USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 972 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: D 45 HIS : no HD1:sc= -0.338 X(o=-2.1,f=-1.8) USER MOD Set 1.2: D 48 GLN : amide:sc= -1.78 K(o=-2.1,f=-5.6!) USER MOD Set 2.1: B 37 HIS : no HE2:sc= -9.23! C(o=-28!,f=-42!) USER MOD Set 2.2: C 37 HIS : no HD1:sc= -18.6! C(o=-28!,f=-33!) USER MOD Set 3.1: A 45 HIS : no HE2:sc= -0.355 K(o=-5,f=-6.4) USER MOD Set 3.2: A 48 GLN : amide:sc= -4.69! C(o=-5!,f=-5.2!) USER MOD Set 4.1: A 37 HIS : no HD1:sc= -10.7! C(o=-12!,f=-20!) USER MOD Set 4.2: D 37 HIS : no HD1:sc= -1.07! C(o=-12!,f=-20!) USER MOD Single : A 23 SER OG : rot 38:sc= 0.169 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -83:sc= 0.0973 USER MOD Single : A 47 ASN : amide:sc= -3.02! C(o=-3!,f=-15!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 SER OG : rot 22:sc= 0.293 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 HIS : no HD1:sc= -0.737 X(o=-0.74,f=-0.51) USER MOD Single : B 47 ASN : amide:sc= -0.112 X(o=-0.11,f=0) USER MOD Single : B 48 GLN : amide:sc= -5.17! C(o=-5.2!,f=-10!) USER MOD Single : B 50 LYS NZ :NH3+ 153:sc= -0.324 (180deg=-1.04) USER MOD Single : C 23 SER OG : rot -50:sc= 0.402 USER MOD Single : C 31 SER OG : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot -80:sc= 0.698 USER MOD Single : C 45 HIS : no HD1:sc=-0.00191 X(o=-0.0019,f=0) USER MOD Single : C 47 ASN : amide:sc= -10.7! K(o=-11!,f=-1.6) USER MOD Single : C 48 GLN : amide:sc= -1.31 K(o=-1.3,f=-6.6!) USER MOD Single : C 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 23 SER OG : rot 28:sc= 0.0928 USER MOD Single : D 31 SER OG : rot 180:sc= 0 USER MOD Single : D 42 THR OG1 : rot -89:sc= -0.261 USER MOD Single : D 47 ASN : amide:sc= -7.03! C(o=-7!,f=-12!) USER MOD Single : D 50 LYS NZ :NH3+ -153:sc= -0.678 (180deg=-1.38) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 23 75.260 3.826 7.939 1.00 0.00 N ATOM 2 CA SER A 23 75.237 3.302 6.545 1.00 0.00 C ATOM 3 C SER A 23 76.038 4.234 5.641 1.00 0.00 C ATOM 4 O SER A 23 75.974 5.455 5.781 1.00 0.00 O ATOM 5 CB SER A 23 73.790 3.219 6.057 1.00 0.00 C ATOM 6 OG SER A 23 73.035 2.423 6.959 1.00 0.00 O ATOM 0 HA SER A 23 75.681 2.307 6.518 1.00 0.00 H new ATOM 0 HB2 SER A 23 73.360 4.218 5.988 1.00 0.00 H new ATOM 0 HB3 SER A 23 73.756 2.787 5.057 1.00 0.00 H new ATOM 0 HG SER A 23 73.326 2.604 7.877 1.00 0.00 H new ATOM 11 N ASP A 24 76.776 3.661 4.729 1.00 0.00 N ATOM 12 CA ASP A 24 77.581 4.453 3.807 1.00 0.00 C ATOM 13 C ASP A 24 78.193 3.571 2.720 1.00 0.00 C ATOM 14 O ASP A 24 79.413 3.482 2.594 1.00 0.00 O ATOM 15 CB ASP A 24 78.698 5.165 4.573 1.00 0.00 C ATOM 16 CG ASP A 24 79.470 4.161 5.421 1.00 0.00 C ATOM 17 OD1 ASP A 24 80.264 3.425 4.857 1.00 0.00 O ATOM 18 OD2 ASP A 24 79.257 4.142 6.623 1.00 0.00 O ATOM 0 H ASP A 24 76.844 2.652 4.596 1.00 0.00 H new ATOM 0 HA ASP A 24 76.931 5.189 3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 24 79.373 5.658 3.873 1.00 0.00 H new ATOM 0 HB3 ASP A 24 78.275 5.942 5.210 1.00 0.00 H new ATOM 23 N PRO A 25 77.368 2.925 1.937 1.00 0.00 N ATOM 24 CA PRO A 25 77.831 2.033 0.834 1.00 0.00 C ATOM 25 C PRO A 25 78.232 2.825 -0.413 1.00 0.00 C ATOM 26 O PRO A 25 78.482 2.249 -1.472 1.00 0.00 O ATOM 27 CB PRO A 25 76.602 1.160 0.564 1.00 0.00 C ATOM 28 CG PRO A 25 75.439 2.049 0.873 1.00 0.00 C ATOM 29 CD PRO A 25 75.895 2.968 2.016 1.00 0.00 C ATOM 0 HA PRO A 25 78.722 1.462 1.098 1.00 0.00 H new ATOM 0 HB2 PRO A 25 76.577 0.818 -0.471 1.00 0.00 H new ATOM 0 HB3 PRO A 25 76.600 0.270 1.194 1.00 0.00 H new ATOM 0 HG2 PRO A 25 75.150 2.630 -0.002 1.00 0.00 H new ATOM 0 HG3 PRO A 25 74.569 1.463 1.168 1.00 0.00 H new ATOM 0 HD2 PRO A 25 75.517 3.982 1.888 1.00 0.00 H new ATOM 0 HD3 PRO A 25 75.536 2.613 2.982 1.00 0.00 H new ATOM 37 N LEU A 26 78.283 4.121 -0.278 1.00 0.00 N ATOM 38 CA LEU A 26 78.646 4.987 -1.396 1.00 0.00 C ATOM 39 C LEU A 26 80.079 4.714 -1.850 1.00 0.00 C ATOM 40 O LEU A 26 80.354 4.628 -3.048 1.00 0.00 O ATOM 41 CB LEU A 26 78.505 6.456 -0.973 1.00 0.00 C ATOM 42 CG LEU A 26 78.780 7.394 -2.161 1.00 0.00 C ATOM 43 CD1 LEU A 26 77.702 7.218 -3.244 1.00 0.00 C ATOM 44 CD2 LEU A 26 78.773 8.844 -1.660 1.00 0.00 C ATOM 0 H LEU A 26 78.080 4.614 0.591 1.00 0.00 H new ATOM 0 HA LEU A 26 77.976 4.779 -2.230 1.00 0.00 H new ATOM 0 HB2 LEU A 26 77.501 6.634 -0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 26 79.200 6.674 -0.163 1.00 0.00 H new ATOM 0 HG LEU A 26 79.750 7.151 -2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 26 77.911 7.889 -4.078 1.00 0.00 H new ATOM 0 HD12 LEU A 26 77.707 6.187 -3.598 1.00 0.00 H new ATOM 0 HD13 LEU A 26 76.724 7.454 -2.825 1.00 0.00 H new ATOM 0 HD21 LEU A 26 78.967 9.518 -2.494 1.00 0.00 H new ATOM 0 HD22 LEU A 26 77.800 9.074 -1.226 1.00 0.00 H new ATOM 0 HD23 LEU A 26 79.547 8.971 -0.903 1.00 0.00 H new ATOM 56 N VAL A 27 80.972 4.592 -0.906 1.00 0.00 N ATOM 57 CA VAL A 27 82.378 4.344 -1.218 1.00 0.00 C ATOM 58 C VAL A 27 82.588 2.933 -1.766 1.00 0.00 C ATOM 59 O VAL A 27 83.404 2.724 -2.664 1.00 0.00 O ATOM 60 CB VAL A 27 83.229 4.533 0.039 1.00 0.00 C ATOM 61 CG1 VAL A 27 82.833 3.492 1.087 1.00 0.00 C ATOM 62 CG2 VAL A 27 84.707 4.362 -0.318 1.00 0.00 C ATOM 0 H VAL A 27 80.764 4.658 0.090 1.00 0.00 H new ATOM 0 HA VAL A 27 82.682 5.057 -1.984 1.00 0.00 H new ATOM 0 HB VAL A 27 83.065 5.532 0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 27 83.440 3.628 1.982 1.00 0.00 H new ATOM 0 HG12 VAL A 27 81.780 3.614 1.341 1.00 0.00 H new ATOM 0 HG13 VAL A 27 82.996 2.492 0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 27 85.315 4.496 0.576 1.00 0.00 H new ATOM 0 HG22 VAL A 27 84.871 3.363 -0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 27 84.989 5.105 -1.064 1.00 0.00 H new ATOM 72 N VAL A 28 81.868 1.988 -1.228 1.00 0.00 N ATOM 73 CA VAL A 28 81.991 0.602 -1.671 1.00 0.00 C ATOM 74 C VAL A 28 81.484 0.447 -3.103 1.00 0.00 C ATOM 75 O VAL A 28 82.088 -0.252 -3.916 1.00 0.00 O ATOM 76 CB VAL A 28 81.194 -0.316 -0.742 1.00 0.00 C ATOM 77 CG1 VAL A 28 81.260 -1.753 -1.261 1.00 0.00 C ATOM 78 CG2 VAL A 28 81.788 -0.256 0.668 1.00 0.00 C ATOM 0 H VAL A 28 81.188 2.138 -0.483 1.00 0.00 H new ATOM 0 HA VAL A 28 83.044 0.324 -1.640 1.00 0.00 H new ATOM 0 HB VAL A 28 80.155 0.012 -0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 28 80.692 -2.406 -0.598 1.00 0.00 H new ATOM 0 HG12 VAL A 28 80.836 -1.797 -2.264 1.00 0.00 H new ATOM 0 HG13 VAL A 28 82.299 -2.082 -1.291 1.00 0.00 H new ATOM 0 HG21 VAL A 28 81.220 -0.910 1.330 1.00 0.00 H new ATOM 0 HG22 VAL A 28 82.827 -0.583 0.639 1.00 0.00 H new ATOM 0 HG23 VAL A 28 81.740 0.767 1.040 1.00 0.00 H new ATOM 88 N ALA A 29 80.387 1.086 -3.391 1.00 0.00 N ATOM 89 CA ALA A 29 79.793 1.009 -4.723 1.00 0.00 C ATOM 90 C ALA A 29 80.837 1.282 -5.805 1.00 0.00 C ATOM 91 O ALA A 29 80.885 0.590 -6.821 1.00 0.00 O ATOM 92 CB ALA A 29 78.655 2.024 -4.846 1.00 0.00 C ATOM 0 H ALA A 29 79.874 1.670 -2.731 1.00 0.00 H new ATOM 0 HA ALA A 29 79.403 0.001 -4.862 1.00 0.00 H new ATOM 0 HB1 ALA A 29 78.217 1.961 -5.842 1.00 0.00 H new ATOM 0 HB2 ALA A 29 77.891 1.807 -4.099 1.00 0.00 H new ATOM 0 HB3 ALA A 29 79.045 3.029 -4.684 1.00 0.00 H new ATOM 98 N ALA A 30 81.649 2.282 -5.590 1.00 0.00 N ATOM 99 CA ALA A 30 82.679 2.644 -6.561 1.00 0.00 C ATOM 100 C ALA A 30 83.627 1.475 -6.831 1.00 0.00 C ATOM 101 O ALA A 30 84.107 1.304 -7.952 1.00 0.00 O ATOM 102 CB ALA A 30 83.482 3.840 -6.045 1.00 0.00 C ATOM 0 H ALA A 30 81.627 2.868 -4.755 1.00 0.00 H new ATOM 0 HA ALA A 30 82.181 2.905 -7.495 1.00 0.00 H new ATOM 0 HB1 ALA A 30 84.248 4.105 -6.773 1.00 0.00 H new ATOM 0 HB2 ALA A 30 82.815 4.689 -5.895 1.00 0.00 H new ATOM 0 HB3 ALA A 30 83.956 3.579 -5.099 1.00 0.00 H new ATOM 108 N SER A 31 83.896 0.695 -5.820 1.00 0.00 N ATOM 109 CA SER A 31 84.799 -0.443 -5.969 1.00 0.00 C ATOM 110 C SER A 31 84.266 -1.434 -7.002 1.00 0.00 C ATOM 111 O SER A 31 85.021 -1.947 -7.829 1.00 0.00 O ATOM 112 CB SER A 31 84.975 -1.153 -4.625 1.00 0.00 C ATOM 113 OG SER A 31 85.900 -2.221 -4.776 1.00 0.00 O ATOM 0 H SER A 31 83.511 0.815 -4.883 1.00 0.00 H new ATOM 0 HA SER A 31 85.762 -0.066 -6.313 1.00 0.00 H new ATOM 0 HB2 SER A 31 85.333 -0.450 -3.873 1.00 0.00 H new ATOM 0 HB3 SER A 31 84.016 -1.534 -4.274 1.00 0.00 H new ATOM 0 HG SER A 31 86.016 -2.677 -3.916 1.00 0.00 H new ATOM 119 N ILE A 32 82.990 -1.701 -6.945 1.00 0.00 N ATOM 120 CA ILE A 32 82.370 -2.639 -7.875 1.00 0.00 C ATOM 121 C ILE A 32 82.677 -2.261 -9.323 1.00 0.00 C ATOM 122 O ILE A 32 82.887 -3.131 -10.169 1.00 0.00 O ATOM 123 CB ILE A 32 80.855 -2.659 -7.665 1.00 0.00 C ATOM 124 CG1 ILE A 32 80.548 -2.971 -6.198 1.00 0.00 C ATOM 125 CG2 ILE A 32 80.228 -3.735 -8.553 1.00 0.00 C ATOM 126 CD1 ILE A 32 79.051 -2.782 -5.941 1.00 0.00 C ATOM 0 H ILE A 32 82.348 -1.288 -6.268 1.00 0.00 H new ATOM 0 HA ILE A 32 82.782 -3.629 -7.679 1.00 0.00 H new ATOM 0 HB ILE A 32 80.441 -1.685 -7.927 1.00 0.00 H new ATOM 0 HG12 ILE A 32 80.842 -3.994 -5.963 1.00 0.00 H new ATOM 0 HG13 ILE A 32 81.126 -2.315 -5.547 1.00 0.00 H new ATOM 0 HG21 ILE A 32 79.149 -3.748 -8.402 1.00 0.00 H new ATOM 0 HG22 ILE A 32 80.446 -3.516 -9.598 1.00 0.00 H new ATOM 0 HG23 ILE A 32 80.642 -4.709 -8.292 1.00 0.00 H new ATOM 0 HD11 ILE A 32 78.830 -3.004 -4.897 1.00 0.00 H new ATOM 0 HD12 ILE A 32 78.771 -1.751 -6.160 1.00 0.00 H new ATOM 0 HD13 ILE A 32 78.484 -3.456 -6.583 1.00 0.00 H new ATOM 138 N ILE A 33 82.696 -0.986 -9.599 1.00 0.00 N ATOM 139 CA ILE A 33 82.973 -0.511 -10.951 1.00 0.00 C ATOM 140 C ILE A 33 84.438 -0.764 -11.307 1.00 0.00 C ATOM 141 O ILE A 33 84.778 -0.960 -12.473 1.00 0.00 O ATOM 142 CB ILE A 33 82.650 0.994 -11.066 1.00 0.00 C ATOM 143 CG1 ILE A 33 81.182 1.236 -10.642 1.00 0.00 C ATOM 144 CG2 ILE A 33 82.860 1.467 -12.519 1.00 0.00 C ATOM 145 CD1 ILE A 33 80.690 2.605 -11.133 1.00 0.00 C ATOM 0 H ILE A 33 82.525 -0.248 -8.915 1.00 0.00 H new ATOM 0 HA ILE A 33 82.341 -1.058 -11.650 1.00 0.00 H new ATOM 0 HB ILE A 33 83.315 1.558 -10.412 1.00 0.00 H new ATOM 0 HG12 ILE A 33 80.547 0.449 -11.049 1.00 0.00 H new ATOM 0 HG13 ILE A 33 81.099 1.183 -9.556 1.00 0.00 H new ATOM 0 HG21 ILE A 33 82.630 2.530 -12.592 1.00 0.00 H new ATOM 0 HG22 ILE A 33 83.897 1.299 -12.810 1.00 0.00 H new ATOM 0 HG23 ILE A 33 82.202 0.907 -13.183 1.00 0.00 H new ATOM 0 HD11 ILE A 33 79.655 2.752 -10.823 1.00 0.00 H new ATOM 0 HD12 ILE A 33 81.313 3.390 -10.705 1.00 0.00 H new ATOM 0 HD13 ILE A 33 80.752 2.645 -12.220 1.00 0.00 H new ATOM 157 N GLY A 34 85.283 -0.750 -10.316 1.00 0.00 N ATOM 158 CA GLY A 34 86.708 -0.966 -10.537 1.00 0.00 C ATOM 159 C GLY A 34 86.995 -2.349 -11.122 1.00 0.00 C ATOM 160 O GLY A 34 87.739 -2.478 -12.087 1.00 0.00 O ATOM 0 H GLY A 34 85.023 -0.592 -9.342 1.00 0.00 H new ATOM 0 HA2 GLY A 34 87.090 -0.201 -11.212 1.00 0.00 H new ATOM 0 HA3 GLY A 34 87.242 -0.854 -9.593 1.00 0.00 H new ATOM 164 N ILE A 35 86.416 -3.362 -10.549 1.00 0.00 N ATOM 165 CA ILE A 35 86.641 -4.721 -11.035 1.00 0.00 C ATOM 166 C ILE A 35 86.231 -4.847 -12.505 1.00 0.00 C ATOM 167 O ILE A 35 86.773 -5.668 -13.244 1.00 0.00 O ATOM 168 CB ILE A 35 85.843 -5.721 -10.190 1.00 0.00 C ATOM 169 CG1 ILE A 35 85.939 -5.339 -8.706 1.00 0.00 C ATOM 170 CG2 ILE A 35 86.414 -7.129 -10.385 1.00 0.00 C ATOM 171 CD1 ILE A 35 87.406 -5.133 -8.313 1.00 0.00 C ATOM 0 H ILE A 35 85.786 -3.291 -9.750 1.00 0.00 H new ATOM 0 HA ILE A 35 87.705 -4.942 -10.949 1.00 0.00 H new ATOM 0 HB ILE A 35 84.800 -5.701 -10.505 1.00 0.00 H new ATOM 0 HG12 ILE A 35 85.372 -4.427 -8.519 1.00 0.00 H new ATOM 0 HG13 ILE A 35 85.495 -6.122 -8.091 1.00 0.00 H new ATOM 0 HG21 ILE A 35 85.846 -7.839 -9.784 1.00 0.00 H new ATOM 0 HG22 ILE A 35 86.345 -7.407 -11.437 1.00 0.00 H new ATOM 0 HG23 ILE A 35 87.458 -7.144 -10.074 1.00 0.00 H new ATOM 0 HD11 ILE A 35 87.466 -4.862 -7.259 1.00 0.00 H new ATOM 0 HD12 ILE A 35 87.961 -6.056 -8.483 1.00 0.00 H new ATOM 0 HD13 ILE A 35 87.836 -4.334 -8.918 1.00 0.00 H new ATOM 183 N LEU A 36 85.274 -4.055 -12.900 1.00 0.00 N ATOM 184 CA LEU A 36 84.773 -4.090 -14.274 1.00 0.00 C ATOM 185 C LEU A 36 85.872 -3.744 -15.288 1.00 0.00 C ATOM 186 O LEU A 36 86.052 -4.447 -16.278 1.00 0.00 O ATOM 187 CB LEU A 36 83.591 -3.109 -14.413 1.00 0.00 C ATOM 188 CG LEU A 36 82.580 -3.614 -15.457 1.00 0.00 C ATOM 189 CD1 LEU A 36 81.500 -2.550 -15.671 1.00 0.00 C ATOM 190 CD2 LEU A 36 83.291 -3.892 -16.787 1.00 0.00 C ATOM 0 H LEU A 36 84.815 -3.370 -12.299 1.00 0.00 H new ATOM 0 HA LEU A 36 84.438 -5.105 -14.490 1.00 0.00 H new ATOM 0 HB2 LEU A 36 83.096 -2.990 -13.449 1.00 0.00 H new ATOM 0 HB3 LEU A 36 83.961 -2.126 -14.705 1.00 0.00 H new ATOM 0 HG LEU A 36 82.125 -4.537 -15.097 1.00 0.00 H new ATOM 0 HD11 LEU A 36 80.782 -2.904 -16.410 1.00 0.00 H new ATOM 0 HD12 LEU A 36 80.986 -2.358 -14.729 1.00 0.00 H new ATOM 0 HD13 LEU A 36 81.962 -1.629 -16.026 1.00 0.00 H new ATOM 0 HD21 LEU A 36 82.567 -4.249 -17.519 1.00 0.00 H new ATOM 0 HD22 LEU A 36 83.753 -2.974 -17.151 1.00 0.00 H new ATOM 0 HD23 LEU A 36 84.059 -4.650 -16.637 1.00 0.00 H new ATOM 202 N HIS A 37 86.578 -2.672 -15.061 1.00 0.00 N ATOM 203 CA HIS A 37 87.624 -2.263 -15.998 1.00 0.00 C ATOM 204 C HIS A 37 88.661 -3.365 -16.214 1.00 0.00 C ATOM 205 O HIS A 37 89.286 -3.427 -17.272 1.00 0.00 O ATOM 206 CB HIS A 37 88.317 -0.974 -15.529 1.00 0.00 C ATOM 207 CG HIS A 37 88.995 -1.183 -14.201 1.00 0.00 C ATOM 208 ND1 HIS A 37 89.785 -2.290 -13.929 1.00 0.00 N ATOM 209 CD2 HIS A 37 89.008 -0.425 -13.054 1.00 0.00 C ATOM 210 CE1 HIS A 37 90.228 -2.173 -12.665 1.00 0.00 C ATOM 211 NE2 HIS A 37 89.787 -1.053 -12.087 1.00 0.00 N ATOM 0 H HIS A 37 86.462 -2.063 -14.251 1.00 0.00 H new ATOM 0 HA HIS A 37 87.133 -2.071 -16.952 1.00 0.00 H new ATOM 0 HB2 HIS A 37 89.051 -0.660 -16.271 1.00 0.00 H new ATOM 0 HB3 HIS A 37 87.584 -0.172 -15.446 1.00 0.00 H new ATOM 0 HD2 HIS A 37 88.492 0.515 -12.923 1.00 0.00 H new ATOM 0 HE1 HIS A 37 90.863 -2.897 -12.176 1.00 0.00 H new ATOM 0 HE2 HIS A 37 89.980 -0.728 -11.140 1.00 0.00 H new ATOM 220 N PHE A 38 88.868 -4.198 -15.229 1.00 0.00 N ATOM 221 CA PHE A 38 89.866 -5.262 -15.339 1.00 0.00 C ATOM 222 C PHE A 38 89.531 -6.276 -16.429 1.00 0.00 C ATOM 223 O PHE A 38 90.383 -6.599 -17.256 1.00 0.00 O ATOM 224 CB PHE A 38 89.992 -5.987 -13.997 1.00 0.00 C ATOM 225 CG PHE A 38 91.007 -7.098 -14.113 1.00 0.00 C ATOM 226 CD1 PHE A 38 92.366 -6.826 -13.922 1.00 0.00 C ATOM 227 CD2 PHE A 38 90.589 -8.400 -14.414 1.00 0.00 C ATOM 228 CE1 PHE A 38 93.309 -7.856 -14.030 1.00 0.00 C ATOM 229 CE2 PHE A 38 91.530 -9.430 -14.522 1.00 0.00 C ATOM 230 CZ PHE A 38 92.891 -9.158 -14.331 1.00 0.00 C ATOM 0 H PHE A 38 88.368 -4.172 -14.340 1.00 0.00 H new ATOM 0 HA PHE A 38 90.809 -4.789 -15.613 1.00 0.00 H new ATOM 0 HB2 PHE A 38 90.294 -5.285 -13.220 1.00 0.00 H new ATOM 0 HB3 PHE A 38 89.025 -6.394 -13.700 1.00 0.00 H new ATOM 0 HD1 PHE A 38 92.688 -5.821 -13.691 1.00 0.00 H new ATOM 0 HD2 PHE A 38 89.540 -8.609 -14.563 1.00 0.00 H new ATOM 0 HE1 PHE A 38 94.358 -7.646 -13.881 1.00 0.00 H new ATOM 0 HE2 PHE A 38 91.207 -10.434 -14.753 1.00 0.00 H new ATOM 0 HZ PHE A 38 93.618 -9.952 -14.416 1.00 0.00 H new ATOM 240 N ILE A 39 88.332 -6.787 -16.429 1.00 0.00 N ATOM 241 CA ILE A 39 87.969 -7.780 -17.434 1.00 0.00 C ATOM 242 C ILE A 39 88.155 -7.219 -18.844 1.00 0.00 C ATOM 243 O ILE A 39 88.585 -7.936 -19.746 1.00 0.00 O ATOM 244 CB ILE A 39 86.526 -8.271 -17.224 1.00 0.00 C ATOM 245 CG1 ILE A 39 86.093 -9.125 -18.424 1.00 0.00 C ATOM 246 CG2 ILE A 39 85.576 -7.080 -17.057 1.00 0.00 C ATOM 247 CD1 ILE A 39 84.828 -9.908 -18.068 1.00 0.00 C ATOM 0 H ILE A 39 87.595 -6.548 -15.766 1.00 0.00 H new ATOM 0 HA ILE A 39 88.635 -8.635 -17.320 1.00 0.00 H new ATOM 0 HB ILE A 39 86.486 -8.876 -16.318 1.00 0.00 H new ATOM 0 HG12 ILE A 39 85.907 -8.488 -19.288 1.00 0.00 H new ATOM 0 HG13 ILE A 39 86.892 -9.812 -18.701 1.00 0.00 H new ATOM 0 HG21 ILE A 39 84.559 -7.444 -16.909 1.00 0.00 H new ATOM 0 HG22 ILE A 39 85.880 -6.491 -16.192 1.00 0.00 H new ATOM 0 HG23 ILE A 39 85.612 -6.457 -17.951 1.00 0.00 H new ATOM 0 HD11 ILE A 39 84.523 -10.513 -18.921 1.00 0.00 H new ATOM 0 HD12 ILE A 39 85.030 -10.557 -17.216 1.00 0.00 H new ATOM 0 HD13 ILE A 39 84.029 -9.212 -17.813 1.00 0.00 H new ATOM 259 N ALA A 40 87.830 -5.969 -19.035 1.00 0.00 N ATOM 260 CA ALA A 40 87.964 -5.352 -20.348 1.00 0.00 C ATOM 261 C ALA A 40 89.433 -5.151 -20.725 1.00 0.00 C ATOM 262 O ALA A 40 89.811 -5.323 -21.883 1.00 0.00 O ATOM 263 CB ALA A 40 87.236 -4.007 -20.362 1.00 0.00 C ATOM 0 H ALA A 40 87.471 -5.351 -18.308 1.00 0.00 H new ATOM 0 HA ALA A 40 87.517 -6.021 -21.083 1.00 0.00 H new ATOM 0 HB1 ALA A 40 87.338 -3.548 -21.345 1.00 0.00 H new ATOM 0 HB2 ALA A 40 86.180 -4.163 -20.142 1.00 0.00 H new ATOM 0 HB3 ALA A 40 87.670 -3.350 -19.608 1.00 0.00 H new ATOM 269 N TRP A 41 90.239 -4.777 -19.764 1.00 0.00 N ATOM 270 CA TRP A 41 91.657 -4.539 -20.024 1.00 0.00 C ATOM 271 C TRP A 41 92.251 -5.706 -20.806 1.00 0.00 C ATOM 272 O TRP A 41 93.143 -5.522 -21.634 1.00 0.00 O ATOM 273 CB TRP A 41 92.411 -4.362 -18.701 1.00 0.00 C ATOM 274 CG TRP A 41 93.750 -3.733 -18.955 1.00 0.00 C ATOM 275 CD1 TRP A 41 94.785 -4.332 -19.591 1.00 0.00 C ATOM 276 CD2 TRP A 41 94.213 -2.401 -18.584 1.00 0.00 C ATOM 277 NE1 TRP A 41 95.848 -3.449 -19.643 1.00 0.00 N ATOM 278 CE2 TRP A 41 95.547 -2.246 -19.035 1.00 0.00 C ATOM 279 CE3 TRP A 41 93.613 -1.322 -17.911 1.00 0.00 C ATOM 280 CZ2 TRP A 41 96.257 -1.064 -18.824 1.00 0.00 C ATOM 281 CZ3 TRP A 41 94.328 -0.131 -17.696 1.00 0.00 C ATOM 282 CH2 TRP A 41 95.648 -0.003 -18.152 1.00 0.00 C ATOM 0 H TRP A 41 89.951 -4.628 -18.797 1.00 0.00 H new ATOM 0 HA TRP A 41 91.757 -3.629 -20.616 1.00 0.00 H new ATOM 0 HB2 TRP A 41 91.830 -3.738 -18.022 1.00 0.00 H new ATOM 0 HB3 TRP A 41 92.540 -5.329 -18.214 1.00 0.00 H new ATOM 0 HD1 TRP A 41 94.781 -5.335 -19.992 1.00 0.00 H new ATOM 0 HE1 TRP A 41 96.746 -3.661 -20.078 1.00 0.00 H new ATOM 0 HE3 TRP A 41 92.596 -1.409 -17.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 97.273 -0.970 -19.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 93.858 0.691 -17.176 1.00 0.00 H new ATOM 0 HH2 TRP A 41 96.192 0.915 -17.984 1.00 0.00 H new ATOM 293 N THR A 42 91.742 -6.879 -20.560 1.00 0.00 N ATOM 294 CA THR A 42 92.220 -8.064 -21.265 1.00 0.00 C ATOM 295 C THR A 42 92.165 -7.841 -22.775 1.00 0.00 C ATOM 296 O THR A 42 93.088 -8.211 -23.500 1.00 0.00 O ATOM 297 CB THR A 42 91.364 -9.281 -20.904 1.00 0.00 C ATOM 298 OG1 THR A 42 90.013 -9.031 -21.262 1.00 0.00 O ATOM 299 CG2 THR A 42 91.457 -9.551 -19.402 1.00 0.00 C ATOM 0 H THR A 42 91.000 -7.054 -19.883 1.00 0.00 H new ATOM 0 HA THR A 42 93.251 -8.246 -20.963 1.00 0.00 H new ATOM 0 HB THR A 42 91.728 -10.153 -21.447 1.00 0.00 H new ATOM 0 HG1 THR A 42 89.576 -8.516 -20.552 1.00 0.00 H new ATOM 0 HG21 THR A 42 90.846 -10.418 -19.150 1.00 0.00 H new ATOM 0 HG22 THR A 42 92.494 -9.747 -19.131 1.00 0.00 H new ATOM 0 HG23 THR A 42 91.097 -8.681 -18.853 1.00 0.00 H new ATOM 307 N ILE A 43 91.093 -7.249 -23.232 1.00 0.00 N ATOM 308 CA ILE A 43 90.928 -6.989 -24.662 1.00 0.00 C ATOM 309 C ILE A 43 92.048 -6.072 -25.161 1.00 0.00 C ATOM 310 O ILE A 43 92.661 -6.338 -26.193 1.00 0.00 O ATOM 311 CB ILE A 43 89.542 -6.352 -24.944 1.00 0.00 C ATOM 312 CG1 ILE A 43 88.423 -7.428 -24.886 1.00 0.00 C ATOM 313 CG2 ILE A 43 89.542 -5.705 -26.341 1.00 0.00 C ATOM 314 CD1 ILE A 43 87.918 -7.598 -23.450 1.00 0.00 C ATOM 0 H ILE A 43 90.318 -6.934 -22.649 1.00 0.00 H new ATOM 0 HA ILE A 43 90.984 -7.937 -25.197 1.00 0.00 H new ATOM 0 HB ILE A 43 89.350 -5.596 -24.182 1.00 0.00 H new ATOM 0 HG12 ILE A 43 87.598 -7.139 -25.536 1.00 0.00 H new ATOM 0 HG13 ILE A 43 88.804 -8.379 -25.259 1.00 0.00 H new ATOM 0 HG21 ILE A 43 88.567 -5.259 -26.535 1.00 0.00 H new ATOM 0 HG22 ILE A 43 90.310 -4.932 -26.384 1.00 0.00 H new ATOM 0 HG23 ILE A 43 89.750 -6.465 -27.094 1.00 0.00 H new ATOM 0 HD11 ILE A 43 87.134 -8.355 -23.427 1.00 0.00 H new ATOM 0 HD12 ILE A 43 88.743 -7.909 -22.809 1.00 0.00 H new ATOM 0 HD13 ILE A 43 87.517 -6.650 -23.091 1.00 0.00 H new ATOM 326 N GLY A 44 92.293 -5.007 -24.452 1.00 0.00 N ATOM 327 CA GLY A 44 93.322 -4.053 -24.855 1.00 0.00 C ATOM 328 C GLY A 44 94.624 -4.759 -25.223 1.00 0.00 C ATOM 329 O GLY A 44 95.389 -4.270 -26.054 1.00 0.00 O ATOM 0 H GLY A 44 91.802 -4.766 -23.591 1.00 0.00 H new ATOM 0 HA2 GLY A 44 92.968 -3.472 -25.707 1.00 0.00 H new ATOM 0 HA3 GLY A 44 93.505 -3.349 -24.043 1.00 0.00 H new ATOM 333 N HIS A 45 94.868 -5.886 -24.617 1.00 0.00 N ATOM 334 CA HIS A 45 96.082 -6.649 -24.893 1.00 0.00 C ATOM 335 C HIS A 45 96.292 -6.838 -26.396 1.00 0.00 C ATOM 336 O HIS A 45 97.419 -7.032 -26.850 1.00 0.00 O ATOM 337 CB HIS A 45 96.007 -8.016 -24.215 1.00 0.00 C ATOM 338 CG HIS A 45 97.345 -8.694 -24.321 1.00 0.00 C ATOM 339 ND1 HIS A 45 97.475 -10.023 -24.689 1.00 0.00 N ATOM 340 CD2 HIS A 45 98.622 -8.236 -24.115 1.00 0.00 C ATOM 341 CE1 HIS A 45 98.788 -10.317 -24.693 1.00 0.00 C ATOM 342 NE2 HIS A 45 99.532 -9.261 -24.350 1.00 0.00 N ATOM 0 H HIS A 45 94.250 -6.309 -23.925 1.00 0.00 H new ATOM 0 HA HIS A 45 96.926 -6.086 -24.495 1.00 0.00 H new ATOM 0 HB2 HIS A 45 95.726 -7.901 -23.168 1.00 0.00 H new ATOM 0 HB3 HIS A 45 95.238 -8.627 -24.686 1.00 0.00 H new ATOM 0 HD1 HIS A 45 96.714 -10.663 -24.916 1.00 0.00 H new ATOM 0 HD2 HIS A 45 98.881 -7.231 -23.816 1.00 0.00 H new ATOM 0 HE1 HIS A 45 99.191 -11.287 -24.943 1.00 0.00 H new ATOM 351 N LEU A 46 95.220 -6.846 -27.141 1.00 0.00 N ATOM 352 CA LEU A 46 95.309 -7.088 -28.578 1.00 0.00 C ATOM 353 C LEU A 46 96.447 -6.285 -29.213 1.00 0.00 C ATOM 354 O LEU A 46 97.173 -6.808 -30.058 1.00 0.00 O ATOM 355 CB LEU A 46 93.966 -6.744 -29.262 1.00 0.00 C ATOM 356 CG LEU A 46 93.714 -5.209 -29.279 1.00 0.00 C ATOM 357 CD1 LEU A 46 94.157 -4.599 -30.624 1.00 0.00 C ATOM 358 CD2 LEU A 46 92.215 -4.917 -29.084 1.00 0.00 C ATOM 0 H LEU A 46 94.275 -6.690 -26.791 1.00 0.00 H new ATOM 0 HA LEU A 46 95.525 -8.146 -28.725 1.00 0.00 H new ATOM 0 HB2 LEU A 46 93.968 -7.125 -30.283 1.00 0.00 H new ATOM 0 HB3 LEU A 46 93.151 -7.242 -28.737 1.00 0.00 H new ATOM 0 HG LEU A 46 94.293 -4.766 -28.468 1.00 0.00 H new ATOM 0 HD11 LEU A 46 93.972 -3.525 -30.615 1.00 0.00 H new ATOM 0 HD12 LEU A 46 95.221 -4.783 -30.774 1.00 0.00 H new ATOM 0 HD13 LEU A 46 93.592 -5.058 -31.435 1.00 0.00 H new ATOM 0 HD21 LEU A 46 92.049 -3.840 -29.097 1.00 0.00 H new ATOM 0 HD22 LEU A 46 91.646 -5.382 -29.889 1.00 0.00 H new ATOM 0 HD23 LEU A 46 91.887 -5.323 -28.127 1.00 0.00 H new ATOM 370 N ASN A 47 96.607 -5.053 -28.826 1.00 0.00 N ATOM 371 CA ASN A 47 97.674 -4.231 -29.392 1.00 0.00 C ATOM 372 C ASN A 47 99.016 -4.964 -29.335 1.00 0.00 C ATOM 373 O ASN A 47 99.770 -4.970 -30.308 1.00 0.00 O ATOM 374 CB ASN A 47 97.782 -2.911 -28.629 1.00 0.00 C ATOM 375 CG ASN A 47 97.911 -3.176 -27.133 1.00 0.00 C ATOM 376 OD1 ASN A 47 97.773 -4.316 -26.689 1.00 0.00 O ATOM 377 ND2 ASN A 47 98.167 -2.184 -26.325 1.00 0.00 N ATOM 0 H ASN A 47 96.027 -4.586 -28.129 1.00 0.00 H new ATOM 0 HA ASN A 47 97.429 -4.030 -30.435 1.00 0.00 H new ATOM 0 HB2 ASN A 47 98.646 -2.348 -28.982 1.00 0.00 H new ATOM 0 HB3 ASN A 47 96.902 -2.298 -28.822 1.00 0.00 H new ATOM 0 HD21 ASN A 47 98.253 -2.352 -25.323 1.00 0.00 H new ATOM 0 HD22 ASN A 47 98.281 -1.241 -26.696 1.00 0.00 H new ATOM 384 N GLN A 48 99.306 -5.559 -28.209 1.00 0.00 N ATOM 385 CA GLN A 48 100.564 -6.278 -28.033 1.00 0.00 C ATOM 386 C GLN A 48 100.559 -7.593 -28.797 1.00 0.00 C ATOM 387 O GLN A 48 101.421 -7.845 -29.639 1.00 0.00 O ATOM 388 CB GLN A 48 100.798 -6.559 -26.543 1.00 0.00 C ATOM 389 CG GLN A 48 102.223 -7.082 -26.317 1.00 0.00 C ATOM 390 CD GLN A 48 102.326 -8.548 -26.733 1.00 0.00 C ATOM 391 OE1 GLN A 48 102.656 -8.848 -27.881 1.00 0.00 O ATOM 392 NE2 GLN A 48 102.069 -9.485 -25.862 1.00 0.00 N ATOM 0 H GLN A 48 98.695 -5.567 -27.392 1.00 0.00 H new ATOM 0 HA GLN A 48 101.366 -5.653 -28.425 1.00 0.00 H new ATOM 0 HB2 GLN A 48 100.642 -5.648 -25.965 1.00 0.00 H new ATOM 0 HB3 GLN A 48 100.074 -7.291 -26.186 1.00 0.00 H new ATOM 0 HG2 GLN A 48 102.931 -6.484 -26.891 1.00 0.00 H new ATOM 0 HG3 GLN A 48 102.494 -6.976 -25.266 1.00 0.00 H new ATOM 0 HE21 GLN A 48 101.796 -9.236 -24.911 1.00 0.00 H new ATOM 0 HE22 GLN A 48 102.141 -10.466 -26.132 1.00 0.00 H new ATOM 401 N ILE A 49 99.607 -8.414 -28.484 1.00 0.00 N ATOM 402 CA ILE A 49 99.488 -9.723 -29.120 1.00 0.00 C ATOM 403 C ILE A 49 99.587 -9.632 -30.659 1.00 0.00 C ATOM 404 O ILE A 49 99.776 -10.647 -31.326 1.00 0.00 O ATOM 405 CB ILE A 49 98.159 -10.385 -28.662 1.00 0.00 C ATOM 406 CG1 ILE A 49 98.360 -11.893 -28.390 1.00 0.00 C ATOM 407 CG2 ILE A 49 97.045 -10.189 -29.703 1.00 0.00 C ATOM 408 CD1 ILE A 49 98.890 -12.612 -29.636 1.00 0.00 C ATOM 0 H ILE A 49 98.888 -8.215 -27.789 1.00 0.00 H new ATOM 0 HA ILE A 49 100.325 -10.347 -28.807 1.00 0.00 H new ATOM 0 HB ILE A 49 97.856 -9.894 -27.737 1.00 0.00 H new ATOM 0 HG12 ILE A 49 99.059 -12.027 -27.564 1.00 0.00 H new ATOM 0 HG13 ILE A 49 97.414 -12.340 -28.083 1.00 0.00 H new ATOM 0 HG21 ILE A 49 96.130 -10.665 -29.350 1.00 0.00 H new ATOM 0 HG22 ILE A 49 96.867 -9.124 -29.849 1.00 0.00 H new ATOM 0 HG23 ILE A 49 97.347 -10.640 -30.648 1.00 0.00 H new ATOM 0 HD11 ILE A 49 99.022 -13.671 -29.416 1.00 0.00 H new ATOM 0 HD12 ILE A 49 98.178 -12.497 -30.453 1.00 0.00 H new ATOM 0 HD13 ILE A 49 99.848 -12.179 -29.926 1.00 0.00 H new ATOM 420 N LYS A 50 99.465 -8.441 -31.214 1.00 0.00 N ATOM 421 CA LYS A 50 99.545 -8.261 -32.670 1.00 0.00 C ATOM 422 C LYS A 50 100.837 -7.546 -33.056 1.00 0.00 C ATOM 423 O LYS A 50 101.648 -8.078 -33.815 1.00 0.00 O ATOM 424 CB LYS A 50 98.348 -7.438 -33.158 1.00 0.00 C ATOM 425 CG LYS A 50 98.248 -7.526 -34.684 1.00 0.00 C ATOM 426 CD LYS A 50 96.950 -6.861 -35.158 1.00 0.00 C ATOM 427 CE LYS A 50 97.020 -5.346 -34.936 1.00 0.00 C ATOM 428 NZ LYS A 50 95.994 -4.676 -35.783 1.00 0.00 N ATOM 0 H LYS A 50 99.310 -7.580 -30.689 1.00 0.00 H new ATOM 0 HA LYS A 50 99.533 -9.245 -33.138 1.00 0.00 H new ATOM 0 HB2 LYS A 50 97.430 -7.808 -32.702 1.00 0.00 H new ATOM 0 HB3 LYS A 50 98.460 -6.398 -32.851 1.00 0.00 H new ATOM 0 HG2 LYS A 50 99.107 -7.036 -35.143 1.00 0.00 H new ATOM 0 HG3 LYS A 50 98.269 -8.569 -35.000 1.00 0.00 H new ATOM 0 HD2 LYS A 50 96.788 -7.074 -36.215 1.00 0.00 H new ATOM 0 HD3 LYS A 50 96.101 -7.277 -34.616 1.00 0.00 H new ATOM 0 HE2 LYS A 50 96.849 -5.113 -33.885 1.00 0.00 H new ATOM 0 HE3 LYS A 50 98.014 -4.976 -35.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 96.039 -3.648 -35.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 96.177 -4.890 -36.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 95.049 -5.022 -35.522 1.00 0.00 H new ATOM 442 N ARG A 51 101.017 -6.357 -32.545 1.00 0.00 N ATOM 443 CA ARG A 51 102.213 -5.572 -32.848 1.00 0.00 C ATOM 444 C ARG A 51 103.369 -5.969 -31.933 1.00 0.00 C ATOM 445 O ARG A 51 103.396 -5.604 -30.757 1.00 0.00 O ATOM 446 CB ARG A 51 101.914 -4.082 -32.669 1.00 0.00 C ATOM 447 CG ARG A 51 100.716 -3.692 -33.538 1.00 0.00 C ATOM 448 CD ARG A 51 100.308 -2.250 -33.227 1.00 0.00 C ATOM 449 NE ARG A 51 99.114 -1.886 -33.985 1.00 0.00 N ATOM 450 CZ ARG A 51 98.401 -0.839 -33.665 1.00 0.00 C ATOM 451 NH1 ARG A 51 98.752 -0.090 -32.656 1.00 0.00 N ATOM 452 NH2 ARG A 51 97.335 -0.540 -34.357 1.00 0.00 N ATOM 0 H ARG A 51 100.358 -5.899 -31.915 1.00 0.00 H new ATOM 0 HA ARG A 51 102.499 -5.770 -33.881 1.00 0.00 H new ATOM 0 HB2 ARG A 51 101.702 -3.866 -31.622 1.00 0.00 H new ATOM 0 HB3 ARG A 51 102.786 -3.490 -32.947 1.00 0.00 H new ATOM 0 HG2 ARG A 51 100.971 -3.789 -34.593 1.00 0.00 H new ATOM 0 HG3 ARG A 51 99.881 -4.366 -33.349 1.00 0.00 H new ATOM 0 HD2 ARG A 51 100.116 -2.141 -32.159 1.00 0.00 H new ATOM 0 HD3 ARG A 51 101.125 -1.572 -33.475 1.00 0.00 H new ATOM 0 HE ARG A 51 98.831 -2.460 -34.779 1.00 0.00 H new ATOM 0 HH11 ARG A 51 99.585 -0.321 -32.115 1.00 0.00 H new ATOM 0 HH12 ARG A 51 98.193 0.727 -32.409 1.00 0.00 H new ATOM 0 HH21 ARG A 51 97.059 -1.124 -35.147 1.00 0.00 H new ATOM 0 HH22 ARG A 51 96.778 0.277 -34.108 1.00 0.00 H new ATOM 466 N GLY A 52 104.307 -6.700 -32.473 1.00 0.00 N ATOM 467 CA GLY A 52 105.466 -7.139 -31.702 1.00 0.00 C ATOM 468 C GLY A 52 106.040 -5.993 -30.876 1.00 0.00 C ATOM 0 H GLY A 52 104.302 -7.011 -33.445 1.00 0.00 H new ATOM 0 HA2 GLY A 52 105.179 -7.959 -31.043 1.00 0.00 H new ATOM 0 HA3 GLY A 52 106.231 -7.524 -32.376 1.00 0.00 H new TER 472 GLY A 52 ATOM 473 N SER B 23 80.337 17.525 3.801 1.00 0.00 N ATOM 474 CA SER B 23 80.504 16.228 4.517 1.00 0.00 C ATOM 475 C SER B 23 81.781 15.547 4.038 1.00 0.00 C ATOM 476 O SER B 23 81.810 14.331 3.841 1.00 0.00 O ATOM 477 CB SER B 23 79.296 15.334 4.232 1.00 0.00 C ATOM 478 OG SER B 23 78.102 16.076 4.445 1.00 0.00 O ATOM 0 HA SER B 23 80.574 16.404 5.590 1.00 0.00 H new ATOM 0 HB2 SER B 23 79.333 14.969 3.205 1.00 0.00 H new ATOM 0 HB3 SER B 23 79.315 14.459 4.882 1.00 0.00 H new ATOM 0 HG SER B 23 78.297 17.034 4.385 1.00 0.00 H new ATOM 483 N ASP B 24 82.815 16.321 3.856 1.00 0.00 N ATOM 484 CA ASP B 24 84.090 15.779 3.399 1.00 0.00 C ATOM 485 C ASP B 24 83.895 14.952 2.130 1.00 0.00 C ATOM 486 O ASP B 24 84.229 13.768 2.094 1.00 0.00 O ATOM 487 CB ASP B 24 84.705 14.903 4.492 1.00 0.00 C ATOM 488 CG ASP B 24 85.225 15.777 5.628 1.00 0.00 C ATOM 489 OD1 ASP B 24 86.317 16.303 5.492 1.00 0.00 O ATOM 490 OD2 ASP B 24 84.523 15.909 6.618 1.00 0.00 O ATOM 0 H ASP B 24 82.812 17.329 4.013 1.00 0.00 H new ATOM 0 HA ASP B 24 84.761 16.610 3.179 1.00 0.00 H new ATOM 0 HB2 ASP B 24 83.960 14.204 4.872 1.00 0.00 H new ATOM 0 HB3 ASP B 24 85.519 14.308 4.078 1.00 0.00 H new ATOM 495 N PRO B 25 83.361 15.553 1.099 1.00 0.00 N ATOM 496 CA PRO B 25 83.114 14.858 -0.200 1.00 0.00 C ATOM 497 C PRO B 25 84.416 14.570 -0.951 1.00 0.00 C ATOM 498 O PRO B 25 84.423 14.436 -2.174 1.00 0.00 O ATOM 499 CB PRO B 25 82.226 15.847 -0.972 1.00 0.00 C ATOM 500 CG PRO B 25 82.573 17.192 -0.414 1.00 0.00 C ATOM 501 CD PRO B 25 82.935 16.963 1.056 1.00 0.00 C ATOM 0 HA PRO B 25 82.649 13.881 -0.069 1.00 0.00 H new ATOM 0 HB2 PRO B 25 82.422 15.801 -2.043 1.00 0.00 H new ATOM 0 HB3 PRO B 25 81.169 15.622 -0.832 1.00 0.00 H new ATOM 0 HG2 PRO B 25 83.408 17.635 -0.956 1.00 0.00 H new ATOM 0 HG3 PRO B 25 81.733 17.880 -0.506 1.00 0.00 H new ATOM 0 HD2 PRO B 25 83.732 17.632 1.380 1.00 0.00 H new ATOM 0 HD3 PRO B 25 82.082 17.143 1.711 1.00 0.00 H new ATOM 509 N LEU B 26 85.493 14.478 -0.219 1.00 0.00 N ATOM 510 CA LEU B 26 86.796 14.207 -0.817 1.00 0.00 C ATOM 511 C LEU B 26 86.845 12.789 -1.383 1.00 0.00 C ATOM 512 O LEU B 26 87.345 12.568 -2.487 1.00 0.00 O ATOM 513 CB LEU B 26 87.895 14.385 0.239 1.00 0.00 C ATOM 514 CG LEU B 26 89.287 14.192 -0.387 1.00 0.00 C ATOM 515 CD1 LEU B 26 89.567 15.296 -1.423 1.00 0.00 C ATOM 516 CD2 LEU B 26 90.339 14.251 0.725 1.00 0.00 C ATOM 0 H LEU B 26 85.506 14.585 0.795 1.00 0.00 H new ATOM 0 HA LEU B 26 86.959 14.910 -1.634 1.00 0.00 H new ATOM 0 HB2 LEU B 26 87.824 15.379 0.681 1.00 0.00 H new ATOM 0 HB3 LEU B 26 87.751 13.666 1.046 1.00 0.00 H new ATOM 0 HG LEU B 26 89.327 13.226 -0.891 1.00 0.00 H new ATOM 0 HD11 LEU B 26 90.556 15.146 -1.857 1.00 0.00 H new ATOM 0 HD12 LEU B 26 88.815 15.255 -2.211 1.00 0.00 H new ATOM 0 HD13 LEU B 26 89.529 16.270 -0.936 1.00 0.00 H new ATOM 0 HD21 LEU B 26 91.331 14.115 0.295 1.00 0.00 H new ATOM 0 HD22 LEU B 26 90.288 15.219 1.223 1.00 0.00 H new ATOM 0 HD23 LEU B 26 90.147 13.460 1.450 1.00 0.00 H new ATOM 528 N VAL B 27 86.340 11.848 -0.631 1.00 0.00 N ATOM 529 CA VAL B 27 86.338 10.452 -1.061 1.00 0.00 C ATOM 530 C VAL B 27 85.362 10.234 -2.215 1.00 0.00 C ATOM 531 O VAL B 27 85.620 9.436 -3.115 1.00 0.00 O ATOM 532 CB VAL B 27 85.951 9.550 0.112 1.00 0.00 C ATOM 533 CG1 VAL B 27 84.533 9.889 0.573 1.00 0.00 C ATOM 534 CG2 VAL B 27 86.004 8.087 -0.333 1.00 0.00 C ATOM 0 H VAL B 27 85.922 12.010 0.285 1.00 0.00 H new ATOM 0 HA VAL B 27 87.341 10.201 -1.405 1.00 0.00 H new ATOM 0 HB VAL B 27 86.648 9.708 0.935 1.00 0.00 H new ATOM 0 HG11 VAL B 27 84.259 9.245 1.409 1.00 0.00 H new ATOM 0 HG12 VAL B 27 84.493 10.931 0.889 1.00 0.00 H new ATOM 0 HG13 VAL B 27 83.836 9.732 -0.250 1.00 0.00 H new ATOM 0 HG21 VAL B 27 85.728 7.443 0.502 1.00 0.00 H new ATOM 0 HG22 VAL B 27 85.307 7.932 -1.157 1.00 0.00 H new ATOM 0 HG23 VAL B 27 87.014 7.843 -0.662 1.00 0.00 H new ATOM 544 N VAL B 28 84.262 10.934 -2.180 1.00 0.00 N ATOM 545 CA VAL B 28 83.254 10.809 -3.228 1.00 0.00 C ATOM 546 C VAL B 28 83.788 11.351 -4.551 1.00 0.00 C ATOM 547 O VAL B 28 83.603 10.744 -5.605 1.00 0.00 O ATOM 548 CB VAL B 28 81.990 11.573 -2.828 1.00 0.00 C ATOM 549 CG1 VAL B 28 80.958 11.483 -3.953 1.00 0.00 C ATOM 550 CG2 VAL B 28 81.407 10.958 -1.554 1.00 0.00 C ATOM 0 H VAL B 28 84.029 11.600 -1.443 1.00 0.00 H new ATOM 0 HA VAL B 28 83.013 9.753 -3.354 1.00 0.00 H new ATOM 0 HB VAL B 28 82.240 12.619 -2.649 1.00 0.00 H new ATOM 0 HG11 VAL B 28 80.059 12.028 -3.666 1.00 0.00 H new ATOM 0 HG12 VAL B 28 81.372 11.919 -4.862 1.00 0.00 H new ATOM 0 HG13 VAL B 28 80.707 10.438 -4.134 1.00 0.00 H new ATOM 0 HG21 VAL B 28 80.506 11.501 -1.267 1.00 0.00 H new ATOM 0 HG22 VAL B 28 81.158 9.912 -1.736 1.00 0.00 H new ATOM 0 HG23 VAL B 28 82.141 11.022 -0.750 1.00 0.00 H new ATOM 560 N ALA B 29 84.433 12.481 -4.487 1.00 0.00 N ATOM 561 CA ALA B 29 84.984 13.105 -5.686 1.00 0.00 C ATOM 562 C ALA B 29 85.794 12.095 -6.495 1.00 0.00 C ATOM 563 O ALA B 29 85.767 12.109 -7.727 1.00 0.00 O ATOM 564 CB ALA B 29 85.879 14.284 -5.299 1.00 0.00 C ATOM 0 H ALA B 29 84.597 12.999 -3.624 1.00 0.00 H new ATOM 0 HA ALA B 29 84.155 13.463 -6.297 1.00 0.00 H new ATOM 0 HB1 ALA B 29 86.286 14.743 -6.200 1.00 0.00 H new ATOM 0 HB2 ALA B 29 85.293 15.020 -4.749 1.00 0.00 H new ATOM 0 HB3 ALA B 29 86.697 13.929 -4.672 1.00 0.00 H new ATOM 570 N ALA B 30 86.501 11.237 -5.812 1.00 0.00 N ATOM 571 CA ALA B 30 87.315 10.228 -6.481 1.00 0.00 C ATOM 572 C ALA B 30 86.444 9.284 -7.308 1.00 0.00 C ATOM 573 O ALA B 30 86.860 8.808 -8.364 1.00 0.00 O ATOM 574 CB ALA B 30 88.102 9.421 -5.446 1.00 0.00 C ATOM 0 H ALA B 30 86.538 11.206 -4.793 1.00 0.00 H new ATOM 0 HA ALA B 30 88.007 10.739 -7.150 1.00 0.00 H new ATOM 0 HB1 ALA B 30 88.707 8.670 -5.954 1.00 0.00 H new ATOM 0 HB2 ALA B 30 88.752 10.089 -4.881 1.00 0.00 H new ATOM 0 HB3 ALA B 30 87.408 8.928 -4.765 1.00 0.00 H new ATOM 580 N SER B 31 85.258 9.019 -6.829 1.00 0.00 N ATOM 581 CA SER B 31 84.343 8.125 -7.535 1.00 0.00 C ATOM 582 C SER B 31 84.026 8.665 -8.926 1.00 0.00 C ATOM 583 O SER B 31 83.992 7.915 -9.902 1.00 0.00 O ATOM 584 CB SER B 31 83.045 7.968 -6.745 1.00 0.00 C ATOM 585 OG SER B 31 82.192 7.052 -7.419 1.00 0.00 O ATOM 0 H SER B 31 84.892 9.402 -5.957 1.00 0.00 H new ATOM 0 HA SER B 31 84.828 7.154 -7.635 1.00 0.00 H new ATOM 0 HB2 SER B 31 83.260 7.609 -5.738 1.00 0.00 H new ATOM 0 HB3 SER B 31 82.550 8.934 -6.641 1.00 0.00 H new ATOM 0 HG SER B 31 81.359 6.948 -6.913 1.00 0.00 H new ATOM 591 N ILE B 32 83.795 9.947 -9.008 1.00 0.00 N ATOM 592 CA ILE B 32 83.476 10.576 -10.285 1.00 0.00 C ATOM 593 C ILE B 32 84.492 10.172 -11.350 1.00 0.00 C ATOM 594 O ILE B 32 84.162 10.076 -12.532 1.00 0.00 O ATOM 595 CB ILE B 32 83.474 12.098 -10.134 1.00 0.00 C ATOM 596 CG1 ILE B 32 82.654 12.499 -8.899 1.00 0.00 C ATOM 597 CG2 ILE B 32 82.864 12.736 -11.384 1.00 0.00 C ATOM 598 CD1 ILE B 32 81.273 11.836 -8.941 1.00 0.00 C ATOM 0 H ILE B 32 83.819 10.586 -8.213 1.00 0.00 H new ATOM 0 HA ILE B 32 82.486 10.241 -10.595 1.00 0.00 H new ATOM 0 HB ILE B 32 84.499 12.447 -10.011 1.00 0.00 H new ATOM 0 HG12 ILE B 32 83.180 12.202 -7.992 1.00 0.00 H new ATOM 0 HG13 ILE B 32 82.544 13.583 -8.863 1.00 0.00 H new ATOM 0 HG21 ILE B 32 82.863 13.821 -11.275 1.00 0.00 H new ATOM 0 HG22 ILE B 32 83.453 12.459 -12.258 1.00 0.00 H new ATOM 0 HG23 ILE B 32 81.840 12.383 -11.510 1.00 0.00 H new ATOM 0 HD11 ILE B 32 80.702 12.129 -8.060 1.00 0.00 H new ATOM 0 HD12 ILE B 32 80.744 12.155 -9.839 1.00 0.00 H new ATOM 0 HD13 ILE B 32 81.390 10.752 -8.954 1.00 0.00 H new ATOM 610 N ILE B 33 85.706 9.947 -10.930 1.00 0.00 N ATOM 611 CA ILE B 33 86.767 9.558 -11.853 1.00 0.00 C ATOM 612 C ILE B 33 86.523 8.140 -12.377 1.00 0.00 C ATOM 613 O ILE B 33 86.920 7.807 -13.494 1.00 0.00 O ATOM 614 CB ILE B 33 88.143 9.651 -11.156 1.00 0.00 C ATOM 615 CG1 ILE B 33 88.345 11.085 -10.607 1.00 0.00 C ATOM 616 CG2 ILE B 33 89.265 9.316 -12.158 1.00 0.00 C ATOM 617 CD1 ILE B 33 89.831 11.359 -10.317 1.00 0.00 C ATOM 0 H ILE B 33 85.998 10.023 -9.956 1.00 0.00 H new ATOM 0 HA ILE B 33 86.762 10.243 -12.701 1.00 0.00 H new ATOM 0 HB ILE B 33 88.178 8.937 -10.333 1.00 0.00 H new ATOM 0 HG12 ILE B 33 87.972 11.811 -11.329 1.00 0.00 H new ATOM 0 HG13 ILE B 33 87.763 11.215 -9.695 1.00 0.00 H new ATOM 0 HG21 ILE B 33 90.231 9.384 -11.658 1.00 0.00 H new ATOM 0 HG22 ILE B 33 89.123 8.304 -12.538 1.00 0.00 H new ATOM 0 HG23 ILE B 33 89.235 10.023 -12.987 1.00 0.00 H new ATOM 0 HD11 ILE B 33 89.946 12.372 -9.933 1.00 0.00 H new ATOM 0 HD12 ILE B 33 90.195 10.647 -9.576 1.00 0.00 H new ATOM 0 HD13 ILE B 33 90.407 11.252 -11.236 1.00 0.00 H new ATOM 629 N GLY B 34 85.887 7.319 -11.584 1.00 0.00 N ATOM 630 CA GLY B 34 85.615 5.939 -11.988 1.00 0.00 C ATOM 631 C GLY B 34 84.622 5.870 -13.149 1.00 0.00 C ATOM 632 O GLY B 34 84.878 5.199 -14.150 1.00 0.00 O ATOM 0 H GLY B 34 85.544 7.567 -10.656 1.00 0.00 H new ATOM 0 HA2 GLY B 34 86.548 5.455 -12.279 1.00 0.00 H new ATOM 0 HA3 GLY B 34 85.219 5.383 -11.138 1.00 0.00 H new ATOM 636 N ILE B 35 83.512 6.545 -13.015 1.00 0.00 N ATOM 637 CA ILE B 35 82.493 6.538 -14.066 1.00 0.00 C ATOM 638 C ILE B 35 83.037 7.147 -15.355 1.00 0.00 C ATOM 639 O ILE B 35 82.610 6.787 -16.452 1.00 0.00 O ATOM 640 CB ILE B 35 81.261 7.326 -13.613 1.00 0.00 C ATOM 641 CG1 ILE B 35 81.686 8.728 -13.165 1.00 0.00 C ATOM 642 CG2 ILE B 35 80.592 6.599 -12.446 1.00 0.00 C ATOM 643 CD1 ILE B 35 80.446 9.582 -12.892 1.00 0.00 C ATOM 0 H ILE B 35 83.278 7.109 -12.198 1.00 0.00 H new ATOM 0 HA ILE B 35 82.213 5.502 -14.257 1.00 0.00 H new ATOM 0 HB ILE B 35 80.558 7.408 -14.442 1.00 0.00 H new ATOM 0 HG12 ILE B 35 82.299 8.662 -12.266 1.00 0.00 H new ATOM 0 HG13 ILE B 35 82.299 9.196 -13.935 1.00 0.00 H new ATOM 0 HG21 ILE B 35 79.715 7.160 -12.123 1.00 0.00 H new ATOM 0 HG22 ILE B 35 80.288 5.602 -12.765 1.00 0.00 H new ATOM 0 HG23 ILE B 35 81.295 6.517 -11.617 1.00 0.00 H new ATOM 0 HD11 ILE B 35 80.753 10.578 -12.574 1.00 0.00 H new ATOM 0 HD12 ILE B 35 79.850 9.659 -13.801 1.00 0.00 H new ATOM 0 HD13 ILE B 35 79.850 9.118 -12.106 1.00 0.00 H new ATOM 655 N LEU B 36 83.956 8.062 -15.218 1.00 0.00 N ATOM 656 CA LEU B 36 84.539 8.720 -16.381 1.00 0.00 C ATOM 657 C LEU B 36 85.238 7.704 -17.277 1.00 0.00 C ATOM 658 O LEU B 36 85.060 7.711 -18.495 1.00 0.00 O ATOM 659 CB LEU B 36 85.538 9.792 -15.925 1.00 0.00 C ATOM 660 CG LEU B 36 86.242 10.428 -17.135 1.00 0.00 C ATOM 661 CD1 LEU B 36 85.204 10.971 -18.130 1.00 0.00 C ATOM 662 CD2 LEU B 36 87.129 11.577 -16.646 1.00 0.00 C ATOM 0 H LEU B 36 84.324 8.377 -14.320 1.00 0.00 H new ATOM 0 HA LEU B 36 83.740 9.192 -16.952 1.00 0.00 H new ATOM 0 HB2 LEU B 36 85.018 10.562 -15.354 1.00 0.00 H new ATOM 0 HB3 LEU B 36 86.278 9.347 -15.260 1.00 0.00 H new ATOM 0 HG LEU B 36 86.848 9.674 -17.637 1.00 0.00 H new ATOM 0 HD11 LEU B 36 85.716 11.419 -18.982 1.00 0.00 H new ATOM 0 HD12 LEU B 36 84.570 10.155 -18.476 1.00 0.00 H new ATOM 0 HD13 LEU B 36 84.589 11.725 -17.639 1.00 0.00 H new ATOM 0 HD21 LEU B 36 87.633 12.035 -17.497 1.00 0.00 H new ATOM 0 HD22 LEU B 36 86.514 12.324 -16.144 1.00 0.00 H new ATOM 0 HD23 LEU B 36 87.873 11.191 -15.949 1.00 0.00 H new ATOM 674 N HIS B 37 86.026 6.854 -16.680 1.00 0.00 N ATOM 675 CA HIS B 37 86.755 5.845 -17.439 1.00 0.00 C ATOM 676 C HIS B 37 85.811 5.066 -18.354 1.00 0.00 C ATOM 677 O HIS B 37 86.081 4.914 -19.543 1.00 0.00 O ATOM 678 CB HIS B 37 87.459 4.869 -16.473 1.00 0.00 C ATOM 679 CG HIS B 37 88.813 5.401 -16.086 1.00 0.00 C ATOM 680 ND1 HIS B 37 89.659 6.001 -17.004 1.00 0.00 N ATOM 681 CD2 HIS B 37 89.481 5.422 -14.888 1.00 0.00 C ATOM 682 CE1 HIS B 37 90.779 6.354 -16.351 1.00 0.00 C ATOM 683 NE2 HIS B 37 90.723 6.025 -15.058 1.00 0.00 N ATOM 0 H HIS B 37 86.188 6.830 -15.673 1.00 0.00 H new ATOM 0 HA HIS B 37 87.499 6.351 -18.055 1.00 0.00 H new ATOM 0 HB2 HIS B 37 86.849 4.726 -15.581 1.00 0.00 H new ATOM 0 HB3 HIS B 37 87.566 3.893 -16.946 1.00 0.00 H new ATOM 0 HD1 HIS B 37 89.467 6.148 -17.995 1.00 0.00 H new ATOM 0 HD2 HIS B 37 89.101 5.030 -13.956 1.00 0.00 H new ATOM 0 HE1 HIS B 37 91.622 6.844 -16.815 1.00 0.00 H new ATOM 692 N PHE B 38 84.736 4.575 -17.803 1.00 0.00 N ATOM 693 CA PHE B 38 83.777 3.795 -18.579 1.00 0.00 C ATOM 694 C PHE B 38 83.302 4.552 -19.816 1.00 0.00 C ATOM 695 O PHE B 38 83.212 3.981 -20.902 1.00 0.00 O ATOM 696 CB PHE B 38 82.575 3.439 -17.701 1.00 0.00 C ATOM 697 CG PHE B 38 81.655 2.506 -18.452 1.00 0.00 C ATOM 698 CD1 PHE B 38 81.877 1.123 -18.414 1.00 0.00 C ATOM 699 CD2 PHE B 38 80.579 3.022 -19.182 1.00 0.00 C ATOM 700 CE1 PHE B 38 81.021 0.258 -19.106 1.00 0.00 C ATOM 701 CE2 PHE B 38 79.724 2.157 -19.875 1.00 0.00 C ATOM 702 CZ PHE B 38 79.945 0.775 -19.837 1.00 0.00 C ATOM 0 H PHE B 38 84.490 4.694 -16.820 1.00 0.00 H new ATOM 0 HA PHE B 38 84.277 2.887 -18.915 1.00 0.00 H new ATOM 0 HB2 PHE B 38 82.913 2.967 -16.778 1.00 0.00 H new ATOM 0 HB3 PHE B 38 82.038 4.344 -17.418 1.00 0.00 H new ATOM 0 HD1 PHE B 38 82.708 0.725 -17.851 1.00 0.00 H new ATOM 0 HD2 PHE B 38 80.408 4.088 -19.211 1.00 0.00 H new ATOM 0 HE1 PHE B 38 81.191 -0.808 -19.076 1.00 0.00 H new ATOM 0 HE2 PHE B 38 78.894 2.556 -20.439 1.00 0.00 H new ATOM 0 HZ PHE B 38 79.285 0.108 -20.372 1.00 0.00 H new ATOM 712 N ILE B 39 82.988 5.807 -19.652 1.00 0.00 N ATOM 713 CA ILE B 39 82.505 6.605 -20.774 1.00 0.00 C ATOM 714 C ILE B 39 83.526 6.651 -21.909 1.00 0.00 C ATOM 715 O ILE B 39 83.187 6.405 -23.060 1.00 0.00 O ATOM 716 CB ILE B 39 82.186 8.027 -20.314 1.00 0.00 C ATOM 717 CG1 ILE B 39 81.125 7.975 -19.211 1.00 0.00 C ATOM 718 CG2 ILE B 39 81.652 8.835 -21.499 1.00 0.00 C ATOM 719 CD1 ILE B 39 80.960 9.364 -18.590 1.00 0.00 C ATOM 0 H ILE B 39 83.053 6.307 -18.765 1.00 0.00 H new ATOM 0 HA ILE B 39 81.598 6.131 -21.149 1.00 0.00 H new ATOM 0 HB ILE B 39 83.089 8.500 -19.929 1.00 0.00 H new ATOM 0 HG12 ILE B 39 80.175 7.635 -19.623 1.00 0.00 H new ATOM 0 HG13 ILE B 39 81.417 7.256 -18.446 1.00 0.00 H new ATOM 0 HG21 ILE B 39 81.423 9.850 -21.174 1.00 0.00 H new ATOM 0 HG22 ILE B 39 82.405 8.867 -22.286 1.00 0.00 H new ATOM 0 HG23 ILE B 39 80.747 8.364 -21.882 1.00 0.00 H new ATOM 0 HD11 ILE B 39 80.204 9.324 -17.805 1.00 0.00 H new ATOM 0 HD12 ILE B 39 81.910 9.687 -18.163 1.00 0.00 H new ATOM 0 HD13 ILE B 39 80.648 10.071 -19.358 1.00 0.00 H new ATOM 731 N ALA B 40 84.751 6.970 -21.596 1.00 0.00 N ATOM 732 CA ALA B 40 85.791 7.040 -22.619 1.00 0.00 C ATOM 733 C ALA B 40 86.186 5.644 -23.112 1.00 0.00 C ATOM 734 O ALA B 40 86.500 5.450 -24.286 1.00 0.00 O ATOM 735 CB ALA B 40 87.023 7.754 -22.062 1.00 0.00 C ATOM 0 H ALA B 40 85.066 7.187 -20.650 1.00 0.00 H new ATOM 0 HA ALA B 40 85.391 7.600 -23.464 1.00 0.00 H new ATOM 0 HB1 ALA B 40 87.794 7.802 -22.831 1.00 0.00 H new ATOM 0 HB2 ALA B 40 86.751 8.764 -21.757 1.00 0.00 H new ATOM 0 HB3 ALA B 40 87.403 7.205 -21.201 1.00 0.00 H new ATOM 741 N TRP B 41 86.202 4.707 -22.202 1.00 0.00 N ATOM 742 CA TRP B 41 86.602 3.327 -22.499 1.00 0.00 C ATOM 743 C TRP B 41 85.902 2.746 -23.726 1.00 0.00 C ATOM 744 O TRP B 41 86.494 1.956 -24.461 1.00 0.00 O ATOM 745 CB TRP B 41 86.295 2.442 -21.290 1.00 0.00 C ATOM 746 CG TRP B 41 86.879 1.085 -21.498 1.00 0.00 C ATOM 747 CD1 TRP B 41 86.434 0.171 -22.390 1.00 0.00 C ATOM 748 CD2 TRP B 41 88.003 0.476 -20.804 1.00 0.00 C ATOM 749 NE1 TRP B 41 87.232 -0.963 -22.298 1.00 0.00 N ATOM 750 CE2 TRP B 41 88.213 -0.818 -21.331 1.00 0.00 C ATOM 751 CE3 TRP B 41 88.858 0.923 -19.780 1.00 0.00 C ATOM 752 CZ2 TRP B 41 89.238 -1.641 -20.856 1.00 0.00 C ATOM 753 CZ3 TRP B 41 89.884 0.096 -19.298 1.00 0.00 C ATOM 754 CH2 TRP B 41 90.073 -1.182 -19.837 1.00 0.00 C ATOM 0 H TRP B 41 85.941 4.863 -21.228 1.00 0.00 H new ATOM 0 HA TRP B 41 87.670 3.348 -22.716 1.00 0.00 H new ATOM 0 HB2 TRP B 41 86.706 2.890 -20.385 1.00 0.00 H new ATOM 0 HB3 TRP B 41 85.217 2.366 -21.147 1.00 0.00 H new ATOM 0 HD1 TRP B 41 85.598 0.301 -23.062 1.00 0.00 H new ATOM 0 HE1 TRP B 41 87.110 -1.798 -22.871 1.00 0.00 H new ATOM 0 HE3 TRP B 41 88.724 1.910 -19.362 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 89.383 -2.626 -21.275 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 90.531 0.447 -18.508 1.00 0.00 H new ATOM 0 HH2 TRP B 41 90.866 -1.813 -19.464 1.00 0.00 H new ATOM 765 N THR B 42 84.677 3.113 -23.943 1.00 0.00 N ATOM 766 CA THR B 42 83.947 2.582 -25.091 1.00 0.00 C ATOM 767 C THR B 42 84.518 3.130 -26.393 1.00 0.00 C ATOM 768 O THR B 42 84.459 2.469 -27.426 1.00 0.00 O ATOM 769 CB THR B 42 82.456 2.916 -25.000 1.00 0.00 C ATOM 770 OG1 THR B 42 81.839 2.614 -26.244 1.00 0.00 O ATOM 771 CG2 THR B 42 82.262 4.404 -24.683 1.00 0.00 C ATOM 0 H THR B 42 84.154 3.767 -23.361 1.00 0.00 H new ATOM 0 HA THR B 42 84.062 1.498 -25.081 1.00 0.00 H new ATOM 0 HB THR B 42 82.004 2.326 -24.203 1.00 0.00 H new ATOM 0 HG1 THR B 42 80.883 2.823 -26.194 1.00 0.00 H new ATOM 0 HG21 THR B 42 81.197 4.627 -24.621 1.00 0.00 H new ATOM 0 HG22 THR B 42 82.738 4.638 -23.731 1.00 0.00 H new ATOM 0 HG23 THR B 42 82.714 5.006 -25.472 1.00 0.00 H new ATOM 779 N ILE B 43 85.064 4.315 -26.345 1.00 0.00 N ATOM 780 CA ILE B 43 85.638 4.910 -27.544 1.00 0.00 C ATOM 781 C ILE B 43 86.790 4.049 -28.051 1.00 0.00 C ATOM 782 O ILE B 43 86.833 3.682 -29.223 1.00 0.00 O ATOM 783 CB ILE B 43 86.159 6.314 -27.225 1.00 0.00 C ATOM 784 CG1 ILE B 43 85.066 7.130 -26.521 1.00 0.00 C ATOM 785 CG2 ILE B 43 86.569 7.019 -28.518 1.00 0.00 C ATOM 786 CD1 ILE B 43 83.763 7.090 -27.326 1.00 0.00 C ATOM 0 H ILE B 43 85.129 4.890 -25.505 1.00 0.00 H new ATOM 0 HA ILE B 43 84.867 4.972 -28.312 1.00 0.00 H new ATOM 0 HB ILE B 43 87.024 6.230 -26.568 1.00 0.00 H new ATOM 0 HG12 ILE B 43 84.895 6.732 -25.521 1.00 0.00 H new ATOM 0 HG13 ILE B 43 85.395 8.162 -26.402 1.00 0.00 H new ATOM 0 HG21 ILE B 43 86.939 8.018 -28.286 1.00 0.00 H new ATOM 0 HG22 ILE B 43 87.354 6.446 -29.011 1.00 0.00 H new ATOM 0 HG23 ILE B 43 85.706 7.096 -29.180 1.00 0.00 H new ATOM 0 HD11 ILE B 43 83.000 7.674 -26.812 1.00 0.00 H new ATOM 0 HD12 ILE B 43 83.935 7.510 -28.317 1.00 0.00 H new ATOM 0 HD13 ILE B 43 83.427 6.058 -27.423 1.00 0.00 H new ATOM 798 N GLY B 44 87.704 3.735 -27.172 1.00 0.00 N ATOM 799 CA GLY B 44 88.857 2.915 -27.533 1.00 0.00 C ATOM 800 C GLY B 44 88.421 1.644 -28.255 1.00 0.00 C ATOM 801 O GLY B 44 89.151 1.112 -29.091 1.00 0.00 O ATOM 0 H GLY B 44 87.683 4.030 -26.196 1.00 0.00 H new ATOM 0 HA2 GLY B 44 89.529 3.488 -28.172 1.00 0.00 H new ATOM 0 HA3 GLY B 44 89.417 2.653 -26.635 1.00 0.00 H new ATOM 805 N HIS B 45 87.250 1.176 -27.931 1.00 0.00 N ATOM 806 CA HIS B 45 86.711 -0.031 -28.545 1.00 0.00 C ATOM 807 C HIS B 45 86.708 0.079 -30.068 1.00 0.00 C ATOM 808 O HIS B 45 86.723 -0.923 -30.770 1.00 0.00 O ATOM 809 CB HIS B 45 85.285 -0.271 -28.046 1.00 0.00 C ATOM 810 CG HIS B 45 84.861 -1.677 -28.370 1.00 0.00 C ATOM 811 ND1 HIS B 45 83.682 -1.953 -29.044 1.00 0.00 N ATOM 812 CD2 HIS B 45 85.442 -2.894 -28.114 1.00 0.00 C ATOM 813 CE1 HIS B 45 83.593 -3.289 -29.170 1.00 0.00 C ATOM 814 NE2 HIS B 45 84.639 -3.911 -28.620 1.00 0.00 N ATOM 0 H HIS B 45 86.636 1.607 -27.240 1.00 0.00 H new ATOM 0 HA HIS B 45 87.348 -0.870 -28.263 1.00 0.00 H new ATOM 0 HB2 HIS B 45 85.234 -0.105 -26.970 1.00 0.00 H new ATOM 0 HB3 HIS B 45 84.603 0.441 -28.511 1.00 0.00 H new ATOM 0 HD2 HIS B 45 86.380 -3.040 -27.598 1.00 0.00 H new ATOM 0 HE1 HIS B 45 82.774 -3.798 -29.657 1.00 0.00 H new ATOM 0 HE2 HIS B 45 84.812 -4.915 -28.580 1.00 0.00 H new ATOM 823 N LEU B 46 86.623 1.274 -30.568 1.00 0.00 N ATOM 824 CA LEU B 46 86.543 1.466 -32.011 1.00 0.00 C ATOM 825 C LEU B 46 87.572 0.609 -32.763 1.00 0.00 C ATOM 826 O LEU B 46 87.337 0.238 -33.914 1.00 0.00 O ATOM 827 CB LEU B 46 86.736 2.961 -32.351 1.00 0.00 C ATOM 828 CG LEU B 46 88.240 3.357 -32.326 1.00 0.00 C ATOM 829 CD1 LEU B 46 88.839 3.300 -33.747 1.00 0.00 C ATOM 830 CD2 LEU B 46 88.396 4.789 -31.779 1.00 0.00 C ATOM 0 H LEU B 46 86.606 2.132 -30.017 1.00 0.00 H new ATOM 0 HA LEU B 46 85.554 1.143 -32.337 1.00 0.00 H new ATOM 0 HB2 LEU B 46 86.319 3.169 -33.337 1.00 0.00 H new ATOM 0 HB3 LEU B 46 86.185 3.573 -31.637 1.00 0.00 H new ATOM 0 HG LEU B 46 88.768 2.652 -31.683 1.00 0.00 H new ATOM 0 HD11 LEU B 46 89.892 3.580 -33.710 1.00 0.00 H new ATOM 0 HD12 LEU B 46 88.747 2.288 -34.140 1.00 0.00 H new ATOM 0 HD13 LEU B 46 88.302 3.992 -34.396 1.00 0.00 H new ATOM 0 HD21 LEU B 46 89.452 5.060 -31.764 1.00 0.00 H new ATOM 0 HD22 LEU B 46 87.852 5.484 -32.419 1.00 0.00 H new ATOM 0 HD23 LEU B 46 87.995 4.838 -30.767 1.00 0.00 H new ATOM 842 N ASN B 47 88.696 0.325 -32.158 1.00 0.00 N ATOM 843 CA ASN B 47 89.735 -0.458 -32.837 1.00 0.00 C ATOM 844 C ASN B 47 89.255 -1.843 -33.297 1.00 0.00 C ATOM 845 O ASN B 47 89.460 -2.211 -34.452 1.00 0.00 O ATOM 846 CB ASN B 47 90.941 -0.636 -31.911 1.00 0.00 C ATOM 847 CG ASN B 47 91.629 0.704 -31.684 1.00 0.00 C ATOM 848 OD1 ASN B 47 91.857 1.100 -30.542 1.00 0.00 O ATOM 849 ND2 ASN B 47 91.981 1.428 -32.713 1.00 0.00 N ATOM 0 H ASN B 47 88.928 0.613 -31.208 1.00 0.00 H new ATOM 0 HA ASN B 47 90.006 0.105 -33.730 1.00 0.00 H new ATOM 0 HB2 ASN B 47 90.619 -1.054 -30.957 1.00 0.00 H new ATOM 0 HB3 ASN B 47 91.644 -1.345 -32.349 1.00 0.00 H new ATOM 0 HD21 ASN B 47 92.446 2.324 -32.571 1.00 0.00 H new ATOM 0 HD22 ASN B 47 91.791 1.097 -33.659 1.00 0.00 H new ATOM 856 N GLN B 48 88.665 -2.619 -32.416 1.00 0.00 N ATOM 857 CA GLN B 48 88.223 -3.949 -32.768 1.00 0.00 C ATOM 858 C GLN B 48 86.900 -3.922 -33.533 1.00 0.00 C ATOM 859 O GLN B 48 86.815 -4.414 -34.659 1.00 0.00 O ATOM 860 CB GLN B 48 88.106 -4.783 -31.479 1.00 0.00 C ATOM 861 CG GLN B 48 87.854 -3.889 -30.260 1.00 0.00 C ATOM 862 CD GLN B 48 89.158 -3.242 -29.797 1.00 0.00 C ATOM 863 OE1 GLN B 48 90.179 -3.348 -30.476 1.00 0.00 O ATOM 864 NE2 GLN B 48 89.183 -2.579 -28.674 1.00 0.00 N ATOM 0 H GLN B 48 88.480 -2.351 -31.449 1.00 0.00 H new ATOM 0 HA GLN B 48 88.954 -4.405 -33.435 1.00 0.00 H new ATOM 0 HB2 GLN B 48 87.293 -5.501 -31.580 1.00 0.00 H new ATOM 0 HB3 GLN B 48 89.021 -5.356 -31.330 1.00 0.00 H new ATOM 0 HG2 GLN B 48 87.126 -3.117 -30.511 1.00 0.00 H new ATOM 0 HG3 GLN B 48 87.426 -4.479 -29.450 1.00 0.00 H new ATOM 0 HE21 GLN B 48 88.335 -2.493 -28.114 1.00 0.00 H new ATOM 0 HE22 GLN B 48 90.050 -2.147 -28.356 1.00 0.00 H new ATOM 873 N ILE B 49 85.897 -3.376 -32.925 1.00 0.00 N ATOM 874 CA ILE B 49 84.575 -3.309 -33.554 1.00 0.00 C ATOM 875 C ILE B 49 84.637 -2.751 -34.993 1.00 0.00 C ATOM 876 O ILE B 49 83.616 -2.696 -35.677 1.00 0.00 O ATOM 877 CB ILE B 49 83.638 -2.445 -32.676 1.00 0.00 C ATOM 878 CG1 ILE B 49 82.186 -2.931 -32.817 1.00 0.00 C ATOM 879 CG2 ILE B 49 83.723 -0.964 -33.081 1.00 0.00 C ATOM 880 CD1 ILE B 49 81.264 -2.065 -31.955 1.00 0.00 C ATOM 0 H ILE B 49 85.946 -2.964 -31.993 1.00 0.00 H new ATOM 0 HA ILE B 49 84.184 -4.324 -33.629 1.00 0.00 H new ATOM 0 HB ILE B 49 83.957 -2.545 -31.639 1.00 0.00 H new ATOM 0 HG12 ILE B 49 81.876 -2.881 -33.861 1.00 0.00 H new ATOM 0 HG13 ILE B 49 82.111 -3.975 -32.511 1.00 0.00 H new ATOM 0 HG21 ILE B 49 83.056 -0.376 -32.451 1.00 0.00 H new ATOM 0 HG22 ILE B 49 84.746 -0.611 -32.956 1.00 0.00 H new ATOM 0 HG23 ILE B 49 83.427 -0.854 -34.124 1.00 0.00 H new ATOM 0 HD11 ILE B 49 80.236 -2.413 -32.058 1.00 0.00 H new ATOM 0 HD12 ILE B 49 81.568 -2.137 -30.911 1.00 0.00 H new ATOM 0 HD13 ILE B 49 81.330 -1.027 -32.281 1.00 0.00 H new ATOM 892 N LYS B 50 85.810 -2.362 -35.443 1.00 0.00 N ATOM 893 CA LYS B 50 85.975 -1.828 -36.796 1.00 0.00 C ATOM 894 C LYS B 50 87.447 -1.547 -37.067 1.00 0.00 C ATOM 895 O LYS B 50 88.195 -1.195 -36.157 1.00 0.00 O ATOM 896 CB LYS B 50 85.179 -0.529 -36.968 1.00 0.00 C ATOM 897 CG LYS B 50 85.285 -0.056 -38.421 1.00 0.00 C ATOM 898 CD LYS B 50 84.215 1.004 -38.702 1.00 0.00 C ATOM 899 CE LYS B 50 84.410 2.201 -37.767 1.00 0.00 C ATOM 900 NZ LYS B 50 85.855 2.562 -37.713 1.00 0.00 N ATOM 0 H LYS B 50 86.671 -2.402 -34.898 1.00 0.00 H new ATOM 0 HA LYS B 50 85.602 -2.570 -37.502 1.00 0.00 H new ATOM 0 HB2 LYS B 50 84.134 -0.692 -36.702 1.00 0.00 H new ATOM 0 HB3 LYS B 50 85.563 0.238 -36.295 1.00 0.00 H new ATOM 0 HG2 LYS B 50 86.276 0.357 -38.607 1.00 0.00 H new ATOM 0 HG3 LYS B 50 85.159 -0.901 -39.098 1.00 0.00 H new ATOM 0 HD2 LYS B 50 84.276 1.329 -39.741 1.00 0.00 H new ATOM 0 HD3 LYS B 50 83.222 0.578 -38.559 1.00 0.00 H new ATOM 0 HE2 LYS B 50 83.825 3.050 -38.120 1.00 0.00 H new ATOM 0 HE3 LYS B 50 84.048 1.958 -36.768 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 85.952 3.573 -37.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 86.327 1.998 -36.978 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 86.296 2.368 -38.635 1.00 0.00 H new ATOM 914 N ARG B 51 87.854 -1.698 -38.299 1.00 0.00 N ATOM 915 CA ARG B 51 89.249 -1.453 -38.667 1.00 0.00 C ATOM 916 C ARG B 51 89.361 -1.103 -40.147 1.00 0.00 C ATOM 917 O ARG B 51 89.358 -1.985 -41.007 1.00 0.00 O ATOM 918 CB ARG B 51 90.090 -2.697 -38.364 1.00 0.00 C ATOM 919 CG ARG B 51 91.564 -2.401 -38.642 1.00 0.00 C ATOM 920 CD ARG B 51 92.411 -3.611 -38.247 1.00 0.00 C ATOM 921 NE ARG B 51 92.337 -3.830 -36.806 1.00 0.00 N ATOM 922 CZ ARG B 51 92.967 -3.051 -35.972 1.00 0.00 C ATOM 923 NH1 ARG B 51 93.682 -2.055 -36.423 1.00 0.00 N ATOM 924 NH2 ARG B 51 92.886 -3.265 -34.688 1.00 0.00 N ATOM 0 H ARG B 51 87.254 -1.988 -39.071 1.00 0.00 H new ATOM 0 HA ARG B 51 89.620 -0.611 -38.082 1.00 0.00 H new ATOM 0 HB2 ARG B 51 89.958 -2.993 -37.323 1.00 0.00 H new ATOM 0 HB3 ARG B 51 89.755 -3.533 -38.978 1.00 0.00 H new ATOM 0 HG2 ARG B 51 91.707 -2.173 -39.698 1.00 0.00 H new ATOM 0 HG3 ARG B 51 91.882 -1.523 -38.080 1.00 0.00 H new ATOM 0 HD2 ARG B 51 92.060 -4.498 -38.775 1.00 0.00 H new ATOM 0 HD3 ARG B 51 93.447 -3.451 -38.545 1.00 0.00 H new ATOM 0 HE ARG B 51 91.783 -4.606 -36.445 1.00 0.00 H new ATOM 0 HH11 ARG B 51 93.747 -1.887 -37.427 1.00 0.00 H new ATOM 0 HH12 ARG B 51 94.175 -1.445 -35.771 1.00 0.00 H new ATOM 0 HH21 ARG B 51 92.329 -4.043 -34.335 1.00 0.00 H new ATOM 0 HH22 ARG B 51 93.380 -2.654 -34.037 1.00 0.00 H new ATOM 938 N GLY B 52 89.459 0.167 -40.432 1.00 0.00 N ATOM 939 CA GLY B 52 89.571 0.627 -41.812 1.00 0.00 C ATOM 940 C GLY B 52 90.917 0.230 -42.408 1.00 0.00 C ATOM 0 H GLY B 52 89.465 0.911 -39.735 1.00 0.00 H new ATOM 0 HA2 GLY B 52 88.764 0.201 -42.409 1.00 0.00 H new ATOM 0 HA3 GLY B 52 89.457 1.710 -41.849 1.00 0.00 H new TER 944 GLY B 52 ATOM 945 N SER C 23 94.328 11.191 9.861 1.00 0.00 N ATOM 946 CA SER C 23 94.860 9.943 10.477 1.00 0.00 C ATOM 947 C SER C 23 94.585 8.765 9.549 1.00 0.00 C ATOM 948 O SER C 23 94.457 7.625 10.000 1.00 0.00 O ATOM 949 CB SER C 23 94.182 9.716 11.828 1.00 0.00 C ATOM 950 OG SER C 23 94.878 8.700 12.539 1.00 0.00 O ATOM 0 HA SER C 23 95.936 10.035 10.629 1.00 0.00 H new ATOM 0 HB2 SER C 23 94.177 10.641 12.405 1.00 0.00 H new ATOM 0 HB3 SER C 23 93.142 9.426 11.681 1.00 0.00 H new ATOM 0 HG SER C 23 94.997 7.918 11.960 1.00 0.00 H new ATOM 955 N ASP C 24 94.504 9.042 8.275 1.00 0.00 N ATOM 956 CA ASP C 24 94.251 7.999 7.285 1.00 0.00 C ATOM 957 C ASP C 24 94.370 8.558 5.869 1.00 0.00 C ATOM 958 O ASP C 24 93.419 8.501 5.089 1.00 0.00 O ATOM 959 CB ASP C 24 92.849 7.416 7.480 1.00 0.00 C ATOM 960 CG ASP C 24 92.704 6.127 6.678 1.00 0.00 C ATOM 961 OD1 ASP C 24 93.708 5.463 6.473 1.00 0.00 O ATOM 962 OD2 ASP C 24 91.593 5.822 6.278 1.00 0.00 O ATOM 0 H ASP C 24 94.608 9.979 7.886 1.00 0.00 H new ATOM 0 HA ASP C 24 94.996 7.215 7.422 1.00 0.00 H new ATOM 0 HB2 ASP C 24 92.672 7.218 8.537 1.00 0.00 H new ATOM 0 HB3 ASP C 24 92.098 8.139 7.161 1.00 0.00 H new ATOM 967 N PRO C 25 95.512 9.091 5.525 1.00 0.00 N ATOM 968 CA PRO C 25 95.760 9.671 4.171 1.00 0.00 C ATOM 969 C PRO C 25 96.017 8.584 3.125 1.00 0.00 C ATOM 970 O PRO C 25 96.393 8.879 1.989 1.00 0.00 O ATOM 971 CB PRO C 25 97.003 10.538 4.391 1.00 0.00 C ATOM 972 CG PRO C 25 97.760 9.837 5.474 1.00 0.00 C ATOM 973 CD PRO C 25 96.703 9.206 6.390 1.00 0.00 C ATOM 0 HA PRO C 25 94.907 10.230 3.786 1.00 0.00 H new ATOM 0 HB2 PRO C 25 97.597 10.620 3.480 1.00 0.00 H new ATOM 0 HB3 PRO C 25 96.733 11.552 4.687 1.00 0.00 H new ATOM 0 HG2 PRO C 25 98.420 9.076 5.058 1.00 0.00 H new ATOM 0 HG3 PRO C 25 98.388 10.536 6.027 1.00 0.00 H new ATOM 0 HD2 PRO C 25 97.024 8.232 6.760 1.00 0.00 H new ATOM 0 HD3 PRO C 25 96.506 9.829 7.262 1.00 0.00 H new ATOM 981 N LEU C 26 95.821 7.353 3.512 1.00 0.00 N ATOM 982 CA LEU C 26 96.038 6.230 2.606 1.00 0.00 C ATOM 983 C LEU C 26 95.036 6.256 1.454 1.00 0.00 C ATOM 984 O LEU C 26 95.409 6.094 0.292 1.00 0.00 O ATOM 985 CB LEU C 26 95.908 4.908 3.381 1.00 0.00 C ATOM 986 CG LEU C 26 95.992 3.706 2.426 1.00 0.00 C ATOM 987 CD1 LEU C 26 97.287 3.775 1.605 1.00 0.00 C ATOM 988 CD2 LEU C 26 95.976 2.412 3.249 1.00 0.00 C ATOM 0 H LEU C 26 95.511 7.090 4.447 1.00 0.00 H new ATOM 0 HA LEU C 26 97.041 6.312 2.188 1.00 0.00 H new ATOM 0 HB2 LEU C 26 96.698 4.840 4.129 1.00 0.00 H new ATOM 0 HB3 LEU C 26 94.959 4.887 3.917 1.00 0.00 H new ATOM 0 HG LEU C 26 95.141 3.725 1.745 1.00 0.00 H new ATOM 0 HD11 LEU C 26 97.337 2.919 0.932 1.00 0.00 H new ATOM 0 HD12 LEU C 26 97.300 4.696 1.023 1.00 0.00 H new ATOM 0 HD13 LEU C 26 98.145 3.759 2.277 1.00 0.00 H new ATOM 0 HD21 LEU C 26 96.035 1.554 2.579 1.00 0.00 H new ATOM 0 HD22 LEU C 26 96.829 2.402 3.928 1.00 0.00 H new ATOM 0 HD23 LEU C 26 95.053 2.359 3.826 1.00 0.00 H new ATOM 1000 N VAL C 27 93.788 6.447 1.779 1.00 0.00 N ATOM 1001 CA VAL C 27 92.739 6.479 0.765 1.00 0.00 C ATOM 1002 C VAL C 27 92.858 7.729 -0.103 1.00 0.00 C ATOM 1003 O VAL C 27 92.681 7.669 -1.320 1.00 0.00 O ATOM 1004 CB VAL C 27 91.367 6.447 1.440 1.00 0.00 C ATOM 1005 CG1 VAL C 27 90.272 6.549 0.378 1.00 0.00 C ATOM 1006 CG2 VAL C 27 91.213 5.130 2.206 1.00 0.00 C ATOM 0 H VAL C 27 93.459 6.584 2.735 1.00 0.00 H new ATOM 0 HA VAL C 27 92.852 5.604 0.125 1.00 0.00 H new ATOM 0 HB VAL C 27 91.280 7.286 2.131 1.00 0.00 H new ATOM 0 HG11 VAL C 27 89.295 6.526 0.860 1.00 0.00 H new ATOM 0 HG12 VAL C 27 90.384 7.484 -0.171 1.00 0.00 H new ATOM 0 HG13 VAL C 27 90.356 5.710 -0.313 1.00 0.00 H new ATOM 0 HG21 VAL C 27 90.236 5.102 2.689 1.00 0.00 H new ATOM 0 HG22 VAL C 27 91.299 4.294 1.512 1.00 0.00 H new ATOM 0 HG23 VAL C 27 91.994 5.056 2.962 1.00 0.00 H new ATOM 1016 N VAL C 28 93.154 8.837 0.519 1.00 0.00 N ATOM 1017 CA VAL C 28 93.295 10.095 -0.206 1.00 0.00 C ATOM 1018 C VAL C 28 94.518 10.052 -1.118 1.00 0.00 C ATOM 1019 O VAL C 28 94.449 10.426 -2.289 1.00 0.00 O ATOM 1020 CB VAL C 28 93.438 11.252 0.785 1.00 0.00 C ATOM 1021 CG1 VAL C 28 93.658 12.558 0.021 1.00 0.00 C ATOM 1022 CG2 VAL C 28 92.164 11.364 1.626 1.00 0.00 C ATOM 0 H VAL C 28 93.305 8.907 1.525 1.00 0.00 H new ATOM 0 HA VAL C 28 92.404 10.245 -0.816 1.00 0.00 H new ATOM 0 HB VAL C 28 94.291 11.065 1.437 1.00 0.00 H new ATOM 0 HG11 VAL C 28 93.760 13.381 0.729 1.00 0.00 H new ATOM 0 HG12 VAL C 28 94.565 12.481 -0.578 1.00 0.00 H new ATOM 0 HG13 VAL C 28 92.806 12.745 -0.633 1.00 0.00 H new ATOM 0 HG21 VAL C 28 92.265 12.188 2.332 1.00 0.00 H new ATOM 0 HG22 VAL C 28 91.312 11.549 0.972 1.00 0.00 H new ATOM 0 HG23 VAL C 28 92.006 10.435 2.173 1.00 0.00 H new ATOM 1032 N ALA C 29 95.618 9.614 -0.574 1.00 0.00 N ATOM 1033 CA ALA C 29 96.862 9.536 -1.331 1.00 0.00 C ATOM 1034 C ALA C 29 96.653 8.812 -2.659 1.00 0.00 C ATOM 1035 O ALA C 29 97.167 9.239 -3.689 1.00 0.00 O ATOM 1036 CB ALA C 29 97.929 8.808 -0.511 1.00 0.00 C ATOM 0 H ALA C 29 95.691 9.301 0.394 1.00 0.00 H new ATOM 0 HA ALA C 29 97.194 10.553 -1.541 1.00 0.00 H new ATOM 0 HB1 ALA C 29 98.855 8.754 -1.084 1.00 0.00 H new ATOM 0 HB2 ALA C 29 98.108 9.351 0.417 1.00 0.00 H new ATOM 0 HB3 ALA C 29 97.586 7.799 -0.281 1.00 0.00 H new ATOM 1042 N ALA C 30 95.918 7.735 -2.628 1.00 0.00 N ATOM 1043 CA ALA C 30 95.658 6.961 -3.841 1.00 0.00 C ATOM 1044 C ALA C 30 94.916 7.802 -4.879 1.00 0.00 C ATOM 1045 O ALA C 30 95.055 7.586 -6.083 1.00 0.00 O ATOM 1046 CB ALA C 30 94.824 5.725 -3.499 1.00 0.00 C ATOM 0 H ALA C 30 95.483 7.362 -1.784 1.00 0.00 H new ATOM 0 HA ALA C 30 96.616 6.656 -4.261 1.00 0.00 H new ATOM 0 HB1 ALA C 30 94.633 5.152 -4.407 1.00 0.00 H new ATOM 0 HB2 ALA C 30 95.368 5.105 -2.786 1.00 0.00 H new ATOM 0 HB3 ALA C 30 93.876 6.036 -3.060 1.00 0.00 H new ATOM 1052 N SER C 31 94.135 8.733 -4.410 1.00 0.00 N ATOM 1053 CA SER C 31 93.359 9.594 -5.297 1.00 0.00 C ATOM 1054 C SER C 31 94.238 10.207 -6.390 1.00 0.00 C ATOM 1055 O SER C 31 93.843 10.259 -7.555 1.00 0.00 O ATOM 1056 CB SER C 31 92.702 10.711 -4.487 1.00 0.00 C ATOM 1057 OG SER C 31 91.717 11.351 -5.287 1.00 0.00 O ATOM 0 H SER C 31 94.009 8.926 -3.416 1.00 0.00 H new ATOM 0 HA SER C 31 92.595 8.982 -5.776 1.00 0.00 H new ATOM 0 HB2 SER C 31 92.246 10.303 -3.585 1.00 0.00 H new ATOM 0 HB3 SER C 31 93.452 11.433 -4.166 1.00 0.00 H new ATOM 0 HG SER C 31 91.292 12.067 -4.771 1.00 0.00 H new ATOM 1063 N ILE C 32 95.397 10.673 -6.016 1.00 0.00 N ATOM 1064 CA ILE C 32 96.310 11.293 -6.975 1.00 0.00 C ATOM 1065 C ILE C 32 96.500 10.411 -8.211 1.00 0.00 C ATOM 1066 O ILE C 32 96.770 10.908 -9.305 1.00 0.00 O ATOM 1067 CB ILE C 32 97.673 11.553 -6.310 1.00 0.00 C ATOM 1068 CG1 ILE C 32 98.489 12.541 -7.164 1.00 0.00 C ATOM 1069 CG2 ILE C 32 98.455 10.234 -6.174 1.00 0.00 C ATOM 1070 CD1 ILE C 32 97.859 13.944 -7.138 1.00 0.00 C ATOM 0 H ILE C 32 95.745 10.642 -5.058 1.00 0.00 H new ATOM 0 HA ILE C 32 95.872 12.239 -7.294 1.00 0.00 H new ATOM 0 HB ILE C 32 97.505 11.976 -5.320 1.00 0.00 H new ATOM 0 HG12 ILE C 32 99.512 12.591 -6.791 1.00 0.00 H new ATOM 0 HG13 ILE C 32 98.542 12.181 -8.192 1.00 0.00 H new ATOM 0 HG21 ILE C 32 99.418 10.429 -5.702 1.00 0.00 H new ATOM 0 HG22 ILE C 32 97.886 9.535 -5.561 1.00 0.00 H new ATOM 0 HG23 ILE C 32 98.616 9.803 -7.162 1.00 0.00 H new ATOM 0 HD11 ILE C 32 98.455 14.622 -7.749 1.00 0.00 H new ATOM 0 HD12 ILE C 32 96.845 13.895 -7.535 1.00 0.00 H new ATOM 0 HD13 ILE C 32 97.830 14.311 -6.112 1.00 0.00 H new ATOM 1082 N ILE C 33 96.381 9.127 -8.026 1.00 0.00 N ATOM 1083 CA ILE C 33 96.562 8.181 -9.125 1.00 0.00 C ATOM 1084 C ILE C 33 95.412 8.275 -10.130 1.00 0.00 C ATOM 1085 O ILE C 33 95.603 8.031 -11.322 1.00 0.00 O ATOM 1086 CB ILE C 33 96.670 6.742 -8.576 1.00 0.00 C ATOM 1087 CG1 ILE C 33 97.815 6.677 -7.537 1.00 0.00 C ATOM 1088 CG2 ILE C 33 96.954 5.760 -9.731 1.00 0.00 C ATOM 1089 CD1 ILE C 33 98.238 5.224 -7.279 1.00 0.00 C ATOM 0 H ILE C 33 96.159 8.697 -7.128 1.00 0.00 H new ATOM 0 HA ILE C 33 97.486 8.437 -9.642 1.00 0.00 H new ATOM 0 HB ILE C 33 95.730 6.463 -8.100 1.00 0.00 H new ATOM 0 HG12 ILE C 33 98.670 7.251 -7.895 1.00 0.00 H new ATOM 0 HG13 ILE C 33 97.491 7.137 -6.603 1.00 0.00 H new ATOM 0 HG21 ILE C 33 97.029 4.747 -9.337 1.00 0.00 H new ATOM 0 HG22 ILE C 33 96.142 5.808 -10.457 1.00 0.00 H new ATOM 0 HG23 ILE C 33 97.892 6.031 -10.217 1.00 0.00 H new ATOM 0 HD11 ILE C 33 99.044 5.204 -6.545 1.00 0.00 H new ATOM 0 HD12 ILE C 33 97.387 4.659 -6.898 1.00 0.00 H new ATOM 0 HD13 ILE C 33 98.584 4.775 -8.210 1.00 0.00 H new ATOM 1101 N GLY C 34 94.241 8.598 -9.658 1.00 0.00 N ATOM 1102 CA GLY C 34 93.075 8.687 -10.536 1.00 0.00 C ATOM 1103 C GLY C 34 93.176 9.843 -11.529 1.00 0.00 C ATOM 1104 O GLY C 34 92.975 9.657 -12.726 1.00 0.00 O ATOM 0 H GLY C 34 94.054 8.806 -8.677 1.00 0.00 H new ATOM 0 HA2 GLY C 34 92.964 7.751 -11.083 1.00 0.00 H new ATOM 0 HA3 GLY C 34 92.177 8.810 -9.930 1.00 0.00 H new ATOM 1108 N ILE C 35 93.474 11.009 -11.042 1.00 0.00 N ATOM 1109 CA ILE C 35 93.587 12.176 -11.912 1.00 0.00 C ATOM 1110 C ILE C 35 94.813 12.051 -12.817 1.00 0.00 C ATOM 1111 O ILE C 35 94.840 12.586 -13.924 1.00 0.00 O ATOM 1112 CB ILE C 35 93.675 13.445 -11.054 1.00 0.00 C ATOM 1113 CG1 ILE C 35 93.942 14.678 -11.931 1.00 0.00 C ATOM 1114 CG2 ILE C 35 94.801 13.289 -10.035 1.00 0.00 C ATOM 1115 CD1 ILE C 35 92.857 14.805 -13.007 1.00 0.00 C ATOM 0 H ILE C 35 93.646 11.194 -10.054 1.00 0.00 H new ATOM 0 HA ILE C 35 92.704 12.237 -12.548 1.00 0.00 H new ATOM 0 HB ILE C 35 92.725 13.586 -10.539 1.00 0.00 H new ATOM 0 HG12 ILE C 35 93.959 15.576 -11.314 1.00 0.00 H new ATOM 0 HG13 ILE C 35 94.922 14.595 -12.400 1.00 0.00 H new ATOM 0 HG21 ILE C 35 94.866 14.189 -9.424 1.00 0.00 H new ATOM 0 HG22 ILE C 35 94.597 12.430 -9.396 1.00 0.00 H new ATOM 0 HG23 ILE C 35 95.746 13.136 -10.557 1.00 0.00 H new ATOM 0 HD11 ILE C 35 93.056 15.682 -13.623 1.00 0.00 H new ATOM 0 HD12 ILE C 35 92.860 13.913 -13.634 1.00 0.00 H new ATOM 0 HD13 ILE C 35 91.882 14.910 -12.530 1.00 0.00 H new ATOM 1127 N LEU C 36 95.815 11.369 -12.334 1.00 0.00 N ATOM 1128 CA LEU C 36 97.052 11.196 -13.091 1.00 0.00 C ATOM 1129 C LEU C 36 96.824 10.443 -14.404 1.00 0.00 C ATOM 1130 O LEU C 36 97.274 10.889 -15.459 1.00 0.00 O ATOM 1131 CB LEU C 36 98.076 10.447 -12.227 1.00 0.00 C ATOM 1132 CG LEU C 36 99.345 10.134 -13.033 1.00 0.00 C ATOM 1133 CD1 LEU C 36 99.900 11.417 -13.668 1.00 0.00 C ATOM 1134 CD2 LEU C 36 100.396 9.536 -12.091 1.00 0.00 C ATOM 0 H LEU C 36 95.812 10.918 -11.419 1.00 0.00 H new ATOM 0 HA LEU C 36 97.430 12.186 -13.348 1.00 0.00 H new ATOM 0 HB2 LEU C 36 98.333 11.049 -11.355 1.00 0.00 H new ATOM 0 HB3 LEU C 36 97.637 9.520 -11.856 1.00 0.00 H new ATOM 0 HG LEU C 36 99.104 9.425 -13.825 1.00 0.00 H new ATOM 0 HD11 LEU C 36 100.800 11.182 -14.237 1.00 0.00 H new ATOM 0 HD12 LEU C 36 99.152 11.847 -14.334 1.00 0.00 H new ATOM 0 HD13 LEU C 36 100.143 12.135 -12.885 1.00 0.00 H new ATOM 0 HD21 LEU C 36 101.302 9.310 -12.653 1.00 0.00 H new ATOM 0 HD22 LEU C 36 100.628 10.252 -11.303 1.00 0.00 H new ATOM 0 HD23 LEU C 36 100.007 8.620 -11.646 1.00 0.00 H new ATOM 1146 N HIS C 37 96.167 9.312 -14.345 1.00 0.00 N ATOM 1147 CA HIS C 37 95.941 8.523 -15.557 1.00 0.00 C ATOM 1148 C HIS C 37 95.196 9.326 -16.621 1.00 0.00 C ATOM 1149 O HIS C 37 95.356 9.079 -17.816 1.00 0.00 O ATOM 1150 CB HIS C 37 95.170 7.237 -15.238 1.00 0.00 C ATOM 1151 CG HIS C 37 93.787 7.561 -14.748 1.00 0.00 C ATOM 1152 ND1 HIS C 37 92.938 8.424 -15.424 1.00 0.00 N ATOM 1153 CD2 HIS C 37 93.090 7.134 -13.648 1.00 0.00 C ATOM 1154 CE1 HIS C 37 91.789 8.491 -14.726 1.00 0.00 C ATOM 1155 NE2 HIS C 37 91.828 7.722 -13.634 1.00 0.00 N ATOM 0 H HIS C 37 95.780 8.911 -13.491 1.00 0.00 H new ATOM 0 HA HIS C 37 96.921 8.258 -15.955 1.00 0.00 H new ATOM 0 HB2 HIS C 37 95.109 6.612 -16.129 1.00 0.00 H new ATOM 0 HB3 HIS C 37 95.705 6.663 -14.481 1.00 0.00 H new ATOM 0 HD2 HIS C 37 93.463 6.445 -12.904 1.00 0.00 H new ATOM 0 HE1 HIS C 37 90.939 9.093 -15.013 1.00 0.00 H new ATOM 0 HE2 HIS C 37 91.092 7.593 -12.940 1.00 0.00 H new ATOM 1164 N PHE C 38 94.389 10.259 -16.197 1.00 0.00 N ATOM 1165 CA PHE C 38 93.622 11.069 -17.138 1.00 0.00 C ATOM 1166 C PHE C 38 94.539 11.779 -18.132 1.00 0.00 C ATOM 1167 O PHE C 38 94.255 11.814 -19.329 1.00 0.00 O ATOM 1168 CB PHE C 38 92.795 12.110 -16.383 1.00 0.00 C ATOM 1169 CG PHE C 38 91.981 12.912 -17.372 1.00 0.00 C ATOM 1170 CD1 PHE C 38 90.839 12.349 -17.955 1.00 0.00 C ATOM 1171 CD2 PHE C 38 92.369 14.215 -17.710 1.00 0.00 C ATOM 1172 CE1 PHE C 38 90.085 13.090 -18.873 1.00 0.00 C ATOM 1173 CE2 PHE C 38 91.615 14.954 -18.628 1.00 0.00 C ATOM 1174 CZ PHE C 38 90.473 14.392 -19.210 1.00 0.00 C ATOM 0 H PHE C 38 94.237 10.486 -15.214 1.00 0.00 H new ATOM 0 HA PHE C 38 92.960 10.401 -17.690 1.00 0.00 H new ATOM 0 HB2 PHE C 38 92.137 11.619 -15.666 1.00 0.00 H new ATOM 0 HB3 PHE C 38 93.450 12.769 -15.814 1.00 0.00 H new ATOM 0 HD1 PHE C 38 90.540 11.344 -17.697 1.00 0.00 H new ATOM 0 HD2 PHE C 38 93.250 14.649 -17.262 1.00 0.00 H new ATOM 0 HE1 PHE C 38 89.203 12.657 -19.321 1.00 0.00 H new ATOM 0 HE2 PHE C 38 91.914 15.959 -18.888 1.00 0.00 H new ATOM 0 HZ PHE C 38 89.891 14.963 -19.919 1.00 0.00 H new ATOM 1184 N ILE C 39 95.610 12.341 -17.643 1.00 0.00 N ATOM 1185 CA ILE C 39 96.542 13.055 -18.511 1.00 0.00 C ATOM 1186 C ILE C 39 97.022 12.165 -19.654 1.00 0.00 C ATOM 1187 O ILE C 39 97.110 12.608 -20.798 1.00 0.00 O ATOM 1188 CB ILE C 39 97.747 13.549 -17.705 1.00 0.00 C ATOM 1189 CG1 ILE C 39 97.263 14.408 -16.532 1.00 0.00 C ATOM 1190 CG2 ILE C 39 98.653 14.391 -18.605 1.00 0.00 C ATOM 1191 CD1 ILE C 39 98.445 14.735 -15.618 1.00 0.00 C ATOM 0 H ILE C 39 95.869 12.326 -16.657 1.00 0.00 H new ATOM 0 HA ILE C 39 96.014 13.909 -18.935 1.00 0.00 H new ATOM 0 HB ILE C 39 98.302 12.691 -17.325 1.00 0.00 H new ATOM 0 HG12 ILE C 39 96.811 15.328 -16.903 1.00 0.00 H new ATOM 0 HG13 ILE C 39 96.493 13.878 -15.972 1.00 0.00 H new ATOM 0 HG21 ILE C 39 99.511 14.743 -18.031 1.00 0.00 H new ATOM 0 HG22 ILE C 39 99.000 13.784 -19.441 1.00 0.00 H new ATOM 0 HG23 ILE C 39 98.095 15.247 -18.984 1.00 0.00 H new ATOM 0 HD11 ILE C 39 98.101 15.346 -14.783 1.00 0.00 H new ATOM 0 HD12 ILE C 39 98.877 13.810 -15.237 1.00 0.00 H new ATOM 0 HD13 ILE C 39 99.200 15.283 -16.182 1.00 0.00 H new ATOM 1203 N ALA C 40 97.328 10.935 -19.350 1.00 0.00 N ATOM 1204 CA ALA C 40 97.800 10.005 -20.370 1.00 0.00 C ATOM 1205 C ALA C 40 96.669 9.631 -21.325 1.00 0.00 C ATOM 1206 O ALA C 40 96.881 9.475 -22.528 1.00 0.00 O ATOM 1207 CB ALA C 40 98.355 8.743 -19.706 1.00 0.00 C ATOM 0 H ALA C 40 97.264 10.542 -18.411 1.00 0.00 H new ATOM 0 HA ALA C 40 98.590 10.492 -20.942 1.00 0.00 H new ATOM 0 HB1 ALA C 40 98.706 8.053 -20.473 1.00 0.00 H new ATOM 0 HB2 ALA C 40 99.185 9.011 -19.052 1.00 0.00 H new ATOM 0 HB3 ALA C 40 97.570 8.265 -19.119 1.00 0.00 H new ATOM 1213 N TRP C 41 95.492 9.476 -20.784 1.00 0.00 N ATOM 1214 CA TRP C 41 94.326 9.103 -21.581 1.00 0.00 C ATOM 1215 C TRP C 41 94.192 9.995 -22.816 1.00 0.00 C ATOM 1216 O TRP C 41 93.733 9.548 -23.867 1.00 0.00 O ATOM 1217 CB TRP C 41 93.061 9.215 -20.718 1.00 0.00 C ATOM 1218 CG TRP C 41 91.927 8.470 -21.354 1.00 0.00 C ATOM 1219 CD1 TRP C 41 91.300 8.834 -22.496 1.00 0.00 C ATOM 1220 CD2 TRP C 41 91.266 7.251 -20.896 1.00 0.00 C ATOM 1221 NE1 TRP C 41 90.303 7.916 -22.772 1.00 0.00 N ATOM 1222 CE2 TRP C 41 90.243 6.923 -21.817 1.00 0.00 C ATOM 1223 CE3 TRP C 41 91.453 6.406 -19.786 1.00 0.00 C ATOM 1224 CZ2 TRP C 41 89.435 5.800 -21.643 1.00 0.00 C ATOM 1225 CZ3 TRP C 41 90.638 5.274 -19.608 1.00 0.00 C ATOM 1226 CH2 TRP C 41 89.631 4.973 -20.536 1.00 0.00 C ATOM 0 H TRP C 41 95.301 9.600 -19.790 1.00 0.00 H new ATOM 0 HA TRP C 41 94.454 8.075 -21.920 1.00 0.00 H new ATOM 0 HB2 TRP C 41 93.255 8.814 -19.723 1.00 0.00 H new ATOM 0 HB3 TRP C 41 92.791 10.263 -20.592 1.00 0.00 H new ATOM 0 HD1 TRP C 41 91.539 9.700 -23.095 1.00 0.00 H new ATOM 0 HE1 TRP C 41 89.687 7.967 -23.583 1.00 0.00 H new ATOM 0 HE3 TRP C 41 92.227 6.628 -19.067 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 88.661 5.571 -22.361 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 90.789 4.633 -18.752 1.00 0.00 H new ATOM 0 HH2 TRP C 41 89.008 4.102 -20.394 1.00 0.00 H new ATOM 1237 N THR C 42 94.591 11.232 -22.690 1.00 0.00 N ATOM 1238 CA THR C 42 94.506 12.168 -23.813 1.00 0.00 C ATOM 1239 C THR C 42 95.436 11.746 -24.947 1.00 0.00 C ATOM 1240 O THR C 42 95.098 11.880 -26.123 1.00 0.00 O ATOM 1241 CB THR C 42 94.877 13.583 -23.359 1.00 0.00 C ATOM 1242 OG1 THR C 42 96.146 13.558 -22.722 1.00 0.00 O ATOM 1243 CG2 THR C 42 93.822 14.106 -22.384 1.00 0.00 C ATOM 0 H THR C 42 94.978 11.627 -21.833 1.00 0.00 H new ATOM 0 HA THR C 42 93.478 12.159 -24.175 1.00 0.00 H new ATOM 0 HB THR C 42 94.920 14.241 -24.227 1.00 0.00 H new ATOM 0 HG1 THR C 42 96.043 13.244 -21.799 1.00 0.00 H new ATOM 0 HG21 THR C 42 94.090 15.113 -22.064 1.00 0.00 H new ATOM 0 HG22 THR C 42 92.850 14.129 -22.877 1.00 0.00 H new ATOM 0 HG23 THR C 42 93.773 13.450 -21.515 1.00 0.00 H new ATOM 1251 N ILE C 43 96.591 11.257 -24.592 1.00 0.00 N ATOM 1252 CA ILE C 43 97.573 10.832 -25.586 1.00 0.00 C ATOM 1253 C ILE C 43 97.015 9.711 -26.464 1.00 0.00 C ATOM 1254 O ILE C 43 97.085 9.780 -27.690 1.00 0.00 O ATOM 1255 CB ILE C 43 98.835 10.346 -24.868 1.00 0.00 C ATOM 1256 CG1 ILE C 43 99.288 11.397 -23.842 1.00 0.00 C ATOM 1257 CG2 ILE C 43 99.954 10.106 -25.883 1.00 0.00 C ATOM 1258 CD1 ILE C 43 99.441 12.770 -24.508 1.00 0.00 C ATOM 0 H ILE C 43 96.888 11.137 -23.624 1.00 0.00 H new ATOM 0 HA ILE C 43 97.811 11.680 -26.228 1.00 0.00 H new ATOM 0 HB ILE C 43 98.611 9.412 -24.353 1.00 0.00 H new ATOM 0 HG12 ILE C 43 98.562 11.459 -23.032 1.00 0.00 H new ATOM 0 HG13 ILE C 43 100.236 11.094 -23.398 1.00 0.00 H new ATOM 0 HG21 ILE C 43 100.848 9.761 -25.364 1.00 0.00 H new ATOM 0 HG22 ILE C 43 99.637 9.351 -26.602 1.00 0.00 H new ATOM 0 HG23 ILE C 43 100.175 11.036 -26.407 1.00 0.00 H new ATOM 0 HD11 ILE C 43 99.762 13.501 -23.766 1.00 0.00 H new ATOM 0 HD12 ILE C 43 100.185 12.708 -25.302 1.00 0.00 H new ATOM 0 HD13 ILE C 43 98.485 13.078 -24.930 1.00 0.00 H new ATOM 1270 N GLY C 44 96.482 8.694 -25.840 1.00 0.00 N ATOM 1271 CA GLY C 44 95.928 7.556 -26.572 1.00 0.00 C ATOM 1272 C GLY C 44 94.964 8.002 -27.671 1.00 0.00 C ATOM 1273 O GLY C 44 94.810 7.321 -28.685 1.00 0.00 O ATOM 0 H GLY C 44 96.414 8.618 -24.825 1.00 0.00 H new ATOM 0 HA2 GLY C 44 96.740 6.978 -27.013 1.00 0.00 H new ATOM 0 HA3 GLY C 44 95.408 6.896 -25.878 1.00 0.00 H new ATOM 1277 N HIS C 45 94.319 9.115 -27.462 1.00 0.00 N ATOM 1278 CA HIS C 45 93.360 9.633 -28.432 1.00 0.00 C ATOM 1279 C HIS C 45 93.944 9.679 -29.845 1.00 0.00 C ATOM 1280 O HIS C 45 93.204 9.621 -30.826 1.00 0.00 O ATOM 1281 CB HIS C 45 92.908 11.034 -28.018 1.00 0.00 C ATOM 1282 CG HIS C 45 91.712 11.434 -28.840 1.00 0.00 C ATOM 1283 ND1 HIS C 45 91.727 12.531 -29.686 1.00 0.00 N ATOM 1284 CD2 HIS C 45 90.459 10.885 -28.960 1.00 0.00 C ATOM 1285 CE1 HIS C 45 90.518 12.607 -30.272 1.00 0.00 C ATOM 1286 NE2 HIS C 45 89.708 11.627 -29.864 1.00 0.00 N ATOM 0 H HIS C 45 94.432 9.692 -26.629 1.00 0.00 H new ATOM 0 HA HIS C 45 92.507 8.955 -28.446 1.00 0.00 H new ATOM 0 HB2 HIS C 45 92.656 11.049 -26.958 1.00 0.00 H new ATOM 0 HB3 HIS C 45 93.719 11.748 -28.163 1.00 0.00 H new ATOM 0 HD2 HIS C 45 90.110 10.010 -28.432 1.00 0.00 H new ATOM 0 HE1 HIS C 45 90.237 13.368 -30.985 1.00 0.00 H new ATOM 0 HE2 HIS C 45 88.745 11.459 -30.154 1.00 0.00 H new ATOM 1295 N LEU C 46 95.237 9.827 -29.949 1.00 0.00 N ATOM 1296 CA LEU C 46 95.875 9.932 -31.259 1.00 0.00 C ATOM 1297 C LEU C 46 95.342 8.864 -32.213 1.00 0.00 C ATOM 1298 O LEU C 46 95.266 9.091 -33.415 1.00 0.00 O ATOM 1299 CB LEU C 46 97.406 9.814 -31.116 1.00 0.00 C ATOM 1300 CG LEU C 46 97.837 8.337 -30.893 1.00 0.00 C ATOM 1301 CD1 LEU C 46 98.270 7.691 -32.225 1.00 0.00 C ATOM 1302 CD2 LEU C 46 99.018 8.278 -29.908 1.00 0.00 C ATOM 0 H LEU C 46 95.877 9.879 -29.156 1.00 0.00 H new ATOM 0 HA LEU C 46 95.636 10.909 -31.680 1.00 0.00 H new ATOM 0 HB2 LEU C 46 97.889 10.205 -32.011 1.00 0.00 H new ATOM 0 HB3 LEU C 46 97.744 10.425 -30.279 1.00 0.00 H new ATOM 0 HG LEU C 46 96.985 7.792 -30.487 1.00 0.00 H new ATOM 0 HD11 LEU C 46 98.568 6.658 -32.048 1.00 0.00 H new ATOM 0 HD12 LEU C 46 97.437 7.713 -32.928 1.00 0.00 H new ATOM 0 HD13 LEU C 46 99.111 8.245 -32.642 1.00 0.00 H new ATOM 0 HD21 LEU C 46 99.314 7.240 -29.757 1.00 0.00 H new ATOM 0 HD22 LEU C 46 99.859 8.840 -30.314 1.00 0.00 H new ATOM 0 HD23 LEU C 46 98.718 8.712 -28.954 1.00 0.00 H new ATOM 1314 N ASN C 47 94.995 7.720 -31.705 1.00 0.00 N ATOM 1315 CA ASN C 47 94.478 6.659 -32.565 1.00 0.00 C ATOM 1316 C ASN C 47 93.187 7.092 -33.283 1.00 0.00 C ATOM 1317 O ASN C 47 93.005 6.802 -34.466 1.00 0.00 O ATOM 1318 CB ASN C 47 94.202 5.407 -31.732 1.00 0.00 C ATOM 1319 CG ASN C 47 93.018 5.648 -30.801 1.00 0.00 C ATOM 1320 OD1 ASN C 47 92.171 4.771 -30.632 1.00 0.00 O ATOM 1321 ND2 ASN C 47 92.907 6.793 -30.185 1.00 0.00 N ATOM 0 H ASN C 47 95.053 7.484 -30.714 1.00 0.00 H new ATOM 0 HA ASN C 47 95.232 6.445 -33.322 1.00 0.00 H new ATOM 0 HB2 ASN C 47 93.992 4.563 -32.389 1.00 0.00 H new ATOM 0 HB3 ASN C 47 95.086 5.146 -31.149 1.00 0.00 H new ATOM 0 HD21 ASN C 47 92.117 6.963 -29.562 1.00 0.00 H new ATOM 0 HD22 ASN C 47 93.610 7.518 -30.326 1.00 0.00 H new ATOM 1328 N GLN C 48 92.297 7.747 -32.569 1.00 0.00 N ATOM 1329 CA GLN C 48 91.015 8.182 -33.135 1.00 0.00 C ATOM 1330 C GLN C 48 91.103 9.559 -33.819 1.00 0.00 C ATOM 1331 O GLN C 48 90.557 10.536 -33.309 1.00 0.00 O ATOM 1332 CB GLN C 48 89.975 8.256 -32.014 1.00 0.00 C ATOM 1333 CG GLN C 48 88.575 8.437 -32.611 1.00 0.00 C ATOM 1334 CD GLN C 48 87.560 8.649 -31.494 1.00 0.00 C ATOM 1335 OE1 GLN C 48 87.925 8.655 -30.320 1.00 0.00 O ATOM 1336 NE2 GLN C 48 86.302 8.827 -31.792 1.00 0.00 N ATOM 0 H GLN C 48 92.429 7.996 -31.589 1.00 0.00 H new ATOM 0 HA GLN C 48 90.731 7.454 -33.895 1.00 0.00 H new ATOM 0 HB2 GLN C 48 90.009 7.347 -31.414 1.00 0.00 H new ATOM 0 HB3 GLN C 48 90.205 9.087 -31.347 1.00 0.00 H new ATOM 0 HG2 GLN C 48 88.567 9.290 -33.289 1.00 0.00 H new ATOM 0 HG3 GLN C 48 88.304 7.560 -33.199 1.00 0.00 H new ATOM 0 HE21 GLN C 48 86.003 8.821 -32.767 1.00 0.00 H new ATOM 0 HE22 GLN C 48 85.618 8.972 -31.050 1.00 0.00 H new ATOM 1345 N ILE C 49 91.741 9.629 -34.966 1.00 0.00 N ATOM 1346 CA ILE C 49 91.838 10.895 -35.709 1.00 0.00 C ATOM 1347 C ILE C 49 92.659 10.702 -36.996 1.00 0.00 C ATOM 1348 O ILE C 49 92.085 10.566 -38.077 1.00 0.00 O ATOM 1349 CB ILE C 49 92.415 12.031 -34.821 1.00 0.00 C ATOM 1350 CG1 ILE C 49 92.937 13.182 -35.709 1.00 0.00 C ATOM 1351 CG2 ILE C 49 93.545 11.500 -33.920 1.00 0.00 C ATOM 1352 CD1 ILE C 49 93.088 14.454 -34.872 1.00 0.00 C ATOM 0 H ILE C 49 92.202 8.837 -35.414 1.00 0.00 H new ATOM 0 HA ILE C 49 90.832 11.200 -35.997 1.00 0.00 H new ATOM 0 HB ILE C 49 91.617 12.408 -34.181 1.00 0.00 H new ATOM 0 HG12 ILE C 49 93.896 12.909 -36.148 1.00 0.00 H new ATOM 0 HG13 ILE C 49 92.247 13.358 -36.534 1.00 0.00 H new ATOM 0 HG21 ILE C 49 93.934 12.313 -33.307 1.00 0.00 H new ATOM 0 HG22 ILE C 49 93.156 10.713 -33.274 1.00 0.00 H new ATOM 0 HG23 ILE C 49 94.346 11.098 -34.540 1.00 0.00 H new ATOM 0 HD11 ILE C 49 93.456 15.263 -35.503 1.00 0.00 H new ATOM 0 HD12 ILE C 49 92.120 14.732 -34.454 1.00 0.00 H new ATOM 0 HD13 ILE C 49 93.795 14.275 -34.062 1.00 0.00 H new ATOM 1364 N LYS C 50 93.964 10.680 -36.891 1.00 0.00 N ATOM 1365 CA LYS C 50 94.805 10.490 -38.064 1.00 0.00 C ATOM 1366 C LYS C 50 94.492 9.149 -38.722 1.00 0.00 C ATOM 1367 O LYS C 50 94.362 8.131 -38.042 1.00 0.00 O ATOM 1368 CB LYS C 50 96.281 10.536 -37.659 1.00 0.00 C ATOM 1369 CG LYS C 50 96.489 9.720 -36.378 1.00 0.00 C ATOM 1370 CD LYS C 50 97.976 9.397 -36.204 1.00 0.00 C ATOM 1371 CE LYS C 50 98.767 10.691 -36.002 1.00 0.00 C ATOM 1372 NZ LYS C 50 100.150 10.366 -35.554 1.00 0.00 N ATOM 0 H LYS C 50 94.473 10.790 -36.014 1.00 0.00 H new ATOM 0 HA LYS C 50 94.603 11.290 -38.776 1.00 0.00 H new ATOM 0 HB2 LYS C 50 96.901 10.136 -38.461 1.00 0.00 H new ATOM 0 HB3 LYS C 50 96.593 11.568 -37.499 1.00 0.00 H new ATOM 0 HG2 LYS C 50 96.126 10.280 -35.516 1.00 0.00 H new ATOM 0 HG3 LYS C 50 95.910 8.798 -36.426 1.00 0.00 H new ATOM 0 HD2 LYS C 50 98.116 8.737 -35.348 1.00 0.00 H new ATOM 0 HD3 LYS C 50 98.347 8.866 -37.081 1.00 0.00 H new ATOM 0 HE2 LYS C 50 98.799 11.259 -36.932 1.00 0.00 H new ATOM 0 HE3 LYS C 50 98.272 11.320 -35.262 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 100.686 11.246 -35.417 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 100.110 9.842 -34.657 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 100.620 9.783 -36.275 1.00 0.00 H new ATOM 1386 N ARG C 51 94.363 9.157 -40.020 1.00 0.00 N ATOM 1387 CA ARG C 51 94.055 7.937 -40.760 1.00 0.00 C ATOM 1388 C ARG C 51 92.683 7.396 -40.353 1.00 0.00 C ATOM 1389 O ARG C 51 92.191 6.424 -40.926 1.00 0.00 O ATOM 1390 CB ARG C 51 95.135 6.878 -40.496 1.00 0.00 C ATOM 1391 CG ARG C 51 95.067 5.788 -41.571 1.00 0.00 C ATOM 1392 CD ARG C 51 96.202 4.787 -41.361 1.00 0.00 C ATOM 1393 NE ARG C 51 97.491 5.416 -41.623 1.00 0.00 N ATOM 1394 CZ ARG C 51 98.601 4.734 -41.547 1.00 0.00 C ATOM 1395 NH1 ARG C 51 98.568 3.467 -41.237 1.00 0.00 N ATOM 1396 NH2 ARG C 51 99.743 5.319 -41.784 1.00 0.00 N ATOM 0 H ARG C 51 94.464 9.990 -40.600 1.00 0.00 H new ATOM 0 HA ARG C 51 94.035 8.171 -41.824 1.00 0.00 H new ATOM 0 HB2 ARG C 51 96.121 7.343 -40.498 1.00 0.00 H new ATOM 0 HB3 ARG C 51 94.992 6.438 -39.509 1.00 0.00 H new ATOM 0 HG2 ARG C 51 94.105 5.277 -41.524 1.00 0.00 H new ATOM 0 HG3 ARG C 51 95.143 6.236 -42.562 1.00 0.00 H new ATOM 0 HD2 ARG C 51 96.176 4.408 -40.339 1.00 0.00 H new ATOM 0 HD3 ARG C 51 96.067 3.931 -42.022 1.00 0.00 H new ATOM 0 HE ARG C 51 97.526 6.405 -41.870 1.00 0.00 H new ATOM 0 HH11 ARG C 51 97.675 3.010 -41.054 1.00 0.00 H new ATOM 0 HH12 ARG C 51 99.435 2.934 -41.178 1.00 0.00 H new ATOM 0 HH21 ARG C 51 99.768 6.309 -42.029 1.00 0.00 H new ATOM 0 HH22 ARG C 51 100.611 4.786 -41.725 1.00 0.00 H new ATOM 1410 N GLY C 52 92.076 8.021 -39.380 1.00 0.00 N ATOM 1411 CA GLY C 52 90.764 7.593 -38.912 1.00 0.00 C ATOM 1412 C GLY C 52 90.440 8.211 -37.557 1.00 0.00 C ATOM 0 H GLY C 52 92.460 8.829 -38.890 1.00 0.00 H new ATOM 0 HA2 GLY C 52 90.003 7.880 -39.638 1.00 0.00 H new ATOM 0 HA3 GLY C 52 90.738 6.506 -38.836 1.00 0.00 H new TER 1416 GLY C 52 ATOM 1417 N SER D 23 86.086 -0.640 9.060 1.00 0.00 N ATOM 1418 CA SER D 23 87.153 -1.263 9.894 1.00 0.00 C ATOM 1419 C SER D 23 87.953 -2.242 9.043 1.00 0.00 C ATOM 1420 O SER D 23 89.159 -2.404 9.236 1.00 0.00 O ATOM 1421 CB SER D 23 86.511 -1.998 11.072 1.00 0.00 C ATOM 1422 OG SER D 23 85.778 -1.069 11.861 1.00 0.00 O ATOM 0 HA SER D 23 87.822 -0.491 10.275 1.00 0.00 H new ATOM 0 HB2 SER D 23 85.850 -2.785 10.708 1.00 0.00 H new ATOM 0 HB3 SER D 23 87.279 -2.481 11.677 1.00 0.00 H new ATOM 0 HG SER D 23 85.477 -0.327 11.297 1.00 0.00 H new ATOM 1427 N ASP D 24 87.288 -2.882 8.120 1.00 0.00 N ATOM 1428 CA ASP D 24 87.945 -3.847 7.241 1.00 0.00 C ATOM 1429 C ASP D 24 88.683 -3.120 6.111 1.00 0.00 C ATOM 1430 O ASP D 24 88.262 -2.042 5.691 1.00 0.00 O ATOM 1431 CB ASP D 24 86.897 -4.792 6.646 1.00 0.00 C ATOM 1432 CG ASP D 24 86.357 -5.720 7.729 1.00 0.00 C ATOM 1433 OD1 ASP D 24 86.970 -6.749 7.960 1.00 0.00 O ATOM 1434 OD2 ASP D 24 85.338 -5.387 8.311 1.00 0.00 O ATOM 0 H ASP D 24 86.290 -2.762 7.947 1.00 0.00 H new ATOM 0 HA ASP D 24 88.668 -4.420 7.822 1.00 0.00 H new ATOM 0 HB2 ASP D 24 86.081 -4.215 6.210 1.00 0.00 H new ATOM 0 HB3 ASP D 24 87.339 -5.378 5.841 1.00 0.00 H new ATOM 1439 N PRO D 25 89.764 -3.676 5.608 1.00 0.00 N ATOM 1440 CA PRO D 25 90.544 -3.039 4.502 1.00 0.00 C ATOM 1441 C PRO D 25 89.825 -3.154 3.155 1.00 0.00 C ATOM 1442 O PRO D 25 90.445 -3.422 2.126 1.00 0.00 O ATOM 1443 CB PRO D 25 91.862 -3.828 4.504 1.00 0.00 C ATOM 1444 CG PRO D 25 91.484 -5.184 5.001 1.00 0.00 C ATOM 1445 CD PRO D 25 90.367 -4.958 6.024 1.00 0.00 C ATOM 0 HA PRO D 25 90.684 -1.968 4.649 1.00 0.00 H new ATOM 0 HB2 PRO D 25 92.296 -3.878 3.506 1.00 0.00 H new ATOM 0 HB3 PRO D 25 92.604 -3.360 5.151 1.00 0.00 H new ATOM 0 HG2 PRO D 25 91.143 -5.819 4.183 1.00 0.00 H new ATOM 0 HG3 PRO D 25 92.337 -5.685 5.458 1.00 0.00 H new ATOM 0 HD2 PRO D 25 89.638 -5.768 6.006 1.00 0.00 H new ATOM 0 HD3 PRO D 25 90.759 -4.905 7.040 1.00 0.00 H new ATOM 1453 N LEU D 26 88.535 -2.952 3.174 1.00 0.00 N ATOM 1454 CA LEU D 26 87.740 -3.034 1.953 1.00 0.00 C ATOM 1455 C LEU D 26 88.130 -1.923 0.980 1.00 0.00 C ATOM 1456 O LEU D 26 88.360 -2.173 -0.204 1.00 0.00 O ATOM 1457 CB LEU D 26 86.248 -2.921 2.300 1.00 0.00 C ATOM 1458 CG LEU D 26 85.383 -3.071 1.037 1.00 0.00 C ATOM 1459 CD1 LEU D 26 85.561 -4.474 0.431 1.00 0.00 C ATOM 1460 CD2 LEU D 26 83.913 -2.856 1.415 1.00 0.00 C ATOM 0 H LEU D 26 88.002 -2.729 4.015 1.00 0.00 H new ATOM 0 HA LEU D 26 87.932 -3.995 1.476 1.00 0.00 H new ATOM 0 HB2 LEU D 26 85.979 -3.690 3.024 1.00 0.00 H new ATOM 0 HB3 LEU D 26 86.051 -1.957 2.770 1.00 0.00 H new ATOM 0 HG LEU D 26 85.691 -2.332 0.298 1.00 0.00 H new ATOM 0 HD11 LEU D 26 84.943 -4.566 -0.462 1.00 0.00 H new ATOM 0 HD12 LEU D 26 86.607 -4.626 0.165 1.00 0.00 H new ATOM 0 HD13 LEU D 26 85.259 -5.226 1.160 1.00 0.00 H new ATOM 0 HD21 LEU D 26 83.290 -2.960 0.527 1.00 0.00 H new ATOM 0 HD22 LEU D 26 83.616 -3.598 2.156 1.00 0.00 H new ATOM 0 HD23 LEU D 26 83.787 -1.857 1.832 1.00 0.00 H new ATOM 1472 N VAL D 27 88.196 -0.719 1.477 1.00 0.00 N ATOM 1473 CA VAL D 27 88.553 0.428 0.648 1.00 0.00 C ATOM 1474 C VAL D 27 90.026 0.382 0.246 1.00 0.00 C ATOM 1475 O VAL D 27 90.393 0.797 -0.853 1.00 0.00 O ATOM 1476 CB VAL D 27 88.268 1.726 1.407 1.00 0.00 C ATOM 1477 CG1 VAL D 27 88.461 2.918 0.470 1.00 0.00 C ATOM 1478 CG2 VAL D 27 86.826 1.708 1.920 1.00 0.00 C ATOM 0 H VAL D 27 88.009 -0.493 2.454 1.00 0.00 H new ATOM 0 HA VAL D 27 87.949 0.392 -0.259 1.00 0.00 H new ATOM 0 HB VAL D 27 88.954 1.813 2.250 1.00 0.00 H new ATOM 0 HG11 VAL D 27 88.258 3.842 1.011 1.00 0.00 H new ATOM 0 HG12 VAL D 27 89.487 2.930 0.103 1.00 0.00 H new ATOM 0 HG13 VAL D 27 87.775 2.833 -0.373 1.00 0.00 H new ATOM 0 HG21 VAL D 27 86.621 2.632 2.461 1.00 0.00 H new ATOM 0 HG22 VAL D 27 86.141 1.622 1.077 1.00 0.00 H new ATOM 0 HG23 VAL D 27 86.688 0.858 2.588 1.00 0.00 H new ATOM 1488 N VAL D 28 90.848 -0.117 1.127 1.00 0.00 N ATOM 1489 CA VAL D 28 92.280 -0.212 0.855 1.00 0.00 C ATOM 1490 C VAL D 28 92.553 -1.268 -0.213 1.00 0.00 C ATOM 1491 O VAL D 28 93.331 -1.044 -1.140 1.00 0.00 O ATOM 1492 CB VAL D 28 93.035 -0.567 2.138 1.00 0.00 C ATOM 1493 CG1 VAL D 28 94.521 -0.744 1.826 1.00 0.00 C ATOM 1494 CG2 VAL D 28 92.858 0.558 3.161 1.00 0.00 C ATOM 0 H VAL D 28 90.565 -0.467 2.042 1.00 0.00 H new ATOM 0 HA VAL D 28 92.627 0.754 0.489 1.00 0.00 H new ATOM 0 HB VAL D 28 92.638 -1.496 2.547 1.00 0.00 H new ATOM 0 HG11 VAL D 28 95.057 -0.997 2.741 1.00 0.00 H new ATOM 0 HG12 VAL D 28 94.647 -1.546 1.098 1.00 0.00 H new ATOM 0 HG13 VAL D 28 94.920 0.184 1.416 1.00 0.00 H new ATOM 0 HG21 VAL D 28 93.395 0.306 4.075 1.00 0.00 H new ATOM 0 HG22 VAL D 28 93.254 1.488 2.752 1.00 0.00 H new ATOM 0 HG23 VAL D 28 91.799 0.682 3.385 1.00 0.00 H new ATOM 1504 N ALA D 29 91.926 -2.403 -0.068 1.00 0.00 N ATOM 1505 CA ALA D 29 92.112 -3.498 -1.015 1.00 0.00 C ATOM 1506 C ALA D 29 91.954 -3.011 -2.454 1.00 0.00 C ATOM 1507 O ALA D 29 92.632 -3.496 -3.361 1.00 0.00 O ATOM 1508 CB ALA D 29 91.094 -4.606 -0.737 1.00 0.00 C ATOM 0 H ALA D 29 91.279 -2.606 0.694 1.00 0.00 H new ATOM 0 HA ALA D 29 93.122 -3.887 -0.889 1.00 0.00 H new ATOM 0 HB1 ALA D 29 91.239 -5.420 -1.448 1.00 0.00 H new ATOM 0 HB2 ALA D 29 91.232 -4.981 0.277 1.00 0.00 H new ATOM 0 HB3 ALA D 29 90.085 -4.208 -0.842 1.00 0.00 H new ATOM 1514 N ALA D 30 91.071 -2.072 -2.654 1.00 0.00 N ATOM 1515 CA ALA D 30 90.832 -1.532 -3.989 1.00 0.00 C ATOM 1516 C ALA D 30 92.053 -0.768 -4.499 1.00 0.00 C ATOM 1517 O ALA D 30 92.293 -0.697 -5.704 1.00 0.00 O ATOM 1518 CB ALA D 30 89.620 -0.599 -3.964 1.00 0.00 C ATOM 0 H ALA D 30 90.499 -1.657 -1.919 1.00 0.00 H new ATOM 0 HA ALA D 30 90.640 -2.367 -4.663 1.00 0.00 H new ATOM 0 HB1 ALA D 30 89.448 -0.200 -4.963 1.00 0.00 H new ATOM 0 HB2 ALA D 30 88.740 -1.154 -3.638 1.00 0.00 H new ATOM 0 HB3 ALA D 30 89.807 0.222 -3.272 1.00 0.00 H new ATOM 1524 N SER D 31 92.799 -0.197 -3.592 1.00 0.00 N ATOM 1525 CA SER D 31 93.985 0.570 -3.962 1.00 0.00 C ATOM 1526 C SER D 31 94.936 -0.268 -4.814 1.00 0.00 C ATOM 1527 O SER D 31 95.497 0.222 -5.794 1.00 0.00 O ATOM 1528 CB SER D 31 94.711 1.048 -2.705 1.00 0.00 C ATOM 1529 OG SER D 31 95.814 1.861 -3.081 1.00 0.00 O ATOM 0 H SER D 31 92.617 -0.241 -2.589 1.00 0.00 H new ATOM 0 HA SER D 31 93.662 1.431 -4.548 1.00 0.00 H new ATOM 0 HB2 SER D 31 94.029 1.612 -2.069 1.00 0.00 H new ATOM 0 HB3 SER D 31 95.056 0.193 -2.123 1.00 0.00 H new ATOM 0 HG SER D 31 96.281 2.171 -2.277 1.00 0.00 H new ATOM 1535 N ILE D 32 95.114 -1.505 -4.441 1.00 0.00 N ATOM 1536 CA ILE D 32 96.005 -2.393 -5.182 1.00 0.00 C ATOM 1537 C ILE D 32 95.627 -2.427 -6.660 1.00 0.00 C ATOM 1538 O ILE D 32 96.485 -2.581 -7.528 1.00 0.00 O ATOM 1539 CB ILE D 32 95.932 -3.805 -4.602 1.00 0.00 C ATOM 1540 CG1 ILE D 32 96.364 -3.774 -3.133 1.00 0.00 C ATOM 1541 CG2 ILE D 32 96.864 -4.730 -5.387 1.00 0.00 C ATOM 1542 CD1 ILE D 32 96.049 -5.119 -2.478 1.00 0.00 C ATOM 0 H ILE D 32 94.661 -1.932 -3.633 1.00 0.00 H new ATOM 0 HA ILE D 32 97.023 -2.013 -5.090 1.00 0.00 H new ATOM 0 HB ILE D 32 94.909 -4.175 -4.674 1.00 0.00 H new ATOM 0 HG12 ILE D 32 97.431 -3.564 -3.062 1.00 0.00 H new ATOM 0 HG13 ILE D 32 95.846 -2.972 -2.608 1.00 0.00 H new ATOM 0 HG21 ILE D 32 96.811 -5.737 -4.973 1.00 0.00 H new ATOM 0 HG22 ILE D 32 96.559 -4.752 -6.433 1.00 0.00 H new ATOM 0 HG23 ILE D 32 97.887 -4.361 -5.315 1.00 0.00 H new ATOM 0 HD11 ILE D 32 96.357 -5.096 -1.433 1.00 0.00 H new ATOM 0 HD12 ILE D 32 94.977 -5.310 -2.536 1.00 0.00 H new ATOM 0 HD13 ILE D 32 96.588 -5.912 -2.997 1.00 0.00 H new ATOM 1554 N ILE D 33 94.362 -2.275 -6.933 1.00 0.00 N ATOM 1555 CA ILE D 33 93.882 -2.279 -8.311 1.00 0.00 C ATOM 1556 C ILE D 33 94.324 -0.997 -9.026 1.00 0.00 C ATOM 1557 O ILE D 33 94.517 -0.989 -10.242 1.00 0.00 O ATOM 1558 CB ILE D 33 92.345 -2.413 -8.341 1.00 0.00 C ATOM 1559 CG1 ILE D 33 91.928 -3.685 -7.563 1.00 0.00 C ATOM 1560 CG2 ILE D 33 91.857 -2.505 -9.801 1.00 0.00 C ATOM 1561 CD1 ILE D 33 90.505 -4.122 -7.944 1.00 0.00 C ATOM 0 H ILE D 33 93.635 -2.146 -6.229 1.00 0.00 H new ATOM 0 HA ILE D 33 94.313 -3.134 -8.832 1.00 0.00 H new ATOM 0 HB ILE D 33 91.893 -1.538 -7.873 1.00 0.00 H new ATOM 0 HG12 ILE D 33 92.629 -4.492 -7.776 1.00 0.00 H new ATOM 0 HG13 ILE D 33 91.979 -3.493 -6.491 1.00 0.00 H new ATOM 0 HG21 ILE D 33 90.771 -2.599 -9.816 1.00 0.00 H new ATOM 0 HG22 ILE D 33 92.151 -1.604 -10.340 1.00 0.00 H new ATOM 0 HG23 ILE D 33 92.304 -3.376 -10.280 1.00 0.00 H new ATOM 0 HD11 ILE D 33 90.237 -5.018 -7.383 1.00 0.00 H new ATOM 0 HD12 ILE D 33 89.803 -3.322 -7.708 1.00 0.00 H new ATOM 0 HD13 ILE D 33 90.464 -4.337 -9.012 1.00 0.00 H new ATOM 1573 N GLY D 34 94.466 0.065 -8.279 1.00 0.00 N ATOM 1574 CA GLY D 34 94.868 1.348 -8.853 1.00 0.00 C ATOM 1575 C GLY D 34 96.290 1.316 -9.411 1.00 0.00 C ATOM 1576 O GLY D 34 96.540 1.817 -10.507 1.00 0.00 O ATOM 0 H GLY D 34 94.312 0.081 -7.271 1.00 0.00 H new ATOM 0 HA2 GLY D 34 94.174 1.620 -9.649 1.00 0.00 H new ATOM 0 HA3 GLY D 34 94.797 2.123 -8.089 1.00 0.00 H new ATOM 1580 N ILE D 35 97.204 0.751 -8.669 1.00 0.00 N ATOM 1581 CA ILE D 35 98.595 0.686 -9.117 1.00 0.00 C ATOM 1582 C ILE D 35 98.732 -0.200 -10.351 1.00 0.00 C ATOM 1583 O ILE D 35 99.512 0.096 -11.258 1.00 0.00 O ATOM 1584 CB ILE D 35 99.496 0.155 -7.996 1.00 0.00 C ATOM 1585 CG1 ILE D 35 98.891 -1.113 -7.390 1.00 0.00 C ATOM 1586 CG2 ILE D 35 99.635 1.219 -6.905 1.00 0.00 C ATOM 1587 CD1 ILE D 35 99.868 -1.701 -6.370 1.00 0.00 C ATOM 0 H ILE D 35 97.027 0.329 -7.758 1.00 0.00 H new ATOM 0 HA ILE D 35 98.908 1.697 -9.379 1.00 0.00 H new ATOM 0 HB ILE D 35 100.476 -0.079 -8.411 1.00 0.00 H new ATOM 0 HG12 ILE D 35 97.940 -0.882 -6.909 1.00 0.00 H new ATOM 0 HG13 ILE D 35 98.683 -1.841 -8.174 1.00 0.00 H new ATOM 0 HG21 ILE D 35 100.276 0.841 -6.108 1.00 0.00 H new ATOM 0 HG22 ILE D 35 100.077 2.120 -7.330 1.00 0.00 H new ATOM 0 HG23 ILE D 35 98.651 1.454 -6.499 1.00 0.00 H new ATOM 0 HD11 ILE D 35 99.441 -2.605 -5.936 1.00 0.00 H new ATOM 0 HD12 ILE D 35 100.808 -1.946 -6.865 1.00 0.00 H new ATOM 0 HD13 ILE D 35 100.053 -0.972 -5.581 1.00 0.00 H new ATOM 1599 N LEU D 36 97.993 -1.272 -10.374 1.00 0.00 N ATOM 1600 CA LEU D 36 98.048 -2.202 -11.495 1.00 0.00 C ATOM 1601 C LEU D 36 97.915 -1.455 -12.817 1.00 0.00 C ATOM 1602 O LEU D 36 98.581 -1.785 -13.793 1.00 0.00 O ATOM 1603 CB LEU D 36 96.921 -3.234 -11.370 1.00 0.00 C ATOM 1604 CG LEU D 36 97.029 -4.287 -12.486 1.00 0.00 C ATOM 1605 CD1 LEU D 36 98.327 -5.102 -12.330 1.00 0.00 C ATOM 1606 CD2 LEU D 36 95.817 -5.223 -12.403 1.00 0.00 C ATOM 0 H LEU D 36 97.341 -1.535 -9.635 1.00 0.00 H new ATOM 0 HA LEU D 36 99.011 -2.712 -11.476 1.00 0.00 H new ATOM 0 HB2 LEU D 36 96.972 -3.721 -10.396 1.00 0.00 H new ATOM 0 HB3 LEU D 36 95.954 -2.734 -11.426 1.00 0.00 H new ATOM 0 HG LEU D 36 97.049 -3.787 -13.454 1.00 0.00 H new ATOM 0 HD11 LEU D 36 98.389 -5.843 -13.127 1.00 0.00 H new ATOM 0 HD12 LEU D 36 99.186 -4.433 -12.388 1.00 0.00 H new ATOM 0 HD13 LEU D 36 98.326 -5.607 -11.364 1.00 0.00 H new ATOM 0 HD21 LEU D 36 95.883 -5.974 -13.190 1.00 0.00 H new ATOM 0 HD22 LEU D 36 95.804 -5.716 -11.431 1.00 0.00 H new ATOM 0 HD23 LEU D 36 94.902 -4.645 -12.529 1.00 0.00 H new ATOM 1618 N HIS D 37 97.054 -0.484 -12.856 1.00 0.00 N ATOM 1619 CA HIS D 37 96.841 0.272 -14.083 1.00 0.00 C ATOM 1620 C HIS D 37 98.122 0.955 -14.556 1.00 0.00 C ATOM 1621 O HIS D 37 98.381 1.021 -15.754 1.00 0.00 O ATOM 1622 CB HIS D 37 95.751 1.319 -13.861 1.00 0.00 C ATOM 1623 CG HIS D 37 94.508 0.615 -13.411 1.00 0.00 C ATOM 1624 ND1 HIS D 37 94.461 -0.760 -13.283 1.00 0.00 N ATOM 1625 CD2 HIS D 37 93.264 1.071 -13.054 1.00 0.00 C ATOM 1626 CE1 HIS D 37 93.230 -1.087 -12.863 1.00 0.00 C ATOM 1627 NE2 HIS D 37 92.456 -0.008 -12.707 1.00 0.00 N ATOM 0 H HIS D 37 96.483 -0.187 -12.065 1.00 0.00 H new ATOM 0 HA HIS D 37 96.531 -0.429 -14.857 1.00 0.00 H new ATOM 0 HB2 HIS D 37 96.068 2.045 -13.112 1.00 0.00 H new ATOM 0 HB3 HIS D 37 95.562 1.872 -14.781 1.00 0.00 H new ATOM 0 HD2 HIS D 37 92.959 2.107 -13.044 1.00 0.00 H new ATOM 0 HE1 HIS D 37 92.904 -2.099 -12.674 1.00 0.00 H new ATOM 0 HE2 HIS D 37 91.484 0.019 -12.400 1.00 0.00 H new ATOM 1636 N PHE D 38 98.893 1.472 -13.639 1.00 0.00 N ATOM 1637 CA PHE D 38 100.124 2.173 -13.998 1.00 0.00 C ATOM 1638 C PHE D 38 101.124 1.279 -14.726 1.00 0.00 C ATOM 1639 O PHE D 38 101.670 1.680 -15.750 1.00 0.00 O ATOM 1640 CB PHE D 38 100.785 2.741 -12.741 1.00 0.00 C ATOM 1641 CG PHE D 38 102.025 3.514 -13.127 1.00 0.00 C ATOM 1642 CD1 PHE D 38 101.919 4.845 -13.549 1.00 0.00 C ATOM 1643 CD2 PHE D 38 103.283 2.899 -13.061 1.00 0.00 C ATOM 1644 CE1 PHE D 38 103.069 5.562 -13.905 1.00 0.00 C ATOM 1645 CE2 PHE D 38 104.432 3.617 -13.416 1.00 0.00 C ATOM 1646 CZ PHE D 38 104.325 4.947 -13.838 1.00 0.00 C ATOM 0 H PHE D 38 98.703 1.429 -12.638 1.00 0.00 H new ATOM 0 HA PHE D 38 99.841 2.975 -14.680 1.00 0.00 H new ATOM 0 HB2 PHE D 38 100.088 3.392 -12.213 1.00 0.00 H new ATOM 0 HB3 PHE D 38 101.046 1.933 -12.058 1.00 0.00 H new ATOM 0 HD1 PHE D 38 100.950 5.319 -13.600 1.00 0.00 H new ATOM 0 HD2 PHE D 38 103.366 1.872 -12.737 1.00 0.00 H new ATOM 0 HE1 PHE D 38 102.987 6.588 -14.231 1.00 0.00 H new ATOM 0 HE2 PHE D 38 105.401 3.144 -13.364 1.00 0.00 H new ATOM 0 HZ PHE D 38 105.212 5.499 -14.112 1.00 0.00 H new ATOM 1656 N ILE D 39 101.386 0.110 -14.208 1.00 0.00 N ATOM 1657 CA ILE D 39 102.361 -0.768 -14.850 1.00 0.00 C ATOM 1658 C ILE D 39 101.876 -1.237 -16.222 1.00 0.00 C ATOM 1659 O ILE D 39 102.668 -1.330 -17.156 1.00 0.00 O ATOM 1660 CB ILE D 39 102.713 -1.963 -13.942 1.00 0.00 C ATOM 1661 CG1 ILE D 39 101.608 -3.053 -13.988 1.00 0.00 C ATOM 1662 CG2 ILE D 39 102.879 -1.451 -12.506 1.00 0.00 C ATOM 1663 CD1 ILE D 39 101.965 -4.145 -15.012 1.00 0.00 C ATOM 0 H ILE D 39 100.955 -0.263 -13.362 1.00 0.00 H new ATOM 0 HA ILE D 39 103.271 -0.189 -15.008 1.00 0.00 H new ATOM 0 HB ILE D 39 103.639 -2.416 -14.296 1.00 0.00 H new ATOM 0 HG12 ILE D 39 101.488 -3.498 -13.000 1.00 0.00 H new ATOM 0 HG13 ILE D 39 100.653 -2.599 -14.251 1.00 0.00 H new ATOM 0 HG21 ILE D 39 103.129 -2.284 -11.849 1.00 0.00 H new ATOM 0 HG22 ILE D 39 103.679 -0.711 -12.474 1.00 0.00 H new ATOM 0 HG23 ILE D 39 101.948 -0.993 -12.173 1.00 0.00 H new ATOM 0 HD11 ILE D 39 101.178 -4.899 -15.029 1.00 0.00 H new ATOM 0 HD12 ILE D 39 102.061 -3.698 -16.002 1.00 0.00 H new ATOM 0 HD13 ILE D 39 102.909 -4.612 -14.732 1.00 0.00 H new ATOM 1675 N ALA D 40 100.609 -1.530 -16.349 1.00 0.00 N ATOM 1676 CA ALA D 40 100.075 -1.985 -17.627 1.00 0.00 C ATOM 1677 C ALA D 40 100.051 -0.844 -18.642 1.00 0.00 C ATOM 1678 O ALA D 40 100.372 -1.035 -19.815 1.00 0.00 O ATOM 1679 CB ALA D 40 98.662 -2.535 -17.426 1.00 0.00 C ATOM 0 H ALA D 40 99.924 -1.466 -15.596 1.00 0.00 H new ATOM 0 HA ALA D 40 100.721 -2.773 -18.014 1.00 0.00 H new ATOM 0 HB1 ALA D 40 98.264 -2.875 -18.382 1.00 0.00 H new ATOM 0 HB2 ALA D 40 98.693 -3.372 -16.728 1.00 0.00 H new ATOM 0 HB3 ALA D 40 98.020 -1.751 -17.024 1.00 0.00 H new ATOM 1685 N TRP D 41 99.668 0.321 -18.192 1.00 0.00 N ATOM 1686 CA TRP D 41 99.597 1.489 -19.068 1.00 0.00 C ATOM 1687 C TRP D 41 100.888 1.635 -19.866 1.00 0.00 C ATOM 1688 O TRP D 41 100.884 2.139 -20.990 1.00 0.00 O ATOM 1689 CB TRP D 41 99.370 2.753 -18.228 1.00 0.00 C ATOM 1690 CG TRP D 41 98.900 3.877 -19.098 1.00 0.00 C ATOM 1691 CD1 TRP D 41 99.657 4.528 -20.012 1.00 0.00 C ATOM 1692 CD2 TRP D 41 97.584 4.500 -19.141 1.00 0.00 C ATOM 1693 NE1 TRP D 41 98.885 5.499 -20.622 1.00 0.00 N ATOM 1694 CE2 TRP D 41 97.602 5.522 -20.118 1.00 0.00 C ATOM 1695 CE3 TRP D 41 96.386 4.277 -18.437 1.00 0.00 C ATOM 1696 CZ2 TRP D 41 96.475 6.295 -20.386 1.00 0.00 C ATOM 1697 CZ3 TRP D 41 95.249 5.057 -18.704 1.00 0.00 C ATOM 1698 CH2 TRP D 41 95.294 6.064 -19.678 1.00 0.00 C ATOM 0 H TRP D 41 99.397 0.500 -17.225 1.00 0.00 H new ATOM 0 HA TRP D 41 98.766 1.355 -19.761 1.00 0.00 H new ATOM 0 HB2 TRP D 41 98.633 2.553 -17.450 1.00 0.00 H new ATOM 0 HB3 TRP D 41 100.295 3.035 -17.726 1.00 0.00 H new ATOM 0 HD1 TRP D 41 100.695 4.322 -20.229 1.00 0.00 H new ATOM 0 HE1 TRP D 41 99.223 6.122 -21.355 1.00 0.00 H new ATOM 0 HE3 TRP D 41 96.341 3.501 -17.687 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 96.514 7.069 -21.138 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 94.335 4.880 -18.156 1.00 0.00 H new ATOM 0 HH2 TRP D 41 94.417 6.660 -19.880 1.00 0.00 H new ATOM 1709 N THR D 42 101.968 1.186 -19.293 1.00 0.00 N ATOM 1710 CA THR D 42 103.261 1.270 -19.963 1.00 0.00 C ATOM 1711 C THR D 42 103.287 0.398 -21.218 1.00 0.00 C ATOM 1712 O THR D 42 103.987 0.712 -22.181 1.00 0.00 O ATOM 1713 CB THR D 42 104.388 0.839 -19.021 1.00 0.00 C ATOM 1714 OG1 THR D 42 104.245 -0.538 -18.707 1.00 0.00 O ATOM 1715 CG2 THR D 42 104.333 1.666 -17.736 1.00 0.00 C ATOM 0 H THR D 42 101.993 0.758 -18.368 1.00 0.00 H new ATOM 0 HA THR D 42 103.413 2.310 -20.253 1.00 0.00 H new ATOM 0 HB THR D 42 105.348 1.001 -19.512 1.00 0.00 H new ATOM 0 HG1 THR D 42 103.679 -0.635 -17.913 1.00 0.00 H new ATOM 0 HG21 THR D 42 105.137 1.356 -17.069 1.00 0.00 H new ATOM 0 HG22 THR D 42 104.450 2.722 -17.978 1.00 0.00 H new ATOM 0 HG23 THR D 42 103.373 1.510 -17.244 1.00 0.00 H new ATOM 1723 N ILE D 43 102.542 -0.678 -21.208 1.00 0.00 N ATOM 1724 CA ILE D 43 102.513 -1.575 -22.363 1.00 0.00 C ATOM 1725 C ILE D 43 101.793 -0.908 -23.539 1.00 0.00 C ATOM 1726 O ILE D 43 102.317 -0.868 -24.651 1.00 0.00 O ATOM 1727 CB ILE D 43 101.808 -2.894 -21.984 1.00 0.00 C ATOM 1728 CG1 ILE D 43 102.750 -3.758 -21.136 1.00 0.00 C ATOM 1729 CG2 ILE D 43 101.422 -3.677 -23.248 1.00 0.00 C ATOM 1730 CD1 ILE D 43 103.267 -2.955 -19.939 1.00 0.00 C ATOM 0 H ILE D 43 101.949 -0.963 -20.428 1.00 0.00 H new ATOM 0 HA ILE D 43 103.537 -1.794 -22.665 1.00 0.00 H new ATOM 0 HB ILE D 43 100.908 -2.655 -21.418 1.00 0.00 H new ATOM 0 HG12 ILE D 43 102.225 -4.647 -20.788 1.00 0.00 H new ATOM 0 HG13 ILE D 43 103.588 -4.100 -21.744 1.00 0.00 H new ATOM 0 HG21 ILE D 43 100.926 -4.605 -22.964 1.00 0.00 H new ATOM 0 HG22 ILE D 43 100.746 -3.076 -23.856 1.00 0.00 H new ATOM 0 HG23 ILE D 43 102.320 -3.907 -23.822 1.00 0.00 H new ATOM 0 HD11 ILE D 43 103.935 -3.578 -19.344 1.00 0.00 H new ATOM 0 HD12 ILE D 43 103.809 -2.079 -20.295 1.00 0.00 H new ATOM 0 HD13 ILE D 43 102.425 -2.635 -19.324 1.00 0.00 H new ATOM 1742 N GLY D 44 100.613 -0.407 -23.294 1.00 0.00 N ATOM 1743 CA GLY D 44 99.835 0.237 -24.349 1.00 0.00 C ATOM 1744 C GLY D 44 100.616 1.369 -25.007 1.00 0.00 C ATOM 1745 O GLY D 44 100.422 1.664 -26.184 1.00 0.00 O ATOM 0 H GLY D 44 100.159 -0.426 -22.381 1.00 0.00 H new ATOM 0 HA2 GLY D 44 99.559 -0.502 -25.102 1.00 0.00 H new ATOM 0 HA3 GLY D 44 98.907 0.628 -23.931 1.00 0.00 H new ATOM 1749 N HIS D 45 101.477 1.991 -24.256 1.00 0.00 N ATOM 1750 CA HIS D 45 102.274 3.097 -24.772 1.00 0.00 C ATOM 1751 C HIS D 45 103.074 2.683 -26.009 1.00 0.00 C ATOM 1752 O HIS D 45 103.394 3.521 -26.851 1.00 0.00 O ATOM 1753 CB HIS D 45 103.224 3.607 -23.687 1.00 0.00 C ATOM 1754 CG HIS D 45 103.822 4.918 -24.119 1.00 0.00 C ATOM 1755 ND1 HIS D 45 105.172 5.056 -24.402 1.00 0.00 N ATOM 1756 CD2 HIS D 45 103.267 6.160 -24.327 1.00 0.00 C ATOM 1757 CE1 HIS D 45 105.384 6.336 -24.760 1.00 0.00 C ATOM 1758 NE2 HIS D 45 104.256 7.051 -24.730 1.00 0.00 N ATOM 0 H HIS D 45 101.655 1.760 -23.279 1.00 0.00 H new ATOM 0 HA HIS D 45 101.590 3.894 -25.064 1.00 0.00 H new ATOM 0 HB2 HIS D 45 102.686 3.733 -22.747 1.00 0.00 H new ATOM 0 HB3 HIS D 45 104.013 2.877 -23.507 1.00 0.00 H new ATOM 0 HD2 HIS D 45 102.223 6.405 -24.197 1.00 0.00 H new ATOM 0 HE1 HIS D 45 106.348 6.736 -25.038 1.00 0.00 H new ATOM 0 HE2 HIS D 45 104.144 8.040 -24.955 1.00 0.00 H new ATOM 1767 N LEU D 46 103.414 1.423 -26.101 1.00 0.00 N ATOM 1768 CA LEU D 46 104.207 0.944 -27.233 1.00 0.00 C ATOM 1769 C LEU D 46 103.624 1.441 -28.561 1.00 0.00 C ATOM 1770 O LEU D 46 104.368 1.748 -29.494 1.00 0.00 O ATOM 1771 CB LEU D 46 104.308 -0.603 -27.199 1.00 0.00 C ATOM 1772 CG LEU D 46 103.107 -1.275 -27.914 1.00 0.00 C ATOM 1773 CD1 LEU D 46 103.393 -1.452 -29.427 1.00 0.00 C ATOM 1774 CD2 LEU D 46 102.837 -2.652 -27.282 1.00 0.00 C ATOM 0 H LEU D 46 103.163 0.707 -25.419 1.00 0.00 H new ATOM 0 HA LEU D 46 105.215 1.351 -27.150 1.00 0.00 H new ATOM 0 HB2 LEU D 46 105.237 -0.917 -27.676 1.00 0.00 H new ATOM 0 HB3 LEU D 46 104.350 -0.942 -26.164 1.00 0.00 H new ATOM 0 HG LEU D 46 102.234 -0.633 -27.798 1.00 0.00 H new ATOM 0 HD11 LEU D 46 102.536 -1.925 -29.906 1.00 0.00 H new ATOM 0 HD12 LEU D 46 103.569 -0.477 -29.880 1.00 0.00 H new ATOM 0 HD13 LEU D 46 104.275 -2.079 -29.560 1.00 0.00 H new ATOM 0 HD21 LEU D 46 101.993 -3.124 -27.785 1.00 0.00 H new ATOM 0 HD22 LEU D 46 103.721 -3.281 -27.389 1.00 0.00 H new ATOM 0 HD23 LEU D 46 102.606 -2.528 -26.224 1.00 0.00 H new ATOM 1786 N ASN D 47 102.325 1.509 -28.649 1.00 0.00 N ATOM 1787 CA ASN D 47 101.681 1.966 -29.881 1.00 0.00 C ATOM 1788 C ASN D 47 101.959 3.455 -30.157 1.00 0.00 C ATOM 1789 O ASN D 47 102.247 3.832 -31.292 1.00 0.00 O ATOM 1790 CB ASN D 47 100.168 1.714 -29.809 1.00 0.00 C ATOM 1791 CG ASN D 47 99.475 2.781 -28.962 1.00 0.00 C ATOM 1792 OD1 ASN D 47 99.481 3.958 -29.321 1.00 0.00 O ATOM 1793 ND2 ASN D 47 98.872 2.437 -27.860 1.00 0.00 N ATOM 0 H ASN D 47 101.683 1.259 -27.897 1.00 0.00 H new ATOM 0 HA ASN D 47 102.105 1.395 -30.707 1.00 0.00 H new ATOM 0 HB2 ASN D 47 99.748 1.713 -30.815 1.00 0.00 H new ATOM 0 HB3 ASN D 47 99.980 0.728 -29.384 1.00 0.00 H new ATOM 0 HD21 ASN D 47 98.404 3.144 -27.293 1.00 0.00 H new ATOM 0 HD22 ASN D 47 98.868 1.461 -27.564 1.00 0.00 H new ATOM 1800 N GLN D 48 101.860 4.279 -29.143 1.00 0.00 N ATOM 1801 CA GLN D 48 102.082 5.691 -29.274 1.00 0.00 C ATOM 1802 C GLN D 48 103.520 5.999 -29.675 1.00 0.00 C ATOM 1803 O GLN D 48 103.771 6.687 -30.665 1.00 0.00 O ATOM 1804 CB GLN D 48 101.779 6.332 -27.922 1.00 0.00 C ATOM 1805 CG GLN D 48 100.489 5.747 -27.321 1.00 0.00 C ATOM 1806 CD GLN D 48 100.177 6.438 -25.998 1.00 0.00 C ATOM 1807 OE1 GLN D 48 100.758 7.475 -25.687 1.00 0.00 O ATOM 1808 NE2 GLN D 48 99.290 5.918 -25.192 1.00 0.00 N ATOM 0 H GLN D 48 101.621 3.982 -28.197 1.00 0.00 H new ATOM 0 HA GLN D 48 101.435 6.088 -30.056 1.00 0.00 H new ATOM 0 HB2 GLN D 48 102.612 6.165 -27.240 1.00 0.00 H new ATOM 0 HB3 GLN D 48 101.675 7.411 -28.040 1.00 0.00 H new ATOM 0 HG2 GLN D 48 99.660 5.880 -28.016 1.00 0.00 H new ATOM 0 HG3 GLN D 48 100.604 4.675 -27.164 1.00 0.00 H new ATOM 0 HE21 GLN D 48 98.808 5.057 -25.451 1.00 0.00 H new ATOM 0 HE22 GLN D 48 99.079 6.373 -24.304 1.00 0.00 H new ATOM 1817 N ILE D 49 104.434 5.505 -28.899 1.00 0.00 N ATOM 1818 CA ILE D 49 105.856 5.733 -29.155 1.00 0.00 C ATOM 1819 C ILE D 49 106.260 5.204 -30.535 1.00 0.00 C ATOM 1820 O ILE D 49 106.563 5.985 -31.435 1.00 0.00 O ATOM 1821 CB ILE D 49 106.706 5.083 -28.045 1.00 0.00 C ATOM 1822 CG1 ILE D 49 108.205 5.247 -28.359 1.00 0.00 C ATOM 1823 CG2 ILE D 49 106.367 3.585 -27.913 1.00 0.00 C ATOM 1824 CD1 ILE D 49 108.550 6.729 -28.552 1.00 0.00 C ATOM 0 H ILE D 49 104.238 4.937 -28.075 1.00 0.00 H new ATOM 0 HA ILE D 49 106.039 6.808 -29.148 1.00 0.00 H new ATOM 0 HB ILE D 49 106.479 5.582 -27.103 1.00 0.00 H new ATOM 0 HG12 ILE D 49 108.801 4.831 -27.547 1.00 0.00 H new ATOM 0 HG13 ILE D 49 108.458 4.688 -29.260 1.00 0.00 H new ATOM 0 HG21 ILE D 49 106.976 3.142 -27.125 1.00 0.00 H new ATOM 0 HG22 ILE D 49 105.312 3.471 -27.663 1.00 0.00 H new ATOM 0 HG23 ILE D 49 106.573 3.081 -28.857 1.00 0.00 H new ATOM 0 HD11 ILE D 49 109.613 6.829 -28.773 1.00 0.00 H new ATOM 0 HD12 ILE D 49 107.967 7.133 -29.380 1.00 0.00 H new ATOM 0 HD13 ILE D 49 108.316 7.279 -27.640 1.00 0.00 H new ATOM 1836 N LYS D 50 106.252 3.908 -30.703 1.00 0.00 N ATOM 1837 CA LYS D 50 106.611 3.315 -31.988 1.00 0.00 C ATOM 1838 C LYS D 50 106.213 1.842 -32.026 1.00 0.00 C ATOM 1839 O LYS D 50 106.640 1.048 -31.188 1.00 0.00 O ATOM 1840 CB LYS D 50 108.115 3.470 -32.245 1.00 0.00 C ATOM 1841 CG LYS D 50 108.913 2.556 -31.308 1.00 0.00 C ATOM 1842 CD LYS D 50 110.373 3.018 -31.260 1.00 0.00 C ATOM 1843 CE LYS D 50 110.969 2.991 -32.672 1.00 0.00 C ATOM 1844 NZ LYS D 50 110.553 1.742 -33.368 1.00 0.00 N ATOM 0 H LYS D 50 106.004 3.236 -29.977 1.00 0.00 H new ATOM 0 HA LYS D 50 106.069 3.839 -32.775 1.00 0.00 H new ATOM 0 HB2 LYS D 50 108.341 3.224 -33.283 1.00 0.00 H new ATOM 0 HB3 LYS D 50 108.412 4.508 -32.092 1.00 0.00 H new ATOM 0 HG2 LYS D 50 108.481 2.578 -30.307 1.00 0.00 H new ATOM 0 HG3 LYS D 50 108.859 1.525 -31.656 1.00 0.00 H new ATOM 0 HD2 LYS D 50 110.433 4.026 -30.849 1.00 0.00 H new ATOM 0 HD3 LYS D 50 110.948 2.370 -30.599 1.00 0.00 H new ATOM 0 HE2 LYS D 50 110.634 3.862 -33.235 1.00 0.00 H new ATOM 0 HE3 LYS D 50 112.056 3.045 -32.619 1.00 0.00 H new ATOM 0 HZ1 LYS D 50 111.265 1.489 -34.082 1.00 0.00 H new ATOM 0 HZ2 LYS D 50 110.468 0.971 -32.676 1.00 0.00 H new ATOM 0 HZ3 LYS D 50 109.635 1.893 -33.833 1.00 0.00 H new ATOM 1858 N ARG D 51 105.395 1.492 -32.984 1.00 0.00 N ATOM 1859 CA ARG D 51 104.932 0.115 -33.124 1.00 0.00 C ATOM 1860 C ARG D 51 105.987 -0.740 -33.817 1.00 0.00 C ATOM 1861 O ARG D 51 105.755 -1.913 -34.112 1.00 0.00 O ATOM 1862 CB ARG D 51 103.629 0.078 -33.928 1.00 0.00 C ATOM 1863 CG ARG D 51 103.856 0.691 -35.312 1.00 0.00 C ATOM 1864 CD ARG D 51 102.540 0.686 -36.092 1.00 0.00 C ATOM 1865 NE ARG D 51 102.751 1.198 -37.440 1.00 0.00 N ATOM 1866 CZ ARG D 51 101.747 1.585 -38.181 1.00 0.00 C ATOM 1867 NH1 ARG D 51 100.531 1.518 -37.715 1.00 0.00 N ATOM 1868 NH2 ARG D 51 101.963 2.036 -39.386 1.00 0.00 N ATOM 0 H ARG D 51 105.029 2.135 -33.686 1.00 0.00 H new ATOM 0 HA ARG D 51 104.753 -0.289 -32.128 1.00 0.00 H new ATOM 0 HB2 ARG D 51 103.282 -0.950 -34.028 1.00 0.00 H new ATOM 0 HB3 ARG D 51 102.850 0.628 -33.400 1.00 0.00 H new ATOM 0 HG2 ARG D 51 104.229 1.710 -35.214 1.00 0.00 H new ATOM 0 HG3 ARG D 51 104.614 0.125 -35.853 1.00 0.00 H new ATOM 0 HD2 ARG D 51 102.140 -0.327 -36.139 1.00 0.00 H new ATOM 0 HD3 ARG D 51 101.800 1.297 -35.575 1.00 0.00 H new ATOM 0 HE ARG D 51 103.699 1.255 -37.812 1.00 0.00 H new ATOM 0 HH11 ARG D 51 100.365 1.164 -36.773 1.00 0.00 H new ATOM 0 HH12 ARG D 51 99.746 1.820 -38.292 1.00 0.00 H new ATOM 0 HH21 ARG D 51 102.915 2.086 -39.749 1.00 0.00 H new ATOM 0 HH22 ARG D 51 101.180 2.338 -39.965 1.00 0.00 H new ATOM 1882 N GLY D 52 107.126 -0.154 -34.070 1.00 0.00 N ATOM 1883 CA GLY D 52 108.212 -0.870 -34.727 1.00 0.00 C ATOM 1884 C GLY D 52 107.882 -1.133 -36.192 1.00 0.00 C ATOM 0 H GLY D 52 107.336 0.816 -33.836 1.00 0.00 H new ATOM 0 HA2 GLY D 52 109.132 -0.289 -34.656 1.00 0.00 H new ATOM 0 HA3 GLY D 52 108.392 -1.815 -34.215 1.00 0.00 H new TER 1888 GLY D 52