USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=28 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 146 SER OG : rot -24:sc= 0.12 USER MOD Set 1.2: A 147 GLN :FLIP amide:sc= 0 F(o=-0.72,f=0.12) USER MOD Set 2.1: A 41 GLN : amide:sc= -1.04 K(o=-1.3,f=-3.1) USER MOD Set 2.2: A 72 MET CE :methyl -153:sc= -0.265 (180deg=-2.85!) USER MOD Set 3.1: A 5 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 8 GLN : amide:sc= 0.021 K(o=0.021,f=-4.1!) USER MOD Single : A 2 SER OG : rot 39:sc= 0.0429 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.202 K(o=-0.2,f=-0.78) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -167:sc= -0.0334 (180deg=-0.21) USER MOD Single : A 29 THR OG1 : rot -19:sc= 0.239 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl -125:sc= -0.0686 (180deg=-0.231) USER MOD Single : A 38 THR OG1 : rot -23:sc= 0.34 USER MOD Single : A 42 ASN :FLIP amide:sc= -0.196 F(o=-2.9!,f=-0.2) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 57 ASN : amide:sc= -0.277 K(o=-0.28,f=-5.7!) USER MOD Single : A 58 ASN : amide:sc= -1.45! C(o=-1.4!,f=-1.7!) USER MOD Single : A 59 ASN : amide:sc= -0.914 K(o=-0.91,f=-2.1!) USER MOD Single : A 60 ASN : amide:sc= -0.218 X(o=-0.22,f=0) USER MOD Single : A 64 ASN : amide:sc= -2.01! C(o=-2!,f=-3.6!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 69 CYS SG : rot 71:sc= -0.375 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN :FLIP amide:sc= 0.0937 F(o=-2.4!,f=0.094) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot -56:sc= 0.366 USER MOD Single : A 85 MET CE :methyl 153:sc= -3.53 (180deg=-4.97!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot -68:sc= 0.155 USER MOD Single : A 109 MET CE :methyl -158:sc= -10.5! (180deg=-11.9!) USER MOD Single : A 111 ASN : amide:sc= -0.768 K(o=-0.77,f=-1.4) USER MOD Single : A 115 LYS NZ :NH3+ -162:sc= -0.074 (180deg=-0.448) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.0498 USER MOD Single : A 124 MET CE :methyl 137:sc= -0.855 (180deg=-1.91) USER MOD Single : A 135 MET CE :methyl -137:sc= -0.267 (180deg=-2.69!) USER MOD Single : A 137 ASN :FLIP amide:sc= -1.27 F(o=-5.4!,f=-1.3) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.346 USER MOD Single : A 144 MET CE :methyl 153:sc= -6! (180deg=-6.26!) USER MOD Single : A 148 LYS NZ :NH3+ 137:sc= 0.112 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 1.195 6.548 -2.376 1.00 3.85 N ATOM 2 CA SER A 2 2.498 7.043 -1.863 1.00 3.35 C ATOM 3 C SER A 2 2.545 6.973 -0.340 1.00 2.64 C ATOM 4 O SER A 2 3.322 6.209 0.233 1.00 3.12 O ATOM 5 CB SER A 2 2.734 8.483 -2.323 1.00 4.09 C ATOM 6 OG SER A 2 2.765 8.568 -3.738 1.00 4.89 O ATOM 0 HA SER A 2 3.285 6.404 -2.264 1.00 3.35 H new ATOM 0 HB2 SER A 2 1.945 9.126 -1.934 1.00 4.09 H new ATOM 0 HB3 SER A 2 3.675 8.850 -1.913 1.00 4.09 H new ATOM 0 HG SER A 2 2.082 7.976 -4.116 1.00 4.89 H new ATOM 12 N GLU A 3 1.709 7.777 0.310 1.00 1.91 N ATOM 13 CA GLU A 3 1.652 7.808 1.768 1.00 1.35 C ATOM 14 C GLU A 3 0.375 8.490 2.252 1.00 1.08 C ATOM 15 O GLU A 3 0.141 9.666 1.972 1.00 1.52 O ATOM 16 CB GLU A 3 2.882 8.526 2.330 1.00 1.52 C ATOM 17 CG GLU A 3 3.176 9.855 1.653 1.00 2.09 C ATOM 18 CD GLU A 3 4.428 10.521 2.192 1.00 2.74 C ATOM 19 OE1 GLU A 3 5.536 10.143 1.756 1.00 3.22 O ATOM 20 OE2 GLU A 3 4.301 11.421 3.048 1.00 3.26 O ATOM 0 H GLU A 3 1.061 8.416 -0.150 1.00 1.91 H new ATOM 0 HA GLU A 3 1.645 6.780 2.130 1.00 1.35 H new ATOM 0 HB2 GLU A 3 2.737 8.696 3.397 1.00 1.52 H new ATOM 0 HB3 GLU A 3 3.750 7.876 2.226 1.00 1.52 H new ATOM 0 HG2 GLU A 3 3.287 9.695 0.581 1.00 2.09 H new ATOM 0 HG3 GLU A 3 2.326 10.524 1.789 1.00 2.09 H new ATOM 27 N LEU A 4 -0.447 7.740 2.982 1.00 0.73 N ATOM 28 CA LEU A 4 -1.707 8.260 3.505 1.00 0.45 C ATOM 29 C LEU A 4 -1.464 9.398 4.494 1.00 0.47 C ATOM 30 O LEU A 4 -0.837 9.204 5.536 1.00 0.58 O ATOM 31 CB LEU A 4 -2.500 7.140 4.184 1.00 0.41 C ATOM 32 CG LEU A 4 -2.715 5.885 3.334 1.00 0.50 C ATOM 33 CD1 LEU A 4 -3.406 4.804 4.146 1.00 1.27 C ATOM 34 CD2 LEU A 4 -3.525 6.215 2.089 1.00 1.19 C ATOM 0 H LEU A 4 -0.262 6.767 3.225 1.00 0.73 H new ATOM 0 HA LEU A 4 -2.284 8.652 2.667 1.00 0.45 H new ATOM 0 HB2 LEU A 4 -1.983 6.855 5.100 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -3.474 7.532 4.477 1.00 0.41 H new ATOM 0 HG LEU A 4 -1.740 5.511 3.021 1.00 0.50 H new ATOM 0 HD11 LEU A 4 -3.551 3.919 3.526 1.00 1.27 H new ATOM 0 HD12 LEU A 4 -2.790 4.546 5.008 1.00 1.27 H new ATOM 0 HD13 LEU A 4 -4.374 5.169 4.489 1.00 1.27 H new ATOM 0 HD21 LEU A 4 -3.668 5.311 1.497 1.00 1.19 H new ATOM 0 HD22 LEU A 4 -4.496 6.614 2.382 1.00 1.19 H new ATOM 0 HD23 LEU A 4 -2.992 6.957 1.495 1.00 1.19 H new ATOM 46 N THR A 5 -1.965 10.585 4.159 1.00 0.47 N ATOM 47 CA THR A 5 -1.806 11.754 5.019 1.00 0.54 C ATOM 48 C THR A 5 -3.053 11.977 5.867 1.00 0.51 C ATOM 49 O THR A 5 -4.103 11.402 5.595 1.00 0.55 O ATOM 50 CB THR A 5 -1.532 13.027 4.196 1.00 0.62 C ATOM 51 OG1 THR A 5 -0.823 12.693 2.996 1.00 1.12 O ATOM 52 CG2 THR A 5 -0.722 14.035 4.998 1.00 0.99 C ATOM 0 H THR A 5 -2.484 10.762 3.299 1.00 0.47 H new ATOM 0 HA THR A 5 -0.951 11.558 5.666 1.00 0.54 H new ATOM 0 HB THR A 5 -2.492 13.476 3.943 1.00 0.62 H new ATOM 0 HG1 THR A 5 -0.654 13.508 2.478 1.00 1.12 H new ATOM 0 HG21 THR A 5 -0.544 14.923 4.392 1.00 0.99 H new ATOM 0 HG22 THR A 5 -1.274 14.313 5.896 1.00 0.99 H new ATOM 0 HG23 THR A 5 0.233 13.592 5.281 1.00 0.99 H new ATOM 60 N GLU A 6 -2.930 12.807 6.896 1.00 0.60 N ATOM 61 CA GLU A 6 -4.052 13.109 7.778 1.00 0.62 C ATOM 62 C GLU A 6 -5.287 13.544 6.986 1.00 0.55 C ATOM 63 O GLU A 6 -6.413 13.175 7.321 1.00 0.53 O ATOM 64 CB GLU A 6 -3.654 14.207 8.767 1.00 0.75 C ATOM 65 CG GLU A 6 -4.822 14.762 9.563 1.00 1.46 C ATOM 66 CD GLU A 6 -4.409 15.867 10.515 1.00 1.74 C ATOM 67 OE1 GLU A 6 -3.949 15.547 11.632 1.00 2.00 O ATOM 68 OE2 GLU A 6 -4.545 17.052 10.146 1.00 2.20 O ATOM 0 H GLU A 6 -2.062 13.284 7.141 1.00 0.60 H new ATOM 0 HA GLU A 6 -4.306 12.200 8.323 1.00 0.62 H new ATOM 0 HB2 GLU A 6 -2.911 13.810 9.458 1.00 0.75 H new ATOM 0 HB3 GLU A 6 -3.178 15.021 8.221 1.00 0.75 H new ATOM 0 HG2 GLU A 6 -5.576 15.144 8.875 1.00 1.46 H new ATOM 0 HG3 GLU A 6 -5.287 13.955 10.129 1.00 1.46 H new ATOM 75 N GLU A 7 -5.066 14.324 5.933 1.00 0.58 N ATOM 76 CA GLU A 7 -6.156 14.820 5.100 1.00 0.58 C ATOM 77 C GLU A 7 -6.749 13.703 4.252 1.00 0.48 C ATOM 78 O GLU A 7 -7.969 13.549 4.172 1.00 0.46 O ATOM 79 CB GLU A 7 -5.661 15.954 4.197 1.00 0.69 C ATOM 80 CG GLU A 7 -4.520 15.554 3.274 1.00 0.69 C ATOM 81 CD GLU A 7 -4.081 16.687 2.366 1.00 1.02 C ATOM 82 OE1 GLU A 7 -3.208 17.476 2.784 1.00 1.35 O ATOM 83 OE2 GLU A 7 -4.613 16.787 1.241 1.00 1.19 O ATOM 0 H GLU A 7 -4.139 14.627 5.635 1.00 0.58 H new ATOM 0 HA GLU A 7 -6.936 15.202 5.759 1.00 0.58 H new ATOM 0 HB2 GLU A 7 -6.494 16.315 3.594 1.00 0.69 H new ATOM 0 HB3 GLU A 7 -5.336 16.786 4.821 1.00 0.69 H new ATOM 0 HG2 GLU A 7 -3.671 15.224 3.873 1.00 0.69 H new ATOM 0 HG3 GLU A 7 -4.830 14.705 2.665 1.00 0.69 H new ATOM 90 N GLN A 8 -5.877 12.930 3.622 1.00 0.44 N ATOM 91 CA GLN A 8 -6.299 11.827 2.774 1.00 0.37 C ATOM 92 C GLN A 8 -7.086 10.796 3.573 1.00 0.31 C ATOM 93 O GLN A 8 -8.108 10.288 3.114 1.00 0.29 O ATOM 94 CB GLN A 8 -5.079 11.174 2.133 1.00 0.40 C ATOM 95 CG GLN A 8 -4.362 12.075 1.144 1.00 0.48 C ATOM 96 CD GLN A 8 -3.180 11.389 0.484 1.00 1.35 C ATOM 97 OE1 GLN A 8 -2.525 10.540 1.087 1.00 2.22 O ATOM 98 NE2 GLN A 8 -2.907 11.752 -0.763 1.00 1.68 N ATOM 0 H GLN A 8 -4.866 13.048 3.683 1.00 0.44 H new ATOM 0 HA GLN A 8 -6.950 12.220 1.993 1.00 0.37 H new ATOM 0 HB2 GLN A 8 -4.381 10.879 2.916 1.00 0.40 H new ATOM 0 HB3 GLN A 8 -5.390 10.262 1.623 1.00 0.40 H new ATOM 0 HG2 GLN A 8 -5.065 12.399 0.377 1.00 0.48 H new ATOM 0 HG3 GLN A 8 -4.017 12.972 1.659 1.00 0.48 H new ATOM 0 HE21 GLN A 8 -3.477 12.461 -1.224 1.00 1.68 H new ATOM 0 HE22 GLN A 8 -2.127 11.322 -1.260 1.00 1.68 H new ATOM 107 N ILE A 9 -6.601 10.497 4.774 1.00 0.33 N ATOM 108 CA ILE A 9 -7.253 9.528 5.643 1.00 0.33 C ATOM 109 C ILE A 9 -8.678 9.954 5.957 1.00 0.34 C ATOM 110 O ILE A 9 -9.617 9.185 5.774 1.00 0.36 O ATOM 111 CB ILE A 9 -6.472 9.329 6.960 1.00 0.42 C ATOM 112 CG1 ILE A 9 -5.116 8.678 6.672 1.00 0.44 C ATOM 113 CG2 ILE A 9 -7.279 8.484 7.939 1.00 0.51 C ATOM 114 CD1 ILE A 9 -4.243 8.516 7.897 1.00 0.54 C ATOM 0 H ILE A 9 -5.757 10.914 5.167 1.00 0.33 H new ATOM 0 HA ILE A 9 -7.272 8.580 5.106 1.00 0.33 H new ATOM 0 HB ILE A 9 -6.300 10.304 7.417 1.00 0.42 H new ATOM 0 HG12 ILE A 9 -5.282 7.698 6.224 1.00 0.44 H new ATOM 0 HG13 ILE A 9 -4.584 9.280 5.935 1.00 0.44 H new ATOM 0 HG21 ILE A 9 -6.712 8.355 8.861 1.00 0.51 H new ATOM 0 HG22 ILE A 9 -8.222 8.984 8.160 1.00 0.51 H new ATOM 0 HG23 ILE A 9 -7.481 7.508 7.497 1.00 0.51 H new ATOM 0 HD11 ILE A 9 -3.300 8.048 7.613 1.00 0.54 H new ATOM 0 HD12 ILE A 9 -4.045 9.494 8.335 1.00 0.54 H new ATOM 0 HD13 ILE A 9 -4.754 7.889 8.627 1.00 0.54 H new ATOM 126 N ALA A 10 -8.830 11.186 6.418 1.00 0.36 N ATOM 127 CA ALA A 10 -10.139 11.719 6.764 1.00 0.40 C ATOM 128 C ALA A 10 -11.074 11.746 5.556 1.00 0.35 C ATOM 129 O ALA A 10 -12.295 11.667 5.704 1.00 0.36 O ATOM 130 CB ALA A 10 -9.985 13.117 7.346 1.00 0.50 C ATOM 0 H ALA A 10 -8.059 11.838 6.562 1.00 0.36 H new ATOM 0 HA ALA A 10 -10.587 11.062 7.509 1.00 0.40 H new ATOM 0 HB1 ALA A 10 -10.967 13.514 7.604 1.00 0.50 H new ATOM 0 HB2 ALA A 10 -9.365 13.072 8.241 1.00 0.50 H new ATOM 0 HB3 ALA A 10 -9.513 13.768 6.610 1.00 0.50 H new ATOM 136 N GLU A 11 -10.496 11.840 4.362 1.00 0.33 N ATOM 137 CA GLU A 11 -11.286 11.900 3.135 1.00 0.33 C ATOM 138 C GLU A 11 -11.981 10.572 2.831 1.00 0.27 C ATOM 139 O GLU A 11 -13.208 10.523 2.706 1.00 0.28 O ATOM 140 CB GLU A 11 -10.395 12.302 1.957 1.00 0.37 C ATOM 141 CG GLU A 11 -11.154 12.482 0.651 1.00 0.41 C ATOM 142 CD GLU A 11 -12.197 13.578 0.730 1.00 1.27 C ATOM 143 OE1 GLU A 11 -11.840 14.756 0.520 1.00 1.19 O ATOM 144 OE2 GLU A 11 -13.375 13.258 1.004 1.00 2.27 O ATOM 0 H GLU A 11 -9.487 11.876 4.217 1.00 0.33 H new ATOM 0 HA GLU A 11 -12.062 12.651 3.284 1.00 0.33 H new ATOM 0 HB2 GLU A 11 -9.883 13.233 2.201 1.00 0.37 H new ATOM 0 HB3 GLU A 11 -9.626 11.542 1.818 1.00 0.37 H new ATOM 0 HG2 GLU A 11 -10.448 12.714 -0.146 1.00 0.41 H new ATOM 0 HG3 GLU A 11 -11.639 11.543 0.384 1.00 0.41 H new ATOM 151 N PHE A 12 -11.209 9.492 2.725 1.00 0.23 N ATOM 152 CA PHE A 12 -11.795 8.191 2.427 1.00 0.22 C ATOM 153 C PHE A 12 -12.438 7.587 3.669 1.00 0.19 C ATOM 154 O PHE A 12 -13.345 6.763 3.564 1.00 0.20 O ATOM 155 CB PHE A 12 -10.763 7.231 1.818 1.00 0.26 C ATOM 156 CG PHE A 12 -9.600 6.899 2.709 1.00 0.25 C ATOM 157 CD1 PHE A 12 -9.771 6.115 3.839 1.00 0.31 C ATOM 158 CD2 PHE A 12 -8.331 7.363 2.407 1.00 0.27 C ATOM 159 CE1 PHE A 12 -8.701 5.804 4.651 1.00 0.37 C ATOM 160 CE2 PHE A 12 -7.256 7.055 3.215 1.00 0.30 C ATOM 161 CZ PHE A 12 -7.442 6.275 4.340 1.00 0.35 C ATOM 0 H PHE A 12 -10.195 9.492 2.839 1.00 0.23 H new ATOM 0 HA PHE A 12 -12.575 8.346 1.682 1.00 0.22 H new ATOM 0 HB2 PHE A 12 -11.268 6.304 1.545 1.00 0.26 H new ATOM 0 HB3 PHE A 12 -10.381 7.669 0.896 1.00 0.26 H new ATOM 0 HD1 PHE A 12 -10.754 5.743 4.087 1.00 0.31 H new ATOM 0 HD2 PHE A 12 -8.181 7.973 1.529 1.00 0.27 H new ATOM 0 HE1 PHE A 12 -8.848 5.193 5.529 1.00 0.37 H new ATOM 0 HE2 PHE A 12 -6.271 7.423 2.969 1.00 0.30 H new ATOM 0 HZ PHE A 12 -6.603 6.034 4.975 1.00 0.35 H new ATOM 171 N LYS A 13 -11.964 7.994 4.845 1.00 0.19 N ATOM 172 CA LYS A 13 -12.526 7.501 6.096 1.00 0.22 C ATOM 173 C LYS A 13 -13.970 7.965 6.206 1.00 0.21 C ATOM 174 O LYS A 13 -14.822 7.265 6.756 1.00 0.23 O ATOM 175 CB LYS A 13 -11.701 7.983 7.296 1.00 0.28 C ATOM 176 CG LYS A 13 -12.417 7.853 8.634 1.00 0.32 C ATOM 177 CD LYS A 13 -12.544 6.398 9.063 1.00 0.33 C ATOM 178 CE LYS A 13 -13.376 6.258 10.329 1.00 0.48 C ATOM 179 NZ LYS A 13 -13.321 4.876 10.880 1.00 1.23 N ATOM 0 H LYS A 13 -11.198 8.659 4.956 1.00 0.19 H new ATOM 0 HA LYS A 13 -12.496 6.411 6.100 1.00 0.22 H new ATOM 0 HB2 LYS A 13 -10.772 7.415 7.336 1.00 0.28 H new ATOM 0 HB3 LYS A 13 -11.430 9.027 7.141 1.00 0.28 H new ATOM 0 HG2 LYS A 13 -11.871 8.411 9.395 1.00 0.32 H new ATOM 0 HG3 LYS A 13 -13.409 8.299 8.561 1.00 0.32 H new ATOM 0 HD2 LYS A 13 -13.002 5.820 8.260 1.00 0.33 H new ATOM 0 HD3 LYS A 13 -11.552 5.980 9.231 1.00 0.33 H new ATOM 0 HE2 LYS A 13 -13.017 6.962 11.079 1.00 0.48 H new ATOM 0 HE3 LYS A 13 -14.411 6.522 10.114 1.00 0.48 H new ATOM 0 HZ1 LYS A 13 -13.901 4.823 11.742 1.00 1.23 H new ATOM 0 HZ2 LYS A 13 -13.688 4.206 10.174 1.00 1.23 H new ATOM 0 HZ3 LYS A 13 -12.336 4.633 11.109 1.00 1.23 H new ATOM 193 N ASP A 14 -14.235 9.160 5.684 1.00 0.23 N ATOM 194 CA ASP A 14 -15.585 9.700 5.678 1.00 0.25 C ATOM 195 C ASP A 14 -16.426 8.900 4.694 1.00 0.22 C ATOM 196 O ASP A 14 -17.526 8.445 5.011 1.00 0.23 O ATOM 197 CB ASP A 14 -15.569 11.178 5.283 1.00 0.31 C ATOM 198 CG ASP A 14 -16.942 11.814 5.377 1.00 0.37 C ATOM 199 OD1 ASP A 14 -17.309 12.274 6.479 1.00 0.44 O ATOM 200 OD2 ASP A 14 -17.651 11.852 4.349 1.00 0.41 O ATOM 0 H ASP A 14 -13.533 9.768 5.262 1.00 0.23 H new ATOM 0 HA ASP A 14 -16.014 9.624 6.677 1.00 0.25 H new ATOM 0 HB2 ASP A 14 -14.876 11.717 5.929 1.00 0.31 H new ATOM 0 HB3 ASP A 14 -15.195 11.275 4.264 1.00 0.31 H new ATOM 205 N ALA A 15 -15.881 8.724 3.493 1.00 0.22 N ATOM 206 CA ALA A 15 -16.551 7.957 2.454 1.00 0.24 C ATOM 207 C ALA A 15 -16.725 6.506 2.894 1.00 0.22 C ATOM 208 O ALA A 15 -17.483 5.749 2.291 1.00 0.29 O ATOM 209 CB ALA A 15 -15.763 8.028 1.155 1.00 0.27 C ATOM 0 H ALA A 15 -14.975 9.104 3.218 1.00 0.22 H new ATOM 0 HA ALA A 15 -17.538 8.387 2.285 1.00 0.24 H new ATOM 0 HB1 ALA A 15 -16.276 7.450 0.386 1.00 0.27 H new ATOM 0 HB2 ALA A 15 -15.683 9.067 0.835 1.00 0.27 H new ATOM 0 HB3 ALA A 15 -14.765 7.618 1.312 1.00 0.27 H new ATOM 215 N PHE A 16 -16.011 6.132 3.954 1.00 0.20 N ATOM 216 CA PHE A 16 -16.062 4.775 4.487 1.00 0.22 C ATOM 217 C PHE A 16 -17.299 4.575 5.354 1.00 0.22 C ATOM 218 O PHE A 16 -18.084 3.655 5.129 1.00 0.25 O ATOM 219 CB PHE A 16 -14.790 4.486 5.295 1.00 0.26 C ATOM 220 CG PHE A 16 -14.893 3.288 6.201 1.00 0.31 C ATOM 221 CD1 PHE A 16 -14.662 2.011 5.711 1.00 0.38 C ATOM 222 CD2 PHE A 16 -15.224 3.438 7.538 1.00 0.37 C ATOM 223 CE1 PHE A 16 -14.757 0.908 6.537 1.00 0.46 C ATOM 224 CE2 PHE A 16 -15.324 2.337 8.369 1.00 0.45 C ATOM 225 CZ PHE A 16 -15.075 1.080 7.881 1.00 0.48 C ATOM 0 H PHE A 16 -15.386 6.757 4.463 1.00 0.20 H new ATOM 0 HA PHE A 16 -16.122 4.077 3.652 1.00 0.22 H new ATOM 0 HB2 PHE A 16 -13.961 4.335 4.604 1.00 0.26 H new ATOM 0 HB3 PHE A 16 -14.548 5.362 5.896 1.00 0.26 H new ATOM 0 HD1 PHE A 16 -14.405 1.878 4.671 1.00 0.38 H new ATOM 0 HD2 PHE A 16 -15.406 4.426 7.936 1.00 0.37 H new ATOM 0 HE1 PHE A 16 -14.585 -0.082 6.142 1.00 0.46 H new ATOM 0 HE2 PHE A 16 -15.599 2.468 9.405 1.00 0.45 H new ATOM 0 HZ PHE A 16 -15.126 0.225 8.539 1.00 0.48 H new ATOM 235 N VAL A 17 -17.473 5.444 6.343 1.00 0.22 N ATOM 236 CA VAL A 17 -18.616 5.353 7.239 1.00 0.23 C ATOM 237 C VAL A 17 -19.911 5.531 6.463 1.00 0.23 C ATOM 238 O VAL A 17 -20.979 5.098 6.899 1.00 0.26 O ATOM 239 CB VAL A 17 -18.545 6.405 8.361 1.00 0.30 C ATOM 240 CG1 VAL A 17 -17.430 6.068 9.339 1.00 1.11 C ATOM 241 CG2 VAL A 17 -18.352 7.797 7.781 1.00 0.91 C ATOM 0 H VAL A 17 -16.838 6.217 6.543 1.00 0.22 H new ATOM 0 HA VAL A 17 -18.593 4.363 7.695 1.00 0.23 H new ATOM 0 HB VAL A 17 -19.490 6.392 8.904 1.00 0.30 H new ATOM 0 HG11 VAL A 17 -17.395 6.822 10.125 1.00 1.11 H new ATOM 0 HG12 VAL A 17 -17.618 5.090 9.783 1.00 1.11 H new ATOM 0 HG13 VAL A 17 -16.476 6.049 8.811 1.00 1.11 H new ATOM 0 HG21 VAL A 17 -18.304 8.525 8.591 1.00 0.91 H new ATOM 0 HG22 VAL A 17 -17.424 7.828 7.210 1.00 0.91 H new ATOM 0 HG23 VAL A 17 -19.189 8.037 7.126 1.00 0.91 H new ATOM 251 N GLN A 18 -19.804 6.176 5.308 1.00 0.24 N ATOM 252 CA GLN A 18 -20.956 6.414 4.452 1.00 0.29 C ATOM 253 C GLN A 18 -21.594 5.102 3.991 1.00 0.32 C ATOM 254 O GLN A 18 -22.808 5.032 3.800 1.00 0.43 O ATOM 255 CB GLN A 18 -20.543 7.250 3.243 1.00 0.33 C ATOM 256 CG GLN A 18 -20.332 8.721 3.563 1.00 0.34 C ATOM 257 CD GLN A 18 -21.601 9.400 4.043 1.00 1.09 C ATOM 258 OE1 GLN A 18 -22.706 9.028 3.647 1.00 1.54 O ATOM 259 NE2 GLN A 18 -21.448 10.400 4.903 1.00 1.60 N ATOM 0 H GLN A 18 -18.926 6.545 4.943 1.00 0.24 H new ATOM 0 HA GLN A 18 -21.699 6.959 5.033 1.00 0.29 H new ATOM 0 HB2 GLN A 18 -19.622 6.842 2.827 1.00 0.33 H new ATOM 0 HB3 GLN A 18 -21.308 7.161 2.472 1.00 0.33 H new ATOM 0 HG2 GLN A 18 -19.561 8.816 4.328 1.00 0.34 H new ATOM 0 HG3 GLN A 18 -19.964 9.233 2.674 1.00 0.34 H new ATOM 0 HE21 GLN A 18 -20.513 10.675 5.204 1.00 1.60 H new ATOM 0 HE22 GLN A 18 -22.265 10.893 5.262 1.00 1.60 H new ATOM 268 N PHE A 19 -20.777 4.064 3.813 1.00 0.28 N ATOM 269 CA PHE A 19 -21.286 2.766 3.370 1.00 0.33 C ATOM 270 C PHE A 19 -21.399 1.782 4.528 1.00 0.35 C ATOM 271 O PHE A 19 -21.194 0.580 4.355 1.00 0.64 O ATOM 272 CB PHE A 19 -20.396 2.176 2.272 1.00 0.36 C ATOM 273 CG PHE A 19 -20.355 3.013 1.026 1.00 0.37 C ATOM 274 CD1 PHE A 19 -21.347 2.897 0.066 1.00 0.48 C ATOM 275 CD2 PHE A 19 -19.328 3.917 0.816 1.00 0.41 C ATOM 276 CE1 PHE A 19 -21.315 3.668 -1.082 1.00 0.54 C ATOM 277 CE2 PHE A 19 -19.290 4.691 -0.329 1.00 0.44 C ATOM 278 CZ PHE A 19 -20.285 4.566 -1.278 1.00 0.47 C ATOM 0 H PHE A 19 -19.769 4.095 3.967 1.00 0.28 H new ATOM 0 HA PHE A 19 -22.284 2.934 2.966 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.383 2.061 2.658 1.00 0.36 H new ATOM 0 HB3 PHE A 19 -20.756 1.179 2.019 1.00 0.36 H new ATOM 0 HD1 PHE A 19 -22.155 2.196 0.216 1.00 0.48 H new ATOM 0 HD2 PHE A 19 -18.547 4.019 1.555 1.00 0.41 H new ATOM 0 HE1 PHE A 19 -22.094 3.568 -1.823 1.00 0.54 H new ATOM 0 HE2 PHE A 19 -18.483 5.393 -0.481 1.00 0.44 H new ATOM 0 HZ PHE A 19 -20.258 5.170 -2.173 1.00 0.47 H new ATOM 288 N ASP A 20 -21.723 2.295 5.710 1.00 0.29 N ATOM 289 CA ASP A 20 -21.875 1.451 6.889 1.00 0.28 C ATOM 290 C ASP A 20 -23.241 1.672 7.529 1.00 0.37 C ATOM 291 O ASP A 20 -23.359 2.332 8.561 1.00 0.44 O ATOM 292 CB ASP A 20 -20.766 1.728 7.904 1.00 0.25 C ATOM 293 CG ASP A 20 -20.860 0.815 9.111 1.00 0.27 C ATOM 294 OD1 ASP A 20 -20.850 -0.421 8.923 1.00 0.29 O ATOM 295 OD2 ASP A 20 -20.945 1.335 10.244 1.00 0.33 O ATOM 0 H ASP A 20 -21.885 3.288 5.877 1.00 0.29 H new ATOM 0 HA ASP A 20 -21.799 0.411 6.573 1.00 0.28 H new ATOM 0 HB2 ASP A 20 -19.795 1.597 7.425 1.00 0.25 H new ATOM 0 HB3 ASP A 20 -20.824 2.767 8.230 1.00 0.25 H new ATOM 300 N LYS A 21 -24.271 1.116 6.901 1.00 0.47 N ATOM 301 CA LYS A 21 -25.622 1.236 7.374 1.00 0.59 C ATOM 302 C LYS A 21 -25.945 0.139 8.386 1.00 0.64 C ATOM 303 O LYS A 21 -26.707 0.355 9.329 1.00 0.83 O ATOM 304 CB LYS A 21 -26.548 1.149 6.174 1.00 0.68 C ATOM 305 CG LYS A 21 -27.967 0.931 6.565 1.00 1.02 C ATOM 306 CD LYS A 21 -28.603 2.190 7.126 1.00 1.14 C ATOM 307 CE LYS A 21 -29.942 1.886 7.769 1.00 1.67 C ATOM 308 NZ LYS A 21 -30.544 3.090 8.404 1.00 2.10 N ATOM 0 H LYS A 21 -24.179 0.569 6.045 1.00 0.47 H new ATOM 0 HA LYS A 21 -25.754 2.191 7.882 1.00 0.59 H new ATOM 0 HB2 LYS A 21 -26.472 2.068 5.593 1.00 0.68 H new ATOM 0 HB3 LYS A 21 -26.223 0.334 5.527 1.00 0.68 H new ATOM 0 HG2 LYS A 21 -28.534 0.594 5.697 1.00 1.02 H new ATOM 0 HG3 LYS A 21 -28.020 0.136 7.309 1.00 1.02 H new ATOM 0 HD2 LYS A 21 -27.937 2.641 7.862 1.00 1.14 H new ATOM 0 HD3 LYS A 21 -28.737 2.920 6.328 1.00 1.14 H new ATOM 0 HE2 LYS A 21 -30.625 1.494 7.015 1.00 1.67 H new ATOM 0 HE3 LYS A 21 -29.815 1.106 8.520 1.00 1.67 H new ATOM 0 HZ1 LYS A 21 -31.458 2.837 8.831 1.00 2.10 H new ATOM 0 HZ2 LYS A 21 -29.905 3.450 9.141 1.00 2.10 H new ATOM 0 HZ3 LYS A 21 -30.690 3.826 7.684 1.00 2.10 H new ATOM 322 N GLU A 22 -25.359 -1.035 8.182 1.00 0.58 N ATOM 323 CA GLU A 22 -25.590 -2.170 9.068 1.00 0.63 C ATOM 324 C GLU A 22 -25.093 -1.882 10.483 1.00 0.60 C ATOM 325 O GLU A 22 -25.447 -2.585 11.429 1.00 0.80 O ATOM 326 CB GLU A 22 -24.904 -3.417 8.508 1.00 0.62 C ATOM 327 CG GLU A 22 -25.337 -3.753 7.090 1.00 0.71 C ATOM 328 CD GLU A 22 -24.673 -5.007 6.557 1.00 0.98 C ATOM 329 OE1 GLU A 22 -25.208 -6.110 6.797 1.00 0.96 O ATOM 330 OE2 GLU A 22 -23.619 -4.887 5.899 1.00 1.80 O ATOM 0 H GLU A 22 -24.720 -1.226 7.410 1.00 0.58 H new ATOM 0 HA GLU A 22 -26.665 -2.345 9.122 1.00 0.63 H new ATOM 0 HB2 GLU A 22 -23.824 -3.269 8.526 1.00 0.62 H new ATOM 0 HB3 GLU A 22 -25.120 -4.265 9.158 1.00 0.62 H new ATOM 0 HG2 GLU A 22 -26.419 -3.882 7.066 1.00 0.71 H new ATOM 0 HG3 GLU A 22 -25.101 -2.915 6.434 1.00 0.71 H new ATOM 337 N GLY A 23 -24.270 -0.845 10.618 1.00 0.45 N ATOM 338 CA GLY A 23 -23.745 -0.476 11.921 1.00 0.46 C ATOM 339 C GLY A 23 -22.648 -1.408 12.399 1.00 0.39 C ATOM 340 O GLY A 23 -22.239 -1.349 13.559 1.00 0.45 O ATOM 0 H GLY A 23 -23.958 -0.254 9.848 1.00 0.45 H new ATOM 0 HA2 GLY A 23 -23.357 0.542 11.876 1.00 0.46 H new ATOM 0 HA3 GLY A 23 -24.557 -0.476 12.648 1.00 0.46 H new ATOM 344 N THR A 24 -22.170 -2.269 11.506 1.00 0.34 N ATOM 345 CA THR A 24 -21.113 -3.216 11.846 1.00 0.30 C ATOM 346 C THR A 24 -19.732 -2.595 11.653 1.00 0.28 C ATOM 347 O THR A 24 -18.725 -3.303 11.617 1.00 0.29 O ATOM 348 CB THR A 24 -21.211 -4.497 10.996 1.00 0.32 C ATOM 349 OG1 THR A 24 -21.363 -4.160 9.612 1.00 0.33 O ATOM 350 CG2 THR A 24 -22.384 -5.356 11.444 1.00 0.40 C ATOM 0 H THR A 24 -22.497 -2.331 10.542 1.00 0.34 H new ATOM 0 HA THR A 24 -21.248 -3.474 12.896 1.00 0.30 H new ATOM 0 HB THR A 24 -20.291 -5.065 11.132 1.00 0.32 H new ATOM 0 HG21 THR A 24 -22.433 -6.255 10.829 1.00 0.40 H new ATOM 0 HG22 THR A 24 -22.251 -5.638 12.488 1.00 0.40 H new ATOM 0 HG23 THR A 24 -23.310 -4.792 11.336 1.00 0.40 H new ATOM 358 N GLY A 25 -19.693 -1.268 11.533 1.00 0.30 N ATOM 359 CA GLY A 25 -18.431 -0.574 11.341 1.00 0.32 C ATOM 360 C GLY A 25 -17.644 -1.129 10.173 1.00 0.28 C ATOM 361 O GLY A 25 -16.418 -1.034 10.138 1.00 0.33 O ATOM 0 H GLY A 25 -20.513 -0.663 11.566 1.00 0.30 H new ATOM 0 HA2 GLY A 25 -18.623 0.486 11.176 1.00 0.32 H new ATOM 0 HA3 GLY A 25 -17.834 -0.652 12.249 1.00 0.32 H new ATOM 365 N LYS A 26 -18.358 -1.709 9.216 1.00 0.22 N ATOM 366 CA LYS A 26 -17.733 -2.293 8.038 1.00 0.19 C ATOM 367 C LYS A 26 -18.480 -1.897 6.768 1.00 0.20 C ATOM 368 O LYS A 26 -19.662 -1.555 6.812 1.00 0.23 O ATOM 369 CB LYS A 26 -17.678 -3.816 8.170 1.00 0.20 C ATOM 370 CG LYS A 26 -16.579 -4.302 9.103 1.00 0.25 C ATOM 371 CD LYS A 26 -16.161 -5.731 8.786 1.00 0.62 C ATOM 372 CE LYS A 26 -17.288 -6.716 9.030 1.00 0.62 C ATOM 373 NZ LYS A 26 -17.702 -6.748 10.460 1.00 1.10 N ATOM 0 H LYS A 26 -19.375 -1.787 9.234 1.00 0.22 H new ATOM 0 HA LYS A 26 -16.716 -1.907 7.965 1.00 0.19 H new ATOM 0 HB2 LYS A 26 -18.640 -4.177 8.535 1.00 0.20 H new ATOM 0 HB3 LYS A 26 -17.527 -4.254 7.183 1.00 0.20 H new ATOM 0 HG2 LYS A 26 -15.714 -3.643 9.021 1.00 0.25 H new ATOM 0 HG3 LYS A 26 -16.926 -4.245 10.135 1.00 0.25 H new ATOM 0 HD2 LYS A 26 -15.842 -5.794 7.745 1.00 0.62 H new ATOM 0 HD3 LYS A 26 -15.302 -6.003 9.399 1.00 0.62 H new ATOM 0 HE2 LYS A 26 -18.144 -6.448 8.411 1.00 0.62 H new ATOM 0 HE3 LYS A 26 -16.971 -7.712 8.722 1.00 0.62 H new ATOM 0 HZ1 LYS A 26 -18.309 -7.576 10.627 1.00 1.10 H new ATOM 0 HZ2 LYS A 26 -16.858 -6.810 11.064 1.00 1.10 H new ATOM 0 HZ3 LYS A 26 -18.228 -5.881 10.688 1.00 1.10 H new ATOM 387 N ILE A 27 -17.782 -1.941 5.637 1.00 0.22 N ATOM 388 CA ILE A 27 -18.375 -1.580 4.354 1.00 0.26 C ATOM 389 C ILE A 27 -18.463 -2.784 3.421 1.00 0.24 C ATOM 390 O ILE A 27 -17.471 -3.469 3.171 1.00 0.25 O ATOM 391 CB ILE A 27 -17.565 -0.473 3.659 1.00 0.34 C ATOM 392 CG1 ILE A 27 -16.087 -0.859 3.593 1.00 0.40 C ATOM 393 CG2 ILE A 27 -17.742 0.847 4.391 1.00 0.33 C ATOM 394 CD1 ILE A 27 -15.263 0.046 2.708 1.00 0.50 C ATOM 0 H ILE A 27 -16.803 -2.224 5.583 1.00 0.22 H new ATOM 0 HA ILE A 27 -19.381 -1.216 4.565 1.00 0.26 H new ATOM 0 HB ILE A 27 -17.935 -0.354 2.641 1.00 0.34 H new ATOM 0 HG12 ILE A 27 -15.671 -0.844 4.600 1.00 0.40 H new ATOM 0 HG13 ILE A 27 -16.004 -1.883 3.229 1.00 0.40 H new ATOM 0 HG21 ILE A 27 -17.163 1.622 3.889 1.00 0.33 H new ATOM 0 HG22 ILE A 27 -18.796 1.124 4.392 1.00 0.33 H new ATOM 0 HG23 ILE A 27 -17.394 0.743 5.419 1.00 0.33 H new ATOM 0 HD11 ILE A 27 -14.226 -0.289 2.710 1.00 0.50 H new ATOM 0 HD12 ILE A 27 -15.653 0.013 1.691 1.00 0.50 H new ATOM 0 HD13 ILE A 27 -15.315 1.068 3.084 1.00 0.50 H new ATOM 406 N ALA A 28 -19.667 -3.042 2.919 1.00 0.26 N ATOM 407 CA ALA A 28 -19.901 -4.157 2.008 1.00 0.26 C ATOM 408 C ALA A 28 -18.963 -4.095 0.808 1.00 0.23 C ATOM 409 O ALA A 28 -18.727 -3.026 0.245 1.00 0.25 O ATOM 410 CB ALA A 28 -21.350 -4.161 1.545 1.00 0.30 C ATOM 0 H ALA A 28 -20.499 -2.491 3.129 1.00 0.26 H new ATOM 0 HA ALA A 28 -19.697 -5.082 2.547 1.00 0.26 H new ATOM 0 HB1 ALA A 28 -21.513 -4.998 0.866 1.00 0.30 H new ATOM 0 HB2 ALA A 28 -22.008 -4.262 2.408 1.00 0.30 H new ATOM 0 HB3 ALA A 28 -21.570 -3.226 1.029 1.00 0.30 H new ATOM 416 N THR A 29 -18.433 -5.252 0.420 1.00 0.27 N ATOM 417 CA THR A 29 -17.517 -5.337 -0.712 1.00 0.30 C ATOM 418 C THR A 29 -18.231 -5.047 -2.028 1.00 0.29 C ATOM 419 O THR A 29 -17.593 -4.904 -3.071 1.00 0.39 O ATOM 420 CB THR A 29 -16.855 -6.725 -0.792 1.00 0.37 C ATOM 421 OG1 THR A 29 -15.956 -6.776 -1.907 1.00 1.03 O ATOM 422 CG2 THR A 29 -17.903 -7.819 -0.931 1.00 0.96 C ATOM 0 H THR A 29 -18.623 -6.145 0.875 1.00 0.27 H new ATOM 0 HA THR A 29 -16.747 -4.582 -0.552 1.00 0.30 H new ATOM 0 HB THR A 29 -16.300 -6.891 0.131 1.00 0.37 H new ATOM 0 HG1 THR A 29 -16.179 -6.061 -2.540 1.00 1.03 H new ATOM 0 HG21 THR A 29 -17.410 -8.790 -0.986 1.00 0.96 H new ATOM 0 HG22 THR A 29 -18.568 -7.798 -0.068 1.00 0.96 H new ATOM 0 HG23 THR A 29 -18.482 -7.655 -1.840 1.00 0.96 H new ATOM 430 N ARG A 30 -19.557 -4.964 -1.972 1.00 0.25 N ATOM 431 CA ARG A 30 -20.356 -4.689 -3.161 1.00 0.29 C ATOM 432 C ARG A 30 -20.493 -3.187 -3.382 1.00 0.28 C ATOM 433 O ARG A 30 -20.904 -2.741 -4.454 1.00 0.44 O ATOM 434 CB ARG A 30 -21.739 -5.330 -3.037 1.00 0.35 C ATOM 435 CG ARG A 30 -21.704 -6.847 -2.931 1.00 0.43 C ATOM 436 CD ARG A 30 -21.459 -7.304 -1.501 1.00 0.83 C ATOM 437 NE ARG A 30 -22.550 -6.917 -0.610 1.00 1.56 N ATOM 438 CZ ARG A 30 -22.848 -7.561 0.515 1.00 2.17 C ATOM 439 NH1 ARG A 30 -22.136 -8.613 0.893 1.00 2.25 N ATOM 440 NH2 ARG A 30 -23.863 -7.151 1.265 1.00 3.08 N ATOM 0 H ARG A 30 -20.100 -5.083 -1.117 1.00 0.25 H new ATOM 0 HA ARG A 30 -19.845 -5.121 -4.021 1.00 0.29 H new ATOM 0 HB2 ARG A 30 -22.240 -4.925 -2.158 1.00 0.35 H new ATOM 0 HB3 ARG A 30 -22.339 -5.049 -3.903 1.00 0.35 H new ATOM 0 HG2 ARG A 30 -22.648 -7.259 -3.288 1.00 0.43 H new ATOM 0 HG3 ARG A 30 -20.920 -7.239 -3.578 1.00 0.43 H new ATOM 0 HD2 ARG A 30 -21.342 -8.387 -1.481 1.00 0.83 H new ATOM 0 HD3 ARG A 30 -20.525 -6.875 -1.138 1.00 0.83 H new ATOM 0 HE ARG A 30 -23.115 -6.107 -0.865 1.00 1.56 H new ATOM 0 HH11 ARG A 30 -21.355 -8.933 0.320 1.00 2.25 H new ATOM 0 HH12 ARG A 30 -22.369 -9.103 1.757 1.00 2.25 H new ATOM 0 HH21 ARG A 30 -24.415 -6.342 0.979 1.00 3.08 H new ATOM 0 HH22 ARG A 30 -24.092 -7.645 2.128 1.00 3.08 H new ATOM 454 N GLU A 31 -20.149 -2.412 -2.359 1.00 0.22 N ATOM 455 CA GLU A 31 -20.226 -0.957 -2.435 1.00 0.23 C ATOM 456 C GLU A 31 -18.832 -0.349 -2.506 1.00 0.21 C ATOM 457 O GLU A 31 -18.679 0.870 -2.579 1.00 0.21 O ATOM 458 CB GLU A 31 -20.977 -0.402 -1.225 1.00 0.30 C ATOM 459 CG GLU A 31 -22.356 -1.013 -1.034 1.00 0.32 C ATOM 460 CD GLU A 31 -23.116 -0.391 0.121 1.00 1.30 C ATOM 461 OE1 GLU A 31 -22.966 -0.877 1.261 1.00 2.26 O ATOM 462 OE2 GLU A 31 -23.863 0.583 -0.115 1.00 1.40 O ATOM 0 H GLU A 31 -19.813 -2.768 -1.464 1.00 0.22 H new ATOM 0 HA GLU A 31 -20.769 -0.690 -3.342 1.00 0.23 H new ATOM 0 HB2 GLU A 31 -20.384 -0.577 -0.328 1.00 0.30 H new ATOM 0 HB3 GLU A 31 -21.079 0.678 -1.335 1.00 0.30 H new ATOM 0 HG2 GLU A 31 -22.933 -0.892 -1.951 1.00 0.32 H new ATOM 0 HG3 GLU A 31 -22.254 -2.084 -0.861 1.00 0.32 H new ATOM 469 N LEU A 32 -17.817 -1.209 -2.482 1.00 0.21 N ATOM 470 CA LEU A 32 -16.434 -0.756 -2.551 1.00 0.24 C ATOM 471 C LEU A 32 -16.200 0.006 -3.850 1.00 0.23 C ATOM 472 O LEU A 32 -15.601 1.081 -3.850 1.00 0.25 O ATOM 473 CB LEU A 32 -15.478 -1.950 -2.447 1.00 0.29 C ATOM 474 CG LEU A 32 -14.064 -1.633 -1.938 1.00 0.44 C ATOM 475 CD1 LEU A 32 -13.292 -0.802 -2.952 1.00 1.04 C ATOM 476 CD2 LEU A 32 -14.123 -0.916 -0.598 1.00 1.37 C ATOM 0 H LEU A 32 -17.928 -2.221 -2.415 1.00 0.21 H new ATOM 0 HA LEU A 32 -16.238 -0.086 -1.714 1.00 0.24 H new ATOM 0 HB2 LEU A 32 -15.924 -2.692 -1.785 1.00 0.29 H new ATOM 0 HB3 LEU A 32 -15.394 -2.411 -3.431 1.00 0.29 H new ATOM 0 HG LEU A 32 -13.538 -2.578 -1.802 1.00 0.44 H new ATOM 0 HD11 LEU A 32 -12.294 -0.592 -2.566 1.00 1.04 H new ATOM 0 HD12 LEU A 32 -13.210 -1.354 -3.888 1.00 1.04 H new ATOM 0 HD13 LEU A 32 -13.818 0.136 -3.129 1.00 1.04 H new ATOM 0 HD21 LEU A 32 -13.111 -0.701 -0.256 1.00 1.37 H new ATOM 0 HD22 LEU A 32 -14.675 0.018 -0.709 1.00 1.37 H new ATOM 0 HD23 LEU A 32 -14.626 -1.550 0.132 1.00 1.37 H new ATOM 488 N GLY A 33 -16.680 -0.559 -4.955 1.00 0.25 N ATOM 489 CA GLY A 33 -16.529 0.094 -6.241 1.00 0.28 C ATOM 490 C GLY A 33 -17.130 1.480 -6.226 1.00 0.27 C ATOM 491 O GLY A 33 -16.600 2.408 -6.837 1.00 0.32 O ATOM 0 H GLY A 33 -17.169 -1.454 -4.982 1.00 0.25 H new ATOM 0 HA2 GLY A 33 -15.472 0.156 -6.498 1.00 0.28 H new ATOM 0 HA3 GLY A 33 -17.010 -0.505 -7.014 1.00 0.28 H new ATOM 495 N THR A 34 -18.242 1.613 -5.516 1.00 0.23 N ATOM 496 CA THR A 34 -18.923 2.889 -5.391 1.00 0.24 C ATOM 497 C THR A 34 -18.101 3.837 -4.524 1.00 0.22 C ATOM 498 O THR A 34 -18.102 5.051 -4.734 1.00 0.23 O ATOM 499 CB THR A 34 -20.322 2.714 -4.772 1.00 0.26 C ATOM 500 OG1 THR A 34 -21.108 1.835 -5.587 1.00 0.31 O ATOM 501 CG2 THR A 34 -21.031 4.054 -4.640 1.00 0.29 C ATOM 0 H THR A 34 -18.692 0.846 -5.016 1.00 0.23 H new ATOM 0 HA THR A 34 -19.035 3.308 -6.391 1.00 0.24 H new ATOM 0 HB THR A 34 -20.203 2.285 -3.777 1.00 0.26 H new ATOM 0 HG1 THR A 34 -21.996 1.726 -5.188 1.00 0.31 H new ATOM 0 HG21 THR A 34 -22.017 3.902 -4.200 1.00 0.29 H new ATOM 0 HG22 THR A 34 -20.446 4.714 -4.000 1.00 0.29 H new ATOM 0 HG23 THR A 34 -21.139 4.507 -5.625 1.00 0.29 H new ATOM 509 N LEU A 35 -17.393 3.264 -3.555 1.00 0.22 N ATOM 510 CA LEU A 35 -16.557 4.045 -2.655 1.00 0.24 C ATOM 511 C LEU A 35 -15.410 4.688 -3.428 1.00 0.25 C ATOM 512 O LEU A 35 -14.991 5.803 -3.126 1.00 0.29 O ATOM 513 CB LEU A 35 -16.007 3.154 -1.536 1.00 0.29 C ATOM 514 CG LEU A 35 -15.823 3.836 -0.183 1.00 0.42 C ATOM 515 CD1 LEU A 35 -15.310 2.845 0.847 1.00 1.24 C ATOM 516 CD2 LEU A 35 -14.883 5.025 -0.292 1.00 1.16 C ATOM 0 H LEU A 35 -17.383 2.260 -3.375 1.00 0.22 H new ATOM 0 HA LEU A 35 -17.164 4.833 -2.208 1.00 0.24 H new ATOM 0 HB2 LEU A 35 -16.679 2.306 -1.407 1.00 0.29 H new ATOM 0 HB3 LEU A 35 -15.045 2.753 -1.855 1.00 0.29 H new ATOM 0 HG LEU A 35 -16.796 4.205 0.143 1.00 0.42 H new ATOM 0 HD11 LEU A 35 -15.185 3.349 1.806 1.00 1.24 H new ATOM 0 HD12 LEU A 35 -16.026 2.030 0.956 1.00 1.24 H new ATOM 0 HD13 LEU A 35 -14.351 2.444 0.520 1.00 1.24 H new ATOM 0 HD21 LEU A 35 -14.771 5.491 0.687 1.00 1.16 H new ATOM 0 HD22 LEU A 35 -13.909 4.688 -0.647 1.00 1.16 H new ATOM 0 HD23 LEU A 35 -15.294 5.750 -0.994 1.00 1.16 H new ATOM 528 N MET A 36 -14.903 3.975 -4.425 1.00 0.28 N ATOM 529 CA MET A 36 -13.814 4.485 -5.249 1.00 0.32 C ATOM 530 C MET A 36 -14.299 5.633 -6.121 1.00 0.30 C ATOM 531 O MET A 36 -13.611 6.637 -6.283 1.00 0.40 O ATOM 532 CB MET A 36 -13.257 3.373 -6.132 1.00 0.45 C ATOM 533 CG MET A 36 -12.481 2.323 -5.365 1.00 0.51 C ATOM 534 SD MET A 36 -11.007 2.996 -4.581 1.00 1.10 S ATOM 535 CE MET A 36 -10.254 1.494 -3.971 1.00 0.69 C ATOM 0 H MET A 36 -15.227 3.043 -4.683 1.00 0.28 H new ATOM 0 HA MET A 36 -13.026 4.849 -4.589 1.00 0.32 H new ATOM 0 HB2 MET A 36 -14.081 2.892 -6.659 1.00 0.45 H new ATOM 0 HB3 MET A 36 -12.608 3.812 -6.889 1.00 0.45 H new ATOM 0 HG2 MET A 36 -13.125 1.883 -4.604 1.00 0.51 H new ATOM 0 HG3 MET A 36 -12.194 1.520 -6.043 1.00 0.51 H new ATOM 0 HE1 MET A 36 -10.078 1.585 -2.899 1.00 0.69 H new ATOM 0 HE2 MET A 36 -10.919 0.651 -4.159 1.00 0.69 H new ATOM 0 HE3 MET A 36 -9.305 1.329 -4.482 1.00 0.69 H new ATOM 545 N ARG A 37 -15.489 5.463 -6.684 1.00 0.30 N ATOM 546 CA ARG A 37 -16.090 6.476 -7.546 1.00 0.34 C ATOM 547 C ARG A 37 -16.135 7.839 -6.857 1.00 0.33 C ATOM 548 O ARG A 37 -15.686 8.840 -7.415 1.00 0.43 O ATOM 549 CB ARG A 37 -17.501 6.049 -7.951 1.00 0.44 C ATOM 550 CG ARG A 37 -17.531 4.828 -8.848 1.00 0.64 C ATOM 551 CD ARG A 37 -18.956 4.442 -9.203 1.00 0.70 C ATOM 552 NE ARG A 37 -19.762 5.600 -9.580 1.00 1.40 N ATOM 553 CZ ARG A 37 -21.077 5.554 -9.770 1.00 1.73 C ATOM 554 NH1 ARG A 37 -21.733 4.410 -9.619 1.00 1.52 N ATOM 555 NH2 ARG A 37 -21.739 6.650 -10.110 1.00 2.69 N ATOM 0 H ARG A 37 -16.061 4.628 -6.558 1.00 0.30 H new ATOM 0 HA ARG A 37 -15.470 6.569 -8.437 1.00 0.34 H new ATOM 0 HB2 ARG A 37 -18.082 5.843 -7.052 1.00 0.44 H new ATOM 0 HB3 ARG A 37 -17.990 6.878 -8.463 1.00 0.44 H new ATOM 0 HG2 ARG A 37 -16.968 5.029 -9.760 1.00 0.64 H new ATOM 0 HG3 ARG A 37 -17.039 3.994 -8.348 1.00 0.64 H new ATOM 0 HD2 ARG A 37 -18.943 3.727 -10.025 1.00 0.70 H new ATOM 0 HD3 ARG A 37 -19.418 3.941 -8.352 1.00 0.70 H new ATOM 0 HE ARG A 37 -19.289 6.495 -9.705 1.00 1.40 H new ATOM 0 HH11 ARG A 37 -21.228 3.563 -9.357 1.00 1.52 H new ATOM 0 HH12 ARG A 37 -22.742 4.377 -9.765 1.00 1.52 H new ATOM 0 HH21 ARG A 37 -21.240 7.532 -10.227 1.00 2.69 H new ATOM 0 HH22 ARG A 37 -22.748 6.612 -10.255 1.00 2.69 H new ATOM 569 N THR A 38 -16.677 7.871 -5.642 1.00 0.31 N ATOM 570 CA THR A 38 -16.782 9.115 -4.883 1.00 0.39 C ATOM 571 C THR A 38 -15.404 9.696 -4.564 1.00 0.36 C ATOM 572 O THR A 38 -15.290 10.846 -4.141 1.00 0.43 O ATOM 573 CB THR A 38 -17.572 8.927 -3.572 1.00 0.50 C ATOM 574 OG1 THR A 38 -17.677 10.177 -2.880 1.00 1.06 O ATOM 575 CG2 THR A 38 -16.905 7.902 -2.671 1.00 0.61 C ATOM 0 H THR A 38 -17.050 7.052 -5.162 1.00 0.31 H new ATOM 0 HA THR A 38 -17.325 9.814 -5.519 1.00 0.39 H new ATOM 0 HB THR A 38 -18.568 8.565 -3.828 1.00 0.50 H new ATOM 0 HG1 THR A 38 -16.954 10.773 -3.169 1.00 1.06 H new ATOM 0 HG21 THR A 38 -17.485 7.791 -1.755 1.00 0.61 H new ATOM 0 HG22 THR A 38 -16.854 6.943 -3.186 1.00 0.61 H new ATOM 0 HG23 THR A 38 -15.897 8.235 -2.424 1.00 0.61 H new ATOM 583 N LEU A 39 -14.363 8.894 -4.769 1.00 0.30 N ATOM 584 CA LEU A 39 -12.995 9.327 -4.500 1.00 0.33 C ATOM 585 C LEU A 39 -12.196 9.434 -5.800 1.00 0.33 C ATOM 586 O LEU A 39 -12.537 8.809 -6.803 1.00 0.31 O ATOM 587 CB LEU A 39 -12.307 8.357 -3.537 1.00 0.38 C ATOM 588 CG LEU A 39 -13.090 8.038 -2.259 1.00 0.64 C ATOM 589 CD1 LEU A 39 -12.324 7.039 -1.406 1.00 1.26 C ATOM 590 CD2 LEU A 39 -13.377 9.305 -1.465 1.00 1.07 C ATOM 0 H LEU A 39 -14.441 7.940 -5.121 1.00 0.30 H new ATOM 0 HA LEU A 39 -13.035 10.313 -4.036 1.00 0.33 H new ATOM 0 HB2 LEU A 39 -12.111 7.424 -4.066 1.00 0.38 H new ATOM 0 HB3 LEU A 39 -11.340 8.774 -3.256 1.00 0.38 H new ATOM 0 HG LEU A 39 -14.044 7.595 -2.546 1.00 0.64 H new ATOM 0 HD11 LEU A 39 -12.892 6.822 -0.502 1.00 1.26 H new ATOM 0 HD12 LEU A 39 -12.174 6.118 -1.970 1.00 1.26 H new ATOM 0 HD13 LEU A 39 -11.356 7.460 -1.134 1.00 1.26 H new ATOM 0 HD21 LEU A 39 -13.934 9.051 -0.563 1.00 1.07 H new ATOM 0 HD22 LEU A 39 -12.437 9.782 -1.189 1.00 1.07 H new ATOM 0 HD23 LEU A 39 -13.966 9.990 -2.074 1.00 1.07 H new ATOM 602 N GLY A 40 -11.143 10.244 -5.777 1.00 0.42 N ATOM 603 CA GLY A 40 -10.325 10.439 -6.964 1.00 0.47 C ATOM 604 C GLY A 40 -9.376 9.288 -7.254 1.00 0.43 C ATOM 605 O GLY A 40 -8.234 9.513 -7.653 1.00 0.69 O ATOM 0 H GLY A 40 -10.840 10.770 -4.958 1.00 0.42 H new ATOM 0 HA2 GLY A 40 -10.979 10.583 -7.824 1.00 0.47 H new ATOM 0 HA3 GLY A 40 -9.745 11.355 -6.847 1.00 0.47 H new ATOM 609 N GLN A 41 -9.839 8.055 -7.059 1.00 0.44 N ATOM 610 CA GLN A 41 -9.009 6.884 -7.330 1.00 0.40 C ATOM 611 C GLN A 41 -9.263 6.356 -8.738 1.00 0.51 C ATOM 612 O GLN A 41 -8.350 6.297 -9.562 1.00 1.45 O ATOM 613 CB GLN A 41 -9.276 5.776 -6.308 1.00 0.48 C ATOM 614 CG GLN A 41 -8.751 6.085 -4.916 1.00 0.74 C ATOM 615 CD GLN A 41 -7.305 6.543 -4.920 1.00 1.06 C ATOM 616 OE1 GLN A 41 -6.509 6.125 -5.760 1.00 1.97 O ATOM 617 NE2 GLN A 41 -6.959 7.411 -3.976 1.00 1.30 N ATOM 0 H GLN A 41 -10.776 7.842 -6.717 1.00 0.44 H new ATOM 0 HA GLN A 41 -7.966 7.192 -7.250 1.00 0.40 H new ATOM 0 HB2 GLN A 41 -10.350 5.599 -6.250 1.00 0.48 H new ATOM 0 HB3 GLN A 41 -8.820 4.851 -6.661 1.00 0.48 H new ATOM 0 HG2 GLN A 41 -9.371 6.859 -4.463 1.00 0.74 H new ATOM 0 HG3 GLN A 41 -8.844 5.196 -4.292 1.00 0.74 H new ATOM 0 HE21 GLN A 41 -7.652 7.731 -3.299 1.00 1.30 H new ATOM 0 HE22 GLN A 41 -6.001 7.757 -3.928 1.00 1.30 H new ATOM 626 N ASN A 42 -10.508 5.973 -9.004 1.00 0.74 N ATOM 627 CA ASN A 42 -10.889 5.449 -10.312 1.00 0.68 C ATOM 628 C ASN A 42 -10.042 4.231 -10.685 1.00 0.53 C ATOM 629 O ASN A 42 -9.253 4.282 -11.630 1.00 0.62 O ATOM 630 CB ASN A 42 -10.750 6.532 -11.385 1.00 0.85 C ATOM 631 CG ASN A 42 -11.795 7.626 -11.259 1.00 1.87 C ATOM 632 OD1 ASN A 42 -12.219 7.911 -10.032 1.00 2.57 O flip ATOM 633 ND2 ASN A 42 -12.216 8.212 -12.256 1.00 2.66 N flip ATOM 0 H ASN A 42 -11.272 6.016 -8.330 1.00 0.74 H new ATOM 0 HA ASN A 42 -11.932 5.138 -10.256 1.00 0.68 H new ATOM 0 HB2 ASN A 42 -9.757 6.976 -11.319 1.00 0.85 H new ATOM 0 HB3 ASN A 42 -10.829 6.073 -12.370 1.00 0.85 H new ATOM 0 HD21 ASN A 42 -11.864 7.963 -13.180 1.00 2.66 H new ATOM 0 HD22 ASN A 42 -12.917 8.947 -12.158 1.00 2.66 H new ATOM 640 N PRO A 43 -10.195 3.119 -9.944 1.00 0.41 N ATOM 641 CA PRO A 43 -9.444 1.884 -10.206 1.00 0.40 C ATOM 642 C PRO A 43 -9.845 1.238 -11.526 1.00 0.39 C ATOM 643 O PRO A 43 -10.848 1.614 -12.133 1.00 0.51 O ATOM 644 CB PRO A 43 -9.833 0.975 -9.037 1.00 0.44 C ATOM 645 CG PRO A 43 -11.154 1.487 -8.584 1.00 0.45 C ATOM 646 CD PRO A 43 -11.105 2.973 -8.792 1.00 0.44 C ATOM 0 HA PRO A 43 -8.373 2.068 -10.284 1.00 0.40 H new ATOM 0 HB2 PRO A 43 -9.898 -0.067 -9.350 1.00 0.44 H new ATOM 0 HB3 PRO A 43 -9.095 1.021 -8.237 1.00 0.44 H new ATOM 0 HG2 PRO A 43 -11.966 1.038 -9.156 1.00 0.45 H new ATOM 0 HG3 PRO A 43 -11.330 1.244 -7.536 1.00 0.45 H new ATOM 0 HD2 PRO A 43 -12.092 3.383 -9.004 1.00 0.44 H new ATOM 0 HD3 PRO A 43 -10.727 3.491 -7.911 1.00 0.44 H new ATOM 654 N THR A 44 -9.055 0.263 -11.966 1.00 0.35 N ATOM 655 CA THR A 44 -9.335 -0.439 -13.212 1.00 0.36 C ATOM 656 C THR A 44 -10.503 -1.401 -13.032 1.00 0.32 C ATOM 657 O THR A 44 -10.722 -1.918 -11.937 1.00 0.33 O ATOM 658 CB THR A 44 -8.103 -1.221 -13.709 1.00 0.43 C ATOM 659 OG1 THR A 44 -6.950 -0.371 -13.711 1.00 0.73 O ATOM 660 CG2 THR A 44 -8.334 -1.766 -15.111 1.00 0.69 C ATOM 0 H THR A 44 -8.218 -0.058 -11.479 1.00 0.35 H new ATOM 0 HA THR A 44 -9.593 0.313 -13.957 1.00 0.36 H new ATOM 0 HB THR A 44 -7.938 -2.059 -13.032 1.00 0.43 H new ATOM 0 HG1 THR A 44 -6.172 -0.876 -14.026 1.00 0.73 H new ATOM 0 HG21 THR A 44 -7.450 -2.314 -15.439 1.00 0.69 H new ATOM 0 HG22 THR A 44 -9.194 -2.436 -15.104 1.00 0.69 H new ATOM 0 HG23 THR A 44 -8.523 -0.940 -15.796 1.00 0.69 H new ATOM 668 N GLU A 45 -11.254 -1.636 -14.102 1.00 0.32 N ATOM 669 CA GLU A 45 -12.402 -2.535 -14.044 1.00 0.33 C ATOM 670 C GLU A 45 -12.007 -3.911 -13.512 1.00 0.32 C ATOM 671 O GLU A 45 -12.662 -4.451 -12.619 1.00 0.34 O ATOM 672 CB GLU A 45 -13.047 -2.670 -15.427 1.00 0.40 C ATOM 673 CG GLU A 45 -12.077 -3.091 -16.521 1.00 1.14 C ATOM 674 CD GLU A 45 -12.734 -3.157 -17.887 1.00 1.84 C ATOM 675 OE1 GLU A 45 -13.284 -4.225 -18.230 1.00 2.70 O ATOM 676 OE2 GLU A 45 -12.698 -2.141 -18.612 1.00 2.04 O ATOM 0 H GLU A 45 -11.090 -1.218 -15.018 1.00 0.32 H new ATOM 0 HA GLU A 45 -13.127 -2.102 -13.354 1.00 0.33 H new ATOM 0 HB2 GLU A 45 -13.855 -3.400 -15.371 1.00 0.40 H new ATOM 0 HB3 GLU A 45 -13.498 -1.716 -15.702 1.00 0.40 H new ATOM 0 HG2 GLU A 45 -11.245 -2.387 -16.555 1.00 1.14 H new ATOM 0 HG3 GLU A 45 -11.659 -4.067 -16.275 1.00 1.14 H new ATOM 683 N ALA A 46 -10.930 -4.468 -14.057 1.00 0.33 N ATOM 684 CA ALA A 46 -10.457 -5.783 -13.640 1.00 0.37 C ATOM 685 C ALA A 46 -10.015 -5.781 -12.180 1.00 0.33 C ATOM 686 O ALA A 46 -10.392 -6.663 -11.410 1.00 0.34 O ATOM 687 CB ALA A 46 -9.314 -6.240 -14.532 1.00 0.46 C ATOM 0 H ALA A 46 -10.369 -4.030 -14.788 1.00 0.33 H new ATOM 0 HA ALA A 46 -11.288 -6.481 -13.738 1.00 0.37 H new ATOM 0 HB1 ALA A 46 -8.971 -7.223 -14.209 1.00 0.46 H new ATOM 0 HB2 ALA A 46 -9.659 -6.297 -15.564 1.00 0.46 H new ATOM 0 HB3 ALA A 46 -8.492 -5.528 -14.463 1.00 0.46 H new ATOM 693 N GLU A 47 -9.222 -4.781 -11.803 1.00 0.32 N ATOM 694 CA GLU A 47 -8.725 -4.674 -10.437 1.00 0.32 C ATOM 695 C GLU A 47 -9.881 -4.650 -9.451 1.00 0.28 C ATOM 696 O GLU A 47 -9.892 -5.390 -8.469 1.00 0.28 O ATOM 697 CB GLU A 47 -7.877 -3.411 -10.275 1.00 0.37 C ATOM 698 CG GLU A 47 -7.235 -3.281 -8.904 1.00 0.43 C ATOM 699 CD GLU A 47 -6.250 -4.396 -8.614 1.00 1.24 C ATOM 700 OE1 GLU A 47 -5.067 -4.256 -8.988 1.00 1.27 O ATOM 701 OE2 GLU A 47 -6.661 -5.410 -8.012 1.00 2.23 O ATOM 0 H GLU A 47 -8.911 -4.035 -12.425 1.00 0.32 H new ATOM 0 HA GLU A 47 -8.104 -5.545 -10.230 1.00 0.32 H new ATOM 0 HB2 GLU A 47 -7.095 -3.408 -11.035 1.00 0.37 H new ATOM 0 HB3 GLU A 47 -8.503 -2.537 -10.458 1.00 0.37 H new ATOM 0 HG2 GLU A 47 -6.722 -2.321 -8.836 1.00 0.43 H new ATOM 0 HG3 GLU A 47 -8.013 -3.281 -8.141 1.00 0.43 H new ATOM 708 N LEU A 48 -10.858 -3.801 -9.736 1.00 0.29 N ATOM 709 CA LEU A 48 -12.028 -3.662 -8.883 1.00 0.31 C ATOM 710 C LEU A 48 -12.744 -4.997 -8.719 1.00 0.30 C ATOM 711 O LEU A 48 -13.185 -5.345 -7.626 1.00 0.35 O ATOM 712 CB LEU A 48 -12.980 -2.630 -9.480 1.00 0.35 C ATOM 713 CG LEU A 48 -14.155 -2.240 -8.588 1.00 0.65 C ATOM 714 CD1 LEU A 48 -13.656 -1.547 -7.330 1.00 1.34 C ATOM 715 CD2 LEU A 48 -15.118 -1.347 -9.353 1.00 1.36 C ATOM 0 H LEU A 48 -10.862 -3.195 -10.557 1.00 0.29 H new ATOM 0 HA LEU A 48 -11.700 -3.328 -7.899 1.00 0.31 H new ATOM 0 HB2 LEU A 48 -12.412 -1.731 -9.720 1.00 0.35 H new ATOM 0 HB3 LEU A 48 -13.371 -3.020 -10.420 1.00 0.35 H new ATOM 0 HG LEU A 48 -14.688 -3.143 -8.289 1.00 0.65 H new ATOM 0 HD11 LEU A 48 -14.505 -1.275 -6.703 1.00 1.34 H new ATOM 0 HD12 LEU A 48 -13.000 -2.221 -6.779 1.00 1.34 H new ATOM 0 HD13 LEU A 48 -13.104 -0.648 -7.604 1.00 1.34 H new ATOM 0 HD21 LEU A 48 -15.953 -1.075 -8.707 1.00 1.36 H new ATOM 0 HD22 LEU A 48 -14.599 -0.444 -9.675 1.00 1.36 H new ATOM 0 HD23 LEU A 48 -15.494 -1.881 -10.226 1.00 1.36 H new ATOM 727 N GLN A 49 -12.848 -5.741 -9.813 1.00 0.30 N ATOM 728 CA GLN A 49 -13.517 -7.036 -9.797 1.00 0.35 C ATOM 729 C GLN A 49 -12.679 -8.081 -9.068 1.00 0.35 C ATOM 730 O GLN A 49 -13.212 -9.054 -8.535 1.00 0.38 O ATOM 731 CB GLN A 49 -13.804 -7.495 -11.226 1.00 0.41 C ATOM 732 CG GLN A 49 -14.776 -6.592 -11.968 1.00 0.48 C ATOM 733 CD GLN A 49 -14.805 -6.862 -13.459 1.00 0.78 C ATOM 734 OE1 GLN A 49 -14.576 -7.986 -13.903 1.00 1.22 O ATOM 735 NE2 GLN A 49 -15.083 -5.824 -14.239 1.00 1.19 N ATOM 0 H GLN A 49 -12.477 -5.470 -10.724 1.00 0.30 H new ATOM 0 HA GLN A 49 -14.459 -6.924 -9.260 1.00 0.35 H new ATOM 0 HB2 GLN A 49 -12.866 -7.540 -11.780 1.00 0.41 H new ATOM 0 HB3 GLN A 49 -14.208 -8.507 -11.200 1.00 0.41 H new ATOM 0 HG2 GLN A 49 -15.777 -6.729 -11.559 1.00 0.48 H new ATOM 0 HG3 GLN A 49 -14.501 -5.551 -11.797 1.00 0.48 H new ATOM 0 HE21 GLN A 49 -15.266 -4.910 -13.825 1.00 1.19 H new ATOM 0 HE22 GLN A 49 -15.113 -5.941 -15.252 1.00 1.19 H new ATOM 744 N ASP A 50 -11.365 -7.878 -9.047 1.00 0.34 N ATOM 745 CA ASP A 50 -10.460 -8.811 -8.381 1.00 0.38 C ATOM 746 C ASP A 50 -10.596 -8.737 -6.861 1.00 0.35 C ATOM 747 O ASP A 50 -10.841 -9.748 -6.204 1.00 0.39 O ATOM 748 CB ASP A 50 -9.010 -8.530 -8.785 1.00 0.43 C ATOM 749 CG ASP A 50 -8.673 -9.068 -10.162 1.00 0.49 C ATOM 750 OD1 ASP A 50 -8.651 -10.307 -10.327 1.00 0.62 O ATOM 751 OD2 ASP A 50 -8.424 -8.253 -11.075 1.00 0.53 O ATOM 0 H ASP A 50 -10.904 -7.079 -9.482 1.00 0.34 H new ATOM 0 HA ASP A 50 -10.735 -9.817 -8.699 1.00 0.38 H new ATOM 0 HB2 ASP A 50 -8.833 -7.455 -8.766 1.00 0.43 H new ATOM 0 HB3 ASP A 50 -8.339 -8.976 -8.051 1.00 0.43 H new ATOM 756 N LEU A 51 -10.437 -7.536 -6.309 1.00 0.32 N ATOM 757 CA LEU A 51 -10.527 -7.341 -4.864 1.00 0.33 C ATOM 758 C LEU A 51 -11.930 -7.636 -4.337 1.00 0.32 C ATOM 759 O LEU A 51 -12.083 -8.206 -3.257 1.00 0.35 O ATOM 760 CB LEU A 51 -10.118 -5.915 -4.492 1.00 0.36 C ATOM 761 CG LEU A 51 -10.876 -4.813 -5.229 1.00 0.30 C ATOM 762 CD1 LEU A 51 -11.757 -4.031 -4.267 1.00 0.39 C ATOM 763 CD2 LEU A 51 -9.898 -3.888 -5.938 1.00 0.31 C ATOM 0 H LEU A 51 -10.246 -6.686 -6.839 1.00 0.32 H new ATOM 0 HA LEU A 51 -9.840 -8.047 -4.397 1.00 0.33 H new ATOM 0 HB2 LEU A 51 -10.262 -5.780 -3.420 1.00 0.36 H new ATOM 0 HB3 LEU A 51 -9.052 -5.796 -4.688 1.00 0.36 H new ATOM 0 HG LEU A 51 -11.521 -5.274 -5.977 1.00 0.30 H new ATOM 0 HD11 LEU A 51 -12.288 -3.251 -4.812 1.00 0.39 H new ATOM 0 HD12 LEU A 51 -12.478 -4.705 -3.804 1.00 0.39 H new ATOM 0 HD13 LEU A 51 -11.137 -3.576 -3.494 1.00 0.39 H new ATOM 0 HD21 LEU A 51 -10.450 -3.106 -6.460 1.00 0.31 H new ATOM 0 HD22 LEU A 51 -9.231 -3.434 -5.206 1.00 0.31 H new ATOM 0 HD23 LEU A 51 -9.312 -4.460 -6.657 1.00 0.31 H new ATOM 775 N ILE A 52 -12.951 -7.246 -5.095 1.00 0.31 N ATOM 776 CA ILE A 52 -14.330 -7.479 -4.684 1.00 0.34 C ATOM 777 C ILE A 52 -14.639 -8.972 -4.643 1.00 0.37 C ATOM 778 O ILE A 52 -15.193 -9.475 -3.666 1.00 0.41 O ATOM 779 CB ILE A 52 -15.332 -6.770 -5.619 1.00 0.38 C ATOM 780 CG1 ILE A 52 -15.206 -5.251 -5.474 1.00 0.42 C ATOM 781 CG2 ILE A 52 -16.758 -7.219 -5.317 1.00 0.50 C ATOM 782 CD1 ILE A 52 -16.025 -4.472 -6.481 1.00 0.50 C ATOM 0 H ILE A 52 -12.850 -6.770 -5.992 1.00 0.31 H new ATOM 0 HA ILE A 52 -14.439 -7.061 -3.683 1.00 0.34 H new ATOM 0 HB ILE A 52 -15.099 -7.043 -6.648 1.00 0.38 H new ATOM 0 HG12 ILE A 52 -15.515 -4.964 -4.469 1.00 0.42 H new ATOM 0 HG13 ILE A 52 -14.158 -4.971 -5.578 1.00 0.42 H new ATOM 0 HG21 ILE A 52 -17.450 -6.708 -5.987 1.00 0.50 H new ATOM 0 HG22 ILE A 52 -16.839 -8.296 -5.464 1.00 0.50 H new ATOM 0 HG23 ILE A 52 -17.005 -6.974 -4.284 1.00 0.50 H new ATOM 0 HD11 ILE A 52 -15.885 -3.404 -6.316 1.00 0.50 H new ATOM 0 HD12 ILE A 52 -15.701 -4.729 -7.490 1.00 0.50 H new ATOM 0 HD13 ILE A 52 -17.079 -4.722 -6.364 1.00 0.50 H new ATOM 794 N ALA A 53 -14.276 -9.676 -5.711 1.00 0.41 N ATOM 795 CA ALA A 53 -14.508 -11.112 -5.792 1.00 0.50 C ATOM 796 C ALA A 53 -13.655 -11.855 -4.771 1.00 0.49 C ATOM 797 O ALA A 53 -14.006 -12.949 -4.330 1.00 0.58 O ATOM 798 CB ALA A 53 -14.220 -11.617 -7.197 1.00 0.59 C ATOM 0 H ALA A 53 -13.821 -9.275 -6.531 1.00 0.41 H new ATOM 0 HA ALA A 53 -15.556 -11.304 -5.563 1.00 0.50 H new ATOM 0 HB1 ALA A 53 -14.398 -12.691 -7.241 1.00 0.59 H new ATOM 0 HB2 ALA A 53 -14.875 -11.111 -7.907 1.00 0.59 H new ATOM 0 HB3 ALA A 53 -13.180 -11.411 -7.452 1.00 0.59 H new ATOM 804 N GLU A 54 -12.530 -11.251 -4.402 1.00 0.45 N ATOM 805 CA GLU A 54 -11.625 -11.849 -3.429 1.00 0.51 C ATOM 806 C GLU A 54 -12.254 -11.837 -2.040 1.00 0.50 C ATOM 807 O GLU A 54 -12.352 -12.872 -1.382 1.00 0.59 O ATOM 808 CB GLU A 54 -10.294 -11.094 -3.406 1.00 0.57 C ATOM 809 CG GLU A 54 -9.223 -11.774 -2.570 1.00 1.07 C ATOM 810 CD GLU A 54 -8.774 -13.095 -3.162 1.00 1.77 C ATOM 811 OE1 GLU A 54 -9.435 -14.120 -2.893 1.00 2.54 O ATOM 812 OE2 GLU A 54 -7.763 -13.105 -3.895 1.00 1.99 O ATOM 0 H GLU A 54 -12.224 -10.347 -4.763 1.00 0.45 H new ATOM 0 HA GLU A 54 -11.439 -12.882 -3.722 1.00 0.51 H new ATOM 0 HB2 GLU A 54 -9.930 -10.984 -4.428 1.00 0.57 H new ATOM 0 HB3 GLU A 54 -10.462 -10.089 -3.018 1.00 0.57 H new ATOM 0 HG2 GLU A 54 -8.363 -11.110 -2.478 1.00 1.07 H new ATOM 0 HG3 GLU A 54 -9.605 -11.942 -1.563 1.00 1.07 H new ATOM 819 N ALA A 55 -12.677 -10.655 -1.602 1.00 0.43 N ATOM 820 CA ALA A 55 -13.303 -10.503 -0.293 1.00 0.47 C ATOM 821 C ALA A 55 -14.711 -11.090 -0.284 1.00 0.46 C ATOM 822 O ALA A 55 -15.304 -11.292 0.776 1.00 0.53 O ATOM 823 CB ALA A 55 -13.340 -9.036 0.106 1.00 0.50 C ATOM 0 H ALA A 55 -12.598 -9.789 -2.134 1.00 0.43 H new ATOM 0 HA ALA A 55 -12.704 -11.052 0.434 1.00 0.47 H new ATOM 0 HB1 ALA A 55 -13.810 -8.937 1.085 1.00 0.50 H new ATOM 0 HB2 ALA A 55 -12.323 -8.645 0.150 1.00 0.50 H new ATOM 0 HB3 ALA A 55 -13.914 -8.473 -0.630 1.00 0.50 H new ATOM 829 N GLU A 56 -15.242 -11.356 -1.475 1.00 0.41 N ATOM 830 CA GLU A 56 -16.584 -11.914 -1.613 1.00 0.44 C ATOM 831 C GLU A 56 -16.732 -13.212 -0.822 1.00 0.49 C ATOM 832 O GLU A 56 -17.819 -13.533 -0.342 1.00 0.63 O ATOM 833 CB GLU A 56 -16.899 -12.164 -3.089 1.00 0.47 C ATOM 834 CG GLU A 56 -18.304 -12.692 -3.332 1.00 0.52 C ATOM 835 CD GLU A 56 -18.611 -12.875 -4.806 1.00 1.26 C ATOM 836 OE1 GLU A 56 -19.077 -11.906 -5.441 1.00 1.66 O ATOM 837 OE2 GLU A 56 -18.385 -13.989 -5.324 1.00 1.95 O ATOM 0 H GLU A 56 -14.762 -11.194 -2.360 1.00 0.41 H new ATOM 0 HA GLU A 56 -17.291 -11.190 -1.209 1.00 0.44 H new ATOM 0 HB2 GLU A 56 -16.769 -11.234 -3.642 1.00 0.47 H new ATOM 0 HB3 GLU A 56 -16.178 -12.876 -3.490 1.00 0.47 H new ATOM 0 HG2 GLU A 56 -18.424 -13.646 -2.819 1.00 0.52 H new ATOM 0 HG3 GLU A 56 -19.028 -12.003 -2.897 1.00 0.52 H new ATOM 844 N ASN A 57 -15.636 -13.953 -0.687 1.00 0.53 N ATOM 845 CA ASN A 57 -15.654 -15.217 0.042 1.00 0.68 C ATOM 846 C ASN A 57 -14.719 -15.176 1.248 1.00 0.79 C ATOM 847 O ASN A 57 -14.993 -15.796 2.277 1.00 1.19 O ATOM 848 CB ASN A 57 -15.257 -16.370 -0.882 1.00 0.87 C ATOM 849 CG ASN A 57 -16.292 -16.633 -1.960 1.00 1.67 C ATOM 850 OD1 ASN A 57 -16.972 -15.717 -2.422 1.00 2.38 O ATOM 851 ND2 ASN A 57 -16.417 -17.891 -2.364 1.00 2.48 N ATOM 0 H ASN A 57 -14.726 -13.701 -1.072 1.00 0.53 H new ATOM 0 HA ASN A 57 -16.670 -15.377 0.402 1.00 0.68 H new ATOM 0 HB2 ASN A 57 -14.299 -16.143 -1.350 1.00 0.87 H new ATOM 0 HB3 ASN A 57 -15.116 -17.274 -0.290 1.00 0.87 H new ATOM 0 HD21 ASN A 57 -17.098 -18.130 -3.085 1.00 2.48 H new ATOM 0 HD22 ASN A 57 -15.832 -18.619 -1.953 1.00 2.48 H new ATOM 858 N ASN A 58 -13.617 -14.445 1.117 1.00 0.84 N ATOM 859 CA ASN A 58 -12.645 -14.329 2.199 1.00 1.03 C ATOM 860 C ASN A 58 -13.209 -13.517 3.360 1.00 1.09 C ATOM 861 O ASN A 58 -12.910 -13.791 4.523 1.00 1.84 O ATOM 862 CB ASN A 58 -11.354 -13.682 1.691 1.00 1.12 C ATOM 863 CG ASN A 58 -10.630 -14.547 0.677 1.00 1.81 C ATOM 864 OD1 ASN A 58 -9.961 -14.038 -0.223 1.00 2.48 O ATOM 865 ND2 ASN A 58 -10.754 -15.863 0.819 1.00 2.14 N ATOM 0 H ASN A 58 -13.375 -13.925 0.274 1.00 0.84 H new ATOM 0 HA ASN A 58 -12.424 -15.334 2.557 1.00 1.03 H new ATOM 0 HB2 ASN A 58 -11.588 -12.718 1.240 1.00 1.12 H new ATOM 0 HB3 ASN A 58 -10.693 -13.487 2.535 1.00 1.12 H new ATOM 0 HD21 ASN A 58 -10.285 -16.493 0.168 1.00 2.14 H new ATOM 0 HD22 ASN A 58 -11.318 -16.243 1.579 1.00 2.14 H new ATOM 872 N ASN A 59 -14.024 -12.518 3.039 1.00 1.04 N ATOM 873 CA ASN A 59 -14.626 -11.665 4.059 1.00 1.01 C ATOM 874 C ASN A 59 -16.142 -11.832 4.095 1.00 0.88 C ATOM 875 O ASN A 59 -16.831 -11.110 4.815 1.00 0.91 O ATOM 876 CB ASN A 59 -14.275 -10.198 3.801 1.00 1.08 C ATOM 877 CG ASN A 59 -12.779 -9.949 3.773 1.00 1.31 C ATOM 878 OD1 ASN A 59 -12.298 -9.083 3.042 1.00 2.05 O ATOM 879 ND2 ASN A 59 -12.036 -10.701 4.574 1.00 1.51 N ATOM 0 H ASN A 59 -14.283 -12.279 2.082 1.00 1.04 H new ATOM 0 HA ASN A 59 -14.223 -11.968 5.025 1.00 1.01 H new ATOM 0 HB2 ASN A 59 -14.709 -9.887 2.851 1.00 1.08 H new ATOM 0 HB3 ASN A 59 -14.728 -9.579 4.576 1.00 1.08 H new ATOM 0 HD21 ASN A 59 -11.024 -10.573 4.600 1.00 1.51 H new ATOM 0 HD22 ASN A 59 -12.476 -11.407 5.164 1.00 1.51 H new ATOM 886 N ASN A 60 -16.644 -12.791 3.313 1.00 0.80 N ATOM 887 CA ASN A 60 -18.080 -13.077 3.231 1.00 0.76 C ATOM 888 C ASN A 60 -18.822 -12.002 2.434 1.00 0.74 C ATOM 889 O ASN A 60 -19.595 -12.320 1.530 1.00 1.42 O ATOM 890 CB ASN A 60 -18.697 -13.220 4.627 1.00 0.86 C ATOM 891 CG ASN A 60 -18.122 -14.393 5.396 1.00 0.95 C ATOM 892 OD1 ASN A 60 -18.634 -15.509 5.320 1.00 1.47 O ATOM 893 ND2 ASN A 60 -17.053 -14.144 6.144 1.00 1.19 N ATOM 0 H ASN A 60 -16.069 -13.390 2.720 1.00 0.80 H new ATOM 0 HA ASN A 60 -18.188 -14.026 2.705 1.00 0.76 H new ATOM 0 HB2 ASN A 60 -18.530 -12.302 5.191 1.00 0.86 H new ATOM 0 HB3 ASN A 60 -19.776 -13.344 4.533 1.00 0.86 H new ATOM 0 HD21 ASN A 60 -16.623 -14.894 6.685 1.00 1.19 H new ATOM 0 HD22 ASN A 60 -16.662 -13.203 6.177 1.00 1.19 H new ATOM 900 N GLY A 61 -18.589 -10.736 2.770 1.00 0.43 N ATOM 901 CA GLY A 61 -19.250 -9.652 2.068 1.00 0.40 C ATOM 902 C GLY A 61 -19.064 -8.307 2.745 1.00 0.32 C ATOM 903 O GLY A 61 -19.681 -7.318 2.348 1.00 0.38 O ATOM 0 H GLY A 61 -17.956 -10.443 3.514 1.00 0.43 H new ATOM 0 HA2 GLY A 61 -18.864 -9.597 1.050 1.00 0.40 H new ATOM 0 HA3 GLY A 61 -20.315 -9.871 1.993 1.00 0.40 H new ATOM 907 N GLN A 62 -18.217 -8.266 3.771 1.00 0.36 N ATOM 908 CA GLN A 62 -17.955 -7.028 4.497 1.00 0.29 C ATOM 909 C GLN A 62 -16.463 -6.706 4.523 1.00 0.31 C ATOM 910 O GLN A 62 -15.621 -7.595 4.406 1.00 0.38 O ATOM 911 CB GLN A 62 -18.494 -7.117 5.929 1.00 0.27 C ATOM 912 CG GLN A 62 -19.954 -6.710 6.063 1.00 0.27 C ATOM 913 CD GLN A 62 -20.132 -5.205 6.165 1.00 0.23 C ATOM 914 OE1 GLN A 62 -21.066 -4.719 6.806 1.00 0.25 O ATOM 915 NE2 GLN A 62 -19.234 -4.457 5.535 1.00 0.21 N ATOM 0 H GLN A 62 -17.702 -9.075 4.117 1.00 0.36 H new ATOM 0 HA GLN A 62 -18.471 -6.224 3.972 1.00 0.29 H new ATOM 0 HB2 GLN A 62 -18.377 -8.140 6.288 1.00 0.27 H new ATOM 0 HB3 GLN A 62 -17.889 -6.481 6.575 1.00 0.27 H new ATOM 0 HG2 GLN A 62 -20.511 -7.081 5.203 1.00 0.27 H new ATOM 0 HG3 GLN A 62 -20.380 -7.184 6.947 1.00 0.27 H new ATOM 0 HE21 GLN A 62 -18.476 -4.899 5.015 1.00 0.21 H new ATOM 0 HE22 GLN A 62 -19.302 -3.440 5.571 1.00 0.21 H new ATOM 924 N LEU A 63 -16.149 -5.423 4.676 1.00 0.30 N ATOM 925 CA LEU A 63 -14.763 -4.964 4.715 1.00 0.36 C ATOM 926 C LEU A 63 -14.519 -4.079 5.930 1.00 0.31 C ATOM 927 O LEU A 63 -15.444 -3.468 6.455 1.00 0.27 O ATOM 928 CB LEU A 63 -14.426 -4.178 3.449 1.00 0.45 C ATOM 929 CG LEU A 63 -14.745 -4.883 2.132 1.00 0.79 C ATOM 930 CD1 LEU A 63 -14.638 -3.902 0.976 1.00 1.41 C ATOM 931 CD2 LEU A 63 -13.814 -6.066 1.920 1.00 1.43 C ATOM 0 H LEU A 63 -16.839 -4.679 4.776 1.00 0.30 H new ATOM 0 HA LEU A 63 -14.123 -5.844 4.780 1.00 0.36 H new ATOM 0 HB2 LEU A 63 -14.967 -3.232 3.475 1.00 0.45 H new ATOM 0 HB3 LEU A 63 -13.363 -3.938 3.464 1.00 0.45 H new ATOM 0 HG LEU A 63 -15.767 -5.260 2.175 1.00 0.79 H new ATOM 0 HD11 LEU A 63 -14.867 -4.414 0.042 1.00 1.41 H new ATOM 0 HD12 LEU A 63 -15.345 -3.086 1.125 1.00 1.41 H new ATOM 0 HD13 LEU A 63 -13.625 -3.502 0.931 1.00 1.41 H new ATOM 0 HD21 LEU A 63 -14.057 -6.556 0.977 1.00 1.43 H new ATOM 0 HD22 LEU A 63 -12.782 -5.716 1.892 1.00 1.43 H new ATOM 0 HD23 LEU A 63 -13.935 -6.775 2.739 1.00 1.43 H new ATOM 943 N ASN A 64 -13.266 -3.990 6.356 1.00 0.33 N ATOM 944 CA ASN A 64 -12.909 -3.172 7.508 1.00 0.31 C ATOM 945 C ASN A 64 -12.065 -1.987 7.077 1.00 0.31 C ATOM 946 O ASN A 64 -11.447 -2.012 6.014 1.00 0.33 O ATOM 947 CB ASN A 64 -12.127 -3.974 8.550 1.00 0.34 C ATOM 948 CG ASN A 64 -12.934 -5.097 9.152 1.00 0.53 C ATOM 949 OD1 ASN A 64 -13.633 -4.911 10.147 1.00 1.19 O ATOM 950 ND2 ASN A 64 -12.823 -6.275 8.561 1.00 0.99 N ATOM 0 H ASN A 64 -12.480 -4.474 5.922 1.00 0.33 H new ATOM 0 HA ASN A 64 -13.842 -2.827 7.954 1.00 0.31 H new ATOM 0 HB2 ASN A 64 -11.230 -4.385 8.087 1.00 0.34 H new ATOM 0 HB3 ASN A 64 -11.797 -3.304 9.344 1.00 0.34 H new ATOM 0 HD21 ASN A 64 -13.330 -7.080 8.929 1.00 0.99 H new ATOM 0 HD22 ASN A 64 -12.230 -6.379 7.737 1.00 0.99 H new ATOM 957 N PHE A 65 -12.065 -0.946 7.896 1.00 0.30 N ATOM 958 CA PHE A 65 -11.290 0.252 7.605 1.00 0.30 C ATOM 959 C PHE A 65 -9.901 -0.117 7.091 1.00 0.29 C ATOM 960 O PHE A 65 -9.378 0.521 6.182 1.00 0.31 O ATOM 961 CB PHE A 65 -11.171 1.123 8.856 1.00 0.32 C ATOM 962 CG PHE A 65 -10.280 2.320 8.675 1.00 0.33 C ATOM 963 CD1 PHE A 65 -10.729 3.439 7.992 1.00 0.37 C ATOM 964 CD2 PHE A 65 -8.992 2.324 9.187 1.00 0.35 C ATOM 965 CE1 PHE A 65 -9.910 4.540 7.824 1.00 0.40 C ATOM 966 CE2 PHE A 65 -8.169 3.422 9.023 1.00 0.38 C ATOM 967 CZ PHE A 65 -8.629 4.531 8.340 1.00 0.39 C ATOM 0 H PHE A 65 -12.593 -0.906 8.768 1.00 0.30 H new ATOM 0 HA PHE A 65 -11.809 0.815 6.829 1.00 0.30 H new ATOM 0 HB2 PHE A 65 -12.165 1.462 9.148 1.00 0.32 H new ATOM 0 HB3 PHE A 65 -10.787 0.516 9.676 1.00 0.32 H new ATOM 0 HD1 PHE A 65 -11.730 3.451 7.586 1.00 0.37 H new ATOM 0 HD2 PHE A 65 -8.627 1.459 9.720 1.00 0.35 H new ATOM 0 HE1 PHE A 65 -10.272 5.406 7.290 1.00 0.40 H new ATOM 0 HE2 PHE A 65 -7.168 3.413 9.428 1.00 0.38 H new ATOM 0 HZ PHE A 65 -7.988 5.390 8.210 1.00 0.39 H new ATOM 977 N THR A 66 -9.322 -1.164 7.672 1.00 0.31 N ATOM 978 CA THR A 66 -7.996 -1.624 7.278 1.00 0.32 C ATOM 979 C THR A 66 -8.014 -2.315 5.923 1.00 0.31 C ATOM 980 O THR A 66 -7.076 -2.180 5.141 1.00 0.30 O ATOM 981 CB THR A 66 -7.404 -2.585 8.315 1.00 0.40 C ATOM 982 OG1 THR A 66 -8.453 -3.220 9.057 1.00 0.56 O ATOM 983 CG2 THR A 66 -6.480 -1.837 9.255 1.00 0.81 C ATOM 0 H THR A 66 -9.752 -1.710 8.419 1.00 0.31 H new ATOM 0 HA THR A 66 -7.373 -0.732 7.213 1.00 0.32 H new ATOM 0 HB THR A 66 -6.829 -3.351 7.794 1.00 0.40 H new ATOM 0 HG1 THR A 66 -8.063 -3.833 9.715 1.00 0.56 H new ATOM 0 HG21 THR A 66 -6.066 -2.531 9.987 1.00 0.81 H new ATOM 0 HG22 THR A 66 -5.669 -1.385 8.684 1.00 0.81 H new ATOM 0 HG23 THR A 66 -7.040 -1.057 9.771 1.00 0.81 H new ATOM 991 N GLU A 67 -9.069 -3.073 5.657 1.00 0.34 N ATOM 992 CA GLU A 67 -9.193 -3.773 4.385 1.00 0.37 C ATOM 993 C GLU A 67 -9.183 -2.769 3.236 1.00 0.32 C ATOM 994 O GLU A 67 -8.427 -2.910 2.271 1.00 0.35 O ATOM 995 CB GLU A 67 -10.484 -4.596 4.358 1.00 0.42 C ATOM 996 CG GLU A 67 -10.575 -5.628 5.473 1.00 0.49 C ATOM 997 CD GLU A 67 -9.549 -6.733 5.328 1.00 0.88 C ATOM 998 OE1 GLU A 67 -9.787 -7.665 4.531 1.00 1.36 O ATOM 999 OE2 GLU A 67 -8.506 -6.668 6.011 1.00 1.21 O ATOM 0 H GLU A 67 -9.847 -3.219 6.300 1.00 0.34 H new ATOM 0 HA GLU A 67 -8.346 -4.450 4.270 1.00 0.37 H new ATOM 0 HB2 GLU A 67 -11.337 -3.921 4.430 1.00 0.42 H new ATOM 0 HB3 GLU A 67 -10.560 -5.105 3.397 1.00 0.42 H new ATOM 0 HG2 GLU A 67 -10.437 -5.133 6.434 1.00 0.49 H new ATOM 0 HG3 GLU A 67 -11.574 -6.063 5.480 1.00 0.49 H new ATOM 1006 N PHE A 68 -10.021 -1.747 3.362 1.00 0.29 N ATOM 1007 CA PHE A 68 -10.123 -0.704 2.351 1.00 0.27 C ATOM 1008 C PHE A 68 -8.853 0.140 2.312 1.00 0.26 C ATOM 1009 O PHE A 68 -8.245 0.304 1.255 1.00 0.32 O ATOM 1010 CB PHE A 68 -11.341 0.176 2.636 1.00 0.26 C ATOM 1011 CG PHE A 68 -11.496 1.335 1.694 1.00 0.30 C ATOM 1012 CD1 PHE A 68 -11.543 1.125 0.328 1.00 0.38 C ATOM 1013 CD2 PHE A 68 -11.588 2.633 2.172 1.00 0.35 C ATOM 1014 CE1 PHE A 68 -11.679 2.184 -0.546 1.00 0.48 C ATOM 1015 CE2 PHE A 68 -11.725 3.698 1.303 1.00 0.45 C ATOM 1016 CZ PHE A 68 -11.796 3.487 -0.036 1.00 0.51 C ATOM 0 H PHE A 68 -10.643 -1.619 4.160 1.00 0.29 H new ATOM 0 HA PHE A 68 -10.244 -1.175 1.375 1.00 0.27 H new ATOM 0 HB2 PHE A 68 -12.239 -0.440 2.588 1.00 0.26 H new ATOM 0 HB3 PHE A 68 -11.270 0.557 3.655 1.00 0.26 H new ATOM 0 HD1 PHE A 68 -11.472 0.119 -0.060 1.00 0.38 H new ATOM 0 HD2 PHE A 68 -11.552 2.814 3.236 1.00 0.35 H new ATOM 0 HE1 PHE A 68 -11.695 2.012 -1.612 1.00 0.48 H new ATOM 0 HE2 PHE A 68 -11.776 4.705 1.691 1.00 0.45 H new ATOM 0 HZ PHE A 68 -11.942 4.320 -0.708 1.00 0.51 H new ATOM 1026 N CYS A 69 -8.458 0.673 3.469 1.00 0.23 N ATOM 1027 CA CYS A 69 -7.253 1.495 3.562 1.00 0.23 C ATOM 1028 C CYS A 69 -6.071 0.769 2.940 1.00 0.27 C ATOM 1029 O CYS A 69 -5.252 1.371 2.245 1.00 0.31 O ATOM 1030 CB CYS A 69 -6.934 1.823 5.021 1.00 0.23 C ATOM 1031 SG CYS A 69 -6.098 3.405 5.261 1.00 0.75 S ATOM 0 H CYS A 69 -8.954 0.550 4.352 1.00 0.23 H new ATOM 0 HA CYS A 69 -7.435 2.423 3.021 1.00 0.23 H new ATOM 0 HB2 CYS A 69 -7.862 1.826 5.592 1.00 0.23 H new ATOM 0 HB3 CYS A 69 -6.310 1.029 5.431 1.00 0.23 H new ATOM 0 HG CYS A 69 -6.931 4.376 5.028 1.00 0.75 H new ATOM 1037 N GLY A 70 -5.989 -0.532 3.202 1.00 0.30 N ATOM 1038 CA GLY A 70 -4.912 -1.333 2.658 1.00 0.35 C ATOM 1039 C GLY A 70 -4.868 -1.252 1.150 1.00 0.37 C ATOM 1040 O GLY A 70 -3.816 -0.989 0.561 1.00 0.41 O ATOM 0 H GLY A 70 -6.652 -1.045 3.783 1.00 0.30 H new ATOM 0 HA2 GLY A 70 -3.961 -0.994 3.069 1.00 0.35 H new ATOM 0 HA3 GLY A 70 -5.039 -2.371 2.964 1.00 0.35 H new ATOM 1044 N ILE A 71 -6.017 -1.475 0.521 1.00 0.37 N ATOM 1045 CA ILE A 71 -6.104 -1.411 -0.928 1.00 0.41 C ATOM 1046 C ILE A 71 -5.773 -0.020 -1.427 1.00 0.40 C ATOM 1047 O ILE A 71 -5.174 0.143 -2.482 1.00 0.44 O ATOM 1048 CB ILE A 71 -7.494 -1.801 -1.442 1.00 0.42 C ATOM 1049 CG1 ILE A 71 -7.784 -3.256 -1.095 1.00 0.47 C ATOM 1050 CG2 ILE A 71 -7.575 -1.565 -2.945 1.00 0.46 C ATOM 1051 CD1 ILE A 71 -9.235 -3.513 -0.760 1.00 0.51 C ATOM 0 H ILE A 71 -6.894 -1.700 0.991 1.00 0.37 H new ATOM 0 HA ILE A 71 -5.378 -2.127 -1.312 1.00 0.41 H new ATOM 0 HB ILE A 71 -8.249 -1.180 -0.960 1.00 0.42 H new ATOM 0 HG12 ILE A 71 -7.495 -3.887 -1.935 1.00 0.47 H new ATOM 0 HG13 ILE A 71 -7.165 -3.550 -0.248 1.00 0.47 H new ATOM 0 HG21 ILE A 71 -8.565 -1.844 -3.304 1.00 0.46 H new ATOM 0 HG22 ILE A 71 -7.395 -0.511 -3.158 1.00 0.46 H new ATOM 0 HG23 ILE A 71 -6.822 -2.171 -3.449 1.00 0.46 H new ATOM 0 HD11 ILE A 71 -9.372 -4.568 -0.523 1.00 0.51 H new ATOM 0 HD12 ILE A 71 -9.523 -2.907 0.099 1.00 0.51 H new ATOM 0 HD13 ILE A 71 -9.858 -3.249 -1.615 1.00 0.51 H new ATOM 1063 N MET A 72 -6.190 0.983 -0.673 1.00 0.38 N ATOM 1064 CA MET A 72 -5.912 2.362 -1.044 1.00 0.41 C ATOM 1065 C MET A 72 -4.417 2.573 -1.137 1.00 0.45 C ATOM 1066 O MET A 72 -3.928 3.255 -2.028 1.00 0.52 O ATOM 1067 CB MET A 72 -6.497 3.334 -0.030 1.00 0.39 C ATOM 1068 CG MET A 72 -8.005 3.269 0.068 1.00 0.41 C ATOM 1069 SD MET A 72 -8.823 3.771 -1.461 1.00 1.01 S ATOM 1070 CE MET A 72 -8.325 5.488 -1.577 1.00 0.58 C ATOM 0 H MET A 72 -6.718 0.871 0.193 1.00 0.38 H new ATOM 0 HA MET A 72 -6.376 2.553 -2.011 1.00 0.41 H new ATOM 0 HB2 MET A 72 -6.068 3.126 0.950 1.00 0.39 H new ATOM 0 HB3 MET A 72 -6.202 4.348 -0.299 1.00 0.39 H new ATOM 0 HG2 MET A 72 -8.305 2.252 0.319 1.00 0.41 H new ATOM 0 HG3 MET A 72 -8.340 3.911 0.883 1.00 0.41 H new ATOM 0 HE1 MET A 72 -9.075 6.047 -2.136 1.00 0.58 H new ATOM 0 HE2 MET A 72 -8.231 5.908 -0.576 1.00 0.58 H new ATOM 0 HE3 MET A 72 -7.366 5.555 -2.090 1.00 0.58 H new ATOM 1080 N ALA A 73 -3.700 1.995 -0.185 1.00 0.46 N ATOM 1081 CA ALA A 73 -2.248 2.091 -0.159 1.00 0.53 C ATOM 1082 C ALA A 73 -1.651 1.586 -1.471 1.00 0.59 C ATOM 1083 O ALA A 73 -0.869 2.286 -2.117 1.00 0.70 O ATOM 1084 CB ALA A 73 -1.688 1.304 1.017 1.00 0.54 C ATOM 0 H ALA A 73 -4.101 1.454 0.581 1.00 0.46 H new ATOM 0 HA ALA A 73 -1.974 3.139 -0.040 1.00 0.53 H new ATOM 0 HB1 ALA A 73 -0.601 1.385 1.024 1.00 0.54 H new ATOM 0 HB2 ALA A 73 -2.088 1.707 1.948 1.00 0.54 H new ATOM 0 HB3 ALA A 73 -1.974 0.256 0.923 1.00 0.54 H new ATOM 1090 N LYS A 74 -2.034 0.372 -1.865 1.00 0.55 N ATOM 1091 CA LYS A 74 -1.528 -0.217 -3.103 1.00 0.62 C ATOM 1092 C LYS A 74 -2.067 0.522 -4.325 1.00 0.63 C ATOM 1093 O LYS A 74 -1.401 0.595 -5.358 1.00 0.70 O ATOM 1094 CB LYS A 74 -1.874 -1.710 -3.182 1.00 0.63 C ATOM 1095 CG LYS A 74 -3.357 -2.026 -3.143 1.00 0.65 C ATOM 1096 CD LYS A 74 -3.588 -3.531 -3.160 1.00 0.74 C ATOM 1097 CE LYS A 74 -5.047 -3.880 -3.408 1.00 0.73 C ATOM 1098 NZ LYS A 74 -5.269 -5.351 -3.435 1.00 1.38 N ATOM 0 H LYS A 74 -2.687 -0.218 -1.350 1.00 0.55 H new ATOM 0 HA LYS A 74 -0.443 -0.116 -3.097 1.00 0.62 H new ATOM 0 HB2 LYS A 74 -1.455 -2.117 -4.102 1.00 0.63 H new ATOM 0 HB3 LYS A 74 -1.386 -2.225 -2.355 1.00 0.63 H new ATOM 0 HG2 LYS A 74 -3.802 -1.595 -2.246 1.00 0.65 H new ATOM 0 HG3 LYS A 74 -3.854 -1.567 -3.998 1.00 0.65 H new ATOM 0 HD2 LYS A 74 -2.970 -3.984 -3.935 1.00 0.74 H new ATOM 0 HD3 LYS A 74 -3.270 -3.958 -2.209 1.00 0.74 H new ATOM 0 HE2 LYS A 74 -5.665 -3.434 -2.628 1.00 0.73 H new ATOM 0 HE3 LYS A 74 -5.368 -3.447 -4.355 1.00 0.73 H new ATOM 0 HZ1 LYS A 74 -6.276 -5.547 -3.606 1.00 1.38 H new ATOM 0 HZ2 LYS A 74 -4.699 -5.774 -4.195 1.00 1.38 H new ATOM 0 HZ3 LYS A 74 -4.987 -5.761 -2.522 1.00 1.38 H new ATOM 1112 N GLN A 75 -3.271 1.070 -4.202 1.00 0.59 N ATOM 1113 CA GLN A 75 -3.897 1.811 -5.293 1.00 0.63 C ATOM 1114 C GLN A 75 -3.159 3.120 -5.555 1.00 0.67 C ATOM 1115 O GLN A 75 -2.880 3.470 -6.701 1.00 0.79 O ATOM 1116 CB GLN A 75 -5.364 2.096 -4.968 1.00 0.63 C ATOM 1117 CG GLN A 75 -6.026 3.070 -5.931 1.00 1.04 C ATOM 1118 CD GLN A 75 -6.035 2.566 -7.360 1.00 1.23 C ATOM 1119 OE1 GLN A 75 -7.098 1.862 -7.729 1.00 1.98 O flip ATOM 1120 NE2 GLN A 75 -5.101 2.808 -8.123 1.00 1.54 N flip ATOM 0 H GLN A 75 -3.836 1.015 -3.354 1.00 0.59 H new ATOM 0 HA GLN A 75 -3.844 1.198 -6.193 1.00 0.63 H new ATOM 0 HB2 GLN A 75 -5.918 1.157 -4.977 1.00 0.63 H new ATOM 0 HB3 GLN A 75 -5.432 2.496 -3.956 1.00 0.63 H new ATOM 0 HG2 GLN A 75 -7.051 3.253 -5.608 1.00 1.04 H new ATOM 0 HG3 GLN A 75 -5.504 4.026 -5.891 1.00 1.04 H new ATOM 0 HE21 GLN A 75 -4.304 3.354 -7.796 1.00 1.54 H new ATOM 0 HE22 GLN A 75 -5.124 2.463 -9.083 1.00 1.54 H new ATOM 1129 N MET A 76 -2.847 3.835 -4.479 1.00 0.65 N ATOM 1130 CA MET A 76 -2.153 5.099 -4.566 1.00 0.73 C ATOM 1131 C MET A 76 -0.801 4.935 -5.255 1.00 0.89 C ATOM 1132 O MET A 76 -0.423 5.743 -6.103 1.00 1.06 O ATOM 1133 CB MET A 76 -1.967 5.672 -3.165 1.00 0.76 C ATOM 1134 CG MET A 76 -3.231 6.284 -2.582 1.00 0.80 C ATOM 1135 SD MET A 76 -2.916 7.218 -1.074 1.00 1.20 S ATOM 1136 CE MET A 76 -4.542 7.896 -0.753 1.00 0.75 C ATOM 0 H MET A 76 -3.071 3.548 -3.526 1.00 0.65 H new ATOM 0 HA MET A 76 -2.751 5.787 -5.164 1.00 0.73 H new ATOM 0 HB2 MET A 76 -1.618 4.881 -2.502 1.00 0.76 H new ATOM 0 HB3 MET A 76 -1.186 6.432 -3.194 1.00 0.76 H new ATOM 0 HG2 MET A 76 -3.688 6.940 -3.323 1.00 0.80 H new ATOM 0 HG3 MET A 76 -3.950 5.492 -2.371 1.00 0.80 H new ATOM 0 HE1 MET A 76 -4.511 8.502 0.153 1.00 0.75 H new ATOM 0 HE2 MET A 76 -4.850 8.517 -1.594 1.00 0.75 H new ATOM 0 HE3 MET A 76 -5.256 7.083 -0.622 1.00 0.75 H new ATOM 1146 N ARG A 77 -0.076 3.882 -4.881 1.00 0.96 N ATOM 1147 CA ARG A 77 1.234 3.609 -5.465 1.00 1.19 C ATOM 1148 C ARG A 77 1.097 2.950 -6.835 1.00 1.32 C ATOM 1149 O ARG A 77 2.036 2.951 -7.631 1.00 1.53 O ATOM 1150 CB ARG A 77 2.055 2.709 -4.540 1.00 1.43 C ATOM 1151 CG ARG A 77 2.387 3.346 -3.201 1.00 1.88 C ATOM 1152 CD ARG A 77 3.285 2.444 -2.368 1.00 2.24 C ATOM 1153 NE ARG A 77 4.529 2.121 -3.062 1.00 3.04 N ATOM 1154 CZ ARG A 77 5.274 1.056 -2.785 1.00 3.73 C ATOM 1155 NH1 ARG A 77 4.908 0.216 -1.825 1.00 3.83 N ATOM 1156 NH2 ARG A 77 6.389 0.828 -3.468 1.00 4.69 N ATOM 0 H ARG A 77 -0.374 3.206 -4.178 1.00 0.96 H new ATOM 0 HA ARG A 77 1.749 4.562 -5.588 1.00 1.19 H new ATOM 0 HB2 ARG A 77 1.505 1.785 -4.365 1.00 1.43 H new ATOM 0 HB3 ARG A 77 2.983 2.437 -5.043 1.00 1.43 H new ATOM 0 HG2 ARG A 77 2.881 4.304 -3.364 1.00 1.88 H new ATOM 0 HG3 ARG A 77 1.466 3.551 -2.655 1.00 1.88 H new ATOM 0 HD2 ARG A 77 3.514 2.934 -1.422 1.00 2.24 H new ATOM 0 HD3 ARG A 77 2.753 1.523 -2.129 1.00 2.24 H new ATOM 0 HE ARG A 77 4.844 2.749 -3.802 1.00 3.04 H new ATOM 0 HH11 ARG A 77 4.052 0.387 -1.297 1.00 3.83 H new ATOM 0 HH12 ARG A 77 5.482 -0.600 -1.615 1.00 3.83 H new ATOM 0 HH21 ARG A 77 6.675 1.471 -4.207 1.00 4.69 H new ATOM 0 HH22 ARG A 77 6.960 0.010 -3.254 1.00 4.69 H new ATOM 1170 N GLU A 78 -0.077 2.387 -7.103 1.00 1.44 N ATOM 1171 CA GLU A 78 -0.333 1.718 -8.373 1.00 1.86 C ATOM 1172 C GLU A 78 -0.288 2.705 -9.536 1.00 2.54 C ATOM 1173 O GLU A 78 0.332 2.436 -10.564 1.00 3.23 O ATOM 1174 CB GLU A 78 -1.695 1.019 -8.338 1.00 2.05 C ATOM 1175 CG GLU A 78 -2.029 0.263 -9.614 1.00 2.65 C ATOM 1176 CD GLU A 78 -1.116 -0.926 -9.841 1.00 3.46 C ATOM 1177 OE1 GLU A 78 -0.018 -0.731 -10.403 1.00 4.01 O ATOM 1178 OE2 GLU A 78 -1.499 -2.051 -9.457 1.00 3.90 O ATOM 0 H GLU A 78 -0.866 2.381 -6.457 1.00 1.44 H new ATOM 0 HA GLU A 78 0.450 0.975 -8.524 1.00 1.86 H new ATOM 0 HB2 GLU A 78 -1.715 0.324 -7.499 1.00 2.05 H new ATOM 0 HB3 GLU A 78 -2.470 1.763 -8.154 1.00 2.05 H new ATOM 0 HG2 GLU A 78 -3.063 -0.080 -9.569 1.00 2.65 H new ATOM 0 HG3 GLU A 78 -1.955 0.941 -10.464 1.00 2.65 H new ATOM 1185 N THR A 79 -0.947 3.848 -9.367 1.00 2.81 N ATOM 1186 CA THR A 79 -0.988 4.864 -10.412 1.00 3.72 C ATOM 1187 C THR A 79 0.255 5.762 -10.372 1.00 3.90 C ATOM 1188 O THR A 79 1.315 5.366 -10.858 1.00 4.36 O ATOM 1189 CB THR A 79 -2.279 5.710 -10.322 1.00 4.37 C ATOM 1190 OG1 THR A 79 -3.422 4.861 -10.471 1.00 4.67 O ATOM 1191 CG2 THR A 79 -2.311 6.790 -11.396 1.00 5.28 C ATOM 0 H THR A 79 -1.458 4.093 -8.519 1.00 2.81 H new ATOM 0 HA THR A 79 -0.992 4.343 -11.369 1.00 3.72 H new ATOM 0 HB THR A 79 -2.297 6.195 -9.346 1.00 4.37 H new ATOM 0 HG1 THR A 79 -4.239 5.399 -10.412 1.00 4.67 H new ATOM 0 HG21 THR A 79 -3.231 7.367 -11.305 1.00 5.28 H new ATOM 0 HG22 THR A 79 -1.454 7.452 -11.272 1.00 5.28 H new ATOM 0 HG23 THR A 79 -2.270 6.325 -12.381 1.00 5.28 H new ATOM 1199 N ASP A 80 0.134 6.957 -9.784 1.00 3.93 N ATOM 1200 CA ASP A 80 1.252 7.897 -9.702 1.00 4.35 C ATOM 1201 C ASP A 80 0.804 9.223 -9.085 1.00 4.98 C ATOM 1202 O ASP A 80 1.495 10.232 -9.220 1.00 5.60 O ATOM 1203 CB ASP A 80 1.830 8.162 -11.095 1.00 4.57 C ATOM 1204 CG ASP A 80 0.795 8.720 -12.052 1.00 4.84 C ATOM 1205 OD1 ASP A 80 0.523 9.937 -11.989 1.00 5.42 O ATOM 1206 OD2 ASP A 80 0.254 7.939 -12.863 1.00 4.80 O ATOM 0 H ASP A 80 -0.729 7.294 -9.358 1.00 3.93 H new ATOM 0 HA ASP A 80 2.018 7.449 -9.068 1.00 4.35 H new ATOM 0 HB2 ASP A 80 2.661 8.863 -11.014 1.00 4.57 H new ATOM 0 HB3 ASP A 80 2.234 7.234 -11.501 1.00 4.57 H new ATOM 1211 N THR A 81 -0.348 9.211 -8.404 1.00 5.18 N ATOM 1212 CA THR A 81 -0.898 10.418 -7.773 1.00 6.15 C ATOM 1213 C THR A 81 -0.642 11.654 -8.635 1.00 6.80 C ATOM 1214 O THR A 81 0.138 12.536 -8.270 1.00 7.13 O ATOM 1215 CB THR A 81 -0.338 10.641 -6.348 1.00 6.60 C ATOM 1216 OG1 THR A 81 -0.762 11.916 -5.849 1.00 7.29 O ATOM 1217 CG2 THR A 81 1.183 10.565 -6.320 1.00 6.89 C ATOM 0 H THR A 81 -0.920 8.376 -8.275 1.00 5.18 H new ATOM 0 HA THR A 81 -1.973 10.262 -7.687 1.00 6.15 H new ATOM 0 HB THR A 81 -0.728 9.845 -5.714 1.00 6.60 H new ATOM 0 HG1 THR A 81 -0.482 12.620 -6.470 1.00 7.29 H new ATOM 0 HG21 THR A 81 1.537 10.727 -5.302 1.00 6.89 H new ATOM 0 HG22 THR A 81 1.505 9.582 -6.664 1.00 6.89 H new ATOM 0 HG23 THR A 81 1.598 11.332 -6.974 1.00 6.89 H new ATOM 1225 N GLU A 82 -1.323 11.701 -9.778 1.00 7.25 N ATOM 1226 CA GLU A 82 -1.183 12.792 -10.745 1.00 8.05 C ATOM 1227 C GLU A 82 -1.308 14.178 -10.109 1.00 8.92 C ATOM 1228 O GLU A 82 -0.881 15.171 -10.699 1.00 9.53 O ATOM 1229 CB GLU A 82 -2.234 12.645 -11.846 1.00 8.64 C ATOM 1230 CG GLU A 82 -2.195 11.299 -12.549 1.00 8.69 C ATOM 1231 CD GLU A 82 -3.261 11.168 -13.617 1.00 9.34 C ATOM 1232 OE1 GLU A 82 -4.397 10.774 -13.278 1.00 9.63 O ATOM 1233 OE2 GLU A 82 -2.961 11.460 -14.795 1.00 9.74 O ATOM 0 H GLU A 82 -1.989 10.983 -10.062 1.00 7.25 H new ATOM 0 HA GLU A 82 -0.177 12.717 -11.159 1.00 8.05 H new ATOM 0 HB2 GLU A 82 -3.224 12.791 -11.413 1.00 8.64 H new ATOM 0 HB3 GLU A 82 -2.089 13.435 -12.583 1.00 8.64 H new ATOM 0 HG2 GLU A 82 -1.213 11.158 -13.002 1.00 8.69 H new ATOM 0 HG3 GLU A 82 -2.324 10.505 -11.813 1.00 8.69 H new ATOM 1240 N GLU A 83 -1.891 14.250 -8.918 1.00 9.15 N ATOM 1241 CA GLU A 83 -2.071 15.533 -8.239 1.00 10.17 C ATOM 1242 C GLU A 83 -0.735 16.226 -7.968 1.00 10.27 C ATOM 1243 O GLU A 83 -0.515 17.362 -8.397 1.00 11.05 O ATOM 1244 CB GLU A 83 -2.825 15.328 -6.923 1.00 10.55 C ATOM 1245 CG GLU A 83 -4.261 14.865 -7.112 1.00 10.83 C ATOM 1246 CD GLU A 83 -5.097 15.866 -7.884 1.00 11.60 C ATOM 1247 OE1 GLU A 83 -5.676 16.772 -7.248 1.00 12.11 O ATOM 1248 OE2 GLU A 83 -5.176 15.744 -9.125 1.00 11.85 O ATOM 0 H GLU A 83 -2.245 13.444 -8.404 1.00 9.15 H new ATOM 0 HA GLU A 83 -2.652 16.176 -8.900 1.00 10.17 H new ATOM 0 HB2 GLU A 83 -2.292 14.594 -6.319 1.00 10.55 H new ATOM 0 HB3 GLU A 83 -2.824 16.263 -6.363 1.00 10.55 H new ATOM 0 HG2 GLU A 83 -4.265 13.910 -7.638 1.00 10.83 H new ATOM 0 HG3 GLU A 83 -4.715 14.693 -6.136 1.00 10.83 H new ATOM 1255 N GLU A 84 0.158 15.533 -7.270 1.00 9.63 N ATOM 1256 CA GLU A 84 1.466 16.089 -6.936 1.00 9.95 C ATOM 1257 C GLU A 84 2.370 16.152 -8.162 1.00 9.87 C ATOM 1258 O GLU A 84 3.408 16.815 -8.143 1.00 10.51 O ATOM 1259 CB GLU A 84 2.135 15.262 -5.837 1.00 9.47 C ATOM 1260 CG GLU A 84 2.406 13.821 -6.234 1.00 9.88 C ATOM 1261 CD GLU A 84 3.122 13.042 -5.147 1.00 10.40 C ATOM 1262 OE1 GLU A 84 2.442 12.553 -4.220 1.00 10.49 O ATOM 1263 OE2 GLU A 84 4.362 12.921 -5.222 1.00 10.87 O ATOM 0 H GLU A 84 0.001 14.586 -6.924 1.00 9.63 H new ATOM 0 HA GLU A 84 1.311 17.105 -6.573 1.00 9.95 H new ATOM 0 HB2 GLU A 84 3.077 15.736 -5.560 1.00 9.47 H new ATOM 0 HB3 GLU A 84 1.501 15.272 -4.951 1.00 9.47 H new ATOM 0 HG2 GLU A 84 1.462 13.328 -6.467 1.00 9.88 H new ATOM 0 HG3 GLU A 84 3.007 13.805 -7.143 1.00 9.88 H new ATOM 1270 N MET A 85 1.972 15.465 -9.227 1.00 9.31 N ATOM 1271 CA MET A 85 2.762 15.436 -10.450 1.00 9.45 C ATOM 1272 C MET A 85 2.547 16.705 -11.256 1.00 10.49 C ATOM 1273 O MET A 85 3.505 17.343 -11.693 1.00 11.09 O ATOM 1274 CB MET A 85 2.391 14.220 -11.292 1.00 8.75 C ATOM 1275 CG MET A 85 2.184 12.960 -10.477 1.00 7.71 C ATOM 1276 SD MET A 85 3.587 12.560 -9.423 1.00 7.19 S ATOM 1277 CE MET A 85 4.214 11.113 -10.266 1.00 6.73 C ATOM 0 H MET A 85 1.109 14.922 -9.267 1.00 9.31 H new ATOM 0 HA MET A 85 3.814 15.370 -10.174 1.00 9.45 H new ATOM 0 HB2 MET A 85 1.479 14.438 -11.848 1.00 8.75 H new ATOM 0 HB3 MET A 85 3.177 14.043 -12.026 1.00 8.75 H new ATOM 0 HG2 MET A 85 1.294 13.077 -9.858 1.00 7.71 H new ATOM 0 HG3 MET A 85 1.995 12.125 -11.152 1.00 7.71 H new ATOM 0 HE1 MET A 85 5.283 11.017 -10.077 1.00 6.73 H new ATOM 0 HE2 MET A 85 3.699 10.226 -9.898 1.00 6.73 H new ATOM 0 HE3 MET A 85 4.042 11.213 -11.338 1.00 6.73 H new ATOM 1287 N ARG A 86 1.284 17.064 -11.460 1.00 10.82 N ATOM 1288 CA ARG A 86 0.955 18.264 -12.209 1.00 11.88 C ATOM 1289 C ARG A 86 1.479 19.491 -11.478 1.00 12.66 C ATOM 1290 O ARG A 86 2.020 20.409 -12.095 1.00 13.43 O ATOM 1291 CB ARG A 86 -0.553 18.388 -12.414 1.00 12.21 C ATOM 1292 CG ARG A 86 -0.920 19.188 -13.645 1.00 13.16 C ATOM 1293 CD ARG A 86 -2.274 19.862 -13.491 1.00 13.63 C ATOM 1294 NE ARG A 86 -2.294 20.804 -12.374 1.00 14.25 N ATOM 1295 CZ ARG A 86 -3.407 21.202 -11.763 1.00 14.86 C ATOM 1296 NH1 ARG A 86 -4.587 20.739 -12.154 1.00 14.96 N ATOM 1297 NH2 ARG A 86 -3.341 22.064 -10.758 1.00 15.52 N ATOM 0 H ARG A 86 0.477 16.542 -11.118 1.00 10.82 H new ATOM 0 HA ARG A 86 1.428 18.194 -13.188 1.00 11.88 H new ATOM 0 HB2 ARG A 86 -0.986 17.391 -12.493 1.00 12.21 H new ATOM 0 HB3 ARG A 86 -0.996 18.859 -11.536 1.00 12.21 H new ATOM 0 HG2 ARG A 86 -0.156 19.943 -13.830 1.00 13.16 H new ATOM 0 HG3 ARG A 86 -0.937 18.531 -14.515 1.00 13.16 H new ATOM 0 HD2 ARG A 86 -2.524 20.388 -14.413 1.00 13.63 H new ATOM 0 HD3 ARG A 86 -3.041 19.103 -13.339 1.00 13.63 H new ATOM 0 HE ARG A 86 -1.404 21.178 -12.044 1.00 14.25 H new ATOM 0 HH11 ARG A 86 -4.644 20.075 -12.926 1.00 14.96 H new ATOM 0 HH12 ARG A 86 -5.437 21.047 -11.683 1.00 14.96 H new ATOM 0 HH21 ARG A 86 -2.436 22.423 -10.452 1.00 15.52 H new ATOM 0 HH22 ARG A 86 -4.195 22.368 -10.290 1.00 15.52 H new ATOM 1311 N GLU A 87 1.309 19.501 -10.159 1.00 12.58 N ATOM 1312 CA GLU A 87 1.785 20.611 -9.347 1.00 13.44 C ATOM 1313 C GLU A 87 3.295 20.753 -9.501 1.00 13.54 C ATOM 1314 O GLU A 87 3.819 21.861 -9.625 1.00 14.45 O ATOM 1315 CB GLU A 87 1.422 20.396 -7.876 1.00 13.42 C ATOM 1316 CG GLU A 87 1.862 21.533 -6.968 1.00 14.12 C ATOM 1317 CD GLU A 87 1.246 22.862 -7.358 1.00 14.57 C ATOM 1318 OE1 GLU A 87 0.099 23.130 -6.944 1.00 14.85 O ATOM 1319 OE2 GLU A 87 1.911 23.636 -8.079 1.00 14.77 O ATOM 0 H GLU A 87 0.848 18.757 -9.635 1.00 12.58 H new ATOM 0 HA GLU A 87 1.303 21.527 -9.689 1.00 13.44 H new ATOM 0 HB2 GLU A 87 0.342 20.272 -7.791 1.00 13.42 H new ATOM 0 HB3 GLU A 87 1.878 19.468 -7.530 1.00 13.42 H new ATOM 0 HG2 GLU A 87 1.589 21.298 -5.939 1.00 14.12 H new ATOM 0 HG3 GLU A 87 2.948 21.617 -6.998 1.00 14.12 H new ATOM 1326 N ALA A 88 3.985 19.617 -9.499 1.00 12.70 N ATOM 1327 CA ALA A 88 5.433 19.601 -9.650 1.00 12.92 C ATOM 1328 C ALA A 88 5.827 19.943 -11.084 1.00 13.38 C ATOM 1329 O ALA A 88 6.942 20.396 -11.339 1.00 14.11 O ATOM 1330 CB ALA A 88 5.993 18.243 -9.256 1.00 12.02 C ATOM 0 H ALA A 88 3.562 18.695 -9.394 1.00 12.70 H new ATOM 0 HA ALA A 88 5.856 20.356 -8.988 1.00 12.92 H new ATOM 0 HB1 ALA A 88 7.077 18.248 -9.375 1.00 12.02 H new ATOM 0 HB2 ALA A 88 5.743 18.034 -8.216 1.00 12.02 H new ATOM 0 HB3 ALA A 88 5.562 17.472 -9.895 1.00 12.02 H new ATOM 1336 N PHE A 89 4.902 19.723 -12.016 1.00 13.10 N ATOM 1337 CA PHE A 89 5.150 20.015 -13.424 1.00 13.68 C ATOM 1338 C PHE A 89 5.244 21.519 -13.648 1.00 14.81 C ATOM 1339 O PHE A 89 6.120 21.996 -14.368 1.00 15.53 O ATOM 1340 CB PHE A 89 4.041 19.418 -14.296 1.00 13.32 C ATOM 1341 CG PHE A 89 4.125 19.817 -15.743 1.00 14.09 C ATOM 1342 CD1 PHE A 89 5.162 19.365 -16.545 1.00 14.63 C ATOM 1343 CD2 PHE A 89 3.166 20.647 -16.300 1.00 14.41 C ATOM 1344 CE1 PHE A 89 5.239 19.733 -17.874 1.00 15.44 C ATOM 1345 CE2 PHE A 89 3.237 21.017 -17.630 1.00 15.22 C ATOM 1346 CZ PHE A 89 4.276 20.560 -18.417 1.00 15.73 C ATOM 0 H PHE A 89 3.975 19.344 -11.821 1.00 13.10 H new ATOM 0 HA PHE A 89 6.100 19.562 -13.708 1.00 13.68 H new ATOM 0 HB2 PHE A 89 4.082 18.331 -14.226 1.00 13.32 H new ATOM 0 HB3 PHE A 89 3.074 19.727 -13.899 1.00 13.32 H new ATOM 0 HD1 PHE A 89 5.918 18.718 -16.126 1.00 14.63 H new ATOM 0 HD2 PHE A 89 2.353 21.009 -15.688 1.00 14.41 H new ATOM 0 HE1 PHE A 89 6.052 19.374 -18.488 1.00 15.44 H new ATOM 0 HE2 PHE A 89 2.481 21.662 -18.053 1.00 15.22 H new ATOM 0 HZ PHE A 89 4.335 20.849 -19.456 1.00 15.73 H new ATOM 1356 N LYS A 90 4.334 22.262 -13.025 1.00 15.06 N ATOM 1357 CA LYS A 90 4.323 23.714 -13.149 1.00 16.18 C ATOM 1358 C LYS A 90 5.540 24.314 -12.457 1.00 16.76 C ATOM 1359 O LYS A 90 6.163 25.247 -12.967 1.00 17.66 O ATOM 1360 CB LYS A 90 3.048 24.295 -12.539 1.00 16.38 C ATOM 1361 CG LYS A 90 1.771 23.644 -13.048 1.00 16.21 C ATOM 1362 CD LYS A 90 0.532 24.340 -12.503 1.00 16.55 C ATOM 1363 CE LYS A 90 0.423 24.192 -10.993 1.00 16.86 C ATOM 1364 NZ LYS A 90 -0.777 24.888 -10.453 1.00 17.18 N ATOM 0 H LYS A 90 3.597 21.883 -12.431 1.00 15.06 H new ATOM 0 HA LYS A 90 4.354 23.965 -14.209 1.00 16.18 H new ATOM 0 HB2 LYS A 90 3.093 24.186 -11.455 1.00 16.38 H new ATOM 0 HB3 LYS A 90 3.009 25.363 -12.751 1.00 16.38 H new ATOM 0 HG2 LYS A 90 1.756 23.674 -14.137 1.00 16.21 H new ATOM 0 HG3 LYS A 90 1.757 22.594 -12.757 1.00 16.21 H new ATOM 0 HD2 LYS A 90 0.564 25.398 -12.764 1.00 16.55 H new ATOM 0 HD3 LYS A 90 -0.357 23.922 -12.975 1.00 16.55 H new ATOM 0 HE2 LYS A 90 0.376 23.134 -10.734 1.00 16.86 H new ATOM 0 HE3 LYS A 90 1.320 24.596 -10.523 1.00 16.86 H new ATOM 0 HZ1 LYS A 90 -0.815 24.764 -9.421 1.00 17.18 H new ATOM 0 HZ2 LYS A 90 -0.721 25.902 -10.678 1.00 17.18 H new ATOM 0 HZ3 LYS A 90 -1.634 24.485 -10.882 1.00 17.18 H new ATOM 1378 N ILE A 91 5.872 23.769 -11.290 1.00 16.32 N ATOM 1379 CA ILE A 91 7.014 24.244 -10.520 1.00 16.96 C ATOM 1380 C ILE A 91 8.321 24.003 -11.270 1.00 17.21 C ATOM 1381 O ILE A 91 9.170 24.891 -11.357 1.00 18.15 O ATOM 1382 CB ILE A 91 7.085 23.559 -9.139 1.00 16.50 C ATOM 1383 CG1 ILE A 91 5.829 23.876 -8.324 1.00 16.43 C ATOM 1384 CG2 ILE A 91 8.334 24.001 -8.390 1.00 17.34 C ATOM 1385 CD1 ILE A 91 5.720 23.083 -7.039 1.00 16.26 C ATOM 0 H ILE A 91 5.365 22.997 -10.858 1.00 16.32 H new ATOM 0 HA ILE A 91 6.877 25.316 -10.376 1.00 16.96 H new ATOM 0 HB ILE A 91 7.138 22.480 -9.288 1.00 16.50 H new ATOM 0 HG12 ILE A 91 5.820 24.940 -8.086 1.00 16.43 H new ATOM 0 HG13 ILE A 91 4.950 23.679 -8.937 1.00 16.43 H new ATOM 0 HG21 ILE A 91 8.369 23.509 -7.418 1.00 17.34 H new ATOM 0 HG22 ILE A 91 9.219 23.730 -8.966 1.00 17.34 H new ATOM 0 HG23 ILE A 91 8.310 25.082 -8.249 1.00 17.34 H new ATOM 0 HD11 ILE A 91 4.805 23.362 -6.516 1.00 16.26 H new ATOM 0 HD12 ILE A 91 5.696 22.018 -7.270 1.00 16.26 H new ATOM 0 HD13 ILE A 91 6.580 23.298 -6.405 1.00 16.26 H new ATOM 1397 N PHE A 92 8.477 22.797 -11.809 1.00 16.44 N ATOM 1398 CA PHE A 92 9.682 22.440 -12.551 1.00 16.75 C ATOM 1399 C PHE A 92 9.794 23.258 -13.833 1.00 17.52 C ATOM 1400 O PHE A 92 10.842 23.834 -14.122 1.00 18.34 O ATOM 1401 CB PHE A 92 9.689 20.947 -12.881 1.00 15.83 C ATOM 1402 CG PHE A 92 10.718 20.171 -12.109 1.00 15.63 C ATOM 1403 CD1 PHE A 92 10.464 19.750 -10.814 1.00 15.79 C ATOM 1404 CD2 PHE A 92 11.943 19.867 -12.680 1.00 15.41 C ATOM 1405 CE1 PHE A 92 11.412 19.038 -10.103 1.00 15.74 C ATOM 1406 CE2 PHE A 92 12.896 19.156 -11.975 1.00 15.39 C ATOM 1407 CZ PHE A 92 12.630 18.741 -10.684 1.00 15.56 C ATOM 0 H PHE A 92 7.784 22.051 -11.746 1.00 16.44 H new ATOM 0 HA PHE A 92 10.542 22.665 -11.920 1.00 16.75 H new ATOM 0 HB2 PHE A 92 8.702 20.532 -12.676 1.00 15.83 H new ATOM 0 HB3 PHE A 92 9.873 20.819 -13.948 1.00 15.83 H new ATOM 0 HD1 PHE A 92 9.514 19.981 -10.354 1.00 15.79 H new ATOM 0 HD2 PHE A 92 12.156 20.189 -13.688 1.00 15.41 H new ATOM 0 HE1 PHE A 92 11.201 18.714 -9.095 1.00 15.74 H new ATOM 0 HE2 PHE A 92 13.847 18.925 -12.432 1.00 15.39 H new ATOM 0 HZ PHE A 92 13.373 18.186 -10.130 1.00 15.56 H new ATOM 1417 N ASP A 93 8.709 23.304 -14.598 1.00 17.35 N ATOM 1418 CA ASP A 93 8.692 24.058 -15.845 1.00 18.13 C ATOM 1419 C ASP A 93 8.950 25.535 -15.567 1.00 19.15 C ATOM 1420 O ASP A 93 8.043 26.274 -15.184 1.00 19.29 O ATOM 1421 CB ASP A 93 7.349 23.882 -16.558 1.00 17.78 C ATOM 1422 CG ASP A 93 7.418 24.258 -18.026 1.00 18.61 C ATOM 1423 OD1 ASP A 93 8.234 25.138 -18.374 1.00 18.94 O ATOM 1424 OD2 ASP A 93 6.659 23.673 -18.828 1.00 18.99 O ATOM 0 H ASP A 93 7.833 22.830 -14.377 1.00 17.35 H new ATOM 0 HA ASP A 93 9.481 23.677 -16.493 1.00 18.13 H new ATOM 0 HB2 ASP A 93 7.026 22.845 -16.466 1.00 17.78 H new ATOM 0 HB3 ASP A 93 6.596 24.496 -16.064 1.00 17.78 H new ATOM 1429 N ARG A 94 10.198 25.954 -15.761 1.00 19.94 N ATOM 1430 CA ARG A 94 10.595 27.339 -15.523 1.00 20.98 C ATOM 1431 C ARG A 94 9.670 28.312 -16.250 1.00 21.56 C ATOM 1432 O ARG A 94 9.488 29.450 -15.817 1.00 22.25 O ATOM 1433 CB ARG A 94 12.042 27.564 -15.975 1.00 21.74 C ATOM 1434 CG ARG A 94 13.029 26.536 -15.436 1.00 21.43 C ATOM 1435 CD ARG A 94 13.161 26.605 -13.922 1.00 21.19 C ATOM 1436 NE ARG A 94 13.312 27.977 -13.449 1.00 21.42 N ATOM 1437 CZ ARG A 94 12.818 28.419 -12.295 1.00 21.61 C ATOM 1438 NH1 ARG A 94 12.136 27.601 -11.503 1.00 21.58 N ATOM 1439 NH2 ARG A 94 13.002 29.683 -11.935 1.00 21.94 N ATOM 0 H ARG A 94 10.955 25.351 -16.084 1.00 19.94 H new ATOM 0 HA ARG A 94 10.519 27.527 -14.452 1.00 20.98 H new ATOM 0 HB2 ARG A 94 12.077 27.550 -17.064 1.00 21.74 H new ATOM 0 HB3 ARG A 94 12.360 28.558 -15.659 1.00 21.74 H new ATOM 0 HG2 ARG A 94 12.704 25.537 -15.726 1.00 21.43 H new ATOM 0 HG3 ARG A 94 14.006 26.699 -15.892 1.00 21.43 H new ATOM 0 HD2 ARG A 94 12.281 26.157 -13.460 1.00 21.19 H new ATOM 0 HD3 ARG A 94 14.022 26.016 -13.606 1.00 21.19 H new ATOM 0 HE ARG A 94 13.825 28.635 -14.036 1.00 21.42 H new ATOM 0 HH11 ARG A 94 11.989 26.630 -11.778 1.00 21.58 H new ATOM 0 HH12 ARG A 94 11.759 27.943 -10.619 1.00 21.58 H new ATOM 0 HH21 ARG A 94 13.522 30.316 -12.543 1.00 21.94 H new ATOM 0 HH22 ARG A 94 12.623 30.022 -11.051 1.00 21.94 H new ATOM 1453 N ASP A 95 9.088 27.857 -17.356 1.00 21.37 N ATOM 1454 CA ASP A 95 8.180 28.689 -18.140 1.00 21.99 C ATOM 1455 C ASP A 95 6.755 28.154 -18.062 1.00 21.37 C ATOM 1456 O ASP A 95 6.518 27.056 -17.558 1.00 20.39 O ATOM 1457 CB ASP A 95 8.629 28.737 -19.601 1.00 22.48 C ATOM 1458 CG ASP A 95 10.132 28.864 -19.743 1.00 22.92 C ATOM 1459 OD1 ASP A 95 10.653 29.984 -19.562 1.00 22.92 O ATOM 1460 OD2 ASP A 95 10.785 27.842 -20.038 1.00 23.34 O ATOM 0 H ASP A 95 9.229 26.918 -17.729 1.00 21.37 H new ATOM 0 HA ASP A 95 8.202 29.696 -17.724 1.00 21.99 H new ATOM 0 HB2 ASP A 95 8.294 27.833 -20.110 1.00 22.48 H new ATOM 0 HB3 ASP A 95 8.148 29.580 -20.098 1.00 22.48 H new ATOM 1465 N GLY A 96 5.808 28.942 -18.562 1.00 22.00 N ATOM 1466 CA GLY A 96 4.416 28.534 -18.549 1.00 21.64 C ATOM 1467 C GLY A 96 3.967 28.001 -19.894 1.00 21.55 C ATOM 1468 O GLY A 96 2.787 27.713 -20.093 1.00 21.40 O ATOM 0 H GLY A 96 5.981 29.858 -18.977 1.00 22.00 H new ATOM 0 HA2 GLY A 96 4.270 27.767 -17.788 1.00 21.64 H new ATOM 0 HA3 GLY A 96 3.792 29.383 -18.269 1.00 21.64 H new ATOM 1472 N ASP A 97 4.914 27.879 -20.821 1.00 21.75 N ATOM 1473 CA ASP A 97 4.621 27.386 -22.161 1.00 21.82 C ATOM 1474 C ASP A 97 3.986 25.999 -22.113 1.00 20.80 C ATOM 1475 O ASP A 97 3.156 25.658 -22.957 1.00 20.85 O ATOM 1476 CB ASP A 97 5.899 27.350 -22.999 1.00 22.28 C ATOM 1477 CG ASP A 97 6.867 26.279 -22.537 1.00 21.72 C ATOM 1478 OD1 ASP A 97 7.401 26.401 -21.414 1.00 21.34 O ATOM 1479 OD2 ASP A 97 7.094 25.318 -23.300 1.00 21.74 O ATOM 0 H ASP A 97 5.894 28.116 -20.666 1.00 21.75 H new ATOM 0 HA ASP A 97 3.908 28.068 -22.623 1.00 21.82 H new ATOM 0 HB2 ASP A 97 5.640 27.175 -24.043 1.00 22.28 H new ATOM 0 HB3 ASP A 97 6.389 28.323 -22.951 1.00 22.28 H new ATOM 1484 N GLY A 98 4.380 25.206 -21.122 1.00 19.93 N ATOM 1485 CA GLY A 98 3.832 23.869 -20.980 1.00 18.92 C ATOM 1486 C GLY A 98 4.821 22.782 -21.356 1.00 18.54 C ATOM 1487 O GLY A 98 4.442 21.623 -21.521 1.00 17.94 O ATOM 0 H GLY A 98 5.068 25.465 -20.415 1.00 19.93 H new ATOM 0 HA2 GLY A 98 3.512 23.721 -19.949 1.00 18.92 H new ATOM 0 HA3 GLY A 98 2.944 23.777 -21.606 1.00 18.92 H new ATOM 1491 N PHE A 99 6.090 23.153 -21.496 1.00 19.01 N ATOM 1492 CA PHE A 99 7.131 22.194 -21.854 1.00 18.88 C ATOM 1493 C PHE A 99 8.405 22.440 -21.048 1.00 18.97 C ATOM 1494 O PHE A 99 8.746 23.583 -20.739 1.00 19.56 O ATOM 1495 CB PHE A 99 7.438 22.268 -23.351 1.00 19.81 C ATOM 1496 CG PHE A 99 6.281 21.871 -24.226 1.00 19.89 C ATOM 1497 CD1 PHE A 99 6.108 20.552 -24.616 1.00 20.07 C ATOM 1498 CD2 PHE A 99 5.365 22.818 -24.655 1.00 19.90 C ATOM 1499 CE1 PHE A 99 5.043 20.186 -25.418 1.00 20.28 C ATOM 1500 CE2 PHE A 99 4.300 22.458 -25.457 1.00 20.10 C ATOM 1501 CZ PHE A 99 4.146 21.134 -25.848 1.00 20.30 C ATOM 0 H PHE A 99 6.422 24.109 -21.367 1.00 19.01 H new ATOM 0 HA PHE A 99 6.761 21.197 -21.617 1.00 18.88 H new ATOM 0 HB2 PHE A 99 7.739 23.285 -23.601 1.00 19.81 H new ATOM 0 HB3 PHE A 99 8.287 21.621 -23.571 1.00 19.81 H new ATOM 0 HD1 PHE A 99 6.813 19.802 -24.290 1.00 20.07 H new ATOM 0 HD2 PHE A 99 5.485 23.850 -24.359 1.00 19.90 H new ATOM 0 HE1 PHE A 99 4.916 19.153 -25.707 1.00 20.28 H new ATOM 0 HE2 PHE A 99 3.589 23.204 -25.779 1.00 20.10 H new ATOM 0 HZ PHE A 99 3.324 20.851 -26.488 1.00 20.30 H new ATOM 1511 N ILE A 100 9.106 21.357 -20.712 1.00 18.48 N ATOM 1512 CA ILE A 100 10.338 21.454 -19.938 1.00 18.67 C ATOM 1513 C ILE A 100 11.543 20.974 -20.744 1.00 19.37 C ATOM 1514 O ILE A 100 11.475 19.962 -21.443 1.00 19.21 O ATOM 1515 CB ILE A 100 10.243 20.632 -18.637 1.00 17.64 C ATOM 1516 CG1 ILE A 100 8.972 21.004 -17.871 1.00 16.97 C ATOM 1517 CG2 ILE A 100 11.478 20.858 -17.775 1.00 18.04 C ATOM 1518 CD1 ILE A 100 8.709 20.133 -16.663 1.00 15.92 C ATOM 0 H ILE A 100 8.840 20.405 -20.964 1.00 18.48 H new ATOM 0 HA ILE A 100 10.473 22.507 -19.691 1.00 18.67 H new ATOM 0 HB ILE A 100 10.195 19.573 -18.892 1.00 17.64 H new ATOM 0 HG12 ILE A 100 9.044 22.043 -17.549 1.00 16.97 H new ATOM 0 HG13 ILE A 100 8.119 20.938 -18.547 1.00 16.97 H new ATOM 0 HG21 ILE A 100 11.396 20.271 -16.860 1.00 18.04 H new ATOM 0 HG22 ILE A 100 12.367 20.550 -18.325 1.00 18.04 H new ATOM 0 HG23 ILE A 100 11.556 21.915 -17.522 1.00 18.04 H new ATOM 0 HD11 ILE A 100 7.791 20.458 -16.173 1.00 15.92 H new ATOM 0 HD12 ILE A 100 8.603 19.095 -16.979 1.00 15.92 H new ATOM 0 HD13 ILE A 100 9.542 20.217 -15.966 1.00 15.92 H new ATOM 1530 N SER A 101 12.643 21.711 -20.635 1.00 20.25 N ATOM 1531 CA SER A 101 13.874 21.375 -21.343 1.00 21.07 C ATOM 1532 C SER A 101 14.987 21.034 -20.354 1.00 21.23 C ATOM 1533 O SER A 101 14.936 21.456 -19.200 1.00 20.98 O ATOM 1534 CB SER A 101 14.309 22.540 -22.234 1.00 22.16 C ATOM 1535 OG SER A 101 14.364 23.750 -21.501 1.00 22.49 O ATOM 0 H SER A 101 12.708 22.550 -20.059 1.00 20.25 H new ATOM 0 HA SER A 101 13.682 20.503 -21.968 1.00 21.07 H new ATOM 0 HB2 SER A 101 15.288 22.327 -22.664 1.00 22.16 H new ATOM 0 HB3 SER A 101 13.612 22.646 -23.065 1.00 22.16 H new ATOM 0 HG SER A 101 13.457 24.022 -21.249 1.00 22.49 H new ATOM 1541 N PRO A 102 16.001 20.257 -20.782 1.00 21.74 N ATOM 1542 CA PRO A 102 17.116 19.871 -19.912 1.00 22.05 C ATOM 1543 C PRO A 102 17.647 21.042 -19.085 1.00 22.55 C ATOM 1544 O PRO A 102 18.003 20.881 -17.918 1.00 22.43 O ATOM 1545 CB PRO A 102 18.174 19.393 -20.904 1.00 23.00 C ATOM 1546 CG PRO A 102 17.390 18.852 -22.051 1.00 22.78 C ATOM 1547 CD PRO A 102 16.146 19.698 -22.142 1.00 22.19 C ATOM 0 HA PRO A 102 16.823 19.121 -19.177 1.00 22.05 H new ATOM 0 HB2 PRO A 102 18.823 20.211 -21.217 1.00 23.00 H new ATOM 0 HB3 PRO A 102 18.814 18.628 -20.464 1.00 23.00 H new ATOM 0 HG2 PRO A 102 17.965 18.904 -22.975 1.00 22.78 H new ATOM 0 HG3 PRO A 102 17.138 17.804 -21.891 1.00 22.78 H new ATOM 0 HD2 PRO A 102 16.251 20.485 -22.889 1.00 22.19 H new ATOM 0 HD3 PRO A 102 15.277 19.103 -22.425 1.00 22.19 H new ATOM 1555 N ALA A 103 17.686 22.222 -19.700 1.00 23.17 N ATOM 1556 CA ALA A 103 18.168 23.426 -19.030 1.00 23.77 C ATOM 1557 C ALA A 103 17.270 23.795 -17.855 1.00 23.02 C ATOM 1558 O ALA A 103 17.745 24.208 -16.797 1.00 23.22 O ATOM 1559 CB ALA A 103 18.231 24.580 -20.016 1.00 24.56 C ATOM 0 H ALA A 103 17.388 22.369 -20.664 1.00 23.17 H new ATOM 0 HA ALA A 103 19.168 23.224 -18.646 1.00 23.77 H new ATOM 0 HB1 ALA A 103 18.592 25.474 -19.507 1.00 24.56 H new ATOM 0 HB2 ALA A 103 18.910 24.327 -20.830 1.00 24.56 H new ATOM 0 HB3 ALA A 103 17.236 24.769 -20.419 1.00 24.56 H new ATOM 1565 N GLU A 104 15.971 23.642 -18.061 1.00 22.23 N ATOM 1566 CA GLU A 104 14.982 23.952 -17.041 1.00 21.53 C ATOM 1567 C GLU A 104 15.007 22.900 -15.942 1.00 20.75 C ATOM 1568 O GLU A 104 14.919 23.220 -14.758 1.00 20.59 O ATOM 1569 CB GLU A 104 13.591 24.016 -17.673 1.00 20.94 C ATOM 1570 CG GLU A 104 13.382 25.219 -18.577 1.00 21.74 C ATOM 1571 CD GLU A 104 11.962 25.310 -19.107 1.00 21.28 C ATOM 1572 OE1 GLU A 104 11.081 25.787 -18.362 1.00 21.43 O ATOM 1573 OE2 GLU A 104 11.731 24.901 -20.264 1.00 20.84 O ATOM 0 H GLU A 104 15.574 23.301 -18.936 1.00 22.23 H new ATOM 0 HA GLU A 104 15.221 24.920 -16.601 1.00 21.53 H new ATOM 0 HB2 GLU A 104 13.422 23.107 -18.250 1.00 20.94 H new ATOM 0 HB3 GLU A 104 12.843 24.035 -16.881 1.00 20.94 H new ATOM 0 HG2 GLU A 104 13.619 26.129 -18.026 1.00 21.74 H new ATOM 0 HG3 GLU A 104 14.076 25.164 -19.416 1.00 21.74 H new ATOM 1580 N LEU A 105 15.133 21.643 -16.351 1.00 20.36 N ATOM 1581 CA LEU A 105 15.172 20.533 -15.413 1.00 19.67 C ATOM 1582 C LEU A 105 16.320 20.711 -14.428 1.00 20.33 C ATOM 1583 O LEU A 105 16.121 20.702 -13.214 1.00 19.95 O ATOM 1584 CB LEU A 105 15.340 19.216 -16.173 1.00 19.42 C ATOM 1585 CG LEU A 105 14.869 17.974 -15.422 1.00 18.62 C ATOM 1586 CD1 LEU A 105 13.379 17.760 -15.628 1.00 17.90 C ATOM 1587 CD2 LEU A 105 15.651 16.748 -15.869 1.00 18.59 C ATOM 0 H LEU A 105 15.210 21.369 -17.330 1.00 20.36 H new ATOM 0 HA LEU A 105 14.234 20.511 -14.858 1.00 19.67 H new ATOM 0 HB2 LEU A 105 14.792 19.284 -17.113 1.00 19.42 H new ATOM 0 HB3 LEU A 105 16.393 19.092 -16.426 1.00 19.42 H new ATOM 0 HG LEU A 105 15.051 18.127 -14.358 1.00 18.62 H new ATOM 0 HD11 LEU A 105 13.061 16.870 -15.085 1.00 17.90 H new ATOM 0 HD12 LEU A 105 12.832 18.627 -15.256 1.00 17.90 H new ATOM 0 HD13 LEU A 105 13.174 17.630 -16.691 1.00 17.90 H new ATOM 0 HD21 LEU A 105 15.300 15.873 -15.322 1.00 18.59 H new ATOM 0 HD22 LEU A 105 15.502 16.591 -16.937 1.00 18.59 H new ATOM 0 HD23 LEU A 105 16.712 16.900 -15.669 1.00 18.59 H new ATOM 1599 N ARG A 106 17.522 20.876 -14.971 1.00 21.40 N ATOM 1600 CA ARG A 106 18.722 21.055 -14.161 1.00 22.20 C ATOM 1601 C ARG A 106 18.568 22.212 -13.178 1.00 22.44 C ATOM 1602 O ARG A 106 18.841 22.065 -11.987 1.00 22.57 O ATOM 1603 CB ARG A 106 19.934 21.296 -15.068 1.00 23.35 C ATOM 1604 CG ARG A 106 21.047 22.088 -14.403 1.00 24.22 C ATOM 1605 CD ARG A 106 22.347 22.008 -15.186 1.00 25.21 C ATOM 1606 NE ARG A 106 22.329 22.858 -16.374 1.00 25.76 N ATOM 1607 CZ ARG A 106 23.427 23.343 -16.947 1.00 26.69 C ATOM 1608 NH1 ARG A 106 24.621 23.071 -16.437 1.00 27.16 N ATOM 1609 NH2 ARG A 106 23.331 24.102 -18.030 1.00 27.19 N ATOM 0 H ARG A 106 17.691 20.889 -15.977 1.00 21.40 H new ATOM 0 HA ARG A 106 18.875 20.144 -13.583 1.00 22.20 H new ATOM 0 HB2 ARG A 106 20.330 20.334 -15.394 1.00 23.35 H new ATOM 0 HB3 ARG A 106 19.607 21.826 -15.963 1.00 23.35 H new ATOM 0 HG2 ARG A 106 20.744 23.131 -14.309 1.00 24.22 H new ATOM 0 HG3 ARG A 106 21.208 21.710 -13.393 1.00 24.22 H new ATOM 0 HD2 ARG A 106 23.176 22.304 -14.542 1.00 25.21 H new ATOM 0 HD3 ARG A 106 22.527 20.975 -15.483 1.00 25.21 H new ATOM 0 HE ARG A 106 21.426 23.092 -16.786 1.00 25.76 H new ATOM 0 HH11 ARG A 106 24.699 22.489 -15.603 1.00 27.16 H new ATOM 0 HH12 ARG A 106 25.461 23.444 -16.879 1.00 27.16 H new ATOM 0 HH21 ARG A 106 22.415 24.314 -18.424 1.00 27.19 H new ATOM 0 HH22 ARG A 106 24.174 24.474 -18.469 1.00 27.19 H new ATOM 1623 N PHE A 107 18.132 23.359 -13.686 1.00 22.61 N ATOM 1624 CA PHE A 107 17.962 24.550 -12.860 1.00 22.97 C ATOM 1625 C PHE A 107 17.065 24.280 -11.654 1.00 22.14 C ATOM 1626 O PHE A 107 17.271 24.854 -10.585 1.00 22.53 O ATOM 1627 CB PHE A 107 17.381 25.694 -13.693 1.00 23.24 C ATOM 1628 CG PHE A 107 17.384 27.015 -12.980 1.00 23.93 C ATOM 1629 CD1 PHE A 107 18.514 27.815 -12.977 1.00 24.11 C ATOM 1630 CD2 PHE A 107 16.252 27.457 -12.313 1.00 24.48 C ATOM 1631 CE1 PHE A 107 18.518 29.032 -12.322 1.00 24.82 C ATOM 1632 CE2 PHE A 107 16.250 28.673 -11.656 1.00 25.19 C ATOM 1633 CZ PHE A 107 17.391 29.460 -11.659 1.00 25.36 C ATOM 0 H PHE A 107 17.889 23.490 -14.668 1.00 22.61 H new ATOM 0 HA PHE A 107 18.947 24.834 -12.489 1.00 22.97 H new ATOM 0 HB2 PHE A 107 17.953 25.787 -14.616 1.00 23.24 H new ATOM 0 HB3 PHE A 107 16.358 25.445 -13.975 1.00 23.24 H new ATOM 0 HD1 PHE A 107 19.403 27.484 -13.493 1.00 24.11 H new ATOM 0 HD2 PHE A 107 15.362 26.845 -12.307 1.00 24.48 H new ATOM 0 HE1 PHE A 107 19.406 29.647 -12.331 1.00 24.82 H new ATOM 0 HE2 PHE A 107 15.362 29.009 -11.142 1.00 25.19 H new ATOM 0 HZ PHE A 107 17.395 30.408 -11.142 1.00 25.36 H new ATOM 1643 N VAL A 108 16.075 23.409 -11.823 1.00 21.06 N ATOM 1644 CA VAL A 108 15.151 23.095 -10.737 1.00 20.23 C ATOM 1645 C VAL A 108 15.752 22.109 -9.738 1.00 20.08 C ATOM 1646 O VAL A 108 15.807 22.392 -8.543 1.00 20.21 O ATOM 1647 CB VAL A 108 13.825 22.523 -11.265 1.00 19.12 C ATOM 1648 CG1 VAL A 108 12.880 22.215 -10.113 1.00 18.33 C ATOM 1649 CG2 VAL A 108 13.178 23.491 -12.242 1.00 19.13 C ATOM 0 H VAL A 108 15.892 22.911 -12.694 1.00 21.06 H new ATOM 0 HA VAL A 108 14.958 24.039 -10.228 1.00 20.23 H new ATOM 0 HB VAL A 108 14.038 21.593 -11.793 1.00 19.12 H new ATOM 0 HG11 VAL A 108 11.947 21.811 -10.506 1.00 18.33 H new ATOM 0 HG12 VAL A 108 13.341 21.483 -9.450 1.00 18.33 H new ATOM 0 HG13 VAL A 108 12.674 23.130 -9.557 1.00 18.33 H new ATOM 0 HG21 VAL A 108 12.241 23.069 -12.605 1.00 19.13 H new ATOM 0 HG22 VAL A 108 12.979 24.437 -11.739 1.00 19.13 H new ATOM 0 HG23 VAL A 108 13.849 23.662 -13.084 1.00 19.13 H new ATOM 1659 N MET A 109 16.199 20.953 -10.226 1.00 19.93 N ATOM 1660 CA MET A 109 16.779 19.930 -9.358 1.00 19.90 C ATOM 1661 C MET A 109 17.859 20.514 -8.453 1.00 20.93 C ATOM 1662 O MET A 109 17.939 20.171 -7.273 1.00 20.91 O ATOM 1663 CB MET A 109 17.349 18.784 -10.190 1.00 20.00 C ATOM 1664 CG MET A 109 16.280 17.898 -10.812 1.00 18.99 C ATOM 1665 SD MET A 109 16.949 16.762 -12.039 1.00 18.30 S ATOM 1666 CE MET A 109 17.503 17.926 -13.279 1.00 17.64 C ATOM 0 H MET A 109 16.171 20.702 -11.214 1.00 19.93 H new ATOM 0 HA MET A 109 15.982 19.543 -8.723 1.00 19.90 H new ATOM 0 HB2 MET A 109 17.975 19.196 -10.982 1.00 20.00 H new ATOM 0 HB3 MET A 109 17.995 18.173 -9.559 1.00 20.00 H new ATOM 0 HG2 MET A 109 15.784 17.328 -10.027 1.00 18.99 H new ATOM 0 HG3 MET A 109 15.520 18.525 -11.279 1.00 18.99 H new ATOM 0 HE1 MET A 109 17.578 17.423 -14.243 1.00 17.64 H new ATOM 0 HE2 MET A 109 16.789 18.747 -13.352 1.00 17.64 H new ATOM 0 HE3 MET A 109 18.480 18.319 -12.998 1.00 17.64 H new ATOM 1676 N ILE A 110 18.690 21.393 -9.005 1.00 21.91 N ATOM 1677 CA ILE A 110 19.751 22.024 -8.228 1.00 22.98 C ATOM 1678 C ILE A 110 19.161 22.867 -7.102 1.00 22.97 C ATOM 1679 O ILE A 110 19.752 22.992 -6.028 1.00 23.58 O ATOM 1680 CB ILE A 110 20.652 22.907 -9.117 1.00 24.01 C ATOM 1681 CG1 ILE A 110 21.370 22.043 -10.158 1.00 24.18 C ATOM 1682 CG2 ILE A 110 21.660 23.673 -8.266 1.00 25.13 C ATOM 1683 CD1 ILE A 110 22.181 22.840 -11.157 1.00 25.10 C ATOM 0 H ILE A 110 18.650 21.683 -9.982 1.00 21.91 H new ATOM 0 HA ILE A 110 20.361 21.228 -7.802 1.00 22.98 H new ATOM 0 HB ILE A 110 20.027 23.633 -9.637 1.00 24.01 H new ATOM 0 HG12 ILE A 110 22.029 21.344 -9.644 1.00 24.18 H new ATOM 0 HG13 ILE A 110 20.631 21.448 -10.695 1.00 24.18 H new ATOM 0 HG21 ILE A 110 22.286 24.290 -8.911 1.00 25.13 H new ATOM 0 HG22 ILE A 110 21.129 24.310 -7.558 1.00 25.13 H new ATOM 0 HG23 ILE A 110 22.286 22.967 -7.720 1.00 25.13 H new ATOM 0 HD11 ILE A 110 22.660 22.160 -11.862 1.00 25.10 H new ATOM 0 HD12 ILE A 110 21.524 23.521 -11.699 1.00 25.10 H new ATOM 0 HD13 ILE A 110 22.944 23.414 -10.631 1.00 25.10 H new ATOM 1695 N ASN A 111 17.991 23.443 -7.357 1.00 22.36 N ATOM 1696 CA ASN A 111 17.307 24.268 -6.367 1.00 22.40 C ATOM 1697 C ASN A 111 16.750 23.409 -5.237 1.00 21.78 C ATOM 1698 O ASN A 111 16.779 23.804 -4.070 1.00 22.21 O ATOM 1699 CB ASN A 111 16.172 25.057 -7.023 1.00 21.96 C ATOM 1700 CG ASN A 111 16.679 26.116 -7.982 1.00 22.60 C ATOM 1701 OD1 ASN A 111 17.787 26.631 -7.829 1.00 23.32 O ATOM 1702 ND2 ASN A 111 15.865 26.451 -8.977 1.00 22.44 N ATOM 0 H ASN A 111 17.495 23.353 -8.244 1.00 22.36 H new ATOM 0 HA ASN A 111 18.033 24.966 -5.950 1.00 22.40 H new ATOM 0 HB2 ASN A 111 15.518 24.369 -7.559 1.00 21.96 H new ATOM 0 HB3 ASN A 111 15.569 25.531 -6.249 1.00 21.96 H new ATOM 0 HD21 ASN A 111 16.150 27.161 -9.652 1.00 22.44 H new ATOM 0 HD22 ASN A 111 14.955 25.998 -9.066 1.00 22.44 H new ATOM 1709 N LEU A 112 16.242 22.233 -5.590 1.00 20.83 N ATOM 1710 CA LEU A 112 15.671 21.317 -4.609 1.00 20.19 C ATOM 1711 C LEU A 112 16.767 20.637 -3.796 1.00 20.95 C ATOM 1712 O LEU A 112 16.544 20.220 -2.660 1.00 21.07 O ATOM 1713 CB LEU A 112 14.809 20.260 -5.303 1.00 19.00 C ATOM 1714 CG LEU A 112 14.111 20.721 -6.586 1.00 18.25 C ATOM 1715 CD1 LEU A 112 13.298 19.586 -7.187 1.00 17.58 C ATOM 1716 CD2 LEU A 112 13.225 21.929 -6.322 1.00 17.84 C ATOM 0 H LEU A 112 16.214 21.891 -6.551 1.00 20.83 H new ATOM 0 HA LEU A 112 15.046 21.898 -3.931 1.00 20.19 H new ATOM 0 HB2 LEU A 112 15.437 19.401 -5.540 1.00 19.00 H new ATOM 0 HB3 LEU A 112 14.050 19.916 -4.600 1.00 19.00 H new ATOM 0 HG LEU A 112 14.879 21.015 -7.301 1.00 18.25 H new ATOM 0 HD11 LEU A 112 12.809 19.931 -8.098 1.00 17.58 H new ATOM 0 HD12 LEU A 112 13.958 18.751 -7.424 1.00 17.58 H new ATOM 0 HD13 LEU A 112 12.543 19.260 -6.471 1.00 17.58 H new ATOM 0 HD21 LEU A 112 12.742 22.235 -7.250 1.00 17.84 H new ATOM 0 HD22 LEU A 112 12.465 21.669 -5.586 1.00 17.84 H new ATOM 0 HD23 LEU A 112 13.833 22.750 -5.941 1.00 17.84 H new ATOM 1728 N GLY A 113 17.951 20.529 -4.390 1.00 21.57 N ATOM 1729 CA GLY A 113 19.070 19.897 -3.713 1.00 22.41 C ATOM 1730 C GLY A 113 19.256 18.451 -4.129 1.00 22.40 C ATOM 1731 O GLY A 113 19.428 17.573 -3.283 1.00 23.05 O ATOM 0 H GLY A 113 18.156 20.868 -5.330 1.00 21.57 H new ATOM 0 HA2 GLY A 113 19.982 20.454 -3.927 1.00 22.41 H new ATOM 0 HA3 GLY A 113 18.913 19.945 -2.635 1.00 22.41 H new ATOM 1735 N GLU A 114 19.221 18.205 -5.434 1.00 21.76 N ATOM 1736 CA GLU A 114 19.380 16.856 -5.963 1.00 21.80 C ATOM 1737 C GLU A 114 20.798 16.623 -6.473 1.00 22.59 C ATOM 1738 O GLU A 114 21.280 15.490 -6.485 1.00 22.48 O ATOM 1739 CB GLU A 114 18.377 16.608 -7.085 1.00 20.80 C ATOM 1740 CG GLU A 114 16.931 16.777 -6.652 1.00 20.26 C ATOM 1741 CD GLU A 114 16.508 15.745 -5.627 1.00 20.12 C ATOM 1742 OE1 GLU A 114 16.704 15.994 -4.417 1.00 20.27 O ATOM 1743 OE2 GLU A 114 15.984 14.686 -6.031 1.00 19.96 O ATOM 0 H GLU A 114 19.084 18.923 -6.145 1.00 21.76 H new ATOM 0 HA GLU A 114 19.192 16.155 -5.150 1.00 21.80 H new ATOM 0 HB2 GLU A 114 18.585 17.294 -7.906 1.00 20.80 H new ATOM 0 HB3 GLU A 114 18.517 15.598 -7.470 1.00 20.80 H new ATOM 0 HG2 GLU A 114 16.794 17.775 -6.236 1.00 20.26 H new ATOM 0 HG3 GLU A 114 16.283 16.704 -7.525 1.00 20.26 H new ATOM 1750 N LYS A 115 21.459 17.697 -6.885 1.00 23.45 N ATOM 1751 CA LYS A 115 22.825 17.608 -7.397 1.00 24.32 C ATOM 1752 C LYS A 115 22.923 16.558 -8.502 1.00 23.94 C ATOM 1753 O LYS A 115 23.257 15.400 -8.246 1.00 23.86 O ATOM 1754 CB LYS A 115 23.791 17.262 -6.260 1.00 25.48 C ATOM 1755 CG LYS A 115 23.815 18.295 -5.143 1.00 26.26 C ATOM 1756 CD LYS A 115 24.424 19.613 -5.601 1.00 26.75 C ATOM 1757 CE LYS A 115 25.913 19.475 -5.882 1.00 27.55 C ATOM 1758 NZ LYS A 115 26.664 19.007 -4.684 1.00 27.96 N ATOM 0 H LYS A 115 21.073 18.641 -6.876 1.00 23.45 H new ATOM 0 HA LYS A 115 23.097 18.576 -7.817 1.00 24.32 H new ATOM 0 HB2 LYS A 115 23.515 16.294 -5.842 1.00 25.48 H new ATOM 0 HB3 LYS A 115 24.796 17.158 -6.668 1.00 25.48 H new ATOM 0 HG2 LYS A 115 22.799 18.469 -4.787 1.00 26.26 H new ATOM 0 HG3 LYS A 115 24.386 17.905 -4.300 1.00 26.26 H new ATOM 0 HD2 LYS A 115 23.914 19.957 -6.501 1.00 26.75 H new ATOM 0 HD3 LYS A 115 24.267 20.373 -4.835 1.00 26.75 H new ATOM 0 HE2 LYS A 115 26.064 18.773 -6.702 1.00 27.55 H new ATOM 0 HE3 LYS A 115 26.311 20.436 -6.208 1.00 27.55 H new ATOM 0 HZ1 LYS A 115 27.676 19.212 -4.807 1.00 27.96 H new ATOM 0 HZ2 LYS A 115 26.311 19.499 -3.839 1.00 27.96 H new ATOM 0 HZ3 LYS A 115 26.530 17.982 -4.569 1.00 27.96 H new ATOM 1772 N VAL A 116 22.628 16.972 -9.731 1.00 23.78 N ATOM 1773 CA VAL A 116 22.671 16.069 -10.878 1.00 23.53 C ATOM 1774 C VAL A 116 23.484 16.650 -12.025 1.00 24.38 C ATOM 1775 O VAL A 116 23.638 17.867 -12.141 1.00 24.75 O ATOM 1776 CB VAL A 116 21.259 15.765 -11.409 1.00 22.24 C ATOM 1777 CG1 VAL A 116 20.561 14.726 -10.550 1.00 21.40 C ATOM 1778 CG2 VAL A 116 20.438 17.042 -11.487 1.00 21.91 C ATOM 0 H VAL A 116 22.356 17.928 -9.959 1.00 23.78 H new ATOM 0 HA VAL A 116 23.142 15.153 -10.520 1.00 23.53 H new ATOM 0 HB VAL A 116 21.355 15.352 -12.413 1.00 22.24 H new ATOM 0 HG11 VAL A 116 19.566 14.532 -10.950 1.00 21.40 H new ATOM 0 HG12 VAL A 116 21.140 13.802 -10.554 1.00 21.40 H new ATOM 0 HG13 VAL A 116 20.476 15.096 -9.528 1.00 21.40 H new ATOM 0 HG21 VAL A 116 19.442 16.812 -11.864 1.00 21.91 H new ATOM 0 HG22 VAL A 116 20.357 17.484 -10.494 1.00 21.91 H new ATOM 0 HG23 VAL A 116 20.926 17.748 -12.159 1.00 21.91 H new ATOM 1788 N THR A 117 24.006 15.767 -12.869 1.00 24.76 N ATOM 1789 CA THR A 117 24.781 16.179 -14.028 1.00 25.62 C ATOM 1790 C THR A 117 23.885 16.228 -15.259 1.00 25.03 C ATOM 1791 O THR A 117 22.951 15.436 -15.386 1.00 24.12 O ATOM 1792 CB THR A 117 25.955 15.220 -14.296 1.00 26.54 C ATOM 1793 OG1 THR A 117 25.459 13.909 -14.594 1.00 25.98 O ATOM 1794 CG2 THR A 117 26.886 15.153 -13.095 1.00 27.24 C ATOM 0 H THR A 117 23.904 14.757 -12.769 1.00 24.76 H new ATOM 0 HA THR A 117 25.187 17.169 -13.819 1.00 25.62 H new ATOM 0 HB THR A 117 26.516 15.600 -15.150 1.00 26.54 H new ATOM 0 HG1 THR A 117 26.212 13.305 -14.765 1.00 25.98 H new ATOM 0 HG21 THR A 117 27.707 14.469 -13.309 1.00 27.24 H new ATOM 0 HG22 THR A 117 27.285 16.146 -12.888 1.00 27.24 H new ATOM 0 HG23 THR A 117 26.334 14.796 -12.226 1.00 27.24 H new ATOM 1802 N ASP A 118 24.170 17.159 -16.162 1.00 25.62 N ATOM 1803 CA ASP A 118 23.379 17.316 -17.379 1.00 25.26 C ATOM 1804 C ASP A 118 23.306 16.015 -18.174 1.00 25.12 C ATOM 1805 O ASP A 118 22.460 15.866 -19.055 1.00 24.60 O ATOM 1806 CB ASP A 118 23.965 18.425 -18.251 1.00 26.22 C ATOM 1807 CG ASP A 118 23.909 19.781 -17.576 1.00 26.44 C ATOM 1808 OD1 ASP A 118 24.838 20.097 -16.803 1.00 26.51 O ATOM 1809 OD2 ASP A 118 22.937 20.526 -17.819 1.00 26.63 O ATOM 0 H ASP A 118 24.944 17.818 -16.075 1.00 25.62 H new ATOM 0 HA ASP A 118 22.366 17.586 -17.081 1.00 25.26 H new ATOM 0 HB2 ASP A 118 25.000 18.185 -18.492 1.00 26.22 H new ATOM 0 HB3 ASP A 118 23.420 18.469 -19.194 1.00 26.22 H new ATOM 1814 N GLU A 119 24.191 15.075 -17.856 1.00 25.66 N ATOM 1815 CA GLU A 119 24.226 13.792 -18.552 1.00 25.70 C ATOM 1816 C GLU A 119 23.140 12.846 -18.043 1.00 24.54 C ATOM 1817 O GLU A 119 22.328 12.347 -18.822 1.00 24.02 O ATOM 1818 CB GLU A 119 25.600 13.141 -18.388 1.00 26.79 C ATOM 1819 CG GLU A 119 26.740 13.980 -18.940 1.00 27.99 C ATOM 1820 CD GLU A 119 28.095 13.330 -18.735 1.00 28.61 C ATOM 1821 OE1 GLU A 119 28.516 12.548 -19.613 1.00 28.61 O ATOM 1822 OE2 GLU A 119 28.732 13.602 -17.696 1.00 29.14 O ATOM 0 H GLU A 119 24.892 15.177 -17.122 1.00 25.66 H new ATOM 0 HA GLU A 119 24.038 13.983 -19.608 1.00 25.70 H new ATOM 0 HB2 GLU A 119 25.779 12.951 -17.330 1.00 26.79 H new ATOM 0 HB3 GLU A 119 25.596 12.173 -18.889 1.00 26.79 H new ATOM 0 HG2 GLU A 119 26.579 14.149 -20.005 1.00 27.99 H new ATOM 0 HG3 GLU A 119 26.733 14.958 -18.458 1.00 27.99 H new ATOM 1829 N GLU A 120 23.127 12.605 -16.734 1.00 24.19 N ATOM 1830 CA GLU A 120 22.146 11.707 -16.131 1.00 23.13 C ATOM 1831 C GLU A 120 20.721 12.212 -16.325 1.00 21.97 C ATOM 1832 O GLU A 120 19.799 11.424 -16.551 1.00 21.17 O ATOM 1833 CB GLU A 120 22.437 11.521 -14.640 1.00 23.10 C ATOM 1834 CG GLU A 120 22.309 12.794 -13.821 1.00 22.97 C ATOM 1835 CD GLU A 120 22.551 12.555 -12.345 1.00 23.00 C ATOM 1836 OE1 GLU A 120 21.641 12.029 -11.670 1.00 22.54 O ATOM 1837 OE2 GLU A 120 23.652 12.896 -11.862 1.00 23.55 O ATOM 0 H GLU A 120 23.784 13.018 -16.072 1.00 24.19 H new ATOM 0 HA GLU A 120 22.231 10.745 -16.637 1.00 23.13 H new ATOM 0 HB2 GLU A 120 21.754 10.773 -14.238 1.00 23.10 H new ATOM 0 HB3 GLU A 120 23.447 11.127 -14.524 1.00 23.10 H new ATOM 0 HG2 GLU A 120 23.021 13.533 -14.189 1.00 22.97 H new ATOM 0 HG3 GLU A 120 21.313 13.214 -13.960 1.00 22.97 H new ATOM 1844 N ILE A 121 20.542 13.523 -16.250 1.00 21.93 N ATOM 1845 CA ILE A 121 19.221 14.118 -16.399 1.00 20.94 C ATOM 1846 C ILE A 121 18.758 14.119 -17.854 1.00 20.97 C ATOM 1847 O ILE A 121 17.580 13.897 -18.134 1.00 20.10 O ATOM 1848 CB ILE A 121 19.190 15.551 -15.838 1.00 21.05 C ATOM 1849 CG1 ILE A 121 20.087 16.479 -16.655 1.00 22.23 C ATOM 1850 CG2 ILE A 121 19.630 15.535 -14.384 1.00 20.98 C ATOM 1851 CD1 ILE A 121 19.849 17.947 -16.376 1.00 22.33 C ATOM 0 H ILE A 121 21.293 14.194 -16.087 1.00 21.93 H new ATOM 0 HA ILE A 121 18.531 13.500 -15.824 1.00 20.94 H new ATOM 0 HB ILE A 121 18.170 15.931 -15.904 1.00 21.05 H new ATOM 0 HG12 ILE A 121 21.130 16.242 -16.445 1.00 22.23 H new ATOM 0 HG13 ILE A 121 19.924 16.288 -17.716 1.00 22.23 H new ATOM 0 HG21 ILE A 121 19.608 16.550 -13.986 1.00 20.98 H new ATOM 0 HG22 ILE A 121 18.954 14.904 -13.806 1.00 20.98 H new ATOM 0 HG23 ILE A 121 20.643 15.140 -14.315 1.00 20.98 H new ATOM 0 HD11 ILE A 121 20.520 18.548 -16.990 1.00 22.33 H new ATOM 0 HD12 ILE A 121 18.816 18.200 -16.614 1.00 22.33 H new ATOM 0 HD13 ILE A 121 20.040 18.153 -15.323 1.00 22.33 H new ATOM 1863 N ASP A 122 19.682 14.368 -18.780 1.00 22.05 N ATOM 1864 CA ASP A 122 19.341 14.386 -20.199 1.00 22.30 C ATOM 1865 C ASP A 122 18.841 13.017 -20.647 1.00 21.86 C ATOM 1866 O ASP A 122 17.851 12.912 -21.372 1.00 21.46 O ATOM 1867 CB ASP A 122 20.551 14.801 -21.037 1.00 23.63 C ATOM 1868 CG ASP A 122 20.232 14.872 -22.516 1.00 24.02 C ATOM 1869 OD1 ASP A 122 19.818 15.954 -22.983 1.00 24.29 O ATOM 1870 OD2 ASP A 122 20.396 13.846 -23.211 1.00 24.14 O ATOM 0 H ASP A 122 20.663 14.558 -18.575 1.00 22.05 H new ATOM 0 HA ASP A 122 18.545 15.116 -20.348 1.00 22.30 H new ATOM 0 HB2 ASP A 122 20.908 15.773 -20.698 1.00 23.63 H new ATOM 0 HB3 ASP A 122 21.362 14.090 -20.877 1.00 23.63 H new ATOM 1875 N GLU A 123 19.535 11.970 -20.209 1.00 22.03 N ATOM 1876 CA GLU A 123 19.159 10.604 -20.557 1.00 21.74 C ATOM 1877 C GLU A 123 17.777 10.273 -20.008 1.00 20.39 C ATOM 1878 O GLU A 123 16.958 9.660 -20.693 1.00 20.02 O ATOM 1879 CB GLU A 123 20.190 9.613 -20.017 1.00 22.27 C ATOM 1880 CG GLU A 123 21.582 9.802 -20.603 1.00 23.66 C ATOM 1881 CD GLU A 123 21.606 9.641 -22.111 1.00 24.40 C ATOM 1882 OE1 GLU A 123 21.728 8.491 -22.583 1.00 24.74 O ATOM 1883 OE2 GLU A 123 21.504 10.665 -22.819 1.00 24.71 O ATOM 0 H GLU A 123 20.360 12.042 -19.613 1.00 22.03 H new ATOM 0 HA GLU A 123 19.130 10.523 -21.644 1.00 21.74 H new ATOM 0 HB2 GLU A 123 20.245 9.713 -18.933 1.00 22.27 H new ATOM 0 HB3 GLU A 123 19.851 8.598 -20.227 1.00 22.27 H new ATOM 0 HG2 GLU A 123 21.951 10.794 -20.341 1.00 23.66 H new ATOM 0 HG3 GLU A 123 22.263 9.079 -20.153 1.00 23.66 H new ATOM 1890 N MET A 124 17.529 10.679 -18.766 1.00 19.71 N ATOM 1891 CA MET A 124 16.241 10.438 -18.126 1.00 18.41 C ATOM 1892 C MET A 124 15.107 11.023 -18.962 1.00 17.96 C ATOM 1893 O MET A 124 14.024 10.442 -19.053 1.00 17.13 O ATOM 1894 CB MET A 124 16.227 11.047 -16.720 1.00 17.97 C ATOM 1895 CG MET A 124 14.846 11.087 -16.085 1.00 16.63 C ATOM 1896 SD MET A 124 14.886 11.663 -14.377 1.00 16.29 S ATOM 1897 CE MET A 124 15.565 13.308 -14.589 1.00 17.07 C ATOM 0 H MET A 124 18.203 11.176 -18.184 1.00 19.71 H new ATOM 0 HA MET A 124 16.092 9.361 -18.047 1.00 18.41 H new ATOM 0 HB2 MET A 124 16.896 10.473 -16.078 1.00 17.97 H new ATOM 0 HB3 MET A 124 16.624 12.061 -16.769 1.00 17.97 H new ATOM 0 HG2 MET A 124 14.200 11.741 -16.670 1.00 16.63 H new ATOM 0 HG3 MET A 124 14.406 10.091 -16.118 1.00 16.63 H new ATOM 0 HE1 MET A 124 15.017 14.011 -13.962 1.00 17.07 H new ATOM 0 HE2 MET A 124 16.616 13.308 -14.301 1.00 17.07 H new ATOM 0 HE3 MET A 124 15.475 13.607 -15.633 1.00 17.07 H new ATOM 1907 N ILE A 125 15.366 12.174 -19.572 1.00 18.60 N ATOM 1908 CA ILE A 125 14.376 12.841 -20.406 1.00 18.41 C ATOM 1909 C ILE A 125 14.060 12.000 -21.635 1.00 18.72 C ATOM 1910 O ILE A 125 12.901 11.860 -22.024 1.00 18.18 O ATOM 1911 CB ILE A 125 14.867 14.234 -20.850 1.00 19.25 C ATOM 1912 CG1 ILE A 125 15.010 15.151 -19.629 1.00 19.04 C ATOM 1913 CG2 ILE A 125 13.918 14.843 -21.877 1.00 19.27 C ATOM 1914 CD1 ILE A 125 15.533 16.535 -19.956 1.00 19.95 C ATOM 0 H ILE A 125 16.257 12.665 -19.503 1.00 18.60 H new ATOM 0 HA ILE A 125 13.472 12.964 -19.809 1.00 18.41 H new ATOM 0 HB ILE A 125 15.843 14.126 -21.323 1.00 19.25 H new ATOM 0 HG12 ILE A 125 14.039 15.246 -19.143 1.00 19.04 H new ATOM 0 HG13 ILE A 125 15.681 14.680 -18.911 1.00 19.04 H new ATOM 0 HG21 ILE A 125 14.286 15.825 -22.175 1.00 19.27 H new ATOM 0 HG22 ILE A 125 13.864 14.195 -22.752 1.00 19.27 H new ATOM 0 HG23 ILE A 125 12.925 14.945 -21.439 1.00 19.27 H new ATOM 0 HD11 ILE A 125 15.606 17.122 -19.041 1.00 19.95 H new ATOM 0 HD12 ILE A 125 16.519 16.453 -20.413 1.00 19.95 H new ATOM 0 HD13 ILE A 125 14.851 17.027 -20.650 1.00 19.95 H new ATOM 1926 N ARG A 126 15.103 11.448 -22.241 1.00 19.67 N ATOM 1927 CA ARG A 126 14.947 10.616 -23.427 1.00 20.18 C ATOM 1928 C ARG A 126 14.058 9.409 -23.137 1.00 19.36 C ATOM 1929 O ARG A 126 13.260 8.997 -23.979 1.00 19.42 O ATOM 1930 CB ARG A 126 16.314 10.146 -23.926 1.00 21.37 C ATOM 1931 CG ARG A 126 16.241 9.267 -25.164 1.00 22.05 C ATOM 1932 CD ARG A 126 17.618 8.773 -25.578 1.00 22.88 C ATOM 1933 NE ARG A 126 17.575 8.011 -26.824 1.00 23.53 N ATOM 1934 CZ ARG A 126 18.538 7.183 -27.217 1.00 24.32 C ATOM 1935 NH1 ARG A 126 19.613 7.003 -26.459 1.00 24.55 N ATOM 1936 NH2 ARG A 126 18.428 6.531 -28.366 1.00 24.95 N ATOM 0 H ARG A 126 16.068 11.562 -21.930 1.00 19.67 H new ATOM 0 HA ARG A 126 14.469 11.217 -24.200 1.00 20.18 H new ATOM 0 HB2 ARG A 126 16.931 11.018 -24.145 1.00 21.37 H new ATOM 0 HB3 ARG A 126 16.813 9.595 -23.129 1.00 21.37 H new ATOM 0 HG2 ARG A 126 15.591 8.414 -24.968 1.00 22.05 H new ATOM 0 HG3 ARG A 126 15.793 9.828 -25.984 1.00 22.05 H new ATOM 0 HD2 ARG A 126 18.288 9.625 -25.697 1.00 22.88 H new ATOM 0 HD3 ARG A 126 18.033 8.149 -24.786 1.00 22.88 H new ATOM 0 HE ARG A 126 16.759 8.121 -27.427 1.00 23.53 H new ATOM 0 HH11 ARG A 126 19.701 7.500 -25.573 1.00 24.55 H new ATOM 0 HH12 ARG A 126 20.351 6.367 -26.763 1.00 24.55 H new ATOM 0 HH21 ARG A 126 17.603 6.664 -28.951 1.00 24.95 H new ATOM 0 HH22 ARG A 126 19.168 5.896 -28.665 1.00 24.95 H new ATOM 1950 N GLU A 127 14.204 8.846 -21.941 1.00 18.69 N ATOM 1951 CA GLU A 127 13.421 7.682 -21.542 1.00 17.91 C ATOM 1952 C GLU A 127 11.960 8.051 -21.306 1.00 16.85 C ATOM 1953 O GLU A 127 11.073 7.203 -21.405 1.00 16.48 O ATOM 1954 CB GLU A 127 14.010 7.056 -20.275 1.00 17.50 C ATOM 1955 CG GLU A 127 15.411 6.504 -20.470 1.00 18.61 C ATOM 1956 CD GLU A 127 15.932 5.787 -19.238 1.00 18.51 C ATOM 1957 OE1 GLU A 127 15.631 4.586 -19.077 1.00 18.51 O ATOM 1958 OE2 GLU A 127 16.640 6.430 -18.434 1.00 18.54 O ATOM 0 H GLU A 127 14.858 9.177 -21.232 1.00 18.69 H new ATOM 0 HA GLU A 127 13.463 6.958 -22.355 1.00 17.91 H new ATOM 0 HB2 GLU A 127 14.030 7.805 -19.484 1.00 17.50 H new ATOM 0 HB3 GLU A 127 13.355 6.253 -19.937 1.00 17.50 H new ATOM 0 HG2 GLU A 127 15.412 5.815 -21.315 1.00 18.61 H new ATOM 0 HG3 GLU A 127 16.087 7.320 -20.724 1.00 18.61 H new ATOM 1965 N ALA A 128 11.716 9.319 -20.994 1.00 16.47 N ATOM 1966 CA ALA A 128 10.362 9.796 -20.741 1.00 15.57 C ATOM 1967 C ALA A 128 9.781 10.486 -21.968 1.00 16.23 C ATOM 1968 O ALA A 128 8.580 10.745 -22.035 1.00 15.78 O ATOM 1969 CB ALA A 128 10.353 10.744 -19.552 1.00 14.84 C ATOM 0 H ALA A 128 12.438 10.035 -20.910 1.00 16.47 H new ATOM 0 HA ALA A 128 9.738 8.932 -20.513 1.00 15.57 H new ATOM 0 HB1 ALA A 128 9.336 11.093 -19.373 1.00 14.84 H new ATOM 0 HB2 ALA A 128 10.718 10.222 -18.668 1.00 14.84 H new ATOM 0 HB3 ALA A 128 10.998 11.597 -19.762 1.00 14.84 H new ATOM 1975 N ASP A 129 10.640 10.779 -22.938 1.00 17.37 N ATOM 1976 CA ASP A 129 10.213 11.448 -24.160 1.00 18.16 C ATOM 1977 C ASP A 129 10.117 10.459 -25.318 1.00 18.88 C ATOM 1978 O ASP A 129 11.114 10.152 -25.973 1.00 19.74 O ATOM 1979 CB ASP A 129 11.187 12.578 -24.504 1.00 19.04 C ATOM 1980 CG ASP A 129 10.695 13.452 -25.641 1.00 19.91 C ATOM 1981 OD1 ASP A 129 9.666 13.099 -26.254 1.00 20.17 O ATOM 1982 OD2 ASP A 129 11.337 14.485 -25.923 1.00 20.40 O ATOM 0 H ASP A 129 11.636 10.563 -22.901 1.00 17.37 H new ATOM 0 HA ASP A 129 9.222 11.870 -23.994 1.00 18.16 H new ATOM 0 HB2 ASP A 129 11.347 13.195 -23.620 1.00 19.04 H new ATOM 0 HB3 ASP A 129 12.153 12.150 -24.773 1.00 19.04 H new ATOM 1987 N PHE A 130 8.906 9.966 -25.562 1.00 18.61 N ATOM 1988 CA PHE A 130 8.668 9.010 -26.639 1.00 19.35 C ATOM 1989 C PHE A 130 8.896 9.651 -28.003 1.00 20.46 C ATOM 1990 O PHE A 130 9.667 9.144 -28.817 1.00 21.43 O ATOM 1991 CB PHE A 130 7.242 8.465 -26.555 1.00 18.69 C ATOM 1992 CG PHE A 130 6.969 7.689 -25.299 1.00 17.66 C ATOM 1993 CD1 PHE A 130 6.571 8.338 -24.141 1.00 17.35 C ATOM 1994 CD2 PHE A 130 7.111 6.311 -25.275 1.00 17.07 C ATOM 1995 CE1 PHE A 130 6.320 7.627 -22.983 1.00 16.46 C ATOM 1996 CE2 PHE A 130 6.862 5.594 -24.120 1.00 16.17 C ATOM 1997 CZ PHE A 130 6.463 6.250 -22.974 1.00 15.86 C ATOM 0 H PHE A 130 8.073 10.213 -25.028 1.00 18.61 H new ATOM 0 HA PHE A 130 9.376 8.189 -26.523 1.00 19.35 H new ATOM 0 HB2 PHE A 130 6.540 9.296 -26.619 1.00 18.69 H new ATOM 0 HB3 PHE A 130 7.056 7.824 -27.416 1.00 18.69 H new ATOM 0 HD1 PHE A 130 6.456 9.412 -24.144 1.00 17.35 H new ATOM 0 HD2 PHE A 130 7.420 5.791 -26.170 1.00 17.07 H new ATOM 0 HE1 PHE A 130 6.013 8.145 -22.086 1.00 16.46 H new ATOM 0 HE2 PHE A 130 6.980 4.520 -24.115 1.00 16.17 H new ATOM 0 HZ PHE A 130 6.263 5.691 -22.072 1.00 15.86 H new ATOM 2007 N ASP A 131 8.218 10.769 -28.246 1.00 20.37 N ATOM 2008 CA ASP A 131 8.342 11.483 -29.511 1.00 21.43 C ATOM 2009 C ASP A 131 9.776 11.952 -29.737 1.00 22.32 C ATOM 2010 O ASP A 131 10.169 12.247 -30.867 1.00 23.37 O ATOM 2011 CB ASP A 131 7.386 12.677 -29.537 1.00 21.16 C ATOM 2012 CG ASP A 131 7.362 13.428 -28.220 1.00 20.32 C ATOM 2013 OD1 ASP A 131 6.547 13.069 -27.344 1.00 19.96 O ATOM 2014 OD2 ASP A 131 8.159 14.377 -28.065 1.00 20.09 O ATOM 0 H ASP A 131 7.576 11.200 -27.581 1.00 20.37 H new ATOM 0 HA ASP A 131 8.078 10.797 -30.316 1.00 21.43 H new ATOM 0 HB2 ASP A 131 7.682 13.358 -30.335 1.00 21.16 H new ATOM 0 HB3 ASP A 131 6.380 12.328 -29.772 1.00 21.16 H new ATOM 2019 N GLY A 132 10.552 12.015 -28.660 1.00 21.94 N ATOM 2020 CA GLY A 132 11.937 12.443 -28.762 1.00 22.81 C ATOM 2021 C GLY A 132 12.090 13.766 -29.486 1.00 23.39 C ATOM 2022 O GLY A 132 12.470 13.801 -30.656 1.00 24.32 O ATOM 0 H GLY A 132 10.247 11.777 -27.716 1.00 21.94 H new ATOM 0 HA2 GLY A 132 12.360 12.530 -27.761 1.00 22.81 H new ATOM 0 HA3 GLY A 132 12.511 11.679 -29.286 1.00 22.81 H new ATOM 2026 N ASP A 133 11.791 14.856 -28.787 1.00 22.90 N ATOM 2027 CA ASP A 133 11.898 16.191 -29.365 1.00 23.47 C ATOM 2028 C ASP A 133 12.716 17.106 -28.459 1.00 23.33 C ATOM 2029 O ASP A 133 12.927 18.278 -28.771 1.00 23.88 O ATOM 2030 CB ASP A 133 10.507 16.784 -29.592 1.00 23.07 C ATOM 2031 CG ASP A 133 9.811 17.145 -28.294 1.00 21.88 C ATOM 2032 OD1 ASP A 133 9.784 16.297 -27.378 1.00 21.33 O ATOM 2033 OD2 ASP A 133 9.292 18.276 -28.195 1.00 21.56 O ATOM 0 H ASP A 133 11.472 14.841 -27.818 1.00 22.90 H new ATOM 0 HA ASP A 133 12.408 16.108 -30.325 1.00 23.47 H new ATOM 0 HB2 ASP A 133 10.592 17.675 -30.215 1.00 23.07 H new ATOM 0 HB3 ASP A 133 9.896 16.068 -30.142 1.00 23.07 H new ATOM 2038 N GLY A 134 13.172 16.559 -27.335 1.00 22.67 N ATOM 2039 CA GLY A 134 13.962 17.334 -26.396 1.00 22.60 C ATOM 2040 C GLY A 134 13.109 18.208 -25.499 1.00 21.81 C ATOM 2041 O GLY A 134 13.599 19.175 -24.913 1.00 21.94 O ATOM 0 H GLY A 134 13.008 15.591 -27.058 1.00 22.67 H new ATOM 0 HA2 GLY A 134 14.555 16.657 -25.780 1.00 22.60 H new ATOM 0 HA3 GLY A 134 14.663 17.961 -26.947 1.00 22.60 H new ATOM 2045 N MET A 135 11.827 17.870 -25.393 1.00 21.09 N ATOM 2046 CA MET A 135 10.900 18.627 -24.559 1.00 20.37 C ATOM 2047 C MET A 135 9.964 17.683 -23.812 1.00 19.18 C ATOM 2048 O MET A 135 9.636 16.602 -24.306 1.00 19.03 O ATOM 2049 CB MET A 135 10.089 19.605 -25.413 1.00 20.92 C ATOM 2050 CG MET A 135 10.941 20.442 -26.354 1.00 22.12 C ATOM 2051 SD MET A 135 10.062 21.876 -26.999 1.00 22.91 S ATOM 2052 CE MET A 135 10.033 22.928 -25.549 1.00 22.22 C ATOM 0 H MET A 135 11.406 17.076 -25.875 1.00 21.09 H new ATOM 0 HA MET A 135 11.479 19.195 -23.831 1.00 20.37 H new ATOM 0 HB2 MET A 135 9.359 19.045 -25.998 1.00 20.92 H new ATOM 0 HB3 MET A 135 9.528 20.270 -24.756 1.00 20.92 H new ATOM 0 HG2 MET A 135 11.835 20.776 -25.828 1.00 22.12 H new ATOM 0 HG3 MET A 135 11.274 19.821 -27.186 1.00 22.12 H new ATOM 0 HE1 MET A 135 9.047 23.381 -25.448 1.00 22.22 H new ATOM 0 HE2 MET A 135 10.251 22.332 -24.663 1.00 22.22 H new ATOM 0 HE3 MET A 135 10.784 23.712 -25.653 1.00 22.22 H new ATOM 2062 N ILE A 136 9.534 18.094 -22.622 1.00 18.41 N ATOM 2063 CA ILE A 136 8.646 17.270 -21.812 1.00 17.25 C ATOM 2064 C ILE A 136 7.292 17.935 -21.595 1.00 16.93 C ATOM 2065 O ILE A 136 7.198 19.148 -21.420 1.00 17.36 O ATOM 2066 CB ILE A 136 9.266 16.954 -20.434 1.00 16.55 C ATOM 2067 CG1 ILE A 136 10.571 16.169 -20.600 1.00 16.94 C ATOM 2068 CG2 ILE A 136 8.278 16.185 -19.560 1.00 15.33 C ATOM 2069 CD1 ILE A 136 10.396 14.819 -21.267 1.00 16.79 C ATOM 0 H ILE A 136 9.785 18.988 -22.200 1.00 18.41 H new ATOM 0 HA ILE A 136 8.504 16.344 -22.369 1.00 17.25 H new ATOM 0 HB ILE A 136 9.495 17.896 -19.936 1.00 16.55 H new ATOM 0 HG12 ILE A 136 11.270 16.765 -21.187 1.00 16.94 H new ATOM 0 HG13 ILE A 136 11.023 16.023 -19.619 1.00 16.94 H new ATOM 0 HG21 ILE A 136 8.736 15.973 -18.594 1.00 15.33 H new ATOM 0 HG22 ILE A 136 7.380 16.785 -19.412 1.00 15.33 H new ATOM 0 HG23 ILE A 136 8.012 15.248 -20.049 1.00 15.33 H new ATOM 0 HD11 ILE A 136 11.364 14.325 -21.348 1.00 16.79 H new ATOM 0 HD12 ILE A 136 9.723 14.203 -20.670 1.00 16.79 H new ATOM 0 HD13 ILE A 136 9.974 14.957 -22.263 1.00 16.79 H new ATOM 2081 N ASN A 137 6.253 17.114 -21.608 1.00 16.28 N ATOM 2082 CA ASN A 137 4.891 17.571 -21.389 1.00 16.03 C ATOM 2083 C ASN A 137 4.359 16.963 -20.097 1.00 14.85 C ATOM 2084 O ASN A 137 4.895 15.960 -19.628 1.00 14.21 O ATOM 2085 CB ASN A 137 3.994 17.204 -22.573 1.00 16.50 C ATOM 2086 CG ASN A 137 4.277 15.817 -23.109 1.00 16.54 C ATOM 2087 OD1 ASN A 137 3.574 14.824 -22.583 1.00 16.44 O flip ATOM 2088 ND2 ASN A 137 5.117 15.641 -23.990 1.00 16.82 N flip ATOM 0 H ASN A 137 6.332 16.110 -21.771 1.00 16.28 H new ATOM 0 HA ASN A 137 4.889 18.657 -21.302 1.00 16.03 H new ATOM 0 HB2 ASN A 137 2.950 17.265 -22.266 1.00 16.50 H new ATOM 0 HB3 ASN A 137 4.135 17.934 -23.371 1.00 16.50 H new ATOM 0 HD21 ASN A 137 5.635 16.435 -24.366 1.00 16.82 H new ATOM 0 HD22 ASN A 137 5.295 14.701 -24.344 1.00 16.82 H new ATOM 2095 N TYR A 138 3.335 17.578 -19.512 1.00 14.65 N ATOM 2096 CA TYR A 138 2.757 17.094 -18.258 1.00 13.62 C ATOM 2097 C TYR A 138 2.713 15.562 -18.185 1.00 12.81 C ATOM 2098 O TYR A 138 2.781 14.993 -17.099 1.00 11.86 O ATOM 2099 CB TYR A 138 1.347 17.672 -18.085 1.00 13.81 C ATOM 2100 CG TYR A 138 0.459 16.873 -17.155 1.00 12.91 C ATOM 2101 CD1 TYR A 138 0.719 16.826 -15.792 1.00 12.17 C ATOM 2102 CD2 TYR A 138 -0.641 16.175 -17.638 1.00 12.92 C ATOM 2103 CE1 TYR A 138 -0.090 16.104 -14.936 1.00 11.46 C ATOM 2104 CE2 TYR A 138 -1.456 15.451 -16.788 1.00 12.20 C ATOM 2105 CZ TYR A 138 -1.172 15.394 -15.456 1.00 11.46 C ATOM 2106 OH TYR A 138 -1.984 14.699 -14.589 1.00 10.87 O ATOM 0 H TYR A 138 2.886 18.414 -19.886 1.00 14.65 H new ATOM 0 HA TYR A 138 3.401 17.433 -17.447 1.00 13.62 H new ATOM 0 HB2 TYR A 138 1.428 18.691 -17.706 1.00 13.81 H new ATOM 0 HB3 TYR A 138 0.869 17.733 -19.063 1.00 13.81 H new ATOM 0 HD1 TYR A 138 1.568 17.363 -15.394 1.00 12.17 H new ATOM 0 HD2 TYR A 138 -0.863 16.198 -18.695 1.00 12.92 H new ATOM 0 HE1 TYR A 138 0.113 16.090 -13.875 1.00 11.46 H new ATOM 0 HE2 TYR A 138 -2.318 14.931 -17.179 1.00 12.20 H new ATOM 0 HH TYR A 138 -2.696 14.254 -15.094 1.00 10.87 H new ATOM 2116 N GLU A 139 2.634 14.893 -19.330 1.00 13.28 N ATOM 2117 CA GLU A 139 2.573 13.432 -19.345 1.00 12.75 C ATOM 2118 C GLU A 139 3.961 12.819 -19.180 1.00 12.57 C ATOM 2119 O GLU A 139 4.194 12.019 -18.270 1.00 11.70 O ATOM 2120 CB GLU A 139 1.930 12.936 -20.641 1.00 13.59 C ATOM 2121 CG GLU A 139 0.503 13.421 -20.833 1.00 13.94 C ATOM 2122 CD GLU A 139 -0.119 12.913 -22.120 1.00 14.48 C ATOM 2123 OE1 GLU A 139 -0.616 11.767 -22.127 1.00 14.68 O ATOM 2124 OE2 GLU A 139 -0.108 13.661 -23.120 1.00 14.82 O ATOM 0 H GLU A 139 2.611 15.331 -20.251 1.00 13.28 H new ATOM 0 HA GLU A 139 1.959 13.116 -18.502 1.00 12.75 H new ATOM 0 HB2 GLU A 139 2.534 13.265 -21.486 1.00 13.59 H new ATOM 0 HB3 GLU A 139 1.939 11.846 -20.648 1.00 13.59 H new ATOM 0 HG2 GLU A 139 -0.104 13.096 -19.988 1.00 13.94 H new ATOM 0 HG3 GLU A 139 0.491 14.511 -20.834 1.00 13.94 H new ATOM 2131 N GLU A 140 4.881 13.203 -20.059 1.00 13.49 N ATOM 2132 CA GLU A 140 6.247 12.694 -20.008 1.00 13.65 C ATOM 2133 C GLU A 140 6.893 13.029 -18.665 1.00 13.01 C ATOM 2134 O GLU A 140 7.751 12.293 -18.171 1.00 12.80 O ATOM 2135 CB GLU A 140 7.072 13.277 -21.158 1.00 14.90 C ATOM 2136 CG GLU A 140 6.519 12.938 -22.533 1.00 15.69 C ATOM 2137 CD GLU A 140 7.299 13.590 -23.660 1.00 16.90 C ATOM 2138 OE1 GLU A 140 8.476 13.942 -23.441 1.00 17.46 O ATOM 2139 OE2 GLU A 140 6.733 13.751 -24.761 1.00 17.35 O ATOM 0 H GLU A 140 4.706 13.865 -20.815 1.00 13.49 H new ATOM 0 HA GLU A 140 6.218 11.610 -20.114 1.00 13.65 H new ATOM 0 HB2 GLU A 140 7.116 14.361 -21.050 1.00 14.90 H new ATOM 0 HB3 GLU A 140 8.095 12.907 -21.085 1.00 14.90 H new ATOM 0 HG2 GLU A 140 6.531 11.856 -22.668 1.00 15.69 H new ATOM 0 HG3 GLU A 140 5.477 13.254 -22.588 1.00 15.69 H new ATOM 2146 N PHE A 141 6.463 14.141 -18.077 1.00 12.87 N ATOM 2147 CA PHE A 141 6.987 14.579 -16.790 1.00 12.46 C ATOM 2148 C PHE A 141 6.514 13.653 -15.676 1.00 11.27 C ATOM 2149 O PHE A 141 7.323 13.095 -14.936 1.00 11.00 O ATOM 2150 CB PHE A 141 6.545 16.019 -16.504 1.00 12.80 C ATOM 2151 CG PHE A 141 6.973 16.527 -15.157 1.00 12.57 C ATOM 2152 CD1 PHE A 141 8.226 17.087 -14.982 1.00 12.93 C ATOM 2153 CD2 PHE A 141 6.120 16.448 -14.068 1.00 12.17 C ATOM 2154 CE1 PHE A 141 8.622 17.561 -13.748 1.00 12.93 C ATOM 2155 CE2 PHE A 141 6.510 16.919 -12.829 1.00 12.17 C ATOM 2156 CZ PHE A 141 7.768 17.457 -12.662 1.00 12.56 C ATOM 0 H PHE A 141 5.752 14.756 -18.473 1.00 12.87 H new ATOM 0 HA PHE A 141 8.076 14.544 -16.829 1.00 12.46 H new ATOM 0 HB2 PHE A 141 6.951 16.674 -17.275 1.00 12.80 H new ATOM 0 HB3 PHE A 141 5.459 16.077 -16.576 1.00 12.80 H new ATOM 0 HD1 PHE A 141 8.902 17.154 -15.821 1.00 12.93 H new ATOM 0 HD2 PHE A 141 5.139 16.013 -14.189 1.00 12.17 H new ATOM 0 HE1 PHE A 141 9.596 18.012 -13.629 1.00 12.93 H new ATOM 0 HE2 PHE A 141 5.830 16.866 -11.992 1.00 12.17 H new ATOM 0 HZ PHE A 141 8.087 17.796 -11.688 1.00 12.56 H new ATOM 2166 N VAL A 142 5.197 13.495 -15.571 1.00 10.70 N ATOM 2167 CA VAL A 142 4.594 12.635 -14.557 1.00 9.58 C ATOM 2168 C VAL A 142 5.261 11.262 -14.502 1.00 9.23 C ATOM 2169 O VAL A 142 5.408 10.679 -13.427 1.00 8.50 O ATOM 2170 CB VAL A 142 3.083 12.447 -14.810 1.00 9.36 C ATOM 2171 CG1 VAL A 142 2.507 11.369 -13.903 1.00 8.32 C ATOM 2172 CG2 VAL A 142 2.340 13.755 -14.611 1.00 9.69 C ATOM 0 H VAL A 142 4.522 13.956 -16.182 1.00 10.70 H new ATOM 0 HA VAL A 142 4.744 13.137 -13.601 1.00 9.58 H new ATOM 0 HB VAL A 142 2.954 12.127 -15.844 1.00 9.36 H new ATOM 0 HG11 VAL A 142 1.441 11.257 -14.102 1.00 8.32 H new ATOM 0 HG12 VAL A 142 3.013 10.423 -14.095 1.00 8.32 H new ATOM 0 HG13 VAL A 142 2.653 11.654 -12.861 1.00 8.32 H new ATOM 0 HG21 VAL A 142 1.277 13.601 -14.794 1.00 9.69 H new ATOM 0 HG22 VAL A 142 2.485 14.104 -13.589 1.00 9.69 H new ATOM 0 HG23 VAL A 142 2.724 14.501 -15.307 1.00 9.69 H new ATOM 2182 N TRP A 143 5.668 10.747 -15.656 1.00 9.94 N ATOM 2183 CA TRP A 143 6.296 9.432 -15.703 1.00 9.97 C ATOM 2184 C TRP A 143 7.711 9.439 -15.123 1.00 10.29 C ATOM 2185 O TRP A 143 8.002 8.685 -14.197 1.00 9.82 O ATOM 2186 CB TRP A 143 6.343 8.897 -17.135 1.00 10.95 C ATOM 2187 CG TRP A 143 6.919 7.517 -17.216 1.00 11.20 C ATOM 2188 CD1 TRP A 143 6.253 6.331 -17.108 1.00 10.93 C ATOM 2189 CD2 TRP A 143 8.293 7.191 -17.404 1.00 11.97 C ATOM 2190 NE1 TRP A 143 7.140 5.285 -17.218 1.00 11.51 N ATOM 2191 CE2 TRP A 143 8.401 5.792 -17.401 1.00 12.15 C ATOM 2192 CE3 TRP A 143 9.438 7.960 -17.574 1.00 12.67 C ATOM 2193 CZ2 TRP A 143 9.621 5.141 -17.563 1.00 13.01 C ATOM 2194 CZ3 TRP A 143 10.652 7.320 -17.735 1.00 13.49 C ATOM 2195 CH2 TRP A 143 10.737 5.922 -17.729 1.00 13.66 C ATOM 0 H TRP A 143 5.577 11.212 -16.559 1.00 9.94 H new ATOM 0 HA TRP A 143 5.679 8.778 -15.087 1.00 9.97 H new ATOM 0 HB2 TRP A 143 5.335 8.891 -17.550 1.00 10.95 H new ATOM 0 HB3 TRP A 143 6.937 9.571 -17.752 1.00 10.95 H new ATOM 0 HD1 TRP A 143 5.188 6.229 -16.958 1.00 10.93 H new ATOM 0 HE1 TRP A 143 6.899 4.295 -17.171 1.00 11.51 H new ATOM 0 HE3 TRP A 143 9.380 9.038 -17.580 1.00 12.67 H new ATOM 0 HZ2 TRP A 143 9.686 4.063 -17.558 1.00 13.01 H new ATOM 0 HZ3 TRP A 143 11.549 7.907 -17.867 1.00 13.49 H new ATOM 0 HH2 TRP A 143 11.700 5.449 -17.858 1.00 13.66 H new ATOM 2206 N MET A 144 8.585 10.292 -15.652 1.00 11.22 N ATOM 2207 CA MET A 144 9.973 10.337 -15.189 1.00 11.83 C ATOM 2208 C MET A 144 10.096 10.706 -13.711 1.00 11.29 C ATOM 2209 O MET A 144 11.075 10.341 -13.060 1.00 11.65 O ATOM 2210 CB MET A 144 10.802 11.299 -16.039 1.00 13.01 C ATOM 2211 CG MET A 144 10.341 12.741 -15.968 1.00 13.05 C ATOM 2212 SD MET A 144 11.511 13.874 -16.745 1.00 14.50 S ATOM 2213 CE MET A 144 10.560 15.390 -16.774 1.00 14.50 C ATOM 0 H MET A 144 8.362 10.956 -16.394 1.00 11.22 H new ATOM 0 HA MET A 144 10.364 9.326 -15.303 1.00 11.83 H new ATOM 0 HB2 MET A 144 11.843 11.245 -15.719 1.00 13.01 H new ATOM 0 HB3 MET A 144 10.770 10.969 -17.077 1.00 13.01 H new ATOM 0 HG2 MET A 144 9.370 12.834 -16.455 1.00 13.05 H new ATOM 0 HG3 MET A 144 10.202 13.025 -14.925 1.00 13.05 H new ATOM 0 HE1 MET A 144 11.237 16.244 -16.759 1.00 14.50 H new ATOM 0 HE2 MET A 144 9.955 15.422 -17.680 1.00 14.50 H new ATOM 0 HE3 MET A 144 9.909 15.428 -15.901 1.00 14.50 H new ATOM 2223 N ILE A 145 9.114 11.422 -13.178 1.00 10.61 N ATOM 2224 CA ILE A 145 9.151 11.829 -11.775 1.00 10.28 C ATOM 2225 C ILE A 145 8.709 10.705 -10.841 1.00 9.33 C ATOM 2226 O ILE A 145 9.296 10.507 -9.777 1.00 9.45 O ATOM 2227 CB ILE A 145 8.270 13.056 -11.520 1.00 10.17 C ATOM 2228 CG1 ILE A 145 6.825 12.743 -11.889 1.00 9.32 C ATOM 2229 CG2 ILE A 145 8.787 14.248 -12.309 1.00 11.25 C ATOM 2230 CD1 ILE A 145 5.845 13.808 -11.453 1.00 9.30 C ATOM 0 H ILE A 145 8.288 11.732 -13.689 1.00 10.61 H new ATOM 0 HA ILE A 145 10.191 12.079 -11.563 1.00 10.28 H new ATOM 0 HB ILE A 145 8.308 13.310 -10.461 1.00 10.17 H new ATOM 0 HG12 ILE A 145 6.754 12.616 -12.969 1.00 9.32 H new ATOM 0 HG13 ILE A 145 6.541 11.793 -11.437 1.00 9.32 H new ATOM 0 HG21 ILE A 145 8.152 15.113 -12.119 1.00 11.25 H new ATOM 0 HG22 ILE A 145 9.808 14.473 -12.001 1.00 11.25 H new ATOM 0 HG23 ILE A 145 8.772 14.014 -13.373 1.00 11.25 H new ATOM 0 HD11 ILE A 145 4.837 13.518 -11.749 1.00 9.30 H new ATOM 0 HD12 ILE A 145 5.887 13.920 -10.370 1.00 9.30 H new ATOM 0 HD13 ILE A 145 6.103 14.756 -11.926 1.00 9.30 H new ATOM 2242 N SER A 146 7.669 9.973 -11.241 1.00 8.54 N ATOM 2243 CA SER A 146 7.154 8.875 -10.431 1.00 7.66 C ATOM 2244 C SER A 146 8.243 7.839 -10.215 1.00 8.22 C ATOM 2245 O SER A 146 8.135 6.963 -9.357 1.00 7.89 O ATOM 2246 CB SER A 146 5.948 8.227 -11.115 1.00 6.98 C ATOM 2247 OG SER A 146 5.344 7.258 -10.276 1.00 6.80 O ATOM 0 H SER A 146 7.170 10.122 -12.118 1.00 8.54 H new ATOM 0 HA SER A 146 6.837 9.271 -9.466 1.00 7.66 H new ATOM 0 HB2 SER A 146 5.218 8.994 -11.374 1.00 6.98 H new ATOM 0 HB3 SER A 146 6.263 7.759 -12.048 1.00 6.98 H new ATOM 0 HG SER A 146 6.004 6.924 -9.634 1.00 6.80 H new ATOM 2253 N GLN A 147 9.293 7.960 -11.012 1.00 9.26 N ATOM 2254 CA GLN A 147 10.423 7.054 -10.953 1.00 10.11 C ATOM 2255 C GLN A 147 11.675 7.800 -10.498 1.00 11.05 C ATOM 2256 O GLN A 147 12.669 7.191 -10.106 1.00 11.87 O ATOM 2257 CB GLN A 147 10.639 6.443 -12.336 1.00 10.77 C ATOM 2258 CG GLN A 147 9.356 6.332 -13.151 1.00 10.15 C ATOM 2259 CD GLN A 147 8.583 5.057 -12.866 1.00 9.47 C ATOM 2260 OE1 GLN A 147 7.565 5.153 -12.013 1.00 10.00 O flip ATOM 2261 NE2 GLN A 147 8.881 4.001 -13.423 1.00 8.44 N flip ATOM 0 H GLN A 147 9.383 8.691 -11.718 1.00 9.26 H new ATOM 0 HA GLN A 147 10.221 6.261 -10.233 1.00 10.11 H new ATOM 0 HB2 GLN A 147 11.359 7.049 -12.885 1.00 10.77 H new ATOM 0 HB3 GLN A 147 11.077 5.451 -12.223 1.00 10.77 H new ATOM 0 HG2 GLN A 147 8.721 7.191 -12.937 1.00 10.15 H new ATOM 0 HG3 GLN A 147 9.601 6.373 -14.212 1.00 10.15 H new ATOM 0 HE21 GLN A 147 9.669 3.970 -14.070 1.00 8.44 H new ATOM 0 HE22 GLN A 147 8.340 3.156 -13.238 1.00 8.44 H new ATOM 2270 N LYS A 148 11.606 9.129 -10.556 1.00 11.08 N ATOM 2271 CA LYS A 148 12.719 9.983 -10.152 1.00 12.08 C ATOM 2272 C LYS A 148 13.036 9.800 -8.669 1.00 12.24 C ATOM 2273 O LYS A 148 12.367 10.447 -7.836 1.00 12.44 O ATOM 2274 CB LYS A 148 12.381 11.451 -10.442 1.00 12.12 C ATOM 2275 CG LYS A 148 13.421 12.440 -9.940 1.00 12.94 C ATOM 2276 CD LYS A 148 12.990 13.881 -10.188 1.00 13.10 C ATOM 2277 CE LYS A 148 12.999 14.224 -11.670 1.00 13.06 C ATOM 2278 NZ LYS A 148 12.750 15.674 -11.904 1.00 13.68 N ATOM 2279 OXT LYS A 148 13.951 9.009 -8.354 1.00 12.34 O ATOM 0 H LYS A 148 10.785 9.639 -10.881 1.00 11.08 H new ATOM 0 HA LYS A 148 13.600 9.696 -10.726 1.00 12.08 H new ATOM 0 HB2 LYS A 148 12.263 11.579 -11.518 1.00 12.12 H new ATOM 0 HB3 LYS A 148 11.420 11.688 -9.985 1.00 12.12 H new ATOM 0 HG2 LYS A 148 13.585 12.287 -8.873 1.00 12.94 H new ATOM 0 HG3 LYS A 148 14.372 12.253 -10.438 1.00 12.94 H new ATOM 0 HD2 LYS A 148 11.989 14.036 -9.785 1.00 13.10 H new ATOM 0 HD3 LYS A 148 13.657 14.557 -9.654 1.00 13.10 H new ATOM 0 HE2 LYS A 148 13.961 13.946 -12.102 1.00 13.06 H new ATOM 0 HE3 LYS A 148 12.238 13.637 -12.184 1.00 13.06 H new ATOM 0 HZ1 LYS A 148 13.402 16.025 -12.635 1.00 13.68 H new ATOM 0 HZ2 LYS A 148 11.769 15.811 -12.221 1.00 13.68 H new ATOM 0 HZ3 LYS A 148 12.905 16.200 -11.020 1.00 13.68 H new TER 2293 LYS A 148 HETATM 2294 CA CA A 149 9.407 25.773 -20.258 1.00 20.82 CA HETATM 2295 CA CA A 150 8.595 15.066 -25.719 1.00 19.22 CA HETATM 2296 CA CA A 151 -21.445 -2.541 7.858 1.00 0.33 CA