USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1111 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 NoAdj : A 62 GLNHE21 : A 62 GLN OE1 : A 151 CACA :(metal ligand) USER MOD NoAdj : A 62 GLNHE22 : A 62 GLN OE1 : A 151 CACA :(metal ligand) USER MOD Set 1.1: A 41 GLN :FLIP amide:sc= -0.463 F(o=-3.8,f=-1.3) USER MOD Set 1.2: A 72 MET CE :methyl -146:sc= -0.855 (180deg=-1.85) USER MOD Set 2.1: A 57 ASN : amide:sc= -0.862 K(o=-1.7,f=-2.6) USER MOD Set 2.2: A 58 ASN : amide:sc= -0.88 X(o=-1.7,f=-1.6) USER MOD Set 3.1: A 36 MET CE :methyl 177:sc= -2.07 (180deg=-2.09) USER MOD Set 3.2: A 75 GLN :FLIP amide:sc= -1.96 F(o=-5.5,f=-4) USER MOD Set 4.1: A 2 SER OG : rot 26:sc= 0.0526 USER MOD Set 4.2: A 79 THR OG1 : rot -9:sc= 0.665 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.00584 USER MOD Single : A 8 GLN : amide:sc= -0.0185 X(o=-0.019,f=-0.063) USER MOD Single : A 13 LYS NZ :NH3+ -167:sc= -0.0509 (180deg=-0.307) USER MOD Single : A 18 GLN : amide:sc= -0.162 K(o=-0.16,f=-0.78) USER MOD Single : A 21 LYS NZ :NH3+ -162:sc= -0.062 (180deg=-0.43) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -30:sc= 0.298 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -23:sc= 0.176 USER MOD Single : A 42 ASN : amide:sc= -1.21 K(o=-1.2,f=-4.9!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.245 X(o=-0.25,f=-0.24) USER MOD Single : A 59 ASN :FLIP amide:sc= -0.102 F(o=-1.2,f=-0.1) USER MOD Single : A 60 ASN :FLIP amide:sc= 0 F(o=-0.86,f=0) USER MOD Single : A 64 ASN : amide:sc= -4.44! C(o=-4.4!,f=-9.6!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.126 USER MOD Single : A 69 CYS SG : rot 61:sc= -1.03! USER MOD Single : A 74 LYS NZ :NH3+ -171:sc= -1.75 (180deg=-2.03) USER MOD Single : A 76 MET CE :methyl 166:sc= -0.739 (180deg=-1.19) USER MOD Single : A 81 THR OG1 : rot -67:sc= 0.0566 USER MOD Single : A 85 MET CE :methyl 176:sc= -2.6 (180deg=-2.74) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 174:sc= -1.66 (180deg=-1.89) USER MOD Single : A 111 ASN : amide:sc=-0.00902 X(o=-0.009,f=-0.2) USER MOD Single : A 115 LYS NZ :NH3+ 165:sc= -0.0288 (180deg=-0.278) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.646 USER MOD Single : A 124 MET CE :methyl 165:sc= -0.814 (180deg=-1.18) USER MOD Single : A 135 MET CE :methyl -110:sc= -0.249 (180deg=-1.69) USER MOD Single : A 137 ASN : amide:sc= -0.677 K(o=-0.68,f=-13!) USER MOD Single : A 138 TYR OH : rot 180:sc=-0.00729 USER MOD Single : A 144 MET CE :methyl -122:sc= -3.01 (180deg=-3.51!) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 GLN : amide:sc= -1.94! X(o=-1.9!,f=-1.9) USER MOD Single : A 148 LYS NZ :NH3+ -112:sc= 0.00918 (180deg=-0.177) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 2.006 7.907 -3.812 1.00 3.85 N ATOM 2 CA SER A 2 1.219 8.715 -2.846 1.00 3.35 C ATOM 3 C SER A 2 0.994 7.944 -1.550 1.00 2.64 C ATOM 4 O SER A 2 0.566 6.789 -1.570 1.00 3.12 O ATOM 5 CB SER A 2 -0.128 9.105 -3.458 1.00 4.09 C ATOM 6 OG SER A 2 0.049 9.876 -4.633 1.00 4.89 O ATOM 0 HA SER A 2 1.785 9.618 -2.618 1.00 3.35 H new ATOM 0 HB2 SER A 2 -0.698 8.206 -3.692 1.00 4.09 H new ATOM 0 HB3 SER A 2 -0.710 9.672 -2.732 1.00 4.09 H new ATOM 0 HG SER A 2 0.915 9.660 -5.038 1.00 4.89 H new ATOM 12 N GLU A 3 1.284 8.589 -0.425 1.00 1.91 N ATOM 13 CA GLU A 3 1.113 7.966 0.882 1.00 1.35 C ATOM 14 C GLU A 3 -0.148 8.479 1.568 1.00 1.08 C ATOM 15 O GLU A 3 -0.599 9.595 1.309 1.00 1.52 O ATOM 16 CB GLU A 3 2.330 8.246 1.766 1.00 1.52 C ATOM 17 CG GLU A 3 3.636 7.723 1.189 1.00 2.09 C ATOM 18 CD GLU A 3 3.631 6.217 1.005 1.00 2.74 C ATOM 19 OE1 GLU A 3 3.226 5.753 -0.080 1.00 3.26 O ATOM 20 OE2 GLU A 3 4.033 5.503 1.949 1.00 3.22 O ATOM 0 H GLU A 3 1.639 9.545 -0.392 1.00 1.91 H new ATOM 0 HA GLU A 3 1.016 6.891 0.733 1.00 1.35 H new ATOM 0 HB2 GLU A 3 2.416 9.321 1.921 1.00 1.52 H new ATOM 0 HB3 GLU A 3 2.169 7.795 2.745 1.00 1.52 H new ATOM 0 HG2 GLU A 3 3.822 8.202 0.228 1.00 2.09 H new ATOM 0 HG3 GLU A 3 4.458 8.002 1.848 1.00 2.09 H new ATOM 27 N LEU A 4 -0.715 7.654 2.445 1.00 0.73 N ATOM 28 CA LEU A 4 -1.922 8.028 3.173 1.00 0.45 C ATOM 29 C LEU A 4 -1.625 9.146 4.168 1.00 0.47 C ATOM 30 O LEU A 4 -1.162 8.896 5.281 1.00 0.58 O ATOM 31 CB LEU A 4 -2.503 6.815 3.906 1.00 0.41 C ATOM 32 CG LEU A 4 -2.793 5.595 3.026 1.00 0.50 C ATOM 33 CD1 LEU A 4 -3.300 4.436 3.872 1.00 1.27 C ATOM 34 CD2 LEU A 4 -3.802 5.943 1.941 1.00 1.19 C ATOM 0 H LEU A 4 -0.358 6.725 2.668 1.00 0.73 H new ATOM 0 HA LEU A 4 -2.656 8.388 2.452 1.00 0.45 H new ATOM 0 HB2 LEU A 4 -1.808 6.519 4.691 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -3.428 7.117 4.397 1.00 0.41 H new ATOM 0 HG LEU A 4 -1.863 5.291 2.545 1.00 0.50 H new ATOM 0 HD11 LEU A 4 -3.501 3.578 3.231 1.00 1.27 H new ATOM 0 HD12 LEU A 4 -2.545 4.168 4.611 1.00 1.27 H new ATOM 0 HD13 LEU A 4 -4.218 4.731 4.381 1.00 1.27 H new ATOM 0 HD21 LEU A 4 -3.994 5.063 1.327 1.00 1.19 H new ATOM 0 HD22 LEU A 4 -4.733 6.274 2.402 1.00 1.19 H new ATOM 0 HD23 LEU A 4 -3.403 6.742 1.316 1.00 1.19 H new ATOM 46 N THR A 5 -1.895 10.380 3.755 1.00 0.47 N ATOM 47 CA THR A 5 -1.655 11.546 4.596 1.00 0.54 C ATOM 48 C THR A 5 -2.750 11.696 5.649 1.00 0.51 C ATOM 49 O THR A 5 -3.788 11.046 5.565 1.00 0.55 O ATOM 50 CB THR A 5 -1.589 12.832 3.750 1.00 0.62 C ATOM 51 OG1 THR A 5 -1.058 12.535 2.453 1.00 1.12 O ATOM 52 CG2 THR A 5 -0.723 13.887 4.420 1.00 0.99 C ATOM 0 H THR A 5 -2.283 10.598 2.837 1.00 0.47 H new ATOM 0 HA THR A 5 -0.697 11.394 5.094 1.00 0.54 H new ATOM 0 HB THR A 5 -2.601 13.225 3.655 1.00 0.62 H new ATOM 0 HG1 THR A 5 -1.020 13.356 1.919 1.00 1.12 H new ATOM 0 HG21 THR A 5 -0.695 14.783 3.800 1.00 0.99 H new ATOM 0 HG22 THR A 5 -1.141 14.134 5.396 1.00 0.99 H new ATOM 0 HG23 THR A 5 0.289 13.501 4.545 1.00 0.99 H new ATOM 60 N GLU A 6 -2.507 12.546 6.640 1.00 0.60 N ATOM 61 CA GLU A 6 -3.475 12.782 7.707 1.00 0.62 C ATOM 62 C GLU A 6 -4.853 13.143 7.150 1.00 0.55 C ATOM 63 O GLU A 6 -5.858 12.529 7.510 1.00 0.53 O ATOM 64 CB GLU A 6 -2.972 13.899 8.624 1.00 0.75 C ATOM 65 CG GLU A 6 -4.029 14.431 9.578 1.00 1.46 C ATOM 66 CD GLU A 6 -3.476 15.453 10.552 1.00 1.74 C ATOM 67 OE1 GLU A 6 -3.312 16.625 10.153 1.00 2.20 O ATOM 68 OE2 GLU A 6 -3.208 15.082 11.714 1.00 2.00 O ATOM 0 H GLU A 6 -1.646 13.085 6.728 1.00 0.60 H new ATOM 0 HA GLU A 6 -3.579 11.858 8.276 1.00 0.62 H new ATOM 0 HB2 GLU A 6 -2.127 13.528 9.203 1.00 0.75 H new ATOM 0 HB3 GLU A 6 -2.602 14.721 8.011 1.00 0.75 H new ATOM 0 HG2 GLU A 6 -4.837 14.883 9.003 1.00 1.46 H new ATOM 0 HG3 GLU A 6 -4.461 13.600 10.136 1.00 1.46 H new ATOM 75 N GLU A 7 -4.889 14.137 6.268 1.00 0.58 N ATOM 76 CA GLU A 7 -6.141 14.590 5.670 1.00 0.58 C ATOM 77 C GLU A 7 -6.709 13.531 4.735 1.00 0.48 C ATOM 78 O GLU A 7 -7.917 13.299 4.698 1.00 0.46 O ATOM 79 CB GLU A 7 -5.919 15.894 4.902 1.00 0.69 C ATOM 80 CG GLU A 7 -4.867 15.789 3.809 1.00 0.69 C ATOM 81 CD GLU A 7 -4.706 17.079 3.027 1.00 1.02 C ATOM 82 OE1 GLU A 7 -3.930 17.950 3.474 1.00 1.35 O ATOM 83 OE2 GLU A 7 -5.354 17.216 1.967 1.00 1.19 O ATOM 0 H GLU A 7 -4.064 14.645 5.951 1.00 0.58 H new ATOM 0 HA GLU A 7 -6.857 14.764 6.473 1.00 0.58 H new ATOM 0 HB2 GLU A 7 -6.863 16.208 4.456 1.00 0.69 H new ATOM 0 HB3 GLU A 7 -5.624 16.673 5.605 1.00 0.69 H new ATOM 0 HG2 GLU A 7 -3.910 15.518 4.256 1.00 0.69 H new ATOM 0 HG3 GLU A 7 -5.139 14.985 3.125 1.00 0.69 H new ATOM 90 N GLN A 8 -5.822 12.895 3.982 1.00 0.44 N ATOM 91 CA GLN A 8 -6.215 11.860 3.038 1.00 0.37 C ATOM 92 C GLN A 8 -6.894 10.699 3.752 1.00 0.31 C ATOM 93 O GLN A 8 -7.885 10.156 3.266 1.00 0.29 O ATOM 94 CB GLN A 8 -4.984 11.368 2.281 1.00 0.40 C ATOM 95 CG GLN A 8 -4.312 12.451 1.454 1.00 0.48 C ATOM 96 CD GLN A 8 -5.164 12.908 0.286 1.00 1.35 C ATOM 97 OE1 GLN A 8 -5.963 13.835 0.411 1.00 2.22 O ATOM 98 NE2 GLN A 8 -4.996 12.257 -0.860 1.00 1.68 N ATOM 0 H GLN A 8 -4.819 13.080 4.008 1.00 0.44 H new ATOM 0 HA GLN A 8 -6.930 12.283 2.333 1.00 0.37 H new ATOM 0 HB2 GLN A 8 -4.264 10.967 2.994 1.00 0.40 H new ATOM 0 HB3 GLN A 8 -5.274 10.547 1.625 1.00 0.40 H new ATOM 0 HG2 GLN A 8 -4.090 13.306 2.093 1.00 0.48 H new ATOM 0 HG3 GLN A 8 -3.359 12.078 1.079 1.00 0.48 H new ATOM 0 HE21 GLN A 8 -4.322 11.494 -0.919 1.00 1.68 H new ATOM 0 HE22 GLN A 8 -5.541 12.520 -1.681 1.00 1.68 H new ATOM 107 N ILE A 9 -6.358 10.326 4.909 1.00 0.33 N ATOM 108 CA ILE A 9 -6.918 9.232 5.688 1.00 0.33 C ATOM 109 C ILE A 9 -8.327 9.575 6.148 1.00 0.34 C ATOM 110 O ILE A 9 -9.255 8.786 5.977 1.00 0.36 O ATOM 111 CB ILE A 9 -6.036 8.894 6.909 1.00 0.42 C ATOM 112 CG1 ILE A 9 -4.728 8.248 6.447 1.00 0.44 C ATOM 113 CG2 ILE A 9 -6.778 7.973 7.871 1.00 0.51 C ATOM 114 CD1 ILE A 9 -3.743 7.998 7.568 1.00 0.54 C ATOM 0 H ILE A 9 -5.538 10.766 5.326 1.00 0.33 H new ATOM 0 HA ILE A 9 -6.953 8.354 5.042 1.00 0.33 H new ATOM 0 HB ILE A 9 -5.803 9.818 7.438 1.00 0.42 H new ATOM 0 HG12 ILE A 9 -4.954 7.301 5.956 1.00 0.44 H new ATOM 0 HG13 ILE A 9 -4.260 8.890 5.701 1.00 0.44 H new ATOM 0 HG21 ILE A 9 -6.139 7.747 8.724 1.00 0.51 H new ATOM 0 HG22 ILE A 9 -7.686 8.465 8.218 1.00 0.51 H new ATOM 0 HG23 ILE A 9 -7.040 7.047 7.359 1.00 0.51 H new ATOM 0 HD11 ILE A 9 -2.841 7.539 7.164 1.00 0.54 H new ATOM 0 HD12 ILE A 9 -3.486 8.944 8.045 1.00 0.54 H new ATOM 0 HD13 ILE A 9 -4.191 7.331 8.304 1.00 0.54 H new ATOM 126 N ALA A 10 -8.477 10.760 6.724 1.00 0.36 N ATOM 127 CA ALA A 10 -9.772 11.218 7.204 1.00 0.40 C ATOM 128 C ALA A 10 -10.730 11.450 6.042 1.00 0.35 C ATOM 129 O ALA A 10 -11.948 11.487 6.224 1.00 0.36 O ATOM 130 CB ALA A 10 -9.601 12.496 8.012 1.00 0.50 C ATOM 0 H ALA A 10 -7.715 11.422 6.870 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.198 10.446 7.844 1.00 0.40 H new ATOM 0 HB1 ALA A 10 -10.574 12.834 8.369 1.00 0.50 H new ATOM 0 HB2 ALA A 10 -8.949 12.303 8.864 1.00 0.50 H new ATOM 0 HB3 ALA A 10 -9.157 13.268 7.383 1.00 0.50 H new ATOM 136 N GLU A 11 -10.171 11.592 4.843 1.00 0.33 N ATOM 137 CA GLU A 11 -10.971 11.838 3.650 1.00 0.33 C ATOM 138 C GLU A 11 -11.754 10.593 3.229 1.00 0.27 C ATOM 139 O GLU A 11 -12.986 10.627 3.140 1.00 0.28 O ATOM 140 CB GLU A 11 -10.067 12.299 2.503 1.00 0.37 C ATOM 141 CG GLU A 11 -10.831 12.772 1.279 1.00 0.41 C ATOM 142 CD GLU A 11 -11.658 14.012 1.554 1.00 1.27 C ATOM 143 OE1 GLU A 11 -12.833 13.866 1.951 1.00 2.27 O ATOM 144 OE2 GLU A 11 -11.131 15.129 1.373 1.00 1.19 O ATOM 0 H GLU A 11 -9.167 11.541 4.673 1.00 0.33 H new ATOM 0 HA GLU A 11 -11.692 12.621 3.886 1.00 0.33 H new ATOM 0 HB2 GLU A 11 -9.429 13.108 2.858 1.00 0.37 H new ATOM 0 HB3 GLU A 11 -9.411 11.477 2.216 1.00 0.37 H new ATOM 0 HG2 GLU A 11 -10.127 12.980 0.473 1.00 0.41 H new ATOM 0 HG3 GLU A 11 -11.485 11.972 0.932 1.00 0.41 H new ATOM 151 N PHE A 12 -11.048 9.490 2.992 1.00 0.23 N ATOM 152 CA PHE A 12 -11.711 8.259 2.580 1.00 0.22 C ATOM 153 C PHE A 12 -12.359 7.570 3.773 1.00 0.19 C ATOM 154 O PHE A 12 -13.335 6.835 3.620 1.00 0.20 O ATOM 155 CB PHE A 12 -10.743 7.315 1.855 1.00 0.26 C ATOM 156 CG PHE A 12 -9.523 6.924 2.644 1.00 0.25 C ATOM 157 CD1 PHE A 12 -9.624 6.088 3.745 1.00 0.31 C ATOM 158 CD2 PHE A 12 -8.269 7.378 2.266 1.00 0.27 C ATOM 159 CE1 PHE A 12 -8.501 5.717 4.456 1.00 0.37 C ATOM 160 CE2 PHE A 12 -7.142 7.011 2.973 1.00 0.30 C ATOM 161 CZ PHE A 12 -7.259 6.179 4.071 1.00 0.35 C ATOM 0 H PHE A 12 -10.034 9.424 3.077 1.00 0.23 H new ATOM 0 HA PHE A 12 -12.497 8.525 1.873 1.00 0.22 H new ATOM 0 HB2 PHE A 12 -11.283 6.410 1.577 1.00 0.26 H new ATOM 0 HB3 PHE A 12 -10.421 7.791 0.929 1.00 0.26 H new ATOM 0 HD1 PHE A 12 -10.593 5.723 4.050 1.00 0.31 H new ATOM 0 HD2 PHE A 12 -8.173 8.027 1.408 1.00 0.27 H new ATOM 0 HE1 PHE A 12 -8.594 5.066 5.313 1.00 0.37 H new ATOM 0 HE2 PHE A 12 -6.171 7.373 2.669 1.00 0.30 H new ATOM 0 HZ PHE A 12 -6.379 5.891 4.627 1.00 0.35 H new ATOM 171 N LYS A 13 -11.813 7.809 4.963 1.00 0.19 N ATOM 172 CA LYS A 13 -12.369 7.226 6.177 1.00 0.22 C ATOM 173 C LYS A 13 -13.771 7.776 6.401 1.00 0.21 C ATOM 174 O LYS A 13 -14.666 7.065 6.859 1.00 0.23 O ATOM 175 CB LYS A 13 -11.468 7.523 7.382 1.00 0.28 C ATOM 176 CG LYS A 13 -12.150 7.333 8.730 1.00 0.32 C ATOM 177 CD LYS A 13 -12.519 5.877 8.971 1.00 0.33 C ATOM 178 CE LYS A 13 -13.240 5.699 10.297 1.00 0.48 C ATOM 179 NZ LYS A 13 -12.422 6.182 11.443 1.00 1.23 N ATOM 0 H LYS A 13 -10.993 8.398 5.110 1.00 0.19 H new ATOM 0 HA LYS A 13 -12.424 6.143 6.064 1.00 0.22 H new ATOM 0 HB2 LYS A 13 -10.592 6.876 7.336 1.00 0.28 H new ATOM 0 HB3 LYS A 13 -11.110 8.550 7.310 1.00 0.28 H new ATOM 0 HG2 LYS A 13 -11.488 7.678 9.525 1.00 0.32 H new ATOM 0 HG3 LYS A 13 -13.048 7.949 8.774 1.00 0.32 H new ATOM 0 HD2 LYS A 13 -13.154 5.522 8.159 1.00 0.33 H new ATOM 0 HD3 LYS A 13 -11.617 5.265 8.961 1.00 0.33 H new ATOM 0 HE2 LYS A 13 -14.185 6.241 10.272 1.00 0.48 H new ATOM 0 HE3 LYS A 13 -13.480 4.646 10.441 1.00 0.48 H new ATOM 0 HZ1 LYS A 13 -12.842 5.849 12.334 1.00 1.23 H new ATOM 0 HZ2 LYS A 13 -11.453 5.814 11.358 1.00 1.23 H new ATOM 0 HZ3 LYS A 13 -12.399 7.222 11.439 1.00 1.23 H new ATOM 193 N ASP A 14 -13.951 9.052 6.072 1.00 0.23 N ATOM 194 CA ASP A 14 -15.249 9.694 6.202 1.00 0.25 C ATOM 195 C ASP A 14 -16.218 9.084 5.197 1.00 0.22 C ATOM 196 O ASP A 14 -17.341 8.715 5.541 1.00 0.23 O ATOM 197 CB ASP A 14 -15.127 11.201 5.968 1.00 0.31 C ATOM 198 CG ASP A 14 -16.441 11.929 6.177 1.00 0.37 C ATOM 199 OD1 ASP A 14 -16.719 12.333 7.325 1.00 0.44 O ATOM 200 OD2 ASP A 14 -17.189 12.095 5.191 1.00 0.41 O ATOM 0 H ASP A 14 -13.213 9.659 5.714 1.00 0.23 H new ATOM 0 HA ASP A 14 -15.626 9.534 7.212 1.00 0.25 H new ATOM 0 HB2 ASP A 14 -14.377 11.611 6.644 1.00 0.31 H new ATOM 0 HB3 ASP A 14 -14.773 11.380 4.953 1.00 0.31 H new ATOM 205 N ALA A 15 -15.769 8.976 3.949 1.00 0.22 N ATOM 206 CA ALA A 15 -16.585 8.391 2.894 1.00 0.24 C ATOM 207 C ALA A 15 -16.851 6.912 3.166 1.00 0.22 C ATOM 208 O ALA A 15 -17.730 6.304 2.557 1.00 0.29 O ATOM 209 CB ALA A 15 -15.904 8.560 1.545 1.00 0.27 C ATOM 0 H ALA A 15 -14.846 9.286 3.646 1.00 0.22 H new ATOM 0 HA ALA A 15 -17.541 8.914 2.876 1.00 0.24 H new ATOM 0 HB1 ALA A 15 -16.525 8.118 0.766 1.00 0.27 H new ATOM 0 HB2 ALA A 15 -15.763 9.621 1.339 1.00 0.27 H new ATOM 0 HB3 ALA A 15 -14.934 8.062 1.562 1.00 0.27 H new ATOM 215 N PHE A 16 -16.081 6.344 4.092 1.00 0.20 N ATOM 216 CA PHE A 16 -16.211 4.935 4.449 1.00 0.22 C ATOM 217 C PHE A 16 -17.393 4.721 5.387 1.00 0.22 C ATOM 218 O PHE A 16 -18.208 3.822 5.179 1.00 0.25 O ATOM 219 CB PHE A 16 -14.910 4.446 5.101 1.00 0.26 C ATOM 220 CG PHE A 16 -15.010 3.098 5.763 1.00 0.31 C ATOM 221 CD1 PHE A 16 -14.743 1.940 5.052 1.00 0.38 C ATOM 222 CD2 PHE A 16 -15.361 2.993 7.100 1.00 0.37 C ATOM 223 CE1 PHE A 16 -14.826 0.702 5.661 1.00 0.46 C ATOM 224 CE2 PHE A 16 -15.446 1.759 7.714 1.00 0.45 C ATOM 225 CZ PHE A 16 -15.178 0.611 6.994 1.00 0.48 C ATOM 0 H PHE A 16 -15.357 6.842 4.610 1.00 0.20 H new ATOM 0 HA PHE A 16 -16.394 4.358 3.543 1.00 0.22 H new ATOM 0 HB2 PHE A 16 -14.130 4.406 4.340 1.00 0.26 H new ATOM 0 HB3 PHE A 16 -14.593 5.178 5.844 1.00 0.26 H new ATOM 0 HD1 PHE A 16 -14.467 2.005 4.010 1.00 0.38 H new ATOM 0 HD2 PHE A 16 -15.571 3.887 7.668 1.00 0.37 H new ATOM 0 HE1 PHE A 16 -14.616 -0.194 5.095 1.00 0.46 H new ATOM 0 HE2 PHE A 16 -15.722 1.692 8.756 1.00 0.45 H new ATOM 0 HZ PHE A 16 -15.243 -0.355 7.472 1.00 0.48 H new ATOM 235 N VAL A 17 -17.481 5.555 6.417 1.00 0.22 N ATOM 236 CA VAL A 17 -18.564 5.453 7.386 1.00 0.23 C ATOM 237 C VAL A 17 -19.890 5.875 6.764 1.00 0.23 C ATOM 238 O VAL A 17 -20.959 5.459 7.211 1.00 0.26 O ATOM 239 CB VAL A 17 -18.286 6.317 8.630 1.00 0.30 C ATOM 240 CG1 VAL A 17 -16.993 5.883 9.303 1.00 1.11 C ATOM 241 CG2 VAL A 17 -18.234 7.794 8.264 1.00 0.91 C ATOM 0 H VAL A 17 -16.817 6.307 6.602 1.00 0.22 H new ATOM 0 HA VAL A 17 -18.626 4.408 7.691 1.00 0.23 H new ATOM 0 HB VAL A 17 -19.105 6.173 9.335 1.00 0.30 H new ATOM 0 HG11 VAL A 17 -16.813 6.505 10.180 1.00 1.11 H new ATOM 0 HG12 VAL A 17 -17.074 4.840 9.608 1.00 1.11 H new ATOM 0 HG13 VAL A 17 -16.164 5.993 8.604 1.00 1.11 H new ATOM 0 HG21 VAL A 17 -18.036 8.384 9.159 1.00 0.91 H new ATOM 0 HG22 VAL A 17 -17.439 7.961 7.537 1.00 0.91 H new ATOM 0 HG23 VAL A 17 -19.189 8.096 7.834 1.00 0.91 H new ATOM 251 N GLN A 18 -19.809 6.705 5.727 1.00 0.24 N ATOM 252 CA GLN A 18 -20.998 7.186 5.034 1.00 0.29 C ATOM 253 C GLN A 18 -21.797 6.032 4.434 1.00 0.32 C ATOM 254 O GLN A 18 -23.024 6.099 4.343 1.00 0.43 O ATOM 255 CB GLN A 18 -20.601 8.170 3.933 1.00 0.33 C ATOM 256 CG GLN A 18 -20.171 9.531 4.455 1.00 0.34 C ATOM 257 CD GLN A 18 -21.287 10.259 5.178 1.00 1.09 C ATOM 258 OE1 GLN A 18 -22.466 10.077 4.870 1.00 1.54 O ATOM 259 NE2 GLN A 18 -20.920 11.091 6.144 1.00 1.60 N ATOM 0 H GLN A 18 -18.930 7.058 5.349 1.00 0.24 H new ATOM 0 HA GLN A 18 -21.630 7.692 5.764 1.00 0.29 H new ATOM 0 HB2 GLN A 18 -19.786 7.740 3.351 1.00 0.33 H new ATOM 0 HB3 GLN A 18 -21.444 8.301 3.254 1.00 0.33 H new ATOM 0 HG2 GLN A 18 -19.326 9.406 5.132 1.00 0.34 H new ATOM 0 HG3 GLN A 18 -19.824 10.142 3.622 1.00 0.34 H new ATOM 0 HE21 GLN A 18 -19.932 11.211 6.366 1.00 1.60 H new ATOM 0 HE22 GLN A 18 -21.626 11.611 6.665 1.00 1.60 H new ATOM 268 N PHE A 19 -21.100 4.976 4.023 1.00 0.28 N ATOM 269 CA PHE A 19 -21.754 3.816 3.424 1.00 0.33 C ATOM 270 C PHE A 19 -22.228 2.828 4.488 1.00 0.35 C ATOM 271 O PHE A 19 -23.112 2.011 4.232 1.00 0.64 O ATOM 272 CB PHE A 19 -20.808 3.116 2.447 1.00 0.36 C ATOM 273 CG PHE A 19 -20.787 3.743 1.082 1.00 0.37 C ATOM 274 CD1 PHE A 19 -20.195 4.980 0.880 1.00 0.41 C ATOM 275 CD2 PHE A 19 -21.362 3.095 0.001 1.00 0.48 C ATOM 276 CE1 PHE A 19 -20.178 5.558 -0.375 1.00 0.44 C ATOM 277 CE2 PHE A 19 -21.348 3.669 -1.256 1.00 0.54 C ATOM 278 CZ PHE A 19 -20.755 4.901 -1.444 1.00 0.47 C ATOM 0 H PHE A 19 -20.085 4.899 4.093 1.00 0.28 H new ATOM 0 HA PHE A 19 -22.629 4.175 2.882 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.799 3.127 2.859 1.00 0.36 H new ATOM 0 HB3 PHE A 19 -21.103 2.071 2.354 1.00 0.36 H new ATOM 0 HD1 PHE A 19 -19.742 5.498 1.713 1.00 0.41 H new ATOM 0 HD2 PHE A 19 -21.826 2.130 0.142 1.00 0.48 H new ATOM 0 HE1 PHE A 19 -19.714 6.522 -0.520 1.00 0.44 H new ATOM 0 HE2 PHE A 19 -21.801 3.154 -2.090 1.00 0.54 H new ATOM 0 HZ PHE A 19 -20.742 5.351 -2.426 1.00 0.47 H new ATOM 288 N ASP A 20 -21.641 2.906 5.677 1.00 0.29 N ATOM 289 CA ASP A 20 -22.016 2.012 6.767 1.00 0.28 C ATOM 290 C ASP A 20 -23.293 2.493 7.449 1.00 0.37 C ATOM 291 O ASP A 20 -23.247 3.271 8.402 1.00 0.44 O ATOM 292 CB ASP A 20 -20.884 1.910 7.789 1.00 0.25 C ATOM 293 CG ASP A 20 -21.167 0.871 8.858 1.00 0.27 C ATOM 294 OD1 ASP A 20 -21.415 -0.300 8.497 1.00 0.29 O ATOM 295 OD2 ASP A 20 -21.139 1.228 10.054 1.00 0.33 O ATOM 0 H ASP A 20 -20.907 3.575 5.910 1.00 0.29 H new ATOM 0 HA ASP A 20 -22.200 1.024 6.344 1.00 0.28 H new ATOM 0 HB2 ASP A 20 -19.956 1.657 7.276 1.00 0.25 H new ATOM 0 HB3 ASP A 20 -20.734 2.881 8.260 1.00 0.25 H new ATOM 300 N LYS A 21 -24.433 2.022 6.952 1.00 0.47 N ATOM 301 CA LYS A 21 -25.728 2.404 7.503 1.00 0.59 C ATOM 302 C LYS A 21 -26.274 1.323 8.430 1.00 0.64 C ATOM 303 O LYS A 21 -27.396 1.427 8.927 1.00 0.83 O ATOM 304 CB LYS A 21 -26.721 2.665 6.374 1.00 0.68 C ATOM 305 CG LYS A 21 -26.353 3.867 5.520 1.00 1.02 C ATOM 306 CD LYS A 21 -26.569 5.176 6.265 1.00 1.14 C ATOM 307 CE LYS A 21 -28.047 5.483 6.444 1.00 1.67 C ATOM 308 NZ LYS A 21 -28.742 5.649 5.137 1.00 2.10 N ATOM 0 H LYS A 21 -24.485 1.373 6.167 1.00 0.47 H new ATOM 0 HA LYS A 21 -25.590 3.316 8.084 1.00 0.59 H new ATOM 0 HB2 LYS A 21 -26.780 1.781 5.739 1.00 0.68 H new ATOM 0 HB3 LYS A 21 -27.713 2.819 6.799 1.00 0.68 H new ATOM 0 HG2 LYS A 21 -25.309 3.790 5.215 1.00 1.02 H new ATOM 0 HG3 LYS A 21 -26.953 3.864 4.610 1.00 1.02 H new ATOM 0 HD2 LYS A 21 -26.087 5.123 7.241 1.00 1.14 H new ATOM 0 HD3 LYS A 21 -26.092 5.989 5.718 1.00 1.14 H new ATOM 0 HE2 LYS A 21 -28.519 4.678 7.007 1.00 1.67 H new ATOM 0 HE3 LYS A 21 -28.160 6.393 7.033 1.00 1.67 H new ATOM 0 HZ1 LYS A 21 -29.644 6.145 5.284 1.00 2.10 H new ATOM 0 HZ2 LYS A 21 -28.143 6.204 4.493 1.00 2.10 H new ATOM 0 HZ3 LYS A 21 -28.925 4.714 4.720 1.00 2.10 H new ATOM 322 N GLU A 22 -25.475 0.287 8.658 1.00 0.58 N ATOM 323 CA GLU A 22 -25.885 -0.818 9.516 1.00 0.63 C ATOM 324 C GLU A 22 -25.294 -0.679 10.917 1.00 0.60 C ATOM 325 O GLU A 22 -25.944 -1.012 11.909 1.00 0.80 O ATOM 326 CB GLU A 22 -25.460 -2.146 8.893 1.00 0.62 C ATOM 327 CG GLU A 22 -25.923 -2.310 7.454 1.00 0.71 C ATOM 328 CD GLU A 22 -25.399 -3.580 6.813 1.00 0.98 C ATOM 329 OE1 GLU A 22 -24.223 -3.589 6.389 1.00 1.80 O ATOM 330 OE2 GLU A 22 -26.163 -4.565 6.734 1.00 0.96 O ATOM 0 H GLU A 22 -24.541 0.189 8.261 1.00 0.58 H new ATOM 0 HA GLU A 22 -26.971 -0.794 9.607 1.00 0.63 H new ATOM 0 HB2 GLU A 22 -24.373 -2.225 8.929 1.00 0.62 H new ATOM 0 HB3 GLU A 22 -25.859 -2.965 9.492 1.00 0.62 H new ATOM 0 HG2 GLU A 22 -27.013 -2.316 7.425 1.00 0.71 H new ATOM 0 HG3 GLU A 22 -25.594 -1.450 6.870 1.00 0.71 H new ATOM 337 N GLY A 23 -24.061 -0.186 10.991 1.00 0.45 N ATOM 338 CA GLY A 23 -23.409 -0.005 12.276 1.00 0.46 C ATOM 339 C GLY A 23 -22.491 -1.157 12.637 1.00 0.39 C ATOM 340 O GLY A 23 -22.303 -1.461 13.815 1.00 0.45 O ATOM 0 H GLY A 23 -23.502 0.091 10.184 1.00 0.45 H new ATOM 0 HA2 GLY A 23 -22.834 0.921 12.259 1.00 0.46 H new ATOM 0 HA3 GLY A 23 -24.168 0.106 13.051 1.00 0.46 H new ATOM 344 N THR A 24 -21.918 -1.798 11.623 1.00 0.34 N ATOM 345 CA THR A 24 -21.014 -2.923 11.841 1.00 0.30 C ATOM 346 C THR A 24 -19.559 -2.506 11.648 1.00 0.28 C ATOM 347 O THR A 24 -18.666 -3.351 11.594 1.00 0.29 O ATOM 348 CB THR A 24 -21.330 -4.091 10.887 1.00 0.32 C ATOM 349 OG1 THR A 24 -21.390 -3.620 9.535 1.00 0.33 O ATOM 350 CG2 THR A 24 -22.650 -4.750 11.259 1.00 0.40 C ATOM 0 H THR A 24 -22.063 -1.558 10.642 1.00 0.34 H new ATOM 0 HA THR A 24 -21.162 -3.252 12.870 1.00 0.30 H new ATOM 0 HB THR A 24 -20.534 -4.830 10.977 1.00 0.32 H new ATOM 0 HG21 THR A 24 -22.853 -5.572 10.572 1.00 0.40 H new ATOM 0 HG22 THR A 24 -22.591 -5.134 12.277 1.00 0.40 H new ATOM 0 HG23 THR A 24 -23.454 -4.017 11.194 1.00 0.40 H new ATOM 358 N GLY A 25 -19.329 -1.199 11.545 1.00 0.30 N ATOM 359 CA GLY A 25 -17.980 -0.696 11.352 1.00 0.32 C ATOM 360 C GLY A 25 -17.343 -1.246 10.093 1.00 0.28 C ATOM 361 O GLY A 25 -16.128 -1.169 9.914 1.00 0.33 O ATOM 0 H GLY A 25 -20.052 -0.481 11.592 1.00 0.30 H new ATOM 0 HA2 GLY A 25 -18.003 0.393 11.301 1.00 0.32 H new ATOM 0 HA3 GLY A 25 -17.368 -0.961 12.214 1.00 0.32 H new ATOM 365 N LYS A 26 -18.175 -1.801 9.218 1.00 0.22 N ATOM 366 CA LYS A 26 -17.707 -2.377 7.964 1.00 0.19 C ATOM 367 C LYS A 26 -18.666 -2.042 6.825 1.00 0.20 C ATOM 368 O LYS A 26 -19.860 -1.848 7.047 1.00 0.23 O ATOM 369 CB LYS A 26 -17.566 -3.894 8.111 1.00 0.20 C ATOM 370 CG LYS A 26 -16.401 -4.308 8.996 1.00 0.25 C ATOM 371 CD LYS A 26 -15.874 -5.689 8.634 1.00 0.62 C ATOM 372 CE LYS A 26 -16.943 -6.762 8.763 1.00 0.62 C ATOM 373 NZ LYS A 26 -16.538 -7.838 9.708 1.00 1.10 N ATOM 0 H LYS A 26 -19.184 -1.864 9.357 1.00 0.22 H new ATOM 0 HA LYS A 26 -16.733 -1.950 7.725 1.00 0.19 H new ATOM 0 HB2 LYS A 26 -18.489 -4.299 8.525 1.00 0.20 H new ATOM 0 HB3 LYS A 26 -17.438 -4.337 7.123 1.00 0.20 H new ATOM 0 HG2 LYS A 26 -15.597 -3.577 8.903 1.00 0.25 H new ATOM 0 HG3 LYS A 26 -16.718 -4.303 10.039 1.00 0.25 H new ATOM 0 HD2 LYS A 26 -15.496 -5.676 7.612 1.00 0.62 H new ATOM 0 HD3 LYS A 26 -15.033 -5.937 9.281 1.00 0.62 H new ATOM 0 HE2 LYS A 26 -17.873 -6.309 9.106 1.00 0.62 H new ATOM 0 HE3 LYS A 26 -17.142 -7.196 7.783 1.00 0.62 H new ATOM 0 HZ1 LYS A 26 -17.294 -8.550 9.768 1.00 1.10 H new ATOM 0 HZ2 LYS A 26 -15.664 -8.288 9.368 1.00 1.10 H new ATOM 0 HZ3 LYS A 26 -16.372 -7.429 10.650 1.00 1.10 H new ATOM 387 N ILE A 27 -18.139 -1.976 5.606 1.00 0.22 N ATOM 388 CA ILE A 27 -18.955 -1.660 4.435 1.00 0.26 C ATOM 389 C ILE A 27 -18.932 -2.801 3.420 1.00 0.24 C ATOM 390 O ILE A 27 -17.881 -3.370 3.140 1.00 0.25 O ATOM 391 CB ILE A 27 -18.470 -0.372 3.747 1.00 0.34 C ATOM 392 CG1 ILE A 27 -17.033 -0.543 3.247 1.00 0.40 C ATOM 393 CG2 ILE A 27 -18.569 0.807 4.706 1.00 0.33 C ATOM 394 CD1 ILE A 27 -16.544 0.613 2.406 1.00 0.50 C ATOM 0 H ILE A 27 -17.153 -2.137 5.402 1.00 0.22 H new ATOM 0 HA ILE A 27 -19.975 -1.515 4.792 1.00 0.26 H new ATOM 0 HB ILE A 27 -19.110 -0.172 2.887 1.00 0.34 H new ATOM 0 HG12 ILE A 27 -16.371 -0.664 4.104 1.00 0.40 H new ATOM 0 HG13 ILE A 27 -16.967 -1.460 2.662 1.00 0.40 H new ATOM 0 HG21 ILE A 27 -18.223 1.712 4.207 1.00 0.33 H new ATOM 0 HG22 ILE A 27 -19.606 0.938 5.016 1.00 0.33 H new ATOM 0 HG23 ILE A 27 -17.949 0.616 5.582 1.00 0.33 H new ATOM 0 HD11 ILE A 27 -15.519 0.423 2.087 1.00 0.50 H new ATOM 0 HD12 ILE A 27 -17.183 0.721 1.529 1.00 0.50 H new ATOM 0 HD13 ILE A 27 -16.577 1.530 2.994 1.00 0.50 H new ATOM 406 N ALA A 28 -20.100 -3.131 2.876 1.00 0.26 N ATOM 407 CA ALA A 28 -20.211 -4.204 1.890 1.00 0.26 C ATOM 408 C ALA A 28 -19.187 -4.027 0.774 1.00 0.23 C ATOM 409 O ALA A 28 -19.115 -2.971 0.147 1.00 0.25 O ATOM 410 CB ALA A 28 -21.620 -4.244 1.315 1.00 0.30 C ATOM 0 H ALA A 28 -20.983 -2.672 3.100 1.00 0.26 H new ATOM 0 HA ALA A 28 -20.006 -5.151 2.390 1.00 0.26 H new ATOM 0 HB1 ALA A 28 -21.691 -5.047 0.582 1.00 0.30 H new ATOM 0 HB2 ALA A 28 -22.336 -4.421 2.118 1.00 0.30 H new ATOM 0 HB3 ALA A 28 -21.844 -3.292 0.833 1.00 0.30 H new ATOM 416 N THR A 29 -18.392 -5.069 0.537 1.00 0.27 N ATOM 417 CA THR A 29 -17.367 -5.032 -0.501 1.00 0.30 C ATOM 418 C THR A 29 -17.991 -4.851 -1.880 1.00 0.29 C ATOM 419 O THR A 29 -17.305 -4.505 -2.843 1.00 0.39 O ATOM 420 CB THR A 29 -16.516 -6.316 -0.499 1.00 0.37 C ATOM 421 OG1 THR A 29 -15.547 -6.263 -1.552 1.00 1.03 O ATOM 422 CG2 THR A 29 -17.390 -7.549 -0.670 1.00 0.96 C ATOM 0 H THR A 29 -18.439 -5.949 1.051 1.00 0.27 H new ATOM 0 HA THR A 29 -16.723 -4.180 -0.280 1.00 0.30 H new ATOM 0 HB THR A 29 -16.006 -6.384 0.462 1.00 0.37 H new ATOM 0 HG1 THR A 29 -15.902 -5.734 -2.297 1.00 1.03 H new ATOM 0 HG21 THR A 29 -16.765 -8.442 -0.665 1.00 0.96 H new ATOM 0 HG22 THR A 29 -18.107 -7.604 0.149 1.00 0.96 H new ATOM 0 HG23 THR A 29 -17.926 -7.487 -1.617 1.00 0.96 H new ATOM 430 N ARG A 30 -19.295 -5.090 -1.967 1.00 0.25 N ATOM 431 CA ARG A 30 -20.019 -4.949 -3.224 1.00 0.29 C ATOM 432 C ARG A 30 -20.253 -3.475 -3.539 1.00 0.28 C ATOM 433 O ARG A 30 -20.528 -3.108 -4.681 1.00 0.44 O ATOM 434 CB ARG A 30 -21.352 -5.691 -3.143 1.00 0.35 C ATOM 435 CG ARG A 30 -21.207 -7.137 -2.701 1.00 0.43 C ATOM 436 CD ARG A 30 -22.552 -7.751 -2.351 1.00 0.83 C ATOM 437 NE ARG A 30 -23.439 -7.827 -3.510 1.00 1.56 N ATOM 438 CZ ARG A 30 -24.661 -8.347 -3.470 1.00 2.17 C ATOM 439 NH1 ARG A 30 -25.140 -8.836 -2.334 1.00 2.25 N ATOM 440 NH2 ARG A 30 -25.406 -8.382 -4.567 1.00 3.08 N ATOM 0 H ARG A 30 -19.873 -5.383 -1.179 1.00 0.25 H new ATOM 0 HA ARG A 30 -19.421 -5.383 -4.025 1.00 0.29 H new ATOM 0 HB2 ARG A 30 -22.009 -5.169 -2.447 1.00 0.35 H new ATOM 0 HB3 ARG A 30 -21.836 -5.663 -4.119 1.00 0.35 H new ATOM 0 HG2 ARG A 30 -20.738 -7.716 -3.496 1.00 0.43 H new ATOM 0 HG3 ARG A 30 -20.546 -7.189 -1.836 1.00 0.43 H new ATOM 0 HD2 ARG A 30 -22.399 -8.751 -1.946 1.00 0.83 H new ATOM 0 HD3 ARG A 30 -23.028 -7.159 -1.569 1.00 0.83 H new ATOM 0 HE ARG A 30 -23.101 -7.460 -4.400 1.00 1.56 H new ATOM 0 HH11 ARG A 30 -24.570 -8.813 -1.488 1.00 2.25 H new ATOM 0 HH12 ARG A 30 -26.078 -9.235 -2.306 1.00 2.25 H new ATOM 0 HH21 ARG A 30 -25.041 -8.009 -5.443 1.00 3.08 H new ATOM 0 HH22 ARG A 30 -26.344 -8.782 -4.534 1.00 3.08 H new ATOM 454 N GLU A 31 -20.140 -2.641 -2.511 1.00 0.22 N ATOM 455 CA GLU A 31 -20.327 -1.202 -2.656 1.00 0.23 C ATOM 456 C GLU A 31 -18.983 -0.485 -2.634 1.00 0.21 C ATOM 457 O GLU A 31 -18.920 0.740 -2.730 1.00 0.21 O ATOM 458 CB GLU A 31 -21.216 -0.670 -1.540 1.00 0.30 C ATOM 459 CG GLU A 31 -22.489 -1.476 -1.332 1.00 0.32 C ATOM 460 CD GLU A 31 -23.396 -1.459 -2.546 1.00 1.30 C ATOM 461 OE1 GLU A 31 -23.248 -2.347 -3.412 1.00 2.26 O ATOM 462 OE2 GLU A 31 -24.257 -0.558 -2.630 1.00 1.40 O ATOM 0 H GLU A 31 -19.918 -2.940 -1.561 1.00 0.22 H new ATOM 0 HA GLU A 31 -20.810 -1.013 -3.615 1.00 0.23 H new ATOM 0 HB2 GLU A 31 -20.648 -0.659 -0.610 1.00 0.30 H new ATOM 0 HB3 GLU A 31 -21.483 0.363 -1.762 1.00 0.30 H new ATOM 0 HG2 GLU A 31 -22.227 -2.507 -1.094 1.00 0.32 H new ATOM 0 HG3 GLU A 31 -23.030 -1.078 -0.474 1.00 0.32 H new ATOM 469 N LEU A 32 -17.909 -1.261 -2.504 1.00 0.21 N ATOM 470 CA LEU A 32 -16.564 -0.704 -2.470 1.00 0.24 C ATOM 471 C LEU A 32 -16.264 0.035 -3.770 1.00 0.23 C ATOM 472 O LEU A 32 -15.802 1.177 -3.751 1.00 0.25 O ATOM 473 CB LEU A 32 -15.531 -1.816 -2.229 1.00 0.29 C ATOM 474 CG LEU A 32 -14.215 -1.374 -1.571 1.00 0.44 C ATOM 475 CD1 LEU A 32 -13.386 -0.537 -2.532 1.00 1.04 C ATOM 476 CD2 LEU A 32 -14.488 -0.597 -0.289 1.00 1.37 C ATOM 0 H LEU A 32 -17.947 -2.277 -2.421 1.00 0.21 H new ATOM 0 HA LEU A 32 -16.501 0.008 -1.647 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.989 -2.582 -1.603 1.00 0.29 H new ATOM 0 HB3 LEU A 32 -15.298 -2.283 -3.186 1.00 0.29 H new ATOM 0 HG LEU A 32 -13.647 -2.269 -1.317 1.00 0.44 H new ATOM 0 HD11 LEU A 32 -12.459 -0.235 -2.045 1.00 1.04 H new ATOM 0 HD12 LEU A 32 -13.155 -1.125 -3.420 1.00 1.04 H new ATOM 0 HD13 LEU A 32 -13.949 0.350 -2.821 1.00 1.04 H new ATOM 0 HD21 LEU A 32 -13.543 -0.294 0.161 1.00 1.37 H new ATOM 0 HD22 LEU A 32 -15.081 0.288 -0.519 1.00 1.37 H new ATOM 0 HD23 LEU A 32 -15.036 -1.229 0.410 1.00 1.37 H new ATOM 488 N GLY A 33 -16.528 -0.621 -4.899 1.00 0.25 N ATOM 489 CA GLY A 33 -16.295 0.006 -6.187 1.00 0.28 C ATOM 490 C GLY A 33 -17.004 1.339 -6.287 1.00 0.27 C ATOM 491 O GLY A 33 -16.469 2.302 -6.838 1.00 0.32 O ATOM 0 H GLY A 33 -16.897 -1.571 -4.943 1.00 0.25 H new ATOM 0 HA2 GLY A 33 -15.225 0.149 -6.336 1.00 0.28 H new ATOM 0 HA3 GLY A 33 -16.642 -0.653 -6.983 1.00 0.28 H new ATOM 495 N THR A 34 -18.215 1.389 -5.744 1.00 0.23 N ATOM 496 CA THR A 34 -19.006 2.608 -5.742 1.00 0.24 C ATOM 497 C THR A 34 -18.336 3.661 -4.870 1.00 0.22 C ATOM 498 O THR A 34 -18.410 4.860 -5.145 1.00 0.23 O ATOM 499 CB THR A 34 -20.430 2.342 -5.214 1.00 0.26 C ATOM 500 OG1 THR A 34 -21.087 1.377 -6.043 1.00 0.31 O ATOM 501 CG2 THR A 34 -21.247 3.624 -5.177 1.00 0.29 C ATOM 0 H THR A 34 -18.670 0.593 -5.298 1.00 0.23 H new ATOM 0 HA THR A 34 -19.074 2.967 -6.769 1.00 0.24 H new ATOM 0 HB THR A 34 -20.348 1.955 -4.198 1.00 0.26 H new ATOM 0 HG1 THR A 34 -21.990 1.212 -5.700 1.00 0.31 H new ATOM 0 HG21 THR A 34 -22.247 3.408 -4.801 1.00 0.29 H new ATOM 0 HG22 THR A 34 -20.761 4.346 -4.521 1.00 0.29 H new ATOM 0 HG23 THR A 34 -21.320 4.038 -6.183 1.00 0.29 H new ATOM 509 N LEU A 35 -17.674 3.195 -3.815 1.00 0.22 N ATOM 510 CA LEU A 35 -16.979 4.079 -2.890 1.00 0.24 C ATOM 511 C LEU A 35 -15.736 4.676 -3.545 1.00 0.25 C ATOM 512 O LEU A 35 -15.224 5.704 -3.104 1.00 0.29 O ATOM 513 CB LEU A 35 -16.590 3.313 -1.623 1.00 0.29 C ATOM 514 CG LEU A 35 -15.817 4.125 -0.581 1.00 0.42 C ATOM 515 CD1 LEU A 35 -16.651 5.295 -0.083 1.00 1.24 C ATOM 516 CD2 LEU A 35 -15.403 3.232 0.578 1.00 1.16 C ATOM 0 H LEU A 35 -17.605 2.205 -3.580 1.00 0.22 H new ATOM 0 HA LEU A 35 -17.651 4.894 -2.621 1.00 0.24 H new ATOM 0 HB2 LEU A 35 -17.497 2.926 -1.159 1.00 0.29 H new ATOM 0 HB3 LEU A 35 -15.987 2.452 -1.909 1.00 0.29 H new ATOM 0 HG LEU A 35 -14.919 4.526 -1.051 1.00 0.42 H new ATOM 0 HD11 LEU A 35 -16.082 5.858 0.657 1.00 1.24 H new ATOM 0 HD12 LEU A 35 -16.902 5.946 -0.921 1.00 1.24 H new ATOM 0 HD13 LEU A 35 -17.568 4.921 0.372 1.00 1.24 H new ATOM 0 HD21 LEU A 35 -14.854 3.821 1.313 1.00 1.16 H new ATOM 0 HD22 LEU A 35 -16.291 2.806 1.045 1.00 1.16 H new ATOM 0 HD23 LEU A 35 -14.767 2.428 0.208 1.00 1.16 H new ATOM 528 N MET A 36 -15.254 4.022 -4.597 1.00 0.28 N ATOM 529 CA MET A 36 -14.074 4.495 -5.312 1.00 0.32 C ATOM 530 C MET A 36 -14.431 5.618 -6.277 1.00 0.30 C ATOM 531 O MET A 36 -13.784 6.663 -6.288 1.00 0.40 O ATOM 532 CB MET A 36 -13.412 3.346 -6.073 1.00 0.45 C ATOM 533 CG MET A 36 -13.091 2.139 -5.206 1.00 0.51 C ATOM 534 SD MET A 36 -11.965 2.529 -3.853 1.00 1.10 S ATOM 535 CE MET A 36 -10.451 2.847 -4.752 1.00 0.69 C ATOM 0 H MET A 36 -15.661 3.165 -4.972 1.00 0.28 H new ATOM 0 HA MET A 36 -13.372 4.884 -4.575 1.00 0.32 H new ATOM 0 HB2 MET A 36 -14.069 3.034 -6.885 1.00 0.45 H new ATOM 0 HB3 MET A 36 -12.491 3.708 -6.530 1.00 0.45 H new ATOM 0 HG2 MET A 36 -14.017 1.735 -4.797 1.00 0.51 H new ATOM 0 HG3 MET A 36 -12.650 1.359 -5.826 1.00 0.51 H new ATOM 0 HE1 MET A 36 -9.672 3.154 -4.055 1.00 0.69 H new ATOM 0 HE2 MET A 36 -10.138 1.940 -5.270 1.00 0.69 H new ATOM 0 HE3 MET A 36 -10.620 3.640 -5.480 1.00 0.69 H new ATOM 545 N ARG A 37 -15.459 5.396 -7.089 1.00 0.30 N ATOM 546 CA ARG A 37 -15.894 6.401 -8.055 1.00 0.34 C ATOM 547 C ARG A 37 -16.322 7.685 -7.352 1.00 0.33 C ATOM 548 O ARG A 37 -16.123 8.782 -7.875 1.00 0.43 O ATOM 549 CB ARG A 37 -17.035 5.866 -8.928 1.00 0.44 C ATOM 550 CG ARG A 37 -18.012 4.969 -8.185 1.00 0.64 C ATOM 551 CD ARG A 37 -19.208 4.606 -9.051 1.00 0.70 C ATOM 552 NE ARG A 37 -20.093 5.748 -9.275 1.00 1.40 N ATOM 553 CZ ARG A 37 -21.178 5.699 -10.041 1.00 1.73 C ATOM 554 NH1 ARG A 37 -21.503 4.575 -10.667 1.00 1.52 N ATOM 555 NH2 ARG A 37 -21.942 6.774 -10.184 1.00 2.69 N ATOM 0 H ARG A 37 -16.005 4.534 -7.099 1.00 0.30 H new ATOM 0 HA ARG A 37 -15.046 6.629 -8.700 1.00 0.34 H new ATOM 0 HB2 ARG A 37 -17.581 6.709 -9.351 1.00 0.44 H new ATOM 0 HB3 ARG A 37 -16.610 5.310 -9.763 1.00 0.44 H new ATOM 0 HG2 ARG A 37 -17.502 4.059 -7.868 1.00 0.64 H new ATOM 0 HG3 ARG A 37 -18.356 5.474 -7.282 1.00 0.64 H new ATOM 0 HD2 ARG A 37 -18.858 4.226 -10.011 1.00 0.70 H new ATOM 0 HD3 ARG A 37 -19.769 3.802 -8.575 1.00 0.70 H new ATOM 0 HE ARG A 37 -19.865 6.631 -8.818 1.00 1.40 H new ATOM 0 HH11 ARG A 37 -20.919 3.745 -10.561 1.00 1.52 H new ATOM 0 HH12 ARG A 37 -22.336 4.541 -11.254 1.00 1.52 H new ATOM 0 HH21 ARG A 37 -21.697 7.641 -9.705 1.00 2.69 H new ATOM 0 HH22 ARG A 37 -22.774 6.734 -10.772 1.00 2.69 H new ATOM 569 N THR A 38 -16.911 7.547 -6.166 1.00 0.31 N ATOM 570 CA THR A 38 -17.347 8.710 -5.399 1.00 0.39 C ATOM 571 C THR A 38 -16.146 9.454 -4.822 1.00 0.36 C ATOM 572 O THR A 38 -16.266 10.585 -4.350 1.00 0.43 O ATOM 573 CB THR A 38 -18.310 8.326 -4.258 1.00 0.50 C ATOM 574 OG1 THR A 38 -18.879 9.508 -3.680 1.00 1.06 O ATOM 575 CG2 THR A 38 -17.590 7.532 -3.181 1.00 0.61 C ATOM 0 H THR A 38 -17.096 6.649 -5.719 1.00 0.31 H new ATOM 0 HA THR A 38 -17.884 9.360 -6.090 1.00 0.39 H new ATOM 0 HB THR A 38 -19.101 7.705 -4.677 1.00 0.50 H new ATOM 0 HG1 THR A 38 -18.289 10.272 -3.849 1.00 1.06 H new ATOM 0 HG21 THR A 38 -18.292 7.274 -2.388 1.00 0.61 H new ATOM 0 HG22 THR A 38 -17.181 6.619 -3.614 1.00 0.61 H new ATOM 0 HG23 THR A 38 -16.780 8.132 -2.767 1.00 0.61 H new ATOM 583 N LEU A 39 -14.990 8.801 -4.869 1.00 0.30 N ATOM 584 CA LEU A 39 -13.750 9.377 -4.358 1.00 0.33 C ATOM 585 C LEU A 39 -12.775 9.642 -5.499 1.00 0.33 C ATOM 586 O LEU A 39 -12.884 9.036 -6.564 1.00 0.31 O ATOM 587 CB LEU A 39 -13.101 8.436 -3.339 1.00 0.38 C ATOM 588 CG LEU A 39 -13.855 8.278 -2.019 1.00 0.64 C ATOM 589 CD1 LEU A 39 -13.271 7.130 -1.209 1.00 1.26 C ATOM 590 CD2 LEU A 39 -13.804 9.569 -1.219 1.00 1.07 C ATOM 0 H LEU A 39 -14.885 7.864 -5.259 1.00 0.30 H new ATOM 0 HA LEU A 39 -13.992 10.320 -3.869 1.00 0.33 H new ATOM 0 HB2 LEU A 39 -12.993 7.452 -3.796 1.00 0.38 H new ATOM 0 HB3 LEU A 39 -12.096 8.799 -3.123 1.00 0.38 H new ATOM 0 HG LEU A 39 -14.897 8.051 -2.242 1.00 0.64 H new ATOM 0 HD11 LEU A 39 -13.819 7.030 -0.272 1.00 1.26 H new ATOM 0 HD12 LEU A 39 -13.354 6.204 -1.778 1.00 1.26 H new ATOM 0 HD13 LEU A 39 -12.221 7.332 -0.996 1.00 1.26 H new ATOM 0 HD21 LEU A 39 -14.346 9.438 -0.282 1.00 1.07 H new ATOM 0 HD22 LEU A 39 -12.766 9.824 -1.005 1.00 1.07 H new ATOM 0 HD23 LEU A 39 -14.264 10.372 -1.795 1.00 1.07 H new ATOM 602 N GLY A 40 -11.841 10.563 -5.283 1.00 0.42 N ATOM 603 CA GLY A 40 -10.865 10.886 -6.312 1.00 0.47 C ATOM 604 C GLY A 40 -10.292 9.650 -6.985 1.00 0.43 C ATOM 605 O GLY A 40 -9.960 9.680 -8.171 1.00 0.69 O ATOM 0 H GLY A 40 -11.741 11.091 -4.416 1.00 0.42 H new ATOM 0 HA2 GLY A 40 -11.333 11.521 -7.065 1.00 0.47 H new ATOM 0 HA3 GLY A 40 -10.053 11.463 -5.869 1.00 0.47 H new ATOM 609 N GLN A 41 -10.189 8.561 -6.230 1.00 0.44 N ATOM 610 CA GLN A 41 -9.660 7.308 -6.757 1.00 0.40 C ATOM 611 C GLN A 41 -10.562 6.754 -7.857 1.00 0.51 C ATOM 612 O GLN A 41 -11.733 7.118 -7.955 1.00 1.45 O ATOM 613 CB GLN A 41 -9.518 6.281 -5.630 1.00 0.48 C ATOM 614 CG GLN A 41 -8.208 6.387 -4.863 1.00 0.74 C ATOM 615 CD GLN A 41 -7.850 7.817 -4.501 1.00 1.06 C ATOM 616 OE1 GLN A 41 -8.293 8.263 -3.332 1.00 1.97 O flip ATOM 617 NE2 GLN A 41 -7.179 8.511 -5.264 1.00 1.30 N flip ATOM 0 H GLN A 41 -10.466 8.521 -5.249 1.00 0.44 H new ATOM 0 HA GLN A 41 -8.678 7.507 -7.187 1.00 0.40 H new ATOM 0 HB2 GLN A 41 -10.347 6.404 -4.933 1.00 0.48 H new ATOM 0 HB3 GLN A 41 -9.601 5.279 -6.051 1.00 0.48 H new ATOM 0 HG2 GLN A 41 -8.277 5.793 -3.952 1.00 0.74 H new ATOM 0 HG3 GLN A 41 -7.406 5.958 -5.463 1.00 0.74 H new ATOM 0 HE21 GLN A 41 -6.859 8.128 -6.153 1.00 1.30 H new ATOM 0 HE22 GLN A 41 -6.943 9.469 -5.007 1.00 1.30 H new ATOM 626 N ASN A 42 -10.006 5.872 -8.682 1.00 0.74 N ATOM 627 CA ASN A 42 -10.757 5.264 -9.776 1.00 0.68 C ATOM 628 C ASN A 42 -10.029 4.031 -10.313 1.00 0.53 C ATOM 629 O ASN A 42 -9.411 4.076 -11.377 1.00 0.62 O ATOM 630 CB ASN A 42 -10.982 6.281 -10.901 1.00 0.85 C ATOM 631 CG ASN A 42 -9.687 6.879 -11.419 1.00 1.87 C ATOM 632 OD1 ASN A 42 -8.710 7.014 -10.682 1.00 2.57 O ATOM 633 ND2 ASN A 42 -9.674 7.244 -12.696 1.00 2.66 N ATOM 0 H ASN A 42 -9.037 5.562 -8.614 1.00 0.74 H new ATOM 0 HA ASN A 42 -11.727 4.950 -9.390 1.00 0.68 H new ATOM 0 HB2 ASN A 42 -11.508 5.796 -11.723 1.00 0.85 H new ATOM 0 HB3 ASN A 42 -11.627 7.081 -10.538 1.00 0.85 H new ATOM 0 HD21 ASN A 42 -8.832 7.654 -13.101 1.00 2.66 H new ATOM 0 HD22 ASN A 42 -10.506 7.114 -13.272 1.00 2.66 H new ATOM 640 N PRO A 43 -10.097 2.905 -9.576 1.00 0.41 N ATOM 641 CA PRO A 43 -9.438 1.656 -9.976 1.00 0.40 C ATOM 642 C PRO A 43 -10.038 1.058 -11.243 1.00 0.39 C ATOM 643 O PRO A 43 -11.224 1.233 -11.524 1.00 0.51 O ATOM 644 CB PRO A 43 -9.681 0.725 -8.783 1.00 0.44 C ATOM 645 CG PRO A 43 -10.893 1.273 -8.115 1.00 0.45 C ATOM 646 CD PRO A 43 -10.821 2.761 -8.300 1.00 0.44 C ATOM 0 HA PRO A 43 -8.384 1.813 -10.207 1.00 0.40 H new ATOM 0 HB2 PRO A 43 -9.839 -0.303 -9.109 1.00 0.44 H new ATOM 0 HB3 PRO A 43 -8.826 0.717 -8.107 1.00 0.44 H new ATOM 0 HG2 PRO A 43 -11.802 0.867 -8.559 1.00 0.45 H new ATOM 0 HG3 PRO A 43 -10.910 1.010 -7.057 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -11.813 3.210 -8.347 1.00 0.44 H new ATOM 0 HD3 PRO A 43 -10.291 3.244 -7.479 1.00 0.44 H new ATOM 654 N THR A 44 -9.208 0.352 -12.005 1.00 0.35 N ATOM 655 CA THR A 44 -9.652 -0.282 -13.239 1.00 0.36 C ATOM 656 C THR A 44 -10.557 -1.472 -12.932 1.00 0.32 C ATOM 657 O THR A 44 -10.495 -2.033 -11.840 1.00 0.33 O ATOM 658 CB THR A 44 -8.454 -0.755 -14.087 1.00 0.43 C ATOM 659 OG1 THR A 44 -7.502 0.305 -14.221 1.00 0.73 O ATOM 660 CG2 THR A 44 -8.907 -1.207 -15.468 1.00 0.69 C ATOM 0 H THR A 44 -8.222 0.205 -11.788 1.00 0.35 H new ATOM 0 HA THR A 44 -10.210 0.462 -13.808 1.00 0.36 H new ATOM 0 HB THR A 44 -7.992 -1.601 -13.578 1.00 0.43 H new ATOM 0 HG1 THR A 44 -6.743 -0.003 -14.759 1.00 0.73 H new ATOM 0 HG21 THR A 44 -8.043 -1.535 -16.045 1.00 0.69 H new ATOM 0 HG22 THR A 44 -9.611 -2.033 -15.368 1.00 0.69 H new ATOM 0 HG23 THR A 44 -9.392 -0.377 -15.982 1.00 0.69 H new ATOM 668 N GLU A 45 -11.396 -1.850 -13.894 1.00 0.32 N ATOM 669 CA GLU A 45 -12.314 -2.972 -13.711 1.00 0.33 C ATOM 670 C GLU A 45 -11.599 -4.197 -13.152 1.00 0.32 C ATOM 671 O GLU A 45 -12.001 -4.738 -12.123 1.00 0.34 O ATOM 672 CB GLU A 45 -12.996 -3.327 -15.032 1.00 0.40 C ATOM 673 CG GLU A 45 -14.316 -2.604 -15.246 1.00 1.14 C ATOM 674 CD GLU A 45 -14.154 -1.098 -15.309 1.00 1.84 C ATOM 675 OE1 GLU A 45 -13.897 -0.575 -16.415 1.00 2.04 O ATOM 676 OE2 GLU A 45 -14.283 -0.441 -14.256 1.00 2.70 O ATOM 0 H GLU A 45 -11.459 -1.397 -14.806 1.00 0.32 H new ATOM 0 HA GLU A 45 -13.069 -2.661 -12.989 1.00 0.33 H new ATOM 0 HB2 GLU A 45 -12.322 -3.088 -15.855 1.00 0.40 H new ATOM 0 HB3 GLU A 45 -13.170 -4.402 -15.064 1.00 0.40 H new ATOM 0 HG2 GLU A 45 -14.772 -2.955 -16.171 1.00 1.14 H new ATOM 0 HG3 GLU A 45 -15.000 -2.858 -14.437 1.00 1.14 H new ATOM 683 N ALA A 46 -10.539 -4.629 -13.831 1.00 0.33 N ATOM 684 CA ALA A 46 -9.776 -5.799 -13.404 1.00 0.37 C ATOM 685 C ALA A 46 -9.435 -5.740 -11.919 1.00 0.33 C ATOM 686 O ALA A 46 -9.759 -6.657 -11.163 1.00 0.34 O ATOM 687 CB ALA A 46 -8.502 -5.928 -14.222 1.00 0.46 C ATOM 0 H ALA A 46 -10.189 -4.186 -14.680 1.00 0.33 H new ATOM 0 HA ALA A 46 -10.403 -6.675 -13.570 1.00 0.37 H new ATOM 0 HB1 ALA A 46 -7.945 -6.805 -13.892 1.00 0.46 H new ATOM 0 HB2 ALA A 46 -8.756 -6.036 -15.277 1.00 0.46 H new ATOM 0 HB3 ALA A 46 -7.890 -5.036 -14.085 1.00 0.46 H new ATOM 693 N GLU A 47 -8.786 -4.656 -11.506 1.00 0.32 N ATOM 694 CA GLU A 47 -8.399 -4.482 -10.112 1.00 0.32 C ATOM 695 C GLU A 47 -9.617 -4.571 -9.204 1.00 0.28 C ATOM 696 O GLU A 47 -9.607 -5.292 -8.207 1.00 0.28 O ATOM 697 CB GLU A 47 -7.696 -3.136 -9.918 1.00 0.37 C ATOM 698 CG GLU A 47 -7.144 -2.934 -8.516 1.00 0.43 C ATOM 699 CD GLU A 47 -6.093 -3.963 -8.147 1.00 1.24 C ATOM 700 OE1 GLU A 47 -6.467 -5.024 -7.602 1.00 2.23 O ATOM 701 OE2 GLU A 47 -4.898 -3.711 -8.404 1.00 1.27 O ATOM 0 H GLU A 47 -8.517 -3.885 -12.118 1.00 0.32 H new ATOM 0 HA GLU A 47 -7.707 -5.281 -9.846 1.00 0.32 H new ATOM 0 HB2 GLU A 47 -6.880 -3.055 -10.636 1.00 0.37 H new ATOM 0 HB3 GLU A 47 -8.398 -2.333 -10.142 1.00 0.37 H new ATOM 0 HG2 GLU A 47 -6.712 -1.936 -8.440 1.00 0.43 H new ATOM 0 HG3 GLU A 47 -7.962 -2.982 -7.797 1.00 0.43 H new ATOM 708 N LEU A 48 -10.669 -3.842 -9.563 1.00 0.29 N ATOM 709 CA LEU A 48 -11.897 -3.836 -8.781 1.00 0.31 C ATOM 710 C LEU A 48 -12.456 -5.247 -8.636 1.00 0.30 C ATOM 711 O LEU A 48 -13.009 -5.601 -7.597 1.00 0.35 O ATOM 712 CB LEU A 48 -12.937 -2.921 -9.431 1.00 0.35 C ATOM 713 CG LEU A 48 -14.040 -2.432 -8.491 1.00 0.65 C ATOM 714 CD1 LEU A 48 -13.450 -1.585 -7.373 1.00 1.34 C ATOM 715 CD2 LEU A 48 -15.085 -1.641 -9.264 1.00 1.36 C ATOM 0 H LEU A 48 -10.694 -3.248 -10.392 1.00 0.29 H new ATOM 0 HA LEU A 48 -11.664 -3.456 -7.786 1.00 0.31 H new ATOM 0 HB2 LEU A 48 -12.426 -2.054 -9.850 1.00 0.35 H new ATOM 0 HB3 LEU A 48 -13.398 -3.453 -10.263 1.00 0.35 H new ATOM 0 HG LEU A 48 -14.525 -3.301 -8.046 1.00 0.65 H new ATOM 0 HD11 LEU A 48 -14.249 -1.245 -6.714 1.00 1.34 H new ATOM 0 HD12 LEU A 48 -12.737 -2.181 -6.803 1.00 1.34 H new ATOM 0 HD13 LEU A 48 -12.941 -0.721 -7.801 1.00 1.34 H new ATOM 0 HD21 LEU A 48 -15.863 -1.300 -8.580 1.00 1.36 H new ATOM 0 HD22 LEU A 48 -14.613 -0.779 -9.736 1.00 1.36 H new ATOM 0 HD23 LEU A 48 -15.529 -2.276 -10.031 1.00 1.36 H new ATOM 727 N GLN A 49 -12.304 -6.053 -9.682 1.00 0.30 N ATOM 728 CA GLN A 49 -12.789 -7.427 -9.663 1.00 0.35 C ATOM 729 C GLN A 49 -11.913 -8.290 -8.763 1.00 0.35 C ATOM 730 O GLN A 49 -12.394 -9.222 -8.122 1.00 0.38 O ATOM 731 CB GLN A 49 -12.808 -8.015 -11.077 1.00 0.41 C ATOM 732 CG GLN A 49 -13.786 -7.334 -12.024 1.00 0.48 C ATOM 733 CD GLN A 49 -15.202 -7.297 -11.483 1.00 0.78 C ATOM 734 OE1 GLN A 49 -15.962 -8.255 -11.633 1.00 1.22 O ATOM 735 NE2 GLN A 49 -15.573 -6.179 -10.870 1.00 1.19 N ATOM 0 H GLN A 49 -11.849 -5.778 -10.552 1.00 0.30 H new ATOM 0 HA GLN A 49 -13.806 -7.419 -9.270 1.00 0.35 H new ATOM 0 HB2 GLN A 49 -11.805 -7.949 -11.499 1.00 0.41 H new ATOM 0 HB3 GLN A 49 -13.058 -9.074 -11.014 1.00 0.41 H new ATOM 0 HG2 GLN A 49 -13.449 -6.315 -12.216 1.00 0.48 H new ATOM 0 HG3 GLN A 49 -13.781 -7.857 -12.981 1.00 0.48 H new ATOM 0 HE21 GLN A 49 -14.911 -5.410 -10.768 1.00 1.19 H new ATOM 0 HE22 GLN A 49 -16.520 -6.089 -10.502 1.00 1.19 H new ATOM 744 N ASP A 50 -10.623 -7.971 -8.723 1.00 0.34 N ATOM 745 CA ASP A 50 -9.671 -8.718 -7.907 1.00 0.38 C ATOM 746 C ASP A 50 -9.906 -8.491 -6.414 1.00 0.35 C ATOM 747 O ASP A 50 -10.062 -9.445 -5.654 1.00 0.39 O ATOM 748 CB ASP A 50 -8.237 -8.328 -8.271 1.00 0.43 C ATOM 749 CG ASP A 50 -7.877 -8.707 -9.693 1.00 0.49 C ATOM 750 OD1 ASP A 50 -7.981 -9.904 -10.033 1.00 0.62 O ATOM 751 OD2 ASP A 50 -7.486 -7.807 -10.466 1.00 0.53 O ATOM 0 H ASP A 50 -10.212 -7.199 -9.247 1.00 0.34 H new ATOM 0 HA ASP A 50 -9.823 -9.777 -8.115 1.00 0.38 H new ATOM 0 HB2 ASP A 50 -8.112 -7.253 -8.142 1.00 0.43 H new ATOM 0 HB3 ASP A 50 -7.546 -8.814 -7.583 1.00 0.43 H new ATOM 756 N LEU A 51 -9.925 -7.226 -6.000 1.00 0.32 N ATOM 757 CA LEU A 51 -10.122 -6.882 -4.594 1.00 0.33 C ATOM 758 C LEU A 51 -11.496 -7.312 -4.085 1.00 0.32 C ATOM 759 O LEU A 51 -11.611 -7.857 -2.988 1.00 0.35 O ATOM 760 CB LEU A 51 -9.933 -5.379 -4.385 1.00 0.36 C ATOM 761 CG LEU A 51 -10.766 -4.489 -5.305 1.00 0.30 C ATOM 762 CD1 LEU A 51 -11.918 -3.855 -4.540 1.00 0.39 C ATOM 763 CD2 LEU A 51 -9.889 -3.420 -5.939 1.00 0.31 C ATOM 0 H LEU A 51 -9.806 -6.423 -6.618 1.00 0.32 H new ATOM 0 HA LEU A 51 -9.373 -7.426 -4.019 1.00 0.33 H new ATOM 0 HB2 LEU A 51 -10.179 -5.138 -3.351 1.00 0.36 H new ATOM 0 HB3 LEU A 51 -8.880 -5.137 -4.527 1.00 0.36 H new ATOM 0 HG LEU A 51 -11.186 -5.107 -6.098 1.00 0.30 H new ATOM 0 HD11 LEU A 51 -12.499 -3.225 -5.213 1.00 0.39 H new ATOM 0 HD12 LEU A 51 -12.558 -4.637 -4.132 1.00 0.39 H new ATOM 0 HD13 LEU A 51 -11.523 -3.248 -3.725 1.00 0.39 H new ATOM 0 HD21 LEU A 51 -10.495 -2.793 -6.592 1.00 0.31 H new ATOM 0 HD22 LEU A 51 -9.442 -2.805 -5.158 1.00 0.31 H new ATOM 0 HD23 LEU A 51 -9.100 -3.895 -6.522 1.00 0.31 H new ATOM 775 N ILE A 52 -12.539 -7.066 -4.874 1.00 0.31 N ATOM 776 CA ILE A 52 -13.894 -7.437 -4.475 1.00 0.34 C ATOM 777 C ILE A 52 -14.033 -8.951 -4.346 1.00 0.37 C ATOM 778 O ILE A 52 -14.609 -9.450 -3.379 1.00 0.41 O ATOM 779 CB ILE A 52 -14.949 -6.910 -5.472 1.00 0.38 C ATOM 780 CG1 ILE A 52 -15.004 -5.381 -5.429 1.00 0.42 C ATOM 781 CG2 ILE A 52 -16.320 -7.504 -5.163 1.00 0.50 C ATOM 782 CD1 ILE A 52 -15.957 -4.778 -6.440 1.00 0.50 C ATOM 0 H ILE A 52 -12.473 -6.615 -5.786 1.00 0.31 H new ATOM 0 HA ILE A 52 -14.073 -6.975 -3.504 1.00 0.34 H new ATOM 0 HB ILE A 52 -14.661 -7.218 -6.477 1.00 0.38 H new ATOM 0 HG12 ILE A 52 -15.301 -5.065 -4.429 1.00 0.42 H new ATOM 0 HG13 ILE A 52 -14.004 -4.985 -5.604 1.00 0.42 H new ATOM 0 HG21 ILE A 52 -17.051 -7.122 -5.875 1.00 0.50 H new ATOM 0 HG22 ILE A 52 -16.272 -8.590 -5.240 1.00 0.50 H new ATOM 0 HG23 ILE A 52 -16.618 -7.225 -4.152 1.00 0.50 H new ATOM 0 HD11 ILE A 52 -15.943 -3.692 -6.351 1.00 0.50 H new ATOM 0 HD12 ILE A 52 -15.649 -5.063 -7.446 1.00 0.50 H new ATOM 0 HD13 ILE A 52 -16.966 -5.144 -6.252 1.00 0.50 H new ATOM 794 N ALA A 53 -13.503 -9.677 -5.325 1.00 0.41 N ATOM 795 CA ALA A 53 -13.574 -11.132 -5.318 1.00 0.50 C ATOM 796 C ALA A 53 -12.830 -11.713 -4.122 1.00 0.49 C ATOM 797 O ALA A 53 -13.383 -12.515 -3.368 1.00 0.58 O ATOM 798 CB ALA A 53 -13.016 -11.697 -6.616 1.00 0.59 C ATOM 0 H ALA A 53 -13.020 -9.281 -6.132 1.00 0.41 H new ATOM 0 HA ALA A 53 -14.623 -11.418 -5.233 1.00 0.50 H new ATOM 0 HB1 ALA A 53 -13.076 -12.785 -6.595 1.00 0.59 H new ATOM 0 HB2 ALA A 53 -13.596 -11.318 -7.457 1.00 0.59 H new ATOM 0 HB3 ALA A 53 -11.975 -11.393 -6.727 1.00 0.59 H new ATOM 804 N GLU A 54 -11.574 -11.309 -3.953 1.00 0.45 N ATOM 805 CA GLU A 54 -10.762 -11.797 -2.845 1.00 0.51 C ATOM 806 C GLU A 54 -11.400 -11.432 -1.510 1.00 0.50 C ATOM 807 O GLU A 54 -11.304 -12.184 -0.541 1.00 0.59 O ATOM 808 CB GLU A 54 -9.339 -11.235 -2.924 1.00 0.57 C ATOM 809 CG GLU A 54 -9.256 -9.735 -2.688 1.00 1.07 C ATOM 810 CD GLU A 54 -7.840 -9.205 -2.809 1.00 1.77 C ATOM 811 OE1 GLU A 54 -7.424 -8.875 -3.939 1.00 1.99 O ATOM 812 OE2 GLU A 54 -7.149 -9.118 -1.772 1.00 2.54 O ATOM 0 H GLU A 54 -11.099 -10.648 -4.567 1.00 0.45 H new ATOM 0 HA GLU A 54 -10.708 -12.883 -2.919 1.00 0.51 H new ATOM 0 HB2 GLU A 54 -8.716 -11.744 -2.188 1.00 0.57 H new ATOM 0 HB3 GLU A 54 -8.923 -11.462 -3.905 1.00 0.57 H new ATOM 0 HG2 GLU A 54 -9.895 -9.222 -3.406 1.00 1.07 H new ATOM 0 HG3 GLU A 54 -9.643 -9.505 -1.695 1.00 1.07 H new ATOM 819 N ALA A 55 -12.051 -10.275 -1.464 1.00 0.43 N ATOM 820 CA ALA A 55 -12.710 -9.823 -0.246 1.00 0.47 C ATOM 821 C ALA A 55 -14.036 -10.547 -0.044 1.00 0.46 C ATOM 822 O ALA A 55 -14.605 -10.528 1.048 1.00 0.53 O ATOM 823 CB ALA A 55 -12.929 -8.319 -0.286 1.00 0.50 C ATOM 0 H ALA A 55 -12.136 -9.635 -2.254 1.00 0.43 H new ATOM 0 HA ALA A 55 -12.061 -10.059 0.597 1.00 0.47 H new ATOM 0 HB1 ALA A 55 -13.422 -7.999 0.632 1.00 0.50 H new ATOM 0 HB2 ALA A 55 -11.968 -7.814 -0.377 1.00 0.50 H new ATOM 0 HB3 ALA A 55 -13.554 -8.065 -1.142 1.00 0.50 H new ATOM 829 N GLU A 56 -14.526 -11.184 -1.104 1.00 0.41 N ATOM 830 CA GLU A 56 -15.789 -11.911 -1.044 1.00 0.44 C ATOM 831 C GLU A 56 -15.607 -13.288 -0.410 1.00 0.49 C ATOM 832 O GLU A 56 -16.330 -13.654 0.519 1.00 0.63 O ATOM 833 CB GLU A 56 -16.384 -12.059 -2.446 1.00 0.47 C ATOM 834 CG GLU A 56 -17.774 -12.675 -2.455 1.00 0.52 C ATOM 835 CD GLU A 56 -18.343 -12.810 -3.853 1.00 1.26 C ATOM 836 OE1 GLU A 56 -18.877 -11.809 -4.377 1.00 1.66 O ATOM 837 OE2 GLU A 56 -18.257 -13.918 -4.425 1.00 1.95 O ATOM 0 H GLU A 56 -14.067 -11.211 -2.015 1.00 0.41 H new ATOM 0 HA GLU A 56 -16.474 -11.336 -0.421 1.00 0.44 H new ATOM 0 HB2 GLU A 56 -16.427 -11.078 -2.919 1.00 0.47 H new ATOM 0 HB3 GLU A 56 -15.719 -12.675 -3.051 1.00 0.47 H new ATOM 0 HG2 GLU A 56 -17.735 -13.658 -1.986 1.00 0.52 H new ATOM 0 HG3 GLU A 56 -18.443 -12.061 -1.852 1.00 0.52 H new ATOM 844 N ASN A 57 -14.640 -14.049 -0.915 1.00 0.53 N ATOM 845 CA ASN A 57 -14.377 -15.391 -0.401 1.00 0.68 C ATOM 846 C ASN A 57 -13.388 -15.361 0.763 1.00 0.79 C ATOM 847 O ASN A 57 -12.633 -16.311 0.972 1.00 1.19 O ATOM 848 CB ASN A 57 -13.846 -16.293 -1.519 1.00 0.87 C ATOM 849 CG ASN A 57 -12.473 -15.872 -2.008 1.00 1.67 C ATOM 850 OD1 ASN A 57 -11.453 -16.318 -1.487 1.00 2.38 O ATOM 851 ND2 ASN A 57 -12.444 -15.008 -3.016 1.00 2.48 N ATOM 0 H ASN A 57 -14.027 -13.761 -1.677 1.00 0.53 H new ATOM 0 HA ASN A 57 -15.319 -15.795 -0.031 1.00 0.68 H new ATOM 0 HB2 ASN A 57 -13.800 -17.321 -1.160 1.00 0.87 H new ATOM 0 HB3 ASN A 57 -14.545 -16.279 -2.355 1.00 0.87 H new ATOM 0 HD21 ASN A 57 -11.550 -14.688 -3.388 1.00 2.48 H new ATOM 0 HD22 ASN A 57 -13.316 -14.664 -3.418 1.00 2.48 H new ATOM 858 N ASN A 58 -13.400 -14.268 1.521 1.00 0.84 N ATOM 859 CA ASN A 58 -12.509 -14.123 2.670 1.00 1.03 C ATOM 860 C ASN A 58 -13.151 -13.265 3.753 1.00 1.09 C ATOM 861 O ASN A 58 -12.728 -13.288 4.909 1.00 1.84 O ATOM 862 CB ASN A 58 -11.173 -13.512 2.243 1.00 1.12 C ATOM 863 CG ASN A 58 -10.328 -14.476 1.432 1.00 1.81 C ATOM 864 OD1 ASN A 58 -10.414 -14.516 0.205 1.00 2.48 O ATOM 865 ND2 ASN A 58 -9.506 -15.262 2.119 1.00 2.14 N ATOM 0 H ASN A 58 -14.016 -13.471 1.361 1.00 0.84 H new ATOM 0 HA ASN A 58 -12.327 -15.117 3.078 1.00 1.03 H new ATOM 0 HB2 ASN A 58 -11.359 -12.613 1.655 1.00 1.12 H new ATOM 0 HB3 ASN A 58 -10.618 -13.204 3.129 1.00 1.12 H new ATOM 0 HD21 ASN A 58 -8.914 -15.933 1.629 1.00 2.14 H new ATOM 0 HD22 ASN A 58 -9.467 -15.195 3.136 1.00 2.14 H new ATOM 872 N ASN A 59 -14.174 -12.507 3.372 1.00 1.04 N ATOM 873 CA ASN A 59 -14.875 -11.643 4.314 1.00 1.01 C ATOM 874 C ASN A 59 -16.385 -11.752 4.126 1.00 0.88 C ATOM 875 O ASN A 59 -17.135 -10.859 4.519 1.00 0.91 O ATOM 876 CB ASN A 59 -14.426 -10.192 4.138 1.00 1.08 C ATOM 877 CG ASN A 59 -12.923 -10.033 4.258 1.00 1.31 C ATOM 878 OD1 ASN A 59 -12.224 -10.142 3.133 1.00 2.05 O flip ATOM 879 ND2 ASN A 59 -12.395 -9.814 5.348 1.00 1.51 N flip ATOM 0 H ASN A 59 -14.535 -12.474 2.419 1.00 1.04 H new ATOM 0 HA ASN A 59 -14.629 -11.969 5.325 1.00 1.01 H new ATOM 0 HB2 ASN A 59 -14.750 -9.830 3.162 1.00 1.08 H new ATOM 0 HB3 ASN A 59 -14.915 -9.570 4.887 1.00 1.08 H new ATOM 0 HD21 ASN A 59 -12.970 -9.738 6.187 1.00 1.51 H new ATOM 0 HD22 ASN A 59 -11.382 -9.709 5.412 1.00 1.51 H new ATOM 886 N ASN A 60 -16.818 -12.856 3.522 1.00 0.80 N ATOM 887 CA ASN A 60 -18.237 -13.106 3.274 1.00 0.76 C ATOM 888 C ASN A 60 -18.843 -12.040 2.363 1.00 0.74 C ATOM 889 O ASN A 60 -18.898 -12.215 1.146 1.00 1.42 O ATOM 890 CB ASN A 60 -19.008 -13.173 4.595 1.00 0.86 C ATOM 891 CG ASN A 60 -18.454 -14.223 5.540 1.00 0.95 C ATOM 892 OD1 ASN A 60 -17.877 -15.281 4.980 1.00 1.47 O flip ATOM 893 ND2 ASN A 60 -18.544 -14.083 6.760 1.00 1.19 N flip ATOM 0 H ASN A 60 -16.201 -13.598 3.192 1.00 0.80 H new ATOM 0 HA ASN A 60 -18.319 -14.067 2.766 1.00 0.76 H new ATOM 0 HB2 ASN A 60 -18.975 -12.198 5.081 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -20.056 -13.391 4.389 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -18.995 -13.254 7.146 1.00 1.19 H new ATOM 0 HD22 ASN A 60 -18.167 -14.796 7.384 1.00 1.19 H new ATOM 900 N GLY A 61 -19.294 -10.937 2.955 1.00 0.43 N ATOM 901 CA GLY A 61 -19.893 -9.871 2.172 1.00 0.40 C ATOM 902 C GLY A 61 -19.618 -8.494 2.745 1.00 0.32 C ATOM 903 O GLY A 61 -20.125 -7.493 2.237 1.00 0.38 O ATOM 0 H GLY A 61 -19.255 -10.763 3.959 1.00 0.43 H new ATOM 0 HA2 GLY A 61 -19.512 -9.918 1.152 1.00 0.40 H new ATOM 0 HA3 GLY A 61 -20.970 -10.028 2.117 1.00 0.40 H new ATOM 907 N GLN A 62 -18.815 -8.441 3.803 1.00 0.36 N ATOM 908 CA GLN A 62 -18.475 -7.174 4.439 1.00 0.29 C ATOM 909 C GLN A 62 -16.987 -6.871 4.298 1.00 0.31 C ATOM 910 O GLN A 62 -16.160 -7.777 4.228 1.00 0.38 O ATOM 911 CB GLN A 62 -18.868 -7.192 5.918 1.00 0.27 C ATOM 912 CG GLN A 62 -20.303 -6.758 6.175 1.00 0.27 C ATOM 913 CD GLN A 62 -20.451 -5.249 6.263 1.00 0.23 C ATOM 914 OE1 GLN A 62 -21.341 -4.738 6.944 1.00 0.25 O ATOM 915 NE2 GLN A 62 -19.573 -4.526 5.579 1.00 0.21 N ATOM 0 H GLN A 62 -18.388 -9.260 4.237 1.00 0.36 H new ATOM 0 HA GLN A 62 -19.035 -6.387 3.934 1.00 0.29 H new ATOM 0 HB2 GLN A 62 -18.727 -8.199 6.310 1.00 0.27 H new ATOM 0 HB3 GLN A 62 -18.195 -6.537 6.472 1.00 0.27 H new ATOM 0 HG2 GLN A 62 -20.941 -7.136 5.376 1.00 0.27 H new ATOM 0 HG3 GLN A 62 -20.654 -7.208 7.103 1.00 0.27 H new ATOM 0 HE21 GLN A 62 -18.851 -4.989 5.027 1.00 0.21 H new ATOM 0 HE22 GLN A 62 -19.620 -3.507 5.605 1.00 0.21 H new ATOM 924 N LEU A 63 -16.665 -5.585 4.261 1.00 0.30 N ATOM 925 CA LEU A 63 -15.285 -5.133 4.128 1.00 0.36 C ATOM 926 C LEU A 63 -14.881 -4.325 5.357 1.00 0.31 C ATOM 927 O LEU A 63 -15.726 -3.702 5.993 1.00 0.27 O ATOM 928 CB LEU A 63 -15.139 -4.293 2.859 1.00 0.45 C ATOM 929 CG LEU A 63 -13.715 -4.138 2.337 1.00 0.79 C ATOM 930 CD1 LEU A 63 -13.621 -4.620 0.897 1.00 1.41 C ATOM 931 CD2 LEU A 63 -13.268 -2.691 2.448 1.00 1.43 C ATOM 0 H LEU A 63 -17.347 -4.829 4.322 1.00 0.30 H new ATOM 0 HA LEU A 63 -14.626 -5.998 4.053 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -15.748 -4.742 2.075 1.00 0.45 H new ATOM 0 HB3 LEU A 63 -15.547 -3.301 3.052 1.00 0.45 H new ATOM 0 HG LEU A 63 -13.052 -4.752 2.947 1.00 0.79 H new ATOM 0 HD11 LEU A 63 -12.598 -4.502 0.540 1.00 1.41 H new ATOM 0 HD12 LEU A 63 -13.904 -5.671 0.846 1.00 1.41 H new ATOM 0 HD13 LEU A 63 -14.293 -4.032 0.272 1.00 1.41 H new ATOM 0 HD21 LEU A 63 -12.250 -2.595 2.072 1.00 1.43 H new ATOM 0 HD22 LEU A 63 -13.933 -2.059 1.860 1.00 1.43 H new ATOM 0 HD23 LEU A 63 -13.300 -2.379 3.492 1.00 1.43 H new ATOM 943 N ASN A 64 -13.592 -4.308 5.674 1.00 0.33 N ATOM 944 CA ASN A 64 -13.114 -3.591 6.853 1.00 0.31 C ATOM 945 C ASN A 64 -12.259 -2.393 6.463 1.00 0.31 C ATOM 946 O ASN A 64 -11.701 -2.351 5.368 1.00 0.33 O ATOM 947 CB ASN A 64 -12.294 -4.513 7.761 1.00 0.34 C ATOM 948 CG ASN A 64 -12.864 -5.916 7.876 1.00 0.53 C ATOM 949 OD1 ASN A 64 -13.443 -6.450 6.930 1.00 1.19 O ATOM 950 ND2 ASN A 64 -12.698 -6.524 9.045 1.00 0.99 N ATOM 0 H ASN A 64 -12.863 -4.778 5.137 1.00 0.33 H new ATOM 0 HA ASN A 64 -13.994 -3.241 7.392 1.00 0.31 H new ATOM 0 HB2 ASN A 64 -11.275 -4.574 7.378 1.00 0.34 H new ATOM 0 HB3 ASN A 64 -12.235 -4.071 8.756 1.00 0.34 H new ATOM 0 HD21 ASN A 64 -13.056 -7.469 9.184 1.00 0.99 H new ATOM 0 HD22 ASN A 64 -12.212 -6.046 9.804 1.00 0.99 H new ATOM 957 N PHE A 65 -12.174 -1.416 7.362 1.00 0.30 N ATOM 958 CA PHE A 65 -11.385 -0.214 7.115 1.00 0.30 C ATOM 959 C PHE A 65 -9.991 -0.572 6.607 1.00 0.29 C ATOM 960 O PHE A 65 -9.453 0.097 5.725 1.00 0.31 O ATOM 961 CB PHE A 65 -11.279 0.626 8.390 1.00 0.32 C ATOM 962 CG PHE A 65 -10.445 1.866 8.223 1.00 0.33 C ATOM 963 CD1 PHE A 65 -10.859 2.886 7.381 1.00 0.37 C ATOM 964 CD2 PHE A 65 -9.250 2.011 8.910 1.00 0.35 C ATOM 965 CE1 PHE A 65 -10.095 4.028 7.227 1.00 0.40 C ATOM 966 CE2 PHE A 65 -8.483 3.150 8.759 1.00 0.38 C ATOM 967 CZ PHE A 65 -8.902 4.157 7.913 1.00 0.39 C ATOM 0 H PHE A 65 -12.642 -1.434 8.268 1.00 0.30 H new ATOM 0 HA PHE A 65 -11.892 0.371 6.347 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -12.280 0.912 8.712 1.00 0.32 H new ATOM 0 HB3 PHE A 65 -10.851 0.014 9.184 1.00 0.32 H new ATOM 0 HD1 PHE A 65 -11.788 2.788 6.839 1.00 0.37 H new ATOM 0 HD2 PHE A 65 -8.915 1.225 9.571 1.00 0.35 H new ATOM 0 HE1 PHE A 65 -10.430 4.818 6.572 1.00 0.40 H new ATOM 0 HE2 PHE A 65 -7.556 3.253 9.303 1.00 0.38 H new ATOM 0 HZ PHE A 65 -8.299 5.044 7.787 1.00 0.39 H new ATOM 977 N THR A 66 -9.410 -1.632 7.164 1.00 0.31 N ATOM 978 CA THR A 66 -8.082 -2.070 6.755 1.00 0.32 C ATOM 979 C THR A 66 -8.109 -2.663 5.353 1.00 0.31 C ATOM 980 O THR A 66 -7.140 -2.546 4.603 1.00 0.30 O ATOM 981 CB THR A 66 -7.491 -3.100 7.733 1.00 0.40 C ATOM 982 OG1 THR A 66 -8.523 -3.639 8.566 1.00 0.56 O ATOM 983 CG2 THR A 66 -6.415 -2.456 8.592 1.00 0.81 C ATOM 0 H THR A 66 -9.837 -2.200 7.896 1.00 0.31 H new ATOM 0 HA THR A 66 -7.446 -1.185 6.760 1.00 0.32 H new ATOM 0 HB THR A 66 -7.043 -3.909 7.156 1.00 0.40 H new ATOM 0 HG1 THR A 66 -8.136 -4.295 9.183 1.00 0.56 H new ATOM 0 HG21 THR A 66 -6.006 -3.197 9.279 1.00 0.81 H new ATOM 0 HG22 THR A 66 -5.618 -2.075 7.953 1.00 0.81 H new ATOM 0 HG23 THR A 66 -6.848 -1.633 9.161 1.00 0.81 H new ATOM 991 N GLU A 67 -9.218 -3.310 5.005 1.00 0.34 N ATOM 992 CA GLU A 67 -9.371 -3.893 3.680 1.00 0.37 C ATOM 993 C GLU A 67 -9.419 -2.783 2.637 1.00 0.32 C ATOM 994 O GLU A 67 -8.733 -2.835 1.614 1.00 0.35 O ATOM 995 CB GLU A 67 -10.652 -4.728 3.613 1.00 0.42 C ATOM 996 CG GLU A 67 -10.670 -5.910 4.570 1.00 0.49 C ATOM 997 CD GLU A 67 -9.749 -7.032 4.130 1.00 0.88 C ATOM 998 OE1 GLU A 67 -10.199 -7.901 3.353 1.00 1.36 O ATOM 999 OE2 GLU A 67 -8.577 -7.042 4.562 1.00 1.21 O ATOM 0 H GLU A 67 -10.020 -3.442 5.621 1.00 0.34 H new ATOM 0 HA GLU A 67 -8.520 -4.543 3.477 1.00 0.37 H new ATOM 0 HB2 GLU A 67 -11.505 -4.085 3.830 1.00 0.42 H new ATOM 0 HB3 GLU A 67 -10.781 -5.096 2.595 1.00 0.42 H new ATOM 0 HG2 GLU A 67 -10.376 -5.572 5.564 1.00 0.49 H new ATOM 0 HG3 GLU A 67 -11.688 -6.291 4.651 1.00 0.49 H new ATOM 1006 N PHE A 68 -10.236 -1.772 2.920 1.00 0.29 N ATOM 1007 CA PHE A 68 -10.389 -0.623 2.038 1.00 0.27 C ATOM 1008 C PHE A 68 -9.073 0.137 1.918 1.00 0.26 C ATOM 1009 O PHE A 68 -8.568 0.351 0.817 1.00 0.32 O ATOM 1010 CB PHE A 68 -11.486 0.298 2.580 1.00 0.26 C ATOM 1011 CG PHE A 68 -11.679 1.565 1.794 1.00 0.30 C ATOM 1012 CD1 PHE A 68 -11.861 1.530 0.421 1.00 0.38 C ATOM 1013 CD2 PHE A 68 -11.693 2.791 2.437 1.00 0.35 C ATOM 1014 CE1 PHE A 68 -12.053 2.696 -0.295 1.00 0.48 C ATOM 1015 CE2 PHE A 68 -11.882 3.959 1.726 1.00 0.45 C ATOM 1016 CZ PHE A 68 -12.065 3.912 0.358 1.00 0.51 C ATOM 0 H PHE A 68 -10.807 -1.728 3.764 1.00 0.29 H new ATOM 0 HA PHE A 68 -10.673 -0.973 1.046 1.00 0.27 H new ATOM 0 HB2 PHE A 68 -12.428 -0.251 2.598 1.00 0.26 H new ATOM 0 HB3 PHE A 68 -11.248 0.558 3.612 1.00 0.26 H new ATOM 0 HD1 PHE A 68 -11.853 0.581 -0.095 1.00 0.38 H new ATOM 0 HD2 PHE A 68 -11.554 2.834 3.507 1.00 0.35 H new ATOM 0 HE1 PHE A 68 -12.194 2.656 -1.365 1.00 0.48 H new ATOM 0 HE2 PHE A 68 -11.887 4.909 2.239 1.00 0.45 H new ATOM 0 HZ PHE A 68 -12.217 4.824 -0.200 1.00 0.51 H new ATOM 1026 N CYS A 69 -8.525 0.540 3.063 1.00 0.23 N ATOM 1027 CA CYS A 69 -7.264 1.269 3.094 1.00 0.23 C ATOM 1028 C CYS A 69 -6.176 0.469 2.390 1.00 0.27 C ATOM 1029 O CYS A 69 -5.337 1.027 1.682 1.00 0.31 O ATOM 1030 CB CYS A 69 -6.841 1.548 4.538 1.00 0.23 C ATOM 1031 SG CYS A 69 -6.083 3.165 4.790 1.00 0.75 S ATOM 0 H CYS A 69 -8.937 0.373 3.981 1.00 0.23 H new ATOM 0 HA CYS A 69 -7.405 2.218 2.576 1.00 0.23 H new ATOM 0 HB2 CYS A 69 -7.716 1.465 5.183 1.00 0.23 H new ATOM 0 HB3 CYS A 69 -6.138 0.777 4.854 1.00 0.23 H new ATOM 0 HG CYS A 69 -6.936 4.097 4.482 1.00 0.75 H new ATOM 1037 N GLY A 70 -6.201 -0.845 2.599 1.00 0.30 N ATOM 1038 CA GLY A 70 -5.222 -1.718 1.979 1.00 0.35 C ATOM 1039 C GLY A 70 -5.156 -1.527 0.479 1.00 0.37 C ATOM 1040 O GLY A 70 -4.074 -1.349 -0.083 1.00 0.41 O ATOM 0 H GLY A 70 -6.884 -1.320 3.189 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -4.240 -1.526 2.412 1.00 0.35 H new ATOM 0 HA3 GLY A 70 -5.471 -2.756 2.201 1.00 0.35 H new ATOM 1044 N ILE A 71 -6.314 -1.561 -0.175 1.00 0.37 N ATOM 1045 CA ILE A 71 -6.369 -1.381 -1.617 1.00 0.41 C ATOM 1046 C ILE A 71 -5.934 0.020 -1.998 1.00 0.40 C ATOM 1047 O ILE A 71 -5.181 0.215 -2.950 1.00 0.44 O ATOM 1048 CB ILE A 71 -7.774 -1.631 -2.177 1.00 0.42 C ATOM 1049 CG1 ILE A 71 -8.194 -3.069 -1.894 1.00 0.47 C ATOM 1050 CG2 ILE A 71 -7.794 -1.344 -3.673 1.00 0.46 C ATOM 1051 CD1 ILE A 71 -9.672 -3.220 -1.613 1.00 0.51 C ATOM 0 H ILE A 71 -7.220 -1.711 0.270 1.00 0.37 H new ATOM 0 HA ILE A 71 -5.688 -2.115 -2.048 1.00 0.41 H new ATOM 0 HB ILE A 71 -8.484 -0.962 -1.690 1.00 0.42 H new ATOM 0 HG12 ILE A 71 -7.929 -3.692 -2.748 1.00 0.47 H new ATOM 0 HG13 ILE A 71 -7.629 -3.443 -1.040 1.00 0.47 H new ATOM 0 HG21 ILE A 71 -8.795 -1.524 -4.065 1.00 0.46 H new ATOM 0 HG22 ILE A 71 -7.517 -0.304 -3.848 1.00 0.46 H new ATOM 0 HG23 ILE A 71 -7.084 -1.998 -4.179 1.00 0.46 H new ATOM 0 HD11 ILE A 71 -9.901 -4.268 -1.420 1.00 0.51 H new ATOM 0 HD12 ILE A 71 -9.939 -2.624 -0.740 1.00 0.51 H new ATOM 0 HD13 ILE A 71 -10.243 -2.877 -2.476 1.00 0.51 H new ATOM 1063 N MET A 72 -6.424 0.998 -1.257 1.00 0.38 N ATOM 1064 CA MET A 72 -6.073 2.381 -1.520 1.00 0.41 C ATOM 1065 C MET A 72 -4.562 2.527 -1.553 1.00 0.45 C ATOM 1066 O MET A 72 -4.025 3.332 -2.300 1.00 0.52 O ATOM 1067 CB MET A 72 -6.662 3.313 -0.464 1.00 0.39 C ATOM 1068 CG MET A 72 -8.177 3.239 -0.362 1.00 0.41 C ATOM 1069 SD MET A 72 -8.911 4.799 0.159 1.00 1.01 S ATOM 1070 CE MET A 72 -8.682 5.792 -1.313 1.00 0.58 C ATOM 0 H MET A 72 -7.062 0.861 -0.473 1.00 0.38 H new ATOM 0 HA MET A 72 -6.490 2.661 -2.487 1.00 0.41 H new ATOM 0 HB2 MET A 72 -6.229 3.069 0.506 1.00 0.39 H new ATOM 0 HB3 MET A 72 -6.372 4.338 -0.694 1.00 0.39 H new ATOM 0 HG2 MET A 72 -8.589 2.952 -1.329 1.00 0.41 H new ATOM 0 HG3 MET A 72 -8.452 2.457 0.346 1.00 0.41 H new ATOM 0 HE1 MET A 72 -8.499 6.828 -1.028 1.00 0.58 H new ATOM 0 HE2 MET A 72 -7.829 5.415 -1.877 1.00 0.58 H new ATOM 0 HE3 MET A 72 -9.578 5.738 -1.931 1.00 0.58 H new ATOM 1080 N ALA A 73 -3.883 1.727 -0.742 1.00 0.46 N ATOM 1081 CA ALA A 73 -2.432 1.760 -0.687 1.00 0.53 C ATOM 1082 C ALA A 73 -1.829 1.193 -1.967 1.00 0.59 C ATOM 1083 O ALA A 73 -0.903 1.770 -2.535 1.00 0.70 O ATOM 1084 CB ALA A 73 -1.930 0.989 0.525 1.00 0.54 C ATOM 0 H ALA A 73 -4.315 1.049 -0.115 1.00 0.46 H new ATOM 0 HA ALA A 73 -2.117 2.799 -0.594 1.00 0.53 H new ATOM 0 HB1 ALA A 73 -0.841 1.023 0.552 1.00 0.54 H new ATOM 0 HB2 ALA A 73 -2.330 1.439 1.434 1.00 0.54 H new ATOM 0 HB3 ALA A 73 -2.259 -0.048 0.458 1.00 0.54 H new ATOM 1090 N LYS A 74 -2.370 0.067 -2.428 1.00 0.55 N ATOM 1091 CA LYS A 74 -1.868 -0.578 -3.638 1.00 0.62 C ATOM 1092 C LYS A 74 -2.111 0.285 -4.878 1.00 0.63 C ATOM 1093 O LYS A 74 -1.309 0.274 -5.812 1.00 0.70 O ATOM 1094 CB LYS A 74 -2.503 -1.968 -3.822 1.00 0.63 C ATOM 1095 CG LYS A 74 -3.901 -1.952 -4.426 1.00 0.65 C ATOM 1096 CD LYS A 74 -4.340 -3.343 -4.860 1.00 0.74 C ATOM 1097 CE LYS A 74 -5.067 -4.080 -3.745 1.00 0.73 C ATOM 1098 NZ LYS A 74 -4.254 -4.156 -2.500 1.00 1.38 N ATOM 0 H LYS A 74 -3.152 -0.415 -1.984 1.00 0.55 H new ATOM 0 HA LYS A 74 -0.791 -0.699 -3.519 1.00 0.62 H new ATOM 0 HB2 LYS A 74 -1.853 -2.568 -4.459 1.00 0.63 H new ATOM 0 HB3 LYS A 74 -2.546 -2.464 -2.853 1.00 0.63 H new ATOM 0 HG2 LYS A 74 -4.609 -1.558 -3.697 1.00 0.65 H new ATOM 0 HG3 LYS A 74 -3.920 -1.280 -5.284 1.00 0.65 H new ATOM 0 HD2 LYS A 74 -4.993 -3.263 -5.729 1.00 0.74 H new ATOM 0 HD3 LYS A 74 -3.468 -3.920 -5.168 1.00 0.74 H new ATOM 0 HE2 LYS A 74 -6.009 -3.575 -3.532 1.00 0.73 H new ATOM 0 HE3 LYS A 74 -5.314 -5.088 -4.078 1.00 0.73 H new ATOM 0 HZ1 LYS A 74 -4.718 -4.792 -1.821 1.00 1.38 H new ATOM 0 HZ2 LYS A 74 -3.307 -4.521 -2.726 1.00 1.38 H new ATOM 0 HZ3 LYS A 74 -4.169 -3.207 -2.083 1.00 1.38 H new ATOM 1112 N GLN A 75 -3.215 1.032 -4.887 1.00 0.59 N ATOM 1113 CA GLN A 75 -3.547 1.875 -6.029 1.00 0.63 C ATOM 1114 C GLN A 75 -2.815 3.207 -5.959 1.00 0.67 C ATOM 1115 O GLN A 75 -2.102 3.591 -6.882 1.00 0.79 O ATOM 1116 CB GLN A 75 -5.052 2.112 -6.101 1.00 0.63 C ATOM 1117 CG GLN A 75 -5.467 3.051 -7.224 1.00 1.04 C ATOM 1118 CD GLN A 75 -6.956 3.331 -7.237 1.00 1.23 C ATOM 1119 OE1 GLN A 75 -7.573 3.327 -6.062 1.00 1.98 O flip ATOM 1120 NE2 GLN A 75 -7.547 3.556 -8.295 1.00 1.54 N flip ATOM 0 H GLN A 75 -3.888 1.069 -4.122 1.00 0.59 H new ATOM 0 HA GLN A 75 -3.227 1.353 -6.931 1.00 0.63 H new ATOM 0 HB2 GLN A 75 -5.556 1.155 -6.234 1.00 0.63 H new ATOM 0 HB3 GLN A 75 -5.393 2.523 -5.151 1.00 0.63 H new ATOM 0 HG2 GLN A 75 -4.926 3.992 -7.123 1.00 1.04 H new ATOM 0 HG3 GLN A 75 -5.175 2.617 -8.180 1.00 1.04 H new ATOM 0 HE21 GLN A 75 -7.034 3.549 -9.177 1.00 1.54 H new ATOM 0 HE22 GLN A 75 -8.549 3.749 -8.289 1.00 1.54 H new ATOM 1129 N MET A 76 -3.006 3.896 -4.843 1.00 0.65 N ATOM 1130 CA MET A 76 -2.406 5.201 -4.613 1.00 0.73 C ATOM 1131 C MET A 76 -0.877 5.170 -4.698 1.00 0.89 C ATOM 1132 O MET A 76 -0.243 6.202 -4.914 1.00 1.06 O ATOM 1133 CB MET A 76 -2.847 5.716 -3.248 1.00 0.76 C ATOM 1134 CG MET A 76 -4.308 6.137 -3.211 1.00 0.80 C ATOM 1135 SD MET A 76 -4.951 6.294 -1.534 1.00 1.20 S ATOM 1136 CE MET A 76 -4.077 7.749 -0.970 1.00 0.75 C ATOM 0 H MET A 76 -3.583 3.564 -4.070 1.00 0.65 H new ATOM 0 HA MET A 76 -2.749 5.871 -5.402 1.00 0.73 H new ATOM 0 HB2 MET A 76 -2.680 4.939 -2.502 1.00 0.76 H new ATOM 0 HB3 MET A 76 -2.223 6.565 -2.968 1.00 0.76 H new ATOM 0 HG2 MET A 76 -4.419 7.090 -3.728 1.00 0.80 H new ATOM 0 HG3 MET A 76 -4.905 5.407 -3.757 1.00 0.80 H new ATOM 0 HE1 MET A 76 -4.540 8.120 -0.056 1.00 0.75 H new ATOM 0 HE2 MET A 76 -3.036 7.494 -0.772 1.00 0.75 H new ATOM 0 HE3 MET A 76 -4.121 8.521 -1.738 1.00 0.75 H new ATOM 1146 N ARG A 77 -0.289 3.988 -4.531 1.00 0.96 N ATOM 1147 CA ARG A 77 1.166 3.843 -4.583 1.00 1.19 C ATOM 1148 C ARG A 77 1.738 4.202 -5.955 1.00 1.32 C ATOM 1149 O ARG A 77 2.948 4.369 -6.095 1.00 1.53 O ATOM 1150 CB ARG A 77 1.579 2.420 -4.207 1.00 1.43 C ATOM 1151 CG ARG A 77 1.994 2.270 -2.751 1.00 1.88 C ATOM 1152 CD ARG A 77 2.410 0.843 -2.434 1.00 2.24 C ATOM 1153 NE ARG A 77 2.738 0.668 -1.021 1.00 3.04 N ATOM 1154 CZ ARG A 77 3.028 -0.508 -0.471 1.00 3.73 C ATOM 1155 NH1 ARG A 77 3.027 -1.610 -1.211 1.00 3.83 N ATOM 1156 NH2 ARG A 77 3.320 -0.584 0.820 1.00 4.69 N ATOM 0 H ARG A 77 -0.794 3.119 -4.359 1.00 0.96 H new ATOM 0 HA ARG A 77 1.578 4.545 -3.859 1.00 1.19 H new ATOM 0 HB2 ARG A 77 0.749 1.744 -4.411 1.00 1.43 H new ATOM 0 HB3 ARG A 77 2.406 2.110 -4.846 1.00 1.43 H new ATOM 0 HG2 ARG A 77 2.820 2.947 -2.536 1.00 1.88 H new ATOM 0 HG3 ARG A 77 1.166 2.561 -2.104 1.00 1.88 H new ATOM 0 HD2 ARG A 77 1.604 0.162 -2.706 1.00 2.24 H new ATOM 0 HD3 ARG A 77 3.273 0.574 -3.042 1.00 2.24 H new ATOM 0 HE ARG A 77 2.745 1.494 -0.423 1.00 3.04 H new ATOM 0 HH11 ARG A 77 2.803 -1.557 -2.205 1.00 3.83 H new ATOM 0 HH12 ARG A 77 3.250 -2.510 -0.786 1.00 3.83 H new ATOM 0 HH21 ARG A 77 3.322 0.260 1.393 1.00 4.69 H new ATOM 0 HH22 ARG A 77 3.542 -1.486 1.240 1.00 4.69 H new ATOM 1170 N GLU A 78 0.874 4.308 -6.963 1.00 1.44 N ATOM 1171 CA GLU A 78 1.317 4.641 -8.320 1.00 1.86 C ATOM 1172 C GLU A 78 1.942 6.038 -8.381 1.00 2.54 C ATOM 1173 O GLU A 78 1.318 6.994 -8.841 1.00 3.23 O ATOM 1174 CB GLU A 78 0.145 4.539 -9.305 1.00 2.05 C ATOM 1175 CG GLU A 78 -1.034 5.440 -8.968 1.00 2.65 C ATOM 1176 CD GLU A 78 -2.229 5.197 -9.869 1.00 3.46 C ATOM 1177 OE1 GLU A 78 -2.313 5.847 -10.932 1.00 4.01 O ATOM 1178 OE2 GLU A 78 -3.081 4.357 -9.511 1.00 3.90 O ATOM 0 H GLU A 78 -0.132 4.169 -6.869 1.00 1.44 H new ATOM 0 HA GLU A 78 2.084 3.920 -8.604 1.00 1.86 H new ATOM 0 HB2 GLU A 78 0.503 4.786 -10.305 1.00 2.05 H new ATOM 0 HB3 GLU A 78 -0.200 3.505 -9.336 1.00 2.05 H new ATOM 0 HG2 GLU A 78 -1.326 5.277 -7.931 1.00 2.65 H new ATOM 0 HG3 GLU A 78 -0.726 6.482 -9.052 1.00 2.65 H new ATOM 1185 N THR A 79 3.190 6.144 -7.931 1.00 2.81 N ATOM 1186 CA THR A 79 3.900 7.418 -7.927 1.00 3.72 C ATOM 1187 C THR A 79 5.392 7.210 -7.685 1.00 3.90 C ATOM 1188 O THR A 79 6.231 7.772 -8.390 1.00 4.36 O ATOM 1189 CB THR A 79 3.350 8.368 -6.842 1.00 4.37 C ATOM 1190 OG1 THR A 79 1.974 8.668 -7.096 1.00 4.67 O ATOM 1191 CG2 THR A 79 4.150 9.663 -6.791 1.00 5.28 C ATOM 0 H THR A 79 3.730 5.361 -7.564 1.00 2.81 H new ATOM 0 HA THR A 79 3.746 7.868 -8.908 1.00 3.72 H new ATOM 0 HB THR A 79 3.441 7.863 -5.880 1.00 4.37 H new ATOM 0 HG1 THR A 79 1.723 8.328 -7.980 1.00 4.67 H new ATOM 0 HG21 THR A 79 3.741 10.313 -6.018 1.00 5.28 H new ATOM 0 HG22 THR A 79 5.192 9.438 -6.562 1.00 5.28 H new ATOM 0 HG23 THR A 79 4.091 10.165 -7.757 1.00 5.28 H new ATOM 1199 N ASP A 80 5.713 6.398 -6.681 1.00 3.93 N ATOM 1200 CA ASP A 80 7.102 6.121 -6.333 1.00 4.35 C ATOM 1201 C ASP A 80 7.424 4.634 -6.480 1.00 4.98 C ATOM 1202 O ASP A 80 8.558 4.222 -6.244 1.00 5.60 O ATOM 1203 CB ASP A 80 7.382 6.571 -4.899 1.00 4.57 C ATOM 1204 CG ASP A 80 6.517 5.845 -3.887 1.00 4.84 C ATOM 1205 OD1 ASP A 80 6.908 4.740 -3.455 1.00 5.42 O ATOM 1206 OD2 ASP A 80 5.448 6.380 -3.527 1.00 4.80 O ATOM 0 H ASP A 80 5.029 5.920 -6.094 1.00 3.93 H new ATOM 0 HA ASP A 80 7.739 6.678 -7.021 1.00 4.35 H new ATOM 0 HB2 ASP A 80 8.433 6.399 -4.665 1.00 4.57 H new ATOM 0 HB3 ASP A 80 7.209 7.644 -4.817 1.00 4.57 H new ATOM 1211 N THR A 81 6.421 3.843 -6.876 1.00 5.18 N ATOM 1212 CA THR A 81 6.586 2.395 -7.060 1.00 6.15 C ATOM 1213 C THR A 81 7.596 1.812 -6.070 1.00 6.80 C ATOM 1214 O THR A 81 8.627 1.264 -6.463 1.00 7.13 O ATOM 1215 CB THR A 81 7.013 2.049 -8.505 1.00 6.60 C ATOM 1216 OG1 THR A 81 7.244 0.641 -8.624 1.00 7.29 O ATOM 1217 CG2 THR A 81 8.268 2.809 -8.912 1.00 6.89 C ATOM 0 H THR A 81 5.480 4.183 -7.077 1.00 5.18 H new ATOM 0 HA THR A 81 5.612 1.945 -6.868 1.00 6.15 H new ATOM 0 HB THR A 81 6.204 2.346 -9.172 1.00 6.60 H new ATOM 0 HG1 THR A 81 8.030 0.392 -8.094 1.00 7.29 H new ATOM 0 HG21 THR A 81 8.540 2.542 -9.933 1.00 6.89 H new ATOM 0 HG22 THR A 81 8.079 3.881 -8.855 1.00 6.89 H new ATOM 0 HG23 THR A 81 9.085 2.549 -8.239 1.00 6.89 H new ATOM 1225 N GLU A 82 7.274 1.932 -4.783 1.00 7.25 N ATOM 1226 CA GLU A 82 8.133 1.450 -3.700 1.00 8.05 C ATOM 1227 C GLU A 82 8.760 0.089 -4.004 1.00 8.92 C ATOM 1228 O GLU A 82 9.937 -0.134 -3.722 1.00 9.53 O ATOM 1229 CB GLU A 82 7.331 1.371 -2.400 1.00 8.64 C ATOM 1230 CG GLU A 82 8.137 0.871 -1.212 1.00 8.69 C ATOM 1231 CD GLU A 82 7.318 0.810 0.062 1.00 9.34 C ATOM 1232 OE1 GLU A 82 6.698 -0.243 0.320 1.00 9.63 O ATOM 1233 OE2 GLU A 82 7.298 1.816 0.804 1.00 9.74 O ATOM 0 H GLU A 82 6.409 2.366 -4.460 1.00 7.25 H new ATOM 0 HA GLU A 82 8.950 2.164 -3.597 1.00 8.05 H new ATOM 0 HB2 GLU A 82 6.934 2.359 -2.168 1.00 8.64 H new ATOM 0 HB3 GLU A 82 6.476 0.712 -2.551 1.00 8.64 H new ATOM 0 HG2 GLU A 82 8.530 -0.121 -1.435 1.00 8.69 H new ATOM 0 HG3 GLU A 82 8.995 1.526 -1.058 1.00 8.69 H new ATOM 1240 N GLU A 83 7.974 -0.818 -4.573 1.00 9.15 N ATOM 1241 CA GLU A 83 8.457 -2.160 -4.894 1.00 10.17 C ATOM 1242 C GLU A 83 9.703 -2.120 -5.781 1.00 10.27 C ATOM 1243 O GLU A 83 10.729 -2.722 -5.454 1.00 11.05 O ATOM 1244 CB GLU A 83 7.355 -2.967 -5.584 1.00 10.55 C ATOM 1245 CG GLU A 83 6.132 -3.198 -4.711 1.00 10.83 C ATOM 1246 CD GLU A 83 5.094 -4.077 -5.382 1.00 11.60 C ATOM 1247 OE1 GLU A 83 5.244 -5.315 -5.332 1.00 12.11 O ATOM 1248 OE2 GLU A 83 4.133 -3.526 -5.960 1.00 11.85 O ATOM 0 H GLU A 83 6.999 -0.650 -4.822 1.00 9.15 H new ATOM 0 HA GLU A 83 8.730 -2.642 -3.955 1.00 10.17 H new ATOM 0 HB2 GLU A 83 7.050 -2.447 -6.492 1.00 10.55 H new ATOM 0 HB3 GLU A 83 7.760 -3.932 -5.890 1.00 10.55 H new ATOM 0 HG2 GLU A 83 6.442 -3.659 -3.773 1.00 10.83 H new ATOM 0 HG3 GLU A 83 5.682 -2.237 -4.461 1.00 10.83 H new ATOM 1255 N GLU A 84 9.609 -1.408 -6.898 1.00 9.63 N ATOM 1256 CA GLU A 84 10.722 -1.301 -7.839 1.00 9.95 C ATOM 1257 C GLU A 84 11.921 -0.587 -7.213 1.00 9.87 C ATOM 1258 O GLU A 84 13.042 -0.676 -7.718 1.00 10.51 O ATOM 1259 CB GLU A 84 10.269 -0.557 -9.099 1.00 9.47 C ATOM 1260 CG GLU A 84 11.338 -0.470 -10.177 1.00 9.88 C ATOM 1261 CD GLU A 84 10.840 0.212 -11.437 1.00 10.40 C ATOM 1262 OE1 GLU A 84 10.320 -0.493 -12.327 1.00 10.49 O ATOM 1263 OE2 GLU A 84 10.969 1.451 -11.533 1.00 10.87 O ATOM 0 H GLU A 84 8.773 -0.895 -7.176 1.00 9.63 H new ATOM 0 HA GLU A 84 11.036 -2.311 -8.104 1.00 9.95 H new ATOM 0 HB2 GLU A 84 9.392 -1.057 -9.510 1.00 9.47 H new ATOM 0 HB3 GLU A 84 9.961 0.452 -8.823 1.00 9.47 H new ATOM 0 HG2 GLU A 84 12.198 0.076 -9.788 1.00 9.88 H new ATOM 0 HG3 GLU A 84 11.683 -1.474 -10.424 1.00 9.88 H new ATOM 1270 N MET A 85 11.691 0.093 -6.095 1.00 9.31 N ATOM 1271 CA MET A 85 12.757 0.831 -5.429 1.00 9.45 C ATOM 1272 C MET A 85 13.582 -0.124 -4.598 1.00 10.49 C ATOM 1273 O MET A 85 14.801 0.003 -4.485 1.00 11.09 O ATOM 1274 CB MET A 85 12.178 1.929 -4.538 1.00 8.75 C ATOM 1275 CG MET A 85 10.986 2.642 -5.148 1.00 7.71 C ATOM 1276 SD MET A 85 11.364 3.416 -6.730 1.00 7.19 S ATOM 1277 CE MET A 85 11.597 5.113 -6.214 1.00 6.73 C ATOM 0 H MET A 85 10.783 0.148 -5.634 1.00 9.31 H new ATOM 0 HA MET A 85 13.387 1.300 -6.184 1.00 9.45 H new ATOM 0 HB2 MET A 85 11.880 1.492 -3.585 1.00 8.75 H new ATOM 0 HB3 MET A 85 12.958 2.660 -4.324 1.00 8.75 H new ATOM 0 HG2 MET A 85 10.173 1.929 -5.284 1.00 7.71 H new ATOM 0 HG3 MET A 85 10.630 3.403 -4.453 1.00 7.71 H new ATOM 0 HE1 MET A 85 11.908 5.714 -7.069 1.00 6.73 H new ATOM 0 HE2 MET A 85 10.660 5.504 -5.817 1.00 6.73 H new ATOM 0 HE3 MET A 85 12.365 5.156 -5.441 1.00 6.73 H new ATOM 1287 N ARG A 86 12.884 -1.081 -4.021 1.00 10.82 N ATOM 1288 CA ARG A 86 13.493 -2.100 -3.197 1.00 11.88 C ATOM 1289 C ARG A 86 14.437 -2.962 -4.030 1.00 12.66 C ATOM 1290 O ARG A 86 15.604 -3.139 -3.677 1.00 13.43 O ATOM 1291 CB ARG A 86 12.384 -2.937 -2.567 1.00 12.21 C ATOM 1292 CG ARG A 86 12.806 -4.320 -2.135 1.00 13.16 C ATOM 1293 CD ARG A 86 13.658 -4.283 -0.877 1.00 13.63 C ATOM 1294 NE ARG A 86 14.148 -5.609 -0.509 1.00 14.25 N ATOM 1295 CZ ARG A 86 14.311 -6.015 0.747 1.00 14.86 C ATOM 1296 NH1 ARG A 86 14.020 -5.200 1.753 1.00 14.96 N ATOM 1297 NH2 ARG A 86 14.766 -7.235 0.997 1.00 15.52 N ATOM 0 H ARG A 86 11.872 -1.172 -4.112 1.00 10.82 H new ATOM 0 HA ARG A 86 14.088 -1.641 -2.407 1.00 11.88 H new ATOM 0 HB2 ARG A 86 11.993 -2.404 -1.700 1.00 12.21 H new ATOM 0 HB3 ARG A 86 11.566 -3.028 -3.281 1.00 12.21 H new ATOM 0 HG2 ARG A 86 11.921 -4.931 -1.957 1.00 13.16 H new ATOM 0 HG3 ARG A 86 13.366 -4.797 -2.939 1.00 13.16 H new ATOM 0 HD2 ARG A 86 14.504 -3.614 -1.032 1.00 13.63 H new ATOM 0 HD3 ARG A 86 13.073 -3.872 -0.055 1.00 13.63 H new ATOM 0 HE ARG A 86 14.378 -6.261 -1.259 1.00 14.25 H new ATOM 0 HH11 ARG A 86 13.671 -4.261 1.564 1.00 14.96 H new ATOM 0 HH12 ARG A 86 14.146 -5.513 2.716 1.00 14.96 H new ATOM 0 HH21 ARG A 86 14.991 -7.863 0.226 1.00 15.52 H new ATOM 0 HH22 ARG A 86 14.891 -7.545 1.961 1.00 15.52 H new ATOM 1311 N GLU A 87 13.927 -3.493 -5.140 1.00 12.58 N ATOM 1312 CA GLU A 87 14.741 -4.315 -6.024 1.00 13.44 C ATOM 1313 C GLU A 87 15.942 -3.514 -6.511 1.00 13.54 C ATOM 1314 O GLU A 87 17.037 -4.054 -6.680 1.00 14.45 O ATOM 1315 CB GLU A 87 13.916 -4.816 -7.213 1.00 13.42 C ATOM 1316 CG GLU A 87 13.266 -3.705 -8.018 1.00 14.12 C ATOM 1317 CD GLU A 87 12.418 -4.231 -9.160 1.00 14.57 C ATOM 1318 OE1 GLU A 87 11.234 -4.548 -8.923 1.00 14.85 O ATOM 1319 OE2 GLU A 87 12.938 -4.324 -10.291 1.00 14.77 O ATOM 0 H GLU A 87 12.961 -3.368 -5.444 1.00 12.58 H new ATOM 0 HA GLU A 87 15.093 -5.184 -5.468 1.00 13.44 H new ATOM 0 HB2 GLU A 87 14.560 -5.399 -7.871 1.00 13.42 H new ATOM 0 HB3 GLU A 87 13.140 -5.489 -6.848 1.00 13.42 H new ATOM 0 HG2 GLU A 87 12.645 -3.099 -7.358 1.00 14.12 H new ATOM 0 HG3 GLU A 87 14.040 -3.050 -8.417 1.00 14.12 H new ATOM 1326 N ALA A 88 15.728 -2.219 -6.739 1.00 12.70 N ATOM 1327 CA ALA A 88 16.799 -1.337 -7.180 1.00 12.92 C ATOM 1328 C ALA A 88 17.836 -1.157 -6.074 1.00 13.38 C ATOM 1329 O ALA A 88 19.034 -1.066 -6.341 1.00 14.11 O ATOM 1330 CB ALA A 88 16.235 0.012 -7.603 1.00 12.02 C ATOM 0 H ALA A 88 14.824 -1.761 -6.625 1.00 12.70 H new ATOM 0 HA ALA A 88 17.289 -1.794 -8.040 1.00 12.92 H new ATOM 0 HB1 ALA A 88 17.048 0.660 -7.930 1.00 12.02 H new ATOM 0 HB2 ALA A 88 15.531 -0.129 -8.423 1.00 12.02 H new ATOM 0 HB3 ALA A 88 15.721 0.472 -6.759 1.00 12.02 H new ATOM 1336 N PHE A 89 17.361 -1.107 -4.830 1.00 13.10 N ATOM 1337 CA PHE A 89 18.243 -0.944 -3.675 1.00 13.68 C ATOM 1338 C PHE A 89 19.027 -2.224 -3.419 1.00 14.81 C ATOM 1339 O PHE A 89 20.037 -2.223 -2.717 1.00 15.53 O ATOM 1340 CB PHE A 89 17.426 -0.572 -2.434 1.00 13.32 C ATOM 1341 CG PHE A 89 18.249 -0.442 -1.183 1.00 14.09 C ATOM 1342 CD1 PHE A 89 19.018 0.689 -0.958 1.00 14.41 C ATOM 1343 CD2 PHE A 89 18.252 -1.450 -0.233 1.00 14.63 C ATOM 1344 CE1 PHE A 89 19.776 0.811 0.190 1.00 15.22 C ATOM 1345 CE2 PHE A 89 19.009 -1.333 0.918 1.00 15.44 C ATOM 1346 CZ PHE A 89 19.772 -0.201 1.129 1.00 15.73 C ATOM 0 H PHE A 89 16.371 -1.177 -4.596 1.00 13.10 H new ATOM 0 HA PHE A 89 18.948 -0.140 -3.889 1.00 13.68 H new ATOM 0 HB2 PHE A 89 16.911 0.371 -2.619 1.00 13.32 H new ATOM 0 HB3 PHE A 89 16.658 -1.329 -2.276 1.00 13.32 H new ATOM 0 HD1 PHE A 89 19.025 1.484 -1.689 1.00 14.41 H new ATOM 0 HD2 PHE A 89 17.657 -2.337 -0.393 1.00 14.63 H new ATOM 0 HE1 PHE A 89 20.371 1.697 0.353 1.00 15.22 H new ATOM 0 HE2 PHE A 89 19.004 -2.126 1.651 1.00 15.44 H new ATOM 0 HZ PHE A 89 20.364 -0.108 2.027 1.00 15.73 H new ATOM 1356 N LYS A 90 18.553 -3.312 -4.007 1.00 15.06 N ATOM 1357 CA LYS A 90 19.175 -4.607 -3.859 1.00 16.18 C ATOM 1358 C LYS A 90 20.392 -4.728 -4.772 1.00 16.76 C ATOM 1359 O LYS A 90 21.472 -5.132 -4.338 1.00 17.66 O ATOM 1360 CB LYS A 90 18.140 -5.668 -4.190 1.00 16.38 C ATOM 1361 CG LYS A 90 18.708 -6.815 -4.967 1.00 16.21 C ATOM 1362 CD LYS A 90 17.685 -7.916 -5.166 1.00 16.55 C ATOM 1363 CE LYS A 90 18.098 -8.864 -6.280 1.00 16.86 C ATOM 1364 NZ LYS A 90 17.134 -9.987 -6.443 1.00 17.18 N ATOM 0 H LYS A 90 17.724 -3.315 -4.601 1.00 15.06 H new ATOM 0 HA LYS A 90 19.526 -4.739 -2.835 1.00 16.18 H new ATOM 0 HB2 LYS A 90 17.704 -6.044 -3.264 1.00 16.38 H new ATOM 0 HB3 LYS A 90 17.331 -5.213 -4.762 1.00 16.38 H new ATOM 0 HG2 LYS A 90 19.056 -6.461 -5.938 1.00 16.21 H new ATOM 0 HG3 LYS A 90 19.577 -7.215 -4.444 1.00 16.21 H new ATOM 0 HD2 LYS A 90 17.564 -8.474 -4.238 1.00 16.55 H new ATOM 0 HD3 LYS A 90 16.716 -7.476 -5.402 1.00 16.55 H new ATOM 0 HE2 LYS A 90 18.173 -8.312 -7.217 1.00 16.86 H new ATOM 0 HE3 LYS A 90 19.089 -9.265 -6.066 1.00 16.86 H new ATOM 0 HZ1 LYS A 90 17.453 -10.609 -7.213 1.00 17.18 H new ATOM 0 HZ2 LYS A 90 17.081 -10.530 -5.558 1.00 17.18 H new ATOM 0 HZ3 LYS A 90 16.194 -9.607 -6.673 1.00 17.18 H new ATOM 1378 N ILE A 91 20.203 -4.374 -6.036 1.00 16.32 N ATOM 1379 CA ILE A 91 21.276 -4.444 -7.023 1.00 16.96 C ATOM 1380 C ILE A 91 22.325 -3.359 -6.788 1.00 17.21 C ATOM 1381 O ILE A 91 23.525 -3.626 -6.842 1.00 18.15 O ATOM 1382 CB ILE A 91 20.730 -4.313 -8.458 1.00 16.50 C ATOM 1383 CG1 ILE A 91 19.658 -5.373 -8.718 1.00 16.43 C ATOM 1384 CG2 ILE A 91 21.864 -4.436 -9.469 1.00 17.34 C ATOM 1385 CD1 ILE A 91 18.905 -5.167 -10.015 1.00 16.26 C ATOM 0 H ILE A 91 19.315 -4.034 -6.404 1.00 16.32 H new ATOM 0 HA ILE A 91 21.743 -5.422 -6.906 1.00 16.96 H new ATOM 0 HB ILE A 91 20.274 -3.329 -8.570 1.00 16.50 H new ATOM 0 HG12 ILE A 91 20.127 -6.357 -8.732 1.00 16.43 H new ATOM 0 HG13 ILE A 91 18.948 -5.370 -7.891 1.00 16.43 H new ATOM 0 HG21 ILE A 91 21.463 -4.342 -10.478 1.00 17.34 H new ATOM 0 HG22 ILE A 91 22.595 -3.647 -9.293 1.00 17.34 H new ATOM 0 HG23 ILE A 91 22.346 -5.408 -9.359 1.00 17.34 H new ATOM 0 HD11 ILE A 91 18.161 -5.955 -10.133 1.00 16.26 H new ATOM 0 HD12 ILE A 91 18.407 -4.198 -9.996 1.00 16.26 H new ATOM 0 HD13 ILE A 91 19.604 -5.199 -10.851 1.00 16.26 H new ATOM 1397 N PHE A 92 21.865 -2.137 -6.532 1.00 16.44 N ATOM 1398 CA PHE A 92 22.772 -1.017 -6.298 1.00 16.75 C ATOM 1399 C PHE A 92 23.655 -1.264 -5.079 1.00 17.52 C ATOM 1400 O PHE A 92 24.861 -1.015 -5.116 1.00 18.34 O ATOM 1401 CB PHE A 92 21.987 0.285 -6.126 1.00 15.83 C ATOM 1402 CG PHE A 92 21.919 1.114 -7.380 1.00 15.63 C ATOM 1403 CD1 PHE A 92 23.065 1.680 -7.914 1.00 15.41 C ATOM 1404 CD2 PHE A 92 20.711 1.326 -8.025 1.00 15.79 C ATOM 1405 CE1 PHE A 92 23.010 2.441 -9.066 1.00 15.39 C ATOM 1406 CE2 PHE A 92 20.648 2.087 -9.177 1.00 15.74 C ATOM 1407 CZ PHE A 92 21.800 2.645 -9.699 1.00 15.56 C ATOM 0 H PHE A 92 20.875 -1.898 -6.481 1.00 16.44 H new ATOM 0 HA PHE A 92 23.418 -0.926 -7.171 1.00 16.75 H new ATOM 0 HB2 PHE A 92 20.974 0.049 -5.800 1.00 15.83 H new ATOM 0 HB3 PHE A 92 22.447 0.876 -5.334 1.00 15.83 H new ATOM 0 HD1 PHE A 92 24.014 1.524 -7.423 1.00 15.41 H new ATOM 0 HD2 PHE A 92 19.808 0.891 -7.623 1.00 15.79 H new ATOM 0 HE1 PHE A 92 23.912 2.876 -9.471 1.00 15.39 H new ATOM 0 HE2 PHE A 92 19.700 2.246 -9.669 1.00 15.74 H new ATOM 0 HZ PHE A 92 21.754 3.239 -10.600 1.00 15.56 H new ATOM 1417 N ASP A 93 23.051 -1.755 -4.002 1.00 17.35 N ATOM 1418 CA ASP A 93 23.793 -2.037 -2.778 1.00 18.13 C ATOM 1419 C ASP A 93 24.673 -3.269 -2.963 1.00 19.15 C ATOM 1420 O ASP A 93 24.184 -4.399 -2.972 1.00 19.29 O ATOM 1421 CB ASP A 93 22.830 -2.249 -1.609 1.00 17.78 C ATOM 1422 CG ASP A 93 23.537 -2.240 -0.264 1.00 18.61 C ATOM 1423 OD1 ASP A 93 24.721 -1.843 -0.222 1.00 18.94 O ATOM 1424 OD2 ASP A 93 22.909 -2.630 0.745 1.00 18.99 O ATOM 0 H ASP A 93 22.054 -1.965 -3.951 1.00 17.35 H new ATOM 0 HA ASP A 93 24.431 -1.182 -2.555 1.00 18.13 H new ATOM 0 HB2 ASP A 93 22.070 -1.467 -1.622 1.00 17.78 H new ATOM 0 HB3 ASP A 93 22.312 -3.199 -1.737 1.00 17.78 H new ATOM 1429 N ARG A 94 25.975 -3.039 -3.111 1.00 19.94 N ATOM 1430 CA ARG A 94 26.930 -4.125 -3.306 1.00 20.98 C ATOM 1431 C ARG A 94 26.899 -5.094 -2.132 1.00 21.56 C ATOM 1432 O ARG A 94 26.731 -6.299 -2.312 1.00 22.25 O ATOM 1433 CB ARG A 94 28.350 -3.574 -3.475 1.00 21.74 C ATOM 1434 CG ARG A 94 28.436 -2.307 -4.316 1.00 21.43 C ATOM 1435 CD ARG A 94 27.813 -2.489 -5.691 1.00 21.19 C ATOM 1436 NE ARG A 94 28.364 -3.643 -6.395 1.00 21.42 N ATOM 1437 CZ ARG A 94 27.711 -4.308 -7.344 1.00 21.61 C ATOM 1438 NH1 ARG A 94 26.487 -3.939 -7.696 1.00 21.58 N ATOM 1439 NH2 ARG A 94 28.283 -5.345 -7.941 1.00 21.94 N ATOM 0 H ARG A 94 26.393 -2.109 -3.099 1.00 19.94 H new ATOM 0 HA ARG A 94 26.643 -4.658 -4.212 1.00 20.98 H new ATOM 0 HB2 ARG A 94 28.768 -3.370 -2.489 1.00 21.74 H new ATOM 0 HB3 ARG A 94 28.973 -4.342 -3.933 1.00 21.74 H new ATOM 0 HG2 ARG A 94 27.933 -1.492 -3.796 1.00 21.43 H new ATOM 0 HG3 ARG A 94 29.481 -2.017 -4.427 1.00 21.43 H new ATOM 0 HD2 ARG A 94 26.735 -2.609 -5.587 1.00 21.19 H new ATOM 0 HD3 ARG A 94 27.978 -1.590 -6.285 1.00 21.19 H new ATOM 0 HE ARG A 94 29.302 -3.957 -6.145 1.00 21.42 H new ATOM 0 HH11 ARG A 94 26.043 -3.143 -7.239 1.00 21.58 H new ATOM 0 HH12 ARG A 94 25.989 -4.451 -8.424 1.00 21.58 H new ATOM 0 HH21 ARG A 94 29.224 -5.633 -7.672 1.00 21.94 H new ATOM 0 HH22 ARG A 94 27.782 -5.855 -8.669 1.00 21.94 H new ATOM 1453 N ASP A 95 27.067 -4.558 -0.928 1.00 21.37 N ATOM 1454 CA ASP A 95 27.061 -5.375 0.277 1.00 21.99 C ATOM 1455 C ASP A 95 25.639 -5.573 0.787 1.00 21.37 C ATOM 1456 O ASP A 95 24.698 -4.943 0.302 1.00 20.39 O ATOM 1457 CB ASP A 95 27.912 -4.721 1.368 1.00 22.48 C ATOM 1458 CG ASP A 95 29.063 -3.917 0.800 1.00 22.92 C ATOM 1459 OD1 ASP A 95 30.019 -4.536 0.287 1.00 23.34 O ATOM 1460 OD2 ASP A 95 29.010 -2.670 0.869 1.00 22.92 O ATOM 0 H ASP A 95 27.209 -3.562 -0.762 1.00 21.37 H new ATOM 0 HA ASP A 95 27.484 -6.348 0.028 1.00 21.99 H new ATOM 0 HB2 ASP A 95 27.282 -4.070 1.974 1.00 22.48 H new ATOM 0 HB3 ASP A 95 28.304 -5.493 2.031 1.00 22.48 H new ATOM 1465 N GLY A 96 25.491 -6.455 1.769 1.00 22.00 N ATOM 1466 CA GLY A 96 24.184 -6.725 2.337 1.00 21.64 C ATOM 1467 C GLY A 96 23.945 -5.948 3.615 1.00 21.55 C ATOM 1468 O GLY A 96 22.931 -6.142 4.285 1.00 21.40 O ATOM 0 H GLY A 96 26.255 -6.989 2.183 1.00 22.00 H new ATOM 0 HA2 GLY A 96 23.414 -6.470 1.609 1.00 21.64 H new ATOM 0 HA3 GLY A 96 24.091 -7.792 2.539 1.00 21.64 H new ATOM 1472 N ASP A 97 24.888 -5.073 3.955 1.00 21.75 N ATOM 1473 CA ASP A 97 24.785 -4.263 5.164 1.00 21.82 C ATOM 1474 C ASP A 97 23.499 -3.441 5.167 1.00 20.80 C ATOM 1475 O ASP A 97 22.809 -3.356 6.183 1.00 20.85 O ATOM 1476 CB ASP A 97 26.002 -3.342 5.291 1.00 22.28 C ATOM 1477 CG ASP A 97 26.008 -2.235 4.253 1.00 21.72 C ATOM 1478 OD1 ASP A 97 26.286 -2.533 3.074 1.00 21.74 O ATOM 1479 OD2 ASP A 97 25.732 -1.073 4.619 1.00 21.34 O ATOM 0 H ASP A 97 25.733 -4.907 3.409 1.00 21.75 H new ATOM 0 HA ASP A 97 24.759 -4.936 6.021 1.00 21.82 H new ATOM 0 HB2 ASP A 97 26.016 -2.900 6.287 1.00 22.28 H new ATOM 0 HB3 ASP A 97 26.912 -3.933 5.191 1.00 22.28 H new ATOM 1484 N GLY A 98 23.182 -2.839 4.024 1.00 19.93 N ATOM 1485 CA GLY A 98 21.975 -2.038 3.914 1.00 18.92 C ATOM 1486 C GLY A 98 22.263 -0.567 3.675 1.00 18.54 C ATOM 1487 O GLY A 98 21.413 0.286 3.934 1.00 17.94 O ATOM 0 H GLY A 98 23.740 -2.892 3.172 1.00 19.93 H new ATOM 0 HA2 GLY A 98 21.364 -2.421 3.097 1.00 18.92 H new ATOM 0 HA3 GLY A 98 21.389 -2.145 4.827 1.00 18.92 H new ATOM 1491 N PHE A 99 23.461 -0.267 3.181 1.00 19.01 N ATOM 1492 CA PHE A 99 23.850 1.114 2.907 1.00 18.88 C ATOM 1493 C PHE A 99 24.742 1.198 1.671 1.00 18.97 C ATOM 1494 O PHE A 99 25.537 0.296 1.405 1.00 19.56 O ATOM 1495 CB PHE A 99 24.581 1.717 4.109 1.00 19.81 C ATOM 1496 CG PHE A 99 23.729 1.842 5.340 1.00 19.89 C ATOM 1497 CD1 PHE A 99 22.887 2.930 5.508 1.00 20.07 C ATOM 1498 CD2 PHE A 99 23.766 0.870 6.326 1.00 19.90 C ATOM 1499 CE1 PHE A 99 22.100 3.047 6.638 1.00 20.28 C ATOM 1500 CE2 PHE A 99 22.981 0.981 7.458 1.00 20.10 C ATOM 1501 CZ PHE A 99 22.154 2.076 7.618 1.00 20.30 C ATOM 0 H PHE A 99 24.178 -0.959 2.963 1.00 19.01 H new ATOM 0 HA PHE A 99 22.939 1.683 2.720 1.00 18.88 H new ATOM 0 HB2 PHE A 99 25.449 1.100 4.341 1.00 19.81 H new ATOM 0 HB3 PHE A 99 24.955 2.704 3.836 1.00 19.81 H new ATOM 0 HD1 PHE A 99 22.845 3.695 4.747 1.00 20.07 H new ATOM 0 HD2 PHE A 99 24.416 0.015 6.209 1.00 19.90 H new ATOM 0 HE1 PHE A 99 21.444 3.897 6.754 1.00 20.28 H new ATOM 0 HE2 PHE A 99 23.014 0.213 8.216 1.00 20.10 H new ATOM 0 HZ PHE A 99 21.551 2.172 8.508 1.00 20.30 H new ATOM 1511 N ILE A 100 24.601 2.288 0.916 1.00 18.48 N ATOM 1512 CA ILE A 100 25.403 2.492 -0.283 1.00 18.67 C ATOM 1513 C ILE A 100 26.329 3.693 -0.114 1.00 19.37 C ATOM 1514 O ILE A 100 25.894 4.774 0.287 1.00 19.21 O ATOM 1515 CB ILE A 100 24.517 2.709 -1.527 1.00 17.64 C ATOM 1516 CG1 ILE A 100 23.509 1.565 -1.665 1.00 16.97 C ATOM 1517 CG2 ILE A 100 25.378 2.820 -2.777 1.00 18.04 C ATOM 1518 CD1 ILE A 100 22.521 1.756 -2.797 1.00 15.92 C ATOM 0 H ILE A 100 23.940 3.039 1.115 1.00 18.48 H new ATOM 0 HA ILE A 100 25.997 1.589 -0.429 1.00 18.67 H new ATOM 0 HB ILE A 100 23.966 3.642 -1.407 1.00 17.64 H new ATOM 0 HG12 ILE A 100 24.051 0.632 -1.821 1.00 16.97 H new ATOM 0 HG13 ILE A 100 22.960 1.462 -0.729 1.00 16.97 H new ATOM 0 HG21 ILE A 100 24.739 2.973 -3.647 1.00 18.04 H new ATOM 0 HG22 ILE A 100 26.060 3.664 -2.675 1.00 18.04 H new ATOM 0 HG23 ILE A 100 25.952 1.903 -2.906 1.00 18.04 H new ATOM 0 HD11 ILE A 100 21.839 0.906 -2.832 1.00 15.92 H new ATOM 0 HD12 ILE A 100 21.952 2.671 -2.633 1.00 15.92 H new ATOM 0 HD13 ILE A 100 23.060 1.829 -3.742 1.00 15.92 H new ATOM 1530 N SER A 101 27.605 3.496 -0.423 1.00 20.25 N ATOM 1531 CA SER A 101 28.599 4.556 -0.301 1.00 21.07 C ATOM 1532 C SER A 101 29.144 4.944 -1.672 1.00 21.23 C ATOM 1533 O SER A 101 29.086 4.146 -2.603 1.00 20.98 O ATOM 1534 CB SER A 101 29.745 4.108 0.610 1.00 22.16 C ATOM 1535 OG SER A 101 29.280 3.837 1.921 1.00 22.49 O ATOM 0 H SER A 101 27.977 2.609 -0.761 1.00 20.25 H new ATOM 0 HA SER A 101 28.116 5.428 0.140 1.00 21.07 H new ATOM 0 HB2 SER A 101 30.215 3.216 0.196 1.00 22.16 H new ATOM 0 HB3 SER A 101 30.510 4.884 0.645 1.00 22.16 H new ATOM 0 HG SER A 101 30.031 3.551 2.482 1.00 22.49 H new ATOM 1541 N PRO A 102 29.669 6.177 -1.824 1.00 21.74 N ATOM 1542 CA PRO A 102 30.214 6.646 -3.101 1.00 22.05 C ATOM 1543 C PRO A 102 31.077 5.592 -3.790 1.00 22.55 C ATOM 1544 O PRO A 102 31.047 5.454 -5.013 1.00 22.43 O ATOM 1545 CB PRO A 102 31.058 7.852 -2.693 1.00 23.00 C ATOM 1546 CG PRO A 102 30.375 8.391 -1.483 1.00 22.78 C ATOM 1547 CD PRO A 102 29.781 7.203 -0.769 1.00 22.19 C ATOM 0 HA PRO A 102 29.431 6.878 -3.823 1.00 22.05 H new ATOM 0 HB2 PRO A 102 32.085 7.562 -2.473 1.00 23.00 H new ATOM 0 HB3 PRO A 102 31.100 8.595 -3.489 1.00 23.00 H new ATOM 0 HG2 PRO A 102 31.080 8.918 -0.841 1.00 22.78 H new ATOM 0 HG3 PRO A 102 29.600 9.106 -1.760 1.00 22.78 H new ATOM 0 HD2 PRO A 102 30.419 6.868 0.049 1.00 22.19 H new ATOM 0 HD3 PRO A 102 28.809 7.441 -0.338 1.00 22.19 H new ATOM 1555 N ALA A 103 31.838 4.843 -2.994 1.00 23.17 N ATOM 1556 CA ALA A 103 32.702 3.794 -3.526 1.00 23.77 C ATOM 1557 C ALA A 103 31.876 2.719 -4.223 1.00 23.02 C ATOM 1558 O ALA A 103 32.226 2.251 -5.307 1.00 23.22 O ATOM 1559 CB ALA A 103 33.531 3.178 -2.411 1.00 24.56 C ATOM 0 H ALA A 103 31.873 4.944 -1.980 1.00 23.17 H new ATOM 0 HA ALA A 103 33.374 4.241 -4.258 1.00 23.77 H new ATOM 0 HB1 ALA A 103 34.171 2.397 -2.822 1.00 24.56 H new ATOM 0 HB2 ALA A 103 34.149 3.948 -1.949 1.00 24.56 H new ATOM 0 HB3 ALA A 103 32.868 2.747 -1.661 1.00 24.56 H new ATOM 1565 N GLU A 104 30.776 2.338 -3.587 1.00 22.23 N ATOM 1566 CA GLU A 104 29.881 1.325 -4.124 1.00 21.53 C ATOM 1567 C GLU A 104 29.076 1.886 -5.287 1.00 20.75 C ATOM 1568 O GLU A 104 28.790 1.184 -6.255 1.00 20.59 O ATOM 1569 CB GLU A 104 28.930 0.833 -3.033 1.00 20.94 C ATOM 1570 CG GLU A 104 29.606 0.009 -1.951 1.00 21.74 C ATOM 1571 CD GLU A 104 28.617 -0.528 -0.933 1.00 21.28 C ATOM 1572 OE1 GLU A 104 27.883 -1.480 -1.267 1.00 20.84 O ATOM 1573 OE2 GLU A 104 28.576 0.006 0.196 1.00 21.43 O ATOM 0 H GLU A 104 30.481 2.721 -2.689 1.00 22.23 H new ATOM 0 HA GLU A 104 30.483 0.490 -4.482 1.00 21.53 H new ATOM 0 HB2 GLU A 104 28.447 1.694 -2.571 1.00 20.94 H new ATOM 0 HB3 GLU A 104 28.144 0.235 -3.493 1.00 20.94 H new ATOM 0 HG2 GLU A 104 30.139 -0.823 -2.411 1.00 21.74 H new ATOM 0 HG3 GLU A 104 30.350 0.622 -1.443 1.00 21.74 H new ATOM 1580 N LEU A 105 28.716 3.159 -5.175 1.00 20.36 N ATOM 1581 CA LEU A 105 27.937 3.834 -6.200 1.00 19.67 C ATOM 1582 C LEU A 105 28.683 3.848 -7.527 1.00 20.33 C ATOM 1583 O LEU A 105 28.089 3.661 -8.586 1.00 19.95 O ATOM 1584 CB LEU A 105 27.620 5.262 -5.761 1.00 19.42 C ATOM 1585 CG LEU A 105 26.650 6.018 -6.666 1.00 18.62 C ATOM 1586 CD1 LEU A 105 25.286 5.345 -6.676 1.00 17.90 C ATOM 1587 CD2 LEU A 105 26.525 7.462 -6.212 1.00 18.59 C ATOM 0 H LEU A 105 28.955 3.747 -4.376 1.00 20.36 H new ATOM 0 HA LEU A 105 27.004 3.287 -6.338 1.00 19.67 H new ATOM 0 HB2 LEU A 105 27.204 5.232 -4.754 1.00 19.42 H new ATOM 0 HB3 LEU A 105 28.552 5.824 -5.704 1.00 19.42 H new ATOM 0 HG LEU A 105 27.045 6.003 -7.682 1.00 18.62 H new ATOM 0 HD11 LEU A 105 24.611 5.900 -7.327 1.00 17.90 H new ATOM 0 HD12 LEU A 105 25.387 4.324 -7.044 1.00 17.90 H new ATOM 0 HD13 LEU A 105 24.881 5.328 -5.664 1.00 17.90 H new ATOM 0 HD21 LEU A 105 25.831 7.990 -6.865 1.00 18.59 H new ATOM 0 HD22 LEU A 105 26.153 7.491 -5.188 1.00 18.59 H new ATOM 0 HD23 LEU A 105 27.502 7.943 -6.256 1.00 18.59 H new ATOM 1599 N ARG A 106 29.988 4.081 -7.465 1.00 21.40 N ATOM 1600 CA ARG A 106 30.806 4.100 -8.666 1.00 22.20 C ATOM 1601 C ARG A 106 30.939 2.693 -9.243 1.00 22.44 C ATOM 1602 O ARG A 106 30.777 2.486 -10.444 1.00 22.57 O ATOM 1603 CB ARG A 106 32.194 4.681 -8.366 1.00 23.35 C ATOM 1604 CG ARG A 106 33.303 4.052 -9.194 1.00 24.22 C ATOM 1605 CD ARG A 106 34.573 4.885 -9.174 1.00 25.21 C ATOM 1606 NE ARG A 106 34.400 6.172 -9.842 1.00 25.76 N ATOM 1607 CZ ARG A 106 35.409 6.898 -10.316 1.00 26.69 C ATOM 1608 NH1 ARG A 106 36.657 6.469 -10.185 1.00 27.16 N ATOM 1609 NH2 ARG A 106 35.171 8.057 -10.918 1.00 27.19 N ATOM 0 H ARG A 106 30.498 4.258 -6.600 1.00 21.40 H new ATOM 0 HA ARG A 106 30.315 4.736 -9.403 1.00 22.20 H new ATOM 0 HB2 ARG A 106 32.178 5.755 -8.550 1.00 23.35 H new ATOM 0 HB3 ARG A 106 32.417 4.542 -7.308 1.00 23.35 H new ATOM 0 HG2 ARG A 106 33.518 3.054 -8.812 1.00 24.22 H new ATOM 0 HG3 ARG A 106 32.964 3.933 -10.223 1.00 24.22 H new ATOM 0 HD2 ARG A 106 34.880 5.052 -8.141 1.00 25.21 H new ATOM 0 HD3 ARG A 106 35.376 4.331 -9.659 1.00 25.21 H new ATOM 0 HE ARG A 106 33.453 6.534 -9.951 1.00 25.76 H new ATOM 0 HH11 ARG A 106 36.845 5.581 -9.720 1.00 27.16 H new ATOM 0 HH12 ARG A 106 37.429 7.027 -10.549 1.00 27.16 H new ATOM 0 HH21 ARG A 106 34.213 8.393 -11.018 1.00 27.19 H new ATOM 0 HH22 ARG A 106 35.946 8.612 -11.281 1.00 27.19 H new ATOM 1623 N PHE A 107 31.233 1.732 -8.373 1.00 22.61 N ATOM 1624 CA PHE A 107 31.400 0.343 -8.788 1.00 22.97 C ATOM 1625 C PHE A 107 30.165 -0.177 -9.518 1.00 22.14 C ATOM 1626 O PHE A 107 30.280 -0.874 -10.525 1.00 22.53 O ATOM 1627 CB PHE A 107 31.697 -0.542 -7.576 1.00 23.24 C ATOM 1628 CG PHE A 107 32.042 -1.960 -7.939 1.00 23.93 C ATOM 1629 CD1 PHE A 107 33.344 -2.308 -8.265 1.00 24.11 C ATOM 1630 CD2 PHE A 107 31.066 -2.944 -7.953 1.00 24.48 C ATOM 1631 CE1 PHE A 107 33.665 -3.611 -8.598 1.00 24.82 C ATOM 1632 CE2 PHE A 107 31.382 -4.248 -8.284 1.00 25.19 C ATOM 1633 CZ PHE A 107 32.683 -4.581 -8.607 1.00 25.36 C ATOM 0 H PHE A 107 31.361 1.890 -7.373 1.00 22.61 H new ATOM 0 HA PHE A 107 32.242 0.305 -9.479 1.00 22.97 H new ATOM 0 HB2 PHE A 107 32.523 -0.108 -7.013 1.00 23.24 H new ATOM 0 HB3 PHE A 107 30.829 -0.545 -6.917 1.00 23.24 H new ATOM 0 HD1 PHE A 107 34.116 -1.553 -8.259 1.00 24.11 H new ATOM 0 HD2 PHE A 107 30.047 -2.689 -7.702 1.00 24.48 H new ATOM 0 HE1 PHE A 107 34.683 -3.869 -8.851 1.00 24.82 H new ATOM 0 HE2 PHE A 107 30.613 -5.006 -8.290 1.00 25.19 H new ATOM 0 HZ PHE A 107 32.932 -5.599 -8.866 1.00 25.36 H new ATOM 1643 N VAL A 108 28.983 0.164 -9.010 1.00 21.06 N ATOM 1644 CA VAL A 108 27.741 -0.289 -9.625 1.00 20.23 C ATOM 1645 C VAL A 108 27.460 0.446 -10.932 1.00 20.08 C ATOM 1646 O VAL A 108 27.169 -0.184 -11.946 1.00 20.21 O ATOM 1647 CB VAL A 108 26.541 -0.138 -8.679 1.00 19.12 C ATOM 1648 CG1 VAL A 108 26.455 1.282 -8.187 1.00 18.33 C ATOM 1649 CG2 VAL A 108 25.253 -0.557 -9.373 1.00 19.13 C ATOM 0 H VAL A 108 28.861 0.747 -8.182 1.00 21.06 H new ATOM 0 HA VAL A 108 27.877 -1.349 -9.841 1.00 20.23 H new ATOM 0 HB VAL A 108 26.682 -0.794 -7.820 1.00 19.12 H new ATOM 0 HG11 VAL A 108 25.602 1.384 -7.516 1.00 18.33 H new ATOM 0 HG12 VAL A 108 27.370 1.538 -7.652 1.00 18.33 H new ATOM 0 HG13 VAL A 108 26.331 1.954 -9.036 1.00 18.33 H new ATOM 0 HG21 VAL A 108 24.415 -0.442 -8.685 1.00 19.13 H new ATOM 0 HG22 VAL A 108 25.091 0.070 -10.250 1.00 19.13 H new ATOM 0 HG23 VAL A 108 25.329 -1.600 -9.682 1.00 19.13 H new ATOM 1659 N MET A 109 27.549 1.774 -10.907 1.00 19.93 N ATOM 1660 CA MET A 109 27.301 2.574 -12.104 1.00 19.90 C ATOM 1661 C MET A 109 28.111 2.045 -13.282 1.00 20.93 C ATOM 1662 O MET A 109 27.590 1.892 -14.388 1.00 20.91 O ATOM 1663 CB MET A 109 27.642 4.043 -11.847 1.00 20.00 C ATOM 1664 CG MET A 109 26.673 4.741 -10.906 1.00 18.99 C ATOM 1665 SD MET A 109 25.457 5.754 -11.774 1.00 18.30 S ATOM 1666 CE MET A 109 24.511 4.499 -12.631 1.00 17.64 C ATOM 0 H MET A 109 27.789 2.316 -10.077 1.00 19.93 H new ATOM 0 HA MET A 109 26.242 2.499 -12.350 1.00 19.90 H new ATOM 0 HB2 MET A 109 28.647 4.106 -11.431 1.00 20.00 H new ATOM 0 HB3 MET A 109 27.657 4.575 -12.798 1.00 20.00 H new ATOM 0 HG2 MET A 109 26.154 3.993 -10.307 1.00 18.99 H new ATOM 0 HG3 MET A 109 27.235 5.369 -10.215 1.00 18.99 H new ATOM 0 HE1 MET A 109 23.657 4.962 -13.126 1.00 17.64 H new ATOM 0 HE2 MET A 109 25.142 4.013 -13.375 1.00 17.64 H new ATOM 0 HE3 MET A 109 24.157 3.757 -11.915 1.00 17.64 H new ATOM 1676 N ILE A 110 29.386 1.763 -13.037 1.00 21.91 N ATOM 1677 CA ILE A 110 30.266 1.236 -14.074 1.00 22.98 C ATOM 1678 C ILE A 110 29.871 -0.195 -14.422 1.00 22.97 C ATOM 1679 O ILE A 110 30.047 -0.644 -15.555 1.00 23.58 O ATOM 1680 CB ILE A 110 31.740 1.263 -13.625 1.00 24.01 C ATOM 1681 CG1 ILE A 110 32.119 2.665 -13.146 1.00 24.18 C ATOM 1682 CG2 ILE A 110 32.651 0.822 -14.763 1.00 25.13 C ATOM 1683 CD1 ILE A 110 33.414 2.711 -12.361 1.00 25.10 C ATOM 0 H ILE A 110 29.833 1.891 -12.129 1.00 21.91 H new ATOM 0 HA ILE A 110 30.159 1.872 -14.953 1.00 22.98 H new ATOM 0 HB ILE A 110 31.866 0.566 -12.796 1.00 24.01 H new ATOM 0 HG12 ILE A 110 32.205 3.324 -14.010 1.00 24.18 H new ATOM 0 HG13 ILE A 110 31.314 3.057 -12.525 1.00 24.18 H new ATOM 0 HG21 ILE A 110 33.688 0.847 -14.429 1.00 25.13 H new ATOM 0 HG22 ILE A 110 32.391 -0.193 -15.065 1.00 25.13 H new ATOM 0 HG23 ILE A 110 32.526 1.496 -15.611 1.00 25.13 H new ATOM 0 HD11 ILE A 110 33.618 3.737 -12.055 1.00 25.10 H new ATOM 0 HD12 ILE A 110 33.326 2.079 -11.477 1.00 25.10 H new ATOM 0 HD13 ILE A 110 34.231 2.350 -12.986 1.00 25.10 H new ATOM 1695 N ASN A 111 29.332 -0.902 -13.433 1.00 22.36 N ATOM 1696 CA ASN A 111 28.895 -2.280 -13.619 1.00 22.40 C ATOM 1697 C ASN A 111 27.685 -2.337 -14.544 1.00 21.78 C ATOM 1698 O ASN A 111 27.480 -3.320 -15.257 1.00 22.21 O ATOM 1699 CB ASN A 111 28.553 -2.911 -12.266 1.00 21.96 C ATOM 1700 CG ASN A 111 27.920 -4.282 -12.407 1.00 22.60 C ATOM 1701 OD1 ASN A 111 26.704 -4.405 -12.549 1.00 23.32 O ATOM 1702 ND2 ASN A 111 28.744 -5.322 -12.360 1.00 22.44 N ATOM 0 H ASN A 111 29.187 -0.540 -12.490 1.00 22.36 H new ATOM 0 HA ASN A 111 29.708 -2.842 -14.077 1.00 22.40 H new ATOM 0 HB2 ASN A 111 29.460 -2.993 -11.668 1.00 21.96 H new ATOM 0 HB3 ASN A 111 27.872 -2.254 -11.724 1.00 21.96 H new ATOM 0 HD21 ASN A 111 28.375 -6.269 -12.443 1.00 22.44 H new ATOM 0 HD22 ASN A 111 29.746 -5.174 -12.241 1.00 22.44 H new ATOM 1709 N LEU A 112 26.886 -1.275 -14.525 1.00 20.83 N ATOM 1710 CA LEU A 112 25.695 -1.194 -15.362 1.00 20.19 C ATOM 1711 C LEU A 112 26.082 -0.970 -16.818 1.00 20.95 C ATOM 1712 O LEU A 112 25.490 -1.554 -17.727 1.00 21.07 O ATOM 1713 CB LEU A 112 24.789 -0.057 -14.885 1.00 19.00 C ATOM 1714 CG LEU A 112 24.414 -0.102 -13.399 1.00 18.25 C ATOM 1715 CD1 LEU A 112 23.542 1.086 -13.023 1.00 17.58 C ATOM 1716 CD2 LEU A 112 23.706 -1.406 -13.062 1.00 17.84 C ATOM 0 H LEU A 112 27.043 -0.456 -13.937 1.00 20.83 H new ATOM 0 HA LEU A 112 25.154 -2.137 -15.283 1.00 20.19 H new ATOM 0 HB2 LEU A 112 25.285 0.892 -15.090 1.00 19.00 H new ATOM 0 HB3 LEU A 112 23.873 -0.072 -15.475 1.00 19.00 H new ATOM 0 HG LEU A 112 25.335 -0.048 -12.819 1.00 18.25 H new ATOM 0 HD11 LEU A 112 23.289 1.031 -11.964 1.00 17.58 H new ATOM 0 HD12 LEU A 112 24.083 2.011 -13.220 1.00 17.58 H new ATOM 0 HD13 LEU A 112 22.627 1.068 -13.616 1.00 17.58 H new ATOM 0 HD21 LEU A 112 23.449 -1.417 -12.003 1.00 17.84 H new ATOM 0 HD22 LEU A 112 22.797 -1.491 -13.657 1.00 17.84 H new ATOM 0 HD23 LEU A 112 24.365 -2.246 -13.284 1.00 17.84 H new ATOM 1728 N GLY A 113 27.081 -0.118 -17.027 1.00 21.57 N ATOM 1729 CA GLY A 113 27.539 0.178 -18.369 1.00 22.41 C ATOM 1730 C GLY A 113 27.794 1.656 -18.577 1.00 22.40 C ATOM 1731 O GLY A 113 28.218 2.073 -19.656 1.00 23.05 O ATOM 0 H GLY A 113 27.582 0.373 -16.287 1.00 21.57 H new ATOM 0 HA2 GLY A 113 28.455 -0.378 -18.569 1.00 22.41 H new ATOM 0 HA3 GLY A 113 26.795 -0.165 -19.088 1.00 22.41 H new ATOM 1735 N GLU A 114 27.538 2.454 -17.543 1.00 21.76 N ATOM 1736 CA GLU A 114 27.745 3.896 -17.626 1.00 21.80 C ATOM 1737 C GLU A 114 28.811 4.360 -16.640 1.00 22.59 C ATOM 1738 O GLU A 114 28.772 4.017 -15.458 1.00 22.48 O ATOM 1739 CB GLU A 114 26.433 4.637 -17.367 1.00 20.80 C ATOM 1740 CG GLU A 114 25.736 4.205 -16.091 1.00 20.26 C ATOM 1741 CD GLU A 114 24.359 4.823 -15.942 1.00 20.12 C ATOM 1742 OE1 GLU A 114 24.268 5.951 -15.414 1.00 20.27 O ATOM 1743 OE2 GLU A 114 23.372 4.178 -16.353 1.00 19.96 O ATOM 0 H GLU A 114 27.188 2.128 -16.642 1.00 21.76 H new ATOM 0 HA GLU A 114 28.092 4.126 -18.633 1.00 21.80 H new ATOM 0 HB2 GLU A 114 26.633 5.707 -17.318 1.00 20.80 H new ATOM 0 HB3 GLU A 114 25.762 4.477 -18.211 1.00 20.80 H new ATOM 0 HG2 GLU A 114 25.646 3.119 -16.080 1.00 20.26 H new ATOM 0 HG3 GLU A 114 26.350 4.483 -15.234 1.00 20.26 H new ATOM 1750 N LYS A 115 29.764 5.144 -17.134 1.00 23.45 N ATOM 1751 CA LYS A 115 30.842 5.658 -16.297 1.00 24.32 C ATOM 1752 C LYS A 115 30.442 6.976 -15.642 1.00 23.94 C ATOM 1753 O LYS A 115 29.609 7.715 -16.168 1.00 23.86 O ATOM 1754 CB LYS A 115 32.115 5.849 -17.126 1.00 25.48 C ATOM 1755 CG LYS A 115 31.948 6.809 -18.293 1.00 26.26 C ATOM 1756 CD LYS A 115 33.262 7.027 -19.032 1.00 26.75 C ATOM 1757 CE LYS A 115 33.718 5.766 -19.753 1.00 27.55 C ATOM 1758 NZ LYS A 115 32.753 5.349 -20.808 1.00 27.96 N ATOM 0 H LYS A 115 29.812 5.437 -18.110 1.00 23.45 H new ATOM 0 HA LYS A 115 31.037 4.929 -15.511 1.00 24.32 H new ATOM 0 HB2 LYS A 115 32.909 6.216 -16.476 1.00 25.48 H new ATOM 0 HB3 LYS A 115 32.438 4.880 -17.508 1.00 25.48 H new ATOM 0 HG2 LYS A 115 31.202 6.416 -18.984 1.00 26.26 H new ATOM 0 HG3 LYS A 115 31.572 7.765 -17.928 1.00 26.26 H new ATOM 0 HD2 LYS A 115 33.144 7.836 -19.753 1.00 26.75 H new ATOM 0 HD3 LYS A 115 34.030 7.340 -18.325 1.00 26.75 H new ATOM 0 HE2 LYS A 115 34.696 5.939 -20.203 1.00 27.55 H new ATOM 0 HE3 LYS A 115 33.838 4.958 -19.031 1.00 27.55 H new ATOM 0 HZ1 LYS A 115 33.205 4.655 -21.437 1.00 27.96 H new ATOM 0 HZ2 LYS A 115 31.916 4.920 -20.363 1.00 27.96 H new ATOM 0 HZ3 LYS A 115 32.463 6.180 -21.361 1.00 27.96 H new ATOM 1772 N VAL A 116 31.042 7.261 -14.492 1.00 23.78 N ATOM 1773 CA VAL A 116 30.752 8.486 -13.755 1.00 23.53 C ATOM 1774 C VAL A 116 31.947 8.926 -12.921 1.00 24.38 C ATOM 1775 O VAL A 116 32.795 8.113 -12.555 1.00 24.75 O ATOM 1776 CB VAL A 116 29.539 8.315 -12.822 1.00 22.24 C ATOM 1777 CG1 VAL A 116 28.253 8.702 -13.534 1.00 21.40 C ATOM 1778 CG2 VAL A 116 29.462 6.886 -12.306 1.00 21.91 C ATOM 0 H VAL A 116 31.735 6.658 -14.048 1.00 23.78 H new ATOM 0 HA VAL A 116 30.526 9.248 -14.501 1.00 23.53 H new ATOM 0 HB VAL A 116 29.665 8.981 -11.969 1.00 22.24 H new ATOM 0 HG11 VAL A 116 27.409 8.573 -12.856 1.00 21.40 H new ATOM 0 HG12 VAL A 116 28.311 9.744 -13.848 1.00 21.40 H new ATOM 0 HG13 VAL A 116 28.116 8.066 -14.409 1.00 21.40 H new ATOM 0 HG21 VAL A 116 28.599 6.783 -11.648 1.00 21.91 H new ATOM 0 HG22 VAL A 116 29.361 6.200 -13.147 1.00 21.91 H new ATOM 0 HG23 VAL A 116 30.371 6.650 -11.752 1.00 21.91 H new ATOM 1788 N THR A 117 32.004 10.219 -12.625 1.00 24.76 N ATOM 1789 CA THR A 117 33.087 10.775 -11.829 1.00 25.62 C ATOM 1790 C THR A 117 32.683 10.837 -10.363 1.00 25.03 C ATOM 1791 O THR A 117 31.553 11.197 -10.037 1.00 24.12 O ATOM 1792 CB THR A 117 33.468 12.187 -12.310 1.00 26.54 C ATOM 1793 OG1 THR A 117 32.353 13.075 -12.166 1.00 25.98 O ATOM 1794 CG2 THR A 117 33.914 12.161 -13.766 1.00 27.24 C ATOM 0 H THR A 117 31.310 10.903 -12.926 1.00 24.76 H new ATOM 0 HA THR A 117 33.952 10.122 -11.946 1.00 25.62 H new ATOM 0 HB THR A 117 34.296 12.542 -11.696 1.00 26.54 H new ATOM 0 HG1 THR A 117 32.606 13.971 -12.473 1.00 25.98 H new ATOM 0 HG21 THR A 117 34.178 13.170 -14.084 1.00 27.24 H new ATOM 0 HG22 THR A 117 34.782 11.509 -13.869 1.00 27.24 H new ATOM 0 HG23 THR A 117 33.102 11.785 -14.389 1.00 27.24 H new ATOM 1802 N ASP A 118 33.618 10.482 -9.484 1.00 25.62 N ATOM 1803 CA ASP A 118 33.366 10.483 -8.044 1.00 25.26 C ATOM 1804 C ASP A 118 32.754 11.801 -7.583 1.00 25.12 C ATOM 1805 O ASP A 118 32.145 11.870 -6.517 1.00 24.60 O ATOM 1806 CB ASP A 118 34.667 10.224 -7.280 1.00 26.22 C ATOM 1807 CG ASP A 118 35.317 8.911 -7.666 1.00 26.44 C ATOM 1808 OD1 ASP A 118 34.848 7.855 -7.190 1.00 26.63 O ATOM 1809 OD2 ASP A 118 36.294 8.936 -8.443 1.00 26.51 O ATOM 0 H ASP A 118 34.560 10.189 -9.745 1.00 25.62 H new ATOM 0 HA ASP A 118 32.653 9.686 -7.833 1.00 25.26 H new ATOM 0 HB2 ASP A 118 35.364 11.040 -7.470 1.00 26.22 H new ATOM 0 HB3 ASP A 118 34.461 10.223 -6.210 1.00 26.22 H new ATOM 1814 N GLU A 119 32.912 12.843 -8.393 1.00 25.66 N ATOM 1815 CA GLU A 119 32.384 14.160 -8.058 1.00 25.70 C ATOM 1816 C GLU A 119 30.879 14.247 -8.300 1.00 24.54 C ATOM 1817 O GLU A 119 30.118 14.588 -7.396 1.00 24.02 O ATOM 1818 CB GLU A 119 33.102 15.236 -8.875 1.00 26.79 C ATOM 1819 CG GLU A 119 34.612 15.231 -8.696 1.00 27.99 C ATOM 1820 CD GLU A 119 35.301 16.284 -9.542 1.00 28.61 C ATOM 1821 OE1 GLU A 119 35.620 15.990 -10.713 1.00 28.61 O ATOM 1822 OE2 GLU A 119 35.521 17.404 -9.033 1.00 29.14 O ATOM 0 H GLU A 119 33.402 12.800 -9.287 1.00 25.66 H new ATOM 0 HA GLU A 119 32.562 14.325 -6.995 1.00 25.70 H new ATOM 0 HB2 GLU A 119 32.869 15.094 -9.930 1.00 26.79 H new ATOM 0 HB3 GLU A 119 32.714 16.214 -8.592 1.00 26.79 H new ATOM 0 HG2 GLU A 119 34.851 15.400 -7.646 1.00 27.99 H new ATOM 0 HG3 GLU A 119 35.002 14.247 -8.957 1.00 27.99 H new ATOM 1829 N GLU A 120 30.456 13.935 -9.521 1.00 24.19 N ATOM 1830 CA GLU A 120 29.042 13.999 -9.880 1.00 23.13 C ATOM 1831 C GLU A 120 28.204 13.025 -9.056 1.00 21.97 C ATOM 1832 O GLU A 120 27.106 13.365 -8.608 1.00 21.17 O ATOM 1833 CB GLU A 120 28.860 13.720 -11.375 1.00 23.10 C ATOM 1834 CG GLU A 120 29.266 12.319 -11.798 1.00 22.97 C ATOM 1835 CD GLU A 120 29.017 12.065 -13.271 1.00 23.00 C ATOM 1836 OE1 GLU A 120 27.844 11.859 -13.648 1.00 22.54 O ATOM 1837 OE2 GLU A 120 29.996 12.068 -14.047 1.00 23.55 O ATOM 0 H GLU A 120 31.071 13.636 -10.278 1.00 24.19 H new ATOM 0 HA GLU A 120 28.691 15.007 -9.658 1.00 23.13 H new ATOM 0 HB2 GLU A 120 27.814 13.879 -11.639 1.00 23.10 H new ATOM 0 HB3 GLU A 120 29.445 14.443 -11.943 1.00 23.10 H new ATOM 0 HG2 GLU A 120 30.323 12.169 -11.580 1.00 22.97 H new ATOM 0 HG3 GLU A 120 28.712 11.589 -11.208 1.00 22.97 H new ATOM 1844 N ILE A 121 28.723 11.819 -8.843 1.00 21.93 N ATOM 1845 CA ILE A 121 27.996 10.814 -8.079 1.00 20.94 C ATOM 1846 C ILE A 121 27.927 11.181 -6.600 1.00 20.97 C ATOM 1847 O ILE A 121 26.907 10.957 -5.948 1.00 20.10 O ATOM 1848 CB ILE A 121 28.608 9.409 -8.235 1.00 21.05 C ATOM 1849 CG1 ILE A 121 30.097 9.418 -7.895 1.00 22.23 C ATOM 1850 CG2 ILE A 121 28.387 8.891 -9.646 1.00 20.98 C ATOM 1851 CD1 ILE A 121 30.641 8.047 -7.554 1.00 22.33 C ATOM 0 H ILE A 121 29.635 11.517 -9.185 1.00 21.93 H new ATOM 0 HA ILE A 121 26.986 10.792 -8.487 1.00 20.94 H new ATOM 0 HB ILE A 121 28.107 8.741 -7.534 1.00 21.05 H new ATOM 0 HG12 ILE A 121 30.653 9.822 -8.741 1.00 22.23 H new ATOM 0 HG13 ILE A 121 30.266 10.088 -7.052 1.00 22.23 H new ATOM 0 HG21 ILE A 121 28.825 7.897 -9.742 1.00 20.98 H new ATOM 0 HG22 ILE A 121 27.318 8.838 -9.851 1.00 20.98 H new ATOM 0 HG23 ILE A 121 28.860 9.566 -10.360 1.00 20.98 H new ATOM 0 HD11 ILE A 121 31.703 8.124 -7.323 1.00 22.33 H new ATOM 0 HD12 ILE A 121 30.109 7.649 -6.690 1.00 22.33 H new ATOM 0 HD13 ILE A 121 30.503 7.379 -8.404 1.00 22.33 H new ATOM 1863 N ASP A 122 29.012 11.744 -6.069 1.00 22.05 N ATOM 1864 CA ASP A 122 29.040 12.145 -4.667 1.00 22.30 C ATOM 1865 C ASP A 122 28.004 13.231 -4.408 1.00 21.86 C ATOM 1866 O ASP A 122 27.423 13.306 -3.325 1.00 21.46 O ATOM 1867 CB ASP A 122 30.432 12.648 -4.276 1.00 23.63 C ATOM 1868 CG ASP A 122 30.497 13.106 -2.832 1.00 24.02 C ATOM 1869 OD1 ASP A 122 30.777 12.263 -1.954 1.00 24.29 O ATOM 1870 OD2 ASP A 122 30.268 14.308 -2.579 1.00 24.14 O ATOM 0 H ASP A 122 29.873 11.930 -6.583 1.00 22.05 H new ATOM 0 HA ASP A 122 28.801 11.273 -4.058 1.00 22.30 H new ATOM 0 HB2 ASP A 122 31.161 11.853 -4.435 1.00 23.63 H new ATOM 0 HB3 ASP A 122 30.714 13.474 -4.929 1.00 23.63 H new ATOM 1875 N GLU A 123 27.776 14.072 -5.414 1.00 22.03 N ATOM 1876 CA GLU A 123 26.803 15.151 -5.304 1.00 21.74 C ATOM 1877 C GLU A 123 25.394 14.588 -5.168 1.00 20.39 C ATOM 1878 O GLU A 123 24.624 15.020 -4.311 1.00 20.02 O ATOM 1879 CB GLU A 123 26.882 16.074 -6.521 1.00 22.27 C ATOM 1880 CG GLU A 123 28.140 16.926 -6.559 1.00 23.66 C ATOM 1881 CD GLU A 123 28.241 17.868 -5.376 1.00 24.40 C ATOM 1882 OE1 GLU A 123 27.652 18.967 -5.440 1.00 24.74 O ATOM 1883 OE2 GLU A 123 28.909 17.506 -4.384 1.00 24.71 O ATOM 0 H GLU A 123 28.253 14.025 -6.314 1.00 22.03 H new ATOM 0 HA GLU A 123 27.038 15.730 -4.411 1.00 21.74 H new ATOM 0 HB2 GLU A 123 26.835 15.471 -7.428 1.00 22.27 H new ATOM 0 HB3 GLU A 123 26.010 16.728 -6.527 1.00 22.27 H new ATOM 0 HG2 GLU A 123 29.015 16.276 -6.577 1.00 23.66 H new ATOM 0 HG3 GLU A 123 28.155 17.505 -7.482 1.00 23.66 H new ATOM 1890 N MET A 124 25.064 13.623 -6.024 1.00 19.71 N ATOM 1891 CA MET A 124 23.748 12.993 -5.992 1.00 18.41 C ATOM 1892 C MET A 124 23.464 12.399 -4.617 1.00 17.96 C ATOM 1893 O MET A 124 22.339 12.473 -4.119 1.00 17.13 O ATOM 1894 CB MET A 124 23.648 11.908 -7.066 1.00 17.97 C ATOM 1895 CG MET A 124 22.381 11.073 -6.974 1.00 16.63 C ATOM 1896 SD MET A 124 22.233 9.881 -8.319 1.00 16.29 S ATOM 1897 CE MET A 124 23.654 8.837 -8.006 1.00 17.07 C ATOM 0 H MET A 124 25.688 13.262 -6.746 1.00 19.71 H new ATOM 0 HA MET A 124 23.001 13.760 -6.197 1.00 18.41 H new ATOM 0 HB2 MET A 124 23.693 12.377 -8.049 1.00 17.97 H new ATOM 0 HB3 MET A 124 24.513 11.250 -6.987 1.00 17.97 H new ATOM 0 HG2 MET A 124 22.369 10.543 -6.022 1.00 16.63 H new ATOM 0 HG3 MET A 124 21.514 11.734 -6.983 1.00 16.63 H new ATOM 0 HE1 MET A 124 23.558 7.912 -8.575 1.00 17.07 H new ATOM 0 HE2 MET A 124 24.562 9.358 -8.310 1.00 17.07 H new ATOM 0 HE3 MET A 124 23.708 8.605 -6.942 1.00 17.07 H new ATOM 1907 N ILE A 125 24.487 11.808 -4.008 1.00 18.60 N ATOM 1908 CA ILE A 125 24.344 11.210 -2.687 1.00 18.41 C ATOM 1909 C ILE A 125 24.036 12.282 -1.653 1.00 18.72 C ATOM 1910 O ILE A 125 23.192 12.094 -0.778 1.00 18.18 O ATOM 1911 CB ILE A 125 25.621 10.453 -2.267 1.00 19.25 C ATOM 1912 CG1 ILE A 125 25.908 9.317 -3.253 1.00 19.04 C ATOM 1913 CG2 ILE A 125 25.482 9.916 -0.847 1.00 19.27 C ATOM 1914 CD1 ILE A 125 27.157 8.526 -2.927 1.00 19.95 C ATOM 0 H ILE A 125 25.422 11.731 -4.408 1.00 18.60 H new ATOM 0 HA ILE A 125 23.520 10.498 -2.739 1.00 18.41 H new ATOM 0 HB ILE A 125 26.462 11.147 -2.285 1.00 19.25 H new ATOM 0 HG12 ILE A 125 25.054 8.639 -3.271 1.00 19.04 H new ATOM 0 HG13 ILE A 125 26.005 9.734 -4.255 1.00 19.04 H new ATOM 0 HG21 ILE A 125 26.392 9.385 -0.568 1.00 19.27 H new ATOM 0 HG22 ILE A 125 25.320 10.745 -0.159 1.00 19.27 H new ATOM 0 HG23 ILE A 125 24.634 9.233 -0.798 1.00 19.27 H new ATOM 0 HD11 ILE A 125 27.294 7.740 -3.669 1.00 19.95 H new ATOM 0 HD12 ILE A 125 28.021 9.190 -2.938 1.00 19.95 H new ATOM 0 HD13 ILE A 125 27.056 8.078 -1.938 1.00 19.95 H new ATOM 1926 N ARG A 126 24.730 13.409 -1.766 1.00 19.67 N ATOM 1927 CA ARG A 126 24.536 14.527 -0.855 1.00 20.18 C ATOM 1928 C ARG A 126 23.093 15.019 -0.898 1.00 19.36 C ATOM 1929 O ARG A 126 22.473 15.250 0.139 1.00 19.42 O ATOM 1930 CB ARG A 126 25.479 15.674 -1.221 1.00 21.37 C ATOM 1931 CG ARG A 126 25.243 16.939 -0.412 1.00 22.05 C ATOM 1932 CD ARG A 126 25.950 18.133 -1.026 1.00 22.88 C ATOM 1933 NE ARG A 126 25.430 18.454 -2.353 1.00 23.53 N ATOM 1934 CZ ARG A 126 25.682 19.597 -2.985 1.00 24.32 C ATOM 1935 NH1 ARG A 126 26.435 20.526 -2.410 1.00 24.55 N ATOM 1936 NH2 ARG A 126 25.175 19.814 -4.191 1.00 24.95 N ATOM 0 H ARG A 126 25.436 13.571 -2.484 1.00 19.67 H new ATOM 0 HA ARG A 126 24.758 14.183 0.155 1.00 20.18 H new ATOM 0 HB2 ARG A 126 26.509 15.347 -1.076 1.00 21.37 H new ATOM 0 HB3 ARG A 126 25.364 15.904 -2.280 1.00 21.37 H new ATOM 0 HG2 ARG A 126 24.173 17.140 -0.352 1.00 22.05 H new ATOM 0 HG3 ARG A 126 25.597 16.791 0.608 1.00 22.05 H new ATOM 0 HD2 ARG A 126 25.835 18.998 -0.373 1.00 22.88 H new ATOM 0 HD3 ARG A 126 27.018 17.926 -1.095 1.00 22.88 H new ATOM 0 HE ARG A 126 24.842 17.764 -2.820 1.00 23.53 H new ATOM 0 HH11 ARG A 126 26.823 20.365 -1.480 1.00 24.55 H new ATOM 0 HH12 ARG A 126 26.626 21.401 -2.898 1.00 24.55 H new ATOM 0 HH21 ARG A 126 24.592 19.104 -4.634 1.00 24.95 H new ATOM 0 HH22 ARG A 126 25.368 20.691 -4.675 1.00 24.95 H new ATOM 1950 N GLU A 127 22.571 15.176 -2.109 1.00 18.69 N ATOM 1951 CA GLU A 127 21.206 15.649 -2.302 1.00 17.91 C ATOM 1952 C GLU A 127 20.194 14.668 -1.720 1.00 16.85 C ATOM 1953 O GLU A 127 19.111 15.064 -1.287 1.00 16.48 O ATOM 1954 CB GLU A 127 20.935 15.871 -3.789 1.00 17.50 C ATOM 1955 CG GLU A 127 21.804 16.952 -4.407 1.00 18.61 C ATOM 1956 CD GLU A 127 21.436 17.245 -5.848 1.00 18.51 C ATOM 1957 OE1 GLU A 127 21.979 16.571 -6.749 1.00 18.54 O ATOM 1958 OE2 GLU A 127 20.605 18.150 -6.077 1.00 18.51 O ATOM 0 H GLU A 127 23.075 14.982 -2.974 1.00 18.69 H new ATOM 0 HA GLU A 127 21.096 16.596 -1.773 1.00 17.91 H new ATOM 0 HB2 GLU A 127 21.097 14.935 -4.324 1.00 17.50 H new ATOM 0 HB3 GLU A 127 19.887 16.137 -3.924 1.00 17.50 H new ATOM 0 HG2 GLU A 127 21.713 17.866 -3.820 1.00 18.61 H new ATOM 0 HG3 GLU A 127 22.849 16.645 -4.358 1.00 18.61 H new ATOM 1965 N ALA A 128 20.549 13.387 -1.712 1.00 16.47 N ATOM 1966 CA ALA A 128 19.668 12.355 -1.178 1.00 15.57 C ATOM 1967 C ALA A 128 19.943 12.111 0.299 1.00 16.23 C ATOM 1968 O ALA A 128 19.148 11.476 0.993 1.00 15.78 O ATOM 1969 CB ALA A 128 19.832 11.064 -1.965 1.00 14.84 C ATOM 0 H ALA A 128 21.439 13.039 -2.069 1.00 16.47 H new ATOM 0 HA ALA A 128 18.640 12.702 -1.278 1.00 15.57 H new ATOM 0 HB1 ALA A 128 19.169 10.302 -1.556 1.00 14.84 H new ATOM 0 HB2 ALA A 128 19.580 11.241 -3.011 1.00 14.84 H new ATOM 0 HB3 ALA A 128 20.865 10.723 -1.893 1.00 14.84 H new ATOM 1975 N ASP A 129 21.070 12.624 0.776 1.00 17.37 N ATOM 1976 CA ASP A 129 21.457 12.459 2.171 1.00 18.16 C ATOM 1977 C ASP A 129 21.154 13.720 2.973 1.00 18.88 C ATOM 1978 O ASP A 129 21.851 14.728 2.853 1.00 19.74 O ATOM 1979 CB ASP A 129 22.942 12.105 2.266 1.00 19.04 C ATOM 1980 CG ASP A 129 23.489 12.245 3.671 1.00 19.91 C ATOM 1981 OD1 ASP A 129 22.848 11.726 4.608 1.00 20.17 O ATOM 1982 OD2 ASP A 129 24.553 12.878 3.836 1.00 20.40 O ATOM 0 H ASP A 129 21.733 13.159 0.216 1.00 17.37 H new ATOM 0 HA ASP A 129 20.873 11.643 2.596 1.00 18.16 H new ATOM 0 HB2 ASP A 129 23.089 11.081 1.924 1.00 19.04 H new ATOM 0 HB3 ASP A 129 23.508 12.750 1.594 1.00 19.04 H new ATOM 1987 N PHE A 130 20.108 13.652 3.791 1.00 18.61 N ATOM 1988 CA PHE A 130 19.699 14.788 4.612 1.00 19.35 C ATOM 1989 C PHE A 130 20.396 14.780 5.970 1.00 20.46 C ATOM 1990 O PHE A 130 20.820 15.826 6.464 1.00 21.43 O ATOM 1991 CB PHE A 130 18.184 14.778 4.817 1.00 18.69 C ATOM 1992 CG PHE A 130 17.401 14.968 3.550 1.00 17.66 C ATOM 1993 CD1 PHE A 130 17.220 16.234 3.015 1.00 17.35 C ATOM 1994 CD2 PHE A 130 16.849 13.881 2.892 1.00 17.07 C ATOM 1995 CE1 PHE A 130 16.501 16.411 1.848 1.00 16.46 C ATOM 1996 CE2 PHE A 130 16.132 14.052 1.724 1.00 16.17 C ATOM 1997 CZ PHE A 130 15.945 15.324 1.210 1.00 15.86 C ATOM 0 H PHE A 130 19.527 12.821 3.903 1.00 18.61 H new ATOM 0 HA PHE A 130 19.991 15.695 4.082 1.00 19.35 H new ATOM 0 HB2 PHE A 130 17.895 13.832 5.274 1.00 18.69 H new ATOM 0 HB3 PHE A 130 17.916 15.566 5.520 1.00 18.69 H new ATOM 0 HD1 PHE A 130 17.645 17.091 3.516 1.00 17.35 H new ATOM 0 HD2 PHE A 130 16.981 12.889 3.297 1.00 17.07 H new ATOM 0 HE1 PHE A 130 16.375 17.401 1.436 1.00 16.46 H new ATOM 0 HE2 PHE A 130 15.718 13.195 1.213 1.00 16.17 H new ATOM 0 HZ PHE A 130 15.364 15.464 0.310 1.00 15.86 H new ATOM 2007 N ASP A 131 20.511 13.600 6.574 1.00 20.37 N ATOM 2008 CA ASP A 131 21.151 13.470 7.879 1.00 21.43 C ATOM 2009 C ASP A 131 22.597 13.949 7.822 1.00 22.32 C ATOM 2010 O ASP A 131 23.162 14.373 8.830 1.00 23.37 O ATOM 2011 CB ASP A 131 21.097 12.020 8.363 1.00 21.16 C ATOM 2012 CG ASP A 131 21.921 11.089 7.498 1.00 20.32 C ATOM 2013 OD1 ASP A 131 23.142 10.980 7.738 1.00 19.96 O ATOM 2014 OD2 ASP A 131 21.347 10.471 6.579 1.00 20.09 O ATOM 0 H ASP A 131 20.170 12.722 6.181 1.00 20.37 H new ATOM 0 HA ASP A 131 20.606 14.096 8.586 1.00 21.43 H new ATOM 0 HB2 ASP A 131 21.457 11.970 9.391 1.00 21.16 H new ATOM 0 HB3 ASP A 131 20.061 11.681 8.371 1.00 21.16 H new ATOM 2019 N GLY A 132 23.190 13.876 6.635 1.00 21.94 N ATOM 2020 CA GLY A 132 24.564 14.309 6.463 1.00 22.81 C ATOM 2021 C GLY A 132 25.564 13.362 7.097 1.00 23.39 C ATOM 2022 O GLY A 132 26.065 13.621 8.191 1.00 24.32 O ATOM 0 H GLY A 132 22.743 13.524 5.788 1.00 21.94 H new ATOM 0 HA2 GLY A 132 24.781 14.399 5.399 1.00 22.81 H new ATOM 0 HA3 GLY A 132 24.684 15.301 6.898 1.00 22.81 H new ATOM 2026 N ASP A 133 25.854 12.260 6.410 1.00 22.90 N ATOM 2027 CA ASP A 133 26.808 11.276 6.913 1.00 23.47 C ATOM 2028 C ASP A 133 27.707 10.762 5.792 1.00 23.33 C ATOM 2029 O ASP A 133 28.878 10.452 6.018 1.00 23.88 O ATOM 2030 CB ASP A 133 26.072 10.105 7.569 1.00 23.07 C ATOM 2031 CG ASP A 133 25.296 9.272 6.568 1.00 21.88 C ATOM 2032 OD1 ASP A 133 24.534 9.858 5.771 1.00 21.33 O ATOM 2033 OD2 ASP A 133 25.448 8.033 6.585 1.00 21.56 O ATOM 0 H ASP A 133 25.443 12.027 5.506 1.00 22.90 H new ATOM 0 HA ASP A 133 27.433 11.767 7.659 1.00 23.47 H new ATOM 0 HB2 ASP A 133 26.793 9.470 8.084 1.00 23.07 H new ATOM 0 HB3 ASP A 133 25.388 10.489 8.326 1.00 23.07 H new ATOM 2038 N GLY A 134 27.155 10.675 4.585 1.00 22.67 N ATOM 2039 CA GLY A 134 27.924 10.200 3.448 1.00 22.60 C ATOM 2040 C GLY A 134 27.504 8.814 2.996 1.00 21.81 C ATOM 2041 O GLY A 134 28.151 8.211 2.140 1.00 21.94 O ATOM 0 H GLY A 134 26.189 10.925 4.374 1.00 22.67 H new ATOM 0 HA2 GLY A 134 27.809 10.899 2.619 1.00 22.60 H new ATOM 0 HA3 GLY A 134 28.982 10.187 3.710 1.00 22.60 H new ATOM 2045 N MET A 135 26.417 8.310 3.573 1.00 21.09 N ATOM 2046 CA MET A 135 25.908 6.987 3.228 1.00 20.37 C ATOM 2047 C MET A 135 24.412 7.049 2.938 1.00 19.18 C ATOM 2048 O MET A 135 23.717 7.944 3.418 1.00 19.03 O ATOM 2049 CB MET A 135 26.183 5.996 4.360 1.00 20.92 C ATOM 2050 CG MET A 135 27.630 5.991 4.825 1.00 22.12 C ATOM 2051 SD MET A 135 27.959 4.729 6.070 1.00 22.91 S ATOM 2052 CE MET A 135 27.706 3.236 5.114 1.00 22.22 C ATOM 0 H MET A 135 25.871 8.799 4.283 1.00 21.09 H new ATOM 0 HA MET A 135 26.424 6.645 2.331 1.00 20.37 H new ATOM 0 HB2 MET A 135 25.539 6.236 5.206 1.00 20.92 H new ATOM 0 HB3 MET A 135 25.913 4.994 4.028 1.00 20.92 H new ATOM 0 HG2 MET A 135 28.282 5.827 3.967 1.00 22.12 H new ATOM 0 HG3 MET A 135 27.879 6.971 5.232 1.00 22.12 H new ATOM 0 HE1 MET A 135 26.796 2.739 5.450 1.00 22.22 H new ATOM 0 HE2 MET A 135 27.612 3.491 4.059 1.00 22.22 H new ATOM 0 HE3 MET A 135 28.556 2.568 5.251 1.00 22.22 H new ATOM 2062 N ILE A 136 23.919 6.095 2.153 1.00 18.41 N ATOM 2063 CA ILE A 136 22.506 6.058 1.798 1.00 17.25 C ATOM 2064 C ILE A 136 21.807 4.833 2.370 1.00 16.93 C ATOM 2065 O ILE A 136 22.379 3.747 2.438 1.00 17.36 O ATOM 2066 CB ILE A 136 22.303 6.059 0.266 1.00 16.55 C ATOM 2067 CG1 ILE A 136 22.869 7.343 -0.353 1.00 16.94 C ATOM 2068 CG2 ILE A 136 20.825 5.897 -0.080 1.00 15.33 C ATOM 2069 CD1 ILE A 136 22.216 8.613 0.153 1.00 16.79 C ATOM 0 H ILE A 136 24.476 5.340 1.752 1.00 18.41 H new ATOM 0 HA ILE A 136 22.068 6.959 2.228 1.00 17.25 H new ATOM 0 HB ILE A 136 22.846 5.212 -0.153 1.00 16.55 H new ATOM 0 HG12 ILE A 136 23.939 7.391 -0.149 1.00 16.94 H new ATOM 0 HG13 ILE A 136 22.753 7.294 -1.436 1.00 16.94 H new ATOM 0 HG21 ILE A 136 20.702 5.900 -1.163 1.00 15.33 H new ATOM 0 HG22 ILE A 136 20.458 4.954 0.324 1.00 15.33 H new ATOM 0 HG23 ILE A 136 20.258 6.722 0.352 1.00 15.33 H new ATOM 0 HD11 ILE A 136 22.672 9.475 -0.333 1.00 16.79 H new ATOM 0 HD12 ILE A 136 21.150 8.590 -0.075 1.00 16.79 H new ATOM 0 HD13 ILE A 136 22.355 8.689 1.231 1.00 16.79 H new ATOM 2081 N ASN A 137 20.560 5.031 2.778 1.00 16.28 N ATOM 2082 CA ASN A 137 19.738 3.959 3.315 1.00 16.03 C ATOM 2083 C ASN A 137 18.555 3.734 2.381 1.00 14.85 C ATOM 2084 O ASN A 137 18.217 4.622 1.600 1.00 14.21 O ATOM 2085 CB ASN A 137 19.252 4.285 4.731 1.00 16.50 C ATOM 2086 CG ASN A 137 18.346 5.498 4.772 1.00 16.54 C ATOM 2087 OD1 ASN A 137 18.481 6.413 3.963 1.00 16.44 O ATOM 2088 ND2 ASN A 137 17.417 5.512 5.721 1.00 16.82 N ATOM 0 H ASN A 137 20.093 5.937 2.745 1.00 16.28 H new ATOM 0 HA ASN A 137 20.336 3.050 3.381 1.00 16.03 H new ATOM 0 HB2 ASN A 137 18.719 3.424 5.135 1.00 16.50 H new ATOM 0 HB3 ASN A 137 20.114 4.458 5.376 1.00 16.50 H new ATOM 0 HD21 ASN A 137 16.780 6.305 5.799 1.00 16.82 H new ATOM 0 HD22 ASN A 137 17.341 4.730 6.372 1.00 16.82 H new ATOM 2095 N TYR A 138 17.954 2.550 2.433 1.00 14.65 N ATOM 2096 CA TYR A 138 16.817 2.223 1.570 1.00 13.62 C ATOM 2097 C TYR A 138 15.853 3.409 1.400 1.00 12.81 C ATOM 2098 O TYR A 138 15.144 3.494 0.400 1.00 11.86 O ATOM 2099 CB TYR A 138 16.067 1.007 2.129 1.00 13.81 C ATOM 2100 CG TYR A 138 14.699 0.788 1.515 1.00 12.91 C ATOM 2101 CD1 TYR A 138 14.569 0.234 0.248 1.00 12.17 C ATOM 2102 CD2 TYR A 138 13.539 1.130 2.203 1.00 12.92 C ATOM 2103 CE1 TYR A 138 13.326 0.026 -0.318 1.00 11.46 C ATOM 2104 CE2 TYR A 138 12.293 0.925 1.643 1.00 12.20 C ATOM 2105 CZ TYR A 138 12.184 0.402 0.392 1.00 11.46 C ATOM 2106 OH TYR A 138 10.952 0.167 -0.174 1.00 10.87 O ATOM 0 H TYR A 138 18.233 1.798 3.063 1.00 14.65 H new ATOM 0 HA TYR A 138 17.214 1.987 0.583 1.00 13.62 H new ATOM 0 HB2 TYR A 138 16.672 0.115 1.969 1.00 13.81 H new ATOM 0 HB3 TYR A 138 15.955 1.127 3.207 1.00 13.81 H new ATOM 0 HD1 TYR A 138 15.456 -0.039 -0.305 1.00 12.17 H new ATOM 0 HD2 TYR A 138 13.614 1.562 3.190 1.00 12.92 H new ATOM 0 HE1 TYR A 138 13.239 -0.422 -1.297 1.00 11.46 H new ATOM 0 HE2 TYR A 138 11.403 1.181 2.200 1.00 12.20 H new ATOM 0 HH TYR A 138 10.248 0.479 0.433 1.00 10.87 H new ATOM 2116 N GLU A 139 15.847 4.332 2.358 1.00 13.28 N ATOM 2117 CA GLU A 139 14.956 5.492 2.288 1.00 12.75 C ATOM 2118 C GLU A 139 15.523 6.577 1.377 1.00 12.57 C ATOM 2119 O GLU A 139 14.874 6.996 0.417 1.00 11.70 O ATOM 2120 CB GLU A 139 14.716 6.062 3.687 1.00 13.59 C ATOM 2121 CG GLU A 139 14.020 5.093 4.628 1.00 13.94 C ATOM 2122 CD GLU A 139 12.612 4.756 4.177 1.00 14.48 C ATOM 2123 OE1 GLU A 139 12.452 3.792 3.400 1.00 14.82 O ATOM 2124 OE2 GLU A 139 11.668 5.455 4.603 1.00 14.68 O ATOM 0 H GLU A 139 16.442 4.303 3.186 1.00 13.28 H new ATOM 0 HA GLU A 139 14.008 5.156 1.867 1.00 12.75 H new ATOM 0 HB2 GLU A 139 15.673 6.353 4.121 1.00 13.59 H new ATOM 0 HB3 GLU A 139 14.116 6.968 3.603 1.00 13.59 H new ATOM 0 HG2 GLU A 139 14.605 4.176 4.698 1.00 13.94 H new ATOM 0 HG3 GLU A 139 13.984 5.525 5.628 1.00 13.94 H new ATOM 2131 N GLU A 140 16.739 7.026 1.676 1.00 13.49 N ATOM 2132 CA GLU A 140 17.388 8.059 0.876 1.00 13.65 C ATOM 2133 C GLU A 140 17.595 7.562 -0.548 1.00 13.01 C ATOM 2134 O GLU A 140 17.671 8.349 -1.493 1.00 12.80 O ATOM 2135 CB GLU A 140 18.725 8.463 1.504 1.00 14.90 C ATOM 2136 CG GLU A 140 18.580 9.113 2.871 1.00 15.69 C ATOM 2137 CD GLU A 140 19.892 9.179 3.628 1.00 16.90 C ATOM 2138 OE1 GLU A 140 20.575 8.138 3.722 1.00 17.35 O ATOM 2139 OE2 GLU A 140 20.235 10.272 4.124 1.00 17.46 O ATOM 0 H GLU A 140 17.293 6.691 2.464 1.00 13.49 H new ATOM 0 HA GLU A 140 16.744 8.938 0.850 1.00 13.65 H new ATOM 0 HB2 GLU A 140 19.356 7.579 1.596 1.00 14.90 H new ATOM 0 HB3 GLU A 140 19.238 9.153 0.835 1.00 14.90 H new ATOM 0 HG2 GLU A 140 18.184 10.121 2.750 1.00 15.69 H new ATOM 0 HG3 GLU A 140 17.853 8.554 3.460 1.00 15.69 H new ATOM 2146 N PHE A 141 17.678 6.243 -0.690 1.00 12.87 N ATOM 2147 CA PHE A 141 17.859 5.618 -1.992 1.00 12.46 C ATOM 2148 C PHE A 141 16.591 5.764 -2.824 1.00 11.27 C ATOM 2149 O PHE A 141 16.624 6.280 -3.941 1.00 11.00 O ATOM 2150 CB PHE A 141 18.205 4.136 -1.819 1.00 12.80 C ATOM 2151 CG PHE A 141 18.294 3.382 -3.116 1.00 12.57 C ATOM 2152 CD1 PHE A 141 19.490 3.309 -3.811 1.00 12.93 C ATOM 2153 CD2 PHE A 141 17.183 2.743 -3.636 1.00 12.17 C ATOM 2154 CE1 PHE A 141 19.575 2.612 -4.998 1.00 12.93 C ATOM 2155 CE2 PHE A 141 17.260 2.045 -4.824 1.00 12.17 C ATOM 2156 CZ PHE A 141 18.460 2.000 -5.519 1.00 12.56 C ATOM 0 H PHE A 141 17.622 5.584 0.087 1.00 12.87 H new ATOM 0 HA PHE A 141 18.679 6.115 -2.510 1.00 12.46 H new ATOM 0 HB2 PHE A 141 19.157 4.053 -1.294 1.00 12.80 H new ATOM 0 HB3 PHE A 141 17.451 3.667 -1.187 1.00 12.80 H new ATOM 0 HD1 PHE A 141 20.366 3.804 -3.419 1.00 12.93 H new ATOM 0 HD2 PHE A 141 16.243 2.791 -3.106 1.00 12.17 H new ATOM 0 HE1 PHE A 141 20.519 2.547 -5.519 1.00 12.93 H new ATOM 0 HE2 PHE A 141 16.390 1.536 -5.211 1.00 12.17 H new ATOM 0 HZ PHE A 141 18.518 1.485 -6.467 1.00 12.56 H new ATOM 2166 N VAL A 142 15.477 5.303 -2.263 1.00 10.70 N ATOM 2167 CA VAL A 142 14.181 5.374 -2.928 1.00 9.58 C ATOM 2168 C VAL A 142 13.922 6.766 -3.500 1.00 9.23 C ATOM 2169 O VAL A 142 13.464 6.908 -4.634 1.00 8.50 O ATOM 2170 CB VAL A 142 13.040 5.011 -1.950 1.00 9.36 C ATOM 2171 CG1 VAL A 142 11.682 5.373 -2.536 1.00 8.32 C ATOM 2172 CG2 VAL A 142 13.088 3.532 -1.598 1.00 9.69 C ATOM 0 H VAL A 142 15.447 4.872 -1.339 1.00 10.70 H new ATOM 0 HA VAL A 142 14.203 4.654 -3.746 1.00 9.58 H new ATOM 0 HB VAL A 142 13.182 5.591 -1.038 1.00 9.36 H new ATOM 0 HG11 VAL A 142 10.897 5.107 -1.828 1.00 8.32 H new ATOM 0 HG12 VAL A 142 11.645 6.444 -2.733 1.00 8.32 H new ATOM 0 HG13 VAL A 142 11.530 4.827 -3.467 1.00 8.32 H new ATOM 0 HG21 VAL A 142 12.277 3.296 -0.909 1.00 9.69 H new ATOM 0 HG22 VAL A 142 12.978 2.938 -2.505 1.00 9.69 H new ATOM 0 HG23 VAL A 142 14.044 3.301 -1.127 1.00 9.69 H new ATOM 2182 N TRP A 143 14.226 7.789 -2.712 1.00 9.94 N ATOM 2183 CA TRP A 143 14.002 9.166 -3.135 1.00 9.97 C ATOM 2184 C TRP A 143 14.852 9.549 -4.347 1.00 10.29 C ATOM 2185 O TRP A 143 14.321 9.992 -5.365 1.00 9.82 O ATOM 2186 CB TRP A 143 14.290 10.132 -1.984 1.00 10.95 C ATOM 2187 CG TRP A 143 13.971 11.554 -2.321 1.00 11.20 C ATOM 2188 CD1 TRP A 143 12.800 12.221 -2.098 1.00 10.93 C ATOM 2189 CD2 TRP A 143 14.845 12.476 -2.959 1.00 11.97 C ATOM 2190 NE1 TRP A 143 12.901 13.511 -2.569 1.00 11.51 N ATOM 2191 CE2 TRP A 143 14.151 13.689 -3.103 1.00 12.15 C ATOM 2192 CE3 TRP A 143 16.152 12.384 -3.423 1.00 12.67 C ATOM 2193 CZ2 TRP A 143 14.731 14.808 -3.699 1.00 13.01 C ATOM 2194 CZ3 TRP A 143 16.730 13.487 -4.015 1.00 13.49 C ATOM 2195 CH2 TRP A 143 16.019 14.688 -4.149 1.00 13.66 C ATOM 0 H TRP A 143 14.627 7.692 -1.779 1.00 9.94 H new ATOM 0 HA TRP A 143 12.954 9.239 -3.427 1.00 9.97 H new ATOM 0 HB2 TRP A 143 13.710 9.832 -1.111 1.00 10.95 H new ATOM 0 HB3 TRP A 143 15.342 10.057 -1.708 1.00 10.95 H new ATOM 0 HD1 TRP A 143 11.926 11.800 -1.623 1.00 10.93 H new ATOM 0 HE1 TRP A 143 12.167 14.218 -2.527 1.00 11.51 H new ATOM 0 HE3 TRP A 143 16.706 11.463 -3.321 1.00 12.67 H new ATOM 0 HZ2 TRP A 143 14.185 15.734 -3.802 1.00 13.01 H new ATOM 0 HZ3 TRP A 143 17.744 13.425 -4.381 1.00 13.49 H new ATOM 0 HH2 TRP A 143 16.497 15.536 -4.617 1.00 13.66 H new ATOM 2206 N MET A 144 16.169 9.379 -4.239 1.00 11.22 N ATOM 2207 CA MET A 144 17.076 9.756 -5.323 1.00 11.83 C ATOM 2208 C MET A 144 16.808 8.983 -6.612 1.00 11.29 C ATOM 2209 O MET A 144 16.943 9.536 -7.703 1.00 11.65 O ATOM 2210 CB MET A 144 18.536 9.590 -4.897 1.00 13.01 C ATOM 2211 CG MET A 144 18.978 8.149 -4.721 1.00 13.05 C ATOM 2212 SD MET A 144 20.765 8.003 -4.513 1.00 14.50 S ATOM 2213 CE MET A 144 20.926 6.278 -4.060 1.00 14.50 C ATOM 0 H MET A 144 16.630 8.986 -3.418 1.00 11.22 H new ATOM 0 HA MET A 144 16.885 10.808 -5.534 1.00 11.83 H new ATOM 0 HB2 MET A 144 19.175 10.065 -5.641 1.00 13.01 H new ATOM 0 HB3 MET A 144 18.691 10.122 -3.958 1.00 13.01 H new ATOM 0 HG2 MET A 144 18.477 7.721 -3.853 1.00 13.05 H new ATOM 0 HG3 MET A 144 18.666 7.567 -5.588 1.00 13.05 H new ATOM 0 HE1 MET A 144 21.418 6.201 -3.090 1.00 14.50 H new ATOM 0 HE2 MET A 144 19.937 5.823 -4.002 1.00 14.50 H new ATOM 0 HE3 MET A 144 21.521 5.759 -4.811 1.00 14.50 H new ATOM 2223 N ILE A 145 16.424 7.715 -6.498 1.00 10.61 N ATOM 2224 CA ILE A 145 16.161 6.904 -7.683 1.00 10.28 C ATOM 2225 C ILE A 145 14.818 7.248 -8.315 1.00 9.33 C ATOM 2226 O ILE A 145 14.603 7.006 -9.503 1.00 9.45 O ATOM 2227 CB ILE A 145 16.203 5.397 -7.377 1.00 10.17 C ATOM 2228 CG1 ILE A 145 15.094 5.011 -6.399 1.00 9.32 C ATOM 2229 CG2 ILE A 145 17.565 5.014 -6.821 1.00 11.25 C ATOM 2230 CD1 ILE A 145 14.714 3.550 -6.474 1.00 9.30 C ATOM 0 H ILE A 145 16.289 7.232 -5.610 1.00 10.61 H new ATOM 0 HA ILE A 145 16.958 7.139 -8.388 1.00 10.28 H new ATOM 0 HB ILE A 145 16.038 4.850 -8.305 1.00 10.17 H new ATOM 0 HG12 ILE A 145 15.416 5.244 -5.384 1.00 9.32 H new ATOM 0 HG13 ILE A 145 14.213 5.620 -6.601 1.00 9.32 H new ATOM 0 HG21 ILE A 145 17.584 3.945 -6.608 1.00 11.25 H new ATOM 0 HG22 ILE A 145 18.337 5.252 -7.553 1.00 11.25 H new ATOM 0 HG23 ILE A 145 17.753 5.570 -5.903 1.00 11.25 H new ATOM 0 HD11 ILE A 145 13.922 3.343 -5.754 1.00 9.30 H new ATOM 0 HD12 ILE A 145 14.362 3.317 -7.479 1.00 9.30 H new ATOM 0 HD13 ILE A 145 15.584 2.935 -6.243 1.00 9.30 H new ATOM 2242 N SER A 146 13.915 7.813 -7.521 1.00 8.54 N ATOM 2243 CA SER A 146 12.598 8.185 -8.019 1.00 7.66 C ATOM 2244 C SER A 146 12.716 9.328 -9.018 1.00 8.22 C ATOM 2245 O SER A 146 11.906 9.453 -9.937 1.00 7.89 O ATOM 2246 CB SER A 146 11.684 8.596 -6.864 1.00 6.98 C ATOM 2247 OG SER A 146 10.403 8.974 -7.337 1.00 6.80 O ATOM 0 H SER A 146 14.071 8.022 -6.535 1.00 8.54 H new ATOM 0 HA SER A 146 12.163 7.320 -8.519 1.00 7.66 H new ATOM 0 HB2 SER A 146 11.586 7.768 -6.161 1.00 6.98 H new ATOM 0 HB3 SER A 146 12.133 9.426 -6.318 1.00 6.98 H new ATOM 0 HG SER A 146 9.837 9.231 -6.579 1.00 6.80 H new ATOM 2253 N GLN A 147 13.733 10.158 -8.826 1.00 9.26 N ATOM 2254 CA GLN A 147 13.972 11.299 -9.695 1.00 10.11 C ATOM 2255 C GLN A 147 14.912 10.938 -10.841 1.00 11.05 C ATOM 2256 O GLN A 147 14.928 11.609 -11.874 1.00 11.87 O ATOM 2257 CB GLN A 147 14.554 12.441 -8.871 1.00 10.77 C ATOM 2258 CG GLN A 147 14.059 12.446 -7.434 1.00 10.15 C ATOM 2259 CD GLN A 147 12.555 12.331 -7.330 1.00 9.47 C ATOM 2260 OE1 GLN A 147 11.820 12.785 -8.208 1.00 10.00 O ATOM 2261 NE2 GLN A 147 12.088 11.720 -6.253 1.00 8.44 N ATOM 0 H GLN A 147 14.410 10.059 -8.069 1.00 9.26 H new ATOM 0 HA GLN A 147 13.024 11.608 -10.135 1.00 10.11 H new ATOM 0 HB2 GLN A 147 15.642 12.368 -8.875 1.00 10.77 H new ATOM 0 HB3 GLN A 147 14.297 13.390 -9.342 1.00 10.77 H new ATOM 0 HG2 GLN A 147 14.520 11.619 -6.893 1.00 10.15 H new ATOM 0 HG3 GLN A 147 14.383 13.366 -6.947 1.00 10.15 H new ATOM 0 HE21 GLN A 147 12.734 11.359 -5.551 1.00 8.44 H new ATOM 0 HE22 GLN A 147 11.082 11.610 -6.125 1.00 8.44 H new ATOM 2270 N LYS A 148 15.697 9.879 -10.649 1.00 11.08 N ATOM 2271 CA LYS A 148 16.638 9.423 -11.672 1.00 12.08 C ATOM 2272 C LYS A 148 15.952 9.289 -13.029 1.00 12.24 C ATOM 2273 O LYS A 148 15.304 8.247 -13.264 1.00 12.44 O ATOM 2274 CB LYS A 148 17.258 8.081 -11.276 1.00 12.12 C ATOM 2275 CG LYS A 148 18.365 8.193 -10.240 1.00 12.94 C ATOM 2276 CD LYS A 148 19.008 6.841 -9.970 1.00 13.10 C ATOM 2277 CE LYS A 148 20.007 6.912 -8.826 1.00 13.06 C ATOM 2278 NZ LYS A 148 20.759 5.637 -8.668 1.00 13.68 N ATOM 2279 OXT LYS A 148 16.070 10.226 -13.847 1.00 12.34 O ATOM 0 H LYS A 148 15.700 9.321 -9.795 1.00 11.08 H new ATOM 0 HA LYS A 148 17.426 10.172 -11.751 1.00 12.08 H new ATOM 0 HB2 LYS A 148 16.474 7.431 -10.887 1.00 12.12 H new ATOM 0 HB3 LYS A 148 17.657 7.599 -12.169 1.00 12.12 H new ATOM 0 HG2 LYS A 148 19.122 8.895 -10.588 1.00 12.94 H new ATOM 0 HG3 LYS A 148 17.959 8.597 -9.313 1.00 12.94 H new ATOM 0 HD2 LYS A 148 18.234 6.111 -9.733 1.00 13.10 H new ATOM 0 HD3 LYS A 148 19.511 6.491 -10.871 1.00 13.10 H new ATOM 0 HE2 LYS A 148 20.708 7.727 -9.006 1.00 13.06 H new ATOM 0 HE3 LYS A 148 19.482 7.141 -7.899 1.00 13.06 H new ATOM 0 HZ1 LYS A 148 20.484 5.180 -7.775 1.00 13.68 H new ATOM 0 HZ2 LYS A 148 20.539 5.004 -9.463 1.00 13.68 H new ATOM 0 HZ3 LYS A 148 21.780 5.835 -8.655 1.00 13.68 H new TER 2293 LYS A 148 HETATM 2294 CA CA A 149 26.751 -1.620 0.908 1.00 20.82 CA HETATM 2295 CA CA A 150 22.494 9.464 4.652 1.00 19.22 CA HETATM 2296 CA CA A 151 -22.015 -2.465 7.530 1.00 0.33 CA