USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 744 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 Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0.197 K(o=0.2,f=-2.1) USER MOD Single : A 20 TYR OH : rot 110:sc= -0.308 USER MOD Single : A 67 THR OG1 : rot -35:sc= 0.329 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot -174:sc= 0.428 USER MOD Single : A 87 ASN : amide:sc= -0.75 K(o=-0.75,f=-1.5) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 121:sc= 1.17 USER MOD Single : A 109 THR OG1 : rot 109:sc= 1.21 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl -163:sc= -2.97! (180deg=-4.18!) USER MOD Single : A 141 LYS NZ :NH3+ -168:sc= 1.27 (180deg=1.11) USER MOD Single : A 144 GLN : amide:sc= -4.65! K(o=-4.6!,f=-3.2) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -2.498 7.019 11.261 1.00 50.54 N ATOM 57 CA VAL A 5 -2.280 5.777 10.542 1.00 54.01 C ATOM 58 C VAL A 5 -3.473 5.521 9.622 1.00 52.22 C ATOM 59 O VAL A 5 -4.548 5.110 10.064 1.00 25.23 O ATOM 60 CB VAL A 5 -2.038 4.578 11.500 1.00 75.31 C ATOM 61 CG1 VAL A 5 -3.122 4.479 12.566 1.00 24.41 C ATOM 62 CG2 VAL A 5 -1.929 3.276 10.716 1.00 62.11 C ATOM 0 HA VAL A 5 -1.373 5.875 9.945 1.00 54.01 H new ATOM 0 HB VAL A 5 -1.092 4.754 12.013 1.00 75.31 H new ATOM 0 HG11 VAL A 5 -2.917 3.628 13.216 1.00 24.41 H new ATOM 0 HG12 VAL A 5 -3.134 5.394 13.159 1.00 24.41 H new ATOM 0 HG13 VAL A 5 -4.092 4.344 12.087 1.00 24.41 H new ATOM 0 HG21 VAL A 5 -1.760 2.449 11.406 1.00 62.11 H new ATOM 0 HG22 VAL A 5 -2.853 3.105 10.164 1.00 62.11 H new ATOM 0 HG23 VAL A 5 -1.096 3.341 10.016 1.00 62.11 H new ATOM 72 N VAL A 6 -3.296 5.809 8.344 1.00 52.05 N ATOM 73 CA VAL A 6 -4.399 5.737 7.399 1.00 34.45 C ATOM 74 C VAL A 6 -4.524 4.343 6.804 1.00 61.51 C ATOM 75 O VAL A 6 -3.531 3.659 6.566 1.00 75.03 O ATOM 76 CB VAL A 6 -4.267 6.773 6.260 1.00 52.34 C ATOM 77 CG1 VAL A 6 -4.444 8.183 6.797 1.00 40.33 C ATOM 78 CG2 VAL A 6 -2.927 6.641 5.552 1.00 23.42 C ATOM 0 H VAL A 6 -2.405 6.093 7.938 1.00 52.05 H new ATOM 0 HA VAL A 6 -5.301 5.970 7.965 1.00 34.45 H new ATOM 0 HB VAL A 6 -5.055 6.574 5.534 1.00 52.34 H new ATOM 0 HG11 VAL A 6 -4.348 8.898 5.980 1.00 40.33 H new ATOM 0 HG12 VAL A 6 -5.431 8.279 7.249 1.00 40.33 H new ATOM 0 HG13 VAL A 6 -3.680 8.385 7.548 1.00 40.33 H new ATOM 0 HG21 VAL A 6 -2.862 7.382 4.755 1.00 23.42 H new ATOM 0 HG22 VAL A 6 -2.120 6.804 6.267 1.00 23.42 H new ATOM 0 HG23 VAL A 6 -2.837 5.642 5.126 1.00 23.42 H new ATOM 88 N ARG A 7 -5.756 3.927 6.588 1.00 12.25 N ATOM 89 CA ARG A 7 -6.036 2.633 5.997 1.00 10.22 C ATOM 90 C ARG A 7 -7.157 2.760 4.977 1.00 33.11 C ATOM 91 O ARG A 7 -8.309 3.008 5.324 1.00 43.24 O ATOM 92 CB ARG A 7 -6.373 1.602 7.093 1.00 43.40 C ATOM 93 CG ARG A 7 -7.111 2.179 8.300 1.00 31.12 C ATOM 94 CD ARG A 7 -8.598 2.353 8.039 1.00 2.21 C ATOM 95 NE ARG A 7 -9.176 3.439 8.824 1.00 3.40 N ATOM 96 CZ ARG A 7 -10.366 3.983 8.565 1.00 0.33 C ATOM 97 NH1 ARG A 7 -11.084 3.547 7.535 1.00 31.10 N ATOM 98 NH2 ARG A 7 -10.828 4.976 9.316 1.00 71.22 N ATOM 0 H ARG A 7 -6.587 4.473 6.816 1.00 12.25 H new ATOM 0 HA ARG A 7 -5.148 2.275 5.476 1.00 10.22 H new ATOM 0 HB2 ARG A 7 -6.982 0.811 6.655 1.00 43.40 H new ATOM 0 HB3 ARG A 7 -5.448 1.139 7.436 1.00 43.40 H new ATOM 0 HG2 ARG A 7 -6.970 1.521 9.158 1.00 31.12 H new ATOM 0 HG3 ARG A 7 -6.675 3.143 8.562 1.00 31.12 H new ATOM 0 HD2 ARG A 7 -8.758 2.549 6.979 1.00 2.21 H new ATOM 0 HD3 ARG A 7 -9.117 1.423 8.273 1.00 2.21 H new ATOM 0 HE ARG A 7 -8.641 3.802 9.613 1.00 3.40 H new ATOM 0 HH11 ARG A 7 -10.725 2.797 6.944 1.00 31.10 H new ATOM 0 HH12 ARG A 7 -11.994 3.962 7.336 1.00 31.10 H new ATOM 0 HH21 ARG A 7 -10.272 5.327 10.096 1.00 71.22 H new ATOM 0 HH22 ARG A 7 -11.739 5.388 9.113 1.00 71.22 H new ATOM 112 N ASP A 8 -6.818 2.623 3.714 1.00 2.32 N ATOM 113 CA ASP A 8 -7.808 2.740 2.669 1.00 1.45 C ATOM 114 C ASP A 8 -7.653 1.586 1.694 1.00 4.23 C ATOM 115 O ASP A 8 -6.695 0.813 1.791 1.00 61.24 O ATOM 116 CB ASP A 8 -7.677 4.085 1.960 1.00 24.21 C ATOM 117 CG ASP A 8 -9.013 4.611 1.486 1.00 2.03 C ATOM 118 OD1 ASP A 8 -9.607 4.000 0.571 1.00 0.04 O ATOM 119 OD2 ASP A 8 -9.472 5.635 2.031 1.00 1.42 O ATOM 0 H ASP A 8 -5.871 2.432 3.388 1.00 2.32 H new ATOM 0 HA ASP A 8 -8.805 2.694 3.106 1.00 1.45 H new ATOM 0 HB2 ASP A 8 -7.223 4.808 2.637 1.00 24.21 H new ATOM 0 HB3 ASP A 8 -7.006 3.981 1.108 1.00 24.21 H new ATOM 124 N ALA A 9 -8.585 1.466 0.770 1.00 55.55 N ATOM 125 CA ALA A 9 -8.622 0.321 -0.119 1.00 13.01 C ATOM 126 C ALA A 9 -9.098 0.722 -1.503 1.00 51.33 C ATOM 127 O ALA A 9 -10.189 1.271 -1.665 1.00 43.33 O ATOM 128 CB ALA A 9 -9.515 -0.765 0.458 1.00 4.14 C ATOM 0 H ALA A 9 -9.328 2.148 0.615 1.00 55.55 H new ATOM 0 HA ALA A 9 -7.609 -0.071 -0.212 1.00 13.01 H new ATOM 0 HB1 ALA A 9 -9.534 -1.619 -0.219 1.00 4.14 H new ATOM 0 HB2 ALA A 9 -9.126 -1.079 1.427 1.00 4.14 H new ATOM 0 HB3 ALA A 9 -10.526 -0.377 0.581 1.00 4.14 H new ATOM 134 N VAL A 10 -8.277 0.443 -2.498 1.00 32.41 N ATOM 135 CA VAL A 10 -8.594 0.795 -3.870 1.00 21.14 C ATOM 136 C VAL A 10 -8.821 -0.450 -4.718 1.00 32.31 C ATOM 137 O VAL A 10 -8.237 -1.504 -4.465 1.00 52.11 O ATOM 138 CB VAL A 10 -7.490 1.671 -4.492 1.00 33.10 C ATOM 139 CG1 VAL A 10 -7.583 3.091 -3.963 1.00 73.21 C ATOM 140 CG2 VAL A 10 -6.117 1.094 -4.197 1.00 60.33 C ATOM 0 H VAL A 10 -7.380 -0.029 -2.381 1.00 32.41 H new ATOM 0 HA VAL A 10 -9.518 1.372 -3.852 1.00 21.14 H new ATOM 0 HB VAL A 10 -7.634 1.686 -5.572 1.00 33.10 H new ATOM 0 HG11 VAL A 10 -6.797 3.698 -4.411 1.00 73.21 H new ATOM 0 HG12 VAL A 10 -8.556 3.511 -4.218 1.00 73.21 H new ATOM 0 HG13 VAL A 10 -7.463 3.084 -2.880 1.00 73.21 H new ATOM 0 HG21 VAL A 10 -5.352 1.728 -4.645 1.00 60.33 H new ATOM 0 HG22 VAL A 10 -5.965 1.049 -3.119 1.00 60.33 H new ATOM 0 HG23 VAL A 10 -6.047 0.090 -4.615 1.00 60.33 H new ATOM 150 N THR A 11 -9.679 -0.319 -5.718 1.00 2.13 N ATOM 151 CA THR A 11 -10.071 -1.440 -6.554 1.00 73.14 C ATOM 152 C THR A 11 -9.322 -1.419 -7.885 1.00 11.02 C ATOM 153 O THR A 11 -9.563 -0.552 -8.723 1.00 20.45 O ATOM 154 CB THR A 11 -11.586 -1.387 -6.827 1.00 15.23 C ATOM 155 OG1 THR A 11 -12.294 -1.139 -5.604 1.00 53.11 O ATOM 156 CG2 THR A 11 -12.071 -2.685 -7.450 1.00 32.55 C ATOM 0 H THR A 11 -10.121 0.565 -5.971 1.00 2.13 H new ATOM 0 HA THR A 11 -9.821 -2.359 -6.024 1.00 73.14 H new ATOM 0 HB THR A 11 -11.780 -0.576 -7.529 1.00 15.23 H new ATOM 0 HG1 THR A 11 -13.257 -1.105 -5.784 1.00 53.11 H new ATOM 0 HG21 THR A 11 -13.144 -2.622 -7.633 1.00 32.55 H new ATOM 0 HG22 THR A 11 -11.551 -2.852 -8.393 1.00 32.55 H new ATOM 0 HG23 THR A 11 -11.867 -3.513 -6.771 1.00 32.55 H new ATOM 164 N ILE A 12 -8.409 -2.362 -8.074 1.00 32.43 N ATOM 165 CA ILE A 12 -7.648 -2.448 -9.318 1.00 53.00 C ATOM 166 C ILE A 12 -7.923 -3.781 -10.010 1.00 21.22 C ATOM 167 O ILE A 12 -8.126 -4.802 -9.348 1.00 33.41 O ATOM 168 CB ILE A 12 -6.115 -2.307 -9.099 1.00 1.05 C ATOM 169 CG1 ILE A 12 -5.765 -1.026 -8.346 1.00 74.24 C ATOM 170 CG2 ILE A 12 -5.377 -2.320 -10.427 1.00 42.24 C ATOM 171 CD1 ILE A 12 -5.895 -1.138 -6.849 1.00 35.51 C ATOM 0 H ILE A 12 -8.176 -3.077 -7.385 1.00 32.43 H new ATOM 0 HA ILE A 12 -7.976 -1.615 -9.939 1.00 53.00 H new ATOM 0 HB ILE A 12 -5.803 -3.160 -8.497 1.00 1.05 H new ATOM 0 HG12 ILE A 12 -4.742 -0.741 -8.591 1.00 74.24 H new ATOM 0 HG13 ILE A 12 -6.412 -0.222 -8.697 1.00 74.24 H new ATOM 0 HG21 ILE A 12 -4.306 -2.220 -10.249 1.00 42.24 H new ATOM 0 HG22 ILE A 12 -5.573 -3.260 -10.943 1.00 42.24 H new ATOM 0 HG23 ILE A 12 -5.722 -1.489 -11.043 1.00 42.24 H new ATOM 0 HD11 ILE A 12 -5.629 -0.187 -6.388 1.00 35.51 H new ATOM 0 HD12 ILE A 12 -6.923 -1.391 -6.591 1.00 35.51 H new ATOM 0 HD13 ILE A 12 -5.227 -1.918 -6.483 1.00 35.51 H new ATOM 183 N GLY A 13 -7.926 -3.765 -11.336 1.00 64.21 N ATOM 184 CA GLY A 13 -8.137 -4.980 -12.100 1.00 52.52 C ATOM 185 C GLY A 13 -6.871 -5.812 -12.234 1.00 4.44 C ATOM 186 O GLY A 13 -6.420 -6.098 -13.341 1.00 4.53 O ATOM 0 H GLY A 13 -7.785 -2.927 -11.900 1.00 64.21 H new ATOM 0 HA2 GLY A 13 -8.911 -5.578 -11.619 1.00 52.52 H new ATOM 0 HA3 GLY A 13 -8.505 -4.722 -13.093 1.00 52.52 H new ATOM 190 N LYS A 14 -6.290 -6.178 -11.101 1.00 14.00 N ATOM 191 CA LYS A 14 -5.130 -7.061 -11.070 1.00 32.22 C ATOM 192 C LYS A 14 -5.475 -8.286 -10.235 1.00 44.31 C ATOM 193 O LYS A 14 -6.378 -8.219 -9.402 1.00 50.23 O ATOM 194 CB LYS A 14 -3.913 -6.344 -10.468 1.00 65.51 C ATOM 195 CG LYS A 14 -3.501 -5.077 -11.204 1.00 61.21 C ATOM 196 CD LYS A 14 -3.068 -5.353 -12.636 1.00 32.03 C ATOM 197 CE LYS A 14 -2.682 -4.070 -13.355 1.00 73.44 C ATOM 198 NZ LYS A 14 -2.326 -4.307 -14.779 1.00 22.33 N ATOM 0 H LYS A 14 -6.606 -5.874 -10.180 1.00 14.00 H new ATOM 0 HA LYS A 14 -4.876 -7.357 -12.088 1.00 32.22 H new ATOM 0 HB2 LYS A 14 -4.132 -6.092 -9.430 1.00 65.51 H new ATOM 0 HB3 LYS A 14 -3.069 -7.034 -10.457 1.00 65.51 H new ATOM 0 HG2 LYS A 14 -4.335 -4.375 -11.208 1.00 61.21 H new ATOM 0 HG3 LYS A 14 -2.683 -4.597 -10.666 1.00 61.21 H new ATOM 0 HD2 LYS A 14 -2.222 -6.041 -12.636 1.00 32.03 H new ATOM 0 HD3 LYS A 14 -3.878 -5.844 -13.175 1.00 32.03 H new ATOM 0 HE2 LYS A 14 -3.510 -3.363 -13.303 1.00 73.44 H new ATOM 0 HE3 LYS A 14 -1.837 -3.609 -12.843 1.00 73.44 H new ATOM 0 HZ1 LYS A 14 -2.070 -3.404 -15.228 1.00 22.33 H new ATOM 0 HZ2 LYS A 14 -1.519 -4.961 -14.831 1.00 22.33 H new ATOM 0 HZ3 LYS A 14 -3.140 -4.722 -15.276 1.00 22.33 H new ATOM 212 N PRO A 15 -4.786 -9.424 -10.441 1.00 41.21 N ATOM 213 CA PRO A 15 -5.081 -10.652 -9.693 1.00 75.12 C ATOM 214 C PRO A 15 -4.990 -10.449 -8.181 1.00 55.31 C ATOM 215 O PRO A 15 -5.971 -10.663 -7.473 1.00 12.42 O ATOM 216 CB PRO A 15 -3.997 -11.627 -10.163 1.00 2.51 C ATOM 217 CG PRO A 15 -3.555 -11.107 -11.489 1.00 23.24 C ATOM 218 CD PRO A 15 -3.707 -9.614 -11.424 1.00 42.44 C ATOM 0 HA PRO A 15 -6.097 -11.002 -9.875 1.00 75.12 H new ATOM 0 HB2 PRO A 15 -3.167 -11.664 -9.457 1.00 2.51 H new ATOM 0 HB3 PRO A 15 -4.388 -12.641 -10.248 1.00 2.51 H new ATOM 0 HG2 PRO A 15 -2.521 -11.385 -11.691 1.00 23.24 H new ATOM 0 HG3 PRO A 15 -4.160 -11.526 -12.293 1.00 23.24 H new ATOM 0 HD2 PRO A 15 -2.784 -9.129 -11.106 1.00 42.44 H new ATOM 0 HD3 PRO A 15 -3.969 -9.194 -12.395 1.00 42.44 H new ATOM 226 N ALA A 16 -3.808 -10.034 -7.709 1.00 22.44 N ATOM 227 CA ALA A 16 -3.583 -9.672 -6.303 1.00 51.43 C ATOM 228 C ALA A 16 -2.099 -9.458 -6.051 1.00 33.12 C ATOM 229 O ALA A 16 -1.670 -8.381 -5.649 1.00 10.01 O ATOM 230 CB ALA A 16 -4.105 -10.741 -5.347 1.00 65.40 C ATOM 0 H ALA A 16 -2.977 -9.939 -8.293 1.00 22.44 H new ATOM 0 HA ALA A 16 -4.133 -8.750 -6.114 1.00 51.43 H new ATOM 0 HB1 ALA A 16 -3.918 -10.432 -4.319 1.00 65.40 H new ATOM 0 HB2 ALA A 16 -5.177 -10.872 -5.497 1.00 65.40 H new ATOM 0 HB3 ALA A 16 -3.594 -11.684 -5.541 1.00 65.40 H new ATOM 236 N GLU A 17 -1.337 -10.511 -6.320 1.00 33.23 N ATOM 237 CA GLU A 17 0.092 -10.577 -6.022 1.00 14.22 C ATOM 238 C GLU A 17 0.845 -9.342 -6.522 1.00 32.51 C ATOM 239 O GLU A 17 1.509 -8.652 -5.746 1.00 11.00 O ATOM 240 CB GLU A 17 0.653 -11.854 -6.661 1.00 22.21 C ATOM 241 CG GLU A 17 1.984 -12.327 -6.099 1.00 54.45 C ATOM 242 CD GLU A 17 3.177 -11.605 -6.684 1.00 0.24 C ATOM 243 OE1 GLU A 17 3.069 -11.078 -7.808 1.00 13.23 O ATOM 244 OE2 GLU A 17 4.229 -11.571 -6.013 1.00 54.20 O ATOM 0 H GLU A 17 -1.699 -11.358 -6.759 1.00 33.23 H new ATOM 0 HA GLU A 17 0.229 -10.600 -4.941 1.00 14.22 H new ATOM 0 HB2 GLU A 17 -0.079 -12.653 -6.541 1.00 22.21 H new ATOM 0 HB3 GLU A 17 0.768 -11.685 -7.732 1.00 22.21 H new ATOM 0 HG2 GLU A 17 1.982 -12.191 -5.018 1.00 54.45 H new ATOM 0 HG3 GLU A 17 2.089 -13.396 -6.286 1.00 54.45 H new ATOM 251 N GLN A 18 0.709 -9.051 -7.809 1.00 41.22 N ATOM 252 CA GLN A 18 1.480 -7.986 -8.441 1.00 35.02 C ATOM 253 C GLN A 18 1.072 -6.593 -7.976 1.00 53.11 C ATOM 254 O GLN A 18 1.764 -5.626 -8.267 1.00 1.33 O ATOM 255 CB GLN A 18 1.382 -8.082 -9.961 1.00 64.14 C ATOM 256 CG GLN A 18 2.389 -9.047 -10.569 1.00 34.02 C ATOM 257 CD GLN A 18 3.823 -8.668 -10.237 1.00 40.33 C ATOM 258 OE1 GLN A 18 4.449 -7.883 -10.948 1.00 60.50 O ATOM 259 NE2 GLN A 18 4.363 -9.238 -9.172 1.00 33.33 N ATOM 0 H GLN A 18 0.071 -9.538 -8.438 1.00 41.22 H new ATOM 0 HA GLN A 18 2.515 -8.132 -8.131 1.00 35.02 H new ATOM 0 HB2 GLN A 18 0.375 -8.398 -10.234 1.00 64.14 H new ATOM 0 HB3 GLN A 18 1.533 -7.092 -10.391 1.00 64.14 H new ATOM 0 HG2 GLN A 18 2.188 -10.055 -10.206 1.00 34.02 H new ATOM 0 HG3 GLN A 18 2.262 -9.067 -11.651 1.00 34.02 H new ATOM 0 HE21 GLN A 18 3.813 -9.884 -8.606 1.00 33.33 H new ATOM 0 HE22 GLN A 18 5.329 -9.031 -8.917 1.00 33.33 H new ATOM 268 N LEU A 19 -0.035 -6.474 -7.253 1.00 60.41 N ATOM 269 CA LEU A 19 -0.442 -5.181 -6.723 1.00 3.13 C ATOM 270 C LEU A 19 0.575 -4.637 -5.727 1.00 32.00 C ATOM 271 O LEU A 19 0.662 -3.430 -5.525 1.00 13.55 O ATOM 272 CB LEU A 19 -1.820 -5.281 -6.083 1.00 12.34 C ATOM 273 CG LEU A 19 -2.977 -5.139 -7.060 1.00 72.21 C ATOM 274 CD1 LEU A 19 -4.298 -5.287 -6.334 1.00 53.45 C ATOM 275 CD2 LEU A 19 -2.897 -3.794 -7.763 1.00 32.24 C ATOM 0 H LEU A 19 -0.659 -7.247 -7.023 1.00 60.41 H new ATOM 0 HA LEU A 19 -0.491 -4.480 -7.556 1.00 3.13 H new ATOM 0 HB2 LEU A 19 -1.903 -6.243 -5.577 1.00 12.34 H new ATOM 0 HB3 LEU A 19 -1.909 -4.509 -5.318 1.00 12.34 H new ATOM 0 HG LEU A 19 -2.910 -5.928 -7.809 1.00 72.21 H new ATOM 0 HD11 LEU A 19 -5.118 -5.183 -7.045 1.00 53.45 H new ATOM 0 HD12 LEU A 19 -4.347 -6.270 -5.865 1.00 53.45 H new ATOM 0 HD13 LEU A 19 -4.381 -4.515 -5.569 1.00 53.45 H new ATOM 0 HD21 LEU A 19 -3.728 -3.698 -8.461 1.00 32.24 H new ATOM 0 HD22 LEU A 19 -2.950 -2.994 -7.025 1.00 32.24 H new ATOM 0 HD23 LEU A 19 -1.956 -3.724 -8.308 1.00 32.24 H new ATOM 287 N TYR A 20 1.343 -5.525 -5.107 1.00 55.42 N ATOM 288 CA TYR A 20 2.410 -5.102 -4.207 1.00 1.21 C ATOM 289 C TYR A 20 3.580 -4.518 -5.004 1.00 2.43 C ATOM 290 O TYR A 20 4.338 -3.686 -4.500 1.00 1.02 O ATOM 291 CB TYR A 20 2.882 -6.275 -3.338 1.00 32.35 C ATOM 292 CG TYR A 20 3.820 -5.862 -2.224 1.00 23.43 C ATOM 293 CD1 TYR A 20 5.188 -5.782 -2.433 1.00 43.15 C ATOM 294 CD2 TYR A 20 3.330 -5.537 -0.965 1.00 11.13 C ATOM 295 CE1 TYR A 20 6.042 -5.394 -1.424 1.00 4.11 C ATOM 296 CE2 TYR A 20 4.182 -5.145 0.052 1.00 23.34 C ATOM 297 CZ TYR A 20 5.537 -5.076 -0.184 1.00 53.34 C ATOM 298 OH TYR A 20 6.392 -4.682 0.817 1.00 21.40 O ATOM 0 H TYR A 20 1.249 -6.535 -5.209 1.00 55.42 H new ATOM 0 HA TYR A 20 2.018 -4.326 -3.549 1.00 1.21 H new ATOM 0 HB2 TYR A 20 2.012 -6.769 -2.905 1.00 32.35 H new ATOM 0 HB3 TYR A 20 3.383 -7.007 -3.971 1.00 32.35 H new ATOM 0 HD1 TYR A 20 5.592 -6.028 -3.404 1.00 43.15 H new ATOM 0 HD2 TYR A 20 2.268 -5.591 -0.778 1.00 11.13 H new ATOM 0 HE1 TYR A 20 7.105 -5.340 -1.606 1.00 4.11 H new ATOM 0 HE2 TYR A 20 3.787 -4.895 1.025 1.00 23.34 H new ATOM 0 HH TYR A 20 6.261 -3.729 1.003 1.00 21.40 H new ATOM 308 N ALA A 21 3.700 -4.934 -6.263 1.00 23.14 N ATOM 309 CA ALA A 21 4.817 -4.525 -7.112 1.00 13.21 C ATOM 310 C ALA A 21 4.667 -3.088 -7.586 1.00 74.10 C ATOM 311 O ALA A 21 5.604 -2.517 -8.136 1.00 20.23 O ATOM 312 CB ALA A 21 4.942 -5.448 -8.314 1.00 2.00 C ATOM 0 H ALA A 21 3.034 -5.557 -6.720 1.00 23.14 H new ATOM 0 HA ALA A 21 5.722 -4.592 -6.508 1.00 13.21 H new ATOM 0 HB1 ALA A 21 5.779 -5.127 -8.934 1.00 2.00 H new ATOM 0 HB2 ALA A 21 5.114 -6.469 -7.973 1.00 2.00 H new ATOM 0 HB3 ALA A 21 4.023 -5.411 -8.898 1.00 2.00 H new ATOM 318 N VAL A 22 3.500 -2.501 -7.330 1.00 65.34 N ATOM 319 CA VAL A 22 3.165 -1.159 -7.812 1.00 63.42 C ATOM 320 C VAL A 22 4.241 -0.123 -7.445 1.00 34.53 C ATOM 321 O VAL A 22 4.346 0.929 -8.084 1.00 60.30 O ATOM 322 CB VAL A 22 1.791 -0.702 -7.267 1.00 14.51 C ATOM 323 CG1 VAL A 22 1.826 -0.555 -5.757 1.00 5.13 C ATOM 324 CG2 VAL A 22 1.352 0.592 -7.930 1.00 63.04 C ATOM 0 H VAL A 22 2.759 -2.940 -6.783 1.00 65.34 H new ATOM 0 HA VAL A 22 3.117 -1.221 -8.899 1.00 63.42 H new ATOM 0 HB VAL A 22 1.058 -1.472 -7.510 1.00 14.51 H new ATOM 0 HG11 VAL A 22 0.848 -0.233 -5.400 1.00 5.13 H new ATOM 0 HG12 VAL A 22 2.080 -1.513 -5.304 1.00 5.13 H new ATOM 0 HG13 VAL A 22 2.575 0.187 -5.481 1.00 5.13 H new ATOM 0 HG21 VAL A 22 0.384 0.895 -7.532 1.00 63.04 H new ATOM 0 HG22 VAL A 22 2.087 1.372 -7.729 1.00 63.04 H new ATOM 0 HG23 VAL A 22 1.270 0.440 -9.006 1.00 63.04 H new ATOM 334 N TRP A 23 5.035 -0.429 -6.419 1.00 4.41 N ATOM 335 CA TRP A 23 6.152 0.422 -6.019 1.00 15.53 C ATOM 336 C TRP A 23 7.047 0.735 -7.223 1.00 1.32 C ATOM 337 O TRP A 23 7.534 1.859 -7.369 1.00 15.41 O ATOM 338 CB TRP A 23 6.972 -0.271 -4.922 1.00 54.35 C ATOM 339 CG TRP A 23 8.010 0.611 -4.281 1.00 34.13 C ATOM 340 CD1 TRP A 23 9.171 1.063 -4.844 1.00 64.34 C ATOM 341 CD2 TRP A 23 7.986 1.132 -2.946 1.00 34.44 C ATOM 342 NE1 TRP A 23 9.858 1.845 -3.950 1.00 1.41 N ATOM 343 CE2 TRP A 23 9.154 1.901 -2.775 1.00 73.03 C ATOM 344 CE3 TRP A 23 7.088 1.030 -1.880 1.00 4.53 C ATOM 345 CZ2 TRP A 23 9.444 2.561 -1.583 1.00 2.35 C ATOM 346 CZ3 TRP A 23 7.378 1.684 -0.697 1.00 53.34 C ATOM 347 CH2 TRP A 23 8.547 2.441 -0.557 1.00 44.42 C ATOM 0 H TRP A 23 4.923 -1.266 -5.847 1.00 4.41 H new ATOM 0 HA TRP A 23 5.753 1.359 -5.630 1.00 15.53 H new ATOM 0 HB2 TRP A 23 6.293 -0.634 -4.151 1.00 54.35 H new ATOM 0 HB3 TRP A 23 7.466 -1.144 -5.349 1.00 54.35 H new ATOM 0 HD1 TRP A 23 9.500 0.837 -5.848 1.00 64.34 H new ATOM 0 HE1 TRP A 23 10.748 2.309 -4.130 1.00 1.41 H new ATOM 0 HE3 TRP A 23 6.182 0.450 -1.979 1.00 4.53 H new ATOM 0 HZ2 TRP A 23 10.345 3.147 -1.473 1.00 2.35 H new ATOM 0 HZ3 TRP A 23 6.691 1.610 0.133 1.00 53.34 H new ATOM 0 HH2 TRP A 23 8.745 2.940 0.380 1.00 44.42 H new ATOM 358 N ARG A 24 7.240 -0.252 -8.096 1.00 1.41 N ATOM 359 CA ARG A 24 8.098 -0.083 -9.260 1.00 72.02 C ATOM 360 C ARG A 24 7.551 -0.867 -10.453 1.00 53.01 C ATOM 361 O ARG A 24 8.216 -1.768 -10.967 1.00 41.12 O ATOM 362 CB ARG A 24 9.522 -0.538 -8.934 1.00 43.53 C ATOM 363 CG ARG A 24 10.589 0.448 -9.381 1.00 52.53 C ATOM 364 CD ARG A 24 10.409 1.792 -8.695 1.00 1.42 C ATOM 365 NE ARG A 24 11.407 2.774 -9.111 1.00 53.12 N ATOM 366 CZ ARG A 24 11.307 4.077 -8.860 1.00 60.02 C ATOM 367 NH1 ARG A 24 10.237 4.552 -8.235 1.00 64.14 N ATOM 368 NH2 ARG A 24 12.273 4.904 -9.240 1.00 4.40 N ATOM 0 H ARG A 24 6.813 -1.175 -8.017 1.00 1.41 H new ATOM 0 HA ARG A 24 8.117 0.974 -9.525 1.00 72.02 H new ATOM 0 HB2 ARG A 24 9.609 -0.693 -7.859 1.00 43.53 H new ATOM 0 HB3 ARG A 24 9.706 -1.501 -9.410 1.00 43.53 H new ATOM 0 HG2 ARG A 24 11.577 0.048 -9.153 1.00 52.53 H new ATOM 0 HG3 ARG A 24 10.540 0.578 -10.462 1.00 52.53 H new ATOM 0 HD2 ARG A 24 9.413 2.177 -8.914 1.00 1.42 H new ATOM 0 HD3 ARG A 24 10.468 1.655 -7.615 1.00 1.42 H new ATOM 0 HE ARG A 24 12.225 2.443 -9.622 1.00 53.12 H new ATOM 0 HH11 ARG A 24 9.491 3.918 -7.947 1.00 64.14 H new ATOM 0 HH12 ARG A 24 10.160 5.551 -8.043 1.00 64.14 H new ATOM 0 HH21 ARG A 24 13.094 4.541 -9.725 1.00 4.40 H new ATOM 0 HH22 ARG A 24 12.195 5.902 -9.047 1.00 4.40 H new ATOM 382 N ASP A 25 6.334 -0.506 -10.875 1.00 0.21 N ATOM 383 CA ASP A 25 5.652 -1.148 -12.001 1.00 12.25 C ATOM 384 C ASP A 25 5.369 -2.633 -11.717 1.00 21.25 C ATOM 385 O ASP A 25 5.810 -3.174 -10.708 1.00 41.03 O ATOM 386 CB ASP A 25 6.487 -0.952 -13.270 1.00 23.23 C ATOM 387 CG ASP A 25 5.892 -1.611 -14.504 1.00 53.21 C ATOM 388 OD1 ASP A 25 4.680 -1.442 -14.746 1.00 30.50 O ATOM 389 OD2 ASP A 25 6.627 -2.312 -15.227 1.00 74.53 O ATOM 0 H ASP A 25 5.793 0.243 -10.442 1.00 0.21 H new ATOM 0 HA ASP A 25 4.679 -0.678 -12.148 1.00 12.25 H new ATOM 0 HB2 ASP A 25 6.600 0.116 -13.458 1.00 23.23 H new ATOM 0 HB3 ASP A 25 7.486 -1.353 -13.102 1.00 23.23 H new ATOM 394 N LEU A 26 4.601 -3.276 -12.586 1.00 63.44 N ATOM 395 CA LEU A 26 4.229 -4.674 -12.404 1.00 1.42 C ATOM 396 C LEU A 26 5.047 -5.561 -13.347 1.00 32.44 C ATOM 397 O LEU A 26 4.600 -5.874 -14.454 1.00 65.24 O ATOM 398 CB LEU A 26 2.730 -4.901 -12.685 1.00 53.32 C ATOM 399 CG LEU A 26 1.732 -3.941 -12.012 1.00 41.01 C ATOM 400 CD1 LEU A 26 2.083 -3.707 -10.555 1.00 41.21 C ATOM 401 CD2 LEU A 26 1.643 -2.622 -12.767 1.00 71.14 C ATOM 0 H LEU A 26 4.221 -2.849 -13.430 1.00 63.44 H new ATOM 0 HA LEU A 26 4.435 -4.935 -11.366 1.00 1.42 H new ATOM 0 HB2 LEU A 26 2.577 -4.846 -13.763 1.00 53.32 H new ATOM 0 HB3 LEU A 26 2.480 -5.917 -12.379 1.00 53.32 H new ATOM 0 HG LEU A 26 0.751 -4.415 -12.045 1.00 41.01 H new ATOM 0 HD11 LEU A 26 1.358 -3.025 -10.111 1.00 41.21 H new ATOM 0 HD12 LEU A 26 2.064 -4.656 -10.019 1.00 41.21 H new ATOM 0 HD13 LEU A 26 3.080 -3.272 -10.486 1.00 41.21 H new ATOM 0 HD21 LEU A 26 0.931 -1.965 -12.268 1.00 71.14 H new ATOM 0 HD22 LEU A 26 2.624 -2.147 -12.786 1.00 71.14 H new ATOM 0 HD23 LEU A 26 1.311 -2.809 -13.788 1.00 71.14 H new ATOM 413 N PRO A 27 6.259 -5.972 -12.938 1.00 62.24 N ATOM 414 CA PRO A 27 7.159 -6.736 -13.804 1.00 72.41 C ATOM 415 C PRO A 27 6.707 -8.180 -13.998 1.00 20.35 C ATOM 416 O PRO A 27 6.955 -8.786 -15.040 1.00 34.10 O ATOM 417 CB PRO A 27 8.492 -6.682 -13.060 1.00 62.22 C ATOM 418 CG PRO A 27 8.121 -6.529 -11.626 1.00 5.02 C ATOM 419 CD PRO A 27 6.845 -5.735 -11.604 1.00 2.25 C ATOM 0 HA PRO A 27 7.200 -6.323 -14.812 1.00 72.41 H new ATOM 0 HB2 PRO A 27 9.073 -7.589 -13.224 1.00 62.22 H new ATOM 0 HB3 PRO A 27 9.102 -5.846 -13.402 1.00 62.22 H new ATOM 0 HG2 PRO A 27 7.982 -7.502 -11.154 1.00 5.02 H new ATOM 0 HG3 PRO A 27 8.908 -6.016 -11.073 1.00 5.02 H new ATOM 0 HD2 PRO A 27 6.179 -6.071 -10.809 1.00 2.25 H new ATOM 0 HD3 PRO A 27 7.036 -4.675 -11.434 1.00 2.25 H new ATOM 998 N ALA A 64 15.220 -4.145 2.990 1.00 4.52 N ATOM 999 CA ALA A 64 14.045 -4.448 3.784 1.00 60.13 C ATOM 1000 C ALA A 64 13.729 -5.934 3.753 1.00 41.34 C ATOM 1001 O ALA A 64 13.845 -6.578 2.713 1.00 61.14 O ATOM 1002 CB ALA A 64 12.858 -3.640 3.286 1.00 41.10 C ATOM 0 HA ALA A 64 14.251 -4.174 4.819 1.00 60.13 H new ATOM 0 HB1 ALA A 64 11.980 -3.874 3.888 1.00 41.10 H new ATOM 0 HB2 ALA A 64 13.082 -2.576 3.369 1.00 41.10 H new ATOM 0 HB3 ALA A 64 12.660 -3.889 2.244 1.00 41.10 H new ATOM 1008 N GLU A 65 13.342 -6.470 4.903 1.00 4.14 N ATOM 1009 CA GLU A 65 12.876 -7.845 4.994 1.00 51.22 C ATOM 1010 C GLU A 65 11.356 -7.858 5.194 1.00 32.13 C ATOM 1011 O GLU A 65 10.773 -6.868 5.630 1.00 31.10 O ATOM 1012 CB GLU A 65 13.572 -8.546 6.164 1.00 44.42 C ATOM 1013 CG GLU A 65 14.023 -9.971 5.862 1.00 35.11 C ATOM 1014 CD GLU A 65 12.879 -10.933 5.617 1.00 61.41 C ATOM 1015 OE1 GLU A 65 12.417 -11.041 4.460 1.00 11.54 O ATOM 1016 OE2 GLU A 65 12.434 -11.588 6.579 1.00 0.24 O ATOM 0 H GLU A 65 13.342 -5.968 5.791 1.00 4.14 H new ATOM 0 HA GLU A 65 13.116 -8.375 4.073 1.00 51.22 H new ATOM 0 HB2 GLU A 65 14.440 -7.958 6.461 1.00 44.42 H new ATOM 0 HB3 GLU A 65 12.893 -8.565 7.017 1.00 44.42 H new ATOM 0 HG2 GLU A 65 14.670 -9.960 4.985 1.00 35.11 H new ATOM 0 HG3 GLU A 65 14.622 -10.337 6.696 1.00 35.11 H new ATOM 1023 N LEU A 66 10.719 -8.969 4.861 1.00 43.00 N ATOM 1024 CA LEU A 66 9.268 -9.074 4.939 1.00 62.03 C ATOM 1025 C LEU A 66 8.863 -10.005 6.081 1.00 12.24 C ATOM 1026 O LEU A 66 9.510 -11.024 6.307 1.00 33.34 O ATOM 1027 CB LEU A 66 8.719 -9.609 3.616 1.00 42.20 C ATOM 1028 CG LEU A 66 7.203 -9.603 3.485 1.00 13.25 C ATOM 1029 CD1 LEU A 66 6.692 -8.180 3.348 1.00 14.13 C ATOM 1030 CD2 LEU A 66 6.778 -10.445 2.298 1.00 43.51 C ATOM 0 H LEU A 66 11.185 -9.815 4.533 1.00 43.00 H new ATOM 0 HA LEU A 66 8.853 -8.084 5.130 1.00 62.03 H new ATOM 0 HB2 LEU A 66 9.139 -9.017 2.803 1.00 42.20 H new ATOM 0 HB3 LEU A 66 9.074 -10.631 3.482 1.00 42.20 H new ATOM 0 HG LEU A 66 6.769 -10.036 4.386 1.00 13.25 H new ATOM 0 HD11 LEU A 66 5.606 -8.191 3.255 1.00 14.13 H new ATOM 0 HD12 LEU A 66 6.975 -7.605 4.230 1.00 14.13 H new ATOM 0 HD13 LEU A 66 7.128 -7.721 2.461 1.00 14.13 H new ATOM 0 HD21 LEU A 66 5.691 -10.433 2.214 1.00 43.51 H new ATOM 0 HD22 LEU A 66 7.217 -10.037 1.387 1.00 43.51 H new ATOM 0 HD23 LEU A 66 7.120 -11.470 2.438 1.00 43.51 H new ATOM 1042 N THR A 67 7.794 -9.668 6.797 1.00 64.44 N ATOM 1043 CA THR A 67 7.374 -10.473 7.939 1.00 42.33 C ATOM 1044 C THR A 67 6.093 -11.264 7.636 1.00 64.22 C ATOM 1045 O THR A 67 5.661 -12.091 8.441 1.00 24.05 O ATOM 1046 CB THR A 67 7.174 -9.593 9.195 1.00 43.21 C ATOM 1047 OG1 THR A 67 6.954 -10.412 10.351 1.00 62.53 O ATOM 1048 CG2 THR A 67 6.001 -8.640 9.018 1.00 63.20 C ATOM 0 H THR A 67 7.209 -8.853 6.610 1.00 64.44 H new ATOM 0 HA THR A 67 8.172 -11.188 8.137 1.00 42.33 H new ATOM 0 HB THR A 67 8.082 -9.006 9.334 1.00 43.21 H new ATOM 0 HG1 THR A 67 6.447 -11.210 10.095 1.00 62.53 H new ATOM 0 HG21 THR A 67 5.885 -8.035 9.917 1.00 63.20 H new ATOM 0 HG22 THR A 67 6.187 -7.989 8.164 1.00 63.20 H new ATOM 0 HG23 THR A 67 5.090 -9.213 8.846 1.00 63.20 H new ATOM 1056 N ALA A 68 5.487 -11.006 6.483 1.00 72.11 N ATOM 1057 CA ALA A 68 4.300 -11.744 6.070 1.00 14.41 C ATOM 1058 C ALA A 68 4.171 -11.756 4.559 1.00 51.44 C ATOM 1059 O ALA A 68 4.144 -10.704 3.924 1.00 11.02 O ATOM 1060 CB ALA A 68 3.048 -11.153 6.691 1.00 34.23 C ATOM 0 H ALA A 68 5.796 -10.295 5.820 1.00 72.11 H new ATOM 0 HA ALA A 68 4.411 -12.770 6.421 1.00 14.41 H new ATOM 0 HB1 ALA A 68 2.177 -11.722 6.366 1.00 34.23 H new ATOM 0 HB2 ALA A 68 3.125 -11.196 7.777 1.00 34.23 H new ATOM 0 HB3 ALA A 68 2.941 -10.115 6.376 1.00 34.23 H new ATOM 1066 N ASP A 69 4.077 -12.948 4.000 1.00 74.21 N ATOM 1067 CA ASP A 69 4.015 -13.126 2.553 1.00 14.45 C ATOM 1068 C ASP A 69 2.952 -14.151 2.177 1.00 61.54 C ATOM 1069 O ASP A 69 3.167 -14.992 1.300 1.00 62.14 O ATOM 1070 CB ASP A 69 5.384 -13.553 1.998 1.00 73.25 C ATOM 1071 CG ASP A 69 5.967 -14.778 2.685 1.00 72.53 C ATOM 1072 OD1 ASP A 69 5.575 -15.914 2.344 1.00 55.40 O ATOM 1073 OD2 ASP A 69 6.843 -14.612 3.560 1.00 65.15 O ATOM 0 H ASP A 69 4.041 -13.819 4.529 1.00 74.21 H new ATOM 0 HA ASP A 69 3.743 -12.168 2.109 1.00 14.45 H new ATOM 0 HB2 ASP A 69 5.286 -13.757 0.932 1.00 73.25 H new ATOM 0 HB3 ASP A 69 6.083 -12.723 2.101 1.00 73.25 H new ATOM 1078 N GLU A 70 1.791 -14.056 2.821 1.00 53.03 N ATOM 1079 CA GLU A 70 0.699 -14.989 2.572 1.00 73.30 C ATOM 1080 C GLU A 70 0.305 -14.967 1.094 1.00 55.10 C ATOM 1081 O GLU A 70 0.306 -13.905 0.466 1.00 22.31 O ATOM 1082 CB GLU A 70 -0.508 -14.635 3.447 1.00 41.40 C ATOM 1083 CG GLU A 70 -0.203 -14.643 4.937 1.00 54.21 C ATOM 1084 CD GLU A 70 0.336 -15.975 5.416 1.00 24.41 C ATOM 1085 OE1 GLU A 70 -0.464 -16.916 5.590 1.00 65.50 O ATOM 1086 OE2 GLU A 70 1.559 -16.090 5.616 1.00 74.10 O ATOM 0 H GLU A 70 1.584 -13.342 3.519 1.00 53.03 H new ATOM 0 HA GLU A 70 1.035 -15.994 2.827 1.00 73.30 H new ATOM 0 HB2 GLU A 70 -0.874 -13.648 3.165 1.00 41.40 H new ATOM 0 HB3 GLU A 70 -1.312 -15.342 3.245 1.00 41.40 H new ATOM 0 HG2 GLU A 70 0.523 -13.861 5.159 1.00 54.21 H new ATOM 0 HG3 GLU A 70 -1.111 -14.403 5.491 1.00 54.21 H new ATOM 1093 N PRO A 71 -0.054 -16.136 0.531 1.00 75.32 N ATOM 1094 CA PRO A 71 -0.310 -16.292 -0.910 1.00 53.42 C ATOM 1095 C PRO A 71 -1.425 -15.384 -1.425 1.00 33.32 C ATOM 1096 O PRO A 71 -2.608 -15.729 -1.355 1.00 14.01 O ATOM 1097 CB PRO A 71 -0.706 -17.767 -1.056 1.00 33.43 C ATOM 1098 CG PRO A 71 -0.164 -18.433 0.161 1.00 72.53 C ATOM 1099 CD PRO A 71 -0.233 -17.408 1.255 1.00 33.20 C ATOM 0 HA PRO A 71 0.564 -16.012 -1.497 1.00 53.42 H new ATOM 0 HB2 PRO A 71 -1.788 -17.881 -1.120 1.00 33.43 H new ATOM 0 HB3 PRO A 71 -0.286 -18.201 -1.964 1.00 33.43 H new ATOM 0 HG2 PRO A 71 -0.749 -19.317 0.416 1.00 72.53 H new ATOM 0 HG3 PRO A 71 0.862 -18.765 0.001 1.00 72.53 H new ATOM 0 HD2 PRO A 71 -1.187 -17.442 1.780 1.00 33.20 H new ATOM 0 HD3 PRO A 71 0.547 -17.561 2.001 1.00 33.20 H new ATOM 1107 N GLY A 72 -1.029 -14.211 -1.911 1.00 60.32 N ATOM 1108 CA GLY A 72 -1.969 -13.267 -2.484 1.00 52.44 C ATOM 1109 C GLY A 72 -3.051 -12.844 -1.510 1.00 15.35 C ATOM 1110 O GLY A 72 -4.195 -12.618 -1.909 1.00 61.32 O ATOM 0 H GLY A 72 -0.059 -13.896 -1.917 1.00 60.32 H new ATOM 0 HA2 GLY A 72 -1.428 -12.384 -2.823 1.00 52.44 H new ATOM 0 HA3 GLY A 72 -2.433 -13.713 -3.363 1.00 52.44 H new ATOM 1114 N LYS A 73 -2.701 -12.748 -0.231 1.00 21.42 N ATOM 1115 CA LYS A 73 -3.665 -12.348 0.785 1.00 74.02 C ATOM 1116 C LYS A 73 -3.138 -11.213 1.655 1.00 40.43 C ATOM 1117 O LYS A 73 -3.382 -10.048 1.368 1.00 4.15 O ATOM 1118 CB LYS A 73 -4.066 -13.537 1.662 1.00 32.42 C ATOM 1119 CG LYS A 73 -5.016 -14.504 0.982 1.00 53.11 C ATOM 1120 CD LYS A 73 -5.483 -15.580 1.943 1.00 24.03 C ATOM 1121 CE LYS A 73 -6.612 -16.403 1.350 1.00 63.42 C ATOM 1122 NZ LYS A 73 -7.104 -17.429 2.305 1.00 45.24 N ATOM 0 H LYS A 73 -1.764 -12.940 0.123 1.00 21.42 H new ATOM 0 HA LYS A 73 -4.547 -11.985 0.257 1.00 74.02 H new ATOM 0 HB2 LYS A 73 -3.167 -14.075 1.962 1.00 32.42 H new ATOM 0 HB3 LYS A 73 -4.533 -13.164 2.573 1.00 32.42 H new ATOM 0 HG2 LYS A 73 -5.877 -13.960 0.594 1.00 53.11 H new ATOM 0 HG3 LYS A 73 -4.520 -14.966 0.128 1.00 53.11 H new ATOM 0 HD2 LYS A 73 -4.647 -16.234 2.193 1.00 24.03 H new ATOM 0 HD3 LYS A 73 -5.817 -15.119 2.873 1.00 24.03 H new ATOM 0 HE2 LYS A 73 -7.434 -15.744 1.068 1.00 63.42 H new ATOM 0 HE3 LYS A 73 -6.267 -16.890 0.438 1.00 63.42 H new ATOM 0 HZ1 LYS A 73 -7.875 -17.971 1.865 1.00 45.24 H new ATOM 0 HZ2 LYS A 73 -6.326 -18.073 2.554 1.00 45.24 H new ATOM 0 HZ3 LYS A 73 -7.456 -16.962 3.165 1.00 45.24 H new ATOM 1136 N ARG A 74 -2.394 -11.550 2.699 1.00 61.21 N ATOM 1137 CA ARG A 74 -1.960 -10.555 3.669 1.00 23.32 C ATOM 1138 C ARG A 74 -0.443 -10.453 3.711 1.00 15.23 C ATOM 1139 O ARG A 74 0.253 -11.393 4.096 1.00 64.13 O ATOM 1140 CB ARG A 74 -2.532 -10.882 5.054 1.00 63.43 C ATOM 1141 CG ARG A 74 -1.834 -10.178 6.209 1.00 23.10 C ATOM 1142 CD ARG A 74 -2.296 -10.725 7.552 1.00 74.12 C ATOM 1143 NE ARG A 74 -1.751 -9.963 8.676 1.00 13.53 N ATOM 1144 CZ ARG A 74 -1.433 -10.489 9.860 1.00 43.30 C ATOM 1145 NH1 ARG A 74 -1.575 -11.791 10.080 1.00 1.04 N ATOM 1146 NH2 ARG A 74 -0.974 -9.698 10.819 1.00 43.35 N ATOM 0 H ARG A 74 -2.080 -12.500 2.895 1.00 61.21 H new ATOM 0 HA ARG A 74 -2.342 -9.582 3.359 1.00 23.32 H new ATOM 0 HB2 ARG A 74 -3.589 -10.616 5.068 1.00 63.43 H new ATOM 0 HB3 ARG A 74 -2.472 -11.959 5.212 1.00 63.43 H new ATOM 0 HG2 ARG A 74 -0.755 -10.303 6.115 1.00 23.10 H new ATOM 0 HG3 ARG A 74 -2.036 -9.108 6.161 1.00 23.10 H new ATOM 0 HD2 ARG A 74 -3.385 -10.705 7.595 1.00 74.12 H new ATOM 0 HD3 ARG A 74 -1.993 -11.768 7.641 1.00 74.12 H new ATOM 0 HE ARG A 74 -1.604 -8.962 8.545 1.00 13.53 H new ATOM 0 HH11 ARG A 74 -1.930 -12.397 9.341 1.00 1.04 H new ATOM 0 HH12 ARG A 74 -1.329 -12.185 10.988 1.00 1.04 H new ATOM 0 HH21 ARG A 74 -0.867 -8.698 10.648 1.00 43.35 H new ATOM 0 HH22 ARG A 74 -0.728 -10.089 11.728 1.00 43.35 H new ATOM 1160 N ILE A 75 0.052 -9.306 3.290 1.00 12.44 N ATOM 1161 CA ILE A 75 1.474 -9.025 3.295 1.00 13.31 C ATOM 1162 C ILE A 75 1.759 -7.856 4.232 1.00 55.12 C ATOM 1163 O ILE A 75 1.203 -6.773 4.071 1.00 23.44 O ATOM 1164 CB ILE A 75 2.002 -8.683 1.874 1.00 54.02 C ATOM 1165 CG1 ILE A 75 1.894 -9.887 0.929 1.00 71.32 C ATOM 1166 CG2 ILE A 75 3.442 -8.200 1.936 1.00 21.21 C ATOM 1167 CD1 ILE A 75 0.502 -10.116 0.378 1.00 4.14 C ATOM 0 H ILE A 75 -0.521 -8.541 2.934 1.00 12.44 H new ATOM 0 HA ILE A 75 1.988 -9.922 3.639 1.00 13.31 H new ATOM 0 HB ILE A 75 1.376 -7.883 1.479 1.00 54.02 H new ATOM 0 HG12 ILE A 75 2.584 -9.746 0.097 1.00 71.32 H new ATOM 0 HG13 ILE A 75 2.215 -10.783 1.461 1.00 71.32 H new ATOM 0 HG21 ILE A 75 3.791 -7.966 0.930 1.00 21.21 H new ATOM 0 HG22 ILE A 75 3.499 -7.306 2.557 1.00 21.21 H new ATOM 0 HG23 ILE A 75 4.070 -8.981 2.366 1.00 21.21 H new ATOM 0 HD11 ILE A 75 0.510 -10.985 -0.281 1.00 4.14 H new ATOM 0 HD12 ILE A 75 -0.191 -10.291 1.201 1.00 4.14 H new ATOM 0 HD13 ILE A 75 0.184 -9.238 -0.184 1.00 4.14 H new ATOM 1179 N ALA A 76 2.600 -8.078 5.225 1.00 34.51 N ATOM 1180 CA ALA A 76 2.994 -7.011 6.130 1.00 51.23 C ATOM 1181 C ALA A 76 4.443 -6.646 5.880 1.00 60.12 C ATOM 1182 O ALA A 76 5.344 -7.469 6.073 1.00 51.54 O ATOM 1183 CB ALA A 76 2.783 -7.421 7.579 1.00 40.33 C ATOM 0 H ALA A 76 3.023 -8.984 5.426 1.00 34.51 H new ATOM 0 HA ALA A 76 2.369 -6.138 5.941 1.00 51.23 H new ATOM 0 HB1 ALA A 76 3.085 -6.605 8.236 1.00 40.33 H new ATOM 0 HB2 ALA A 76 1.730 -7.648 7.743 1.00 40.33 H new ATOM 0 HB3 ALA A 76 3.383 -8.304 7.798 1.00 40.33 H new ATOM 1189 N TRP A 77 4.671 -5.420 5.443 1.00 62.52 N ATOM 1190 CA TRP A 77 6.002 -5.005 5.044 1.00 2.12 C ATOM 1191 C TRP A 77 6.792 -4.473 6.227 1.00 12.52 C ATOM 1192 O TRP A 77 6.259 -3.795 7.108 1.00 41.40 O ATOM 1193 CB TRP A 77 5.960 -3.978 3.902 1.00 22.43 C ATOM 1194 CG TRP A 77 5.192 -2.721 4.193 1.00 34.44 C ATOM 1195 CD1 TRP A 77 5.627 -1.636 4.902 1.00 42.12 C ATOM 1196 CD2 TRP A 77 3.866 -2.406 3.753 1.00 50.40 C ATOM 1197 NE1 TRP A 77 4.650 -0.673 4.937 1.00 62.42 N ATOM 1198 CE2 TRP A 77 3.561 -1.119 4.236 1.00 60.05 C ATOM 1199 CE3 TRP A 77 2.907 -3.085 2.996 1.00 51.34 C ATOM 1200 CZ2 TRP A 77 2.338 -0.502 3.991 1.00 12.50 C ATOM 1201 CZ3 TRP A 77 1.693 -2.470 2.753 1.00 62.34 C ATOM 1202 CH2 TRP A 77 1.419 -1.189 3.247 1.00 30.03 C ATOM 0 H TRP A 77 3.955 -4.699 5.356 1.00 62.52 H new ATOM 0 HA TRP A 77 6.516 -5.890 4.668 1.00 2.12 H new ATOM 0 HB2 TRP A 77 6.983 -3.706 3.643 1.00 22.43 H new ATOM 0 HB3 TRP A 77 5.524 -4.454 3.024 1.00 22.43 H new ATOM 0 HD1 TRP A 77 6.598 -1.549 5.367 1.00 42.12 H new ATOM 0 HE1 TRP A 77 4.723 0.229 5.408 1.00 62.42 H new ATOM 0 HE3 TRP A 77 3.111 -4.072 2.608 1.00 51.34 H new ATOM 0 HZ2 TRP A 77 2.122 0.484 4.375 1.00 12.50 H new ATOM 0 HZ3 TRP A 77 0.943 -2.987 2.172 1.00 62.34 H new ATOM 0 HH2 TRP A 77 0.462 -0.734 3.036 1.00 30.03 H new ATOM 1213 N ARG A 78 8.068 -4.806 6.241 1.00 52.50 N ATOM 1214 CA ARG A 78 8.964 -4.388 7.297 1.00 45.23 C ATOM 1215 C ARG A 78 10.291 -3.948 6.712 1.00 64.02 C ATOM 1216 O ARG A 78 10.509 -4.035 5.499 1.00 54.14 O ATOM 1217 CB ARG A 78 9.173 -5.514 8.315 1.00 54.31 C ATOM 1218 CG ARG A 78 8.091 -5.585 9.385 1.00 45.41 C ATOM 1219 CD ARG A 78 8.328 -4.577 10.505 1.00 42.20 C ATOM 1220 NE ARG A 78 8.431 -3.203 10.012 1.00 23.11 N ATOM 1221 CZ ARG A 78 9.425 -2.370 10.338 1.00 65.10 C ATOM 1222 NH1 ARG A 78 10.355 -2.746 11.210 1.00 55.34 N ATOM 1223 NH2 ARG A 78 9.476 -1.153 9.808 1.00 4.14 N ATOM 0 H ARG A 78 8.511 -5.374 5.519 1.00 52.50 H new ATOM 0 HA ARG A 78 8.512 -3.543 7.817 1.00 45.23 H new ATOM 0 HB2 ARG A 78 9.211 -6.466 7.786 1.00 54.31 H new ATOM 0 HB3 ARG A 78 10.141 -5.379 8.798 1.00 54.31 H new ATOM 0 HG2 ARG A 78 7.118 -5.399 8.930 1.00 45.41 H new ATOM 0 HG3 ARG A 78 8.060 -6.591 9.803 1.00 45.41 H new ATOM 0 HD2 ARG A 78 7.512 -4.641 11.225 1.00 42.20 H new ATOM 0 HD3 ARG A 78 9.243 -4.838 11.036 1.00 42.20 H new ATOM 0 HE ARG A 78 7.703 -2.861 9.384 1.00 23.11 H new ATOM 0 HH11 ARG A 78 10.312 -3.673 11.633 1.00 55.34 H new ATOM 0 HH12 ARG A 78 11.111 -2.108 11.456 1.00 55.34 H new ATOM 0 HH21 ARG A 78 8.756 -0.852 9.151 1.00 4.14 H new ATOM 0 HH22 ARG A 78 10.235 -0.519 10.058 1.00 4.14 H new ATOM 1237 N SER A 79 11.155 -3.456 7.570 1.00 63.34 N ATOM 1238 CA SER A 79 12.456 -2.983 7.167 1.00 34.44 C ATOM 1239 C SER A 79 13.454 -3.305 8.262 1.00 41.42 C ATOM 1240 O SER A 79 13.059 -3.635 9.382 1.00 52.12 O ATOM 1241 CB SER A 79 12.411 -1.476 6.894 1.00 13.10 C ATOM 1242 OG SER A 79 11.806 -0.782 7.973 1.00 14.12 O ATOM 0 H SER A 79 10.973 -3.373 8.570 1.00 63.34 H new ATOM 0 HA SER A 79 12.762 -3.479 6.246 1.00 34.44 H new ATOM 0 HB2 SER A 79 13.422 -1.101 6.737 1.00 13.10 H new ATOM 0 HB3 SER A 79 11.854 -1.285 5.976 1.00 13.10 H new ATOM 0 HG SER A 79 11.705 0.164 7.738 1.00 14.12 H new ATOM 1248 N LEU A 80 14.734 -3.226 7.947 1.00 53.24 N ATOM 1249 CA LEU A 80 15.759 -3.558 8.916 1.00 11.12 C ATOM 1250 C LEU A 80 15.937 -2.407 9.898 1.00 24.24 C ATOM 1251 O LEU A 80 15.724 -1.245 9.543 1.00 52.43 O ATOM 1252 CB LEU A 80 17.078 -3.885 8.210 1.00 55.35 C ATOM 1253 CG LEU A 80 16.959 -4.874 7.047 1.00 65.42 C ATOM 1254 CD1 LEU A 80 18.326 -5.359 6.606 1.00 41.42 C ATOM 1255 CD2 LEU A 80 16.071 -6.049 7.412 1.00 55.10 C ATOM 0 H LEU A 80 15.086 -2.937 7.034 1.00 53.24 H new ATOM 0 HA LEU A 80 15.448 -4.442 9.472 1.00 11.12 H new ATOM 0 HB2 LEU A 80 17.513 -2.958 7.836 1.00 55.35 H new ATOM 0 HB3 LEU A 80 17.775 -4.291 8.943 1.00 55.35 H new ATOM 0 HG LEU A 80 16.496 -4.347 6.213 1.00 65.42 H new ATOM 0 HD11 LEU A 80 18.214 -6.060 5.779 1.00 41.42 H new ATOM 0 HD12 LEU A 80 18.927 -4.509 6.282 1.00 41.42 H new ATOM 0 HD13 LEU A 80 18.822 -5.857 7.439 1.00 41.42 H new ATOM 0 HD21 LEU A 80 16.007 -6.733 6.566 1.00 55.10 H new ATOM 0 HD22 LEU A 80 16.494 -6.572 8.270 1.00 55.10 H new ATOM 0 HD23 LEU A 80 15.074 -5.687 7.663 1.00 55.10 H new ATOM 1267 N PRO A 81 16.314 -2.714 11.151 1.00 20.34 N ATOM 1268 CA PRO A 81 16.475 -1.704 12.208 1.00 30.31 C ATOM 1269 C PRO A 81 17.435 -0.583 11.814 1.00 64.23 C ATOM 1270 O PRO A 81 17.313 0.546 12.289 1.00 74.34 O ATOM 1271 CB PRO A 81 17.041 -2.506 13.383 1.00 11.15 C ATOM 1272 CG PRO A 81 16.599 -3.905 13.137 1.00 51.14 C ATOM 1273 CD PRO A 81 16.596 -4.077 11.646 1.00 54.10 C ATOM 0 HA PRO A 81 15.534 -1.200 12.429 1.00 30.31 H new ATOM 0 HB2 PRO A 81 18.128 -2.436 13.423 1.00 11.15 H new ATOM 0 HB3 PRO A 81 16.663 -2.133 14.335 1.00 11.15 H new ATOM 0 HG2 PRO A 81 17.274 -4.617 13.611 1.00 51.14 H new ATOM 0 HG3 PRO A 81 15.607 -4.080 13.553 1.00 51.14 H new ATOM 0 HD2 PRO A 81 17.554 -4.448 11.281 1.00 54.10 H new ATOM 0 HD3 PRO A 81 15.835 -4.788 11.324 1.00 54.10 H new ATOM 1281 N GLY A 82 18.375 -0.896 10.930 1.00 14.30 N ATOM 1282 CA GLY A 82 19.368 0.079 10.522 1.00 65.22 C ATOM 1283 C GLY A 82 18.929 0.919 9.336 1.00 42.40 C ATOM 1284 O GLY A 82 19.678 1.783 8.875 1.00 20.52 O ATOM 0 H GLY A 82 18.467 -1.810 10.488 1.00 14.30 H new ATOM 0 HA2 GLY A 82 19.589 0.737 11.363 1.00 65.22 H new ATOM 0 HA3 GLY A 82 20.294 -0.438 10.270 1.00 65.22 H new ATOM 1288 N ALA A 83 17.724 0.679 8.841 1.00 13.03 N ATOM 1289 CA ALA A 83 17.214 1.422 7.698 1.00 43.33 C ATOM 1290 C ALA A 83 16.584 2.738 8.141 1.00 64.31 C ATOM 1291 O ALA A 83 16.213 2.899 9.302 1.00 60.10 O ATOM 1292 CB ALA A 83 16.207 0.583 6.925 1.00 11.45 C ATOM 0 H ALA A 83 17.083 -0.022 9.211 1.00 13.03 H new ATOM 0 HA ALA A 83 18.053 1.652 7.041 1.00 43.33 H new ATOM 0 HB1 ALA A 83 15.835 1.153 6.074 1.00 11.45 H new ATOM 0 HB2 ALA A 83 16.689 -0.328 6.569 1.00 11.45 H new ATOM 0 HB3 ALA A 83 15.374 0.321 7.578 1.00 11.45 H new ATOM 1298 N ARG A 84 16.469 3.678 7.212 1.00 44.22 N ATOM 1299 CA ARG A 84 15.877 4.981 7.507 1.00 11.32 C ATOM 1300 C ARG A 84 14.419 5.022 7.073 1.00 43.13 C ATOM 1301 O ARG A 84 13.804 6.087 7.015 1.00 12.04 O ATOM 1302 CB ARG A 84 16.660 6.104 6.819 1.00 4.22 C ATOM 1303 CG ARG A 84 17.852 6.622 7.617 1.00 44.31 C ATOM 1304 CD ARG A 84 18.897 5.545 7.854 1.00 15.11 C ATOM 1305 NE ARG A 84 20.065 6.067 8.557 1.00 33.31 N ATOM 1306 CZ ARG A 84 21.191 5.383 8.749 1.00 42.44 C ATOM 1307 NH1 ARG A 84 21.306 4.137 8.307 1.00 54.54 N ATOM 1308 NH2 ARG A 84 22.197 5.949 9.396 1.00 65.13 N ATOM 0 H ARG A 84 16.777 3.565 6.246 1.00 44.22 H new ATOM 0 HA ARG A 84 15.925 5.133 8.585 1.00 11.32 H new ATOM 0 HB2 ARG A 84 17.014 5.744 5.853 1.00 4.22 H new ATOM 0 HB3 ARG A 84 15.982 6.934 6.621 1.00 4.22 H new ATOM 0 HG2 ARG A 84 18.308 7.457 7.085 1.00 44.31 H new ATOM 0 HG3 ARG A 84 17.505 7.006 8.576 1.00 44.31 H new ATOM 0 HD2 ARG A 84 18.457 4.733 8.433 1.00 15.11 H new ATOM 0 HD3 ARG A 84 19.207 5.123 6.898 1.00 15.11 H new ATOM 0 HE ARG A 84 20.015 7.017 8.925 1.00 33.31 H new ATOM 0 HH11 ARG A 84 20.528 3.696 7.816 1.00 54.54 H new ATOM 0 HH12 ARG A 84 22.172 3.620 8.458 1.00 54.54 H new ATOM 0 HH21 ARG A 84 22.107 6.904 9.744 1.00 65.13 H new ATOM 0 HH22 ARG A 84 23.063 5.431 9.547 1.00 65.13 H new ATOM 1322 N ILE A 85 13.866 3.860 6.774 1.00 13.44 N ATOM 1323 CA ILE A 85 12.478 3.771 6.364 1.00 1.52 C ATOM 1324 C ILE A 85 11.621 3.343 7.551 1.00 53.33 C ATOM 1325 O ILE A 85 11.291 2.166 7.705 1.00 61.54 O ATOM 1326 CB ILE A 85 12.262 2.785 5.183 1.00 64.24 C ATOM 1327 CG1 ILE A 85 13.150 3.139 3.979 1.00 23.11 C ATOM 1328 CG2 ILE A 85 10.801 2.779 4.756 1.00 12.51 C ATOM 1329 CD1 ILE A 85 14.579 2.649 4.094 1.00 52.30 C ATOM 0 H ILE A 85 14.357 2.967 6.808 1.00 13.44 H new ATOM 0 HA ILE A 85 12.181 4.760 6.016 1.00 1.52 H new ATOM 0 HB ILE A 85 12.543 1.792 5.533 1.00 64.24 H new ATOM 0 HG12 ILE A 85 12.705 2.718 3.078 1.00 23.11 H new ATOM 0 HG13 ILE A 85 13.158 4.222 3.854 1.00 23.11 H new ATOM 0 HG21 ILE A 85 10.667 2.083 3.928 1.00 12.51 H new ATOM 0 HG22 ILE A 85 10.178 2.469 5.595 1.00 12.51 H new ATOM 0 HG23 ILE A 85 10.510 3.781 4.439 1.00 12.51 H new ATOM 0 HD11 ILE A 85 15.136 2.941 3.204 1.00 52.30 H new ATOM 0 HD12 ILE A 85 15.045 3.090 4.975 1.00 52.30 H new ATOM 0 HD13 ILE A 85 14.585 1.563 4.186 1.00 52.30 H new ATOM 1341 N GLU A 86 11.301 4.296 8.414 1.00 33.33 N ATOM 1342 CA GLU A 86 10.460 4.014 9.563 1.00 0.21 C ATOM 1343 C GLU A 86 9.000 4.017 9.139 1.00 73.05 C ATOM 1344 O GLU A 86 8.355 5.066 9.081 1.00 12.30 O ATOM 1345 CB GLU A 86 10.696 5.024 10.691 1.00 63.04 C ATOM 1346 CG GLU A 86 9.859 4.749 11.932 1.00 14.52 C ATOM 1347 CD GLU A 86 10.187 5.675 13.085 1.00 64.12 C ATOM 1348 OE1 GLU A 86 11.165 5.401 13.809 1.00 31.05 O ATOM 1349 OE2 GLU A 86 9.461 6.670 13.285 1.00 52.23 O ATOM 0 H GLU A 86 11.610 5.265 8.340 1.00 33.33 H new ATOM 0 HA GLU A 86 10.721 3.028 9.948 1.00 0.21 H new ATOM 0 HB2 GLU A 86 11.751 5.013 10.964 1.00 63.04 H new ATOM 0 HB3 GLU A 86 10.472 6.026 10.325 1.00 63.04 H new ATOM 0 HG2 GLU A 86 8.803 4.850 11.681 1.00 14.52 H new ATOM 0 HG3 GLU A 86 10.014 3.717 12.247 1.00 14.52 H new ATOM 1356 N ASN A 87 8.510 2.845 8.781 1.00 62.52 N ATOM 1357 CA ASN A 87 7.125 2.688 8.378 1.00 10.42 C ATOM 1358 C ASN A 87 6.630 1.304 8.759 1.00 34.44 C ATOM 1359 O ASN A 87 7.360 0.316 8.650 1.00 34.33 O ATOM 1360 CB ASN A 87 6.967 2.907 6.865 1.00 53.13 C ATOM 1361 CG ASN A 87 5.522 2.798 6.396 1.00 24.40 C ATOM 1362 OD1 ASN A 87 4.587 3.083 7.143 1.00 60.33 O ATOM 1363 ND2 ASN A 87 5.333 2.381 5.152 1.00 33.12 N ATOM 0 H ASN A 87 9.054 1.983 8.761 1.00 62.52 H new ATOM 0 HA ASN A 87 6.528 3.439 8.896 1.00 10.42 H new ATOM 0 HB2 ASN A 87 7.355 3.891 6.603 1.00 53.13 H new ATOM 0 HB3 ASN A 87 7.573 2.174 6.332 1.00 53.13 H new ATOM 0 HD21 ASN A 87 4.386 2.287 4.784 1.00 33.12 H new ATOM 0 HD22 ASN A 87 6.134 2.154 4.563 1.00 33.12 H new ATOM 1370 N SER A 88 5.402 1.244 9.231 1.00 2.22 N ATOM 1371 CA SER A 88 4.769 -0.012 9.571 1.00 12.53 C ATOM 1372 C SER A 88 3.459 -0.123 8.810 1.00 14.02 C ATOM 1373 O SER A 88 2.648 0.805 8.826 1.00 5.13 O ATOM 1374 CB SER A 88 4.525 -0.087 11.078 1.00 44.22 C ATOM 1375 OG SER A 88 5.733 0.128 11.791 1.00 43.53 O ATOM 0 H SER A 88 4.816 2.064 9.389 1.00 2.22 H new ATOM 0 HA SER A 88 5.419 -0.842 9.293 1.00 12.53 H new ATOM 0 HB2 SER A 88 3.786 0.660 11.370 1.00 44.22 H new ATOM 0 HB3 SER A 88 4.112 -1.062 11.337 1.00 44.22 H new ATOM 0 HG SER A 88 5.558 0.078 12.754 1.00 43.53 H new ATOM 1381 N GLY A 89 3.263 -1.234 8.124 1.00 23.43 N ATOM 1382 CA GLY A 89 2.092 -1.373 7.297 1.00 71.43 C ATOM 1383 C GLY A 89 1.707 -2.811 7.063 1.00 64.00 C ATOM 1384 O GLY A 89 2.434 -3.731 7.439 1.00 43.41 O ATOM 0 H GLY A 89 3.891 -2.038 8.126 1.00 23.43 H new ATOM 0 HA2 GLY A 89 1.258 -0.851 7.766 1.00 71.43 H new ATOM 0 HA3 GLY A 89 2.272 -0.889 6.337 1.00 71.43 H new ATOM 1388 N GLU A 90 0.571 -2.992 6.415 1.00 33.24 N ATOM 1389 CA GLU A 90 0.008 -4.306 6.193 1.00 23.50 C ATOM 1390 C GLU A 90 -1.042 -4.229 5.091 1.00 62.34 C ATOM 1391 O GLU A 90 -1.924 -3.370 5.131 1.00 45.25 O ATOM 1392 CB GLU A 90 -0.613 -4.808 7.495 1.00 52.33 C ATOM 1393 CG GLU A 90 -1.150 -6.220 7.429 1.00 65.42 C ATOM 1394 CD GLU A 90 -1.804 -6.628 8.728 1.00 71.23 C ATOM 1395 OE1 GLU A 90 -2.966 -6.237 8.957 1.00 53.44 O ATOM 1396 OE2 GLU A 90 -1.154 -7.321 9.536 1.00 64.31 O ATOM 0 H GLU A 90 0.014 -2.230 6.028 1.00 33.24 H new ATOM 0 HA GLU A 90 0.787 -5.001 5.881 1.00 23.50 H new ATOM 0 HB2 GLU A 90 0.136 -4.754 8.285 1.00 52.33 H new ATOM 0 HB3 GLU A 90 -1.424 -4.137 7.779 1.00 52.33 H new ATOM 0 HG2 GLU A 90 -1.873 -6.297 6.617 1.00 65.42 H new ATOM 0 HG3 GLU A 90 -0.337 -6.909 7.198 1.00 65.42 H new ATOM 1403 N VAL A 91 -0.929 -5.100 4.101 1.00 32.31 N ATOM 1404 CA VAL A 91 -1.863 -5.112 2.985 1.00 13.13 C ATOM 1405 C VAL A 91 -2.546 -6.468 2.836 1.00 50.22 C ATOM 1406 O VAL A 91 -1.890 -7.498 2.682 1.00 51.32 O ATOM 1407 CB VAL A 91 -1.173 -4.729 1.652 1.00 61.22 C ATOM 1408 CG1 VAL A 91 0.108 -5.518 1.435 1.00 34.24 C ATOM 1409 CG2 VAL A 91 -2.118 -4.943 0.485 1.00 74.42 C ATOM 0 H VAL A 91 -0.198 -5.810 4.047 1.00 32.31 H new ATOM 0 HA VAL A 91 -2.621 -4.362 3.212 1.00 13.13 H new ATOM 0 HB VAL A 91 -0.910 -3.673 1.712 1.00 61.22 H new ATOM 0 HG11 VAL A 91 0.562 -5.221 0.490 1.00 34.24 H new ATOM 0 HG12 VAL A 91 0.802 -5.316 2.251 1.00 34.24 H new ATOM 0 HG13 VAL A 91 -0.121 -6.583 1.409 1.00 34.24 H new ATOM 0 HG21 VAL A 91 -1.617 -4.669 -0.444 1.00 74.42 H new ATOM 0 HG22 VAL A 91 -2.412 -5.992 0.443 1.00 74.42 H new ATOM 0 HG23 VAL A 91 -3.004 -4.322 0.616 1.00 74.42 H new ATOM 1419 N LEU A 92 -3.867 -6.461 2.922 1.00 33.12 N ATOM 1420 CA LEU A 92 -4.660 -7.645 2.659 1.00 64.14 C ATOM 1421 C LEU A 92 -5.458 -7.466 1.369 1.00 10.41 C ATOM 1422 O LEU A 92 -6.232 -6.518 1.232 1.00 42.42 O ATOM 1423 CB LEU A 92 -5.614 -7.921 3.824 1.00 34.45 C ATOM 1424 CG LEU A 92 -4.991 -8.469 5.109 1.00 11.11 C ATOM 1425 CD1 LEU A 92 -4.083 -7.443 5.768 1.00 64.30 C ATOM 1426 CD2 LEU A 92 -6.090 -8.883 6.062 1.00 75.20 C ATOM 0 H LEU A 92 -4.414 -5.638 3.175 1.00 33.12 H new ATOM 0 HA LEU A 92 -3.986 -8.494 2.549 1.00 64.14 H new ATOM 0 HB2 LEU A 92 -6.132 -6.993 4.066 1.00 34.45 H new ATOM 0 HB3 LEU A 92 -6.370 -8.629 3.484 1.00 34.45 H new ATOM 0 HG LEU A 92 -4.379 -9.334 4.854 1.00 11.11 H new ATOM 0 HD11 LEU A 92 -3.657 -7.865 6.678 1.00 64.30 H new ATOM 0 HD12 LEU A 92 -3.280 -7.174 5.082 1.00 64.30 H new ATOM 0 HD13 LEU A 92 -4.660 -6.553 6.017 1.00 64.30 H new ATOM 0 HD21 LEU A 92 -5.649 -9.274 6.979 1.00 75.20 H new ATOM 0 HD22 LEU A 92 -6.711 -8.019 6.298 1.00 75.20 H new ATOM 0 HD23 LEU A 92 -6.703 -9.655 5.597 1.00 75.20 H new ATOM 1438 N PHE A 93 -5.262 -8.367 0.425 1.00 45.10 N ATOM 1439 CA PHE A 93 -5.974 -8.310 -0.842 1.00 61.12 C ATOM 1440 C PHE A 93 -7.311 -9.036 -0.738 1.00 12.43 C ATOM 1441 O PHE A 93 -7.371 -10.192 -0.316 1.00 2.45 O ATOM 1442 CB PHE A 93 -5.132 -8.926 -1.963 1.00 23.20 C ATOM 1443 CG PHE A 93 -3.805 -8.249 -2.165 1.00 30.33 C ATOM 1444 CD1 PHE A 93 -3.732 -6.997 -2.755 1.00 30.42 C ATOM 1445 CD2 PHE A 93 -2.630 -8.867 -1.769 1.00 74.33 C ATOM 1446 CE1 PHE A 93 -2.513 -6.376 -2.946 1.00 74.33 C ATOM 1447 CE2 PHE A 93 -1.408 -8.250 -1.959 1.00 32.02 C ATOM 1448 CZ PHE A 93 -1.349 -7.003 -2.547 1.00 1.52 C ATOM 0 H PHE A 93 -4.614 -9.150 0.510 1.00 45.10 H new ATOM 0 HA PHE A 93 -6.160 -7.262 -1.079 1.00 61.12 H new ATOM 0 HB2 PHE A 93 -4.962 -9.979 -1.741 1.00 23.20 H new ATOM 0 HB3 PHE A 93 -5.697 -8.884 -2.894 1.00 23.20 H new ATOM 0 HD1 PHE A 93 -4.639 -6.501 -3.069 1.00 30.42 H new ATOM 0 HD2 PHE A 93 -2.669 -9.842 -1.306 1.00 74.33 H new ATOM 0 HE1 PHE A 93 -2.470 -5.400 -3.407 1.00 74.33 H new ATOM 0 HE2 PHE A 93 -0.499 -8.744 -1.647 1.00 32.02 H new ATOM 0 HZ PHE A 93 -0.395 -6.519 -2.695 1.00 1.52 H new ATOM 1458 N ARG A 94 -8.382 -8.350 -1.104 1.00 31.44 N ATOM 1459 CA ARG A 94 -9.707 -8.948 -1.097 1.00 54.40 C ATOM 1460 C ARG A 94 -10.384 -8.754 -2.449 1.00 35.13 C ATOM 1461 O ARG A 94 -10.194 -7.729 -3.099 1.00 64.51 O ATOM 1462 CB ARG A 94 -10.576 -8.354 0.021 1.00 60.14 C ATOM 1463 CG ARG A 94 -10.490 -6.837 0.148 1.00 21.14 C ATOM 1464 CD ARG A 94 -9.632 -6.430 1.337 1.00 75.22 C ATOM 1465 NE ARG A 94 -10.264 -6.778 2.610 1.00 25.04 N ATOM 1466 CZ ARG A 94 -9.836 -7.746 3.422 1.00 24.43 C ATOM 1467 NH1 ARG A 94 -8.778 -8.474 3.095 1.00 41.54 N ATOM 1468 NH2 ARG A 94 -10.480 -7.985 4.556 1.00 44.14 N ATOM 0 H ARG A 94 -8.359 -7.377 -1.410 1.00 31.44 H new ATOM 0 HA ARG A 94 -9.593 -10.015 -0.908 1.00 54.40 H new ATOM 0 HB2 ARG A 94 -11.615 -8.633 -0.156 1.00 60.14 H new ATOM 0 HB3 ARG A 94 -10.282 -8.803 0.970 1.00 60.14 H new ATOM 0 HG2 ARG A 94 -10.071 -6.416 -0.766 1.00 21.14 H new ATOM 0 HG3 ARG A 94 -11.492 -6.422 0.260 1.00 21.14 H new ATOM 0 HD2 ARG A 94 -8.660 -6.919 1.268 1.00 75.22 H new ATOM 0 HD3 ARG A 94 -9.451 -5.356 1.303 1.00 75.22 H new ATOM 0 HE ARG A 94 -11.086 -6.245 2.895 1.00 25.04 H new ATOM 0 HH11 ARG A 94 -8.287 -8.295 2.219 1.00 41.54 H new ATOM 0 HH12 ARG A 94 -8.455 -9.213 3.719 1.00 41.54 H new ATOM 0 HH21 ARG A 94 -11.299 -7.430 4.804 1.00 44.14 H new ATOM 0 HH22 ARG A 94 -10.157 -8.724 5.180 1.00 44.14 H new ATOM 1482 N PRO A 95 -11.165 -9.747 -2.898 1.00 62.00 N ATOM 1483 CA PRO A 95 -11.921 -9.651 -4.148 1.00 21.42 C ATOM 1484 C PRO A 95 -12.962 -8.542 -4.078 1.00 1.20 C ATOM 1485 O PRO A 95 -13.719 -8.456 -3.110 1.00 52.43 O ATOM 1486 CB PRO A 95 -12.603 -11.019 -4.278 1.00 73.51 C ATOM 1487 CG PRO A 95 -11.871 -11.918 -3.340 1.00 34.00 C ATOM 1488 CD PRO A 95 -11.363 -11.042 -2.233 1.00 35.40 C ATOM 0 HA PRO A 95 -11.283 -9.412 -4.999 1.00 21.42 H new ATOM 0 HB2 PRO A 95 -13.660 -10.957 -4.018 1.00 73.51 H new ATOM 0 HB3 PRO A 95 -12.547 -11.390 -5.301 1.00 73.51 H new ATOM 0 HG2 PRO A 95 -12.530 -12.695 -2.951 1.00 34.00 H new ATOM 0 HG3 PRO A 95 -11.048 -12.422 -3.846 1.00 34.00 H new ATOM 0 HD2 PRO A 95 -12.080 -10.970 -1.415 1.00 35.40 H new ATOM 0 HD3 PRO A 95 -10.434 -11.424 -1.810 1.00 35.40 H new ATOM 1496 N ALA A 96 -12.994 -7.695 -5.094 1.00 24.15 N ATOM 1497 CA ALA A 96 -13.913 -6.572 -5.108 1.00 2.33 C ATOM 1498 C ALA A 96 -15.307 -7.021 -5.529 1.00 50.34 C ATOM 1499 O ALA A 96 -15.452 -7.890 -6.393 1.00 41.31 O ATOM 1500 CB ALA A 96 -13.402 -5.486 -6.037 1.00 50.54 C ATOM 0 H ALA A 96 -12.395 -7.765 -5.917 1.00 24.15 H new ATOM 0 HA ALA A 96 -13.976 -6.166 -4.098 1.00 2.33 H new ATOM 0 HB1 ALA A 96 -14.101 -4.650 -6.038 1.00 50.54 H new ATOM 0 HB2 ALA A 96 -12.426 -5.143 -5.694 1.00 50.54 H new ATOM 0 HB3 ALA A 96 -13.312 -5.884 -7.048 1.00 50.54 H new ATOM 1506 N PRO A 97 -16.347 -6.424 -4.927 1.00 61.41 N ATOM 1507 CA PRO A 97 -17.743 -6.767 -5.213 1.00 23.10 C ATOM 1508 C PRO A 97 -18.099 -6.592 -6.686 1.00 31.54 C ATOM 1509 O PRO A 97 -17.635 -5.657 -7.346 1.00 72.14 O ATOM 1510 CB PRO A 97 -18.547 -5.789 -4.348 1.00 32.31 C ATOM 1511 CG PRO A 97 -17.586 -4.714 -3.969 1.00 2.52 C ATOM 1512 CD PRO A 97 -16.241 -5.370 -3.906 1.00 25.51 C ATOM 0 HA PRO A 97 -17.950 -7.815 -4.994 1.00 23.10 H new ATOM 0 HB2 PRO A 97 -19.394 -5.382 -4.899 1.00 32.31 H new ATOM 0 HB3 PRO A 97 -18.950 -6.285 -3.465 1.00 32.31 H new ATOM 0 HG2 PRO A 97 -17.593 -3.907 -4.702 1.00 2.52 H new ATOM 0 HG3 PRO A 97 -17.851 -4.274 -3.008 1.00 2.52 H new ATOM 0 HD2 PRO A 97 -15.437 -4.668 -4.130 1.00 25.51 H new ATOM 0 HD3 PRO A 97 -16.038 -5.783 -2.918 1.00 25.51 H new ATOM 1520 N GLY A 98 -18.915 -7.505 -7.197 1.00 71.10 N ATOM 1521 CA GLY A 98 -19.310 -7.460 -8.589 1.00 72.44 C ATOM 1522 C GLY A 98 -18.198 -7.908 -9.511 1.00 35.14 C ATOM 1523 O GLY A 98 -18.206 -7.584 -10.702 1.00 63.44 O ATOM 0 H GLY A 98 -19.312 -8.281 -6.667 1.00 71.10 H new ATOM 0 HA2 GLY A 98 -20.183 -8.096 -8.738 1.00 72.44 H new ATOM 0 HA3 GLY A 98 -19.608 -6.444 -8.848 1.00 72.44 H new ATOM 1527 N ALA A 99 -17.236 -8.650 -8.950 1.00 72.35 N ATOM 1528 CA ALA A 99 -16.076 -9.131 -9.697 1.00 34.35 C ATOM 1529 C ALA A 99 -15.373 -7.980 -10.411 1.00 21.21 C ATOM 1530 O ALA A 99 -14.861 -8.139 -11.518 1.00 23.32 O ATOM 1531 CB ALA A 99 -16.496 -10.202 -10.690 1.00 15.21 C ATOM 0 H ALA A 99 -17.243 -8.931 -7.969 1.00 72.35 H new ATOM 0 HA ALA A 99 -15.371 -9.569 -8.991 1.00 34.35 H new ATOM 0 HB1 ALA A 99 -15.622 -10.551 -11.240 1.00 15.21 H new ATOM 0 HB2 ALA A 99 -16.946 -11.038 -10.155 1.00 15.21 H new ATOM 0 HB3 ALA A 99 -17.222 -9.786 -11.389 1.00 15.21 H new ATOM 1537 N ARG A 100 -15.340 -6.825 -9.753 1.00 65.44 N ATOM 1538 CA ARG A 100 -14.776 -5.619 -10.349 1.00 54.44 C ATOM 1539 C ARG A 100 -13.254 -5.708 -10.424 1.00 73.11 C ATOM 1540 O ARG A 100 -12.613 -4.994 -11.194 1.00 71.21 O ATOM 1541 CB ARG A 100 -15.194 -4.382 -9.543 1.00 53.42 C ATOM 1542 CG ARG A 100 -14.932 -3.068 -10.262 1.00 65.51 C ATOM 1543 CD ARG A 100 -15.631 -3.036 -11.609 1.00 72.23 C ATOM 1544 NE ARG A 100 -15.477 -1.754 -12.288 1.00 1.41 N ATOM 1545 CZ ARG A 100 -15.525 -1.605 -13.608 1.00 22.32 C ATOM 1546 NH1 ARG A 100 -15.684 -2.665 -14.392 1.00 43.22 N ATOM 1547 NH2 ARG A 100 -15.415 -0.398 -14.145 1.00 52.15 N ATOM 0 H ARG A 100 -15.698 -6.699 -8.806 1.00 65.44 H new ATOM 0 HA ARG A 100 -15.164 -5.528 -11.364 1.00 54.44 H new ATOM 0 HB2 ARG A 100 -16.256 -4.453 -9.310 1.00 53.42 H new ATOM 0 HB3 ARG A 100 -14.659 -4.380 -8.594 1.00 53.42 H new ATOM 0 HG2 ARG A 100 -15.280 -2.238 -9.648 1.00 65.51 H new ATOM 0 HG3 ARG A 100 -13.859 -2.933 -10.402 1.00 65.51 H new ATOM 0 HD2 ARG A 100 -15.231 -3.829 -12.241 1.00 72.23 H new ATOM 0 HD3 ARG A 100 -16.692 -3.244 -11.469 1.00 72.23 H new ATOM 0 HE ARG A 100 -15.323 -0.923 -11.716 1.00 1.41 H new ATOM 0 HH11 ARG A 100 -15.769 -3.595 -13.981 1.00 43.22 H new ATOM 0 HH12 ARG A 100 -15.721 -2.549 -15.405 1.00 43.22 H new ATOM 0 HH21 ARG A 100 -15.293 0.418 -13.545 1.00 52.15 H new ATOM 0 HH22 ARG A 100 -15.452 -0.285 -15.158 1.00 52.15 H new ATOM 1561 N GLY A 101 -12.691 -6.603 -9.632 1.00 43.33 N ATOM 1562 CA GLY A 101 -11.256 -6.759 -9.580 1.00 11.01 C ATOM 1563 C GLY A 101 -10.804 -7.136 -8.192 1.00 61.42 C ATOM 1564 O GLY A 101 -11.495 -7.877 -7.490 1.00 23.52 O ATOM 0 H GLY A 101 -13.209 -7.231 -9.018 1.00 43.33 H new ATOM 0 HA2 GLY A 101 -10.944 -7.526 -10.289 1.00 11.01 H new ATOM 0 HA3 GLY A 101 -10.774 -5.830 -9.883 1.00 11.01 H new ATOM 1568 N THR A 102 -9.665 -6.618 -7.778 1.00 40.32 N ATOM 1569 CA THR A 102 -9.148 -6.894 -6.455 1.00 24.41 C ATOM 1570 C THR A 102 -8.912 -5.591 -5.703 1.00 24.23 C ATOM 1571 O THR A 102 -8.323 -4.646 -6.234 1.00 42.41 O ATOM 1572 CB THR A 102 -7.844 -7.708 -6.537 1.00 24.12 C ATOM 1573 OG1 THR A 102 -8.064 -8.868 -7.351 1.00 10.43 O ATOM 1574 CG2 THR A 102 -7.373 -8.139 -5.154 1.00 31.54 C ATOM 0 H THR A 102 -9.079 -6.002 -8.342 1.00 40.32 H new ATOM 0 HA THR A 102 -9.886 -7.486 -5.913 1.00 24.41 H new ATOM 0 HB THR A 102 -7.071 -7.078 -6.977 1.00 24.12 H new ATOM 0 HG1 THR A 102 -7.451 -8.852 -8.115 1.00 10.43 H new ATOM 0 HG21 THR A 102 -6.450 -8.712 -5.246 1.00 31.54 H new ATOM 0 HG22 THR A 102 -7.193 -7.257 -4.540 1.00 31.54 H new ATOM 0 HG23 THR A 102 -8.139 -8.757 -4.685 1.00 31.54 H new ATOM 1582 N GLU A 103 -9.402 -5.537 -4.476 1.00 22.41 N ATOM 1583 CA GLU A 103 -9.287 -4.347 -3.662 1.00 20.25 C ATOM 1584 C GLU A 103 -8.133 -4.495 -2.678 1.00 24.34 C ATOM 1585 O GLU A 103 -8.092 -5.433 -1.874 1.00 44.20 O ATOM 1586 CB GLU A 103 -10.605 -4.083 -2.933 1.00 40.41 C ATOM 1587 CG GLU A 103 -10.638 -2.760 -2.190 1.00 21.31 C ATOM 1588 CD GLU A 103 -12.032 -2.376 -1.743 1.00 31.42 C ATOM 1589 OE1 GLU A 103 -12.742 -1.707 -2.518 1.00 11.14 O ATOM 1590 OE2 GLU A 103 -12.423 -2.730 -0.612 1.00 32.24 O ATOM 0 H GLU A 103 -9.886 -6.312 -4.022 1.00 22.41 H new ATOM 0 HA GLU A 103 -9.076 -3.491 -4.303 1.00 20.25 H new ATOM 0 HB2 GLU A 103 -11.420 -4.104 -3.656 1.00 40.41 H new ATOM 0 HB3 GLU A 103 -10.786 -4.892 -2.225 1.00 40.41 H new ATOM 0 HG2 GLU A 103 -9.985 -2.821 -1.319 1.00 21.31 H new ATOM 0 HG3 GLU A 103 -10.238 -1.976 -2.834 1.00 21.31 H new ATOM 1597 N VAL A 104 -7.187 -3.576 -2.770 1.00 14.34 N ATOM 1598 CA VAL A 104 -6.007 -3.599 -1.923 1.00 53.12 C ATOM 1599 C VAL A 104 -6.170 -2.652 -0.733 1.00 1.44 C ATOM 1600 O VAL A 104 -6.240 -1.433 -0.898 1.00 2.20 O ATOM 1601 CB VAL A 104 -4.730 -3.246 -2.736 1.00 52.32 C ATOM 1602 CG1 VAL A 104 -4.936 -2.017 -3.598 1.00 51.54 C ATOM 1603 CG2 VAL A 104 -3.542 -3.039 -1.819 1.00 30.02 C ATOM 0 H VAL A 104 -7.214 -2.798 -3.429 1.00 14.34 H new ATOM 0 HA VAL A 104 -5.893 -4.612 -1.537 1.00 53.12 H new ATOM 0 HB VAL A 104 -4.527 -4.092 -3.393 1.00 52.32 H new ATOM 0 HG11 VAL A 104 -4.021 -1.803 -4.151 1.00 51.54 H new ATOM 0 HG12 VAL A 104 -5.750 -2.197 -4.300 1.00 51.54 H new ATOM 0 HG13 VAL A 104 -5.185 -1.166 -2.964 1.00 51.54 H new ATOM 0 HG21 VAL A 104 -2.662 -2.793 -2.413 1.00 30.02 H new ATOM 0 HG22 VAL A 104 -3.753 -2.222 -1.129 1.00 30.02 H new ATOM 0 HG23 VAL A 104 -3.355 -3.952 -1.254 1.00 30.02 H new ATOM 1613 N VAL A 105 -6.265 -3.226 0.463 1.00 4.43 N ATOM 1614 CA VAL A 105 -6.375 -2.440 1.680 1.00 11.02 C ATOM 1615 C VAL A 105 -5.021 -2.394 2.391 1.00 31.32 C ATOM 1616 O VAL A 105 -4.441 -3.427 2.733 1.00 14.51 O ATOM 1617 CB VAL A 105 -7.482 -2.979 2.632 1.00 41.25 C ATOM 1618 CG1 VAL A 105 -7.141 -4.348 3.201 1.00 44.42 C ATOM 1619 CG2 VAL A 105 -7.755 -1.983 3.748 1.00 73.41 C ATOM 0 H VAL A 105 -6.268 -4.235 0.612 1.00 4.43 H new ATOM 0 HA VAL A 105 -6.669 -1.429 1.398 1.00 11.02 H new ATOM 0 HB VAL A 105 -8.387 -3.101 2.037 1.00 41.25 H new ATOM 0 HG11 VAL A 105 -7.945 -4.679 3.859 1.00 44.42 H new ATOM 0 HG12 VAL A 105 -7.022 -5.062 2.386 1.00 44.42 H new ATOM 0 HG13 VAL A 105 -6.212 -4.286 3.767 1.00 44.42 H new ATOM 0 HG21 VAL A 105 -8.532 -2.376 4.404 1.00 73.41 H new ATOM 0 HG22 VAL A 105 -6.843 -1.821 4.322 1.00 73.41 H new ATOM 0 HG23 VAL A 105 -8.087 -1.038 3.319 1.00 73.41 H new ATOM 1629 N VAL A 106 -4.506 -1.193 2.575 1.00 70.41 N ATOM 1630 CA VAL A 106 -3.186 -1.011 3.155 1.00 62.33 C ATOM 1631 C VAL A 106 -3.234 -0.121 4.388 1.00 44.24 C ATOM 1632 O VAL A 106 -4.069 0.778 4.495 1.00 35.35 O ATOM 1633 CB VAL A 106 -2.191 -0.399 2.141 1.00 42.32 C ATOM 1634 CG1 VAL A 106 -1.931 -1.360 0.994 1.00 13.23 C ATOM 1635 CG2 VAL A 106 -2.703 0.932 1.613 1.00 30.13 C ATOM 0 H VAL A 106 -4.983 -0.325 2.331 1.00 70.41 H new ATOM 0 HA VAL A 106 -2.841 -2.005 3.439 1.00 62.33 H new ATOM 0 HB VAL A 106 -1.250 -0.221 2.661 1.00 42.32 H new ATOM 0 HG11 VAL A 106 -1.229 -0.909 0.293 1.00 13.23 H new ATOM 0 HG12 VAL A 106 -1.510 -2.287 1.384 1.00 13.23 H new ATOM 0 HG13 VAL A 106 -2.868 -1.575 0.480 1.00 13.23 H new ATOM 0 HG21 VAL A 106 -1.986 1.342 0.902 1.00 30.13 H new ATOM 0 HG22 VAL A 106 -3.661 0.782 1.116 1.00 30.13 H new ATOM 0 HG23 VAL A 106 -2.830 1.628 2.442 1.00 30.13 H new ATOM 1645 N ARG A 107 -2.352 -0.410 5.328 1.00 1.00 N ATOM 1646 CA ARG A 107 -2.137 0.457 6.478 1.00 21.41 C ATOM 1647 C ARG A 107 -0.887 1.302 6.264 1.00 71.03 C ATOM 1648 O ARG A 107 0.214 0.768 6.144 1.00 24.33 O ATOM 1649 CB ARG A 107 -1.997 -0.361 7.768 1.00 34.24 C ATOM 1650 CG ARG A 107 -3.261 -0.393 8.613 1.00 31.14 C ATOM 1651 CD ARG A 107 -4.384 -1.158 7.934 1.00 73.32 C ATOM 1652 NE ARG A 107 -4.187 -2.606 7.993 1.00 73.51 N ATOM 1653 CZ ARG A 107 -5.105 -3.497 7.618 1.00 62.32 C ATOM 1654 NH1 ARG A 107 -6.263 -3.092 7.111 1.00 42.41 N ATOM 1655 NH2 ARG A 107 -4.872 -4.797 7.743 1.00 61.45 N ATOM 0 H ARG A 107 -1.767 -1.246 5.319 1.00 1.00 H new ATOM 0 HA ARG A 107 -3.005 1.109 6.579 1.00 21.41 H new ATOM 0 HB2 ARG A 107 -1.717 -1.383 7.511 1.00 34.24 H new ATOM 0 HB3 ARG A 107 -1.183 0.053 8.363 1.00 34.24 H new ATOM 0 HG2 ARG A 107 -3.041 -0.853 9.576 1.00 31.14 H new ATOM 0 HG3 ARG A 107 -3.588 0.627 8.814 1.00 31.14 H new ATOM 0 HD2 ARG A 107 -5.332 -0.903 8.408 1.00 73.32 H new ATOM 0 HD3 ARG A 107 -4.455 -0.846 6.892 1.00 73.32 H new ATOM 0 HE ARG A 107 -3.294 -2.955 8.342 1.00 73.51 H new ATOM 0 HH11 ARG A 107 -6.453 -2.095 7.007 1.00 42.41 H new ATOM 0 HH12 ARG A 107 -6.962 -3.777 6.825 1.00 42.41 H new ATOM 0 HH21 ARG A 107 -3.985 -5.121 8.128 1.00 61.45 H new ATOM 0 HH22 ARG A 107 -5.580 -5.472 7.454 1.00 61.45 H new ATOM 1669 N LEU A 108 -1.060 2.612 6.201 1.00 63.42 N ATOM 1670 CA LEU A 108 0.055 3.522 6.006 1.00 54.51 C ATOM 1671 C LEU A 108 0.242 4.356 7.268 1.00 74.43 C ATOM 1672 O LEU A 108 -0.668 5.069 7.691 1.00 73.21 O ATOM 1673 CB LEU A 108 -0.208 4.417 4.786 1.00 30.32 C ATOM 1674 CG LEU A 108 1.019 5.098 4.159 1.00 65.53 C ATOM 1675 CD1 LEU A 108 0.655 5.677 2.801 1.00 70.13 C ATOM 1676 CD2 LEU A 108 1.566 6.196 5.057 1.00 11.35 C ATOM 0 H LEU A 108 -1.968 3.070 6.283 1.00 63.42 H new ATOM 0 HA LEU A 108 0.969 2.958 5.818 1.00 54.51 H new ATOM 0 HB2 LEU A 108 -0.693 3.814 4.018 1.00 30.32 H new ATOM 0 HB3 LEU A 108 -0.917 5.192 5.078 1.00 30.32 H new ATOM 0 HG LEU A 108 1.795 4.342 4.038 1.00 65.53 H new ATOM 0 HD11 LEU A 108 1.530 6.158 2.364 1.00 70.13 H new ATOM 0 HD12 LEU A 108 0.314 4.877 2.144 1.00 70.13 H new ATOM 0 HD13 LEU A 108 -0.141 6.412 2.920 1.00 70.13 H new ATOM 0 HD21 LEU A 108 2.433 6.656 4.583 1.00 11.35 H new ATOM 0 HD22 LEU A 108 0.797 6.951 5.218 1.00 11.35 H new ATOM 0 HD23 LEU A 108 1.861 5.769 6.015 1.00 11.35 H new ATOM 1688 N THR A 109 1.418 4.258 7.865 1.00 63.03 N ATOM 1689 CA THR A 109 1.691 4.941 9.117 1.00 63.13 C ATOM 1690 C THR A 109 2.672 6.089 8.913 1.00 30.33 C ATOM 1691 O THR A 109 3.698 5.936 8.247 1.00 21.43 O ATOM 1692 CB THR A 109 2.259 3.957 10.162 1.00 45.42 C ATOM 1693 OG1 THR A 109 1.409 2.805 10.257 1.00 63.30 O ATOM 1694 CG2 THR A 109 2.378 4.612 11.530 1.00 21.53 C ATOM 0 H THR A 109 2.199 3.712 7.502 1.00 63.03 H new ATOM 0 HA THR A 109 0.748 5.347 9.482 1.00 63.13 H new ATOM 0 HB THR A 109 3.255 3.658 9.836 1.00 45.42 H new ATOM 0 HG1 THR A 109 1.859 2.032 9.855 1.00 63.30 H new ATOM 0 HG21 THR A 109 2.781 3.893 12.244 1.00 21.53 H new ATOM 0 HG22 THR A 109 3.045 5.472 11.465 1.00 21.53 H new ATOM 0 HG23 THR A 109 1.394 4.941 11.863 1.00 21.53 H new ATOM 1702 N TYR A 110 2.348 7.244 9.478 1.00 75.44 N ATOM 1703 CA TYR A 110 3.224 8.390 9.433 1.00 73.35 C ATOM 1704 C TYR A 110 4.004 8.461 10.730 1.00 2.42 C ATOM 1705 O TYR A 110 3.611 7.867 11.736 1.00 43.14 O ATOM 1706 CB TYR A 110 2.428 9.681 9.226 1.00 64.21 C ATOM 1707 CG TYR A 110 1.613 9.700 7.951 1.00 12.33 C ATOM 1708 CD1 TYR A 110 2.208 9.959 6.723 1.00 4.34 C ATOM 1709 CD2 TYR A 110 0.247 9.452 7.977 1.00 3.23 C ATOM 1710 CE1 TYR A 110 1.463 9.974 5.559 1.00 71.00 C ATOM 1711 CE2 TYR A 110 -0.504 9.465 6.818 1.00 54.10 C ATOM 1712 CZ TYR A 110 0.108 9.724 5.613 1.00 32.11 C ATOM 1713 OH TYR A 110 -0.640 9.735 4.455 1.00 51.13 O ATOM 0 H TYR A 110 1.473 7.405 9.977 1.00 75.44 H new ATOM 0 HA TYR A 110 3.909 8.282 8.592 1.00 73.35 H new ATOM 0 HB2 TYR A 110 1.760 9.825 10.075 1.00 64.21 H new ATOM 0 HB3 TYR A 110 3.118 10.525 9.217 1.00 64.21 H new ATOM 0 HD1 TYR A 110 3.270 10.152 6.677 1.00 4.34 H new ATOM 0 HD2 TYR A 110 -0.237 9.245 8.920 1.00 3.23 H new ATOM 0 HE1 TYR A 110 1.940 10.180 4.612 1.00 71.00 H new ATOM 0 HE2 TYR A 110 -1.566 9.273 6.857 1.00 54.10 H new ATOM 0 HH TYR A 110 -1.576 9.539 4.668 1.00 51.13 H new ATOM 1782 N GLY A 115 14.971 14.912 12.818 1.00 33.10 N ATOM 1783 CA GLY A 115 16.102 15.154 11.948 1.00 41.34 C ATOM 1784 C GLY A 115 15.685 15.903 10.703 1.00 20.11 C ATOM 1785 O GLY A 115 14.562 16.393 10.627 1.00 62.20 O ATOM 0 HA2 GLY A 115 16.860 15.727 12.483 1.00 41.34 H new ATOM 0 HA3 GLY A 115 16.558 14.205 11.668 1.00 41.34 H new ATOM 1789 N SER A 116 16.567 15.984 9.722 1.00 14.24 N ATOM 1790 CA SER A 116 16.264 16.707 8.498 1.00 1.31 C ATOM 1791 C SER A 116 15.531 15.796 7.516 1.00 34.11 C ATOM 1792 O SER A 116 14.579 16.212 6.851 1.00 62.53 O ATOM 1793 CB SER A 116 17.548 17.249 7.868 1.00 61.51 C ATOM 1794 OG SER A 116 17.268 18.297 6.956 1.00 2.20 O ATOM 0 H SER A 116 17.495 15.561 9.748 1.00 14.24 H new ATOM 0 HA SER A 116 15.617 17.550 8.741 1.00 1.31 H new ATOM 0 HB2 SER A 116 18.215 17.612 8.650 1.00 61.51 H new ATOM 0 HB3 SER A 116 18.071 16.444 7.352 1.00 61.51 H new ATOM 0 HG SER A 116 18.106 18.626 6.569 1.00 2.20 H new ATOM 1800 N ALA A 117 15.970 14.545 7.441 1.00 52.24 N ATOM 1801 CA ALA A 117 15.341 13.566 6.564 1.00 74.51 C ATOM 1802 C ALA A 117 13.992 13.145 7.131 1.00 51.52 C ATOM 1803 O ALA A 117 13.065 12.810 6.395 1.00 44.12 O ATOM 1804 CB ALA A 117 16.247 12.357 6.383 1.00 65.23 C ATOM 0 H ALA A 117 16.759 14.185 7.977 1.00 52.24 H new ATOM 0 HA ALA A 117 15.180 14.022 5.587 1.00 74.51 H new ATOM 0 HB1 ALA A 117 15.763 11.635 5.725 1.00 65.23 H new ATOM 0 HB2 ALA A 117 17.192 12.673 5.942 1.00 65.23 H new ATOM 0 HB3 ALA A 117 16.436 11.895 7.352 1.00 65.23 H new ATOM 1810 N GLY A 118 13.899 13.172 8.452 1.00 40.24 N ATOM 1811 CA GLY A 118 12.665 12.828 9.127 1.00 32.41 C ATOM 1812 C GLY A 118 11.670 13.975 9.168 1.00 41.32 C ATOM 1813 O GLY A 118 10.482 13.758 9.375 1.00 64.31 O ATOM 0 H GLY A 118 14.665 13.429 9.074 1.00 40.24 H new ATOM 0 HA2 GLY A 118 12.208 11.976 8.624 1.00 32.41 H new ATOM 0 HA3 GLY A 118 12.890 12.513 10.146 1.00 32.41 H new ATOM 1817 N ALA A 119 12.150 15.198 8.984 1.00 75.51 N ATOM 1818 CA ALA A 119 11.284 16.373 9.075 1.00 41.40 C ATOM 1819 C ALA A 119 10.468 16.584 7.804 1.00 41.12 C ATOM 1820 O ALA A 119 9.418 17.223 7.835 1.00 70.22 O ATOM 1821 CB ALA A 119 12.101 17.618 9.379 1.00 42.51 C ATOM 0 H ALA A 119 13.126 15.405 8.772 1.00 75.51 H new ATOM 0 HA ALA A 119 10.586 16.192 9.892 1.00 41.40 H new ATOM 0 HB1 ALA A 119 11.439 18.481 9.443 1.00 42.51 H new ATOM 0 HB2 ALA A 119 12.621 17.489 10.328 1.00 42.51 H new ATOM 0 HB3 ALA A 119 12.830 17.778 8.584 1.00 42.51 H new ATOM 1827 N VAL A 120 10.942 16.034 6.693 1.00 22.31 N ATOM 1828 CA VAL A 120 10.301 16.264 5.402 1.00 25.20 C ATOM 1829 C VAL A 120 8.888 15.670 5.362 1.00 12.43 C ATOM 1830 O VAL A 120 8.017 16.171 4.647 1.00 24.43 O ATOM 1831 CB VAL A 120 11.144 15.690 4.239 1.00 11.10 C ATOM 1832 CG1 VAL A 120 11.150 14.170 4.257 1.00 53.53 C ATOM 1833 CG2 VAL A 120 10.645 16.214 2.897 1.00 55.42 C ATOM 0 H VAL A 120 11.763 15.429 6.658 1.00 22.31 H new ATOM 0 HA VAL A 120 10.227 17.344 5.276 1.00 25.20 H new ATOM 0 HB VAL A 120 12.171 16.027 4.377 1.00 11.10 H new ATOM 0 HG11 VAL A 120 11.751 13.799 3.427 1.00 53.53 H new ATOM 0 HG12 VAL A 120 11.574 13.819 5.198 1.00 53.53 H new ATOM 0 HG13 VAL A 120 10.129 13.801 4.159 1.00 53.53 H new ATOM 0 HG21 VAL A 120 11.253 15.797 2.095 1.00 55.42 H new ATOM 0 HG22 VAL A 120 9.605 15.919 2.755 1.00 55.42 H new ATOM 0 HG23 VAL A 120 10.719 17.301 2.881 1.00 55.42 H new ATOM 1843 N ILE A 121 8.653 14.630 6.158 1.00 73.32 N ATOM 1844 CA ILE A 121 7.360 13.954 6.163 1.00 70.34 C ATOM 1845 C ILE A 121 6.263 14.887 6.681 1.00 11.43 C ATOM 1846 O ILE A 121 5.112 14.798 6.256 1.00 63.45 O ATOM 1847 CB ILE A 121 7.395 12.654 7.008 1.00 44.41 C ATOM 1848 CG1 ILE A 121 6.094 11.859 6.847 1.00 74.33 C ATOM 1849 CG2 ILE A 121 7.642 12.965 8.476 1.00 25.41 C ATOM 1850 CD1 ILE A 121 5.851 11.370 5.434 1.00 54.10 C ATOM 0 H ILE A 121 9.338 14.239 6.805 1.00 73.32 H new ATOM 0 HA ILE A 121 7.135 13.679 5.132 1.00 70.34 H new ATOM 0 HB ILE A 121 8.220 12.044 6.641 1.00 44.41 H new ATOM 0 HG12 ILE A 121 6.117 11.002 7.520 1.00 74.33 H new ATOM 0 HG13 ILE A 121 5.256 12.484 7.155 1.00 74.33 H new ATOM 0 HG21 ILE A 121 7.662 12.036 9.046 1.00 25.41 H new ATOM 0 HG22 ILE A 121 8.598 13.477 8.584 1.00 25.41 H new ATOM 0 HG23 ILE A 121 6.843 13.605 8.852 1.00 25.41 H new ATOM 0 HD11 ILE A 121 4.913 10.816 5.397 1.00 54.10 H new ATOM 0 HD12 ILE A 121 5.796 12.223 4.758 1.00 54.10 H new ATOM 0 HD13 ILE A 121 6.669 10.718 5.129 1.00 54.10 H new ATOM 1862 N ALA A 122 6.642 15.808 7.561 1.00 15.11 N ATOM 1863 CA ALA A 122 5.694 16.745 8.149 1.00 62.15 C ATOM 1864 C ALA A 122 5.285 17.810 7.140 1.00 31.42 C ATOM 1865 O ALA A 122 4.227 18.427 7.264 1.00 1.44 O ATOM 1866 CB ALA A 122 6.292 17.388 9.393 1.00 65.05 C ATOM 0 H ALA A 122 7.603 15.925 7.883 1.00 15.11 H new ATOM 0 HA ALA A 122 4.799 16.193 8.437 1.00 62.15 H new ATOM 0 HB1 ALA A 122 5.574 18.086 9.823 1.00 65.05 H new ATOM 0 HB2 ALA A 122 6.529 16.615 10.124 1.00 65.05 H new ATOM 0 HB3 ALA A 122 7.202 17.924 9.124 1.00 65.05 H new ATOM 1872 N ARG A 123 6.136 18.026 6.144 1.00 21.43 N ATOM 1873 CA ARG A 123 5.830 18.970 5.077 1.00 15.15 C ATOM 1874 C ARG A 123 5.093 18.251 3.954 1.00 24.13 C ATOM 1875 O ARG A 123 4.304 18.848 3.222 1.00 73.53 O ATOM 1876 CB ARG A 123 7.115 19.613 4.547 1.00 54.34 C ATOM 1877 CG ARG A 123 6.881 20.841 3.675 1.00 41.11 C ATOM 1878 CD ARG A 123 7.308 20.615 2.232 1.00 34.20 C ATOM 1879 NE ARG A 123 6.417 19.700 1.516 1.00 40.10 N ATOM 1880 CZ ARG A 123 6.713 19.136 0.345 1.00 71.53 C ATOM 1881 NH1 ARG A 123 7.877 19.389 -0.245 1.00 31.31 N ATOM 1882 NH2 ARG A 123 5.838 18.333 -0.249 1.00 42.42 N ATOM 0 H ARG A 123 7.040 17.562 6.053 1.00 21.43 H new ATOM 0 HA ARG A 123 5.192 19.760 5.473 1.00 15.15 H new ATOM 0 HB2 ARG A 123 7.743 19.895 5.392 1.00 54.34 H new ATOM 0 HB3 ARG A 123 7.669 18.872 3.971 1.00 54.34 H new ATOM 0 HG2 ARG A 123 5.824 21.106 3.701 1.00 41.11 H new ATOM 0 HG3 ARG A 123 7.432 21.686 4.087 1.00 41.11 H new ATOM 0 HD2 ARG A 123 7.334 21.572 1.711 1.00 34.20 H new ATOM 0 HD3 ARG A 123 8.322 20.215 2.216 1.00 34.20 H new ATOM 0 HE ARG A 123 5.515 19.481 1.939 1.00 40.10 H new ATOM 0 HH11 ARG A 123 8.548 20.017 0.198 1.00 31.31 H new ATOM 0 HH12 ARG A 123 8.100 18.955 -1.141 1.00 31.31 H new ATOM 0 HH21 ARG A 123 4.937 18.146 0.191 1.00 42.42 H new ATOM 0 HH22 ARG A 123 6.067 17.903 -1.145 1.00 42.42 H new ATOM 1896 N MET A 124 5.376 16.965 3.809 1.00 15.34 N ATOM 1897 CA MET A 124 4.706 16.139 2.817 1.00 34.23 C ATOM 1898 C MET A 124 3.263 15.896 3.242 1.00 60.01 C ATOM 1899 O MET A 124 2.325 16.175 2.492 1.00 23.24 O ATOM 1900 CB MET A 124 5.449 14.809 2.648 1.00 22.50 C ATOM 1901 CG MET A 124 4.913 13.931 1.528 1.00 23.42 C ATOM 1902 SD MET A 124 5.871 12.415 1.329 1.00 60.15 S ATOM 1903 CE MET A 124 4.987 11.624 -0.013 1.00 3.13 C ATOM 0 H MET A 124 6.069 16.469 4.369 1.00 15.34 H new ATOM 0 HA MET A 124 4.708 16.657 1.858 1.00 34.23 H new ATOM 0 HB2 MET A 124 6.502 15.016 2.459 1.00 22.50 H new ATOM 0 HB3 MET A 124 5.396 14.255 3.585 1.00 22.50 H new ATOM 0 HG2 MET A 124 3.873 13.677 1.734 1.00 23.42 H new ATOM 0 HG3 MET A 124 4.925 14.491 0.593 1.00 23.42 H new ATOM 0 HE1 MET A 124 5.462 10.672 -0.251 1.00 3.13 H new ATOM 0 HE2 MET A 124 3.953 11.449 0.285 1.00 3.13 H new ATOM 0 HE3 MET A 124 5.007 12.269 -0.892 1.00 3.13 H new ATOM 2057 N ARG A 134 -9.495 8.043 0.234 1.00 32.10 N ATOM 2058 CA ARG A 134 -9.929 7.132 -0.822 1.00 53.32 C ATOM 2059 C ARG A 134 -9.973 7.799 -2.195 1.00 64.25 C ATOM 2060 O ARG A 134 -9.611 7.180 -3.193 1.00 5.23 O ATOM 2061 CB ARG A 134 -11.294 6.517 -0.498 1.00 10.04 C ATOM 2062 CG ARG A 134 -12.391 7.528 -0.208 1.00 54.20 C ATOM 2063 CD ARG A 134 -13.761 6.866 -0.227 1.00 73.15 C ATOM 2064 NE ARG A 134 -14.116 6.408 -1.569 1.00 0.24 N ATOM 2065 CZ ARG A 134 -15.173 5.652 -1.860 1.00 23.21 C ATOM 2066 NH1 ARG A 134 -15.966 5.189 -0.900 1.00 24.31 N ATOM 2067 NH2 ARG A 134 -15.426 5.355 -3.128 1.00 70.12 N ATOM 0 HA ARG A 134 -9.181 6.340 -0.865 1.00 53.32 H new ATOM 0 HB2 ARG A 134 -11.605 5.894 -1.336 1.00 10.04 H new ATOM 0 HB3 ARG A 134 -11.186 5.860 0.365 1.00 10.04 H new ATOM 0 HG2 ARG A 134 -12.219 7.988 0.765 1.00 54.20 H new ATOM 0 HG3 ARG A 134 -12.359 8.327 -0.948 1.00 54.20 H new ATOM 0 HD2 ARG A 134 -13.767 6.020 0.461 1.00 73.15 H new ATOM 0 HD3 ARG A 134 -14.512 7.571 0.128 1.00 73.15 H new ATOM 0 HE ARG A 134 -13.509 6.688 -2.340 1.00 0.24 H new ATOM 0 HH11 ARG A 134 -15.769 5.411 0.076 1.00 24.31 H new ATOM 0 HH12 ARG A 134 -16.772 4.611 -1.139 1.00 24.31 H new ATOM 0 HH21 ARG A 134 -14.814 5.705 -3.866 1.00 70.12 H new ATOM 0 HH22 ARG A 134 -16.232 4.777 -3.365 1.00 70.12 H new ATOM 2081 N ASP A 135 -10.406 9.054 -2.259 1.00 72.44 N ATOM 2082 CA ASP A 135 -10.518 9.734 -3.546 1.00 4.04 C ATOM 2083 C ASP A 135 -9.138 10.070 -4.111 1.00 31.15 C ATOM 2084 O ASP A 135 -8.918 9.976 -5.316 1.00 34.21 O ATOM 2085 CB ASP A 135 -11.394 10.992 -3.455 1.00 40.13 C ATOM 2086 CG ASP A 135 -10.774 12.099 -2.631 1.00 14.32 C ATOM 2087 OD1 ASP A 135 -10.936 12.080 -1.392 1.00 11.11 O ATOM 2088 OD2 ASP A 135 -10.138 12.995 -3.220 1.00 4.21 O ATOM 0 H ASP A 135 -10.681 9.613 -1.451 1.00 72.44 H new ATOM 0 HA ASP A 135 -11.010 9.045 -4.233 1.00 4.04 H new ATOM 0 HB2 ASP A 135 -11.588 11.364 -4.461 1.00 40.13 H new ATOM 0 HB3 ASP A 135 -12.358 10.724 -3.022 1.00 40.13 H new ATOM 2093 N ASP A 136 -8.205 10.453 -3.245 1.00 10.20 N ATOM 2094 CA ASP A 136 -6.843 10.734 -3.690 1.00 2.20 C ATOM 2095 C ASP A 136 -6.108 9.432 -3.987 1.00 42.43 C ATOM 2096 O ASP A 136 -5.346 9.334 -4.949 1.00 63.14 O ATOM 2097 CB ASP A 136 -6.077 11.542 -2.644 1.00 22.10 C ATOM 2098 CG ASP A 136 -4.769 12.079 -3.192 1.00 74.53 C ATOM 2099 OD1 ASP A 136 -4.785 13.164 -3.812 1.00 41.53 O ATOM 2100 OD2 ASP A 136 -3.723 11.422 -3.016 1.00 24.41 O ATOM 0 H ASP A 136 -8.362 10.575 -2.245 1.00 10.20 H new ATOM 0 HA ASP A 136 -6.901 11.328 -4.602 1.00 2.20 H new ATOM 0 HB2 ASP A 136 -6.695 12.372 -2.302 1.00 22.10 H new ATOM 0 HB3 ASP A 136 -5.877 10.914 -1.776 1.00 22.10 H new ATOM 2105 N LEU A 137 -6.364 8.427 -3.157 1.00 45.33 N ATOM 2106 CA LEU A 137 -5.765 7.108 -3.320 1.00 12.15 C ATOM 2107 C LEU A 137 -6.292 6.463 -4.599 1.00 13.14 C ATOM 2108 O LEU A 137 -5.642 5.604 -5.194 1.00 54.33 O ATOM 2109 CB LEU A 137 -6.085 6.228 -2.098 1.00 73.40 C ATOM 2110 CG LEU A 137 -5.299 4.914 -1.998 1.00 41.11 C ATOM 2111 CD1 LEU A 137 -3.807 5.191 -1.943 1.00 31.45 C ATOM 2112 CD2 LEU A 137 -5.728 4.124 -0.766 1.00 13.11 C ATOM 0 H LEU A 137 -6.990 8.503 -2.355 1.00 45.33 H new ATOM 0 HA LEU A 137 -4.682 7.208 -3.396 1.00 12.15 H new ATOM 0 HB2 LEU A 137 -5.899 6.810 -1.196 1.00 73.40 H new ATOM 0 HB3 LEU A 137 -7.149 5.993 -2.112 1.00 73.40 H new ATOM 0 HG LEU A 137 -5.515 4.320 -2.886 1.00 41.11 H new ATOM 0 HD11 LEU A 137 -3.264 4.248 -1.872 1.00 31.45 H new ATOM 0 HD12 LEU A 137 -3.501 5.719 -2.846 1.00 31.45 H new ATOM 0 HD13 LEU A 137 -3.583 5.805 -1.071 1.00 31.45 H new ATOM 0 HD21 LEU A 137 -5.159 3.196 -0.713 1.00 13.11 H new ATOM 0 HD22 LEU A 137 -5.540 4.716 0.130 1.00 13.11 H new ATOM 0 HD23 LEU A 137 -6.791 3.895 -0.833 1.00 13.11 H new ATOM 2124 N MET A 138 -7.474 6.902 -5.023 1.00 12.12 N ATOM 2125 CA MET A 138 -8.079 6.436 -6.267 1.00 62.43 C ATOM 2126 C MET A 138 -7.202 6.818 -7.459 1.00 10.43 C ATOM 2127 O MET A 138 -7.176 6.123 -8.477 1.00 22.22 O ATOM 2128 CB MET A 138 -9.475 7.043 -6.433 1.00 12.31 C ATOM 2129 CG MET A 138 -10.292 6.436 -7.564 1.00 4.54 C ATOM 2130 SD MET A 138 -11.379 5.100 -7.018 1.00 13.24 S ATOM 2131 CE MET A 138 -10.205 3.898 -6.401 1.00 35.40 C ATOM 0 H MET A 138 -8.036 7.587 -4.517 1.00 12.12 H new ATOM 0 HA MET A 138 -8.165 5.350 -6.226 1.00 62.43 H new ATOM 0 HB2 MET A 138 -10.024 6.923 -5.499 1.00 12.31 H new ATOM 0 HB3 MET A 138 -9.374 8.114 -6.608 1.00 12.31 H new ATOM 0 HG2 MET A 138 -10.893 7.217 -8.030 1.00 4.54 H new ATOM 0 HG3 MET A 138 -9.615 6.056 -8.329 1.00 4.54 H new ATOM 0 HE1 MET A 138 -10.690 2.926 -6.317 1.00 35.40 H new ATOM 0 HE2 MET A 138 -9.363 3.825 -7.090 1.00 35.40 H new ATOM 0 HE3 MET A 138 -9.846 4.211 -5.421 1.00 35.40 H new ATOM 2141 N ARG A 139 -6.482 7.925 -7.318 1.00 53.12 N ATOM 2142 CA ARG A 139 -5.544 8.368 -8.342 1.00 34.20 C ATOM 2143 C ARG A 139 -4.358 7.416 -8.414 1.00 54.11 C ATOM 2144 O ARG A 139 -3.925 7.027 -9.497 1.00 11.03 O ATOM 2145 CB ARG A 139 -5.070 9.794 -8.050 1.00 33.33 C ATOM 2146 CG ARG A 139 -6.181 10.823 -8.141 1.00 52.34 C ATOM 2147 CD ARG A 139 -5.720 12.192 -7.678 1.00 43.43 C ATOM 2148 NE ARG A 139 -6.730 13.212 -7.947 1.00 75.44 N ATOM 2149 CZ ARG A 139 -7.068 14.179 -7.098 1.00 23.45 C ATOM 2150 NH1 ARG A 139 -6.486 14.269 -5.907 1.00 53.31 N ATOM 2151 NH2 ARG A 139 -8.007 15.053 -7.439 1.00 4.32 N ATOM 0 H ARG A 139 -6.531 8.534 -6.501 1.00 53.12 H new ATOM 0 HA ARG A 139 -6.052 8.365 -9.307 1.00 34.20 H new ATOM 0 HB2 ARG A 139 -4.633 9.828 -7.052 1.00 33.33 H new ATOM 0 HB3 ARG A 139 -4.280 10.059 -8.753 1.00 33.33 H new ATOM 0 HG2 ARG A 139 -6.534 10.887 -9.170 1.00 52.34 H new ATOM 0 HG3 ARG A 139 -7.027 10.500 -7.534 1.00 52.34 H new ATOM 0 HD2 ARG A 139 -5.505 12.163 -6.610 1.00 43.43 H new ATOM 0 HD3 ARG A 139 -4.791 12.455 -8.183 1.00 43.43 H new ATOM 0 HE ARG A 139 -7.209 13.181 -8.847 1.00 75.44 H new ATOM 0 HH11 ARG A 139 -5.772 13.593 -5.636 1.00 53.31 H new ATOM 0 HH12 ARG A 139 -6.753 15.014 -5.264 1.00 53.31 H new ATOM 0 HH21 ARG A 139 -8.465 14.981 -8.348 1.00 4.32 H new ATOM 0 HH22 ARG A 139 -8.271 15.797 -6.792 1.00 4.32 H new ATOM 2165 N PHE A 140 -3.857 7.026 -7.249 1.00 53.20 N ATOM 2166 CA PHE A 140 -2.796 6.029 -7.160 1.00 65.35 C ATOM 2167 C PHE A 140 -3.271 4.710 -7.762 1.00 51.32 C ATOM 2168 O PHE A 140 -2.517 4.015 -8.435 1.00 61.51 O ATOM 2169 CB PHE A 140 -2.373 5.844 -5.696 1.00 2.15 C ATOM 2170 CG PHE A 140 -1.495 4.646 -5.448 1.00 63.40 C ATOM 2171 CD1 PHE A 140 -0.315 4.466 -6.152 1.00 4.41 C ATOM 2172 CD2 PHE A 140 -1.855 3.699 -4.502 1.00 4.14 C ATOM 2173 CE1 PHE A 140 0.486 3.364 -5.919 1.00 14.03 C ATOM 2174 CE2 PHE A 140 -1.057 2.596 -4.265 1.00 61.14 C ATOM 2175 CZ PHE A 140 0.114 2.429 -4.974 1.00 25.43 C ATOM 0 H PHE A 140 -4.170 7.387 -6.348 1.00 53.20 H new ATOM 0 HA PHE A 140 -1.929 6.371 -7.726 1.00 65.35 H new ATOM 0 HB2 PHE A 140 -1.846 6.740 -5.367 1.00 2.15 H new ATOM 0 HB3 PHE A 140 -3.268 5.757 -5.080 1.00 2.15 H new ATOM 0 HD1 PHE A 140 -0.018 5.195 -6.891 1.00 4.41 H new ATOM 0 HD2 PHE A 140 -2.771 3.825 -3.943 1.00 4.14 H new ATOM 0 HE1 PHE A 140 1.402 3.234 -6.476 1.00 14.03 H new ATOM 0 HE2 PHE A 140 -1.350 1.866 -3.525 1.00 61.14 H new ATOM 0 HZ PHE A 140 0.739 1.568 -4.790 1.00 25.43 H new ATOM 2185 N LYS A 141 -4.540 4.391 -7.527 1.00 73.31 N ATOM 2186 CA LYS A 141 -5.170 3.206 -8.102 1.00 55.13 C ATOM 2187 C LYS A 141 -4.999 3.192 -9.622 1.00 62.14 C ATOM 2188 O LYS A 141 -4.704 2.153 -10.217 1.00 72.14 O ATOM 2189 CB LYS A 141 -6.657 3.186 -7.713 1.00 0.44 C ATOM 2190 CG LYS A 141 -7.429 1.938 -8.134 1.00 20.02 C ATOM 2191 CD LYS A 141 -7.849 1.972 -9.598 1.00 52.34 C ATOM 2192 CE LYS A 141 -8.705 3.187 -9.907 1.00 72.21 C ATOM 2193 NZ LYS A 141 -9.186 3.181 -11.311 1.00 34.15 N ATOM 0 H LYS A 141 -5.159 4.944 -6.935 1.00 73.31 H new ATOM 0 HA LYS A 141 -4.689 2.310 -7.709 1.00 55.13 H new ATOM 0 HB2 LYS A 141 -6.733 3.291 -6.631 1.00 0.44 H new ATOM 0 HB3 LYS A 141 -7.142 4.058 -8.153 1.00 0.44 H new ATOM 0 HG2 LYS A 141 -6.811 1.057 -7.958 1.00 20.02 H new ATOM 0 HG3 LYS A 141 -8.316 1.836 -7.508 1.00 20.02 H new ATOM 0 HD2 LYS A 141 -6.962 1.981 -10.231 1.00 52.34 H new ATOM 0 HD3 LYS A 141 -8.403 1.065 -9.839 1.00 52.34 H new ATOM 0 HE2 LYS A 141 -9.559 3.211 -9.230 1.00 72.21 H new ATOM 0 HE3 LYS A 141 -8.128 4.094 -9.724 1.00 72.21 H new ATOM 0 HZ1 LYS A 141 -9.590 4.111 -11.544 1.00 34.15 H new ATOM 0 HZ2 LYS A 141 -8.390 2.980 -11.950 1.00 34.15 H new ATOM 0 HZ3 LYS A 141 -9.915 2.448 -11.425 1.00 34.15 H new ATOM 2207 N ARG A 142 -5.172 4.358 -10.236 1.00 20.25 N ATOM 2208 CA ARG A 142 -5.035 4.498 -11.684 1.00 13.50 C ATOM 2209 C ARG A 142 -3.606 4.188 -12.116 1.00 14.22 C ATOM 2210 O ARG A 142 -3.366 3.685 -13.213 1.00 21.15 O ATOM 2211 CB ARG A 142 -5.404 5.916 -12.126 1.00 54.43 C ATOM 2212 CG ARG A 142 -6.815 6.333 -11.751 1.00 64.43 C ATOM 2213 CD ARG A 142 -7.107 7.757 -12.197 1.00 12.40 C ATOM 2214 NE ARG A 142 -8.448 8.196 -11.811 1.00 11.34 N ATOM 2215 CZ ARG A 142 -9.073 9.242 -12.353 1.00 34.33 C ATOM 2216 NH1 ARG A 142 -8.481 9.948 -13.309 1.00 62.21 N ATOM 2217 NH2 ARG A 142 -10.290 9.577 -11.938 1.00 4.51 N ATOM 0 H ARG A 142 -5.408 5.224 -9.752 1.00 20.25 H new ATOM 0 HA ARG A 142 -5.715 3.790 -12.157 1.00 13.50 H new ATOM 0 HB2 ARG A 142 -4.699 6.619 -11.682 1.00 54.43 H new ATOM 0 HB3 ARG A 142 -5.290 5.990 -13.208 1.00 54.43 H new ATOM 0 HG2 ARG A 142 -7.532 5.652 -12.210 1.00 64.43 H new ATOM 0 HG3 ARG A 142 -6.945 6.254 -10.672 1.00 64.43 H new ATOM 0 HD2 ARG A 142 -6.368 8.430 -11.763 1.00 12.40 H new ATOM 0 HD3 ARG A 142 -7.003 7.825 -13.280 1.00 12.40 H new ATOM 0 HE ARG A 142 -8.934 7.671 -11.084 1.00 11.34 H new ATOM 0 HH11 ARG A 142 -7.548 9.690 -13.629 1.00 62.21 H new ATOM 0 HH12 ARG A 142 -8.960 10.748 -13.723 1.00 62.21 H new ATOM 0 HH21 ARG A 142 -10.746 9.034 -11.205 1.00 4.51 H new ATOM 0 HH22 ARG A 142 -10.768 10.377 -12.353 1.00 4.51 H new ATOM 2231 N GLU A 143 -2.663 4.488 -11.236 1.00 1.42 N ATOM 2232 CA GLU A 143 -1.254 4.252 -11.505 1.00 31.41 C ATOM 2233 C GLU A 143 -0.896 2.781 -11.293 1.00 13.14 C ATOM 2234 O GLU A 143 0.021 2.261 -11.931 1.00 14.32 O ATOM 2235 CB GLU A 143 -0.396 5.158 -10.615 1.00 14.34 C ATOM 2236 CG GLU A 143 -0.596 6.638 -10.906 1.00 70.13 C ATOM 2237 CD GLU A 143 0.064 7.545 -9.885 1.00 52.10 C ATOM 2238 OE1 GLU A 143 1.311 7.628 -9.866 1.00 3.15 O ATOM 2239 OE2 GLU A 143 -0.665 8.205 -9.115 1.00 1.44 O ATOM 0 H GLU A 143 -2.851 4.899 -10.322 1.00 1.42 H new ATOM 0 HA GLU A 143 -1.052 4.493 -12.549 1.00 31.41 H new ATOM 0 HB2 GLU A 143 -0.635 4.963 -9.570 1.00 14.34 H new ATOM 0 HB3 GLU A 143 0.655 4.905 -10.754 1.00 14.34 H new ATOM 0 HG2 GLU A 143 -0.196 6.864 -11.895 1.00 70.13 H new ATOM 0 HG3 GLU A 143 -1.664 6.854 -10.937 1.00 70.13 H new ATOM 2246 N GLN A 144 -1.634 2.106 -10.412 1.00 24.22 N ATOM 2247 CA GLN A 144 -1.392 0.689 -10.136 1.00 54.54 C ATOM 2248 C GLN A 144 -1.784 -0.164 -11.329 1.00 23.42 C ATOM 2249 O GLN A 144 -1.104 -1.130 -11.669 1.00 72.21 O ATOM 2250 CB GLN A 144 -2.188 0.204 -8.923 1.00 64.44 C ATOM 2251 CG GLN A 144 -2.096 1.105 -7.710 1.00 64.03 C ATOM 2252 CD GLN A 144 -2.710 0.475 -6.479 1.00 4.02 C ATOM 2253 OE1 GLN A 144 -3.302 1.157 -5.650 1.00 55.54 O ATOM 2254 NE2 GLN A 144 -2.550 -0.830 -6.336 1.00 41.40 N ATOM 0 H GLN A 144 -2.401 2.515 -9.879 1.00 24.22 H new ATOM 0 HA GLN A 144 -0.326 0.588 -9.931 1.00 54.54 H new ATOM 0 HB2 GLN A 144 -3.236 0.105 -9.208 1.00 64.44 H new ATOM 0 HB3 GLN A 144 -1.837 -0.791 -8.648 1.00 64.44 H new ATOM 0 HG2 GLN A 144 -1.050 1.339 -7.512 1.00 64.03 H new ATOM 0 HG3 GLN A 144 -2.599 2.048 -7.922 1.00 64.03 H new ATOM 0 HE21 GLN A 144 -2.051 -1.364 -7.048 1.00 41.40 H new ATOM 0 HE22 GLN A 144 -2.925 -1.303 -5.514 1.00 41.40 H new ATOM 2263 N GLU A 145 -2.899 0.187 -11.950 1.00 5.14 N ATOM 2264 CA GLU A 145 -3.391 -0.558 -13.096 1.00 22.33 C ATOM 2265 C GLU A 145 -2.603 -0.188 -14.349 1.00 23.12 C ATOM 2266 O GLU A 145 -2.665 -0.881 -15.365 1.00 21.11 O ATOM 2267 CB GLU A 145 -4.889 -0.308 -13.299 1.00 61.43 C ATOM 2268 CG GLU A 145 -5.252 1.137 -13.610 1.00 53.13 C ATOM 2269 CD GLU A 145 -6.747 1.341 -13.741 1.00 63.31 C ATOM 2270 OE1 GLU A 145 -7.356 0.731 -14.642 1.00 42.44 O ATOM 2271 OE2 GLU A 145 -7.327 2.115 -12.946 1.00 25.43 O ATOM 0 H GLU A 145 -3.479 0.982 -11.680 1.00 5.14 H new ATOM 0 HA GLU A 145 -3.249 -1.622 -12.905 1.00 22.33 H new ATOM 0 HB2 GLU A 145 -5.243 -0.941 -14.112 1.00 61.43 H new ATOM 0 HB3 GLU A 145 -5.421 -0.617 -12.399 1.00 61.43 H new ATOM 0 HG2 GLU A 145 -4.868 1.783 -12.821 1.00 53.13 H new ATOM 0 HG3 GLU A 145 -4.764 1.440 -14.536 1.00 53.13 H new ATOM 2278 N LEU A 146 -1.846 0.898 -14.256 1.00 52.35 N ATOM 2279 CA LEU A 146 -1.032 1.358 -15.366 1.00 3.42 C ATOM 2280 C LEU A 146 0.366 0.753 -15.302 1.00 34.43 C ATOM 2281 O LEU A 146 0.767 0.010 -16.196 1.00 22.01 O ATOM 2282 CB LEU A 146 -0.934 2.887 -15.367 1.00 63.04 C ATOM 2283 CG LEU A 146 -0.093 3.482 -16.498 1.00 75.52 C ATOM 2284 CD1 LEU A 146 -0.738 3.206 -17.847 1.00 51.53 C ATOM 2285 CD2 LEU A 146 0.103 4.975 -16.286 1.00 71.42 C ATOM 0 H LEU A 146 -1.781 1.476 -13.418 1.00 52.35 H new ATOM 0 HA LEU A 146 -1.513 1.033 -16.289 1.00 3.42 H new ATOM 0 HB2 LEU A 146 -1.941 3.300 -15.428 1.00 63.04 H new ATOM 0 HB3 LEU A 146 -0.514 3.209 -14.414 1.00 63.04 H new ATOM 0 HG LEU A 146 0.887 3.005 -16.488 1.00 75.52 H new ATOM 0 HD11 LEU A 146 -0.125 3.637 -18.638 1.00 51.53 H new ATOM 0 HD12 LEU A 146 -0.820 2.130 -17.997 1.00 51.53 H new ATOM 0 HD13 LEU A 146 -1.732 3.653 -17.873 1.00 51.53 H new ATOM 0 HD21 LEU A 146 0.703 5.382 -17.099 1.00 71.42 H new ATOM 0 HD22 LEU A 146 -0.868 5.470 -16.268 1.00 71.42 H new ATOM 0 HD23 LEU A 146 0.614 5.144 -15.338 1.00 71.42 H new ATOM 2297 N GLY A 147 1.090 1.054 -14.228 1.00 2.14 N ATOM 2298 CA GLY A 147 2.483 0.659 -14.136 1.00 71.23 C ATOM 2299 C GLY A 147 3.352 1.525 -15.025 1.00 22.41 C ATOM 2300 O GLY A 147 3.265 1.444 -16.251 1.00 42.12 O ATOM 0 H GLY A 147 0.736 1.565 -13.419 1.00 2.14 H new ATOM 0 HA2 GLY A 147 2.820 0.739 -13.103 1.00 71.23 H new ATOM 0 HA3 GLY A 147 2.588 -0.387 -14.426 1.00 71.23 H new