582 1.00 0.00 H new ATOM 454 N ARG A 34 11.538 -8.380 2.689 1.00 0.00 N ATOM 455 CA ARG A 34 12.859 -8.900 3.044 1.00 0.00 C ATOM 456 C ARG A 34 13.949 -8.266 2.188 1.00 0.00 C ATOM 457 O ARG A 34 15.022 -7.988 2.720 1.00 0.00 O ATOM 458 CB ARG A 34 12.909 -10.436 2.892 1.00 0.00 C ATOM 459 CG ARG A 34 11.663 -11.220 3.350 1.00 0.00 C ATOM 460 CD ARG A 34 11.431 -11.248 4.863 1.00 0.00 C ATOM 461 NE ARG A 34 11.297 -9.907 5.457 1.00 0.00 N ATOM 462 CZ ARG A 34 11.554 -9.548 6.718 1.00 0.00 C ATOM 463 NH1 ARG A 34 11.782 -10.447 7.667 1.00 0.00 N ATOM 464 NH2 ARG A 34 11.570 -8.268 7.055 1.00 0.00 N ATOM 0 H ARG A 34 11.150 -8.833 1.861 1.00 0.00 H new ATOM 0 HA ARG A 34 13.038 -8.642 4.088 1.00 0.00 H new ATOM 0 HB2 ARG A 34 13.090 -10.668 1.842 1.00 0.00 H new ATOM 0 HB3 ARG A 34 13.768 -10.805 3.452 1.00 0.00 H new ATOM 0 HG2 ARG A 34 10.785 -10.787 2.872 1.00 0.00 H new ATOM 0 HG3 ARG A 34 11.747 -12.246 2.992 1.00 0.00 H new ATOM 0 HD2 ARG A 34 10.530 -11.823 5.075 1.00 0.00 H new ATOM 0 HD3 ARG A 34 12.261 -11.768 5.341 1.00 0.00 H new ATOM 0 HE ARG A 34 10.971 -9.168 4.835 1.00 0.00 H new ATOM 0 HH11 ARG A 34 11.764 -11.442 7.442 1.00 0.00 H new ATOM 0 HH12 ARG A 34 11.976 -10.143 8.621 1.00 0.00 H new ATOM 0 HH21 ARG A 34 11.386 -7.553 6.351 1.00 0.00 H new ATOM 0 HH22 ARG A 34 11.766 -7.997 8.018 1.00 0.00 H new ATOM 478 N GLN A 35 13.720 -8.072 0.886 1.00 0.00 N ATOM 479 CA GLN A 35 14.760 -7.587 -0.023 1.00 0.00 C ATOM 480 C GLN A 35 14.689 -6.083 -0.282 1.00 0.00 C ATOM 481 O GLN A 35 15.728 -5.462 -0.510 1.00 0.00 O ATOM 482 CB GLN A 35 14.789 -8.427 -1.303 1.00 0.00 C ATOM 483 CG GLN A 35 13.539 -8.436 -2.200 1.00 0.00 C ATOM 484 CD GLN A 35 13.613 -9.582 -3.211 1.00 0.00 C ATOM 485 OE1 GLN A 35 14.690 -9.987 -3.643 1.00 0.00 O ATOM 486 NE2 GLN A 35 12.503 -10.163 -3.630 1.00 0.00 N ATOM 0 H GLN A 35 12.820 -8.244 0.438 1.00 0.00 H new ATOM 0 HA GLN A 35 15.719 -7.723 0.477 1.00 0.00 H new ATOM 0 HB2 GLN A 35 15.629 -8.083 -1.907 1.00 0.00 H new ATOM 0 HB3 GLN A 35 15.002 -9.458 -1.019 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.645 -8.542 -1.586 1.00 0.00 H new ATOM 0 HG3 GLN A 35 13.454 -7.485 -2.725 1.00 0.00 H new ATOM 0 HE21 GLN A 35 11.598 -9.843 -3.285 1.00 0.00 H new ATOM 0 HE22 GLN A 35 12.551 -10.932 -4.299 1.00 0.00 H new ATOM 495 N VAL A 36 13.494 -5.503 -0.178 1.00 0.00 N ATOM 496 CA VAL A 36 13.272 -4.064 -0.213 1.00 0.00 C ATOM 497 C VAL A 36 13.073 -3.610 1.236 1.00 0.00 C ATOM 498 O VAL A 36 14.008 -3.078 1.824 1.00 0.00 O ATOM 499 CB VAL A 36 12.113 -3.691 -1.169 1.00 0.00 C ATOM 500 CG1 VAL A 36 12.038 -2.172 -1.378 1.00 0.00 C ATOM 501 CG2 VAL A 36 12.265 -4.367 -2.538 1.00 0.00 C ATOM 0 H VAL A 36 12.633 -6.038 -0.064 1.00 0.00 H new ATOM 0 HA VAL A 36 14.128 -3.533 -0.629 1.00 0.00 H new ATOM 0 HB VAL A 36 11.196 -4.044 -0.697 1.00 0.00 H new ATOM 0 HG11 VAL A 36 11.215 -1.938 -2.054 1.00 0.00 H new ATOM 0 HG12 VAL A 36 11.871 -1.681 -0.419 1.00 0.00 H new ATOM 0 HG13 VAL A 36 12.974 -1.817 -1.810 1.00 0.00 H new ATOM 0 HG21 VAL A 36 11.432 -4.080 -3.180 1.00 0.00 H new ATOM 0 HG22 VAL A 36 13.202 -4.052 -2.997 1.00 0.00 H new ATOM 0 HG23 VAL A 36 12.269 -5.450 -2.411 1.00 0.00 H new ATOM 511 N GLY A 37 11.897 -3.823 1.839 1.00 0.00 N ATOM 512 CA GLY A 37 11.504 -3.290 3.146 1.00 0.00 C ATOM 513 C GLY A 37 10.030 -2.881 3.123 1.00 0.00 C ATOM 514 O GLY A 37 9.301 -3.336 2.241 1.00 0.00 O ATOM 0 H GLY A 37 11.167 -4.393 1.412 1.00 0.00 H new ATOM 0 HA2 GLY A 37 11.669 -4.041 3.919 1.00 0.00 H new ATOM 0 HA3 GLY A 37 12.125 -2.430 3.399 1.00 0.00 H new ATOM 518 N SER A 38 9.576 -2.053 4.074 1.00 0.00 N ATOM 519 CA SER A 38 8.174 -1.624 4.200 1.00 0.00 C ATOM 520 C SER A 38 8.062 -0.111 4.472 1.00 0.00 C ATOM 521 O SER A 38 8.976 0.430 5.088 1.00 0.00 O ATOM 522 CB SER A 38 7.481 -2.414 5.324 1.00 0.00 C ATOM 523 OG SER A 38 8.042 -3.700 5.531 1.00 0.00 O ATOM 0 H SER A 38 10.183 -1.655 4.791 1.00 0.00 H new ATOM 0 HA SER A 38 7.678 -1.828 3.251 1.00 0.00 H new ATOM 0 HB2 SER A 38 7.543 -1.844 6.251 1.00 0.00 H new ATOM 0 HB3 SER A 38 6.423 -2.520 5.085 1.00 0.00 H new ATOM 0 HG SER A 38 7.563 -4.153 6.256 1.00 0.00 H new ATOM 529 N PRO A 39 6.961 0.570 4.103 1.00 0.00 N ATOM 530 CA PRO A 39 6.757 2.011 4.300 1.00 0.00 C ATOM 531 C PRO A 39 6.455 2.381 5.757 1.00 0.00 C ATOM 532 O PRO A 39 5.705 1.683 6.443 1.00 0.00 O ATOM 533 CB PRO A 39 5.571 2.359 3.393 1.00 0.00 C ATOM 534 CG PRO A 39 4.755 1.067 3.367 1.00 0.00 C ATOM 535 CD PRO A 39 5.844 0.004 3.367 1.00 0.00 C ATOM 0 HA PRO A 39 7.661 2.569 4.056 1.00 0.00 H new ATOM 0 HB2 PRO A 39 4.992 3.192 3.791 1.00 0.00 H new ATOM 0 HB3 PRO A 39 5.900 2.647 2.394 1.00 0.00 H new ATOM 0 HG2 PRO A 39 4.101 0.980 4.234 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.122 1.002 2.482 1.00 0.00 H new ATOM 0 HD2 PRO A 39 5.492 -0.914 3.838 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.138 -0.252 2.349 1.00 0.00 H new ATOM 543 N ASN A 40 7.003 3.506 6.244 1.00 0.00 N ATOM 544 CA ASN A 40 6.773 3.959 7.621 1.00 0.00 C ATOM 545 C ASN A 40 5.708 5.045 7.635 1.00 0.00 C ATOM 546 O ASN A 40 5.997 6.241 7.686 1.00 0.00 O ATOM 547 CB ASN A 40 8.044 4.412 8.357 1.00 0.00 C ATOM 548 CG ASN A 40 7.760 4.640 9.847 1.00 0.00 C ATOM 549 OD1 ASN A 40 6.634 4.901 10.264 1.00 0.00 O ATOM 550 ND2 ASN A 40 8.754 4.485 10.694 1.00 0.00 N ATOM 0 H ASN A 40 7.610 4.119 5.700 1.00 0.00 H new ATOM 0 HA ASN A 40 6.422 3.091 8.179 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.824 3.659 8.242 1.00 0.00 H new ATOM 0 HB3 ASN A 40 8.420 5.332 7.909 1.00 0.00 H new ATOM 0 HD21 ASN A 40 8.590 4.581 11.696 1.00 0.00 H new ATOM 0 HD22 ASN A 40 9.689 4.268 10.349 1.00 0.00 H new ATOM 557 N ILE A 41 4.451 4.621 7.641 1.00 0.00 N ATOM 558 CA ILE A 41 3.323 5.521 7.861 1.00 0.00 C ATOM 559 C ILE A 41 2.985 5.683 9.351 1.00 0.00 C ATOM 560 O ILE A 41 1.978 6.303 9.682 1.00 0.00 O ATOM 561 CB ILE A 41 2.122 5.080 7.010 1.00 0.00 C ATOM 562 CG1 ILE A 41 1.596 3.669 7.346 1.00 0.00 C ATOM 563 CG2 ILE A 41 2.497 5.184 5.522 1.00 0.00 C ATOM 564 CD1 ILE A 41 0.063 3.673 7.349 1.00 0.00 C ATOM 0 H ILE A 41 4.184 3.648 7.494 1.00 0.00 H new ATOM 0 HA ILE A 41 3.609 6.519 7.529 1.00 0.00 H new ATOM 0 HB ILE A 41 1.298 5.754 7.246 1.00 0.00 H new ATOM 0 HG12 ILE A 41 1.965 2.950 6.615 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.970 3.354 8.320 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.650 4.873 4.911 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.757 6.215 5.284 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.350 4.538 5.316 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.303 2.674 7.587 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.298 4.379 8.097 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -0.302 3.968 6.365 1.00 0.00 H new ATOM 576 N LYS A 42 3.770 5.101 10.265 1.00 0.00 N ATOM 577 CA LYS A 42 3.437 5.089 11.686 1.00 0.00 C ATOM 578 C LYS A 42 3.414 6.507 12.254 1.00 0.00 C ATOM 579 O LYS A 42 2.537 6.815 13.059 1.00 0.00 O ATOM 580 CB LYS A 42 4.392 4.154 12.449 1.00 0.00 C ATOM 581 CG LYS A 42 3.694 3.274 13.498 1.00 0.00 C ATOM 582 CD LYS A 42 2.995 4.096 14.577 1.00 0.00 C ATOM 583 CE LYS A 42 2.624 3.242 15.788 1.00 0.00 C ATOM 584 NZ LYS A 42 2.090 4.086 16.868 1.00 0.00 N ATOM 0 H LYS A 42 4.646 4.630 10.039 1.00 0.00 H new ATOM 0 HA LYS A 42 2.430 4.692 11.814 1.00 0.00 H new ATOM 0 HB2 LYS A 42 4.905 3.512 11.733 1.00 0.00 H new ATOM 0 HB3 LYS A 42 5.156 4.755 12.943 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.964 2.634 13.003 1.00 0.00 H new ATOM 0 HG3 LYS A 42 4.429 2.618 13.964 1.00 0.00 H new ATOM 0 HD2 LYS A 42 3.646 4.911 14.893 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.095 4.550 14.162 1.00 0.00 H new ATOM 0 HE2 LYS A 42 1.883 2.496 15.501 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.501 2.700 16.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.843 3.490 17.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 2.809 4.782 17.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.241 4.583 16.532 1.00 0.00 H new ATOM 598 N GLY A 43 4.300 7.388 11.785 1.00 0.00 N ATOM 599 CA GLY A 43 4.282 8.798 12.158 1.00 0.00 C ATOM 600 C GLY A 43 2.945 9.475 11.838 1.00 0.00 C ATOM 601 O GLY A 43 2.544 10.388 12.559 1.00 0.00 O ATOM 0 H GLY A 43 5.048 7.141 11.137 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.486 8.890 13.225 1.00 0.00 H new ATOM 0 HA3 GLY A 43 5.083 9.319 11.634 1.00 0.00 H new ATOM 605 N LEU A 44 2.228 9.012 10.806 1.00 0.00 N ATOM 606 CA LEU A 44 0.909 9.532 10.444 1.00 0.00 C ATOM 607 C LEU A 44 -0.162 9.156 11.459 1.00 0.00 C ATOM 608 O LEU A 44 -1.191 9.829 11.515 1.00 0.00 O ATOM 609 CB LEU A 44 0.425 8.981 9.093 1.00 0.00 C ATOM 610 CG LEU A 44 1.385 9.145 7.909 1.00 0.00 C ATOM 611 CD1 LEU A 44 0.645 8.726 6.645 1.00 0.00 C ATOM 612 CD2 LEU A 44 1.867 10.587 7.779 1.00 0.00 C ATOM 0 H LEU A 44 2.552 8.261 10.196 1.00 0.00 H new ATOM 0 HA LEU A 44 1.040 10.613 10.404 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.209 7.919 9.214 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.516 9.471 8.841 1.00 0.00 H new ATOM 0 HG LEU A 44 2.266 8.522 8.067 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.305 8.833 5.784 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.331 7.686 6.735 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.232 9.359 6.510 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.546 10.669 6.930 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.011 11.244 7.624 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.389 10.880 8.690 1.00 0.00 H new ATOM 624 N GLY A 45 0.028 8.061 12.196 1.00 0.00 N ATOM 625 CA GLY A 45 -0.947 7.585 13.157 1.00 0.00 C ATOM 626 C GLY A 45 -0.866 6.089 13.430 1.00 0.00 C ATOM 627 O GLY A 45 -1.233 5.666 14.525 1.00 0.00 O ATOM 0 H GLY A 45 0.867 7.483 12.137 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -0.811 8.123 14.095 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.947 7.824 12.794 1.00 0.00 H new ATOM 631 N LYS A 46 -0.481 5.268 12.446 1.00 0.00 N ATOM 632 CA LYS A 46 -0.650 3.814 12.510 1.00 0.00 C ATOM 633 C LYS A 46 0.192 3.133 11.454 1.00 0.00 C ATOM 634 O LYS A 46 0.676 3.769 10.526 1.00 0.00 O ATOM 635 CB LYS A 46 -2.121 3.386 12.345 1.00 0.00 C ATOM 636 CG LYS A 46 -3.049 4.261 11.495 1.00 0.00 C ATOM 637 CD LYS A 46 -2.637 4.647 10.061 1.00 0.00 C ATOM 638 CE LYS A 46 -3.827 5.266 9.321 1.00 0.00 C ATOM 639 NZ LYS A 46 -4.240 6.628 9.750 1.00 0.00 N ATOM 0 H LYS A 46 -0.044 5.594 11.584 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.320 3.505 13.502 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.128 2.383 11.917 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.558 3.311 13.341 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.009 3.749 11.431 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.217 5.187 12.045 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.809 5.355 10.090 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.284 3.765 9.526 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.587 5.301 8.258 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -4.682 4.599 9.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -5.266 6.642 9.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -3.738 6.884 10.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -4.005 7.313 9.004 1.00 0.00 H new ATOM 653 N LYS A 47 0.430 1.839 11.631 1.00 0.00 N ATOM 654 CA LYS A 47 1.279 1.070 10.722 1.00 0.00 C ATOM 655 C LYS A 47 0.489 0.741 9.452 1.00 0.00 C ATOM 656 O LYS A 47 -0.742 0.707 9.482 1.00 0.00 O ATOM 657 CB LYS A 47 1.757 -0.209 11.430 1.00 0.00 C ATOM 658 CG LYS A 47 3.092 -0.732 10.873 1.00 0.00 C ATOM 659 CD LYS A 47 4.310 -0.028 11.491 1.00 0.00 C ATOM 660 CE LYS A 47 4.945 -0.814 12.645 1.00 0.00 C ATOM 661 NZ LYS A 47 4.071 -0.940 13.827 1.00 0.00 N ATOM 0 H LYS A 47 0.044 1.294 12.402 1.00 0.00 H new ATOM 0 HA LYS A 47 2.157 1.652 10.440 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.866 -0.010 12.496 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.996 -0.983 11.326 1.00 0.00 H new ATOM 0 HG2 LYS A 47 3.164 -1.804 11.060 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.108 -0.595 9.792 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.059 0.134 10.716 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.008 0.955 11.853 1.00 0.00 H new ATOM 0 HE2 LYS A 47 5.210 -1.811 12.292 1.00 0.00 H new ATOM 0 HE3 LYS A 47 5.872 -0.323 12.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 4.563 -1.481 14.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.838 0.007 14.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.196 -1.434 13.560 1.00 0.00 H new ATOM 675 N ALA A 48 1.179 0.423 8.354 1.00 0.00 N ATOM 676 CA ALA A 48 0.558 -0.177 7.179 1.00 0.00 C ATOM 677 C ALA A 48 0.089 -1.599 7.490 1.00 0.00 C ATOM 678 O ALA A 48 0.516 -2.205 8.476 1.00 0.00 O ATOM 679 CB ALA A 48 1.568 -0.201 6.026 1.00 0.00 C ATOM 0 H ALA A 48 2.183 0.576 8.258 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.309 0.418 6.893 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.106 -0.649 5.147 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.879 0.818 5.793 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.439 -0.788 6.317 1.00 0.00 H new ATOM 685 N VAL A 49 -0.765 -2.153 6.635 1.00 0.00 N ATOM 686 CA VAL A 49 -0.994 -3.588 6.535 1.00 0.00 C ATOM 687 C VAL A 49 -0.148 -4.080 5.347 1.00 0.00 C ATOM 688 O VAL A 49 0.180 -3.298 4.453 1.00 0.00 O ATOM 689 CB VAL A 49 -2.510 -3.836 6.356 1.00 0.00 C ATOM 690 CG1 VAL A 49 -2.845 -5.325 6.169 1.00 0.00 C ATOM 691 CG2 VAL A 49 -3.347 -3.317 7.541 1.00 0.00 C ATOM 0 H VAL A 49 -1.326 -1.607 5.982 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.696 -4.138 7.427 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.769 -3.280 5.455 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -3.922 -5.443 6.048 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.336 -5.704 5.283 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.515 -5.885 7.044 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.402 -3.520 7.358 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.034 -3.821 8.456 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.197 -2.243 7.649 1.00 0.00 H new ATOM 701 N SER A 50 0.178 -5.372 5.317 1.00 0.00 N ATOM 702 CA SER A 50 0.880 -6.032 4.225 1.00 0.00 C ATOM 703 C SER A 50 0.155 -7.333 3.890 1.00 0.00 C ATOM 704 O SER A 50 -0.020 -8.194 4.764 1.00 0.00 O ATOM 705 CB SER A 50 2.350 -6.262 4.609 1.00 0.00 C ATOM 706 OG SER A 50 2.485 -6.731 5.944 1.00 0.00 O ATOM 0 H SER A 50 -0.049 -6.008 6.082 1.00 0.00 H new ATOM 0 HA SER A 50 0.880 -5.405 3.333 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.795 -6.984 3.924 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.905 -5.331 4.494 1.00 0.00 H new ATOM 0 HG SER A 50 3.434 -6.866 6.149 1.00 0.00 H new ATOM 712 N THR A 51 -0.323 -7.498 2.661 1.00 0.00 N ATOM 713 CA THR A 51 -0.915 -8.735 2.161 1.00 0.00 C ATOM 714 C THR A 51 -0.719 -8.715 0.645 1.00 0.00 C ATOM 715 O THR A 51 -1.348 -7.895 -0.016 1.00 0.00 O ATOM 716 CB THR A 51 -2.407 -8.833 2.562 1.00 0.00 C ATOM 717 OG1 THR A 51 -2.560 -8.820 3.972 1.00 0.00 O ATOM 718 CG2 THR A 51 -3.071 -10.123 2.076 1.00 0.00 C ATOM 0 H THR A 51 -0.309 -6.753 1.964 1.00 0.00 H new ATOM 0 HA THR A 51 -0.440 -9.616 2.592 1.00 0.00 H new ATOM 0 HB THR A 51 -2.880 -7.969 2.094 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.679 -8.748 4.396 1.00 0.00 H new ATOM 0 HG21 THR A 51 -4.116 -10.134 2.387 1.00 0.00 H new ATOM 0 HG22 THR A 51 -3.016 -10.173 0.989 1.00 0.00 H new ATOM 0 HG23 THR A 51 -2.555 -10.982 2.505 1.00 0.00 H new ATOM 726 N VAL A 52 0.154 -9.565 0.085 1.00 0.00 N ATOM 727 CA VAL A 52 0.359 -9.604 -1.365 1.00 0.00 C ATOM 728 C VAL A 52 -0.966 -9.949 -2.053 1.00 0.00 C ATOM 729 O VAL A 52 -1.593 -10.959 -1.711 1.00 0.00 O ATOM 730 CB VAL A 52 1.548 -10.509 -1.769 1.00 0.00 C ATOM 731 CG1 VAL A 52 1.493 -11.952 -1.267 1.00 0.00 C ATOM 732 CG2 VAL A 52 1.762 -10.542 -3.290 1.00 0.00 C ATOM 0 H VAL A 52 0.723 -10.228 0.611 1.00 0.00 H new ATOM 0 HA VAL A 52 0.657 -8.617 -1.718 1.00 0.00 H new ATOM 0 HB VAL A 52 2.386 -10.029 -1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.376 -12.491 -1.611 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.466 -11.957 -0.177 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.598 -12.438 -1.655 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.607 -11.190 -3.525 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.865 -10.926 -3.775 1.00 0.00 H new ATOM 0 HG23 VAL A 52 1.967 -9.534 -3.651 1.00 0.00 H new ATOM 742 N TYR A 53 -1.403 -9.088 -2.977 1.00 0.00 N ATOM 743 CA TYR A 53 -2.576 -9.320 -3.807 1.00 0.00 C ATOM 744 C TYR A 53 -2.269 -10.393 -4.844 1.00 0.00 C ATOM 745 O TYR A 53 -1.120 -10.543 -5.269 1.00 0.00 O ATOM 746 CB TYR A 53 -3.009 -8.017 -4.498 1.00 0.00 C ATOM 747 CG TYR A 53 -4.182 -8.198 -5.442 1.00 0.00 C ATOM 748 CD1 TYR A 53 -5.410 -8.663 -4.942 1.00 0.00 C ATOM 749 CD2 TYR A 53 -4.038 -7.973 -6.824 1.00 0.00 C ATOM 750 CE1 TYR A 53 -6.470 -8.948 -5.815 1.00 0.00 C ATOM 751 CE2 TYR A 53 -5.082 -8.293 -7.710 1.00 0.00 C ATOM 752 CZ TYR A 53 -6.293 -8.812 -7.206 1.00 0.00 C ATOM 753 OH TYR A 53 -7.281 -9.226 -8.045 1.00 0.00 O ATOM 0 H TYR A 53 -0.941 -8.199 -3.168 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.395 -9.662 -3.175 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.274 -7.282 -3.738 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.164 -7.611 -5.054 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -5.538 -8.802 -3.879 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -3.120 -7.552 -7.206 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -7.422 -9.272 -5.421 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -4.957 -8.142 -8.772 1.00 0.00 H new ATOM 0 HH TYR A 53 -7.011 -9.065 -8.973 1.00 0.00 H new ATOM 763 N ASN A 54 -3.304 -11.106 -5.294 1.00 0.00 N ATOM 764 CA ASN A 54 -3.178 -12.016 -6.437 1.00 0.00 C ATOM 765 C ASN A 54 -4.480 -12.127 -7.221 1.00 0.00 C ATOM 766 O ASN A 54 -5.544 -12.256 -6.614 1.00 0.00 O ATOM 767 CB ASN A 54 -2.798 -13.415 -5.947 1.00 0.00 C ATOM 768 CG ASN A 54 -2.395 -14.329 -7.081 1.00 0.00 C ATOM 769 OD1 ASN A 54 -1.648 -13.954 -7.977 1.00 0.00 O ATOM 770 ND2 ASN A 54 -2.867 -15.550 -7.056 1.00 0.00 N ATOM 0 H ASN A 54 -4.238 -11.072 -4.886 1.00 0.00 H new ATOM 0 HA ASN A 54 -2.406 -11.607 -7.089 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -1.976 -13.338 -5.236 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -3.642 -13.852 -5.413 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -2.614 -16.210 -7.792 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -3.487 -15.842 -6.301 1.00 0.00 H new ATOM 777 N GLY A 55 -4.418 -12.168 -8.552 1.00 0.00 N ATOM 778 CA GLY A 55 -5.615 -12.268 -9.379 1.00 0.00 C ATOM 779 C GLY A 55 -6.295 -13.637 -9.325 1.00 0.00 C ATOM 780 O GLY A 55 -7.482 -13.716 -9.657 1.00 0.00 O ATOM 0 H GLY A 55 -3.546 -12.133 -9.080 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -6.328 -11.507 -9.062 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -5.350 -12.046 -10.413 1.00 0.00 H new ATOM 784 N GLU A 56 -5.603 -14.701 -8.896 1.00 0.00 N ATOM 785 CA GLU A 56 -6.188 -16.038 -8.820 1.00 0.00 C ATOM 786 C GLU A 56 -7.370 -16.033 -7.860 1.00 0.00 C ATOM 787 O GLU A 56 -8.456 -16.528 -8.174 1.00 0.00 O ATOM 788 CB GLU A 56 -5.166 -17.073 -8.321 1.00 0.00 C ATOM 789 CG GLU A 56 -5.730 -18.493 -8.468 1.00 0.00 C ATOM 790 CD GLU A 56 -4.723 -19.608 -8.182 1.00 0.00 C ATOM 791 OE1 GLU A 56 -4.260 -19.719 -7.023 1.00 0.00 O ATOM 792 OE2 GLU A 56 -4.480 -20.444 -9.077 1.00 0.00 O ATOM 0 H GLU A 56 -4.629 -14.656 -8.595 1.00 0.00 H new ATOM 0 HA GLU A 56 -6.509 -16.311 -9.825 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.240 -16.982 -8.888 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.921 -16.878 -7.277 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.578 -18.605 -7.793 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.111 -18.616 -9.482 1.00 0.00 H new ATOM 799 N ASP A 57 -7.144 -15.488 -6.670 1.00 0.00 N ATOM 800 CA ASP A 57 -7.851 -15.837 -5.456 1.00 0.00 C ATOM 801 C ASP A 57 -8.374 -14.574 -4.792 1.00 0.00 C ATOM 802 O ASP A 57 -7.897 -14.140 -3.749 1.00 0.00 O ATOM 803 CB ASP A 57 -6.964 -16.720 -4.559 1.00 0.00 C ATOM 804 CG ASP A 57 -5.652 -16.083 -4.077 1.00 0.00 C ATOM 805 OD1 ASP A 57 -4.692 -16.040 -4.883 1.00 0.00 O ATOM 806 OD2 ASP A 57 -5.492 -15.766 -2.881 1.00 0.00 O ATOM 0 H ASP A 57 -6.438 -14.766 -6.525 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.729 -16.445 -5.676 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -7.545 -17.015 -3.685 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.723 -17.632 -5.105 1.00 0.00 H new ATOM 811 N LYS A 58 -9.414 -13.989 -5.390 1.00 0.00 N ATOM 812 CA LYS A 58 -10.186 -12.885 -4.810 1.00 0.00 C ATOM 813 C LYS A 58 -10.585 -13.169 -3.346 1.00 0.00 C ATOM 814 O LYS A 58 -10.143 -12.439 -2.451 1.00 0.00 O ATOM 815 CB LYS A 58 -11.361 -12.514 -5.735 1.00 0.00 C ATOM 816 CG LYS A 58 -10.949 -12.000 -7.130 1.00 0.00 C ATOM 817 CD LYS A 58 -10.689 -10.491 -7.184 1.00 0.00 C ATOM 818 CE LYS A 58 -10.637 -10.013 -8.644 1.00 0.00 C ATOM 819 NZ LYS A 58 -11.982 -9.853 -9.242 1.00 0.00 N ATOM 0 H LYS A 58 -9.751 -14.274 -6.310 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.555 -11.998 -4.750 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.998 -13.390 -5.859 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -11.963 -11.749 -5.245 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -10.049 -12.525 -7.449 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -11.733 -12.249 -7.845 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -11.475 -9.960 -6.648 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.749 -10.258 -6.684 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -10.107 -9.062 -8.692 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -10.064 -10.727 -9.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.928 -10.017 -10.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -12.636 -10.540 -8.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -12.329 -8.889 -9.063 1.00 0.00 H new ATOM 833 N PRO A 59 -11.321 -14.255 -3.041 1.00 0.00 N ATOM 834 CA PRO A 59 -11.617 -14.632 -1.662 1.00 0.00 C ATOM 835 C PRO A 59 -10.380 -15.067 -0.866 1.00 0.00 C ATOM 836 O PRO A 59 -10.423 -15.099 0.365 1.00 0.00 O ATOM 837 CB PRO A 59 -12.624 -15.783 -1.766 1.00 0.00 C ATOM 838 CG PRO A 59 -12.297 -16.424 -3.110 1.00 0.00 C ATOM 839 CD PRO A 59 -11.925 -15.212 -3.957 1.00 0.00 C ATOM 0 HA PRO A 59 -12.007 -13.773 -1.116 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -12.510 -16.491 -0.945 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -13.652 -15.421 -1.734 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -11.475 -17.136 -3.033 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.149 -16.964 -3.523 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -11.229 -15.488 -4.749 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -12.805 -14.788 -4.440 1.00 0.00 H new ATOM 847 N GLY A 60 -9.284 -15.448 -1.525 1.00 0.00 N ATOM 848 CA GLY A 60 -8.052 -15.861 -0.866 1.00 0.00 C ATOM 849 C GLY A 60 -7.218 -14.681 -0.383 1.00 0.00 C ATOM 850 O GLY A 60 -6.211 -14.894 0.276 1.00 0.00 O ATOM 0 H GLY A 60 -9.230 -15.477 -2.543 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -8.296 -16.500 -0.017 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.459 -16.461 -1.556 1.00 0.00 H new ATOM 854 N PHE A 61 -7.677 -13.447 -0.601 1.00 0.00 N ATOM 855 CA PHE A 61 -6.989 -12.214 -0.250 1.00 0.00 C ATOM 856 C PHE A 61 -7.813 -11.418 0.762 1.00 0.00 C ATOM 857 O PHE A 61 -7.333 -11.096 1.852 1.00 0.00 O ATOM 858 CB PHE A 61 -6.775 -11.467 -1.556 1.00 0.00 C ATOM 859 CG PHE A 61 -6.330 -10.033 -1.432 1.00 0.00 C ATOM 860 CD1 PHE A 61 -4.991 -9.749 -1.123 1.00 0.00 C ATOM 861 CD2 PHE A 61 -7.232 -8.988 -1.714 1.00 0.00 C ATOM 862 CE1 PHE A 61 -4.538 -8.424 -1.171 1.00 0.00 C ATOM 863 CE2 PHE A 61 -6.775 -7.662 -1.756 1.00 0.00 C ATOM 864 CZ PHE A 61 -5.416 -7.391 -1.525 1.00 0.00 C ATOM 0 H PHE A 61 -8.579 -13.278 -1.047 1.00 0.00 H new ATOM 0 HA PHE A 61 -6.029 -12.396 0.233 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -6.032 -12.007 -2.143 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -7.707 -11.490 -2.121 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.315 -10.546 -0.850 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -8.273 -9.207 -1.898 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.509 -8.198 -0.934 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -7.463 -6.856 -1.964 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.046 -6.381 -1.621 1.00 0.00 H new ATOM 874 N LEU A 62 -9.094 -11.181 0.455 1.00 0.00 N ATOM 875 CA LEU A 62 -10.036 -10.458 1.320 1.00 0.00 C ATOM 876 C LEU A 62 -10.220 -11.133 2.693 1.00 0.00 C ATOM 877 O LEU A 62 -10.756 -10.525 3.617 1.00 0.00 O ATOM 878 CB LEU A 62 -11.393 -10.308 0.614 1.00 0.00 C ATOM 879 CG LEU A 62 -11.365 -9.399 -0.631 1.00 0.00 C ATOM 880 CD1 LEU A 62 -12.615 -9.665 -1.470 1.00 0.00 C ATOM 881 CD2 LEU A 62 -11.292 -7.899 -0.297 1.00 0.00 C ATOM 0 H LEU A 62 -9.514 -11.493 -0.420 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.609 -9.473 1.506 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.747 -11.296 0.320 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -12.117 -9.909 1.325 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.455 -9.643 -1.180 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.603 -9.026 -2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.630 -10.710 -1.779 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -13.504 -9.449 -0.877 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -11.276 -7.321 -1.221 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.163 -7.615 0.293 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.385 -7.697 0.273 1.00 0.00 H new ATOM 893 N LYS A 63 -9.725 -12.364 2.875 1.00 0.00 N ATOM 894 CA LYS A 63 -9.709 -13.085 4.144 1.00 0.00 C ATOM 895 C LYS A 63 -8.827 -12.425 5.199 1.00 0.00 C ATOM 896 O LYS A 63 -8.881 -12.822 6.363 1.00 0.00 O ATOM 897 CB LYS A 63 -9.320 -14.558 3.925 1.00 0.00 C ATOM 898 CG LYS A 63 -8.101 -14.819 3.014 1.00 0.00 C ATOM 899 CD LYS A 63 -6.810 -14.233 3.585 1.00 0.00 C ATOM 900 CE LYS A 63 -5.527 -14.975 3.203 1.00 0.00 C ATOM 901 NZ LYS A 63 -5.514 -16.403 3.571 1.00 0.00 N ATOM 0 H LYS A 63 -9.311 -12.900 2.112 1.00 0.00 H new ATOM 0 HA LYS A 63 -10.724 -13.047 4.540 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -9.121 -15.007 4.898 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.179 -15.079 3.503 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -7.979 -15.893 2.875 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -8.288 -14.389 2.030 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.723 -13.198 3.254 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.889 -14.215 4.672 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -5.379 -14.889 2.127 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -4.681 -14.482 3.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -4.539 -16.763 3.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -5.886 -16.516 4.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -6.107 -16.938 2.906 1.00 0.00 H new ATOM 915 N LYS A 64 -8.001 -11.450 4.810 1.00 0.00 N ATOM 916 CA LYS A 64 -7.177 -10.681 5.728 1.00 0.00 C ATOM 917 C LYS A 64 -7.834 -9.348 6.047 1.00 0.00 C ATOM 918 O LYS A 64 -7.726 -8.883 7.175 1.00 0.00 O ATOM 919 CB LYS A 64 -5.775 -10.481 5.134 1.00 0.00 C ATOM 920 CG LYS A 64 -4.894 -11.731 5.298 1.00 0.00 C ATOM 921 CD LYS A 64 -3.992 -11.648 6.540 1.00 0.00 C ATOM 922 CE LYS A 64 -2.954 -12.776 6.564 1.00 0.00 C ATOM 923 NZ LYS A 64 -3.479 -14.098 6.977 1.00 0.00 N ATOM 0 H LYS A 64 -7.889 -11.174 3.834 1.00 0.00 H new ATOM 0 HA LYS A 64 -7.077 -11.234 6.662 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -5.862 -10.235 4.076 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -5.294 -9.632 5.620 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -5.529 -12.614 5.371 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.275 -11.856 4.410 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -3.483 -10.684 6.556 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.606 -11.699 7.439 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -2.517 -12.869 5.570 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -2.148 -12.494 7.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -2.709 -14.797 6.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -3.870 -14.031 7.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.228 -14.395 6.319 1.00 0.00 H new ATOM 937 N LEU A 65 -8.459 -8.687 5.073 1.00 0.00 N ATOM 938 CA LEU A 65 -8.808 -7.272 5.173 1.00 0.00 C ATOM 939 C LEU A 65 -10.098 -7.015 5.962 1.00 0.00 C ATOM 940 O LEU A 65 -10.558 -5.877 5.993 1.00 0.00 O ATOM 941 CB LEU A 65 -8.897 -6.640 3.765 1.00 0.00 C ATOM 942 CG LEU A 65 -7.579 -6.422 2.992 1.00 0.00 C ATOM 943 CD1 LEU A 65 -7.075 -7.686 2.286 1.00 0.00 C ATOM 944 CD2 LEU A 65 -7.786 -5.326 1.946 1.00 0.00 C ATOM 0 H LEU A 65 -8.737 -9.119 4.192 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.007 -6.796 5.738 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -9.543 -7.271 3.155 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -9.393 -5.674 3.862 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.825 -6.138 3.726 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.146 -7.464 1.762 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.897 -8.469 3.024 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -7.823 -8.026 1.570 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -6.858 -5.167 1.397 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.571 -5.628 1.253 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.077 -4.400 2.442 1.00 0.00 H new ATOM 956 N SER A 66 -10.673 -7.988 6.663 1.00 0.00 N ATOM 957 CA SER A 66 -11.512 -7.644 7.807 1.00 0.00 C ATOM 958 C SER A 66 -10.638 -7.373 9.033 1.00 0.00 C ATOM 959 O SER A 66 -10.781 -6.344 9.685 1.00 0.00 O ATOM 960 CB SER A 66 -12.558 -8.734 8.055 1.00 0.00 C ATOM 961 OG SER A 66 -13.616 -8.262 8.863 1.00 0.00 O ATOM 0 H SER A 66 -10.580 -8.985 6.470 1.00 0.00 H new ATOM 0 HA SER A 66 -12.062 -6.728 7.593 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.955 -9.083 7.102 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.086 -9.590 8.536 1.00 0.00 H new ATOM 0 HG SER A 66 -14.268 -8.981 9.001 1.00 0.00 H new ATOM 967 N LEU A 67 -9.738 -8.298 9.378 1.00 0.00 N ATOM 968 CA LEU A 67 -9.170 -8.399 10.728 1.00 0.00 C ATOM 969 C LEU A 67 -7.970 -7.470 10.919 1.00 0.00 C ATOM 970 O LEU A 67 -7.197 -7.606 11.869 1.00 0.00 O ATOM 971 CB LEU A 67 -8.820 -9.862 11.046 1.00 0.00 C ATOM 972 CG LEU A 67 -7.803 -10.513 10.086 1.00 0.00 C ATOM 973 CD1 LEU A 67 -6.719 -11.259 10.857 1.00 0.00 C ATOM 974 CD2 LEU A 67 -8.492 -11.488 9.121 1.00 0.00 C ATOM 0 H LEU A 67 -9.381 -9.000 8.729 1.00 0.00 H new ATOM 0 HA LEU A 67 -9.926 -8.066 11.439 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.423 -9.913 12.060 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.737 -10.450 11.033 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.347 -9.706 9.512 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.016 -11.708 10.155 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -6.189 -10.562 11.506 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -7.176 -12.042 11.463 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.748 -11.930 8.458 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.985 -12.276 9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -9.233 -10.951 8.529 1.00 0.00 H new ATOM 986 N LYS A 68 -7.786 -6.566 9.962 1.00 0.00 N ATOM 987 CA LYS A 68 -6.652 -5.690 9.783 1.00 0.00 C ATOM 988 C LYS A 68 -7.072 -4.213 9.769 1.00 0.00 C ATOM 989 O LYS A 68 -6.200 -3.340 9.696 1.00 0.00 O ATOM 990 CB LYS A 68 -5.993 -6.150 8.472 1.00 0.00 C ATOM 991 CG LYS A 68 -4.639 -6.851 8.675 1.00 0.00 C ATOM 992 CD LYS A 68 -4.701 -8.103 9.560 1.00 0.00 C ATOM 993 CE LYS A 68 -3.293 -8.648 9.808 1.00 0.00 C ATOM 994 NZ LYS A 68 -3.242 -9.580 10.956 1.00 0.00 N ATOM 0 H LYS A 68 -8.489 -6.422 9.237 1.00 0.00 H new ATOM 0 HA LYS A 68 -5.945 -5.753 10.610 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.670 -6.829 7.954 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.851 -5.285 7.824 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.238 -7.129 7.700 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.939 -6.142 9.118 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.178 -7.862 10.510 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.314 -8.866 9.080 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.942 -9.160 8.912 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -2.611 -7.817 9.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -2.268 -9.921 11.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -3.551 -9.087 11.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -3.871 -10.388 10.775 1.00 0.00 H new ATOM 1008 N PHE A 69 -8.376 -3.931 9.804 1.00 0.00 N ATOM 1009 CA PHE A 69 -8.973 -2.598 9.810 1.00 0.00 C ATOM 1010 C PHE A 69 -9.970 -2.495 10.955 1.00 0.00 C ATOM 1011 O PHE A 69 -10.219 -3.485 11.644 1.00 0.00 O ATOM 1012 CB PHE A 69 -9.645 -2.312 8.459 1.00 0.00 C ATOM 1013 CG PHE A 69 -8.678 -2.413 7.310 1.00 0.00 C ATOM 1014 CD1 PHE A 69 -8.355 -3.662 6.751 1.00 0.00 C ATOM 1015 CD2 PHE A 69 -8.038 -1.250 6.865 1.00 0.00 C ATOM 1016 CE1 PHE A 69 -7.380 -3.747 5.751 1.00 0.00 C ATOM 1017 CE2 PHE A 69 -7.071 -1.335 5.858 1.00 0.00 C ATOM 1018 CZ PHE A 69 -6.747 -2.580 5.307 1.00 0.00 C ATOM 0 H PHE A 69 -9.080 -4.668 9.830 1.00 0.00 H new ATOM 0 HA PHE A 69 -8.195 -1.849 9.959 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -10.463 -3.016 8.306 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.082 -1.314 8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.859 -4.554 7.093 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.290 -0.293 7.297 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -7.118 -4.704 5.325 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -6.576 -0.442 5.507 1.00 0.00 H new ATOM 0 HZ PHE A 69 -6.000 -2.641 4.530 1.00 0.00 H new ATOM 1028 N LYS A 70 -10.543 -1.303 11.153 1.00 0.00 N ATOM 1029 CA LYS A 70 -11.537 -1.076 12.203 1.00 0.00 C ATOM 1030 C LYS A 70 -12.799 -0.349 11.761 1.00 0.00 C ATOM 1031 O LYS A 70 -13.834 -0.516 12.396 1.00 0.00 O ATOM 1032 CB LYS A 70 -10.939 -0.473 13.458 1.00 0.00 C ATOM 1033 CG LYS A 70 -10.198 0.788 13.096 1.00 0.00 C ATOM 1034 CD LYS A 70 -10.177 1.769 14.268 1.00 0.00 C ATOM 1035 CE LYS A 70 -9.351 3.033 14.001 1.00 0.00 C ATOM 1036 NZ LYS A 70 -9.544 4.006 15.093 1.00 0.00 N ATOM 0 H LYS A 70 -10.332 -0.476 10.594 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.878 -2.081 12.453 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.725 -0.253 14.180 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.262 -1.184 13.931 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.177 0.543 12.805 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -10.672 1.257 12.233 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.201 2.058 14.506 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -9.776 1.263 15.146 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.295 2.775 13.916 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -9.649 3.477 13.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.980 4.859 14.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -10.550 4.263 15.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -9.239 3.583 15.993 1.00 0.00 H new ATOM 1050 N ASP A 71 -12.733 0.443 10.696 1.00 0.00 N ATOM 1051 CA ASP A 71 -13.904 1.140 10.167 1.00 0.00 C ATOM 1052 C ASP A 71 -13.796 1.132 8.646 1.00 0.00 C ATOM 1053 O ASP A 71 -13.472 2.155 8.041 1.00 0.00 O ATOM 1054 CB ASP A 71 -13.996 2.542 10.793 1.00 0.00 C ATOM 1055 CG ASP A 71 -15.397 3.167 10.744 1.00 0.00 C ATOM 1056 OD1 ASP A 71 -16.120 3.082 9.731 1.00 0.00 O ATOM 1057 OD2 ASP A 71 -15.781 3.793 11.761 1.00 0.00 O ATOM 0 H ASP A 71 -11.873 0.620 10.177 1.00 0.00 H new ATOM 0 HA ASP A 71 -14.839 0.646 10.430 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.673 2.484 11.833 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.298 3.203 10.279 1.00 0.00 H new ATOM 1062 N PRO A 72 -13.915 -0.044 7.998 1.00 0.00 N ATOM 1063 CA PRO A 72 -13.665 -0.156 6.569 1.00 0.00 C ATOM 1064 C PRO A 72 -14.645 0.708 5.769 1.00 0.00 C ATOM 1065 O PRO A 72 -14.244 1.319 4.777 1.00 0.00 O ATOM 1066 CB PRO A 72 -13.758 -1.648 6.260 1.00 0.00 C ATOM 1067 CG PRO A 72 -14.684 -2.188 7.330 1.00 0.00 C ATOM 1068 CD PRO A 72 -14.288 -1.344 8.546 1.00 0.00 C ATOM 0 HA PRO A 72 -12.684 0.222 6.280 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.157 -1.824 5.261 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -12.779 -2.126 6.301 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.733 -2.057 7.066 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.530 -3.253 7.504 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -15.115 -1.253 9.250 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.458 -1.797 9.087 1.00 0.00 H new ATOM 1076 N GLU A 73 -15.888 0.817 6.235 1.00 0.00 N ATOM 1077 CA GLU A 73 -16.956 1.635 5.680 1.00 0.00 C ATOM 1078 C GLU A 73 -16.700 3.147 5.801 1.00 0.00 C ATOM 1079 O GLU A 73 -17.523 3.928 5.320 1.00 0.00 O ATOM 1080 CB GLU A 73 -18.307 1.226 6.299 1.00 0.00 C ATOM 1081 CG GLU A 73 -18.510 1.564 7.788 1.00 0.00 C ATOM 1082 CD GLU A 73 -17.969 0.528 8.783 1.00 0.00 C ATOM 1083 OE1 GLU A 73 -17.210 -0.383 8.377 1.00 0.00 O ATOM 1084 OE2 GLU A 73 -18.375 0.527 9.966 1.00 0.00 O ATOM 0 H GLU A 73 -16.191 0.303 7.062 1.00 0.00 H new ATOM 0 HA GLU A 73 -16.986 1.442 4.608 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -19.103 1.705 5.729 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -18.428 0.150 6.174 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -18.032 2.522 7.993 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -19.577 1.694 7.970 1.00 0.00 H new ATOM 1091 N ASN A 74 -15.569 3.580 6.371 1.00 0.00 N ATOM 1092 CA ASN A 74 -15.094 4.966 6.310 1.00 0.00 C ATOM 1093 C ASN A 74 -13.613 5.072 5.952 1.00 0.00 C ATOM 1094 O ASN A 74 -13.148 6.170 5.640 1.00 0.00 O ATOM 1095 CB ASN A 74 -15.358 5.700 7.631 1.00 0.00 C ATOM 1096 CG ASN A 74 -16.833 6.028 7.770 1.00 0.00 C ATOM 1097 OD1 ASN A 74 -17.311 6.981 7.155 1.00 0.00 O ATOM 1098 ND2 ASN A 74 -17.562 5.238 8.531 1.00 0.00 N ATOM 0 H ASN A 74 -14.948 2.965 6.897 1.00 0.00 H new ATOM 0 HA ASN A 74 -15.661 5.442 5.510 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -15.036 5.081 8.469 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -14.770 6.617 7.668 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -18.564 5.405 8.628 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -17.125 4.459 9.023 1.00 0.00 H new ATOM 1105 N THR A 75 -12.854 3.979 5.967 1.00 0.00 N ATOM 1106 CA THR A 75 -11.446 3.973 5.622 1.00 0.00 C ATOM 1107 C THR A 75 -11.256 4.325 4.140 1.00 0.00 C ATOM 1108 O THR A 75 -11.779 3.655 3.249 1.00 0.00 O ATOM 1109 CB THR A 75 -10.832 2.620 6.045 1.00 0.00 C ATOM 1110 OG1 THR A 75 -10.325 2.698 7.365 1.00 0.00 O ATOM 1111 CG2 THR A 75 -9.672 2.140 5.167 1.00 0.00 C ATOM 0 H THR A 75 -13.212 3.059 6.225 1.00 0.00 H new ATOM 0 HA THR A 75 -10.905 4.746 6.168 1.00 0.00 H new ATOM 0 HB THR A 75 -11.655 1.912 5.947 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.720 3.466 7.438 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.305 1.184 5.540 1.00 0.00 H new ATOM 0 HG22 THR A 75 -10.018 2.021 4.140 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.866 2.874 5.196 1.00 0.00 H new ATOM 1119 N THR A 76 -10.422 5.336 3.895 1.00 0.00 N ATOM 1120 CA THR A 76 -9.852 5.667 2.597 1.00 0.00 C ATOM 1121 C THR A 76 -8.572 4.822 2.441 1.00 0.00 C ATOM 1122 O THR A 76 -7.488 5.236 2.867 1.00 0.00 O ATOM 1123 CB THR A 76 -9.584 7.189 2.560 1.00 0.00 C ATOM 1124 OG1 THR A 76 -10.690 7.946 3.020 1.00 0.00 O ATOM 1125 CG2 THR A 76 -9.180 7.694 1.177 1.00 0.00 C ATOM 0 H THR A 76 -10.114 5.972 4.631 1.00 0.00 H new ATOM 0 HA THR A 76 -10.517 5.440 1.764 1.00 0.00 H new ATOM 0 HB THR A 76 -8.744 7.335 3.239 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.433 8.445 3.823 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.006 8.769 1.219 1.00 0.00 H new ATOM 0 HG22 THR A 76 -8.267 7.191 0.858 1.00 0.00 H new ATOM 0 HG23 THR A 76 -9.978 7.483 0.465 1.00 0.00 H new ATOM 1133 N LEU A 77 -8.669 3.581 1.952 1.00 0.00 N ATOM 1134 CA LEU A 77 -7.501 2.701 1.865 1.00 0.00 C ATOM 1135 C LEU A 77 -6.645 3.068 0.664 1.00 0.00 C ATOM 1136 O LEU A 77 -7.163 3.297 -0.424 1.00 0.00 O ATOM 1137 CB LEU A 77 -7.924 1.241 1.711 1.00 0.00 C ATOM 1138 CG LEU A 77 -7.240 0.265 2.674 1.00 0.00 C ATOM 1139 CD1 LEU A 77 -7.612 -1.183 2.338 1.00 0.00 C ATOM 1140 CD2 LEU A 77 -5.717 0.379 2.661 1.00 0.00 C ATOM 0 H LEU A 77 -9.537 3.167 1.613 1.00 0.00 H new ATOM 0 HA LEU A 77 -6.934 2.827 2.788 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.002 1.174 1.854 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.718 0.924 0.689 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.597 0.536 3.668 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.115 -1.858 3.035 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.692 -1.309 2.419 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.295 -1.414 1.321 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.292 -0.338 3.364 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.345 0.168 1.658 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.425 1.388 2.952 1.00 0.00 H new ATOM 1152 N TYR A 78 -5.335 3.083 0.821 1.00 0.00 N ATOM 1153 CA TYR A 78 -4.409 3.337 -0.273 1.00 0.00 C ATOM 1154 C TYR A 78 -3.641 2.043 -0.488 1.00 0.00 C ATOM 1155 O TYR A 78 -2.942 1.598 0.420 1.00 0.00 O ATOM 1156 CB TYR A 78 -3.492 4.516 0.078 1.00 0.00 C ATOM 1157 CG TYR A 78 -4.187 5.865 0.146 1.00 0.00 C ATOM 1158 CD1 TYR A 78 -4.480 6.538 -1.052 1.00 0.00 C ATOM 1159 CD2 TYR A 78 -4.542 6.455 1.375 1.00 0.00 C ATOM 1160 CE1 TYR A 78 -5.185 7.750 -1.047 1.00 0.00 C ATOM 1161 CE2 TYR A 78 -5.248 7.673 1.387 1.00 0.00 C ATOM 1162 CZ TYR A 78 -5.609 8.300 0.178 1.00 0.00 C ATOM 1163 OH TYR A 78 -6.409 9.396 0.196 1.00 0.00 O ATOM 0 H TYR A 78 -4.877 2.918 1.717 1.00 0.00 H new ATOM 0 HA TYR A 78 -4.921 3.619 -1.193 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.020 4.317 1.040 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.694 4.571 -0.663 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -4.157 6.115 -1.992 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -4.274 5.975 2.304 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -5.401 8.258 -1.975 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -5.515 8.130 2.329 1.00 0.00 H new ATOM 0 HH TYR A 78 -6.731 9.551 1.109 1.00 0.00 H new ATOM 1173 N ILE A 79 -3.782 1.405 -1.648 1.00 0.00 N ATOM 1174 CA ILE A 79 -2.917 0.287 -2.008 1.00 0.00 C ATOM 1175 C ILE A 79 -1.486 0.820 -2.151 1.00 0.00 C ATOM 1176 O ILE A 79 -1.294 2.021 -2.335 1.00 0.00 O ATOM 1177 CB ILE A 79 -3.478 -0.426 -3.266 1.00 0.00 C ATOM 1178 CG1 ILE A 79 -4.774 -1.167 -2.871 1.00 0.00 C ATOM 1179 CG2 ILE A 79 -2.517 -1.459 -3.877 1.00 0.00 C ATOM 1180 CD1 ILE A 79 -6.038 -0.316 -2.965 1.00 0.00 C ATOM 0 H ILE A 79 -4.483 1.642 -2.350 1.00 0.00 H new ATOM 0 HA ILE A 79 -2.892 -0.482 -1.236 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.643 0.348 -4.015 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.889 -2.040 -3.513 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -4.672 -1.534 -1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -2.981 -1.914 -4.752 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.591 -0.965 -4.172 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.297 -2.231 -3.140 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -6.901 -0.913 -2.670 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.948 0.544 -2.301 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -6.169 0.029 -3.991 1.00 0.00 H new ATOM 1192 N LEU A 80 -0.481 -0.051 -2.099 1.00 0.00 N ATOM 1193 CA LEU A 80 0.895 0.240 -2.472 1.00 0.00 C ATOM 1194 C LEU A 80 1.461 -1.046 -3.074 1.00 0.00 C ATOM 1195 O LEU A 80 1.554 -2.052 -2.373 1.00 0.00 O ATOM 1196 CB LEU A 80 1.683 0.709 -1.234 1.00 0.00 C ATOM 1197 CG LEU A 80 2.895 1.602 -1.557 1.00 0.00 C ATOM 1198 CD1 LEU A 80 3.674 1.886 -0.270 1.00 0.00 C ATOM 1199 CD2 LEU A 80 3.857 1.039 -2.584 1.00 0.00 C ATOM 0 H LEU A 80 -0.610 -1.013 -1.784 1.00 0.00 H new ATOM 0 HA LEU A 80 0.965 1.047 -3.201 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.009 1.255 -0.574 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.028 -0.166 -0.684 1.00 0.00 H new ATOM 0 HG LEU A 80 2.474 2.506 -1.997 1.00 0.00 H new ATOM 0 HD11 LEU A 80 4.533 2.518 -0.496 1.00 0.00 H new ATOM 0 HD12 LEU A 80 3.026 2.396 0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 80 4.019 0.946 0.161 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.675 1.743 -2.741 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.258 0.091 -2.226 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.331 0.878 -3.525 1.00 0.00 H new ATOM 1211 N ASP A 81 1.783 -1.051 -4.364 1.00 0.00 N ATOM 1212 CA ASP A 81 2.428 -2.164 -5.062 1.00 0.00 C ATOM 1213 C ASP A 81 3.903 -1.838 -5.347 1.00 0.00 C ATOM 1214 O ASP A 81 4.432 -0.834 -4.883 1.00 0.00 O ATOM 1215 CB ASP A 81 1.628 -2.552 -6.318 1.00 0.00 C ATOM 1216 CG ASP A 81 2.270 -2.032 -7.597 1.00 0.00 C ATOM 1217 OD1 ASP A 81 2.166 -0.822 -7.856 1.00 0.00 O ATOM 1218 OD2 ASP A 81 2.964 -2.854 -8.252 1.00 0.00 O ATOM 0 H ASP A 81 1.597 -0.255 -4.974 1.00 0.00 H new ATOM 0 HA ASP A 81 2.429 -3.045 -4.420 1.00 0.00 H new ATOM 0 HB2 ASP A 81 1.544 -3.637 -6.372 1.00 0.00 H new ATOM 0 HB3 ASP A 81 0.615 -2.158 -6.237 1.00 0.00 H new ATOM 1223 N LYS A 82 4.638 -2.726 -6.017 1.00 0.00 N ATOM 1224 CA LYS A 82 6.042 -2.510 -6.337 1.00 0.00 C ATOM 1225 C LYS A 82 6.210 -1.395 -7.360 1.00 0.00 C ATOM 1226 O LYS A 82 7.148 -0.616 -7.220 1.00 0.00 O ATOM 1227 CB LYS A 82 6.653 -3.811 -6.870 1.00 0.00 C ATOM 1228 CG LYS A 82 6.699 -4.909 -5.797 1.00 0.00 C ATOM 1229 CD LYS A 82 7.694 -6.042 -6.069 1.00 0.00 C ATOM 1230 CE LYS A 82 7.379 -6.946 -7.270 1.00 0.00 C ATOM 1231 NZ LYS A 82 7.614 -6.302 -8.580 1.00 0.00 N ATOM 0 H LYS A 82 4.272 -3.617 -6.352 1.00 0.00 H new ATOM 0 HA LYS A 82 6.560 -2.209 -5.427 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.071 -4.162 -7.722 1.00 0.00 H new ATOM 0 HB3 LYS A 82 7.662 -3.616 -7.232 1.00 0.00 H new ATOM 0 HG2 LYS A 82 6.947 -4.450 -4.840 1.00 0.00 H new ATOM 0 HG3 LYS A 82 5.702 -5.338 -5.695 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.680 -5.603 -6.220 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.755 -6.666 -5.177 1.00 0.00 H new ATOM 0 HE2 LYS A 82 7.989 -7.847 -7.204 1.00 0.00 H new ATOM 0 HE3 LYS A 82 6.337 -7.261 -7.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 7.914 -7.019 -9.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 6.736 -5.852 -8.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.358 -5.581 -8.484 1.00 0.00 H new ATOM 1245 N PHE A 83 5.392 -1.378 -8.413 1.00 0.00 N ATOM 1246 CA PHE A 83 5.743 -0.700 -9.654 1.00 0.00 C ATOM 1247 C PHE A 83 4.525 -0.376 -10.528 1.00 0.00 C ATOM 1248 O PHE A 83 4.573 0.594 -11.283 1.00 0.00 O ATOM 1249 CB PHE A 83 6.683 -1.632 -10.446 1.00 0.00 C ATOM 1250 CG PHE A 83 7.967 -1.005 -10.949 1.00 0.00 C ATOM 1251 CD1 PHE A 83 7.959 -0.221 -12.114 1.00 0.00 C ATOM 1252 CD2 PHE A 83 9.184 -1.246 -10.282 1.00 0.00 C ATOM 1253 CE1 PHE A 83 9.155 0.328 -12.607 1.00 0.00 C ATOM 1254 CE2 PHE A 83 10.385 -0.721 -10.791 1.00 0.00 C ATOM 1255 CZ PHE A 83 10.374 0.055 -11.965 1.00 0.00 C ATOM 0 H PHE A 83 4.478 -1.830 -8.427 1.00 0.00 H new ATOM 0 HA PHE A 83 6.214 0.249 -9.398 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.940 -2.481 -9.812 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.135 -2.027 -11.301 1.00 0.00 H new ATOM 0 HD1 PHE A 83 7.030 -0.039 -12.633 1.00 0.00 H new ATOM 0 HD2 PHE A 83 9.195 -1.836 -9.377 1.00 0.00 H new ATOM 0 HE1 PHE A 83 9.137 0.961 -13.482 1.00 0.00 H new ATOM 0 HE2 PHE A 83 11.317 -0.913 -10.280 1.00 0.00 H new ATOM 0 HZ PHE A 83 11.299 0.439 -12.370 1.00 0.00 H new ATOM 1265 N ASP A 84 3.524 -1.257 -10.554 1.00 0.00 N ATOM 1266 CA ASP A 84 2.329 -1.221 -11.397 1.00 0.00 C ATOM 1267 C ASP A 84 1.352 -2.216 -10.766 1.00 0.00 C ATOM 1268 O ASP A 84 0.306 -1.849 -10.216 1.00 0.00 O ATOM 1269 CB ASP A 84 2.635 -1.682 -12.843 1.00 0.00 C ATOM 1270 CG ASP A 84 3.216 -0.619 -13.769 1.00 0.00 C ATOM 1271 OD1 ASP A 84 2.582 0.443 -13.958 1.00 0.00 O ATOM 1272 OD2 ASP A 84 4.273 -0.878 -14.396 1.00 0.00 O ATOM 0 H ASP A 84 3.528 -2.073 -9.942 1.00 0.00 H new ATOM 0 HA ASP A 84 1.936 -0.206 -11.454 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.333 -2.518 -12.798 1.00 0.00 H new ATOM 0 HB3 ASP A 84 1.714 -2.059 -13.287 1.00 0.00 H new ATOM 1277 N GLY A 85 1.750 -3.497 -10.814 1.00 0.00 N ATOM 1278 CA GLY A 85 1.052 -4.634 -10.243 1.00 0.00 C ATOM 1279 C GLY A 85 -0.391 -4.620 -10.708 1.00 0.00 C ATOM 1280 O GLY A 85 -0.652 -4.517 -11.909 1.00 0.00 O ATOM 0 H GLY A 85 2.615 -3.770 -11.280 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.535 -5.562 -10.547 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.096 -4.593 -9.155 1.00 0.00 H new ATOM 1284 N ASN A 86 -1.316 -4.695 -9.755 1.00 0.00 N ATOM 1285 CA ASN A 86 -2.744 -4.526 -9.984 1.00 0.00 C ATOM 1286 C ASN A 86 -3.286 -3.546 -8.933 1.00 0.00 C ATOM 1287 O ASN A 86 -4.329 -3.778 -8.327 1.00 0.00 O ATOM 1288 CB ASN A 86 -3.460 -5.886 -10.015 1.00 0.00 C ATOM 1289 CG ASN A 86 -3.147 -6.657 -11.288 1.00 0.00 C ATOM 1290 OD1 ASN A 86 -2.116 -7.317 -11.379 1.00 0.00 O ATOM 1291 ND2 ASN A 86 -3.999 -6.601 -12.298 1.00 0.00 N ATOM 0 H ASN A 86 -1.085 -4.880 -8.779 1.00 0.00 H new ATOM 0 HA ASN A 86 -2.938 -4.093 -10.965 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.159 -6.476 -9.149 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.536 -5.733 -9.938 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -3.802 -7.109 -13.160 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -4.854 -6.050 -12.214 1.00 0.00 H new ATOM 1298 N SER A 87 -2.534 -2.477 -8.650 1.00 0.00 N ATOM 1299 CA SER A 87 -2.882 -1.434 -7.696 1.00 0.00 C ATOM 1300 C SER A 87 -4.264 -0.833 -7.982 1.00 0.00 C ATOM 1301 O SER A 87 -5.099 -0.803 -7.079 1.00 0.00 O ATOM 1302 CB SER A 87 -1.747 -0.397 -7.680 1.00 0.00 C ATOM 1303 OG SER A 87 -1.371 0.014 -8.988 1.00 0.00 O ATOM 0 H SER A 87 -1.633 -2.314 -9.100 1.00 0.00 H new ATOM 0 HA SER A 87 -2.974 -1.855 -6.695 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.062 0.474 -7.105 1.00 0.00 H new ATOM 0 HB3 SER A 87 -0.880 -0.819 -7.171 1.00 0.00 H new ATOM 0 HG SER A 87 -0.721 -0.620 -9.356 1.00 0.00 H new ATOM 1309 N GLU A 88 -4.524 -0.387 -9.216 1.00 0.00 N ATOM 1310 CA GLU A 88 -5.790 0.230 -9.624 1.00 0.00 C ATOM 1311 C GLU A 88 -6.952 -0.754 -9.447 1.00 0.00 C ATOM 1312 O GLU A 88 -8.066 -0.365 -9.096 1.00 0.00 O ATOM 1313 CB GLU A 88 -5.755 0.669 -11.103 1.00 0.00 C ATOM 1314 CG GLU A 88 -4.531 1.476 -11.548 1.00 0.00 C ATOM 1315 CD GLU A 88 -4.457 1.560 -13.078 1.00 0.00 C ATOM 1316 OE1 GLU A 88 -5.204 2.357 -13.690 1.00 0.00 O ATOM 1317 OE2 GLU A 88 -3.635 0.847 -13.696 1.00 0.00 O ATOM 0 H GLU A 88 -3.845 -0.446 -9.975 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.934 1.105 -8.989 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.820 -0.224 -11.725 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.647 1.263 -11.304 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.580 2.480 -11.127 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.624 1.012 -11.161 1.00 0.00 H new ATOM 1324 N LEU A 89 -6.704 -2.039 -9.706 1.00 0.00 N ATOM 1325 CA LEU A 89 -7.696 -3.096 -9.586 1.00 0.00 C ATOM 1326 C LEU A 89 -8.146 -3.207 -8.140 1.00 0.00 C ATOM 1327 O LEU A 89 -9.338 -3.126 -7.835 1.00 0.00 O ATOM 1328 CB LEU A 89 -7.078 -4.419 -10.064 1.00 0.00 C ATOM 1329 CG LEU A 89 -8.038 -5.600 -10.262 1.00 0.00 C ATOM 1330 CD1 LEU A 89 -8.521 -6.245 -8.958 1.00 0.00 C ATOM 1331 CD2 LEU A 89 -9.217 -5.174 -11.142 1.00 0.00 C ATOM 0 H LEU A 89 -5.790 -2.375 -10.010 1.00 0.00 H new ATOM 0 HA LEU A 89 -8.565 -2.867 -10.202 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.568 -4.234 -11.009 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.316 -4.718 -9.344 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.467 -6.380 -10.766 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.195 -7.070 -9.188 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.664 -6.621 -8.399 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.048 -5.503 -8.358 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.893 -6.018 -11.278 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.751 -4.354 -10.662 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -8.846 -4.846 -12.113 1.00 0.00 H new ATOM 1343 N VAL A 90 -7.187 -3.414 -7.239 1.00 0.00 N ATOM 1344 CA VAL A 90 -7.475 -3.551 -5.827 1.00 0.00 C ATOM 1345 C VAL A 90 -8.112 -2.253 -5.318 1.00 0.00 C ATOM 1346 O VAL A 90 -9.011 -2.338 -4.482 1.00 0.00 O ATOM 1347 CB VAL A 90 -6.203 -3.980 -5.074 1.00 0.00 C ATOM 1348 CG1 VAL A 90 -6.467 -4.208 -3.578 1.00 0.00 C ATOM 1349 CG2 VAL A 90 -5.659 -5.310 -5.607 1.00 0.00 C ATOM 0 H VAL A 90 -6.197 -3.490 -7.473 1.00 0.00 H new ATOM 0 HA VAL A 90 -8.202 -4.342 -5.643 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.493 -3.167 -5.225 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.542 -4.509 -3.087 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.833 -3.285 -3.128 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.214 -4.992 -3.456 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -4.761 -5.584 -5.053 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.413 -6.087 -5.483 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.416 -5.206 -6.664 1.00 0.00 H new ATOM 1359 N ALA A 91 -7.740 -1.087 -5.867 1.00 0.00 N ATOM 1360 CA ALA A 91 -8.321 0.207 -5.531 1.00 0.00 C ATOM 1361 C ALA A 91 -9.816 0.319 -5.850 1.00 0.00 C ATOM 1362 O ALA A 91 -10.433 1.245 -5.337 1.00 0.00 O ATOM 1363 CB ALA A 91 -7.558 1.338 -6.229 1.00 0.00 C ATOM 0 H ALA A 91 -7.008 -1.024 -6.574 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.226 0.300 -4.449 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -8.007 2.296 -5.966 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.516 1.325 -5.909 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.608 1.198 -7.309 1.00 0.00 H new ATOM 1369 N GLU A 92 -10.441 -0.605 -6.591 1.00 0.00 N ATOM 1370 CA GLU A 92 -11.900 -0.627 -6.771 1.00 0.00 C ATOM 1371 C GLU A 92 -12.560 -1.924 -6.320 1.00 0.00 C ATOM 1372 O GLU A 92 -13.777 -1.983 -6.155 1.00 0.00 O ATOM 1373 CB GLU A 92 -12.273 -0.205 -8.199 1.00 0.00 C ATOM 1374 CG GLU A 92 -11.965 -1.259 -9.275 1.00 0.00 C ATOM 1375 CD GLU A 92 -12.224 -0.755 -10.700 1.00 0.00 C ATOM 1376 OE1 GLU A 92 -13.200 -0.014 -10.959 1.00 0.00 O ATOM 1377 OE2 GLU A 92 -11.420 -1.095 -11.603 1.00 0.00 O ATOM 0 H GLU A 92 -9.953 -1.355 -7.081 1.00 0.00 H new ATOM 0 HA GLU A 92 -12.319 0.117 -6.093 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -13.338 0.027 -8.230 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -11.739 0.713 -8.444 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.922 -1.565 -9.188 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -12.574 -2.145 -9.093 1.00 0.00 H new ATOM 1384 N LEU A 93 -11.771 -2.954 -6.044 1.00 0.00 N ATOM 1385 CA LEU A 93 -12.273 -4.228 -5.563 1.00 0.00 C ATOM 1386 C LEU A 93 -12.816 -4.131 -4.144 1.00 0.00 C ATOM 1387 O LEU A 93 -13.798 -4.789 -3.798 1.00 0.00 O ATOM 1388 CB LEU A 93 -11.094 -5.207 -5.635 1.00 0.00 C ATOM 1389 CG LEU A 93 -11.336 -6.626 -5.085 1.00 0.00 C ATOM 1390 CD1 LEU A 93 -12.471 -7.360 -5.803 1.00 0.00 C ATOM 1391 CD2 LEU A 93 -10.045 -7.444 -5.214 1.00 0.00 C ATOM 0 H LEU A 93 -10.757 -2.925 -6.150 1.00 0.00 H new ATOM 0 HA LEU A 93 -13.110 -4.563 -6.175 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -10.788 -5.294 -6.677 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -10.256 -4.770 -5.092 1.00 0.00 H new ATOM 0 HG LEU A 93 -11.631 -6.520 -4.041 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.593 -8.353 -5.371 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -13.398 -6.798 -5.688 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -12.232 -7.452 -6.862 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.211 -8.449 -4.826 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.755 -7.503 -6.263 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.250 -6.962 -4.645 1.00 0.00 H new ATOM 1403 N VAL A 94 -12.141 -3.362 -3.302 1.00 0.00 N ATOM 1404 CA VAL A 94 -12.382 -3.335 -1.870 1.00 0.00 C ATOM 1405 C VAL A 94 -13.613 -2.520 -1.491 1.00 0.00 C ATOM 1406 O VAL A 94 -14.366 -2.968 -0.623 1.00 0.00 O ATOM 1407 CB VAL A 94 -11.134 -2.821 -1.156 1.00 0.00 C ATOM 1408 CG1 VAL A 94 -10.049 -3.907 -1.214 1.00 0.00 C ATOM 1409 CG2 VAL A 94 -10.597 -1.501 -1.713 1.00 0.00 C ATOM 0 H VAL A 94 -11.399 -2.730 -3.601 1.00 0.00 H new ATOM 0 HA VAL A 94 -12.592 -4.355 -1.547 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.418 -2.607 -0.126 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.152 -3.552 -0.707 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -10.411 -4.810 -0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.814 -4.131 -2.254 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -9.711 -1.203 -1.153 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -10.336 -1.629 -2.764 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -11.361 -0.729 -1.620 1.00 0.00 H new ATOM 1419 N ALA A 95 -13.867 -1.384 -2.150 1.00 0.00 N ATOM 1420 CA ALA A 95 -15.080 -0.612 -1.916 1.00 0.00 C ATOM 1421 C ALA A 95 -16.296 -1.506 -2.201 1.00 0.00 C ATOM 1422 O ALA A 95 -17.192 -1.689 -1.374 1.00 0.00 O ATOM 1423 CB ALA A 95 -15.097 0.663 -2.763 1.00 0.00 C ATOM 0 H ALA A 95 -13.243 -0.983 -2.850 1.00 0.00 H new ATOM 0 HA ALA A 95 -15.115 -0.289 -0.875 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -16.014 1.218 -2.567 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -14.237 1.281 -2.507 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -15.052 0.399 -3.819 1.00 0.00 H new ATOM 1429 N LEU A 96 -16.241 -2.185 -3.350 1.00 0.00 N ATOM 1430 CA LEU A 96 -17.179 -3.203 -3.822 1.00 0.00 C ATOM 1431 C LEU A 96 -17.279 -4.426 -2.891 1.00 0.00 C ATOM 1432 O LEU A 96 -18.075 -5.324 -3.164 1.00 0.00 O ATOM 1433 CB LEU A 96 -16.755 -3.620 -5.248 1.00 0.00 C ATOM 1434 CG LEU A 96 -17.383 -2.764 -6.363 1.00 0.00 C ATOM 1435 CD1 LEU A 96 -17.161 -1.258 -6.212 1.00 0.00 C ATOM 1436 CD2 LEU A 96 -16.867 -3.193 -7.737 1.00 0.00 C ATOM 0 H LEU A 96 -15.488 -2.026 -4.019 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.179 -2.770 -3.827 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -15.669 -3.560 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.029 -4.663 -5.407 1.00 0.00 H new ATOM 0 HG LEU A 96 -18.455 -2.942 -6.272 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -17.638 -0.735 -7.041 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -17.595 -0.919 -5.271 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -16.092 -1.046 -6.216 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -17.326 -2.573 -8.508 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -15.784 -3.074 -7.772 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -17.123 -4.238 -7.912 1.00 0.00 H new ATOM 1448 N ASN A 97 -16.499 -4.496 -1.810 1.00 0.00 N ATOM 1449 CA ASN A 97 -16.498 -5.587 -0.840 1.00 0.00 C ATOM 1450 C ASN A 97 -16.719 -5.103 0.599 1.00 0.00 C ATOM 1451 O ASN A 97 -16.636 -5.898 1.538 1.00 0.00 O ATOM 1452 CB ASN A 97 -15.215 -6.421 -1.001 1.00 0.00 C ATOM 1453 CG ASN A 97 -15.427 -7.513 -2.036 1.00 0.00 C ATOM 1454 OD1 ASN A 97 -15.919 -8.593 -1.721 1.00 0.00 O ATOM 1455 ND2 ASN A 97 -15.077 -7.270 -3.286 1.00 0.00 N ATOM 0 H ASN A 97 -15.826 -3.765 -1.580 1.00 0.00 H new ATOM 0 HA ASN A 97 -17.351 -6.232 -1.049 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -14.389 -5.777 -1.304 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -14.938 -6.865 -0.045 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.214 -7.983 -4.002 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -14.669 -6.369 -3.535 1.00 0.00 H new ATOM 1462 N GLY A 98 -17.006 -3.817 0.814 1.00 0.00 N ATOM 1463 CA GLY A 98 -17.467 -3.303 2.100 1.00 0.00 C ATOM 1464 C GLY A 98 -16.749 -2.039 2.542 1.00 0.00 C ATOM 1465 O GLY A 98 -17.123 -1.474 3.568 1.00 0.00 O ATOM 0 H GLY A 98 -16.923 -3.100 0.093 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -18.536 -3.101 2.039 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -17.331 -4.073 2.860 1.00 0.00 H new ATOM 1469 N PHE A 99 -15.696 -1.621 1.838 1.00 0.00 N ATOM 1470 CA PHE A 99 -15.011 -0.384 2.175 1.00 0.00 C ATOM 1471 C PHE A 99 -15.710 0.802 1.504 1.00 0.00 C ATOM 1472 O PHE A 99 -16.574 0.635 0.640 1.00 0.00 O ATOM 1473 CB PHE A 99 -13.519 -0.481 1.824 1.00 0.00 C ATOM 1474 CG PHE A 99 -12.714 -1.356 2.774 1.00 0.00 C ATOM 1475 CD1 PHE A 99 -12.867 -2.758 2.782 1.00 0.00 C ATOM 1476 CD2 PHE A 99 -11.774 -0.758 3.640 1.00 0.00 C ATOM 1477 CE1 PHE A 99 -12.128 -3.546 3.687 1.00 0.00 C ATOM 1478 CE2 PHE A 99 -10.989 -1.553 4.491 1.00 0.00 C ATOM 1479 CZ PHE A 99 -11.179 -2.943 4.529 1.00 0.00 C ATOM 0 H PHE A 99 -15.306 -2.120 1.038 1.00 0.00 H new ATOM 0 HA PHE A 99 -15.063 -0.217 3.251 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -13.419 -0.874 0.812 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -13.092 0.522 1.820 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.552 -3.229 2.093 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.658 0.316 3.648 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -12.291 -4.613 3.733 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.238 -1.094 5.117 1.00 0.00 H new ATOM 0 HZ PHE A 99 -10.595 -3.549 5.206 1.00 0.00 H new ATOM 1489 N LYS A 100 -15.320 2.013 1.896 1.00 0.00 N ATOM 1490 CA LYS A 100 -15.916 3.225 1.340 1.00 0.00 C ATOM 1491 C LYS A 100 -15.304 3.551 -0.012 1.00 0.00 C ATOM 1492 O LYS A 100 -16.013 3.613 -1.015 1.00 0.00 O ATOM 1493 CB LYS A 100 -15.774 4.401 2.316 1.00 0.00 C ATOM 1494 CG LYS A 100 -16.528 5.664 1.858 1.00 0.00 C ATOM 1495 CD LYS A 100 -18.013 5.457 1.492 1.00 0.00 C ATOM 1496 CE LYS A 100 -18.772 4.613 2.526 1.00 0.00 C ATOM 1497 NZ LYS A 100 -20.189 4.398 2.166 1.00 0.00 N ATOM 0 H LYS A 100 -14.596 2.181 2.595 1.00 0.00 H new ATOM 0 HA LYS A 100 -16.981 3.047 1.191 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -16.145 4.099 3.295 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -14.717 4.640 2.436 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -16.468 6.409 2.651 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -16.013 6.079 0.992 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -18.497 6.429 1.398 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -18.078 4.973 0.518 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -18.279 3.647 2.631 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -18.720 5.105 3.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -20.650 3.823 2.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -20.672 5.316 2.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -20.244 3.903 1.253 1.00 0.00 H new ATOM 1511 N SER A 101 -13.999 3.789 -0.026 1.00 0.00 N ATOM 1512 CA SER A 101 -13.245 4.120 -1.215 1.00 0.00 C ATOM 1513 C SER A 101 -11.845 3.571 -1.037 1.00 0.00 C ATOM 1514 O SER A 101 -11.362 3.455 0.095 1.00 0.00 O ATOM 1515 CB SER A 101 -13.146 5.638 -1.370 1.00 0.00 C ATOM 1516 OG SER A 101 -14.409 6.247 -1.523 1.00 0.00 O ATOM 0 H SER A 101 -13.425 3.755 0.816 1.00 0.00 H new ATOM 0 HA SER A 101 -13.735 3.700 -2.093 1.00 0.00 H new ATOM 0 HB2 SER A 101 -12.647 6.058 -0.497 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.526 5.872 -2.235 1.00 0.00 H new ATOM 0 HG SER A 101 -14.296 7.216 -1.617 1.00 0.00 H new ATOM 1522 N ALA A 102 -11.155 3.323 -2.145 1.00 0.00 N ATOM 1523 CA ALA A 102 -9.733 3.077 -2.101 1.00 0.00 C ATOM 1524 C ALA A 102 -9.052 3.686 -3.325 1.00 0.00 C ATOM 1525 O ALA A 102 -9.700 4.003 -4.325 1.00 0.00 O ATOM 1526 CB ALA A 102 -9.492 1.574 -1.952 1.00 0.00 C ATOM 0 H ALA A 102 -11.564 3.289 -3.079 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.284 3.564 -1.236 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.420 1.379 -1.918 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.955 1.221 -1.030 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -9.929 1.049 -2.801 1.00 0.00 H new ATOM 1532 N TYR A 103 -7.737 3.852 -3.229 1.00 0.00 N ATOM 1533 CA TYR A 103 -6.884 4.484 -4.232 1.00 0.00 C ATOM 1534 C TYR A 103 -5.663 3.630 -4.527 1.00 0.00 C ATOM 1535 O TYR A 103 -5.255 2.810 -3.701 1.00 0.00 O ATOM 1536 CB TYR A 103 -6.399 5.826 -3.684 1.00 0.00 C ATOM 1537 CG TYR A 103 -7.301 6.998 -3.972 1.00 0.00 C ATOM 1538 CD1 TYR A 103 -8.559 7.087 -3.354 1.00 0.00 C ATOM 1539 CD2 TYR A 103 -6.888 7.999 -4.864 1.00 0.00 C ATOM 1540 CE1 TYR A 103 -9.434 8.127 -3.672 1.00 0.00 C ATOM 1541 CE2 TYR A 103 -7.753 9.055 -5.184 1.00 0.00 C ATOM 1542 CZ TYR A 103 -9.058 9.089 -4.636 1.00 0.00 C ATOM 1543 OH TYR A 103 -9.943 10.054 -4.995 1.00 0.00 O ATOM 0 H TYR A 103 -7.212 3.536 -2.414 1.00 0.00 H new ATOM 0 HA TYR A 103 -7.462 4.610 -5.148 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -6.278 5.737 -2.604 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -5.413 6.035 -4.099 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -8.852 6.344 -2.627 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -5.903 7.956 -5.305 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.395 8.196 -3.183 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -7.424 9.841 -5.847 1.00 0.00 H new ATOM 0 HH TYR A 103 -9.534 10.639 -5.666 1.00 0.00 H new ATOM 1553 N ALA A 104 -5.031 3.906 -5.668 1.00 0.00 N ATOM 1554 CA ALA A 104 -3.717 3.406 -6.022 1.00 0.00 C ATOM 1555 C ALA A 104 -2.716 4.567 -6.001 1.00 0.00 C ATOM 1556 O ALA A 104 -3.059 5.726 -6.265 1.00 0.00 O ATOM 1557 CB ALA A 104 -3.796 2.741 -7.400 1.00 0.00 C ATOM 0 H ALA A 104 -5.438 4.502 -6.388 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.376 2.659 -5.305 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -2.813 2.361 -7.677 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -4.508 1.916 -7.366 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.124 3.472 -8.139 1.00 0.00 H new ATOM 1563 N ILE A 105 -1.460 4.241 -5.716 1.00 0.00 N ATOM 1564 CA ILE A 105 -0.294 5.079 -5.974 1.00 0.00 C ATOM 1565 C ILE A 105 0.285 4.543 -7.274 1.00 0.00 C ATOM 1566 O ILE A 105 0.539 3.341 -7.410 1.00 0.00 O ATOM 1567 CB ILE A 105 0.723 5.091 -4.799 1.00 0.00 C ATOM 1568 CG1 ILE A 105 2.170 5.353 -5.260 1.00 0.00 C ATOM 1569 CG2 ILE A 105 0.685 3.811 -3.972 1.00 0.00 C ATOM 1570 CD1 ILE A 105 3.168 5.588 -4.123 1.00 0.00 C ATOM 0 H ILE A 105 -1.216 3.351 -5.282 1.00 0.00 H new ATOM 0 HA ILE A 105 -0.564 6.131 -6.063 1.00 0.00 H new ATOM 0 HB ILE A 105 0.404 5.922 -4.170 1.00 0.00 H new ATOM 0 HG12 ILE A 105 2.508 4.503 -5.853 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.176 6.223 -5.917 1.00 0.00 H new ATOM 0 HG21 ILE A 105 1.416 3.877 -3.166 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -0.311 3.681 -3.549 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.923 2.959 -4.609 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.160 5.764 -4.540 1.00 0.00 H new ATOM 0 HD12 ILE A 105 2.859 6.457 -3.542 1.00 0.00 H new ATOM 0 HD13 ILE A 105 3.196 4.711 -3.477 1.00 0.00 H new ATOM 1582 N LYS A 106 0.436 5.438 -8.240 1.00 0.00 N ATOM 1583 CA LYS A 106 1.120 5.140 -9.478 1.00 0.00 C ATOM 1584 C LYS A 106 2.586 4.873 -9.170 1.00 0.00 C ATOM 1585 O LYS A 106 3.115 5.396 -8.193 1.00 0.00 O ATOM 1586 CB LYS A 106 0.992 6.346 -10.412 1.00 0.00 C ATOM 1587 CG LYS A 106 0.947 5.849 -11.857 1.00 0.00 C ATOM 1588 CD LYS A 106 0.705 6.958 -12.881 1.00 0.00 C ATOM 1589 CE LYS A 106 1.943 7.840 -13.051 1.00 0.00 C ATOM 1590 NZ LYS A 106 1.833 8.623 -14.294 1.00 0.00 N ATOM 0 H LYS A 106 0.084 6.394 -8.181 1.00 0.00 H new ATOM 0 HA LYS A 106 0.685 4.264 -9.958 1.00 0.00 H new ATOM 0 HB2 LYS A 106 0.089 6.910 -10.179 1.00 0.00 H new ATOM 0 HB3 LYS A 106 1.835 7.023 -10.272 1.00 0.00 H new ATOM 0 HG2 LYS A 106 1.888 5.351 -12.090 1.00 0.00 H new ATOM 0 HG3 LYS A 106 0.159 5.102 -11.951 1.00 0.00 H new ATOM 0 HD2 LYS A 106 0.436 6.517 -13.841 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -0.139 7.570 -12.564 1.00 0.00 H new ATOM 0 HE2 LYS A 106 2.044 8.509 -12.197 1.00 0.00 H new ATOM 0 HE3 LYS A 106 2.840 7.221 -13.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 2.677 9.220 -14.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 1.758 7.977 -15.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 0.986 9.225 -14.251 1.00 0.00 H new ATOM 1604 N ASP A 107 3.248 4.094 -10.020 1.00 0.00 N ATOM 1605 CA ASP A 107 4.679 3.807 -9.948 1.00 0.00 C ATOM 1606 C ASP A 107 5.067 2.963 -8.715 1.00 0.00 C ATOM 1607 O ASP A 107 6.247 2.622 -8.568 1.00 0.00 O ATOM 1608 CB ASP A 107 5.541 5.084 -10.073 1.00 0.00 C ATOM 1609 CG ASP A 107 5.232 5.954 -11.299 1.00 0.00 C ATOM 1610 OD1 ASP A 107 4.398 6.889 -11.191 1.00 0.00 O ATOM 1611 OD2 ASP A 107 5.933 5.824 -12.329 1.00 0.00 O ATOM 0 H ASP A 107 2.789 3.629 -10.804 1.00 0.00 H new ATOM 0 HA ASP A 107 4.900 3.188 -10.818 1.00 0.00 H new ATOM 0 HB2 ASP A 107 5.405 5.686 -9.175 1.00 0.00 H new ATOM 0 HB3 ASP A 107 6.591 4.794 -10.107 1.00 0.00 H new ATOM 1616 N GLY A 108 4.094 2.576 -7.875 1.00 0.00 N ATOM 1617 CA GLY A 108 4.236 1.776 -6.661 1.00 0.00 C ATOM 1618 C GLY A 108 5.323 2.305 -5.739 1.00 0.00 C ATOM 1619 O GLY A 108 5.442 3.513 -5.565 1.00 0.00 O ATOM 0 H GLY A 108 3.122 2.835 -8.043 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.286 1.761 -6.126 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.465 0.746 -6.933 1.00 0.00 H new ATOM 1623 N ALA A 109 6.076 1.427 -5.079 1.00 0.00 N ATOM 1624 CA ALA A 109 7.153 1.798 -4.180 1.00 0.00 C ATOM 1625 C ALA A 109 8.415 2.110 -4.963 1.00 0.00 C ATOM 1626 O ALA A 109 9.017 3.157 -4.743 1.00 0.00 O ATOM 1627 CB ALA A 109 7.445 0.676 -3.170 1.00 0.00 C ATOM 0 H ALA A 109 5.947 0.418 -5.160 1.00 0.00 H new ATOM 0 HA ALA A 109 6.835 2.686 -3.635 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.256 0.983 -2.510 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.551 0.477 -2.578 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.735 -0.229 -3.705 1.00 0.00 H new ATOM 1633 N GLU A 110 8.860 1.157 -5.778 1.00 0.00 N ATOM 1634 CA GLU A 110 10.223 1.073 -6.281 1.00 0.00 C ATOM 1635 C GLU A 110 10.460 2.016 -7.463 1.00 0.00 C ATOM 1636 O GLU A 110 11.588 2.123 -7.955 1.00 0.00 O ATOM 1637 CB GLU A 110 10.525 -0.367 -6.722 1.00 0.00 C ATOM 1638 CG GLU A 110 10.366 -1.411 -5.605 1.00 0.00 C ATOM 1639 CD GLU A 110 10.693 -2.808 -6.131 1.00 0.00 C ATOM 1640 OE1 GLU A 110 10.005 -3.269 -7.062 1.00 0.00 O ATOM 1641 OE2 GLU A 110 11.659 -3.434 -5.645 1.00 0.00 O ATOM 0 H GLU A 110 8.263 0.402 -6.115 1.00 0.00 H new ATOM 0 HA GLU A 110 10.887 1.372 -5.470 1.00 0.00 H new ATOM 0 HB2 GLU A 110 9.863 -0.629 -7.547 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.545 -0.412 -7.105 1.00 0.00 H new ATOM 0 HG2 GLU A 110 11.025 -1.165 -4.772 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.346 -1.390 -5.221 1.00 0.00 H new ATOM 1648 N GLY A 111 9.411 2.664 -7.971 1.00 0.00 N ATOM 1649 CA GLY A 111 9.480 3.471 -9.172 1.00 0.00 C ATOM 1650 C GLY A 111 10.456 4.642 -9.070 1.00 0.00 C ATOM 1651 O GLY A 111 10.798 5.070 -7.969 1.00 0.00 O ATOM 0 H GLY A 111 8.483 2.638 -7.549 1.00 0.00 H new ATOM 0 HA2 GLY A 111 9.773 2.837 -10.009 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.486 3.857 -9.397 1.00 0.00 H new ATOM 1655 N PRO A 112 10.810 5.265 -10.206 1.00 0.00 N ATOM 1656 CA PRO A 112 11.500 6.559 -10.230 1.00 0.00 C ATOM 1657 C PRO A 112 10.607 7.679 -9.676 1.00 0.00 C ATOM 1658 O PRO A 112 11.067 8.798 -9.439 1.00 0.00 O ATOM 1659 CB PRO A 112 11.803 6.800 -11.713 1.00 0.00 C ATOM 1660 CG PRO A 112 10.697 6.038 -12.450 1.00 0.00 C ATOM 1661 CD PRO A 112 10.444 4.835 -11.551 1.00 0.00 C ATOM 0 HA PRO A 112 12.397 6.555 -9.610 1.00 0.00 H new ATOM 0 HB2 PRO A 112 11.785 7.862 -11.956 1.00 0.00 H new ATOM 0 HB3 PRO A 112 12.791 6.428 -11.983 1.00 0.00 H new ATOM 0 HG2 PRO A 112 9.801 6.646 -12.570 1.00 0.00 H new ATOM 0 HG3 PRO A 112 11.013 5.735 -13.448 1.00 0.00 H new ATOM 0 HD2 PRO A 112 9.399 4.527 -11.593 1.00 0.00 H new ATOM 0 HD3 PRO A 112 11.041 3.979 -11.865 1.00 0.00 H new ATOM 1669 N ARG A 113 9.314 7.400 -9.523 1.00 0.00 N ATOM 1670 CA ARG A 113 8.239 8.339 -9.243 1.00 0.00 C ATOM 1671 C ARG A 113 7.271 7.766 -8.193 1.00 0.00 C ATOM 1672 O ARG A 113 6.135 8.237 -8.095 1.00 0.00 O ATOM 1673 CB ARG A 113 7.517 8.611 -10.573 1.00 0.00 C ATOM 1674 CG ARG A 113 8.375 9.248 -11.673 1.00 0.00 C ATOM 1675 CD ARG A 113 8.517 10.740 -11.440 1.00 0.00 C ATOM 1676 NE ARG A 113 7.303 11.469 -11.840 1.00 0.00 N ATOM 1677 CZ ARG A 113 7.203 12.800 -11.812 1.00 0.00 C ATOM 1678 NH1 ARG A 113 8.190 13.530 -11.307 1.00 0.00 N ATOM 1679 NH2 ARG A 113 6.113 13.409 -12.273 1.00 0.00 N ATOM 0 H ARG A 113 8.970 6.443 -9.597 1.00 0.00 H new ATOM 0 HA ARG A 113 8.635 9.266 -8.829 1.00 0.00 H new ATOM 0 HB2 ARG A 113 7.117 7.669 -10.948 1.00 0.00 H new ATOM 0 HB3 ARG A 113 6.666 9.263 -10.377 1.00 0.00 H new ATOM 0 HG2 ARG A 113 9.360 8.781 -11.690 1.00 0.00 H new ATOM 0 HG3 ARG A 113 7.920 9.068 -12.647 1.00 0.00 H new ATOM 0 HD2 ARG A 113 8.723 10.926 -10.386 1.00 0.00 H new ATOM 0 HD3 ARG A 113 9.371 11.117 -12.003 1.00 0.00 H new ATOM 0 HE ARG A 113 6.496 10.930 -12.155 1.00 0.00 H new ATOM 0 HH11 ARG A 113 9.025 13.074 -10.940 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.113 14.547 -11.286 1.00 0.00 H new ATOM 0 HH21 ARG A 113 5.343 12.858 -12.653 1.00 0.00 H new ATOM 0 HH22 ARG A 113 6.048 14.427 -12.247 1.00 0.00 H new ATOM 1693 N GLY A 114 7.665 6.672 -7.534 1.00 0.00 N ATOM 1694 CA GLY A 114 6.825 5.893 -6.639 1.00 0.00 C ATOM 1695 C GLY A 114 6.953 6.410 -5.213 1.00 0.00 C ATOM 1696 O GLY A 114 7.255 7.576 -4.992 1.00 0.00 O ATOM 0 H GLY A 114 8.610 6.298 -7.616 1.00 0.00 H new ATOM 0 HA2 GLY A 114 5.786 5.951 -6.962 1.00 0.00 H new ATOM 0 HA3 GLY A 114 7.114 4.843 -6.680 1.00 0.00 H new ATOM 1700 N TRP A 115 6.690 5.567 -4.219 1.00 0.00 N ATOM 1701 CA TRP A 115 6.801 5.935 -2.814 1.00 0.00 C ATOM 1702 C TRP A 115 8.239 6.357 -2.516 1.00 0.00 C ATOM 1703 O TRP A 115 8.471 7.395 -1.891 1.00 0.00 O ATOM 1704 CB TRP A 115 6.414 4.739 -1.925 1.00 0.00 C ATOM 1705 CG TRP A 115 6.170 5.039 -0.477 1.00 0.00 C ATOM 1706 CD1 TRP A 115 7.116 5.204 0.474 1.00 0.00 C ATOM 1707 CD2 TRP A 115 4.898 5.249 0.195 1.00 0.00 C ATOM 1708 NE1 TRP A 115 6.516 5.477 1.692 1.00 0.00 N ATOM 1709 CE2 TRP A 115 5.139 5.550 1.569 1.00 0.00 C ATOM 1710 CE3 TRP A 115 3.561 5.245 -0.246 1.00 0.00 C ATOM 1711 CZ2 TRP A 115 4.084 5.843 2.456 1.00 0.00 C ATOM 1712 CZ3 TRP A 115 2.505 5.485 0.643 1.00 0.00 C ATOM 1713 CH2 TRP A 115 2.759 5.766 1.992 1.00 0.00 C ATOM 0 H TRP A 115 6.392 4.603 -4.368 1.00 0.00 H new ATOM 0 HA TRP A 115 6.126 6.764 -2.603 1.00 0.00 H new ATOM 0 HB2 TRP A 115 5.513 4.284 -2.337 1.00 0.00 H new ATOM 0 HB3 TRP A 115 7.206 3.993 -1.991 1.00 0.00 H new ATOM 0 HD1 TRP A 115 8.181 5.133 0.309 1.00 0.00 H new ATOM 0 HE1 TRP A 115 7.023 5.608 2.567 1.00 0.00 H new ATOM 0 HE3 TRP A 115 3.346 5.054 -1.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 4.290 6.123 3.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 1.486 5.453 0.285 1.00 0.00 H new ATOM 0 HH2 TRP A 115 1.937 5.923 2.675 1.00 0.00 H new ATOM 1724 N LEU A 116 9.203 5.514 -2.892 1.00 0.00 N ATOM 1725 CA LEU A 116 10.600 5.777 -2.801 1.00 0.00 C ATOM 1726 C LEU A 116 10.894 6.784 -3.914 1.00 0.00 C ATOM 1727 O LEU A 116 10.048 7.207 -4.706 1.00 0.00 O ATOM 1728 CB LEU A 116 11.394 4.469 -2.994 1.00 0.00 C ATOM 1729 CG LEU A 116 11.051 3.374 -1.965 1.00 0.00 C ATOM 1730 CD1 LEU A 116 11.752 2.063 -2.334 1.00 0.00 C ATOM 1731 CD2 LEU A 116 11.445 3.797 -0.547 1.00 0.00 C ATOM 0 H LEU A 116 8.999 4.594 -3.283 1.00 0.00 H new ATOM 0 HA LEU A 116 10.890 6.174 -1.828 1.00 0.00 H new ATOM 0 HB2 LEU A 116 11.204 4.085 -3.996 1.00 0.00 H new ATOM 0 HB3 LEU A 116 12.460 4.690 -2.934 1.00 0.00 H new ATOM 0 HG LEU A 116 9.972 3.223 -1.985 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.502 1.297 -1.600 1.00 0.00 H new ATOM 0 HD12 LEU A 116 11.423 1.740 -3.322 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.831 2.218 -2.344 1.00 0.00 H new ATOM 0 HD21 LEU A 116 11.189 3.002 0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.518 3.984 -0.508 1.00 0.00 H new ATOM 0 HD23 LEU A 116 10.908 4.706 -0.276 1.00 0.00 H new ATOM 1743 N ASN A 117 12.135 7.207 -3.911 1.00 0.00 N ATOM 1744 CA ASN A 117 12.713 8.301 -4.711 1.00 0.00 C ATOM 1745 C ASN A 117 11.884 9.613 -4.674 1.00 0.00 C ATOM 1746 O ASN A 117 12.009 10.473 -5.548 1.00 0.00 O ATOM 1747 CB ASN A 117 12.954 7.796 -6.146 1.00 0.00 C ATOM 1748 CG ASN A 117 13.908 8.698 -6.918 1.00 0.00 C ATOM 1749 OD1 ASN A 117 15.063 8.858 -6.533 1.00 0.00 O ATOM 1750 ND2 ASN A 117 13.491 9.240 -8.047 1.00 0.00 N ATOM 0 H ASN A 117 12.834 6.773 -3.309 1.00 0.00 H new ATOM 0 HA ASN A 117 13.665 8.580 -4.260 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.360 6.785 -6.111 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.002 7.739 -6.674 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.131 9.799 -8.611 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.529 9.099 -8.355 1.00 0.00 H new ATOM 1757 N SER A 118 10.989 9.757 -3.692 1.00 0.00 N ATOM 1758 CA SER A 118 9.930 10.763 -3.593 1.00 0.00 C ATOM 1759 C SER A 118 9.741 11.216 -2.144 1.00 0.00 C ATOM 1760 O SER A 118 8.639 11.601 -1.748 1.00 0.00 O ATOM 1761 CB SER A 118 8.656 10.214 -4.232 1.00 0.00 C ATOM 1762 OG SER A 118 8.918 9.647 -5.503 1.00 0.00 O ATOM 0 H SER A 118 10.986 9.128 -2.889 1.00 0.00 H new ATOM 0 HA SER A 118 10.210 11.660 -4.144 1.00 0.00 H new ATOM 0 HB2 SER A 118 8.216 9.460 -3.579 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.924 11.015 -4.333 1.00 0.00 H new ATOM 0 HG SER A 118 8.408 8.816 -5.602 1.00 0.00 H new ATOM 1768 N SER A 119 10.825 11.187 -1.360 1.00 0.00 N ATOM 1769 CA SER A 119 10.976 11.763 -0.026 1.00 0.00 C ATOM 1770 C SER A 119 10.248 10.986 1.071 1.00 0.00 C ATOM 1771 O SER A 119 10.315 11.377 2.235 1.00 0.00 O ATOM 1772 CB SER A 119 10.548 13.245 -0.060 1.00 0.00 C ATOM 1773 OG SER A 119 11.007 13.986 1.056 1.00 0.00 O ATOM 0 H SER A 119 11.681 10.725 -1.668 1.00 0.00 H new ATOM 0 HA SER A 119 12.030 11.692 0.242 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.927 13.704 -0.973 1.00 0.00 H new ATOM 0 HB3 SER A 119 9.460 13.301 -0.102 1.00 0.00 H new ATOM 0 HG SER A 119 10.898 13.452 1.870 1.00 0.00 H new ATOM 1779 N LEU A 120 9.498 9.938 0.743 1.00 0.00 N ATOM 1780 CA LEU A 120 8.545 9.374 1.693 1.00 0.00 C ATOM 1781 C LEU A 120 9.240 8.528 2.758 1.00 0.00 C ATOM 1782 O LEU A 120 10.317 7.979 2.507 1.00 0.00 O ATOM 1783 CB LEU A 120 7.465 8.565 0.971 1.00 0.00 C ATOM 1784 CG LEU A 120 6.624 9.395 -0.003 1.00 0.00 C ATOM 1785 CD1 LEU A 120 5.429 8.602 -0.517 1.00 0.00 C ATOM 1786 CD2 LEU A 120 6.096 10.676 0.639 1.00 0.00 C ATOM 0 H LEU A 120 9.530 9.467 -0.161 1.00 0.00 H new ATOM 0 HA LEU A 120 8.063 10.208 2.203 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.939 7.749 0.425 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.806 8.112 1.712 1.00 0.00 H new ATOM 0 HG LEU A 120 7.290 9.651 -0.827 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.852 9.219 -1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.780 7.710 -1.036 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.798 8.309 0.322 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.506 11.232 -0.090 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.471 10.423 1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.934 11.289 0.970 1.00 0.00 H new ATOM 1798 N PRO A 121 8.636 8.405 3.951 1.00 0.00 N ATOM 1799 CA PRO A 121 9.243 7.673 5.047 1.00 0.00 C ATOM 1800 C PRO A 121 9.165 6.169 4.806 1.00 0.00 C ATOM 1801 O PRO A 121 8.251 5.662 4.138 1.00 0.00 O ATOM 1802 CB PRO A 121 8.442 8.067 6.281 1.00 0.00 C ATOM 1803 CG PRO A 121 7.060 8.315 5.702 1.00 0.00 C ATOM 1804 CD PRO A 121 7.369 8.990 4.375 1.00 0.00 C ATOM 0 HA PRO A 121 10.301 7.910 5.157 1.00 0.00 H new ATOM 0 HB2 PRO A 121 8.433 7.275 7.030 1.00 0.00 H new ATOM 0 HB3 PRO A 121 8.847 8.957 6.762 1.00 0.00 H new ATOM 0 HG2 PRO A 121 6.506 7.386 5.564 1.00 0.00 H new ATOM 0 HG3 PRO A 121 6.458 8.952 6.350 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.582 8.805 3.643 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.450 10.071 4.489 1.00 0.00 H new ATOM 1812 N TRP A 122 10.109 5.442 5.397 1.00 0.00 N ATOM 1813 CA TRP A 122 10.277 4.025 5.161 1.00 0.00 C ATOM 1814 C TRP A 122 10.809 3.358 6.433 1.00 0.00 C ATOM 1815 O TRP A 122 11.440 4.017 7.261 1.00 0.00 O ATOM 1816 CB TRP A 122 11.187 3.853 3.942 1.00 0.00 C ATOM 1817 CG TRP A 122 11.081 2.494 3.356 1.00 0.00 C ATOM 1818 CD1 TRP A 122 11.903 1.459 3.613 1.00 0.00 C ATOM 1819 CD2 TRP A 122 10.083 2.014 2.413 1.00 0.00 C ATOM 1820 NE1 TRP A 122 11.508 0.386 2.841 1.00 0.00 N ATOM 1821 CE2 TRP A 122 10.387 0.665 2.083 1.00 0.00 C ATOM 1822 CE3 TRP A 122 8.969 2.600 1.780 1.00 0.00 C ATOM 1823 CZ2 TRP A 122 9.623 -0.061 1.157 1.00 0.00 C ATOM 1824 CZ3 TRP A 122 8.187 1.878 0.859 1.00 0.00 C ATOM 1825 CH2 TRP A 122 8.514 0.549 0.547 1.00 0.00 C ATOM 0 H TRP A 122 10.781 5.831 6.058 1.00 0.00 H new ATOM 0 HA TRP A 122 9.332 3.531 4.935 1.00 0.00 H new ATOM 0 HB2 TRP A 122 10.926 4.595 3.187 1.00 0.00 H new ATOM 0 HB3 TRP A 122 12.220 4.043 4.231 1.00 0.00 H new ATOM 0 HD1 TRP A 122 12.731 1.467 4.306 1.00 0.00 H new ATOM 0 HE1 TRP A 122 11.990 -0.513 2.831 1.00 0.00 H new ATOM 0 HE3 TRP A 122 8.710 3.624 2.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 9.885 -1.080 0.915 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 7.334 2.347 0.392 1.00 0.00 H new ATOM 0 HH2 TRP A 122 7.914 -0.004 -0.161 1.00 0.00 H new ATOM 1836 N ILE A 123 10.512 2.073 6.638 1.00 0.00 N ATOM 1837 CA ILE A 123 10.890 1.301 7.821 1.00 0.00 C ATOM 1838 C ILE A 123 12.185 0.570 7.570 1.00 0.00 C ATOM 1839 O ILE A 123 13.035 0.608 8.457 1.00 0.00 O ATOM 1840 CB ILE A 123 9.790 0.303 8.283 1.00 0.00 C ATOM 1841 CG1 ILE A 123 8.470 1.016 8.617 1.00 0.00 C ATOM 1842 CG2 ILE A 123 10.271 -0.496 9.507 1.00 0.00 C ATOM 1843 CD1 ILE A 123 7.282 0.091 8.900 1.00 0.00 C ATOM 0 H ILE A 123 9.983 1.523 5.961 1.00 0.00 H new ATOM 0 HA ILE A 123 11.018 2.017 8.633 1.00 0.00 H new ATOM 0 HB ILE A 123 9.603 -0.377 7.452 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.630 1.652 9.487 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.209 1.672 7.786 1.00 0.00 H new ATOM 0 HG21 ILE A 123 9.490 -1.190 9.818 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.170 -1.054 9.247 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.494 0.190 10.324 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.400 0.690 9.125 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.087 -0.528 8.025 1.00 0.00 H new ATOM 0 HD13 ILE A 123 7.513 -0.548 9.752 1.00 0.00 H new ATOM 1855 N GLU A 124 12.317 -0.048 6.395 1.00 0.00 N ATOM 1856 CA GLU A 124 13.467 -0.833 5.945 1.00 0.00 C ATOM 1857 C GLU A 124 13.669 -2.122 6.767 1.00 0.00 C ATOM 1858 O GLU A 124 13.102 -2.256 7.858 1.00 0.00 O ATOM 1859 CB GLU A 124 14.673 0.107 5.738 1.00 0.00 C ATOM 1860 CG GLU A 124 15.456 0.555 6.949 1.00 0.00 C ATOM 1861 CD GLU A 124 16.933 0.906 6.743 1.00 0.00 C ATOM 1862 OE1 GLU A 124 17.461 0.874 5.612 1.00 0.00 O ATOM 1863 OE2 GLU A 124 17.598 1.195 7.769 1.00 0.00 O ATOM 0 H GLU A 124 11.580 -0.011 5.691 1.00 0.00 H new ATOM 0 HA GLU A 124 13.290 -1.265 4.960 1.00 0.00 H new ATOM 0 HB2 GLU A 124 15.367 -0.389 5.060 1.00 0.00 H new ATOM 0 HB3 GLU A 124 14.313 1.000 5.228 1.00 0.00 H new ATOM 0 HG2 GLU A 124 14.957 1.429 7.368 1.00 0.00 H new ATOM 0 HG3 GLU A 124 15.399 -0.235 7.698 1.00 0.00 H new ATOM 1870 N PRO A 125 14.410 -3.121 6.258 1.00 0.00 N ATOM 1871 CA PRO A 125 14.770 -4.312 7.013 1.00 0.00 C ATOM 1872 C PRO A 125 15.844 -3.973 8.058 1.00 0.00 C ATOM 1873 O PRO A 125 16.260 -2.823 8.229 1.00 0.00 O ATOM 1874 CB PRO A 125 15.287 -5.290 5.952 1.00 0.00 C ATOM 1875 CG PRO A 125 16.024 -4.356 5.002 1.00 0.00 C ATOM 1876 CD PRO A 125 15.108 -3.131 4.984 1.00 0.00 C ATOM 0 HA PRO A 125 13.937 -4.735 7.574 1.00 0.00 H new ATOM 0 HB2 PRO A 125 15.948 -6.044 6.379 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.475 -5.821 5.455 1.00 0.00 H new ATOM 0 HG2 PRO A 125 17.023 -4.113 5.363 1.00 0.00 H new ATOM 0 HG3 PRO A 125 16.141 -4.792 4.010 1.00 0.00 H new ATOM 0 HD2 PRO A 125 15.686 -2.216 4.851 1.00 0.00 H new ATOM 0 HD3 PRO A 125 14.402 -3.186 4.155 1.00 0.00 H new ATOM 1884 N LYS A 126 16.307 -4.995 8.777 1.00 0.00 N ATOM 1885 CA LYS A 126 17.484 -4.903 9.637 1.00 0.00 C ATOM 1886 C LYS A 126 18.729 -4.708 8.764 1.00 0.00 C ATOM 1887 O LYS A 126 18.679 -4.904 7.546 1.00 0.00 O ATOM 1888 CB LYS A 126 17.616 -6.181 10.478 1.00 0.00 C ATOM 1889 CG LYS A 126 16.411 -6.448 11.397 1.00 0.00 C ATOM 1890 CD LYS A 126 16.392 -7.894 11.895 1.00 0.00 C ATOM 1891 CE LYS A 126 17.549 -8.171 12.863 1.00 0.00 C ATOM 1892 NZ LYS A 126 18.065 -9.543 12.708 1.00 0.00 N ATOM 0 H LYS A 126 15.871 -5.917 8.778 1.00 0.00 H new ATOM 0 HA LYS A 126 17.382 -4.054 10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 126 17.747 -7.032 9.810 1.00 0.00 H new ATOM 0 HB3 LYS A 126 18.517 -6.112 11.087 1.00 0.00 H new ATOM 0 HG2 LYS A 126 16.445 -5.769 12.249 1.00 0.00 H new ATOM 0 HG3 LYS A 126 15.488 -6.236 10.858 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.444 -8.096 12.393 1.00 0.00 H new ATOM 0 HD3 LYS A 126 16.457 -8.573 11.045 1.00 0.00 H new ATOM 0 HE2 LYS A 126 18.353 -7.456 12.685 1.00 0.00 H new ATOM 0 HE3 LYS A 126 17.211 -8.022 13.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.846 -9.698 13.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.303 -10.224 12.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 18.410 -9.676 11.736 1.00 0.00 H new ATOM 1906 N LYS A 127 19.870 -4.425 9.399 1.00 0.00 N ATOM 1907 CA LYS A 127 21.179 -4.367 8.752 1.00 0.00 C ATOM 1908 C LYS A 127 21.393 -5.585 7.849 1.00 0.00 C ATOM 1909 O LYS A 127 21.289 -6.734 8.290 1.00 0.00 O ATOM 1910 CB LYS A 127 22.297 -4.175 9.792 1.00 0.00 C ATOM 1911 CG LYS A 127 22.345 -5.252 10.888 1.00 0.00 C ATOM 1912 CD LYS A 127 23.397 -4.908 11.947 1.00 0.00 C ATOM 1913 CE LYS A 127 23.290 -5.837 13.160 1.00 0.00 C ATOM 1914 NZ LYS A 127 23.647 -7.230 12.831 1.00 0.00 N ATOM 0 H LYS A 127 19.908 -4.226 10.399 1.00 0.00 H new ATOM 0 HA LYS A 127 21.215 -3.493 8.101 1.00 0.00 H new ATOM 0 HB2 LYS A 127 23.257 -4.158 9.275 1.00 0.00 H new ATOM 0 HB3 LYS A 127 22.172 -3.200 10.264 1.00 0.00 H new ATOM 0 HG2 LYS A 127 21.366 -5.342 11.358 1.00 0.00 H new ATOM 0 HG3 LYS A 127 22.575 -6.220 10.442 1.00 0.00 H new ATOM 0 HD2 LYS A 127 24.393 -4.987 11.512 1.00 0.00 H new ATOM 0 HD3 LYS A 127 23.270 -3.874 12.266 1.00 0.00 H new ATOM 0 HE2 LYS A 127 23.945 -5.474 13.952 1.00 0.00 H new ATOM 0 HE3 LYS A 127 22.272 -5.807 13.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 23.560 -7.821 13.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 23.006 -7.588 12.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 24.627 -7.265 12.484 1.00 0.00 H new ATOM 1928 N THR A 128 21.631 -5.318 6.572 1.00 0.00 N ATOM 1929 CA THR A 128 21.792 -6.290 5.504 1.00 0.00 C ATOM 1930 C THR A 128 22.825 -5.718 4.512 1.00 0.00 C ATOM 1931 O THR A 128 23.124 -4.519 4.531 1.00 0.00 O ATOM 1932 CB THR A 128 20.400 -6.523 4.869 1.00 0.00 C ATOM 1933 OG1 THR A 128 19.408 -6.802 5.847 1.00 0.00 O ATOM 1934 CG2 THR A 128 20.347 -7.720 3.923 1.00 0.00 C ATOM 0 H THR A 128 21.722 -4.359 6.236 1.00 0.00 H new ATOM 0 HA THR A 128 22.162 -7.255 5.850 1.00 0.00 H new ATOM 0 HB THR A 128 20.213 -5.593 4.332 1.00 0.00 H new ATOM 0 HG1 THR A 128 19.059 -5.961 6.208 1.00 0.00 H new ATOM 0 HG21 THR A 128 19.340 -7.819 3.518 1.00 0.00 H new ATOM 0 HG22 THR A 128 21.054 -7.570 3.107 1.00 0.00 H new ATOM 0 HG23 THR A 128 20.609 -8.627 4.468 1.00 0.00 H new ATOM 1942 N SER A 129 23.373 -6.548 3.630 1.00 0.00 N ATOM 1943 CA SER A 129 23.990 -6.135 2.381 1.00 0.00 C ATOM 1944 C SER A 129 23.094 -6.655 1.260 1.00 0.00 C ATOM 1945 O SER A 129 22.786 -7.852 1.256 1.00 0.00 O ATOM 1946 CB SER A 129 25.371 -6.773 2.230 1.00 0.00 C ATOM 1947 OG SER A 129 26.240 -6.539 3.320 1.00 0.00 O ATOM 0 H SER A 129 23.399 -7.558 3.772 1.00 0.00 H new ATOM 0 HA SER A 129 24.103 -5.051 2.354 1.00 0.00 H new ATOM 0 HB2 SER A 129 25.250 -7.849 2.101 1.00 0.00 H new ATOM 0 HB3 SER A 129 25.837 -6.393 1.321 1.00 0.00 H new ATOM 0 HG SER A 129 27.100 -6.978 3.153 1.00 0.00 H new ATOM 1953 N GLY A 130 22.712 -5.797 0.314 1.00 0.00 N ATOM 1954 CA GLY A 130 21.844 -6.148 -0.797 1.00 0.00 C ATOM 1955 C GLY A 130 22.568 -6.021 -2.136 1.00 0.00 C ATOM 1956 O GLY A 130 22.247 -5.098 -2.890 1.00 0.00 O ATOM 0 H GLY A 130 23.006 -4.820 0.303 1.00 0.00 H new ATOM 0 HA2 GLY A 130 21.486 -7.170 -0.671 1.00 0.00 H new ATOM 0 HA3 GLY A 130 20.967 -5.500 -0.794 1.00 0.00 H new ATOM 1960 N PRO A 131 23.512 -6.922 -2.475 1.00 0.00 N ATOM 1961 CA PRO A 131 24.230 -6.909 -3.754 1.00 0.00 C ATOM 1962 C PRO A 131 23.345 -7.299 -4.947 1.00 0.00 C ATOM 1963 O PRO A 131 23.839 -7.362 -6.076 1.00 0.00 O ATOM 1964 CB PRO A 131 25.381 -7.906 -3.576 1.00 0.00 C ATOM 1965 CG PRO A 131 24.800 -8.923 -2.600 1.00 0.00 C ATOM 1966 CD PRO A 131 23.962 -8.049 -1.671 1.00 0.00 C ATOM 0 HA PRO A 131 24.577 -5.902 -3.987 1.00 0.00 H new ATOM 0 HB2 PRO A 131 25.665 -8.369 -4.521 1.00 0.00 H new ATOM 0 HB3 PRO A 131 26.274 -7.426 -3.176 1.00 0.00 H new ATOM 0 HG2 PRO A 131 24.193 -9.673 -3.108 1.00 0.00 H new ATOM 0 HG3 PRO A 131 25.581 -9.458 -2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 131 23.114 -8.606 -1.271 1.00 0.00 H new ATOM 0 HD3 PRO A 131 24.551 -7.710 -0.819 1.00 0.00 H new ATOM 1974 N SER A 132 22.060 -7.577 -4.714 1.00 0.00 N ATOM 1975 CA SER A 132 21.096 -7.953 -5.732 1.00 0.00 C ATOM 1976 C SER A 132 19.890 -7.003 -5.760 1.00 0.00 C ATOM 1977 O SER A 132 18.942 -7.278 -6.494 1.00 0.00 O ATOM 1978 CB SER A 132 20.651 -9.406 -5.513 1.00 0.00 C ATOM 1979 OG SER A 132 21.673 -10.226 -4.949 1.00 0.00 O ATOM 0 H SER A 132 21.656 -7.543 -3.778 1.00 0.00 H new ATOM 0 HA SER A 132 21.580 -7.872 -6.705 1.00 0.00 H new ATOM 0 HB2 SER A 132 19.781 -9.418 -4.857 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.337 -9.831 -6.466 1.00 0.00 H new ATOM 0 HG SER A 132 21.333 -11.137 -4.831 1.00 0.00 H new ATOM 1985 N SER A 133 19.892 -5.925 -4.964 1.00 0.00 N ATOM 1986 CA SER A 133 18.758 -5.015 -4.869 1.00 0.00 C ATOM 1987 C SER A 133 18.461 -4.396 -6.234 1.00 0.00 C ATOM 1988 O SER A 133 19.374 -4.193 -7.043 1.00 0.00 O ATOM 1989 CB SER A 133 19.069 -3.933 -3.835 1.00 0.00 C ATOM 1990 OG SER A 133 17.898 -3.236 -3.462 1.00 0.00 O ATOM 0 H SER A 133 20.681 -5.666 -4.372 1.00 0.00 H new ATOM 0 HA SER A 133 17.872 -5.565 -4.551 1.00 0.00 H new ATOM 0 HB2 SER A 133 19.522 -4.387 -2.954 1.00 0.00 H new ATOM 0 HB3 SER A 133 19.798 -3.233 -4.244 1.00 0.00 H new ATOM 0 HG SER A 133 18.123 -2.551 -2.799 1.00 0.00 H new ATOM 1996 N GLY A 134 17.201 -4.041 -6.467 1.00 0.00 N ATOM 1997 CA GLY A 134 16.704 -3.567 -7.743 1.00 0.00 C ATOM 1998 C GLY A 134 15.288 -4.067 -7.897 1.00 0.00 C ATOM 1999 O GLY A 134 14.387 -3.232 -8.120 1.00 0.00 O ATOM 0 H GLY A 134 16.480 -4.079 -5.747 1.00 0.00 H new ATOM 0 HA2 GLY A 134 16.732 -2.478 -7.784 1.00 0.00 H new ATOM 0 HA3 GLY A 134 17.330 -3.933 -8.557 1.00 0.00 H new TER 2003 GLY A 134