USER MOD reduce.3.24.130724 H: found=0, std=0, add=598, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 600 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 6 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 66 MET CE :methyl 167:sc= -1.03 (180deg=-2.08!) USER MOD Set 1.3: A 70 GLN : amide:sc= -6.33! C(o=-7.4!,f=-27!) USER MOD Single : A 3 GLN : amide:sc= -0.75 K(o=-0.75,f=-2.9!) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -0.86 K(o=-0.86,f=-5.4!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot 145:sc= -0.4 USER MOD Single : A 25 HIS : no HE2:sc= -1.55! C(o=-1.5!,f=-5!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 146:sc= -2.16! (180deg=-2.84!) USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc= -2.01! K(o=-2!,f=-0.11) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -151:sc= -3.94! (180deg=-4.87!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 58:sc= -1.17! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 24:sc= 0.439 USER MOD Single : A 105 LYS NZ :NH3+ -160:sc= -0.0835 (180deg=-0.636) USER MOD ----------------------------------------------------------------- ATOM 10 N VAL A 2 -52.255 -31.856 59.853 1.00 0.00 N ATOM 11 CA VAL A 2 -51.984 -32.798 60.993 1.00 0.00 C ATOM 12 C VAL A 2 -52.805 -34.053 60.719 1.00 0.00 C ATOM 13 O VAL A 2 -53.871 -33.974 60.143 1.00 0.00 O ATOM 14 CB VAL A 2 -52.452 -32.166 62.318 1.00 0.00 C ATOM 15 CG1 VAL A 2 -53.955 -31.809 62.225 1.00 0.00 C ATOM 16 CG2 VAL A 2 -52.293 -33.173 63.485 1.00 0.00 C ATOM 0 HA VAL A 2 -50.920 -33.020 61.074 1.00 0.00 H new ATOM 0 HB VAL A 2 -51.847 -31.277 62.497 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -54.282 -31.362 63.164 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -54.111 -31.100 61.412 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -54.533 -32.713 62.033 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -52.628 -32.710 64.413 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -52.894 -34.060 63.284 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -51.245 -33.458 63.579 1.00 0.00 H new ATOM 26 N GLN A 3 -52.309 -35.189 61.128 1.00 0.00 N ATOM 27 CA GLN A 3 -53.060 -36.467 60.907 1.00 0.00 C ATOM 28 C GLN A 3 -53.275 -37.073 62.268 1.00 0.00 C ATOM 29 O GLN A 3 -52.536 -36.839 63.205 1.00 0.00 O ATOM 30 CB GLN A 3 -52.252 -37.442 60.049 1.00 0.00 C ATOM 31 CG GLN A 3 -52.301 -37.016 58.585 1.00 0.00 C ATOM 32 CD GLN A 3 -53.661 -37.353 57.957 1.00 0.00 C ATOM 33 OE1 GLN A 3 -54.685 -36.780 58.274 1.00 0.00 O ATOM 34 NE2 GLN A 3 -53.711 -38.291 57.051 1.00 0.00 N ATOM 0 H GLN A 3 -51.414 -35.292 61.607 1.00 0.00 H new ATOM 0 HA GLN A 3 -53.998 -36.269 60.388 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -51.218 -37.471 60.393 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -52.652 -38.450 60.156 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -52.117 -35.944 58.508 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -51.507 -37.516 58.031 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -52.859 -38.780 56.776 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -54.602 -38.535 56.618 1.00 0.00 H new ATOM 43 N VAL A 4 -54.313 -37.856 62.316 1.00 0.00 N ATOM 44 CA VAL A 4 -54.713 -38.556 63.575 1.00 0.00 C ATOM 45 C VAL A 4 -54.855 -40.051 63.298 1.00 0.00 C ATOM 46 O VAL A 4 -55.719 -40.473 62.557 1.00 0.00 O ATOM 47 CB VAL A 4 -56.050 -38.012 64.039 1.00 0.00 C ATOM 48 CG1 VAL A 4 -56.385 -38.570 65.428 1.00 0.00 C ATOM 49 CG2 VAL A 4 -55.996 -36.491 64.077 1.00 0.00 C ATOM 0 H VAL A 4 -54.918 -38.047 61.518 1.00 0.00 H new ATOM 0 HA VAL A 4 -53.956 -38.393 64.343 1.00 0.00 H new ATOM 0 HB VAL A 4 -56.830 -38.320 63.342 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -57.347 -38.176 65.756 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -56.436 -39.658 65.381 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -55.611 -38.274 66.136 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -56.958 -36.101 64.411 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -55.216 -36.172 64.768 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -55.776 -36.110 63.080 1.00 0.00 H new ATOM 59 N GLU A 5 -53.997 -40.820 63.901 1.00 0.00 N ATOM 60 CA GLU A 5 -54.023 -42.311 63.722 1.00 0.00 C ATOM 61 C GLU A 5 -54.294 -42.896 65.103 1.00 0.00 C ATOM 62 O GLU A 5 -53.412 -42.986 65.934 1.00 0.00 O ATOM 63 CB GLU A 5 -52.672 -42.791 63.194 1.00 0.00 C ATOM 64 CG GLU A 5 -52.755 -44.312 63.017 1.00 0.00 C ATOM 65 CD GLU A 5 -51.456 -44.826 62.396 1.00 0.00 C ATOM 66 OE1 GLU A 5 -51.150 -44.349 61.315 1.00 0.00 O ATOM 67 OE2 GLU A 5 -50.845 -45.667 63.036 1.00 0.00 O ATOM 0 H GLU A 5 -53.263 -40.481 64.523 1.00 0.00 H new ATOM 0 HA GLU A 5 -54.785 -42.621 63.007 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -52.438 -42.308 62.245 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -51.875 -42.530 63.890 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -52.924 -44.792 63.981 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -53.601 -44.569 62.380 1.00 0.00 H new ATOM 74 N THR A 6 -55.521 -43.284 65.317 1.00 0.00 N ATOM 75 CA THR A 6 -55.873 -43.858 66.642 1.00 0.00 C ATOM 76 C THR A 6 -55.265 -45.233 66.893 1.00 0.00 C ATOM 77 O THR A 6 -55.028 -46.000 65.980 1.00 0.00 O ATOM 78 CB THR A 6 -57.396 -43.933 66.728 1.00 0.00 C ATOM 79 OG1 THR A 6 -57.820 -42.606 66.452 1.00 0.00 O ATOM 80 CG2 THR A 6 -57.843 -44.152 68.174 1.00 0.00 C ATOM 0 H THR A 6 -56.284 -43.229 64.642 1.00 0.00 H new ATOM 0 HA THR A 6 -55.458 -43.209 67.413 1.00 0.00 H new ATOM 0 HB THR A 6 -57.777 -44.720 66.077 1.00 0.00 H new ATOM 0 HG1 THR A 6 -58.798 -42.562 66.485 1.00 0.00 H new ATOM 0 HG21 THR A 6 -58.931 -44.203 68.215 1.00 0.00 H new ATOM 0 HG22 THR A 6 -57.422 -45.085 68.548 1.00 0.00 H new ATOM 0 HG23 THR A 6 -57.495 -43.324 68.792 1.00 0.00 H new ATOM 88 N ILE A 7 -55.024 -45.508 68.153 1.00 0.00 N ATOM 89 CA ILE A 7 -54.431 -46.820 68.564 1.00 0.00 C ATOM 90 C ILE A 7 -55.540 -47.553 69.303 1.00 0.00 C ATOM 91 O ILE A 7 -55.896 -48.664 68.962 1.00 0.00 O ATOM 92 CB ILE A 7 -53.234 -46.565 69.496 1.00 0.00 C ATOM 93 CG1 ILE A 7 -52.168 -45.770 68.704 1.00 0.00 C ATOM 94 CG2 ILE A 7 -52.662 -47.940 69.914 1.00 0.00 C ATOM 95 CD1 ILE A 7 -51.136 -45.146 69.661 1.00 0.00 C ATOM 0 H ILE A 7 -55.216 -44.869 68.925 1.00 0.00 H new ATOM 0 HA ILE A 7 -54.071 -47.402 67.715 1.00 0.00 H new ATOM 0 HB ILE A 7 -53.527 -46.000 70.381 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -51.665 -46.430 67.998 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -52.651 -44.987 68.120 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -51.809 -47.793 70.577 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -53.431 -48.511 70.433 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -52.342 -48.486 69.027 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -50.395 -44.591 69.085 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -51.641 -44.469 70.350 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -50.640 -45.935 70.226 1.00 0.00 H new ATOM 107 N SER A 8 -56.069 -46.911 70.313 1.00 0.00 N ATOM 108 CA SER A 8 -57.174 -47.537 71.118 1.00 0.00 C ATOM 109 C SER A 8 -58.339 -46.539 71.242 1.00 0.00 C ATOM 110 O SER A 8 -58.355 -45.744 72.164 1.00 0.00 O ATOM 111 CB SER A 8 -56.653 -47.893 72.506 1.00 0.00 C ATOM 112 OG SER A 8 -57.750 -48.571 73.101 1.00 0.00 O ATOM 0 H SER A 8 -55.787 -45.980 70.619 1.00 0.00 H new ATOM 0 HA SER A 8 -57.522 -48.443 70.622 1.00 0.00 H new ATOM 0 HB2 SER A 8 -55.768 -48.527 72.453 1.00 0.00 H new ATOM 0 HB3 SER A 8 -56.374 -47.004 73.072 1.00 0.00 H new ATOM 0 HG SER A 8 -57.510 -48.846 74.010 1.00 0.00 H new ATOM 118 N PRO A 9 -59.279 -46.579 70.325 1.00 0.00 N ATOM 119 CA PRO A 9 -60.499 -45.744 70.409 1.00 0.00 C ATOM 120 C PRO A 9 -61.017 -45.606 71.840 1.00 0.00 C ATOM 121 O PRO A 9 -60.624 -46.334 72.730 1.00 0.00 O ATOM 122 CB PRO A 9 -61.458 -46.441 69.452 1.00 0.00 C ATOM 123 CG PRO A 9 -60.497 -46.881 68.322 1.00 0.00 C ATOM 124 CD PRO A 9 -59.286 -47.432 69.101 1.00 0.00 C ATOM 0 HA PRO A 9 -60.337 -44.703 70.128 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -61.959 -47.289 69.918 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -62.237 -45.770 69.090 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -60.946 -47.640 67.682 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -60.219 -46.046 67.679 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -59.404 -48.488 69.342 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -58.360 -47.337 68.534 1.00 0.00 H new ATOM 132 N GLY A 10 -61.900 -44.659 72.020 1.00 0.00 N ATOM 133 CA GLY A 10 -62.509 -44.399 73.366 1.00 0.00 C ATOM 134 C GLY A 10 -64.013 -44.609 73.205 1.00 0.00 C ATOM 135 O GLY A 10 -64.458 -45.713 72.957 1.00 0.00 O ATOM 0 H GLY A 10 -62.233 -44.042 71.280 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -62.100 -45.077 74.115 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -62.292 -43.385 73.701 1.00 0.00 H new ATOM 139 N ASP A 11 -64.779 -43.554 73.345 1.00 0.00 N ATOM 140 CA ASP A 11 -66.251 -43.600 73.212 1.00 0.00 C ATOM 141 C ASP A 11 -66.654 -43.085 71.825 1.00 0.00 C ATOM 142 O ASP A 11 -67.224 -43.808 71.030 1.00 0.00 O ATOM 143 CB ASP A 11 -66.874 -42.732 74.317 1.00 0.00 C ATOM 144 CG ASP A 11 -66.292 -41.318 74.268 1.00 0.00 C ATOM 145 OD1 ASP A 11 -65.086 -41.226 74.427 1.00 0.00 O ATOM 146 OD2 ASP A 11 -67.089 -40.416 74.074 1.00 0.00 O ATOM 0 H ASP A 11 -64.415 -42.625 73.556 1.00 0.00 H new ATOM 0 HA ASP A 11 -66.611 -44.624 73.317 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -67.956 -42.692 74.192 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -66.682 -43.179 75.292 1.00 0.00 H new ATOM 151 N GLY A 12 -66.346 -41.841 71.565 1.00 0.00 N ATOM 152 CA GLY A 12 -66.679 -41.210 70.249 1.00 0.00 C ATOM 153 C GLY A 12 -67.868 -40.271 70.432 1.00 0.00 C ATOM 154 O GLY A 12 -68.633 -40.039 69.517 1.00 0.00 O ATOM 0 H GLY A 12 -65.869 -41.223 72.221 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -65.819 -40.658 69.868 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -66.916 -41.978 69.513 1.00 0.00 H new ATOM 158 N ARG A 13 -67.998 -39.747 71.625 1.00 0.00 N ATOM 159 CA ARG A 13 -69.122 -38.808 71.948 1.00 0.00 C ATOM 160 C ARG A 13 -68.638 -37.568 72.701 1.00 0.00 C ATOM 161 O ARG A 13 -69.114 -36.477 72.456 1.00 0.00 O ATOM 162 CB ARG A 13 -70.155 -39.549 72.795 1.00 0.00 C ATOM 163 CG ARG A 13 -70.659 -40.749 71.991 1.00 0.00 C ATOM 164 CD ARG A 13 -71.814 -41.397 72.753 1.00 0.00 C ATOM 165 NE ARG A 13 -72.926 -40.391 72.831 1.00 0.00 N ATOM 166 CZ ARG A 13 -73.385 -39.963 73.980 1.00 0.00 C ATOM 167 NH1 ARG A 13 -73.995 -40.806 74.767 1.00 0.00 N ATOM 168 NH2 ARG A 13 -73.217 -38.709 74.297 1.00 0.00 N ATOM 0 H ARG A 13 -67.364 -39.932 72.402 1.00 0.00 H new ATOM 0 HA ARG A 13 -69.562 -38.469 71.010 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -69.710 -39.880 73.734 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -70.983 -38.887 73.050 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -70.990 -40.430 71.003 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -69.854 -41.469 71.841 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -72.150 -42.300 72.244 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -71.495 -41.694 73.752 1.00 0.00 H new ATOM 0 HE ARG A 13 -73.334 -40.032 71.968 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -74.107 -41.779 74.483 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -74.360 -40.492 75.666 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -72.735 -38.081 73.654 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -73.568 -38.357 75.188 1.00 0.00 H new ATOM 182 N THR A 14 -67.704 -37.740 73.606 1.00 0.00 N ATOM 183 CA THR A 14 -67.180 -36.573 74.393 1.00 0.00 C ATOM 184 C THR A 14 -65.775 -36.178 73.971 1.00 0.00 C ATOM 185 O THR A 14 -64.891 -37.005 73.858 1.00 0.00 O ATOM 186 CB THR A 14 -67.138 -36.938 75.859 1.00 0.00 C ATOM 187 OG1 THR A 14 -68.459 -37.356 76.170 1.00 0.00 O ATOM 188 CG2 THR A 14 -66.914 -35.697 76.729 1.00 0.00 C ATOM 0 H THR A 14 -67.280 -38.639 73.836 1.00 0.00 H new ATOM 0 HA THR A 14 -67.849 -35.733 74.207 1.00 0.00 H new ATOM 0 HB THR A 14 -66.352 -37.672 76.036 1.00 0.00 H new ATOM 0 HG1 THR A 14 -68.507 -37.612 77.115 1.00 0.00 H new ATOM 0 HG21 THR A 14 -66.888 -35.989 77.779 1.00 0.00 H new ATOM 0 HG22 THR A 14 -65.967 -35.229 76.459 1.00 0.00 H new ATOM 0 HG23 THR A 14 -67.727 -34.989 76.569 1.00 0.00 H new ATOM 196 N PHE A 15 -65.599 -34.901 73.744 1.00 0.00 N ATOM 197 CA PHE A 15 -64.270 -34.347 73.328 1.00 0.00 C ATOM 198 C PHE A 15 -63.994 -33.169 74.273 1.00 0.00 C ATOM 199 O PHE A 15 -64.864 -32.834 75.051 1.00 0.00 O ATOM 200 CB PHE A 15 -64.354 -33.849 71.894 1.00 0.00 C ATOM 201 CG PHE A 15 -64.834 -34.985 70.989 1.00 0.00 C ATOM 202 CD1 PHE A 15 -66.155 -35.385 71.014 1.00 0.00 C ATOM 203 CD2 PHE A 15 -63.953 -35.619 70.137 1.00 0.00 C ATOM 204 CE1 PHE A 15 -66.591 -36.405 70.194 1.00 0.00 C ATOM 205 CE2 PHE A 15 -64.385 -36.640 69.315 1.00 0.00 C ATOM 206 CZ PHE A 15 -65.706 -37.034 69.343 1.00 0.00 C ATOM 0 H PHE A 15 -66.337 -34.202 73.831 1.00 0.00 H new ATOM 0 HA PHE A 15 -63.481 -35.098 73.380 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -65.040 -33.004 71.830 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -63.378 -33.493 71.563 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -66.851 -34.896 71.680 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -62.917 -35.314 70.113 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -67.626 -36.711 70.218 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -63.689 -37.130 68.650 1.00 0.00 H new ATOM 0 HZ PHE A 15 -66.047 -37.833 68.701 1.00 0.00 H new ATOM 216 N PRO A 16 -62.838 -32.550 74.225 1.00 0.00 N ATOM 217 CA PRO A 16 -62.658 -31.240 74.903 1.00 0.00 C ATOM 218 C PRO A 16 -63.407 -30.114 74.176 1.00 0.00 C ATOM 219 O PRO A 16 -63.413 -30.057 72.963 1.00 0.00 O ATOM 220 CB PRO A 16 -61.134 -31.007 74.919 1.00 0.00 C ATOM 221 CG PRO A 16 -60.542 -32.395 74.559 1.00 0.00 C ATOM 222 CD PRO A 16 -61.572 -33.008 73.584 1.00 0.00 C ATOM 0 HA PRO A 16 -63.074 -31.243 75.911 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -60.838 -30.247 74.196 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -60.792 -30.668 75.897 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -59.561 -32.300 74.094 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -60.415 -33.016 75.446 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -61.459 -32.631 72.567 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -61.501 -34.094 73.531 1.00 0.00 H new ATOM 230 N LYS A 17 -64.025 -29.239 74.931 1.00 0.00 N ATOM 231 CA LYS A 17 -64.781 -28.097 74.348 1.00 0.00 C ATOM 232 C LYS A 17 -64.211 -26.750 74.823 1.00 0.00 C ATOM 233 O LYS A 17 -63.361 -26.675 75.693 1.00 0.00 O ATOM 234 CB LYS A 17 -66.205 -28.246 74.780 1.00 0.00 C ATOM 235 CG LYS A 17 -66.795 -29.493 74.118 1.00 0.00 C ATOM 236 CD LYS A 17 -68.269 -29.608 74.507 1.00 0.00 C ATOM 237 CE LYS A 17 -68.860 -30.833 73.806 1.00 0.00 C ATOM 238 NZ LYS A 17 -70.303 -30.968 74.153 1.00 0.00 N ATOM 0 H LYS A 17 -64.035 -29.273 75.950 1.00 0.00 H new ATOM 0 HA LYS A 17 -64.700 -28.107 73.261 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -66.263 -28.332 75.865 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -66.779 -27.363 74.499 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -66.695 -29.428 73.035 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -66.251 -30.382 74.436 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -68.369 -29.705 75.588 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -68.809 -28.707 74.216 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -68.744 -30.736 72.727 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -68.319 -31.731 74.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -70.699 -31.802 73.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -70.404 -31.080 75.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -70.815 -30.117 73.846 1.00 0.00 H new ATOM 252 N ARG A 18 -64.722 -25.711 74.221 1.00 0.00 N ATOM 253 CA ARG A 18 -64.285 -24.342 74.556 1.00 0.00 C ATOM 254 C ARG A 18 -64.784 -23.915 75.930 1.00 0.00 C ATOM 255 O ARG A 18 -65.943 -23.598 76.114 1.00 0.00 O ATOM 256 CB ARG A 18 -64.809 -23.363 73.490 1.00 0.00 C ATOM 257 CG ARG A 18 -64.390 -21.932 73.880 1.00 0.00 C ATOM 258 CD ARG A 18 -64.725 -20.971 72.741 1.00 0.00 C ATOM 259 NE ARG A 18 -64.391 -19.588 73.215 1.00 0.00 N ATOM 260 CZ ARG A 18 -63.468 -18.866 72.632 1.00 0.00 C ATOM 261 NH1 ARG A 18 -63.609 -18.554 71.374 1.00 0.00 N ATOM 262 NH2 ARG A 18 -62.435 -18.482 73.333 1.00 0.00 N ATOM 0 H ARG A 18 -65.439 -25.763 73.497 1.00 0.00 H new ATOM 0 HA ARG A 18 -63.195 -24.329 74.576 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -64.406 -23.620 72.511 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -65.894 -23.431 73.416 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -64.906 -21.627 74.790 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -63.322 -21.901 74.093 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -64.153 -21.220 71.847 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -65.780 -21.042 72.475 1.00 0.00 H new ATOM 0 HE ARG A 18 -64.896 -19.200 74.012 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -64.430 -18.872 70.859 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -62.899 -17.992 70.905 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -62.359 -18.745 74.315 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -61.704 -17.919 72.898 1.00 0.00 H new ATOM 276 N GLY A 19 -63.878 -23.923 76.870 1.00 0.00 N ATOM 277 CA GLY A 19 -64.205 -23.530 78.275 1.00 0.00 C ATOM 278 C GLY A 19 -63.817 -24.663 79.215 1.00 0.00 C ATOM 279 O GLY A 19 -64.138 -24.633 80.388 1.00 0.00 O ATOM 0 H GLY A 19 -62.905 -24.191 76.722 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -63.671 -22.619 78.544 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -65.269 -23.314 78.366 1.00 0.00 H new ATOM 283 N GLN A 20 -63.132 -25.652 78.694 1.00 0.00 N ATOM 284 CA GLN A 20 -62.703 -26.810 79.547 1.00 0.00 C ATOM 285 C GLN A 20 -61.185 -26.928 79.485 1.00 0.00 C ATOM 286 O GLN A 20 -60.530 -26.226 78.741 1.00 0.00 O ATOM 287 CB GLN A 20 -63.358 -28.086 79.016 1.00 0.00 C ATOM 288 CG GLN A 20 -64.874 -27.941 79.191 1.00 0.00 C ATOM 289 CD GLN A 20 -65.561 -29.236 78.756 1.00 0.00 C ATOM 290 OE1 GLN A 20 -65.459 -29.658 77.621 1.00 0.00 O ATOM 291 NE2 GLN A 20 -66.268 -29.899 79.629 1.00 0.00 N ATOM 0 H GLN A 20 -62.850 -25.709 77.715 1.00 0.00 H new ATOM 0 HA GLN A 20 -63.008 -26.658 80.582 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -63.107 -28.236 77.966 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -62.992 -28.958 79.559 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -65.112 -27.722 80.232 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -65.241 -27.104 78.597 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -66.358 -29.550 80.583 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -66.731 -30.766 79.357 1.00 0.00 H new ATOM 300 N THR A 21 -60.657 -27.822 80.276 1.00 0.00 N ATOM 301 CA THR A 21 -59.176 -28.049 80.325 1.00 0.00 C ATOM 302 C THR A 21 -58.867 -29.488 79.926 1.00 0.00 C ATOM 303 O THR A 21 -59.231 -30.408 80.627 1.00 0.00 O ATOM 304 CB THR A 21 -58.697 -27.773 81.747 1.00 0.00 C ATOM 305 OG1 THR A 21 -58.961 -26.390 81.936 1.00 0.00 O ATOM 306 CG2 THR A 21 -57.175 -27.888 81.839 1.00 0.00 C ATOM 0 H THR A 21 -61.197 -28.418 80.904 1.00 0.00 H new ATOM 0 HA THR A 21 -58.663 -27.384 79.631 1.00 0.00 H new ATOM 0 HB THR A 21 -59.170 -28.457 82.452 1.00 0.00 H new ATOM 0 HG1 THR A 21 -58.682 -26.124 82.837 1.00 0.00 H new ATOM 0 HG21 THR A 21 -56.856 -27.687 82.862 1.00 0.00 H new ATOM 0 HG22 THR A 21 -56.868 -28.894 81.554 1.00 0.00 H new ATOM 0 HG23 THR A 21 -56.714 -27.164 81.167 1.00 0.00 H new ATOM 314 N CYS A 22 -58.195 -29.662 78.819 1.00 0.00 N ATOM 315 CA CYS A 22 -57.874 -31.054 78.387 1.00 0.00 C ATOM 316 C CYS A 22 -56.854 -31.590 79.381 1.00 0.00 C ATOM 317 O CYS A 22 -56.110 -30.849 79.991 1.00 0.00 O ATOM 318 CB CYS A 22 -57.255 -31.032 76.988 1.00 0.00 C ATOM 319 SG CYS A 22 -58.171 -30.215 75.658 1.00 0.00 S ATOM 0 H CYS A 22 -57.860 -28.918 78.206 1.00 0.00 H new ATOM 0 HA CYS A 22 -58.770 -31.674 78.358 1.00 0.00 H new ATOM 0 HB2 CYS A 22 -56.279 -30.552 77.064 1.00 0.00 H new ATOM 0 HB3 CYS A 22 -57.080 -32.064 76.686 1.00 0.00 H new ATOM 0 HG CYS A 22 -57.335 -29.641 74.845 1.00 0.00 H new ATOM 325 N VAL A 23 -56.866 -32.884 79.509 1.00 0.00 N ATOM 326 CA VAL A 23 -55.942 -33.601 80.436 1.00 0.00 C ATOM 327 C VAL A 23 -55.300 -34.661 79.555 1.00 0.00 C ATOM 328 O VAL A 23 -55.931 -35.661 79.265 1.00 0.00 O ATOM 329 CB VAL A 23 -56.807 -34.177 81.560 1.00 0.00 C ATOM 330 CG1 VAL A 23 -55.955 -34.787 82.656 1.00 0.00 C ATOM 331 CG2 VAL A 23 -57.575 -33.006 82.176 1.00 0.00 C ATOM 0 H VAL A 23 -57.498 -33.497 78.994 1.00 0.00 H new ATOM 0 HA VAL A 23 -55.167 -32.998 80.910 1.00 0.00 H new ATOM 0 HB VAL A 23 -57.459 -34.949 81.152 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -56.600 -35.187 83.438 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -55.348 -35.591 82.240 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -55.303 -34.022 83.079 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -58.208 -33.371 82.985 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -56.869 -32.274 82.569 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -58.196 -32.537 81.413 1.00 0.00 H new ATOM 341 N VAL A 24 -54.072 -34.411 79.145 1.00 0.00 N ATOM 342 CA VAL A 24 -53.323 -35.373 78.257 1.00 0.00 C ATOM 343 C VAL A 24 -51.969 -35.898 78.789 1.00 0.00 C ATOM 344 O VAL A 24 -51.261 -35.238 79.523 1.00 0.00 O ATOM 345 CB VAL A 24 -53.090 -34.659 76.869 1.00 0.00 C ATOM 346 CG1 VAL A 24 -54.397 -34.023 76.413 1.00 0.00 C ATOM 347 CG2 VAL A 24 -52.069 -33.455 76.880 1.00 0.00 C ATOM 0 H VAL A 24 -53.549 -33.570 79.391 1.00 0.00 H new ATOM 0 HA VAL A 24 -53.948 -36.264 78.194 1.00 0.00 H new ATOM 0 HB VAL A 24 -52.699 -35.451 76.230 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -54.245 -33.527 75.454 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -55.159 -34.795 76.306 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -54.723 -33.291 77.152 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -51.986 -33.039 75.876 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -52.423 -32.684 77.564 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -51.092 -33.810 77.208 1.00 0.00 H new ATOM 357 N HIS A 25 -51.678 -37.107 78.369 1.00 0.00 N ATOM 358 CA HIS A 25 -50.405 -37.828 78.741 1.00 0.00 C ATOM 359 C HIS A 25 -49.832 -38.277 77.404 1.00 0.00 C ATOM 360 O HIS A 25 -50.396 -39.124 76.740 1.00 0.00 O ATOM 361 CB HIS A 25 -50.670 -39.089 79.631 1.00 0.00 C ATOM 362 CG HIS A 25 -49.463 -40.042 79.621 1.00 0.00 C ATOM 363 ND1 HIS A 25 -48.985 -40.629 78.574 1.00 0.00 N ATOM 364 CD2 HIS A 25 -48.650 -40.473 80.656 1.00 0.00 C ATOM 365 CE1 HIS A 25 -47.970 -41.360 78.909 1.00 0.00 C ATOM 366 NE2 HIS A 25 -47.726 -41.293 80.196 1.00 0.00 N ATOM 0 H HIS A 25 -52.292 -37.648 77.760 1.00 0.00 H new ATOM 0 HA HIS A 25 -49.744 -37.182 79.319 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -50.882 -38.777 80.654 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -51.554 -39.614 79.268 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -49.352 -40.531 77.627 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -48.757 -40.180 81.690 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -47.394 -41.953 78.213 1.00 0.00 H new ATOM 374 N TYR A 26 -48.721 -37.704 77.024 1.00 0.00 N ATOM 375 CA TYR A 26 -48.074 -38.066 75.720 1.00 0.00 C ATOM 376 C TYR A 26 -46.560 -38.313 75.787 1.00 0.00 C ATOM 377 O TYR A 26 -45.929 -38.311 76.825 1.00 0.00 O ATOM 378 CB TYR A 26 -48.310 -36.945 74.758 1.00 0.00 C ATOM 379 CG TYR A 26 -47.623 -35.709 75.336 1.00 0.00 C ATOM 380 CD1 TYR A 26 -48.233 -34.987 76.335 1.00 0.00 C ATOM 381 CD2 TYR A 26 -46.386 -35.309 74.867 1.00 0.00 C ATOM 382 CE1 TYR A 26 -47.609 -33.881 76.851 1.00 0.00 C ATOM 383 CE2 TYR A 26 -45.767 -34.195 75.396 1.00 0.00 C ATOM 384 CZ TYR A 26 -46.377 -33.472 76.394 1.00 0.00 C ATOM 385 OH TYR A 26 -45.765 -32.356 76.928 1.00 0.00 O ATOM 0 H TYR A 26 -48.226 -36.994 77.564 1.00 0.00 H new ATOM 0 HA TYR A 26 -48.525 -39.010 75.413 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -47.905 -37.188 73.776 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -49.377 -36.767 74.627 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -49.199 -35.290 76.711 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -45.901 -35.871 74.082 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -48.095 -33.318 77.634 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -44.800 -33.890 75.025 1.00 0.00 H new ATOM 0 HH TYR A 26 -44.901 -32.215 76.488 1.00 0.00 H new ATOM 395 N THR A 27 -46.062 -38.519 74.600 1.00 0.00 N ATOM 396 CA THR A 27 -44.622 -38.766 74.358 1.00 0.00 C ATOM 397 C THR A 27 -44.371 -37.966 73.071 1.00 0.00 C ATOM 398 O THR A 27 -45.042 -38.208 72.084 1.00 0.00 O ATOM 399 CB THR A 27 -44.393 -40.234 74.125 1.00 0.00 C ATOM 400 OG1 THR A 27 -44.856 -40.862 75.312 1.00 0.00 O ATOM 401 CG2 THR A 27 -42.893 -40.527 74.091 1.00 0.00 C ATOM 0 H THR A 27 -46.627 -38.525 73.751 1.00 0.00 H new ATOM 0 HA THR A 27 -43.969 -38.479 75.182 1.00 0.00 H new ATOM 0 HB THR A 27 -44.872 -40.560 73.202 1.00 0.00 H new ATOM 0 HG1 THR A 27 -44.740 -41.832 75.235 1.00 0.00 H new ATOM 0 HG21 THR A 27 -42.734 -41.592 73.922 1.00 0.00 H new ATOM 0 HG22 THR A 27 -42.429 -39.958 73.285 1.00 0.00 H new ATOM 0 HG23 THR A 27 -42.445 -40.240 75.042 1.00 0.00 H new ATOM 409 N GLY A 28 -43.438 -37.045 73.095 1.00 0.00 N ATOM 410 CA GLY A 28 -43.127 -36.217 71.875 1.00 0.00 C ATOM 411 C GLY A 28 -41.719 -36.516 71.369 1.00 0.00 C ATOM 412 O GLY A 28 -40.755 -36.419 72.102 1.00 0.00 O ATOM 0 H GLY A 28 -42.870 -36.826 73.914 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -43.854 -36.428 71.091 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -43.216 -35.158 72.115 1.00 0.00 H new ATOM 416 N MET A 29 -41.631 -36.879 70.115 1.00 0.00 N ATOM 417 CA MET A 29 -40.305 -37.200 69.509 1.00 0.00 C ATOM 418 C MET A 29 -40.343 -36.710 68.063 1.00 0.00 C ATOM 419 O MET A 29 -41.347 -36.209 67.596 1.00 0.00 O ATOM 420 CB MET A 29 -40.110 -38.738 69.623 1.00 0.00 C ATOM 421 CG MET A 29 -38.651 -39.105 69.972 1.00 0.00 C ATOM 422 SD MET A 29 -37.329 -38.814 68.770 1.00 0.00 S ATOM 423 CE MET A 29 -37.372 -40.433 67.961 1.00 0.00 C ATOM 0 H MET A 29 -42.426 -36.967 69.482 1.00 0.00 H new ATOM 0 HA MET A 29 -39.465 -36.716 70.008 1.00 0.00 H new ATOM 0 HB2 MET A 29 -40.778 -39.134 70.388 1.00 0.00 H new ATOM 0 HB3 MET A 29 -40.389 -39.211 68.681 1.00 0.00 H new ATOM 0 HG2 MET A 29 -38.389 -38.561 70.880 1.00 0.00 H new ATOM 0 HG3 MET A 29 -38.635 -40.166 70.220 1.00 0.00 H new ATOM 0 HE1 MET A 29 -36.620 -40.466 67.173 1.00 0.00 H new ATOM 0 HE2 MET A 29 -37.163 -41.212 68.694 1.00 0.00 H new ATOM 0 HE3 MET A 29 -38.359 -40.597 67.528 1.00 0.00 H new ATOM 694 N PHE A 46 -50.004 -33.931 81.593 1.00 0.00 N ATOM 695 CA PHE A 46 -50.052 -32.532 81.063 1.00 0.00 C ATOM 696 C PHE A 46 -51.512 -32.060 80.864 1.00 0.00 C ATOM 697 O PHE A 46 -52.375 -32.870 80.590 1.00 0.00 O ATOM 698 CB PHE A 46 -49.305 -32.580 79.787 1.00 0.00 C ATOM 699 CG PHE A 46 -49.072 -31.193 79.229 1.00 0.00 C ATOM 700 CD1 PHE A 46 -48.155 -30.396 79.870 1.00 0.00 C ATOM 701 CD2 PHE A 46 -49.753 -30.730 78.130 1.00 0.00 C ATOM 702 CE1 PHE A 46 -47.903 -29.119 79.427 1.00 0.00 C ATOM 703 CE2 PHE A 46 -49.499 -29.443 77.683 1.00 0.00 C ATOM 704 CZ PHE A 46 -48.579 -28.642 78.327 1.00 0.00 C ATOM 0 HA PHE A 46 -49.611 -31.814 81.754 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -48.347 -33.076 79.943 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -49.859 -33.177 79.062 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -47.626 -30.777 80.731 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -50.472 -31.357 77.624 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -47.182 -28.497 79.937 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -50.027 -29.063 76.821 1.00 0.00 H new ATOM 0 HZ PHE A 46 -48.389 -27.641 77.968 1.00 0.00 H new ATOM 714 N LYS A 47 -51.780 -30.778 80.997 1.00 0.00 N ATOM 715 CA LYS A 47 -53.195 -30.277 80.814 1.00 0.00 C ATOM 716 C LYS A 47 -53.256 -28.866 80.160 1.00 0.00 C ATOM 717 O LYS A 47 -52.474 -28.012 80.529 1.00 0.00 O ATOM 718 CB LYS A 47 -53.865 -30.202 82.191 1.00 0.00 C ATOM 719 CG LYS A 47 -53.453 -31.415 83.032 1.00 0.00 C ATOM 720 CD LYS A 47 -54.258 -31.387 84.334 1.00 0.00 C ATOM 721 CE LYS A 47 -53.686 -32.398 85.332 1.00 0.00 C ATOM 722 NZ LYS A 47 -53.443 -33.720 84.689 1.00 0.00 N ATOM 0 H LYS A 47 -51.091 -30.060 81.222 1.00 0.00 H new ATOM 0 HA LYS A 47 -53.706 -30.972 80.148 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -53.576 -29.281 82.697 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -54.949 -30.177 82.078 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -53.644 -32.339 82.486 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -52.384 -31.385 83.245 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -54.232 -30.386 84.764 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -55.303 -31.619 84.129 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -52.752 -32.016 85.745 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -54.377 -32.519 86.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -52.604 -34.164 85.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -54.270 -34.334 84.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -53.285 -33.587 83.670 1.00 0.00 H new ATOM 736 N PHE A 48 -54.147 -28.613 79.220 1.00 0.00 N ATOM 737 CA PHE A 48 -54.216 -27.234 78.594 1.00 0.00 C ATOM 738 C PHE A 48 -55.669 -26.772 78.452 1.00 0.00 C ATOM 739 O PHE A 48 -56.579 -27.567 78.568 1.00 0.00 O ATOM 740 CB PHE A 48 -53.522 -27.233 77.203 1.00 0.00 C ATOM 741 CG PHE A 48 -54.159 -28.099 76.100 1.00 0.00 C ATOM 742 CD1 PHE A 48 -55.209 -27.656 75.312 1.00 0.00 C ATOM 743 CD2 PHE A 48 -53.649 -29.353 75.868 1.00 0.00 C ATOM 744 CE1 PHE A 48 -55.719 -28.472 74.310 1.00 0.00 C ATOM 745 CE2 PHE A 48 -54.149 -30.157 74.885 1.00 0.00 C ATOM 746 CZ PHE A 48 -55.176 -29.723 74.109 1.00 0.00 C ATOM 0 H PHE A 48 -54.822 -29.288 78.860 1.00 0.00 H new ATOM 0 HA PHE A 48 -53.693 -26.539 79.251 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -53.483 -26.204 76.845 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -52.492 -27.562 77.339 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -55.631 -26.676 75.477 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -52.833 -29.711 76.478 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -56.536 -28.128 73.692 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -53.728 -31.138 74.724 1.00 0.00 H new ATOM 0 HZ PHE A 48 -55.569 -30.361 73.331 1.00 0.00 H new ATOM 756 N MET A 49 -55.856 -25.497 78.198 1.00 0.00 N ATOM 757 CA MET A 49 -57.237 -24.915 78.048 1.00 0.00 C ATOM 758 C MET A 49 -57.592 -24.318 76.683 1.00 0.00 C ATOM 759 O MET A 49 -57.426 -23.134 76.463 1.00 0.00 O ATOM 760 CB MET A 49 -57.390 -23.871 79.114 1.00 0.00 C ATOM 761 CG MET A 49 -58.816 -23.286 79.146 1.00 0.00 C ATOM 762 SD MET A 49 -59.182 -22.111 80.475 1.00 0.00 S ATOM 763 CE MET A 49 -58.613 -20.614 79.629 1.00 0.00 C ATOM 0 H MET A 49 -55.100 -24.822 78.086 1.00 0.00 H new ATOM 0 HA MET A 49 -57.932 -25.749 78.145 1.00 0.00 H new ATOM 0 HB2 MET A 49 -57.155 -24.307 80.085 1.00 0.00 H new ATOM 0 HB3 MET A 49 -56.672 -23.069 78.942 1.00 0.00 H new ATOM 0 HG2 MET A 49 -59.002 -22.791 78.193 1.00 0.00 H new ATOM 0 HG3 MET A 49 -59.522 -24.113 79.219 1.00 0.00 H new ATOM 0 HE1 MET A 49 -58.750 -19.752 80.282 1.00 0.00 H new ATOM 0 HE2 MET A 49 -57.557 -20.716 79.380 1.00 0.00 H new ATOM 0 HE3 MET A 49 -59.189 -20.472 78.715 1.00 0.00 H new ATOM 773 N LEU A 50 -58.066 -25.168 75.811 1.00 0.00 N ATOM 774 CA LEU A 50 -58.464 -24.743 74.436 1.00 0.00 C ATOM 775 C LEU A 50 -59.008 -23.307 74.389 1.00 0.00 C ATOM 776 O LEU A 50 -59.934 -22.978 75.103 1.00 0.00 O ATOM 777 CB LEU A 50 -59.527 -25.741 73.936 1.00 0.00 C ATOM 778 CG LEU A 50 -60.213 -25.286 72.630 1.00 0.00 C ATOM 779 CD1 LEU A 50 -59.198 -25.099 71.504 1.00 0.00 C ATOM 780 CD2 LEU A 50 -61.175 -26.396 72.197 1.00 0.00 C ATOM 0 H LEU A 50 -58.197 -26.162 75.999 1.00 0.00 H new ATOM 0 HA LEU A 50 -57.583 -24.746 73.794 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -59.059 -26.712 73.775 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -60.283 -25.876 74.709 1.00 0.00 H new ATOM 0 HG LEU A 50 -60.720 -24.339 72.814 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -59.714 -24.779 70.599 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -58.469 -24.342 71.793 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -58.686 -26.043 71.315 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -61.676 -26.103 71.274 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -60.616 -27.317 72.030 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -61.918 -26.559 72.978 1.00 0.00 H new ATOM 792 N GLY A 51 -58.434 -22.475 73.557 1.00 0.00 N ATOM 793 CA GLY A 51 -58.902 -21.056 73.442 1.00 0.00 C ATOM 794 C GLY A 51 -57.711 -20.115 73.561 1.00 0.00 C ATOM 795 O GLY A 51 -57.695 -19.045 72.987 1.00 0.00 O ATOM 0 H GLY A 51 -57.654 -22.719 72.946 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -59.404 -20.904 72.487 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -59.630 -20.838 74.223 1.00 0.00 H new ATOM 799 N LYS A 52 -56.729 -20.539 74.314 1.00 0.00 N ATOM 800 CA LYS A 52 -55.497 -19.717 74.525 1.00 0.00 C ATOM 801 C LYS A 52 -54.289 -20.519 74.045 1.00 0.00 C ATOM 802 O LYS A 52 -53.275 -20.550 74.713 1.00 0.00 O ATOM 803 CB LYS A 52 -55.412 -19.427 76.009 1.00 0.00 C ATOM 804 CG LYS A 52 -54.427 -18.277 76.270 1.00 0.00 C ATOM 805 CD LYS A 52 -54.324 -18.044 77.778 1.00 0.00 C ATOM 806 CE LYS A 52 -53.339 -16.897 78.021 1.00 0.00 C ATOM 807 NZ LYS A 52 -53.193 -16.656 79.485 1.00 0.00 N ATOM 0 H LYS A 52 -56.728 -21.436 74.800 1.00 0.00 H new ATOM 0 HA LYS A 52 -55.522 -18.780 73.968 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -56.398 -19.165 76.393 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -55.089 -20.320 76.544 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -53.447 -18.519 75.858 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -54.767 -17.369 75.771 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -55.302 -17.799 78.192 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -53.983 -18.950 78.280 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -52.370 -17.140 77.585 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -53.693 -15.992 77.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -52.523 -15.876 79.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -54.118 -16.406 79.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -52.836 -17.518 79.945 1.00 0.00 H new ATOM 821 N GLN A 53 -54.477 -21.129 72.899 1.00 0.00 N ATOM 822 CA GLN A 53 -53.451 -21.979 72.205 1.00 0.00 C ATOM 823 C GLN A 53 -52.159 -22.140 73.004 1.00 0.00 C ATOM 824 O GLN A 53 -51.087 -21.733 72.602 1.00 0.00 O ATOM 825 CB GLN A 53 -53.151 -21.342 70.840 1.00 0.00 C ATOM 826 CG GLN A 53 -52.345 -22.326 69.979 1.00 0.00 C ATOM 827 CD GLN A 53 -52.119 -21.700 68.601 1.00 0.00 C ATOM 828 OE1 GLN A 53 -51.520 -20.651 68.471 1.00 0.00 O ATOM 829 NE2 GLN A 53 -52.585 -22.314 67.548 1.00 0.00 N ATOM 0 H GLN A 53 -55.356 -21.067 72.385 1.00 0.00 H new ATOM 0 HA GLN A 53 -53.862 -22.983 72.095 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -54.082 -21.081 70.337 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -52.591 -20.417 70.974 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -51.390 -22.549 70.454 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -52.881 -23.270 69.882 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -53.088 -23.195 67.652 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -52.446 -21.913 66.621 1.00 0.00 H new ATOM 838 N GLU A 54 -52.325 -22.746 74.145 1.00 0.00 N ATOM 839 CA GLU A 54 -51.157 -22.976 75.035 1.00 0.00 C ATOM 840 C GLU A 54 -50.322 -24.069 74.386 1.00 0.00 C ATOM 841 O GLU A 54 -49.132 -24.174 74.606 1.00 0.00 O ATOM 842 CB GLU A 54 -51.646 -23.428 76.409 1.00 0.00 C ATOM 843 CG GLU A 54 -50.433 -23.619 77.325 1.00 0.00 C ATOM 844 CD GLU A 54 -50.920 -24.077 78.701 1.00 0.00 C ATOM 845 OE1 GLU A 54 -51.534 -25.131 78.733 1.00 0.00 O ATOM 846 OE2 GLU A 54 -50.649 -23.345 79.639 1.00 0.00 O ATOM 0 H GLU A 54 -53.217 -23.091 74.499 1.00 0.00 H new ATOM 0 HA GLU A 54 -50.569 -22.068 75.168 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -52.325 -22.687 76.831 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -52.205 -24.360 76.323 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -49.753 -24.357 76.901 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -49.876 -22.686 77.413 1.00 0.00 H new ATOM 853 N VAL A 55 -50.985 -24.868 73.588 1.00 0.00 N ATOM 854 CA VAL A 55 -50.296 -25.992 72.876 1.00 0.00 C ATOM 855 C VAL A 55 -50.317 -25.710 71.371 1.00 0.00 C ATOM 856 O VAL A 55 -51.159 -24.978 70.890 1.00 0.00 O ATOM 857 CB VAL A 55 -51.042 -27.299 73.251 1.00 0.00 C ATOM 858 CG1 VAL A 55 -50.812 -27.533 74.736 1.00 0.00 C ATOM 859 CG2 VAL A 55 -52.588 -27.251 73.046 1.00 0.00 C ATOM 0 H VAL A 55 -51.984 -24.790 73.397 1.00 0.00 H new ATOM 0 HA VAL A 55 -49.250 -26.092 73.167 1.00 0.00 H new ATOM 0 HB VAL A 55 -50.653 -28.079 72.597 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -51.322 -28.446 75.044 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -49.744 -27.631 74.928 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -51.206 -26.689 75.303 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -53.023 -28.208 73.334 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -53.012 -26.459 73.663 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -52.810 -27.052 71.997 1.00 0.00 H new ATOM 869 N ILE A 56 -49.394 -26.292 70.650 1.00 0.00 N ATOM 870 CA ILE A 56 -49.381 -26.033 69.180 1.00 0.00 C ATOM 871 C ILE A 56 -50.701 -26.492 68.555 1.00 0.00 C ATOM 872 O ILE A 56 -51.520 -27.105 69.211 1.00 0.00 O ATOM 873 CB ILE A 56 -48.170 -26.778 68.535 1.00 0.00 C ATOM 874 CG1 ILE A 56 -48.017 -28.156 69.201 1.00 0.00 C ATOM 875 CG2 ILE A 56 -46.876 -25.931 68.773 1.00 0.00 C ATOM 876 CD1 ILE A 56 -47.194 -29.094 68.319 1.00 0.00 C ATOM 0 H ILE A 56 -48.669 -26.917 71.002 1.00 0.00 H new ATOM 0 HA ILE A 56 -49.274 -24.964 68.996 1.00 0.00 H new ATOM 0 HB ILE A 56 -48.332 -26.909 67.465 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -47.534 -28.045 70.172 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -49.001 -28.589 69.382 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -46.021 -26.440 68.327 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -46.994 -24.950 68.314 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -46.710 -25.813 69.844 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -47.098 -30.063 68.809 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -47.693 -29.221 67.358 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -46.203 -28.668 68.160 1.00 0.00 H new ATOM 888 N ARG A 57 -50.883 -26.189 67.297 1.00 0.00 N ATOM 889 CA ARG A 57 -52.135 -26.586 66.613 1.00 0.00 C ATOM 890 C ARG A 57 -52.281 -28.096 66.489 1.00 0.00 C ATOM 891 O ARG A 57 -53.254 -28.622 66.991 1.00 0.00 O ATOM 892 CB ARG A 57 -52.152 -25.932 65.232 1.00 0.00 C ATOM 893 CG ARG A 57 -53.527 -26.142 64.596 1.00 0.00 C ATOM 894 CD ARG A 57 -53.554 -25.406 63.254 1.00 0.00 C ATOM 895 NE ARG A 57 -54.907 -25.611 62.638 1.00 0.00 N ATOM 896 CZ ARG A 57 -55.700 -24.603 62.380 1.00 0.00 C ATOM 897 NH1 ARG A 57 -56.357 -24.052 63.362 1.00 0.00 N ATOM 898 NH2 ARG A 57 -55.806 -24.182 61.149 1.00 0.00 N ATOM 0 H ARG A 57 -50.214 -25.682 66.718 1.00 0.00 H new ATOM 0 HA ARG A 57 -52.980 -26.247 67.212 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -51.936 -24.867 65.318 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -51.376 -26.365 64.601 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -53.719 -27.205 64.450 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -54.311 -25.764 65.252 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -53.358 -24.343 63.398 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -52.774 -25.787 62.595 1.00 0.00 H new ATOM 0 HE ARG A 57 -55.215 -26.558 62.415 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -56.248 -24.408 64.312 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -56.980 -23.265 63.181 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -55.275 -24.638 60.407 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -56.420 -23.397 60.929 1.00 0.00 H new ATOM 912 N GLY A 58 -51.347 -28.734 65.821 1.00 0.00 N ATOM 913 CA GLY A 58 -51.353 -30.228 65.631 1.00 0.00 C ATOM 914 C GLY A 58 -52.067 -30.935 66.783 1.00 0.00 C ATOM 915 O GLY A 58 -52.732 -31.940 66.630 1.00 0.00 O ATOM 0 H GLY A 58 -50.553 -28.267 65.384 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -51.845 -30.474 64.690 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -50.328 -30.591 65.559 1.00 0.00 H new ATOM 919 N TRP A 59 -51.877 -30.335 67.923 1.00 0.00 N ATOM 920 CA TRP A 59 -52.476 -30.837 69.186 1.00 0.00 C ATOM 921 C TRP A 59 -53.914 -30.314 69.261 1.00 0.00 C ATOM 922 O TRP A 59 -54.859 -31.015 68.966 1.00 0.00 O ATOM 923 CB TRP A 59 -51.649 -30.287 70.374 1.00 0.00 C ATOM 924 CG TRP A 59 -50.743 -31.344 71.000 1.00 0.00 C ATOM 925 CD1 TRP A 59 -50.020 -32.252 70.308 1.00 0.00 C ATOM 926 CD2 TRP A 59 -50.521 -31.510 72.318 1.00 0.00 C ATOM 927 NE1 TRP A 59 -49.397 -32.917 71.261 1.00 0.00 N ATOM 928 CE2 TRP A 59 -49.631 -32.548 72.513 1.00 0.00 C ATOM 929 CE3 TRP A 59 -51.018 -30.840 73.415 1.00 0.00 C ATOM 930 CZ2 TRP A 59 -49.270 -32.883 73.807 1.00 0.00 C ATOM 931 CZ3 TRP A 59 -50.641 -31.197 74.660 1.00 0.00 C ATOM 932 CH2 TRP A 59 -49.778 -32.205 74.857 1.00 0.00 C ATOM 0 H TRP A 59 -51.314 -29.492 68.033 1.00 0.00 H new ATOM 0 HA TRP A 59 -52.475 -31.926 69.222 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -51.041 -29.450 70.031 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -52.327 -29.899 71.134 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -49.966 -32.397 69.239 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -48.761 -33.684 71.044 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -51.713 -30.025 73.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -48.576 -33.693 73.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -51.040 -30.664 75.510 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -49.488 -32.475 75.862 1.00 0.00 H new ATOM 943 N GLU A 60 -53.994 -29.067 69.667 1.00 0.00 N ATOM 944 CA GLU A 60 -55.291 -28.332 69.826 1.00 0.00 C ATOM 945 C GLU A 60 -56.341 -28.876 68.861 1.00 0.00 C ATOM 946 O GLU A 60 -57.452 -29.189 69.230 1.00 0.00 O ATOM 947 CB GLU A 60 -55.010 -26.874 69.565 1.00 0.00 C ATOM 948 CG GLU A 60 -56.216 -26.033 69.969 1.00 0.00 C ATOM 949 CD GLU A 60 -55.941 -24.571 69.606 1.00 0.00 C ATOM 950 OE1 GLU A 60 -55.752 -24.336 68.424 1.00 0.00 O ATOM 951 OE2 GLU A 60 -55.938 -23.777 70.533 1.00 0.00 O ATOM 0 H GLU A 60 -53.176 -28.506 69.904 1.00 0.00 H new ATOM 0 HA GLU A 60 -55.692 -28.465 70.831 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -54.131 -26.558 70.126 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -54.786 -26.721 68.509 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -57.111 -26.387 69.458 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -56.401 -26.128 71.039 1.00 0.00 H new ATOM 958 N GLU A 61 -55.914 -28.972 67.629 1.00 0.00 N ATOM 959 CA GLU A 61 -56.774 -29.480 66.545 1.00 0.00 C ATOM 960 C GLU A 61 -56.801 -30.998 66.711 1.00 0.00 C ATOM 961 O GLU A 61 -57.850 -31.604 66.801 1.00 0.00 O ATOM 962 CB GLU A 61 -56.170 -29.101 65.189 1.00 0.00 C ATOM 963 CG GLU A 61 -57.115 -29.555 64.066 1.00 0.00 C ATOM 964 CD GLU A 61 -58.388 -28.702 64.080 1.00 0.00 C ATOM 965 OE1 GLU A 61 -58.400 -27.749 64.842 1.00 0.00 O ATOM 966 OE2 GLU A 61 -59.275 -29.055 63.321 1.00 0.00 O ATOM 0 H GLU A 61 -54.975 -28.709 67.331 1.00 0.00 H new ATOM 0 HA GLU A 61 -57.779 -29.059 66.588 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -56.015 -28.023 65.136 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -55.193 -29.570 65.069 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -56.617 -29.465 63.101 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -57.370 -30.607 64.196 1.00 0.00 H new ATOM 973 N GLY A 62 -55.638 -31.595 66.745 1.00 0.00 N ATOM 974 CA GLY A 62 -55.579 -33.067 66.909 1.00 0.00 C ATOM 975 C GLY A 62 -56.407 -33.454 68.138 1.00 0.00 C ATOM 976 O GLY A 62 -57.497 -33.972 68.027 1.00 0.00 O ATOM 0 H GLY A 62 -54.736 -31.126 66.666 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -55.967 -33.563 66.019 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -54.546 -33.393 67.030 1.00 0.00 H new ATOM 980 N VAL A 63 -55.860 -33.193 69.295 1.00 0.00 N ATOM 981 CA VAL A 63 -56.571 -33.516 70.567 1.00 0.00 C ATOM 982 C VAL A 63 -58.082 -33.240 70.458 1.00 0.00 C ATOM 983 O VAL A 63 -58.885 -34.045 70.882 1.00 0.00 O ATOM 984 CB VAL A 63 -55.956 -32.683 71.679 1.00 0.00 C ATOM 985 CG1 VAL A 63 -56.578 -33.144 72.997 1.00 0.00 C ATOM 986 CG2 VAL A 63 -54.437 -32.934 71.740 1.00 0.00 C ATOM 0 H VAL A 63 -54.942 -32.765 69.415 1.00 0.00 H new ATOM 0 HA VAL A 63 -56.458 -34.579 70.782 1.00 0.00 H new ATOM 0 HB VAL A 63 -56.138 -31.623 71.501 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -56.158 -32.565 73.820 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -57.657 -32.994 72.962 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -56.363 -34.202 73.151 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -54.001 -32.334 72.539 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -54.250 -33.990 71.936 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -53.984 -32.656 70.789 1.00 0.00 H new ATOM 996 N ALA A 64 -58.448 -32.110 69.911 1.00 0.00 N ATOM 997 CA ALA A 64 -59.908 -31.817 69.780 1.00 0.00 C ATOM 998 C ALA A 64 -60.597 -32.979 69.080 1.00 0.00 C ATOM 999 O ALA A 64 -61.655 -33.441 69.458 1.00 0.00 O ATOM 1000 CB ALA A 64 -60.148 -30.581 68.926 1.00 0.00 C ATOM 0 H ALA A 64 -57.817 -31.392 69.556 1.00 0.00 H new ATOM 0 HA ALA A 64 -60.302 -31.659 70.784 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -61.219 -30.394 68.849 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -59.661 -29.721 69.386 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -59.736 -30.741 67.930 1.00 0.00 H new ATOM 1006 N GLN A 65 -59.920 -33.398 68.052 1.00 0.00 N ATOM 1007 CA GLN A 65 -60.366 -34.502 67.191 1.00 0.00 C ATOM 1008 C GLN A 65 -60.181 -35.862 67.880 1.00 0.00 C ATOM 1009 O GLN A 65 -60.341 -36.900 67.269 1.00 0.00 O ATOM 1010 CB GLN A 65 -59.550 -34.306 65.905 1.00 0.00 C ATOM 1011 CG GLN A 65 -60.036 -35.071 64.688 1.00 0.00 C ATOM 1012 CD GLN A 65 -59.137 -34.634 63.506 1.00 0.00 C ATOM 1013 OE1 GLN A 65 -59.204 -35.194 62.430 1.00 0.00 O ATOM 1014 NE2 GLN A 65 -58.288 -33.642 63.660 1.00 0.00 N ATOM 0 H GLN A 65 -59.029 -32.991 67.767 1.00 0.00 H new ATOM 0 HA GLN A 65 -61.433 -34.495 66.971 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -59.541 -33.243 65.662 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -58.519 -34.596 66.105 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -59.965 -36.146 64.852 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -61.083 -34.848 64.482 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -58.221 -33.163 64.558 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -57.696 -33.352 62.882 1.00 0.00 H new ATOM 1023 N MET A 66 -59.842 -35.819 69.148 1.00 0.00 N ATOM 1024 CA MET A 66 -59.642 -37.082 69.945 1.00 0.00 C ATOM 1025 C MET A 66 -60.726 -37.032 71.031 1.00 0.00 C ATOM 1026 O MET A 66 -61.095 -35.954 71.455 1.00 0.00 O ATOM 1027 CB MET A 66 -58.254 -37.084 70.592 1.00 0.00 C ATOM 1028 CG MET A 66 -57.191 -37.033 69.492 1.00 0.00 C ATOM 1029 SD MET A 66 -55.461 -36.945 70.015 1.00 0.00 S ATOM 1030 CE MET A 66 -55.332 -38.619 70.690 1.00 0.00 C ATOM 0 H MET A 66 -59.693 -34.957 69.673 1.00 0.00 H new ATOM 0 HA MET A 66 -59.712 -37.977 69.327 1.00 0.00 H new ATOM 0 HB2 MET A 66 -58.148 -36.228 71.258 1.00 0.00 H new ATOM 0 HB3 MET A 66 -58.124 -37.979 71.200 1.00 0.00 H new ATOM 0 HG2 MET A 66 -57.310 -37.918 68.866 1.00 0.00 H new ATOM 0 HG3 MET A 66 -57.398 -36.167 68.863 1.00 0.00 H new ATOM 0 HE1 MET A 66 -54.283 -38.862 70.861 1.00 0.00 H new ATOM 0 HE2 MET A 66 -55.876 -38.674 71.633 1.00 0.00 H new ATOM 0 HE3 MET A 66 -55.759 -39.330 69.983 1.00 0.00 H new ATOM 1040 N SER A 67 -61.216 -38.164 71.481 1.00 0.00 N ATOM 1041 CA SER A 67 -62.289 -38.171 72.544 1.00 0.00 C ATOM 1042 C SER A 67 -61.857 -38.825 73.855 1.00 0.00 C ATOM 1043 O SER A 67 -60.992 -39.676 73.915 1.00 0.00 O ATOM 1044 CB SER A 67 -63.504 -38.917 72.004 1.00 0.00 C ATOM 1045 OG SER A 67 -62.995 -40.214 71.729 1.00 0.00 O ATOM 0 H SER A 67 -60.923 -39.087 71.161 1.00 0.00 H new ATOM 0 HA SER A 67 -62.513 -37.129 72.772 1.00 0.00 H new ATOM 0 HB2 SER A 67 -64.313 -38.949 72.733 1.00 0.00 H new ATOM 0 HB3 SER A 67 -63.902 -38.442 71.107 1.00 0.00 H new ATOM 0 HG SER A 67 -63.713 -40.778 71.373 1.00 0.00 H new ATOM 1051 N VAL A 68 -62.525 -38.363 74.876 1.00 0.00 N ATOM 1052 CA VAL A 68 -62.297 -38.832 76.267 1.00 0.00 C ATOM 1053 C VAL A 68 -62.128 -40.338 76.450 1.00 0.00 C ATOM 1054 O VAL A 68 -63.097 -41.071 76.478 1.00 0.00 O ATOM 1055 CB VAL A 68 -63.477 -38.317 77.108 1.00 0.00 C ATOM 1056 CG1 VAL A 68 -63.357 -38.739 78.572 1.00 0.00 C ATOM 1057 CG2 VAL A 68 -63.490 -36.788 77.046 1.00 0.00 C ATOM 0 H VAL A 68 -63.249 -37.649 74.795 1.00 0.00 H new ATOM 0 HA VAL A 68 -61.335 -38.433 76.587 1.00 0.00 H new ATOM 0 HB VAL A 68 -64.395 -38.742 76.702 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -64.210 -38.355 79.132 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -63.340 -39.827 78.637 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -62.436 -38.336 78.992 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -64.322 -36.407 77.638 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -62.553 -36.400 77.445 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -63.604 -36.467 76.011 1.00 0.00 H new ATOM 1067 N GLY A 69 -60.902 -40.784 76.573 1.00 0.00 N ATOM 1068 CA GLY A 69 -60.644 -42.249 76.763 1.00 0.00 C ATOM 1069 C GLY A 69 -59.993 -42.840 75.525 1.00 0.00 C ATOM 1070 O GLY A 69 -59.774 -44.033 75.443 1.00 0.00 O ATOM 0 H GLY A 69 -60.067 -40.198 76.550 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -59.999 -42.401 77.628 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -61.581 -42.765 76.970 1.00 0.00 H new ATOM 1074 N GLN A 70 -59.690 -41.994 74.575 1.00 0.00 N ATOM 1075 CA GLN A 70 -59.041 -42.482 73.305 1.00 0.00 C ATOM 1076 C GLN A 70 -57.590 -42.030 73.196 1.00 0.00 C ATOM 1077 O GLN A 70 -57.231 -40.949 73.623 1.00 0.00 O ATOM 1078 CB GLN A 70 -59.848 -41.938 72.106 1.00 0.00 C ATOM 1079 CG GLN A 70 -59.208 -42.332 70.742 1.00 0.00 C ATOM 1080 CD GLN A 70 -58.196 -41.289 70.249 1.00 0.00 C ATOM 1081 OE1 GLN A 70 -57.136 -41.096 70.810 1.00 0.00 O ATOM 1082 NE2 GLN A 70 -58.489 -40.590 69.185 1.00 0.00 N ATOM 0 H GLN A 70 -59.860 -40.989 74.616 1.00 0.00 H new ATOM 0 HA GLN A 70 -59.040 -43.572 73.311 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -60.867 -42.321 72.152 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -59.912 -40.852 72.176 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -58.712 -43.297 70.842 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -59.994 -42.453 69.996 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -59.375 -40.741 68.704 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -57.831 -39.893 68.836 1.00 0.00 H new ATOM 1091 N ARG A 71 -56.778 -42.886 72.617 1.00 0.00 N ATOM 1092 CA ARG A 71 -55.316 -42.568 72.431 1.00 0.00 C ATOM 1093 C ARG A 71 -54.928 -42.784 70.978 1.00 0.00 C ATOM 1094 O ARG A 71 -55.418 -43.678 70.308 1.00 0.00 O ATOM 1095 CB ARG A 71 -54.435 -43.469 73.325 1.00 0.00 C ATOM 1096 CG ARG A 71 -54.950 -44.877 73.300 1.00 0.00 C ATOM 1097 CD ARG A 71 -54.025 -45.734 74.177 1.00 0.00 C ATOM 1098 NE ARG A 71 -52.646 -45.703 73.585 1.00 0.00 N ATOM 1099 CZ ARG A 71 -51.970 -46.797 73.340 1.00 0.00 C ATOM 1100 NH1 ARG A 71 -52.322 -47.919 73.909 1.00 0.00 N ATOM 1101 NH2 ARG A 71 -50.952 -46.728 72.527 1.00 0.00 N ATOM 0 H ARG A 71 -57.064 -43.798 72.262 1.00 0.00 H new ATOM 0 HA ARG A 71 -55.156 -41.528 72.714 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -53.403 -43.444 72.975 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -54.434 -43.091 74.348 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -55.973 -44.916 73.673 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -54.969 -45.258 72.279 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -54.008 -45.351 75.197 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -54.393 -46.759 74.227 1.00 0.00 H new ATOM 0 HE ARG A 71 -52.222 -44.801 73.367 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -53.121 -47.941 74.542 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -51.797 -48.773 73.720 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -50.700 -45.837 72.100 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -50.408 -47.565 72.319 1.00 0.00 H new ATOM 1115 N ALA A 72 -54.023 -41.931 70.562 1.00 0.00 N ATOM 1116 CA ALA A 72 -53.519 -41.972 69.149 1.00 0.00 C ATOM 1117 C ALA A 72 -52.044 -41.638 68.968 1.00 0.00 C ATOM 1118 O ALA A 72 -51.297 -41.389 69.892 1.00 0.00 O ATOM 1119 CB ALA A 72 -54.304 -40.980 68.314 1.00 0.00 C ATOM 0 H ALA A 72 -53.608 -41.203 71.143 1.00 0.00 H new ATOM 0 HA ALA A 72 -53.651 -43.008 68.837 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -53.943 -41.004 67.286 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -55.361 -41.244 68.334 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -54.173 -39.977 68.721 1.00 0.00 H new ATOM 1125 N LYS A 73 -51.724 -41.656 67.701 1.00 0.00 N ATOM 1126 CA LYS A 73 -50.362 -41.359 67.185 1.00 0.00 C ATOM 1127 C LYS A 73 -50.647 -40.248 66.174 1.00 0.00 C ATOM 1128 O LYS A 73 -51.178 -40.492 65.110 1.00 0.00 O ATOM 1129 CB LYS A 73 -49.766 -42.590 66.491 1.00 0.00 C ATOM 1130 CG LYS A 73 -48.367 -42.208 65.970 1.00 0.00 C ATOM 1131 CD LYS A 73 -47.565 -43.445 65.516 1.00 0.00 C ATOM 1132 CE LYS A 73 -48.268 -44.187 64.372 1.00 0.00 C ATOM 1133 NZ LYS A 73 -49.465 -44.915 64.878 1.00 0.00 N ATOM 0 H LYS A 73 -52.395 -41.878 66.965 1.00 0.00 H new ATOM 0 HA LYS A 73 -49.644 -41.082 67.956 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -49.699 -43.426 67.188 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -50.405 -42.911 65.668 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -48.467 -41.514 65.135 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -47.818 -41.687 66.754 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -46.571 -43.136 65.193 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -47.430 -44.121 66.360 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -48.566 -43.478 63.600 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -47.577 -44.891 63.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -49.637 -45.754 64.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -49.301 -45.212 65.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -50.294 -44.289 64.839 1.00 0.00 H new ATOM 1147 N LEU A 74 -50.285 -39.045 66.530 1.00 0.00 N ATOM 1148 CA LEU A 74 -50.535 -37.889 65.604 1.00 0.00 C ATOM 1149 C LEU A 74 -49.218 -37.556 64.900 1.00 0.00 C ATOM 1150 O LEU A 74 -48.153 -37.639 65.482 1.00 0.00 O ATOM 1151 CB LEU A 74 -51.003 -36.654 66.412 1.00 0.00 C ATOM 1152 CG LEU A 74 -51.969 -37.051 67.522 1.00 0.00 C ATOM 1153 CD1 LEU A 74 -52.381 -35.794 68.291 1.00 0.00 C ATOM 1154 CD2 LEU A 74 -53.205 -37.690 66.931 1.00 0.00 C ATOM 0 H LEU A 74 -49.831 -38.808 67.412 1.00 0.00 H new ATOM 0 HA LEU A 74 -51.308 -38.151 64.881 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -50.138 -36.150 66.843 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -51.487 -35.942 65.744 1.00 0.00 H new ATOM 0 HG LEU A 74 -51.480 -37.762 68.187 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -53.073 -36.066 69.088 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -51.497 -35.325 68.722 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -52.868 -35.095 67.611 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -53.889 -37.970 67.733 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -53.698 -36.982 66.265 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -52.921 -38.580 66.369 1.00 0.00 H new ATOM 1166 N THR A 75 -49.338 -37.182 63.655 1.00 0.00 N ATOM 1167 CA THR A 75 -48.137 -36.817 62.835 1.00 0.00 C ATOM 1168 C THR A 75 -48.376 -35.344 62.563 1.00 0.00 C ATOM 1169 O THR A 75 -49.339 -34.975 61.921 1.00 0.00 O ATOM 1170 CB THR A 75 -48.126 -37.608 61.528 1.00 0.00 C ATOM 1171 OG1 THR A 75 -48.183 -38.967 61.936 1.00 0.00 O ATOM 1172 CG2 THR A 75 -46.757 -37.485 60.856 1.00 0.00 C ATOM 0 H THR A 75 -50.228 -37.112 63.161 1.00 0.00 H new ATOM 0 HA THR A 75 -47.185 -37.027 63.323 1.00 0.00 H new ATOM 0 HB THR A 75 -48.923 -37.270 60.866 1.00 0.00 H new ATOM 0 HG1 THR A 75 -48.181 -39.546 61.145 1.00 0.00 H new ATOM 0 HG21 THR A 75 -46.757 -38.051 59.925 1.00 0.00 H new ATOM 0 HG22 THR A 75 -46.549 -36.436 60.643 1.00 0.00 H new ATOM 0 HG23 THR A 75 -45.989 -37.879 61.521 1.00 0.00 H new ATOM 1180 N ILE A 76 -47.491 -34.518 63.055 1.00 0.00 N ATOM 1181 CA ILE A 76 -47.623 -33.039 62.865 1.00 0.00 C ATOM 1182 C ILE A 76 -46.533 -32.549 61.932 1.00 0.00 C ATOM 1183 O ILE A 76 -45.414 -33.013 61.984 1.00 0.00 O ATOM 1184 CB ILE A 76 -47.461 -32.339 64.220 1.00 0.00 C ATOM 1185 CG1 ILE A 76 -48.369 -33.054 65.252 1.00 0.00 C ATOM 1186 CG2 ILE A 76 -47.872 -30.865 64.028 1.00 0.00 C ATOM 1187 CD1 ILE A 76 -48.200 -32.487 66.671 1.00 0.00 C ATOM 0 H ILE A 76 -46.671 -34.807 63.588 1.00 0.00 H new ATOM 0 HA ILE A 76 -48.602 -32.815 62.441 1.00 0.00 H new ATOM 0 HB ILE A 76 -46.435 -32.380 64.586 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -49.410 -32.956 64.946 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -48.138 -34.119 65.259 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -47.770 -30.333 64.974 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -47.228 -30.402 63.280 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -48.909 -30.817 63.695 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -48.857 -33.021 67.357 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -47.165 -32.609 66.991 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -48.457 -31.428 66.673 1.00 0.00 H new ATOM 1199 N SER A 77 -46.910 -31.605 61.108 1.00 0.00 N ATOM 1200 CA SER A 77 -45.967 -30.990 60.108 1.00 0.00 C ATOM 1201 C SER A 77 -45.759 -29.510 60.491 1.00 0.00 C ATOM 1202 O SER A 77 -46.595 -28.965 61.184 1.00 0.00 O ATOM 1203 CB SER A 77 -46.619 -31.131 58.725 1.00 0.00 C ATOM 1204 OG SER A 77 -47.907 -30.571 58.926 1.00 0.00 O ATOM 0 H SER A 77 -47.855 -31.221 61.082 1.00 0.00 H new ATOM 0 HA SER A 77 -44.993 -31.478 60.096 1.00 0.00 H new ATOM 0 HB2 SER A 77 -46.060 -30.595 57.958 1.00 0.00 H new ATOM 0 HB3 SER A 77 -46.676 -32.173 58.409 1.00 0.00 H new ATOM 0 HG SER A 77 -47.817 -29.648 59.242 1.00 0.00 H new ATOM 1210 N PRO A 78 -44.688 -28.878 60.063 1.00 0.00 N ATOM 1211 CA PRO A 78 -44.418 -27.461 60.420 1.00 0.00 C ATOM 1212 C PRO A 78 -45.681 -26.597 60.528 1.00 0.00 C ATOM 1213 O PRO A 78 -45.928 -25.969 61.539 1.00 0.00 O ATOM 1214 CB PRO A 78 -43.411 -26.986 59.324 1.00 0.00 C ATOM 1215 CG PRO A 78 -43.379 -28.152 58.300 1.00 0.00 C ATOM 1216 CD PRO A 78 -43.612 -29.391 59.169 1.00 0.00 C ATOM 0 HA PRO A 78 -44.003 -27.362 61.423 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -43.739 -26.057 58.858 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -42.423 -26.800 59.745 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -44.153 -28.042 57.541 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -42.424 -28.202 57.777 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -43.931 -30.255 58.586 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -42.719 -29.689 59.719 1.00 0.00 H new ATOM 1224 N ASP A 79 -46.447 -26.590 59.474 1.00 0.00 N ATOM 1225 CA ASP A 79 -47.694 -25.795 59.448 1.00 0.00 C ATOM 1226 C ASP A 79 -48.472 -25.895 60.755 1.00 0.00 C ATOM 1227 O ASP A 79 -48.989 -24.914 61.251 1.00 0.00 O ATOM 1228 CB ASP A 79 -48.523 -26.289 58.241 1.00 0.00 C ATOM 1229 CG ASP A 79 -48.541 -27.823 58.187 1.00 0.00 C ATOM 1230 OD1 ASP A 79 -47.452 -28.371 58.186 1.00 0.00 O ATOM 1231 OD2 ASP A 79 -49.635 -28.361 58.143 1.00 0.00 O ATOM 0 H ASP A 79 -46.254 -27.111 58.619 1.00 0.00 H new ATOM 0 HA ASP A 79 -47.460 -24.736 59.340 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -49.543 -25.911 58.314 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -48.102 -25.892 57.317 1.00 0.00 H new ATOM 1236 N TYR A 80 -48.542 -27.089 61.292 1.00 0.00 N ATOM 1237 CA TYR A 80 -49.280 -27.345 62.571 1.00 0.00 C ATOM 1238 C TYR A 80 -48.370 -27.626 63.774 1.00 0.00 C ATOM 1239 O TYR A 80 -48.824 -28.223 64.730 1.00 0.00 O ATOM 1240 CB TYR A 80 -50.207 -28.546 62.325 1.00 0.00 C ATOM 1241 CG TYR A 80 -51.516 -28.120 61.652 1.00 0.00 C ATOM 1242 CD1 TYR A 80 -51.503 -27.449 60.448 1.00 0.00 C ATOM 1243 CD2 TYR A 80 -52.727 -28.408 62.250 1.00 0.00 C ATOM 1244 CE1 TYR A 80 -52.689 -27.070 59.851 1.00 0.00 C ATOM 1245 CE2 TYR A 80 -53.909 -28.033 61.655 1.00 0.00 C ATOM 1246 CZ TYR A 80 -53.901 -27.360 60.450 1.00 0.00 C ATOM 1247 OH TYR A 80 -55.085 -26.980 59.852 1.00 0.00 O ATOM 0 H TYR A 80 -48.107 -27.918 60.887 1.00 0.00 H new ATOM 0 HA TYR A 80 -49.830 -26.441 62.832 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -49.697 -29.278 61.699 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -50.428 -29.036 63.273 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -50.562 -27.219 59.970 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -52.746 -28.933 63.194 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -52.670 -26.543 58.909 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -54.849 -28.266 62.133 1.00 0.00 H new ATOM 0 HH TYR A 80 -55.839 -27.265 60.409 1.00 0.00 H new ATOM 1457 N THR A 96 -40.407 -32.243 61.877 1.00 0.00 N ATOM 1458 CA THR A 96 -41.754 -32.889 62.000 1.00 0.00 C ATOM 1459 C THR A 96 -41.857 -33.531 63.390 1.00 0.00 C ATOM 1460 O THR A 96 -40.867 -34.030 63.887 1.00 0.00 O ATOM 1461 CB THR A 96 -41.884 -33.974 60.929 1.00 0.00 C ATOM 1462 OG1 THR A 96 -41.559 -33.299 59.722 1.00 0.00 O ATOM 1463 CG2 THR A 96 -43.339 -34.384 60.708 1.00 0.00 C ATOM 0 HA THR A 96 -42.545 -32.151 61.869 1.00 0.00 H new ATOM 0 HB THR A 96 -41.281 -34.839 61.207 1.00 0.00 H new ATOM 0 HG1 THR A 96 -41.009 -32.514 59.924 1.00 0.00 H new ATOM 0 HG21 THR A 96 -43.387 -35.156 59.940 1.00 0.00 H new ATOM 0 HG22 THR A 96 -43.753 -34.772 61.639 1.00 0.00 H new ATOM 0 HG23 THR A 96 -43.917 -33.517 60.387 1.00 0.00 H new ATOM 1471 N LEU A 97 -43.014 -33.527 64.013 1.00 0.00 N ATOM 1472 CA LEU A 97 -43.166 -34.142 65.353 1.00 0.00 C ATOM 1473 C LEU A 97 -44.128 -35.331 65.184 1.00 0.00 C ATOM 1474 O LEU A 97 -44.927 -35.365 64.268 1.00 0.00 O ATOM 1475 CB LEU A 97 -43.796 -33.131 66.301 1.00 0.00 C ATOM 1476 CG LEU A 97 -43.285 -31.708 66.146 1.00 0.00 C ATOM 1477 CD1 LEU A 97 -43.931 -30.850 67.222 1.00 0.00 C ATOM 1478 CD2 LEU A 97 -41.765 -31.579 66.359 1.00 0.00 C ATOM 0 H LEU A 97 -43.867 -33.115 63.635 1.00 0.00 H new ATOM 0 HA LEU A 97 -42.203 -34.457 65.755 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -44.875 -33.133 66.147 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -43.619 -33.456 67.326 1.00 0.00 H new ATOM 0 HG LEU A 97 -43.527 -31.399 65.129 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -43.578 -29.823 67.129 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -45.014 -30.873 67.104 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -43.665 -31.238 68.205 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -41.467 -30.538 66.234 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -41.509 -31.911 67.365 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -41.242 -32.196 65.629 1.00 0.00 H new ATOM 1490 N VAL A 98 -44.027 -36.278 66.073 1.00 0.00 N ATOM 1491 CA VAL A 98 -44.910 -37.478 66.029 1.00 0.00 C ATOM 1492 C VAL A 98 -45.279 -37.750 67.477 1.00 0.00 C ATOM 1493 O VAL A 98 -44.510 -38.367 68.187 1.00 0.00 O ATOM 1494 CB VAL A 98 -44.162 -38.669 65.470 1.00 0.00 C ATOM 1495 CG1 VAL A 98 -45.141 -39.864 65.434 1.00 0.00 C ATOM 1496 CG2 VAL A 98 -43.711 -38.349 64.043 1.00 0.00 C ATOM 0 H VAL A 98 -43.358 -36.272 66.843 1.00 0.00 H new ATOM 0 HA VAL A 98 -45.781 -37.312 65.395 1.00 0.00 H new ATOM 0 HB VAL A 98 -43.291 -38.902 66.083 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -44.631 -40.741 65.035 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -45.492 -40.077 66.444 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -45.992 -39.618 64.798 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -43.171 -39.202 63.632 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -44.583 -38.140 63.424 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -43.057 -37.477 64.055 1.00 0.00 H new ATOM 1506 N PHE A 99 -46.425 -37.311 67.927 1.00 0.00 N ATOM 1507 CA PHE A 99 -46.762 -37.593 69.360 1.00 0.00 C ATOM 1508 C PHE A 99 -47.549 -38.903 69.438 1.00 0.00 C ATOM 1509 O PHE A 99 -48.019 -39.442 68.457 1.00 0.00 O ATOM 1510 CB PHE A 99 -47.692 -36.539 70.004 1.00 0.00 C ATOM 1511 CG PHE A 99 -47.011 -35.197 70.286 1.00 0.00 C ATOM 1512 CD1 PHE A 99 -46.473 -34.494 69.245 1.00 0.00 C ATOM 1513 CD2 PHE A 99 -46.967 -34.665 71.567 1.00 0.00 C ATOM 1514 CE1 PHE A 99 -45.897 -33.264 69.467 1.00 0.00 C ATOM 1515 CE2 PHE A 99 -46.396 -33.438 71.808 1.00 0.00 C ATOM 1516 CZ PHE A 99 -45.855 -32.730 70.744 1.00 0.00 C ATOM 0 H PHE A 99 -47.120 -36.790 67.393 1.00 0.00 H new ATOM 0 HA PHE A 99 -45.806 -37.608 69.884 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -48.544 -36.371 69.346 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -48.085 -36.939 70.939 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -46.500 -34.904 68.246 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -47.389 -35.225 72.389 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -45.475 -32.712 68.640 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -46.369 -33.032 72.808 1.00 0.00 H new ATOM 0 HZ PHE A 99 -45.402 -31.764 70.912 1.00 0.00 H new ATOM 1526 N ASP A 100 -47.642 -39.349 70.658 1.00 0.00 N ATOM 1527 CA ASP A 100 -48.382 -40.599 71.001 1.00 0.00 C ATOM 1528 C ASP A 100 -49.223 -40.024 72.135 1.00 0.00 C ATOM 1529 O ASP A 100 -48.822 -40.115 73.276 1.00 0.00 O ATOM 1530 CB ASP A 100 -47.428 -41.669 71.525 1.00 0.00 C ATOM 1531 CG ASP A 100 -46.323 -41.903 70.493 1.00 0.00 C ATOM 1532 OD1 ASP A 100 -46.685 -42.273 69.389 1.00 0.00 O ATOM 1533 OD2 ASP A 100 -45.181 -41.698 70.872 1.00 0.00 O ATOM 0 H ASP A 100 -47.221 -38.883 71.461 1.00 0.00 H new ATOM 0 HA ASP A 100 -48.921 -41.086 70.188 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -46.995 -41.354 72.475 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -47.969 -42.596 71.713 1.00 0.00 H new ATOM 1538 N VAL A 101 -50.369 -39.448 71.845 1.00 0.00 N ATOM 1539 CA VAL A 101 -51.199 -38.854 72.951 1.00 0.00 C ATOM 1540 C VAL A 101 -52.369 -39.701 73.419 1.00 0.00 C ATOM 1541 O VAL A 101 -52.965 -40.465 72.685 1.00 0.00 O ATOM 1542 CB VAL A 101 -51.780 -37.497 72.500 1.00 0.00 C ATOM 1543 CG1 VAL A 101 -52.410 -36.740 73.684 1.00 0.00 C ATOM 1544 CG2 VAL A 101 -50.728 -36.645 71.814 1.00 0.00 C ATOM 0 H VAL A 101 -50.762 -39.363 70.908 1.00 0.00 H new ATOM 0 HA VAL A 101 -50.506 -38.769 73.788 1.00 0.00 H new ATOM 0 HB VAL A 101 -52.567 -37.704 71.775 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -52.811 -35.788 73.335 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -53.215 -37.338 74.111 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -51.651 -36.557 74.444 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -51.170 -35.697 71.509 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -49.906 -36.457 72.504 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -50.352 -37.169 70.935 1.00 0.00 H new ATOM 1554 N GLU A 102 -52.642 -39.505 74.680 1.00 0.00 N ATOM 1555 CA GLU A 102 -53.752 -40.206 75.385 1.00 0.00 C ATOM 1556 C GLU A 102 -54.640 -39.129 76.030 1.00 0.00 C ATOM 1557 O GLU A 102 -54.273 -38.602 77.061 1.00 0.00 O ATOM 1558 CB GLU A 102 -53.161 -41.122 76.459 1.00 0.00 C ATOM 1559 CG GLU A 102 -54.303 -41.825 77.208 1.00 0.00 C ATOM 1560 CD GLU A 102 -53.718 -42.784 78.250 1.00 0.00 C ATOM 1561 OE1 GLU A 102 -52.501 -42.838 78.326 1.00 0.00 O ATOM 1562 OE2 GLU A 102 -54.529 -43.412 78.911 1.00 0.00 O ATOM 0 H GLU A 102 -52.119 -38.861 75.273 1.00 0.00 H new ATOM 0 HA GLU A 102 -54.340 -40.814 74.697 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -52.502 -41.860 76.002 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -52.556 -40.542 77.156 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -54.941 -41.087 77.695 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -54.930 -42.374 76.505 1.00 0.00 H new ATOM 1569 N LEU A 103 -55.771 -38.798 75.448 1.00 0.00 N ATOM 1570 CA LEU A 103 -56.617 -37.747 76.107 1.00 0.00 C ATOM 1571 C LEU A 103 -57.232 -38.481 77.288 1.00 0.00 C ATOM 1572 O LEU A 103 -58.029 -39.388 77.140 1.00 0.00 O ATOM 1573 CB LEU A 103 -57.725 -37.242 75.148 1.00 0.00 C ATOM 1574 CG LEU A 103 -58.746 -36.301 75.881 1.00 0.00 C ATOM 1575 CD1 LEU A 103 -58.099 -34.980 76.406 1.00 0.00 C ATOM 1576 CD2 LEU A 103 -59.861 -35.931 74.886 1.00 0.00 C ATOM 0 H LEU A 103 -56.135 -39.191 74.580 1.00 0.00 H new ATOM 0 HA LEU A 103 -56.045 -36.865 76.396 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -57.269 -36.705 74.316 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -58.256 -38.095 74.725 1.00 0.00 H new ATOM 0 HG LEU A 103 -59.125 -36.844 76.747 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -58.858 -34.375 76.902 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -57.306 -35.220 77.114 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -57.681 -34.422 75.568 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -60.583 -35.277 75.375 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -59.427 -35.416 74.028 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -60.364 -36.838 74.549 1.00 0.00 H new ATOM 1588 N LEU A 104 -56.824 -38.035 78.441 1.00 0.00 N ATOM 1589 CA LEU A 104 -57.306 -38.643 79.703 1.00 0.00 C ATOM 1590 C LEU A 104 -58.713 -38.193 80.033 1.00 0.00 C ATOM 1591 O LEU A 104 -59.605 -38.994 80.224 1.00 0.00 O ATOM 1592 CB LEU A 104 -56.355 -38.232 80.814 1.00 0.00 C ATOM 1593 CG LEU A 104 -54.898 -38.638 80.426 1.00 0.00 C ATOM 1594 CD1 LEU A 104 -53.910 -37.728 81.120 1.00 0.00 C ATOM 1595 CD2 LEU A 104 -54.615 -40.086 80.850 1.00 0.00 C ATOM 0 H LEU A 104 -56.167 -37.264 78.561 1.00 0.00 H new ATOM 0 HA LEU A 104 -57.330 -39.727 79.595 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -56.413 -37.156 80.978 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -56.641 -38.713 81.749 1.00 0.00 H new ATOM 0 HG LEU A 104 -54.793 -38.549 79.345 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -52.895 -38.016 80.846 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -54.089 -36.697 80.816 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -54.032 -37.814 82.200 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -53.595 -40.354 80.573 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -54.733 -40.179 81.930 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -55.315 -40.755 80.349 1.00 0.00 H new ATOM 1607 N LYS A 105 -58.874 -36.904 80.091 1.00 0.00 N ATOM 1608 CA LYS A 105 -60.217 -36.371 80.411 1.00 0.00 C ATOM 1609 C LYS A 105 -60.216 -34.849 80.339 1.00 0.00 C ATOM 1610 O LYS A 105 -59.292 -34.232 79.848 1.00 0.00 O ATOM 1611 CB LYS A 105 -60.630 -36.865 81.854 1.00 0.00 C ATOM 1612 CG LYS A 105 -61.897 -37.737 81.794 1.00 0.00 C ATOM 1613 CD LYS A 105 -62.272 -38.127 83.226 1.00 0.00 C ATOM 1614 CE LYS A 105 -63.504 -39.033 83.184 1.00 0.00 C ATOM 1615 NZ LYS A 105 -64.636 -38.322 82.527 1.00 0.00 N ATOM 0 H LYS A 105 -58.145 -36.208 79.933 1.00 0.00 H new ATOM 0 HA LYS A 105 -60.942 -36.736 79.683 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -59.812 -37.434 82.296 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -60.806 -36.005 82.501 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -62.713 -37.191 81.322 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -61.719 -38.627 81.191 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -61.441 -38.643 83.707 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -62.479 -37.235 83.818 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -63.274 -39.949 82.640 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -63.785 -39.326 84.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -65.533 -38.777 82.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -64.648 -37.329 82.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -64.519 -38.363 81.494 1.00 0.00 H new ATOM 1629 N LEU A 106 -61.279 -34.273 80.836 1.00 0.00 N ATOM 1630 CA LEU A 106 -61.407 -32.782 80.836 1.00 0.00 C ATOM 1631 C LEU A 106 -61.417 -32.368 82.308 1.00 0.00 C ATOM 1632 O LEU A 106 -61.856 -33.107 83.167 1.00 0.00 O ATOM 1633 CB LEU A 106 -62.731 -32.349 80.189 1.00 0.00 C ATOM 1634 CG LEU A 106 -62.970 -33.125 78.904 1.00 0.00 C ATOM 1635 CD1 LEU A 106 -64.246 -32.606 78.240 1.00 0.00 C ATOM 1636 CD2 LEU A 106 -61.821 -32.955 77.917 1.00 0.00 C ATOM 0 H LEU A 106 -62.069 -34.772 81.244 1.00 0.00 H new ATOM 0 HA LEU A 106 -60.594 -32.322 80.274 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -63.555 -32.518 80.882 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -62.707 -31.280 79.977 1.00 0.00 H new ATOM 0 HG LEU A 106 -63.054 -34.180 79.163 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -64.426 -33.157 77.317 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -65.090 -32.745 78.916 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -64.133 -31.546 78.014 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -62.031 -33.525 77.012 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -61.712 -31.900 77.664 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -60.897 -33.317 78.368 1.00 0.00 H new ATOM 1648 N GLU A 107 -60.928 -31.186 82.564 1.00 0.00 N ATOM 1649 CA GLU A 107 -60.879 -30.653 83.967 1.00 0.00 C ATOM 1650 C GLU A 107 -61.381 -29.206 83.975 1.00 0.00 C ATOM 1651 O GLU A 107 -61.526 -28.688 82.879 1.00 0.00 O ATOM 1652 CB GLU A 107 -59.418 -30.755 84.459 1.00 0.00 C ATOM 1653 CG GLU A 107 -59.288 -30.182 85.877 1.00 0.00 C ATOM 1654 CD GLU A 107 -57.876 -30.467 86.392 1.00 0.00 C ATOM 1655 OE1 GLU A 107 -57.553 -31.642 86.462 1.00 0.00 O ATOM 1656 OE2 GLU A 107 -57.202 -29.492 86.684 1.00 0.00 O ATOM 1657 OXT GLU A 107 -61.591 -28.699 85.064 1.00 0.00 O ATOM 0 H GLU A 107 -60.554 -30.554 81.856 1.00 0.00 H new ATOM 0 HA GLU A 107 -61.520 -31.227 84.636 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -59.097 -31.797 84.450 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -58.760 -30.213 83.779 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -59.479 -29.109 85.870 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -60.029 -30.633 86.537 1.00 0.00 H new