USER MOD reduce.3.24.130724 H: found=0, std=0, add=1163, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1161 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 GLN : amide:sc= 0.56 K(o=-2.3,f=-6.9) USER MOD Set 1.2: A 105 ASN : amide:sc= -2.9 K(o=-2.3,f=-6.4!) USER MOD Set 2.1: A 94 ASN : amide:sc= -0.323 K(o=-0.32,f=-1.4) USER MOD Set 2.2: A 111 GLN : amide:sc=0.000163 K(o=-0.32,f=-1.2) USER MOD Single : A 0 ASN : amide:sc= -1.61 K(o=-1.6,f=-3.9!) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.044 USER MOD Single : A 4 CYS SG : rot -48:sc= -0.285 USER MOD Single : A 5 HIS : no HD1:sc= -0.0281 X(o=-0.028,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 166:sc= -0.0431 (180deg=-0.282) USER MOD Single : A 9 TYR OH : rot -103:sc= 0.689 USER MOD Single : A -2 MET CE :methyl 146:sc= -0.283 (180deg=-1.11) USER MOD Single : A -4 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 10:sc= -3.25 USER MOD Single : A 19 GLN : amide:sc= -0.0197 K(o=-0.02,f=-1) USER MOD Single : A 20 TYR OH : rot -148:sc= 0.124! USER MOD Single : A 21 HIS : no HD1:sc= -3.5 K(o=-3.5,f=-7.5!) USER MOD Single : A 22 ASN :FLIP amide:sc= -0.836 F(o=-1.5,f=-0.84) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -1.34 X(o=-1.3,f=-1.5) USER MOD Single : A 31 LYS NZ :NH3+ -175:sc= 0.258 (180deg=0.227) USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -21:sc= 1.14 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 167:sc= -0.043 (180deg=-0.27) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -0.385 X(o=-0.38,f=-0.1) USER MOD Single : A 61 LYS NZ :NH3+ -165:sc= -0.0276 (180deg=-0.258) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.175 USER MOD Single : A 68 ASN :FLIP amide:sc= -0.584! F(o=-1.5,f=-0.58!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc=-0.000802 K(o=-0.0008,f=-6.9!) USER MOD Single : A 87 THR OG1 : rot -35:sc= -1.64! USER MOD Single : A 88 LYS NZ :NH3+ -162:sc= -0.0564 (180deg=-0.341) USER MOD Single : A 90 SER OG : rot 110:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -171:sc=-0.00356 (180deg=-0.106) USER MOD Single : A 96 TYR OH : rot 38:sc= -2.5! USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot -152:sc= -0.616! USER MOD Single : A 119 GLN : amide:sc= -0.686 K(o=-0.69,f=-9!) USER MOD Single : A 121 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-2.2!) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -156:sc= -1.85! (180deg=-3.41!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 21.934 -13.873 -11.830 1.00 11.02 N ATOM 2 CA GLY A -4 21.501 -15.128 -11.155 1.00 10.52 C ATOM 3 C GLY A -4 22.570 -15.692 -10.242 1.00 10.30 C ATOM 4 O GLY A -4 22.455 -15.618 -9.019 1.00 10.51 O ATOM 0 H1 GLY A -4 21.169 -13.527 -12.443 1.00 11.02 H new ATOM 0 H2 GLY A -4 22.157 -13.153 -11.114 1.00 11.02 H new ATOM 0 H3 GLY A -4 22.780 -14.062 -12.405 1.00 11.02 H new ATOM 0 HA2 GLY A -4 20.599 -14.933 -10.576 1.00 10.52 H new ATOM 0 HA3 GLY A -4 21.242 -15.872 -11.909 1.00 10.52 H new ATOM 10 N ALA A -3 23.615 -16.258 -10.837 1.00 10.11 N ATOM 11 CA ALA A -3 24.710 -16.836 -10.069 1.00 10.15 C ATOM 12 C ALA A -3 25.664 -15.753 -9.574 1.00 9.98 C ATOM 13 O ALA A -3 26.570 -15.336 -10.296 1.00 10.45 O ATOM 14 CB ALA A -3 25.459 -17.859 -10.910 1.00 10.85 C ATOM 0 H ALA A -3 23.726 -16.328 -11.849 1.00 10.11 H new ATOM 0 HA ALA A -3 24.288 -17.337 -9.198 1.00 10.15 H new ATOM 0 HB1 ALA A -3 26.275 -18.284 -10.325 1.00 10.85 H new ATOM 0 HB2 ALA A -3 24.776 -18.653 -11.210 1.00 10.85 H new ATOM 0 HB3 ALA A -3 25.864 -17.374 -11.798 1.00 10.85 H new ATOM 20 N MET A -2 25.454 -15.299 -8.341 1.00 9.54 N ATOM 21 CA MET A -2 26.300 -14.264 -7.756 1.00 9.62 C ATOM 22 C MET A -2 26.645 -14.589 -6.305 1.00 9.46 C ATOM 23 O MET A -2 26.848 -13.690 -5.490 1.00 9.56 O ATOM 24 CB MET A -2 25.611 -12.900 -7.837 1.00 9.74 C ATOM 25 CG MET A -2 25.476 -12.369 -9.257 1.00 10.00 C ATOM 26 SD MET A -2 24.770 -10.710 -9.314 1.00 10.44 S ATOM 27 CE MET A -2 25.954 -9.807 -8.321 1.00 10.72 C ATOM 0 H MET A -2 24.708 -15.631 -7.730 1.00 9.54 H new ATOM 0 HA MET A -2 27.227 -14.228 -8.329 1.00 9.62 H new ATOM 0 HB2 MET A -2 24.619 -12.976 -7.391 1.00 9.74 H new ATOM 0 HB3 MET A -2 26.174 -12.182 -7.241 1.00 9.74 H new ATOM 0 HG2 MET A -2 26.457 -12.359 -9.732 1.00 10.00 H new ATOM 0 HG3 MET A -2 24.849 -13.047 -9.836 1.00 10.00 H new ATOM 0 HE1 MET A -2 26.055 -8.793 -8.708 1.00 10.72 H new ATOM 0 HE2 MET A -2 25.608 -9.768 -7.288 1.00 10.72 H new ATOM 0 HE3 MET A -2 26.921 -10.309 -8.361 1.00 10.72 H new ATOM 37 N ALA A -1 26.709 -15.878 -5.991 1.00 9.48 N ATOM 38 CA ALA A -1 27.036 -16.319 -4.639 1.00 9.64 C ATOM 39 C ALA A -1 26.095 -15.699 -3.613 1.00 9.49 C ATOM 40 O ALA A -1 26.515 -15.326 -2.517 1.00 10.19 O ATOM 41 CB ALA A -1 28.478 -15.971 -4.308 1.00 10.62 C ATOM 0 H ALA A -1 26.539 -16.635 -6.653 1.00 9.48 H new ATOM 0 HA ALA A -1 26.912 -17.401 -4.598 1.00 9.64 H new ATOM 0 HB1 ALA A -1 28.710 -16.305 -3.297 1.00 10.62 H new ATOM 0 HB2 ALA A -1 29.143 -16.466 -5.015 1.00 10.62 H new ATOM 0 HB3 ALA A -1 28.616 -14.892 -4.374 1.00 10.62 H new ATOM 47 N ASN A 0 24.820 -15.592 -3.971 1.00 8.80 N ATOM 48 CA ASN A 0 23.823 -15.015 -3.077 1.00 8.90 C ATOM 49 C ASN A 0 22.474 -15.705 -3.249 1.00 8.17 C ATOM 50 O ASN A 0 21.450 -15.047 -3.437 1.00 8.36 O ATOM 51 CB ASN A 0 23.678 -13.515 -3.340 1.00 9.21 C ATOM 52 CG ASN A 0 23.367 -13.208 -4.794 1.00 9.30 C ATOM 53 OD1 ASN A 0 22.746 -14.011 -5.489 1.00 9.55 O ATOM 54 ND2 ASN A 0 23.798 -12.040 -5.262 1.00 9.37 N ATOM 0 H ASN A 0 24.453 -15.897 -4.873 1.00 8.80 H new ATOM 0 HA ASN A 0 24.161 -15.166 -2.052 1.00 8.90 H new ATOM 0 HB2 ASN A 0 22.885 -13.114 -2.709 1.00 9.21 H new ATOM 0 HB3 ASN A 0 24.600 -13.008 -3.054 1.00 9.21 H new ATOM 0 HD21 ASN A 0 23.617 -11.781 -6.232 1.00 9.37 H new ATOM 0 HD22 ASN A 0 24.310 -11.403 -4.651 1.00 9.37 H new ATOM 61 N SER A 1 22.480 -17.034 -3.188 1.00 7.57 N ATOM 62 CA SER A 1 21.256 -17.814 -3.334 1.00 7.04 C ATOM 63 C SER A 1 20.731 -17.741 -4.765 1.00 6.32 C ATOM 64 O SER A 1 20.646 -18.755 -5.457 1.00 6.00 O ATOM 65 CB SER A 1 20.187 -17.321 -2.356 1.00 7.04 C ATOM 66 OG SER A 1 20.684 -17.295 -1.028 1.00 7.69 O ATOM 0 H SER A 1 23.320 -17.593 -3.038 1.00 7.57 H new ATOM 0 HA SER A 1 21.490 -18.854 -3.106 1.00 7.04 H new ATOM 0 HB2 SER A 1 19.858 -16.323 -2.644 1.00 7.04 H new ATOM 0 HB3 SER A 1 19.314 -17.971 -2.408 1.00 7.04 H new ATOM 0 HG SER A 1 19.983 -16.975 -0.423 1.00 7.69 H new ATOM 72 N ASP A 2 20.378 -16.535 -5.202 1.00 6.42 N ATOM 73 CA ASP A 2 19.866 -16.330 -6.552 1.00 6.11 C ATOM 74 C ASP A 2 19.576 -14.854 -6.804 1.00 5.30 C ATOM 75 O ASP A 2 20.327 -14.175 -7.505 1.00 5.37 O ATOM 76 CB ASP A 2 18.598 -17.156 -6.772 1.00 6.52 C ATOM 77 CG ASP A 2 18.007 -16.951 -8.153 1.00 7.29 C ATOM 78 OD1 ASP A 2 17.268 -15.962 -8.342 1.00 7.71 O ATOM 79 OD2 ASP A 2 18.282 -17.780 -9.047 1.00 7.68 O ATOM 0 H ASP A 2 20.437 -15.686 -4.640 1.00 6.42 H new ATOM 0 HA ASP A 2 20.630 -16.658 -7.257 1.00 6.11 H new ATOM 0 HB2 ASP A 2 18.827 -18.212 -6.631 1.00 6.52 H new ATOM 0 HB3 ASP A 2 17.857 -16.887 -6.019 1.00 6.52 H new ATOM 84 N SER A 3 18.484 -14.362 -6.227 1.00 4.91 N ATOM 85 CA SER A 3 18.096 -12.967 -6.390 1.00 4.46 C ATOM 86 C SER A 3 19.023 -12.050 -5.596 1.00 3.40 C ATOM 87 O SER A 3 19.683 -12.483 -4.653 1.00 3.58 O ATOM 88 CB SER A 3 16.648 -12.762 -5.940 1.00 5.33 C ATOM 89 OG SER A 3 16.252 -11.412 -6.098 1.00 5.63 O ATOM 0 H SER A 3 17.853 -14.910 -5.642 1.00 4.91 H new ATOM 0 HA SER A 3 18.179 -12.713 -7.447 1.00 4.46 H new ATOM 0 HB2 SER A 3 15.989 -13.408 -6.520 1.00 5.33 H new ATOM 0 HB3 SER A 3 16.543 -13.055 -4.895 1.00 5.33 H new ATOM 0 HG SER A 3 15.323 -11.307 -5.805 1.00 5.63 H new ATOM 95 N CYS A 4 19.066 -10.779 -5.987 1.00 2.86 N ATOM 96 CA CYS A 4 19.912 -9.802 -5.313 1.00 2.40 C ATOM 97 C CYS A 4 19.106 -8.571 -4.912 1.00 1.90 C ATOM 98 O CYS A 4 19.580 -7.440 -5.029 1.00 2.51 O ATOM 99 CB CYS A 4 21.073 -9.391 -6.222 1.00 3.21 C ATOM 100 SG CYS A 4 22.272 -8.289 -5.436 1.00 3.99 S ATOM 0 H CYS A 4 18.525 -10.403 -6.766 1.00 2.86 H new ATOM 0 HA CYS A 4 20.311 -10.264 -4.410 1.00 2.40 H new ATOM 0 HB2 CYS A 4 21.589 -10.289 -6.562 1.00 3.21 H new ATOM 0 HB3 CYS A 4 20.670 -8.900 -7.108 1.00 3.21 H new ATOM 0 HG CYS A 4 21.644 -7.320 -4.839 1.00 3.99 H new ATOM 106 N HIS A 5 17.885 -8.799 -4.440 1.00 1.37 N ATOM 107 CA HIS A 5 17.013 -7.707 -4.024 1.00 1.06 C ATOM 108 C HIS A 5 15.750 -8.244 -3.362 1.00 0.81 C ATOM 109 O HIS A 5 14.787 -8.603 -4.039 1.00 0.79 O ATOM 110 CB HIS A 5 16.641 -6.837 -5.226 1.00 1.56 C ATOM 111 CG HIS A 5 15.857 -5.614 -4.861 1.00 1.02 C ATOM 112 ND1 HIS A 5 16.438 -4.381 -4.654 1.00 0.80 N ATOM 113 CD2 HIS A 5 14.527 -5.438 -4.672 1.00 0.83 C ATOM 114 CE1 HIS A 5 15.501 -3.500 -4.353 1.00 0.68 C ATOM 115 NE2 HIS A 5 14.334 -4.116 -4.358 1.00 0.64 N ATOM 0 H HIS A 5 17.478 -9.728 -4.336 1.00 1.37 H new ATOM 0 HA HIS A 5 17.554 -7.100 -3.298 1.00 1.06 H new ATOM 0 HB2 HIS A 5 17.553 -6.534 -5.741 1.00 1.56 H new ATOM 0 HB3 HIS A 5 16.061 -7.434 -5.930 1.00 1.56 H new ATOM 0 HD2 HIS A 5 13.762 -6.196 -4.753 1.00 0.83 H new ATOM 0 HE1 HIS A 5 15.662 -2.454 -4.139 1.00 0.68 H new ATOM 0 HE2 HIS A 5 13.433 -3.680 -4.160 1.00 0.64 H new ATOM 124 N LYS A 6 15.762 -8.297 -2.036 1.00 0.78 N ATOM 125 CA LYS A 6 14.614 -8.786 -1.284 1.00 0.64 C ATOM 126 C LYS A 6 13.415 -7.869 -1.475 1.00 0.60 C ATOM 127 O LYS A 6 13.504 -6.659 -1.268 1.00 0.96 O ATOM 128 CB LYS A 6 14.957 -8.898 0.200 1.00 0.77 C ATOM 129 CG LYS A 6 13.776 -9.296 1.065 1.00 1.44 C ATOM 130 CD LYS A 6 14.153 -9.339 2.537 1.00 1.86 C ATOM 131 CE LYS A 6 12.981 -9.783 3.397 1.00 2.27 C ATOM 132 NZ LYS A 6 12.538 -11.164 3.059 1.00 3.12 N ATOM 0 H LYS A 6 16.553 -8.008 -1.460 1.00 0.78 H new ATOM 0 HA LYS A 6 14.357 -9.776 -1.662 1.00 0.64 H new ATOM 0 HB2 LYS A 6 15.753 -9.631 0.326 1.00 0.77 H new ATOM 0 HB3 LYS A 6 15.346 -7.941 0.548 1.00 0.77 H new ATOM 0 HG2 LYS A 6 12.961 -8.588 0.918 1.00 1.44 H new ATOM 0 HG3 LYS A 6 13.409 -10.274 0.754 1.00 1.44 H new ATOM 0 HD2 LYS A 6 14.990 -10.022 2.680 1.00 1.86 H new ATOM 0 HD3 LYS A 6 14.488 -8.352 2.857 1.00 1.86 H new ATOM 0 HE2 LYS A 6 13.265 -9.740 4.448 1.00 2.27 H new ATOM 0 HE3 LYS A 6 12.149 -9.091 3.263 1.00 2.27 H new ATOM 0 HZ1 LYS A 6 11.909 -11.520 3.807 1.00 3.12 H new ATOM 0 HZ2 LYS A 6 12.027 -11.153 2.153 1.00 3.12 H new ATOM 0 HZ3 LYS A 6 13.368 -11.785 2.980 1.00 3.12 H new ATOM 146 N ILE A 7 12.294 -8.456 -1.868 1.00 0.35 N ATOM 147 CA ILE A 7 11.077 -7.696 -2.097 1.00 0.28 C ATOM 148 C ILE A 7 10.333 -7.426 -0.797 1.00 0.24 C ATOM 149 O ILE A 7 10.286 -8.270 0.097 1.00 0.31 O ATOM 150 CB ILE A 7 10.137 -8.426 -3.070 1.00 0.29 C ATOM 151 CG1 ILE A 7 10.860 -8.719 -4.382 1.00 0.36 C ATOM 152 CG2 ILE A 7 8.885 -7.599 -3.322 1.00 0.27 C ATOM 153 CD1 ILE A 7 9.987 -9.403 -5.410 1.00 0.43 C ATOM 0 H ILE A 7 12.203 -9.458 -2.035 1.00 0.35 H new ATOM 0 HA ILE A 7 11.381 -6.746 -2.536 1.00 0.28 H new ATOM 0 HB ILE A 7 9.837 -9.373 -2.621 1.00 0.29 H new ATOM 0 HG12 ILE A 7 11.234 -7.784 -4.799 1.00 0.36 H new ATOM 0 HG13 ILE A 7 11.727 -9.347 -4.178 1.00 0.36 H new ATOM 0 HG21 ILE A 7 8.231 -8.131 -4.013 1.00 0.27 H new ATOM 0 HG22 ILE A 7 8.362 -7.435 -2.380 1.00 0.27 H new ATOM 0 HG23 ILE A 7 9.165 -6.638 -3.754 1.00 0.27 H new ATOM 0 HD11 ILE A 7 10.564 -9.581 -6.317 1.00 0.43 H new ATOM 0 HD12 ILE A 7 9.634 -10.354 -5.012 1.00 0.43 H new ATOM 0 HD13 ILE A 7 9.133 -8.767 -5.643 1.00 0.43 H new ATOM 165 N ASP A 8 9.757 -6.238 -0.710 1.00 0.19 N ATOM 166 CA ASP A 8 8.999 -5.832 0.463 1.00 0.16 C ATOM 167 C ASP A 8 7.687 -5.190 0.036 1.00 0.14 C ATOM 168 O ASP A 8 7.671 -4.079 -0.491 1.00 0.14 O ATOM 169 CB ASP A 8 9.814 -4.851 1.305 1.00 0.19 C ATOM 170 CG ASP A 8 9.112 -4.472 2.594 1.00 1.13 C ATOM 171 OD1 ASP A 8 9.273 -5.203 3.595 1.00 1.06 O ATOM 172 OD2 ASP A 8 8.401 -3.446 2.603 1.00 2.04 O ATOM 0 H ASP A 8 9.801 -5.532 -1.445 1.00 0.19 H new ATOM 0 HA ASP A 8 8.783 -6.714 1.066 1.00 0.16 H new ATOM 0 HB2 ASP A 8 10.782 -5.294 1.539 1.00 0.19 H new ATOM 0 HB3 ASP A 8 10.008 -3.951 0.722 1.00 0.19 H new ATOM 177 N TYR A 9 6.587 -5.898 0.269 1.00 0.12 N ATOM 178 CA TYR A 9 5.268 -5.405 -0.103 1.00 0.12 C ATOM 179 C TYR A 9 5.059 -3.989 0.409 1.00 0.11 C ATOM 180 O TYR A 9 4.397 -3.177 -0.235 1.00 0.12 O ATOM 181 CB TYR A 9 4.184 -6.330 0.445 1.00 0.14 C ATOM 182 CG TYR A 9 4.427 -7.785 0.127 1.00 0.16 C ATOM 183 CD1 TYR A 9 5.010 -8.162 -1.073 1.00 0.15 C ATOM 184 CD2 TYR A 9 4.068 -8.780 1.025 1.00 0.24 C ATOM 185 CE1 TYR A 9 5.230 -9.490 -1.373 1.00 0.18 C ATOM 186 CE2 TYR A 9 4.284 -10.113 0.735 1.00 0.27 C ATOM 187 CZ TYR A 9 4.883 -10.464 -0.452 1.00 0.23 C ATOM 188 OH TYR A 9 5.082 -11.791 -0.760 1.00 0.27 O ATOM 0 H TYR A 9 6.584 -6.816 0.714 1.00 0.12 H new ATOM 0 HA TYR A 9 5.201 -5.390 -1.191 1.00 0.12 H new ATOM 0 HB2 TYR A 9 4.123 -6.206 1.526 1.00 0.14 H new ATOM 0 HB3 TYR A 9 3.219 -6.031 0.035 1.00 0.14 H new ATOM 0 HD1 TYR A 9 5.297 -7.403 -1.785 1.00 0.15 H new ATOM 0 HD2 TYR A 9 3.612 -8.508 1.966 1.00 0.24 H new ATOM 0 HE1 TYR A 9 5.670 -9.768 -2.319 1.00 0.18 H new ATOM 0 HE2 TYR A 9 3.984 -10.876 1.437 1.00 0.27 H new ATOM 0 HH TYR A 9 4.227 -12.202 -1.006 1.00 0.27 H new ATOM 198 N GLY A 10 5.634 -3.688 1.566 1.00 0.10 N ATOM 199 CA GLY A 10 5.497 -2.363 2.119 1.00 0.11 C ATOM 200 C GLY A 10 6.169 -1.336 1.239 1.00 0.10 C ATOM 201 O GLY A 10 5.525 -0.418 0.737 1.00 0.12 O ATOM 0 H GLY A 10 6.189 -4.336 2.125 1.00 0.10 H new ATOM 0 HA2 GLY A 10 4.440 -2.118 2.228 1.00 0.11 H new ATOM 0 HA3 GLY A 10 5.935 -2.335 3.117 1.00 0.11 H new ATOM 205 N LEU A 11 7.460 -1.517 1.011 1.00 0.10 N ATOM 206 CA LEU A 11 8.210 -0.605 0.170 1.00 0.11 C ATOM 207 C LEU A 11 7.588 -0.556 -1.212 1.00 0.11 C ATOM 208 O LEU A 11 7.482 0.506 -1.827 1.00 0.16 O ATOM 209 CB LEU A 11 9.664 -1.055 0.063 1.00 0.13 C ATOM 210 CG LEU A 11 10.586 -0.081 -0.664 1.00 0.16 C ATOM 211 CD1 LEU A 11 10.617 1.261 0.055 1.00 0.13 C ATOM 212 CD2 LEU A 11 11.982 -0.670 -0.775 1.00 0.23 C ATOM 0 H LEU A 11 8.007 -2.286 1.397 1.00 0.10 H new ATOM 0 HA LEU A 11 8.182 0.389 0.617 1.00 0.11 H new ATOM 0 HB2 LEU A 11 10.053 -1.220 1.068 1.00 0.13 H new ATOM 0 HB3 LEU A 11 9.695 -2.015 -0.452 1.00 0.13 H new ATOM 0 HG LEU A 11 10.201 0.085 -1.670 1.00 0.16 H new ATOM 0 HD11 LEU A 11 11.280 1.944 -0.477 1.00 0.13 H new ATOM 0 HD12 LEU A 11 9.612 1.681 0.085 1.00 0.13 H new ATOM 0 HD13 LEU A 11 10.982 1.120 1.072 1.00 0.13 H new ATOM 0 HD21 LEU A 11 12.633 0.032 -1.295 1.00 0.23 H new ATOM 0 HD22 LEU A 11 12.377 -0.860 0.223 1.00 0.23 H new ATOM 0 HD23 LEU A 11 11.939 -1.606 -1.332 1.00 0.23 H new ATOM 224 N TYR A 12 7.171 -1.719 -1.690 1.00 0.09 N ATOM 225 CA TYR A 12 6.547 -1.825 -2.994 1.00 0.09 C ATOM 226 C TYR A 12 5.250 -1.035 -3.015 1.00 0.09 C ATOM 227 O TYR A 12 5.007 -0.240 -3.922 1.00 0.12 O ATOM 228 CB TYR A 12 6.277 -3.287 -3.335 1.00 0.09 C ATOM 229 CG TYR A 12 5.759 -3.493 -4.735 1.00 0.10 C ATOM 230 CD1 TYR A 12 6.159 -2.662 -5.769 1.00 0.14 C ATOM 231 CD2 TYR A 12 4.874 -4.523 -5.023 1.00 0.10 C ATOM 232 CE1 TYR A 12 5.690 -2.847 -7.054 1.00 0.16 C ATOM 233 CE2 TYR A 12 4.400 -4.718 -6.304 1.00 0.12 C ATOM 234 CZ TYR A 12 4.797 -3.870 -7.313 1.00 0.15 C ATOM 235 OH TYR A 12 4.341 -4.069 -8.593 1.00 0.18 O ATOM 0 H TYR A 12 7.255 -2.604 -1.190 1.00 0.09 H new ATOM 0 HA TYR A 12 7.225 -1.413 -3.742 1.00 0.09 H new ATOM 0 HB2 TYR A 12 7.198 -3.857 -3.209 1.00 0.09 H new ATOM 0 HB3 TYR A 12 5.554 -3.689 -2.626 1.00 0.09 H new ATOM 0 HD1 TYR A 12 6.849 -1.856 -5.566 1.00 0.14 H new ATOM 0 HD2 TYR A 12 4.551 -5.183 -4.231 1.00 0.10 H new ATOM 0 HE1 TYR A 12 6.018 -2.197 -7.852 1.00 0.16 H new ATOM 0 HE2 TYR A 12 3.721 -5.531 -6.514 1.00 0.12 H new ATOM 0 HH TYR A 12 4.857 -3.514 -9.214 1.00 0.18 H new ATOM 245 N ALA A 13 4.420 -1.258 -2.004 1.00 0.10 N ATOM 246 CA ALA A 13 3.158 -0.553 -1.898 1.00 0.12 C ATOM 247 C ALA A 13 3.409 0.944 -1.866 1.00 0.12 C ATOM 248 O ALA A 13 2.636 1.732 -2.410 1.00 0.13 O ATOM 249 CB ALA A 13 2.402 -1.000 -0.659 1.00 0.13 C ATOM 0 H ALA A 13 4.601 -1.920 -1.250 1.00 0.10 H new ATOM 0 HA ALA A 13 2.545 -0.787 -2.768 1.00 0.12 H new ATOM 0 HB1 ALA A 13 1.457 -0.461 -0.595 1.00 0.13 H new ATOM 0 HB2 ALA A 13 2.206 -2.070 -0.719 1.00 0.13 H new ATOM 0 HB3 ALA A 13 3.000 -0.790 0.228 1.00 0.13 H new ATOM 255 N LEU A 14 4.507 1.329 -1.224 1.00 0.11 N ATOM 256 CA LEU A 14 4.885 2.728 -1.136 1.00 0.11 C ATOM 257 C LEU A 14 5.227 3.240 -2.525 1.00 0.12 C ATOM 258 O LEU A 14 4.729 4.274 -2.966 1.00 0.14 O ATOM 259 CB LEU A 14 6.092 2.900 -0.212 1.00 0.12 C ATOM 260 CG LEU A 14 6.099 4.175 0.636 1.00 0.10 C ATOM 261 CD1 LEU A 14 7.505 4.473 1.129 1.00 0.11 C ATOM 262 CD2 LEU A 14 5.551 5.359 -0.147 1.00 0.10 C ATOM 0 H LEU A 14 5.149 0.688 -0.758 1.00 0.11 H new ATOM 0 HA LEU A 14 4.051 3.297 -0.726 1.00 0.11 H new ATOM 0 HB2 LEU A 14 6.141 2.040 0.456 1.00 0.12 H new ATOM 0 HB3 LEU A 14 6.997 2.884 -0.819 1.00 0.12 H new ATOM 0 HG LEU A 14 5.450 4.011 1.497 1.00 0.10 H new ATOM 0 HD11 LEU A 14 7.495 5.382 1.730 1.00 0.11 H new ATOM 0 HD12 LEU A 14 7.862 3.641 1.736 1.00 0.11 H new ATOM 0 HD13 LEU A 14 8.168 4.610 0.275 1.00 0.11 H new ATOM 0 HD21 LEU A 14 5.568 6.250 0.481 1.00 0.10 H new ATOM 0 HD22 LEU A 14 6.166 5.526 -1.031 1.00 0.10 H new ATOM 0 HD23 LEU A 14 4.526 5.150 -0.452 1.00 0.10 H new ATOM 274 N GLU A 15 6.091 2.495 -3.204 1.00 0.11 N ATOM 275 CA GLU A 15 6.504 2.837 -4.555 1.00 0.13 C ATOM 276 C GLU A 15 5.285 3.004 -5.446 1.00 0.13 C ATOM 277 O GLU A 15 5.116 4.024 -6.106 1.00 0.15 O ATOM 278 CB GLU A 15 7.388 1.730 -5.122 1.00 0.14 C ATOM 279 CG GLU A 15 8.707 1.559 -4.392 1.00 0.16 C ATOM 280 CD GLU A 15 9.329 0.198 -4.640 1.00 0.26 C ATOM 281 OE1 GLU A 15 9.877 -0.012 -5.742 1.00 0.34 O ATOM 282 OE2 GLU A 15 9.271 -0.656 -3.732 1.00 0.35 O ATOM 0 H GLU A 15 6.520 1.646 -2.836 1.00 0.11 H new ATOM 0 HA GLU A 15 7.062 3.773 -4.523 1.00 0.13 H new ATOM 0 HB2 GLU A 15 6.840 0.788 -5.087 1.00 0.14 H new ATOM 0 HB3 GLU A 15 7.590 1.942 -6.172 1.00 0.14 H new ATOM 0 HG2 GLU A 15 9.400 2.337 -4.712 1.00 0.16 H new ATOM 0 HG3 GLU A 15 8.548 1.694 -3.322 1.00 0.16 H new ATOM 289 N ILE A 16 4.431 1.989 -5.438 1.00 0.11 N ATOM 290 CA ILE A 16 3.220 1.999 -6.239 1.00 0.12 C ATOM 291 C ILE A 16 2.385 3.229 -5.935 1.00 0.11 C ATOM 292 O ILE A 16 1.951 3.941 -6.839 1.00 0.14 O ATOM 293 CB ILE A 16 2.386 0.740 -5.965 1.00 0.12 C ATOM 294 CG1 ILE A 16 3.208 -0.508 -6.270 1.00 0.13 C ATOM 295 CG2 ILE A 16 1.104 0.755 -6.782 1.00 0.13 C ATOM 296 CD1 ILE A 16 2.704 -1.744 -5.566 1.00 0.25 C ATOM 0 H ILE A 16 4.558 1.144 -4.881 1.00 0.11 H new ATOM 0 HA ILE A 16 3.513 2.018 -7.289 1.00 0.12 H new ATOM 0 HB ILE A 16 2.111 0.726 -4.910 1.00 0.12 H new ATOM 0 HG12 ILE A 16 3.203 -0.684 -7.346 1.00 0.13 H new ATOM 0 HG13 ILE A 16 4.244 -0.331 -5.981 1.00 0.13 H new ATOM 0 HG21 ILE A 16 0.528 -0.147 -6.572 1.00 0.13 H new ATOM 0 HG22 ILE A 16 0.514 1.632 -6.517 1.00 0.13 H new ATOM 0 HG23 ILE A 16 1.349 0.790 -7.843 1.00 0.13 H new ATOM 0 HD11 ILE A 16 3.334 -2.594 -5.827 1.00 0.25 H new ATOM 0 HD12 ILE A 16 2.735 -1.587 -4.488 1.00 0.25 H new ATOM 0 HD13 ILE A 16 1.678 -1.945 -5.874 1.00 0.25 H new ATOM 308 N LEU A 17 2.164 3.472 -4.651 1.00 0.10 N ATOM 309 CA LEU A 17 1.392 4.623 -4.222 1.00 0.10 C ATOM 310 C LEU A 17 2.132 5.895 -4.588 1.00 0.11 C ATOM 311 O LEU A 17 1.529 6.900 -4.957 1.00 0.16 O ATOM 312 CB LEU A 17 1.148 4.561 -2.718 1.00 0.10 C ATOM 313 CG LEU A 17 0.320 3.366 -2.263 1.00 0.10 C ATOM 314 CD1 LEU A 17 0.544 3.099 -0.787 1.00 0.12 C ATOM 315 CD2 LEU A 17 -1.152 3.605 -2.557 1.00 0.12 C ATOM 0 H LEU A 17 2.509 2.886 -3.891 1.00 0.10 H new ATOM 0 HA LEU A 17 0.426 4.618 -4.727 1.00 0.10 H new ATOM 0 HB2 LEU A 17 2.110 4.536 -2.207 1.00 0.10 H new ATOM 0 HB3 LEU A 17 0.645 5.476 -2.406 1.00 0.10 H new ATOM 0 HG LEU A 17 0.639 2.484 -2.817 1.00 0.10 H new ATOM 0 HD11 LEU A 17 -0.055 2.242 -0.477 1.00 0.12 H new ATOM 0 HD12 LEU A 17 1.599 2.887 -0.612 1.00 0.12 H new ATOM 0 HD13 LEU A 17 0.249 3.975 -0.210 1.00 0.12 H new ATOM 0 HD21 LEU A 17 -1.733 2.744 -2.227 1.00 0.12 H new ATOM 0 HD22 LEU A 17 -1.489 4.495 -2.026 1.00 0.12 H new ATOM 0 HD23 LEU A 17 -1.291 3.747 -3.629 1.00 0.12 H new ATOM 327 N ALA A 18 3.453 5.835 -4.487 1.00 0.08 N ATOM 328 CA ALA A 18 4.288 6.970 -4.827 1.00 0.10 C ATOM 329 C ALA A 18 4.195 7.236 -6.319 1.00 0.12 C ATOM 330 O ALA A 18 4.128 8.379 -6.762 1.00 0.14 O ATOM 331 CB ALA A 18 5.730 6.718 -4.416 1.00 0.11 C ATOM 0 H ALA A 18 3.965 5.011 -4.172 1.00 0.08 H new ATOM 0 HA ALA A 18 3.935 7.847 -4.285 1.00 0.10 H new ATOM 0 HB1 ALA A 18 6.340 7.582 -4.680 1.00 0.11 H new ATOM 0 HB2 ALA A 18 5.778 6.555 -3.339 1.00 0.11 H new ATOM 0 HB3 ALA A 18 6.107 5.836 -4.934 1.00 0.11 H new ATOM 337 N GLN A 19 4.189 6.159 -7.088 1.00 0.14 N ATOM 338 CA GLN A 19 4.085 6.255 -8.531 1.00 0.16 C ATOM 339 C GLN A 19 2.654 6.574 -8.924 1.00 0.16 C ATOM 340 O GLN A 19 2.403 7.227 -9.937 1.00 0.18 O ATOM 341 CB GLN A 19 4.527 4.951 -9.185 1.00 0.20 C ATOM 342 CG GLN A 19 5.998 4.650 -8.993 1.00 0.23 C ATOM 343 CD GLN A 19 6.486 3.535 -9.897 1.00 0.32 C ATOM 344 OE1 GLN A 19 5.996 3.367 -11.013 1.00 0.80 O ATOM 345 NE2 GLN A 19 7.450 2.761 -9.416 1.00 0.40 N ATOM 0 H GLN A 19 4.255 5.205 -6.733 1.00 0.14 H new ATOM 0 HA GLN A 19 4.739 7.056 -8.877 1.00 0.16 H new ATOM 0 HB2 GLN A 19 3.939 4.130 -8.774 1.00 0.20 H new ATOM 0 HB3 GLN A 19 4.309 4.996 -10.252 1.00 0.20 H new ATOM 0 HG2 GLN A 19 6.578 5.552 -9.188 1.00 0.23 H new ATOM 0 HG3 GLN A 19 6.176 4.375 -7.954 1.00 0.23 H new ATOM 0 HE21 GLN A 19 7.828 2.936 -8.485 1.00 0.40 H new ATOM 0 HE22 GLN A 19 7.813 1.991 -9.977 1.00 0.40 H new ATOM 354 N TYR A 20 1.718 6.108 -8.107 1.00 0.16 N ATOM 355 CA TYR A 20 0.309 6.353 -8.350 1.00 0.17 C ATOM 356 C TYR A 20 0.035 7.843 -8.257 1.00 0.16 C ATOM 357 O TYR A 20 -0.820 8.381 -8.962 1.00 0.17 O ATOM 358 CB TYR A 20 -0.542 5.600 -7.333 1.00 0.19 C ATOM 359 CG TYR A 20 -2.012 5.908 -7.448 1.00 0.22 C ATOM 360 CD1 TYR A 20 -2.814 5.211 -8.339 1.00 0.26 C ATOM 361 CD2 TYR A 20 -2.600 6.886 -6.660 1.00 0.23 C ATOM 362 CE1 TYR A 20 -4.162 5.482 -8.445 1.00 0.30 C ATOM 363 CE2 TYR A 20 -3.947 7.166 -6.758 1.00 0.27 C ATOM 364 CZ TYR A 20 -4.720 6.488 -7.668 1.00 0.30 C ATOM 365 OH TYR A 20 -6.071 6.735 -7.753 1.00 0.36 O ATOM 0 H TYR A 20 1.913 5.558 -7.270 1.00 0.16 H new ATOM 0 HA TYR A 20 0.050 5.998 -9.347 1.00 0.17 H new ATOM 0 HB2 TYR A 20 -0.390 4.529 -7.464 1.00 0.19 H new ATOM 0 HB3 TYR A 20 -0.202 5.850 -6.328 1.00 0.19 H new ATOM 0 HD1 TYR A 20 -2.376 4.444 -8.960 1.00 0.26 H new ATOM 0 HD2 TYR A 20 -1.993 7.438 -5.958 1.00 0.23 H new ATOM 0 HE1 TYR A 20 -4.779 4.916 -9.127 1.00 0.30 H new ATOM 0 HE2 TYR A 20 -4.392 7.916 -6.121 1.00 0.27 H new ATOM 0 HH TYR A 20 -6.239 7.688 -7.601 1.00 0.36 H new ATOM 375 N HIS A 21 0.775 8.497 -7.371 1.00 0.14 N ATOM 376 CA HIS A 21 0.653 9.930 -7.172 1.00 0.15 C ATOM 377 C HIS A 21 1.675 10.689 -8.016 1.00 0.16 C ATOM 378 O HIS A 21 1.719 11.919 -7.984 1.00 0.20 O ATOM 379 CB HIS A 21 0.843 10.267 -5.697 1.00 0.18 C ATOM 380 CG HIS A 21 -0.372 9.998 -4.867 1.00 0.19 C ATOM 381 ND1 HIS A 21 -1.373 10.930 -4.742 1.00 0.20 N ATOM 382 CD2 HIS A 21 -0.704 8.893 -4.158 1.00 0.21 C ATOM 383 CE1 HIS A 21 -2.287 10.376 -3.968 1.00 0.21 C ATOM 384 NE2 HIS A 21 -1.926 9.141 -3.587 1.00 0.23 N ATOM 0 H HIS A 21 1.472 8.050 -6.775 1.00 0.14 H new ATOM 0 HA HIS A 21 -0.345 10.236 -7.488 1.00 0.15 H new ATOM 0 HB2 HIS A 21 1.678 9.688 -5.304 1.00 0.18 H new ATOM 0 HB3 HIS A 21 1.113 11.319 -5.604 1.00 0.18 H new ATOM 0 HD2 HIS A 21 -0.119 7.990 -4.061 1.00 0.21 H new ATOM 0 HE1 HIS A 21 -3.210 10.856 -3.678 1.00 0.21 H new ATOM 0 HE2 HIS A 21 -2.458 8.509 -2.988 1.00 0.23 H new ATOM 392 N ASN A 22 2.502 9.952 -8.760 1.00 0.15 N ATOM 393 CA ASN A 22 3.515 10.555 -9.611 1.00 0.18 C ATOM 394 C ASN A 22 4.594 11.214 -8.766 1.00 0.19 C ATOM 395 O ASN A 22 5.233 12.177 -9.188 1.00 0.21 O ATOM 396 CB ASN A 22 2.881 11.574 -10.560 1.00 0.20 C ATOM 397 CG ASN A 22 3.886 12.218 -11.497 1.00 0.87 C ATOM 398 OD1 ASN A 22 4.853 11.437 -11.964 1.00 1.35 O flip ATOM 399 ND2 ASN A 22 3.788 13.405 -11.807 1.00 1.28 N flip ATOM 0 H ASN A 22 2.485 8.932 -8.786 1.00 0.15 H new ATOM 0 HA ASN A 22 3.976 9.769 -10.209 1.00 0.18 H new ATOM 0 HB2 ASN A 22 2.108 11.081 -11.149 1.00 0.20 H new ATOM 0 HB3 ASN A 22 2.389 12.351 -9.974 1.00 0.20 H new ATOM 0 HD21 ASN A 22 3.030 13.971 -11.426 1.00 1.28 H new ATOM 0 HD22 ASN A 22 4.465 13.823 -12.445 1.00 1.28 H new ATOM 406 N VAL A 23 4.791 10.680 -7.568 1.00 0.19 N ATOM 407 CA VAL A 23 5.789 11.205 -6.654 1.00 0.22 C ATOM 408 C VAL A 23 7.014 10.300 -6.623 1.00 0.25 C ATOM 409 O VAL A 23 6.898 9.076 -6.578 1.00 0.35 O ATOM 410 CB VAL A 23 5.219 11.365 -5.231 1.00 0.23 C ATOM 411 CG1 VAL A 23 4.590 10.074 -4.760 1.00 0.26 C ATOM 412 CG2 VAL A 23 6.296 11.820 -4.261 1.00 0.26 C ATOM 0 H VAL A 23 4.269 9.881 -7.208 1.00 0.19 H new ATOM 0 HA VAL A 23 6.082 12.190 -7.017 1.00 0.22 H new ATOM 0 HB VAL A 23 4.446 12.133 -5.262 1.00 0.23 H new ATOM 0 HG11 VAL A 23 4.194 10.208 -3.753 1.00 0.26 H new ATOM 0 HG12 VAL A 23 3.780 9.796 -5.435 1.00 0.26 H new ATOM 0 HG13 VAL A 23 5.342 9.285 -4.752 1.00 0.26 H new ATOM 0 HG21 VAL A 23 5.867 11.925 -3.264 1.00 0.26 H new ATOM 0 HG22 VAL A 23 7.098 11.082 -4.235 1.00 0.26 H new ATOM 0 HG23 VAL A 23 6.697 12.780 -4.587 1.00 0.26 H new ATOM 422 N SER A 24 8.184 10.920 -6.648 1.00 0.22 N ATOM 423 CA SER A 24 9.442 10.191 -6.638 1.00 0.25 C ATOM 424 C SER A 24 9.522 9.231 -5.461 1.00 0.27 C ATOM 425 O SER A 24 8.876 9.430 -4.433 1.00 0.49 O ATOM 426 CB SER A 24 10.614 11.169 -6.587 1.00 0.35 C ATOM 427 OG SER A 24 10.630 12.009 -7.728 1.00 0.82 O ATOM 0 H SER A 24 8.288 11.934 -6.676 1.00 0.22 H new ATOM 0 HA SER A 24 9.494 9.605 -7.556 1.00 0.25 H new ATOM 0 HB2 SER A 24 10.545 11.777 -5.685 1.00 0.35 H new ATOM 0 HB3 SER A 24 11.551 10.615 -6.527 1.00 0.35 H new ATOM 0 HG SER A 24 11.389 12.626 -7.669 1.00 0.82 H new ATOM 433 N VAL A 25 10.322 8.187 -5.630 1.00 0.20 N ATOM 434 CA VAL A 25 10.518 7.187 -4.595 1.00 0.17 C ATOM 435 C VAL A 25 11.744 6.341 -4.896 1.00 0.18 C ATOM 436 O VAL A 25 11.809 5.667 -5.925 1.00 0.25 O ATOM 437 CB VAL A 25 9.292 6.265 -4.448 1.00 0.13 C ATOM 438 CG1 VAL A 25 8.964 5.592 -5.770 1.00 0.13 C ATOM 439 CG2 VAL A 25 9.532 5.224 -3.364 1.00 0.15 C ATOM 0 H VAL A 25 10.850 8.012 -6.485 1.00 0.20 H new ATOM 0 HA VAL A 25 10.660 7.724 -3.657 1.00 0.17 H new ATOM 0 HB VAL A 25 8.439 6.877 -4.155 1.00 0.13 H new ATOM 0 HG11 VAL A 25 8.095 4.946 -5.644 1.00 0.13 H new ATOM 0 HG12 VAL A 25 8.745 6.352 -6.520 1.00 0.13 H new ATOM 0 HG13 VAL A 25 9.816 4.995 -6.096 1.00 0.13 H new ATOM 0 HG21 VAL A 25 8.655 4.583 -3.275 1.00 0.15 H new ATOM 0 HG22 VAL A 25 10.400 4.619 -3.627 1.00 0.15 H new ATOM 0 HG23 VAL A 25 9.713 5.724 -2.413 1.00 0.15 H new ATOM 449 N ASN A 26 12.725 6.396 -4.005 1.00 0.15 N ATOM 450 CA ASN A 26 13.942 5.623 -4.169 1.00 0.15 C ATOM 451 C ASN A 26 13.995 4.505 -3.140 1.00 0.16 C ATOM 452 O ASN A 26 14.567 4.663 -2.063 1.00 0.17 O ATOM 453 CB ASN A 26 15.167 6.521 -4.037 1.00 0.16 C ATOM 454 CG ASN A 26 16.459 5.768 -4.263 1.00 0.18 C ATOM 455 OD1 ASN A 26 16.476 4.710 -4.893 1.00 0.20 O ATOM 456 ND2 ASN A 26 17.553 6.320 -3.762 1.00 0.20 N ATOM 0 H ASN A 26 12.699 6.969 -3.162 1.00 0.15 H new ATOM 0 HA ASN A 26 13.942 5.183 -5.166 1.00 0.15 H new ATOM 0 HB2 ASN A 26 15.095 7.338 -4.755 1.00 0.16 H new ATOM 0 HB3 ASN A 26 15.180 6.970 -3.044 1.00 0.16 H new ATOM 0 HD21 ASN A 26 18.458 5.867 -3.891 1.00 0.20 H new ATOM 0 HD22 ASN A 26 17.491 7.198 -3.247 1.00 0.20 H new ATOM 463 N PRO A 27 13.398 3.351 -3.474 1.00 0.17 N ATOM 464 CA PRO A 27 13.361 2.191 -2.587 1.00 0.19 C ATOM 465 C PRO A 27 14.690 1.968 -1.891 1.00 0.20 C ATOM 466 O PRO A 27 14.744 1.506 -0.754 1.00 0.25 O ATOM 467 CB PRO A 27 13.055 1.050 -3.547 1.00 0.23 C ATOM 468 CG PRO A 27 12.217 1.677 -4.604 1.00 0.30 C ATOM 469 CD PRO A 27 12.719 3.083 -4.755 1.00 0.19 C ATOM 0 HA PRO A 27 12.636 2.297 -1.780 1.00 0.19 H new ATOM 0 HB2 PRO A 27 13.968 0.624 -3.963 1.00 0.23 H new ATOM 0 HB3 PRO A 27 12.525 0.240 -3.047 1.00 0.23 H new ATOM 0 HG2 PRO A 27 12.301 1.130 -5.543 1.00 0.30 H new ATOM 0 HG3 PRO A 27 11.164 1.667 -4.323 1.00 0.30 H new ATOM 0 HD2 PRO A 27 13.404 3.175 -5.598 1.00 0.19 H new ATOM 0 HD3 PRO A 27 11.902 3.783 -4.929 1.00 0.19 H new ATOM 477 N GLU A 28 15.762 2.313 -2.585 1.00 0.18 N ATOM 478 CA GLU A 28 17.099 2.163 -2.037 1.00 0.19 C ATOM 479 C GLU A 28 17.286 3.122 -0.875 1.00 0.19 C ATOM 480 O GLU A 28 17.778 2.745 0.188 1.00 0.21 O ATOM 481 CB GLU A 28 18.145 2.438 -3.115 1.00 0.21 C ATOM 482 CG GLU A 28 17.876 1.711 -4.419 1.00 0.23 C ATOM 483 CD GLU A 28 18.962 1.944 -5.452 1.00 0.72 C ATOM 484 OE1 GLU A 28 18.884 2.959 -6.177 1.00 1.24 O ATOM 485 OE2 GLU A 28 19.888 1.111 -5.537 1.00 0.70 O ATOM 0 H GLU A 28 15.732 2.699 -3.529 1.00 0.18 H new ATOM 0 HA GLU A 28 17.224 1.140 -1.682 1.00 0.19 H new ATOM 0 HB2 GLU A 28 18.184 3.510 -3.307 1.00 0.21 H new ATOM 0 HB3 GLU A 28 19.126 2.146 -2.741 1.00 0.21 H new ATOM 0 HG2 GLU A 28 17.789 0.642 -4.223 1.00 0.23 H new ATOM 0 HG3 GLU A 28 16.919 2.040 -4.823 1.00 0.23 H new ATOM 492 N GLU A 29 16.880 4.365 -1.092 1.00 0.18 N ATOM 493 CA GLU A 29 16.982 5.395 -0.072 1.00 0.18 C ATOM 494 C GLU A 29 15.928 5.173 0.999 1.00 0.16 C ATOM 495 O GLU A 29 16.167 5.412 2.183 1.00 0.20 O ATOM 496 CB GLU A 29 16.813 6.778 -0.695 1.00 0.20 C ATOM 497 CG GLU A 29 16.793 7.901 0.318 1.00 0.22 C ATOM 498 CD GLU A 29 16.672 9.270 -0.323 1.00 1.02 C ATOM 499 OE1 GLU A 29 15.529 9.714 -0.561 1.00 1.85 O ATOM 500 OE2 GLU A 29 17.719 9.897 -0.587 1.00 0.95 O ATOM 0 H GLU A 29 16.475 4.684 -1.972 1.00 0.18 H new ATOM 0 HA GLU A 29 17.970 5.337 0.385 1.00 0.18 H new ATOM 0 HB2 GLU A 29 17.626 6.951 -1.401 1.00 0.20 H new ATOM 0 HB3 GLU A 29 15.885 6.799 -1.266 1.00 0.20 H new ATOM 0 HG2 GLU A 29 15.959 7.751 1.003 1.00 0.22 H new ATOM 0 HG3 GLU A 29 17.705 7.863 0.913 1.00 0.22 H new ATOM 507 N ILE A 30 14.759 4.710 0.571 1.00 0.14 N ATOM 508 CA ILE A 30 13.671 4.441 1.493 1.00 0.14 C ATOM 509 C ILE A 30 14.111 3.411 2.517 1.00 0.14 C ATOM 510 O ILE A 30 13.977 3.607 3.720 1.00 0.21 O ATOM 511 CB ILE A 30 12.423 3.914 0.759 1.00 0.17 C ATOM 512 CG1 ILE A 30 11.940 4.933 -0.272 1.00 0.22 C ATOM 513 CG2 ILE A 30 11.317 3.590 1.750 1.00 0.17 C ATOM 514 CD1 ILE A 30 11.549 6.262 0.333 1.00 0.28 C ATOM 0 H ILE A 30 14.544 4.515 -0.407 1.00 0.14 H new ATOM 0 HA ILE A 30 13.413 5.379 1.984 1.00 0.14 H new ATOM 0 HB ILE A 30 12.693 2.996 0.236 1.00 0.17 H new ATOM 0 HG12 ILE A 30 12.728 5.095 -1.008 1.00 0.22 H new ATOM 0 HG13 ILE A 30 11.085 4.520 -0.807 1.00 0.22 H new ATOM 0 HG21 ILE A 30 10.444 3.219 1.213 1.00 0.17 H new ATOM 0 HG22 ILE A 30 11.665 2.828 2.447 1.00 0.17 H new ATOM 0 HG23 ILE A 30 11.048 4.490 2.302 1.00 0.17 H new ATOM 0 HD11 ILE A 30 11.216 6.937 -0.456 1.00 0.28 H new ATOM 0 HD12 ILE A 30 10.740 6.112 1.048 1.00 0.28 H new ATOM 0 HD13 ILE A 30 12.409 6.696 0.843 1.00 0.28 H new ATOM 526 N LYS A 31 14.643 2.308 2.027 1.00 0.15 N ATOM 527 CA LYS A 31 15.109 1.254 2.902 1.00 0.20 C ATOM 528 C LYS A 31 16.305 1.724 3.709 1.00 0.21 C ATOM 529 O LYS A 31 16.520 1.298 4.842 1.00 0.26 O ATOM 530 CB LYS A 31 15.488 0.022 2.095 1.00 0.26 C ATOM 531 CG LYS A 31 14.305 -0.640 1.422 1.00 0.80 C ATOM 532 CD LYS A 31 14.614 -2.078 1.050 1.00 0.82 C ATOM 533 CE LYS A 31 15.854 -2.168 0.177 1.00 0.65 C ATOM 534 NZ LYS A 31 15.672 -1.464 -1.122 1.00 1.35 N ATOM 0 H LYS A 31 14.762 2.120 1.032 1.00 0.15 H new ATOM 0 HA LYS A 31 14.300 0.996 3.585 1.00 0.20 H new ATOM 0 HB2 LYS A 31 16.218 0.304 1.336 1.00 0.26 H new ATOM 0 HB3 LYS A 31 15.974 -0.699 2.752 1.00 0.26 H new ATOM 0 HG2 LYS A 31 13.443 -0.612 2.088 1.00 0.80 H new ATOM 0 HG3 LYS A 31 14.034 -0.081 0.526 1.00 0.80 H new ATOM 0 HD2 LYS A 31 14.761 -2.667 1.956 1.00 0.82 H new ATOM 0 HD3 LYS A 31 13.763 -2.510 0.523 1.00 0.82 H new ATOM 0 HE2 LYS A 31 16.703 -1.737 0.707 1.00 0.65 H new ATOM 0 HE3 LYS A 31 16.092 -3.215 -0.008 1.00 0.65 H new ATOM 0 HZ1 LYS A 31 16.507 -1.620 -1.722 1.00 1.35 H new ATOM 0 HZ2 LYS A 31 14.827 -1.834 -1.602 1.00 1.35 H new ATOM 0 HZ3 LYS A 31 15.555 -0.445 -0.951 1.00 1.35 H new ATOM 548 N HIS A 32 17.076 2.611 3.109 1.00 0.19 N ATOM 549 CA HIS A 32 18.261 3.149 3.747 1.00 0.23 C ATOM 550 C HIS A 32 17.886 4.040 4.920 1.00 0.23 C ATOM 551 O HIS A 32 18.624 4.149 5.897 1.00 0.29 O ATOM 552 CB HIS A 32 19.065 3.954 2.732 1.00 0.25 C ATOM 553 CG HIS A 32 20.479 4.194 3.145 1.00 0.32 C ATOM 554 ND1 HIS A 32 20.894 5.340 3.790 1.00 0.37 N ATOM 555 CD2 HIS A 32 21.582 3.425 3.003 1.00 0.38 C ATOM 556 CE1 HIS A 32 22.191 5.265 4.027 1.00 0.44 C ATOM 557 NE2 HIS A 32 22.633 4.111 3.560 1.00 0.44 N ATOM 0 H HIS A 32 16.900 2.976 2.173 1.00 0.19 H new ATOM 0 HA HIS A 32 18.861 2.319 4.120 1.00 0.23 H new ATOM 0 HB2 HIS A 32 19.058 3.429 1.777 1.00 0.25 H new ATOM 0 HB3 HIS A 32 18.574 4.914 2.571 1.00 0.25 H new ATOM 0 HD2 HIS A 32 21.628 2.451 2.538 1.00 0.38 H new ATOM 0 HE1 HIS A 32 22.788 6.019 4.519 1.00 0.44 H new ATOM 0 HE2 HIS A 32 23.598 3.783 3.606 1.00 0.44 H new ATOM 566 N ARG A 33 16.734 4.681 4.804 1.00 0.19 N ATOM 567 CA ARG A 33 16.255 5.590 5.830 1.00 0.21 C ATOM 568 C ARG A 33 15.197 4.966 6.727 1.00 0.21 C ATOM 569 O ARG A 33 15.111 5.286 7.913 1.00 0.27 O ATOM 570 CB ARG A 33 15.663 6.823 5.166 1.00 0.24 C ATOM 571 CG ARG A 33 16.674 7.636 4.390 1.00 0.29 C ATOM 572 CD ARG A 33 16.009 8.793 3.665 1.00 0.36 C ATOM 573 NE ARG A 33 15.102 9.535 4.535 1.00 0.47 N ATOM 574 CZ ARG A 33 15.503 10.444 5.418 1.00 0.64 C ATOM 575 NH1 ARG A 33 16.793 10.724 5.549 1.00 1.13 N ATOM 576 NH2 ARG A 33 14.613 11.076 6.170 1.00 0.71 N ATOM 0 H ARG A 33 16.110 4.587 4.003 1.00 0.19 H new ATOM 0 HA ARG A 33 17.110 5.845 6.457 1.00 0.21 H new ATOM 0 HB2 ARG A 33 14.863 6.514 4.493 1.00 0.24 H new ATOM 0 HB3 ARG A 33 15.210 7.455 5.930 1.00 0.24 H new ATOM 0 HG2 ARG A 33 17.435 8.019 5.070 1.00 0.29 H new ATOM 0 HG3 ARG A 33 17.183 6.996 3.669 1.00 0.29 H new ATOM 0 HD2 ARG A 33 16.774 9.467 3.280 1.00 0.36 H new ATOM 0 HD3 ARG A 33 15.457 8.413 2.805 1.00 0.36 H new ATOM 0 HE ARG A 33 14.103 9.345 4.461 1.00 0.47 H new ATOM 0 HH11 ARG A 33 17.481 10.241 4.971 1.00 1.13 H new ATOM 0 HH12 ARG A 33 17.097 11.422 6.228 1.00 1.13 H new ATOM 0 HH21 ARG A 33 13.620 10.865 6.071 1.00 0.71 H new ATOM 0 HH22 ARG A 33 14.921 11.773 6.847 1.00 0.71 H new ATOM 590 N PHE A 34 14.393 4.076 6.163 1.00 0.17 N ATOM 591 CA PHE A 34 13.299 3.478 6.915 1.00 0.21 C ATOM 592 C PHE A 34 13.439 1.966 7.095 1.00 0.22 C ATOM 593 O PHE A 34 12.914 1.408 8.058 1.00 0.31 O ATOM 594 CB PHE A 34 11.990 3.843 6.221 1.00 0.23 C ATOM 595 CG PHE A 34 11.862 5.328 6.019 1.00 0.21 C ATOM 596 CD1 PHE A 34 11.264 6.125 6.985 1.00 0.29 C ATOM 597 CD2 PHE A 34 12.311 5.925 4.854 1.00 0.21 C ATOM 598 CE1 PHE A 34 11.119 7.483 6.793 1.00 0.29 C ATOM 599 CE2 PHE A 34 12.172 7.286 4.657 1.00 0.24 C ATOM 600 CZ PHE A 34 11.678 8.079 5.665 1.00 0.23 C ATOM 0 H PHE A 34 14.475 3.755 5.198 1.00 0.17 H new ATOM 0 HA PHE A 34 13.317 3.880 7.928 1.00 0.21 H new ATOM 0 HB2 PHE A 34 11.937 3.339 5.256 1.00 0.23 H new ATOM 0 HB3 PHE A 34 11.150 3.483 6.816 1.00 0.23 H new ATOM 0 HD1 PHE A 34 10.907 5.676 7.900 1.00 0.29 H new ATOM 0 HD2 PHE A 34 12.776 5.320 4.089 1.00 0.21 H new ATOM 0 HE1 PHE A 34 10.576 8.079 7.511 1.00 0.29 H new ATOM 0 HE2 PHE A 34 12.452 7.726 3.711 1.00 0.24 H new ATOM 0 HZ PHE A 34 11.723 9.155 5.583 1.00 0.23 H new ATOM 610 N ASP A 35 14.137 1.301 6.183 1.00 0.19 N ATOM 611 CA ASP A 35 14.330 -0.144 6.301 1.00 0.22 C ATOM 612 C ASP A 35 15.762 -0.445 6.705 1.00 0.29 C ATOM 613 O ASP A 35 16.330 -1.470 6.329 1.00 0.34 O ATOM 614 CB ASP A 35 14.000 -0.858 4.994 1.00 0.23 C ATOM 615 CG ASP A 35 13.713 -2.333 5.190 1.00 0.28 C ATOM 616 OD1 ASP A 35 14.510 -3.005 5.877 1.00 1.10 O ATOM 617 OD2 ASP A 35 12.692 -2.816 4.658 1.00 0.94 O ATOM 0 H ASP A 35 14.573 1.727 5.366 1.00 0.19 H new ATOM 0 HA ASP A 35 13.649 -0.512 7.069 1.00 0.22 H new ATOM 0 HB2 ASP A 35 13.135 -0.382 4.533 1.00 0.23 H new ATOM 0 HB3 ASP A 35 14.834 -0.743 4.301 1.00 0.23 H new ATOM 622 N THR A 36 16.340 0.469 7.472 1.00 0.31 N ATOM 623 CA THR A 36 17.709 0.324 7.943 1.00 0.39 C ATOM 624 C THR A 36 17.936 -1.045 8.571 1.00 0.46 C ATOM 625 O THR A 36 19.063 -1.536 8.621 1.00 0.54 O ATOM 626 CB THR A 36 18.065 1.416 8.965 1.00 0.43 C ATOM 627 OG1 THR A 36 17.104 1.433 10.028 1.00 0.47 O ATOM 628 CG2 THR A 36 18.113 2.779 8.295 1.00 0.39 C ATOM 0 H THR A 36 15.878 1.324 7.782 1.00 0.31 H new ATOM 0 HA THR A 36 18.357 0.427 7.072 1.00 0.39 H new ATOM 0 HB THR A 36 19.049 1.192 9.376 1.00 0.43 H new ATOM 0 HG1 THR A 36 17.342 2.131 10.673 1.00 0.47 H new ATOM 0 HG21 THR A 36 18.366 3.539 9.034 1.00 0.39 H new ATOM 0 HG22 THR A 36 18.868 2.772 7.509 1.00 0.39 H new ATOM 0 HG23 THR A 36 17.139 3.006 7.861 1.00 0.39 H new ATOM 636 N ASP A 37 16.858 -1.657 9.048 1.00 0.45 N ATOM 637 CA ASP A 37 16.940 -2.970 9.664 1.00 0.51 C ATOM 638 C ASP A 37 16.992 -4.068 8.606 1.00 0.50 C ATOM 639 O ASP A 37 17.451 -5.179 8.872 1.00 0.58 O ATOM 640 CB ASP A 37 15.745 -3.191 10.592 1.00 0.51 C ATOM 641 CG ASP A 37 15.831 -2.359 11.855 1.00 1.04 C ATOM 642 OD1 ASP A 37 16.497 -2.802 12.814 1.00 0.98 O ATOM 643 OD2 ASP A 37 15.234 -1.262 11.885 1.00 1.71 O ATOM 0 H ASP A 37 15.918 -1.262 9.019 1.00 0.45 H new ATOM 0 HA ASP A 37 17.859 -3.015 10.248 1.00 0.51 H new ATOM 0 HB2 ASP A 37 14.826 -2.945 10.060 1.00 0.51 H new ATOM 0 HB3 ASP A 37 15.686 -4.246 10.859 1.00 0.51 H new ATOM 648 N GLY A 38 16.517 -3.748 7.404 1.00 0.43 N ATOM 649 CA GLY A 38 16.520 -4.713 6.323 1.00 0.46 C ATOM 650 C GLY A 38 15.488 -5.801 6.520 1.00 0.42 C ATOM 651 O GLY A 38 15.598 -6.885 5.947 1.00 0.46 O ATOM 0 H GLY A 38 16.130 -2.836 7.162 1.00 0.43 H new ATOM 0 HA2 GLY A 38 16.328 -4.200 5.381 1.00 0.46 H new ATOM 0 HA3 GLY A 38 17.509 -5.164 6.245 1.00 0.46 H new ATOM 655 N THR A 39 14.478 -5.508 7.330 1.00 0.35 N ATOM 656 CA THR A 39 13.420 -6.467 7.610 1.00 0.33 C ATOM 657 C THR A 39 12.067 -5.974 7.105 1.00 0.30 C ATOM 658 O THR A 39 11.031 -6.547 7.436 1.00 0.41 O ATOM 659 CB THR A 39 13.315 -6.750 9.119 1.00 0.35 C ATOM 660 OG1 THR A 39 12.206 -7.619 9.381 1.00 0.65 O ATOM 661 CG2 THR A 39 13.148 -5.455 9.900 1.00 0.64 C ATOM 0 H THR A 39 14.371 -4.612 7.805 1.00 0.35 H new ATOM 0 HA THR A 39 13.682 -7.385 7.084 1.00 0.33 H new ATOM 0 HB THR A 39 14.237 -7.235 9.441 1.00 0.35 H new ATOM 0 HG1 THR A 39 11.570 -7.571 8.637 1.00 0.65 H new ATOM 0 HG21 THR A 39 13.076 -5.679 10.964 1.00 0.64 H new ATOM 0 HG22 THR A 39 14.008 -4.809 9.722 1.00 0.64 H new ATOM 0 HG23 THR A 39 12.240 -4.948 9.574 1.00 0.64 H new ATOM 669 N GLY A 40 12.077 -4.909 6.306 1.00 0.22 N ATOM 670 CA GLY A 40 10.838 -4.371 5.786 1.00 0.21 C ATOM 671 C GLY A 40 10.482 -3.046 6.422 1.00 0.20 C ATOM 672 O GLY A 40 10.908 -2.751 7.539 1.00 0.32 O ATOM 0 H GLY A 40 12.919 -4.413 6.012 1.00 0.22 H new ATOM 0 HA2 GLY A 40 10.923 -4.243 4.707 1.00 0.21 H new ATOM 0 HA3 GLY A 40 10.032 -5.084 5.960 1.00 0.21 H new ATOM 676 N LEU A 41 9.702 -2.247 5.710 1.00 0.12 N ATOM 677 CA LEU A 41 9.295 -0.943 6.206 1.00 0.10 C ATOM 678 C LEU A 41 8.278 -1.071 7.328 1.00 0.10 C ATOM 679 O LEU A 41 7.258 -1.745 7.186 1.00 0.14 O ATOM 680 CB LEU A 41 8.709 -0.107 5.073 1.00 0.10 C ATOM 681 CG LEU A 41 9.726 0.414 4.063 1.00 0.11 C ATOM 682 CD1 LEU A 41 10.714 1.344 4.743 1.00 0.12 C ATOM 683 CD2 LEU A 41 10.449 -0.742 3.396 1.00 0.14 C ATOM 0 H LEU A 41 9.338 -2.480 4.786 1.00 0.12 H new ATOM 0 HA LEU A 41 10.181 -0.447 6.602 1.00 0.10 H new ATOM 0 HB2 LEU A 41 7.969 -0.708 4.544 1.00 0.10 H new ATOM 0 HB3 LEU A 41 8.180 0.743 5.505 1.00 0.10 H new ATOM 0 HG LEU A 41 9.198 0.977 3.293 1.00 0.11 H new ATOM 0 HD11 LEU A 41 11.434 1.708 4.010 1.00 0.12 H new ATOM 0 HD12 LEU A 41 10.179 2.189 5.177 1.00 0.12 H new ATOM 0 HD13 LEU A 41 11.239 0.804 5.531 1.00 0.12 H new ATOM 0 HD21 LEU A 41 11.171 -0.354 2.678 1.00 0.14 H new ATOM 0 HD22 LEU A 41 10.969 -1.331 4.152 1.00 0.14 H new ATOM 0 HD23 LEU A 41 9.726 -1.373 2.879 1.00 0.14 H new ATOM 695 N GLY A 42 8.568 -0.421 8.447 1.00 0.09 N ATOM 696 CA GLY A 42 7.659 -0.454 9.572 1.00 0.11 C ATOM 697 C GLY A 42 6.451 0.413 9.312 1.00 0.10 C ATOM 698 O GLY A 42 6.436 1.182 8.356 1.00 0.11 O ATOM 0 H GLY A 42 9.415 0.127 8.594 1.00 0.09 H new ATOM 0 HA2 GLY A 42 7.342 -1.480 9.759 1.00 0.11 H new ATOM 0 HA3 GLY A 42 8.172 -0.110 10.470 1.00 0.11 H new ATOM 702 N LEU A 43 5.433 0.301 10.146 1.00 0.12 N ATOM 703 CA LEU A 43 4.236 1.100 9.961 1.00 0.12 C ATOM 704 C LEU A 43 4.577 2.583 9.984 1.00 0.11 C ATOM 705 O LEU A 43 4.239 3.326 9.063 1.00 0.12 O ATOM 706 CB LEU A 43 3.206 0.780 11.044 1.00 0.14 C ATOM 707 CG LEU A 43 1.872 1.524 10.919 1.00 0.14 C ATOM 708 CD1 LEU A 43 1.972 2.902 11.551 1.00 0.14 C ATOM 709 CD2 LEU A 43 1.453 1.637 9.459 1.00 0.14 C ATOM 0 H LEU A 43 5.410 -0.328 10.949 1.00 0.12 H new ATOM 0 HA LEU A 43 3.808 0.855 8.989 1.00 0.12 H new ATOM 0 HB2 LEU A 43 3.008 -0.292 11.029 1.00 0.14 H new ATOM 0 HB3 LEU A 43 3.642 1.010 12.016 1.00 0.14 H new ATOM 0 HG LEU A 43 1.110 0.953 11.450 1.00 0.14 H new ATOM 0 HD11 LEU A 43 1.016 3.417 11.454 1.00 0.14 H new ATOM 0 HD12 LEU A 43 2.224 2.801 12.607 1.00 0.14 H new ATOM 0 HD13 LEU A 43 2.748 3.478 11.047 1.00 0.14 H new ATOM 0 HD21 LEU A 43 0.504 2.168 9.393 1.00 0.14 H new ATOM 0 HD22 LEU A 43 2.214 2.184 8.903 1.00 0.14 H new ATOM 0 HD23 LEU A 43 1.341 0.639 9.034 1.00 0.14 H new ATOM 721 N THR A 44 5.247 3.002 11.047 1.00 0.11 N ATOM 722 CA THR A 44 5.644 4.392 11.204 1.00 0.12 C ATOM 723 C THR A 44 6.759 4.756 10.232 1.00 0.12 C ATOM 724 O THR A 44 6.800 5.866 9.708 1.00 0.16 O ATOM 725 CB THR A 44 6.113 4.681 12.641 1.00 0.15 C ATOM 726 OG1 THR A 44 5.068 4.373 13.570 1.00 0.18 O ATOM 727 CG2 THR A 44 6.518 6.140 12.793 1.00 0.18 C ATOM 0 H THR A 44 5.528 2.395 11.817 1.00 0.11 H new ATOM 0 HA THR A 44 4.766 5.001 10.988 1.00 0.12 H new ATOM 0 HB THR A 44 6.980 4.054 12.850 1.00 0.15 H new ATOM 0 HG1 THR A 44 5.376 4.558 14.482 1.00 0.18 H new ATOM 0 HG21 THR A 44 6.846 6.322 13.816 1.00 0.18 H new ATOM 0 HG22 THR A 44 7.333 6.365 12.105 1.00 0.18 H new ATOM 0 HG23 THR A 44 5.665 6.780 12.566 1.00 0.18 H new ATOM 735 N SER A 45 7.659 3.809 9.991 1.00 0.11 N ATOM 736 CA SER A 45 8.778 4.037 9.087 1.00 0.13 C ATOM 737 C SER A 45 8.282 4.115 7.652 1.00 0.13 C ATOM 738 O SER A 45 8.819 4.860 6.832 1.00 0.19 O ATOM 739 CB SER A 45 9.814 2.922 9.228 1.00 0.17 C ATOM 740 OG SER A 45 10.186 2.739 10.583 1.00 0.31 O ATOM 0 H SER A 45 7.635 2.879 10.408 1.00 0.11 H new ATOM 0 HA SER A 45 9.251 4.984 9.349 1.00 0.13 H new ATOM 0 HB2 SER A 45 9.408 1.992 8.830 1.00 0.17 H new ATOM 0 HB3 SER A 45 10.696 3.164 8.635 1.00 0.17 H new ATOM 0 HG SER A 45 10.848 2.019 10.646 1.00 0.31 H new ATOM 746 N TRP A 46 7.250 3.335 7.361 1.00 0.10 N ATOM 747 CA TRP A 46 6.655 3.312 6.038 1.00 0.09 C ATOM 748 C TRP A 46 5.932 4.620 5.770 1.00 0.08 C ATOM 749 O TRP A 46 6.038 5.196 4.688 1.00 0.10 O ATOM 750 CB TRP A 46 5.679 2.146 5.928 1.00 0.09 C ATOM 751 CG TRP A 46 5.121 1.977 4.555 1.00 0.09 C ATOM 752 CD1 TRP A 46 5.453 1.008 3.658 1.00 0.11 C ATOM 753 CD2 TRP A 46 4.144 2.803 3.915 1.00 0.08 C ATOM 754 NE1 TRP A 46 4.739 1.178 2.501 1.00 0.12 N ATOM 755 CE2 TRP A 46 3.929 2.270 2.633 1.00 0.10 C ATOM 756 CE3 TRP A 46 3.428 3.937 4.302 1.00 0.08 C ATOM 757 CZ2 TRP A 46 3.029 2.832 1.733 1.00 0.10 C ATOM 758 CZ3 TRP A 46 2.534 4.496 3.407 1.00 0.08 C ATOM 759 CH2 TRP A 46 2.341 3.940 2.136 1.00 0.09 C ATOM 0 H TRP A 46 6.807 2.706 8.031 1.00 0.10 H new ATOM 0 HA TRP A 46 7.444 3.186 5.297 1.00 0.09 H new ATOM 0 HB2 TRP A 46 6.185 1.227 6.223 1.00 0.09 H new ATOM 0 HB3 TRP A 46 4.860 2.298 6.630 1.00 0.09 H new ATOM 0 HD1 TRP A 46 6.173 0.222 3.833 1.00 0.11 H new ATOM 0 HE1 TRP A 46 4.802 0.584 1.674 1.00 0.12 H new ATOM 0 HE3 TRP A 46 3.569 4.370 5.281 1.00 0.08 H new ATOM 0 HZ2 TRP A 46 2.880 2.407 0.751 1.00 0.10 H new ATOM 0 HZ3 TRP A 46 1.976 5.375 3.693 1.00 0.08 H new ATOM 0 HH2 TRP A 46 1.633 4.397 1.461 1.00 0.09 H new ATOM 770 N LEU A 47 5.189 5.080 6.768 1.00 0.08 N ATOM 771 CA LEU A 47 4.449 6.326 6.660 1.00 0.08 C ATOM 772 C LEU A 47 5.409 7.483 6.438 1.00 0.08 C ATOM 773 O LEU A 47 5.199 8.326 5.567 1.00 0.11 O ATOM 774 CB LEU A 47 3.625 6.558 7.925 1.00 0.09 C ATOM 775 CG LEU A 47 2.435 5.617 8.102 1.00 0.15 C ATOM 776 CD1 LEU A 47 1.831 5.781 9.486 1.00 0.60 C ATOM 777 CD2 LEU A 47 1.389 5.878 7.030 1.00 0.62 C ATOM 0 H LEU A 47 5.084 4.605 7.664 1.00 0.08 H new ATOM 0 HA LEU A 47 3.772 6.263 5.808 1.00 0.08 H new ATOM 0 HB2 LEU A 47 4.280 6.458 8.791 1.00 0.09 H new ATOM 0 HB3 LEU A 47 3.259 7.585 7.919 1.00 0.09 H new ATOM 0 HG LEU A 47 2.786 4.590 7.999 1.00 0.15 H new ATOM 0 HD11 LEU A 47 0.984 5.104 9.596 1.00 0.60 H new ATOM 0 HD12 LEU A 47 2.582 5.548 10.241 1.00 0.60 H new ATOM 0 HD13 LEU A 47 1.492 6.809 9.616 1.00 0.60 H new ATOM 0 HD21 LEU A 47 0.547 5.199 7.170 1.00 0.62 H new ATOM 0 HD22 LEU A 47 1.041 6.908 7.105 1.00 0.62 H new ATOM 0 HD23 LEU A 47 1.828 5.714 6.046 1.00 0.62 H new ATOM 789 N LEU A 48 6.465 7.508 7.237 1.00 0.08 N ATOM 790 CA LEU A 48 7.479 8.543 7.135 1.00 0.10 C ATOM 791 C LEU A 48 8.222 8.421 5.809 1.00 0.10 C ATOM 792 O LEU A 48 8.766 9.399 5.297 1.00 0.11 O ATOM 793 CB LEU A 48 8.456 8.427 8.302 1.00 0.12 C ATOM 794 CG LEU A 48 7.831 8.613 9.684 1.00 0.13 C ATOM 795 CD1 LEU A 48 8.776 8.124 10.768 1.00 0.17 C ATOM 796 CD2 LEU A 48 7.468 10.070 9.908 1.00 0.17 C ATOM 0 H LEU A 48 6.641 6.818 7.967 1.00 0.08 H new ATOM 0 HA LEU A 48 6.996 9.520 7.174 1.00 0.10 H new ATOM 0 HB2 LEU A 48 8.931 7.447 8.263 1.00 0.12 H new ATOM 0 HB3 LEU A 48 9.244 9.169 8.173 1.00 0.12 H new ATOM 0 HG LEU A 48 6.919 8.019 9.734 1.00 0.13 H new ATOM 0 HD11 LEU A 48 8.313 8.265 11.745 1.00 0.17 H new ATOM 0 HD12 LEU A 48 8.988 7.066 10.616 1.00 0.17 H new ATOM 0 HD13 LEU A 48 9.706 8.690 10.722 1.00 0.17 H new ATOM 0 HD21 LEU A 48 7.024 10.186 10.897 1.00 0.17 H new ATOM 0 HD22 LEU A 48 8.366 10.684 9.839 1.00 0.17 H new ATOM 0 HD23 LEU A 48 6.753 10.388 9.149 1.00 0.17 H new ATOM 808 N ALA A 49 8.241 7.208 5.263 1.00 0.10 N ATOM 809 CA ALA A 49 8.905 6.952 3.993 1.00 0.11 C ATOM 810 C ALA A 49 8.189 7.680 2.865 1.00 0.11 C ATOM 811 O ALA A 49 8.816 8.173 1.927 1.00 0.15 O ATOM 812 CB ALA A 49 8.961 5.456 3.716 1.00 0.11 C ATOM 0 H ALA A 49 7.803 6.388 5.682 1.00 0.10 H new ATOM 0 HA ALA A 49 9.926 7.329 4.051 1.00 0.11 H new ATOM 0 HB1 ALA A 49 9.460 5.281 2.763 1.00 0.11 H new ATOM 0 HB2 ALA A 49 9.515 4.959 4.513 1.00 0.11 H new ATOM 0 HB3 ALA A 49 7.948 5.056 3.674 1.00 0.11 H new ATOM 818 N ALA A 50 6.866 7.744 2.969 1.00 0.08 N ATOM 819 CA ALA A 50 6.051 8.423 1.975 1.00 0.08 C ATOM 820 C ALA A 50 6.183 9.930 2.130 1.00 0.10 C ATOM 821 O ALA A 50 6.273 10.664 1.147 1.00 0.13 O ATOM 822 CB ALA A 50 4.597 8.004 2.109 1.00 0.10 C ATOM 0 H ALA A 50 6.336 7.331 3.736 1.00 0.08 H new ATOM 0 HA ALA A 50 6.403 8.141 0.983 1.00 0.08 H new ATOM 0 HB1 ALA A 50 3.999 8.520 1.358 1.00 0.10 H new ATOM 0 HB2 ALA A 50 4.514 6.927 1.962 1.00 0.10 H new ATOM 0 HB3 ALA A 50 4.234 8.263 3.103 1.00 0.10 H new ATOM 828 N LYS A 51 6.196 10.381 3.377 1.00 0.09 N ATOM 829 CA LYS A 51 6.325 11.797 3.673 1.00 0.11 C ATOM 830 C LYS A 51 7.652 12.322 3.145 1.00 0.13 C ATOM 831 O LYS A 51 7.732 13.433 2.623 1.00 0.15 O ATOM 832 CB LYS A 51 6.227 12.036 5.178 1.00 0.14 C ATOM 833 CG LYS A 51 4.925 11.545 5.789 1.00 0.14 C ATOM 834 CD LYS A 51 4.875 11.820 7.284 1.00 0.21 C ATOM 835 CE LYS A 51 3.611 11.260 7.918 1.00 0.61 C ATOM 836 NZ LYS A 51 3.570 11.504 9.386 1.00 1.40 N ATOM 0 H LYS A 51 6.118 9.783 4.200 1.00 0.09 H new ATOM 0 HA LYS A 51 5.512 12.332 3.182 1.00 0.11 H new ATOM 0 HB2 LYS A 51 7.061 11.537 5.672 1.00 0.14 H new ATOM 0 HB3 LYS A 51 6.332 13.103 5.376 1.00 0.14 H new ATOM 0 HG2 LYS A 51 4.084 12.035 5.299 1.00 0.14 H new ATOM 0 HG3 LYS A 51 4.818 10.475 5.611 1.00 0.14 H new ATOM 0 HD2 LYS A 51 5.749 11.379 7.764 1.00 0.21 H new ATOM 0 HD3 LYS A 51 4.924 12.895 7.458 1.00 0.21 H new ATOM 0 HE2 LYS A 51 2.738 11.715 7.450 1.00 0.61 H new ATOM 0 HE3 LYS A 51 3.553 10.189 7.727 1.00 0.61 H new ATOM 0 HZ1 LYS A 51 2.693 11.107 9.780 1.00 1.40 H new ATOM 0 HZ2 LYS A 51 4.389 11.048 9.837 1.00 1.40 H new ATOM 0 HZ3 LYS A 51 3.599 12.527 9.569 1.00 1.40 H new ATOM 850 N SER A 52 8.695 11.511 3.290 1.00 0.12 N ATOM 851 CA SER A 52 10.019 11.887 2.811 1.00 0.15 C ATOM 852 C SER A 52 9.972 12.186 1.316 1.00 0.14 C ATOM 853 O SER A 52 10.793 12.941 0.795 1.00 0.16 O ATOM 854 CB SER A 52 11.031 10.774 3.093 1.00 0.17 C ATOM 855 OG SER A 52 12.315 11.113 2.597 1.00 1.23 O ATOM 0 H SER A 52 8.649 10.594 3.733 1.00 0.12 H new ATOM 0 HA SER A 52 10.335 12.785 3.342 1.00 0.15 H new ATOM 0 HB2 SER A 52 11.088 10.594 4.167 1.00 0.17 H new ATOM 0 HB3 SER A 52 10.693 9.846 2.632 1.00 0.17 H new ATOM 0 HG SER A 52 12.943 10.386 2.791 1.00 1.23 H new ATOM 861 N LEU A 53 9.002 11.584 0.633 1.00 0.12 N ATOM 862 CA LEU A 53 8.828 11.783 -0.800 1.00 0.12 C ATOM 863 C LEU A 53 7.873 12.938 -1.076 1.00 0.12 C ATOM 864 O LEU A 53 7.377 13.087 -2.190 1.00 0.15 O ATOM 865 CB LEU A 53 8.265 10.516 -1.439 1.00 0.13 C ATOM 866 CG LEU A 53 9.050 9.240 -1.159 1.00 0.12 C ATOM 867 CD1 LEU A 53 8.299 8.033 -1.694 1.00 0.13 C ATOM 868 CD2 LEU A 53 10.436 9.328 -1.773 1.00 0.14 C ATOM 0 H LEU A 53 8.322 10.951 1.053 1.00 0.12 H new ATOM 0 HA LEU A 53 9.804 12.015 -1.227 1.00 0.12 H new ATOM 0 HB2 LEU A 53 7.242 10.377 -1.090 1.00 0.13 H new ATOM 0 HB3 LEU A 53 8.217 10.664 -2.518 1.00 0.13 H new ATOM 0 HG LEU A 53 9.161 9.125 -0.081 1.00 0.12 H new ATOM 0 HD11 LEU A 53 8.870 7.128 -1.488 1.00 0.13 H new ATOM 0 HD12 LEU A 53 7.325 7.966 -1.209 1.00 0.13 H new ATOM 0 HD13 LEU A 53 8.162 8.138 -2.770 1.00 0.13 H new ATOM 0 HD21 LEU A 53 10.985 8.410 -1.565 1.00 0.14 H new ATOM 0 HD22 LEU A 53 10.348 9.462 -2.851 1.00 0.14 H new ATOM 0 HD23 LEU A 53 10.971 10.176 -1.344 1.00 0.14 H new ATOM 880 N GLU A 54 7.620 13.759 -0.065 1.00 0.12 N ATOM 881 CA GLU A 54 6.694 14.869 -0.218 1.00 0.13 C ATOM 882 C GLU A 54 5.284 14.339 -0.479 1.00 0.11 C ATOM 883 O GLU A 54 4.405 15.075 -0.926 1.00 0.13 O ATOM 884 CB GLU A 54 7.134 15.774 -1.365 1.00 0.17 C ATOM 885 CG GLU A 54 8.582 16.214 -1.263 1.00 0.23 C ATOM 886 CD GLU A 54 9.013 17.081 -2.431 1.00 0.63 C ATOM 887 OE1 GLU A 54 9.474 16.520 -3.447 1.00 1.14 O ATOM 888 OE2 GLU A 54 8.889 18.319 -2.328 1.00 0.59 O ATOM 0 H GLU A 54 8.040 13.677 0.861 1.00 0.12 H new ATOM 0 HA GLU A 54 6.691 15.452 0.703 1.00 0.13 H new ATOM 0 HB2 GLU A 54 6.987 15.249 -2.309 1.00 0.17 H new ATOM 0 HB3 GLU A 54 6.494 16.656 -1.388 1.00 0.17 H new ATOM 0 HG2 GLU A 54 8.725 16.765 -0.334 1.00 0.23 H new ATOM 0 HG3 GLU A 54 9.223 15.334 -1.213 1.00 0.23 H new ATOM 895 N LEU A 55 5.082 13.051 -0.195 1.00 0.11 N ATOM 896 CA LEU A 55 3.796 12.406 -0.394 1.00 0.13 C ATOM 897 C LEU A 55 3.056 12.297 0.934 1.00 0.17 C ATOM 898 O LEU A 55 3.617 11.843 1.930 1.00 0.33 O ATOM 899 CB LEU A 55 4.011 11.018 -1.001 1.00 0.20 C ATOM 900 CG LEU A 55 2.775 10.124 -1.058 1.00 0.38 C ATOM 901 CD1 LEU A 55 1.805 10.619 -2.120 1.00 0.69 C ATOM 902 CD2 LEU A 55 3.183 8.682 -1.325 1.00 0.72 C ATOM 0 H LEU A 55 5.804 12.434 0.177 1.00 0.11 H new ATOM 0 HA LEU A 55 3.192 13.003 -1.077 1.00 0.13 H new ATOM 0 HB2 LEU A 55 4.396 11.140 -2.013 1.00 0.20 H new ATOM 0 HB3 LEU A 55 4.782 10.505 -0.426 1.00 0.20 H new ATOM 0 HG LEU A 55 2.268 10.166 -0.094 1.00 0.38 H new ATOM 0 HD11 LEU A 55 0.930 9.969 -2.145 1.00 0.69 H new ATOM 0 HD12 LEU A 55 1.494 11.636 -1.883 1.00 0.69 H new ATOM 0 HD13 LEU A 55 2.294 10.607 -3.094 1.00 0.69 H new ATOM 0 HD21 LEU A 55 2.293 8.053 -1.364 1.00 0.72 H new ATOM 0 HD22 LEU A 55 3.710 8.623 -2.277 1.00 0.72 H new ATOM 0 HD23 LEU A 55 3.838 8.335 -0.526 1.00 0.72 H new ATOM 914 N LYS A 56 1.799 12.717 0.944 1.00 0.15 N ATOM 915 CA LYS A 56 0.997 12.678 2.157 1.00 0.16 C ATOM 916 C LYS A 56 0.496 11.268 2.439 1.00 0.16 C ATOM 917 O LYS A 56 0.016 10.574 1.545 1.00 0.20 O ATOM 918 CB LYS A 56 -0.185 13.641 2.052 1.00 0.18 C ATOM 919 CG LYS A 56 -0.946 13.802 3.356 1.00 0.61 C ATOM 920 CD LYS A 56 -2.134 14.739 3.201 1.00 0.62 C ATOM 921 CE LYS A 56 -2.871 14.925 4.517 1.00 1.18 C ATOM 922 NZ LYS A 56 -1.994 15.513 5.566 1.00 1.86 N ATOM 0 H LYS A 56 1.314 13.088 0.127 1.00 0.15 H new ATOM 0 HA LYS A 56 1.634 12.989 2.985 1.00 0.16 H new ATOM 0 HB2 LYS A 56 0.178 14.617 1.728 1.00 0.18 H new ATOM 0 HB3 LYS A 56 -0.869 13.284 1.282 1.00 0.18 H new ATOM 0 HG2 LYS A 56 -1.293 12.827 3.698 1.00 0.61 H new ATOM 0 HG3 LYS A 56 -0.275 14.188 4.124 1.00 0.61 H new ATOM 0 HD2 LYS A 56 -1.790 15.707 2.835 1.00 0.62 H new ATOM 0 HD3 LYS A 56 -2.819 14.340 2.452 1.00 0.62 H new ATOM 0 HE2 LYS A 56 -3.734 15.572 4.361 1.00 1.18 H new ATOM 0 HE3 LYS A 56 -3.251 13.963 4.859 1.00 1.18 H new ATOM 0 HZ1 LYS A 56 -2.576 15.827 6.369 1.00 1.86 H new ATOM 0 HZ2 LYS A 56 -1.313 14.797 5.891 1.00 1.86 H new ATOM 0 HZ3 LYS A 56 -1.479 16.327 5.172 1.00 1.86 H new ATOM 936 N VAL A 57 0.625 10.852 3.689 1.00 0.14 N ATOM 937 CA VAL A 57 0.179 9.531 4.109 1.00 0.14 C ATOM 938 C VAL A 57 -0.245 9.554 5.569 1.00 0.15 C ATOM 939 O VAL A 57 0.229 10.381 6.348 1.00 0.15 O ATOM 940 CB VAL A 57 1.283 8.476 3.915 1.00 0.12 C ATOM 941 CG1 VAL A 57 1.729 8.437 2.463 1.00 0.12 C ATOM 942 CG2 VAL A 57 2.462 8.756 4.834 1.00 0.13 C ATOM 0 H VAL A 57 1.037 11.413 4.435 1.00 0.14 H new ATOM 0 HA VAL A 57 -0.673 9.260 3.485 1.00 0.14 H new ATOM 0 HB VAL A 57 0.876 7.499 4.176 1.00 0.12 H new ATOM 0 HG11 VAL A 57 2.510 7.686 2.342 1.00 0.12 H new ATOM 0 HG12 VAL A 57 0.880 8.183 1.828 1.00 0.12 H new ATOM 0 HG13 VAL A 57 2.117 9.414 2.175 1.00 0.12 H new ATOM 0 HG21 VAL A 57 3.231 7.999 4.681 1.00 0.13 H new ATOM 0 HG22 VAL A 57 2.873 9.740 4.609 1.00 0.13 H new ATOM 0 HG23 VAL A 57 2.129 8.730 5.872 1.00 0.13 H new ATOM 952 N LYS A 58 -1.133 8.644 5.942 1.00 0.17 N ATOM 953 CA LYS A 58 -1.609 8.585 7.315 1.00 0.20 C ATOM 954 C LYS A 58 -2.324 7.275 7.604 1.00 0.16 C ATOM 955 O LYS A 58 -3.288 6.915 6.928 1.00 0.18 O ATOM 956 CB LYS A 58 -2.548 9.755 7.595 1.00 0.26 C ATOM 957 CG LYS A 58 -3.096 9.762 9.011 1.00 0.63 C ATOM 958 CD LYS A 58 -4.091 10.891 9.219 1.00 1.21 C ATOM 959 CE LYS A 58 -5.319 10.714 8.342 1.00 1.69 C ATOM 960 NZ LYS A 58 -6.337 11.771 8.591 1.00 2.33 N ATOM 0 H LYS A 58 -1.535 7.943 5.320 1.00 0.17 H new ATOM 0 HA LYS A 58 -0.739 8.648 7.969 1.00 0.20 H new ATOM 0 HB2 LYS A 58 -2.016 10.689 7.414 1.00 0.26 H new ATOM 0 HB3 LYS A 58 -3.380 9.720 6.891 1.00 0.26 H new ATOM 0 HG2 LYS A 58 -3.579 8.807 9.220 1.00 0.63 H new ATOM 0 HG3 LYS A 58 -2.274 9.865 9.720 1.00 0.63 H new ATOM 0 HD2 LYS A 58 -4.391 10.925 10.266 1.00 1.21 H new ATOM 0 HD3 LYS A 58 -3.614 11.845 8.993 1.00 1.21 H new ATOM 0 HE2 LYS A 58 -5.022 10.736 7.293 1.00 1.69 H new ATOM 0 HE3 LYS A 58 -5.760 9.735 8.528 1.00 1.69 H new ATOM 0 HZ1 LYS A 58 -7.159 11.614 7.973 1.00 2.33 H new ATOM 0 HZ2 LYS A 58 -6.640 11.734 9.585 1.00 2.33 H new ATOM 0 HZ3 LYS A 58 -5.925 12.704 8.389 1.00 2.33 H new ATOM 974 N GLN A 59 -1.844 6.568 8.617 1.00 0.15 N ATOM 975 CA GLN A 59 -2.440 5.309 9.020 1.00 0.13 C ATOM 976 C GLN A 59 -3.586 5.568 9.986 1.00 0.13 C ATOM 977 O GLN A 59 -3.400 6.188 11.033 1.00 0.16 O ATOM 978 CB GLN A 59 -1.392 4.409 9.670 1.00 0.16 C ATOM 979 CG GLN A 59 -1.948 3.076 10.138 1.00 0.20 C ATOM 980 CD GLN A 59 -1.921 2.913 11.647 1.00 0.44 C ATOM 981 OE1 GLN A 59 -1.729 1.809 12.156 1.00 1.13 O ATOM 982 NE2 GLN A 59 -2.127 4.006 12.372 1.00 0.36 N ATOM 0 H GLN A 59 -1.039 6.850 9.176 1.00 0.15 H new ATOM 0 HA GLN A 59 -2.828 4.802 8.136 1.00 0.13 H new ATOM 0 HB2 GLN A 59 -0.587 4.228 8.958 1.00 0.16 H new ATOM 0 HB3 GLN A 59 -0.954 4.930 10.521 1.00 0.16 H new ATOM 0 HG2 GLN A 59 -2.975 2.974 9.786 1.00 0.20 H new ATOM 0 HG3 GLN A 59 -1.374 2.270 9.682 1.00 0.20 H new ATOM 0 HE21 GLN A 59 -2.282 4.902 11.911 1.00 0.36 H new ATOM 0 HE22 GLN A 59 -2.130 3.949 13.390 1.00 0.36 H new ATOM 991 N VAL A 60 -4.769 5.092 9.632 1.00 0.13 N ATOM 992 CA VAL A 60 -5.944 5.294 10.466 1.00 0.16 C ATOM 993 C VAL A 60 -6.790 4.033 10.542 1.00 0.15 C ATOM 994 O VAL A 60 -6.694 3.154 9.686 1.00 0.18 O ATOM 995 CB VAL A 60 -6.813 6.444 9.924 1.00 0.20 C ATOM 996 CG1 VAL A 60 -7.267 6.144 8.504 1.00 0.22 C ATOM 997 CG2 VAL A 60 -8.006 6.689 10.834 1.00 0.23 C ATOM 0 H VAL A 60 -4.941 4.565 8.776 1.00 0.13 H new ATOM 0 HA VAL A 60 -5.587 5.547 11.464 1.00 0.16 H new ATOM 0 HB VAL A 60 -6.211 7.352 9.905 1.00 0.20 H new ATOM 0 HG11 VAL A 60 -7.880 6.967 8.136 1.00 0.22 H new ATOM 0 HG12 VAL A 60 -6.395 6.026 7.861 1.00 0.22 H new ATOM 0 HG13 VAL A 60 -7.852 5.224 8.496 1.00 0.22 H new ATOM 0 HG21 VAL A 60 -8.607 7.505 10.434 1.00 0.23 H new ATOM 0 HG22 VAL A 60 -8.612 5.785 10.890 1.00 0.23 H new ATOM 0 HG23 VAL A 60 -7.655 6.953 11.832 1.00 0.23 H new ATOM 1007 N LYS A 61 -7.620 3.951 11.574 1.00 0.19 N ATOM 1008 CA LYS A 61 -8.486 2.800 11.759 1.00 0.20 C ATOM 1009 C LYS A 61 -9.842 3.063 11.127 1.00 0.21 C ATOM 1010 O LYS A 61 -10.639 3.847 11.642 1.00 0.23 O ATOM 1011 CB LYS A 61 -8.649 2.486 13.244 1.00 0.23 C ATOM 1012 CG LYS A 61 -9.343 1.162 13.510 1.00 0.28 C ATOM 1013 CD LYS A 61 -9.481 0.893 15.000 1.00 0.37 C ATOM 1014 CE LYS A 61 -10.198 -0.420 15.270 1.00 1.05 C ATOM 1015 NZ LYS A 61 -11.568 -0.433 14.686 1.00 2.03 N ATOM 0 H LYS A 61 -7.710 4.668 12.294 1.00 0.19 H new ATOM 0 HA LYS A 61 -8.029 1.938 11.272 1.00 0.20 H new ATOM 0 HB2 LYS A 61 -7.666 2.473 13.715 1.00 0.23 H new ATOM 0 HB3 LYS A 61 -9.218 3.287 13.716 1.00 0.23 H new ATOM 0 HG2 LYS A 61 -10.330 1.168 13.048 1.00 0.28 H new ATOM 0 HG3 LYS A 61 -8.778 0.354 13.044 1.00 0.28 H new ATOM 0 HD2 LYS A 61 -8.492 0.869 15.459 1.00 0.37 H new ATOM 0 HD3 LYS A 61 -10.030 1.710 15.468 1.00 0.37 H new ATOM 0 HE2 LYS A 61 -9.618 -1.243 14.853 1.00 1.05 H new ATOM 0 HE3 LYS A 61 -10.260 -0.586 16.346 1.00 1.05 H new ATOM 0 HZ1 LYS A 61 -12.113 -1.218 15.096 1.00 2.03 H new ATOM 0 HZ2 LYS A 61 -12.044 0.467 14.898 1.00 2.03 H new ATOM 0 HZ3 LYS A 61 -11.505 -0.556 13.655 1.00 2.03 H new ATOM 1029 N LYS A 62 -10.097 2.403 10.010 1.00 0.20 N ATOM 1030 CA LYS A 62 -11.350 2.572 9.295 1.00 0.22 C ATOM 1031 C LYS A 62 -12.042 1.238 9.072 1.00 0.23 C ATOM 1032 O LYS A 62 -11.394 0.216 8.850 1.00 0.38 O ATOM 1033 CB LYS A 62 -11.094 3.252 7.951 1.00 0.23 C ATOM 1034 CG LYS A 62 -10.480 4.636 8.081 1.00 0.30 C ATOM 1035 CD LYS A 62 -11.496 5.648 8.587 1.00 0.50 C ATOM 1036 CE LYS A 62 -10.855 7.002 8.843 1.00 0.75 C ATOM 1037 NZ LYS A 62 -11.863 8.031 9.221 1.00 1.04 N ATOM 0 H LYS A 62 -9.450 1.743 9.578 1.00 0.20 H new ATOM 0 HA LYS A 62 -12.004 3.197 9.903 1.00 0.22 H new ATOM 0 HB2 LYS A 62 -10.432 2.624 7.355 1.00 0.23 H new ATOM 0 HB3 LYS A 62 -12.035 3.330 7.407 1.00 0.23 H new ATOM 0 HG2 LYS A 62 -9.632 4.597 8.764 1.00 0.30 H new ATOM 0 HG3 LYS A 62 -10.095 4.957 7.113 1.00 0.30 H new ATOM 0 HD2 LYS A 62 -12.298 5.756 7.857 1.00 0.50 H new ATOM 0 HD3 LYS A 62 -11.950 5.280 9.507 1.00 0.50 H new ATOM 0 HE2 LYS A 62 -10.115 6.909 9.638 1.00 0.75 H new ATOM 0 HE3 LYS A 62 -10.323 7.327 7.949 1.00 0.75 H new ATOM 0 HZ1 LYS A 62 -11.386 8.940 9.387 1.00 1.04 H new ATOM 0 HZ2 LYS A 62 -12.555 8.139 8.452 1.00 1.04 H new ATOM 0 HZ3 LYS A 62 -12.354 7.734 10.089 1.00 1.04 H new ATOM 1051 N THR A 63 -13.366 1.256 9.132 1.00 0.17 N ATOM 1052 CA THR A 63 -14.152 0.051 8.928 1.00 0.15 C ATOM 1053 C THR A 63 -14.221 -0.299 7.449 1.00 0.13 C ATOM 1054 O THR A 63 -14.241 0.583 6.593 1.00 0.15 O ATOM 1055 CB THR A 63 -15.582 0.205 9.477 1.00 0.20 C ATOM 1056 OG1 THR A 63 -16.247 1.292 8.821 1.00 0.24 O ATOM 1057 CG2 THR A 63 -15.560 0.450 10.979 1.00 0.24 C ATOM 0 H THR A 63 -13.917 2.093 9.321 1.00 0.17 H new ATOM 0 HA THR A 63 -13.655 -0.751 9.473 1.00 0.15 H new ATOM 0 HB THR A 63 -16.124 -0.721 9.282 1.00 0.20 H new ATOM 0 HG1 THR A 63 -17.156 1.381 9.176 1.00 0.24 H new ATOM 0 HG21 THR A 63 -16.581 0.556 11.345 1.00 0.24 H new ATOM 0 HG22 THR A 63 -15.081 -0.392 11.478 1.00 0.24 H new ATOM 0 HG23 THR A 63 -15.002 1.362 11.191 1.00 0.24 H new ATOM 1065 N ILE A 64 -14.255 -1.587 7.148 1.00 0.12 N ATOM 1066 CA ILE A 64 -14.315 -2.046 5.768 1.00 0.13 C ATOM 1067 C ILE A 64 -15.363 -1.274 4.970 1.00 0.17 C ATOM 1068 O ILE A 64 -15.103 -0.820 3.855 1.00 0.21 O ATOM 1069 CB ILE A 64 -14.638 -3.546 5.705 1.00 0.15 C ATOM 1070 CG1 ILE A 64 -13.591 -4.340 6.478 1.00 0.16 C ATOM 1071 CG2 ILE A 64 -14.710 -4.017 4.265 1.00 0.20 C ATOM 1072 CD1 ILE A 64 -13.768 -5.834 6.367 1.00 0.20 C ATOM 0 H ILE A 64 -14.242 -2.335 7.841 1.00 0.12 H new ATOM 0 HA ILE A 64 -13.334 -1.867 5.327 1.00 0.13 H new ATOM 0 HB ILE A 64 -15.612 -3.713 6.165 1.00 0.15 H new ATOM 0 HG12 ILE A 64 -12.600 -4.071 6.113 1.00 0.16 H new ATOM 0 HG13 ILE A 64 -13.632 -4.054 7.529 1.00 0.16 H new ATOM 0 HG21 ILE A 64 -14.940 -5.082 4.242 1.00 0.20 H new ATOM 0 HG22 ILE A 64 -15.491 -3.466 3.741 1.00 0.20 H new ATOM 0 HG23 ILE A 64 -13.751 -3.842 3.777 1.00 0.20 H new ATOM 0 HD11 ILE A 64 -12.989 -6.336 6.941 1.00 0.20 H new ATOM 0 HD12 ILE A 64 -14.746 -6.115 6.759 1.00 0.20 H new ATOM 0 HD13 ILE A 64 -13.697 -6.132 5.321 1.00 0.20 H new ATOM 1084 N ASP A 65 -16.540 -1.124 5.559 1.00 0.21 N ATOM 1085 CA ASP A 65 -17.631 -0.410 4.908 1.00 0.26 C ATOM 1086 C ASP A 65 -17.284 1.065 4.715 1.00 0.24 C ATOM 1087 O ASP A 65 -17.904 1.756 3.907 1.00 0.27 O ATOM 1088 CB ASP A 65 -18.913 -0.542 5.731 1.00 0.33 C ATOM 1089 CG ASP A 65 -18.761 0.010 7.135 1.00 1.34 C ATOM 1090 OD1 ASP A 65 -18.941 1.232 7.314 1.00 2.08 O ATOM 1091 OD2 ASP A 65 -18.461 -0.781 8.054 1.00 1.99 O ATOM 0 H ASP A 65 -16.765 -1.486 6.486 1.00 0.21 H new ATOM 0 HA ASP A 65 -17.788 -0.855 3.926 1.00 0.26 H new ATOM 0 HB2 ASP A 65 -19.722 -0.017 5.223 1.00 0.33 H new ATOM 0 HB3 ASP A 65 -19.199 -1.592 5.786 1.00 0.33 H new ATOM 1096 N ARG A 66 -16.288 1.542 5.459 1.00 0.20 N ATOM 1097 CA ARG A 66 -15.862 2.931 5.365 1.00 0.20 C ATOM 1098 C ARG A 66 -14.857 3.116 4.232 1.00 0.15 C ATOM 1099 O ARG A 66 -14.721 4.208 3.680 1.00 0.14 O ATOM 1100 CB ARG A 66 -15.241 3.380 6.690 1.00 0.24 C ATOM 1101 CG ARG A 66 -14.694 4.795 6.660 1.00 0.71 C ATOM 1102 CD ARG A 66 -15.807 5.817 6.523 1.00 0.66 C ATOM 1103 NE ARG A 66 -15.290 7.179 6.425 1.00 1.54 N ATOM 1104 CZ ARG A 66 -16.032 8.264 6.617 1.00 1.70 C ATOM 1105 NH1 ARG A 66 -17.316 8.146 6.924 1.00 0.95 N ATOM 1106 NH2 ARG A 66 -15.490 9.468 6.500 1.00 2.72 N ATOM 0 H ARG A 66 -15.763 0.985 6.133 1.00 0.20 H new ATOM 0 HA ARG A 66 -16.738 3.543 5.152 1.00 0.20 H new ATOM 0 HB2 ARG A 66 -15.993 3.307 7.476 1.00 0.24 H new ATOM 0 HB3 ARG A 66 -14.436 2.694 6.954 1.00 0.24 H new ATOM 0 HG2 ARG A 66 -14.131 4.988 7.573 1.00 0.71 H new ATOM 0 HG3 ARG A 66 -13.998 4.900 5.828 1.00 0.71 H new ATOM 0 HD2 ARG A 66 -16.401 5.590 5.637 1.00 0.66 H new ATOM 0 HD3 ARG A 66 -16.474 5.743 7.382 1.00 0.66 H new ATOM 0 HE ARG A 66 -14.304 7.304 6.196 1.00 1.54 H new ATOM 0 HH11 ARG A 66 -17.736 7.221 7.013 1.00 0.95 H new ATOM 0 HH12 ARG A 66 -17.884 8.980 7.071 1.00 0.95 H new ATOM 0 HH21 ARG A 66 -14.503 9.562 6.262 1.00 2.72 H new ATOM 0 HH22 ARG A 66 -16.060 10.301 6.648 1.00 2.72 H new ATOM 1120 N LEU A 67 -14.156 2.039 3.892 1.00 0.13 N ATOM 1121 CA LEU A 67 -13.160 2.072 2.830 1.00 0.11 C ATOM 1122 C LEU A 67 -13.752 2.568 1.518 1.00 0.13 C ATOM 1123 O LEU A 67 -13.027 3.016 0.628 1.00 0.14 O ATOM 1124 CB LEU A 67 -12.556 0.682 2.640 1.00 0.11 C ATOM 1125 CG LEU A 67 -11.354 0.359 3.537 1.00 0.12 C ATOM 1126 CD1 LEU A 67 -11.534 0.937 4.936 1.00 0.12 C ATOM 1127 CD2 LEU A 67 -11.148 -1.143 3.609 1.00 0.15 C ATOM 0 H LEU A 67 -14.261 1.129 4.340 1.00 0.13 H new ATOM 0 HA LEU A 67 -12.379 2.772 3.126 1.00 0.11 H new ATOM 0 HB2 LEU A 67 -13.333 -0.061 2.821 1.00 0.11 H new ATOM 0 HB3 LEU A 67 -12.250 0.576 1.599 1.00 0.11 H new ATOM 0 HG LEU A 67 -10.470 0.821 3.098 1.00 0.12 H new ATOM 0 HD11 LEU A 67 -10.665 0.690 5.546 1.00 0.12 H new ATOM 0 HD12 LEU A 67 -11.636 2.020 4.872 1.00 0.12 H new ATOM 0 HD13 LEU A 67 -12.429 0.514 5.392 1.00 0.12 H new ATOM 0 HD21 LEU A 67 -10.293 -1.363 4.248 1.00 0.15 H new ATOM 0 HD22 LEU A 67 -12.040 -1.613 4.023 1.00 0.15 H new ATOM 0 HD23 LEU A 67 -10.963 -1.533 2.608 1.00 0.15 H new ATOM 1139 N ASN A 68 -15.067 2.478 1.393 1.00 0.15 N ATOM 1140 CA ASN A 68 -15.739 2.933 0.187 1.00 0.19 C ATOM 1141 C ASN A 68 -15.791 4.463 0.137 1.00 0.19 C ATOM 1142 O ASN A 68 -16.136 5.046 -0.890 1.00 0.22 O ATOM 1143 CB ASN A 68 -17.154 2.356 0.123 1.00 0.25 C ATOM 1144 CG ASN A 68 -17.769 2.467 -1.259 1.00 0.88 C ATOM 1145 OD1 ASN A 68 -18.650 1.532 -1.588 1.00 1.69 O flip ATOM 1146 ND2 ASN A 68 -17.458 3.380 -2.022 1.00 0.83 N flip ATOM 0 H ASN A 68 -15.687 2.096 2.108 1.00 0.15 H new ATOM 0 HA ASN A 68 -15.172 2.581 -0.675 1.00 0.19 H new ATOM 0 HB2 ASN A 68 -17.129 1.308 0.422 1.00 0.25 H new ATOM 0 HB3 ASN A 68 -17.787 2.877 0.841 1.00 0.25 H new ATOM 0 HD21 ASN A 68 -16.776 4.079 -1.729 1.00 0.83 H new ATOM 0 HD22 ASN A 68 -17.883 3.438 -2.948 1.00 0.83 H new ATOM 1153 N PHE A 69 -15.440 5.115 1.248 1.00 0.17 N ATOM 1154 CA PHE A 69 -15.464 6.571 1.311 1.00 0.18 C ATOM 1155 C PHE A 69 -14.087 7.154 1.629 1.00 0.15 C ATOM 1156 O PHE A 69 -13.889 8.365 1.541 1.00 0.18 O ATOM 1157 CB PHE A 69 -16.476 7.032 2.360 1.00 0.22 C ATOM 1158 CG PHE A 69 -17.799 6.333 2.253 1.00 0.25 C ATOM 1159 CD1 PHE A 69 -18.792 6.820 1.418 1.00 0.32 C ATOM 1160 CD2 PHE A 69 -18.048 5.185 2.986 1.00 0.27 C ATOM 1161 CE1 PHE A 69 -20.008 6.173 1.318 1.00 0.36 C ATOM 1162 CE2 PHE A 69 -19.262 4.534 2.889 1.00 0.31 C ATOM 1163 CZ PHE A 69 -20.244 5.028 2.054 1.00 0.34 C ATOM 0 H PHE A 69 -15.138 4.658 2.109 1.00 0.17 H new ATOM 0 HA PHE A 69 -15.759 6.936 0.327 1.00 0.18 H new ATOM 0 HB2 PHE A 69 -16.062 6.862 3.354 1.00 0.22 H new ATOM 0 HB3 PHE A 69 -16.631 8.106 2.259 1.00 0.22 H new ATOM 0 HD1 PHE A 69 -18.613 7.714 0.840 1.00 0.32 H new ATOM 0 HD2 PHE A 69 -17.284 4.794 3.641 1.00 0.27 H new ATOM 0 HE1 PHE A 69 -20.775 6.562 0.664 1.00 0.36 H new ATOM 0 HE2 PHE A 69 -19.443 3.639 3.466 1.00 0.31 H new ATOM 0 HZ PHE A 69 -21.194 4.521 1.976 1.00 0.34 H new ATOM 1173 N ILE A 70 -13.135 6.299 2.001 1.00 0.12 N ATOM 1174 CA ILE A 70 -11.793 6.768 2.328 1.00 0.11 C ATOM 1175 C ILE A 70 -11.026 7.142 1.068 1.00 0.12 C ATOM 1176 O ILE A 70 -11.495 6.920 -0.048 1.00 0.13 O ATOM 1177 CB ILE A 70 -10.986 5.719 3.117 1.00 0.11 C ATOM 1178 CG1 ILE A 70 -10.724 4.489 2.255 1.00 0.11 C ATOM 1179 CG2 ILE A 70 -11.716 5.337 4.396 1.00 0.13 C ATOM 1180 CD1 ILE A 70 -9.949 3.406 2.972 1.00 0.15 C ATOM 0 H ILE A 70 -13.267 5.291 2.082 1.00 0.12 H new ATOM 0 HA ILE A 70 -11.919 7.649 2.957 1.00 0.11 H new ATOM 0 HB ILE A 70 -10.025 6.155 3.391 1.00 0.11 H new ATOM 0 HG12 ILE A 70 -11.677 4.081 1.918 1.00 0.11 H new ATOM 0 HG13 ILE A 70 -10.173 4.790 1.364 1.00 0.11 H new ATOM 0 HG21 ILE A 70 -11.132 4.595 4.941 1.00 0.13 H new ATOM 0 HG22 ILE A 70 -11.848 6.222 5.018 1.00 0.13 H new ATOM 0 HG23 ILE A 70 -12.692 4.919 4.147 1.00 0.13 H new ATOM 0 HD11 ILE A 70 -9.798 2.561 2.300 1.00 0.15 H new ATOM 0 HD12 ILE A 70 -8.981 3.798 3.285 1.00 0.15 H new ATOM 0 HD13 ILE A 70 -10.508 3.078 3.848 1.00 0.15 H new ATOM 1192 N SER A 71 -9.843 7.707 1.258 1.00 0.12 N ATOM 1193 CA SER A 71 -9.009 8.132 0.142 1.00 0.14 C ATOM 1194 C SER A 71 -8.369 6.943 -0.567 1.00 0.13 C ATOM 1195 O SER A 71 -7.312 6.460 -0.162 1.00 0.15 O ATOM 1196 CB SER A 71 -7.925 9.088 0.634 1.00 0.17 C ATOM 1197 OG SER A 71 -7.122 9.548 -0.440 1.00 1.14 O ATOM 0 H SER A 71 -9.437 7.882 2.177 1.00 0.12 H new ATOM 0 HA SER A 71 -9.650 8.644 -0.575 1.00 0.14 H new ATOM 0 HB2 SER A 71 -8.387 9.938 1.137 1.00 0.17 H new ATOM 0 HB3 SER A 71 -7.299 8.584 1.370 1.00 0.17 H new ATOM 0 HG SER A 71 -6.437 10.159 -0.098 1.00 1.14 H new ATOM 1203 N LEU A 72 -9.020 6.479 -1.627 1.00 0.12 N ATOM 1204 CA LEU A 72 -8.514 5.363 -2.413 1.00 0.12 C ATOM 1205 C LEU A 72 -7.635 5.880 -3.555 1.00 0.13 C ATOM 1206 O LEU A 72 -7.860 6.980 -4.062 1.00 0.15 O ATOM 1207 CB LEU A 72 -9.676 4.536 -2.976 1.00 0.13 C ATOM 1208 CG LEU A 72 -9.781 3.103 -2.445 1.00 0.15 C ATOM 1209 CD1 LEU A 72 -9.788 3.088 -0.925 1.00 0.17 C ATOM 1210 CD2 LEU A 72 -11.033 2.431 -2.989 1.00 0.16 C ATOM 0 H LEU A 72 -9.904 6.862 -1.962 1.00 0.12 H new ATOM 0 HA LEU A 72 -7.913 4.724 -1.765 1.00 0.12 H new ATOM 0 HB2 LEU A 72 -10.609 5.056 -2.757 1.00 0.13 H new ATOM 0 HB3 LEU A 72 -9.580 4.497 -4.061 1.00 0.13 H new ATOM 0 HG LEU A 72 -8.908 2.546 -2.785 1.00 0.15 H new ATOM 0 HD11 LEU A 72 -9.863 2.060 -0.572 1.00 0.17 H new ATOM 0 HD12 LEU A 72 -8.865 3.533 -0.552 1.00 0.17 H new ATOM 0 HD13 LEU A 72 -10.640 3.661 -0.559 1.00 0.17 H new ATOM 0 HD21 LEU A 72 -11.096 1.413 -2.604 1.00 0.16 H new ATOM 0 HD22 LEU A 72 -11.913 2.993 -2.675 1.00 0.16 H new ATOM 0 HD23 LEU A 72 -10.988 2.405 -4.078 1.00 0.16 H new ATOM 1222 N PRO A 73 -6.621 5.103 -3.981 1.00 0.13 N ATOM 1223 CA PRO A 73 -6.314 3.787 -3.415 1.00 0.11 C ATOM 1224 C PRO A 73 -5.667 3.884 -2.040 1.00 0.10 C ATOM 1225 O PRO A 73 -4.761 4.689 -1.822 1.00 0.13 O ATOM 1226 CB PRO A 73 -5.340 3.187 -4.425 1.00 0.12 C ATOM 1227 CG PRO A 73 -4.660 4.363 -5.031 1.00 0.19 C ATOM 1228 CD PRO A 73 -5.685 5.465 -5.061 1.00 0.14 C ATOM 0 HA PRO A 73 -7.212 3.189 -3.262 1.00 0.11 H new ATOM 0 HB2 PRO A 73 -4.626 2.522 -3.940 1.00 0.12 H new ATOM 0 HB3 PRO A 73 -5.863 2.599 -5.179 1.00 0.12 H new ATOM 0 HG2 PRO A 73 -3.790 4.656 -4.444 1.00 0.19 H new ATOM 0 HG3 PRO A 73 -4.304 4.133 -6.035 1.00 0.19 H new ATOM 0 HD2 PRO A 73 -5.230 6.440 -4.886 1.00 0.14 H new ATOM 0 HD3 PRO A 73 -6.189 5.517 -6.026 1.00 0.14 H new ATOM 1236 N ALA A 74 -6.139 3.055 -1.118 1.00 0.09 N ATOM 1237 CA ALA A 74 -5.614 3.044 0.240 1.00 0.09 C ATOM 1238 C ALA A 74 -4.774 1.797 0.491 1.00 0.08 C ATOM 1239 O ALA A 74 -4.989 0.757 -0.133 1.00 0.14 O ATOM 1240 CB ALA A 74 -6.754 3.126 1.242 1.00 0.09 C ATOM 0 H ALA A 74 -6.886 2.381 -1.287 1.00 0.09 H new ATOM 0 HA ALA A 74 -4.970 3.915 0.365 1.00 0.09 H new ATOM 0 HB1 ALA A 74 -6.350 3.117 2.254 1.00 0.09 H new ATOM 0 HB2 ALA A 74 -7.313 4.048 1.083 1.00 0.09 H new ATOM 0 HB3 ALA A 74 -7.418 2.272 1.109 1.00 0.09 H new ATOM 1246 N LEU A 75 -3.816 1.903 1.407 1.00 0.07 N ATOM 1247 CA LEU A 75 -2.947 0.778 1.731 1.00 0.07 C ATOM 1248 C LEU A 75 -3.379 0.095 3.020 1.00 0.07 C ATOM 1249 O LEU A 75 -3.262 0.661 4.106 1.00 0.10 O ATOM 1250 CB LEU A 75 -1.499 1.242 1.866 1.00 0.08 C ATOM 1251 CG LEU A 75 -0.532 0.177 2.385 1.00 0.07 C ATOM 1252 CD1 LEU A 75 -0.385 -0.945 1.372 1.00 0.07 C ATOM 1253 CD2 LEU A 75 0.820 0.794 2.705 1.00 0.09 C ATOM 0 H LEU A 75 -3.623 2.753 1.936 1.00 0.07 H new ATOM 0 HA LEU A 75 -3.026 0.061 0.914 1.00 0.07 H new ATOM 0 HB2 LEU A 75 -1.150 1.587 0.893 1.00 0.08 H new ATOM 0 HB3 LEU A 75 -1.468 2.100 2.538 1.00 0.08 H new ATOM 0 HG LEU A 75 -0.941 -0.243 3.304 1.00 0.07 H new ATOM 0 HD11 LEU A 75 0.307 -1.694 1.757 1.00 0.07 H new ATOM 0 HD12 LEU A 75 -1.357 -1.405 1.195 1.00 0.07 H new ATOM 0 HD13 LEU A 75 0.001 -0.542 0.436 1.00 0.07 H new ATOM 0 HD21 LEU A 75 1.495 0.021 3.073 1.00 0.09 H new ATOM 0 HD22 LEU A 75 1.238 1.242 1.803 1.00 0.09 H new ATOM 0 HD23 LEU A 75 0.698 1.562 3.468 1.00 0.09 H new ATOM 1265 N VAL A 76 -3.866 -1.129 2.896 1.00 0.06 N ATOM 1266 CA VAL A 76 -4.306 -1.898 4.049 1.00 0.07 C ATOM 1267 C VAL A 76 -3.111 -2.502 4.774 1.00 0.07 C ATOM 1268 O VAL A 76 -2.644 -3.588 4.430 1.00 0.08 O ATOM 1269 CB VAL A 76 -5.269 -3.022 3.628 1.00 0.08 C ATOM 1270 CG1 VAL A 76 -4.644 -3.849 2.524 1.00 0.08 C ATOM 1271 CG2 VAL A 76 -5.640 -3.899 4.816 1.00 0.10 C ATOM 0 H VAL A 76 -3.967 -1.613 2.004 1.00 0.06 H new ATOM 0 HA VAL A 76 -4.831 -1.218 4.720 1.00 0.07 H new ATOM 0 HB VAL A 76 -6.187 -2.570 3.253 1.00 0.08 H new ATOM 0 HG11 VAL A 76 -5.331 -4.643 2.231 1.00 0.08 H new ATOM 0 HG12 VAL A 76 -4.438 -3.212 1.664 1.00 0.08 H new ATOM 0 HG13 VAL A 76 -3.713 -4.289 2.881 1.00 0.08 H new ATOM 0 HG21 VAL A 76 -6.321 -4.685 4.490 1.00 0.10 H new ATOM 0 HG22 VAL A 76 -4.739 -4.350 5.231 1.00 0.10 H new ATOM 0 HG23 VAL A 76 -6.126 -3.291 5.579 1.00 0.10 H new ATOM 1281 N TRP A 77 -2.618 -1.791 5.777 1.00 0.07 N ATOM 1282 CA TRP A 77 -1.476 -2.254 6.545 1.00 0.08 C ATOM 1283 C TRP A 77 -1.782 -3.575 7.239 1.00 0.09 C ATOM 1284 O TRP A 77 -2.792 -3.706 7.929 1.00 0.13 O ATOM 1285 CB TRP A 77 -1.076 -1.208 7.582 1.00 0.10 C ATOM 1286 CG TRP A 77 0.266 -1.464 8.185 1.00 0.09 C ATOM 1287 CD1 TRP A 77 0.527 -1.970 9.425 1.00 0.10 C ATOM 1288 CD2 TRP A 77 1.535 -1.233 7.569 1.00 0.09 C ATOM 1289 NE1 TRP A 77 1.882 -2.058 9.620 1.00 0.11 N ATOM 1290 CE2 TRP A 77 2.523 -1.612 8.495 1.00 0.10 C ATOM 1291 CE3 TRP A 77 1.930 -0.739 6.325 1.00 0.09 C ATOM 1292 CZ2 TRP A 77 3.882 -1.510 8.215 1.00 0.11 C ATOM 1293 CZ3 TRP A 77 3.279 -0.641 6.047 1.00 0.11 C ATOM 1294 CH2 TRP A 77 4.242 -1.024 6.989 1.00 0.12 C ATOM 0 H TRP A 77 -2.992 -0.891 6.077 1.00 0.07 H new ATOM 0 HA TRP A 77 -0.648 -2.410 5.853 1.00 0.08 H new ATOM 0 HB2 TRP A 77 -1.076 -0.223 7.115 1.00 0.10 H new ATOM 0 HB3 TRP A 77 -1.825 -1.185 8.374 1.00 0.10 H new ATOM 0 HD1 TRP A 77 -0.223 -2.259 10.147 1.00 0.10 H new ATOM 0 HE1 TRP A 77 2.338 -2.400 10.466 1.00 0.11 H new ATOM 0 HE3 TRP A 77 1.194 -0.439 5.593 1.00 0.09 H new ATOM 0 HZ2 TRP A 77 4.626 -1.804 8.940 1.00 0.11 H new ATOM 0 HZ3 TRP A 77 3.597 -0.263 5.087 1.00 0.11 H new ATOM 0 HH2 TRP A 77 5.289 -0.934 6.742 1.00 0.12 H new ATOM 1305 N ARG A 78 -0.902 -4.550 7.049 1.00 0.10 N ATOM 1306 CA ARG A 78 -1.073 -5.859 7.664 1.00 0.13 C ATOM 1307 C ARG A 78 0.107 -6.201 8.558 1.00 0.15 C ATOM 1308 O ARG A 78 1.241 -6.324 8.096 1.00 0.17 O ATOM 1309 CB ARG A 78 -1.247 -6.940 6.597 1.00 0.16 C ATOM 1310 CG ARG A 78 -2.660 -7.021 6.047 1.00 0.19 C ATOM 1311 CD ARG A 78 -3.073 -8.460 5.781 1.00 0.30 C ATOM 1312 NE ARG A 78 -2.958 -9.292 6.976 1.00 0.23 N ATOM 1313 CZ ARG A 78 -3.153 -10.606 6.977 1.00 0.33 C ATOM 1314 NH1 ARG A 78 -3.471 -11.234 5.853 1.00 0.79 N ATOM 1315 NH2 ARG A 78 -3.031 -11.295 8.103 1.00 0.38 N ATOM 0 H ARG A 78 -0.064 -4.459 6.475 1.00 0.10 H new ATOM 0 HA ARG A 78 -1.973 -5.821 8.278 1.00 0.13 H new ATOM 0 HB2 ARG A 78 -0.556 -6.745 5.777 1.00 0.16 H new ATOM 0 HB3 ARG A 78 -0.974 -7.906 7.021 1.00 0.16 H new ATOM 0 HG2 ARG A 78 -3.354 -6.567 6.755 1.00 0.19 H new ATOM 0 HG3 ARG A 78 -2.726 -6.446 5.123 1.00 0.19 H new ATOM 0 HD2 ARG A 78 -4.102 -8.481 5.422 1.00 0.30 H new ATOM 0 HD3 ARG A 78 -2.450 -8.875 4.989 1.00 0.30 H new ATOM 0 HE ARG A 78 -2.715 -8.840 7.857 1.00 0.23 H new ATOM 0 HH11 ARG A 78 -3.566 -10.708 4.984 1.00 0.79 H new ATOM 0 HH12 ARG A 78 -3.620 -12.243 5.857 1.00 0.79 H new ATOM 0 HH21 ARG A 78 -2.787 -10.816 8.970 1.00 0.38 H new ATOM 0 HH22 ARG A 78 -3.181 -12.304 8.102 1.00 0.38 H new ATOM 1329 N GLU A 79 -0.174 -6.354 9.845 1.00 0.17 N ATOM 1330 CA GLU A 79 0.853 -6.692 10.818 1.00 0.20 C ATOM 1331 C GLU A 79 1.602 -7.949 10.394 1.00 0.23 C ATOM 1332 O GLU A 79 2.735 -8.179 10.817 1.00 0.28 O ATOM 1333 CB GLU A 79 0.232 -6.897 12.197 1.00 0.21 C ATOM 1334 CG GLU A 79 -0.464 -5.664 12.739 1.00 0.28 C ATOM 1335 CD GLU A 79 -1.068 -5.891 14.111 1.00 0.86 C ATOM 1336 OE1 GLU A 79 -0.334 -5.759 15.113 1.00 1.13 O ATOM 1337 OE2 GLU A 79 -2.276 -6.203 14.183 1.00 1.75 O ATOM 0 H GLU A 79 -1.109 -6.249 10.239 1.00 0.17 H new ATOM 0 HA GLU A 79 1.560 -5.864 10.868 1.00 0.20 H new ATOM 0 HB2 GLU A 79 -0.486 -7.716 12.145 1.00 0.21 H new ATOM 0 HB3 GLU A 79 1.012 -7.201 12.896 1.00 0.21 H new ATOM 0 HG2 GLU A 79 0.250 -4.842 12.792 1.00 0.28 H new ATOM 0 HG3 GLU A 79 -1.249 -5.360 12.046 1.00 0.28 H new ATOM 1344 N ASP A 80 0.960 -8.761 9.559 1.00 0.24 N ATOM 1345 CA ASP A 80 1.572 -9.988 9.074 1.00 0.32 C ATOM 1346 C ASP A 80 2.540 -9.702 7.926 1.00 0.35 C ATOM 1347 O ASP A 80 3.201 -10.611 7.422 1.00 0.45 O ATOM 1348 CB ASP A 80 0.495 -10.978 8.622 1.00 0.34 C ATOM 1349 CG ASP A 80 1.076 -12.311 8.194 1.00 1.29 C ATOM 1350 OD1 ASP A 80 1.224 -13.199 9.060 1.00 1.86 O ATOM 1351 OD2 ASP A 80 1.380 -12.469 6.993 1.00 2.00 O ATOM 0 H ASP A 80 0.018 -8.590 9.206 1.00 0.24 H new ATOM 0 HA ASP A 80 2.137 -10.430 9.894 1.00 0.32 H new ATOM 0 HB2 ASP A 80 -0.212 -11.138 9.436 1.00 0.34 H new ATOM 0 HB3 ASP A 80 -0.066 -10.547 7.793 1.00 0.34 H new ATOM 1356 N GLY A 81 2.624 -8.435 7.512 1.00 0.32 N ATOM 1357 CA GLY A 81 3.519 -8.070 6.433 1.00 0.40 C ATOM 1358 C GLY A 81 2.912 -8.288 5.060 1.00 0.45 C ATOM 1359 O GLY A 81 3.522 -7.944 4.050 1.00 0.82 O ATOM 0 H GLY A 81 2.088 -7.662 7.906 1.00 0.32 H new ATOM 0 HA2 GLY A 81 3.798 -7.022 6.539 1.00 0.40 H new ATOM 0 HA3 GLY A 81 4.436 -8.654 6.516 1.00 0.40 H new ATOM 1363 N ARG A 82 1.706 -8.852 5.018 1.00 0.18 N ATOM 1364 CA ARG A 82 1.028 -9.113 3.757 1.00 0.18 C ATOM 1365 C ARG A 82 0.078 -7.975 3.412 1.00 0.14 C ATOM 1366 O ARG A 82 -1.140 -8.146 3.415 1.00 0.17 O ATOM 1367 CB ARG A 82 0.253 -10.424 3.850 1.00 0.22 C ATOM 1368 CG ARG A 82 1.093 -11.585 4.353 1.00 0.29 C ATOM 1369 CD ARG A 82 2.050 -12.086 3.285 1.00 0.60 C ATOM 1370 NE ARG A 82 2.840 -13.227 3.746 1.00 0.96 N ATOM 1371 CZ ARG A 82 3.640 -13.933 2.955 1.00 1.46 C ATOM 1372 NH1 ARG A 82 3.769 -13.608 1.675 1.00 1.68 N ATOM 1373 NH2 ARG A 82 4.315 -14.964 3.444 1.00 1.85 N ATOM 0 H ARG A 82 1.181 -9.136 5.845 1.00 0.18 H new ATOM 0 HA ARG A 82 1.777 -9.189 2.969 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -0.600 -10.287 4.515 1.00 0.22 H new ATOM 0 HB3 ARG A 82 -0.146 -10.673 2.867 1.00 0.22 H new ATOM 0 HG2 ARG A 82 1.658 -11.273 5.231 1.00 0.29 H new ATOM 0 HG3 ARG A 82 0.439 -12.399 4.667 1.00 0.29 H new ATOM 0 HD2 ARG A 82 1.485 -12.372 2.398 1.00 0.60 H new ATOM 0 HD3 ARG A 82 2.719 -11.278 2.990 1.00 0.60 H new ATOM 0 HE ARG A 82 2.773 -13.495 4.728 1.00 0.96 H new ATOM 0 HH11 ARG A 82 3.253 -12.814 1.296 1.00 1.68 H new ATOM 0 HH12 ARG A 82 4.384 -14.152 1.070 1.00 1.68 H new ATOM 0 HH21 ARG A 82 4.220 -15.215 4.428 1.00 1.85 H new ATOM 0 HH22 ARG A 82 4.929 -15.506 2.836 1.00 1.85 H new ATOM 1387 N HIS A 83 0.641 -6.814 3.107 1.00 0.11 N ATOM 1388 CA HIS A 83 -0.162 -5.649 2.772 1.00 0.09 C ATOM 1389 C HIS A 83 -0.610 -5.697 1.316 1.00 0.08 C ATOM 1390 O HIS A 83 -0.174 -6.549 0.544 1.00 0.10 O ATOM 1391 CB HIS A 83 0.624 -4.353 3.011 1.00 0.12 C ATOM 1392 CG HIS A 83 1.659 -4.447 4.092 1.00 0.12 C ATOM 1393 ND1 HIS A 83 1.314 -4.665 5.402 1.00 0.22 N ATOM 1394 CD2 HIS A 83 3.006 -4.333 4.001 1.00 0.13 C ATOM 1395 CE1 HIS A 83 2.449 -4.679 6.079 1.00 0.23 C ATOM 1396 NE2 HIS A 83 3.503 -4.482 5.271 1.00 0.15 N ATOM 0 H HIS A 83 1.648 -6.655 3.085 1.00 0.11 H new ATOM 0 HA HIS A 83 -1.039 -5.663 3.420 1.00 0.09 H new ATOM 0 HB2 HIS A 83 1.113 -4.062 2.081 1.00 0.12 H new ATOM 0 HB3 HIS A 83 -0.078 -3.558 3.265 1.00 0.12 H new ATOM 0 HD2 HIS A 83 3.578 -4.158 3.102 1.00 0.13 H new ATOM 0 HE1 HIS A 83 2.520 -4.830 7.146 1.00 0.23 H new ATOM 0 HE2 HIS A 83 4.484 -4.449 5.548 1.00 0.15 H new ATOM 1404 N PHE A 84 -1.492 -4.773 0.960 1.00 0.09 N ATOM 1405 CA PHE A 84 -1.996 -4.657 -0.399 1.00 0.08 C ATOM 1406 C PHE A 84 -2.734 -3.336 -0.558 1.00 0.08 C ATOM 1407 O PHE A 84 -3.276 -2.800 0.409 1.00 0.08 O ATOM 1408 CB PHE A 84 -2.888 -5.845 -0.779 1.00 0.09 C ATOM 1409 CG PHE A 84 -4.096 -6.030 0.093 1.00 0.09 C ATOM 1410 CD1 PHE A 84 -5.244 -5.286 -0.123 1.00 0.12 C ATOM 1411 CD2 PHE A 84 -4.075 -6.934 1.141 1.00 0.11 C ATOM 1412 CE1 PHE A 84 -6.352 -5.445 0.688 1.00 0.14 C ATOM 1413 CE2 PHE A 84 -5.176 -7.095 1.956 1.00 0.14 C ATOM 1414 CZ PHE A 84 -6.344 -6.396 1.684 1.00 0.15 C ATOM 0 H PHE A 84 -1.877 -4.084 1.606 1.00 0.09 H new ATOM 0 HA PHE A 84 -1.149 -4.673 -1.084 1.00 0.08 H new ATOM 0 HB2 PHE A 84 -3.218 -5.718 -1.810 1.00 0.09 H new ATOM 0 HB3 PHE A 84 -2.290 -6.756 -0.745 1.00 0.09 H new ATOM 0 HD1 PHE A 84 -5.274 -4.574 -0.934 1.00 0.12 H new ATOM 0 HD2 PHE A 84 -3.186 -7.520 1.323 1.00 0.11 H new ATOM 0 HE1 PHE A 84 -7.223 -4.824 0.541 1.00 0.14 H new ATOM 0 HE2 PHE A 84 -5.129 -7.763 2.803 1.00 0.14 H new ATOM 0 HZ PHE A 84 -7.241 -6.597 2.250 1.00 0.15 H new ATOM 1424 N ILE A 85 -2.754 -2.812 -1.774 1.00 0.09 N ATOM 1425 CA ILE A 85 -3.388 -1.528 -2.037 1.00 0.09 C ATOM 1426 C ILE A 85 -4.833 -1.678 -2.495 1.00 0.08 C ATOM 1427 O ILE A 85 -5.109 -2.257 -3.544 1.00 0.09 O ATOM 1428 CB ILE A 85 -2.599 -0.735 -3.101 1.00 0.11 C ATOM 1429 CG1 ILE A 85 -1.171 -0.477 -2.614 1.00 0.12 C ATOM 1430 CG2 ILE A 85 -3.295 0.578 -3.434 1.00 0.13 C ATOM 1431 CD1 ILE A 85 -0.350 0.367 -3.566 1.00 0.12 C ATOM 0 H ILE A 85 -2.339 -3.255 -2.594 1.00 0.09 H new ATOM 0 HA ILE A 85 -3.386 -0.983 -1.093 1.00 0.09 H new ATOM 0 HB ILE A 85 -2.558 -1.332 -4.012 1.00 0.11 H new ATOM 0 HG12 ILE A 85 -1.211 0.019 -1.644 1.00 0.12 H new ATOM 0 HG13 ILE A 85 -0.669 -1.433 -2.463 1.00 0.12 H new ATOM 0 HG21 ILE A 85 -2.717 1.116 -4.186 1.00 0.13 H new ATOM 0 HG22 ILE A 85 -4.293 0.373 -3.821 1.00 0.13 H new ATOM 0 HG23 ILE A 85 -3.374 1.187 -2.533 1.00 0.13 H new ATOM 0 HD11 ILE A 85 0.650 0.509 -3.156 1.00 0.12 H new ATOM 0 HD12 ILE A 85 -0.279 -0.137 -4.530 1.00 0.12 H new ATOM 0 HD13 ILE A 85 -0.829 1.337 -3.698 1.00 0.12 H new ATOM 1443 N LEU A 86 -5.750 -1.143 -1.694 1.00 0.08 N ATOM 1444 CA LEU A 86 -7.166 -1.181 -2.021 1.00 0.08 C ATOM 1445 C LEU A 86 -7.477 -0.084 -3.026 1.00 0.08 C ATOM 1446 O LEU A 86 -7.140 1.077 -2.807 1.00 0.10 O ATOM 1447 CB LEU A 86 -8.018 -0.999 -0.761 1.00 0.09 C ATOM 1448 CG LEU A 86 -9.528 -0.979 -1.002 1.00 0.10 C ATOM 1449 CD1 LEU A 86 -9.950 -2.191 -1.816 1.00 0.11 C ATOM 1450 CD2 LEU A 86 -10.281 -0.940 0.320 1.00 0.14 C ATOM 0 H LEU A 86 -5.534 -0.678 -0.812 1.00 0.08 H new ATOM 0 HA LEU A 86 -7.405 -2.152 -2.454 1.00 0.08 H new ATOM 0 HB2 LEU A 86 -7.787 -1.805 -0.064 1.00 0.09 H new ATOM 0 HB3 LEU A 86 -7.730 -0.066 -0.277 1.00 0.09 H new ATOM 0 HG LEU A 86 -9.775 -0.079 -1.565 1.00 0.10 H new ATOM 0 HD11 LEU A 86 -11.027 -2.163 -1.979 1.00 0.11 H new ATOM 0 HD12 LEU A 86 -9.437 -2.180 -2.778 1.00 0.11 H new ATOM 0 HD13 LEU A 86 -9.689 -3.101 -1.276 1.00 0.11 H new ATOM 0 HD21 LEU A 86 -11.354 -0.926 0.127 1.00 0.14 H new ATOM 0 HD22 LEU A 86 -10.029 -1.822 0.908 1.00 0.14 H new ATOM 0 HD23 LEU A 86 -10.000 -0.043 0.872 1.00 0.14 H new ATOM 1462 N THR A 87 -8.118 -0.449 -4.127 1.00 0.08 N ATOM 1463 CA THR A 87 -8.435 0.520 -5.167 1.00 0.09 C ATOM 1464 C THR A 87 -9.935 0.696 -5.354 1.00 0.09 C ATOM 1465 O THR A 87 -10.383 1.689 -5.928 1.00 0.11 O ATOM 1466 CB THR A 87 -7.805 0.109 -6.508 1.00 0.10 C ATOM 1467 OG1 THR A 87 -8.333 -1.151 -6.936 1.00 0.14 O ATOM 1468 CG2 THR A 87 -6.295 0.010 -6.379 1.00 0.13 C ATOM 0 H THR A 87 -8.427 -1.401 -4.323 1.00 0.08 H new ATOM 0 HA THR A 87 -8.017 1.472 -4.840 1.00 0.09 H new ATOM 0 HB THR A 87 -8.048 0.871 -7.248 1.00 0.10 H new ATOM 0 HG1 THR A 87 -8.500 -1.718 -6.154 1.00 0.14 H new ATOM 0 HG21 THR A 87 -5.866 -0.282 -7.338 1.00 0.13 H new ATOM 0 HG22 THR A 87 -5.891 0.977 -6.080 1.00 0.13 H new ATOM 0 HG23 THR A 87 -6.042 -0.737 -5.626 1.00 0.13 H new ATOM 1476 N LYS A 88 -10.711 -0.268 -4.878 1.00 0.09 N ATOM 1477 CA LYS A 88 -12.158 -0.201 -5.010 1.00 0.10 C ATOM 1478 C LYS A 88 -12.835 -1.326 -4.241 1.00 0.11 C ATOM 1479 O LYS A 88 -12.221 -2.352 -3.952 1.00 0.11 O ATOM 1480 CB LYS A 88 -12.550 -0.270 -6.484 1.00 0.12 C ATOM 1481 CG LYS A 88 -14.050 -0.272 -6.713 1.00 0.16 C ATOM 1482 CD LYS A 88 -14.392 -0.235 -8.193 1.00 0.21 C ATOM 1483 CE LYS A 88 -15.892 -0.347 -8.415 1.00 0.55 C ATOM 1484 NZ LYS A 88 -16.431 -1.642 -7.919 1.00 1.43 N ATOM 0 H LYS A 88 -10.365 -1.100 -4.400 1.00 0.09 H new ATOM 0 HA LYS A 88 -12.493 0.747 -4.589 1.00 0.10 H new ATOM 0 HB2 LYS A 88 -12.112 0.579 -7.008 1.00 0.12 H new ATOM 0 HB3 LYS A 88 -12.122 -1.171 -6.924 1.00 0.12 H new ATOM 0 HG2 LYS A 88 -14.486 -1.163 -6.261 1.00 0.16 H new ATOM 0 HG3 LYS A 88 -14.495 0.589 -6.215 1.00 0.16 H new ATOM 0 HD2 LYS A 88 -14.026 0.694 -8.630 1.00 0.21 H new ATOM 0 HD3 LYS A 88 -13.884 -1.051 -8.707 1.00 0.21 H new ATOM 0 HE2 LYS A 88 -16.397 0.475 -7.907 1.00 0.55 H new ATOM 0 HE3 LYS A 88 -16.110 -0.246 -9.478 1.00 0.55 H new ATOM 0 HZ1 LYS A 88 -17.363 -1.817 -8.347 1.00 1.43 H new ATOM 0 HZ2 LYS A 88 -15.781 -2.411 -8.179 1.00 1.43 H new ATOM 0 HZ3 LYS A 88 -16.527 -1.605 -6.884 1.00 1.43 H new ATOM 1498 N VAL A 89 -14.102 -1.120 -3.906 1.00 0.13 N ATOM 1499 CA VAL A 89 -14.869 -2.119 -3.179 1.00 0.15 C ATOM 1500 C VAL A 89 -16.271 -2.263 -3.767 1.00 0.17 C ATOM 1501 O VAL A 89 -17.070 -1.326 -3.731 1.00 0.20 O ATOM 1502 CB VAL A 89 -14.957 -1.779 -1.675 1.00 0.18 C ATOM 1503 CG1 VAL A 89 -13.578 -1.451 -1.128 1.00 0.18 C ATOM 1504 CG2 VAL A 89 -15.917 -0.626 -1.418 1.00 0.21 C ATOM 0 H VAL A 89 -14.619 -0.269 -4.127 1.00 0.13 H new ATOM 0 HA VAL A 89 -14.346 -3.069 -3.283 1.00 0.15 H new ATOM 0 HB VAL A 89 -15.346 -2.656 -1.157 1.00 0.18 H new ATOM 0 HG11 VAL A 89 -13.655 -1.213 -0.067 1.00 0.18 H new ATOM 0 HG12 VAL A 89 -12.920 -2.310 -1.261 1.00 0.18 H new ATOM 0 HG13 VAL A 89 -13.169 -0.594 -1.663 1.00 0.18 H new ATOM 0 HG21 VAL A 89 -15.954 -0.414 -0.349 1.00 0.21 H new ATOM 0 HG22 VAL A 89 -15.573 0.260 -1.952 1.00 0.21 H new ATOM 0 HG23 VAL A 89 -16.913 -0.897 -1.769 1.00 0.21 H new ATOM 1514 N SER A 90 -16.558 -3.437 -4.315 1.00 0.20 N ATOM 1515 CA SER A 90 -17.862 -3.698 -4.911 1.00 0.24 C ATOM 1516 C SER A 90 -18.859 -4.144 -3.851 1.00 0.23 C ATOM 1517 O SER A 90 -19.204 -5.321 -3.771 1.00 0.22 O ATOM 1518 CB SER A 90 -17.750 -4.771 -5.995 1.00 0.27 C ATOM 1519 OG SER A 90 -18.984 -4.946 -6.668 1.00 1.15 O ATOM 0 H SER A 90 -15.908 -4.221 -4.359 1.00 0.20 H new ATOM 0 HA SER A 90 -18.218 -2.771 -5.362 1.00 0.24 H new ATOM 0 HB2 SER A 90 -16.978 -4.490 -6.711 1.00 0.27 H new ATOM 0 HB3 SER A 90 -17.440 -5.715 -5.546 1.00 0.27 H new ATOM 0 HG SER A 90 -18.910 -4.601 -7.582 1.00 1.15 H new ATOM 1525 N LYS A 91 -19.324 -3.199 -3.044 1.00 0.28 N ATOM 1526 CA LYS A 91 -20.280 -3.506 -1.989 1.00 0.31 C ATOM 1527 C LYS A 91 -21.474 -4.269 -2.552 1.00 0.33 C ATOM 1528 O LYS A 91 -22.155 -4.998 -1.830 1.00 0.35 O ATOM 1529 CB LYS A 91 -20.755 -2.224 -1.309 1.00 0.41 C ATOM 1530 CG LYS A 91 -21.534 -2.471 -0.030 1.00 0.80 C ATOM 1531 CD LYS A 91 -21.868 -1.169 0.679 1.00 1.43 C ATOM 1532 CE LYS A 91 -22.558 -1.419 2.011 1.00 1.61 C ATOM 1533 NZ LYS A 91 -23.855 -2.131 1.842 1.00 1.86 N ATOM 0 H LYS A 91 -19.055 -2.217 -3.100 1.00 0.28 H new ATOM 0 HA LYS A 91 -19.781 -4.133 -1.250 1.00 0.31 H new ATOM 0 HB2 LYS A 91 -19.890 -1.600 -1.084 1.00 0.41 H new ATOM 0 HB3 LYS A 91 -21.381 -1.664 -2.004 1.00 0.41 H new ATOM 0 HG2 LYS A 91 -22.454 -3.007 -0.261 1.00 0.80 H new ATOM 0 HG3 LYS A 91 -20.952 -3.109 0.634 1.00 0.80 H new ATOM 0 HD2 LYS A 91 -20.954 -0.598 0.843 1.00 1.43 H new ATOM 0 HD3 LYS A 91 -22.512 -0.562 0.043 1.00 1.43 H new ATOM 0 HE2 LYS A 91 -21.903 -2.007 2.654 1.00 1.61 H new ATOM 0 HE3 LYS A 91 -22.729 -0.468 2.515 1.00 1.61 H new ATOM 0 HZ1 LYS A 91 -24.363 -2.147 2.749 1.00 1.86 H new ATOM 0 HZ2 LYS A 91 -24.432 -1.638 1.131 1.00 1.86 H new ATOM 0 HZ3 LYS A 91 -23.677 -3.106 1.528 1.00 1.86 H new ATOM 1547 N GLU A 92 -21.723 -4.093 -3.844 1.00 0.36 N ATOM 1548 CA GLU A 92 -22.825 -4.773 -4.507 1.00 0.41 C ATOM 1549 C GLU A 92 -22.600 -6.277 -4.484 1.00 0.35 C ATOM 1550 O GLU A 92 -23.544 -7.063 -4.402 1.00 0.39 O ATOM 1551 CB GLU A 92 -22.952 -4.288 -5.949 1.00 0.49 C ATOM 1552 CG GLU A 92 -23.135 -2.784 -6.074 1.00 0.57 C ATOM 1553 CD GLU A 92 -23.149 -2.318 -7.516 1.00 1.27 C ATOM 1554 OE1 GLU A 92 -22.061 -2.031 -8.060 1.00 2.09 O ATOM 1555 OE2 GLU A 92 -24.249 -2.238 -8.103 1.00 1.29 O ATOM 0 H GLU A 92 -21.175 -3.484 -4.452 1.00 0.36 H new ATOM 0 HA GLU A 92 -23.748 -4.544 -3.975 1.00 0.41 H new ATOM 0 HB2 GLU A 92 -22.061 -4.584 -6.502 1.00 0.49 H new ATOM 0 HB3 GLU A 92 -23.799 -4.788 -6.418 1.00 0.49 H new ATOM 0 HG2 GLU A 92 -24.069 -2.494 -5.593 1.00 0.57 H new ATOM 0 HG3 GLU A 92 -22.331 -2.278 -5.540 1.00 0.57 H new ATOM 1562 N ALA A 93 -21.333 -6.663 -4.560 1.00 0.30 N ATOM 1563 CA ALA A 93 -20.951 -8.067 -4.547 1.00 0.30 C ATOM 1564 C ALA A 93 -20.100 -8.406 -3.322 1.00 0.26 C ATOM 1565 O ALA A 93 -19.716 -9.558 -3.126 1.00 0.34 O ATOM 1566 CB ALA A 93 -20.198 -8.408 -5.822 1.00 0.36 C ATOM 0 H ALA A 93 -20.547 -6.016 -4.632 1.00 0.30 H new ATOM 0 HA ALA A 93 -21.861 -8.665 -4.493 1.00 0.30 H new ATOM 0 HB1 ALA A 93 -19.914 -9.460 -5.807 1.00 0.36 H new ATOM 0 HB2 ALA A 93 -20.837 -8.217 -6.684 1.00 0.36 H new ATOM 0 HB3 ALA A 93 -19.302 -7.792 -5.891 1.00 0.36 H new ATOM 1572 N ASN A 94 -19.806 -7.399 -2.501 1.00 0.18 N ATOM 1573 CA ASN A 94 -19.002 -7.595 -1.306 1.00 0.18 C ATOM 1574 C ASN A 94 -17.551 -7.890 -1.671 1.00 0.19 C ATOM 1575 O ASN A 94 -16.800 -8.431 -0.864 1.00 0.33 O ATOM 1576 CB ASN A 94 -19.574 -8.738 -0.468 1.00 0.24 C ATOM 1577 CG ASN A 94 -21.070 -8.613 -0.269 1.00 0.21 C ATOM 1578 OD1 ASN A 94 -21.860 -9.120 -1.066 1.00 0.53 O ATOM 1579 ND2 ASN A 94 -21.468 -7.933 0.799 1.00 0.44 N ATOM 0 H ASN A 94 -20.116 -6.438 -2.646 1.00 0.18 H new ATOM 0 HA ASN A 94 -19.029 -6.676 -0.721 1.00 0.18 H new ATOM 0 HB2 ASN A 94 -19.353 -9.688 -0.954 1.00 0.24 H new ATOM 0 HB3 ASN A 94 -19.081 -8.755 0.504 1.00 0.24 H new ATOM 0 HD21 ASN A 94 -22.464 -7.814 0.986 1.00 0.44 H new ATOM 0 HD22 ASN A 94 -20.778 -7.530 1.433 1.00 0.44 H new ATOM 1586 N ARG A 95 -17.158 -7.522 -2.888 1.00 0.15 N ATOM 1587 CA ARG A 95 -15.797 -7.757 -3.350 1.00 0.15 C ATOM 1588 C ARG A 95 -14.921 -6.533 -3.112 1.00 0.13 C ATOM 1589 O ARG A 95 -15.417 -5.452 -2.798 1.00 0.15 O ATOM 1590 CB ARG A 95 -15.797 -8.117 -4.832 1.00 0.18 C ATOM 1591 CG ARG A 95 -16.773 -9.224 -5.182 1.00 0.26 C ATOM 1592 CD ARG A 95 -16.891 -9.402 -6.684 1.00 0.30 C ATOM 1593 NE ARG A 95 -17.293 -8.167 -7.352 1.00 1.01 N ATOM 1594 CZ ARG A 95 -17.465 -8.063 -8.666 1.00 1.19 C ATOM 1595 NH1 ARG A 95 -17.273 -9.116 -9.447 1.00 0.65 N ATOM 1596 NH2 ARG A 95 -17.832 -6.904 -9.199 1.00 1.98 N ATOM 0 H ARG A 95 -17.762 -7.061 -3.569 1.00 0.15 H new ATOM 0 HA ARG A 95 -15.386 -8.590 -2.780 1.00 0.15 H new ATOM 0 HB2 ARG A 95 -16.042 -7.229 -5.414 1.00 0.18 H new ATOM 0 HB3 ARG A 95 -14.792 -8.422 -5.124 1.00 0.18 H new ATOM 0 HG2 ARG A 95 -16.444 -10.159 -4.728 1.00 0.26 H new ATOM 0 HG3 ARG A 95 -17.753 -8.994 -4.763 1.00 0.26 H new ATOM 0 HD2 ARG A 95 -15.934 -9.736 -7.086 1.00 0.30 H new ATOM 0 HD3 ARG A 95 -17.619 -10.184 -6.900 1.00 0.30 H new ATOM 0 HE ARG A 95 -17.451 -7.338 -6.778 1.00 1.01 H new ATOM 0 HH11 ARG A 95 -16.993 -10.008 -9.040 1.00 0.65 H new ATOM 0 HH12 ARG A 95 -17.405 -9.034 -10.455 1.00 0.65 H new ATOM 0 HH21 ARG A 95 -17.982 -6.092 -8.600 1.00 1.98 H new ATOM 0 HH22 ARG A 95 -17.964 -6.825 -10.207 1.00 1.98 H new ATOM 1610 N TYR A 96 -13.616 -6.713 -3.266 1.00 0.11 N ATOM 1611 CA TYR A 96 -12.668 -5.631 -3.061 1.00 0.10 C ATOM 1612 C TYR A 96 -11.536 -5.685 -4.077 1.00 0.08 C ATOM 1613 O TYR A 96 -10.862 -6.704 -4.220 1.00 0.09 O ATOM 1614 CB TYR A 96 -12.105 -5.706 -1.646 1.00 0.11 C ATOM 1615 CG TYR A 96 -13.166 -5.554 -0.586 1.00 0.11 C ATOM 1616 CD1 TYR A 96 -14.043 -6.592 -0.300 1.00 0.10 C ATOM 1617 CD2 TYR A 96 -13.303 -4.366 0.116 1.00 0.14 C ATOM 1618 CE1 TYR A 96 -15.027 -6.448 0.658 1.00 0.12 C ATOM 1619 CE2 TYR A 96 -14.285 -4.213 1.073 1.00 0.16 C ATOM 1620 CZ TYR A 96 -15.146 -5.257 1.342 1.00 0.13 C ATOM 1621 OH TYR A 96 -16.129 -5.111 2.293 1.00 0.17 O ATOM 0 H TYR A 96 -13.191 -7.601 -3.533 1.00 0.11 H new ATOM 0 HA TYR A 96 -13.193 -4.686 -3.197 1.00 0.10 H new ATOM 0 HB2 TYR A 96 -11.598 -6.662 -1.512 1.00 0.11 H new ATOM 0 HB3 TYR A 96 -11.354 -4.926 -1.517 1.00 0.11 H new ATOM 0 HD1 TYR A 96 -13.954 -7.526 -0.835 1.00 0.10 H new ATOM 0 HD2 TYR A 96 -12.630 -3.547 -0.090 1.00 0.14 H new ATOM 0 HE1 TYR A 96 -15.701 -7.265 0.871 1.00 0.12 H new ATOM 0 HE2 TYR A 96 -14.379 -3.280 1.609 1.00 0.16 H new ATOM 0 HH TYR A 96 -16.232 -5.950 2.789 1.00 0.17 H new ATOM 1631 N LEU A 97 -11.331 -4.577 -4.780 1.00 0.08 N ATOM 1632 CA LEU A 97 -10.274 -4.495 -5.776 1.00 0.07 C ATOM 1633 C LEU A 97 -8.978 -4.027 -5.134 1.00 0.07 C ATOM 1634 O LEU A 97 -8.856 -2.872 -4.731 1.00 0.08 O ATOM 1635 CB LEU A 97 -10.664 -3.536 -6.897 1.00 0.09 C ATOM 1636 CG LEU A 97 -9.646 -3.427 -8.033 1.00 0.10 C ATOM 1637 CD1 LEU A 97 -9.504 -4.756 -8.758 1.00 0.15 C ATOM 1638 CD2 LEU A 97 -10.047 -2.324 -8.999 1.00 0.13 C ATOM 0 H LEU A 97 -11.883 -3.725 -4.678 1.00 0.08 H new ATOM 0 HA LEU A 97 -10.127 -5.490 -6.197 1.00 0.07 H new ATOM 0 HB2 LEU A 97 -11.619 -3.856 -7.314 1.00 0.09 H new ATOM 0 HB3 LEU A 97 -10.818 -2.545 -6.470 1.00 0.09 H new ATOM 0 HG LEU A 97 -8.677 -3.172 -7.605 1.00 0.10 H new ATOM 0 HD11 LEU A 97 -8.775 -4.656 -9.562 1.00 0.15 H new ATOM 0 HD12 LEU A 97 -9.167 -5.519 -8.056 1.00 0.15 H new ATOM 0 HD13 LEU A 97 -10.468 -5.047 -9.176 1.00 0.15 H new ATOM 0 HD21 LEU A 97 -9.313 -2.259 -9.802 1.00 0.13 H new ATOM 0 HD22 LEU A 97 -11.027 -2.548 -9.421 1.00 0.13 H new ATOM 0 HD23 LEU A 97 -10.089 -1.373 -8.468 1.00 0.13 H new ATOM 1650 N ILE A 98 -8.008 -4.923 -5.052 1.00 0.08 N ATOM 1651 CA ILE A 98 -6.727 -4.599 -4.453 1.00 0.09 C ATOM 1652 C ILE A 98 -5.590 -4.848 -5.424 1.00 0.09 C ATOM 1653 O ILE A 98 -5.734 -5.605 -6.380 1.00 0.10 O ATOM 1654 CB ILE A 98 -6.487 -5.434 -3.186 1.00 0.09 C ATOM 1655 CG1 ILE A 98 -6.438 -6.922 -3.532 1.00 0.09 C ATOM 1656 CG2 ILE A 98 -7.570 -5.162 -2.156 1.00 0.09 C ATOM 1657 CD1 ILE A 98 -5.083 -7.392 -4.010 1.00 0.11 C ATOM 0 H ILE A 98 -8.085 -5.881 -5.394 1.00 0.08 H new ATOM 0 HA ILE A 98 -6.754 -3.541 -4.193 1.00 0.09 H new ATOM 0 HB ILE A 98 -5.527 -5.146 -2.758 1.00 0.09 H new ATOM 0 HG12 ILE A 98 -6.723 -7.500 -2.653 1.00 0.09 H new ATOM 0 HG13 ILE A 98 -7.178 -7.131 -4.305 1.00 0.09 H new ATOM 0 HG21 ILE A 98 -7.384 -5.762 -1.265 1.00 0.09 H new ATOM 0 HG22 ILE A 98 -7.562 -4.105 -1.890 1.00 0.09 H new ATOM 0 HG23 ILE A 98 -8.543 -5.424 -2.573 1.00 0.09 H new ATOM 0 HD11 ILE A 98 -5.126 -8.457 -4.236 1.00 0.11 H new ATOM 0 HD12 ILE A 98 -4.803 -6.842 -4.908 1.00 0.11 H new ATOM 0 HD13 ILE A 98 -4.341 -7.216 -3.231 1.00 0.11 H new ATOM 1669 N PHE A 99 -4.459 -4.205 -5.181 1.00 0.10 N ATOM 1670 CA PHE A 99 -3.301 -4.385 -6.037 1.00 0.11 C ATOM 1671 C PHE A 99 -2.345 -5.395 -5.417 1.00 0.12 C ATOM 1672 O PHE A 99 -1.785 -5.157 -4.351 1.00 0.14 O ATOM 1673 CB PHE A 99 -2.587 -3.055 -6.276 1.00 0.12 C ATOM 1674 CG PHE A 99 -1.528 -3.144 -7.333 1.00 0.12 C ATOM 1675 CD1 PHE A 99 -1.862 -3.074 -8.677 1.00 0.16 C ATOM 1676 CD2 PHE A 99 -0.200 -3.308 -6.983 1.00 0.12 C ATOM 1677 CE1 PHE A 99 -0.887 -3.163 -9.651 1.00 0.18 C ATOM 1678 CE2 PHE A 99 0.778 -3.400 -7.951 1.00 0.13 C ATOM 1679 CZ PHE A 99 0.435 -3.328 -9.288 1.00 0.15 C ATOM 0 H PHE A 99 -4.320 -3.559 -4.404 1.00 0.10 H new ATOM 0 HA PHE A 99 -3.642 -4.764 -7.000 1.00 0.11 H new ATOM 0 HB2 PHE A 99 -3.320 -2.302 -6.565 1.00 0.12 H new ATOM 0 HB3 PHE A 99 -2.135 -2.718 -5.343 1.00 0.12 H new ATOM 0 HD1 PHE A 99 -2.895 -2.949 -8.965 1.00 0.16 H new ATOM 0 HD2 PHE A 99 0.074 -3.365 -5.940 1.00 0.12 H new ATOM 0 HE1 PHE A 99 -1.158 -3.104 -10.695 1.00 0.18 H new ATOM 0 HE2 PHE A 99 1.811 -3.528 -7.664 1.00 0.13 H new ATOM 0 HZ PHE A 99 1.200 -3.401 -10.047 1.00 0.15 H new ATOM 1689 N ASP A 100 -2.177 -6.531 -6.084 1.00 0.17 N ATOM 1690 CA ASP A 100 -1.298 -7.586 -5.591 1.00 0.20 C ATOM 1691 C ASP A 100 0.158 -7.130 -5.560 1.00 0.15 C ATOM 1692 O ASP A 100 0.788 -6.951 -6.603 1.00 0.14 O ATOM 1693 CB ASP A 100 -1.437 -8.837 -6.458 1.00 0.28 C ATOM 1694 CG ASP A 100 -0.777 -10.050 -5.832 1.00 0.32 C ATOM 1695 OD1 ASP A 100 0.388 -9.936 -5.401 1.00 0.17 O ATOM 1696 OD2 ASP A 100 -1.427 -11.115 -5.774 1.00 0.58 O ATOM 0 H ASP A 100 -2.638 -6.746 -6.968 1.00 0.17 H new ATOM 0 HA ASP A 100 -1.599 -7.821 -4.570 1.00 0.20 H new ATOM 0 HB2 ASP A 100 -2.494 -9.046 -6.622 1.00 0.28 H new ATOM 0 HB3 ASP A 100 -0.993 -8.649 -7.436 1.00 0.28 H new ATOM 1701 N LEU A 101 0.685 -6.943 -4.354 1.00 0.14 N ATOM 1702 CA LEU A 101 2.068 -6.513 -4.171 1.00 0.12 C ATOM 1703 C LEU A 101 3.053 -7.647 -4.454 1.00 0.13 C ATOM 1704 O LEU A 101 4.254 -7.412 -4.597 1.00 0.16 O ATOM 1705 CB LEU A 101 2.267 -5.994 -2.744 1.00 0.14 C ATOM 1706 CG LEU A 101 1.776 -4.566 -2.490 1.00 0.11 C ATOM 1707 CD1 LEU A 101 0.465 -4.306 -3.210 1.00 0.10 C ATOM 1708 CD2 LEU A 101 1.612 -4.321 -1.000 1.00 0.11 C ATOM 0 H LEU A 101 0.172 -7.083 -3.484 1.00 0.14 H new ATOM 0 HA LEU A 101 2.266 -5.713 -4.884 1.00 0.12 H new ATOM 0 HB2 LEU A 101 1.752 -6.665 -2.056 1.00 0.14 H new ATOM 0 HB3 LEU A 101 3.329 -6.043 -2.502 1.00 0.14 H new ATOM 0 HG LEU A 101 2.524 -3.877 -2.882 1.00 0.11 H new ATOM 0 HD11 LEU A 101 0.138 -3.285 -3.013 1.00 0.10 H new ATOM 0 HD12 LEU A 101 0.606 -4.442 -4.282 1.00 0.10 H new ATOM 0 HD13 LEU A 101 -0.291 -5.004 -2.852 1.00 0.10 H new ATOM 0 HD21 LEU A 101 1.262 -3.302 -0.835 1.00 0.11 H new ATOM 0 HD22 LEU A 101 0.885 -5.024 -0.594 1.00 0.11 H new ATOM 0 HD23 LEU A 101 2.571 -4.461 -0.501 1.00 0.11 H new ATOM 1720 N GLU A 102 2.545 -8.874 -4.531 1.00 0.14 N ATOM 1721 CA GLU A 102 3.386 -10.035 -4.789 1.00 0.16 C ATOM 1722 C GLU A 102 3.522 -10.277 -6.286 1.00 0.16 C ATOM 1723 O GLU A 102 4.611 -10.553 -6.789 1.00 0.20 O ATOM 1724 CB GLU A 102 2.788 -11.275 -4.124 1.00 0.17 C ATOM 1725 CG GLU A 102 2.301 -11.024 -2.709 1.00 0.21 C ATOM 1726 CD GLU A 102 1.737 -12.270 -2.053 1.00 0.23 C ATOM 1727 OE1 GLU A 102 2.524 -13.032 -1.451 1.00 0.32 O ATOM 1728 OE2 GLU A 102 0.509 -12.482 -2.137 1.00 0.29 O ATOM 0 H GLU A 102 1.554 -9.088 -4.418 1.00 0.14 H new ATOM 0 HA GLU A 102 4.374 -9.841 -4.372 1.00 0.16 H new ATOM 0 HB2 GLU A 102 1.956 -11.636 -4.728 1.00 0.17 H new ATOM 0 HB3 GLU A 102 3.537 -12.066 -4.107 1.00 0.17 H new ATOM 0 HG2 GLU A 102 3.127 -10.644 -2.107 1.00 0.21 H new ATOM 0 HG3 GLU A 102 1.535 -10.249 -2.725 1.00 0.21 H new ATOM 1735 N GLN A 103 2.402 -10.166 -6.987 1.00 0.15 N ATOM 1736 CA GLN A 103 2.370 -10.376 -8.426 1.00 0.16 C ATOM 1737 C GLN A 103 2.435 -9.053 -9.183 1.00 0.15 C ATOM 1738 O GLN A 103 2.732 -9.027 -10.377 1.00 0.17 O ATOM 1739 CB GLN A 103 1.103 -11.131 -8.811 1.00 0.17 C ATOM 1740 CG GLN A 103 0.788 -12.272 -7.866 1.00 0.23 C ATOM 1741 CD GLN A 103 -0.478 -13.013 -8.236 1.00 0.56 C ATOM 1742 OE1 GLN A 103 -0.838 -13.109 -9.410 1.00 1.11 O ATOM 1743 NE2 GLN A 103 -1.164 -13.538 -7.229 1.00 0.45 N ATOM 0 H GLN A 103 1.498 -9.930 -6.578 1.00 0.15 H new ATOM 0 HA GLN A 103 3.245 -10.965 -8.701 1.00 0.16 H new ATOM 0 HB2 GLN A 103 0.263 -10.437 -8.827 1.00 0.17 H new ATOM 0 HB3 GLN A 103 1.212 -11.523 -9.822 1.00 0.17 H new ATOM 0 HG2 GLN A 103 1.623 -12.972 -7.859 1.00 0.23 H new ATOM 0 HG3 GLN A 103 0.691 -11.881 -6.853 1.00 0.23 H new ATOM 0 HE21 GLN A 103 -0.826 -13.433 -6.272 1.00 0.45 H new ATOM 0 HE22 GLN A 103 -2.029 -14.047 -7.412 1.00 0.45 H new ATOM 1752 N ARG A 104 2.152 -7.956 -8.481 1.00 0.15 N ATOM 1753 CA ARG A 104 2.173 -6.631 -9.088 1.00 0.15 C ATOM 1754 C ARG A 104 0.991 -6.457 -10.026 1.00 0.16 C ATOM 1755 O ARG A 104 1.091 -5.784 -11.051 1.00 0.20 O ATOM 1756 CB ARG A 104 3.479 -6.416 -9.854 1.00 0.16 C ATOM 1757 CG ARG A 104 4.712 -6.795 -9.055 1.00 0.17 C ATOM 1758 CD ARG A 104 5.983 -6.329 -9.740 1.00 0.21 C ATOM 1759 NE ARG A 104 7.181 -6.820 -9.063 1.00 0.79 N ATOM 1760 CZ ARG A 104 8.418 -6.516 -9.443 1.00 0.98 C ATOM 1761 NH1 ARG A 104 8.618 -5.725 -10.488 1.00 0.64 N ATOM 1762 NH2 ARG A 104 9.454 -7.004 -8.777 1.00 1.67 N ATOM 0 H ARG A 104 1.906 -7.962 -7.491 1.00 0.15 H new ATOM 0 HA ARG A 104 2.103 -5.890 -8.292 1.00 0.15 H new ATOM 0 HB2 ARG A 104 3.455 -7.003 -10.772 1.00 0.16 H new ATOM 0 HB3 ARG A 104 3.552 -5.369 -10.147 1.00 0.16 H new ATOM 0 HG2 ARG A 104 4.651 -6.355 -8.060 1.00 0.17 H new ATOM 0 HG3 ARG A 104 4.744 -7.877 -8.924 1.00 0.17 H new ATOM 0 HD2 ARG A 104 5.984 -6.673 -10.774 1.00 0.21 H new ATOM 0 HD3 ARG A 104 6.002 -5.239 -9.766 1.00 0.21 H new ATOM 0 HE ARG A 104 7.062 -7.430 -8.254 1.00 0.79 H new ATOM 0 HH11 ARG A 104 7.822 -5.348 -11.002 1.00 0.64 H new ATOM 0 HH12 ARG A 104 9.568 -5.493 -10.778 1.00 0.64 H new ATOM 0 HH21 ARG A 104 9.302 -7.613 -7.973 1.00 1.67 H new ATOM 0 HH22 ARG A 104 10.403 -6.771 -9.068 1.00 1.67 H new ATOM 1776 N ASN A 105 -0.132 -7.064 -9.664 1.00 0.14 N ATOM 1777 CA ASN A 105 -1.331 -6.986 -10.483 1.00 0.16 C ATOM 1778 C ASN A 105 -2.576 -6.772 -9.629 1.00 0.13 C ATOM 1779 O ASN A 105 -2.635 -7.216 -8.484 1.00 0.15 O ATOM 1780 CB ASN A 105 -1.488 -8.267 -11.299 1.00 0.22 C ATOM 1781 CG ASN A 105 -1.582 -9.499 -10.418 1.00 0.42 C ATOM 1782 OD1 ASN A 105 -2.062 -9.432 -9.288 1.00 1.23 O ATOM 1783 ND2 ASN A 105 -1.125 -10.634 -10.933 1.00 0.45 N ATOM 0 H ASN A 105 -0.236 -7.614 -8.811 1.00 0.14 H new ATOM 0 HA ASN A 105 -1.223 -6.132 -11.152 1.00 0.16 H new ATOM 0 HB2 ASN A 105 -2.383 -8.195 -11.917 1.00 0.22 H new ATOM 0 HB3 ASN A 105 -0.640 -8.371 -11.977 1.00 0.22 H new ATOM 0 HD21 ASN A 105 -1.165 -11.494 -10.387 1.00 0.45 H new ATOM 0 HD22 ASN A 105 -0.734 -10.646 -11.875 1.00 0.45 H new ATOM 1790 N PRO A 106 -3.590 -6.082 -10.179 1.00 0.14 N ATOM 1791 CA PRO A 106 -4.842 -5.830 -9.469 1.00 0.13 C ATOM 1792 C PRO A 106 -5.636 -7.111 -9.274 1.00 0.15 C ATOM 1793 O PRO A 106 -5.524 -8.048 -10.064 1.00 0.21 O ATOM 1794 CB PRO A 106 -5.605 -4.862 -10.382 1.00 0.15 C ATOM 1795 CG PRO A 106 -4.605 -4.386 -11.379 1.00 0.20 C ATOM 1796 CD PRO A 106 -3.602 -5.490 -11.522 1.00 0.22 C ATOM 0 HA PRO A 106 -4.671 -5.427 -8.471 1.00 0.13 H new ATOM 0 HB2 PRO A 106 -6.441 -5.361 -10.872 1.00 0.15 H new ATOM 0 HB3 PRO A 106 -6.019 -4.030 -9.813 1.00 0.15 H new ATOM 0 HG2 PRO A 106 -5.082 -4.166 -12.334 1.00 0.20 H new ATOM 0 HG3 PRO A 106 -4.127 -3.466 -11.042 1.00 0.20 H new ATOM 0 HD2 PRO A 106 -3.899 -6.213 -12.282 1.00 0.22 H new ATOM 0 HD3 PRO A 106 -2.620 -5.112 -11.808 1.00 0.22 H new ATOM 1804 N ARG A 107 -6.439 -7.146 -8.223 1.00 0.11 N ATOM 1805 CA ARG A 107 -7.240 -8.321 -7.921 1.00 0.13 C ATOM 1806 C ARG A 107 -8.515 -7.948 -7.184 1.00 0.11 C ATOM 1807 O ARG A 107 -8.559 -6.961 -6.455 1.00 0.11 O ATOM 1808 CB ARG A 107 -6.428 -9.304 -7.082 1.00 0.16 C ATOM 1809 CG ARG A 107 -5.426 -10.106 -7.892 1.00 0.18 C ATOM 1810 CD ARG A 107 -4.648 -11.075 -7.015 1.00 0.27 C ATOM 1811 NE ARG A 107 -5.527 -11.868 -6.159 1.00 0.35 N ATOM 1812 CZ ARG A 107 -6.172 -12.955 -6.570 1.00 0.98 C ATOM 1813 NH1 ARG A 107 -6.047 -13.371 -7.822 1.00 1.70 N ATOM 1814 NH2 ARG A 107 -6.946 -13.624 -5.726 1.00 1.02 N ATOM 0 H ARG A 107 -6.553 -6.375 -7.565 1.00 0.11 H new ATOM 0 HA ARG A 107 -7.518 -8.789 -8.865 1.00 0.13 H new ATOM 0 HB2 ARG A 107 -5.898 -8.754 -6.304 1.00 0.16 H new ATOM 0 HB3 ARG A 107 -7.110 -9.990 -6.579 1.00 0.16 H new ATOM 0 HG2 ARG A 107 -5.948 -10.659 -8.673 1.00 0.18 H new ATOM 0 HG3 ARG A 107 -4.733 -9.428 -8.390 1.00 0.18 H new ATOM 0 HD2 ARG A 107 -4.059 -11.741 -7.645 1.00 0.27 H new ATOM 0 HD3 ARG A 107 -3.945 -10.518 -6.395 1.00 0.27 H new ATOM 0 HE ARG A 107 -5.653 -11.571 -5.191 1.00 0.35 H new ATOM 0 HH11 ARG A 107 -5.454 -12.857 -8.474 1.00 1.70 H new ATOM 0 HH12 ARG A 107 -6.543 -14.206 -8.134 1.00 1.70 H new ATOM 0 HH21 ARG A 107 -7.046 -13.304 -4.763 1.00 1.02 H new ATOM 0 HH22 ARG A 107 -7.441 -14.458 -6.040 1.00 1.02 H new ATOM 1828 N VAL A 108 -9.548 -8.751 -7.381 1.00 0.13 N ATOM 1829 CA VAL A 108 -10.831 -8.523 -6.735 1.00 0.12 C ATOM 1830 C VAL A 108 -11.110 -9.613 -5.708 1.00 0.12 C ATOM 1831 O VAL A 108 -11.461 -10.738 -6.062 1.00 0.15 O ATOM 1832 CB VAL A 108 -11.981 -8.485 -7.760 1.00 0.14 C ATOM 1833 CG1 VAL A 108 -13.319 -8.288 -7.061 1.00 0.66 C ATOM 1834 CG2 VAL A 108 -11.743 -7.390 -8.788 1.00 0.61 C ATOM 0 H VAL A 108 -9.523 -9.571 -7.987 1.00 0.13 H new ATOM 0 HA VAL A 108 -10.777 -7.555 -6.238 1.00 0.12 H new ATOM 0 HB VAL A 108 -12.009 -9.442 -8.280 1.00 0.14 H new ATOM 0 HG11 VAL A 108 -14.117 -8.264 -7.803 1.00 0.66 H new ATOM 0 HG12 VAL A 108 -13.492 -9.111 -6.368 1.00 0.66 H new ATOM 0 HG13 VAL A 108 -13.307 -7.347 -6.511 1.00 0.66 H new ATOM 0 HG21 VAL A 108 -12.565 -7.378 -9.504 1.00 0.61 H new ATOM 0 HG22 VAL A 108 -11.686 -6.425 -8.285 1.00 0.61 H new ATOM 0 HG23 VAL A 108 -10.807 -7.581 -9.313 1.00 0.61 H new ATOM 1844 N LEU A 109 -10.951 -9.272 -4.438 1.00 0.12 N ATOM 1845 CA LEU A 109 -11.182 -10.223 -3.362 1.00 0.12 C ATOM 1846 C LEU A 109 -12.623 -10.179 -2.896 1.00 0.12 C ATOM 1847 O LEU A 109 -13.340 -9.213 -3.146 1.00 0.17 O ATOM 1848 CB LEU A 109 -10.269 -9.923 -2.174 1.00 0.11 C ATOM 1849 CG LEU A 109 -8.786 -10.197 -2.400 1.00 0.12 C ATOM 1850 CD1 LEU A 109 -8.217 -9.229 -3.422 1.00 0.12 C ATOM 1851 CD2 LEU A 109 -8.029 -10.103 -1.083 1.00 0.14 C ATOM 0 H LEU A 109 -10.663 -8.344 -4.128 1.00 0.12 H new ATOM 0 HA LEU A 109 -10.962 -11.217 -3.752 1.00 0.12 H new ATOM 0 HB2 LEU A 109 -10.389 -8.875 -1.901 1.00 0.11 H new ATOM 0 HB3 LEU A 109 -10.604 -10.515 -1.322 1.00 0.11 H new ATOM 0 HG LEU A 109 -8.671 -11.208 -2.791 1.00 0.12 H new ATOM 0 HD11 LEU A 109 -7.158 -9.439 -3.571 1.00 0.12 H new ATOM 0 HD12 LEU A 109 -8.747 -9.345 -4.368 1.00 0.12 H new ATOM 0 HD13 LEU A 109 -8.337 -8.207 -3.062 1.00 0.12 H new ATOM 0 HD21 LEU A 109 -6.971 -10.300 -1.256 1.00 0.14 H new ATOM 0 HD22 LEU A 109 -8.148 -9.103 -0.666 1.00 0.14 H new ATOM 0 HD23 LEU A 109 -8.425 -10.838 -0.382 1.00 0.14 H new ATOM 1863 N GLU A 110 -13.040 -11.235 -2.219 1.00 0.13 N ATOM 1864 CA GLU A 110 -14.385 -11.306 -1.687 1.00 0.13 C ATOM 1865 C GLU A 110 -14.372 -10.818 -0.251 1.00 0.12 C ATOM 1866 O GLU A 110 -13.357 -10.934 0.433 1.00 0.12 O ATOM 1867 CB GLU A 110 -14.918 -12.736 -1.746 1.00 0.15 C ATOM 1868 CG GLU A 110 -14.545 -13.469 -3.020 1.00 0.19 C ATOM 1869 CD GLU A 110 -15.199 -14.833 -3.120 1.00 0.26 C ATOM 1870 OE1 GLU A 110 -16.335 -14.912 -3.635 1.00 0.33 O ATOM 1871 OE2 GLU A 110 -14.576 -15.823 -2.683 1.00 0.34 O ATOM 0 H GLU A 110 -12.464 -12.054 -2.026 1.00 0.13 H new ATOM 0 HA GLU A 110 -15.040 -10.676 -2.289 1.00 0.13 H new ATOM 0 HB2 GLU A 110 -14.536 -13.293 -0.891 1.00 0.15 H new ATOM 0 HB3 GLU A 110 -16.004 -12.715 -1.653 1.00 0.15 H new ATOM 0 HG2 GLU A 110 -14.836 -12.866 -3.880 1.00 0.19 H new ATOM 0 HG3 GLU A 110 -13.462 -13.585 -3.064 1.00 0.19 H new ATOM 1878 N GLN A 111 -15.486 -10.279 0.218 1.00 0.13 N ATOM 1879 CA GLN A 111 -15.553 -9.771 1.581 1.00 0.13 C ATOM 1880 C GLN A 111 -14.978 -10.777 2.565 1.00 0.12 C ATOM 1881 O GLN A 111 -14.204 -10.424 3.451 1.00 0.13 O ATOM 1882 CB GLN A 111 -16.987 -9.432 1.960 1.00 0.14 C ATOM 1883 CG GLN A 111 -17.119 -8.970 3.394 1.00 0.16 C ATOM 1884 CD GLN A 111 -18.450 -8.312 3.684 1.00 0.17 C ATOM 1885 OE1 GLN A 111 -19.473 -8.661 3.094 1.00 0.36 O ATOM 1886 NE2 GLN A 111 -18.437 -7.351 4.595 1.00 0.31 N ATOM 0 H GLN A 111 -16.349 -10.182 -0.318 1.00 0.13 H new ATOM 0 HA GLN A 111 -14.955 -8.861 1.627 1.00 0.13 H new ATOM 0 HB2 GLN A 111 -17.359 -8.652 1.296 1.00 0.14 H new ATOM 0 HB3 GLN A 111 -17.616 -10.309 1.806 1.00 0.14 H new ATOM 0 HG2 GLN A 111 -16.990 -9.825 4.058 1.00 0.16 H new ATOM 0 HG3 GLN A 111 -16.316 -8.268 3.619 1.00 0.16 H new ATOM 0 HE21 GLN A 111 -17.563 -7.098 5.057 1.00 0.31 H new ATOM 0 HE22 GLN A 111 -19.301 -6.864 4.835 1.00 0.31 H new ATOM 1895 N SER A 112 -15.351 -12.035 2.399 1.00 0.13 N ATOM 1896 CA SER A 112 -14.848 -13.082 3.267 1.00 0.14 C ATOM 1897 C SER A 112 -13.328 -13.105 3.206 1.00 0.14 C ATOM 1898 O SER A 112 -12.655 -13.347 4.209 1.00 0.16 O ATOM 1899 CB SER A 112 -15.412 -14.443 2.855 1.00 0.16 C ATOM 1900 OG SER A 112 -16.804 -14.518 3.108 1.00 0.95 O ATOM 0 H SER A 112 -15.996 -12.353 1.676 1.00 0.13 H new ATOM 0 HA SER A 112 -15.167 -12.876 4.289 1.00 0.14 H new ATOM 0 HB2 SER A 112 -15.223 -14.612 1.795 1.00 0.16 H new ATOM 0 HB3 SER A 112 -14.897 -15.233 3.401 1.00 0.16 H new ATOM 0 HG SER A 112 -17.139 -15.397 2.834 1.00 0.95 H new ATOM 1906 N GLU A 113 -12.798 -12.852 2.015 1.00 0.13 N ATOM 1907 CA GLU A 113 -11.361 -12.823 1.807 1.00 0.13 C ATOM 1908 C GLU A 113 -10.768 -11.536 2.362 1.00 0.14 C ATOM 1909 O GLU A 113 -9.835 -11.563 3.163 1.00 0.17 O ATOM 1910 CB GLU A 113 -11.041 -12.943 0.319 1.00 0.14 C ATOM 1911 CG GLU A 113 -11.472 -14.266 -0.283 1.00 0.18 C ATOM 1912 CD GLU A 113 -10.786 -15.454 0.364 1.00 0.25 C ATOM 1913 OE1 GLU A 113 -9.639 -15.762 -0.024 1.00 0.31 O ATOM 1914 OE2 GLU A 113 -11.396 -16.076 1.259 1.00 0.30 O ATOM 0 H GLU A 113 -13.348 -12.664 1.177 1.00 0.13 H new ATOM 0 HA GLU A 113 -10.920 -13.668 2.335 1.00 0.13 H new ATOM 0 HB2 GLU A 113 -11.531 -12.131 -0.218 1.00 0.14 H new ATOM 0 HB3 GLU A 113 -9.968 -12.818 0.174 1.00 0.14 H new ATOM 0 HG2 GLU A 113 -12.552 -14.374 -0.178 1.00 0.18 H new ATOM 0 HG3 GLU A 113 -11.254 -14.263 -1.351 1.00 0.18 H new ATOM 1921 N PHE A 114 -11.322 -10.407 1.931 1.00 0.11 N ATOM 1922 CA PHE A 114 -10.847 -9.112 2.386 1.00 0.12 C ATOM 1923 C PHE A 114 -10.953 -9.021 3.900 1.00 0.13 C ATOM 1924 O PHE A 114 -10.007 -8.626 4.576 1.00 0.19 O ATOM 1925 CB PHE A 114 -11.642 -7.985 1.729 1.00 0.12 C ATOM 1926 CG PHE A 114 -11.148 -6.621 2.106 1.00 0.12 C ATOM 1927 CD1 PHE A 114 -11.665 -5.965 3.211 1.00 0.14 C ATOM 1928 CD2 PHE A 114 -10.175 -5.992 1.350 1.00 0.12 C ATOM 1929 CE1 PHE A 114 -11.218 -4.704 3.554 1.00 0.15 C ATOM 1930 CE2 PHE A 114 -9.725 -4.732 1.688 1.00 0.13 C ATOM 1931 CZ PHE A 114 -10.218 -4.105 2.820 1.00 0.14 C ATOM 0 H PHE A 114 -12.097 -10.366 1.270 1.00 0.11 H new ATOM 0 HA PHE A 114 -9.801 -9.005 2.098 1.00 0.12 H new ATOM 0 HB2 PHE A 114 -11.592 -8.097 0.646 1.00 0.12 H new ATOM 0 HB3 PHE A 114 -12.691 -8.076 2.011 1.00 0.12 H new ATOM 0 HD1 PHE A 114 -12.425 -6.444 3.810 1.00 0.14 H new ATOM 0 HD2 PHE A 114 -9.763 -6.492 0.486 1.00 0.12 H new ATOM 0 HE1 PHE A 114 -11.652 -4.188 4.397 1.00 0.15 H new ATOM 0 HE2 PHE A 114 -8.990 -4.236 1.071 1.00 0.13 H new ATOM 0 HZ PHE A 114 -9.820 -3.149 3.127 1.00 0.14 H new ATOM 1941 N GLU A 115 -12.115 -9.389 4.426 1.00 0.12 N ATOM 1942 CA GLU A 115 -12.339 -9.378 5.864 1.00 0.14 C ATOM 1943 C GLU A 115 -11.286 -10.227 6.551 1.00 0.15 C ATOM 1944 O GLU A 115 -10.837 -9.924 7.657 1.00 0.18 O ATOM 1945 CB GLU A 115 -13.724 -9.934 6.191 1.00 0.14 C ATOM 1946 CG GLU A 115 -14.865 -8.996 5.849 1.00 0.14 C ATOM 1947 CD GLU A 115 -16.208 -9.521 6.316 1.00 0.41 C ATOM 1948 OE1 GLU A 115 -16.541 -10.679 5.986 1.00 0.60 O ATOM 1949 OE2 GLU A 115 -16.928 -8.775 7.012 1.00 0.66 O ATOM 0 H GLU A 115 -12.917 -9.699 3.877 1.00 0.12 H new ATOM 0 HA GLU A 115 -12.274 -8.349 6.219 1.00 0.14 H new ATOM 0 HB2 GLU A 115 -13.864 -10.871 5.652 1.00 0.14 H new ATOM 0 HB3 GLU A 115 -13.767 -10.169 7.255 1.00 0.14 H new ATOM 0 HG2 GLU A 115 -14.680 -8.023 6.305 1.00 0.14 H new ATOM 0 HG3 GLU A 115 -14.894 -8.842 4.770 1.00 0.14 H new ATOM 1956 N ALA A 116 -10.903 -11.295 5.870 1.00 0.13 N ATOM 1957 CA ALA A 116 -9.908 -12.224 6.375 1.00 0.15 C ATOM 1958 C ALA A 116 -8.498 -11.645 6.277 1.00 0.16 C ATOM 1959 O ALA A 116 -7.548 -12.214 6.816 1.00 0.21 O ATOM 1960 CB ALA A 116 -10.000 -13.529 5.601 1.00 0.17 C ATOM 0 H ALA A 116 -11.274 -11.541 4.952 1.00 0.13 H new ATOM 0 HA ALA A 116 -10.111 -12.408 7.430 1.00 0.15 H new ATOM 0 HB1 ALA A 116 -9.254 -14.229 5.978 1.00 0.17 H new ATOM 0 HB2 ALA A 116 -10.995 -13.957 5.726 1.00 0.17 H new ATOM 0 HB3 ALA A 116 -9.817 -13.338 4.543 1.00 0.17 H new ATOM 1966 N LEU A 117 -8.362 -10.513 5.589 1.00 0.16 N ATOM 1967 CA LEU A 117 -7.064 -9.877 5.420 1.00 0.18 C ATOM 1968 C LEU A 117 -7.029 -8.494 6.070 1.00 0.19 C ATOM 1969 O LEU A 117 -5.975 -8.028 6.502 1.00 0.28 O ATOM 1970 CB LEU A 117 -6.737 -9.763 3.933 1.00 0.19 C ATOM 1971 CG LEU A 117 -6.739 -11.089 3.175 1.00 0.19 C ATOM 1972 CD1 LEU A 117 -6.721 -10.848 1.673 1.00 0.22 C ATOM 1973 CD2 LEU A 117 -5.549 -11.940 3.595 1.00 0.23 C ATOM 0 H LEU A 117 -9.135 -10.021 5.142 1.00 0.16 H new ATOM 0 HA LEU A 117 -6.316 -10.497 5.914 1.00 0.18 H new ATOM 0 HB2 LEU A 117 -7.459 -9.093 3.467 1.00 0.19 H new ATOM 0 HB3 LEU A 117 -5.756 -9.300 3.825 1.00 0.19 H new ATOM 0 HG LEU A 117 -7.654 -11.627 3.423 1.00 0.19 H new ATOM 0 HD11 LEU A 117 -6.723 -11.805 1.151 1.00 0.22 H new ATOM 0 HD12 LEU A 117 -7.603 -10.276 1.386 1.00 0.22 H new ATOM 0 HD13 LEU A 117 -5.824 -10.290 1.405 1.00 0.22 H new ATOM 0 HD21 LEU A 117 -5.564 -12.882 3.047 1.00 0.23 H new ATOM 0 HD22 LEU A 117 -4.624 -11.406 3.375 1.00 0.23 H new ATOM 0 HD23 LEU A 117 -5.606 -12.142 4.665 1.00 0.23 H new ATOM 1985 N TYR A 118 -8.186 -7.845 6.135 1.00 0.14 N ATOM 1986 CA TYR A 118 -8.283 -6.516 6.725 1.00 0.14 C ATOM 1987 C TYR A 118 -8.172 -6.584 8.243 1.00 0.20 C ATOM 1988 O TYR A 118 -8.790 -7.434 8.882 1.00 0.28 O ATOM 1989 CB TYR A 118 -9.604 -5.857 6.329 1.00 0.14 C ATOM 1990 CG TYR A 118 -9.622 -4.364 6.552 1.00 0.17 C ATOM 1991 CD1 TYR A 118 -8.728 -3.542 5.883 1.00 0.22 C ATOM 1992 CD2 TYR A 118 -10.527 -3.776 7.427 1.00 0.19 C ATOM 1993 CE1 TYR A 118 -8.732 -2.175 6.076 1.00 0.27 C ATOM 1994 CE2 TYR A 118 -10.538 -2.410 7.626 1.00 0.23 C ATOM 1995 CZ TYR A 118 -9.639 -1.613 6.949 1.00 0.27 C ATOM 1996 OH TYR A 118 -9.648 -0.253 7.144 1.00 0.33 O ATOM 0 H TYR A 118 -9.069 -8.218 5.786 1.00 0.14 H new ATOM 0 HA TYR A 118 -7.456 -5.916 6.346 1.00 0.14 H new ATOM 0 HB2 TYR A 118 -9.802 -6.062 5.277 1.00 0.14 H new ATOM 0 HB3 TYR A 118 -10.413 -6.312 6.900 1.00 0.14 H new ATOM 0 HD1 TYR A 118 -8.016 -3.979 5.199 1.00 0.22 H new ATOM 0 HD2 TYR A 118 -11.232 -4.397 7.959 1.00 0.19 H new ATOM 0 HE1 TYR A 118 -8.029 -1.550 5.546 1.00 0.27 H new ATOM 0 HE2 TYR A 118 -11.248 -1.967 8.309 1.00 0.23 H new ATOM 0 HH TYR A 118 -9.982 -0.054 8.043 1.00 0.33 H new ATOM 2006 N GLN A 119 -7.384 -5.679 8.816 1.00 0.22 N ATOM 2007 CA GLN A 119 -7.195 -5.644 10.263 1.00 0.29 C ATOM 2008 C GLN A 119 -7.835 -4.406 10.893 1.00 0.26 C ATOM 2009 O GLN A 119 -7.592 -4.106 12.062 1.00 0.40 O ATOM 2010 CB GLN A 119 -5.706 -5.686 10.605 1.00 0.36 C ATOM 2011 CG GLN A 119 -5.021 -6.969 10.170 1.00 0.56 C ATOM 2012 CD GLN A 119 -3.583 -7.044 10.638 1.00 0.70 C ATOM 2013 OE1 GLN A 119 -2.910 -6.023 10.783 1.00 1.49 O ATOM 2014 NE2 GLN A 119 -3.104 -8.256 10.878 1.00 0.36 N ATOM 0 H GLN A 119 -6.868 -4.963 8.304 1.00 0.22 H new ATOM 0 HA GLN A 119 -7.690 -6.523 10.676 1.00 0.29 H new ATOM 0 HB2 GLN A 119 -5.209 -4.839 10.132 1.00 0.36 H new ATOM 0 HB3 GLN A 119 -5.585 -5.566 11.682 1.00 0.36 H new ATOM 0 HG2 GLN A 119 -5.573 -7.823 10.563 1.00 0.56 H new ATOM 0 HG3 GLN A 119 -5.051 -7.043 9.083 1.00 0.56 H new ATOM 0 HE21 GLN A 119 -3.698 -9.075 10.744 1.00 0.36 H new ATOM 0 HE22 GLN A 119 -2.142 -8.370 11.196 1.00 0.36 H new ATOM 2023 N GLY A 120 -8.651 -3.689 10.124 1.00 0.26 N ATOM 2024 CA GLY A 120 -9.301 -2.500 10.649 1.00 0.25 C ATOM 2025 C GLY A 120 -8.480 -1.241 10.446 1.00 0.22 C ATOM 2026 O GLY A 120 -9.018 -0.134 10.459 1.00 0.35 O ATOM 0 H GLY A 120 -8.873 -3.908 9.153 1.00 0.26 H new ATOM 0 HA2 GLY A 120 -10.270 -2.378 10.165 1.00 0.25 H new ATOM 0 HA3 GLY A 120 -9.491 -2.636 11.714 1.00 0.25 H new ATOM 2030 N HIS A 121 -7.174 -1.404 10.256 1.00 0.20 N ATOM 2031 CA HIS A 121 -6.286 -0.267 10.054 1.00 0.18 C ATOM 2032 C HIS A 121 -5.871 -0.153 8.595 1.00 0.17 C ATOM 2033 O HIS A 121 -5.535 -1.149 7.953 1.00 0.26 O ATOM 2034 CB HIS A 121 -5.044 -0.386 10.939 1.00 0.21 C ATOM 2035 CG HIS A 121 -5.243 0.143 12.324 1.00 0.23 C ATOM 2036 ND1 HIS A 121 -5.120 -0.634 13.456 1.00 0.29 N ATOM 2037 CD2 HIS A 121 -5.547 1.388 12.756 1.00 0.24 C ATOM 2038 CE1 HIS A 121 -5.341 0.111 14.525 1.00 0.32 C ATOM 2039 NE2 HIS A 121 -5.601 1.342 14.127 1.00 0.29 N ATOM 0 H HIS A 121 -6.709 -2.312 10.238 1.00 0.20 H new ATOM 0 HA HIS A 121 -6.833 0.634 10.332 1.00 0.18 H new ATOM 0 HB2 HIS A 121 -4.749 -1.434 10.998 1.00 0.21 H new ATOM 0 HB3 HIS A 121 -4.220 0.151 10.469 1.00 0.21 H new ATOM 0 HD2 HIS A 121 -5.716 2.257 12.137 1.00 0.24 H new ATOM 0 HE1 HIS A 121 -5.314 -0.230 15.550 1.00 0.32 H new ATOM 0 HE2 HIS A 121 -5.808 2.131 14.739 1.00 0.29 H new ATOM 2048 N ILE A 122 -5.896 1.069 8.078 1.00 0.09 N ATOM 2049 CA ILE A 122 -5.524 1.314 6.695 1.00 0.08 C ATOM 2050 C ILE A 122 -4.750 2.619 6.558 1.00 0.08 C ATOM 2051 O ILE A 122 -4.987 3.575 7.296 1.00 0.12 O ATOM 2052 CB ILE A 122 -6.765 1.350 5.782 1.00 0.08 C ATOM 2053 CG1 ILE A 122 -6.344 1.305 4.318 1.00 0.09 C ATOM 2054 CG2 ILE A 122 -7.606 2.586 6.062 1.00 0.10 C ATOM 2055 CD1 ILE A 122 -7.484 0.977 3.381 1.00 0.12 C ATOM 0 H ILE A 122 -6.170 1.903 8.597 1.00 0.09 H new ATOM 0 HA ILE A 122 -4.883 0.490 6.383 1.00 0.08 H new ATOM 0 HB ILE A 122 -7.376 0.472 5.995 1.00 0.08 H new ATOM 0 HG12 ILE A 122 -5.919 2.269 4.039 1.00 0.09 H new ATOM 0 HG13 ILE A 122 -5.556 0.562 4.196 1.00 0.09 H new ATOM 0 HG21 ILE A 122 -8.476 2.590 5.406 1.00 0.10 H new ATOM 0 HG22 ILE A 122 -7.935 2.575 7.101 1.00 0.10 H new ATOM 0 HG23 ILE A 122 -7.010 3.480 5.880 1.00 0.10 H new ATOM 0 HD11 ILE A 122 -7.118 0.961 2.354 1.00 0.12 H new ATOM 0 HD12 ILE A 122 -7.895 -0.000 3.636 1.00 0.12 H new ATOM 0 HD13 ILE A 122 -8.263 1.734 3.476 1.00 0.12 H new ATOM 2067 N ILE A 123 -3.824 2.651 5.610 1.00 0.08 N ATOM 2068 CA ILE A 123 -3.011 3.831 5.377 1.00 0.08 C ATOM 2069 C ILE A 123 -3.504 4.609 4.166 1.00 0.08 C ATOM 2070 O ILE A 123 -3.451 4.124 3.036 1.00 0.09 O ATOM 2071 CB ILE A 123 -1.532 3.453 5.178 1.00 0.09 C ATOM 2072 CG1 ILE A 123 -1.019 2.729 6.419 1.00 0.10 C ATOM 2073 CG2 ILE A 123 -0.692 4.689 4.892 1.00 0.09 C ATOM 2074 CD1 ILE A 123 0.370 2.158 6.264 1.00 0.10 C ATOM 0 H ILE A 123 -3.618 1.869 4.989 1.00 0.08 H new ATOM 0 HA ILE A 123 -3.100 4.463 6.261 1.00 0.08 H new ATOM 0 HB ILE A 123 -1.450 2.788 4.318 1.00 0.09 H new ATOM 0 HG12 ILE A 123 -1.024 3.422 7.260 1.00 0.10 H new ATOM 0 HG13 ILE A 123 -1.708 1.921 6.667 1.00 0.10 H new ATOM 0 HG21 ILE A 123 0.349 4.397 4.755 1.00 0.09 H new ATOM 0 HG22 ILE A 123 -1.055 5.174 3.986 1.00 0.09 H new ATOM 0 HG23 ILE A 123 -0.767 5.382 5.730 1.00 0.09 H new ATOM 0 HD11 ILE A 123 0.664 1.659 7.188 1.00 0.10 H new ATOM 0 HD12 ILE A 123 0.378 1.439 5.445 1.00 0.10 H new ATOM 0 HD13 ILE A 123 1.072 2.963 6.047 1.00 0.10 H new ATOM 2086 N LEU A 124 -3.983 5.817 4.417 1.00 0.08 N ATOM 2087 CA LEU A 124 -4.486 6.673 3.354 1.00 0.09 C ATOM 2088 C LEU A 124 -3.365 7.547 2.806 1.00 0.09 C ATOM 2089 O LEU A 124 -2.645 8.195 3.566 1.00 0.09 O ATOM 2090 CB LEU A 124 -5.629 7.543 3.876 1.00 0.10 C ATOM 2091 CG LEU A 124 -6.735 6.784 4.615 1.00 0.11 C ATOM 2092 CD1 LEU A 124 -7.729 7.759 5.228 1.00 0.16 C ATOM 2093 CD2 LEU A 124 -7.442 5.817 3.675 1.00 0.13 C ATOM 0 H LEU A 124 -4.034 6.228 5.349 1.00 0.08 H new ATOM 0 HA LEU A 124 -4.864 6.045 2.547 1.00 0.09 H new ATOM 0 HB2 LEU A 124 -5.215 8.296 4.547 1.00 0.10 H new ATOM 0 HB3 LEU A 124 -6.074 8.075 3.035 1.00 0.10 H new ATOM 0 HG LEU A 124 -6.279 6.206 5.419 1.00 0.11 H new ATOM 0 HD11 LEU A 124 -8.509 7.204 5.750 1.00 0.16 H new ATOM 0 HD12 LEU A 124 -7.213 8.409 5.934 1.00 0.16 H new ATOM 0 HD13 LEU A 124 -8.179 8.363 4.440 1.00 0.16 H new ATOM 0 HD21 LEU A 124 -8.224 5.287 4.219 1.00 0.13 H new ATOM 0 HD22 LEU A 124 -7.886 6.372 2.849 1.00 0.13 H new ATOM 0 HD23 LEU A 124 -6.722 5.098 3.283 1.00 0.13 H new ATOM 2105 N ILE A 125 -3.219 7.565 1.486 1.00 0.10 N ATOM 2106 CA ILE A 125 -2.176 8.357 0.855 1.00 0.11 C ATOM 2107 C ILE A 125 -2.761 9.485 0.015 1.00 0.12 C ATOM 2108 O ILE A 125 -3.810 9.340 -0.611 1.00 0.17 O ATOM 2109 CB ILE A 125 -1.258 7.485 -0.031 1.00 0.12 C ATOM 2110 CG1 ILE A 125 -0.559 6.420 0.812 1.00 0.11 C ATOM 2111 CG2 ILE A 125 -0.227 8.339 -0.760 1.00 0.13 C ATOM 2112 CD1 ILE A 125 -1.424 5.215 1.108 1.00 0.11 C ATOM 0 H ILE A 125 -3.807 7.042 0.837 1.00 0.10 H new ATOM 0 HA ILE A 125 -1.583 8.788 1.662 1.00 0.11 H new ATOM 0 HB ILE A 125 -1.881 6.992 -0.777 1.00 0.12 H new ATOM 0 HG12 ILE A 125 0.341 6.091 0.293 1.00 0.11 H new ATOM 0 HG13 ILE A 125 -0.239 6.867 1.753 1.00 0.11 H new ATOM 0 HG21 ILE A 125 0.405 7.699 -1.376 1.00 0.13 H new ATOM 0 HG22 ILE A 125 -0.738 9.063 -1.394 1.00 0.13 H new ATOM 0 HG23 ILE A 125 0.390 8.866 -0.032 1.00 0.13 H new ATOM 0 HD11 ILE A 125 -0.861 4.502 1.710 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.312 5.530 1.655 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.723 4.743 0.172 1.00 0.11 H new ATOM 2124 N ALA A 126 -2.058 10.608 0.016 1.00 0.12 N ATOM 2125 CA ALA A 126 -2.461 11.781 -0.739 1.00 0.14 C ATOM 2126 C ALA A 126 -1.232 12.530 -1.232 1.00 0.13 C ATOM 2127 O ALA A 126 -0.175 12.477 -0.608 1.00 0.21 O ATOM 2128 CB ALA A 126 -3.328 12.692 0.114 1.00 0.17 C ATOM 0 H ALA A 126 -1.192 10.730 0.541 1.00 0.12 H new ATOM 0 HA ALA A 126 -3.046 11.458 -1.600 1.00 0.14 H new ATOM 0 HB1 ALA A 126 -3.621 13.566 -0.468 1.00 0.17 H new ATOM 0 HB2 ALA A 126 -4.220 12.152 0.432 1.00 0.17 H new ATOM 0 HB3 ALA A 126 -2.766 13.012 0.991 1.00 0.17 H new ATOM 2134 N SER A 127 -1.368 13.220 -2.352 1.00 0.19 N ATOM 2135 CA SER A 127 -0.253 13.968 -2.908 1.00 0.19 C ATOM 2136 C SER A 127 -0.611 15.433 -3.101 1.00 0.26 C ATOM 2137 O SER A 127 -1.754 15.770 -3.407 1.00 0.28 O ATOM 2138 CB SER A 127 0.193 13.356 -4.234 1.00 0.23 C ATOM 2139 OG SER A 127 1.271 14.084 -4.797 1.00 0.27 O ATOM 0 H SER A 127 -2.232 13.278 -2.891 1.00 0.19 H new ATOM 0 HA SER A 127 0.571 13.912 -2.197 1.00 0.19 H new ATOM 0 HB2 SER A 127 0.493 12.320 -4.077 1.00 0.23 H new ATOM 0 HB3 SER A 127 -0.644 13.343 -4.932 1.00 0.23 H new ATOM 0 HG SER A 127 1.538 13.670 -5.644 1.00 0.27 H new ATOM 2145 N ARG A 128 0.376 16.300 -2.917 1.00 0.40 N ATOM 2146 CA ARG A 128 0.179 17.739 -3.067 1.00 0.53 C ATOM 2147 C ARG A 128 -0.643 18.059 -4.313 1.00 0.55 C ATOM 2148 O ARG A 128 -1.654 18.760 -4.241 1.00 0.83 O ATOM 2149 CB ARG A 128 1.532 18.443 -3.142 1.00 0.80 C ATOM 2150 CG ARG A 128 2.388 18.243 -1.906 1.00 0.95 C ATOM 2151 CD ARG A 128 3.759 18.881 -2.068 1.00 1.25 C ATOM 2152 NE ARG A 128 3.668 20.316 -2.320 1.00 1.65 N ATOM 2153 CZ ARG A 128 4.713 21.077 -2.623 1.00 1.99 C ATOM 2154 NH1 ARG A 128 5.921 20.540 -2.713 1.00 1.94 N ATOM 2155 NH2 ARG A 128 4.551 22.377 -2.838 1.00 2.54 N ATOM 0 H ARG A 128 1.326 16.032 -2.662 1.00 0.40 H new ATOM 0 HA ARG A 128 -0.371 18.098 -2.197 1.00 0.53 H new ATOM 0 HB2 ARG A 128 2.075 18.077 -4.013 1.00 0.80 H new ATOM 0 HB3 ARG A 128 1.369 19.510 -3.293 1.00 0.80 H new ATOM 0 HG2 ARG A 128 1.885 18.674 -1.040 1.00 0.95 H new ATOM 0 HG3 ARG A 128 2.503 17.177 -1.710 1.00 0.95 H new ATOM 0 HD2 ARG A 128 4.348 18.708 -1.167 1.00 1.25 H new ATOM 0 HD3 ARG A 128 4.287 18.401 -2.892 1.00 1.25 H new ATOM 0 HE ARG A 128 2.751 20.759 -2.260 1.00 1.65 H new ATOM 0 HH11 ARG A 128 6.049 19.541 -2.549 1.00 1.94 H new ATOM 0 HH12 ARG A 128 6.723 21.125 -2.946 1.00 1.94 H new ATOM 0 HH21 ARG A 128 3.622 22.793 -2.771 1.00 2.54 H new ATOM 0 HH22 ARG A 128 5.355 22.960 -3.071 1.00 2.54 H new ATOM 2169 N SER A 129 -0.206 17.531 -5.451 1.00 0.60 N ATOM 2170 CA SER A 129 -0.897 17.758 -6.715 1.00 0.69 C ATOM 2171 C SER A 129 -2.173 16.926 -6.806 1.00 0.72 C ATOM 2172 O SER A 129 -3.055 17.215 -7.615 1.00 1.08 O ATOM 2173 CB SER A 129 0.026 17.426 -7.888 1.00 0.89 C ATOM 2174 OG SER A 129 1.211 18.200 -7.840 1.00 1.55 O ATOM 0 H SER A 129 0.624 16.943 -5.524 1.00 0.60 H new ATOM 0 HA SER A 129 -1.174 18.811 -6.761 1.00 0.69 H new ATOM 0 HB2 SER A 129 0.279 16.366 -7.867 1.00 0.89 H new ATOM 0 HB3 SER A 129 -0.495 17.610 -8.828 1.00 0.89 H new ATOM 0 HG SER A 129 1.785 17.967 -8.600 1.00 1.55 H new ATOM 2180 N SER A 130 -2.271 15.892 -5.973 1.00 0.58 N ATOM 2181 CA SER A 130 -3.441 15.024 -5.975 1.00 0.74 C ATOM 2182 C SER A 130 -3.956 14.784 -4.559 1.00 0.97 C ATOM 2183 O SER A 130 -3.554 13.829 -3.894 1.00 1.60 O ATOM 2184 CB SER A 130 -3.108 13.686 -6.636 1.00 1.13 C ATOM 2185 OG SER A 130 -2.651 13.872 -7.965 1.00 1.78 O ATOM 0 H SER A 130 -1.556 15.637 -5.291 1.00 0.58 H new ATOM 0 HA SER A 130 -4.224 15.524 -6.545 1.00 0.74 H new ATOM 0 HB2 SER A 130 -2.344 13.170 -6.055 1.00 1.13 H new ATOM 0 HB3 SER A 130 -3.992 13.048 -6.638 1.00 1.13 H new ATOM 0 HG SER A 130 -2.444 13.001 -8.364 1.00 1.78 H new ATOM 2191 N VAL A 131 -4.848 15.657 -4.107 1.00 1.26 N ATOM 2192 CA VAL A 131 -5.427 15.540 -2.775 1.00 1.73 C ATOM 2193 C VAL A 131 -6.870 15.057 -2.853 1.00 1.69 C ATOM 2194 O VAL A 131 -7.668 15.300 -1.946 1.00 2.16 O ATOM 2195 CB VAL A 131 -5.391 16.883 -2.027 1.00 2.26 C ATOM 2196 CG1 VAL A 131 -3.957 17.341 -1.818 1.00 2.59 C ATOM 2197 CG2 VAL A 131 -6.189 17.933 -2.784 1.00 2.28 C ATOM 0 H VAL A 131 -5.186 16.455 -4.645 1.00 1.26 H new ATOM 0 HA VAL A 131 -4.826 14.813 -2.228 1.00 1.73 H new ATOM 0 HB VAL A 131 -5.848 16.746 -1.047 1.00 2.26 H new ATOM 0 HG11 VAL A 131 -3.953 18.293 -1.287 1.00 2.59 H new ATOM 0 HG12 VAL A 131 -3.419 16.596 -1.232 1.00 2.59 H new ATOM 0 HG13 VAL A 131 -3.469 17.463 -2.785 1.00 2.59 H new ATOM 0 HG21 VAL A 131 -6.154 18.878 -2.242 1.00 2.28 H new ATOM 0 HG22 VAL A 131 -5.761 18.069 -3.777 1.00 2.28 H new ATOM 0 HG23 VAL A 131 -7.225 17.606 -2.876 1.00 2.28 H new ATOM 2207 N ALA A 132 -7.199 14.372 -3.941 1.00 1.45 N ATOM 2208 CA ALA A 132 -8.544 13.858 -4.144 1.00 1.75 C ATOM 2209 C ALA A 132 -8.558 12.335 -4.125 1.00 2.08 C ATOM 2210 O ALA A 132 -9.539 11.715 -3.713 1.00 2.50 O ATOM 2211 CB ALA A 132 -9.110 14.374 -5.457 1.00 1.89 C ATOM 0 H ALA A 132 -6.549 14.160 -4.698 1.00 1.45 H new ATOM 0 HA ALA A 132 -9.170 14.211 -3.324 1.00 1.75 H new ATOM 0 HB1 ALA A 132 -10.117 13.982 -5.598 1.00 1.89 H new ATOM 0 HB2 ALA A 132 -9.144 15.463 -5.436 1.00 1.89 H new ATOM 0 HB3 ALA A 132 -8.475 14.047 -6.280 1.00 1.89 H new ATOM 2217 N GLY A 133 -7.459 11.738 -4.571 1.00 2.20 N ATOM 2218 CA GLY A 133 -7.360 10.291 -4.600 1.00 2.72 C ATOM 2219 C GLY A 133 -7.390 9.738 -6.010 1.00 2.49 C ATOM 2220 O GLY A 133 -6.619 8.840 -6.349 1.00 2.56 O ATOM 0 H GLY A 133 -6.634 12.231 -4.913 1.00 2.20 H new ATOM 0 HA2 GLY A 133 -6.436 9.983 -4.111 1.00 2.72 H new ATOM 0 HA3 GLY A 133 -8.182 9.862 -4.027 1.00 2.72 H new ATOM 2224 N LYS A 134 -8.285 10.274 -6.834 1.00 2.56 N ATOM 2225 CA LYS A 134 -8.414 9.829 -8.215 1.00 2.53 C ATOM 2226 C LYS A 134 -7.465 10.598 -9.126 1.00 2.33 C ATOM 2227 O LYS A 134 -7.415 11.828 -9.096 1.00 2.66 O ATOM 2228 CB LYS A 134 -9.855 10.001 -8.695 1.00 3.01 C ATOM 2229 CG LYS A 134 -10.044 9.716 -10.177 1.00 3.36 C ATOM 2230 CD LYS A 134 -11.514 9.757 -10.571 1.00 4.13 C ATOM 2231 CE LYS A 134 -11.992 11.180 -10.825 1.00 4.97 C ATOM 2232 NZ LYS A 134 -11.880 12.038 -9.614 1.00 5.84 N ATOM 0 H LYS A 134 -8.931 11.017 -6.568 1.00 2.56 H new ATOM 0 HA LYS A 134 -8.149 8.772 -8.256 1.00 2.53 H new ATOM 0 HB2 LYS A 134 -10.501 9.337 -8.121 1.00 3.01 H new ATOM 0 HB3 LYS A 134 -10.179 11.021 -8.486 1.00 3.01 H new ATOM 0 HG2 LYS A 134 -9.489 10.448 -10.763 1.00 3.36 H new ATOM 0 HG3 LYS A 134 -9.630 8.737 -10.416 1.00 3.36 H new ATOM 0 HD2 LYS A 134 -11.667 9.157 -11.468 1.00 4.13 H new ATOM 0 HD3 LYS A 134 -12.115 9.307 -9.780 1.00 4.13 H new ATOM 0 HE2 LYS A 134 -11.407 11.618 -11.634 1.00 4.97 H new ATOM 0 HE3 LYS A 134 -13.030 11.158 -11.158 1.00 4.97 H new ATOM 0 HZ1 LYS A 134 -12.555 12.826 -9.684 1.00 5.84 H new ATOM 0 HZ2 LYS A 134 -12.094 11.473 -8.767 1.00 5.84 H new ATOM 0 HZ3 LYS A 134 -10.913 12.415 -9.544 1.00 5.84 H new ATOM 2246 N LEU A 135 -6.715 9.862 -9.937 1.00 2.03 N ATOM 2247 CA LEU A 135 -5.763 10.462 -10.859 1.00 2.01 C ATOM 2248 C LEU A 135 -6.341 10.537 -12.266 1.00 2.30 C ATOM 2249 O LEU A 135 -6.123 11.510 -12.989 1.00 2.68 O ATOM 2250 CB LEU A 135 -4.465 9.656 -10.868 1.00 1.88 C ATOM 2251 CG LEU A 135 -3.476 10.033 -11.970 1.00 2.28 C ATOM 2252 CD1 LEU A 135 -3.007 11.468 -11.799 1.00 2.66 C ATOM 2253 CD2 LEU A 135 -2.291 9.078 -11.971 1.00 2.33 C ATOM 0 H LEU A 135 -6.749 8.843 -9.973 1.00 2.03 H new ATOM 0 HA LEU A 135 -5.553 11.477 -10.522 1.00 2.01 H new ATOM 0 HB2 LEU A 135 -3.973 9.777 -9.903 1.00 1.88 H new ATOM 0 HB3 LEU A 135 -4.712 8.599 -10.969 1.00 1.88 H new ATOM 0 HG LEU A 135 -3.984 9.952 -12.931 1.00 2.28 H new ATOM 0 HD11 LEU A 135 -2.303 11.718 -12.593 1.00 2.66 H new ATOM 0 HD12 LEU A 135 -3.864 12.139 -11.849 1.00 2.66 H new ATOM 0 HD13 LEU A 135 -2.516 11.578 -10.832 1.00 2.66 H new ATOM 0 HD21 LEU A 135 -1.596 9.361 -12.762 1.00 2.33 H new ATOM 0 HD22 LEU A 135 -1.783 9.127 -11.008 1.00 2.33 H new ATOM 0 HD23 LEU A 135 -2.643 8.061 -12.144 1.00 2.33 H new ATOM 2265 N ALA A 136 -7.081 9.501 -12.649 1.00 2.40 N ATOM 2266 CA ALA A 136 -7.693 9.445 -13.970 1.00 2.83 C ATOM 2267 C ALA A 136 -8.486 8.158 -14.153 1.00 2.82 C ATOM 2268 O ALA A 136 -8.209 7.370 -15.058 1.00 3.32 O ATOM 2269 CB ALA A 136 -6.630 9.569 -15.052 1.00 3.52 C ATOM 0 H ALA A 136 -7.271 8.689 -12.062 1.00 2.40 H new ATOM 0 HA ALA A 136 -8.384 10.283 -14.057 1.00 2.83 H new ATOM 0 HB1 ALA A 136 -7.103 9.525 -16.033 1.00 3.52 H new ATOM 0 HB2 ALA A 136 -6.108 10.520 -14.942 1.00 3.52 H new ATOM 0 HB3 ALA A 136 -5.916 8.751 -14.956 1.00 3.52 H new ATOM 2275 N LYS A 137 -9.473 7.950 -13.290 1.00 2.71 N ATOM 2276 CA LYS A 137 -10.308 6.757 -13.358 1.00 3.21 C ATOM 2277 C LYS A 137 -11.536 6.896 -12.462 1.00 3.74 C ATOM 2278 O LYS A 137 -12.491 7.586 -12.872 1.00 4.08 O ATOM 2279 CB LYS A 137 -9.499 5.520 -12.959 1.00 3.53 C ATOM 2280 CG LYS A 137 -8.765 5.667 -11.635 1.00 4.27 C ATOM 2281 CD LYS A 137 -7.901 4.451 -11.337 1.00 4.96 C ATOM 2282 CE LYS A 137 -6.779 4.302 -12.351 1.00 5.65 C ATOM 2283 NZ LYS A 137 -5.916 3.123 -12.059 1.00 6.33 N ATOM 2284 OXT LYS A 137 -11.534 6.309 -11.360 1.00 4.29 O ATOM 0 H LYS A 137 -9.715 8.592 -12.535 1.00 2.71 H new ATOM 0 HA LYS A 137 -10.649 6.640 -14.387 1.00 3.21 H new ATOM 0 HB2 LYS A 137 -10.170 4.663 -12.899 1.00 3.53 H new ATOM 0 HB3 LYS A 137 -8.774 5.303 -13.743 1.00 3.53 H new ATOM 0 HG2 LYS A 137 -8.141 6.560 -11.661 1.00 4.27 H new ATOM 0 HG3 LYS A 137 -9.488 5.807 -10.831 1.00 4.27 H new ATOM 0 HD2 LYS A 137 -7.479 4.540 -10.336 1.00 4.96 H new ATOM 0 HD3 LYS A 137 -8.520 3.554 -11.343 1.00 4.96 H new ATOM 0 HE2 LYS A 137 -7.204 4.202 -13.350 1.00 5.65 H new ATOM 0 HE3 LYS A 137 -6.170 5.206 -12.353 1.00 5.65 H new ATOM 0 HZ1 LYS A 137 -5.164 3.058 -12.774 1.00 6.33 H new ATOM 0 HZ2 LYS A 137 -5.490 3.230 -11.116 1.00 6.33 H new ATOM 0 HZ3 LYS A 137 -6.492 2.257 -12.082 1.00 6.33 H new TER 2298 LYS A 137