USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 684 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 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 77 THR OG1 : rot 98:sc= 1.1 USER MOD Single : A 1 MET CE :methyl 147:sc= -1.72! (180deg=-3!) USER MOD Single : A 1 MET N :NH3+ -126:sc= -0.066 (180deg=-0.483) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -67:sc= 0.874 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 99:sc= 1.28 USER MOD Single : A 16 CYS SG : rot -35:sc= -2.07 USER MOD Single : A 22 SER OG : rot 180:sc= -1.22 USER MOD Single : A 39 TYR OH : rot 180:sc= -1 USER MOD Single : A 41 SER OG : rot 180:sc= -0.621 USER MOD Single : A 46 ASN :FLIP amide:sc= -0.478 F(o=-2,f=-0.48) USER MOD Single : A 47 THR OG1 : rot 69:sc= -0.696 USER MOD Single : A 55 TYR OH : rot 15:sc= -0.872 USER MOD Single : A 58 GLN :FLIP amide:sc= 0.414 F(o=-0.26,f=0.41) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.00381 USER MOD Single : A 78 ASN : amide:sc= -7.31! C(o=-7.3!,f=-8!) USER MOD Single : A 80 SER OG : rot -55:sc= -1.06 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ -121:sc= 0.449 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 60.985 12.572 5.262 1.00 0.00 N ATOM 2 CA MET A 1 62.444 12.271 5.219 1.00 0.00 C ATOM 3 C MET A 1 62.929 12.305 3.775 1.00 0.00 C ATOM 4 O MET A 1 62.237 11.852 2.862 1.00 0.00 O ATOM 5 CB MET A 1 62.695 10.880 5.805 1.00 0.00 C ATOM 6 CG MET A 1 62.402 10.897 7.306 1.00 0.00 C ATOM 7 SD MET A 1 63.644 11.906 8.154 1.00 0.00 S ATOM 8 CE MET A 1 65.036 10.764 7.967 1.00 0.00 C ATOM 0 H1 MET A 1 60.812 13.360 5.918 1.00 0.00 H new ATOM 0 H2 MET A 1 60.657 12.835 4.311 1.00 0.00 H new ATOM 0 H3 MET A 1 60.467 11.731 5.587 1.00 0.00 H new ATOM 0 HA MET A 1 62.985 13.016 5.802 1.00 0.00 H new ATOM 0 HB2 MET A 1 62.061 10.145 5.309 1.00 0.00 H new ATOM 0 HB3 MET A 1 63.728 10.581 5.629 1.00 0.00 H new ATOM 0 HG2 MET A 1 61.405 11.299 7.488 1.00 0.00 H new ATOM 0 HG3 MET A 1 62.413 9.881 7.701 1.00 0.00 H new ATOM 0 HE1 MET A 1 65.961 11.332 7.862 1.00 0.00 H new ATOM 0 HE2 MET A 1 65.102 10.123 8.846 1.00 0.00 H new ATOM 0 HE3 MET A 1 64.885 10.149 7.080 1.00 0.00 H new ATOM 20 N THR A 2 64.130 12.843 3.577 1.00 0.00 N ATOM 21 CA THR A 2 64.703 12.927 2.237 1.00 0.00 C ATOM 22 C THR A 2 64.918 11.530 1.671 1.00 0.00 C ATOM 23 O THR A 2 65.130 10.572 2.412 1.00 0.00 O ATOM 24 CB THR A 2 66.046 13.655 2.270 1.00 0.00 C ATOM 25 OG1 THR A 2 66.912 13.007 3.193 1.00 0.00 O ATOM 26 CG2 THR A 2 65.830 15.106 2.698 1.00 0.00 C ATOM 0 H THR A 2 64.719 13.223 4.318 1.00 0.00 H new ATOM 0 HA THR A 2 64.007 13.480 1.607 1.00 0.00 H new ATOM 0 HB THR A 2 66.496 13.636 1.277 1.00 0.00 H new ATOM 0 HG1 THR A 2 67.775 13.472 3.214 1.00 0.00 H new ATOM 0 HG21 THR A 2 66.788 15.625 2.721 1.00 0.00 H new ATOM 0 HG22 THR A 2 65.167 15.600 1.988 1.00 0.00 H new ATOM 0 HG23 THR A 2 65.380 15.129 3.691 1.00 0.00 H new ATOM 34 N LEU A 3 64.865 11.425 0.348 1.00 0.00 N ATOM 35 CA LEU A 3 65.059 10.137 -0.306 1.00 0.00 C ATOM 36 C LEU A 3 66.510 9.685 -0.135 1.00 0.00 C ATOM 37 O LEU A 3 67.273 10.309 0.603 1.00 0.00 O ATOM 38 CB LEU A 3 64.690 10.238 -1.792 1.00 0.00 C ATOM 39 CG LEU A 3 65.739 10.879 -2.705 1.00 0.00 C ATOM 40 CD1 LEU A 3 65.358 10.641 -4.167 1.00 0.00 C ATOM 41 CD2 LEU A 3 65.799 12.384 -2.434 1.00 0.00 C ATOM 0 H LEU A 3 64.692 12.205 -0.286 1.00 0.00 H new ATOM 0 HA LEU A 3 64.407 9.396 0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 3 64.480 9.235 -2.162 1.00 0.00 H new ATOM 0 HB3 LEU A 3 63.766 10.809 -1.878 1.00 0.00 H new ATOM 0 HG LEU A 3 66.714 10.433 -2.506 1.00 0.00 H new ATOM 0 HD11 LEU A 3 66.105 11.097 -4.817 1.00 0.00 H new ATOM 0 HD12 LEU A 3 65.314 9.569 -4.362 1.00 0.00 H new ATOM 0 HD13 LEU A 3 64.383 11.086 -4.366 1.00 0.00 H new ATOM 0 HD21 LEU A 3 66.546 12.841 -3.083 1.00 0.00 H new ATOM 0 HD22 LEU A 3 64.824 12.829 -2.633 1.00 0.00 H new ATOM 0 HD23 LEU A 3 66.070 12.556 -1.392 1.00 0.00 H new ATOM 53 N LEU A 4 66.896 8.604 -0.817 1.00 0.00 N ATOM 54 CA LEU A 4 68.276 8.121 -0.699 1.00 0.00 C ATOM 55 C LEU A 4 68.887 7.883 -2.078 1.00 0.00 C ATOM 56 O LEU A 4 68.376 8.364 -3.089 1.00 0.00 O ATOM 57 CB LEU A 4 68.349 6.852 0.182 1.00 0.00 C ATOM 58 CG LEU A 4 68.197 5.481 -0.520 1.00 0.00 C ATOM 59 CD1 LEU A 4 69.300 4.525 -0.048 1.00 0.00 C ATOM 60 CD2 LEU A 4 66.836 4.878 -0.174 1.00 0.00 C ATOM 0 H LEU A 4 66.296 8.061 -1.438 1.00 0.00 H new ATOM 0 HA LEU A 4 68.865 8.894 -0.205 1.00 0.00 H new ATOM 0 HB2 LEU A 4 69.307 6.859 0.702 1.00 0.00 H new ATOM 0 HB3 LEU A 4 67.573 6.927 0.944 1.00 0.00 H new ATOM 0 HG LEU A 4 68.277 5.625 -1.597 1.00 0.00 H new ATOM 0 HD11 LEU A 4 69.185 3.563 -0.547 1.00 0.00 H new ATOM 0 HD12 LEU A 4 70.275 4.946 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 4 69.224 4.386 1.030 1.00 0.00 H new ATOM 0 HD21 LEU A 4 66.729 3.913 -0.669 1.00 0.00 H new ATOM 0 HD22 LEU A 4 66.762 4.743 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 4 66.045 5.548 -0.511 1.00 0.00 H new ATOM 72 N THR A 5 69.997 7.149 -2.107 1.00 0.00 N ATOM 73 CA THR A 5 70.673 6.876 -3.370 1.00 0.00 C ATOM 74 C THR A 5 71.486 5.590 -3.299 1.00 0.00 C ATOM 75 O THR A 5 71.512 4.902 -2.278 1.00 0.00 O ATOM 76 CB THR A 5 71.609 8.033 -3.717 1.00 0.00 C ATOM 77 OG1 THR A 5 72.401 8.355 -2.581 1.00 0.00 O ATOM 78 CG2 THR A 5 70.777 9.247 -4.120 1.00 0.00 C ATOM 0 H THR A 5 70.440 6.739 -1.285 1.00 0.00 H new ATOM 0 HA THR A 5 69.908 6.764 -4.138 1.00 0.00 H new ATOM 0 HB THR A 5 72.260 7.746 -4.543 1.00 0.00 H new ATOM 0 HG1 THR A 5 71.827 8.719 -1.875 1.00 0.00 H new ATOM 0 HG21 THR A 5 71.440 10.076 -4.369 1.00 0.00 H new ATOM 0 HG22 THR A 5 70.166 8.998 -4.988 1.00 0.00 H new ATOM 0 HG23 THR A 5 70.130 9.536 -3.292 1.00 0.00 H new ATOM 86 N LEU A 6 72.152 5.280 -4.407 1.00 0.00 N ATOM 87 CA LEU A 6 72.977 4.076 -4.487 1.00 0.00 C ATOM 88 C LEU A 6 74.166 4.185 -3.545 1.00 0.00 C ATOM 89 O LEU A 6 74.419 3.297 -2.732 1.00 0.00 O ATOM 90 CB LEU A 6 73.487 3.868 -5.914 1.00 0.00 C ATOM 91 CG LEU A 6 74.391 2.650 -6.110 1.00 0.00 C ATOM 92 CD1 LEU A 6 73.572 1.371 -5.925 1.00 0.00 C ATOM 93 CD2 LEU A 6 74.981 2.677 -7.522 1.00 0.00 C ATOM 0 H LEU A 6 72.138 5.841 -5.258 1.00 0.00 H new ATOM 0 HA LEU A 6 72.360 3.225 -4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 6 72.629 3.775 -6.580 1.00 0.00 H new ATOM 0 HB3 LEU A 6 74.034 4.760 -6.221 1.00 0.00 H new ATOM 0 HG LEU A 6 75.197 2.674 -5.377 1.00 0.00 H new ATOM 0 HD11 LEU A 6 74.216 0.503 -6.065 1.00 0.00 H new ATOM 0 HD12 LEU A 6 73.150 1.352 -4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 6 72.766 1.346 -6.658 1.00 0.00 H new ATOM 0 HD21 LEU A 6 75.626 1.810 -7.664 1.00 0.00 H new ATOM 0 HD22 LEU A 6 74.174 2.653 -8.254 1.00 0.00 H new ATOM 0 HD23 LEU A 6 75.564 3.588 -7.655 1.00 0.00 H new ATOM 105 N SER A 7 74.890 5.294 -3.660 1.00 0.00 N ATOM 106 CA SER A 7 76.065 5.532 -2.813 1.00 0.00 C ATOM 107 C SER A 7 75.720 5.335 -1.335 1.00 0.00 C ATOM 108 O SER A 7 76.559 4.922 -0.534 1.00 0.00 O ATOM 109 CB SER A 7 76.588 6.954 -3.016 1.00 0.00 C ATOM 110 OG SER A 7 77.551 6.954 -4.063 1.00 0.00 O ATOM 0 H SER A 7 74.690 6.041 -4.325 1.00 0.00 H new ATOM 0 HA SER A 7 76.833 4.814 -3.100 1.00 0.00 H new ATOM 0 HB2 SER A 7 75.765 7.625 -3.263 1.00 0.00 H new ATOM 0 HB3 SER A 7 77.036 7.324 -2.094 1.00 0.00 H new ATOM 0 HG SER A 7 77.888 7.864 -4.198 1.00 0.00 H new ATOM 116 N ASP A 8 74.469 5.628 -0.993 1.00 0.00 N ATOM 117 CA ASP A 8 74.009 5.474 0.378 1.00 0.00 C ATOM 118 C ASP A 8 73.907 3.996 0.738 1.00 0.00 C ATOM 119 O ASP A 8 74.458 3.547 1.742 1.00 0.00 O ATOM 120 CB ASP A 8 72.635 6.122 0.545 1.00 0.00 C ATOM 121 CG ASP A 8 72.755 7.632 0.370 1.00 0.00 C ATOM 122 OD1 ASP A 8 73.769 8.178 0.772 1.00 0.00 O ATOM 123 OD2 ASP A 8 71.828 8.220 -0.164 1.00 0.00 O ATOM 0 H ASP A 8 73.762 5.971 -1.643 1.00 0.00 H new ATOM 0 HA ASP A 8 74.727 5.960 1.038 1.00 0.00 H new ATOM 0 HB2 ASP A 8 71.939 5.715 -0.188 1.00 0.00 H new ATOM 0 HB3 ASP A 8 72.231 5.891 1.531 1.00 0.00 H new ATOM 128 N LEU A 9 73.191 3.244 -0.096 1.00 0.00 N ATOM 129 CA LEU A 9 73.012 1.812 0.140 1.00 0.00 C ATOM 130 C LEU A 9 74.358 1.094 0.170 1.00 0.00 C ATOM 131 O LEU A 9 74.605 0.248 1.029 1.00 0.00 O ATOM 132 CB LEU A 9 72.147 1.188 -0.956 1.00 0.00 C ATOM 133 CG LEU A 9 71.833 -0.299 -0.762 1.00 0.00 C ATOM 134 CD1 LEU A 9 70.523 -0.450 0.012 1.00 0.00 C ATOM 135 CD2 LEU A 9 71.696 -0.975 -2.129 1.00 0.00 C ATOM 0 H LEU A 9 72.729 3.598 -0.934 1.00 0.00 H new ATOM 0 HA LEU A 9 72.518 1.699 1.105 1.00 0.00 H new ATOM 0 HB2 LEU A 9 71.208 1.738 -1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 9 72.652 1.316 -1.914 1.00 0.00 H new ATOM 0 HG LEU A 9 72.642 -0.768 -0.202 1.00 0.00 H new ATOM 0 HD11 LEU A 9 70.301 -1.508 0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 9 70.619 0.030 0.986 1.00 0.00 H new ATOM 0 HD13 LEU A 9 69.714 0.021 -0.547 1.00 0.00 H new ATOM 0 HD21 LEU A 9 71.473 -2.033 -1.991 1.00 0.00 H new ATOM 0 HD22 LEU A 9 70.888 -0.504 -2.689 1.00 0.00 H new ATOM 0 HD23 LEU A 9 72.630 -0.870 -2.682 1.00 0.00 H new ATOM 147 N LEU A 10 75.230 1.437 -0.780 1.00 0.00 N ATOM 148 CA LEU A 10 76.552 0.810 -0.853 1.00 0.00 C ATOM 149 C LEU A 10 77.306 0.976 0.466 1.00 0.00 C ATOM 150 O LEU A 10 77.890 0.029 0.984 1.00 0.00 O ATOM 151 CB LEU A 10 77.380 1.421 -1.987 1.00 0.00 C ATOM 152 CG LEU A 10 76.799 1.240 -3.395 1.00 0.00 C ATOM 153 CD1 LEU A 10 77.815 1.724 -4.431 1.00 0.00 C ATOM 154 CD2 LEU A 10 76.489 -0.240 -3.640 1.00 0.00 C ATOM 0 H LEU A 10 75.049 2.136 -1.501 1.00 0.00 H new ATOM 0 HA LEU A 10 76.403 -0.252 -1.049 1.00 0.00 H new ATOM 0 HB2 LEU A 10 77.497 2.487 -1.795 1.00 0.00 H new ATOM 0 HB3 LEU A 10 78.377 0.981 -1.964 1.00 0.00 H new ATOM 0 HG LEU A 10 75.881 1.821 -3.483 1.00 0.00 H new ATOM 0 HD11 LEU A 10 77.403 1.596 -5.432 1.00 0.00 H new ATOM 0 HD12 LEU A 10 78.034 2.778 -4.261 1.00 0.00 H new ATOM 0 HD13 LEU A 10 78.733 1.143 -4.339 1.00 0.00 H new ATOM 0 HD21 LEU A 10 76.076 -0.364 -4.641 1.00 0.00 H new ATOM 0 HD22 LEU A 10 77.405 -0.823 -3.550 1.00 0.00 H new ATOM 0 HD23 LEU A 10 75.764 -0.587 -2.903 1.00 0.00 H new ATOM 166 N THR A 11 77.274 2.190 1.003 1.00 0.00 N ATOM 167 CA THR A 11 77.934 2.496 2.261 1.00 0.00 C ATOM 168 C THR A 11 77.409 1.594 3.382 1.00 0.00 C ATOM 169 O THR A 11 78.177 0.965 4.107 1.00 0.00 O ATOM 170 CB THR A 11 77.659 3.954 2.615 1.00 0.00 C ATOM 171 OG1 THR A 11 78.046 4.785 1.531 1.00 0.00 O ATOM 172 CG2 THR A 11 78.448 4.331 3.851 1.00 0.00 C ATOM 0 H THR A 11 76.792 2.983 0.580 1.00 0.00 H new ATOM 0 HA THR A 11 79.005 2.325 2.153 1.00 0.00 H new ATOM 0 HB THR A 11 76.595 4.087 2.811 1.00 0.00 H new ATOM 0 HG1 THR A 11 77.256 5.023 1.003 1.00 0.00 H new ATOM 0 HG21 THR A 11 78.252 5.373 4.104 1.00 0.00 H new ATOM 0 HG22 THR A 11 78.149 3.693 4.682 1.00 0.00 H new ATOM 0 HG23 THR A 11 79.513 4.199 3.657 1.00 0.00 H new ATOM 180 N LEU A 12 76.088 1.536 3.518 1.00 0.00 N ATOM 181 CA LEU A 12 75.478 0.698 4.553 1.00 0.00 C ATOM 182 C LEU A 12 75.894 -0.753 4.359 1.00 0.00 C ATOM 183 O LEU A 12 76.348 -1.415 5.292 1.00 0.00 O ATOM 184 CB LEU A 12 73.953 0.796 4.503 1.00 0.00 C ATOM 185 CG LEU A 12 73.394 2.218 4.563 1.00 0.00 C ATOM 186 CD1 LEU A 12 71.866 2.166 4.576 1.00 0.00 C ATOM 187 CD2 LEU A 12 73.890 2.907 5.836 1.00 0.00 C ATOM 0 H LEU A 12 75.425 2.049 2.936 1.00 0.00 H new ATOM 0 HA LEU A 12 75.823 1.053 5.524 1.00 0.00 H new ATOM 0 HB2 LEU A 12 73.604 0.323 3.585 1.00 0.00 H new ATOM 0 HB3 LEU A 12 73.540 0.224 5.334 1.00 0.00 H new ATOM 0 HG LEU A 12 73.731 2.777 3.690 1.00 0.00 H new ATOM 0 HD11 LEU A 12 71.468 3.180 4.619 1.00 0.00 H new ATOM 0 HD12 LEU A 12 71.511 1.675 3.670 1.00 0.00 H new ATOM 0 HD13 LEU A 12 71.528 1.606 5.448 1.00 0.00 H new ATOM 0 HD21 LEU A 12 73.492 3.921 5.880 1.00 0.00 H new ATOM 0 HD22 LEU A 12 73.553 2.347 6.708 1.00 0.00 H new ATOM 0 HD23 LEU A 12 74.979 2.945 5.828 1.00 0.00 H new ATOM 199 N LEU A 13 75.762 -1.230 3.126 1.00 0.00 N ATOM 200 CA LEU A 13 76.157 -2.598 2.808 1.00 0.00 C ATOM 201 C LEU A 13 77.659 -2.759 3.040 1.00 0.00 C ATOM 202 O LEU A 13 78.134 -3.827 3.424 1.00 0.00 O ATOM 203 CB LEU A 13 75.818 -2.936 1.353 1.00 0.00 C ATOM 204 CG LEU A 13 74.470 -3.634 1.149 1.00 0.00 C ATOM 205 CD1 LEU A 13 74.180 -3.760 -0.348 1.00 0.00 C ATOM 206 CD2 LEU A 13 74.519 -5.030 1.774 1.00 0.00 C ATOM 0 H LEU A 13 75.390 -0.698 2.339 1.00 0.00 H new ATOM 0 HA LEU A 13 75.609 -3.281 3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 13 75.825 -2.015 0.770 1.00 0.00 H new ATOM 0 HB3 LEU A 13 76.605 -3.574 0.951 1.00 0.00 H new ATOM 0 HG LEU A 13 73.684 -3.048 1.624 1.00 0.00 H new ATOM 0 HD11 LEU A 13 73.221 -4.257 -0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 13 74.146 -2.767 -0.797 1.00 0.00 H new ATOM 0 HD13 LEU A 13 74.967 -4.346 -0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 13 73.560 -5.527 1.629 1.00 0.00 H new ATOM 0 HD22 LEU A 13 75.306 -5.614 1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 13 74.726 -4.944 2.841 1.00 0.00 H new ATOM 218 N ARG A 14 78.395 -1.669 2.821 1.00 0.00 N ATOM 219 CA ARG A 14 79.834 -1.666 3.027 1.00 0.00 C ATOM 220 C ARG A 14 80.117 -1.808 4.522 1.00 0.00 C ATOM 221 O ARG A 14 80.982 -2.580 4.936 1.00 0.00 O ATOM 222 CB ARG A 14 80.438 -0.354 2.479 1.00 0.00 C ATOM 223 CG ARG A 14 81.920 -0.219 2.855 1.00 0.00 C ATOM 224 CD ARG A 14 82.358 1.236 2.686 1.00 0.00 C ATOM 225 NE ARG A 14 83.801 1.368 2.899 1.00 0.00 N ATOM 226 CZ ARG A 14 84.378 2.552 3.153 1.00 0.00 C ATOM 227 NH1 ARG A 14 83.670 3.654 3.222 1.00 0.00 N ATOM 228 NH2 ARG A 14 85.669 2.607 3.336 1.00 0.00 N ATOM 0 H ARG A 14 78.013 -0.779 2.501 1.00 0.00 H new ATOM 0 HA ARG A 14 80.291 -2.500 2.494 1.00 0.00 H new ATOM 0 HB2 ARG A 14 80.333 -0.328 1.394 1.00 0.00 H new ATOM 0 HB3 ARG A 14 79.882 0.497 2.873 1.00 0.00 H new ATOM 0 HG2 ARG A 14 82.076 -0.539 3.885 1.00 0.00 H new ATOM 0 HG3 ARG A 14 82.527 -0.868 2.224 1.00 0.00 H new ATOM 0 HD2 ARG A 14 82.099 1.586 1.687 1.00 0.00 H new ATOM 0 HD3 ARG A 14 81.821 1.868 3.394 1.00 0.00 H new ATOM 0 HE ARG A 14 84.386 0.533 2.853 1.00 0.00 H new ATOM 0 HH11 ARG A 14 82.660 3.621 3.081 1.00 0.00 H new ATOM 0 HH12 ARG A 14 84.129 4.544 3.416 1.00 0.00 H new ATOM 0 HH21 ARG A 14 86.228 1.755 3.285 1.00 0.00 H new ATOM 0 HH22 ARG A 14 86.119 3.502 3.530 1.00 0.00 H new ATOM 242 N GLU A 15 79.363 -1.058 5.327 1.00 0.00 N ATOM 243 CA GLU A 15 79.525 -1.110 6.780 1.00 0.00 C ATOM 244 C GLU A 15 79.291 -2.532 7.276 1.00 0.00 C ATOM 245 O GLU A 15 80.111 -3.103 7.995 1.00 0.00 O ATOM 246 CB GLU A 15 78.527 -0.167 7.462 1.00 0.00 C ATOM 247 CG GLU A 15 78.794 -0.130 8.972 1.00 0.00 C ATOM 248 CD GLU A 15 79.513 1.166 9.337 1.00 0.00 C ATOM 249 OE1 GLU A 15 78.983 2.221 9.031 1.00 0.00 O ATOM 250 OE2 GLU A 15 80.584 1.082 9.916 1.00 0.00 O ATOM 0 H GLU A 15 78.642 -0.414 5.002 1.00 0.00 H new ATOM 0 HA GLU A 15 80.539 -0.797 7.027 1.00 0.00 H new ATOM 0 HB2 GLU A 15 78.616 0.835 7.043 1.00 0.00 H new ATOM 0 HB3 GLU A 15 77.508 -0.503 7.272 1.00 0.00 H new ATOM 0 HG2 GLU A 15 77.854 -0.202 9.519 1.00 0.00 H new ATOM 0 HG3 GLU A 15 79.399 -0.988 9.265 1.00 0.00 H new ATOM 257 N CYS A 16 78.165 -3.096 6.862 1.00 0.00 N ATOM 258 CA CYS A 16 77.823 -4.464 7.245 1.00 0.00 C ATOM 259 C CYS A 16 78.823 -5.432 6.628 1.00 0.00 C ATOM 260 O CYS A 16 79.259 -6.397 7.257 1.00 0.00 O ATOM 261 CB CYS A 16 76.425 -4.819 6.746 1.00 0.00 C ATOM 262 SG CYS A 16 75.748 -6.153 7.764 1.00 0.00 S ATOM 0 H CYS A 16 77.477 -2.635 6.267 1.00 0.00 H new ATOM 0 HA CYS A 16 77.850 -4.538 8.332 1.00 0.00 H new ATOM 0 HB2 CYS A 16 75.776 -3.944 6.794 1.00 0.00 H new ATOM 0 HB3 CYS A 16 76.467 -5.128 5.702 1.00 0.00 H new ATOM 0 HG CYS A 16 76.705 -6.959 8.116 1.00 0.00 H new ATOM 268 N ALA A 17 79.177 -5.152 5.378 1.00 0.00 N ATOM 269 CA ALA A 17 80.129 -5.981 4.640 1.00 0.00 C ATOM 270 C ALA A 17 81.453 -6.081 5.384 1.00 0.00 C ATOM 271 O ALA A 17 82.119 -7.116 5.365 1.00 0.00 O ATOM 272 CB ALA A 17 80.398 -5.373 3.265 1.00 0.00 C ATOM 0 H ALA A 17 78.819 -4.355 4.852 1.00 0.00 H new ATOM 0 HA ALA A 17 79.693 -6.975 4.537 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.108 -5.998 2.723 1.00 0.00 H new ATOM 0 HB2 ALA A 17 79.465 -5.314 2.704 1.00 0.00 H new ATOM 0 HB3 ALA A 17 80.813 -4.372 3.385 1.00 0.00 H new ATOM 278 N GLY A 18 81.828 -4.989 6.038 1.00 0.00 N ATOM 279 CA GLY A 18 83.080 -4.957 6.786 1.00 0.00 C ATOM 280 C GLY A 18 84.047 -3.928 6.204 1.00 0.00 C ATOM 281 O GLY A 18 85.265 -4.089 6.298 1.00 0.00 O ATOM 0 H GLY A 18 81.291 -4.122 6.067 1.00 0.00 H new ATOM 0 HA2 GLY A 18 82.877 -4.719 7.830 1.00 0.00 H new ATOM 0 HA3 GLY A 18 83.542 -5.944 6.769 1.00 0.00 H new ATOM 285 N GLU A 19 83.491 -2.862 5.605 1.00 0.00 N ATOM 286 CA GLU A 19 84.298 -1.785 5.009 1.00 0.00 C ATOM 287 C GLU A 19 84.795 -2.186 3.619 1.00 0.00 C ATOM 288 O GLU A 19 84.327 -3.167 3.040 1.00 0.00 O ATOM 289 CB GLU A 19 85.500 -1.413 5.908 1.00 0.00 C ATOM 290 CG GLU A 19 85.526 0.100 6.147 1.00 0.00 C ATOM 291 CD GLU A 19 86.910 0.517 6.630 1.00 0.00 C ATOM 292 OE1 GLU A 19 87.856 0.346 5.877 1.00 0.00 O ATOM 293 OE2 GLU A 19 87.007 1.003 7.745 1.00 0.00 O ATOM 0 H GLU A 19 82.484 -2.723 5.521 1.00 0.00 H new ATOM 0 HA GLU A 19 83.655 -0.910 4.919 1.00 0.00 H new ATOM 0 HB2 GLU A 19 85.429 -1.939 6.860 1.00 0.00 H new ATOM 0 HB3 GLU A 19 86.430 -1.731 5.436 1.00 0.00 H new ATOM 0 HG2 GLU A 19 85.276 0.628 5.227 1.00 0.00 H new ATOM 0 HG3 GLU A 19 84.774 0.375 6.886 1.00 0.00 H new ATOM 300 N GLU A 20 85.748 -1.398 3.097 1.00 0.00 N ATOM 301 CA GLU A 20 86.348 -1.622 1.769 1.00 0.00 C ATOM 302 C GLU A 20 85.537 -0.921 0.673 1.00 0.00 C ATOM 303 O GLU A 20 85.029 -1.554 -0.254 1.00 0.00 O ATOM 304 CB GLU A 20 86.486 -3.116 1.430 1.00 0.00 C ATOM 305 CG GLU A 20 87.534 -3.289 0.333 1.00 0.00 C ATOM 306 CD GLU A 20 87.714 -4.772 0.028 1.00 0.00 C ATOM 307 OE1 GLU A 20 87.782 -5.546 0.969 1.00 0.00 O ATOM 308 OE2 GLU A 20 87.782 -5.112 -1.142 1.00 0.00 O ATOM 0 H GLU A 20 86.126 -0.585 3.584 1.00 0.00 H new ATOM 0 HA GLU A 20 87.349 -1.194 1.810 1.00 0.00 H new ATOM 0 HB2 GLU A 20 86.776 -3.677 2.318 1.00 0.00 H new ATOM 0 HB3 GLU A 20 85.527 -3.516 1.100 1.00 0.00 H new ATOM 0 HG2 GLU A 20 87.225 -2.757 -0.567 1.00 0.00 H new ATOM 0 HG3 GLU A 20 88.482 -2.855 0.650 1.00 0.00 H new ATOM 315 N GLU A 21 85.445 0.403 0.785 1.00 0.00 N ATOM 316 CA GLU A 21 84.722 1.210 -0.201 1.00 0.00 C ATOM 317 C GLU A 21 83.270 0.756 -0.345 1.00 0.00 C ATOM 318 O GLU A 21 82.894 -0.332 0.088 1.00 0.00 O ATOM 319 CB GLU A 21 85.408 1.114 -1.564 1.00 0.00 C ATOM 320 CG GLU A 21 86.593 2.082 -1.609 1.00 0.00 C ATOM 321 CD GLU A 21 87.751 1.506 -0.801 1.00 0.00 C ATOM 322 OE1 GLU A 21 87.957 0.306 -0.871 1.00 0.00 O ATOM 323 OE2 GLU A 21 88.415 2.274 -0.124 1.00 0.00 O ATOM 0 H GLU A 21 85.860 0.940 1.546 1.00 0.00 H new ATOM 0 HA GLU A 21 84.731 2.241 0.153 1.00 0.00 H new ATOM 0 HB2 GLU A 21 85.751 0.094 -1.739 1.00 0.00 H new ATOM 0 HB3 GLU A 21 84.699 1.353 -2.357 1.00 0.00 H new ATOM 0 HG2 GLU A 21 86.902 2.247 -2.641 1.00 0.00 H new ATOM 0 HG3 GLU A 21 86.300 3.051 -1.205 1.00 0.00 H new ATOM 330 N SER A 22 82.458 1.615 -0.971 1.00 0.00 N ATOM 331 CA SER A 22 81.035 1.320 -1.189 1.00 0.00 C ATOM 332 C SER A 22 80.855 -0.062 -1.835 1.00 0.00 C ATOM 333 O SER A 22 80.582 -1.046 -1.149 1.00 0.00 O ATOM 334 CB SER A 22 80.406 2.403 -2.076 1.00 0.00 C ATOM 335 OG SER A 22 79.541 3.210 -1.287 1.00 0.00 O ATOM 0 H SER A 22 82.760 2.519 -1.335 1.00 0.00 H new ATOM 0 HA SER A 22 80.533 1.312 -0.222 1.00 0.00 H new ATOM 0 HB2 SER A 22 81.185 3.018 -2.528 1.00 0.00 H new ATOM 0 HB3 SER A 22 79.849 1.943 -2.893 1.00 0.00 H new ATOM 0 HG SER A 22 79.138 3.904 -1.849 1.00 0.00 H new ATOM 341 N ILE A 23 81.004 -0.124 -3.158 1.00 0.00 N ATOM 342 CA ILE A 23 80.850 -1.381 -3.875 1.00 0.00 C ATOM 343 C ILE A 23 82.124 -1.712 -4.662 1.00 0.00 C ATOM 344 O ILE A 23 82.071 -2.248 -5.769 1.00 0.00 O ATOM 345 CB ILE A 23 79.637 -1.283 -4.810 1.00 0.00 C ATOM 346 CG1 ILE A 23 79.231 -2.681 -5.270 1.00 0.00 C ATOM 347 CG2 ILE A 23 79.951 -0.408 -6.032 1.00 0.00 C ATOM 348 CD1 ILE A 23 78.606 -3.441 -4.100 1.00 0.00 C ATOM 0 H ILE A 23 81.229 0.677 -3.748 1.00 0.00 H new ATOM 0 HA ILE A 23 80.684 -2.188 -3.161 1.00 0.00 H new ATOM 0 HB ILE A 23 78.816 -0.822 -4.261 1.00 0.00 H new ATOM 0 HG12 ILE A 23 78.521 -2.612 -6.094 1.00 0.00 H new ATOM 0 HG13 ILE A 23 80.102 -3.220 -5.644 1.00 0.00 H new ATOM 0 HG21 ILE A 23 79.074 -0.356 -6.677 1.00 0.00 H new ATOM 0 HG22 ILE A 23 80.218 0.596 -5.702 1.00 0.00 H new ATOM 0 HG23 ILE A 23 80.784 -0.842 -6.586 1.00 0.00 H new ATOM 0 HD11 ILE A 23 78.316 -4.439 -4.428 1.00 0.00 H new ATOM 0 HD12 ILE A 23 79.331 -3.522 -3.290 1.00 0.00 H new ATOM 0 HD13 ILE A 23 77.725 -2.905 -3.747 1.00 0.00 H new ATOM 360 N ASP A 24 83.264 -1.379 -4.077 1.00 0.00 N ATOM 361 CA ASP A 24 84.545 -1.639 -4.728 1.00 0.00 C ATOM 362 C ASP A 24 84.816 -3.139 -4.786 1.00 0.00 C ATOM 363 O ASP A 24 85.449 -3.636 -5.717 1.00 0.00 O ATOM 364 CB ASP A 24 85.684 -0.951 -3.974 1.00 0.00 C ATOM 365 CG ASP A 24 86.976 -1.070 -4.776 1.00 0.00 C ATOM 366 OD1 ASP A 24 87.138 -0.312 -5.718 1.00 0.00 O ATOM 367 OD2 ASP A 24 87.786 -1.917 -4.436 1.00 0.00 O ATOM 0 H ASP A 24 83.332 -0.933 -3.162 1.00 0.00 H new ATOM 0 HA ASP A 24 84.494 -1.239 -5.741 1.00 0.00 H new ATOM 0 HB2 ASP A 24 85.442 0.099 -3.809 1.00 0.00 H new ATOM 0 HB3 ASP A 24 85.811 -1.407 -2.992 1.00 0.00 H new ATOM 372 N LEU A 25 84.327 -3.858 -3.777 1.00 0.00 N ATOM 373 CA LEU A 25 84.519 -5.304 -3.723 1.00 0.00 C ATOM 374 C LEU A 25 83.863 -5.973 -4.925 1.00 0.00 C ATOM 375 O LEU A 25 84.342 -6.991 -5.427 1.00 0.00 O ATOM 376 CB LEU A 25 83.914 -5.877 -2.440 1.00 0.00 C ATOM 377 CG LEU A 25 82.396 -5.727 -2.316 1.00 0.00 C ATOM 378 CD1 LEU A 25 81.710 -6.949 -2.930 1.00 0.00 C ATOM 379 CD2 LEU A 25 82.014 -5.618 -0.838 1.00 0.00 C ATOM 0 H LEU A 25 83.801 -3.468 -2.995 1.00 0.00 H new ATOM 0 HA LEU A 25 85.591 -5.502 -3.738 1.00 0.00 H new ATOM 0 HB2 LEU A 25 84.165 -6.936 -2.379 1.00 0.00 H new ATOM 0 HB3 LEU A 25 84.383 -5.389 -1.586 1.00 0.00 H new ATOM 0 HG LEU A 25 82.076 -4.828 -2.843 1.00 0.00 H new ATOM 0 HD11 LEU A 25 80.629 -6.842 -2.842 1.00 0.00 H new ATOM 0 HD12 LEU A 25 81.982 -7.028 -3.983 1.00 0.00 H new ATOM 0 HD13 LEU A 25 82.030 -7.848 -2.404 1.00 0.00 H new ATOM 0 HD21 LEU A 25 80.933 -5.511 -0.749 1.00 0.00 H new ATOM 0 HD22 LEU A 25 82.334 -6.517 -0.312 1.00 0.00 H new ATOM 0 HD23 LEU A 25 82.502 -4.748 -0.399 1.00 0.00 H new ATOM 391 N GLY A 26 82.760 -5.388 -5.384 1.00 0.00 N ATOM 392 CA GLY A 26 82.041 -5.933 -6.531 1.00 0.00 C ATOM 393 C GLY A 26 82.475 -5.237 -7.817 1.00 0.00 C ATOM 394 O GLY A 26 82.746 -5.884 -8.829 1.00 0.00 O ATOM 0 H GLY A 26 82.348 -4.545 -4.984 1.00 0.00 H new ATOM 0 HA2 GLY A 26 82.229 -7.004 -6.609 1.00 0.00 H new ATOM 0 HA3 GLY A 26 80.968 -5.807 -6.387 1.00 0.00 H new ATOM 398 N GLY A 27 82.539 -3.909 -7.765 1.00 0.00 N ATOM 399 CA GLY A 27 82.944 -3.130 -8.928 1.00 0.00 C ATOM 400 C GLY A 27 81.729 -2.628 -9.702 1.00 0.00 C ATOM 401 O GLY A 27 81.694 -1.484 -10.155 1.00 0.00 O ATOM 0 H GLY A 27 82.318 -3.355 -6.937 1.00 0.00 H new ATOM 0 HA2 GLY A 27 83.551 -2.283 -8.609 1.00 0.00 H new ATOM 0 HA3 GLY A 27 83.568 -3.742 -9.580 1.00 0.00 H new ATOM 405 N ASP A 28 80.732 -3.497 -9.850 1.00 0.00 N ATOM 406 CA ASP A 28 79.518 -3.133 -10.572 1.00 0.00 C ATOM 407 C ASP A 28 78.465 -4.226 -10.419 1.00 0.00 C ATOM 408 O ASP A 28 78.494 -5.239 -11.118 1.00 0.00 O ATOM 409 CB ASP A 28 79.816 -2.931 -12.058 1.00 0.00 C ATOM 410 CG ASP A 28 78.756 -2.024 -12.673 1.00 0.00 C ATOM 411 OD1 ASP A 28 77.748 -2.545 -13.122 1.00 0.00 O ATOM 412 OD2 ASP A 28 78.966 -0.823 -12.685 1.00 0.00 O ATOM 0 H ASP A 28 80.741 -4.449 -9.483 1.00 0.00 H new ATOM 0 HA ASP A 28 79.141 -2.201 -10.151 1.00 0.00 H new ATOM 0 HB2 ASP A 28 80.805 -2.490 -12.184 1.00 0.00 H new ATOM 0 HB3 ASP A 28 79.828 -3.893 -12.571 1.00 0.00 H new ATOM 417 N VAL A 29 77.535 -4.007 -9.494 1.00 0.00 N ATOM 418 CA VAL A 29 76.474 -4.980 -9.250 1.00 0.00 C ATOM 419 C VAL A 29 75.180 -4.270 -8.860 1.00 0.00 C ATOM 420 O VAL A 29 74.401 -4.767 -8.046 1.00 0.00 O ATOM 421 CB VAL A 29 76.876 -5.938 -8.128 1.00 0.00 C ATOM 422 CG1 VAL A 29 78.058 -6.794 -8.585 1.00 0.00 C ATOM 423 CG2 VAL A 29 77.279 -5.134 -6.890 1.00 0.00 C ATOM 0 H VAL A 29 77.494 -3.174 -8.907 1.00 0.00 H new ATOM 0 HA VAL A 29 76.315 -5.544 -10.169 1.00 0.00 H new ATOM 0 HB VAL A 29 76.032 -6.584 -7.884 1.00 0.00 H new ATOM 0 HG11 VAL A 29 78.344 -7.477 -7.785 1.00 0.00 H new ATOM 0 HG12 VAL A 29 77.772 -7.368 -9.467 1.00 0.00 H new ATOM 0 HG13 VAL A 29 78.901 -6.149 -8.830 1.00 0.00 H new ATOM 0 HG21 VAL A 29 77.566 -5.817 -6.090 1.00 0.00 H new ATOM 0 HG22 VAL A 29 78.122 -4.487 -7.135 1.00 0.00 H new ATOM 0 HG23 VAL A 29 76.437 -4.524 -6.562 1.00 0.00 H new ATOM 433 N GLU A 30 74.961 -3.098 -9.451 1.00 0.00 N ATOM 434 CA GLU A 30 73.763 -2.321 -9.161 1.00 0.00 C ATOM 435 C GLU A 30 72.508 -3.053 -9.644 1.00 0.00 C ATOM 436 O GLU A 30 71.419 -2.874 -9.098 1.00 0.00 O ATOM 437 CB GLU A 30 73.854 -0.946 -9.833 1.00 0.00 C ATOM 438 CG GLU A 30 73.865 -1.099 -11.360 1.00 0.00 C ATOM 439 CD GLU A 30 74.851 -0.109 -11.972 1.00 0.00 C ATOM 440 OE1 GLU A 30 74.608 1.081 -11.868 1.00 0.00 O ATOM 441 OE2 GLU A 30 75.835 -0.557 -12.537 1.00 0.00 O ATOM 0 H GLU A 30 75.593 -2.670 -10.128 1.00 0.00 H new ATOM 0 HA GLU A 30 73.693 -2.191 -8.081 1.00 0.00 H new ATOM 0 HB2 GLU A 30 73.009 -0.328 -9.529 1.00 0.00 H new ATOM 0 HB3 GLU A 30 74.758 -0.433 -9.506 1.00 0.00 H new ATOM 0 HG2 GLU A 30 74.143 -2.118 -11.630 1.00 0.00 H new ATOM 0 HG3 GLU A 30 72.866 -0.925 -11.759 1.00 0.00 H new ATOM 448 N ASP A 31 72.675 -3.876 -10.676 1.00 0.00 N ATOM 449 CA ASP A 31 71.556 -4.630 -11.230 1.00 0.00 C ATOM 450 C ASP A 31 71.820 -6.132 -11.133 1.00 0.00 C ATOM 451 O ASP A 31 71.284 -6.922 -11.910 1.00 0.00 O ATOM 452 CB ASP A 31 71.331 -4.252 -12.695 1.00 0.00 C ATOM 453 CG ASP A 31 70.553 -2.943 -12.769 1.00 0.00 C ATOM 454 OD1 ASP A 31 69.493 -2.873 -12.168 1.00 0.00 O ATOM 455 OD2 ASP A 31 71.027 -2.031 -13.425 1.00 0.00 O ATOM 0 H ASP A 31 73.568 -4.037 -11.142 1.00 0.00 H new ATOM 0 HA ASP A 31 70.665 -4.384 -10.652 1.00 0.00 H new ATOM 0 HB2 ASP A 31 72.288 -4.148 -13.206 1.00 0.00 H new ATOM 0 HB3 ASP A 31 70.782 -5.043 -13.205 1.00 0.00 H new ATOM 460 N VAL A 32 72.638 -6.520 -10.154 1.00 0.00 N ATOM 461 CA VAL A 32 72.953 -7.927 -9.943 1.00 0.00 C ATOM 462 C VAL A 32 72.411 -8.365 -8.587 1.00 0.00 C ATOM 463 O VAL A 32 72.445 -7.604 -7.620 1.00 0.00 O ATOM 464 CB VAL A 32 74.466 -8.148 -9.980 1.00 0.00 C ATOM 465 CG1 VAL A 32 74.766 -9.645 -9.913 1.00 0.00 C ATOM 466 CG2 VAL A 32 75.033 -7.572 -11.279 1.00 0.00 C ATOM 0 H VAL A 32 73.090 -5.881 -9.500 1.00 0.00 H new ATOM 0 HA VAL A 32 72.493 -8.515 -10.737 1.00 0.00 H new ATOM 0 HB VAL A 32 74.927 -7.648 -9.128 1.00 0.00 H new ATOM 0 HG11 VAL A 32 75.844 -9.802 -9.939 1.00 0.00 H new ATOM 0 HG12 VAL A 32 74.362 -10.056 -8.988 1.00 0.00 H new ATOM 0 HG13 VAL A 32 74.306 -10.147 -10.764 1.00 0.00 H new ATOM 0 HG21 VAL A 32 76.111 -7.729 -11.306 1.00 0.00 H new ATOM 0 HG22 VAL A 32 74.572 -8.072 -12.131 1.00 0.00 H new ATOM 0 HG23 VAL A 32 74.820 -6.504 -11.327 1.00 0.00 H new ATOM 476 N ALA A 33 71.901 -9.591 -8.522 1.00 0.00 N ATOM 477 CA ALA A 33 71.343 -10.104 -7.271 1.00 0.00 C ATOM 478 C ALA A 33 72.382 -10.067 -6.153 1.00 0.00 C ATOM 479 O ALA A 33 73.580 -10.228 -6.390 1.00 0.00 O ATOM 480 CB ALA A 33 70.852 -11.541 -7.439 1.00 0.00 C ATOM 0 H ALA A 33 71.861 -10.241 -9.307 1.00 0.00 H new ATOM 0 HA ALA A 33 70.503 -9.462 -7.007 1.00 0.00 H new ATOM 0 HB1 ALA A 33 70.442 -11.898 -6.494 1.00 0.00 H new ATOM 0 HB2 ALA A 33 70.078 -11.574 -8.206 1.00 0.00 H new ATOM 0 HB3 ALA A 33 71.685 -12.178 -7.737 1.00 0.00 H new ATOM 486 N PHE A 34 71.903 -9.851 -4.929 1.00 0.00 N ATOM 487 CA PHE A 34 72.788 -9.791 -3.763 1.00 0.00 C ATOM 488 C PHE A 34 73.639 -11.056 -3.658 1.00 0.00 C ATOM 489 O PHE A 34 74.827 -10.999 -3.343 1.00 0.00 O ATOM 490 CB PHE A 34 71.967 -9.644 -2.485 1.00 0.00 C ATOM 491 CG PHE A 34 71.230 -8.326 -2.509 1.00 0.00 C ATOM 492 CD1 PHE A 34 71.947 -7.125 -2.538 1.00 0.00 C ATOM 493 CD2 PHE A 34 69.832 -8.307 -2.503 1.00 0.00 C ATOM 494 CE1 PHE A 34 71.265 -5.903 -2.560 1.00 0.00 C ATOM 495 CE2 PHE A 34 69.149 -7.085 -2.525 1.00 0.00 C ATOM 496 CZ PHE A 34 69.866 -5.884 -2.553 1.00 0.00 C ATOM 0 H PHE A 34 70.914 -9.715 -4.718 1.00 0.00 H new ATOM 0 HA PHE A 34 73.442 -8.928 -3.886 1.00 0.00 H new ATOM 0 HB2 PHE A 34 71.258 -10.468 -2.399 1.00 0.00 H new ATOM 0 HB3 PHE A 34 72.620 -9.692 -1.613 1.00 0.00 H new ATOM 0 HD1 PHE A 34 73.027 -7.141 -2.543 1.00 0.00 H new ATOM 0 HD2 PHE A 34 69.279 -9.235 -2.481 1.00 0.00 H new ATOM 0 HE1 PHE A 34 71.818 -4.976 -2.582 1.00 0.00 H new ATOM 0 HE2 PHE A 34 68.069 -7.070 -2.520 1.00 0.00 H new ATOM 0 HZ PHE A 34 69.339 -4.941 -2.569 1.00 0.00 H new ATOM 506 N ASP A 35 73.016 -12.195 -3.931 1.00 0.00 N ATOM 507 CA ASP A 35 73.725 -13.468 -3.874 1.00 0.00 C ATOM 508 C ASP A 35 74.707 -13.599 -5.040 1.00 0.00 C ATOM 509 O ASP A 35 75.644 -14.397 -4.988 1.00 0.00 O ATOM 510 CB ASP A 35 72.734 -14.633 -3.925 1.00 0.00 C ATOM 511 CG ASP A 35 73.464 -15.935 -3.614 1.00 0.00 C ATOM 512 OD1 ASP A 35 73.700 -16.196 -2.446 1.00 0.00 O ATOM 513 OD2 ASP A 35 73.777 -16.654 -4.549 1.00 0.00 O ATOM 0 H ASP A 35 72.032 -12.265 -4.191 1.00 0.00 H new ATOM 0 HA ASP A 35 74.278 -13.497 -2.935 1.00 0.00 H new ATOM 0 HB2 ASP A 35 71.931 -14.473 -3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 35 72.272 -14.689 -4.911 1.00 0.00 H new ATOM 518 N ALA A 36 74.479 -12.820 -6.100 1.00 0.00 N ATOM 519 CA ALA A 36 75.342 -12.874 -7.272 1.00 0.00 C ATOM 520 C ALA A 36 76.599 -12.023 -7.087 1.00 0.00 C ATOM 521 O ALA A 36 77.617 -12.266 -7.734 1.00 0.00 O ATOM 522 CB ALA A 36 74.589 -12.379 -8.508 1.00 0.00 C ATOM 0 H ALA A 36 73.711 -12.152 -6.167 1.00 0.00 H new ATOM 0 HA ALA A 36 75.640 -13.914 -7.405 1.00 0.00 H new ATOM 0 HB1 ALA A 36 75.246 -12.425 -9.377 1.00 0.00 H new ATOM 0 HB2 ALA A 36 73.716 -13.009 -8.679 1.00 0.00 H new ATOM 0 HB3 ALA A 36 74.267 -11.350 -8.350 1.00 0.00 H new ATOM 528 N LEU A 37 76.528 -11.019 -6.210 1.00 0.00 N ATOM 529 CA LEU A 37 77.686 -10.155 -5.987 1.00 0.00 C ATOM 530 C LEU A 37 78.519 -10.650 -4.806 1.00 0.00 C ATOM 531 O LEU A 37 79.727 -10.421 -4.750 1.00 0.00 O ATOM 532 CB LEU A 37 77.256 -8.704 -5.749 1.00 0.00 C ATOM 533 CG LEU A 37 76.582 -8.421 -4.402 1.00 0.00 C ATOM 534 CD1 LEU A 37 77.651 -8.102 -3.347 1.00 0.00 C ATOM 535 CD2 LEU A 37 75.629 -7.225 -4.552 1.00 0.00 C ATOM 0 H LEU A 37 75.703 -10.789 -5.656 1.00 0.00 H new ATOM 0 HA LEU A 37 78.298 -10.192 -6.888 1.00 0.00 H new ATOM 0 HB2 LEU A 37 78.135 -8.065 -5.835 1.00 0.00 H new ATOM 0 HB3 LEU A 37 76.571 -8.413 -6.545 1.00 0.00 H new ATOM 0 HG LEU A 37 76.018 -9.298 -4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 37 77.169 -7.901 -2.390 1.00 0.00 H new ATOM 0 HD12 LEU A 37 78.325 -8.953 -3.243 1.00 0.00 H new ATOM 0 HD13 LEU A 37 78.219 -7.225 -3.658 1.00 0.00 H new ATOM 0 HD21 LEU A 37 75.148 -7.021 -3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 37 76.193 -6.348 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU A 37 74.869 -7.457 -5.298 1.00 0.00 H new ATOM 547 N GLY A 38 77.874 -11.341 -3.867 1.00 0.00 N ATOM 548 CA GLY A 38 78.597 -11.865 -2.709 1.00 0.00 C ATOM 549 C GLY A 38 77.822 -11.697 -1.399 1.00 0.00 C ATOM 550 O GLY A 38 78.258 -12.187 -0.356 1.00 0.00 O ATOM 0 H GLY A 38 76.875 -11.548 -3.882 1.00 0.00 H new ATOM 0 HA2 GLY A 38 78.809 -12.922 -2.867 1.00 0.00 H new ATOM 0 HA3 GLY A 38 79.557 -11.356 -2.625 1.00 0.00 H new ATOM 554 N TYR A 39 76.678 -11.009 -1.439 1.00 0.00 N ATOM 555 CA TYR A 39 75.895 -10.814 -0.223 1.00 0.00 C ATOM 556 C TYR A 39 75.030 -12.040 0.048 1.00 0.00 C ATOM 557 O TYR A 39 74.620 -12.742 -0.876 1.00 0.00 O ATOM 558 CB TYR A 39 75.001 -9.581 -0.357 1.00 0.00 C ATOM 559 CG TYR A 39 75.834 -8.320 -0.281 1.00 0.00 C ATOM 560 CD1 TYR A 39 76.773 -8.149 0.746 1.00 0.00 C ATOM 561 CD2 TYR A 39 75.662 -7.319 -1.243 1.00 0.00 C ATOM 562 CE1 TYR A 39 77.537 -6.978 0.808 1.00 0.00 C ATOM 563 CE2 TYR A 39 76.426 -6.148 -1.181 1.00 0.00 C ATOM 564 CZ TYR A 39 77.365 -5.978 -0.156 1.00 0.00 C ATOM 565 OH TYR A 39 78.120 -4.825 -0.097 1.00 0.00 O ATOM 0 H TYR A 39 76.283 -10.588 -2.280 1.00 0.00 H new ATOM 0 HA TYR A 39 76.584 -10.667 0.609 1.00 0.00 H new ATOM 0 HB2 TYR A 39 74.464 -9.614 -1.305 1.00 0.00 H new ATOM 0 HB3 TYR A 39 74.252 -9.579 0.434 1.00 0.00 H new ATOM 0 HD1 TYR A 39 76.907 -8.921 1.489 1.00 0.00 H new ATOM 0 HD2 TYR A 39 74.939 -7.450 -2.034 1.00 0.00 H new ATOM 0 HE1 TYR A 39 78.259 -6.846 1.600 1.00 0.00 H new ATOM 0 HE2 TYR A 39 76.291 -5.375 -1.924 1.00 0.00 H new ATOM 0 HH TYR A 39 77.876 -4.236 -0.841 1.00 0.00 H new ATOM 575 N ASP A 40 74.762 -12.299 1.325 1.00 0.00 N ATOM 576 CA ASP A 40 73.950 -13.452 1.701 1.00 0.00 C ATOM 577 C ASP A 40 72.511 -13.033 1.980 1.00 0.00 C ATOM 578 O ASP A 40 71.615 -13.255 1.166 1.00 0.00 O ATOM 579 CB ASP A 40 74.534 -14.136 2.942 1.00 0.00 C ATOM 580 CG ASP A 40 75.659 -15.077 2.522 1.00 0.00 C ATOM 581 OD1 ASP A 40 75.492 -15.761 1.526 1.00 0.00 O ATOM 582 OD2 ASP A 40 76.670 -15.100 3.204 1.00 0.00 O ATOM 0 H ASP A 40 75.091 -11.734 2.108 1.00 0.00 H new ATOM 0 HA ASP A 40 73.957 -14.154 0.867 1.00 0.00 H new ATOM 0 HB2 ASP A 40 74.912 -13.388 3.639 1.00 0.00 H new ATOM 0 HB3 ASP A 40 73.756 -14.693 3.464 1.00 0.00 H new ATOM 587 N SER A 41 72.306 -12.431 3.144 1.00 0.00 N ATOM 588 CA SER A 41 70.979 -11.983 3.551 1.00 0.00 C ATOM 589 C SER A 41 71.067 -11.379 4.937 1.00 0.00 C ATOM 590 O SER A 41 70.557 -10.290 5.203 1.00 0.00 O ATOM 591 CB SER A 41 70.009 -13.161 3.608 1.00 0.00 C ATOM 592 OG SER A 41 70.376 -14.018 4.682 1.00 0.00 O ATOM 0 H SER A 41 73.042 -12.241 3.824 1.00 0.00 H new ATOM 0 HA SER A 41 70.621 -11.252 2.826 1.00 0.00 H new ATOM 0 HB2 SER A 41 68.989 -12.801 3.746 1.00 0.00 H new ATOM 0 HB3 SER A 41 70.029 -13.710 2.666 1.00 0.00 H new ATOM 0 HG SER A 41 69.755 -14.775 4.723 1.00 0.00 H new ATOM 598 N LEU A 42 71.739 -12.115 5.813 1.00 0.00 N ATOM 599 CA LEU A 42 71.930 -11.690 7.196 1.00 0.00 C ATOM 600 C LEU A 42 72.542 -10.282 7.239 1.00 0.00 C ATOM 601 O LEU A 42 72.146 -9.442 8.047 1.00 0.00 O ATOM 602 CB LEU A 42 72.825 -12.717 7.924 1.00 0.00 C ATOM 603 CG LEU A 42 73.762 -12.177 9.011 1.00 0.00 C ATOM 604 CD1 LEU A 42 72.936 -11.587 10.156 1.00 0.00 C ATOM 605 CD2 LEU A 42 74.635 -13.315 9.544 1.00 0.00 C ATOM 0 H LEU A 42 72.164 -13.015 5.589 1.00 0.00 H new ATOM 0 HA LEU A 42 70.967 -11.645 7.705 1.00 0.00 H new ATOM 0 HB2 LEU A 42 72.179 -13.469 8.377 1.00 0.00 H new ATOM 0 HB3 LEU A 42 73.432 -13.227 7.176 1.00 0.00 H new ATOM 0 HG LEU A 42 74.397 -11.400 8.587 1.00 0.00 H new ATOM 0 HD11 LEU A 42 73.604 -11.204 10.927 1.00 0.00 H new ATOM 0 HD12 LEU A 42 72.316 -10.774 9.777 1.00 0.00 H new ATOM 0 HD13 LEU A 42 72.298 -12.362 10.581 1.00 0.00 H new ATOM 0 HD21 LEU A 42 75.301 -12.931 10.317 1.00 0.00 H new ATOM 0 HD22 LEU A 42 74.000 -14.094 9.966 1.00 0.00 H new ATOM 0 HD23 LEU A 42 75.227 -13.732 8.729 1.00 0.00 H new ATOM 617 N ALA A 43 73.498 -10.035 6.348 1.00 0.00 N ATOM 618 CA ALA A 43 74.137 -8.725 6.291 1.00 0.00 C ATOM 619 C ALA A 43 73.147 -7.694 5.779 1.00 0.00 C ATOM 620 O ALA A 43 73.036 -6.597 6.325 1.00 0.00 O ATOM 621 CB ALA A 43 75.357 -8.755 5.369 1.00 0.00 C ATOM 0 H ALA A 43 73.842 -10.712 5.667 1.00 0.00 H new ATOM 0 HA ALA A 43 74.463 -8.459 7.296 1.00 0.00 H new ATOM 0 HB1 ALA A 43 75.817 -7.767 5.342 1.00 0.00 H new ATOM 0 HB2 ALA A 43 76.078 -9.481 5.744 1.00 0.00 H new ATOM 0 HB3 ALA A 43 75.046 -9.038 4.363 1.00 0.00 H new ATOM 627 N LEU A 44 72.415 -8.065 4.735 1.00 0.00 N ATOM 628 CA LEU A 44 71.417 -7.170 4.157 1.00 0.00 C ATOM 629 C LEU A 44 70.354 -6.848 5.196 1.00 0.00 C ATOM 630 O LEU A 44 69.911 -5.708 5.330 1.00 0.00 O ATOM 631 CB LEU A 44 70.760 -7.822 2.943 1.00 0.00 C ATOM 632 CG LEU A 44 71.476 -7.562 1.621 1.00 0.00 C ATOM 633 CD1 LEU A 44 70.908 -8.477 0.537 1.00 0.00 C ATOM 634 CD2 LEU A 44 71.269 -6.101 1.224 1.00 0.00 C ATOM 0 H LEU A 44 72.492 -8.972 4.274 1.00 0.00 H new ATOM 0 HA LEU A 44 71.911 -6.251 3.842 1.00 0.00 H new ATOM 0 HB2 LEU A 44 70.708 -8.898 3.108 1.00 0.00 H new ATOM 0 HB3 LEU A 44 69.734 -7.462 2.863 1.00 0.00 H new ATOM 0 HG LEU A 44 72.541 -7.766 1.733 1.00 0.00 H new ATOM 0 HD11 LEU A 44 71.422 -8.288 -0.405 1.00 0.00 H new ATOM 0 HD12 LEU A 44 71.053 -9.518 0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 44 69.843 -8.279 0.415 1.00 0.00 H new ATOM 0 HD21 LEU A 44 71.777 -5.905 0.280 1.00 0.00 H new ATOM 0 HD22 LEU A 44 70.203 -5.902 1.111 1.00 0.00 H new ATOM 0 HD23 LEU A 44 71.679 -5.452 1.998 1.00 0.00 H new ATOM 646 N LEU A 45 69.967 -7.877 5.945 1.00 0.00 N ATOM 647 CA LEU A 45 68.967 -7.722 7.004 1.00 0.00 C ATOM 648 C LEU A 45 69.397 -6.614 7.966 1.00 0.00 C ATOM 649 O LEU A 45 68.592 -5.779 8.381 1.00 0.00 O ATOM 650 CB LEU A 45 68.805 -9.045 7.772 1.00 0.00 C ATOM 651 CG LEU A 45 68.042 -8.967 9.103 1.00 0.00 C ATOM 652 CD1 LEU A 45 66.712 -8.240 8.895 1.00 0.00 C ATOM 653 CD2 LEU A 45 67.772 -10.382 9.618 1.00 0.00 C ATOM 0 H LEU A 45 70.328 -8.825 5.841 1.00 0.00 H new ATOM 0 HA LEU A 45 68.012 -7.454 6.553 1.00 0.00 H new ATOM 0 HB2 LEU A 45 68.293 -9.757 7.124 1.00 0.00 H new ATOM 0 HB3 LEU A 45 69.797 -9.451 7.969 1.00 0.00 H new ATOM 0 HG LEU A 45 68.642 -8.420 9.830 1.00 0.00 H new ATOM 0 HD11 LEU A 45 66.174 -8.187 9.842 1.00 0.00 H new ATOM 0 HD12 LEU A 45 66.902 -7.231 8.529 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.111 -8.783 8.166 1.00 0.00 H new ATOM 0 HD21 LEU A 45 67.231 -10.328 10.563 1.00 0.00 H new ATOM 0 HD22 LEU A 45 67.174 -10.927 8.888 1.00 0.00 H new ATOM 0 HD23 LEU A 45 68.719 -10.900 9.771 1.00 0.00 H new ATOM 665 N ASN A 46 70.683 -6.615 8.298 1.00 0.00 N ATOM 666 CA ASN A 46 71.228 -5.604 9.192 1.00 0.00 C ATOM 667 C ASN A 46 71.258 -4.255 8.486 1.00 0.00 C ATOM 668 O ASN A 46 70.832 -3.239 9.035 1.00 0.00 O ATOM 669 CB ASN A 46 72.648 -5.970 9.621 1.00 0.00 C ATOM 670 CG ASN A 46 72.627 -7.280 10.396 1.00 0.00 C ATOM 671 OD1 ASN A 46 73.384 -8.266 10.001 1.00 0.00 O flip ATOM 672 ND2 ASN A 46 71.908 -7.414 11.385 1.00 0.00 N flip ATOM 0 H ASN A 46 71.362 -7.299 7.964 1.00 0.00 H new ATOM 0 HA ASN A 46 70.591 -5.550 10.075 1.00 0.00 H new ATOM 0 HB2 ASN A 46 73.290 -6.064 8.745 1.00 0.00 H new ATOM 0 HB3 ASN A 46 73.067 -5.177 10.240 1.00 0.00 H new ATOM 0 HD21 ASN A 46 71.316 -6.643 11.694 1.00 0.00 H new ATOM 0 HD22 ASN A 46 71.904 -8.296 11.897 1.00 0.00 H new ATOM 679 N THR A 47 71.767 -4.260 7.252 1.00 0.00 N ATOM 680 CA THR A 47 71.850 -3.026 6.464 1.00 0.00 C ATOM 681 C THR A 47 70.475 -2.374 6.333 1.00 0.00 C ATOM 682 O THR A 47 70.318 -1.172 6.545 1.00 0.00 O ATOM 683 CB THR A 47 72.399 -3.310 5.062 1.00 0.00 C ATOM 684 OG1 THR A 47 73.199 -4.480 5.091 1.00 0.00 O ATOM 685 CG2 THR A 47 73.249 -2.129 4.598 1.00 0.00 C ATOM 0 H THR A 47 72.124 -5.092 6.781 1.00 0.00 H new ATOM 0 HA THR A 47 72.525 -2.349 6.987 1.00 0.00 H new ATOM 0 HB THR A 47 71.567 -3.455 4.373 1.00 0.00 H new ATOM 0 HG1 THR A 47 72.629 -5.262 5.245 1.00 0.00 H new ATOM 0 HG21 THR A 47 73.639 -2.331 3.601 1.00 0.00 H new ATOM 0 HG22 THR A 47 72.636 -1.228 4.572 1.00 0.00 H new ATOM 0 HG23 THR A 47 74.079 -1.984 5.290 1.00 0.00 H new ATOM 693 N VAL A 48 69.479 -3.187 5.988 1.00 0.00 N ATOM 694 CA VAL A 48 68.110 -2.686 5.840 1.00 0.00 C ATOM 695 C VAL A 48 67.630 -2.085 7.156 1.00 0.00 C ATOM 696 O VAL A 48 66.913 -1.085 7.175 1.00 0.00 O ATOM 697 CB VAL A 48 67.164 -3.817 5.419 1.00 0.00 C ATOM 698 CG1 VAL A 48 65.769 -3.248 5.143 1.00 0.00 C ATOM 699 CG2 VAL A 48 67.700 -4.488 4.149 1.00 0.00 C ATOM 0 H VAL A 48 69.589 -4.185 5.807 1.00 0.00 H new ATOM 0 HA VAL A 48 68.107 -1.918 5.067 1.00 0.00 H new ATOM 0 HB VAL A 48 67.103 -4.552 6.222 1.00 0.00 H new ATOM 0 HG11 VAL A 48 65.100 -4.055 4.844 1.00 0.00 H new ATOM 0 HG12 VAL A 48 65.385 -2.773 6.046 1.00 0.00 H new ATOM 0 HG13 VAL A 48 65.829 -2.511 4.342 1.00 0.00 H new ATOM 0 HG21 VAL A 48 67.027 -5.292 3.850 1.00 0.00 H new ATOM 0 HG22 VAL A 48 67.764 -3.752 3.348 1.00 0.00 H new ATOM 0 HG23 VAL A 48 68.691 -4.898 4.345 1.00 0.00 H new ATOM 709 N GLY A 49 68.050 -2.698 8.258 1.00 0.00 N ATOM 710 CA GLY A 49 67.673 -2.205 9.577 1.00 0.00 C ATOM 711 C GLY A 49 68.245 -0.808 9.792 1.00 0.00 C ATOM 712 O GLY A 49 67.635 0.041 10.444 1.00 0.00 O ATOM 0 H GLY A 49 68.644 -3.527 8.265 1.00 0.00 H new ATOM 0 HA2 GLY A 49 66.587 -2.181 9.669 1.00 0.00 H new ATOM 0 HA3 GLY A 49 68.043 -2.882 10.347 1.00 0.00 H new ATOM 716 N ARG A 50 69.430 -0.585 9.228 1.00 0.00 N ATOM 717 CA ARG A 50 70.094 0.705 9.352 1.00 0.00 C ATOM 718 C ARG A 50 69.351 1.773 8.559 1.00 0.00 C ATOM 719 O ARG A 50 69.301 2.932 8.961 1.00 0.00 O ATOM 720 CB ARG A 50 71.535 0.617 8.845 1.00 0.00 C ATOM 721 CG ARG A 50 72.299 1.878 9.253 1.00 0.00 C ATOM 722 CD ARG A 50 72.766 1.746 10.703 1.00 0.00 C ATOM 723 NE ARG A 50 74.023 0.999 10.775 1.00 0.00 N ATOM 724 CZ ARG A 50 74.810 1.031 11.861 1.00 0.00 C ATOM 725 NH1 ARG A 50 74.485 1.740 12.916 1.00 0.00 N ATOM 726 NH2 ARG A 50 75.919 0.343 11.869 1.00 0.00 N ATOM 0 H ARG A 50 69.945 -1.278 8.685 1.00 0.00 H new ATOM 0 HA ARG A 50 70.096 0.978 10.407 1.00 0.00 H new ATOM 0 HB2 ARG A 50 72.023 -0.266 9.257 1.00 0.00 H new ATOM 0 HB3 ARG A 50 71.544 0.509 7.760 1.00 0.00 H new ATOM 0 HG2 ARG A 50 73.156 2.025 8.596 1.00 0.00 H new ATOM 0 HG3 ARG A 50 71.660 2.754 9.144 1.00 0.00 H new ATOM 0 HD2 ARG A 50 72.900 2.736 11.139 1.00 0.00 H new ATOM 0 HD3 ARG A 50 72.002 1.239 11.292 1.00 0.00 H new ATOM 0 HE ARG A 50 74.310 0.436 9.974 1.00 0.00 H new ATOM 0 HH11 ARG A 50 73.620 2.280 12.921 1.00 0.00 H new ATOM 0 HH12 ARG A 50 75.097 1.751 13.732 1.00 0.00 H new ATOM 0 HH21 ARG A 50 76.181 -0.212 11.054 1.00 0.00 H new ATOM 0 HH22 ARG A 50 76.524 0.361 12.690 1.00 0.00 H new ATOM 740 N ILE A 51 68.770 1.374 7.429 1.00 0.00 N ATOM 741 CA ILE A 51 68.029 2.323 6.601 1.00 0.00 C ATOM 742 C ILE A 51 66.723 2.698 7.288 1.00 0.00 C ATOM 743 O ILE A 51 66.412 3.874 7.455 1.00 0.00 O ATOM 744 CB ILE A 51 67.717 1.729 5.224 1.00 0.00 C ATOM 745 CG1 ILE A 51 69.013 1.237 4.570 1.00 0.00 C ATOM 746 CG2 ILE A 51 67.079 2.803 4.337 1.00 0.00 C ATOM 747 CD1 ILE A 51 68.712 0.042 3.660 1.00 0.00 C ATOM 0 H ILE A 51 68.796 0.419 7.071 1.00 0.00 H new ATOM 0 HA ILE A 51 68.650 3.209 6.468 1.00 0.00 H new ATOM 0 HB ILE A 51 67.028 0.893 5.340 1.00 0.00 H new ATOM 0 HG12 ILE A 51 69.468 2.041 3.992 1.00 0.00 H new ATOM 0 HG13 ILE A 51 69.732 0.950 5.337 1.00 0.00 H new ATOM 0 HG21 ILE A 51 66.857 2.381 3.357 1.00 0.00 H new ATOM 0 HG22 ILE A 51 66.156 3.155 4.798 1.00 0.00 H new ATOM 0 HG23 ILE A 51 67.770 3.639 4.224 1.00 0.00 H new ATOM 0 HD11 ILE A 51 69.636 -0.305 3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 51 68.277 -0.764 4.250 1.00 0.00 H new ATOM 0 HD13 ILE A 51 68.008 0.344 2.884 1.00 0.00 H new ATOM 759 N GLU A 52 65.962 1.685 7.686 1.00 0.00 N ATOM 760 CA GLU A 52 64.689 1.933 8.360 1.00 0.00 C ATOM 761 C GLU A 52 64.897 2.747 9.639 1.00 0.00 C ATOM 762 O GLU A 52 63.981 3.416 10.114 1.00 0.00 O ATOM 763 CB GLU A 52 63.994 0.613 8.709 1.00 0.00 C ATOM 764 CG GLU A 52 64.914 -0.240 9.581 1.00 0.00 C ATOM 765 CD GLU A 52 64.205 -1.539 9.949 1.00 0.00 C ATOM 766 OE1 GLU A 52 63.668 -2.172 9.054 1.00 0.00 O ATOM 767 OE2 GLU A 52 64.210 -1.883 11.119 1.00 0.00 O ATOM 0 H GLU A 52 66.196 0.701 7.558 1.00 0.00 H new ATOM 0 HA GLU A 52 64.060 2.501 7.675 1.00 0.00 H new ATOM 0 HB2 GLU A 52 63.060 0.811 9.235 1.00 0.00 H new ATOM 0 HB3 GLU A 52 63.739 0.073 7.797 1.00 0.00 H new ATOM 0 HG2 GLU A 52 65.840 -0.457 9.048 1.00 0.00 H new ATOM 0 HG3 GLU A 52 65.187 0.306 10.484 1.00 0.00 H new ATOM 774 N ARG A 53 66.109 2.686 10.196 1.00 0.00 N ATOM 775 CA ARG A 53 66.405 3.429 11.419 1.00 0.00 C ATOM 776 C ARG A 53 67.040 4.780 11.091 1.00 0.00 C ATOM 777 O ARG A 53 66.737 5.794 11.721 1.00 0.00 O ATOM 778 CB ARG A 53 67.360 2.634 12.311 1.00 0.00 C ATOM 779 CG ARG A 53 67.114 2.999 13.777 1.00 0.00 C ATOM 780 CD ARG A 53 68.021 4.164 14.172 1.00 0.00 C ATOM 781 NE ARG A 53 69.414 3.722 14.281 1.00 0.00 N ATOM 782 CZ ARG A 53 69.865 3.043 15.346 1.00 0.00 C ATOM 783 NH1 ARG A 53 69.071 2.744 16.347 1.00 0.00 N ATOM 784 NH2 ARG A 53 71.116 2.675 15.389 1.00 0.00 N ATOM 0 H ARG A 53 66.887 2.140 9.827 1.00 0.00 H new ATOM 0 HA ARG A 53 65.464 3.591 11.945 1.00 0.00 H new ATOM 0 HB2 ARG A 53 67.209 1.565 12.161 1.00 0.00 H new ATOM 0 HB3 ARG A 53 68.393 2.851 12.040 1.00 0.00 H new ATOM 0 HG2 ARG A 53 66.069 3.272 13.924 1.00 0.00 H new ATOM 0 HG3 ARG A 53 67.312 2.138 14.415 1.00 0.00 H new ATOM 0 HD2 ARG A 53 67.944 4.959 13.431 1.00 0.00 H new ATOM 0 HD3 ARG A 53 67.691 4.582 15.123 1.00 0.00 H new ATOM 0 HE ARG A 53 70.061 3.938 13.523 1.00 0.00 H new ATOM 0 HH11 ARG A 53 68.092 3.029 16.324 1.00 0.00 H new ATOM 0 HH12 ARG A 53 69.433 2.227 17.148 1.00 0.00 H new ATOM 0 HH21 ARG A 53 71.742 2.904 14.617 1.00 0.00 H new ATOM 0 HH22 ARG A 53 71.468 2.158 16.195 1.00 0.00 H new ATOM 798 N ASP A 54 67.927 4.779 10.102 1.00 0.00 N ATOM 799 CA ASP A 54 68.609 6.001 9.695 1.00 0.00 C ATOM 800 C ASP A 54 67.664 6.921 8.931 1.00 0.00 C ATOM 801 O ASP A 54 67.676 8.138 9.115 1.00 0.00 O ATOM 802 CB ASP A 54 69.803 5.669 8.799 1.00 0.00 C ATOM 803 CG ASP A 54 70.926 5.078 9.643 1.00 0.00 C ATOM 804 OD1 ASP A 54 70.623 4.332 10.560 1.00 0.00 O ATOM 805 OD2 ASP A 54 72.074 5.380 9.361 1.00 0.00 O ATOM 0 H ASP A 54 68.189 3.949 9.570 1.00 0.00 H new ATOM 0 HA ASP A 54 68.952 6.506 10.598 1.00 0.00 H new ATOM 0 HB2 ASP A 54 69.505 4.961 8.026 1.00 0.00 H new ATOM 0 HB3 ASP A 54 70.151 6.569 8.291 1.00 0.00 H new ATOM 810 N TYR A 55 66.842 6.326 8.073 1.00 0.00 N ATOM 811 CA TYR A 55 65.889 7.099 7.287 1.00 0.00 C ATOM 812 C TYR A 55 64.543 7.176 8.011 1.00 0.00 C ATOM 813 O TYR A 55 63.760 8.097 7.787 1.00 0.00 O ATOM 814 CB TYR A 55 65.697 6.466 5.904 1.00 0.00 C ATOM 815 CG TYR A 55 66.875 6.815 5.020 1.00 0.00 C ATOM 816 CD1 TYR A 55 68.120 6.215 5.245 1.00 0.00 C ATOM 817 CD2 TYR A 55 66.723 7.738 3.974 1.00 0.00 C ATOM 818 CE1 TYR A 55 69.211 6.535 4.427 1.00 0.00 C ATOM 819 CE2 TYR A 55 67.818 8.059 3.156 1.00 0.00 C ATOM 820 CZ TYR A 55 69.060 7.457 3.384 1.00 0.00 C ATOM 821 OH TYR A 55 70.137 7.770 2.579 1.00 0.00 O ATOM 0 H TYR A 55 66.816 5.320 7.905 1.00 0.00 H new ATOM 0 HA TYR A 55 66.285 8.107 7.162 1.00 0.00 H new ATOM 0 HB2 TYR A 55 65.607 5.384 5.997 1.00 0.00 H new ATOM 0 HB3 TYR A 55 64.772 6.825 5.453 1.00 0.00 H new ATOM 0 HD1 TYR A 55 68.239 5.505 6.050 1.00 0.00 H new ATOM 0 HD2 TYR A 55 65.764 8.202 3.798 1.00 0.00 H new ATOM 0 HE1 TYR A 55 70.170 6.070 4.601 1.00 0.00 H new ATOM 0 HE2 TYR A 55 67.702 8.770 2.351 1.00 0.00 H new ATOM 0 HH TYR A 55 70.846 7.106 2.708 1.00 0.00 H new ATOM 831 N GLY A 56 64.288 6.207 8.895 1.00 0.00 N ATOM 832 CA GLY A 56 63.039 6.193 9.653 1.00 0.00 C ATOM 833 C GLY A 56 61.851 5.902 8.748 1.00 0.00 C ATOM 834 O GLY A 56 60.801 6.536 8.860 1.00 0.00 O ATOM 0 H GLY A 56 64.921 5.434 9.100 1.00 0.00 H new ATOM 0 HA2 GLY A 56 63.095 5.439 10.438 1.00 0.00 H new ATOM 0 HA3 GLY A 56 62.898 7.155 10.145 1.00 0.00 H new ATOM 838 N VAL A 57 62.020 4.939 7.848 1.00 0.00 N ATOM 839 CA VAL A 57 60.936 4.588 6.929 1.00 0.00 C ATOM 840 C VAL A 57 60.785 3.076 6.800 1.00 0.00 C ATOM 841 O VAL A 57 61.733 2.322 7.016 1.00 0.00 O ATOM 842 CB VAL A 57 61.197 5.178 5.547 1.00 0.00 C ATOM 843 CG1 VAL A 57 61.109 6.703 5.624 1.00 0.00 C ATOM 844 CG2 VAL A 57 62.596 4.766 5.076 1.00 0.00 C ATOM 0 H VAL A 57 62.876 4.396 7.733 1.00 0.00 H new ATOM 0 HA VAL A 57 60.015 5.001 7.340 1.00 0.00 H new ATOM 0 HB VAL A 57 60.453 4.807 4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 57 61.295 7.128 4.638 1.00 0.00 H new ATOM 0 HG12 VAL A 57 60.115 6.993 5.963 1.00 0.00 H new ATOM 0 HG13 VAL A 57 61.855 7.075 6.326 1.00 0.00 H new ATOM 0 HG21 VAL A 57 62.786 5.186 4.088 1.00 0.00 H new ATOM 0 HG22 VAL A 57 63.341 5.139 5.778 1.00 0.00 H new ATOM 0 HG23 VAL A 57 62.658 3.679 5.026 1.00 0.00 H new ATOM 854 N GLN A 58 59.572 2.650 6.436 1.00 0.00 N ATOM 855 CA GLN A 58 59.272 1.227 6.269 1.00 0.00 C ATOM 856 C GLN A 58 57.797 1.037 5.923 1.00 0.00 C ATOM 857 O GLN A 58 56.919 1.269 6.754 1.00 0.00 O ATOM 858 CB GLN A 58 59.570 0.449 7.555 1.00 0.00 C ATOM 859 CG GLN A 58 59.470 -1.051 7.278 1.00 0.00 C ATOM 860 CD GLN A 58 60.468 -1.798 8.157 1.00 0.00 C ATOM 861 OE1 GLN A 58 60.291 -1.822 9.450 1.00 0.00 O flip ATOM 862 NE2 GLN A 58 61.434 -2.375 7.657 1.00 0.00 N flip ATOM 0 H GLN A 58 58.783 3.270 6.252 1.00 0.00 H new ATOM 0 HA GLN A 58 59.901 0.850 5.462 1.00 0.00 H new ATOM 0 HB2 GLN A 58 60.567 0.697 7.920 1.00 0.00 H new ATOM 0 HB3 GLN A 58 58.865 0.733 8.336 1.00 0.00 H new ATOM 0 HG2 GLN A 58 58.458 -1.402 7.479 1.00 0.00 H new ATOM 0 HG3 GLN A 58 59.674 -1.252 6.226 1.00 0.00 H new ATOM 0 HE21 GLN A 58 61.572 -2.356 6.647 1.00 0.00 H new ATOM 0 HE22 GLN A 58 62.096 -2.872 8.253 1.00 0.00 H new ATOM 871 N LEU A 59 57.530 0.610 4.691 1.00 0.00 N ATOM 872 CA LEU A 59 56.147 0.393 4.258 1.00 0.00 C ATOM 873 C LEU A 59 55.977 -0.956 3.552 1.00 0.00 C ATOM 874 O LEU A 59 54.899 -1.260 3.041 1.00 0.00 O ATOM 875 CB LEU A 59 55.699 1.501 3.306 1.00 0.00 C ATOM 876 CG LEU A 59 56.780 2.028 2.359 1.00 0.00 C ATOM 877 CD1 LEU A 59 57.305 0.889 1.484 1.00 0.00 C ATOM 878 CD2 LEU A 59 56.184 3.118 1.468 1.00 0.00 C ATOM 0 H LEU A 59 58.237 0.410 3.984 1.00 0.00 H new ATOM 0 HA LEU A 59 55.531 0.401 5.157 1.00 0.00 H new ATOM 0 HB2 LEU A 59 54.866 1.129 2.709 1.00 0.00 H new ATOM 0 HB3 LEU A 59 55.320 2.334 3.898 1.00 0.00 H new ATOM 0 HG LEU A 59 57.602 2.439 2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 59 58.074 1.271 0.812 1.00 0.00 H new ATOM 0 HD12 LEU A 59 57.730 0.110 2.117 1.00 0.00 H new ATOM 0 HD13 LEU A 59 56.485 0.473 0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 59 56.951 3.496 0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 59 55.361 2.703 0.887 1.00 0.00 H new ATOM 0 HD23 LEU A 59 55.814 3.934 2.089 1.00 0.00 H new ATOM 890 N GLY A 60 57.036 -1.764 3.522 1.00 0.00 N ATOM 891 CA GLY A 60 56.960 -3.063 2.871 1.00 0.00 C ATOM 892 C GLY A 60 57.803 -4.094 3.611 1.00 0.00 C ATOM 893 O GLY A 60 59.017 -4.173 3.426 1.00 0.00 O ATOM 0 H GLY A 60 57.942 -1.543 3.935 1.00 0.00 H new ATOM 0 HA2 GLY A 60 55.922 -3.395 2.834 1.00 0.00 H new ATOM 0 HA3 GLY A 60 57.305 -2.978 1.840 1.00 0.00 H new ATOM 897 N ASP A 61 57.143 -4.890 4.450 1.00 0.00 N ATOM 898 CA ASP A 61 57.840 -5.923 5.214 1.00 0.00 C ATOM 899 C ASP A 61 58.498 -6.920 4.266 1.00 0.00 C ATOM 900 O ASP A 61 59.678 -7.248 4.402 1.00 0.00 O ATOM 901 CB ASP A 61 56.864 -6.670 6.126 1.00 0.00 C ATOM 902 CG ASP A 61 56.305 -5.707 7.168 1.00 0.00 C ATOM 903 OD1 ASP A 61 56.915 -5.578 8.216 1.00 0.00 O ATOM 904 OD2 ASP A 61 55.272 -5.113 6.903 1.00 0.00 O ATOM 0 H ASP A 61 56.138 -4.841 4.617 1.00 0.00 H new ATOM 0 HA ASP A 61 58.601 -5.438 5.825 1.00 0.00 H new ATOM 0 HB2 ASP A 61 56.052 -7.096 5.537 1.00 0.00 H new ATOM 0 HB3 ASP A 61 57.371 -7.500 6.617 1.00 0.00 H new ATOM 909 N ASP A 62 57.722 -7.384 3.295 1.00 0.00 N ATOM 910 CA ASP A 62 58.233 -8.334 2.316 1.00 0.00 C ATOM 911 C ASP A 62 59.066 -7.633 1.239 1.00 0.00 C ATOM 912 O ASP A 62 59.625 -8.285 0.357 1.00 0.00 O ATOM 913 CB ASP A 62 57.084 -9.086 1.643 1.00 0.00 C ATOM 914 CG ASP A 62 56.094 -8.086 1.056 1.00 0.00 C ATOM 915 OD1 ASP A 62 55.447 -7.399 1.830 1.00 0.00 O ATOM 916 OD2 ASP A 62 55.996 -8.021 -0.158 1.00 0.00 O ATOM 0 H ASP A 62 56.745 -7.121 3.165 1.00 0.00 H new ATOM 0 HA ASP A 62 58.869 -9.038 2.853 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.471 -9.734 0.857 1.00 0.00 H new ATOM 0 HB3 ASP A 62 56.582 -9.728 2.367 1.00 0.00 H new ATOM 921 N ALA A 63 59.169 -6.300 1.321 1.00 0.00 N ATOM 922 CA ALA A 63 59.960 -5.541 0.354 1.00 0.00 C ATOM 923 C ALA A 63 61.394 -6.057 0.338 1.00 0.00 C ATOM 924 O ALA A 63 62.059 -6.068 -0.697 1.00 0.00 O ATOM 925 CB ALA A 63 59.971 -4.061 0.731 1.00 0.00 C ATOM 0 H ALA A 63 58.719 -5.734 2.040 1.00 0.00 H new ATOM 0 HA ALA A 63 59.513 -5.663 -0.633 1.00 0.00 H new ATOM 0 HB1 ALA A 63 60.563 -3.505 0.004 1.00 0.00 H new ATOM 0 HB2 ALA A 63 58.950 -3.679 0.736 1.00 0.00 H new ATOM 0 HB3 ALA A 63 60.408 -3.941 1.722 1.00 0.00 H new ATOM 931 N VAL A 64 61.849 -6.501 1.505 1.00 0.00 N ATOM 932 CA VAL A 64 63.198 -7.041 1.626 1.00 0.00 C ATOM 933 C VAL A 64 63.298 -8.362 0.856 1.00 0.00 C ATOM 934 O VAL A 64 64.360 -8.723 0.349 1.00 0.00 O ATOM 935 CB VAL A 64 63.550 -7.261 3.107 1.00 0.00 C ATOM 936 CG1 VAL A 64 62.597 -8.288 3.729 1.00 0.00 C ATOM 937 CG2 VAL A 64 64.998 -7.757 3.233 1.00 0.00 C ATOM 0 H VAL A 64 61.311 -6.498 2.371 1.00 0.00 H new ATOM 0 HA VAL A 64 63.906 -6.329 1.203 1.00 0.00 H new ATOM 0 HB VAL A 64 63.447 -6.314 3.636 1.00 0.00 H new ATOM 0 HG11 VAL A 64 62.855 -8.436 4.778 1.00 0.00 H new ATOM 0 HG12 VAL A 64 61.572 -7.924 3.656 1.00 0.00 H new ATOM 0 HG13 VAL A 64 62.685 -9.235 3.197 1.00 0.00 H new ATOM 0 HG21 VAL A 64 65.240 -7.910 4.285 1.00 0.00 H new ATOM 0 HG22 VAL A 64 65.108 -8.698 2.694 1.00 0.00 H new ATOM 0 HG23 VAL A 64 65.675 -7.015 2.810 1.00 0.00 H new ATOM 947 N GLU A 65 62.173 -9.075 0.772 1.00 0.00 N ATOM 948 CA GLU A 65 62.140 -10.349 0.062 1.00 0.00 C ATOM 949 C GLU A 65 62.343 -10.131 -1.434 1.00 0.00 C ATOM 950 O GLU A 65 63.263 -10.685 -2.037 1.00 0.00 O ATOM 951 CB GLU A 65 60.799 -11.052 0.285 1.00 0.00 C ATOM 952 CG GLU A 65 60.917 -12.520 -0.130 1.00 0.00 C ATOM 953 CD GLU A 65 59.601 -13.236 0.154 1.00 0.00 C ATOM 954 OE1 GLU A 65 58.688 -13.093 -0.642 1.00 0.00 O ATOM 955 OE2 GLU A 65 59.526 -13.917 1.163 1.00 0.00 O ATOM 0 H GLU A 65 61.283 -8.793 1.183 1.00 0.00 H new ATOM 0 HA GLU A 65 62.946 -10.972 0.451 1.00 0.00 H new ATOM 0 HB2 GLU A 65 60.509 -10.982 1.333 1.00 0.00 H new ATOM 0 HB3 GLU A 65 60.018 -10.561 -0.295 1.00 0.00 H new ATOM 0 HG2 GLU A 65 61.160 -12.591 -1.190 1.00 0.00 H new ATOM 0 HG3 GLU A 65 61.729 -12.999 0.416 1.00 0.00 H new ATOM 962 N LYS A 66 61.472 -9.317 -2.027 1.00 0.00 N ATOM 963 CA LYS A 66 61.562 -9.030 -3.456 1.00 0.00 C ATOM 964 C LYS A 66 62.895 -8.363 -3.783 1.00 0.00 C ATOM 965 O LYS A 66 63.463 -8.569 -4.856 1.00 0.00 O ATOM 966 CB LYS A 66 60.420 -8.109 -3.894 1.00 0.00 C ATOM 967 CG LYS A 66 59.102 -8.891 -3.899 1.00 0.00 C ATOM 968 CD LYS A 66 58.253 -8.462 -5.098 1.00 0.00 C ATOM 969 CE LYS A 66 57.097 -9.446 -5.286 1.00 0.00 C ATOM 970 NZ LYS A 66 56.460 -9.219 -6.613 1.00 0.00 N ATOM 0 H LYS A 66 60.704 -8.849 -1.546 1.00 0.00 H new ATOM 0 HA LYS A 66 61.488 -9.976 -3.993 1.00 0.00 H new ATOM 0 HB2 LYS A 66 60.347 -7.257 -3.218 1.00 0.00 H new ATOM 0 HB3 LYS A 66 60.622 -7.710 -4.888 1.00 0.00 H new ATOM 0 HG2 LYS A 66 59.303 -9.961 -3.948 1.00 0.00 H new ATOM 0 HG3 LYS A 66 58.557 -8.711 -2.972 1.00 0.00 H new ATOM 0 HD2 LYS A 66 57.865 -7.456 -4.940 1.00 0.00 H new ATOM 0 HD3 LYS A 66 58.867 -8.430 -5.998 1.00 0.00 H new ATOM 0 HE2 LYS A 66 57.463 -10.470 -5.217 1.00 0.00 H new ATOM 0 HE3 LYS A 66 56.362 -9.316 -4.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 55.674 -9.888 -6.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 56.097 -8.246 -6.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 57.163 -9.364 -7.365 1.00 0.00 H new ATOM 984 N ALA A 67 63.387 -7.562 -2.839 1.00 0.00 N ATOM 985 CA ALA A 67 64.661 -6.865 -3.024 1.00 0.00 C ATOM 986 C ALA A 67 65.787 -7.858 -3.310 1.00 0.00 C ATOM 987 O ALA A 67 66.341 -8.470 -2.397 1.00 0.00 O ATOM 988 CB ALA A 67 65.015 -6.065 -1.769 1.00 0.00 C ATOM 0 H ALA A 67 62.929 -7.380 -1.946 1.00 0.00 H new ATOM 0 HA ALA A 67 64.552 -6.191 -3.873 1.00 0.00 H new ATOM 0 HB1 ALA A 67 65.965 -5.552 -1.920 1.00 0.00 H new ATOM 0 HB2 ALA A 67 64.233 -5.331 -1.573 1.00 0.00 H new ATOM 0 HB3 ALA A 67 65.100 -6.741 -0.918 1.00 0.00 H new ATOM 994 N THR A 68 66.123 -8.003 -4.589 1.00 0.00 N ATOM 995 CA THR A 68 67.194 -8.914 -4.992 1.00 0.00 C ATOM 996 C THR A 68 68.440 -8.116 -5.373 1.00 0.00 C ATOM 997 O THR A 68 69.569 -8.570 -5.192 1.00 0.00 O ATOM 998 CB THR A 68 66.758 -9.777 -6.181 1.00 0.00 C ATOM 999 OG1 THR A 68 67.832 -10.623 -6.566 1.00 0.00 O ATOM 1000 CG2 THR A 68 66.367 -8.879 -7.358 1.00 0.00 C ATOM 0 H THR A 68 65.675 -7.507 -5.359 1.00 0.00 H new ATOM 0 HA THR A 68 67.420 -9.568 -4.150 1.00 0.00 H new ATOM 0 HB THR A 68 65.899 -10.383 -5.892 1.00 0.00 H new ATOM 0 HG1 THR A 68 67.556 -11.177 -7.325 1.00 0.00 H new ATOM 0 HG21 THR A 68 66.058 -9.498 -8.201 1.00 0.00 H new ATOM 0 HG22 THR A 68 65.543 -8.230 -7.062 1.00 0.00 H new ATOM 0 HG23 THR A 68 67.222 -8.269 -7.650 1.00 0.00 H new ATOM 1008 N THR A 69 68.215 -6.916 -5.899 1.00 0.00 N ATOM 1009 CA THR A 69 69.313 -6.039 -6.298 1.00 0.00 C ATOM 1010 C THR A 69 69.348 -4.823 -5.368 1.00 0.00 C ATOM 1011 O THR A 69 68.407 -4.601 -4.605 1.00 0.00 O ATOM 1012 CB THR A 69 69.126 -5.556 -7.750 1.00 0.00 C ATOM 1013 OG1 THR A 69 67.800 -5.835 -8.181 1.00 0.00 O ATOM 1014 CG2 THR A 69 70.118 -6.269 -8.670 1.00 0.00 C ATOM 0 H THR A 69 67.285 -6.528 -6.059 1.00 0.00 H new ATOM 0 HA THR A 69 70.247 -6.596 -6.231 1.00 0.00 H new ATOM 0 HB THR A 69 69.305 -4.482 -7.791 1.00 0.00 H new ATOM 0 HG1 THR A 69 67.684 -5.525 -9.103 1.00 0.00 H new ATOM 0 HG21 THR A 69 69.979 -5.922 -9.694 1.00 0.00 H new ATOM 0 HG22 THR A 69 71.136 -6.049 -8.347 1.00 0.00 H new ATOM 0 HG23 THR A 69 69.947 -7.345 -8.625 1.00 0.00 H new ATOM 1022 N PRO A 70 70.408 -4.005 -5.423 1.00 0.00 N ATOM 1023 CA PRO A 70 70.493 -2.811 -4.565 1.00 0.00 C ATOM 1024 C PRO A 70 69.477 -1.764 -4.991 1.00 0.00 C ATOM 1025 O PRO A 70 68.843 -1.115 -4.160 1.00 0.00 O ATOM 1026 CB PRO A 70 71.924 -2.339 -4.787 1.00 0.00 C ATOM 1027 CG PRO A 70 72.361 -2.905 -6.125 1.00 0.00 C ATOM 1028 CD PRO A 70 71.560 -4.191 -6.336 1.00 0.00 C ATOM 0 HA PRO A 70 70.271 -3.007 -3.516 1.00 0.00 H new ATOM 0 HB2 PRO A 70 71.977 -1.250 -4.790 1.00 0.00 H new ATOM 0 HB3 PRO A 70 72.576 -2.688 -3.986 1.00 0.00 H new ATOM 0 HG2 PRO A 70 72.170 -2.193 -6.928 1.00 0.00 H new ATOM 0 HG3 PRO A 70 73.432 -3.110 -6.128 1.00 0.00 H new ATOM 0 HD2 PRO A 70 71.242 -4.306 -7.372 1.00 0.00 H new ATOM 0 HD3 PRO A 70 72.141 -5.077 -6.081 1.00 0.00 H new ATOM 1036 N ARG A 71 69.306 -1.631 -6.305 1.00 0.00 N ATOM 1037 CA ARG A 71 68.334 -0.685 -6.842 1.00 0.00 C ATOM 1038 C ARG A 71 66.926 -1.020 -6.337 1.00 0.00 C ATOM 1039 O ARG A 71 66.050 -0.156 -6.292 1.00 0.00 O ATOM 1040 CB ARG A 71 68.335 -0.726 -8.370 1.00 0.00 C ATOM 1041 CG ARG A 71 69.729 -0.375 -8.890 1.00 0.00 C ATOM 1042 CD ARG A 71 69.812 1.128 -9.154 1.00 0.00 C ATOM 1043 NE ARG A 71 70.869 1.422 -10.122 1.00 0.00 N ATOM 1044 CZ ARG A 71 70.959 2.607 -10.744 1.00 0.00 C ATOM 1045 NH1 ARG A 71 70.097 3.566 -10.507 1.00 0.00 N ATOM 1046 NH2 ARG A 71 71.923 2.809 -11.600 1.00 0.00 N ATOM 0 H ARG A 71 69.821 -2.160 -7.009 1.00 0.00 H new ATOM 0 HA ARG A 71 68.615 0.313 -6.505 1.00 0.00 H new ATOM 0 HB2 ARG A 71 68.045 -1.717 -8.718 1.00 0.00 H new ATOM 0 HB3 ARG A 71 67.601 -0.023 -8.763 1.00 0.00 H new ATOM 0 HG2 ARG A 71 70.485 -0.669 -8.162 1.00 0.00 H new ATOM 0 HG3 ARG A 71 69.937 -0.928 -9.806 1.00 0.00 H new ATOM 0 HD2 ARG A 71 68.855 1.490 -9.530 1.00 0.00 H new ATOM 0 HD3 ARG A 71 70.008 1.657 -8.221 1.00 0.00 H new ATOM 0 HE ARG A 71 71.560 0.702 -10.331 1.00 0.00 H new ATOM 0 HH11 ARG A 71 69.340 3.418 -9.839 1.00 0.00 H new ATOM 0 HH12 ARG A 71 70.183 4.460 -10.991 1.00 0.00 H new ATOM 0 HH21 ARG A 71 72.599 2.069 -11.791 1.00 0.00 H new ATOM 0 HH22 ARG A 71 72.000 3.706 -12.078 1.00 0.00 H new ATOM 1060 N ALA A 72 66.716 -2.284 -5.949 1.00 0.00 N ATOM 1061 CA ALA A 72 65.413 -2.707 -5.444 1.00 0.00 C ATOM 1062 C ALA A 72 65.156 -2.078 -4.082 1.00 0.00 C ATOM 1063 O ALA A 72 64.150 -1.404 -3.868 1.00 0.00 O ATOM 1064 CB ALA A 72 65.353 -4.229 -5.313 1.00 0.00 C ATOM 0 H ALA A 72 67.423 -3.019 -5.976 1.00 0.00 H new ATOM 0 HA ALA A 72 64.650 -2.381 -6.151 1.00 0.00 H new ATOM 0 HB1 ALA A 72 64.374 -4.523 -4.935 1.00 0.00 H new ATOM 0 HB2 ALA A 72 65.517 -4.685 -6.289 1.00 0.00 H new ATOM 0 HB3 ALA A 72 66.125 -4.565 -4.621 1.00 0.00 H new ATOM 1070 N LEU A 73 66.093 -2.301 -3.163 1.00 0.00 N ATOM 1071 CA LEU A 73 65.981 -1.746 -1.811 1.00 0.00 C ATOM 1072 C LEU A 73 65.832 -0.231 -1.874 1.00 0.00 C ATOM 1073 O LEU A 73 64.959 0.351 -1.232 1.00 0.00 O ATOM 1074 CB LEU A 73 67.225 -2.077 -0.984 1.00 0.00 C ATOM 1075 CG LEU A 73 67.598 -3.556 -0.927 1.00 0.00 C ATOM 1076 CD1 LEU A 73 69.036 -3.702 -0.427 1.00 0.00 C ATOM 1077 CD2 LEU A 73 66.651 -4.283 0.031 1.00 0.00 C ATOM 0 H LEU A 73 66.933 -2.857 -3.325 1.00 0.00 H new ATOM 0 HA LEU A 73 65.103 -2.189 -1.341 1.00 0.00 H new ATOM 0 HB2 LEU A 73 68.070 -1.522 -1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 73 67.070 -1.719 0.034 1.00 0.00 H new ATOM 0 HG LEU A 73 67.514 -3.990 -1.923 1.00 0.00 H new ATOM 0 HD11 LEU A 73 69.302 -4.758 -0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 73 69.712 -3.184 -1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 73 69.121 -3.268 0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 73 66.916 -5.339 0.073 1.00 0.00 H new ATOM 0 HD22 LEU A 73 66.736 -3.848 1.027 1.00 0.00 H new ATOM 0 HD23 LEU A 73 65.625 -4.180 -0.323 1.00 0.00 H new ATOM 1089 N ILE A 74 66.695 0.401 -2.667 1.00 0.00 N ATOM 1090 CA ILE A 74 66.650 1.856 -2.821 1.00 0.00 C ATOM 1091 C ILE A 74 65.280 2.283 -3.346 1.00 0.00 C ATOM 1092 O ILE A 74 64.754 3.328 -2.969 1.00 0.00 O ATOM 1093 CB ILE A 74 67.739 2.332 -3.794 1.00 0.00 C ATOM 1094 CG1 ILE A 74 69.113 1.889 -3.285 1.00 0.00 C ATOM 1095 CG2 ILE A 74 67.717 3.862 -3.897 1.00 0.00 C ATOM 1096 CD1 ILE A 74 70.176 2.205 -4.341 1.00 0.00 C ATOM 0 H ILE A 74 67.425 -0.063 -3.207 1.00 0.00 H new ATOM 0 HA ILE A 74 66.826 2.309 -1.845 1.00 0.00 H new ATOM 0 HB ILE A 74 67.549 1.897 -4.775 1.00 0.00 H new ATOM 0 HG12 ILE A 74 69.349 2.401 -2.352 1.00 0.00 H new ATOM 0 HG13 ILE A 74 69.106 0.820 -3.070 1.00 0.00 H new ATOM 0 HG21 ILE A 74 68.492 4.191 -4.589 1.00 0.00 H new ATOM 0 HG22 ILE A 74 66.743 4.188 -4.262 1.00 0.00 H new ATOM 0 HG23 ILE A 74 67.900 4.296 -2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 74 71.154 1.889 -3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 74 69.942 1.673 -5.263 1.00 0.00 H new ATOM 0 HD13 ILE A 74 70.189 3.278 -4.534 1.00 0.00 H new ATOM 1108 N GLU A 75 64.711 1.458 -4.220 1.00 0.00 N ATOM 1109 CA GLU A 75 63.403 1.755 -4.791 1.00 0.00 C ATOM 1110 C GLU A 75 62.326 1.720 -3.713 1.00 0.00 C ATOM 1111 O GLU A 75 61.582 2.682 -3.526 1.00 0.00 O ATOM 1112 CB GLU A 75 63.052 0.744 -5.883 1.00 0.00 C ATOM 1113 CG GLU A 75 63.592 1.237 -7.228 1.00 0.00 C ATOM 1114 CD GLU A 75 62.713 2.370 -7.744 1.00 0.00 C ATOM 1115 OE1 GLU A 75 62.880 3.484 -7.273 1.00 0.00 O ATOM 1116 OE2 GLU A 75 61.886 2.110 -8.602 1.00 0.00 O ATOM 0 H GLU A 75 65.131 0.587 -4.545 1.00 0.00 H new ATOM 0 HA GLU A 75 63.447 2.754 -5.224 1.00 0.00 H new ATOM 0 HB2 GLU A 75 63.479 -0.230 -5.643 1.00 0.00 H new ATOM 0 HB3 GLU A 75 61.971 0.613 -5.939 1.00 0.00 H new ATOM 0 HG2 GLU A 75 64.620 1.582 -7.115 1.00 0.00 H new ATOM 0 HG3 GLU A 75 63.608 0.418 -7.948 1.00 0.00 H new ATOM 1123 N MET A 76 62.252 0.598 -3.007 1.00 0.00 N ATOM 1124 CA MET A 76 61.264 0.440 -1.949 1.00 0.00 C ATOM 1125 C MET A 76 61.496 1.467 -0.844 1.00 0.00 C ATOM 1126 O MET A 76 60.549 2.002 -0.266 1.00 0.00 O ATOM 1127 CB MET A 76 61.331 -0.969 -1.355 1.00 0.00 C ATOM 1128 CG MET A 76 62.749 -1.258 -0.856 1.00 0.00 C ATOM 1129 SD MET A 76 62.806 -2.909 -0.115 1.00 0.00 S ATOM 1130 CE MET A 76 63.710 -2.451 1.384 1.00 0.00 C ATOM 0 H MET A 76 62.859 -0.209 -3.147 1.00 0.00 H new ATOM 0 HA MET A 76 60.277 0.597 -2.384 1.00 0.00 H new ATOM 0 HB2 MET A 76 60.621 -1.060 -0.533 1.00 0.00 H new ATOM 0 HB3 MET A 76 61.044 -1.704 -2.107 1.00 0.00 H new ATOM 0 HG2 MET A 76 63.456 -1.195 -1.683 1.00 0.00 H new ATOM 0 HG3 MET A 76 63.047 -0.509 -0.123 1.00 0.00 H new ATOM 0 HE1 MET A 76 63.860 -3.336 2.003 1.00 0.00 H new ATOM 0 HE2 MET A 76 64.678 -2.030 1.111 1.00 0.00 H new ATOM 0 HE3 MET A 76 63.137 -1.711 1.942 1.00 0.00 H new ATOM 1140 N THR A 77 62.766 1.741 -0.557 1.00 0.00 N ATOM 1141 CA THR A 77 63.100 2.711 0.481 1.00 0.00 C ATOM 1142 C THR A 77 62.778 4.123 0.001 1.00 0.00 C ATOM 1143 O THR A 77 62.266 4.944 0.757 1.00 0.00 O ATOM 1144 CB THR A 77 64.580 2.623 0.857 1.00 0.00 C ATOM 1145 OG1 THR A 77 64.933 1.263 1.064 1.00 0.00 O ATOM 1146 CG2 THR A 77 64.826 3.412 2.144 1.00 0.00 C ATOM 0 H THR A 77 63.568 1.313 -1.020 1.00 0.00 H new ATOM 0 HA THR A 77 62.503 2.481 1.363 1.00 0.00 H new ATOM 0 HB THR A 77 65.186 3.040 0.052 1.00 0.00 H new ATOM 0 HG1 THR A 77 65.352 0.907 0.253 1.00 0.00 H new ATOM 0 HG21 THR A 77 65.880 3.350 2.413 1.00 0.00 H new ATOM 0 HG22 THR A 77 64.552 4.456 1.989 1.00 0.00 H new ATOM 0 HG23 THR A 77 64.221 2.994 2.949 1.00 0.00 H new ATOM 1154 N ASN A 78 63.061 4.395 -1.271 1.00 0.00 N ATOM 1155 CA ASN A 78 62.760 5.713 -1.825 1.00 0.00 C ATOM 1156 C ASN A 78 61.247 5.894 -1.890 1.00 0.00 C ATOM 1157 O ASN A 78 60.731 6.998 -1.714 1.00 0.00 O ATOM 1158 CB ASN A 78 63.355 5.878 -3.226 1.00 0.00 C ATOM 1159 CG ASN A 78 64.767 6.448 -3.112 1.00 0.00 C ATOM 1160 OD1 ASN A 78 65.017 7.598 -3.463 1.00 0.00 O ATOM 1161 ND2 ASN A 78 65.717 5.707 -2.629 1.00 0.00 N ATOM 0 H ASN A 78 63.488 3.738 -1.924 1.00 0.00 H new ATOM 0 HA ASN A 78 63.205 6.469 -1.178 1.00 0.00 H new ATOM 0 HB2 ASN A 78 63.379 4.916 -3.739 1.00 0.00 H new ATOM 0 HB3 ASN A 78 62.730 6.542 -3.823 1.00 0.00 H new ATOM 0 HD21 ASN A 78 66.662 6.081 -2.543 1.00 0.00 H new ATOM 0 HD22 ASN A 78 65.518 4.751 -2.335 1.00 0.00 H new ATOM 1168 N ALA A 79 60.542 4.785 -2.123 1.00 0.00 N ATOM 1169 CA ALA A 79 59.084 4.812 -2.187 1.00 0.00 C ATOM 1170 C ALA A 79 58.523 5.254 -0.839 1.00 0.00 C ATOM 1171 O ALA A 79 57.543 5.995 -0.764 1.00 0.00 O ATOM 1172 CB ALA A 79 58.541 3.423 -2.527 1.00 0.00 C ATOM 0 H ALA A 79 60.956 3.864 -2.269 1.00 0.00 H new ATOM 0 HA ALA A 79 58.780 5.514 -2.964 1.00 0.00 H new ATOM 0 HB1 ALA A 79 57.452 3.459 -2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 79 58.933 3.105 -3.493 1.00 0.00 H new ATOM 0 HB3 ALA A 79 58.850 2.714 -1.759 1.00 0.00 H new ATOM 1178 N SER A 80 59.175 4.797 0.226 1.00 0.00 N ATOM 1179 CA SER A 80 58.767 5.151 1.575 1.00 0.00 C ATOM 1180 C SER A 80 59.181 6.589 1.866 1.00 0.00 C ATOM 1181 O SER A 80 58.428 7.366 2.452 1.00 0.00 O ATOM 1182 CB SER A 80 59.421 4.216 2.587 1.00 0.00 C ATOM 1183 OG SER A 80 60.801 4.524 2.686 1.00 0.00 O ATOM 0 H SER A 80 59.987 4.182 0.178 1.00 0.00 H new ATOM 0 HA SER A 80 57.684 5.055 1.657 1.00 0.00 H new ATOM 0 HB2 SER A 80 58.942 4.323 3.560 1.00 0.00 H new ATOM 0 HB3 SER A 80 59.289 3.179 2.279 1.00 0.00 H new ATOM 0 HG SER A 80 61.208 4.491 1.795 1.00 0.00 H new ATOM 1189 N LEU A 81 60.388 6.930 1.427 1.00 0.00 N ATOM 1190 CA LEU A 81 60.918 8.273 1.613 1.00 0.00 C ATOM 1191 C LEU A 81 60.029 9.296 0.915 1.00 0.00 C ATOM 1192 O LEU A 81 59.637 10.306 1.498 1.00 0.00 O ATOM 1193 CB LEU A 81 62.328 8.359 1.018 1.00 0.00 C ATOM 1194 CG LEU A 81 63.498 7.818 1.879 1.00 0.00 C ATOM 1195 CD1 LEU A 81 63.013 6.877 2.991 1.00 0.00 C ATOM 1196 CD2 LEU A 81 64.488 7.060 0.988 1.00 0.00 C ATOM 0 H LEU A 81 61.017 6.293 0.939 1.00 0.00 H new ATOM 0 HA LEU A 81 60.948 8.487 2.681 1.00 0.00 H new ATOM 0 HB2 LEU A 81 62.328 7.819 0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 81 62.534 9.404 0.788 1.00 0.00 H new ATOM 0 HG LEU A 81 63.979 8.677 2.346 1.00 0.00 H new ATOM 0 HD11 LEU A 81 63.868 6.524 3.567 1.00 0.00 H new ATOM 0 HD12 LEU A 81 62.329 7.413 3.649 1.00 0.00 H new ATOM 0 HD13 LEU A 81 62.497 6.025 2.548 1.00 0.00 H new ATOM 0 HD21 LEU A 81 65.309 6.681 1.597 1.00 0.00 H new ATOM 0 HD22 LEU A 81 63.979 6.226 0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 81 64.882 7.733 0.227 1.00 0.00 H new ATOM 1208 N THR A 82 59.720 9.019 -0.350 1.00 0.00 N ATOM 1209 CA THR A 82 58.878 9.922 -1.132 1.00 0.00 C ATOM 1210 C THR A 82 57.425 9.838 -0.670 1.00 0.00 C ATOM 1211 O THR A 82 56.683 10.819 -0.724 1.00 0.00 O ATOM 1212 CB THR A 82 58.957 9.581 -2.625 1.00 0.00 C ATOM 1213 OG1 THR A 82 58.113 10.459 -3.355 1.00 0.00 O ATOM 1214 CG2 THR A 82 58.513 8.134 -2.860 1.00 0.00 C ATOM 0 H THR A 82 60.035 8.188 -0.850 1.00 0.00 H new ATOM 0 HA THR A 82 59.245 10.937 -0.978 1.00 0.00 H new ATOM 0 HB THR A 82 59.987 9.695 -2.962 1.00 0.00 H new ATOM 0 HG1 THR A 82 58.164 10.243 -4.310 1.00 0.00 H new ATOM 0 HG21 THR A 82 58.573 7.903 -3.924 1.00 0.00 H new ATOM 0 HG22 THR A 82 59.164 7.459 -2.305 1.00 0.00 H new ATOM 0 HG23 THR A 82 57.485 8.009 -2.519 1.00 0.00 H new ATOM 1222 N GLY A 83 57.029 8.652 -0.215 1.00 0.00 N ATOM 1223 CA GLY A 83 55.663 8.444 0.258 1.00 0.00 C ATOM 1224 C GLY A 83 55.346 9.367 1.431 1.00 0.00 C ATOM 1225 O GLY A 83 54.202 9.778 1.627 1.00 0.00 O ATOM 0 H GLY A 83 57.628 7.828 -0.164 1.00 0.00 H new ATOM 0 HA2 GLY A 83 54.961 8.628 -0.555 1.00 0.00 H new ATOM 0 HA3 GLY A 83 55.533 7.405 0.562 1.00 0.00 H new ATOM 1229 N ALA A 84 56.377 9.689 2.211 1.00 0.00 N ATOM 1230 CA ALA A 84 56.204 10.567 3.367 1.00 0.00 C ATOM 1231 C ALA A 84 55.235 9.942 4.372 1.00 0.00 C ATOM 1232 O ALA A 84 54.164 10.483 4.654 1.00 0.00 O ATOM 1233 CB ALA A 84 55.671 11.936 2.928 1.00 0.00 C ATOM 0 H ALA A 84 57.331 9.359 2.066 1.00 0.00 H new ATOM 0 HA ALA A 84 57.177 10.698 3.841 1.00 0.00 H new ATOM 0 HB1 ALA A 84 55.549 12.576 3.802 1.00 0.00 H new ATOM 0 HB2 ALA A 84 56.377 12.397 2.237 1.00 0.00 H new ATOM 0 HB3 ALA A 84 54.708 11.810 2.433 1.00 0.00 H new ATOM 1239 N SER A 85 55.627 8.790 4.909 1.00 0.00 N ATOM 1240 CA SER A 85 54.794 8.092 5.885 1.00 0.00 C ATOM 1241 C SER A 85 55.556 7.909 7.204 1.00 0.00 C ATOM 1242 O SER A 85 56.063 6.822 7.488 1.00 0.00 O ATOM 1243 CB SER A 85 54.376 6.722 5.348 1.00 0.00 C ATOM 1244 OG SER A 85 53.917 6.861 4.009 1.00 0.00 O ATOM 0 H SER A 85 56.507 8.323 4.688 1.00 0.00 H new ATOM 0 HA SER A 85 53.903 8.695 6.064 1.00 0.00 H new ATOM 0 HB2 SER A 85 55.219 6.032 5.386 1.00 0.00 H new ATOM 0 HB3 SER A 85 53.589 6.299 5.972 1.00 0.00 H new ATOM 0 HG SER A 85 53.650 5.984 3.662 1.00 0.00 H new ATOM 1250 N PRO A 86 55.650 8.967 8.029 1.00 0.00 N ATOM 1251 CA PRO A 86 56.362 8.889 9.317 1.00 0.00 C ATOM 1252 C PRO A 86 55.503 8.292 10.429 1.00 0.00 C ATOM 1253 O PRO A 86 54.389 7.824 10.190 1.00 0.00 O ATOM 1254 CB PRO A 86 56.675 10.352 9.604 1.00 0.00 C ATOM 1255 CG PRO A 86 55.655 11.187 8.837 1.00 0.00 C ATOM 1256 CD PRO A 86 55.062 10.296 7.740 1.00 0.00 C ATOM 0 HA PRO A 86 57.237 8.241 9.272 1.00 0.00 H new ATOM 0 HB2 PRO A 86 56.615 10.556 10.673 1.00 0.00 H new ATOM 0 HB3 PRO A 86 57.689 10.598 9.289 1.00 0.00 H new ATOM 0 HG2 PRO A 86 54.872 11.545 9.505 1.00 0.00 H new ATOM 0 HG3 PRO A 86 56.129 12.067 8.402 1.00 0.00 H new ATOM 0 HD2 PRO A 86 53.973 10.273 7.785 1.00 0.00 H new ATOM 0 HD3 PRO A 86 55.333 10.648 6.745 1.00 0.00 H new ATOM 1264 N SER A 87 56.034 8.315 11.648 1.00 0.00 N ATOM 1265 CA SER A 87 55.310 7.774 12.795 1.00 0.00 C ATOM 1266 C SER A 87 55.477 8.684 14.007 1.00 0.00 C ATOM 1267 O SER A 87 54.500 9.158 14.587 1.00 0.00 O ATOM 1268 CB SER A 87 55.826 6.379 13.145 1.00 0.00 C ATOM 1269 OG SER A 87 57.243 6.357 13.021 1.00 0.00 O ATOM 0 H SER A 87 56.954 8.698 11.867 1.00 0.00 H new ATOM 0 HA SER A 87 54.255 7.713 12.528 1.00 0.00 H new ATOM 0 HB2 SER A 87 55.534 6.115 14.162 1.00 0.00 H new ATOM 0 HB3 SER A 87 55.380 5.637 12.483 1.00 0.00 H new ATOM 0 HG SER A 87 57.577 5.464 13.247 1.00 0.00 H new ATOM 1275 N ALA A 88 56.731 8.925 14.383 1.00 0.00 N ATOM 1276 CA ALA A 88 57.022 9.781 15.529 1.00 0.00 C ATOM 1277 C ALA A 88 58.529 9.933 15.712 1.00 0.00 C ATOM 1278 O ALA A 88 59.038 11.036 15.910 1.00 0.00 O ATOM 1279 CB ALA A 88 56.423 9.190 16.807 1.00 0.00 C ATOM 0 H ALA A 88 57.554 8.544 13.916 1.00 0.00 H new ATOM 0 HA ALA A 88 56.578 10.758 15.339 1.00 0.00 H new ATOM 0 HB1 ALA A 88 56.650 9.842 17.651 1.00 0.00 H new ATOM 0 HB2 ALA A 88 55.342 9.104 16.696 1.00 0.00 H new ATOM 0 HB3 ALA A 88 56.849 8.203 16.986 1.00 0.00 H new ATOM 1285 N GLY A 89 59.237 8.808 15.644 1.00 0.00 N ATOM 1286 CA GLY A 89 60.688 8.822 15.802 1.00 0.00 C ATOM 1287 C GLY A 89 61.354 9.535 14.632 1.00 0.00 C ATOM 1288 O GLY A 89 60.692 9.951 13.681 1.00 0.00 O ATOM 0 H GLY A 89 58.835 7.885 15.482 1.00 0.00 H new ATOM 0 HA2 GLY A 89 60.952 9.320 16.735 1.00 0.00 H new ATOM 0 HA3 GLY A 89 61.061 7.800 15.870 1.00 0.00 H new ATOM 1292 N GLY A 90 62.675 9.672 14.711 1.00 0.00 N ATOM 1293 CA GLY A 90 63.428 10.338 13.652 1.00 0.00 C ATOM 1294 C GLY A 90 63.159 11.838 13.658 1.00 0.00 C ATOM 1295 O GLY A 90 62.022 12.280 13.490 1.00 0.00 O ATOM 0 H GLY A 90 63.242 9.334 15.489 1.00 0.00 H new ATOM 0 HA2 GLY A 90 64.494 10.155 13.787 1.00 0.00 H new ATOM 0 HA3 GLY A 90 63.152 9.918 12.684 1.00 0.00 H new ATOM 1299 N ALA A 91 64.219 12.617 13.854 1.00 0.00 N ATOM 1300 CA ALA A 91 64.088 14.071 13.881 1.00 0.00 C ATOM 1301 C ALA A 91 65.240 14.723 13.125 1.00 0.00 C ATOM 1302 O ALA A 91 65.059 15.271 12.037 1.00 0.00 O ATOM 1303 CB ALA A 91 64.083 14.582 15.323 1.00 0.00 C ATOM 0 H ALA A 91 65.168 12.271 13.995 1.00 0.00 H new ATOM 0 HA ALA A 91 63.145 14.333 13.402 1.00 0.00 H new ATOM 0 HB1 ALA A 91 63.985 15.668 15.324 1.00 0.00 H new ATOM 0 HB2 ALA A 91 63.245 14.141 15.862 1.00 0.00 H new ATOM 0 HB3 ALA A 91 65.016 14.302 15.812 1.00 0.00 H new ATOM 1309 N ALA A 92 66.428 14.657 13.715 1.00 0.00 N ATOM 1310 CA ALA A 92 67.612 15.243 13.094 1.00 0.00 C ATOM 1311 C ALA A 92 68.880 14.652 13.701 1.00 0.00 C ATOM 1312 O ALA A 92 68.825 13.850 14.633 1.00 0.00 O ATOM 1313 CB ALA A 92 67.625 16.760 13.292 1.00 0.00 C ATOM 0 H ALA A 92 66.597 14.208 14.615 1.00 0.00 H new ATOM 0 HA ALA A 92 67.580 15.016 12.028 1.00 0.00 H new ATOM 0 HB1 ALA A 92 68.514 17.181 12.823 1.00 0.00 H new ATOM 0 HB2 ALA A 92 66.735 17.194 12.837 1.00 0.00 H new ATOM 0 HB3 ALA A 92 67.635 16.988 14.358 1.00 0.00 H new ATOM 1319 N ARG A 93 70.026 15.057 13.160 1.00 0.00 N ATOM 1320 CA ARG A 93 71.308 14.563 13.653 1.00 0.00 C ATOM 1321 C ARG A 93 72.459 15.275 12.950 1.00 0.00 C ATOM 1322 O ARG A 93 72.613 15.185 11.733 1.00 0.00 O ATOM 1323 CB ARG A 93 71.431 13.057 13.411 1.00 0.00 C ATOM 1324 CG ARG A 93 72.429 12.460 14.405 1.00 0.00 C ATOM 1325 CD ARG A 93 71.691 12.029 15.673 1.00 0.00 C ATOM 1326 NE ARG A 93 71.688 13.111 16.662 1.00 0.00 N ATOM 1327 CZ ARG A 93 70.892 13.087 17.740 1.00 0.00 C ATOM 1328 NH1 ARG A 93 70.073 12.086 17.960 1.00 0.00 N ATOM 1329 NH2 ARG A 93 70.933 14.080 18.587 1.00 0.00 N ATOM 0 H ARG A 93 70.093 15.720 12.387 1.00 0.00 H new ATOM 0 HA ARG A 93 71.356 14.763 14.723 1.00 0.00 H new ATOM 0 HB2 ARG A 93 70.458 12.579 13.525 1.00 0.00 H new ATOM 0 HB3 ARG A 93 71.761 12.868 12.390 1.00 0.00 H new ATOM 0 HG2 ARG A 93 72.936 11.605 13.958 1.00 0.00 H new ATOM 0 HG3 ARG A 93 73.197 13.193 14.650 1.00 0.00 H new ATOM 0 HD2 ARG A 93 70.666 11.751 15.427 1.00 0.00 H new ATOM 0 HD3 ARG A 93 72.168 11.145 16.095 1.00 0.00 H new ATOM 0 HE ARG A 93 72.311 13.907 16.526 1.00 0.00 H new ATOM 0 HH11 ARG A 93 70.033 11.306 17.304 1.00 0.00 H new ATOM 0 HH12 ARG A 93 69.476 12.088 18.787 1.00 0.00 H new ATOM 0 HH21 ARG A 93 71.566 14.863 18.425 1.00 0.00 H new ATOM 0 HH22 ARG A 93 70.332 14.073 19.411 1.00 0.00 H new ATOM 1343 N ASP A 94 73.267 15.984 13.733 1.00 0.00 N ATOM 1344 CA ASP A 94 74.404 16.712 13.179 1.00 0.00 C ATOM 1345 C ASP A 94 75.707 15.983 13.493 1.00 0.00 C ATOM 1346 O ASP A 94 76.453 15.598 12.593 1.00 0.00 O ATOM 1347 CB ASP A 94 74.472 18.126 13.759 1.00 0.00 C ATOM 1348 CG ASP A 94 75.184 19.047 12.775 1.00 0.00 C ATOM 1349 OD1 ASP A 94 74.511 19.601 11.922 1.00 0.00 O ATOM 1350 OD2 ASP A 94 76.391 19.185 12.889 1.00 0.00 O ATOM 0 H ASP A 94 73.158 16.070 14.743 1.00 0.00 H new ATOM 0 HA ASP A 94 74.270 16.771 12.099 1.00 0.00 H new ATOM 0 HB2 ASP A 94 73.467 18.497 13.958 1.00 0.00 H new ATOM 0 HB3 ASP A 94 75.002 18.115 14.711 1.00 0.00 H new ATOM 1355 N LYS A 95 75.970 15.798 14.784 1.00 0.00 N ATOM 1356 CA LYS A 95 77.187 15.113 15.213 1.00 0.00 C ATOM 1357 C LYS A 95 76.840 13.893 16.060 1.00 0.00 C ATOM 1358 O LYS A 95 77.700 13.042 16.217 1.00 0.00 O ATOM 1359 CB LYS A 95 78.071 16.054 16.033 1.00 0.00 C ATOM 1360 CG LYS A 95 78.988 16.841 15.094 1.00 0.00 C ATOM 1361 CD LYS A 95 78.279 18.116 14.636 1.00 0.00 C ATOM 1362 CE LYS A 95 78.629 19.265 15.584 1.00 0.00 C ATOM 1363 NZ LYS A 95 77.839 20.473 15.213 1.00 0.00 N ATOM 1364 OXT LYS A 95 75.720 13.828 16.540 1.00 0.00 O ATOM 0 H LYS A 95 75.365 16.109 15.544 1.00 0.00 H new ATOM 0 HA LYS A 95 77.727 14.795 14.321 1.00 0.00 H new ATOM 0 HB2 LYS A 95 77.452 16.739 16.612 1.00 0.00 H new ATOM 0 HB3 LYS A 95 78.666 15.482 16.745 1.00 0.00 H new ATOM 0 HG2 LYS A 95 79.918 17.093 15.604 1.00 0.00 H new ATOM 0 HG3 LYS A 95 79.253 16.230 14.231 1.00 0.00 H new ATOM 0 HD2 LYS A 95 78.579 18.366 13.618 1.00 0.00 H new ATOM 0 HD3 LYS A 95 77.200 17.959 14.621 1.00 0.00 H new ATOM 0 HE2 LYS A 95 78.415 18.979 16.614 1.00 0.00 H new ATOM 0 HE3 LYS A 95 79.695 19.484 15.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 78.486 21.254 14.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 77.246 20.259 14.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 77.233 20.750 16.011 1.00 0.00 H new TER 1378 LYS A 95