USER MOD reduce.3.24.130724 H: found=0, std=0, add=568, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 571 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 119 GLN : amide:sc= -1.1 K(o=-1.1,f=-0.0059) USER MOD Single : A 122 LYS NZ :NH3+ 162:sc= -0.074 (180deg=-0.392) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 23:sc= 0.784 USER MOD Single : A 132 GLN : amide:sc= -0.0622 K(o=-0.062,f=-1.6!) USER MOD Single : A 134 LYS NZ :NH3+ -168:sc= -0.0196 (180deg=-0.193) USER MOD Single : A 136 GLN : amide:sc= -0.108 K(o=-0.11,f=-0.75) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 151 MET CE :methyl -158:sc= -0.856 (180deg=-2.47!) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 SER OG : rot -27:sc= 0.883 USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD Single : A 161 THR OG1 : rot 180:sc= 0 USER MOD Single : A 166 SER OG : rot 79:sc= 1.06 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 170 GLN : amide:sc= -1.18 K(o=-1.2,f=-0.0017) USER MOD Single : A 173 LYS NZ :NH3+ 171:sc=-0.00669 (180deg=-0.138) USER MOD Single : A 175 HIS : no HD1:sc= -0.0355 X(o=-0.036,f=-0.036) USER MOD Single : A 180 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 183 ASN : amide:sc= -0.963 K(o=-0.96,f=0) USER MOD Single : A 184 THR OG1 : rot -78:sc= 0.164 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 119 -19.065 15.830 -6.377 1.00 0.00 N ATOM 2 CA GLN A 119 -18.945 15.374 -4.968 1.00 0.00 C ATOM 3 C GLN A 119 -17.504 15.480 -4.485 1.00 0.00 C ATOM 4 O GLN A 119 -16.608 15.840 -5.248 1.00 0.00 O ATOM 5 CB GLN A 119 -19.427 13.929 -4.838 1.00 0.00 C ATOM 6 CG GLN A 119 -20.885 13.735 -5.221 1.00 0.00 C ATOM 7 CD GLN A 119 -21.341 12.295 -5.088 1.00 0.00 C ATOM 8 OE1 GLN A 119 -22.506 12.026 -4.797 1.00 0.00 O ATOM 9 NE2 GLN A 119 -20.422 11.358 -5.303 1.00 0.00 N ATOM 0 HA GLN A 119 -19.568 16.019 -4.349 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -18.807 13.290 -5.467 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -19.284 13.599 -3.809 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -21.509 14.369 -4.591 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -21.033 14.065 -6.249 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -19.467 11.625 -5.542 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -20.672 10.372 -5.229 1.00 0.00 H new ATOM 20 N ARG A 120 -17.290 15.164 -3.214 1.00 0.00 N ATOM 21 CA ARG A 120 -15.958 15.222 -2.625 1.00 0.00 C ATOM 22 C ARG A 120 -15.697 13.999 -1.752 1.00 0.00 C ATOM 23 O ARG A 120 -16.610 13.223 -1.468 1.00 0.00 O ATOM 24 CB ARG A 120 -15.796 16.496 -1.793 1.00 0.00 C ATOM 25 CG ARG A 120 -15.986 17.772 -2.589 1.00 0.00 C ATOM 26 CD ARG A 120 -15.938 18.997 -1.690 1.00 0.00 C ATOM 27 NE ARG A 120 -16.143 20.236 -2.435 1.00 0.00 N ATOM 28 CZ ARG A 120 -15.836 21.441 -1.963 1.00 0.00 C ATOM 29 NH1 ARG A 120 -15.297 21.566 -0.757 1.00 0.00 N ATOM 30 NH2 ARG A 120 -16.065 22.521 -2.697 1.00 0.00 N ATOM 0 H ARG A 120 -18.023 14.865 -2.571 1.00 0.00 H new ATOM 0 HA ARG A 120 -15.231 15.232 -3.437 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -16.515 16.479 -0.974 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -14.803 16.503 -1.344 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.210 17.847 -3.351 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -16.942 17.739 -3.111 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -16.702 18.909 -0.918 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.974 19.035 -1.182 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.544 20.174 -3.371 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.117 20.737 -0.190 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -15.062 22.491 -0.397 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -16.477 22.429 -3.625 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -15.829 23.444 -2.333 1.00 0.00 H new ATOM 44 N LEU A 121 -14.448 13.833 -1.334 1.00 0.00 N ATOM 45 CA LEU A 121 -14.066 12.707 -0.490 1.00 0.00 C ATOM 46 C LEU A 121 -13.193 13.173 0.669 1.00 0.00 C ATOM 47 O LEU A 121 -13.289 12.651 1.779 1.00 0.00 O ATOM 48 CB LEU A 121 -13.326 11.643 -1.309 1.00 0.00 C ATOM 49 CG LEU A 121 -11.983 12.085 -1.899 1.00 0.00 C ATOM 50 CD1 LEU A 121 -11.129 10.875 -2.243 1.00 0.00 C ATOM 51 CD2 LEU A 121 -12.199 12.948 -3.134 1.00 0.00 C ATOM 0 H LEU A 121 -13.681 14.465 -1.566 1.00 0.00 H new ATOM 0 HA LEU A 121 -14.977 12.266 -0.085 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -13.156 10.773 -0.674 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -13.974 11.321 -2.124 1.00 0.00 H new ATOM 0 HG LEU A 121 -11.459 12.679 -1.150 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -10.179 11.207 -2.661 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -10.945 10.292 -1.341 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -11.651 10.257 -2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -11.234 13.252 -3.539 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -12.744 12.377 -3.886 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -12.774 13.833 -2.863 1.00 0.00 H new ATOM 63 N LYS A 122 -12.347 14.165 0.399 1.00 0.00 N ATOM 64 CA LYS A 122 -11.446 14.709 1.410 1.00 0.00 C ATOM 65 C LYS A 122 -10.587 13.606 2.025 1.00 0.00 C ATOM 66 O LYS A 122 -10.982 12.967 3.000 1.00 0.00 O ATOM 67 CB LYS A 122 -12.240 15.432 2.501 1.00 0.00 C ATOM 68 CG LYS A 122 -13.069 16.595 1.977 1.00 0.00 C ATOM 69 CD LYS A 122 -13.878 17.255 3.083 1.00 0.00 C ATOM 70 CE LYS A 122 -12.980 17.944 4.098 1.00 0.00 C ATOM 71 NZ LYS A 122 -12.112 18.974 3.463 1.00 0.00 N ATOM 0 H LYS A 122 -12.267 14.609 -0.516 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.785 15.426 0.923 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.900 14.718 2.993 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -11.549 15.801 3.259 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.411 17.333 1.518 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -13.742 16.239 1.197 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -14.563 17.983 2.649 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -14.488 16.505 3.586 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -13.594 18.411 4.868 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.357 17.201 4.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -11.748 19.620 4.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.315 18.509 2.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.666 19.514 2.768 1.00 0.00 H new ATOM 85 N VAL A 123 -9.413 13.389 1.441 1.00 0.00 N ATOM 86 CA VAL A 123 -8.494 12.365 1.918 1.00 0.00 C ATOM 87 C VAL A 123 -8.099 12.601 3.371 1.00 0.00 C ATOM 88 O VAL A 123 -7.356 13.530 3.687 1.00 0.00 O ATOM 89 CB VAL A 123 -7.223 12.294 1.045 1.00 0.00 C ATOM 90 CG1 VAL A 123 -7.532 11.634 -0.291 1.00 0.00 C ATOM 91 CG2 VAL A 123 -6.632 13.681 0.833 1.00 0.00 C ATOM 0 H VAL A 123 -9.076 13.912 0.633 1.00 0.00 H new ATOM 0 HA VAL A 123 -9.023 11.414 1.848 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.484 11.688 1.568 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -6.625 11.592 -0.894 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -7.902 10.623 -0.120 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -8.291 12.214 -0.816 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -5.737 13.605 0.215 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -7.364 14.316 0.335 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -6.371 14.116 1.797 1.00 0.00 H new ATOM 101 N GLU A 124 -8.611 11.750 4.252 1.00 0.00 N ATOM 102 CA GLU A 124 -8.316 11.851 5.676 1.00 0.00 C ATOM 103 C GLU A 124 -7.250 10.836 6.084 1.00 0.00 C ATOM 104 O GLU A 124 -7.512 9.634 6.146 1.00 0.00 O ATOM 105 CB GLU A 124 -9.588 11.646 6.505 1.00 0.00 C ATOM 106 CG GLU A 124 -10.407 10.428 6.100 1.00 0.00 C ATOM 107 CD GLU A 124 -11.313 10.696 4.913 1.00 0.00 C ATOM 108 OE1 GLU A 124 -12.366 11.338 5.104 1.00 0.00 O ATOM 109 OE2 GLU A 124 -10.972 10.259 3.793 1.00 0.00 O ATOM 0 H GLU A 124 -9.234 10.981 4.005 1.00 0.00 H new ATOM 0 HA GLU A 124 -7.930 12.852 5.870 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.312 11.552 7.555 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.212 12.535 6.418 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -9.733 9.607 5.858 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -11.012 10.105 6.947 1.00 0.00 H new ATOM 116 N ASP A 125 -6.044 11.332 6.354 1.00 0.00 N ATOM 117 CA ASP A 125 -4.927 10.477 6.755 1.00 0.00 C ATOM 118 C ASP A 125 -4.617 9.442 5.676 1.00 0.00 C ATOM 119 O ASP A 125 -3.978 8.425 5.946 1.00 0.00 O ATOM 120 CB ASP A 125 -5.237 9.774 8.079 1.00 0.00 C ATOM 121 CG ASP A 125 -5.540 10.750 9.200 1.00 0.00 C ATOM 122 OD1 ASP A 125 -6.691 11.230 9.274 1.00 0.00 O ATOM 123 OD2 ASP A 125 -4.627 11.035 10.003 1.00 0.00 O ATOM 0 H ASP A 125 -5.814 12.324 6.302 1.00 0.00 H new ATOM 0 HA ASP A 125 -4.051 11.111 6.888 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -6.089 9.108 7.942 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -4.388 9.152 8.363 1.00 0.00 H new ATOM 128 N ALA A 126 -5.067 9.711 4.454 1.00 0.00 N ATOM 129 CA ALA A 126 -4.839 8.800 3.338 1.00 0.00 C ATOM 130 C ALA A 126 -3.589 9.191 2.555 1.00 0.00 C ATOM 131 O ALA A 126 -3.052 8.394 1.786 1.00 0.00 O ATOM 132 CB ALA A 126 -6.053 8.774 2.421 1.00 0.00 C ATOM 0 H ALA A 126 -5.591 10.552 4.212 1.00 0.00 H new ATOM 0 HA ALA A 126 -4.683 7.800 3.744 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -5.869 8.090 1.593 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.925 8.438 2.982 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.236 9.775 2.031 1.00 0.00 H new ATOM 138 N LEU A 127 -3.133 10.423 2.756 1.00 0.00 N ATOM 139 CA LEU A 127 -1.945 10.925 2.073 1.00 0.00 C ATOM 140 C LEU A 127 -0.747 10.918 3.017 1.00 0.00 C ATOM 141 O LEU A 127 0.205 11.677 2.840 1.00 0.00 O ATOM 142 CB LEU A 127 -2.201 12.344 1.549 1.00 0.00 C ATOM 143 CG LEU A 127 -1.685 12.634 0.133 1.00 0.00 C ATOM 144 CD1 LEU A 127 -0.168 12.547 0.077 1.00 0.00 C ATOM 145 CD2 LEU A 127 -2.313 11.679 -0.874 1.00 0.00 C ATOM 0 H LEU A 127 -3.569 11.094 3.388 1.00 0.00 H new ATOM 0 HA LEU A 127 -1.724 10.272 1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.275 12.531 1.570 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -1.740 13.054 2.236 1.00 0.00 H new ATOM 0 HG LEU A 127 -1.975 13.651 -0.129 1.00 0.00 H new ATOM 0 HD11 LEU A 127 0.171 12.757 -0.937 1.00 0.00 H new ATOM 0 HD12 LEU A 127 0.264 13.277 0.762 1.00 0.00 H new ATOM 0 HD13 LEU A 127 0.150 11.545 0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.934 11.901 -1.872 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -2.059 10.653 -0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.396 11.799 -0.862 1.00 0.00 H new ATOM 157 N SER A 128 -0.800 10.049 4.022 1.00 0.00 N ATOM 158 CA SER A 128 0.277 9.940 4.997 1.00 0.00 C ATOM 159 C SER A 128 1.199 8.773 4.661 1.00 0.00 C ATOM 160 O SER A 128 2.393 8.961 4.435 1.00 0.00 O ATOM 161 CB SER A 128 -0.296 9.764 6.405 1.00 0.00 C ATOM 162 OG SER A 128 0.738 9.657 7.367 1.00 0.00 O ATOM 0 H SER A 128 -1.579 9.410 4.182 1.00 0.00 H new ATOM 0 HA SER A 128 0.859 10.861 4.962 1.00 0.00 H new ATOM 0 HB2 SER A 128 -0.937 10.611 6.648 1.00 0.00 H new ATOM 0 HB3 SER A 128 -0.921 8.872 6.438 1.00 0.00 H new ATOM 0 HG SER A 128 0.346 9.547 8.258 1.00 0.00 H new ATOM 168 N TYR A 129 0.635 7.571 4.628 1.00 0.00 N ATOM 169 CA TYR A 129 1.408 6.373 4.323 1.00 0.00 C ATOM 170 C TYR A 129 1.863 6.364 2.867 1.00 0.00 C ATOM 171 O TYR A 129 3.029 6.098 2.574 1.00 0.00 O ATOM 172 CB TYR A 129 0.581 5.120 4.619 1.00 0.00 C ATOM 173 CG TYR A 129 1.315 3.831 4.331 1.00 0.00 C ATOM 174 CD1 TYR A 129 2.337 3.388 5.162 1.00 0.00 C ATOM 175 CD2 TYR A 129 0.987 3.056 3.226 1.00 0.00 C ATOM 176 CE1 TYR A 129 3.011 2.212 4.899 1.00 0.00 C ATOM 177 CE2 TYR A 129 1.657 1.877 2.957 1.00 0.00 C ATOM 178 CZ TYR A 129 2.667 1.460 3.797 1.00 0.00 C ATOM 179 OH TYR A 129 3.337 0.288 3.533 1.00 0.00 O ATOM 0 H TYR A 129 -0.354 7.400 4.809 1.00 0.00 H new ATOM 0 HA TYR A 129 2.295 6.377 4.957 1.00 0.00 H new ATOM 0 HB2 TYR A 129 0.281 5.132 5.667 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -0.333 5.149 4.025 1.00 0.00 H new ATOM 0 HD1 TYR A 129 2.609 3.973 6.028 1.00 0.00 H new ATOM 0 HD2 TYR A 129 0.196 3.380 2.566 1.00 0.00 H new ATOM 0 HE1 TYR A 129 3.804 1.883 5.554 1.00 0.00 H new ATOM 0 HE2 TYR A 129 1.390 1.286 2.093 1.00 0.00 H new ATOM 0 HH TYR A 129 3.739 -0.052 4.359 1.00 0.00 H new ATOM 189 N LEU A 130 0.936 6.651 1.956 1.00 0.00 N ATOM 190 CA LEU A 130 1.246 6.675 0.531 1.00 0.00 C ATOM 191 C LEU A 130 2.418 7.608 0.248 1.00 0.00 C ATOM 192 O LEU A 130 3.326 7.271 -0.515 1.00 0.00 O ATOM 193 CB LEU A 130 0.022 7.114 -0.275 1.00 0.00 C ATOM 194 CG LEU A 130 -1.220 6.235 -0.100 1.00 0.00 C ATOM 195 CD1 LEU A 130 -2.382 6.794 -0.906 1.00 0.00 C ATOM 196 CD2 LEU A 130 -0.924 4.800 -0.514 1.00 0.00 C ATOM 0 H LEU A 130 -0.035 6.870 2.180 1.00 0.00 H new ATOM 0 HA LEU A 130 1.525 5.666 0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -0.232 8.136 0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 130 0.289 7.132 -1.332 1.00 0.00 H new ATOM 0 HG LEU A 130 -1.497 6.236 0.954 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -3.257 6.158 -0.771 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -2.610 7.803 -0.563 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -2.113 6.822 -1.962 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -1.819 4.191 -0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -0.621 4.778 -1.561 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -0.120 4.401 0.104 1.00 0.00 H new ATOM 208 N ASP A 131 2.392 8.783 0.869 1.00 0.00 N ATOM 209 CA ASP A 131 3.456 9.761 0.694 1.00 0.00 C ATOM 210 C ASP A 131 4.788 9.192 1.175 1.00 0.00 C ATOM 211 O ASP A 131 5.842 9.498 0.618 1.00 0.00 O ATOM 212 CB ASP A 131 3.124 11.049 1.452 1.00 0.00 C ATOM 213 CG ASP A 131 4.190 12.113 1.282 1.00 0.00 C ATOM 214 OD1 ASP A 131 4.125 12.865 0.285 1.00 0.00 O ATOM 215 OD2 ASP A 131 5.089 12.196 2.145 1.00 0.00 O ATOM 0 H ASP A 131 1.645 9.079 1.497 1.00 0.00 H new ATOM 0 HA ASP A 131 3.542 9.993 -0.368 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.168 11.437 1.101 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.006 10.823 2.512 1.00 0.00 H new ATOM 220 N GLN A 132 4.728 8.358 2.211 1.00 0.00 N ATOM 221 CA GLN A 132 5.928 7.737 2.763 1.00 0.00 C ATOM 222 C GLN A 132 6.495 6.709 1.790 1.00 0.00 C ATOM 223 O GLN A 132 7.710 6.553 1.677 1.00 0.00 O ATOM 224 CB GLN A 132 5.619 7.072 4.106 1.00 0.00 C ATOM 225 CG GLN A 132 5.316 8.059 5.221 1.00 0.00 C ATOM 226 CD GLN A 132 4.967 7.374 6.528 1.00 0.00 C ATOM 227 OE1 GLN A 132 3.801 7.091 6.802 1.00 0.00 O ATOM 228 NE2 GLN A 132 5.981 7.104 7.344 1.00 0.00 N ATOM 0 H GLN A 132 3.863 8.098 2.684 1.00 0.00 H new ATOM 0 HA GLN A 132 6.673 8.517 2.921 1.00 0.00 H new ATOM 0 HB2 GLN A 132 4.767 6.404 3.983 1.00 0.00 H new ATOM 0 HB3 GLN A 132 6.468 6.455 4.400 1.00 0.00 H new ATOM 0 HG2 GLN A 132 6.180 8.706 5.374 1.00 0.00 H new ATOM 0 HG3 GLN A 132 4.488 8.700 4.919 1.00 0.00 H new ATOM 0 HE21 GLN A 132 6.932 7.357 7.076 1.00 0.00 H new ATOM 0 HE22 GLN A 132 5.808 6.644 8.238 1.00 0.00 H new ATOM 237 N VAL A 133 5.605 6.008 1.091 1.00 0.00 N ATOM 238 CA VAL A 133 6.020 5.001 0.122 1.00 0.00 C ATOM 239 C VAL A 133 6.757 5.650 -1.044 1.00 0.00 C ATOM 240 O VAL A 133 7.814 5.180 -1.464 1.00 0.00 O ATOM 241 CB VAL A 133 4.814 4.210 -0.425 1.00 0.00 C ATOM 242 CG1 VAL A 133 5.272 3.147 -1.411 1.00 0.00 C ATOM 243 CG2 VAL A 133 4.024 3.584 0.713 1.00 0.00 C ATOM 0 H VAL A 133 4.595 6.120 1.178 1.00 0.00 H new ATOM 0 HA VAL A 133 6.686 4.312 0.641 1.00 0.00 H new ATOM 0 HB VAL A 133 4.160 4.904 -0.953 1.00 0.00 H new ATOM 0 HG11 VAL A 133 4.406 2.600 -1.785 1.00 0.00 H new ATOM 0 HG12 VAL A 133 5.789 3.622 -2.245 1.00 0.00 H new ATOM 0 HG13 VAL A 133 5.950 2.455 -0.911 1.00 0.00 H new ATOM 0 HG21 VAL A 133 3.177 3.030 0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 133 4.667 2.905 1.272 1.00 0.00 H new ATOM 0 HG23 VAL A 133 3.660 4.368 1.377 1.00 0.00 H new ATOM 253 N LYS A 134 6.186 6.733 -1.562 1.00 0.00 N ATOM 254 CA LYS A 134 6.784 7.453 -2.679 1.00 0.00 C ATOM 255 C LYS A 134 8.039 8.201 -2.236 1.00 0.00 C ATOM 256 O LYS A 134 8.951 8.428 -3.031 1.00 0.00 O ATOM 257 CB LYS A 134 5.772 8.434 -3.276 1.00 0.00 C ATOM 258 CG LYS A 134 6.283 9.168 -4.505 1.00 0.00 C ATOM 259 CD LYS A 134 5.267 10.177 -5.012 1.00 0.00 C ATOM 260 CE LYS A 134 5.750 10.866 -6.278 1.00 0.00 C ATOM 261 NZ LYS A 134 7.042 11.576 -6.069 1.00 0.00 N ATOM 0 H LYS A 134 5.309 7.131 -1.225 1.00 0.00 H new ATOM 0 HA LYS A 134 7.069 6.726 -3.440 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.865 7.890 -3.540 1.00 0.00 H new ATOM 0 HB3 LYS A 134 5.496 9.165 -2.516 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.215 9.678 -4.264 1.00 0.00 H new ATOM 0 HG3 LYS A 134 6.508 8.449 -5.293 1.00 0.00 H new ATOM 0 HD2 LYS A 134 4.320 9.674 -5.209 1.00 0.00 H new ATOM 0 HD3 LYS A 134 5.077 10.923 -4.240 1.00 0.00 H new ATOM 0 HE2 LYS A 134 5.867 10.127 -7.071 1.00 0.00 H new ATOM 0 HE3 LYS A 134 4.996 11.578 -6.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 7.234 12.194 -6.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 6.987 12.150 -5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 7.809 10.880 -5.974 1.00 0.00 H new ATOM 275 N LEU A 135 8.078 8.581 -0.961 1.00 0.00 N ATOM 276 CA LEU A 135 9.220 9.307 -0.413 1.00 0.00 C ATOM 277 C LEU A 135 10.445 8.404 -0.298 1.00 0.00 C ATOM 278 O LEU A 135 11.514 8.726 -0.817 1.00 0.00 O ATOM 279 CB LEU A 135 8.874 9.883 0.963 1.00 0.00 C ATOM 280 CG LEU A 135 9.969 10.739 1.603 1.00 0.00 C ATOM 281 CD1 LEU A 135 10.205 12.003 0.790 1.00 0.00 C ATOM 282 CD2 LEU A 135 9.603 11.086 3.037 1.00 0.00 C ATOM 0 H LEU A 135 7.333 8.398 -0.289 1.00 0.00 H new ATOM 0 HA LEU A 135 9.455 10.122 -1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.971 10.486 0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 135 8.639 9.058 1.636 1.00 0.00 H new ATOM 0 HG LEU A 135 10.894 10.162 1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 135 10.987 12.598 1.261 1.00 0.00 H new ATOM 0 HD12 LEU A 135 10.513 11.734 -0.220 1.00 0.00 H new ATOM 0 HD13 LEU A 135 9.284 12.584 0.745 1.00 0.00 H new ATOM 0 HD21 LEU A 135 10.393 11.695 3.477 1.00 0.00 H new ATOM 0 HD22 LEU A 135 8.666 11.643 3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 135 9.487 10.169 3.615 1.00 0.00 H new ATOM 294 N GLN A 136 10.284 7.276 0.386 1.00 0.00 N ATOM 295 CA GLN A 136 11.381 6.332 0.572 1.00 0.00 C ATOM 296 C GLN A 136 11.907 5.833 -0.769 1.00 0.00 C ATOM 297 O GLN A 136 13.116 5.737 -0.975 1.00 0.00 O ATOM 298 CB GLN A 136 10.925 5.148 1.428 1.00 0.00 C ATOM 299 CG GLN A 136 10.568 5.530 2.856 1.00 0.00 C ATOM 300 CD GLN A 136 11.754 6.080 3.625 1.00 0.00 C ATOM 301 OE1 GLN A 136 12.900 5.706 3.372 1.00 0.00 O ATOM 302 NE2 GLN A 136 11.484 6.971 4.571 1.00 0.00 N ATOM 0 H GLN A 136 9.406 6.993 0.820 1.00 0.00 H new ATOM 0 HA GLN A 136 12.189 6.853 1.086 1.00 0.00 H new ATOM 0 HB2 GLN A 136 10.058 4.683 0.958 1.00 0.00 H new ATOM 0 HB3 GLN A 136 11.717 4.399 1.448 1.00 0.00 H new ATOM 0 HG2 GLN A 136 9.772 6.275 2.841 1.00 0.00 H new ATOM 0 HG3 GLN A 136 10.177 4.655 3.375 1.00 0.00 H new ATOM 0 HE21 GLN A 136 10.519 7.252 4.747 1.00 0.00 H new ATOM 0 HE22 GLN A 136 12.241 7.375 5.122 1.00 0.00 H new ATOM 311 N PHE A 137 10.989 5.519 -1.679 1.00 0.00 N ATOM 312 CA PHE A 137 11.360 5.029 -3.002 1.00 0.00 C ATOM 313 C PHE A 137 11.184 6.119 -4.054 1.00 0.00 C ATOM 314 O PHE A 137 10.072 6.380 -4.513 1.00 0.00 O ATOM 315 CB PHE A 137 10.518 3.806 -3.367 1.00 0.00 C ATOM 316 CG PHE A 137 10.665 2.669 -2.397 1.00 0.00 C ATOM 317 CD1 PHE A 137 9.863 2.596 -1.270 1.00 0.00 C ATOM 318 CD2 PHE A 137 11.606 1.675 -2.611 1.00 0.00 C ATOM 319 CE1 PHE A 137 9.996 1.553 -0.374 1.00 0.00 C ATOM 320 CE2 PHE A 137 11.745 0.629 -1.719 1.00 0.00 C ATOM 321 CZ PHE A 137 10.939 0.568 -0.599 1.00 0.00 C ATOM 0 H PHE A 137 9.984 5.595 -1.524 1.00 0.00 H new ATOM 0 HA PHE A 137 12.411 4.743 -2.977 1.00 0.00 H new ATOM 0 HB2 PHE A 137 9.469 4.098 -3.417 1.00 0.00 H new ATOM 0 HB3 PHE A 137 10.801 3.463 -4.362 1.00 0.00 H new ATOM 0 HD1 PHE A 137 9.125 3.364 -1.090 1.00 0.00 H new ATOM 0 HD2 PHE A 137 12.238 1.718 -3.485 1.00 0.00 H new ATOM 0 HE1 PHE A 137 9.364 1.507 0.501 1.00 0.00 H new ATOM 0 HE2 PHE A 137 12.483 -0.140 -1.897 1.00 0.00 H new ATOM 0 HZ PHE A 137 11.046 -0.248 0.100 1.00 0.00 H new ATOM 331 N GLY A 138 12.290 6.758 -4.429 1.00 0.00 N ATOM 332 CA GLY A 138 12.238 7.814 -5.423 1.00 0.00 C ATOM 333 C GLY A 138 12.950 7.440 -6.708 1.00 0.00 C ATOM 334 O GLY A 138 12.513 7.812 -7.798 1.00 0.00 O ATOM 0 H GLY A 138 13.221 6.562 -4.061 1.00 0.00 H new ATOM 0 HA2 GLY A 138 11.197 8.049 -5.644 1.00 0.00 H new ATOM 0 HA3 GLY A 138 12.688 8.717 -5.012 1.00 0.00 H new ATOM 338 N SER A 139 14.050 6.706 -6.581 1.00 0.00 N ATOM 339 CA SER A 139 14.823 6.278 -7.741 1.00 0.00 C ATOM 340 C SER A 139 14.113 5.142 -8.468 1.00 0.00 C ATOM 341 O SER A 139 14.264 4.973 -9.677 1.00 0.00 O ATOM 342 CB SER A 139 16.223 5.834 -7.316 1.00 0.00 C ATOM 343 OG SER A 139 16.160 4.758 -6.397 1.00 0.00 O ATOM 0 H SER A 139 14.427 6.395 -5.686 1.00 0.00 H new ATOM 0 HA SER A 139 14.915 7.125 -8.421 1.00 0.00 H new ATOM 0 HB2 SER A 139 16.795 5.533 -8.194 1.00 0.00 H new ATOM 0 HB3 SER A 139 16.752 6.673 -6.863 1.00 0.00 H new ATOM 0 HG SER A 139 17.068 4.492 -6.142 1.00 0.00 H new ATOM 349 N GLN A 140 13.339 4.366 -7.715 1.00 0.00 N ATOM 350 CA GLN A 140 12.599 3.244 -8.280 1.00 0.00 C ATOM 351 C GLN A 140 11.093 3.457 -8.128 1.00 0.00 C ATOM 352 O GLN A 140 10.476 2.930 -7.202 1.00 0.00 O ATOM 353 CB GLN A 140 13.015 1.938 -7.600 1.00 0.00 C ATOM 354 CG GLN A 140 14.486 1.602 -7.782 1.00 0.00 C ATOM 355 CD GLN A 140 14.872 0.290 -7.130 1.00 0.00 C ATOM 356 OE1 GLN A 140 14.787 -0.772 -7.746 1.00 0.00 O ATOM 357 NE2 GLN A 140 15.304 0.358 -5.876 1.00 0.00 N ATOM 0 H GLN A 140 13.208 4.494 -6.712 1.00 0.00 H new ATOM 0 HA GLN A 140 12.834 3.181 -9.343 1.00 0.00 H new ATOM 0 HB2 GLN A 140 12.795 2.006 -6.535 1.00 0.00 H new ATOM 0 HB3 GLN A 140 12.412 1.122 -7.998 1.00 0.00 H new ATOM 0 HG2 GLN A 140 14.714 1.555 -8.847 1.00 0.00 H new ATOM 0 HG3 GLN A 140 15.092 2.404 -7.361 1.00 0.00 H new ATOM 0 HE21 GLN A 140 15.358 1.260 -5.404 1.00 0.00 H new ATOM 0 HE22 GLN A 140 15.581 -0.492 -5.385 1.00 0.00 H new ATOM 366 N PRO A 141 10.484 4.244 -9.034 1.00 0.00 N ATOM 367 CA PRO A 141 9.045 4.524 -8.993 1.00 0.00 C ATOM 368 C PRO A 141 8.206 3.309 -9.372 1.00 0.00 C ATOM 369 O PRO A 141 6.980 3.333 -9.267 1.00 0.00 O ATOM 370 CB PRO A 141 8.871 5.639 -10.026 1.00 0.00 C ATOM 371 CG PRO A 141 9.995 5.443 -10.982 1.00 0.00 C ATOM 372 CD PRO A 141 11.146 4.921 -10.167 1.00 0.00 C ATOM 0 HA PRO A 141 8.711 4.797 -7.992 1.00 0.00 H new ATOM 0 HB2 PRO A 141 7.906 5.567 -10.528 1.00 0.00 H new ATOM 0 HB3 PRO A 141 8.915 6.623 -9.559 1.00 0.00 H new ATOM 0 HG2 PRO A 141 9.721 4.738 -11.767 1.00 0.00 H new ATOM 0 HG3 PRO A 141 10.258 6.380 -11.473 1.00 0.00 H new ATOM 0 HD2 PRO A 141 11.765 4.231 -10.741 1.00 0.00 H new ATOM 0 HD3 PRO A 141 11.797 5.727 -9.829 1.00 0.00 H new ATOM 380 N GLN A 142 8.876 2.250 -9.815 1.00 0.00 N ATOM 381 CA GLN A 142 8.193 1.023 -10.207 1.00 0.00 C ATOM 382 C GLN A 142 7.469 0.403 -9.017 1.00 0.00 C ATOM 383 O GLN A 142 6.375 -0.142 -9.159 1.00 0.00 O ATOM 384 CB GLN A 142 9.189 0.022 -10.795 1.00 0.00 C ATOM 385 CG GLN A 142 10.318 -0.348 -9.845 1.00 0.00 C ATOM 386 CD GLN A 142 11.286 -1.346 -10.449 1.00 0.00 C ATOM 387 OE1 GLN A 142 11.104 -2.558 -10.328 1.00 0.00 O ATOM 388 NE2 GLN A 142 12.325 -0.839 -11.103 1.00 0.00 N ATOM 0 H GLN A 142 9.891 2.217 -9.911 1.00 0.00 H new ATOM 0 HA GLN A 142 7.455 1.274 -10.968 1.00 0.00 H new ATOM 0 HB2 GLN A 142 8.654 -0.884 -11.080 1.00 0.00 H new ATOM 0 HB3 GLN A 142 9.616 0.440 -11.707 1.00 0.00 H new ATOM 0 HG2 GLN A 142 10.861 0.554 -9.563 1.00 0.00 H new ATOM 0 HG3 GLN A 142 9.896 -0.765 -8.930 1.00 0.00 H new ATOM 0 HE21 GLN A 142 12.436 0.172 -11.178 1.00 0.00 H new ATOM 0 HE22 GLN A 142 13.012 -1.461 -11.530 1.00 0.00 H new ATOM 397 N VAL A 143 8.088 0.491 -7.843 1.00 0.00 N ATOM 398 CA VAL A 143 7.505 -0.058 -6.626 1.00 0.00 C ATOM 399 C VAL A 143 6.183 0.629 -6.301 1.00 0.00 C ATOM 400 O VAL A 143 5.255 0.003 -5.788 1.00 0.00 O ATOM 401 CB VAL A 143 8.464 0.095 -5.428 1.00 0.00 C ATOM 402 CG1 VAL A 143 7.864 -0.525 -4.175 1.00 0.00 C ATOM 403 CG2 VAL A 143 9.815 -0.528 -5.745 1.00 0.00 C ATOM 0 H VAL A 143 8.995 0.938 -7.710 1.00 0.00 H new ATOM 0 HA VAL A 143 7.327 -1.119 -6.803 1.00 0.00 H new ATOM 0 HB VAL A 143 8.613 1.158 -5.240 1.00 0.00 H new ATOM 0 HG11 VAL A 143 8.557 -0.406 -3.342 1.00 0.00 H new ATOM 0 HG12 VAL A 143 6.923 -0.028 -3.938 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.681 -1.586 -4.346 1.00 0.00 H new ATOM 0 HG21 VAL A 143 10.479 -0.411 -4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 143 9.685 -1.588 -5.961 1.00 0.00 H new ATOM 0 HG23 VAL A 143 10.250 -0.032 -6.612 1.00 0.00 H new ATOM 413 N TYR A 144 6.105 1.920 -6.607 1.00 0.00 N ATOM 414 CA TYR A 144 4.900 2.699 -6.353 1.00 0.00 C ATOM 415 C TYR A 144 3.741 2.197 -7.210 1.00 0.00 C ATOM 416 O TYR A 144 2.622 2.027 -6.723 1.00 0.00 O ATOM 417 CB TYR A 144 5.160 4.179 -6.637 1.00 0.00 C ATOM 418 CG TYR A 144 3.996 5.079 -6.291 1.00 0.00 C ATOM 419 CD1 TYR A 144 3.622 5.286 -4.969 1.00 0.00 C ATOM 420 CD2 TYR A 144 3.273 5.724 -7.287 1.00 0.00 C ATOM 421 CE1 TYR A 144 2.559 6.109 -4.650 1.00 0.00 C ATOM 422 CE2 TYR A 144 2.210 6.550 -6.974 1.00 0.00 C ATOM 423 CZ TYR A 144 1.857 6.738 -5.655 1.00 0.00 C ATOM 424 OH TYR A 144 0.797 7.558 -5.340 1.00 0.00 O ATOM 0 H TYR A 144 6.866 2.450 -7.033 1.00 0.00 H new ATOM 0 HA TYR A 144 4.629 2.580 -5.304 1.00 0.00 H new ATOM 0 HB2 TYR A 144 6.036 4.500 -6.073 1.00 0.00 H new ATOM 0 HB3 TYR A 144 5.400 4.300 -7.693 1.00 0.00 H new ATOM 0 HD1 TYR A 144 4.171 4.796 -4.178 1.00 0.00 H new ATOM 0 HD2 TYR A 144 3.546 5.578 -8.322 1.00 0.00 H new ATOM 0 HE1 TYR A 144 2.280 6.259 -3.618 1.00 0.00 H new ATOM 0 HE2 TYR A 144 1.659 7.046 -7.759 1.00 0.00 H new ATOM 0 HH TYR A 144 0.411 7.924 -6.163 1.00 0.00 H new ATOM 434 N ASN A 145 4.020 1.961 -8.487 1.00 0.00 N ATOM 435 CA ASN A 145 3.007 1.478 -9.416 1.00 0.00 C ATOM 436 C ASN A 145 2.504 0.099 -8.999 1.00 0.00 C ATOM 437 O ASN A 145 1.299 -0.157 -8.993 1.00 0.00 O ATOM 438 CB ASN A 145 3.575 1.419 -10.835 1.00 0.00 C ATOM 439 CG ASN A 145 2.549 0.959 -11.852 1.00 0.00 C ATOM 440 OD1 ASN A 145 2.411 -0.235 -12.113 1.00 0.00 O ATOM 441 ND2 ASN A 145 1.823 1.907 -12.432 1.00 0.00 N ATOM 0 H ASN A 145 4.942 2.097 -8.903 1.00 0.00 H new ATOM 0 HA ASN A 145 2.168 2.173 -9.397 1.00 0.00 H new ATOM 0 HB2 ASN A 145 3.944 2.405 -11.117 1.00 0.00 H new ATOM 0 HB3 ASN A 145 4.429 0.742 -10.853 1.00 0.00 H new ATOM 0 HD21 ASN A 145 1.117 1.657 -13.124 1.00 0.00 H new ATOM 0 HD22 ASN A 145 1.971 2.886 -12.185 1.00 0.00 H new ATOM 448 N ASP A 146 3.435 -0.782 -8.648 1.00 0.00 N ATOM 449 CA ASP A 146 3.090 -2.135 -8.227 1.00 0.00 C ATOM 450 C ASP A 146 2.210 -2.111 -6.982 1.00 0.00 C ATOM 451 O ASP A 146 1.269 -2.896 -6.863 1.00 0.00 O ATOM 452 CB ASP A 146 4.356 -2.950 -7.955 1.00 0.00 C ATOM 453 CG ASP A 146 5.176 -3.183 -9.208 1.00 0.00 C ATOM 454 OD1 ASP A 146 4.640 -3.780 -10.166 1.00 0.00 O ATOM 455 OD2 ASP A 146 6.354 -2.769 -9.234 1.00 0.00 O ATOM 0 H ASP A 146 4.435 -0.583 -8.647 1.00 0.00 H new ATOM 0 HA ASP A 146 2.532 -2.606 -9.036 1.00 0.00 H new ATOM 0 HB2 ASP A 146 4.967 -2.431 -7.216 1.00 0.00 H new ATOM 0 HB3 ASP A 146 4.079 -3.911 -7.522 1.00 0.00 H new ATOM 460 N PHE A 147 2.520 -1.207 -6.057 1.00 0.00 N ATOM 461 CA PHE A 147 1.752 -1.089 -4.823 1.00 0.00 C ATOM 462 C PHE A 147 0.310 -0.688 -5.119 1.00 0.00 C ATOM 463 O PHE A 147 -0.631 -1.313 -4.628 1.00 0.00 O ATOM 464 CB PHE A 147 2.396 -0.068 -3.883 1.00 0.00 C ATOM 465 CG PHE A 147 1.688 0.058 -2.563 1.00 0.00 C ATOM 466 CD1 PHE A 147 1.945 -0.836 -1.538 1.00 0.00 C ATOM 467 CD2 PHE A 147 0.762 1.068 -2.350 1.00 0.00 C ATOM 468 CE1 PHE A 147 1.293 -0.727 -0.324 1.00 0.00 C ATOM 469 CE2 PHE A 147 0.106 1.181 -1.139 1.00 0.00 C ATOM 470 CZ PHE A 147 0.372 0.282 -0.125 1.00 0.00 C ATOM 0 H PHE A 147 3.295 -0.548 -6.138 1.00 0.00 H new ATOM 0 HA PHE A 147 1.749 -2.063 -4.334 1.00 0.00 H new ATOM 0 HB2 PHE A 147 3.433 -0.353 -3.705 1.00 0.00 H new ATOM 0 HB3 PHE A 147 2.412 0.906 -4.373 1.00 0.00 H new ATOM 0 HD1 PHE A 147 2.663 -1.628 -1.689 1.00 0.00 H new ATOM 0 HD2 PHE A 147 0.551 1.774 -3.139 1.00 0.00 H new ATOM 0 HE1 PHE A 147 1.504 -1.430 0.468 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -0.614 1.971 -0.986 1.00 0.00 H new ATOM 0 HZ PHE A 147 -0.140 0.368 0.822 1.00 0.00 H new ATOM 480 N LEU A 148 0.144 0.359 -5.924 1.00 0.00 N ATOM 481 CA LEU A 148 -1.186 0.838 -6.285 1.00 0.00 C ATOM 482 C LEU A 148 -1.978 -0.248 -7.002 1.00 0.00 C ATOM 483 O LEU A 148 -3.196 -0.340 -6.855 1.00 0.00 O ATOM 484 CB LEU A 148 -1.087 2.083 -7.172 1.00 0.00 C ATOM 485 CG LEU A 148 -0.554 3.338 -6.479 1.00 0.00 C ATOM 486 CD1 LEU A 148 -0.482 4.497 -7.461 1.00 0.00 C ATOM 487 CD2 LEU A 148 -1.428 3.704 -5.287 1.00 0.00 C ATOM 0 H LEU A 148 0.911 0.889 -6.337 1.00 0.00 H new ATOM 0 HA LEU A 148 -1.709 1.100 -5.365 1.00 0.00 H new ATOM 0 HB2 LEU A 148 -0.442 1.854 -8.020 1.00 0.00 H new ATOM 0 HB3 LEU A 148 -2.076 2.302 -7.574 1.00 0.00 H new ATOM 0 HG LEU A 148 0.452 3.129 -6.116 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -0.101 5.382 -6.952 1.00 0.00 H new ATOM 0 HD12 LEU A 148 0.184 4.236 -8.283 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -1.478 4.704 -7.853 1.00 0.00 H new ATOM 0 HD21 LEU A 148 -1.033 4.599 -4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 148 -2.446 3.894 -5.627 1.00 0.00 H new ATOM 0 HD23 LEU A 148 -1.432 2.881 -4.572 1.00 0.00 H new ATOM 499 N ASP A 149 -1.279 -1.068 -7.780 1.00 0.00 N ATOM 500 CA ASP A 149 -1.917 -2.150 -8.519 1.00 0.00 C ATOM 501 C ASP A 149 -2.520 -3.177 -7.565 1.00 0.00 C ATOM 502 O ASP A 149 -3.709 -3.482 -7.640 1.00 0.00 O ATOM 503 CB ASP A 149 -0.907 -2.829 -9.447 1.00 0.00 C ATOM 504 CG ASP A 149 -1.524 -3.960 -10.247 1.00 0.00 C ATOM 505 OD1 ASP A 149 -2.041 -3.692 -11.352 1.00 0.00 O ATOM 506 OD2 ASP A 149 -1.486 -5.114 -9.771 1.00 0.00 O ATOM 0 H ASP A 149 -0.270 -1.003 -7.915 1.00 0.00 H new ATOM 0 HA ASP A 149 -2.720 -1.722 -9.120 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -0.492 -2.089 -10.131 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -0.078 -3.217 -8.855 1.00 0.00 H new ATOM 511 N ILE A 150 -1.693 -3.707 -6.670 1.00 0.00 N ATOM 512 CA ILE A 150 -2.152 -4.697 -5.702 1.00 0.00 C ATOM 513 C ILE A 150 -3.307 -4.146 -4.872 1.00 0.00 C ATOM 514 O ILE A 150 -4.246 -4.869 -4.533 1.00 0.00 O ATOM 515 CB ILE A 150 -1.011 -5.132 -4.760 1.00 0.00 C ATOM 516 CG1 ILE A 150 0.165 -5.685 -5.572 1.00 0.00 C ATOM 517 CG2 ILE A 150 -1.512 -6.171 -3.765 1.00 0.00 C ATOM 518 CD1 ILE A 150 1.380 -6.020 -4.735 1.00 0.00 C ATOM 0 H ILE A 150 -0.704 -3.469 -6.595 1.00 0.00 H new ATOM 0 HA ILE A 150 -2.493 -5.566 -6.265 1.00 0.00 H new ATOM 0 HB ILE A 150 -0.666 -4.261 -4.202 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -0.160 -6.582 -6.100 1.00 0.00 H new ATOM 0 HG13 ILE A 150 0.447 -4.954 -6.329 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -0.695 -6.468 -3.107 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -2.320 -5.745 -3.171 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -1.879 -7.044 -4.305 1.00 0.00 H new ATOM 0 HD11 ILE A 150 2.170 -6.406 -5.379 1.00 0.00 H new ATOM 0 HD12 ILE A 150 1.731 -5.122 -4.228 1.00 0.00 H new ATOM 0 HD13 ILE A 150 1.115 -6.775 -3.995 1.00 0.00 H new ATOM 530 N MET A 151 -3.236 -2.855 -4.557 1.00 0.00 N ATOM 531 CA MET A 151 -4.271 -2.202 -3.766 1.00 0.00 C ATOM 532 C MET A 151 -5.577 -2.100 -4.549 1.00 0.00 C ATOM 533 O MET A 151 -6.657 -2.317 -3.997 1.00 0.00 O ATOM 534 CB MET A 151 -3.810 -0.806 -3.338 1.00 0.00 C ATOM 535 CG MET A 151 -4.765 -0.108 -2.381 1.00 0.00 C ATOM 536 SD MET A 151 -4.288 -0.294 -0.650 1.00 0.00 S ATOM 537 CE MET A 151 -4.516 -2.055 -0.411 1.00 0.00 C ATOM 0 H MET A 151 -2.471 -2.242 -4.839 1.00 0.00 H new ATOM 0 HA MET A 151 -4.449 -2.809 -2.878 1.00 0.00 H new ATOM 0 HB2 MET A 151 -2.831 -0.886 -2.865 1.00 0.00 H new ATOM 0 HB3 MET A 151 -3.685 -0.187 -4.226 1.00 0.00 H new ATOM 0 HG2 MET A 151 -4.808 0.953 -2.628 1.00 0.00 H new ATOM 0 HG3 MET A 151 -5.769 -0.509 -2.521 1.00 0.00 H new ATOM 0 HE1 MET A 151 -4.646 -2.264 0.651 1.00 0.00 H new ATOM 0 HE2 MET A 151 -5.400 -2.385 -0.957 1.00 0.00 H new ATOM 0 HE3 MET A 151 -3.641 -2.589 -0.781 1.00 0.00 H new ATOM 547 N LYS A 152 -5.476 -1.770 -5.835 1.00 0.00 N ATOM 548 CA LYS A 152 -6.657 -1.643 -6.682 1.00 0.00 C ATOM 549 C LYS A 152 -7.336 -2.998 -6.857 1.00 0.00 C ATOM 550 O LYS A 152 -8.556 -3.080 -6.993 1.00 0.00 O ATOM 551 CB LYS A 152 -6.284 -1.043 -8.044 1.00 0.00 C ATOM 552 CG LYS A 152 -6.080 -2.073 -9.148 1.00 0.00 C ATOM 553 CD LYS A 152 -5.699 -1.412 -10.463 1.00 0.00 C ATOM 554 CE LYS A 152 -6.864 -0.636 -11.060 1.00 0.00 C ATOM 555 NZ LYS A 152 -6.506 -0.006 -12.361 1.00 0.00 N ATOM 0 H LYS A 152 -4.592 -1.587 -6.310 1.00 0.00 H new ATOM 0 HA LYS A 152 -7.360 -0.967 -6.194 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -7.068 -0.350 -8.350 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -5.369 -0.460 -7.933 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -5.300 -2.775 -8.853 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -6.995 -2.651 -9.282 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -4.857 -0.738 -10.301 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -5.367 -2.172 -11.170 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -7.711 -1.307 -11.203 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -7.183 0.135 -10.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -7.327 0.513 -12.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -5.714 0.654 -12.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -6.226 -0.744 -13.039 1.00 0.00 H new ATOM 569 N GLU A 153 -6.533 -4.059 -6.857 1.00 0.00 N ATOM 570 CA GLU A 153 -7.057 -5.411 -7.001 1.00 0.00 C ATOM 571 C GLU A 153 -7.763 -5.838 -5.720 1.00 0.00 C ATOM 572 O GLU A 153 -8.789 -6.518 -5.760 1.00 0.00 O ATOM 573 CB GLU A 153 -5.932 -6.391 -7.336 1.00 0.00 C ATOM 574 CG GLU A 153 -5.261 -6.115 -8.673 1.00 0.00 C ATOM 575 CD GLU A 153 -6.232 -6.175 -9.836 1.00 0.00 C ATOM 576 OE1 GLU A 153 -6.491 -7.290 -10.337 1.00 0.00 O ATOM 577 OE2 GLU A 153 -6.732 -5.107 -10.247 1.00 0.00 O ATOM 0 H GLU A 153 -5.519 -4.007 -6.759 1.00 0.00 H new ATOM 0 HA GLU A 153 -7.776 -5.419 -7.820 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -5.181 -6.352 -6.547 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -6.334 -7.404 -7.343 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -4.794 -5.130 -8.645 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -4.464 -6.841 -8.832 1.00 0.00 H new ATOM 584 N PHE A 154 -7.202 -5.431 -4.586 1.00 0.00 N ATOM 585 CA PHE A 154 -7.779 -5.757 -3.288 1.00 0.00 C ATOM 586 C PHE A 154 -9.138 -5.085 -3.122 1.00 0.00 C ATOM 587 O PHE A 154 -10.078 -5.681 -2.594 1.00 0.00 O ATOM 588 CB PHE A 154 -6.835 -5.319 -2.166 1.00 0.00 C ATOM 589 CG PHE A 154 -7.394 -5.534 -0.787 1.00 0.00 C ATOM 590 CD1 PHE A 154 -7.385 -6.792 -0.209 1.00 0.00 C ATOM 591 CD2 PHE A 154 -7.928 -4.474 -0.072 1.00 0.00 C ATOM 592 CE1 PHE A 154 -7.898 -6.990 1.059 1.00 0.00 C ATOM 593 CE2 PHE A 154 -8.444 -4.666 1.195 1.00 0.00 C ATOM 594 CZ PHE A 154 -8.428 -5.925 1.763 1.00 0.00 C ATOM 0 H PHE A 154 -6.348 -4.875 -4.540 1.00 0.00 H new ATOM 0 HA PHE A 154 -7.917 -6.837 -3.233 1.00 0.00 H new ATOM 0 HB2 PHE A 154 -5.897 -5.867 -2.258 1.00 0.00 H new ATOM 0 HB3 PHE A 154 -6.600 -4.262 -2.293 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -6.973 -7.628 -0.755 1.00 0.00 H new ATOM 0 HD2 PHE A 154 -7.941 -3.487 -0.510 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -7.885 -7.976 1.499 1.00 0.00 H new ATOM 0 HE2 PHE A 154 -8.860 -3.832 1.741 1.00 0.00 H new ATOM 0 HZ PHE A 154 -8.828 -6.077 2.754 1.00 0.00 H new ATOM 604 N LYS A 155 -9.234 -3.838 -3.577 1.00 0.00 N ATOM 605 CA LYS A 155 -10.477 -3.080 -3.482 1.00 0.00 C ATOM 606 C LYS A 155 -11.526 -3.637 -4.440 1.00 0.00 C ATOM 607 O LYS A 155 -12.721 -3.383 -4.284 1.00 0.00 O ATOM 608 CB LYS A 155 -10.225 -1.602 -3.793 1.00 0.00 C ATOM 609 CG LYS A 155 -9.257 -0.926 -2.833 1.00 0.00 C ATOM 610 CD LYS A 155 -9.839 -0.802 -1.433 1.00 0.00 C ATOM 611 CE LYS A 155 -11.033 0.140 -1.400 1.00 0.00 C ATOM 612 NZ LYS A 155 -11.540 0.345 -0.015 1.00 0.00 N ATOM 0 H LYS A 155 -8.465 -3.332 -4.015 1.00 0.00 H new ATOM 0 HA LYS A 155 -10.851 -3.172 -2.462 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -9.835 -1.516 -4.807 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -11.175 -1.069 -3.770 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -8.329 -1.497 -2.791 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -9.005 0.065 -3.210 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -10.143 -1.786 -1.077 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -9.070 -0.439 -0.751 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -10.749 1.101 -1.829 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -11.831 -0.264 -2.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -12.353 0.993 -0.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -11.835 -0.568 0.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -10.786 0.754 0.574 1.00 0.00 H new ATOM 626 N SER A 156 -11.070 -4.397 -5.430 1.00 0.00 N ATOM 627 CA SER A 156 -11.967 -4.990 -6.415 1.00 0.00 C ATOM 628 C SER A 156 -12.450 -6.361 -5.953 1.00 0.00 C ATOM 629 O SER A 156 -13.053 -7.109 -6.724 1.00 0.00 O ATOM 630 CB SER A 156 -11.266 -5.110 -7.769 1.00 0.00 C ATOM 631 OG SER A 156 -12.140 -5.631 -8.756 1.00 0.00 O ATOM 0 H SER A 156 -10.084 -4.617 -5.572 1.00 0.00 H new ATOM 0 HA SER A 156 -12.833 -4.337 -6.522 1.00 0.00 H new ATOM 0 HB2 SER A 156 -10.903 -4.131 -8.081 1.00 0.00 H new ATOM 0 HB3 SER A 156 -10.394 -5.757 -7.674 1.00 0.00 H new ATOM 0 HG SER A 156 -12.817 -6.196 -8.328 1.00 0.00 H new ATOM 637 N GLN A 157 -12.175 -6.684 -4.691 1.00 0.00 N ATOM 638 CA GLN A 157 -12.582 -7.963 -4.113 1.00 0.00 C ATOM 639 C GLN A 157 -11.937 -9.129 -4.860 1.00 0.00 C ATOM 640 O GLN A 157 -12.343 -10.282 -4.705 1.00 0.00 O ATOM 641 CB GLN A 157 -14.109 -8.095 -4.146 1.00 0.00 C ATOM 642 CG GLN A 157 -14.653 -9.176 -3.226 1.00 0.00 C ATOM 643 CD GLN A 157 -16.160 -9.311 -3.316 1.00 0.00 C ATOM 644 OE1 GLN A 157 -16.678 -10.077 -4.130 1.00 0.00 O ATOM 645 NE2 GLN A 157 -16.873 -8.567 -2.480 1.00 0.00 N ATOM 0 H GLN A 157 -11.670 -6.075 -4.047 1.00 0.00 H new ATOM 0 HA GLN A 157 -12.244 -7.993 -3.077 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -14.553 -7.139 -3.869 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -14.424 -8.309 -5.168 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -14.190 -10.130 -3.479 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -14.373 -8.948 -2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -16.402 -7.946 -1.822 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -17.892 -8.616 -2.496 1.00 0.00 H new ATOM 654 N SER A 158 -10.924 -8.822 -5.663 1.00 0.00 N ATOM 655 CA SER A 158 -10.222 -9.842 -6.435 1.00 0.00 C ATOM 656 C SER A 158 -9.429 -10.771 -5.519 1.00 0.00 C ATOM 657 O SER A 158 -9.676 -11.977 -5.481 1.00 0.00 O ATOM 658 CB SER A 158 -9.285 -9.185 -7.451 1.00 0.00 C ATOM 659 OG SER A 158 -8.593 -10.160 -8.212 1.00 0.00 O ATOM 0 H SER A 158 -10.570 -7.875 -5.797 1.00 0.00 H new ATOM 0 HA SER A 158 -10.965 -10.436 -6.966 1.00 0.00 H new ATOM 0 HB2 SER A 158 -9.859 -8.540 -8.116 1.00 0.00 H new ATOM 0 HB3 SER A 158 -8.568 -8.549 -6.931 1.00 0.00 H new ATOM 0 HG SER A 158 -8.002 -9.715 -8.855 1.00 0.00 H new ATOM 665 N ILE A 159 -8.479 -10.202 -4.783 1.00 0.00 N ATOM 666 CA ILE A 159 -7.651 -10.981 -3.868 1.00 0.00 C ATOM 667 C ILE A 159 -8.216 -10.954 -2.450 1.00 0.00 C ATOM 668 O ILE A 159 -9.193 -10.259 -2.173 1.00 0.00 O ATOM 669 CB ILE A 159 -6.200 -10.459 -3.843 1.00 0.00 C ATOM 670 CG1 ILE A 159 -6.165 -9.001 -3.374 1.00 0.00 C ATOM 671 CG2 ILE A 159 -5.567 -10.599 -5.221 1.00 0.00 C ATOM 672 CD1 ILE A 159 -4.766 -8.437 -3.238 1.00 0.00 C ATOM 0 H ILE A 159 -8.263 -9.205 -4.802 1.00 0.00 H new ATOM 0 HA ILE A 159 -7.655 -12.007 -4.235 1.00 0.00 H new ATOM 0 HB ILE A 159 -5.624 -11.057 -3.137 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -6.727 -8.389 -4.079 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -6.672 -8.926 -2.412 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -4.543 -10.227 -5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -5.563 -11.649 -5.515 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -6.141 -10.022 -5.946 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -4.822 -7.402 -2.902 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -4.206 -9.024 -2.510 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -4.262 -8.479 -4.203 1.00 0.00 H new ATOM 684 N ASP A 160 -7.593 -11.717 -1.555 1.00 0.00 N ATOM 685 CA ASP A 160 -8.031 -11.784 -0.164 1.00 0.00 C ATOM 686 C ASP A 160 -7.142 -10.925 0.729 1.00 0.00 C ATOM 687 O ASP A 160 -6.225 -10.258 0.250 1.00 0.00 O ATOM 688 CB ASP A 160 -8.014 -13.232 0.329 1.00 0.00 C ATOM 689 CG ASP A 160 -8.853 -14.150 -0.539 1.00 0.00 C ATOM 690 OD1 ASP A 160 -10.096 -14.044 -0.488 1.00 0.00 O ATOM 691 OD2 ASP A 160 -8.265 -14.976 -1.269 1.00 0.00 O ATOM 0 H ASP A 160 -6.782 -12.298 -1.769 1.00 0.00 H new ATOM 0 HA ASP A 160 -9.050 -11.400 -0.113 1.00 0.00 H new ATOM 0 HB2 ASP A 160 -6.986 -13.594 0.348 1.00 0.00 H new ATOM 0 HB3 ASP A 160 -8.384 -13.268 1.354 1.00 0.00 H new ATOM 696 N THR A 161 -7.419 -10.945 2.030 1.00 0.00 N ATOM 697 CA THR A 161 -6.640 -10.171 2.988 1.00 0.00 C ATOM 698 C THR A 161 -5.219 -10.728 3.128 1.00 0.00 C ATOM 699 O THR A 161 -4.249 -9.976 3.034 1.00 0.00 O ATOM 700 CB THR A 161 -7.318 -10.129 4.374 1.00 0.00 C ATOM 701 OG1 THR A 161 -8.651 -9.618 4.253 1.00 0.00 O ATOM 702 CG2 THR A 161 -6.527 -9.259 5.340 1.00 0.00 C ATOM 0 H THR A 161 -8.177 -11.489 2.443 1.00 0.00 H new ATOM 0 HA THR A 161 -6.585 -9.154 2.599 1.00 0.00 H new ATOM 0 HB THR A 161 -7.350 -11.146 4.766 1.00 0.00 H new ATOM 0 HG1 THR A 161 -9.074 -9.596 5.137 1.00 0.00 H new ATOM 0 HG21 THR A 161 -7.025 -9.246 6.309 1.00 0.00 H new ATOM 0 HG22 THR A 161 -5.521 -9.664 5.454 1.00 0.00 H new ATOM 0 HG23 THR A 161 -6.467 -8.243 4.949 1.00 0.00 H new ATOM 710 N PRO A 162 -5.062 -12.053 3.349 1.00 0.00 N ATOM 711 CA PRO A 162 -3.736 -12.664 3.489 1.00 0.00 C ATOM 712 C PRO A 162 -2.884 -12.462 2.241 1.00 0.00 C ATOM 713 O PRO A 162 -1.660 -12.354 2.321 1.00 0.00 O ATOM 714 CB PRO A 162 -4.033 -14.155 3.695 1.00 0.00 C ATOM 715 CG PRO A 162 -5.453 -14.211 4.140 1.00 0.00 C ATOM 716 CD PRO A 162 -6.140 -13.053 3.476 1.00 0.00 C ATOM 0 HA PRO A 162 -3.170 -12.220 4.308 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -3.887 -14.717 2.773 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -3.369 -14.590 4.442 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -5.915 -15.156 3.853 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -5.525 -14.138 5.225 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -6.549 -13.330 2.505 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -6.969 -12.678 4.076 1.00 0.00 H new ATOM 724 N GLY A 163 -3.546 -12.406 1.089 1.00 0.00 N ATOM 725 CA GLY A 163 -2.842 -12.216 -0.165 1.00 0.00 C ATOM 726 C GLY A 163 -2.169 -10.861 -0.259 1.00 0.00 C ATOM 727 O GLY A 163 -0.964 -10.778 -0.495 1.00 0.00 O ATOM 0 H GLY A 163 -4.559 -12.489 1.002 1.00 0.00 H new ATOM 0 HA2 GLY A 163 -2.091 -12.998 -0.278 1.00 0.00 H new ATOM 0 HA3 GLY A 163 -3.544 -12.326 -0.991 1.00 0.00 H new ATOM 731 N VAL A 164 -2.946 -9.797 -0.073 1.00 0.00 N ATOM 732 CA VAL A 164 -2.409 -8.442 -0.145 1.00 0.00 C ATOM 733 C VAL A 164 -1.339 -8.211 0.919 1.00 0.00 C ATOM 734 O VAL A 164 -0.332 -7.552 0.662 1.00 0.00 O ATOM 735 CB VAL A 164 -3.519 -7.378 0.002 1.00 0.00 C ATOM 736 CG1 VAL A 164 -4.227 -7.509 1.341 1.00 0.00 C ATOM 737 CG2 VAL A 164 -2.947 -5.978 -0.170 1.00 0.00 C ATOM 0 H VAL A 164 -3.945 -9.847 0.128 1.00 0.00 H new ATOM 0 HA VAL A 164 -1.957 -8.338 -1.131 1.00 0.00 H new ATOM 0 HB VAL A 164 -4.254 -7.547 -0.785 1.00 0.00 H new ATOM 0 HG11 VAL A 164 -5.003 -6.748 1.418 1.00 0.00 H new ATOM 0 HG12 VAL A 164 -4.679 -8.498 1.418 1.00 0.00 H new ATOM 0 HG13 VAL A 164 -3.507 -7.375 2.148 1.00 0.00 H new ATOM 0 HG21 VAL A 164 -3.745 -5.243 -0.063 1.00 0.00 H new ATOM 0 HG22 VAL A 164 -2.186 -5.800 0.589 1.00 0.00 H new ATOM 0 HG23 VAL A 164 -2.500 -5.887 -1.160 1.00 0.00 H new ATOM 747 N ILE A 165 -1.559 -8.755 2.114 1.00 0.00 N ATOM 748 CA ILE A 165 -0.602 -8.603 3.205 1.00 0.00 C ATOM 749 C ILE A 165 0.748 -9.213 2.838 1.00 0.00 C ATOM 750 O ILE A 165 1.794 -8.597 3.042 1.00 0.00 O ATOM 751 CB ILE A 165 -1.114 -9.255 4.506 1.00 0.00 C ATOM 752 CG1 ILE A 165 -2.386 -8.552 4.987 1.00 0.00 C ATOM 753 CG2 ILE A 165 -0.038 -9.211 5.582 1.00 0.00 C ATOM 754 CD1 ILE A 165 -3.051 -9.233 6.165 1.00 0.00 C ATOM 0 H ILE A 165 -2.387 -9.302 2.350 1.00 0.00 H new ATOM 0 HA ILE A 165 -0.483 -7.533 3.372 1.00 0.00 H new ATOM 0 HB ILE A 165 -1.352 -10.299 4.302 1.00 0.00 H new ATOM 0 HG12 ILE A 165 -2.141 -7.526 5.263 1.00 0.00 H new ATOM 0 HG13 ILE A 165 -3.096 -8.499 4.161 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -0.415 -9.675 6.493 1.00 0.00 H new ATOM 0 HG22 ILE A 165 0.843 -9.752 5.238 1.00 0.00 H new ATOM 0 HG23 ILE A 165 0.230 -8.174 5.787 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -3.945 -8.678 6.449 1.00 0.00 H new ATOM 0 HD12 ILE A 165 -3.328 -10.250 5.888 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -2.359 -9.262 7.007 1.00 0.00 H new ATOM 766 N SER A 166 0.716 -10.427 2.297 1.00 0.00 N ATOM 767 CA SER A 166 1.938 -11.122 1.903 1.00 0.00 C ATOM 768 C SER A 166 2.675 -10.357 0.807 1.00 0.00 C ATOM 769 O SER A 166 3.882 -10.133 0.897 1.00 0.00 O ATOM 770 CB SER A 166 1.612 -12.536 1.422 1.00 0.00 C ATOM 771 OG SER A 166 0.978 -13.289 2.440 1.00 0.00 O ATOM 0 H SER A 166 -0.142 -10.950 2.121 1.00 0.00 H new ATOM 0 HA SER A 166 2.588 -11.182 2.776 1.00 0.00 H new ATOM 0 HB2 SER A 166 0.964 -12.485 0.547 1.00 0.00 H new ATOM 0 HB3 SER A 166 2.528 -13.038 1.112 1.00 0.00 H new ATOM 0 HG SER A 166 0.032 -13.039 2.491 1.00 0.00 H new ATOM 777 N ARG A 167 1.937 -9.961 -0.227 1.00 0.00 N ATOM 778 CA ARG A 167 2.514 -9.225 -1.348 1.00 0.00 C ATOM 779 C ARG A 167 3.237 -7.966 -0.875 1.00 0.00 C ATOM 780 O ARG A 167 4.384 -7.724 -1.249 1.00 0.00 O ATOM 781 CB ARG A 167 1.421 -8.853 -2.352 1.00 0.00 C ATOM 782 CG ARG A 167 0.798 -10.056 -3.044 1.00 0.00 C ATOM 783 CD ARG A 167 -0.294 -9.638 -4.015 1.00 0.00 C ATOM 784 NE ARG A 167 -0.889 -10.786 -4.695 1.00 0.00 N ATOM 785 CZ ARG A 167 -1.866 -10.689 -5.593 1.00 0.00 C ATOM 786 NH1 ARG A 167 -2.358 -9.502 -5.921 1.00 0.00 N ATOM 787 NH2 ARG A 167 -2.351 -11.783 -6.165 1.00 0.00 N ATOM 0 H ARG A 167 0.936 -10.138 -0.312 1.00 0.00 H new ATOM 0 HA ARG A 167 3.245 -9.873 -1.832 1.00 0.00 H new ATOM 0 HB2 ARG A 167 0.639 -8.295 -1.836 1.00 0.00 H new ATOM 0 HB3 ARG A 167 1.842 -8.188 -3.106 1.00 0.00 H new ATOM 0 HG2 ARG A 167 1.570 -10.609 -3.579 1.00 0.00 H new ATOM 0 HG3 ARG A 167 0.382 -10.732 -2.297 1.00 0.00 H new ATOM 0 HD2 ARG A 167 -1.070 -9.094 -3.476 1.00 0.00 H new ATOM 0 HD3 ARG A 167 0.121 -8.953 -4.755 1.00 0.00 H new ATOM 0 HE ARG A 167 -0.535 -11.715 -4.468 1.00 0.00 H new ATOM 0 HH11 ARG A 167 -1.987 -8.658 -5.484 1.00 0.00 H new ATOM 0 HH12 ARG A 167 -3.107 -9.433 -6.610 1.00 0.00 H new ATOM 0 HH21 ARG A 167 -1.975 -12.698 -5.916 1.00 0.00 H new ATOM 0 HH22 ARG A 167 -3.100 -11.709 -6.853 1.00 0.00 H new ATOM 801 N VAL A 168 2.560 -7.169 -0.054 1.00 0.00 N ATOM 802 CA VAL A 168 3.142 -5.936 0.467 1.00 0.00 C ATOM 803 C VAL A 168 4.388 -6.223 1.299 1.00 0.00 C ATOM 804 O VAL A 168 5.383 -5.503 1.210 1.00 0.00 O ATOM 805 CB VAL A 168 2.124 -5.154 1.322 1.00 0.00 C ATOM 806 CG1 VAL A 168 2.775 -3.937 1.964 1.00 0.00 C ATOM 807 CG2 VAL A 168 0.929 -4.738 0.479 1.00 0.00 C ATOM 0 H VAL A 168 1.609 -7.354 0.265 1.00 0.00 H new ATOM 0 HA VAL A 168 3.422 -5.327 -0.393 1.00 0.00 H new ATOM 0 HB VAL A 168 1.774 -5.810 2.119 1.00 0.00 H new ATOM 0 HG11 VAL A 168 2.037 -3.402 2.562 1.00 0.00 H new ATOM 0 HG12 VAL A 168 3.596 -4.259 2.605 1.00 0.00 H new ATOM 0 HG13 VAL A 168 3.159 -3.277 1.186 1.00 0.00 H new ATOM 0 HG21 VAL A 168 0.221 -4.187 1.098 1.00 0.00 H new ATOM 0 HG22 VAL A 168 1.265 -4.103 -0.340 1.00 0.00 H new ATOM 0 HG23 VAL A 168 0.443 -5.626 0.074 1.00 0.00 H new ATOM 817 N SER A 169 4.328 -7.279 2.104 1.00 0.00 N ATOM 818 CA SER A 169 5.453 -7.662 2.951 1.00 0.00 C ATOM 819 C SER A 169 6.683 -7.984 2.106 1.00 0.00 C ATOM 820 O SER A 169 7.810 -7.675 2.493 1.00 0.00 O ATOM 821 CB SER A 169 5.081 -8.869 3.812 1.00 0.00 C ATOM 822 OG SER A 169 6.158 -9.255 4.647 1.00 0.00 O ATOM 0 H SER A 169 3.512 -7.885 2.188 1.00 0.00 H new ATOM 0 HA SER A 169 5.691 -6.820 3.602 1.00 0.00 H new ATOM 0 HB2 SER A 169 4.212 -8.628 4.424 1.00 0.00 H new ATOM 0 HB3 SER A 169 4.798 -9.703 3.170 1.00 0.00 H new ATOM 0 HG SER A 169 5.892 -10.028 5.188 1.00 0.00 H new ATOM 828 N GLN A 170 6.457 -8.605 0.951 1.00 0.00 N ATOM 829 CA GLN A 170 7.547 -8.964 0.051 1.00 0.00 C ATOM 830 C GLN A 170 7.976 -7.766 -0.791 1.00 0.00 C ATOM 831 O GLN A 170 9.121 -7.685 -1.235 1.00 0.00 O ATOM 832 CB GLN A 170 7.124 -10.116 -0.865 1.00 0.00 C ATOM 833 CG GLN A 170 6.782 -11.396 -0.118 1.00 0.00 C ATOM 834 CD GLN A 170 6.328 -12.511 -1.041 1.00 0.00 C ATOM 835 OE1 GLN A 170 6.552 -13.690 -0.766 1.00 0.00 O ATOM 836 NE2 GLN A 170 5.681 -12.146 -2.143 1.00 0.00 N ATOM 0 H GLN A 170 5.530 -8.869 0.618 1.00 0.00 H new ATOM 0 HA GLN A 170 8.394 -9.282 0.659 1.00 0.00 H new ATOM 0 HB2 GLN A 170 6.258 -9.805 -1.450 1.00 0.00 H new ATOM 0 HB3 GLN A 170 7.929 -10.322 -1.571 1.00 0.00 H new ATOM 0 HG2 GLN A 170 7.655 -11.728 0.444 1.00 0.00 H new ATOM 0 HG3 GLN A 170 5.996 -11.189 0.608 1.00 0.00 H new ATOM 0 HE21 GLN A 170 5.516 -11.158 -2.334 1.00 0.00 H new ATOM 0 HE22 GLN A 170 5.350 -12.854 -2.798 1.00 0.00 H new ATOM 845 N LEU A 171 7.049 -6.837 -1.004 1.00 0.00 N ATOM 846 CA LEU A 171 7.326 -5.643 -1.797 1.00 0.00 C ATOM 847 C LEU A 171 8.239 -4.682 -1.041 1.00 0.00 C ATOM 848 O LEU A 171 9.090 -4.021 -1.638 1.00 0.00 O ATOM 849 CB LEU A 171 6.017 -4.940 -2.168 1.00 0.00 C ATOM 850 CG LEU A 171 6.169 -3.713 -3.070 1.00 0.00 C ATOM 851 CD1 LEU A 171 6.706 -4.113 -4.435 1.00 0.00 C ATOM 852 CD2 LEU A 171 4.838 -2.989 -3.210 1.00 0.00 C ATOM 0 H LEU A 171 6.098 -6.888 -0.638 1.00 0.00 H new ATOM 0 HA LEU A 171 7.837 -5.953 -2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 171 5.366 -5.659 -2.666 1.00 0.00 H new ATOM 0 HB3 LEU A 171 5.514 -4.636 -1.250 1.00 0.00 H new ATOM 0 HG LEU A 171 6.885 -3.033 -2.608 1.00 0.00 H new ATOM 0 HD11 LEU A 171 6.807 -3.226 -5.061 1.00 0.00 H new ATOM 0 HD12 LEU A 171 7.681 -4.587 -4.318 1.00 0.00 H new ATOM 0 HD13 LEU A 171 6.016 -4.813 -4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 171 4.963 -2.119 -3.854 1.00 0.00 H new ATOM 0 HD22 LEU A 171 4.102 -3.663 -3.649 1.00 0.00 H new ATOM 0 HD23 LEU A 171 4.494 -2.666 -2.227 1.00 0.00 H new ATOM 864 N PHE A 172 8.057 -4.607 0.274 1.00 0.00 N ATOM 865 CA PHE A 172 8.866 -3.725 1.109 1.00 0.00 C ATOM 866 C PHE A 172 9.776 -4.530 2.030 1.00 0.00 C ATOM 867 O PHE A 172 10.131 -4.080 3.120 1.00 0.00 O ATOM 868 CB PHE A 172 7.966 -2.803 1.936 1.00 0.00 C ATOM 869 CG PHE A 172 7.056 -1.945 1.104 1.00 0.00 C ATOM 870 CD1 PHE A 172 7.576 -1.014 0.219 1.00 0.00 C ATOM 871 CD2 PHE A 172 5.680 -2.072 1.206 1.00 0.00 C ATOM 872 CE1 PHE A 172 6.741 -0.225 -0.548 1.00 0.00 C ATOM 873 CE2 PHE A 172 4.840 -1.285 0.441 1.00 0.00 C ATOM 874 CZ PHE A 172 5.371 -0.361 -0.437 1.00 0.00 C ATOM 0 H PHE A 172 7.357 -5.146 0.784 1.00 0.00 H new ATOM 0 HA PHE A 172 9.491 -3.118 0.454 1.00 0.00 H new ATOM 0 HB2 PHE A 172 7.363 -3.409 2.612 1.00 0.00 H new ATOM 0 HB3 PHE A 172 8.591 -2.160 2.556 1.00 0.00 H new ATOM 0 HD1 PHE A 172 8.647 -0.904 0.128 1.00 0.00 H new ATOM 0 HD2 PHE A 172 5.259 -2.794 1.891 1.00 0.00 H new ATOM 0 HE1 PHE A 172 7.159 0.497 -1.234 1.00 0.00 H new ATOM 0 HE2 PHE A 172 3.769 -1.393 0.530 1.00 0.00 H new ATOM 0 HZ PHE A 172 4.716 0.254 -1.036 1.00 0.00 H new ATOM 884 N LYS A 173 10.155 -5.723 1.579 1.00 0.00 N ATOM 885 CA LYS A 173 11.026 -6.599 2.356 1.00 0.00 C ATOM 886 C LYS A 173 12.326 -5.890 2.727 1.00 0.00 C ATOM 887 O LYS A 173 13.222 -5.743 1.896 1.00 0.00 O ATOM 888 CB LYS A 173 11.333 -7.873 1.564 1.00 0.00 C ATOM 889 CG LYS A 173 12.205 -8.870 2.312 1.00 0.00 C ATOM 890 CD LYS A 173 11.484 -9.449 3.520 1.00 0.00 C ATOM 891 CE LYS A 173 12.318 -10.521 4.202 1.00 0.00 C ATOM 892 NZ LYS A 173 13.614 -9.983 4.698 1.00 0.00 N ATOM 0 H LYS A 173 9.871 -6.106 0.677 1.00 0.00 H new ATOM 0 HA LYS A 173 10.506 -6.865 3.277 1.00 0.00 H new ATOM 0 HB2 LYS A 173 10.394 -8.357 1.295 1.00 0.00 H new ATOM 0 HB3 LYS A 173 11.829 -7.599 0.633 1.00 0.00 H new ATOM 0 HG2 LYS A 173 12.495 -9.677 1.639 1.00 0.00 H new ATOM 0 HG3 LYS A 173 13.123 -8.380 2.636 1.00 0.00 H new ATOM 0 HD2 LYS A 173 11.262 -8.652 4.230 1.00 0.00 H new ATOM 0 HD3 LYS A 173 10.529 -9.872 3.208 1.00 0.00 H new ATOM 0 HE2 LYS A 173 11.757 -10.942 5.036 1.00 0.00 H new ATOM 0 HE3 LYS A 173 12.507 -11.335 3.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 173 14.085 -10.700 5.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 173 14.223 -9.744 3.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 173 13.441 -9.128 5.265 1.00 0.00 H new ATOM 906 N GLY A 174 12.418 -5.450 3.979 1.00 0.00 N ATOM 907 CA GLY A 174 13.611 -4.760 4.438 1.00 0.00 C ATOM 908 C GLY A 174 13.319 -3.360 4.942 1.00 0.00 C ATOM 909 O GLY A 174 14.233 -2.554 5.115 1.00 0.00 O ATOM 0 H GLY A 174 11.688 -5.559 4.683 1.00 0.00 H new ATOM 0 HA2 GLY A 174 14.077 -5.339 5.235 1.00 0.00 H new ATOM 0 HA3 GLY A 174 14.331 -4.705 3.622 1.00 0.00 H new ATOM 913 N HIS A 175 12.043 -3.071 5.179 1.00 0.00 N ATOM 914 CA HIS A 175 11.634 -1.758 5.668 1.00 0.00 C ATOM 915 C HIS A 175 10.589 -1.893 6.776 1.00 0.00 C ATOM 916 O HIS A 175 9.390 -1.937 6.503 1.00 0.00 O ATOM 917 CB HIS A 175 11.072 -0.914 4.521 1.00 0.00 C ATOM 918 CG HIS A 175 12.052 -0.690 3.412 1.00 0.00 C ATOM 919 ND1 HIS A 175 12.948 0.358 3.398 1.00 0.00 N ATOM 920 CD2 HIS A 175 12.276 -1.387 2.272 1.00 0.00 C ATOM 921 CE1 HIS A 175 13.680 0.296 2.300 1.00 0.00 C ATOM 922 NE2 HIS A 175 13.292 -0.754 1.601 1.00 0.00 N ATOM 0 H HIS A 175 11.275 -3.728 5.041 1.00 0.00 H new ATOM 0 HA HIS A 175 12.513 -1.260 6.078 1.00 0.00 H new ATOM 0 HB2 HIS A 175 10.186 -1.405 4.119 1.00 0.00 H new ATOM 0 HB3 HIS A 175 10.752 0.051 4.913 1.00 0.00 H new ATOM 0 HD2 HIS A 175 11.752 -2.275 1.951 1.00 0.00 H new ATOM 0 HE1 HIS A 175 14.462 0.987 2.022 1.00 0.00 H new ATOM 0 HE2 HIS A 175 13.684 -1.048 0.706 1.00 0.00 H new ATOM 931 N PRO A 176 11.035 -1.969 8.048 1.00 0.00 N ATOM 932 CA PRO A 176 10.129 -2.103 9.196 1.00 0.00 C ATOM 933 C PRO A 176 9.093 -0.984 9.262 1.00 0.00 C ATOM 934 O PRO A 176 8.026 -1.149 9.852 1.00 0.00 O ATOM 935 CB PRO A 176 11.065 -2.028 10.407 1.00 0.00 C ATOM 936 CG PRO A 176 12.403 -2.419 9.884 1.00 0.00 C ATOM 937 CD PRO A 176 12.450 -1.934 8.465 1.00 0.00 C ATOM 0 HA PRO A 176 9.550 -3.025 9.141 1.00 0.00 H new ATOM 0 HB2 PRO A 176 11.084 -1.023 10.829 1.00 0.00 H new ATOM 0 HB3 PRO A 176 10.739 -2.701 11.200 1.00 0.00 H new ATOM 0 HG2 PRO A 176 13.200 -1.970 10.476 1.00 0.00 H new ATOM 0 HG3 PRO A 176 12.540 -3.499 9.932 1.00 0.00 H new ATOM 0 HD2 PRO A 176 12.865 -0.928 8.397 1.00 0.00 H new ATOM 0 HD3 PRO A 176 13.070 -2.577 7.840 1.00 0.00 H new ATOM 945 N ASP A 177 9.412 0.152 8.653 1.00 0.00 N ATOM 946 CA ASP A 177 8.508 1.298 8.651 1.00 0.00 C ATOM 947 C ASP A 177 7.314 1.060 7.730 1.00 0.00 C ATOM 948 O ASP A 177 6.161 1.133 8.160 1.00 0.00 O ATOM 949 CB ASP A 177 9.257 2.561 8.220 1.00 0.00 C ATOM 950 CG ASP A 177 10.420 2.884 9.139 1.00 0.00 C ATOM 951 OD1 ASP A 177 11.510 2.307 8.943 1.00 0.00 O ATOM 952 OD2 ASP A 177 10.241 3.714 10.055 1.00 0.00 O ATOM 0 H ASP A 177 10.289 0.305 8.155 1.00 0.00 H new ATOM 0 HA ASP A 177 8.133 1.431 9.666 1.00 0.00 H new ATOM 0 HB2 ASP A 177 9.626 2.432 7.203 1.00 0.00 H new ATOM 0 HB3 ASP A 177 8.565 3.403 8.204 1.00 0.00 H new ATOM 957 N LEU A 178 7.597 0.772 6.463 1.00 0.00 N ATOM 958 CA LEU A 178 6.548 0.530 5.477 1.00 0.00 C ATOM 959 C LEU A 178 5.657 -0.643 5.881 1.00 0.00 C ATOM 960 O LEU A 178 4.431 -0.543 5.841 1.00 0.00 O ATOM 961 CB LEU A 178 7.167 0.258 4.103 1.00 0.00 C ATOM 962 CG LEU A 178 7.649 1.495 3.334 1.00 0.00 C ATOM 963 CD1 LEU A 178 6.490 2.439 3.048 1.00 0.00 C ATOM 964 CD2 LEU A 178 8.751 2.217 4.097 1.00 0.00 C ATOM 0 H LEU A 178 8.545 0.700 6.094 1.00 0.00 H new ATOM 0 HA LEU A 178 5.929 1.426 5.428 1.00 0.00 H new ATOM 0 HB2 LEU A 178 8.012 -0.418 4.233 1.00 0.00 H new ATOM 0 HB3 LEU A 178 6.432 -0.264 3.491 1.00 0.00 H new ATOM 0 HG LEU A 178 8.060 1.158 2.382 1.00 0.00 H new ATOM 0 HD11 LEU A 178 6.855 3.309 2.502 1.00 0.00 H new ATOM 0 HD12 LEU A 178 5.740 1.923 2.449 1.00 0.00 H new ATOM 0 HD13 LEU A 178 6.043 2.762 3.988 1.00 0.00 H new ATOM 0 HD21 LEU A 178 9.075 3.090 3.530 1.00 0.00 H new ATOM 0 HD22 LEU A 178 8.373 2.535 5.068 1.00 0.00 H new ATOM 0 HD23 LEU A 178 9.596 1.544 4.240 1.00 0.00 H new ATOM 976 N ILE A 179 6.279 -1.754 6.269 1.00 0.00 N ATOM 977 CA ILE A 179 5.536 -2.946 6.665 1.00 0.00 C ATOM 978 C ILE A 179 4.556 -2.648 7.797 1.00 0.00 C ATOM 979 O ILE A 179 3.356 -2.884 7.663 1.00 0.00 O ATOM 980 CB ILE A 179 6.484 -4.083 7.100 1.00 0.00 C ATOM 981 CG1 ILE A 179 7.467 -4.409 5.972 1.00 0.00 C ATOM 982 CG2 ILE A 179 5.684 -5.319 7.492 1.00 0.00 C ATOM 983 CD1 ILE A 179 8.474 -5.480 6.331 1.00 0.00 C ATOM 0 H ILE A 179 7.293 -1.853 6.317 1.00 0.00 H new ATOM 0 HA ILE A 179 4.974 -3.267 5.788 1.00 0.00 H new ATOM 0 HB ILE A 179 7.053 -3.755 7.970 1.00 0.00 H new ATOM 0 HG12 ILE A 179 6.906 -4.731 5.095 1.00 0.00 H new ATOM 0 HG13 ILE A 179 8.001 -3.500 5.693 1.00 0.00 H new ATOM 0 HG21 ILE A 179 6.366 -6.113 7.796 1.00 0.00 H new ATOM 0 HG22 ILE A 179 5.019 -5.074 8.320 1.00 0.00 H new ATOM 0 HG23 ILE A 179 5.093 -5.655 6.640 1.00 0.00 H new ATOM 0 HD11 ILE A 179 9.136 -5.656 5.483 1.00 0.00 H new ATOM 0 HD12 ILE A 179 9.062 -5.153 7.189 1.00 0.00 H new ATOM 0 HD13 ILE A 179 7.950 -6.403 6.581 1.00 0.00 H new ATOM 995 N MET A 180 5.071 -2.128 8.908 1.00 0.00 N ATOM 996 CA MET A 180 4.228 -1.801 10.056 1.00 0.00 C ATOM 997 C MET A 180 3.191 -0.745 9.687 1.00 0.00 C ATOM 998 O MET A 180 2.117 -0.682 10.284 1.00 0.00 O ATOM 999 CB MET A 180 5.082 -1.303 11.225 1.00 0.00 C ATOM 1000 CG MET A 180 6.053 -2.343 11.761 1.00 0.00 C ATOM 1001 SD MET A 180 7.088 -1.702 13.091 1.00 0.00 S ATOM 1002 CE MET A 180 8.141 -3.115 13.412 1.00 0.00 C ATOM 0 H MET A 180 6.062 -1.925 9.038 1.00 0.00 H new ATOM 0 HA MET A 180 3.707 -2.710 10.358 1.00 0.00 H new ATOM 0 HB2 MET A 180 5.644 -0.426 10.905 1.00 0.00 H new ATOM 0 HB3 MET A 180 4.424 -0.983 12.033 1.00 0.00 H new ATOM 0 HG2 MET A 180 5.493 -3.205 12.124 1.00 0.00 H new ATOM 0 HG3 MET A 180 6.688 -2.695 10.948 1.00 0.00 H new ATOM 0 HE1 MET A 180 8.839 -2.874 14.214 1.00 0.00 H new ATOM 0 HE2 MET A 180 7.528 -3.966 13.709 1.00 0.00 H new ATOM 0 HE3 MET A 180 8.698 -3.366 12.509 1.00 0.00 H new ATOM 1012 N GLY A 181 3.520 0.081 8.698 1.00 0.00 N ATOM 1013 CA GLY A 181 2.608 1.125 8.267 1.00 0.00 C ATOM 1014 C GLY A 181 1.349 0.576 7.624 1.00 0.00 C ATOM 1015 O GLY A 181 0.238 0.956 7.999 1.00 0.00 O ATOM 0 H GLY A 181 4.402 0.046 8.187 1.00 0.00 H new ATOM 0 HA2 GLY A 181 2.334 1.739 9.125 1.00 0.00 H new ATOM 0 HA3 GLY A 181 3.118 1.777 7.558 1.00 0.00 H new ATOM 1019 N PHE A 182 1.519 -0.319 6.655 1.00 0.00 N ATOM 1020 CA PHE A 182 0.384 -0.916 5.957 1.00 0.00 C ATOM 1021 C PHE A 182 -0.330 -1.932 6.844 1.00 0.00 C ATOM 1022 O PHE A 182 -1.534 -2.149 6.707 1.00 0.00 O ATOM 1023 CB PHE A 182 0.848 -1.586 4.662 1.00 0.00 C ATOM 1024 CG PHE A 182 -0.277 -2.148 3.840 1.00 0.00 C ATOM 1025 CD1 PHE A 182 -1.032 -1.323 3.021 1.00 0.00 C ATOM 1026 CD2 PHE A 182 -0.580 -3.499 3.885 1.00 0.00 C ATOM 1027 CE1 PHE A 182 -2.067 -1.836 2.262 1.00 0.00 C ATOM 1028 CE2 PHE A 182 -1.615 -4.017 3.129 1.00 0.00 C ATOM 1029 CZ PHE A 182 -2.358 -3.185 2.316 1.00 0.00 C ATOM 0 H PHE A 182 2.431 -0.647 6.335 1.00 0.00 H new ATOM 0 HA PHE A 182 -0.319 -0.119 5.713 1.00 0.00 H new ATOM 0 HB2 PHE A 182 1.397 -0.859 4.063 1.00 0.00 H new ATOM 0 HB3 PHE A 182 1.544 -2.388 4.907 1.00 0.00 H new ATOM 0 HD1 PHE A 182 -0.809 -0.267 2.975 1.00 0.00 H new ATOM 0 HD2 PHE A 182 -0.001 -4.155 4.518 1.00 0.00 H new ATOM 0 HE1 PHE A 182 -2.647 -1.183 1.627 1.00 0.00 H new ATOM 0 HE2 PHE A 182 -1.842 -5.072 3.174 1.00 0.00 H new ATOM 0 HZ PHE A 182 -3.166 -3.588 1.723 1.00 0.00 H new ATOM 1039 N ASN A 183 0.420 -2.553 7.749 1.00 0.00 N ATOM 1040 CA ASN A 183 -0.140 -3.547 8.657 1.00 0.00 C ATOM 1041 C ASN A 183 -1.266 -2.948 9.494 1.00 0.00 C ATOM 1042 O ASN A 183 -2.333 -3.546 9.636 1.00 0.00 O ATOM 1043 CB ASN A 183 0.951 -4.104 9.572 1.00 0.00 C ATOM 1044 CG ASN A 183 0.423 -5.142 10.544 1.00 0.00 C ATOM 1045 OD1 ASN A 183 0.921 -5.271 11.662 1.00 0.00 O ATOM 1046 ND2 ASN A 183 -0.589 -5.892 10.122 1.00 0.00 N ATOM 0 H ASN A 183 1.418 -2.385 7.873 1.00 0.00 H new ATOM 0 HA ASN A 183 -0.551 -4.359 8.057 1.00 0.00 H new ATOM 0 HB2 ASN A 183 1.738 -4.549 8.963 1.00 0.00 H new ATOM 0 HB3 ASN A 183 1.404 -3.285 10.131 1.00 0.00 H new ATOM 0 HD21 ASN A 183 -0.983 -6.608 10.733 1.00 0.00 H new ATOM 0 HD22 ASN A 183 -0.972 -5.752 9.187 1.00 0.00 H new ATOM 1053 N THR A 184 -1.022 -1.763 10.045 1.00 0.00 N ATOM 1054 CA THR A 184 -2.014 -1.082 10.867 1.00 0.00 C ATOM 1055 C THR A 184 -2.943 -0.226 10.014 1.00 0.00 C ATOM 1056 O THR A 184 -3.872 0.399 10.527 1.00 0.00 O ATOM 1057 CB THR A 184 -1.348 -0.188 11.929 1.00 0.00 C ATOM 1058 OG1 THR A 184 -0.494 0.772 11.297 1.00 0.00 O ATOM 1059 CG2 THR A 184 -0.541 -1.023 12.912 1.00 0.00 C ATOM 0 H THR A 184 -0.144 -1.255 9.936 1.00 0.00 H new ATOM 0 HA THR A 184 -2.594 -1.858 11.366 1.00 0.00 H new ATOM 0 HB THR A 184 -2.134 0.331 12.478 1.00 0.00 H new ATOM 0 HG1 THR A 184 0.347 0.341 11.038 1.00 0.00 H new ATOM 0 HG21 THR A 184 -0.080 -0.369 13.652 1.00 0.00 H new ATOM 0 HG22 THR A 184 -1.200 -1.732 13.414 1.00 0.00 H new ATOM 0 HG23 THR A 184 0.236 -1.567 12.375 1.00 0.00 H new ATOM 1067 N PHE A 185 -2.688 -0.201 8.709 1.00 0.00 N ATOM 1068 CA PHE A 185 -3.507 0.579 7.788 1.00 0.00 C ATOM 1069 C PHE A 185 -4.805 -0.154 7.466 1.00 0.00 C ATOM 1070 O PHE A 185 -5.796 0.462 7.073 1.00 0.00 O ATOM 1071 CB PHE A 185 -2.730 0.868 6.500 1.00 0.00 C ATOM 1072 CG PHE A 185 -3.439 1.811 5.570 1.00 0.00 C ATOM 1073 CD1 PHE A 185 -3.345 3.183 5.747 1.00 0.00 C ATOM 1074 CD2 PHE A 185 -4.201 1.326 4.519 1.00 0.00 C ATOM 1075 CE1 PHE A 185 -3.997 4.052 4.893 1.00 0.00 C ATOM 1076 CE2 PHE A 185 -4.855 2.191 3.662 1.00 0.00 C ATOM 1077 CZ PHE A 185 -4.754 3.555 3.849 1.00 0.00 C ATOM 0 H PHE A 185 -1.923 -0.710 8.267 1.00 0.00 H new ATOM 0 HA PHE A 185 -3.756 1.525 8.269 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -1.758 1.288 6.758 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -2.544 -0.071 5.979 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -2.755 3.577 6.562 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -4.285 0.260 4.368 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -3.915 5.119 5.041 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -5.445 1.800 2.846 1.00 0.00 H new ATOM 0 HZ PHE A 185 -5.265 4.232 3.181 1.00 0.00 H new ATOM 1087 N LEU A 186 -4.791 -1.473 7.637 1.00 0.00 N ATOM 1088 CA LEU A 186 -5.967 -2.294 7.369 1.00 0.00 C ATOM 1089 C LEU A 186 -7.109 -1.934 8.319 1.00 0.00 C ATOM 1090 O LEU A 186 -6.872 -1.571 9.471 1.00 0.00 O ATOM 1091 CB LEU A 186 -5.624 -3.780 7.517 1.00 0.00 C ATOM 1092 CG LEU A 186 -4.560 -4.305 6.551 1.00 0.00 C ATOM 1093 CD1 LEU A 186 -4.177 -5.732 6.909 1.00 0.00 C ATOM 1094 CD2 LEU A 186 -5.059 -4.231 5.115 1.00 0.00 C ATOM 0 H LEU A 186 -3.977 -1.996 7.960 1.00 0.00 H new ATOM 0 HA LEU A 186 -6.288 -2.099 6.346 1.00 0.00 H new ATOM 0 HB2 LEU A 186 -5.284 -3.958 8.537 1.00 0.00 H new ATOM 0 HB3 LEU A 186 -6.535 -4.362 7.379 1.00 0.00 H new ATOM 0 HG LEU A 186 -3.674 -3.677 6.639 1.00 0.00 H new ATOM 0 HD11 LEU A 186 -3.419 -6.091 6.213 1.00 0.00 H new ATOM 0 HD12 LEU A 186 -3.779 -5.758 7.923 1.00 0.00 H new ATOM 0 HD13 LEU A 186 -5.058 -6.371 6.848 1.00 0.00 H new ATOM 0 HD21 LEU A 186 -4.289 -4.609 4.442 1.00 0.00 H new ATOM 0 HD22 LEU A 186 -5.960 -4.836 5.011 1.00 0.00 H new ATOM 0 HD23 LEU A 186 -5.286 -3.195 4.862 1.00 0.00 H new ATOM 1106 N PRO A 187 -8.369 -2.031 7.850 1.00 0.00 N ATOM 1107 CA PRO A 187 -9.538 -1.715 8.672 1.00 0.00 C ATOM 1108 C PRO A 187 -9.891 -2.849 9.635 1.00 0.00 C ATOM 1109 O PRO A 187 -9.593 -4.013 9.365 1.00 0.00 O ATOM 1110 CB PRO A 187 -10.645 -1.536 7.635 1.00 0.00 C ATOM 1111 CG PRO A 187 -10.260 -2.451 6.525 1.00 0.00 C ATOM 1112 CD PRO A 187 -8.753 -2.447 6.484 1.00 0.00 C ATOM 0 HA PRO A 187 -9.375 -0.843 9.306 1.00 0.00 H new ATOM 0 HB2 PRO A 187 -11.621 -1.797 8.045 1.00 0.00 H new ATOM 0 HB3 PRO A 187 -10.708 -0.502 7.295 1.00 0.00 H new ATOM 0 HG2 PRO A 187 -10.643 -3.457 6.699 1.00 0.00 H new ATOM 0 HG3 PRO A 187 -10.677 -2.111 5.577 1.00 0.00 H new ATOM 0 HD2 PRO A 187 -8.356 -3.432 6.238 1.00 0.00 H new ATOM 0 HD3 PRO A 187 -8.374 -1.754 5.733 1.00 0.00 H new ATOM 1120 N PRO A 188 -10.529 -2.526 10.777 1.00 0.00 N ATOM 1121 CA PRO A 188 -10.920 -3.526 11.771 1.00 0.00 C ATOM 1122 C PRO A 188 -12.204 -4.254 11.387 1.00 0.00 C ATOM 1123 O PRO A 188 -13.054 -3.704 10.687 1.00 0.00 O ATOM 1124 CB PRO A 188 -11.139 -2.687 13.027 1.00 0.00 C ATOM 1125 CG PRO A 188 -11.611 -1.371 12.512 1.00 0.00 C ATOM 1126 CD PRO A 188 -10.914 -1.160 11.192 1.00 0.00 C ATOM 0 HA PRO A 188 -10.173 -4.312 11.883 1.00 0.00 H new ATOM 0 HB2 PRO A 188 -11.876 -3.144 13.687 1.00 0.00 H new ATOM 0 HB3 PRO A 188 -10.218 -2.583 13.601 1.00 0.00 H new ATOM 0 HG2 PRO A 188 -12.694 -1.369 12.385 1.00 0.00 H new ATOM 0 HG3 PRO A 188 -11.370 -0.570 13.211 1.00 0.00 H new ATOM 0 HD2 PRO A 188 -11.573 -0.690 10.462 1.00 0.00 H new ATOM 0 HD3 PRO A 188 -10.043 -0.513 11.298 1.00 0.00 H new ATOM 1134 N GLY A 189 -12.338 -5.494 11.848 1.00 0.00 N ATOM 1135 CA GLY A 189 -13.523 -6.276 11.544 1.00 0.00 C ATOM 1136 C GLY A 189 -13.298 -7.252 10.406 1.00 0.00 C ATOM 1137 O GLY A 189 -12.147 -7.701 10.227 1.00 0.00 O ATOM 1138 OXT GLY A 189 -14.275 -7.568 9.694 1.00 0.00 O ATOM 0 H GLY A 189 -11.647 -5.971 12.427 1.00 0.00 H new ATOM 0 HA2 GLY A 189 -13.830 -6.825 12.434 1.00 0.00 H new ATOM 0 HA3 GLY A 189 -14.341 -5.604 11.286 1.00 0.00 H new TER 1142 GLY A 189