USER MOD reduce.3.24.130724 H: found=0, std=0, add=1122, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1122 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 109 MET CE :methyl -125:sc= -0.613 (180deg=-2.36!) USER MOD Set 1.2: A 124 MET CE :methyl 158:sc= -0.196 (180deg=-0.853) USER MOD Set 2.1: A 41 GLN : amide:sc= -2.27 K(o=-8.9,f=-10) USER MOD Set 2.2: A 72 MET CE :methyl 172:sc= -6.58! (180deg=-7.08!) USER MOD Set 2.3: A 76 MET CE :methyl 153:sc= -0.0464 (180deg=0) USER MOD Set 3.1: A 36 MET CE :methyl -152:sc= -4.73! (180deg=-2.94!) USER MOD Set 3.2: A 75 GLN : amide:sc= -3.6! C(o=-8.3!,f=-8.9!) USER MOD Set 4.1: A 60 ASN :FLIP amide:sc=-0.00242 F(o=-5.6,f=-4) USER MOD Set 4.2: A 62 GLN :FLIP amide:sc= -4.03! C(o=-7.9!,f=-4!) USER MOD Set 5.1: A 5 THR OG1 : rot -75:sc= -0.233 USER MOD Set 5.2: A 8 GLN : amide:sc= -4.91! C(o=-5.1!,f=-9!) USER MOD Set 6.1: A 1 MET N :NH3+ 177:sc= -0.78 (180deg=-0.846) USER MOD Set 6.2: A 69 CYS SG : rot -44:sc= 0.546 USER MOD Single : A 1 MET CE :methyl 176:sc= -1.74 (180deg=-1.85) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc=-0.00465 X(o=-0.0047,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 62:sc= 1.07 USER MOD Single : A 26 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0679) USER MOD Single : A 29 THR OG1 : rot -150:sc= -0.841 USER MOD Single : A 34 THR OG1 : rot -170:sc= 0 USER MOD Single : A 38 THR OG1 : rot 73:sc= 1.19 USER MOD Single : A 42 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.6!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.178 USER MOD Single : A 49 GLN :FLIP amide:sc= -2.95! C(o=-5.7!,f=-2.9!) USER MOD Single : A 57 ASN : amide:sc= -0.0957 K(o=-0.096,f=-1) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 64 ASN : amide:sc= -0.0281 K(o=-0.028,f=-1.2) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.576 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0.069 USER MOD Single : A 85 MET CE :methyl -128:sc= -6.38! (180deg=-12.7!) USER MOD Single : A 90 LYS NZ :NH3+ 166:sc= -0.0427 (180deg=-0.268) USER MOD Single : A 101 SER OG : rot 180:sc= -1.35 USER MOD Single : A 111 ASN :FLIP amide:sc= -0.716 F(o=-1.9,f=-0.72) USER MOD Single : A 115 LYS NZ :NH3+ 170:sc= -0.0329 (180deg=-0.194) USER MOD Single : A 117 THR OG1 : rot -170:sc= -0.399 USER MOD Single : A 135 MET CE :methyl -153:sc= -0.201 (180deg=-0.951) USER MOD Single : A 137 ASN : amide:sc= -2.7! C(o=-2.7!,f=-13!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.28 USER MOD Single : A 144 MET CE :methyl -159:sc= -0.738 (180deg=-1.85!) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN : amide:sc= -1.19! C(o=-1.2!,f=-2!) USER MOD Single : A 148 LYS NZ :NH3+ 152:sc= -0.952 (180deg=-2.04!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.162 -6.200 7.524 1.00 1.05 N ATOM 2 CA MET A 1 11.901 -7.010 8.740 1.00 0.92 C ATOM 3 C MET A 1 11.831 -6.123 9.978 1.00 0.91 C ATOM 4 O MET A 1 12.825 -5.514 10.375 1.00 1.39 O ATOM 5 CB MET A 1 12.996 -8.065 8.916 1.00 1.18 C ATOM 6 CG MET A 1 12.786 -8.966 10.122 1.00 1.50 C ATOM 7 SD MET A 1 14.119 -10.162 10.339 1.00 1.72 S ATOM 8 CE MET A 1 13.983 -11.104 8.821 1.00 2.27 C ATOM 0 H1 MET A 1 12.256 -6.829 6.701 1.00 1.05 H new ATOM 0 H2 MET A 1 11.371 -5.543 7.368 1.00 1.05 H new ATOM 0 H3 MET A 1 13.042 -5.660 7.649 1.00 1.05 H new ATOM 0 HA MET A 1 10.939 -7.509 8.617 1.00 0.92 H new ATOM 0 HB2 MET A 1 13.044 -8.680 8.017 1.00 1.18 H new ATOM 0 HB3 MET A 1 13.959 -7.564 9.011 1.00 1.18 H new ATOM 0 HG2 MET A 1 12.705 -8.352 11.019 1.00 1.50 H new ATOM 0 HG3 MET A 1 11.841 -9.498 10.013 1.00 1.50 H new ATOM 0 HE1 MET A 1 14.788 -11.838 8.775 1.00 2.27 H new ATOM 0 HE2 MET A 1 13.022 -11.617 8.796 1.00 2.27 H new ATOM 0 HE3 MET A 1 14.057 -10.431 7.967 1.00 2.27 H new ATOM 20 N SER A 2 10.650 -6.057 10.585 1.00 0.85 N ATOM 21 CA SER A 2 10.448 -5.249 11.785 1.00 0.89 C ATOM 22 C SER A 2 9.078 -5.524 12.397 1.00 0.89 C ATOM 23 O SER A 2 8.972 -5.875 13.573 1.00 0.98 O ATOM 24 CB SER A 2 10.591 -3.760 11.460 1.00 0.92 C ATOM 25 OG SER A 2 10.353 -2.961 12.607 1.00 1.04 O ATOM 0 H SER A 2 9.818 -6.553 10.266 1.00 0.85 H new ATOM 0 HA SER A 2 11.213 -5.524 12.511 1.00 0.89 H new ATOM 0 HB2 SER A 2 11.592 -3.563 11.077 1.00 0.92 H new ATOM 0 HB3 SER A 2 9.889 -3.488 10.672 1.00 0.92 H new ATOM 0 HG SER A 2 10.452 -2.015 12.373 1.00 1.04 H new ATOM 31 N GLU A 3 8.034 -5.364 11.593 1.00 0.85 N ATOM 32 CA GLU A 3 6.669 -5.602 12.048 1.00 0.93 C ATOM 33 C GLU A 3 5.872 -6.319 10.967 1.00 0.95 C ATOM 34 O GLU A 3 4.643 -6.376 11.013 1.00 1.73 O ATOM 35 CB GLU A 3 5.986 -4.283 12.417 1.00 1.02 C ATOM 36 CG GLU A 3 6.605 -3.587 13.619 1.00 1.10 C ATOM 37 CD GLU A 3 6.311 -4.302 14.925 1.00 1.54 C ATOM 38 OE1 GLU A 3 6.974 -5.321 15.207 1.00 2.13 O ATOM 39 OE2 GLU A 3 5.416 -3.841 15.664 1.00 1.67 O ATOM 0 H GLU A 3 8.107 -5.069 10.619 1.00 0.85 H new ATOM 0 HA GLU A 3 6.707 -6.232 12.936 1.00 0.93 H new ATOM 0 HB2 GLU A 3 6.026 -3.611 11.559 1.00 1.02 H new ATOM 0 HB3 GLU A 3 4.933 -4.475 12.622 1.00 1.02 H new ATOM 0 HG2 GLU A 3 7.684 -3.522 13.480 1.00 1.10 H new ATOM 0 HG3 GLU A 3 6.229 -2.566 13.676 1.00 1.10 H new ATOM 46 N LEU A 4 6.592 -6.861 9.994 1.00 0.37 N ATOM 47 CA LEU A 4 5.980 -7.576 8.881 1.00 0.29 C ATOM 48 C LEU A 4 5.576 -8.991 9.278 1.00 0.32 C ATOM 49 O LEU A 4 5.603 -9.345 10.457 1.00 0.36 O ATOM 50 CB LEU A 4 6.950 -7.630 7.705 1.00 0.22 C ATOM 51 CG LEU A 4 7.414 -6.270 7.188 1.00 0.25 C ATOM 52 CD1 LEU A 4 8.683 -5.826 7.895 1.00 0.37 C ATOM 53 CD2 LEU A 4 7.636 -6.325 5.691 1.00 0.27 C ATOM 0 H LEU A 4 7.610 -6.818 9.953 1.00 0.37 H new ATOM 0 HA LEU A 4 5.078 -7.036 8.592 1.00 0.29 H new ATOM 0 HB2 LEU A 4 7.826 -8.207 8.002 1.00 0.22 H new ATOM 0 HB3 LEU A 4 6.475 -8.170 6.886 1.00 0.22 H new ATOM 0 HG LEU A 4 6.633 -5.540 7.400 1.00 0.25 H new ATOM 0 HD11 LEU A 4 8.994 -4.855 7.509 1.00 0.37 H new ATOM 0 HD12 LEU A 4 8.495 -5.748 8.966 1.00 0.37 H new ATOM 0 HD13 LEU A 4 9.473 -6.556 7.718 1.00 0.37 H new ATOM 0 HD21 LEU A 4 7.966 -5.349 5.336 1.00 0.27 H new ATOM 0 HD22 LEU A 4 8.398 -7.071 5.463 1.00 0.27 H new ATOM 0 HD23 LEU A 4 6.704 -6.595 5.195 1.00 0.27 H new ATOM 65 N THR A 5 5.205 -9.797 8.287 1.00 0.32 N ATOM 66 CA THR A 5 4.800 -11.174 8.540 1.00 0.37 C ATOM 67 C THR A 5 5.985 -12.119 8.409 1.00 0.37 C ATOM 68 O THR A 5 6.534 -12.593 9.406 1.00 0.39 O ATOM 69 CB THR A 5 3.693 -11.628 7.568 1.00 0.42 C ATOM 70 OG1 THR A 5 4.068 -11.328 6.219 1.00 0.91 O ATOM 71 CG2 THR A 5 2.373 -10.951 7.889 1.00 0.91 C ATOM 0 H THR A 5 5.177 -9.521 7.306 1.00 0.32 H new ATOM 0 HA THR A 5 4.413 -11.207 9.558 1.00 0.37 H new ATOM 0 HB THR A 5 3.568 -12.705 7.681 1.00 0.42 H new ATOM 0 HG1 THR A 5 3.974 -10.366 6.060 1.00 0.91 H new ATOM 0 HG21 THR A 5 1.610 -11.290 7.188 1.00 0.91 H new ATOM 0 HG22 THR A 5 2.071 -11.206 8.905 1.00 0.91 H new ATOM 0 HG23 THR A 5 2.489 -9.870 7.805 1.00 0.91 H new ATOM 79 N GLU A 6 6.375 -12.367 7.162 1.00 0.35 N ATOM 80 CA GLU A 6 7.488 -13.249 6.838 1.00 0.35 C ATOM 81 C GLU A 6 7.552 -13.444 5.333 1.00 0.34 C ATOM 82 O GLU A 6 8.634 -13.501 4.750 1.00 0.32 O ATOM 83 CB GLU A 6 7.346 -14.603 7.540 1.00 0.40 C ATOM 84 CG GLU A 6 5.999 -15.271 7.313 1.00 0.94 C ATOM 85 CD GLU A 6 5.855 -16.569 8.082 1.00 1.48 C ATOM 86 OE1 GLU A 6 5.501 -16.512 9.280 1.00 2.21 O ATOM 87 OE2 GLU A 6 6.096 -17.641 7.489 1.00 1.55 O ATOM 0 H GLU A 6 5.924 -11.958 6.344 1.00 0.35 H new ATOM 0 HA GLU A 6 8.411 -12.788 7.189 1.00 0.35 H new ATOM 0 HB2 GLU A 6 8.135 -15.268 7.190 1.00 0.40 H new ATOM 0 HB3 GLU A 6 7.497 -14.465 8.611 1.00 0.40 H new ATOM 0 HG2 GLU A 6 5.204 -14.587 7.610 1.00 0.94 H new ATOM 0 HG3 GLU A 6 5.870 -15.467 6.249 1.00 0.94 H new ATOM 94 N GLU A 7 6.383 -13.554 4.706 1.00 0.38 N ATOM 95 CA GLU A 7 6.314 -13.708 3.263 1.00 0.40 C ATOM 96 C GLU A 7 6.871 -12.454 2.600 1.00 0.35 C ATOM 97 O GLU A 7 7.757 -12.525 1.744 1.00 0.33 O ATOM 98 CB GLU A 7 4.870 -13.960 2.821 1.00 0.46 C ATOM 99 CG GLU A 7 3.881 -12.915 3.311 1.00 0.49 C ATOM 100 CD GLU A 7 2.455 -13.222 2.897 1.00 0.56 C ATOM 101 OE1 GLU A 7 1.800 -14.035 3.582 1.00 0.62 O ATOM 102 OE2 GLU A 7 1.995 -12.652 1.884 1.00 0.60 O ATOM 0 H GLU A 7 5.478 -13.539 5.175 1.00 0.38 H new ATOM 0 HA GLU A 7 6.911 -14.568 2.960 1.00 0.40 H new ATOM 0 HB2 GLU A 7 4.835 -13.995 1.732 1.00 0.46 H new ATOM 0 HB3 GLU A 7 4.556 -14.939 3.182 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.934 -12.851 4.398 1.00 0.49 H new ATOM 0 HG3 GLU A 7 4.167 -11.938 2.920 1.00 0.49 H new ATOM 109 N GLN A 8 6.349 -11.304 3.014 1.00 0.33 N ATOM 110 CA GLN A 8 6.806 -10.028 2.496 1.00 0.30 C ATOM 111 C GLN A 8 8.272 -9.842 2.841 1.00 0.24 C ATOM 112 O GLN A 8 9.044 -9.253 2.076 1.00 0.22 O ATOM 113 CB GLN A 8 5.981 -8.896 3.097 1.00 0.32 C ATOM 114 CG GLN A 8 5.805 -9.023 4.598 1.00 0.32 C ATOM 115 CD GLN A 8 4.806 -8.028 5.165 1.00 0.36 C ATOM 116 OE1 GLN A 8 4.129 -8.310 6.153 1.00 0.85 O ATOM 117 NE2 GLN A 8 4.704 -6.856 4.545 1.00 0.57 N ATOM 0 H GLN A 8 5.606 -11.234 3.710 1.00 0.33 H new ATOM 0 HA GLN A 8 6.684 -10.012 1.413 1.00 0.30 H new ATOM 0 HB2 GLN A 8 6.462 -7.944 2.872 1.00 0.32 H new ATOM 0 HB3 GLN A 8 5.000 -8.877 2.622 1.00 0.32 H new ATOM 0 HG2 GLN A 8 5.476 -10.035 4.835 1.00 0.32 H new ATOM 0 HG3 GLN A 8 6.769 -8.879 5.085 1.00 0.32 H new ATOM 0 HE21 GLN A 8 5.283 -6.659 3.728 1.00 0.57 H new ATOM 0 HE22 GLN A 8 4.047 -6.154 4.886 1.00 0.57 H new ATOM 126 N ILE A 9 8.648 -10.370 4.002 1.00 0.22 N ATOM 127 CA ILE A 9 10.016 -10.285 4.471 1.00 0.18 C ATOM 128 C ILE A 9 10.921 -11.011 3.500 1.00 0.17 C ATOM 129 O ILE A 9 11.984 -10.519 3.130 1.00 0.15 O ATOM 130 CB ILE A 9 10.177 -10.889 5.881 1.00 0.20 C ATOM 131 CG1 ILE A 9 9.326 -10.105 6.885 1.00 0.21 C ATOM 132 CG2 ILE A 9 11.644 -10.886 6.296 1.00 0.21 C ATOM 133 CD1 ILE A 9 9.420 -10.621 8.306 1.00 0.24 C ATOM 0 H ILE A 9 8.017 -10.862 4.634 1.00 0.22 H new ATOM 0 HA ILE A 9 10.290 -9.232 4.529 1.00 0.18 H new ATOM 0 HB ILE A 9 9.832 -11.923 5.866 1.00 0.20 H new ATOM 0 HG12 ILE A 9 9.633 -9.059 6.868 1.00 0.21 H new ATOM 0 HG13 ILE A 9 8.284 -10.137 6.566 1.00 0.21 H new ATOM 0 HG21 ILE A 9 11.741 -11.315 7.293 1.00 0.21 H new ATOM 0 HG22 ILE A 9 12.224 -11.478 5.588 1.00 0.21 H new ATOM 0 HG23 ILE A 9 12.018 -9.862 6.304 1.00 0.21 H new ATOM 0 HD11 ILE A 9 8.790 -10.014 8.956 1.00 0.24 H new ATOM 0 HD12 ILE A 9 9.084 -11.657 8.340 1.00 0.24 H new ATOM 0 HD13 ILE A 9 10.454 -10.563 8.646 1.00 0.24 H new ATOM 145 N ALA A 10 10.468 -12.182 3.085 1.00 0.20 N ATOM 146 CA ALA A 10 11.209 -13.001 2.139 1.00 0.21 C ATOM 147 C ALA A 10 11.264 -12.315 0.784 1.00 0.20 C ATOM 148 O ALA A 10 12.123 -12.610 -0.045 1.00 0.19 O ATOM 149 CB ALA A 10 10.558 -14.369 2.011 1.00 0.26 C ATOM 0 H ALA A 10 9.584 -12.590 3.391 1.00 0.20 H new ATOM 0 HA ALA A 10 12.227 -13.131 2.506 1.00 0.21 H new ATOM 0 HB1 ALA A 10 11.120 -14.975 1.300 1.00 0.26 H new ATOM 0 HB2 ALA A 10 10.553 -14.862 2.983 1.00 0.26 H new ATOM 0 HB3 ALA A 10 9.533 -14.253 1.658 1.00 0.26 H new ATOM 155 N GLU A 11 10.327 -11.397 0.571 1.00 0.20 N ATOM 156 CA GLU A 11 10.245 -10.659 -0.687 1.00 0.21 C ATOM 157 C GLU A 11 11.416 -9.704 -0.858 1.00 0.18 C ATOM 158 O GLU A 11 12.330 -9.981 -1.631 1.00 0.18 O ATOM 159 CB GLU A 11 8.950 -9.863 -0.771 1.00 0.25 C ATOM 160 CG GLU A 11 8.460 -9.645 -2.193 1.00 0.29 C ATOM 161 CD GLU A 11 7.130 -8.919 -2.246 1.00 0.94 C ATOM 162 OE1 GLU A 11 6.083 -9.597 -2.191 1.00 0.84 O ATOM 163 OE2 GLU A 11 7.137 -7.675 -2.344 1.00 1.78 O ATOM 0 H GLU A 11 9.612 -11.145 1.254 1.00 0.20 H new ATOM 0 HA GLU A 11 10.273 -11.401 -1.485 1.00 0.21 H new ATOM 0 HB2 GLU A 11 8.177 -10.383 -0.205 1.00 0.25 H new ATOM 0 HB3 GLU A 11 9.097 -8.894 -0.294 1.00 0.25 H new ATOM 0 HG2 GLU A 11 9.205 -9.073 -2.746 1.00 0.29 H new ATOM 0 HG3 GLU A 11 8.364 -10.609 -2.692 1.00 0.29 H new ATOM 170 N PHE A 12 11.397 -8.570 -0.145 1.00 0.17 N ATOM 171 CA PHE A 12 12.489 -7.611 -0.288 1.00 0.17 C ATOM 172 C PHE A 12 13.804 -8.284 0.029 1.00 0.14 C ATOM 173 O PHE A 12 14.864 -7.845 -0.413 1.00 0.15 O ATOM 174 CB PHE A 12 12.295 -6.355 0.563 1.00 0.20 C ATOM 175 CG PHE A 12 11.865 -6.594 1.978 1.00 0.18 C ATOM 176 CD1 PHE A 12 10.527 -6.755 2.293 1.00 0.24 C ATOM 177 CD2 PHE A 12 12.803 -6.686 2.986 1.00 0.21 C ATOM 178 CE1 PHE A 12 10.134 -7.000 3.594 1.00 0.26 C ATOM 179 CE2 PHE A 12 12.420 -6.934 4.285 1.00 0.23 C ATOM 180 CZ PHE A 12 11.052 -6.983 4.600 1.00 0.21 C ATOM 0 H PHE A 12 10.664 -8.304 0.513 1.00 0.17 H new ATOM 0 HA PHE A 12 12.494 -7.274 -1.325 1.00 0.17 H new ATOM 0 HB2 PHE A 12 13.232 -5.798 0.576 1.00 0.20 H new ATOM 0 HB3 PHE A 12 11.553 -5.720 0.079 1.00 0.20 H new ATOM 0 HD1 PHE A 12 9.783 -6.688 1.513 1.00 0.24 H new ATOM 0 HD2 PHE A 12 13.850 -6.562 2.753 1.00 0.21 H new ATOM 0 HE1 PHE A 12 9.097 -7.205 3.814 1.00 0.26 H new ATOM 0 HE2 PHE A 12 13.163 -7.089 5.053 1.00 0.23 H new ATOM 0 HZ PHE A 12 10.731 -7.007 5.631 1.00 0.21 H new ATOM 190 N LYS A 13 13.729 -9.349 0.814 1.00 0.12 N ATOM 191 CA LYS A 13 14.909 -10.120 1.141 1.00 0.12 C ATOM 192 C LYS A 13 15.451 -10.749 -0.132 1.00 0.13 C ATOM 193 O LYS A 13 16.628 -10.614 -0.451 1.00 0.16 O ATOM 194 CB LYS A 13 14.573 -11.206 2.162 1.00 0.14 C ATOM 195 CG LYS A 13 15.661 -12.254 2.317 1.00 0.24 C ATOM 196 CD LYS A 13 16.925 -11.661 2.921 1.00 1.07 C ATOM 197 CE LYS A 13 18.111 -12.600 2.774 1.00 1.30 C ATOM 198 NZ LYS A 13 19.357 -12.012 3.340 1.00 2.27 N ATOM 0 H LYS A 13 12.865 -9.694 1.232 1.00 0.12 H new ATOM 0 HA LYS A 13 15.661 -9.464 1.579 1.00 0.12 H new ATOM 0 HB2 LYS A 13 14.390 -10.739 3.130 1.00 0.14 H new ATOM 0 HB3 LYS A 13 13.647 -11.698 1.865 1.00 0.14 H new ATOM 0 HG2 LYS A 13 15.300 -13.064 2.950 1.00 0.24 H new ATOM 0 HG3 LYS A 13 15.891 -12.688 1.344 1.00 0.24 H new ATOM 0 HD2 LYS A 13 17.150 -10.712 2.435 1.00 1.07 H new ATOM 0 HD3 LYS A 13 16.758 -11.447 3.977 1.00 1.07 H new ATOM 0 HE2 LYS A 13 17.893 -13.542 3.277 1.00 1.30 H new ATOM 0 HE3 LYS A 13 18.264 -12.830 1.719 1.00 1.30 H new ATOM 0 HZ1 LYS A 13 20.143 -12.683 3.220 1.00 2.27 H new ATOM 0 HZ2 LYS A 13 19.579 -11.126 2.843 1.00 2.27 H new ATOM 0 HZ3 LYS A 13 19.220 -11.816 4.352 1.00 2.27 H new ATOM 212 N ASP A 14 14.564 -11.418 -0.867 1.00 0.14 N ATOM 213 CA ASP A 14 14.935 -12.073 -2.114 1.00 0.16 C ATOM 214 C ASP A 14 15.337 -11.042 -3.162 1.00 0.16 C ATOM 215 O ASP A 14 16.206 -11.300 -3.994 1.00 0.17 O ATOM 216 CB ASP A 14 13.781 -12.944 -2.633 1.00 0.19 C ATOM 217 CG ASP A 14 12.783 -12.179 -3.485 1.00 0.20 C ATOM 218 OD1 ASP A 14 13.146 -11.780 -4.609 1.00 0.22 O ATOM 219 OD2 ASP A 14 11.643 -11.965 -3.020 1.00 0.22 O ATOM 0 H ASP A 14 13.580 -11.519 -0.617 1.00 0.14 H new ATOM 0 HA ASP A 14 15.791 -12.718 -1.919 1.00 0.16 H new ATOM 0 HB2 ASP A 14 14.192 -13.767 -3.218 1.00 0.19 H new ATOM 0 HB3 ASP A 14 13.259 -13.386 -1.784 1.00 0.19 H new ATOM 224 N ALA A 15 14.699 -9.872 -3.119 1.00 0.16 N ATOM 225 CA ALA A 15 15.005 -8.811 -4.070 1.00 0.17 C ATOM 226 C ALA A 15 16.395 -8.250 -3.808 1.00 0.16 C ATOM 227 O ALA A 15 17.174 -8.007 -4.726 1.00 0.20 O ATOM 228 CB ALA A 15 13.962 -7.708 -3.980 1.00 0.20 C ATOM 0 H ALA A 15 13.974 -9.639 -2.441 1.00 0.16 H new ATOM 0 HA ALA A 15 14.985 -9.228 -5.077 1.00 0.17 H new ATOM 0 HB1 ALA A 15 14.202 -6.921 -4.695 1.00 0.20 H new ATOM 0 HB2 ALA A 15 12.978 -8.118 -4.208 1.00 0.20 H new ATOM 0 HB3 ALA A 15 13.957 -7.293 -2.972 1.00 0.20 H new ATOM 234 N PHE A 16 16.682 -8.037 -2.535 1.00 0.14 N ATOM 235 CA PHE A 16 17.963 -7.504 -2.100 1.00 0.14 C ATOM 236 C PHE A 16 19.147 -8.345 -2.589 1.00 0.14 C ATOM 237 O PHE A 16 20.055 -7.834 -3.244 1.00 0.15 O ATOM 238 CB PHE A 16 17.971 -7.447 -0.574 1.00 0.15 C ATOM 239 CG PHE A 16 19.151 -6.728 -0.004 1.00 0.25 C ATOM 240 CD1 PHE A 16 19.177 -5.347 0.032 1.00 0.35 C ATOM 241 CD2 PHE A 16 20.226 -7.434 0.500 1.00 0.45 C ATOM 242 CE1 PHE A 16 20.260 -4.678 0.564 1.00 0.50 C ATOM 243 CE2 PHE A 16 21.314 -6.772 1.034 1.00 0.59 C ATOM 244 CZ PHE A 16 21.331 -5.390 1.066 1.00 0.59 C ATOM 0 H PHE A 16 16.033 -8.229 -1.772 1.00 0.14 H new ATOM 0 HA PHE A 16 18.080 -6.510 -2.531 1.00 0.14 H new ATOM 0 HB2 PHE A 16 17.059 -6.957 -0.233 1.00 0.15 H new ATOM 0 HB3 PHE A 16 17.952 -8.464 -0.181 1.00 0.15 H new ATOM 0 HD1 PHE A 16 18.342 -4.786 -0.360 1.00 0.35 H new ATOM 0 HD2 PHE A 16 20.216 -8.514 0.476 1.00 0.45 H new ATOM 0 HE1 PHE A 16 20.270 -3.598 0.588 1.00 0.50 H new ATOM 0 HE2 PHE A 16 22.150 -7.333 1.426 1.00 0.59 H new ATOM 0 HZ PHE A 16 22.180 -4.869 1.483 1.00 0.59 H new ATOM 254 N VAL A 17 19.126 -9.636 -2.263 1.00 0.16 N ATOM 255 CA VAL A 17 20.209 -10.549 -2.634 1.00 0.18 C ATOM 256 C VAL A 17 20.374 -10.655 -4.136 1.00 0.16 C ATOM 257 O VAL A 17 21.483 -10.590 -4.664 1.00 0.15 O ATOM 258 CB VAL A 17 19.958 -11.975 -2.086 1.00 0.22 C ATOM 259 CG1 VAL A 17 19.341 -11.908 -0.712 1.00 0.31 C ATOM 260 CG2 VAL A 17 19.065 -12.787 -3.018 1.00 0.28 C ATOM 0 H VAL A 17 18.368 -10.076 -1.741 1.00 0.16 H new ATOM 0 HA VAL A 17 21.114 -10.129 -2.195 1.00 0.18 H new ATOM 0 HB VAL A 17 20.923 -12.477 -2.024 1.00 0.22 H new ATOM 0 HG11 VAL A 17 19.170 -12.918 -0.340 1.00 0.31 H new ATOM 0 HG12 VAL A 17 20.015 -11.381 -0.036 1.00 0.31 H new ATOM 0 HG13 VAL A 17 18.391 -11.376 -0.765 1.00 0.31 H new ATOM 0 HG21 VAL A 17 18.912 -13.782 -2.600 1.00 0.28 H new ATOM 0 HG22 VAL A 17 18.103 -12.287 -3.127 1.00 0.28 H new ATOM 0 HG23 VAL A 17 19.542 -12.874 -3.994 1.00 0.28 H new ATOM 270 N GLN A 18 19.250 -10.794 -4.810 1.00 0.17 N ATOM 271 CA GLN A 18 19.225 -10.971 -6.238 1.00 0.18 C ATOM 272 C GLN A 18 19.816 -9.759 -6.951 1.00 0.15 C ATOM 273 O GLN A 18 20.124 -9.811 -8.141 1.00 0.18 O ATOM 274 CB GLN A 18 17.800 -11.266 -6.673 1.00 0.23 C ATOM 275 CG GLN A 18 16.922 -10.044 -6.779 1.00 0.19 C ATOM 276 CD GLN A 18 15.775 -10.242 -7.741 1.00 0.39 C ATOM 277 OE1 GLN A 18 15.877 -9.926 -8.927 1.00 1.02 O ATOM 278 NE2 GLN A 18 14.675 -10.775 -7.235 1.00 0.42 N ATOM 0 H GLN A 18 18.327 -10.787 -4.376 1.00 0.17 H new ATOM 0 HA GLN A 18 19.850 -11.819 -6.517 1.00 0.18 H new ATOM 0 HB2 GLN A 18 17.824 -11.768 -7.640 1.00 0.23 H new ATOM 0 HB3 GLN A 18 17.352 -11.962 -5.964 1.00 0.23 H new ATOM 0 HG2 GLN A 18 16.528 -9.797 -5.793 1.00 0.19 H new ATOM 0 HG3 GLN A 18 17.523 -9.195 -7.104 1.00 0.19 H new ATOM 0 HE21 GLN A 18 14.636 -11.021 -6.246 1.00 0.42 H new ATOM 0 HE22 GLN A 18 13.866 -10.940 -7.834 1.00 0.42 H new ATOM 287 N PHE A 19 19.965 -8.669 -6.207 1.00 0.12 N ATOM 288 CA PHE A 19 20.555 -7.450 -6.742 1.00 0.15 C ATOM 289 C PHE A 19 22.042 -7.387 -6.403 1.00 0.18 C ATOM 290 O PHE A 19 22.831 -6.787 -7.132 1.00 0.26 O ATOM 291 CB PHE A 19 19.834 -6.216 -6.192 1.00 0.16 C ATOM 292 CG PHE A 19 18.695 -5.754 -7.057 1.00 0.18 C ATOM 293 CD1 PHE A 19 17.634 -6.597 -7.343 1.00 0.26 C ATOM 294 CD2 PHE A 19 18.693 -4.478 -7.593 1.00 0.23 C ATOM 295 CE1 PHE A 19 16.591 -6.177 -8.145 1.00 0.28 C ATOM 296 CE2 PHE A 19 17.653 -4.051 -8.397 1.00 0.25 C ATOM 297 CZ PHE A 19 16.601 -4.901 -8.673 1.00 0.24 C ATOM 0 H PHE A 19 19.684 -8.606 -5.229 1.00 0.12 H new ATOM 0 HA PHE A 19 20.443 -7.461 -7.826 1.00 0.15 H new ATOM 0 HB2 PHE A 19 19.455 -6.440 -5.195 1.00 0.16 H new ATOM 0 HB3 PHE A 19 20.552 -5.403 -6.085 1.00 0.16 H new ATOM 0 HD1 PHE A 19 17.622 -7.596 -6.933 1.00 0.26 H new ATOM 0 HD2 PHE A 19 19.513 -3.808 -7.381 1.00 0.23 H new ATOM 0 HE1 PHE A 19 15.770 -6.845 -8.359 1.00 0.28 H new ATOM 0 HE2 PHE A 19 17.663 -3.053 -8.809 1.00 0.25 H new ATOM 0 HZ PHE A 19 15.787 -4.569 -9.301 1.00 0.24 H new ATOM 307 N ASP A 20 22.415 -8.014 -5.287 1.00 0.15 N ATOM 308 CA ASP A 20 23.808 -8.036 -4.848 1.00 0.19 C ATOM 309 C ASP A 20 24.527 -9.299 -5.318 1.00 0.27 C ATOM 310 O ASP A 20 25.308 -9.261 -6.267 1.00 0.37 O ATOM 311 CB ASP A 20 23.885 -7.949 -3.321 1.00 0.20 C ATOM 312 CG ASP A 20 25.273 -8.263 -2.801 1.00 0.29 C ATOM 313 OD1 ASP A 20 26.235 -7.598 -3.238 1.00 0.34 O ATOM 314 OD2 ASP A 20 25.397 -9.172 -1.954 1.00 0.40 O ATOM 0 H ASP A 20 21.772 -8.512 -4.672 1.00 0.15 H new ATOM 0 HA ASP A 20 24.303 -7.173 -5.293 1.00 0.19 H new ATOM 0 HB2 ASP A 20 23.596 -6.948 -3.000 1.00 0.20 H new ATOM 0 HB3 ASP A 20 23.168 -8.643 -2.882 1.00 0.20 H new ATOM 319 N LYS A 21 24.234 -10.416 -4.653 1.00 0.35 N ATOM 320 CA LYS A 21 24.859 -11.704 -4.967 1.00 0.45 C ATOM 321 C LYS A 21 26.358 -11.550 -5.226 1.00 0.46 C ATOM 322 O LYS A 21 26.850 -11.866 -6.309 1.00 0.84 O ATOM 323 CB LYS A 21 24.179 -12.367 -6.169 1.00 0.53 C ATOM 324 CG LYS A 21 22.871 -13.069 -5.829 1.00 0.61 C ATOM 325 CD LYS A 21 23.089 -14.235 -4.875 1.00 0.69 C ATOM 326 CE LYS A 21 21.775 -14.910 -4.512 1.00 0.83 C ATOM 327 NZ LYS A 21 21.982 -16.090 -3.625 1.00 1.65 N ATOM 0 H LYS A 21 23.562 -10.456 -3.887 1.00 0.35 H new ATOM 0 HA LYS A 21 24.729 -12.347 -4.097 1.00 0.45 H new ATOM 0 HB2 LYS A 21 23.986 -11.609 -6.928 1.00 0.53 H new ATOM 0 HB3 LYS A 21 24.865 -13.091 -6.608 1.00 0.53 H new ATOM 0 HG2 LYS A 21 22.181 -12.355 -5.379 1.00 0.61 H new ATOM 0 HG3 LYS A 21 22.403 -13.431 -6.745 1.00 0.61 H new ATOM 0 HD2 LYS A 21 23.758 -14.962 -5.334 1.00 0.69 H new ATOM 0 HD3 LYS A 21 23.579 -13.879 -3.969 1.00 0.69 H new ATOM 0 HE2 LYS A 21 21.123 -14.192 -4.014 1.00 0.83 H new ATOM 0 HE3 LYS A 21 21.265 -15.225 -5.422 1.00 0.83 H new ATOM 0 HZ1 LYS A 21 21.063 -16.521 -3.401 1.00 1.65 H new ATOM 0 HZ2 LYS A 21 22.583 -16.787 -4.109 1.00 1.65 H new ATOM 0 HZ3 LYS A 21 22.445 -15.786 -2.745 1.00 1.65 H new ATOM 341 N GLU A 22 27.076 -11.067 -4.213 1.00 0.42 N ATOM 342 CA GLU A 22 28.523 -10.879 -4.306 1.00 0.47 C ATOM 343 C GLU A 22 29.176 -11.032 -2.935 1.00 0.45 C ATOM 344 O GLU A 22 30.381 -10.827 -2.785 1.00 0.53 O ATOM 345 CB GLU A 22 28.861 -9.500 -4.879 1.00 0.46 C ATOM 346 CG GLU A 22 28.455 -9.322 -6.333 1.00 0.66 C ATOM 347 CD GLU A 22 28.752 -7.930 -6.854 1.00 1.52 C ATOM 348 OE1 GLU A 22 27.890 -7.041 -6.695 1.00 2.47 O ATOM 349 OE2 GLU A 22 29.847 -7.729 -7.421 1.00 1.49 O ATOM 0 H GLU A 22 26.677 -10.798 -3.314 1.00 0.42 H new ATOM 0 HA GLU A 22 28.912 -11.645 -4.976 1.00 0.47 H new ATOM 0 HB2 GLU A 22 28.367 -8.736 -4.278 1.00 0.46 H new ATOM 0 HB3 GLU A 22 29.934 -9.333 -4.788 1.00 0.46 H new ATOM 0 HG2 GLU A 22 28.980 -10.055 -6.945 1.00 0.66 H new ATOM 0 HG3 GLU A 22 27.389 -9.525 -6.436 1.00 0.66 H new ATOM 356 N GLY A 23 28.373 -11.392 -1.937 1.00 0.48 N ATOM 357 CA GLY A 23 28.892 -11.559 -0.592 1.00 0.51 C ATOM 358 C GLY A 23 28.647 -10.337 0.268 1.00 0.45 C ATOM 359 O GLY A 23 28.440 -10.448 1.477 1.00 0.72 O ATOM 0 H GLY A 23 27.374 -11.571 -2.036 1.00 0.48 H new ATOM 0 HA2 GLY A 23 28.424 -12.428 -0.129 1.00 0.51 H new ATOM 0 HA3 GLY A 23 29.962 -11.760 -0.639 1.00 0.51 H new ATOM 363 N THR A 24 28.670 -9.166 -0.361 1.00 0.33 N ATOM 364 CA THR A 24 28.447 -7.911 0.343 1.00 0.33 C ATOM 365 C THR A 24 26.980 -7.500 0.253 1.00 0.27 C ATOM 366 O THR A 24 26.557 -6.893 -0.727 1.00 0.25 O ATOM 367 CB THR A 24 29.333 -6.785 -0.231 1.00 0.43 C ATOM 368 OG1 THR A 24 28.830 -6.354 -1.502 1.00 0.52 O ATOM 369 CG2 THR A 24 30.769 -7.261 -0.396 1.00 0.44 C ATOM 0 H THR A 24 28.842 -9.062 -1.361 1.00 0.33 H new ATOM 0 HA THR A 24 28.715 -8.068 1.388 1.00 0.33 H new ATOM 0 HB THR A 24 29.312 -5.951 0.470 1.00 0.43 H new ATOM 0 HG1 THR A 24 27.930 -5.983 -1.389 1.00 0.52 H new ATOM 0 HG21 THR A 24 31.376 -6.452 -0.802 1.00 0.44 H new ATOM 0 HG22 THR A 24 31.166 -7.562 0.573 1.00 0.44 H new ATOM 0 HG23 THR A 24 30.794 -8.111 -1.078 1.00 0.44 H new ATOM 377 N GLY A 25 26.209 -7.845 1.279 1.00 0.27 N ATOM 378 CA GLY A 25 24.793 -7.517 1.292 1.00 0.24 C ATOM 379 C GLY A 25 24.516 -6.035 1.414 1.00 0.20 C ATOM 380 O GLY A 25 24.048 -5.569 2.454 1.00 0.21 O ATOM 0 H GLY A 25 26.539 -8.347 2.104 1.00 0.27 H new ATOM 0 HA2 GLY A 25 24.334 -7.890 0.376 1.00 0.24 H new ATOM 0 HA3 GLY A 25 24.316 -8.037 2.123 1.00 0.24 H new ATOM 384 N LYS A 26 24.805 -5.294 0.353 1.00 0.16 N ATOM 385 CA LYS A 26 24.564 -3.860 0.328 1.00 0.14 C ATOM 386 C LYS A 26 24.341 -3.405 -1.105 1.00 0.14 C ATOM 387 O LYS A 26 25.235 -3.507 -1.946 1.00 0.17 O ATOM 388 CB LYS A 26 25.725 -3.064 0.937 1.00 0.17 C ATOM 389 CG LYS A 26 26.427 -3.755 2.094 1.00 0.37 C ATOM 390 CD LYS A 26 27.708 -3.031 2.479 1.00 0.50 C ATOM 391 CE LYS A 26 28.309 -3.603 3.753 1.00 0.56 C ATOM 392 NZ LYS A 26 28.657 -5.042 3.606 1.00 1.37 N ATOM 0 H LYS A 26 25.209 -5.666 -0.506 1.00 0.16 H new ATOM 0 HA LYS A 26 23.677 -3.668 0.932 1.00 0.14 H new ATOM 0 HB2 LYS A 26 26.457 -2.858 0.156 1.00 0.17 H new ATOM 0 HB3 LYS A 26 25.347 -2.101 1.281 1.00 0.17 H new ATOM 0 HG2 LYS A 26 25.759 -3.797 2.954 1.00 0.37 H new ATOM 0 HG3 LYS A 26 26.658 -4.784 1.819 1.00 0.37 H new ATOM 0 HD2 LYS A 26 28.431 -3.111 1.667 1.00 0.50 H new ATOM 0 HD3 LYS A 26 27.500 -1.970 2.618 1.00 0.50 H new ATOM 0 HE2 LYS A 26 29.203 -3.039 4.018 1.00 0.56 H new ATOM 0 HE3 LYS A 26 27.602 -3.483 4.574 1.00 0.56 H new ATOM 0 HZ1 LYS A 26 29.170 -5.363 4.452 1.00 1.37 H new ATOM 0 HZ2 LYS A 26 27.786 -5.600 3.497 1.00 1.37 H new ATOM 0 HZ3 LYS A 26 29.258 -5.170 2.767 1.00 1.37 H new ATOM 406 N ILE A 27 23.147 -2.905 -1.378 1.00 0.16 N ATOM 407 CA ILE A 27 22.810 -2.436 -2.720 1.00 0.19 C ATOM 408 C ILE A 27 22.993 -0.930 -2.835 1.00 0.19 C ATOM 409 O ILE A 27 22.766 -0.195 -1.882 1.00 0.22 O ATOM 410 CB ILE A 27 21.365 -2.794 -3.111 1.00 0.23 C ATOM 411 CG1 ILE A 27 20.382 -2.249 -2.076 1.00 0.28 C ATOM 412 CG2 ILE A 27 21.210 -4.300 -3.256 1.00 0.32 C ATOM 413 CD1 ILE A 27 19.022 -1.924 -2.648 1.00 0.34 C ATOM 0 H ILE A 27 22.395 -2.812 -0.695 1.00 0.16 H new ATOM 0 HA ILE A 27 23.492 -2.942 -3.403 1.00 0.19 H new ATOM 0 HB ILE A 27 21.142 -2.333 -4.073 1.00 0.23 H new ATOM 0 HG12 ILE A 27 20.266 -2.981 -1.277 1.00 0.28 H new ATOM 0 HG13 ILE A 27 20.802 -1.350 -1.626 1.00 0.28 H new ATOM 0 HG21 ILE A 27 20.182 -4.535 -3.533 1.00 0.32 H new ATOM 0 HG22 ILE A 27 21.886 -4.662 -4.030 1.00 0.32 H new ATOM 0 HG23 ILE A 27 21.450 -4.783 -2.309 1.00 0.32 H new ATOM 0 HD11 ILE A 27 18.376 -1.542 -1.857 1.00 0.34 H new ATOM 0 HD12 ILE A 27 19.126 -1.169 -3.427 1.00 0.34 H new ATOM 0 HD13 ILE A 27 18.581 -2.826 -3.073 1.00 0.34 H new ATOM 425 N ALA A 28 23.388 -0.476 -4.016 1.00 0.19 N ATOM 426 CA ALA A 28 23.609 0.945 -4.256 1.00 0.21 C ATOM 427 C ALA A 28 22.295 1.714 -4.220 1.00 0.20 C ATOM 428 O ALA A 28 21.291 1.280 -4.784 1.00 0.20 O ATOM 429 CB ALA A 28 24.312 1.156 -5.588 1.00 0.23 C ATOM 0 H ALA A 28 23.563 -1.072 -4.825 1.00 0.19 H new ATOM 0 HA ALA A 28 24.248 1.328 -3.460 1.00 0.21 H new ATOM 0 HB1 ALA A 28 24.469 2.222 -5.752 1.00 0.23 H new ATOM 0 HB2 ALA A 28 25.275 0.645 -5.576 1.00 0.23 H new ATOM 0 HB3 ALA A 28 23.697 0.752 -6.392 1.00 0.23 H new ATOM 435 N THR A 29 22.315 2.857 -3.537 1.00 0.21 N ATOM 436 CA THR A 29 21.136 3.706 -3.407 1.00 0.22 C ATOM 437 C THR A 29 20.574 4.099 -4.770 1.00 0.22 C ATOM 438 O THR A 29 19.374 4.335 -4.909 1.00 0.22 O ATOM 439 CB THR A 29 21.456 4.984 -2.611 1.00 0.26 C ATOM 440 OG1 THR A 29 22.386 5.797 -3.339 1.00 0.28 O ATOM 441 CG2 THR A 29 22.038 4.640 -1.251 1.00 0.28 C ATOM 0 H THR A 29 23.143 3.217 -3.062 1.00 0.21 H new ATOM 0 HA THR A 29 20.388 3.122 -2.870 1.00 0.22 H new ATOM 0 HB THR A 29 20.527 5.536 -2.465 1.00 0.26 H new ATOM 0 HG1 THR A 29 22.936 6.308 -2.709 1.00 0.28 H new ATOM 0 HG21 THR A 29 22.257 5.558 -0.706 1.00 0.28 H new ATOM 0 HG22 THR A 29 21.319 4.046 -0.687 1.00 0.28 H new ATOM 0 HG23 THR A 29 22.957 4.069 -1.382 1.00 0.28 H new ATOM 449 N ARG A 30 21.447 4.175 -5.772 1.00 0.23 N ATOM 450 CA ARG A 30 21.031 4.535 -7.124 1.00 0.25 C ATOM 451 C ARG A 30 20.135 3.454 -7.725 1.00 0.26 C ATOM 452 O ARG A 30 19.644 3.589 -8.846 1.00 0.43 O ATOM 453 CB ARG A 30 22.254 4.753 -8.019 1.00 0.29 C ATOM 454 CG ARG A 30 23.174 3.545 -8.103 1.00 1.36 C ATOM 455 CD ARG A 30 24.321 3.788 -9.072 1.00 1.46 C ATOM 456 NE ARG A 30 25.242 2.657 -9.126 1.00 1.85 N ATOM 457 CZ ARG A 30 26.060 2.420 -10.148 1.00 2.23 C ATOM 458 NH1 ARG A 30 26.065 3.230 -11.199 1.00 2.10 N ATOM 459 NH2 ARG A 30 26.871 1.372 -10.120 1.00 3.19 N ATOM 0 H ARG A 30 22.446 3.992 -5.673 1.00 0.23 H new ATOM 0 HA ARG A 30 20.463 5.463 -7.065 1.00 0.25 H new ATOM 0 HB2 ARG A 30 21.917 5.012 -9.023 1.00 0.29 H new ATOM 0 HB3 ARG A 30 22.821 5.605 -7.643 1.00 0.29 H new ATOM 0 HG2 ARG A 30 23.573 3.320 -7.114 1.00 1.36 H new ATOM 0 HG3 ARG A 30 22.604 2.673 -8.423 1.00 1.36 H new ATOM 0 HD2 ARG A 30 23.920 3.977 -10.068 1.00 1.46 H new ATOM 0 HD3 ARG A 30 24.865 4.684 -8.772 1.00 1.46 H new ATOM 0 HE ARG A 30 25.259 2.012 -8.336 1.00 1.85 H new ATOM 0 HH11 ARG A 30 25.441 4.036 -11.224 1.00 2.10 H new ATOM 0 HH12 ARG A 30 26.693 3.046 -11.981 1.00 2.10 H new ATOM 0 HH21 ARG A 30 26.868 0.746 -9.314 1.00 3.19 H new ATOM 0 HH22 ARG A 30 27.498 1.191 -10.904 1.00 3.19 H new ATOM 473 N GLU A 31 19.927 2.382 -6.968 1.00 0.17 N ATOM 474 CA GLU A 31 19.095 1.272 -7.414 1.00 0.18 C ATOM 475 C GLU A 31 18.160 0.818 -6.291 1.00 0.16 C ATOM 476 O GLU A 31 17.688 -0.319 -6.277 1.00 0.18 O ATOM 477 CB GLU A 31 19.982 0.113 -7.875 1.00 0.20 C ATOM 478 CG GLU A 31 19.249 -0.933 -8.699 1.00 0.26 C ATOM 479 CD GLU A 31 20.194 -1.901 -9.382 1.00 0.29 C ATOM 480 OE1 GLU A 31 20.893 -2.652 -8.669 1.00 0.28 O ATOM 481 OE2 GLU A 31 20.235 -1.911 -10.629 1.00 0.44 O ATOM 0 H GLU A 31 20.326 2.259 -6.037 1.00 0.17 H new ATOM 0 HA GLU A 31 18.483 1.604 -8.253 1.00 0.18 H new ATOM 0 HB2 GLU A 31 20.808 0.512 -8.464 1.00 0.20 H new ATOM 0 HB3 GLU A 31 20.418 -0.368 -7.000 1.00 0.20 H new ATOM 0 HG2 GLU A 31 18.569 -1.489 -8.053 1.00 0.26 H new ATOM 0 HG3 GLU A 31 18.638 -0.435 -9.452 1.00 0.26 H new ATOM 488 N LEU A 32 17.901 1.724 -5.351 1.00 0.17 N ATOM 489 CA LEU A 32 17.026 1.437 -4.217 1.00 0.19 C ATOM 490 C LEU A 32 15.557 1.507 -4.626 1.00 0.18 C ATOM 491 O LEU A 32 14.758 0.624 -4.291 1.00 0.17 O ATOM 492 CB LEU A 32 17.298 2.428 -3.081 1.00 0.24 C ATOM 493 CG LEU A 32 16.268 2.420 -1.950 1.00 0.29 C ATOM 494 CD1 LEU A 32 16.172 1.041 -1.327 1.00 0.39 C ATOM 495 CD2 LEU A 32 16.623 3.457 -0.897 1.00 0.38 C ATOM 0 H LEU A 32 18.287 2.668 -5.353 1.00 0.17 H new ATOM 0 HA LEU A 32 17.237 0.425 -3.873 1.00 0.19 H new ATOM 0 HB2 LEU A 32 18.279 2.212 -2.659 1.00 0.24 H new ATOM 0 HB3 LEU A 32 17.346 3.433 -3.500 1.00 0.24 H new ATOM 0 HG LEU A 32 15.295 2.676 -2.370 1.00 0.29 H new ATOM 0 HD11 LEU A 32 15.435 1.055 -0.524 1.00 0.39 H new ATOM 0 HD12 LEU A 32 15.869 0.319 -2.086 1.00 0.39 H new ATOM 0 HD13 LEU A 32 17.143 0.756 -0.922 1.00 0.39 H new ATOM 0 HD21 LEU A 32 15.879 3.436 -0.101 1.00 0.38 H new ATOM 0 HD22 LEU A 32 17.605 3.232 -0.482 1.00 0.38 H new ATOM 0 HD23 LEU A 32 16.640 4.447 -1.352 1.00 0.38 H new ATOM 507 N GLY A 33 15.208 2.575 -5.338 1.00 0.22 N ATOM 508 CA GLY A 33 13.843 2.754 -5.794 1.00 0.23 C ATOM 509 C GLY A 33 13.303 1.511 -6.468 1.00 0.20 C ATOM 510 O GLY A 33 12.113 1.213 -6.375 1.00 0.19 O ATOM 0 H GLY A 33 15.849 3.321 -5.607 1.00 0.22 H new ATOM 0 HA2 GLY A 33 13.208 3.011 -4.946 1.00 0.23 H new ATOM 0 HA3 GLY A 33 13.800 3.592 -6.490 1.00 0.23 H new ATOM 514 N THR A 34 14.186 0.782 -7.141 1.00 0.19 N ATOM 515 CA THR A 34 13.803 -0.434 -7.843 1.00 0.18 C ATOM 516 C THR A 34 13.146 -1.447 -6.907 1.00 0.16 C ATOM 517 O THR A 34 12.064 -1.953 -7.197 1.00 0.17 O ATOM 518 CB THR A 34 15.019 -1.093 -8.520 1.00 0.21 C ATOM 519 OG1 THR A 34 15.734 -0.123 -9.294 1.00 0.26 O ATOM 520 CG2 THR A 34 14.577 -2.237 -9.421 1.00 0.23 C ATOM 0 H THR A 34 15.176 1.015 -7.214 1.00 0.19 H new ATOM 0 HA THR A 34 13.080 -0.138 -8.603 1.00 0.18 H new ATOM 0 HB THR A 34 15.671 -1.490 -7.742 1.00 0.21 H new ATOM 0 HG1 THR A 34 16.407 -0.575 -9.844 1.00 0.26 H new ATOM 0 HG21 THR A 34 15.451 -2.689 -9.890 1.00 0.23 H new ATOM 0 HG22 THR A 34 14.055 -2.987 -8.827 1.00 0.23 H new ATOM 0 HG23 THR A 34 13.908 -1.855 -10.192 1.00 0.23 H new ATOM 528 N LEU A 35 13.804 -1.745 -5.787 1.00 0.13 N ATOM 529 CA LEU A 35 13.270 -2.710 -4.827 1.00 0.12 C ATOM 530 C LEU A 35 11.963 -2.248 -4.209 1.00 0.14 C ATOM 531 O LEU A 35 10.955 -2.945 -4.312 1.00 0.15 O ATOM 532 CB LEU A 35 14.286 -3.005 -3.722 1.00 0.13 C ATOM 533 CG LEU A 35 15.201 -4.204 -3.986 1.00 0.14 C ATOM 534 CD1 LEU A 35 15.658 -4.225 -5.433 1.00 0.18 C ATOM 535 CD2 LEU A 35 16.394 -4.177 -3.046 1.00 0.20 C ATOM 0 H LEU A 35 14.700 -1.336 -5.524 1.00 0.13 H new ATOM 0 HA LEU A 35 13.071 -3.624 -5.387 1.00 0.12 H new ATOM 0 HB2 LEU A 35 14.905 -2.120 -3.573 1.00 0.13 H new ATOM 0 HB3 LEU A 35 13.747 -3.177 -2.790 1.00 0.13 H new ATOM 0 HG LEU A 35 14.634 -5.116 -3.798 1.00 0.14 H new ATOM 0 HD11 LEU A 35 16.307 -5.085 -5.597 1.00 0.18 H new ATOM 0 HD12 LEU A 35 14.789 -4.295 -6.088 1.00 0.18 H new ATOM 0 HD13 LEU A 35 16.206 -3.309 -5.655 1.00 0.18 H new ATOM 0 HD21 LEU A 35 17.035 -5.036 -3.246 1.00 0.20 H new ATOM 0 HD22 LEU A 35 16.959 -3.258 -3.202 1.00 0.20 H new ATOM 0 HD23 LEU A 35 16.045 -4.218 -2.014 1.00 0.20 H new ATOM 547 N MET A 36 11.961 -1.071 -3.586 1.00 0.17 N ATOM 548 CA MET A 36 10.740 -0.581 -2.951 1.00 0.21 C ATOM 549 C MET A 36 9.574 -0.642 -3.930 1.00 0.23 C ATOM 550 O MET A 36 8.440 -0.914 -3.538 1.00 0.26 O ATOM 551 CB MET A 36 10.923 0.829 -2.390 1.00 0.25 C ATOM 552 CG MET A 36 11.813 1.727 -3.226 1.00 0.21 C ATOM 553 SD MET A 36 12.494 3.096 -2.268 1.00 0.30 S ATOM 554 CE MET A 36 11.032 3.681 -1.412 1.00 0.73 C ATOM 0 H MET A 36 12.769 -0.453 -3.508 1.00 0.17 H new ATOM 0 HA MET A 36 10.514 -1.232 -2.106 1.00 0.21 H new ATOM 0 HB2 MET A 36 9.944 1.298 -2.293 1.00 0.25 H new ATOM 0 HB3 MET A 36 11.342 0.756 -1.386 1.00 0.25 H new ATOM 0 HG2 MET A 36 12.629 1.138 -3.645 1.00 0.21 H new ATOM 0 HG3 MET A 36 11.241 2.122 -4.065 1.00 0.21 H new ATOM 0 HE1 MET A 36 11.137 4.745 -1.198 1.00 0.73 H new ATOM 0 HE2 MET A 36 10.155 3.522 -2.040 1.00 0.73 H new ATOM 0 HE3 MET A 36 10.914 3.132 -0.478 1.00 0.73 H new ATOM 564 N ARG A 37 9.857 -0.390 -5.206 1.00 0.23 N ATOM 565 CA ARG A 37 8.826 -0.465 -6.234 1.00 0.27 C ATOM 566 C ARG A 37 8.391 -1.915 -6.421 1.00 0.25 C ATOM 567 O ARG A 37 7.200 -2.226 -6.408 1.00 0.28 O ATOM 568 CB ARG A 37 9.341 0.098 -7.561 1.00 0.31 C ATOM 569 CG ARG A 37 9.460 1.613 -7.576 1.00 0.37 C ATOM 570 CD ARG A 37 10.064 2.112 -8.879 1.00 0.43 C ATOM 571 NE ARG A 37 10.182 3.567 -8.906 1.00 0.53 N ATOM 572 CZ ARG A 37 10.711 4.247 -9.920 1.00 0.71 C ATOM 573 NH1 ARG A 37 11.168 3.606 -10.988 1.00 0.94 N ATOM 574 NH2 ARG A 37 10.784 5.570 -9.866 1.00 0.79 N ATOM 0 H ARG A 37 10.783 -0.135 -5.549 1.00 0.23 H new ATOM 0 HA ARG A 37 7.973 0.133 -5.914 1.00 0.27 H new ATOM 0 HB2 ARG A 37 10.317 -0.337 -7.776 1.00 0.31 H new ATOM 0 HB3 ARG A 37 8.671 -0.213 -8.362 1.00 0.31 H new ATOM 0 HG2 ARG A 37 8.475 2.058 -7.437 1.00 0.37 H new ATOM 0 HG3 ARG A 37 10.078 1.939 -6.739 1.00 0.37 H new ATOM 0 HD2 ARG A 37 11.049 1.666 -9.016 1.00 0.43 H new ATOM 0 HD3 ARG A 37 9.446 1.783 -9.714 1.00 0.43 H new ATOM 0 HE ARG A 37 9.839 4.092 -8.102 1.00 0.53 H new ATOM 0 HH11 ARG A 37 11.114 2.588 -11.034 1.00 0.94 H new ATOM 0 HH12 ARG A 37 11.573 4.131 -11.763 1.00 0.94 H new ATOM 0 HH21 ARG A 37 10.435 6.067 -9.047 1.00 0.79 H new ATOM 0 HH22 ARG A 37 11.190 6.091 -10.644 1.00 0.79 H new ATOM 588 N THR A 38 9.376 -2.798 -6.596 1.00 0.24 N ATOM 589 CA THR A 38 9.118 -4.223 -6.767 1.00 0.29 C ATOM 590 C THR A 38 8.325 -4.764 -5.582 1.00 0.26 C ATOM 591 O THR A 38 7.690 -5.815 -5.667 1.00 0.32 O ATOM 592 CB THR A 38 10.434 -5.020 -6.904 1.00 0.38 C ATOM 593 OG1 THR A 38 11.258 -4.433 -7.918 1.00 1.07 O ATOM 594 CG2 THR A 38 10.160 -6.477 -7.254 1.00 0.67 C ATOM 0 H THR A 38 10.364 -2.546 -6.623 1.00 0.24 H new ATOM 0 HA THR A 38 8.539 -4.344 -7.683 1.00 0.29 H new ATOM 0 HB THR A 38 10.950 -4.985 -5.945 1.00 0.38 H new ATOM 0 HG1 THR A 38 11.639 -3.594 -7.585 1.00 1.07 H new ATOM 0 HG21 THR A 38 11.105 -7.013 -7.344 1.00 0.67 H new ATOM 0 HG22 THR A 38 9.557 -6.933 -6.468 1.00 0.67 H new ATOM 0 HG23 THR A 38 9.622 -6.529 -8.200 1.00 0.67 H new ATOM 602 N LEU A 39 8.369 -4.026 -4.476 1.00 0.21 N ATOM 603 CA LEU A 39 7.651 -4.406 -3.269 1.00 0.26 C ATOM 604 C LEU A 39 6.190 -3.975 -3.357 1.00 0.33 C ATOM 605 O LEU A 39 5.284 -4.794 -3.214 1.00 0.83 O ATOM 606 CB LEU A 39 8.313 -3.791 -2.030 1.00 0.24 C ATOM 607 CG LEU A 39 9.373 -4.659 -1.350 1.00 0.25 C ATOM 608 CD1 LEU A 39 10.571 -4.878 -2.260 1.00 0.29 C ATOM 609 CD2 LEU A 39 9.804 -4.014 -0.044 1.00 0.41 C ATOM 0 H LEU A 39 8.898 -3.158 -4.394 1.00 0.21 H new ATOM 0 HA LEU A 39 7.688 -5.492 -3.178 1.00 0.26 H new ATOM 0 HB2 LEU A 39 8.773 -2.845 -2.317 1.00 0.24 H new ATOM 0 HB3 LEU A 39 7.536 -3.560 -1.301 1.00 0.24 H new ATOM 0 HG LEU A 39 8.937 -5.635 -1.139 1.00 0.25 H new ATOM 0 HD11 LEU A 39 11.307 -5.498 -1.749 1.00 0.29 H new ATOM 0 HD12 LEU A 39 10.248 -5.377 -3.174 1.00 0.29 H new ATOM 0 HD13 LEU A 39 11.018 -3.916 -2.511 1.00 0.29 H new ATOM 0 HD21 LEU A 39 10.559 -4.636 0.437 1.00 0.41 H new ATOM 0 HD22 LEU A 39 10.221 -3.027 -0.246 1.00 0.41 H new ATOM 0 HD23 LEU A 39 8.942 -3.915 0.615 1.00 0.41 H new ATOM 621 N GLY A 40 5.969 -2.684 -3.591 1.00 0.48 N ATOM 622 CA GLY A 40 4.614 -2.174 -3.699 1.00 0.54 C ATOM 623 C GLY A 40 4.554 -0.659 -3.718 1.00 0.44 C ATOM 624 O GLY A 40 3.693 -0.074 -4.375 1.00 0.56 O ATOM 0 H GLY A 40 6.702 -1.984 -3.707 1.00 0.48 H new ATOM 0 HA2 GLY A 40 4.156 -2.562 -4.609 1.00 0.54 H new ATOM 0 HA3 GLY A 40 4.023 -2.546 -2.862 1.00 0.54 H new ATOM 628 N GLN A 41 5.471 -0.025 -2.995 1.00 0.41 N ATOM 629 CA GLN A 41 5.515 1.431 -2.917 1.00 0.37 C ATOM 630 C GLN A 41 6.539 2.008 -3.889 1.00 0.29 C ATOM 631 O GLN A 41 7.709 1.625 -3.872 1.00 0.35 O ATOM 632 CB GLN A 41 5.856 1.873 -1.493 1.00 0.47 C ATOM 633 CG GLN A 41 4.784 1.538 -0.467 1.00 0.66 C ATOM 634 CD GLN A 41 4.612 0.045 -0.257 1.00 0.90 C ATOM 635 OE1 GLN A 41 3.789 -0.594 -0.911 1.00 1.79 O ATOM 636 NE2 GLN A 41 5.392 -0.516 0.660 1.00 0.85 N ATOM 0 H GLN A 41 6.195 -0.497 -2.454 1.00 0.41 H new ATOM 0 HA GLN A 41 4.530 1.808 -3.191 1.00 0.37 H new ATOM 0 HB2 GLN A 41 6.792 1.402 -1.192 1.00 0.47 H new ATOM 0 HB3 GLN A 41 6.025 2.950 -1.489 1.00 0.47 H new ATOM 0 HG2 GLN A 41 5.039 2.006 0.484 1.00 0.66 H new ATOM 0 HG3 GLN A 41 3.835 1.966 -0.788 1.00 0.66 H new ATOM 0 HE21 GLN A 41 6.061 0.054 1.178 1.00 0.85 H new ATOM 0 HE22 GLN A 41 5.322 -1.517 0.846 1.00 0.85 H new ATOM 645 N ASN A 42 6.093 2.933 -4.732 1.00 0.34 N ATOM 646 CA ASN A 42 6.974 3.570 -5.703 1.00 0.29 C ATOM 647 C ASN A 42 7.422 4.944 -5.199 1.00 0.31 C ATOM 648 O ASN A 42 6.606 5.856 -5.067 1.00 0.36 O ATOM 649 CB ASN A 42 6.255 3.714 -7.045 1.00 0.34 C ATOM 650 CG ASN A 42 5.776 2.382 -7.588 1.00 0.43 C ATOM 651 OD1 ASN A 42 6.458 1.743 -8.389 1.00 1.03 O ATOM 652 ND2 ASN A 42 4.599 1.952 -7.147 1.00 0.96 N ATOM 0 H ASN A 42 5.127 3.258 -4.762 1.00 0.34 H new ATOM 0 HA ASN A 42 7.856 2.944 -5.836 1.00 0.29 H new ATOM 0 HB2 ASN A 42 5.403 4.384 -6.928 1.00 0.34 H new ATOM 0 HB3 ASN A 42 6.928 4.177 -7.767 1.00 0.34 H new ATOM 0 HD21 ASN A 42 4.227 1.060 -7.472 1.00 0.96 H new ATOM 0 HD22 ASN A 42 4.067 2.514 -6.483 1.00 0.96 H new ATOM 659 N PRO A 43 8.729 5.114 -4.911 1.00 0.30 N ATOM 660 CA PRO A 43 9.271 6.387 -4.419 1.00 0.35 C ATOM 661 C PRO A 43 9.373 7.445 -5.510 1.00 0.34 C ATOM 662 O PRO A 43 9.475 7.125 -6.694 1.00 0.52 O ATOM 663 CB PRO A 43 10.667 6.000 -3.936 1.00 0.40 C ATOM 664 CG PRO A 43 11.046 4.856 -4.805 1.00 0.35 C ATOM 665 CD PRO A 43 9.779 4.081 -5.021 1.00 0.27 C ATOM 0 HA PRO A 43 8.634 6.830 -3.654 1.00 0.35 H new ATOM 0 HB2 PRO A 43 11.368 6.828 -4.039 1.00 0.40 H new ATOM 0 HB3 PRO A 43 10.660 5.716 -2.884 1.00 0.40 H new ATOM 0 HG2 PRO A 43 11.461 5.203 -5.752 1.00 0.35 H new ATOM 0 HG3 PRO A 43 11.808 4.238 -4.330 1.00 0.35 H new ATOM 0 HD2 PRO A 43 9.765 3.595 -5.997 1.00 0.27 H new ATOM 0 HD3 PRO A 43 9.653 3.298 -4.273 1.00 0.27 H new ATOM 673 N THR A 44 9.345 8.709 -5.099 1.00 0.38 N ATOM 674 CA THR A 44 9.447 9.821 -6.036 1.00 0.38 C ATOM 675 C THR A 44 10.908 10.145 -6.334 1.00 0.34 C ATOM 676 O THR A 44 11.776 9.946 -5.488 1.00 0.33 O ATOM 677 CB THR A 44 8.754 11.083 -5.488 1.00 0.43 C ATOM 678 OG1 THR A 44 9.302 11.428 -4.210 1.00 0.43 O ATOM 679 CG2 THR A 44 7.254 10.866 -5.360 1.00 0.53 C ATOM 0 H THR A 44 9.252 8.988 -4.122 1.00 0.38 H new ATOM 0 HA THR A 44 8.947 9.514 -6.954 1.00 0.38 H new ATOM 0 HB THR A 44 8.928 11.899 -6.190 1.00 0.43 H new ATOM 0 HG1 THR A 44 8.857 12.232 -3.870 1.00 0.43 H new ATOM 0 HG21 THR A 44 6.787 11.771 -4.971 1.00 0.53 H new ATOM 0 HG22 THR A 44 6.835 10.634 -6.339 1.00 0.53 H new ATOM 0 HG23 THR A 44 7.063 10.038 -4.678 1.00 0.53 H new ATOM 687 N GLU A 45 11.177 10.632 -7.539 1.00 0.36 N ATOM 688 CA GLU A 45 12.540 10.976 -7.931 1.00 0.37 C ATOM 689 C GLU A 45 13.223 11.832 -6.867 1.00 0.33 C ATOM 690 O GLU A 45 14.394 11.627 -6.548 1.00 0.30 O ATOM 691 CB GLU A 45 12.534 11.723 -9.266 1.00 0.43 C ATOM 692 CG GLU A 45 13.925 12.019 -9.804 1.00 0.48 C ATOM 693 CD GLU A 45 13.895 12.847 -11.073 1.00 0.58 C ATOM 694 OE1 GLU A 45 13.886 14.092 -10.969 1.00 0.63 O ATOM 695 OE2 GLU A 45 13.880 12.251 -12.170 1.00 0.66 O ATOM 0 H GLU A 45 10.474 10.797 -8.259 1.00 0.36 H new ATOM 0 HA GLU A 45 13.100 10.047 -8.037 1.00 0.37 H new ATOM 0 HB2 GLU A 45 11.987 11.132 -10.001 1.00 0.43 H new ATOM 0 HB3 GLU A 45 11.993 12.661 -9.145 1.00 0.43 H new ATOM 0 HG2 GLU A 45 14.500 12.547 -9.043 1.00 0.48 H new ATOM 0 HG3 GLU A 45 14.442 11.080 -10.000 1.00 0.48 H new ATOM 702 N ALA A 46 12.471 12.774 -6.307 1.00 0.35 N ATOM 703 CA ALA A 46 12.992 13.683 -5.289 1.00 0.35 C ATOM 704 C ALA A 46 13.518 12.945 -4.060 1.00 0.32 C ATOM 705 O ALA A 46 14.662 13.142 -3.651 1.00 0.33 O ATOM 706 CB ALA A 46 11.915 14.673 -4.879 1.00 0.40 C ATOM 0 H ALA A 46 11.491 12.929 -6.543 1.00 0.35 H new ATOM 0 HA ALA A 46 13.835 14.214 -5.731 1.00 0.35 H new ATOM 0 HB1 ALA A 46 12.311 15.347 -4.120 1.00 0.40 H new ATOM 0 HB2 ALA A 46 11.601 15.250 -5.749 1.00 0.40 H new ATOM 0 HB3 ALA A 46 11.059 14.133 -4.474 1.00 0.40 H new ATOM 712 N GLU A 47 12.683 12.098 -3.470 1.00 0.30 N ATOM 713 CA GLU A 47 13.080 11.362 -2.275 1.00 0.30 C ATOM 714 C GLU A 47 14.263 10.441 -2.561 1.00 0.26 C ATOM 715 O GLU A 47 15.060 10.144 -1.672 1.00 0.26 O ATOM 716 CB GLU A 47 11.901 10.563 -1.710 1.00 0.33 C ATOM 717 CG GLU A 47 11.430 9.433 -2.608 1.00 0.37 C ATOM 718 CD GLU A 47 10.382 8.566 -1.942 1.00 0.88 C ATOM 719 OE1 GLU A 47 9.181 8.883 -2.069 1.00 1.43 O ATOM 720 OE2 GLU A 47 10.763 7.570 -1.292 1.00 1.15 O ATOM 0 H GLU A 47 11.736 11.905 -3.795 1.00 0.30 H new ATOM 0 HA GLU A 47 13.393 12.090 -1.526 1.00 0.30 H new ATOM 0 HB2 GLU A 47 12.187 10.149 -0.743 1.00 0.33 H new ATOM 0 HB3 GLU A 47 11.068 11.243 -1.532 1.00 0.33 H new ATOM 0 HG2 GLU A 47 11.021 9.850 -3.528 1.00 0.37 H new ATOM 0 HG3 GLU A 47 12.283 8.816 -2.889 1.00 0.37 H new ATOM 727 N LEU A 48 14.370 9.987 -3.803 1.00 0.24 N ATOM 728 CA LEU A 48 15.459 9.105 -4.199 1.00 0.22 C ATOM 729 C LEU A 48 16.810 9.805 -4.105 1.00 0.20 C ATOM 730 O LEU A 48 17.714 9.338 -3.417 1.00 0.19 O ATOM 731 CB LEU A 48 15.242 8.615 -5.631 1.00 0.25 C ATOM 732 CG LEU A 48 14.015 7.726 -5.836 1.00 0.27 C ATOM 733 CD1 LEU A 48 13.761 7.511 -7.320 1.00 0.31 C ATOM 734 CD2 LEU A 48 14.200 6.392 -5.127 1.00 0.29 C ATOM 0 H LEU A 48 13.717 10.215 -4.552 1.00 0.24 H new ATOM 0 HA LEU A 48 15.463 8.258 -3.513 1.00 0.22 H new ATOM 0 HB2 LEU A 48 15.156 9.482 -6.286 1.00 0.25 H new ATOM 0 HB3 LEU A 48 16.127 8.063 -5.947 1.00 0.25 H new ATOM 0 HG LEU A 48 13.148 8.226 -5.405 1.00 0.27 H new ATOM 0 HD11 LEU A 48 12.885 6.876 -7.451 1.00 0.31 H new ATOM 0 HD12 LEU A 48 13.588 8.473 -7.803 1.00 0.31 H new ATOM 0 HD13 LEU A 48 14.628 7.029 -7.772 1.00 0.31 H new ATOM 0 HD21 LEU A 48 13.318 5.772 -5.283 1.00 0.29 H new ATOM 0 HD22 LEU A 48 15.076 5.884 -5.530 1.00 0.29 H new ATOM 0 HD23 LEU A 48 14.339 6.563 -4.060 1.00 0.29 H new ATOM 746 N GLN A 49 16.941 10.934 -4.795 1.00 0.23 N ATOM 747 CA GLN A 49 18.194 11.681 -4.804 1.00 0.25 C ATOM 748 C GLN A 49 18.635 12.086 -3.399 1.00 0.25 C ATOM 749 O GLN A 49 19.829 12.083 -3.102 1.00 0.26 O ATOM 750 CB GLN A 49 18.073 12.916 -5.697 1.00 0.31 C ATOM 751 CG GLN A 49 17.126 13.978 -5.166 1.00 0.36 C ATOM 752 CD GLN A 49 16.187 14.503 -6.235 1.00 0.36 C ATOM 753 OE1 GLN A 49 15.848 13.646 -7.194 1.00 0.40 O flip ATOM 754 NE2 GLN A 49 15.770 15.660 -6.199 1.00 0.33 N flip ATOM 0 H GLN A 49 16.197 11.351 -5.354 1.00 0.23 H new ATOM 0 HA GLN A 49 18.960 11.019 -5.208 1.00 0.25 H new ATOM 0 HB2 GLN A 49 19.062 13.357 -5.824 1.00 0.31 H new ATOM 0 HB3 GLN A 49 17.734 12.604 -6.685 1.00 0.31 H new ATOM 0 HG2 GLN A 49 16.541 13.562 -4.345 1.00 0.36 H new ATOM 0 HG3 GLN A 49 17.705 14.806 -4.757 1.00 0.36 H new ATOM 0 HE21 GLN A 49 16.057 16.282 -5.444 1.00 0.33 H new ATOM 0 HE22 GLN A 49 15.137 15.997 -6.925 1.00 0.33 H new ATOM 763 N ASP A 50 17.684 12.441 -2.534 1.00 0.25 N ATOM 764 CA ASP A 50 18.035 12.851 -1.177 1.00 0.29 C ATOM 765 C ASP A 50 18.657 11.692 -0.399 1.00 0.27 C ATOM 766 O ASP A 50 19.728 11.842 0.184 1.00 0.30 O ATOM 767 CB ASP A 50 16.819 13.424 -0.430 1.00 0.33 C ATOM 768 CG ASP A 50 16.038 12.384 0.353 1.00 0.33 C ATOM 769 OD1 ASP A 50 16.546 11.917 1.394 1.00 0.35 O ATOM 770 OD2 ASP A 50 14.912 12.052 -0.062 1.00 0.33 O ATOM 0 H ASP A 50 16.686 12.453 -2.743 1.00 0.25 H new ATOM 0 HA ASP A 50 18.778 13.645 -1.255 1.00 0.29 H new ATOM 0 HB2 ASP A 50 17.158 14.202 0.254 1.00 0.33 H new ATOM 0 HB3 ASP A 50 16.153 13.900 -1.150 1.00 0.33 H new ATOM 775 N LEU A 51 17.987 10.538 -0.392 1.00 0.25 N ATOM 776 CA LEU A 51 18.495 9.370 0.319 1.00 0.27 C ATOM 777 C LEU A 51 19.769 8.850 -0.331 1.00 0.24 C ATOM 778 O LEU A 51 20.574 8.176 0.312 1.00 0.27 O ATOM 779 CB LEU A 51 17.431 8.267 0.382 1.00 0.30 C ATOM 780 CG LEU A 51 16.892 7.783 -0.966 1.00 0.29 C ATOM 781 CD1 LEU A 51 17.854 6.793 -1.601 1.00 0.30 C ATOM 782 CD2 LEU A 51 15.518 7.157 -0.792 1.00 0.35 C ATOM 0 H LEU A 51 17.097 10.390 -0.868 1.00 0.25 H new ATOM 0 HA LEU A 51 18.734 9.674 1.338 1.00 0.27 H new ATOM 0 HB2 LEU A 51 17.852 7.412 0.912 1.00 0.30 H new ATOM 0 HB3 LEU A 51 16.593 8.630 0.978 1.00 0.30 H new ATOM 0 HG LEU A 51 16.798 8.642 -1.630 1.00 0.29 H new ATOM 0 HD11 LEU A 51 17.454 6.460 -2.559 1.00 0.30 H new ATOM 0 HD12 LEU A 51 18.819 7.274 -1.759 1.00 0.30 H new ATOM 0 HD13 LEU A 51 17.980 5.934 -0.942 1.00 0.30 H new ATOM 0 HD21 LEU A 51 15.148 6.818 -1.759 1.00 0.35 H new ATOM 0 HD22 LEU A 51 15.588 6.308 -0.112 1.00 0.35 H new ATOM 0 HD23 LEU A 51 14.831 7.896 -0.380 1.00 0.35 H new ATOM 794 N ILE A 52 19.948 9.165 -1.611 1.00 0.20 N ATOM 795 CA ILE A 52 21.136 8.733 -2.339 1.00 0.21 C ATOM 796 C ILE A 52 22.360 9.518 -1.877 1.00 0.25 C ATOM 797 O ILE A 52 23.345 8.937 -1.420 1.00 0.29 O ATOM 798 CB ILE A 52 20.957 8.892 -3.867 1.00 0.23 C ATOM 799 CG1 ILE A 52 20.021 7.805 -4.403 1.00 0.25 C ATOM 800 CG2 ILE A 52 22.304 8.832 -4.577 1.00 0.28 C ATOM 801 CD1 ILE A 52 19.625 8.004 -5.850 1.00 0.31 C ATOM 0 H ILE A 52 19.289 9.715 -2.162 1.00 0.20 H new ATOM 0 HA ILE A 52 21.284 7.675 -2.123 1.00 0.21 H new ATOM 0 HB ILE A 52 20.512 9.867 -4.064 1.00 0.23 H new ATOM 0 HG12 ILE A 52 20.507 6.835 -4.298 1.00 0.25 H new ATOM 0 HG13 ILE A 52 19.121 7.778 -3.789 1.00 0.25 H new ATOM 0 HG21 ILE A 52 22.155 8.946 -5.651 1.00 0.28 H new ATOM 0 HG22 ILE A 52 22.944 9.636 -4.212 1.00 0.28 H new ATOM 0 HG23 ILE A 52 22.778 7.871 -4.377 1.00 0.28 H new ATOM 0 HD11 ILE A 52 18.962 7.196 -6.160 1.00 0.31 H new ATOM 0 HD12 ILE A 52 19.110 8.958 -5.958 1.00 0.31 H new ATOM 0 HD13 ILE A 52 20.518 8.001 -6.475 1.00 0.31 H new ATOM 813 N ALA A 53 22.289 10.839 -1.997 1.00 0.29 N ATOM 814 CA ALA A 53 23.385 11.704 -1.581 1.00 0.36 C ATOM 815 C ALA A 53 23.638 11.521 -0.094 1.00 0.38 C ATOM 816 O ALA A 53 24.773 11.589 0.380 1.00 0.45 O ATOM 817 CB ALA A 53 23.055 13.158 -1.889 1.00 0.40 C ATOM 0 H ALA A 53 21.483 11.334 -2.379 1.00 0.29 H new ATOM 0 HA ALA A 53 24.286 11.434 -2.132 1.00 0.36 H new ATOM 0 HB1 ALA A 53 23.882 13.794 -1.573 1.00 0.40 H new ATOM 0 HB2 ALA A 53 22.896 13.276 -2.961 1.00 0.40 H new ATOM 0 HB3 ALA A 53 22.151 13.447 -1.354 1.00 0.40 H new ATOM 823 N GLU A 54 22.550 11.286 0.623 1.00 0.40 N ATOM 824 CA GLU A 54 22.583 11.066 2.059 1.00 0.47 C ATOM 825 C GLU A 54 23.477 9.883 2.421 1.00 0.40 C ATOM 826 O GLU A 54 24.406 10.018 3.218 1.00 0.45 O ATOM 827 CB GLU A 54 21.152 10.844 2.556 1.00 0.59 C ATOM 828 CG GLU A 54 21.043 9.889 3.725 1.00 0.69 C ATOM 829 CD GLU A 54 19.697 9.963 4.420 1.00 1.02 C ATOM 830 OE1 GLU A 54 19.505 10.880 5.246 1.00 1.27 O ATOM 831 OE2 GLU A 54 18.834 9.105 4.136 1.00 1.47 O ATOM 0 H GLU A 54 21.613 11.242 0.221 1.00 0.40 H new ATOM 0 HA GLU A 54 23.007 11.944 2.546 1.00 0.47 H new ATOM 0 HB2 GLU A 54 20.727 11.805 2.845 1.00 0.59 H new ATOM 0 HB3 GLU A 54 20.548 10.463 1.732 1.00 0.59 H new ATOM 0 HG2 GLU A 54 21.210 8.871 3.373 1.00 0.69 H new ATOM 0 HG3 GLU A 54 21.831 10.111 4.444 1.00 0.69 H new ATOM 838 N ALA A 55 23.193 8.725 1.835 1.00 0.33 N ATOM 839 CA ALA A 55 23.977 7.525 2.101 1.00 0.31 C ATOM 840 C ALA A 55 25.421 7.706 1.645 1.00 0.33 C ATOM 841 O ALA A 55 26.350 7.203 2.277 1.00 0.41 O ATOM 842 CB ALA A 55 23.350 6.320 1.419 1.00 0.37 C ATOM 0 H ALA A 55 22.427 8.592 1.174 1.00 0.33 H new ATOM 0 HA ALA A 55 23.981 7.353 3.177 1.00 0.31 H new ATOM 0 HB1 ALA A 55 23.947 5.432 1.627 1.00 0.37 H new ATOM 0 HB2 ALA A 55 22.338 6.174 1.797 1.00 0.37 H new ATOM 0 HB3 ALA A 55 23.314 6.489 0.343 1.00 0.37 H new ATOM 848 N GLU A 56 25.603 8.427 0.542 1.00 0.34 N ATOM 849 CA GLU A 56 26.935 8.678 0.003 1.00 0.44 C ATOM 850 C GLU A 56 27.737 9.589 0.928 1.00 0.52 C ATOM 851 O GLU A 56 28.967 9.579 0.910 1.00 0.65 O ATOM 852 CB GLU A 56 26.837 9.309 -1.387 1.00 0.50 C ATOM 853 CG GLU A 56 26.300 8.363 -2.448 1.00 0.61 C ATOM 854 CD GLU A 56 26.256 8.997 -3.825 1.00 1.09 C ATOM 855 OE1 GLU A 56 25.269 9.704 -4.120 1.00 1.88 O ATOM 856 OE2 GLU A 56 27.208 8.789 -4.605 1.00 1.31 O ATOM 0 H GLU A 56 24.845 8.847 0.005 1.00 0.34 H new ATOM 0 HA GLU A 56 27.451 7.721 -0.074 1.00 0.44 H new ATOM 0 HB2 GLU A 56 26.192 10.186 -1.334 1.00 0.50 H new ATOM 0 HB3 GLU A 56 27.825 9.657 -1.689 1.00 0.50 H new ATOM 0 HG2 GLU A 56 26.924 7.470 -2.483 1.00 0.61 H new ATOM 0 HG3 GLU A 56 25.297 8.040 -2.168 1.00 0.61 H new ATOM 863 N ASN A 57 27.030 10.373 1.737 1.00 0.54 N ATOM 864 CA ASN A 57 27.676 11.290 2.670 1.00 0.68 C ATOM 865 C ASN A 57 28.077 10.564 3.950 1.00 0.70 C ATOM 866 O ASN A 57 28.914 11.045 4.713 1.00 0.98 O ATOM 867 CB ASN A 57 26.745 12.458 3.001 1.00 0.79 C ATOM 868 CG ASN A 57 27.386 13.460 3.941 1.00 0.96 C ATOM 869 OD1 ASN A 57 28.603 13.647 3.932 1.00 1.37 O ATOM 870 ND2 ASN A 57 26.568 14.112 4.760 1.00 1.66 N ATOM 0 H ASN A 57 26.011 10.391 1.765 1.00 0.54 H new ATOM 0 HA ASN A 57 28.576 11.679 2.195 1.00 0.68 H new ATOM 0 HB2 ASN A 57 26.457 12.962 2.078 1.00 0.79 H new ATOM 0 HB3 ASN A 57 25.831 12.073 3.453 1.00 0.79 H new ATOM 0 HD21 ASN A 57 26.943 14.799 5.415 1.00 1.66 H new ATOM 0 HD22 ASN A 57 25.565 13.926 4.734 1.00 1.66 H new ATOM 877 N ASN A 58 27.470 9.402 4.178 1.00 0.64 N ATOM 878 CA ASN A 58 27.760 8.606 5.365 1.00 0.70 C ATOM 879 C ASN A 58 28.612 7.391 5.010 1.00 0.63 C ATOM 880 O ASN A 58 29.786 7.315 5.372 1.00 0.89 O ATOM 881 CB ASN A 58 26.457 8.156 6.029 1.00 0.79 C ATOM 882 CG ASN A 58 25.536 9.319 6.337 1.00 1.13 C ATOM 883 OD1 ASN A 58 25.990 10.430 6.616 1.00 2.14 O ATOM 884 ND2 ASN A 58 24.231 9.071 6.288 1.00 1.12 N ATOM 0 H ASN A 58 26.774 8.992 3.555 1.00 0.64 H new ATOM 0 HA ASN A 58 28.321 9.227 6.064 1.00 0.70 H new ATOM 0 HB2 ASN A 58 25.943 7.452 5.375 1.00 0.79 H new ATOM 0 HB3 ASN A 58 26.687 7.624 6.952 1.00 0.79 H new ATOM 0 HD21 ASN A 58 23.563 9.816 6.486 1.00 1.12 H new ATOM 0 HD22 ASN A 58 23.898 8.136 6.053 1.00 1.12 H new ATOM 891 N ASN A 59 28.010 6.443 4.298 1.00 0.54 N ATOM 892 CA ASN A 59 28.709 5.229 3.890 1.00 0.72 C ATOM 893 C ASN A 59 29.510 5.465 2.613 1.00 0.82 C ATOM 894 O ASN A 59 29.654 6.601 2.162 1.00 1.69 O ATOM 895 CB ASN A 59 27.711 4.091 3.675 1.00 0.81 C ATOM 896 CG ASN A 59 26.846 3.840 4.893 1.00 0.88 C ATOM 897 OD1 ASN A 59 27.274 4.054 6.028 1.00 1.09 O ATOM 898 ND2 ASN A 59 25.619 3.386 4.664 1.00 0.93 N ATOM 0 H ASN A 59 27.038 6.492 3.991 1.00 0.54 H new ATOM 0 HA ASN A 59 29.401 4.953 4.686 1.00 0.72 H new ATOM 0 HB2 ASN A 59 27.073 4.327 2.823 1.00 0.81 H new ATOM 0 HB3 ASN A 59 28.253 3.179 3.424 1.00 0.81 H new ATOM 0 HD21 ASN A 59 24.990 3.201 5.445 1.00 0.93 H new ATOM 0 HD22 ASN A 59 25.306 3.223 3.707 1.00 0.93 H new ATOM 905 N ASN A 60 30.028 4.386 2.035 1.00 0.78 N ATOM 906 CA ASN A 60 30.812 4.479 0.808 1.00 0.73 C ATOM 907 C ASN A 60 29.933 4.909 -0.363 1.00 0.61 C ATOM 908 O ASN A 60 30.332 5.740 -1.180 1.00 0.68 O ATOM 909 CB ASN A 60 31.470 3.133 0.498 1.00 0.76 C ATOM 910 CG ASN A 60 32.329 2.635 1.643 1.00 1.00 C ATOM 911 OD1 ASN A 60 31.725 1.867 2.542 1.00 1.32 O flip ATOM 912 ND2 ASN A 60 33.521 2.936 1.718 1.00 1.74 N flip ATOM 0 H ASN A 60 29.919 3.438 2.396 1.00 0.78 H new ATOM 0 HA ASN A 60 31.588 5.230 0.954 1.00 0.73 H new ATOM 0 HB2 ASN A 60 30.698 2.396 0.279 1.00 0.76 H new ATOM 0 HB3 ASN A 60 32.083 3.229 -0.398 1.00 0.76 H new ATOM 0 HD21 ASN A 60 33.943 3.529 1.004 1.00 1.74 H new ATOM 0 HD22 ASN A 60 34.086 2.592 2.494 1.00 1.74 H new ATOM 919 N GLY A 61 28.735 4.339 -0.432 1.00 0.53 N ATOM 920 CA GLY A 61 27.811 4.669 -1.503 1.00 0.47 C ATOM 921 C GLY A 61 26.767 3.590 -1.711 1.00 0.41 C ATOM 922 O GLY A 61 26.130 3.526 -2.763 1.00 0.56 O ATOM 0 H GLY A 61 28.386 3.652 0.236 1.00 0.53 H new ATOM 0 HA2 GLY A 61 27.315 5.613 -1.275 1.00 0.47 H new ATOM 0 HA3 GLY A 61 28.368 4.817 -2.428 1.00 0.47 H new ATOM 926 N GLN A 62 26.595 2.740 -0.703 1.00 0.28 N ATOM 927 CA GLN A 62 25.623 1.654 -0.768 1.00 0.22 C ATOM 928 C GLN A 62 24.857 1.524 0.546 1.00 0.19 C ATOM 929 O GLN A 62 25.328 1.960 1.597 1.00 0.22 O ATOM 930 CB GLN A 62 26.314 0.330 -1.117 1.00 0.22 C ATOM 931 CG GLN A 62 27.754 0.222 -0.628 1.00 0.31 C ATOM 932 CD GLN A 62 27.895 0.328 0.880 1.00 1.15 C ATOM 933 OE1 GLN A 62 26.865 -0.080 1.607 1.00 1.44 O flip ATOM 934 NE2 GLN A 62 28.923 0.778 1.386 1.00 1.87 N flip ATOM 0 H GLN A 62 27.118 2.783 0.171 1.00 0.28 H new ATOM 0 HA GLN A 62 24.908 1.891 -1.556 1.00 0.22 H new ATOM 0 HB2 GLN A 62 25.736 -0.490 -0.691 1.00 0.22 H new ATOM 0 HB3 GLN A 62 26.300 0.201 -2.199 1.00 0.22 H new ATOM 0 HG2 GLN A 62 28.170 -0.730 -0.957 1.00 0.31 H new ATOM 0 HG3 GLN A 62 28.347 1.008 -1.096 1.00 0.31 H new ATOM 0 HE21 GLN A 62 29.694 1.082 0.791 1.00 1.87 H new ATOM 0 HE22 GLN A 62 29.004 0.847 2.400 1.00 1.87 H new ATOM 943 N LEU A 63 23.666 0.940 0.473 1.00 0.19 N ATOM 944 CA LEU A 63 22.829 0.752 1.652 1.00 0.19 C ATOM 945 C LEU A 63 22.772 -0.719 2.056 1.00 0.18 C ATOM 946 O LEU A 63 22.885 -1.614 1.214 1.00 0.19 O ATOM 947 CB LEU A 63 21.415 1.287 1.391 1.00 0.23 C ATOM 948 CG LEU A 63 20.617 0.558 0.306 1.00 0.25 C ATOM 949 CD1 LEU A 63 19.906 -0.658 0.880 1.00 0.28 C ATOM 950 CD2 LEU A 63 19.616 1.502 -0.339 1.00 0.39 C ATOM 0 H LEU A 63 23.258 0.588 -0.393 1.00 0.19 H new ATOM 0 HA LEU A 63 23.273 1.312 2.475 1.00 0.19 H new ATOM 0 HB2 LEU A 63 20.852 1.241 2.323 1.00 0.23 H new ATOM 0 HB3 LEU A 63 21.490 2.339 1.116 1.00 0.23 H new ATOM 0 HG LEU A 63 21.315 0.214 -0.457 1.00 0.25 H new ATOM 0 HD11 LEU A 63 19.346 -1.159 0.090 1.00 0.28 H new ATOM 0 HD12 LEU A 63 20.641 -1.347 1.296 1.00 0.28 H new ATOM 0 HD13 LEU A 63 19.220 -0.341 1.666 1.00 0.28 H new ATOM 0 HD21 LEU A 63 19.057 0.969 -1.108 1.00 0.39 H new ATOM 0 HD22 LEU A 63 18.927 1.874 0.419 1.00 0.39 H new ATOM 0 HD23 LEU A 63 20.146 2.341 -0.791 1.00 0.39 H new ATOM 962 N ASN A 64 22.576 -0.953 3.350 1.00 0.18 N ATOM 963 CA ASN A 64 22.496 -2.303 3.896 1.00 0.18 C ATOM 964 C ASN A 64 21.043 -2.755 4.004 1.00 0.17 C ATOM 965 O ASN A 64 20.131 -1.933 4.071 1.00 0.17 O ATOM 966 CB ASN A 64 23.162 -2.368 5.271 1.00 0.20 C ATOM 967 CG ASN A 64 24.532 -1.720 5.284 1.00 0.26 C ATOM 968 OD1 ASN A 64 25.242 -1.718 4.279 1.00 0.74 O ATOM 969 ND2 ASN A 64 24.907 -1.161 6.429 1.00 0.61 N ATOM 0 H ASN A 64 22.469 -0.216 4.047 1.00 0.18 H new ATOM 0 HA ASN A 64 23.023 -2.973 3.216 1.00 0.18 H new ATOM 0 HB2 ASN A 64 22.524 -1.875 6.004 1.00 0.20 H new ATOM 0 HB3 ASN A 64 23.254 -3.410 5.578 1.00 0.20 H new ATOM 0 HD21 ASN A 64 25.817 -0.706 6.500 1.00 0.61 H new ATOM 0 HD22 ASN A 64 24.285 -1.187 7.237 1.00 0.61 H new ATOM 976 N PHE A 65 20.837 -4.066 4.011 1.00 0.17 N ATOM 977 CA PHE A 65 19.495 -4.632 4.097 1.00 0.17 C ATOM 978 C PHE A 65 18.697 -4.063 5.271 1.00 0.19 C ATOM 979 O PHE A 65 17.475 -3.951 5.193 1.00 0.18 O ATOM 980 CB PHE A 65 19.564 -6.155 4.216 1.00 0.19 C ATOM 981 CG PHE A 65 18.210 -6.803 4.280 1.00 0.18 C ATOM 982 CD1 PHE A 65 17.447 -6.961 3.135 1.00 0.20 C ATOM 983 CD2 PHE A 65 17.706 -7.262 5.485 1.00 0.19 C ATOM 984 CE1 PHE A 65 16.205 -7.566 3.192 1.00 0.21 C ATOM 985 CE2 PHE A 65 16.467 -7.867 5.549 1.00 0.19 C ATOM 986 CZ PHE A 65 15.696 -7.980 4.398 1.00 0.19 C ATOM 0 H PHE A 65 21.583 -4.759 3.958 1.00 0.17 H new ATOM 0 HA PHE A 65 18.977 -4.356 3.178 1.00 0.17 H new ATOM 0 HB2 PHE A 65 20.112 -6.556 3.363 1.00 0.19 H new ATOM 0 HB3 PHE A 65 20.129 -6.418 5.110 1.00 0.19 H new ATOM 0 HD1 PHE A 65 17.826 -6.608 2.187 1.00 0.20 H new ATOM 0 HD2 PHE A 65 18.290 -7.145 6.386 1.00 0.19 H new ATOM 0 HE1 PHE A 65 15.635 -7.713 2.287 1.00 0.21 H new ATOM 0 HE2 PHE A 65 16.098 -8.251 6.489 1.00 0.19 H new ATOM 0 HZ PHE A 65 14.699 -8.392 4.452 1.00 0.19 H new ATOM 996 N THR A 66 19.378 -3.705 6.358 1.00 0.23 N ATOM 997 CA THR A 66 18.688 -3.172 7.531 1.00 0.25 C ATOM 998 C THR A 66 18.043 -1.819 7.251 1.00 0.24 C ATOM 999 O THR A 66 16.846 -1.643 7.475 1.00 0.24 O ATOM 1000 CB THR A 66 19.618 -3.022 8.746 1.00 0.30 C ATOM 1001 OG1 THR A 66 20.256 -4.272 9.034 1.00 0.33 O ATOM 1002 CG2 THR A 66 18.821 -2.558 9.961 1.00 0.32 C ATOM 0 H THR A 66 20.391 -3.773 6.451 1.00 0.23 H new ATOM 0 HA THR A 66 17.915 -3.905 7.763 1.00 0.25 H new ATOM 0 HB THR A 66 20.380 -2.278 8.514 1.00 0.30 H new ATOM 0 HG1 THR A 66 20.848 -4.167 9.808 1.00 0.33 H new ATOM 0 HG21 THR A 66 19.489 -2.455 10.816 1.00 0.32 H new ATOM 0 HG22 THR A 66 18.356 -1.596 9.745 1.00 0.32 H new ATOM 0 HG23 THR A 66 18.048 -3.291 10.191 1.00 0.32 H new ATOM 1010 N GLU A 67 18.829 -0.858 6.775 1.00 0.25 N ATOM 1011 CA GLU A 67 18.288 0.464 6.495 1.00 0.26 C ATOM 1012 C GLU A 67 17.159 0.377 5.476 1.00 0.23 C ATOM 1013 O GLU A 67 16.120 1.018 5.640 1.00 0.23 O ATOM 1014 CB GLU A 67 19.382 1.430 6.028 1.00 0.29 C ATOM 1015 CG GLU A 67 20.264 0.891 4.916 1.00 0.27 C ATOM 1016 CD GLU A 67 21.446 1.798 4.632 1.00 0.45 C ATOM 1017 OE1 GLU A 67 21.248 2.846 3.982 1.00 0.66 O ATOM 1018 OE2 GLU A 67 22.571 1.458 5.056 1.00 0.61 O ATOM 0 H GLU A 67 19.824 -0.967 6.579 1.00 0.25 H new ATOM 0 HA GLU A 67 17.879 0.862 7.423 1.00 0.26 H new ATOM 0 HB2 GLU A 67 18.913 2.353 5.688 1.00 0.29 H new ATOM 0 HB3 GLU A 67 20.010 1.687 6.881 1.00 0.29 H new ATOM 0 HG2 GLU A 67 20.626 -0.100 5.190 1.00 0.27 H new ATOM 0 HG3 GLU A 67 19.671 0.774 4.009 1.00 0.27 H new ATOM 1025 N PHE A 68 17.356 -0.414 4.422 1.00 0.22 N ATOM 1026 CA PHE A 68 16.320 -0.580 3.410 1.00 0.20 C ATOM 1027 C PHE A 68 15.056 -1.173 4.018 1.00 0.18 C ATOM 1028 O PHE A 68 13.970 -0.617 3.876 1.00 0.19 O ATOM 1029 CB PHE A 68 16.791 -1.481 2.268 1.00 0.19 C ATOM 1030 CG PHE A 68 15.668 -1.869 1.344 1.00 0.18 C ATOM 1031 CD1 PHE A 68 14.784 -0.908 0.879 1.00 0.25 C ATOM 1032 CD2 PHE A 68 15.485 -3.185 0.956 1.00 0.17 C ATOM 1033 CE1 PHE A 68 13.741 -1.250 0.046 1.00 0.27 C ATOM 1034 CE2 PHE A 68 14.442 -3.533 0.118 1.00 0.18 C ATOM 1035 CZ PHE A 68 13.569 -2.561 -0.335 1.00 0.23 C ATOM 0 H PHE A 68 18.211 -0.942 4.250 1.00 0.22 H new ATOM 0 HA PHE A 68 16.104 0.412 3.013 1.00 0.20 H new ATOM 0 HB2 PHE A 68 17.565 -0.967 1.699 1.00 0.19 H new ATOM 0 HB3 PHE A 68 17.245 -2.381 2.682 1.00 0.19 H new ATOM 0 HD1 PHE A 68 14.914 0.123 1.174 1.00 0.25 H new ATOM 0 HD2 PHE A 68 16.163 -3.947 1.311 1.00 0.17 H new ATOM 0 HE1 PHE A 68 13.060 -0.490 -0.307 1.00 0.27 H new ATOM 0 HE2 PHE A 68 14.309 -4.562 -0.182 1.00 0.18 H new ATOM 0 HZ PHE A 68 12.752 -2.831 -0.988 1.00 0.23 H new ATOM 1045 N CYS A 69 15.200 -2.327 4.664 1.00 0.18 N ATOM 1046 CA CYS A 69 14.064 -2.991 5.297 1.00 0.19 C ATOM 1047 C CYS A 69 13.309 -1.998 6.168 1.00 0.20 C ATOM 1048 O CYS A 69 12.081 -2.021 6.245 1.00 0.20 O ATOM 1049 CB CYS A 69 14.523 -4.191 6.132 1.00 0.21 C ATOM 1050 SG CYS A 69 15.039 -3.785 7.816 1.00 0.26 S ATOM 0 H CYS A 69 16.088 -2.820 4.763 1.00 0.18 H new ATOM 0 HA CYS A 69 13.400 -3.361 4.516 1.00 0.19 H new ATOM 0 HB2 CYS A 69 13.710 -4.915 6.180 1.00 0.21 H new ATOM 0 HB3 CYS A 69 15.353 -4.677 5.619 1.00 0.21 H new ATOM 0 HG CYS A 69 15.785 -2.720 7.797 1.00 0.26 H new ATOM 1056 N GLY A 70 14.064 -1.119 6.820 1.00 0.22 N ATOM 1057 CA GLY A 70 13.460 -0.108 7.656 1.00 0.25 C ATOM 1058 C GLY A 70 12.675 0.886 6.822 1.00 0.25 C ATOM 1059 O GLY A 70 11.664 1.433 7.264 1.00 0.27 O ATOM 0 H GLY A 70 15.083 -1.092 6.782 1.00 0.22 H new ATOM 0 HA2 GLY A 70 12.800 -0.579 8.384 1.00 0.25 H new ATOM 0 HA3 GLY A 70 14.234 0.414 8.219 1.00 0.25 H new ATOM 1063 N ILE A 71 13.161 1.110 5.603 1.00 0.25 N ATOM 1064 CA ILE A 71 12.539 2.034 4.661 1.00 0.27 C ATOM 1065 C ILE A 71 11.241 1.490 4.086 1.00 0.26 C ATOM 1066 O ILE A 71 10.211 2.152 4.145 1.00 0.29 O ATOM 1067 CB ILE A 71 13.498 2.366 3.505 1.00 0.28 C ATOM 1068 CG1 ILE A 71 14.571 3.325 4.016 1.00 0.30 C ATOM 1069 CG2 ILE A 71 12.742 2.959 2.320 1.00 0.30 C ATOM 1070 CD1 ILE A 71 15.547 3.781 2.952 1.00 0.33 C ATOM 0 H ILE A 71 13.999 0.654 5.241 1.00 0.25 H new ATOM 0 HA ILE A 71 12.310 2.938 5.225 1.00 0.27 H new ATOM 0 HB ILE A 71 13.974 1.451 3.152 1.00 0.28 H new ATOM 0 HG12 ILE A 71 14.086 4.200 4.448 1.00 0.30 H new ATOM 0 HG13 ILE A 71 15.125 2.839 4.819 1.00 0.30 H new ATOM 0 HG21 ILE A 71 13.444 3.185 1.517 1.00 0.30 H new ATOM 0 HG22 ILE A 71 12.002 2.242 1.965 1.00 0.30 H new ATOM 0 HG23 ILE A 71 12.239 3.875 2.631 1.00 0.30 H new ATOM 0 HD11 ILE A 71 16.277 4.459 3.394 1.00 0.33 H new ATOM 0 HD12 ILE A 71 16.062 2.915 2.535 1.00 0.33 H new ATOM 0 HD13 ILE A 71 15.006 4.297 2.159 1.00 0.33 H new ATOM 1082 N MET A 72 11.291 0.299 3.507 1.00 0.24 N ATOM 1083 CA MET A 72 10.093 -0.289 2.935 1.00 0.25 C ATOM 1084 C MET A 72 8.991 -0.315 3.986 1.00 0.27 C ATOM 1085 O MET A 72 7.814 -0.136 3.674 1.00 0.31 O ATOM 1086 CB MET A 72 10.378 -1.689 2.384 1.00 0.23 C ATOM 1087 CG MET A 72 11.062 -2.625 3.372 1.00 0.26 C ATOM 1088 SD MET A 72 9.947 -3.257 4.642 1.00 0.49 S ATOM 1089 CE MET A 72 8.578 -3.833 3.646 1.00 0.33 C ATOM 0 H MET A 72 12.134 -0.269 3.422 1.00 0.24 H new ATOM 0 HA MET A 72 9.760 0.321 2.096 1.00 0.25 H new ATOM 0 HB2 MET A 72 9.438 -2.140 2.066 1.00 0.23 H new ATOM 0 HB3 MET A 72 11.004 -1.597 1.496 1.00 0.23 H new ATOM 0 HG2 MET A 72 11.495 -3.464 2.827 1.00 0.26 H new ATOM 0 HG3 MET A 72 11.886 -2.097 3.852 1.00 0.26 H new ATOM 0 HE1 MET A 72 7.874 -4.377 4.275 1.00 0.33 H new ATOM 0 HE2 MET A 72 8.074 -2.980 3.192 1.00 0.33 H new ATOM 0 HE3 MET A 72 8.950 -4.493 2.863 1.00 0.33 H new ATOM 1099 N ALA A 73 9.389 -0.540 5.236 1.00 0.26 N ATOM 1100 CA ALA A 73 8.453 -0.559 6.349 1.00 0.29 C ATOM 1101 C ALA A 73 7.770 0.796 6.523 1.00 0.31 C ATOM 1102 O ALA A 73 6.544 0.872 6.594 1.00 0.36 O ATOM 1103 CB ALA A 73 9.175 -0.954 7.627 1.00 0.29 C ATOM 0 H ALA A 73 10.359 -0.712 5.501 1.00 0.26 H new ATOM 0 HA ALA A 73 7.680 -1.296 6.131 1.00 0.29 H new ATOM 0 HB1 ALA A 73 8.467 -0.966 8.456 1.00 0.29 H new ATOM 0 HB2 ALA A 73 9.610 -1.946 7.507 1.00 0.29 H new ATOM 0 HB3 ALA A 73 9.966 -0.234 7.836 1.00 0.29 H new ATOM 1109 N LYS A 74 8.565 1.869 6.597 1.00 0.31 N ATOM 1110 CA LYS A 74 8.006 3.208 6.770 1.00 0.35 C ATOM 1111 C LYS A 74 7.217 3.628 5.538 1.00 0.38 C ATOM 1112 O LYS A 74 6.265 4.400 5.630 1.00 0.44 O ATOM 1113 CB LYS A 74 9.108 4.234 7.044 1.00 0.38 C ATOM 1114 CG LYS A 74 10.110 4.381 5.912 1.00 0.43 C ATOM 1115 CD LYS A 74 11.137 5.453 6.208 1.00 0.48 C ATOM 1116 CE LYS A 74 11.950 5.802 4.972 1.00 1.38 C ATOM 1117 NZ LYS A 74 12.939 6.880 5.247 1.00 2.11 N ATOM 0 H LYS A 74 9.583 1.835 6.540 1.00 0.31 H new ATOM 0 HA LYS A 74 7.336 3.174 7.629 1.00 0.35 H new ATOM 0 HB2 LYS A 74 8.648 5.203 7.237 1.00 0.38 H new ATOM 0 HB3 LYS A 74 9.640 3.947 7.951 1.00 0.38 H new ATOM 0 HG2 LYS A 74 10.615 3.429 5.747 1.00 0.43 H new ATOM 0 HG3 LYS A 74 9.583 4.626 4.990 1.00 0.43 H new ATOM 0 HD2 LYS A 74 10.635 6.347 6.579 1.00 0.48 H new ATOM 0 HD3 LYS A 74 11.804 5.111 6.999 1.00 0.48 H new ATOM 0 HE2 LYS A 74 12.471 4.913 4.617 1.00 1.38 H new ATOM 0 HE3 LYS A 74 11.279 6.119 4.173 1.00 1.38 H new ATOM 0 HZ1 LYS A 74 13.474 7.090 4.380 1.00 2.11 H new ATOM 0 HZ2 LYS A 74 12.440 7.737 5.562 1.00 2.11 H new ATOM 0 HZ3 LYS A 74 13.595 6.568 5.991 1.00 2.11 H new ATOM 1131 N GLN A 75 7.628 3.117 4.385 1.00 0.36 N ATOM 1132 CA GLN A 75 6.967 3.442 3.131 1.00 0.42 C ATOM 1133 C GLN A 75 5.583 2.813 3.063 1.00 0.51 C ATOM 1134 O GLN A 75 4.769 3.178 2.216 1.00 0.63 O ATOM 1135 CB GLN A 75 7.812 2.987 1.940 1.00 0.43 C ATOM 1136 CG GLN A 75 9.031 3.862 1.689 1.00 0.69 C ATOM 1137 CD GLN A 75 8.667 5.241 1.167 1.00 0.90 C ATOM 1138 OE1 GLN A 75 7.592 5.768 1.457 1.00 1.48 O ATOM 1139 NE2 GLN A 75 9.566 5.836 0.395 1.00 0.80 N ATOM 0 H GLN A 75 8.416 2.476 4.294 1.00 0.36 H new ATOM 0 HA GLN A 75 6.854 4.525 3.086 1.00 0.42 H new ATOM 0 HB2 GLN A 75 8.140 1.961 2.108 1.00 0.43 H new ATOM 0 HB3 GLN A 75 7.190 2.980 1.045 1.00 0.43 H new ATOM 0 HG2 GLN A 75 9.595 3.966 2.616 1.00 0.69 H new ATOM 0 HG3 GLN A 75 9.686 3.368 0.971 1.00 0.69 H new ATOM 0 HE21 GLN A 75 10.444 5.365 0.179 1.00 0.80 H new ATOM 0 HE22 GLN A 75 9.379 6.765 0.017 1.00 0.80 H new ATOM 1148 N MET A 76 5.318 1.871 3.962 1.00 0.49 N ATOM 1149 CA MET A 76 4.024 1.208 3.997 1.00 0.59 C ATOM 1150 C MET A 76 2.952 2.224 4.367 1.00 0.75 C ATOM 1151 O MET A 76 1.995 2.433 3.621 1.00 1.15 O ATOM 1152 CB MET A 76 4.035 0.042 4.992 1.00 0.57 C ATOM 1153 CG MET A 76 4.823 -1.167 4.515 1.00 0.63 C ATOM 1154 SD MET A 76 4.075 -1.972 3.086 1.00 0.96 S ATOM 1155 CE MET A 76 5.208 -3.336 2.835 1.00 0.68 C ATOM 0 H MET A 76 5.979 1.553 4.671 1.00 0.49 H new ATOM 0 HA MET A 76 3.805 0.797 3.012 1.00 0.59 H new ATOM 0 HB2 MET A 76 4.455 0.387 5.937 1.00 0.57 H new ATOM 0 HB3 MET A 76 3.008 -0.262 5.192 1.00 0.57 H new ATOM 0 HG2 MET A 76 5.837 -0.857 4.262 1.00 0.63 H new ATOM 0 HG3 MET A 76 4.904 -1.886 5.330 1.00 0.63 H new ATOM 0 HE1 MET A 76 4.683 -4.161 2.354 1.00 0.68 H new ATOM 0 HE2 MET A 76 6.033 -3.012 2.201 1.00 0.68 H new ATOM 0 HE3 MET A 76 5.599 -3.666 3.797 1.00 0.68 H new ATOM 1165 N ARG A 77 3.119 2.852 5.525 1.00 1.01 N ATOM 1166 CA ARG A 77 2.184 3.874 5.977 1.00 1.21 C ATOM 1167 C ARG A 77 2.229 5.076 5.036 1.00 1.56 C ATOM 1168 O ARG A 77 1.230 5.771 4.848 1.00 1.86 O ATOM 1169 CB ARG A 77 2.528 4.307 7.405 1.00 1.28 C ATOM 1170 CG ARG A 77 3.934 4.865 7.555 1.00 1.81 C ATOM 1171 CD ARG A 77 4.262 5.158 9.010 1.00 2.26 C ATOM 1172 NE ARG A 77 5.641 5.608 9.180 1.00 2.93 N ATOM 1173 CZ ARG A 77 6.336 5.459 10.304 1.00 3.56 C ATOM 1174 NH1 ARG A 77 5.784 4.875 11.360 1.00 3.66 N ATOM 1175 NH2 ARG A 77 7.587 5.895 10.373 1.00 4.44 N ATOM 0 H ARG A 77 3.891 2.672 6.166 1.00 1.01 H new ATOM 0 HA ARG A 77 1.176 3.459 5.970 1.00 1.21 H new ATOM 0 HB2 ARG A 77 1.811 5.062 7.728 1.00 1.28 H new ATOM 0 HB3 ARG A 77 2.413 3.452 8.071 1.00 1.28 H new ATOM 0 HG2 ARG A 77 4.655 4.152 7.154 1.00 1.81 H new ATOM 0 HG3 ARG A 77 4.029 5.778 6.968 1.00 1.81 H new ATOM 0 HD2 ARG A 77 3.582 5.922 9.388 1.00 2.26 H new ATOM 0 HD3 ARG A 77 4.097 4.261 9.607 1.00 2.26 H new ATOM 0 HE ARG A 77 6.098 6.063 8.390 1.00 2.93 H new ATOM 0 HH11 ARG A 77 4.822 4.538 11.312 1.00 3.66 H new ATOM 0 HH12 ARG A 77 6.321 4.763 12.220 1.00 3.66 H new ATOM 0 HH21 ARG A 77 8.016 6.345 9.564 1.00 4.44 H new ATOM 0 HH22 ARG A 77 8.120 5.781 11.235 1.00 4.44 H new ATOM 1189 N GLU A 78 3.413 5.305 4.458 1.00 1.79 N ATOM 1190 CA GLU A 78 3.651 6.402 3.516 1.00 2.41 C ATOM 1191 C GLU A 78 3.699 7.761 4.206 1.00 3.29 C ATOM 1192 O GLU A 78 4.408 8.662 3.759 1.00 3.87 O ATOM 1193 CB GLU A 78 2.606 6.408 2.396 1.00 2.38 C ATOM 1194 CG GLU A 78 2.807 5.296 1.377 1.00 2.16 C ATOM 1195 CD GLU A 78 1.763 5.319 0.277 1.00 2.80 C ATOM 1196 OE1 GLU A 78 1.789 6.257 -0.546 1.00 3.27 O ATOM 1197 OE2 GLU A 78 0.918 4.399 0.242 1.00 3.22 O ATOM 0 H GLU A 78 4.238 4.730 4.632 1.00 1.79 H new ATOM 0 HA GLU A 78 4.633 6.225 3.076 1.00 2.41 H new ATOM 0 HB2 GLU A 78 1.613 6.313 2.835 1.00 2.38 H new ATOM 0 HB3 GLU A 78 2.638 7.370 1.884 1.00 2.38 H new ATOM 0 HG2 GLU A 78 3.799 5.389 0.934 1.00 2.16 H new ATOM 0 HG3 GLU A 78 2.774 4.332 1.885 1.00 2.16 H new ATOM 1204 N THR A 79 2.957 7.890 5.298 1.00 3.77 N ATOM 1205 CA THR A 79 2.899 9.134 6.072 1.00 4.81 C ATOM 1206 C THR A 79 2.749 10.371 5.192 1.00 5.38 C ATOM 1207 O THR A 79 1.637 10.848 4.967 1.00 6.26 O ATOM 1208 CB THR A 79 4.142 9.315 6.957 1.00 5.61 C ATOM 1209 OG1 THR A 79 5.302 8.788 6.305 1.00 6.33 O ATOM 1210 CG2 THR A 79 3.953 8.640 8.306 1.00 6.12 C ATOM 0 H THR A 79 2.378 7.140 5.676 1.00 3.77 H new ATOM 0 HA THR A 79 2.011 9.039 6.698 1.00 4.81 H new ATOM 0 HB THR A 79 4.283 10.383 7.123 1.00 5.61 H new ATOM 0 HG1 THR A 79 6.086 8.912 6.880 1.00 6.33 H new ATOM 0 HG21 THR A 79 4.847 8.783 8.913 1.00 6.12 H new ATOM 0 HG22 THR A 79 3.095 9.078 8.815 1.00 6.12 H new ATOM 0 HG23 THR A 79 3.781 7.574 8.158 1.00 6.12 H new ATOM 1218 N ASP A 80 3.880 10.891 4.715 1.00 5.21 N ATOM 1219 CA ASP A 80 3.901 12.089 3.882 1.00 6.18 C ATOM 1220 C ASP A 80 3.529 13.307 4.716 1.00 7.07 C ATOM 1221 O ASP A 80 3.352 14.406 4.189 1.00 7.91 O ATOM 1222 CB ASP A 80 2.952 11.961 2.689 1.00 6.70 C ATOM 1223 CG ASP A 80 3.012 10.592 2.039 1.00 6.31 C ATOM 1224 OD1 ASP A 80 3.972 10.336 1.282 1.00 6.38 O ATOM 1225 OD2 ASP A 80 2.100 9.776 2.288 1.00 6.26 O ATOM 0 H ASP A 80 4.802 10.494 4.895 1.00 5.21 H new ATOM 0 HA ASP A 80 4.912 12.209 3.492 1.00 6.18 H new ATOM 0 HB2 ASP A 80 1.932 12.158 3.018 1.00 6.70 H new ATOM 0 HB3 ASP A 80 3.200 12.722 1.949 1.00 6.70 H new ATOM 1230 N THR A 81 3.402 13.101 6.025 1.00 7.15 N ATOM 1231 CA THR A 81 3.068 14.184 6.938 1.00 8.23 C ATOM 1232 C THR A 81 4.242 15.125 7.108 1.00 9.23 C ATOM 1233 O THR A 81 4.080 16.342 7.068 1.00 9.95 O ATOM 1234 CB THR A 81 2.630 13.667 8.313 1.00 8.38 C ATOM 1235 OG1 THR A 81 3.244 12.404 8.595 1.00 7.82 O ATOM 1236 CG2 THR A 81 1.120 13.541 8.359 1.00 8.29 C ATOM 0 H THR A 81 3.526 12.194 6.474 1.00 7.15 H new ATOM 0 HA THR A 81 2.230 14.720 6.493 1.00 8.23 H new ATOM 0 HB THR A 81 2.950 14.379 9.073 1.00 8.38 H new ATOM 0 HG1 THR A 81 2.955 12.089 9.477 1.00 7.82 H new ATOM 0 HG21 THR A 81 0.815 13.173 9.339 1.00 8.29 H new ATOM 0 HG22 THR A 81 0.668 14.517 8.181 1.00 8.29 H new ATOM 0 HG23 THR A 81 0.790 12.842 7.590 1.00 8.29 H new ATOM 1244 N GLU A 82 5.425 14.560 7.310 1.00 9.45 N ATOM 1245 CA GLU A 82 6.619 15.371 7.446 1.00 10.56 C ATOM 1246 C GLU A 82 6.899 16.034 6.112 1.00 10.71 C ATOM 1247 O GLU A 82 7.500 17.102 6.042 1.00 11.73 O ATOM 1248 CB GLU A 82 7.814 14.526 7.889 1.00 10.89 C ATOM 1249 CG GLU A 82 7.876 14.301 9.391 1.00 11.44 C ATOM 1250 CD GLU A 82 6.628 13.632 9.935 1.00 10.69 C ATOM 1251 OE1 GLU A 82 6.582 12.384 9.948 1.00 10.52 O ATOM 1252 OE2 GLU A 82 5.698 14.356 10.350 1.00 10.45 O ATOM 0 H GLU A 82 5.579 13.554 7.382 1.00 9.45 H new ATOM 0 HA GLU A 82 6.459 16.128 8.214 1.00 10.56 H new ATOM 0 HB2 GLU A 82 7.771 13.560 7.387 1.00 10.89 H new ATOM 0 HB3 GLU A 82 8.733 15.014 7.565 1.00 10.89 H new ATOM 0 HG2 GLU A 82 8.745 13.686 9.627 1.00 11.44 H new ATOM 0 HG3 GLU A 82 8.018 15.259 9.892 1.00 11.44 H new ATOM 1259 N GLU A 83 6.453 15.380 5.046 1.00 9.86 N ATOM 1260 CA GLU A 83 6.621 15.908 3.703 1.00 10.23 C ATOM 1261 C GLU A 83 5.840 17.210 3.558 1.00 10.94 C ATOM 1262 O GLU A 83 6.400 18.257 3.230 1.00 12.03 O ATOM 1263 CB GLU A 83 6.123 14.883 2.678 1.00 9.26 C ATOM 1264 CG GLU A 83 6.216 15.363 1.238 1.00 9.89 C ATOM 1265 CD GLU A 83 7.644 15.619 0.800 1.00 10.21 C ATOM 1266 OE1 GLU A 83 8.140 16.742 1.022 1.00 10.48 O ATOM 1267 OE2 GLU A 83 8.266 14.695 0.233 1.00 10.36 O ATOM 0 H GLU A 83 5.972 14.482 5.089 1.00 9.86 H new ATOM 0 HA GLU A 83 7.678 16.106 3.525 1.00 10.23 H new ATOM 0 HB2 GLU A 83 6.702 13.966 2.784 1.00 9.26 H new ATOM 0 HB3 GLU A 83 5.086 14.633 2.902 1.00 9.26 H new ATOM 0 HG2 GLU A 83 5.766 14.619 0.581 1.00 9.89 H new ATOM 0 HG3 GLU A 83 5.636 16.279 1.126 1.00 9.89 H new ATOM 1274 N GLU A 84 4.537 17.128 3.817 1.00 10.48 N ATOM 1275 CA GLU A 84 3.658 18.287 3.738 1.00 11.32 C ATOM 1276 C GLU A 84 4.015 19.323 4.800 1.00 12.38 C ATOM 1277 O GLU A 84 3.925 20.527 4.559 1.00 13.44 O ATOM 1278 CB GLU A 84 2.202 17.852 3.916 1.00 10.78 C ATOM 1279 CG GLU A 84 1.202 18.984 3.748 1.00 11.09 C ATOM 1280 CD GLU A 84 -0.234 18.526 3.905 1.00 11.33 C ATOM 1281 OE1 GLU A 84 -0.824 18.070 2.903 1.00 11.29 O ATOM 1282 OE2 GLU A 84 -0.769 18.623 5.029 1.00 11.72 O ATOM 0 H GLU A 84 4.066 16.264 4.085 1.00 10.48 H new ATOM 0 HA GLU A 84 3.788 18.742 2.756 1.00 11.32 H new ATOM 0 HB2 GLU A 84 1.975 17.068 3.193 1.00 10.78 H new ATOM 0 HB3 GLU A 84 2.081 17.416 4.908 1.00 10.78 H new ATOM 0 HG2 GLU A 84 1.413 19.761 4.482 1.00 11.09 H new ATOM 0 HG3 GLU A 84 1.330 19.433 2.763 1.00 11.09 H new ATOM 1289 N MET A 85 4.424 18.847 5.975 1.00 12.20 N ATOM 1290 CA MET A 85 4.781 19.739 7.073 1.00 13.28 C ATOM 1291 C MET A 85 6.022 20.559 6.735 1.00 14.20 C ATOM 1292 O MET A 85 5.998 21.788 6.801 1.00 15.28 O ATOM 1293 CB MET A 85 5.013 18.950 8.366 1.00 13.04 C ATOM 1294 CG MET A 85 5.591 19.795 9.483 1.00 14.20 C ATOM 1295 SD MET A 85 4.716 21.357 9.678 1.00 15.12 S ATOM 1296 CE MET A 85 5.930 22.308 10.581 1.00 16.29 C ATOM 0 H MET A 85 4.516 17.854 6.189 1.00 12.20 H new ATOM 0 HA MET A 85 3.945 20.422 7.224 1.00 13.28 H new ATOM 0 HB2 MET A 85 4.068 18.519 8.696 1.00 13.04 H new ATOM 0 HB3 MET A 85 5.688 18.119 8.161 1.00 13.04 H new ATOM 0 HG2 MET A 85 5.547 19.237 10.418 1.00 14.20 H new ATOM 0 HG3 MET A 85 6.643 19.993 9.279 1.00 14.20 H new ATOM 0 HE1 MET A 85 5.469 22.733 11.473 1.00 16.29 H new ATOM 0 HE2 MET A 85 6.756 21.660 10.873 1.00 16.29 H new ATOM 0 HE3 MET A 85 6.306 23.112 9.948 1.00 16.29 H new ATOM 1306 N ARG A 86 7.102 19.874 6.377 1.00 13.88 N ATOM 1307 CA ARG A 86 8.351 20.537 6.033 1.00 14.84 C ATOM 1308 C ARG A 86 8.149 21.508 4.878 1.00 15.43 C ATOM 1309 O ARG A 86 8.842 22.521 4.775 1.00 16.55 O ATOM 1310 CB ARG A 86 9.410 19.500 5.667 1.00 14.45 C ATOM 1311 CG ARG A 86 9.845 18.637 6.840 1.00 14.20 C ATOM 1312 CD ARG A 86 10.968 17.690 6.451 1.00 14.13 C ATOM 1313 NE ARG A 86 12.114 18.398 5.886 1.00 14.82 N ATOM 1314 CZ ARG A 86 13.300 17.834 5.676 1.00 15.11 C ATOM 1315 NH1 ARG A 86 13.499 16.561 5.990 1.00 14.78 N ATOM 1316 NH2 ARG A 86 14.289 18.544 5.150 1.00 15.88 N ATOM 0 H ARG A 86 7.136 18.856 6.318 1.00 13.88 H new ATOM 0 HA ARG A 86 8.690 21.103 6.901 1.00 14.84 H new ATOM 0 HB2 ARG A 86 9.020 18.857 4.878 1.00 14.45 H new ATOM 0 HB3 ARG A 86 10.282 20.011 5.259 1.00 14.45 H new ATOM 0 HG2 ARG A 86 10.174 19.275 7.660 1.00 14.20 H new ATOM 0 HG3 ARG A 86 8.994 18.062 7.205 1.00 14.20 H new ATOM 0 HD2 ARG A 86 11.287 17.127 7.328 1.00 14.13 H new ATOM 0 HD3 ARG A 86 10.596 16.966 5.726 1.00 14.13 H new ATOM 0 HE ARG A 86 11.998 19.381 5.638 1.00 14.82 H new ATOM 0 HH11 ARG A 86 12.741 16.011 6.394 1.00 14.78 H new ATOM 0 HH12 ARG A 86 14.410 16.132 5.827 1.00 14.78 H new ATOM 0 HH21 ARG A 86 14.140 19.523 4.906 1.00 15.88 H new ATOM 0 HH22 ARG A 86 15.198 18.111 4.989 1.00 15.88 H new ATOM 1330 N GLU A 87 7.191 21.196 4.014 1.00 14.77 N ATOM 1331 CA GLU A 87 6.892 22.042 2.870 1.00 15.43 C ATOM 1332 C GLU A 87 6.309 23.373 3.327 1.00 16.43 C ATOM 1333 O GLU A 87 6.683 24.432 2.823 1.00 17.50 O ATOM 1334 CB GLU A 87 5.908 21.339 1.936 1.00 14.60 C ATOM 1335 CG GLU A 87 5.722 22.052 0.607 1.00 15.22 C ATOM 1336 CD GLU A 87 4.636 21.424 -0.243 1.00 14.94 C ATOM 1337 OE1 GLU A 87 4.924 20.420 -0.928 1.00 14.72 O ATOM 1338 OE2 GLU A 87 3.497 21.937 -0.225 1.00 15.08 O ATOM 0 H GLU A 87 6.608 20.362 4.086 1.00 14.77 H new ATOM 0 HA GLU A 87 7.821 22.232 2.332 1.00 15.43 H new ATOM 0 HB2 GLU A 87 6.258 20.324 1.749 1.00 14.60 H new ATOM 0 HB3 GLU A 87 4.942 21.256 2.434 1.00 14.60 H new ATOM 0 HG2 GLU A 87 5.475 23.098 0.791 1.00 15.22 H new ATOM 0 HG3 GLU A 87 6.663 22.038 0.057 1.00 15.22 H new ATOM 1345 N ALA A 88 5.426 23.313 4.317 1.00 16.17 N ATOM 1346 CA ALA A 88 4.775 24.508 4.838 1.00 17.18 C ATOM 1347 C ALA A 88 5.756 25.363 5.625 1.00 18.20 C ATOM 1348 O ALA A 88 5.818 26.576 5.430 1.00 19.32 O ATOM 1349 CB ALA A 88 3.573 24.137 5.693 1.00 16.77 C ATOM 0 H ALA A 88 5.144 22.447 4.776 1.00 16.17 H new ATOM 0 HA ALA A 88 4.421 25.096 3.991 1.00 17.18 H new ATOM 0 HB1 ALA A 88 3.102 25.044 6.072 1.00 16.77 H new ATOM 0 HB2 ALA A 88 2.856 23.580 5.090 1.00 16.77 H new ATOM 0 HB3 ALA A 88 3.899 23.520 6.531 1.00 16.77 H new ATOM 1355 N PHE A 89 6.520 24.737 6.516 1.00 17.88 N ATOM 1356 CA PHE A 89 7.501 25.467 7.307 1.00 18.88 C ATOM 1357 C PHE A 89 8.387 26.307 6.391 1.00 19.75 C ATOM 1358 O PHE A 89 8.699 27.459 6.694 1.00 20.90 O ATOM 1359 CB PHE A 89 8.357 24.505 8.139 1.00 18.44 C ATOM 1360 CG PHE A 89 9.529 25.175 8.799 1.00 19.53 C ATOM 1361 CD1 PHE A 89 9.379 25.812 10.019 1.00 20.04 C ATOM 1362 CD2 PHE A 89 10.776 25.178 8.194 1.00 20.12 C ATOM 1363 CE1 PHE A 89 10.450 26.440 10.624 1.00 21.09 C ATOM 1364 CE2 PHE A 89 11.850 25.805 8.795 1.00 21.19 C ATOM 1365 CZ PHE A 89 11.686 26.438 10.011 1.00 21.66 C ATOM 0 H PHE A 89 6.479 23.736 6.706 1.00 17.88 H new ATOM 0 HA PHE A 89 6.970 26.127 7.993 1.00 18.88 H new ATOM 0 HB2 PHE A 89 7.733 24.043 8.904 1.00 18.44 H new ATOM 0 HB3 PHE A 89 8.720 23.703 7.496 1.00 18.44 H new ATOM 0 HD1 PHE A 89 8.414 25.818 10.503 1.00 20.04 H new ATOM 0 HD2 PHE A 89 10.909 24.685 7.242 1.00 20.12 H new ATOM 0 HE1 PHE A 89 10.320 26.932 11.576 1.00 21.09 H new ATOM 0 HE2 PHE A 89 12.817 25.800 8.314 1.00 21.19 H new ATOM 0 HZ PHE A 89 12.524 26.931 10.482 1.00 21.66 H new ATOM 1375 N LYS A 90 8.787 25.716 5.269 1.00 19.26 N ATOM 1376 CA LYS A 90 9.626 26.401 4.294 1.00 20.11 C ATOM 1377 C LYS A 90 8.897 27.596 3.684 1.00 20.94 C ATOM 1378 O LYS A 90 9.512 28.617 3.377 1.00 22.05 O ATOM 1379 CB LYS A 90 10.049 25.431 3.188 1.00 19.45 C ATOM 1380 CG LYS A 90 11.009 24.350 3.660 1.00 18.94 C ATOM 1381 CD LYS A 90 11.188 23.264 2.609 1.00 18.35 C ATOM 1382 CE LYS A 90 11.842 23.805 1.347 1.00 17.84 C ATOM 1383 NZ LYS A 90 13.191 24.372 1.619 1.00 18.07 N ATOM 0 H LYS A 90 8.542 24.760 5.013 1.00 19.26 H new ATOM 0 HA LYS A 90 10.513 26.768 4.811 1.00 20.11 H new ATOM 0 HB2 LYS A 90 9.160 24.958 2.771 1.00 19.45 H new ATOM 0 HB3 LYS A 90 10.518 25.995 2.382 1.00 19.45 H new ATOM 0 HG2 LYS A 90 11.976 24.797 3.891 1.00 18.94 H new ATOM 0 HG3 LYS A 90 10.634 23.907 4.582 1.00 18.94 H new ATOM 0 HD2 LYS A 90 11.798 22.458 3.018 1.00 18.35 H new ATOM 0 HD3 LYS A 90 10.217 22.834 2.361 1.00 18.35 H new ATOM 0 HE2 LYS A 90 11.926 23.006 0.611 1.00 17.84 H new ATOM 0 HE3 LYS A 90 11.206 24.575 0.910 1.00 17.84 H new ATOM 0 HZ1 LYS A 90 13.697 24.511 0.721 1.00 18.07 H new ATOM 0 HZ2 LYS A 90 13.092 25.286 2.105 1.00 18.07 H new ATOM 0 HZ3 LYS A 90 13.728 23.716 2.221 1.00 18.07 H new ATOM 1397 N ILE A 91 7.583 27.463 3.506 1.00 20.46 N ATOM 1398 CA ILE A 91 6.780 28.540 2.929 1.00 21.30 C ATOM 1399 C ILE A 91 6.805 29.794 3.803 1.00 22.45 C ATOM 1400 O ILE A 91 6.884 30.911 3.290 1.00 23.52 O ATOM 1401 CB ILE A 91 5.312 28.111 2.714 1.00 20.67 C ATOM 1402 CG1 ILE A 91 5.244 26.859 1.838 1.00 19.54 C ATOM 1403 CG2 ILE A 91 4.515 29.247 2.089 1.00 21.70 C ATOM 1404 CD1 ILE A 91 3.861 26.247 1.746 1.00 18.86 C ATOM 0 H ILE A 91 7.055 26.626 3.751 1.00 20.46 H new ATOM 0 HA ILE A 91 7.230 28.767 1.962 1.00 21.30 H new ATOM 0 HB ILE A 91 4.873 27.875 3.683 1.00 20.67 H new ATOM 0 HG12 ILE A 91 5.586 27.111 0.834 1.00 19.54 H new ATOM 0 HG13 ILE A 91 5.935 26.114 2.233 1.00 19.54 H new ATOM 0 HG21 ILE A 91 3.482 28.930 1.943 1.00 21.70 H new ATOM 0 HG22 ILE A 91 4.539 30.114 2.749 1.00 21.70 H new ATOM 0 HG23 ILE A 91 4.952 29.512 1.126 1.00 21.70 H new ATOM 0 HD11 ILE A 91 3.896 25.364 1.108 1.00 18.86 H new ATOM 0 HD12 ILE A 91 3.522 25.962 2.742 1.00 18.86 H new ATOM 0 HD13 ILE A 91 3.169 26.974 1.322 1.00 18.86 H new ATOM 1416 N PHE A 92 6.740 29.611 5.120 1.00 22.30 N ATOM 1417 CA PHE A 92 6.745 30.743 6.045 1.00 23.42 C ATOM 1418 C PHE A 92 8.131 31.355 6.177 1.00 24.20 C ATOM 1419 O PHE A 92 8.262 32.562 6.357 1.00 25.36 O ATOM 1420 CB PHE A 92 6.263 30.322 7.429 1.00 23.12 C ATOM 1421 CG PHE A 92 4.883 29.734 7.444 1.00 22.46 C ATOM 1422 CD1 PHE A 92 3.775 30.556 7.362 1.00 22.15 C ATOM 1423 CD2 PHE A 92 4.694 28.364 7.542 1.00 22.24 C ATOM 1424 CE1 PHE A 92 2.499 30.031 7.374 1.00 21.64 C ATOM 1425 CE2 PHE A 92 3.418 27.829 7.556 1.00 21.74 C ATOM 1426 CZ PHE A 92 2.320 28.664 7.472 1.00 21.45 C ATOM 0 H PHE A 92 6.684 28.697 5.569 1.00 22.30 H new ATOM 0 HA PHE A 92 6.065 31.487 5.630 1.00 23.42 H new ATOM 0 HB2 PHE A 92 6.962 29.593 7.839 1.00 23.12 H new ATOM 0 HB3 PHE A 92 6.284 31.189 8.089 1.00 23.12 H new ATOM 0 HD1 PHE A 92 3.910 31.625 7.287 1.00 22.15 H new ATOM 0 HD2 PHE A 92 5.550 27.709 7.608 1.00 22.24 H new ATOM 0 HE1 PHE A 92 1.643 30.686 7.307 1.00 21.64 H new ATOM 0 HE2 PHE A 92 3.280 26.761 7.632 1.00 21.74 H new ATOM 0 HZ PHE A 92 1.323 28.249 7.483 1.00 21.45 H new ATOM 1436 N ASP A 93 9.161 30.523 6.074 1.00 23.63 N ATOM 1437 CA ASP A 93 10.535 30.993 6.215 1.00 24.39 C ATOM 1438 C ASP A 93 10.898 31.963 5.099 1.00 25.20 C ATOM 1439 O ASP A 93 11.510 33.001 5.350 1.00 26.19 O ATOM 1440 CB ASP A 93 11.507 29.810 6.223 1.00 23.63 C ATOM 1441 CG ASP A 93 12.899 30.200 6.683 1.00 24.48 C ATOM 1442 OD1 ASP A 93 13.436 31.206 6.172 1.00 24.88 O ATOM 1443 OD2 ASP A 93 13.455 29.495 7.550 1.00 24.81 O ATOM 0 H ASP A 93 9.072 29.523 5.894 1.00 23.63 H new ATOM 0 HA ASP A 93 10.614 31.521 7.165 1.00 24.39 H new ATOM 0 HB2 ASP A 93 11.118 29.030 6.877 1.00 23.63 H new ATOM 0 HB3 ASP A 93 11.565 29.386 5.221 1.00 23.63 H new ATOM 1448 N ARG A 94 10.538 31.599 3.871 1.00 24.82 N ATOM 1449 CA ARG A 94 10.806 32.418 2.684 1.00 25.61 C ATOM 1450 C ARG A 94 12.235 32.221 2.195 1.00 25.96 C ATOM 1451 O ARG A 94 12.483 32.101 0.995 1.00 26.03 O ATOM 1452 CB ARG A 94 10.569 33.905 2.970 1.00 26.84 C ATOM 1453 CG ARG A 94 9.164 34.218 3.458 1.00 26.72 C ATOM 1454 CD ARG A 94 9.039 35.669 3.895 1.00 27.97 C ATOM 1455 NE ARG A 94 9.260 36.595 2.787 1.00 28.57 N ATOM 1456 CZ ARG A 94 9.269 37.917 2.922 1.00 29.55 C ATOM 1457 NH1 ARG A 94 9.074 38.469 4.113 1.00 30.03 N ATOM 1458 NH2 ARG A 94 9.474 38.691 1.865 1.00 30.10 N ATOM 0 H ARG A 94 10.051 30.726 3.667 1.00 24.82 H new ATOM 0 HA ARG A 94 10.114 32.093 1.907 1.00 25.61 H new ATOM 0 HB2 ARG A 94 11.287 34.241 3.718 1.00 26.84 H new ATOM 0 HB3 ARG A 94 10.764 34.476 2.062 1.00 26.84 H new ATOM 0 HG2 ARG A 94 8.447 34.013 2.663 1.00 26.72 H new ATOM 0 HG3 ARG A 94 8.912 33.562 4.292 1.00 26.72 H new ATOM 0 HD2 ARG A 94 8.048 35.837 4.316 1.00 27.97 H new ATOM 0 HD3 ARG A 94 9.760 35.873 4.687 1.00 27.97 H new ATOM 0 HE ARG A 94 9.416 36.205 1.858 1.00 28.57 H new ATOM 0 HH11 ARG A 94 8.916 37.878 4.929 1.00 30.03 H new ATOM 0 HH12 ARG A 94 9.082 39.484 4.212 1.00 30.03 H new ATOM 0 HH21 ARG A 94 9.625 38.272 0.947 1.00 30.10 H new ATOM 0 HH22 ARG A 94 9.481 39.706 1.969 1.00 30.10 H new ATOM 1472 N ASP A 95 13.171 32.190 3.140 1.00 26.27 N ATOM 1473 CA ASP A 95 14.583 32.023 2.817 1.00 26.74 C ATOM 1474 C ASP A 95 14.962 30.549 2.773 1.00 25.70 C ATOM 1475 O ASP A 95 15.455 30.051 1.760 1.00 25.63 O ATOM 1476 CB ASP A 95 15.454 32.728 3.859 1.00 27.69 C ATOM 1477 CG ASP A 95 14.758 33.905 4.511 1.00 28.38 C ATOM 1478 OD1 ASP A 95 14.586 34.944 3.840 1.00 28.88 O ATOM 1479 OD2 ASP A 95 14.384 33.784 5.699 1.00 28.47 O ATOM 0 H ASP A 95 12.975 32.279 4.137 1.00 26.27 H new ATOM 0 HA ASP A 95 14.752 32.465 1.835 1.00 26.74 H new ATOM 0 HB2 ASP A 95 15.743 32.012 4.628 1.00 27.69 H new ATOM 0 HB3 ASP A 95 16.372 33.073 3.384 1.00 27.69 H new ATOM 1484 N GLY A 96 14.725 29.858 3.883 1.00 24.96 N ATOM 1485 CA GLY A 96 15.058 28.450 3.973 1.00 24.00 C ATOM 1486 C GLY A 96 16.302 28.217 4.808 1.00 24.47 C ATOM 1487 O GLY A 96 17.060 27.280 4.557 1.00 24.19 O ATOM 0 H GLY A 96 14.306 30.251 4.726 1.00 24.96 H new ATOM 0 HA2 GLY A 96 14.220 27.906 4.409 1.00 24.00 H new ATOM 0 HA3 GLY A 96 15.212 28.048 2.971 1.00 24.00 H new ATOM 1491 N ASP A 97 16.508 29.073 5.807 1.00 25.28 N ATOM 1492 CA ASP A 97 17.669 28.966 6.684 1.00 25.89 C ATOM 1493 C ASP A 97 17.418 27.944 7.785 1.00 25.11 C ATOM 1494 O ASP A 97 18.286 27.687 8.620 1.00 25.54 O ATOM 1495 CB ASP A 97 17.992 30.325 7.310 1.00 27.15 C ATOM 1496 CG ASP A 97 17.667 31.482 6.387 1.00 27.81 C ATOM 1497 OD1 ASP A 97 18.413 31.690 5.407 1.00 28.07 O ATOM 1498 OD2 ASP A 97 16.664 32.182 6.646 1.00 28.13 O ATOM 0 H ASP A 97 15.884 29.849 6.028 1.00 25.28 H new ATOM 0 HA ASP A 97 18.517 28.638 6.083 1.00 25.89 H new ATOM 0 HB2 ASP A 97 17.431 30.436 8.238 1.00 27.15 H new ATOM 0 HB3 ASP A 97 19.050 30.359 7.571 1.00 27.15 H new ATOM 1503 N GLY A 98 16.225 27.362 7.777 1.00 24.03 N ATOM 1504 CA GLY A 98 15.873 26.374 8.779 1.00 23.27 C ATOM 1505 C GLY A 98 15.059 26.967 9.912 1.00 23.53 C ATOM 1506 O GLY A 98 14.545 26.237 10.760 1.00 22.95 O ATOM 0 H GLY A 98 15.494 27.557 7.093 1.00 24.03 H new ATOM 0 HA2 GLY A 98 15.306 25.570 8.310 1.00 23.27 H new ATOM 0 HA3 GLY A 98 16.783 25.929 9.182 1.00 23.27 H new ATOM 1510 N PHE A 99 14.961 28.292 9.939 1.00 24.50 N ATOM 1511 CA PHE A 99 14.195 28.985 10.967 1.00 24.94 C ATOM 1512 C PHE A 99 13.436 30.188 10.407 1.00 25.47 C ATOM 1513 O PHE A 99 13.983 31.004 9.659 1.00 26.19 O ATOM 1514 CB PHE A 99 15.101 29.402 12.130 1.00 25.98 C ATOM 1515 CG PHE A 99 16.546 29.566 11.756 1.00 26.68 C ATOM 1516 CD1 PHE A 99 17.011 30.740 11.185 1.00 27.05 C ATOM 1517 CD2 PHE A 99 17.440 28.534 11.982 1.00 27.04 C ATOM 1518 CE1 PHE A 99 18.344 30.877 10.847 1.00 27.77 C ATOM 1519 CE2 PHE A 99 18.771 28.662 11.648 1.00 27.76 C ATOM 1520 CZ PHE A 99 19.227 29.838 11.079 1.00 28.11 C ATOM 0 H PHE A 99 15.404 28.909 9.258 1.00 24.50 H new ATOM 0 HA PHE A 99 13.450 28.284 11.343 1.00 24.94 H new ATOM 0 HB2 PHE A 99 14.735 30.342 12.542 1.00 25.98 H new ATOM 0 HB3 PHE A 99 15.024 28.656 12.921 1.00 25.98 H new ATOM 0 HD1 PHE A 99 16.326 31.555 11.003 1.00 27.05 H new ATOM 0 HD2 PHE A 99 17.089 27.614 12.427 1.00 27.04 H new ATOM 0 HE1 PHE A 99 18.696 31.796 10.402 1.00 27.77 H new ATOM 0 HE2 PHE A 99 19.456 27.847 11.830 1.00 27.76 H new ATOM 0 HZ PHE A 99 20.269 29.944 10.817 1.00 28.11 H new ATOM 1530 N ILE A 100 12.161 30.273 10.784 1.00 25.18 N ATOM 1531 CA ILE A 100 11.282 31.347 10.349 1.00 25.71 C ATOM 1532 C ILE A 100 11.337 32.528 11.310 1.00 26.98 C ATOM 1533 O ILE A 100 10.920 32.421 12.463 1.00 27.09 O ATOM 1534 CB ILE A 100 9.817 30.870 10.278 1.00 24.88 C ATOM 1535 CG1 ILE A 100 9.679 29.647 9.379 1.00 23.56 C ATOM 1536 CG2 ILE A 100 8.915 31.988 9.783 1.00 25.54 C ATOM 1537 CD1 ILE A 100 8.427 28.850 9.664 1.00 22.62 C ATOM 0 H ILE A 100 11.712 29.596 11.401 1.00 25.18 H new ATOM 0 HA ILE A 100 11.628 31.652 9.361 1.00 25.71 H new ATOM 0 HB ILE A 100 9.509 30.589 11.285 1.00 24.88 H new ATOM 0 HG12 ILE A 100 9.672 29.967 8.337 1.00 23.56 H new ATOM 0 HG13 ILE A 100 10.550 29.005 9.510 1.00 23.56 H new ATOM 0 HG21 ILE A 100 7.885 31.633 9.740 1.00 25.54 H new ATOM 0 HG22 ILE A 100 8.978 32.835 10.466 1.00 25.54 H new ATOM 0 HG23 ILE A 100 9.234 32.299 8.788 1.00 25.54 H new ATOM 0 HD11 ILE A 100 8.382 27.991 8.994 1.00 22.62 H new ATOM 0 HD12 ILE A 100 8.444 28.504 10.697 1.00 22.62 H new ATOM 0 HD13 ILE A 100 7.551 29.480 9.506 1.00 22.62 H new ATOM 1549 N SER A 101 11.846 33.649 10.829 1.00 27.98 N ATOM 1550 CA SER A 101 11.921 34.856 11.638 1.00 29.24 C ATOM 1551 C SER A 101 10.550 35.530 11.684 1.00 29.53 C ATOM 1552 O SER A 101 9.747 35.343 10.773 1.00 29.01 O ATOM 1553 CB SER A 101 12.967 35.807 11.055 1.00 30.23 C ATOM 1554 OG SER A 101 12.826 37.116 11.577 1.00 31.40 O ATOM 0 H SER A 101 12.214 33.750 9.883 1.00 27.98 H new ATOM 0 HA SER A 101 12.217 34.595 12.654 1.00 29.24 H new ATOM 0 HB2 SER A 101 13.966 35.431 11.277 1.00 30.23 H new ATOM 0 HB3 SER A 101 12.871 35.835 9.970 1.00 30.23 H new ATOM 0 HG SER A 101 13.510 37.699 11.186 1.00 31.40 H new ATOM 1560 N PRO A 102 10.249 36.294 12.753 1.00 30.40 N ATOM 1561 CA PRO A 102 8.969 36.988 12.895 1.00 30.84 C ATOM 1562 C PRO A 102 8.424 37.527 11.572 1.00 31.00 C ATOM 1563 O PRO A 102 7.283 37.253 11.208 1.00 30.80 O ATOM 1564 CB PRO A 102 9.318 38.132 13.840 1.00 32.14 C ATOM 1565 CG PRO A 102 10.385 37.576 14.725 1.00 32.10 C ATOM 1566 CD PRO A 102 11.119 36.528 13.921 1.00 31.10 C ATOM 0 HA PRO A 102 8.182 36.326 13.256 1.00 30.84 H new ATOM 0 HB2 PRO A 102 9.672 39.005 13.292 1.00 32.14 H new ATOM 0 HB3 PRO A 102 8.449 38.449 14.417 1.00 32.14 H new ATOM 0 HG2 PRO A 102 11.067 38.362 15.049 1.00 32.10 H new ATOM 0 HG3 PRO A 102 9.952 37.139 15.625 1.00 32.10 H new ATOM 0 HD2 PRO A 102 12.106 36.877 13.619 1.00 31.10 H new ATOM 0 HD3 PRO A 102 11.266 35.615 14.497 1.00 31.10 H new ATOM 1574 N ALA A 103 9.247 38.282 10.851 1.00 31.44 N ATOM 1575 CA ALA A 103 8.834 38.861 9.575 1.00 31.71 C ATOM 1576 C ALA A 103 8.401 37.784 8.580 1.00 30.52 C ATOM 1577 O ALA A 103 7.473 37.985 7.804 1.00 30.50 O ATOM 1578 CB ALA A 103 9.960 39.698 8.989 1.00 32.55 C ATOM 0 H ALA A 103 10.203 38.508 11.127 1.00 31.44 H new ATOM 0 HA ALA A 103 7.973 39.502 9.764 1.00 31.71 H new ATOM 0 HB1 ALA A 103 9.640 40.124 8.038 1.00 32.55 H new ATOM 0 HB2 ALA A 103 10.213 40.502 9.680 1.00 32.55 H new ATOM 0 HB3 ALA A 103 10.835 39.069 8.828 1.00 32.55 H new ATOM 1584 N GLU A 104 9.080 36.646 8.615 1.00 29.57 N ATOM 1585 CA GLU A 104 8.782 35.526 7.722 1.00 28.37 C ATOM 1586 C GLU A 104 7.454 34.859 8.085 1.00 27.59 C ATOM 1587 O GLU A 104 6.596 34.646 7.222 1.00 27.15 O ATOM 1588 CB GLU A 104 9.930 34.519 7.793 1.00 27.67 C ATOM 1589 CG GLU A 104 11.293 35.139 7.524 1.00 28.56 C ATOM 1590 CD GLU A 104 12.436 34.194 7.833 1.00 28.05 C ATOM 1591 OE1 GLU A 104 12.212 32.965 7.821 1.00 28.09 O ATOM 1592 OE2 GLU A 104 13.556 34.681 8.087 1.00 27.67 O ATOM 0 H GLU A 104 9.851 36.470 9.259 1.00 29.57 H new ATOM 0 HA GLU A 104 8.683 35.901 6.703 1.00 28.37 H new ATOM 0 HB2 GLU A 104 9.938 34.056 8.780 1.00 27.67 H new ATOM 0 HB3 GLU A 104 9.751 33.724 7.070 1.00 27.67 H new ATOM 0 HG2 GLU A 104 11.350 35.442 6.478 1.00 28.56 H new ATOM 0 HG3 GLU A 104 11.402 36.042 8.124 1.00 28.56 H new ATOM 1599 N LEU A 105 7.274 34.566 9.367 1.00 27.51 N ATOM 1600 CA LEU A 105 6.060 33.909 9.841 1.00 26.86 C ATOM 1601 C LEU A 105 4.823 34.773 9.608 1.00 27.51 C ATOM 1602 O LEU A 105 3.866 34.337 8.973 1.00 26.94 O ATOM 1603 CB LEU A 105 6.193 33.573 11.330 1.00 26.95 C ATOM 1604 CG LEU A 105 4.981 32.883 11.960 1.00 26.49 C ATOM 1605 CD1 LEU A 105 4.644 31.597 11.220 1.00 25.10 C ATOM 1606 CD2 LEU A 105 5.241 32.597 13.431 1.00 26.84 C ATOM 0 H LEU A 105 7.954 34.773 10.099 1.00 27.51 H new ATOM 0 HA LEU A 105 5.935 32.989 9.270 1.00 26.86 H new ATOM 0 HB2 LEU A 105 7.064 32.932 11.464 1.00 26.95 H new ATOM 0 HB3 LEU A 105 6.389 34.495 11.877 1.00 26.95 H new ATOM 0 HG LEU A 105 4.126 33.554 11.880 1.00 26.49 H new ATOM 0 HD11 LEU A 105 3.779 31.125 11.686 1.00 25.10 H new ATOM 0 HD12 LEU A 105 4.415 31.825 10.179 1.00 25.10 H new ATOM 0 HD13 LEU A 105 5.496 30.918 11.264 1.00 25.10 H new ATOM 0 HD21 LEU A 105 4.370 32.106 13.866 1.00 26.84 H new ATOM 0 HD22 LEU A 105 6.110 31.946 13.527 1.00 26.84 H new ATOM 0 HD23 LEU A 105 5.429 33.533 13.956 1.00 26.84 H new ATOM 1618 N ARG A 106 4.856 35.998 10.119 1.00 28.76 N ATOM 1619 CA ARG A 106 3.735 36.925 9.980 1.00 29.56 C ATOM 1620 C ARG A 106 3.403 37.201 8.520 1.00 29.58 C ATOM 1621 O ARG A 106 2.271 37.026 8.082 1.00 29.39 O ATOM 1622 CB ARG A 106 4.066 38.253 10.658 1.00 30.94 C ATOM 1623 CG ARG A 106 4.542 38.109 12.087 1.00 31.13 C ATOM 1624 CD ARG A 106 4.853 39.462 12.703 1.00 32.40 C ATOM 1625 NE ARG A 106 6.016 40.089 12.080 1.00 32.96 N ATOM 1626 CZ ARG A 106 6.608 41.181 12.552 1.00 33.97 C ATOM 1627 NH1 ARG A 106 6.144 41.772 13.646 1.00 34.53 N ATOM 1628 NH2 ARG A 106 7.665 41.685 11.930 1.00 34.47 N ATOM 0 H ARG A 106 5.650 36.375 10.636 1.00 28.76 H new ATOM 0 HA ARG A 106 2.872 36.456 10.453 1.00 29.56 H new ATOM 0 HB2 ARG A 106 4.835 38.764 10.079 1.00 30.94 H new ATOM 0 HB3 ARG A 106 3.181 38.888 10.642 1.00 30.94 H new ATOM 0 HG2 ARG A 106 3.778 37.605 12.678 1.00 31.13 H new ATOM 0 HG3 ARG A 106 5.432 37.481 12.115 1.00 31.13 H new ATOM 0 HD2 ARG A 106 3.988 40.116 12.598 1.00 32.40 H new ATOM 0 HD3 ARG A 106 5.034 39.342 13.771 1.00 32.40 H new ATOM 0 HE ARG A 106 6.396 39.664 11.234 1.00 32.96 H new ATOM 0 HH11 ARG A 106 5.331 41.388 14.127 1.00 34.53 H new ATOM 0 HH12 ARG A 106 6.601 42.610 14.006 1.00 34.53 H new ATOM 0 HH21 ARG A 106 8.024 41.234 11.088 1.00 34.47 H new ATOM 0 HH22 ARG A 106 8.119 42.523 12.293 1.00 34.47 H new ATOM 1642 N PHE A 107 4.409 37.637 7.784 1.00 29.92 N ATOM 1643 CA PHE A 107 4.256 37.991 6.373 1.00 30.13 C ATOM 1644 C PHE A 107 3.523 36.922 5.573 1.00 29.04 C ATOM 1645 O PHE A 107 2.745 37.244 4.678 1.00 29.31 O ATOM 1646 CB PHE A 107 5.622 38.257 5.738 1.00 30.44 C ATOM 1647 CG PHE A 107 5.556 38.613 4.280 1.00 30.81 C ATOM 1648 CD1 PHE A 107 5.174 39.883 3.879 1.00 30.89 C ATOM 1649 CD2 PHE A 107 5.876 37.677 3.310 1.00 31.17 C ATOM 1650 CE1 PHE A 107 5.113 40.214 2.539 1.00 31.32 C ATOM 1651 CE2 PHE A 107 5.817 38.001 1.968 1.00 31.59 C ATOM 1652 CZ PHE A 107 5.435 39.271 1.582 1.00 31.68 C ATOM 0 H PHE A 107 5.357 37.758 8.141 1.00 29.92 H new ATOM 0 HA PHE A 107 3.649 38.896 6.344 1.00 30.13 H new ATOM 0 HB2 PHE A 107 6.111 39.068 6.278 1.00 30.44 H new ATOM 0 HB3 PHE A 107 6.246 37.372 5.858 1.00 30.44 H new ATOM 0 HD1 PHE A 107 4.921 40.624 4.623 1.00 30.89 H new ATOM 0 HD2 PHE A 107 6.175 36.682 3.606 1.00 31.17 H new ATOM 0 HE1 PHE A 107 4.814 41.208 2.240 1.00 31.32 H new ATOM 0 HE2 PHE A 107 6.069 37.262 1.222 1.00 31.59 H new ATOM 0 HZ PHE A 107 5.388 39.526 0.534 1.00 31.68 H new ATOM 1662 N VAL A 108 3.752 35.654 5.892 1.00 27.85 N ATOM 1663 CA VAL A 108 3.109 34.580 5.151 1.00 26.77 C ATOM 1664 C VAL A 108 1.712 34.260 5.684 1.00 26.50 C ATOM 1665 O VAL A 108 0.766 34.124 4.908 1.00 26.41 O ATOM 1666 CB VAL A 108 3.974 33.310 5.152 1.00 25.58 C ATOM 1667 CG1 VAL A 108 3.243 32.168 4.472 1.00 24.43 C ATOM 1668 CG2 VAL A 108 5.305 33.582 4.469 1.00 25.89 C ATOM 0 H VAL A 108 4.368 35.349 6.646 1.00 27.85 H new ATOM 0 HA VAL A 108 3.000 34.935 4.126 1.00 26.77 H new ATOM 0 HB VAL A 108 4.169 33.020 6.184 1.00 25.58 H new ATOM 0 HG11 VAL A 108 3.871 31.277 4.482 1.00 24.43 H new ATOM 0 HG12 VAL A 108 2.314 31.963 5.003 1.00 24.43 H new ATOM 0 HG13 VAL A 108 3.019 32.442 3.441 1.00 24.43 H new ATOM 0 HG21 VAL A 108 5.909 32.675 4.476 1.00 25.89 H new ATOM 0 HG22 VAL A 108 5.129 33.893 3.439 1.00 25.89 H new ATOM 0 HG23 VAL A 108 5.832 34.373 5.002 1.00 25.89 H new ATOM 1678 N MET A 109 1.581 34.139 6.999 1.00 26.48 N ATOM 1679 CA MET A 109 0.289 33.828 7.605 1.00 26.33 C ATOM 1680 C MET A 109 -0.714 34.963 7.402 1.00 27.50 C ATOM 1681 O MET A 109 -1.924 34.740 7.404 1.00 27.46 O ATOM 1682 CB MET A 109 0.455 33.535 9.095 1.00 26.26 C ATOM 1683 CG MET A 109 1.045 34.689 9.883 1.00 27.48 C ATOM 1684 SD MET A 109 1.709 34.163 11.472 1.00 27.39 S ATOM 1685 CE MET A 109 0.243 33.487 12.246 1.00 26.90 C ATOM 0 H MET A 109 2.347 34.250 7.664 1.00 26.48 H new ATOM 0 HA MET A 109 -0.103 32.940 7.108 1.00 26.33 H new ATOM 0 HB2 MET A 109 -0.517 33.279 9.516 1.00 26.26 H new ATOM 0 HB3 MET A 109 1.095 32.661 9.215 1.00 26.26 H new ATOM 0 HG2 MET A 109 1.836 35.158 9.298 1.00 27.48 H new ATOM 0 HG3 MET A 109 0.277 35.446 10.045 1.00 27.48 H new ATOM 0 HE1 MET A 109 0.082 33.973 13.208 1.00 26.90 H new ATOM 0 HE2 MET A 109 -0.620 33.660 11.603 1.00 26.90 H new ATOM 0 HE3 MET A 109 0.373 32.416 12.398 1.00 26.90 H new ATOM 1695 N ILE A 110 -0.203 36.178 7.232 1.00 28.57 N ATOM 1696 CA ILE A 110 -1.054 37.346 7.032 1.00 29.77 C ATOM 1697 C ILE A 110 -1.376 37.552 5.555 1.00 29.90 C ATOM 1698 O ILE A 110 -2.484 37.960 5.204 1.00 30.43 O ATOM 1699 CB ILE A 110 -0.395 38.625 7.586 1.00 30.96 C ATOM 1700 CG1 ILE A 110 -0.096 38.467 9.079 1.00 31.00 C ATOM 1701 CG2 ILE A 110 -1.294 39.832 7.348 1.00 32.20 C ATOM 1702 CD1 ILE A 110 0.799 39.553 9.641 1.00 32.05 C ATOM 0 H ILE A 110 0.797 36.380 7.229 1.00 28.57 H new ATOM 0 HA ILE A 110 -1.979 37.156 7.577 1.00 29.77 H new ATOM 0 HB ILE A 110 0.546 38.786 7.060 1.00 30.96 H new ATOM 0 HG12 ILE A 110 -1.036 38.463 9.630 1.00 31.00 H new ATOM 0 HG13 ILE A 110 0.375 37.498 9.245 1.00 31.00 H new ATOM 0 HG21 ILE A 110 -0.814 40.727 7.745 1.00 32.20 H new ATOM 0 HG22 ILE A 110 -1.463 39.955 6.278 1.00 32.20 H new ATOM 0 HG23 ILE A 110 -2.249 39.679 7.851 1.00 32.20 H new ATOM 0 HD11 ILE A 110 0.966 39.374 10.703 1.00 32.05 H new ATOM 0 HD12 ILE A 110 1.755 39.544 9.117 1.00 32.05 H new ATOM 0 HD13 ILE A 110 0.321 40.524 9.508 1.00 32.05 H new ATOM 1714 N ASN A 111 -0.402 37.270 4.692 1.00 29.51 N ATOM 1715 CA ASN A 111 -0.594 37.427 3.254 1.00 29.69 C ATOM 1716 C ASN A 111 -1.665 36.471 2.742 1.00 28.92 C ATOM 1717 O ASN A 111 -2.467 36.831 1.880 1.00 29.42 O ATOM 1718 CB ASN A 111 0.721 37.202 2.503 1.00 29.42 C ATOM 1719 CG ASN A 111 1.560 38.464 2.412 1.00 30.42 C ATOM 1720 OD1 ASN A 111 1.452 39.326 3.417 1.00 30.38 O flip ATOM 1721 ND2 ASN A 111 2.301 38.661 1.449 1.00 31.39 N flip ATOM 0 H ASN A 111 0.522 36.934 4.962 1.00 29.51 H new ATOM 0 HA ASN A 111 -0.927 38.448 3.070 1.00 29.69 H new ATOM 0 HB2 ASN A 111 1.295 36.423 3.006 1.00 29.42 H new ATOM 0 HB3 ASN A 111 0.505 36.840 1.498 1.00 29.42 H new ATOM 0 HD21 ASN A 111 2.355 37.973 0.698 1.00 31.39 H new ATOM 0 HD22 ASN A 111 2.861 39.512 1.402 1.00 31.39 H new ATOM 1728 N LEU A 112 -1.677 35.252 3.275 1.00 27.75 N ATOM 1729 CA LEU A 112 -2.668 34.260 2.872 1.00 26.97 C ATOM 1730 C LEU A 112 -4.065 34.709 3.292 1.00 27.67 C ATOM 1731 O LEU A 112 -5.071 34.139 2.868 1.00 27.59 O ATOM 1732 CB LEU A 112 -2.333 32.874 3.443 1.00 25.59 C ATOM 1733 CG LEU A 112 -2.442 32.726 4.961 1.00 25.50 C ATOM 1734 CD1 LEU A 112 -3.862 32.363 5.364 1.00 25.51 C ATOM 1735 CD2 LEU A 112 -1.467 31.670 5.459 1.00 24.36 C ATOM 0 H LEU A 112 -1.016 34.929 3.982 1.00 27.75 H new ATOM 0 HA LEU A 112 -2.647 34.176 1.785 1.00 26.97 H new ATOM 0 HB2 LEU A 112 -2.995 32.143 2.979 1.00 25.59 H new ATOM 0 HB3 LEU A 112 -1.316 32.617 3.146 1.00 25.59 H new ATOM 0 HG LEU A 112 -2.188 33.682 5.419 1.00 25.50 H new ATOM 0 HD11 LEU A 112 -3.918 32.262 6.448 1.00 25.51 H new ATOM 0 HD12 LEU A 112 -4.545 33.147 5.037 1.00 25.51 H new ATOM 0 HD13 LEU A 112 -4.143 31.419 4.897 1.00 25.51 H new ATOM 0 HD21 LEU A 112 -1.555 31.575 6.541 1.00 24.36 H new ATOM 0 HD22 LEU A 112 -1.697 30.713 4.991 1.00 24.36 H new ATOM 0 HD23 LEU A 112 -0.449 31.964 5.202 1.00 24.36 H new ATOM 1747 N GLY A 113 -4.110 35.743 4.132 1.00 28.44 N ATOM 1748 CA GLY A 113 -5.374 36.279 4.605 1.00 29.23 C ATOM 1749 C GLY A 113 -5.803 35.733 5.953 1.00 29.21 C ATOM 1750 O GLY A 113 -6.467 34.700 6.037 1.00 29.01 O ATOM 0 H GLY A 113 -3.285 36.221 4.495 1.00 28.44 H new ATOM 0 HA2 GLY A 113 -5.296 37.364 4.671 1.00 29.23 H new ATOM 0 HA3 GLY A 113 -6.149 36.059 3.871 1.00 29.23 H new ATOM 1754 N GLU A 114 -5.415 36.444 7.012 1.00 29.51 N ATOM 1755 CA GLU A 114 -5.765 36.060 8.379 1.00 29.65 C ATOM 1756 C GLU A 114 -5.912 37.274 9.288 1.00 30.86 C ATOM 1757 O GLU A 114 -6.757 37.293 10.183 1.00 31.02 O ATOM 1758 CB GLU A 114 -4.729 35.100 8.963 1.00 28.56 C ATOM 1759 CG GLU A 114 -4.834 33.686 8.421 1.00 27.33 C ATOM 1760 CD GLU A 114 -4.063 32.682 9.254 1.00 26.52 C ATOM 1761 OE1 GLU A 114 -4.631 32.165 10.239 1.00 26.29 O ATOM 1762 OE2 GLU A 114 -2.889 32.411 8.920 1.00 26.19 O ATOM 0 H GLU A 114 -4.855 37.294 6.948 1.00 29.51 H new ATOM 0 HA GLU A 114 -6.729 35.554 8.327 1.00 29.65 H new ATOM 0 HB2 GLU A 114 -3.731 35.486 8.755 1.00 28.56 H new ATOM 0 HB3 GLU A 114 -4.841 35.074 10.047 1.00 28.56 H new ATOM 0 HG2 GLU A 114 -5.883 33.392 8.384 1.00 27.33 H new ATOM 0 HG3 GLU A 114 -4.461 33.665 7.397 1.00 27.33 H new ATOM 1769 N LYS A 115 -5.086 38.276 9.055 1.00 31.76 N ATOM 1770 CA LYS A 115 -5.110 39.502 9.846 1.00 32.97 C ATOM 1771 C LYS A 115 -4.813 39.194 11.305 1.00 32.97 C ATOM 1772 O LYS A 115 -5.687 39.291 12.168 1.00 33.55 O ATOM 1773 CB LYS A 115 -6.464 40.208 9.716 1.00 34.07 C ATOM 1774 CG LYS A 115 -6.646 40.959 8.406 1.00 34.37 C ATOM 1775 CD LYS A 115 -6.732 40.012 7.219 1.00 34.03 C ATOM 1776 CE LYS A 115 -6.979 40.765 5.923 1.00 34.21 C ATOM 1777 NZ LYS A 115 -5.899 41.749 5.635 1.00 34.46 N ATOM 0 H LYS A 115 -4.381 38.269 8.318 1.00 31.76 H new ATOM 0 HA LYS A 115 -4.339 40.171 9.464 1.00 32.97 H new ATOM 0 HB2 LYS A 115 -7.259 39.468 9.812 1.00 34.07 H new ATOM 0 HB3 LYS A 115 -6.578 40.908 10.543 1.00 34.07 H new ATOM 0 HG2 LYS A 115 -7.552 41.562 8.456 1.00 34.37 H new ATOM 0 HG3 LYS A 115 -5.813 41.647 8.263 1.00 34.37 H new ATOM 0 HD2 LYS A 115 -5.806 39.442 7.139 1.00 34.03 H new ATOM 0 HD3 LYS A 115 -7.535 39.294 7.383 1.00 34.03 H new ATOM 0 HE2 LYS A 115 -7.051 40.055 5.099 1.00 34.21 H new ATOM 0 HE3 LYS A 115 -7.936 41.284 5.982 1.00 34.21 H new ATOM 0 HZ1 LYS A 115 -6.014 42.117 4.669 1.00 34.46 H new ATOM 0 HZ2 LYS A 115 -5.955 42.535 6.314 1.00 34.46 H new ATOM 0 HZ3 LYS A 115 -4.973 41.283 5.720 1.00 34.46 H new ATOM 1791 N VAL A 116 -3.569 38.816 11.568 1.00 32.39 N ATOM 1792 CA VAL A 116 -3.139 38.483 12.914 1.00 32.39 C ATOM 1793 C VAL A 116 -2.487 39.677 13.597 1.00 33.53 C ATOM 1794 O VAL A 116 -1.879 40.528 12.945 1.00 33.96 O ATOM 1795 CB VAL A 116 -2.137 37.311 12.906 1.00 31.13 C ATOM 1796 CG1 VAL A 116 -2.593 36.217 11.956 1.00 29.96 C ATOM 1797 CG2 VAL A 116 -0.741 37.794 12.547 1.00 31.21 C ATOM 0 H VAL A 116 -2.839 38.733 10.861 1.00 32.39 H new ATOM 0 HA VAL A 116 -4.033 38.193 13.467 1.00 32.39 H new ATOM 0 HB VAL A 116 -2.100 36.891 13.911 1.00 31.13 H new ATOM 0 HG11 VAL A 116 -1.870 35.401 11.967 1.00 29.96 H new ATOM 0 HG12 VAL A 116 -3.567 35.844 12.272 1.00 29.96 H new ATOM 0 HG13 VAL A 116 -2.669 36.620 10.946 1.00 29.96 H new ATOM 0 HG21 VAL A 116 -0.052 36.949 12.548 1.00 31.21 H new ATOM 0 HG22 VAL A 116 -0.757 38.248 11.556 1.00 31.21 H new ATOM 0 HG23 VAL A 116 -0.412 38.531 13.279 1.00 31.21 H new ATOM 1807 N THR A 117 -2.626 39.735 14.911 1.00 34.07 N ATOM 1808 CA THR A 117 -2.032 40.805 15.693 1.00 35.18 C ATOM 1809 C THR A 117 -0.624 40.415 16.131 1.00 34.78 C ATOM 1810 O THR A 117 -0.359 39.248 16.417 1.00 33.80 O ATOM 1811 CB THR A 117 -2.881 41.134 16.934 1.00 36.10 C ATOM 1812 OG1 THR A 117 -3.203 39.932 17.641 1.00 35.42 O ATOM 1813 CG2 THR A 117 -4.160 41.855 16.538 1.00 36.81 C ATOM 0 H THR A 117 -3.147 39.051 15.460 1.00 34.07 H new ATOM 0 HA THR A 117 -1.989 41.692 15.061 1.00 35.18 H new ATOM 0 HB THR A 117 -2.299 41.790 17.582 1.00 36.10 H new ATOM 0 HG1 THR A 117 -3.868 40.128 18.333 1.00 35.42 H new ATOM 0 HG21 THR A 117 -4.744 42.077 17.431 1.00 36.81 H new ATOM 0 HG22 THR A 117 -3.910 42.785 16.027 1.00 36.81 H new ATOM 0 HG23 THR A 117 -4.744 41.220 15.871 1.00 36.81 H new ATOM 1821 N ASP A 118 0.276 41.389 16.176 1.00 35.59 N ATOM 1822 CA ASP A 118 1.656 41.134 16.570 1.00 35.40 C ATOM 1823 C ASP A 118 1.718 40.382 17.894 1.00 35.21 C ATOM 1824 O ASP A 118 2.614 39.570 18.117 1.00 34.50 O ATOM 1825 CB ASP A 118 2.427 42.450 16.686 1.00 36.59 C ATOM 1826 CG ASP A 118 2.539 43.172 15.356 1.00 36.85 C ATOM 1827 OD1 ASP A 118 3.486 42.875 14.599 1.00 37.02 O ATOM 1828 OD2 ASP A 118 1.680 44.034 15.074 1.00 36.95 O ATOM 0 H ASP A 118 0.076 42.362 15.945 1.00 35.59 H new ATOM 0 HA ASP A 118 2.115 40.515 15.799 1.00 35.40 H new ATOM 0 HB2 ASP A 118 1.929 43.098 17.407 1.00 36.59 H new ATOM 0 HB3 ASP A 118 3.426 42.250 17.073 1.00 36.59 H new ATOM 1833 N GLU A 119 0.761 40.663 18.771 1.00 35.91 N ATOM 1834 CA GLU A 119 0.712 40.021 20.077 1.00 35.91 C ATOM 1835 C GLU A 119 0.595 38.501 19.970 1.00 34.60 C ATOM 1836 O GLU A 119 1.301 37.776 20.672 1.00 34.24 O ATOM 1837 CB GLU A 119 -0.448 40.581 20.904 1.00 36.90 C ATOM 1838 CG GLU A 119 -1.813 40.376 20.270 1.00 36.71 C ATOM 1839 CD GLU A 119 -2.943 40.879 21.147 1.00 37.77 C ATOM 1840 OE1 GLU A 119 -3.429 40.101 21.994 1.00 38.19 O ATOM 1841 OE2 GLU A 119 -3.343 42.052 20.985 1.00 38.22 O ATOM 0 H GLU A 119 0.009 41.331 18.600 1.00 35.91 H new ATOM 0 HA GLU A 119 1.654 40.242 20.579 1.00 35.91 H new ATOM 0 HB2 GLU A 119 -0.441 40.110 21.887 1.00 36.90 H new ATOM 0 HB3 GLU A 119 -0.288 41.648 21.060 1.00 36.90 H new ATOM 0 HG2 GLU A 119 -1.845 40.892 19.310 1.00 36.71 H new ATOM 0 HG3 GLU A 119 -1.960 39.315 20.067 1.00 36.71 H new ATOM 1848 N GLU A 120 -0.288 38.008 19.103 1.00 33.92 N ATOM 1849 CA GLU A 120 -0.445 36.566 18.964 1.00 32.68 C ATOM 1850 C GLU A 120 0.811 35.976 18.340 1.00 31.73 C ATOM 1851 O GLU A 120 1.192 34.843 18.638 1.00 30.88 O ATOM 1852 CB GLU A 120 -1.692 36.208 18.148 1.00 32.23 C ATOM 1853 CG GLU A 120 -1.586 36.507 16.664 1.00 31.98 C ATOM 1854 CD GLU A 120 -2.717 35.884 15.873 1.00 31.39 C ATOM 1855 OE1 GLU A 120 -3.776 36.533 15.739 1.00 31.34 O ATOM 1856 OE2 GLU A 120 -2.546 34.746 15.387 1.00 31.03 O ATOM 0 H GLU A 120 -0.890 38.570 18.502 1.00 33.92 H new ATOM 0 HA GLU A 120 -0.585 36.135 19.955 1.00 32.68 H new ATOM 0 HB2 GLU A 120 -1.901 35.146 18.277 1.00 32.23 H new ATOM 0 HB3 GLU A 120 -2.544 36.752 18.555 1.00 32.23 H new ATOM 0 HG2 GLU A 120 -1.590 37.586 16.511 1.00 31.98 H new ATOM 0 HG3 GLU A 120 -0.633 36.135 16.287 1.00 31.98 H new ATOM 1863 N ILE A 121 1.449 36.754 17.470 1.00 31.93 N ATOM 1864 CA ILE A 121 2.685 36.329 16.833 1.00 31.19 C ATOM 1865 C ILE A 121 3.777 36.091 17.876 1.00 31.38 C ATOM 1866 O ILE A 121 4.409 35.036 17.893 1.00 30.48 O ATOM 1867 CB ILE A 121 3.184 37.371 15.803 1.00 31.66 C ATOM 1868 CG1 ILE A 121 2.233 37.456 14.600 1.00 31.30 C ATOM 1869 CG2 ILE A 121 4.595 37.037 15.342 1.00 31.21 C ATOM 1870 CD1 ILE A 121 1.865 36.110 14.013 1.00 29.89 C ATOM 0 H ILE A 121 1.128 37.681 17.192 1.00 31.93 H new ATOM 0 HA ILE A 121 2.470 35.397 16.310 1.00 31.19 H new ATOM 0 HB ILE A 121 3.201 38.345 16.292 1.00 31.66 H new ATOM 0 HG12 ILE A 121 1.321 37.970 14.905 1.00 31.30 H new ATOM 0 HG13 ILE A 121 2.697 38.065 13.824 1.00 31.30 H new ATOM 0 HG21 ILE A 121 4.927 37.781 14.618 1.00 31.21 H new ATOM 0 HG22 ILE A 121 5.268 37.039 16.199 1.00 31.21 H new ATOM 0 HG23 ILE A 121 4.602 36.051 14.877 1.00 31.21 H new ATOM 0 HD11 ILE A 121 1.191 36.253 13.168 1.00 29.89 H new ATOM 0 HD12 ILE A 121 2.768 35.601 13.675 1.00 29.89 H new ATOM 0 HD13 ILE A 121 1.370 35.505 14.773 1.00 29.89 H new ATOM 1882 N ASP A 122 4.007 37.079 18.741 1.00 32.59 N ATOM 1883 CA ASP A 122 5.029 36.955 19.776 1.00 32.95 C ATOM 1884 C ASP A 122 4.733 35.774 20.696 1.00 32.41 C ATOM 1885 O ASP A 122 5.647 35.150 21.234 1.00 32.19 O ATOM 1886 CB ASP A 122 5.131 38.247 20.597 1.00 34.41 C ATOM 1887 CG ASP A 122 4.116 38.324 21.723 1.00 35.02 C ATOM 1888 OD1 ASP A 122 4.250 37.552 22.694 1.00 35.24 O ATOM 1889 OD2 ASP A 122 3.181 39.145 21.628 1.00 35.33 O ATOM 0 H ASP A 122 3.503 37.966 18.745 1.00 32.59 H new ATOM 0 HA ASP A 122 5.984 36.778 19.281 1.00 32.95 H new ATOM 0 HB2 ASP A 122 6.134 38.325 21.016 1.00 34.41 H new ATOM 0 HB3 ASP A 122 4.994 39.102 19.935 1.00 34.41 H new ATOM 1894 N GLU A 123 3.448 35.474 20.871 1.00 32.28 N ATOM 1895 CA GLU A 123 3.024 34.379 21.736 1.00 31.88 C ATOM 1896 C GLU A 123 3.527 33.031 21.226 1.00 30.51 C ATOM 1897 O GLU A 123 4.185 32.290 21.954 1.00 30.32 O ATOM 1898 CB GLU A 123 1.495 34.356 21.844 1.00 32.05 C ATOM 1899 CG GLU A 123 0.952 33.174 22.633 1.00 31.72 C ATOM 1900 CD GLU A 123 1.453 33.143 24.064 1.00 32.49 C ATOM 1901 OE1 GLU A 123 0.897 33.882 24.903 1.00 32.95 O ATOM 1902 OE2 GLU A 123 2.398 32.377 24.346 1.00 32.69 O ATOM 0 H GLU A 123 2.681 35.976 20.423 1.00 32.28 H new ATOM 0 HA GLU A 123 3.458 34.548 22.721 1.00 31.88 H new ATOM 0 HB2 GLU A 123 1.160 35.280 22.315 1.00 32.05 H new ATOM 0 HB3 GLU A 123 1.070 34.337 20.841 1.00 32.05 H new ATOM 0 HG2 GLU A 123 -0.137 33.214 22.635 1.00 31.72 H new ATOM 0 HG3 GLU A 123 1.236 32.248 22.133 1.00 31.72 H new ATOM 1909 N MET A 124 3.205 32.715 19.977 1.00 29.62 N ATOM 1910 CA MET A 124 3.621 31.448 19.383 1.00 28.28 C ATOM 1911 C MET A 124 5.142 31.306 19.351 1.00 28.13 C ATOM 1912 O MET A 124 5.681 30.281 19.770 1.00 27.52 O ATOM 1913 CB MET A 124 3.046 31.298 17.970 1.00 27.46 C ATOM 1914 CG MET A 124 3.262 32.511 17.083 1.00 28.01 C ATOM 1915 SD MET A 124 2.450 32.354 15.480 1.00 27.29 S ATOM 1916 CE MET A 124 0.733 32.234 15.978 1.00 26.32 C ATOM 0 H MET A 124 2.660 33.315 19.358 1.00 29.62 H new ATOM 0 HA MET A 124 3.226 30.651 20.014 1.00 28.28 H new ATOM 0 HB2 MET A 124 3.499 30.428 17.495 1.00 27.46 H new ATOM 0 HB3 MET A 124 1.977 31.100 18.043 1.00 27.46 H new ATOM 0 HG2 MET A 124 2.886 33.399 17.591 1.00 28.01 H new ATOM 0 HG3 MET A 124 4.331 32.659 16.931 1.00 28.01 H new ATOM 0 HE1 MET A 124 0.092 32.520 15.145 1.00 26.32 H new ATOM 0 HE2 MET A 124 0.510 31.208 16.272 1.00 26.32 H new ATOM 0 HE3 MET A 124 0.551 32.900 16.821 1.00 26.32 H new ATOM 1926 N ILE A 125 5.836 32.331 18.854 1.00 28.78 N ATOM 1927 CA ILE A 125 7.295 32.286 18.767 1.00 28.80 C ATOM 1928 C ILE A 125 7.945 32.012 20.120 1.00 29.32 C ATOM 1929 O ILE A 125 8.683 31.047 20.267 1.00 28.74 O ATOM 1930 CB ILE A 125 7.890 33.603 18.222 1.00 29.69 C ATOM 1931 CG1 ILE A 125 7.268 33.963 16.870 1.00 29.31 C ATOM 1932 CG2 ILE A 125 9.409 33.475 18.104 1.00 29.77 C ATOM 1933 CD1 ILE A 125 7.664 35.334 16.362 1.00 30.29 C ATOM 0 H ILE A 125 5.416 33.194 18.509 1.00 28.78 H new ATOM 0 HA ILE A 125 7.511 31.469 18.078 1.00 28.80 H new ATOM 0 HB ILE A 125 7.658 34.408 18.919 1.00 29.69 H new ATOM 0 HG12 ILE A 125 7.562 33.214 16.134 1.00 29.31 H new ATOM 0 HG13 ILE A 125 6.182 33.917 16.956 1.00 29.31 H new ATOM 0 HG21 ILE A 125 9.824 34.407 17.719 1.00 29.77 H new ATOM 0 HG22 ILE A 125 9.834 33.267 19.086 1.00 29.77 H new ATOM 0 HG23 ILE A 125 9.654 32.660 17.423 1.00 29.77 H new ATOM 0 HD11 ILE A 125 7.185 35.518 15.400 1.00 30.29 H new ATOM 0 HD12 ILE A 125 7.346 36.093 17.077 1.00 30.29 H new ATOM 0 HD13 ILE A 125 8.746 35.379 16.243 1.00 30.29 H new ATOM 1945 N ARG A 126 7.661 32.864 21.101 1.00 30.48 N ATOM 1946 CA ARG A 126 8.250 32.733 22.434 1.00 31.17 C ATOM 1947 C ARG A 126 8.067 31.335 23.034 1.00 30.45 C ATOM 1948 O ARG A 126 9.017 30.754 23.561 1.00 30.52 O ATOM 1949 CB ARG A 126 7.672 33.794 23.379 1.00 32.45 C ATOM 1950 CG ARG A 126 6.223 33.561 23.776 1.00 32.40 C ATOM 1951 CD ARG A 126 5.758 34.584 24.800 1.00 33.74 C ATOM 1952 NE ARG A 126 4.461 34.238 25.374 1.00 34.27 N ATOM 1953 CZ ARG A 126 4.002 34.739 26.517 1.00 35.37 C ATOM 1954 NH1 ARG A 126 4.729 35.610 27.205 1.00 36.06 N ATOM 1955 NH2 ARG A 126 2.814 34.368 26.976 1.00 35.85 N ATOM 0 H ARG A 126 7.025 33.655 20.999 1.00 30.48 H new ATOM 0 HA ARG A 126 9.323 32.889 22.319 1.00 31.17 H new ATOM 0 HB2 ARG A 126 8.282 33.830 24.282 1.00 32.45 H new ATOM 0 HB3 ARG A 126 7.752 34.771 22.901 1.00 32.45 H new ATOM 0 HG2 ARG A 126 5.588 33.615 22.891 1.00 32.40 H new ATOM 0 HG3 ARG A 126 6.113 32.557 24.186 1.00 32.40 H new ATOM 0 HD2 ARG A 126 6.498 34.660 25.597 1.00 33.74 H new ATOM 0 HD3 ARG A 126 5.695 35.565 24.329 1.00 33.74 H new ATOM 0 HE ARG A 126 3.873 33.574 24.870 1.00 34.27 H new ATOM 0 HH11 ARG A 126 5.644 35.898 26.858 1.00 36.06 H new ATOM 0 HH12 ARG A 126 4.373 35.992 28.081 1.00 36.06 H new ATOM 0 HH21 ARG A 126 2.251 33.698 26.452 1.00 35.85 H new ATOM 0 HH22 ARG A 126 2.463 34.753 27.853 1.00 35.85 H new ATOM 1969 N GLU A 127 6.853 30.799 22.958 1.00 29.84 N ATOM 1970 CA GLU A 127 6.558 29.485 23.528 1.00 29.22 C ATOM 1971 C GLU A 127 7.359 28.365 22.870 1.00 28.15 C ATOM 1972 O GLU A 127 7.847 27.465 23.554 1.00 28.09 O ATOM 1973 CB GLU A 127 5.069 29.175 23.409 1.00 28.76 C ATOM 1974 CG GLU A 127 4.558 28.252 24.506 1.00 28.80 C ATOM 1975 CD GLU A 127 3.045 28.173 24.549 1.00 28.73 C ATOM 1976 OE1 GLU A 127 2.417 29.108 25.088 1.00 28.70 O ATOM 1977 OE2 GLU A 127 2.487 27.177 24.043 1.00 28.78 O ATOM 0 H GLU A 127 6.057 31.252 22.508 1.00 29.84 H new ATOM 0 HA GLU A 127 6.849 29.530 24.577 1.00 29.22 H new ATOM 0 HB2 GLU A 127 4.507 30.108 23.438 1.00 28.76 H new ATOM 0 HB3 GLU A 127 4.876 28.717 22.439 1.00 28.76 H new ATOM 0 HG2 GLU A 127 4.965 27.253 24.353 1.00 28.80 H new ATOM 0 HG3 GLU A 127 4.927 28.602 25.470 1.00 28.80 H new ATOM 1984 N ALA A 128 7.494 28.416 21.550 1.00 27.36 N ATOM 1985 CA ALA A 128 8.219 27.377 20.829 1.00 26.33 C ATOM 1986 C ALA A 128 9.705 27.693 20.724 1.00 26.81 C ATOM 1987 O ALA A 128 10.514 26.800 20.496 1.00 26.28 O ATOM 1988 CB ALA A 128 7.619 27.167 19.448 1.00 25.22 C ATOM 0 H ALA A 128 7.115 29.158 20.962 1.00 27.36 H new ATOM 0 HA ALA A 128 8.120 26.453 21.399 1.00 26.33 H new ATOM 0 HB1 ALA A 128 8.173 26.388 18.925 1.00 25.22 H new ATOM 0 HB2 ALA A 128 6.576 26.866 19.546 1.00 25.22 H new ATOM 0 HB3 ALA A 128 7.677 28.096 18.881 1.00 25.22 H new ATOM 1994 N ASP A 129 10.061 28.959 20.903 1.00 27.88 N ATOM 1995 CA ASP A 129 11.455 29.376 20.817 1.00 28.48 C ATOM 1996 C ASP A 129 12.262 28.808 21.978 1.00 29.02 C ATOM 1997 O ASP A 129 12.594 29.516 22.930 1.00 30.17 O ATOM 1998 CB ASP A 129 11.562 30.898 20.796 1.00 29.57 C ATOM 1999 CG ASP A 129 12.958 31.363 20.447 1.00 30.10 C ATOM 2000 OD1 ASP A 129 13.557 30.787 19.516 1.00 30.56 O ATOM 2001 OD2 ASP A 129 13.453 32.304 21.110 1.00 30.12 O ATOM 0 H ASP A 129 9.406 29.713 21.108 1.00 27.88 H new ATOM 0 HA ASP A 129 11.866 28.986 19.886 1.00 28.48 H new ATOM 0 HB2 ASP A 129 10.854 31.301 20.072 1.00 29.57 H new ATOM 0 HB3 ASP A 129 11.281 31.295 21.772 1.00 29.57 H new ATOM 2006 N PHE A 130 12.569 27.523 21.885 1.00 28.23 N ATOM 2007 CA PHE A 130 13.328 26.831 22.921 1.00 28.72 C ATOM 2008 C PHE A 130 14.788 27.271 22.931 1.00 29.48 C ATOM 2009 O PHE A 130 15.384 27.451 23.992 1.00 30.47 O ATOM 2010 CB PHE A 130 13.248 25.317 22.710 1.00 27.68 C ATOM 2011 CG PHE A 130 11.843 24.781 22.717 1.00 26.94 C ATOM 2012 CD1 PHE A 130 11.047 24.900 23.845 1.00 26.82 C ATOM 2013 CD2 PHE A 130 11.321 24.158 21.594 1.00 26.44 C ATOM 2014 CE1 PHE A 130 9.755 24.408 23.852 1.00 26.23 C ATOM 2015 CE2 PHE A 130 10.031 23.663 21.597 1.00 25.82 C ATOM 2016 CZ PHE A 130 9.245 23.793 22.729 1.00 25.72 C ATOM 0 H PHE A 130 12.303 26.933 21.097 1.00 28.23 H new ATOM 0 HA PHE A 130 12.888 27.090 23.884 1.00 28.72 H new ATOM 0 HB2 PHE A 130 13.719 25.066 21.760 1.00 27.68 H new ATOM 0 HB3 PHE A 130 13.822 24.819 23.492 1.00 27.68 H new ATOM 0 HD1 PHE A 130 11.440 25.382 24.728 1.00 26.82 H new ATOM 0 HD2 PHE A 130 11.929 24.058 20.707 1.00 26.44 H new ATOM 0 HE1 PHE A 130 9.145 24.506 24.738 1.00 26.23 H new ATOM 0 HE2 PHE A 130 9.637 23.176 20.718 1.00 25.82 H new ATOM 0 HZ PHE A 130 8.234 23.413 22.732 1.00 25.72 H new ATOM 2026 N ASP A 131 15.359 27.443 21.743 1.00 29.07 N ATOM 2027 CA ASP A 131 16.756 27.848 21.619 1.00 29.81 C ATOM 2028 C ASP A 131 16.927 29.313 21.997 1.00 31.01 C ATOM 2029 O ASP A 131 18.042 29.834 22.028 1.00 31.82 O ATOM 2030 CB ASP A 131 17.244 27.662 20.186 1.00 29.11 C ATOM 2031 CG ASP A 131 16.467 26.614 19.418 1.00 27.70 C ATOM 2032 OD1 ASP A 131 16.615 25.413 19.728 1.00 27.01 O ATOM 2033 OD2 ASP A 131 15.709 27.002 18.499 1.00 27.31 O ATOM 0 H ASP A 131 14.878 27.309 20.854 1.00 29.07 H new ATOM 0 HA ASP A 131 17.340 27.222 22.294 1.00 29.81 H new ATOM 0 HB2 ASP A 131 17.174 28.614 19.660 1.00 29.11 H new ATOM 0 HB3 ASP A 131 18.298 27.383 20.202 1.00 29.11 H new ATOM 2038 N GLY A 132 15.808 29.970 22.284 1.00 31.16 N ATOM 2039 CA GLY A 132 15.835 31.376 22.632 1.00 32.30 C ATOM 2040 C GLY A 132 16.452 32.233 21.553 1.00 32.54 C ATOM 2041 O GLY A 132 17.321 33.060 21.824 1.00 33.59 O ATOM 0 H GLY A 132 14.879 29.550 22.281 1.00 31.16 H new ATOM 0 HA2 GLY A 132 14.818 31.718 22.824 1.00 32.30 H new ATOM 0 HA3 GLY A 132 16.395 31.506 23.558 1.00 32.30 H new ATOM 2045 N ASP A 133 15.992 32.034 20.324 1.00 31.60 N ATOM 2046 CA ASP A 133 16.468 32.806 19.199 1.00 31.81 C ATOM 2047 C ASP A 133 15.337 33.662 18.681 1.00 31.80 C ATOM 2048 O ASP A 133 14.163 33.366 18.898 1.00 31.29 O ATOM 2049 CB ASP A 133 16.942 31.911 18.051 1.00 30.84 C ATOM 2050 CG ASP A 133 17.401 30.546 18.494 1.00 30.25 C ATOM 2051 OD1 ASP A 133 18.326 30.488 19.334 1.00 29.45 O ATOM 2052 OD2 ASP A 133 16.841 29.539 18.011 1.00 30.65 O ATOM 0 H ASP A 133 15.285 31.338 20.087 1.00 31.60 H new ATOM 0 HA ASP A 133 17.308 33.409 19.543 1.00 31.81 H new ATOM 0 HB2 ASP A 133 16.130 31.796 17.333 1.00 30.84 H new ATOM 0 HB3 ASP A 133 17.760 32.408 17.529 1.00 30.84 H new ATOM 2057 N GLY A 134 15.692 34.717 17.995 1.00 32.44 N ATOM 2058 CA GLY A 134 14.693 35.589 17.418 1.00 32.56 C ATOM 2059 C GLY A 134 14.031 34.945 16.218 1.00 31.38 C ATOM 2060 O GLY A 134 13.474 35.632 15.364 1.00 31.48 O ATOM 0 H GLY A 134 16.658 34.995 17.821 1.00 32.44 H new ATOM 0 HA2 GLY A 134 13.939 35.828 18.168 1.00 32.56 H new ATOM 0 HA3 GLY A 134 15.156 36.530 17.120 1.00 32.56 H new ATOM 2064 N MET A 135 14.105 33.614 16.151 1.00 30.31 N ATOM 2065 CA MET A 135 13.522 32.867 15.044 1.00 29.12 C ATOM 2066 C MET A 135 13.018 31.496 15.497 1.00 28.02 C ATOM 2067 O MET A 135 13.515 30.918 16.475 1.00 28.13 O ATOM 2068 CB MET A 135 14.549 32.704 13.921 1.00 28.97 C ATOM 2069 CG MET A 135 15.915 32.231 14.396 1.00 29.26 C ATOM 2070 SD MET A 135 16.893 33.551 15.142 1.00 30.55 S ATOM 2071 CE MET A 135 17.126 34.643 13.741 1.00 31.50 C ATOM 0 H MET A 135 14.564 33.034 16.853 1.00 30.31 H new ATOM 0 HA MET A 135 12.667 33.432 14.673 1.00 29.12 H new ATOM 0 HB2 MET A 135 14.163 31.993 13.190 1.00 28.97 H new ATOM 0 HB3 MET A 135 14.665 33.658 13.407 1.00 28.97 H new ATOM 0 HG2 MET A 135 15.784 31.428 15.121 1.00 29.26 H new ATOM 0 HG3 MET A 135 16.463 31.812 13.552 1.00 29.26 H new ATOM 0 HE1 MET A 135 18.048 35.210 13.871 1.00 31.50 H new ATOM 0 HE2 MET A 135 17.189 34.053 12.827 1.00 31.50 H new ATOM 0 HE3 MET A 135 16.283 35.331 13.672 1.00 31.50 H new ATOM 2081 N ILE A 136 12.038 30.976 14.763 1.00 27.01 N ATOM 2082 CA ILE A 136 11.451 29.676 15.076 1.00 25.91 C ATOM 2083 C ILE A 136 12.033 28.580 14.193 1.00 24.90 C ATOM 2084 O ILE A 136 12.047 28.700 12.976 1.00 24.54 O ATOM 2085 CB ILE A 136 9.920 29.674 14.887 1.00 25.40 C ATOM 2086 CG1 ILE A 136 9.259 30.779 15.708 1.00 26.49 C ATOM 2087 CG2 ILE A 136 9.351 28.318 15.272 1.00 24.33 C ATOM 2088 CD1 ILE A 136 7.756 30.845 15.521 1.00 26.17 C ATOM 0 H ILE A 136 11.633 31.435 13.947 1.00 27.01 H new ATOM 0 HA ILE A 136 11.689 29.483 16.122 1.00 25.91 H new ATOM 0 HB ILE A 136 9.707 29.866 13.836 1.00 25.40 H new ATOM 0 HG12 ILE A 136 9.481 30.620 16.763 1.00 26.49 H new ATOM 0 HG13 ILE A 136 9.695 31.739 15.431 1.00 26.49 H new ATOM 0 HG21 ILE A 136 8.270 28.325 15.136 1.00 24.33 H new ATOM 0 HG22 ILE A 136 9.791 27.546 14.641 1.00 24.33 H new ATOM 0 HG23 ILE A 136 9.584 28.109 16.316 1.00 24.33 H new ATOM 0 HD11 ILE A 136 7.348 31.651 16.132 1.00 26.17 H new ATOM 0 HD12 ILE A 136 7.528 31.034 14.472 1.00 26.17 H new ATOM 0 HD13 ILE A 136 7.310 29.898 15.825 1.00 26.17 H new ATOM 2100 N ASN A 137 12.490 27.501 14.808 1.00 24.49 N ATOM 2101 CA ASN A 137 13.057 26.391 14.061 1.00 23.59 C ATOM 2102 C ASN A 137 11.968 25.379 13.734 1.00 22.27 C ATOM 2103 O ASN A 137 10.992 25.262 14.471 1.00 22.13 O ATOM 2104 CB ASN A 137 14.182 25.732 14.866 1.00 23.94 C ATOM 2105 CG ASN A 137 14.931 24.668 14.083 1.00 23.25 C ATOM 2106 OD1 ASN A 137 14.378 24.006 13.208 1.00 22.19 O ATOM 2107 ND2 ASN A 137 16.204 24.494 14.400 1.00 23.92 N ATOM 0 H ASN A 137 12.479 27.371 15.820 1.00 24.49 H new ATOM 0 HA ASN A 137 13.477 26.766 13.128 1.00 23.59 H new ATOM 0 HB2 ASN A 137 14.886 26.499 15.190 1.00 23.94 H new ATOM 0 HB3 ASN A 137 13.762 25.284 15.766 1.00 23.94 H new ATOM 0 HD21 ASN A 137 16.760 23.791 13.912 1.00 23.92 H new ATOM 0 HD22 ASN A 137 16.630 25.062 15.132 1.00 23.92 H new ATOM 2114 N TYR A 138 12.125 24.674 12.621 1.00 21.38 N ATOM 2115 CA TYR A 138 11.152 23.673 12.199 1.00 20.08 C ATOM 2116 C TYR A 138 10.601 22.888 13.383 1.00 19.79 C ATOM 2117 O TYR A 138 9.401 22.643 13.464 1.00 19.22 O ATOM 2118 CB TYR A 138 11.787 22.719 11.190 1.00 19.28 C ATOM 2119 CG TYR A 138 10.882 21.578 10.791 1.00 17.91 C ATOM 2120 CD1 TYR A 138 9.776 21.793 9.977 1.00 17.42 C ATOM 2121 CD2 TYR A 138 11.134 20.285 11.230 1.00 17.16 C ATOM 2122 CE1 TYR A 138 8.948 20.751 9.615 1.00 16.17 C ATOM 2123 CE2 TYR A 138 10.309 19.236 10.870 1.00 15.93 C ATOM 2124 CZ TYR A 138 9.218 19.475 10.064 1.00 15.40 C ATOM 2125 OH TYR A 138 8.392 18.433 9.705 1.00 14.17 O ATOM 0 H TYR A 138 12.921 24.777 11.991 1.00 21.38 H new ATOM 0 HA TYR A 138 10.319 24.197 11.731 1.00 20.08 H new ATOM 0 HB2 TYR A 138 12.067 23.279 10.298 1.00 19.28 H new ATOM 0 HB3 TYR A 138 12.706 22.313 11.613 1.00 19.28 H new ATOM 0 HD1 TYR A 138 9.562 22.791 9.623 1.00 17.42 H new ATOM 0 HD2 TYR A 138 11.988 20.096 11.863 1.00 17.16 H new ATOM 0 HE1 TYR A 138 8.092 20.933 8.983 1.00 16.17 H new ATOM 0 HE2 TYR A 138 10.519 18.235 11.218 1.00 15.93 H new ATOM 0 HH TYR A 138 8.723 17.601 10.104 1.00 14.17 H new ATOM 2135 N GLU A 139 11.482 22.515 14.303 1.00 20.30 N ATOM 2136 CA GLU A 139 11.086 21.743 15.480 1.00 20.23 C ATOM 2137 C GLU A 139 10.127 22.518 16.380 1.00 20.87 C ATOM 2138 O GLU A 139 9.133 21.974 16.867 1.00 20.48 O ATOM 2139 CB GLU A 139 12.324 21.353 16.283 1.00 20.94 C ATOM 2140 CG GLU A 139 13.197 22.536 16.674 1.00 22.25 C ATOM 2141 CD GLU A 139 14.361 22.135 17.557 1.00 22.99 C ATOM 2142 OE1 GLU A 139 15.407 21.725 17.010 1.00 23.36 O ATOM 2143 OE2 GLU A 139 14.227 22.229 18.796 1.00 23.27 O ATOM 0 H GLU A 139 12.477 22.734 14.259 1.00 20.30 H new ATOM 0 HA GLU A 139 10.568 20.852 15.125 1.00 20.23 H new ATOM 0 HB2 GLU A 139 12.010 20.830 17.186 1.00 20.94 H new ATOM 0 HB3 GLU A 139 12.919 20.651 15.699 1.00 20.94 H new ATOM 0 HG2 GLU A 139 13.578 23.015 15.772 1.00 22.25 H new ATOM 0 HG3 GLU A 139 12.589 23.275 17.195 1.00 22.25 H new ATOM 2150 N GLU A 140 10.420 23.793 16.574 1.00 21.93 N ATOM 2151 CA GLU A 140 9.615 24.644 17.439 1.00 22.74 C ATOM 2152 C GLU A 140 8.267 24.941 16.805 1.00 22.24 C ATOM 2153 O GLU A 140 7.221 24.819 17.441 1.00 22.29 O ATOM 2154 CB GLU A 140 10.339 25.961 17.690 1.00 24.01 C ATOM 2155 CG GLU A 140 11.817 25.812 18.024 1.00 24.56 C ATOM 2156 CD GLU A 140 12.481 27.149 18.305 1.00 25.83 C ATOM 2157 OE1 GLU A 140 12.153 28.137 17.618 1.00 26.40 O ATOM 2158 OE2 GLU A 140 13.337 27.206 19.210 1.00 26.30 O ATOM 0 H GLU A 140 11.214 24.265 16.142 1.00 21.93 H new ATOM 0 HA GLU A 140 9.459 24.116 18.380 1.00 22.74 H new ATOM 0 HB2 GLU A 140 10.240 26.590 16.805 1.00 24.01 H new ATOM 0 HB3 GLU A 140 9.845 26.483 18.509 1.00 24.01 H new ATOM 0 HG2 GLU A 140 11.927 25.164 18.893 1.00 24.56 H new ATOM 0 HG3 GLU A 140 12.327 25.322 17.195 1.00 24.56 H new ATOM 2165 N PHE A 141 8.313 25.333 15.545 1.00 21.88 N ATOM 2166 CA PHE A 141 7.115 25.676 14.800 1.00 21.51 C ATOM 2167 C PHE A 141 6.165 24.484 14.697 1.00 20.36 C ATOM 2168 O PHE A 141 4.990 24.585 15.049 1.00 20.46 O ATOM 2169 CB PHE A 141 7.517 26.169 13.409 1.00 21.36 C ATOM 2170 CG PHE A 141 6.365 26.415 12.488 1.00 20.89 C ATOM 2171 CD1 PHE A 141 5.636 27.588 12.559 1.00 20.72 C ATOM 2172 CD2 PHE A 141 6.018 25.467 11.548 1.00 20.72 C ATOM 2173 CE1 PHE A 141 4.574 27.811 11.703 1.00 20.40 C ATOM 2174 CE2 PHE A 141 4.959 25.680 10.688 1.00 20.40 C ATOM 2175 CZ PHE A 141 4.236 26.854 10.766 1.00 20.24 C ATOM 0 H PHE A 141 9.177 25.422 15.011 1.00 21.88 H new ATOM 0 HA PHE A 141 6.584 26.467 15.329 1.00 21.51 H new ATOM 0 HB2 PHE A 141 8.087 27.092 13.514 1.00 21.36 H new ATOM 0 HB3 PHE A 141 8.181 25.434 12.954 1.00 21.36 H new ATOM 0 HD1 PHE A 141 5.899 28.337 13.291 1.00 20.72 H new ATOM 0 HD2 PHE A 141 6.581 24.548 11.484 1.00 20.72 H new ATOM 0 HE1 PHE A 141 4.010 28.730 11.766 1.00 20.40 H new ATOM 0 HE2 PHE A 141 4.697 24.930 9.956 1.00 20.40 H new ATOM 0 HZ PHE A 141 3.407 27.024 10.095 1.00 20.24 H new ATOM 2185 N VAL A 142 6.681 23.357 14.213 1.00 19.36 N ATOM 2186 CA VAL A 142 5.867 22.148 14.060 1.00 18.22 C ATOM 2187 C VAL A 142 5.259 21.724 15.386 1.00 18.56 C ATOM 2188 O VAL A 142 4.165 21.160 15.433 1.00 18.08 O ATOM 2189 CB VAL A 142 6.664 20.960 13.484 1.00 17.23 C ATOM 2190 CG1 VAL A 142 7.760 20.513 14.431 1.00 17.77 C ATOM 2191 CG2 VAL A 142 5.722 19.808 13.182 1.00 16.07 C ATOM 0 H VAL A 142 7.653 23.253 13.921 1.00 19.36 H new ATOM 0 HA VAL A 142 5.080 22.411 13.353 1.00 18.22 H new ATOM 0 HB VAL A 142 7.142 21.287 12.561 1.00 17.23 H new ATOM 0 HG11 VAL A 142 8.300 19.674 13.992 1.00 17.77 H new ATOM 0 HG12 VAL A 142 8.450 21.339 14.604 1.00 17.77 H new ATOM 0 HG13 VAL A 142 7.319 20.204 15.379 1.00 17.77 H new ATOM 0 HG21 VAL A 142 6.290 18.971 12.775 1.00 16.07 H new ATOM 0 HG22 VAL A 142 5.223 19.496 14.099 1.00 16.07 H new ATOM 0 HG23 VAL A 142 4.977 20.129 12.454 1.00 16.07 H new ATOM 2201 N TRP A 143 5.978 21.998 16.461 1.00 19.50 N ATOM 2202 CA TRP A 143 5.512 21.659 17.792 1.00 20.05 C ATOM 2203 C TRP A 143 4.232 22.418 18.091 1.00 20.61 C ATOM 2204 O TRP A 143 3.217 21.847 18.489 1.00 20.44 O ATOM 2205 CB TRP A 143 6.582 22.029 18.823 1.00 21.15 C ATOM 2206 CG TRP A 143 6.032 22.230 20.198 1.00 22.13 C ATOM 2207 CD1 TRP A 143 5.809 21.265 21.116 1.00 22.20 C ATOM 2208 CD2 TRP A 143 5.614 23.461 20.798 1.00 23.25 C ATOM 2209 NE1 TRP A 143 5.292 21.810 22.266 1.00 23.30 N ATOM 2210 CE2 TRP A 143 5.159 23.157 22.093 1.00 23.94 C ATOM 2211 CE3 TRP A 143 5.583 24.788 20.371 1.00 23.82 C ATOM 2212 CZ2 TRP A 143 4.677 24.128 22.962 1.00 25.11 C ATOM 2213 CZ3 TRP A 143 5.102 25.752 21.233 1.00 24.98 C ATOM 2214 CH2 TRP A 143 4.655 25.417 22.515 1.00 25.59 C ATOM 0 H TRP A 143 6.889 22.456 16.436 1.00 19.50 H new ATOM 0 HA TRP A 143 5.318 20.588 17.844 1.00 20.05 H new ATOM 0 HB2 TRP A 143 7.336 21.243 18.852 1.00 21.15 H new ATOM 0 HB3 TRP A 143 7.085 22.942 18.503 1.00 21.15 H new ATOM 0 HD1 TRP A 143 6.009 20.214 20.967 1.00 22.20 H new ATOM 0 HE1 TRP A 143 5.048 21.293 23.111 1.00 23.30 H new ATOM 0 HE3 TRP A 143 5.929 25.056 19.384 1.00 23.82 H new ATOM 0 HZ2 TRP A 143 4.333 23.872 23.953 1.00 25.11 H new ATOM 0 HZ3 TRP A 143 5.070 26.783 20.912 1.00 24.98 H new ATOM 0 HH2 TRP A 143 4.284 26.195 23.165 1.00 25.59 H new ATOM 2225 N MET A 144 4.314 23.717 17.892 1.00 21.37 N ATOM 2226 CA MET A 144 3.210 24.624 18.136 1.00 22.12 C ATOM 2227 C MET A 144 1.949 24.236 17.367 1.00 21.40 C ATOM 2228 O MET A 144 0.883 24.066 17.955 1.00 21.75 O ATOM 2229 CB MET A 144 3.671 26.023 17.757 1.00 22.89 C ATOM 2230 CG MET A 144 2.554 27.053 17.678 1.00 23.65 C ATOM 2231 SD MET A 144 1.904 27.248 16.008 1.00 23.25 S ATOM 2232 CE MET A 144 3.383 27.747 15.131 1.00 22.97 C ATOM 0 H MET A 144 5.158 24.179 17.553 1.00 21.37 H new ATOM 0 HA MET A 144 2.936 24.578 19.190 1.00 22.12 H new ATOM 0 HB2 MET A 144 4.408 26.359 18.486 1.00 22.89 H new ATOM 0 HB3 MET A 144 4.175 25.977 16.792 1.00 22.89 H new ATOM 0 HG2 MET A 144 1.745 26.758 18.346 1.00 23.65 H new ATOM 0 HG3 MET A 144 2.926 28.014 18.033 1.00 23.65 H new ATOM 0 HE1 MET A 144 3.105 28.256 14.209 1.00 22.97 H new ATOM 0 HE2 MET A 144 3.967 28.422 15.757 1.00 22.97 H new ATOM 0 HE3 MET A 144 3.980 26.866 14.893 1.00 22.97 H new ATOM 2242 N ILE A 145 2.076 24.101 16.054 1.00 20.47 N ATOM 2243 CA ILE A 145 0.943 23.746 15.204 1.00 19.79 C ATOM 2244 C ILE A 145 0.370 22.377 15.563 1.00 18.96 C ATOM 2245 O ILE A 145 -0.760 22.055 15.196 1.00 18.60 O ATOM 2246 CB ILE A 145 1.351 23.728 13.724 1.00 19.06 C ATOM 2247 CG1 ILE A 145 2.317 22.570 13.477 1.00 18.09 C ATOM 2248 CG2 ILE A 145 1.979 25.059 13.333 1.00 20.01 C ATOM 2249 CD1 ILE A 145 2.847 22.507 12.062 1.00 17.41 C ATOM 0 H ILE A 145 2.954 24.232 15.551 1.00 20.47 H new ATOM 0 HA ILE A 145 0.181 24.507 15.372 1.00 19.79 H new ATOM 0 HB ILE A 145 0.466 23.583 13.104 1.00 19.06 H new ATOM 0 HG12 ILE A 145 3.157 22.657 14.166 1.00 18.09 H new ATOM 0 HG13 ILE A 145 1.812 21.632 13.708 1.00 18.09 H new ATOM 0 HG21 ILE A 145 2.263 25.032 12.281 1.00 20.01 H new ATOM 0 HG22 ILE A 145 1.260 25.862 13.494 1.00 20.01 H new ATOM 0 HG23 ILE A 145 2.864 25.237 13.944 1.00 20.01 H new ATOM 0 HD11 ILE A 145 3.526 21.659 11.965 1.00 17.41 H new ATOM 0 HD12 ILE A 145 2.016 22.388 11.367 1.00 17.41 H new ATOM 0 HD13 ILE A 145 3.382 23.428 11.833 1.00 17.41 H new ATOM 2261 N SER A 146 1.151 21.576 16.282 1.00 18.76 N ATOM 2262 CA SER A 146 0.709 20.241 16.671 1.00 18.09 C ATOM 2263 C SER A 146 -0.346 20.333 17.765 1.00 18.99 C ATOM 2264 O SER A 146 -1.391 19.685 17.690 1.00 18.73 O ATOM 2265 CB SER A 146 1.893 19.395 17.145 1.00 17.78 C ATOM 2266 OG SER A 146 1.478 18.085 17.490 1.00 17.22 O ATOM 0 H SER A 146 2.086 21.825 16.605 1.00 18.76 H new ATOM 0 HA SER A 146 0.270 19.757 15.799 1.00 18.09 H new ATOM 0 HB2 SER A 146 2.647 19.346 16.359 1.00 17.78 H new ATOM 0 HB3 SER A 146 2.362 19.870 18.007 1.00 17.78 H new ATOM 0 HG SER A 146 2.253 17.564 17.788 1.00 17.22 H new ATOM 2272 N GLN A 147 -0.065 21.140 18.779 1.00 20.13 N ATOM 2273 CA GLN A 147 -0.997 21.332 19.882 1.00 21.14 C ATOM 2274 C GLN A 147 -1.860 22.552 19.627 1.00 21.86 C ATOM 2275 O GLN A 147 -3.087 22.466 19.559 1.00 22.11 O ATOM 2276 CB GLN A 147 -0.245 21.524 21.187 1.00 22.13 C ATOM 2277 CG GLN A 147 1.063 20.776 21.242 1.00 21.65 C ATOM 2278 CD GLN A 147 1.595 20.687 22.644 1.00 22.67 C ATOM 2279 OE1 GLN A 147 0.836 20.572 23.607 1.00 22.79 O ATOM 2280 NE2 GLN A 147 2.902 20.757 22.771 1.00 23.48 N ATOM 0 H GLN A 147 0.801 21.672 18.861 1.00 20.13 H new ATOM 0 HA GLN A 147 -1.625 20.444 19.955 1.00 21.14 H new ATOM 0 HB2 GLN A 147 -0.053 22.587 21.334 1.00 22.13 H new ATOM 0 HB3 GLN A 147 -0.877 21.197 22.013 1.00 22.13 H new ATOM 0 HG2 GLN A 147 0.925 19.772 20.841 1.00 21.65 H new ATOM 0 HG3 GLN A 147 1.794 21.275 20.606 1.00 21.65 H new ATOM 0 HE21 GLN A 147 3.490 20.852 21.943 1.00 23.48 H new ATOM 0 HE22 GLN A 147 3.327 20.716 23.697 1.00 23.48 H new ATOM 2289 N LYS A 148 -1.196 23.693 19.487 1.00 22.30 N ATOM 2290 CA LYS A 148 -1.883 24.955 19.241 1.00 23.11 C ATOM 2291 C LYS A 148 -2.194 25.126 17.756 1.00 22.36 C ATOM 2292 O LYS A 148 -3.304 24.735 17.338 1.00 22.12 O ATOM 2293 CB LYS A 148 -1.037 26.130 19.736 1.00 24.04 C ATOM 2294 CG LYS A 148 -0.804 26.121 21.239 1.00 24.96 C ATOM 2295 CD LYS A 148 -0.046 27.358 21.694 1.00 25.58 C ATOM 2296 CE LYS A 148 1.387 27.357 21.185 1.00 25.71 C ATOM 2297 NZ LYS A 148 2.113 28.599 21.572 1.00 26.17 N ATOM 2298 OXT LYS A 148 -1.326 25.647 17.025 1.00 22.11 O ATOM 0 H LYS A 148 -0.180 23.770 19.540 1.00 22.30 H new ATOM 0 HA LYS A 148 -2.824 24.939 19.792 1.00 23.11 H new ATOM 0 HB2 LYS A 148 -0.073 26.113 19.227 1.00 24.04 H new ATOM 0 HB3 LYS A 148 -1.528 27.063 19.458 1.00 24.04 H new ATOM 0 HG2 LYS A 148 -1.762 26.070 21.756 1.00 24.96 H new ATOM 0 HG3 LYS A 148 -0.244 25.228 21.516 1.00 24.96 H new ATOM 0 HD2 LYS A 148 -0.559 28.251 21.337 1.00 25.58 H new ATOM 0 HD3 LYS A 148 -0.046 27.405 22.783 1.00 25.58 H new ATOM 0 HE2 LYS A 148 1.913 26.489 21.583 1.00 25.71 H new ATOM 0 HE3 LYS A 148 1.387 27.259 20.099 1.00 25.71 H new ATOM 0 HZ1 LYS A 148 3.130 28.397 21.650 1.00 26.17 H new ATOM 0 HZ2 LYS A 148 1.960 29.330 20.849 1.00 26.17 H new ATOM 0 HZ3 LYS A 148 1.757 28.938 22.488 1.00 26.17 H new TER 2312 LYS A 148 HETATM 2313 CA CA A 149 14.574 32.369 7.784 1.00 27.20 CA HETATM 2314 CA CA A 150 14.415 29.189 18.007 1.00 27.86 CA