USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 653 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 34 TYR OH : rot 91:sc= 1.24 USER MOD Set 1.2: A 49 ASN : amide:sc= 1.12 X(o=2.4,f=2) USER MOD Set 2.1: A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 5 SER OG : rot -148:sc= 1.68 USER MOD Set 2.3: A 30 TYR OH : rot -115:sc= 1.23 USER MOD Single : A 0 MET N :NH3+ -168:sc= 0 (180deg=-0.0922) USER MOD Single : A 4 TYR OH : rot 30:sc= 0 USER MOD Single : A 9 THR OG1 : rot -9:sc= 0.229 USER MOD Single : A 14 LYS NZ :NH3+ -136:sc=-0.00526 (180deg=-0.434) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 HIS :FLIP no HD1:sc= -2.01 F(o=-3.7,f=-2) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= -2.67 X(o=-2.7,f=-2.6!) USER MOD Single : A 29 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.0964) USER MOD Single : A 33 SER OG : rot 69:sc= 1.89 USER MOD Single : A 44 SER OG : rot -52:sc= 0.0567 USER MOD Single : A 45 SER OG : rot 150:sc= 0.0414 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.098 USER MOD Single : A 51 LYS NZ :NH3+ 178:sc= -0.129 (180deg=-0.131) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.93) USER MOD Single : A 60 TYR OH : rot 7:sc= 1.19 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot -46:sc= 0.345 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 HIS : no HE2:sc= 0.0938 K(o=0.094,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 281.412 121.242 406.255 1.00 0.00 N ATOM 2 CA MET A 0 281.902 122.093 405.212 1.00 0.00 C ATOM 3 C MET A 0 283.409 121.954 405.202 1.00 0.00 C ATOM 4 O MET A 0 284.139 122.833 405.659 1.00 0.00 O ATOM 5 CB MET A 0 281.431 123.571 405.375 1.00 0.00 C ATOM 6 CG MET A 0 279.899 123.725 405.536 1.00 0.00 C ATOM 7 SD MET A 0 278.905 122.824 404.295 1.00 0.00 S ATOM 8 CE MET A 0 277.278 123.292 404.959 1.00 0.00 C ATOM 0 H1 MET A 0 280.380 121.147 406.169 1.00 0.00 H new ATOM 0 H2 MET A 0 281.854 120.304 406.174 1.00 0.00 H new ATOM 0 H3 MET A 0 281.646 121.656 407.180 1.00 0.00 H new ATOM 0 HA MET A 0 281.492 121.788 404.249 1.00 0.00 H new ATOM 0 HB2 MET A 0 281.924 124.006 406.245 1.00 0.00 H new ATOM 0 HB3 MET A 0 281.755 124.144 404.506 1.00 0.00 H new ATOM 0 HG2 MET A 0 279.615 123.378 406.530 1.00 0.00 H new ATOM 0 HG3 MET A 0 279.647 124.784 405.484 1.00 0.00 H new ATOM 0 HE1 MET A 0 276.494 122.846 404.348 1.00 0.00 H new ATOM 0 HE2 MET A 0 277.187 122.934 405.984 1.00 0.00 H new ATOM 0 HE3 MET A 0 277.177 124.377 404.944 1.00 0.00 H new ATOM 18 N GLY A 1 283.930 120.809 404.672 1.00 0.00 N ATOM 19 CA GLY A 1 285.362 120.457 404.630 1.00 0.00 C ATOM 20 C GLY A 1 286.214 121.223 403.638 1.00 0.00 C ATOM 21 O GLY A 1 287.437 121.290 403.746 1.00 0.00 O ATOM 0 H GLY A 1 283.339 120.091 404.253 1.00 0.00 H new ATOM 0 HA2 GLY A 1 285.780 120.605 405.626 1.00 0.00 H new ATOM 0 HA3 GLY A 1 285.446 119.394 404.404 1.00 0.00 H new ATOM 25 N ILE A 2 285.565 121.856 402.632 1.00 0.00 N ATOM 26 CA ILE A 2 286.195 122.731 401.652 1.00 0.00 C ATOM 27 C ILE A 2 285.492 124.070 401.787 1.00 0.00 C ATOM 28 O ILE A 2 284.275 124.130 401.994 1.00 0.00 O ATOM 29 CB ILE A 2 286.139 122.265 400.195 1.00 0.00 C ATOM 30 CG1 ILE A 2 286.092 120.723 400.066 1.00 0.00 C ATOM 31 CG2 ILE A 2 287.339 122.941 399.481 1.00 0.00 C ATOM 32 CD1 ILE A 2 286.489 120.199 398.682 1.00 0.00 C ATOM 0 H ILE A 2 284.560 121.760 402.488 1.00 0.00 H new ATOM 0 HA ILE A 2 287.263 122.757 401.870 1.00 0.00 H new ATOM 0 HB ILE A 2 285.212 122.569 399.709 1.00 0.00 H new ATOM 0 HG12 ILE A 2 286.756 120.286 400.812 1.00 0.00 H new ATOM 0 HG13 ILE A 2 285.083 120.380 400.297 1.00 0.00 H new ATOM 0 HG21 ILE A 2 287.352 122.645 398.432 1.00 0.00 H new ATOM 0 HG22 ILE A 2 287.241 124.024 399.551 1.00 0.00 H new ATOM 0 HG23 ILE A 2 288.268 122.629 399.958 1.00 0.00 H new ATOM 0 HD11 ILE A 2 286.430 119.111 398.674 1.00 0.00 H new ATOM 0 HD12 ILE A 2 285.811 120.604 397.931 1.00 0.00 H new ATOM 0 HD13 ILE A 2 287.509 120.509 398.454 1.00 0.00 H new ATOM 44 N ASP A 3 286.225 125.206 401.647 1.00 0.00 N ATOM 45 CA ASP A 3 285.633 126.512 401.875 1.00 0.00 C ATOM 46 C ASP A 3 284.843 127.104 400.699 1.00 0.00 C ATOM 47 O ASP A 3 285.135 128.164 400.166 1.00 0.00 O ATOM 48 CB ASP A 3 286.859 127.491 402.114 1.00 0.00 C ATOM 49 CG ASP A 3 287.859 127.379 400.934 1.00 0.00 C ATOM 50 OD1 ASP A 3 288.609 126.374 400.858 1.00 0.00 O ATOM 51 OD2 ASP A 3 287.844 128.294 400.068 1.00 0.00 O1- ATOM 0 H ASP A 3 287.210 125.225 401.381 1.00 0.00 H new ATOM 0 HA ASP A 3 284.925 126.403 402.696 1.00 0.00 H new ATOM 0 HB2 ASP A 3 286.504 128.517 402.205 1.00 0.00 H new ATOM 0 HB3 ASP A 3 287.358 127.242 403.050 1.00 0.00 H new ATOM 56 N TYR A 4 283.739 126.470 400.295 1.00 0.00 N ATOM 57 CA TYR A 4 282.654 127.050 399.533 1.00 0.00 C ATOM 58 C TYR A 4 281.624 127.917 400.241 1.00 0.00 C ATOM 59 O TYR A 4 281.474 129.105 399.980 1.00 0.00 O ATOM 60 CB TYR A 4 282.195 126.257 398.301 1.00 0.00 C ATOM 61 CG TYR A 4 283.223 125.317 397.800 1.00 0.00 C ATOM 62 CD1 TYR A 4 284.195 125.798 396.962 1.00 0.00 C ATOM 63 CD2 TYR A 4 283.160 123.960 398.062 1.00 0.00 C ATOM 64 CE1 TYR A 4 285.118 124.933 396.440 1.00 0.00 C ATOM 65 CE2 TYR A 4 284.095 123.101 397.526 1.00 0.00 C ATOM 66 CZ TYR A 4 285.129 123.596 396.760 1.00 0.00 C ATOM 67 OH TYR A 4 286.102 122.754 396.168 1.00 0.00 O ATOM 0 H TYR A 4 283.579 125.485 400.507 1.00 0.00 H new ATOM 0 HA TYR A 4 283.195 127.880 399.080 1.00 0.00 H new ATOM 0 HB2 TYR A 4 281.292 125.700 398.551 1.00 0.00 H new ATOM 0 HB3 TYR A 4 281.930 126.954 397.506 1.00 0.00 H new ATOM 0 HD1 TYR A 4 284.232 126.849 396.716 1.00 0.00 H new ATOM 0 HD2 TYR A 4 282.373 123.571 398.691 1.00 0.00 H new ATOM 0 HE1 TYR A 4 285.861 125.313 395.755 1.00 0.00 H new ATOM 0 HE2 TYR A 4 284.018 122.039 397.706 1.00 0.00 H new ATOM 0 HH TYR A 4 286.913 123.272 395.982 1.00 0.00 H new ATOM 77 N SER A 5 280.797 127.246 401.119 1.00 0.00 N ATOM 78 CA SER A 5 279.495 127.722 401.629 1.00 0.00 C ATOM 79 C SER A 5 279.424 129.050 402.353 1.00 0.00 C ATOM 80 O SER A 5 278.654 129.894 401.931 1.00 0.00 O ATOM 81 CB SER A 5 278.640 126.621 402.327 1.00 0.00 C ATOM 82 OG SER A 5 279.351 125.952 403.358 1.00 0.00 O ATOM 0 H SER A 5 281.045 126.330 401.492 1.00 0.00 H new ATOM 0 HA SER A 5 279.026 127.970 400.677 1.00 0.00 H new ATOM 0 HB2 SER A 5 277.741 127.074 402.745 1.00 0.00 H new ATOM 0 HB3 SER A 5 278.314 125.893 401.584 1.00 0.00 H new ATOM 0 HG SER A 5 279.047 125.022 403.414 1.00 0.00 H new ATOM 88 N GLY A 6 280.309 129.375 403.336 1.00 0.00 N ATOM 89 CA GLY A 6 280.575 130.682 403.933 1.00 0.00 C ATOM 90 C GLY A 6 280.978 131.758 402.954 1.00 0.00 C ATOM 91 O GLY A 6 280.606 132.913 403.052 1.00 0.00 O ATOM 0 H GLY A 6 280.897 128.655 403.756 1.00 0.00 H new ATOM 0 HA2 GLY A 6 279.682 131.011 404.465 1.00 0.00 H new ATOM 0 HA3 GLY A 6 281.366 130.572 404.675 1.00 0.00 H new ATOM 95 N LEU A 7 281.715 131.410 401.885 1.00 0.00 N ATOM 96 CA LEU A 7 282.131 132.329 400.844 1.00 0.00 C ATOM 97 C LEU A 7 280.951 132.660 399.904 1.00 0.00 C ATOM 98 O LEU A 7 280.685 133.826 399.621 1.00 0.00 O ATOM 99 CB LEU A 7 283.412 131.817 400.164 1.00 0.00 C ATOM 100 CG LEU A 7 284.634 131.576 401.107 1.00 0.00 C ATOM 101 CD1 LEU A 7 284.452 130.567 402.255 1.00 0.00 C ATOM 102 CD2 LEU A 7 285.758 131.013 400.266 1.00 0.00 C ATOM 0 H LEU A 7 282.039 130.455 401.729 1.00 0.00 H new ATOM 0 HA LEU A 7 282.410 133.293 401.270 1.00 0.00 H new ATOM 0 HB2 LEU A 7 283.181 130.882 399.654 1.00 0.00 H new ATOM 0 HB3 LEU A 7 283.705 132.534 399.397 1.00 0.00 H new ATOM 0 HG LEU A 7 284.809 132.548 401.568 1.00 0.00 H new ATOM 0 HD11 LEU A 7 285.376 130.498 402.829 1.00 0.00 H new ATOM 0 HD12 LEU A 7 283.644 130.899 402.907 1.00 0.00 H new ATOM 0 HD13 LEU A 7 284.206 129.588 401.843 1.00 0.00 H new ATOM 0 HD21 LEU A 7 286.629 130.833 400.896 1.00 0.00 H new ATOM 0 HD22 LEU A 7 285.438 130.075 399.812 1.00 0.00 H new ATOM 0 HD23 LEU A 7 286.018 131.725 399.483 1.00 0.00 H new ATOM 114 N ARG A 8 280.119 131.642 399.512 1.00 0.00 N ATOM 115 CA ARG A 8 278.838 131.857 398.813 1.00 0.00 C ATOM 116 C ARG A 8 277.719 132.505 399.624 1.00 0.00 C ATOM 117 O ARG A 8 276.989 133.354 399.119 1.00 0.00 O ATOM 118 CB ARG A 8 278.270 130.607 398.031 1.00 0.00 C ATOM 119 CG ARG A 8 279.119 129.310 398.056 1.00 0.00 C ATOM 120 CD ARG A 8 278.593 128.197 397.115 1.00 0.00 C ATOM 121 NE ARG A 8 279.433 126.908 397.125 1.00 0.00 N ATOM 122 CZ ARG A 8 278.957 125.807 397.785 1.00 0.00 C ATOM 123 NH1 ARG A 8 278.082 125.921 398.819 1.00 0.00 N1+ ATOM 124 NH2 ARG A 8 279.426 124.586 397.398 1.00 0.00 N ATOM 0 H ARG A 8 280.331 130.658 399.678 1.00 0.00 H new ATOM 0 HA ARG A 8 279.161 132.595 398.078 1.00 0.00 H new ATOM 0 HB2 ARG A 8 277.285 130.374 398.436 1.00 0.00 H new ATOM 0 HB3 ARG A 8 278.126 130.897 396.990 1.00 0.00 H new ATOM 0 HG2 ARG A 8 280.144 129.553 397.777 1.00 0.00 H new ATOM 0 HG3 ARG A 8 279.148 128.926 399.076 1.00 0.00 H new ATOM 0 HD2 ARG A 8 277.570 127.952 397.399 1.00 0.00 H new ATOM 0 HD3 ARG A 8 278.557 128.585 396.097 1.00 0.00 H new ATOM 0 HE ARG A 8 280.333 126.874 396.646 1.00 0.00 H new ATOM 0 HH11 ARG A 8 277.765 126.843 399.120 1.00 0.00 H new ATOM 0 HH12 ARG A 8 277.742 125.085 399.294 1.00 0.00 H new ATOM 0 HH21 ARG A 8 280.107 124.518 396.642 1.00 0.00 H new ATOM 0 HH22 ARG A 8 279.096 123.741 397.865 1.00 0.00 H new ATOM 138 N THR A 9 277.558 132.117 400.909 1.00 0.00 N ATOM 139 CA THR A 9 276.544 132.631 401.827 1.00 0.00 C ATOM 140 C THR A 9 276.874 133.949 402.522 1.00 0.00 C ATOM 141 O THR A 9 275.954 134.692 402.863 1.00 0.00 O ATOM 142 CB THR A 9 275.959 131.499 402.664 1.00 0.00 C ATOM 143 OG1 THR A 9 274.576 131.676 402.939 1.00 0.00 O ATOM 144 CG2 THR A 9 276.684 131.136 403.979 1.00 0.00 C ATOM 0 H THR A 9 278.157 131.413 401.340 1.00 0.00 H new ATOM 0 HA THR A 9 275.709 132.997 401.230 1.00 0.00 H new ATOM 0 HB THR A 9 276.120 130.651 401.999 1.00 0.00 H new ATOM 0 HG1 THR A 9 274.299 132.573 402.658 1.00 0.00 H new ATOM 0 HG21 THR A 9 276.159 130.316 404.469 1.00 0.00 H new ATOM 0 HG22 THR A 9 277.707 130.832 403.758 1.00 0.00 H new ATOM 0 HG23 THR A 9 276.698 132.004 404.638 1.00 0.00 H new ATOM 152 N ILE A 10 278.187 134.307 402.695 1.00 0.00 N ATOM 153 CA ILE A 10 278.636 135.619 403.172 1.00 0.00 C ATOM 154 C ILE A 10 278.958 136.547 401.963 1.00 0.00 C ATOM 155 O ILE A 10 278.697 137.746 402.066 1.00 0.00 O ATOM 156 CB ILE A 10 279.804 135.586 404.219 1.00 0.00 C ATOM 157 CG1 ILE A 10 279.463 134.910 405.592 1.00 0.00 C ATOM 158 CG2 ILE A 10 280.283 137.004 404.648 1.00 0.00 C ATOM 159 CD1 ILE A 10 279.750 133.416 405.814 1.00 0.00 C ATOM 0 H ILE A 10 278.958 133.669 402.499 1.00 0.00 H new ATOM 0 HA ILE A 10 277.800 136.034 403.735 1.00 0.00 H new ATOM 0 HB ILE A 10 280.550 135.015 403.667 1.00 0.00 H new ATOM 0 HG12 ILE A 10 280.000 135.460 406.365 1.00 0.00 H new ATOM 0 HG13 ILE A 10 278.399 135.064 405.772 1.00 0.00 H new ATOM 0 HG21 ILE A 10 281.092 136.911 405.373 1.00 0.00 H new ATOM 0 HG22 ILE A 10 280.640 137.547 403.773 1.00 0.00 H new ATOM 0 HG23 ILE A 10 279.453 137.548 405.099 1.00 0.00 H new ATOM 0 HD11 ILE A 10 279.447 133.133 406.822 1.00 0.00 H new ATOM 0 HD12 ILE A 10 279.190 132.826 405.088 1.00 0.00 H new ATOM 0 HD13 ILE A 10 280.816 133.228 405.690 1.00 0.00 H new ATOM 171 N PHE A 11 279.556 136.108 400.793 1.00 0.00 N ATOM 172 CA PHE A 11 280.008 137.079 399.766 1.00 0.00 C ATOM 173 C PHE A 11 279.163 137.092 398.496 1.00 0.00 C ATOM 174 O PHE A 11 279.074 138.114 397.812 1.00 0.00 O ATOM 175 CB PHE A 11 281.525 136.923 399.411 1.00 0.00 C ATOM 176 CG PHE A 11 282.354 136.773 400.671 1.00 0.00 C ATOM 177 CD1 PHE A 11 282.337 137.704 401.700 1.00 0.00 C ATOM 178 CD2 PHE A 11 283.118 135.639 400.843 1.00 0.00 C ATOM 179 CE1 PHE A 11 282.990 137.449 402.895 1.00 0.00 C ATOM 180 CE2 PHE A 11 283.775 135.383 402.029 1.00 0.00 C ATOM 181 CZ PHE A 11 283.686 136.273 403.070 1.00 0.00 C ATOM 0 H PHE A 11 279.722 135.129 400.561 1.00 0.00 H new ATOM 0 HA PHE A 11 279.865 138.048 400.243 1.00 0.00 H new ATOM 0 HB2 PHE A 11 281.667 136.053 398.770 1.00 0.00 H new ATOM 0 HB3 PHE A 11 281.864 137.792 398.848 1.00 0.00 H new ATOM 0 HD1 PHE A 11 281.809 138.637 401.568 1.00 0.00 H new ATOM 0 HD2 PHE A 11 283.205 134.934 400.030 1.00 0.00 H new ATOM 0 HE1 PHE A 11 282.953 138.176 403.693 1.00 0.00 H new ATOM 0 HE2 PHE A 11 284.360 134.482 402.138 1.00 0.00 H new ATOM 0 HZ PHE A 11 284.157 136.054 404.017 1.00 0.00 H new ATOM 191 N GLY A 12 278.497 135.955 398.173 1.00 0.00 N ATOM 192 CA GLY A 12 277.563 135.833 397.048 1.00 0.00 C ATOM 193 C GLY A 12 278.072 135.110 395.817 1.00 0.00 C ATOM 194 O GLY A 12 278.079 133.881 395.758 1.00 0.00 O ATOM 0 H GLY A 12 278.602 135.089 398.701 1.00 0.00 H new ATOM 0 HA2 GLY A 12 276.670 135.317 397.401 1.00 0.00 H new ATOM 0 HA3 GLY A 12 277.255 136.836 396.751 1.00 0.00 H new ATOM 198 N GLU A 13 278.470 135.866 394.758 1.00 0.00 N ATOM 199 CA GLU A 13 278.821 135.394 393.410 1.00 0.00 C ATOM 200 C GLU A 13 280.175 134.706 393.180 1.00 0.00 C ATOM 201 O GLU A 13 280.274 133.770 392.390 1.00 0.00 O ATOM 202 CB GLU A 13 278.649 136.583 392.420 1.00 0.00 C ATOM 203 CG GLU A 13 278.633 136.206 390.922 1.00 0.00 C ATOM 204 CD GLU A 13 278.361 137.452 390.079 1.00 0.00 C ATOM 205 OE1 GLU A 13 279.257 137.835 389.280 1.00 0.00 O ATOM 206 OE2 GLU A 13 277.253 138.035 390.221 1.00 0.00 O1- ATOM 0 H GLU A 13 278.556 136.879 394.838 1.00 0.00 H new ATOM 0 HA GLU A 13 278.130 134.568 393.240 1.00 0.00 H new ATOM 0 HB2 GLU A 13 277.718 137.098 392.657 1.00 0.00 H new ATOM 0 HB3 GLU A 13 279.458 137.293 392.589 1.00 0.00 H new ATOM 0 HG2 GLU A 13 279.588 135.765 390.638 1.00 0.00 H new ATOM 0 HG3 GLU A 13 277.866 135.454 390.735 1.00 0.00 H new ATOM 213 N LYS A 14 281.253 135.166 393.850 1.00 0.00 N ATOM 214 CA LYS A 14 282.598 134.627 393.737 1.00 0.00 C ATOM 215 C LYS A 14 283.169 134.737 395.134 1.00 0.00 C ATOM 216 O LYS A 14 282.657 135.489 395.963 1.00 0.00 O ATOM 217 CB LYS A 14 283.454 135.401 392.679 1.00 0.00 C ATOM 218 CG LYS A 14 284.889 134.884 392.431 1.00 0.00 C ATOM 219 CD LYS A 14 285.640 135.631 391.309 1.00 0.00 C ATOM 220 CE LYS A 14 285.162 135.303 389.886 1.00 0.00 C ATOM 221 NZ LYS A 14 285.417 133.883 389.545 1.00 0.00 N1+ ATOM 0 H LYS A 14 281.194 135.948 394.502 1.00 0.00 H new ATOM 0 HA LYS A 14 282.599 133.597 393.380 1.00 0.00 H new ATOM 0 HB2 LYS A 14 282.918 135.384 391.730 1.00 0.00 H new ATOM 0 HB3 LYS A 14 283.518 136.444 392.990 1.00 0.00 H new ATOM 0 HG2 LYS A 14 285.460 134.970 393.356 1.00 0.00 H new ATOM 0 HG3 LYS A 14 284.844 133.824 392.181 1.00 0.00 H new ATOM 0 HD2 LYS A 14 285.537 136.704 391.474 1.00 0.00 H new ATOM 0 HD3 LYS A 14 286.702 135.397 391.384 1.00 0.00 H new ATOM 0 HE2 LYS A 14 284.096 135.514 389.801 1.00 0.00 H new ATOM 0 HE3 LYS A 14 285.673 135.948 389.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 285.807 133.822 388.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 286.098 133.481 390.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 284.526 133.349 389.592 1.00 0.00 H new ATOM 235 N LEU A 15 284.259 133.989 395.430 1.00 0.00 N ATOM 236 CA LEU A 15 284.938 133.963 396.710 1.00 0.00 C ATOM 237 C LEU A 15 286.114 134.956 396.708 1.00 0.00 C ATOM 238 O LEU A 15 286.641 135.258 395.638 1.00 0.00 O ATOM 239 CB LEU A 15 285.272 132.517 397.163 1.00 0.00 C ATOM 240 CG LEU A 15 286.053 131.570 396.237 1.00 0.00 C ATOM 241 CD1 LEU A 15 286.801 130.557 397.111 1.00 0.00 C ATOM 242 CD2 LEU A 15 285.188 130.776 395.260 1.00 0.00 C ATOM 0 H LEU A 15 284.691 133.370 394.744 1.00 0.00 H new ATOM 0 HA LEU A 15 284.265 134.317 397.491 1.00 0.00 H new ATOM 0 HB2 LEU A 15 285.834 132.593 398.094 1.00 0.00 H new ATOM 0 HB3 LEU A 15 284.327 132.028 397.401 1.00 0.00 H new ATOM 0 HG LEU A 15 286.710 132.203 395.640 1.00 0.00 H new ATOM 0 HD11 LEU A 15 287.363 129.873 396.475 1.00 0.00 H new ATOM 0 HD12 LEU A 15 287.488 131.085 397.773 1.00 0.00 H new ATOM 0 HD13 LEU A 15 286.085 129.992 397.707 1.00 0.00 H new ATOM 0 HD21 LEU A 15 285.824 130.136 394.648 1.00 0.00 H new ATOM 0 HD22 LEU A 15 284.482 130.160 395.817 1.00 0.00 H new ATOM 0 HD23 LEU A 15 284.640 131.465 394.617 1.00 0.00 H new ATOM 254 N PRO A 16 286.577 135.505 397.826 1.00 0.00 N ATOM 255 CA PRO A 16 287.509 136.617 397.865 1.00 0.00 C ATOM 256 C PRO A 16 288.974 136.226 397.996 1.00 0.00 C ATOM 257 O PRO A 16 289.359 135.060 398.079 1.00 0.00 O ATOM 258 CB PRO A 16 287.001 137.383 399.087 1.00 0.00 C ATOM 259 CG PRO A 16 286.573 136.275 400.052 1.00 0.00 C ATOM 260 CD PRO A 16 286.193 135.101 399.167 1.00 0.00 C ATOM 0 HA PRO A 16 287.522 137.183 396.934 1.00 0.00 H new ATOM 0 HB2 PRO A 16 287.780 138.012 399.518 1.00 0.00 H new ATOM 0 HB3 PRO A 16 286.167 138.037 398.832 1.00 0.00 H new ATOM 0 HG2 PRO A 16 287.383 136.010 400.731 1.00 0.00 H new ATOM 0 HG3 PRO A 16 285.732 136.592 400.668 1.00 0.00 H new ATOM 0 HD2 PRO A 16 286.714 134.193 399.470 1.00 0.00 H new ATOM 0 HD3 PRO A 16 285.125 134.891 399.226 1.00 0.00 H new ATOM 268 N GLU A 17 289.797 137.293 398.068 1.00 0.00 N ATOM 269 CA GLU A 17 291.234 137.309 398.256 1.00 0.00 C ATOM 270 C GLU A 17 291.727 136.909 399.668 1.00 0.00 C ATOM 271 O GLU A 17 290.991 136.883 400.666 1.00 0.00 O ATOM 272 CB GLU A 17 291.728 138.740 397.935 1.00 0.00 C ATOM 273 CG GLU A 17 291.154 139.325 396.626 1.00 0.00 C ATOM 274 CD GLU A 17 291.949 140.544 396.143 1.00 0.00 C ATOM 275 OE1 GLU A 17 292.892 140.985 396.854 1.00 0.00 O ATOM 276 OE2 GLU A 17 291.606 141.056 395.044 1.00 0.00 O1- ATOM 0 H GLU A 17 289.425 138.239 397.987 1.00 0.00 H new ATOM 0 HA GLU A 17 291.644 136.550 397.590 1.00 0.00 H new ATOM 0 HB2 GLU A 17 291.463 139.399 398.762 1.00 0.00 H new ATOM 0 HB3 GLU A 17 292.816 138.732 397.870 1.00 0.00 H new ATOM 0 HG2 GLU A 17 291.162 138.557 395.852 1.00 0.00 H new ATOM 0 HG3 GLU A 17 290.113 139.610 396.782 1.00 0.00 H new ATOM 283 N SER A 18 293.053 136.606 399.786 1.00 0.00 N ATOM 284 CA SER A 18 293.700 136.088 401.004 1.00 0.00 C ATOM 285 C SER A 18 293.727 136.950 402.265 1.00 0.00 C ATOM 286 O SER A 18 293.691 136.395 403.357 1.00 0.00 O ATOM 287 CB SER A 18 295.069 135.374 400.784 1.00 0.00 C ATOM 288 OG SER A 18 296.207 136.239 400.807 1.00 0.00 O ATOM 0 H SER A 18 293.707 136.722 399.012 1.00 0.00 H new ATOM 0 HA SER A 18 292.949 135.334 401.238 1.00 0.00 H new ATOM 0 HB2 SER A 18 295.193 134.613 401.554 1.00 0.00 H new ATOM 0 HB3 SER A 18 295.043 134.856 399.825 1.00 0.00 H new ATOM 0 HG SER A 18 297.021 135.713 400.664 1.00 0.00 H new ATOM 294 N HIS A 19 293.728 138.321 402.149 1.00 0.00 N ATOM 295 CA HIS A 19 293.661 139.309 403.248 1.00 0.00 C ATOM 296 C HIS A 19 292.468 139.096 404.184 1.00 0.00 C ATOM 297 O HIS A 19 292.639 139.008 405.391 1.00 0.00 O ATOM 298 CB HIS A 19 293.706 140.794 402.747 1.00 0.00 C ATOM 299 CG HIS A 19 292.568 141.217 401.840 1.00 0.00 C ATOM 300 ND1 HIS A 19 291.876 140.477 400.937 1.00 0.00 N flip ATOM 301 CD2 HIS A 19 292.003 142.476 401.785 1.00 0.00 C flip ATOM 302 CE1 HIS A 19 290.888 141.223 400.339 1.00 0.00 C flip ATOM 303 NE2 HIS A 19 290.991 142.412 400.878 1.00 0.00 N flip ATOM 0 H HIS A 19 293.778 138.773 401.236 1.00 0.00 H new ATOM 0 HA HIS A 19 294.567 139.129 403.827 1.00 0.00 H new ATOM 0 HB2 HIS A 19 293.716 141.451 403.617 1.00 0.00 H new ATOM 0 HB3 HIS A 19 294.646 140.951 402.217 1.00 0.00 H new ATOM 0 HD2 HIS A 19 292.306 143.344 402.352 1.00 0.00 H new ATOM 0 HE1 HIS A 19 290.182 140.899 399.589 1.00 0.00 H new ATOM 0 HE2 HIS A 19 290.384 143.198 400.645 1.00 0.00 H new ATOM 311 N ILE A 20 291.247 138.887 403.604 1.00 0.00 N ATOM 312 CA ILE A 20 290.066 138.370 404.311 1.00 0.00 C ATOM 313 C ILE A 20 290.107 136.868 404.517 1.00 0.00 C ATOM 314 O ILE A 20 289.804 136.382 405.609 1.00 0.00 O ATOM 315 CB ILE A 20 288.677 138.807 403.776 1.00 0.00 C ATOM 316 CG1 ILE A 20 287.804 137.694 403.125 1.00 0.00 C ATOM 317 CG2 ILE A 20 288.856 139.981 402.791 1.00 0.00 C ATOM 318 CD1 ILE A 20 286.456 138.185 402.628 1.00 0.00 C ATOM 0 H ILE A 20 291.069 139.080 402.618 1.00 0.00 H new ATOM 0 HA ILE A 20 290.157 138.869 405.276 1.00 0.00 H new ATOM 0 HB ILE A 20 288.115 139.101 404.663 1.00 0.00 H new ATOM 0 HG12 ILE A 20 288.352 137.258 402.290 1.00 0.00 H new ATOM 0 HG13 ILE A 20 287.645 136.898 403.852 1.00 0.00 H new ATOM 0 HG21 ILE A 20 287.882 140.291 402.413 1.00 0.00 H new ATOM 0 HG22 ILE A 20 289.329 140.818 403.305 1.00 0.00 H new ATOM 0 HG23 ILE A 20 289.484 139.665 401.958 1.00 0.00 H new ATOM 0 HD11 ILE A 20 285.906 137.354 402.188 1.00 0.00 H new ATOM 0 HD12 ILE A 20 285.888 138.595 403.463 1.00 0.00 H new ATOM 0 HD13 ILE A 20 286.606 138.960 401.876 1.00 0.00 H new ATOM 330 N PHE A 21 290.419 136.066 403.436 1.00 0.00 N ATOM 331 CA PHE A 21 290.285 134.610 403.476 1.00 0.00 C ATOM 332 C PHE A 21 291.227 133.913 404.502 1.00 0.00 C ATOM 333 O PHE A 21 290.753 133.101 405.296 1.00 0.00 O ATOM 334 CB PHE A 21 290.126 134.046 402.012 1.00 0.00 C ATOM 335 CG PHE A 21 289.767 132.580 401.814 1.00 0.00 C ATOM 336 CD1 PHE A 21 289.837 132.045 400.528 1.00 0.00 C ATOM 337 CD2 PHE A 21 289.408 131.721 402.846 1.00 0.00 C ATOM 338 CE1 PHE A 21 289.827 130.673 400.389 1.00 0.00 C ATOM 339 CE2 PHE A 21 289.367 130.359 402.691 1.00 0.00 C ATOM 340 CZ PHE A 21 289.694 129.848 401.478 1.00 0.00 C ATOM 0 H PHE A 21 290.760 136.428 402.545 1.00 0.00 H new ATOM 0 HA PHE A 21 289.347 134.310 403.944 1.00 0.00 H new ATOM 0 HB2 PHE A 21 289.361 134.641 401.513 1.00 0.00 H new ATOM 0 HB3 PHE A 21 291.064 134.227 401.487 1.00 0.00 H new ATOM 0 HD1 PHE A 21 289.898 132.689 399.663 1.00 0.00 H new ATOM 0 HD2 PHE A 21 289.151 132.142 403.807 1.00 0.00 H new ATOM 0 HE1 PHE A 21 289.926 130.239 399.405 1.00 0.00 H new ATOM 0 HE2 PHE A 21 289.083 129.714 403.509 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.851 128.785 401.368 1.00 0.00 H new ATOM 350 N PHE A 22 292.547 134.262 404.579 1.00 0.00 N ATOM 351 CA PHE A 22 293.487 133.785 405.609 1.00 0.00 C ATOM 352 C PHE A 22 293.292 134.488 406.991 1.00 0.00 C ATOM 353 O PHE A 22 293.807 133.985 407.988 1.00 0.00 O ATOM 354 CB PHE A 22 295.020 133.800 405.165 1.00 0.00 C ATOM 355 CG PHE A 22 295.533 132.611 404.323 1.00 0.00 C ATOM 356 CD1 PHE A 22 296.338 132.798 403.200 1.00 0.00 C ATOM 357 CD2 PHE A 22 295.330 131.284 404.681 1.00 0.00 C ATOM 358 CE1 PHE A 22 296.712 131.741 402.375 1.00 0.00 C ATOM 359 CE2 PHE A 22 295.744 130.225 403.907 1.00 0.00 C ATOM 360 CZ PHE A 22 296.339 130.448 402.694 1.00 0.00 C ATOM 0 H PHE A 22 292.983 134.895 403.908 1.00 0.00 H new ATOM 0 HA PHE A 22 293.222 132.735 405.733 1.00 0.00 H new ATOM 0 HB2 PHE A 22 295.196 134.714 404.598 1.00 0.00 H new ATOM 0 HB3 PHE A 22 295.630 133.861 406.066 1.00 0.00 H new ATOM 0 HD1 PHE A 22 296.682 133.794 402.963 1.00 0.00 H new ATOM 0 HD2 PHE A 22 294.823 131.074 405.611 1.00 0.00 H new ATOM 0 HE1 PHE A 22 297.294 131.931 401.485 1.00 0.00 H new ATOM 0 HE2 PHE A 22 295.599 129.214 404.257 1.00 0.00 H new ATOM 0 HZ PHE A 22 296.513 129.635 402.004 1.00 0.00 H new ATOM 370 N ALA A 23 292.595 135.672 407.129 1.00 0.00 N ATOM 371 CA ALA A 23 292.402 136.342 408.433 1.00 0.00 C ATOM 372 C ALA A 23 290.990 136.467 409.061 1.00 0.00 C ATOM 373 O ALA A 23 290.887 136.640 410.274 1.00 0.00 O ATOM 374 CB ALA A 23 293.027 137.757 408.372 1.00 0.00 C ATOM 0 H ALA A 23 292.167 136.165 406.345 1.00 0.00 H new ATOM 0 HA ALA A 23 292.892 135.637 409.105 1.00 0.00 H new ATOM 0 HB1 ALA A 23 292.889 138.258 409.330 1.00 0.00 H new ATOM 0 HB2 ALA A 23 294.092 137.675 408.156 1.00 0.00 H new ATOM 0 HB3 ALA A 23 292.541 138.336 407.587 1.00 0.00 H new ATOM 380 N THR A 24 289.861 136.388 408.300 1.00 0.00 N ATOM 381 CA THR A 24 288.484 136.613 408.806 1.00 0.00 C ATOM 382 C THR A 24 287.707 135.299 408.765 1.00 0.00 C ATOM 383 O THR A 24 287.608 134.653 407.722 1.00 0.00 O ATOM 384 CB THR A 24 287.728 137.695 407.995 1.00 0.00 C ATOM 385 OG1 THR A 24 288.413 138.945 408.028 1.00 0.00 O ATOM 386 CG2 THR A 24 286.284 137.972 408.487 1.00 0.00 C ATOM 0 H THR A 24 289.887 136.163 407.305 1.00 0.00 H new ATOM 0 HA THR A 24 288.563 136.974 409.831 1.00 0.00 H new ATOM 0 HB THR A 24 287.685 137.279 406.988 1.00 0.00 H new ATOM 0 HG1 THR A 24 287.912 139.606 407.506 1.00 0.00 H new ATOM 0 HG21 THR A 24 285.829 138.742 407.864 1.00 0.00 H new ATOM 0 HG22 THR A 24 285.695 137.057 408.421 1.00 0.00 H new ATOM 0 HG23 THR A 24 286.311 138.312 409.522 1.00 0.00 H new ATOM 394 N VAL A 25 287.073 134.839 409.897 1.00 0.00 N ATOM 395 CA VAL A 25 286.364 133.538 410.038 1.00 0.00 C ATOM 396 C VAL A 25 285.185 133.248 409.142 1.00 0.00 C ATOM 397 O VAL A 25 284.754 132.105 409.049 1.00 0.00 O ATOM 398 CB VAL A 25 286.072 133.014 411.463 1.00 0.00 C ATOM 399 CG1 VAL A 25 287.056 133.631 412.476 1.00 0.00 C ATOM 400 CG2 VAL A 25 284.590 133.142 411.926 1.00 0.00 C ATOM 0 H VAL A 25 287.047 135.388 410.756 1.00 0.00 H new ATOM 0 HA VAL A 25 287.199 132.958 409.644 1.00 0.00 H new ATOM 0 HB VAL A 25 286.234 131.937 411.420 1.00 0.00 H new ATOM 0 HG11 VAL A 25 286.836 133.252 413.474 1.00 0.00 H new ATOM 0 HG12 VAL A 25 288.076 133.362 412.202 1.00 0.00 H new ATOM 0 HG13 VAL A 25 286.952 134.716 412.469 1.00 0.00 H new ATOM 0 HG21 VAL A 25 284.489 132.747 412.937 1.00 0.00 H new ATOM 0 HG22 VAL A 25 284.295 134.191 411.915 1.00 0.00 H new ATOM 0 HG23 VAL A 25 283.948 132.577 411.250 1.00 0.00 H new ATOM 410 N ALA A 26 284.696 134.256 408.365 1.00 0.00 N ATOM 411 CA ALA A 26 283.700 134.199 407.302 1.00 0.00 C ATOM 412 C ALA A 26 284.011 133.089 406.276 1.00 0.00 C ATOM 413 O ALA A 26 283.151 132.315 405.865 1.00 0.00 O ATOM 414 CB ALA A 26 283.672 135.599 406.641 1.00 0.00 C ATOM 0 H ALA A 26 285.033 135.210 408.495 1.00 0.00 H new ATOM 0 HA ALA A 26 282.722 133.946 407.711 1.00 0.00 H new ATOM 0 HB1 ALA A 26 282.938 135.606 405.835 1.00 0.00 H new ATOM 0 HB2 ALA A 26 283.401 136.348 407.386 1.00 0.00 H new ATOM 0 HB3 ALA A 26 284.657 135.830 406.236 1.00 0.00 H new ATOM 420 N ALA A 27 285.320 132.978 405.949 1.00 0.00 N ATOM 421 CA ALA A 27 285.924 131.928 405.167 1.00 0.00 C ATOM 422 C ALA A 27 286.844 130.959 405.934 1.00 0.00 C ATOM 423 O ALA A 27 286.997 129.803 405.540 1.00 0.00 O ATOM 424 CB ALA A 27 286.586 132.644 403.986 1.00 0.00 C ATOM 0 H ALA A 27 286.004 133.671 406.253 1.00 0.00 H new ATOM 0 HA ALA A 27 285.164 131.222 404.832 1.00 0.00 H new ATOM 0 HB1 ALA A 27 287.070 131.911 403.341 1.00 0.00 H new ATOM 0 HB2 ALA A 27 285.829 133.184 403.417 1.00 0.00 H new ATOM 0 HB3 ALA A 27 287.331 133.347 404.358 1.00 0.00 H new ATOM 430 N HIS A 28 287.478 131.424 407.051 1.00 0.00 N ATOM 431 CA HIS A 28 288.438 130.721 407.925 1.00 0.00 C ATOM 432 C HIS A 28 287.868 129.626 408.819 1.00 0.00 C ATOM 433 O HIS A 28 288.608 128.792 409.331 1.00 0.00 O ATOM 434 CB HIS A 28 289.210 131.700 408.840 1.00 0.00 C ATOM 435 CG HIS A 28 290.673 131.400 408.957 1.00 0.00 C ATOM 436 ND1 HIS A 28 291.572 132.385 409.277 1.00 0.00 N ATOM 437 CD2 HIS A 28 291.394 130.245 408.884 1.00 0.00 C ATOM 438 CE1 HIS A 28 292.786 131.796 409.388 1.00 0.00 C ATOM 439 NE2 HIS A 28 292.725 130.501 409.166 1.00 0.00 N ATOM 0 H HIS A 28 287.311 132.375 407.380 1.00 0.00 H new ATOM 0 HA HIS A 28 289.089 130.236 407.198 1.00 0.00 H new ATOM 0 HB2 HIS A 28 289.087 132.713 408.457 1.00 0.00 H new ATOM 0 HB3 HIS A 28 288.765 131.679 409.835 1.00 0.00 H new ATOM 0 HD1 HIS A 28 291.365 133.375 409.407 1.00 0.00 H new ATOM 0 HD2 HIS A 28 290.987 129.274 408.642 1.00 0.00 H new ATOM 0 HE1 HIS A 28 293.695 132.326 409.630 1.00 0.00 H new ATOM 447 N LYS A 29 286.518 129.620 409.041 1.00 0.00 N ATOM 448 CA LYS A 29 285.738 128.659 409.828 1.00 0.00 C ATOM 449 C LYS A 29 285.711 127.255 409.232 1.00 0.00 C ATOM 450 O LYS A 29 285.285 126.296 409.864 1.00 0.00 O ATOM 451 CB LYS A 29 284.267 129.163 410.043 1.00 0.00 C ATOM 452 CG LYS A 29 283.327 129.087 408.808 1.00 0.00 C ATOM 453 CD LYS A 29 282.216 130.149 408.670 1.00 0.00 C ATOM 454 CE LYS A 29 281.635 130.745 409.959 1.00 0.00 C ATOM 455 NZ LYS A 29 281.072 129.698 410.847 1.00 0.00 N1+ ATOM 0 H LYS A 29 285.921 130.343 408.640 1.00 0.00 H new ATOM 0 HA LYS A 29 286.251 128.591 410.787 1.00 0.00 H new ATOM 0 HB2 LYS A 29 283.820 128.582 410.849 1.00 0.00 H new ATOM 0 HB3 LYS A 29 284.306 130.199 410.380 1.00 0.00 H new ATOM 0 HG2 LYS A 29 283.948 129.137 407.914 1.00 0.00 H new ATOM 0 HG3 LYS A 29 282.851 128.106 408.812 1.00 0.00 H new ATOM 0 HD2 LYS A 29 282.609 130.969 408.069 1.00 0.00 H new ATOM 0 HD3 LYS A 29 281.396 129.705 408.106 1.00 0.00 H new ATOM 0 HE2 LYS A 29 282.415 131.291 410.490 1.00 0.00 H new ATOM 0 HE3 LYS A 29 280.856 131.465 409.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 280.381 130.127 411.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 280.601 128.971 410.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 281.838 129.261 411.398 1.00 0.00 H new ATOM 469 N TYR A 30 286.179 127.132 407.963 1.00 0.00 N ATOM 470 CA TYR A 30 286.243 125.880 407.219 1.00 0.00 C ATOM 471 C TYR A 30 287.657 125.377 406.995 1.00 0.00 C ATOM 472 O TYR A 30 288.069 124.324 407.472 1.00 0.00 O ATOM 473 CB TYR A 30 285.617 126.049 405.809 1.00 0.00 C ATOM 474 CG TYR A 30 284.227 126.589 405.849 1.00 0.00 C ATOM 475 CD1 TYR A 30 283.300 126.239 406.807 1.00 0.00 C ATOM 476 CD2 TYR A 30 283.833 127.394 404.804 1.00 0.00 C ATOM 477 CE1 TYR A 30 281.996 126.651 406.681 1.00 0.00 C ATOM 478 CE2 TYR A 30 282.510 127.587 404.530 1.00 0.00 C ATOM 479 CZ TYR A 30 281.589 127.250 405.513 1.00 0.00 C ATOM 480 OH TYR A 30 280.211 127.455 405.385 1.00 0.00 O ATOM 0 H TYR A 30 286.527 127.929 407.430 1.00 0.00 H new ATOM 0 HA TYR A 30 285.697 125.164 407.833 1.00 0.00 H new ATOM 0 HB2 TYR A 30 286.243 126.717 405.217 1.00 0.00 H new ATOM 0 HB3 TYR A 30 285.612 125.084 405.302 1.00 0.00 H new ATOM 0 HD1 TYR A 30 283.599 125.642 407.656 1.00 0.00 H new ATOM 0 HD2 TYR A 30 284.580 127.879 404.193 1.00 0.00 H new ATOM 0 HE1 TYR A 30 281.297 126.506 407.492 1.00 0.00 H new ATOM 0 HE2 TYR A 30 282.190 127.989 403.580 1.00 0.00 H new ATOM 0 HH TYR A 30 279.867 126.913 404.644 1.00 0.00 H new ATOM 490 N VAL A 31 288.402 126.149 406.162 1.00 0.00 N ATOM 491 CA VAL A 31 289.747 125.920 405.683 1.00 0.00 C ATOM 492 C VAL A 31 290.239 127.310 405.588 1.00 0.00 C ATOM 493 O VAL A 31 289.399 128.187 405.423 1.00 0.00 O ATOM 494 CB VAL A 31 289.893 125.294 404.269 1.00 0.00 C ATOM 495 CG1 VAL A 31 288.596 124.598 403.836 1.00 0.00 C ATOM 496 CG2 VAL A 31 290.532 126.141 403.103 1.00 0.00 C ATOM 0 H VAL A 31 288.023 127.019 405.788 1.00 0.00 H new ATOM 0 HA VAL A 31 290.258 125.213 406.336 1.00 0.00 H new ATOM 0 HB VAL A 31 290.689 124.568 404.435 1.00 0.00 H new ATOM 0 HG11 VAL A 31 288.727 124.169 402.843 1.00 0.00 H new ATOM 0 HG12 VAL A 31 288.354 123.806 404.544 1.00 0.00 H new ATOM 0 HG13 VAL A 31 287.784 125.324 403.813 1.00 0.00 H new ATOM 0 HG21 VAL A 31 290.553 125.546 402.190 1.00 0.00 H new ATOM 0 HG22 VAL A 31 289.936 127.039 402.937 1.00 0.00 H new ATOM 0 HG23 VAL A 31 291.549 126.425 403.375 1.00 0.00 H new ATOM 506 N PRO A 32 291.516 127.597 405.656 1.00 0.00 N ATOM 507 CA PRO A 32 291.965 128.971 405.624 1.00 0.00 C ATOM 508 C PRO A 32 292.237 129.671 404.262 1.00 0.00 C ATOM 509 O PRO A 32 291.941 130.848 404.215 1.00 0.00 O ATOM 510 CB PRO A 32 293.246 128.767 406.454 1.00 0.00 C ATOM 511 CG PRO A 32 293.814 127.404 406.083 1.00 0.00 C ATOM 512 CD PRO A 32 292.530 126.617 406.053 1.00 0.00 C ATOM 0 HA PRO A 32 291.200 129.666 405.970 1.00 0.00 H new ATOM 0 HB2 PRO A 32 293.969 129.555 406.244 1.00 0.00 H new ATOM 0 HB3 PRO A 32 293.024 128.814 407.520 1.00 0.00 H new ATOM 0 HG2 PRO A 32 294.328 127.409 405.122 1.00 0.00 H new ATOM 0 HG3 PRO A 32 294.522 127.027 406.821 1.00 0.00 H new ATOM 0 HD2 PRO A 32 292.585 125.792 405.343 1.00 0.00 H new ATOM 0 HD3 PRO A 32 292.305 126.184 407.028 1.00 0.00 H new ATOM 520 N SER A 33 292.804 129.061 403.177 1.00 0.00 N ATOM 521 CA SER A 33 293.120 129.712 401.878 1.00 0.00 C ATOM 522 C SER A 33 293.756 128.711 400.906 1.00 0.00 C ATOM 523 O SER A 33 293.841 127.508 401.202 1.00 0.00 O ATOM 524 CB SER A 33 293.525 131.239 401.717 1.00 0.00 C ATOM 525 OG SER A 33 292.703 132.019 400.858 1.00 0.00 O ATOM 0 H SER A 33 293.059 128.073 403.189 1.00 0.00 H new ATOM 0 HA SER A 33 292.113 129.996 401.573 1.00 0.00 H new ATOM 0 HB2 SER A 33 293.523 131.700 402.705 1.00 0.00 H new ATOM 0 HB3 SER A 33 294.549 131.285 401.346 1.00 0.00 H new ATOM 0 HG SER A 33 291.821 132.137 401.268 1.00 0.00 H new ATOM 531 N TYR A 34 294.192 129.184 399.681 1.00 0.00 N ATOM 532 CA TYR A 34 294.832 128.510 398.508 1.00 0.00 C ATOM 533 C TYR A 34 295.967 127.497 398.773 1.00 0.00 C ATOM 534 O TYR A 34 296.235 126.583 397.993 1.00 0.00 O ATOM 535 CB TYR A 34 295.384 129.577 397.500 1.00 0.00 C ATOM 536 CG TYR A 34 294.442 130.729 397.224 1.00 0.00 C ATOM 537 CD1 TYR A 34 294.536 131.849 398.025 1.00 0.00 C ATOM 538 CD2 TYR A 34 293.564 130.760 396.141 1.00 0.00 C ATOM 539 CE1 TYR A 34 293.791 132.965 397.744 1.00 0.00 C ATOM 540 CE2 TYR A 34 292.850 131.911 395.807 1.00 0.00 C ATOM 541 CZ TYR A 34 292.990 133.009 396.636 1.00 0.00 C ATOM 542 OH TYR A 34 292.461 134.261 396.313 1.00 0.00 O ATOM 0 H TYR A 34 294.083 130.178 399.479 1.00 0.00 H new ATOM 0 HA TYR A 34 294.006 127.916 398.117 1.00 0.00 H new ATOM 0 HB2 TYR A 34 296.320 129.976 397.890 1.00 0.00 H new ATOM 0 HB3 TYR A 34 295.617 129.081 396.558 1.00 0.00 H new ATOM 0 HD1 TYR A 34 295.200 131.846 398.877 1.00 0.00 H new ATOM 0 HD2 TYR A 34 293.433 129.869 395.545 1.00 0.00 H new ATOM 0 HE1 TYR A 34 293.837 133.818 398.404 1.00 0.00 H new ATOM 0 HE2 TYR A 34 292.213 131.943 394.935 1.00 0.00 H new ATOM 0 HH TYR A 34 293.071 134.726 395.703 1.00 0.00 H new ATOM 552 N ALA A 35 296.579 127.617 399.976 1.00 0.00 N ATOM 553 CA ALA A 35 297.587 126.772 400.590 1.00 0.00 C ATOM 554 C ALA A 35 297.043 125.466 401.120 1.00 0.00 C ATOM 555 O ALA A 35 297.609 124.405 400.887 1.00 0.00 O ATOM 556 CB ALA A 35 298.202 127.542 401.789 1.00 0.00 C ATOM 0 H ALA A 35 296.341 128.396 400.590 1.00 0.00 H new ATOM 0 HA ALA A 35 298.316 126.535 399.815 1.00 0.00 H new ATOM 0 HB1 ALA A 35 298.963 126.925 402.266 1.00 0.00 H new ATOM 0 HB2 ALA A 35 298.656 128.467 401.433 1.00 0.00 H new ATOM 0 HB3 ALA A 35 297.420 127.776 402.511 1.00 0.00 H new ATOM 562 N PHE A 36 295.856 125.522 401.797 1.00 0.00 N ATOM 563 CA PHE A 36 295.069 124.379 402.232 1.00 0.00 C ATOM 564 C PHE A 36 294.389 123.809 400.992 1.00 0.00 C ATOM 565 O PHE A 36 294.476 122.615 400.708 1.00 0.00 O ATOM 566 CB PHE A 36 294.024 124.795 403.329 1.00 0.00 C ATOM 567 CG PHE A 36 293.079 123.635 403.729 1.00 0.00 C ATOM 568 CD1 PHE A 36 293.302 122.887 404.870 1.00 0.00 C ATOM 569 CD2 PHE A 36 292.005 123.245 402.923 1.00 0.00 C ATOM 570 CE1 PHE A 36 292.466 121.835 405.207 1.00 0.00 C ATOM 571 CE2 PHE A 36 291.155 122.211 403.254 1.00 0.00 C ATOM 572 CZ PHE A 36 291.383 121.507 404.414 1.00 0.00 C ATOM 0 H PHE A 36 295.425 126.410 402.053 1.00 0.00 H new ATOM 0 HA PHE A 36 295.705 123.624 402.694 1.00 0.00 H new ATOM 0 HB2 PHE A 36 294.554 125.147 404.214 1.00 0.00 H new ATOM 0 HB3 PHE A 36 293.430 125.631 402.960 1.00 0.00 H new ATOM 0 HD1 PHE A 36 294.140 123.126 405.508 1.00 0.00 H new ATOM 0 HD2 PHE A 36 291.833 123.778 401.999 1.00 0.00 H new ATOM 0 HE1 PHE A 36 292.663 121.263 406.102 1.00 0.00 H new ATOM 0 HE2 PHE A 36 290.324 121.958 402.613 1.00 0.00 H new ATOM 0 HZ PHE A 36 290.721 120.704 404.702 1.00 0.00 H new ATOM 582 N LEU A 37 293.703 124.699 400.205 1.00 0.00 N ATOM 583 CA LEU A 37 293.007 124.249 398.977 1.00 0.00 C ATOM 584 C LEU A 37 293.861 123.628 397.859 1.00 0.00 C ATOM 585 O LEU A 37 293.375 122.711 397.206 1.00 0.00 O ATOM 586 CB LEU A 37 291.848 125.134 398.425 1.00 0.00 C ATOM 587 CG LEU A 37 292.057 126.636 398.483 1.00 0.00 C ATOM 588 CD1 LEU A 37 292.058 127.267 397.087 1.00 0.00 C ATOM 589 CD2 LEU A 37 291.065 127.414 399.331 1.00 0.00 C ATOM 0 H LEU A 37 293.624 125.697 400.399 1.00 0.00 H new ATOM 0 HA LEU A 37 292.496 123.402 399.434 1.00 0.00 H new ATOM 0 HB2 LEU A 37 291.670 124.854 397.387 1.00 0.00 H new ATOM 0 HB3 LEU A 37 290.941 124.894 398.980 1.00 0.00 H new ATOM 0 HG LEU A 37 293.031 126.717 398.965 1.00 0.00 H new ATOM 0 HD11 LEU A 37 292.210 128.343 397.174 1.00 0.00 H new ATOM 0 HD12 LEU A 37 292.862 126.834 396.492 1.00 0.00 H new ATOM 0 HD13 LEU A 37 291.102 127.074 396.600 1.00 0.00 H new ATOM 0 HD21 LEU A 37 291.312 128.475 399.298 1.00 0.00 H new ATOM 0 HD22 LEU A 37 290.058 127.264 398.943 1.00 0.00 H new ATOM 0 HD23 LEU A 37 291.113 127.062 400.362 1.00 0.00 H new ATOM 601 N ARG A 38 295.172 123.996 397.648 1.00 0.00 N ATOM 602 CA ARG A 38 295.996 123.255 396.668 1.00 0.00 C ATOM 603 C ARG A 38 296.361 121.842 397.107 1.00 0.00 C ATOM 604 O ARG A 38 296.274 120.901 396.324 1.00 0.00 O ATOM 605 CB ARG A 38 297.295 124.007 396.300 1.00 0.00 C ATOM 606 CG ARG A 38 298.238 123.277 395.317 1.00 0.00 C ATOM 607 CD ARG A 38 299.126 124.257 394.547 1.00 0.00 C ATOM 608 NE ARG A 38 300.210 123.493 393.841 1.00 0.00 N ATOM 609 CZ ARG A 38 301.113 124.087 393.000 1.00 0.00 C ATOM 610 NH1 ARG A 38 301.003 125.407 392.670 1.00 0.00 N1+ ATOM 611 NH2 ARG A 38 302.132 123.344 392.480 1.00 0.00 N ATOM 0 H ARG A 38 295.646 124.763 398.124 1.00 0.00 H new ATOM 0 HA ARG A 38 295.352 123.181 395.791 1.00 0.00 H new ATOM 0 HB2 ARG A 38 297.025 124.970 395.867 1.00 0.00 H new ATOM 0 HB3 ARG A 38 297.846 124.213 397.218 1.00 0.00 H new ATOM 0 HG2 ARG A 38 298.864 122.575 395.868 1.00 0.00 H new ATOM 0 HG3 ARG A 38 297.647 122.692 394.613 1.00 0.00 H new ATOM 0 HD2 ARG A 38 298.530 124.816 393.826 1.00 0.00 H new ATOM 0 HD3 ARG A 38 299.564 124.984 395.231 1.00 0.00 H new ATOM 0 HE ARG A 38 300.276 122.487 393.995 1.00 0.00 H new ATOM 0 HH11 ARG A 38 300.240 125.966 393.051 1.00 0.00 H new ATOM 0 HH12 ARG A 38 301.684 125.834 392.042 1.00 0.00 H new ATOM 0 HH21 ARG A 38 302.216 122.356 392.719 1.00 0.00 H new ATOM 0 HH22 ARG A 38 302.810 123.777 391.853 1.00 0.00 H new ATOM 625 N ARG A 39 296.720 121.668 398.407 1.00 0.00 N ATOM 626 CA ARG A 39 296.993 120.378 399.042 1.00 0.00 C ATOM 627 C ARG A 39 295.755 119.490 399.219 1.00 0.00 C ATOM 628 O ARG A 39 295.823 118.269 399.078 1.00 0.00 O ATOM 629 CB ARG A 39 297.793 120.539 400.361 1.00 0.00 C ATOM 630 CG ARG A 39 299.055 121.430 400.242 1.00 0.00 C ATOM 631 CD ARG A 39 299.954 121.207 399.008 1.00 0.00 C ATOM 632 NE ARG A 39 300.366 119.760 398.938 1.00 0.00 N ATOM 633 CZ ARG A 39 300.781 119.151 397.782 1.00 0.00 C ATOM 634 NH1 ARG A 39 300.856 119.847 396.610 1.00 0.00 N1+ ATOM 635 NH2 ARG A 39 301.116 117.829 397.804 1.00 0.00 N ATOM 0 H ARG A 39 296.827 122.453 399.049 1.00 0.00 H new ATOM 0 HA ARG A 39 297.626 119.840 398.337 1.00 0.00 H new ATOM 0 HB2 ARG A 39 297.136 120.962 401.121 1.00 0.00 H new ATOM 0 HB3 ARG A 39 298.093 119.552 400.712 1.00 0.00 H new ATOM 0 HG2 ARG A 39 298.736 122.472 400.245 1.00 0.00 H new ATOM 0 HG3 ARG A 39 299.662 121.280 401.135 1.00 0.00 H new ATOM 0 HD2 ARG A 39 299.419 121.488 398.101 1.00 0.00 H new ATOM 0 HD3 ARG A 39 300.836 121.844 399.068 1.00 0.00 H new ATOM 0 HE ARG A 39 300.335 119.205 399.793 1.00 0.00 H new ATOM 0 HH11 ARG A 39 300.601 120.834 396.586 1.00 0.00 H new ATOM 0 HH12 ARG A 39 301.167 119.380 395.758 1.00 0.00 H new ATOM 0 HH21 ARG A 39 301.057 117.302 398.675 1.00 0.00 H new ATOM 0 HH22 ARG A 39 301.426 117.367 396.949 1.00 0.00 H new ATOM 649 N GLU A 40 294.572 120.112 399.496 1.00 0.00 N ATOM 650 CA GLU A 40 293.279 119.448 399.620 1.00 0.00 C ATOM 651 C GLU A 40 292.586 119.133 398.283 1.00 0.00 C ATOM 652 O GLU A 40 291.896 118.119 398.195 1.00 0.00 O ATOM 653 CB GLU A 40 292.373 120.191 400.637 1.00 0.00 C ATOM 654 CG GLU A 40 291.229 119.336 401.233 1.00 0.00 C ATOM 655 CD GLU A 40 289.958 119.422 400.391 1.00 0.00 C ATOM 656 OE1 GLU A 40 289.411 118.351 400.014 1.00 0.00 O ATOM 657 OE2 GLU A 40 289.518 120.569 400.123 1.00 0.00 O1- ATOM 0 H GLU A 40 294.511 121.120 399.640 1.00 0.00 H new ATOM 0 HA GLU A 40 293.480 118.457 400.026 1.00 0.00 H new ATOM 0 HB2 GLU A 40 292.994 120.561 401.453 1.00 0.00 H new ATOM 0 HB3 GLU A 40 291.939 121.062 400.147 1.00 0.00 H new ATOM 0 HG2 GLU A 40 291.550 118.297 401.301 1.00 0.00 H new ATOM 0 HG3 GLU A 40 291.016 119.671 402.248 1.00 0.00 H new ATOM 664 N LEU A 41 292.744 119.932 397.171 1.00 0.00 N ATOM 665 CA LEU A 41 292.134 119.516 395.886 1.00 0.00 C ATOM 666 C LEU A 41 293.004 118.538 395.091 1.00 0.00 C ATOM 667 O LEU A 41 292.574 118.029 394.060 1.00 0.00 O ATOM 668 CB LEU A 41 291.913 120.674 394.852 1.00 0.00 C ATOM 669 CG LEU A 41 290.930 121.803 395.241 1.00 0.00 C ATOM 670 CD1 LEU A 41 290.894 122.850 394.110 1.00 0.00 C ATOM 671 CD2 LEU A 41 289.494 121.296 395.501 1.00 0.00 C ATOM 0 H LEU A 41 293.259 120.812 397.149 1.00 0.00 H new ATOM 0 HA LEU A 41 291.194 119.089 396.235 1.00 0.00 H new ATOM 0 HB2 LEU A 41 292.882 121.129 394.645 1.00 0.00 H new ATOM 0 HB3 LEU A 41 291.563 120.230 393.920 1.00 0.00 H new ATOM 0 HG LEU A 41 291.292 122.236 396.174 1.00 0.00 H new ATOM 0 HD11 LEU A 41 290.203 123.650 394.376 1.00 0.00 H new ATOM 0 HD12 LEU A 41 291.892 123.265 393.967 1.00 0.00 H new ATOM 0 HD13 LEU A 41 290.562 122.376 393.186 1.00 0.00 H new ATOM 0 HD21 LEU A 41 288.854 122.137 395.769 1.00 0.00 H new ATOM 0 HD22 LEU A 41 289.108 120.819 394.600 1.00 0.00 H new ATOM 0 HD23 LEU A 41 289.505 120.574 396.317 1.00 0.00 H new ATOM 683 N GLY A 42 294.275 118.296 395.511 1.00 0.00 N ATOM 684 CA GLY A 42 295.259 117.445 394.828 1.00 0.00 C ATOM 685 C GLY A 42 295.867 117.982 393.538 1.00 0.00 C ATOM 686 O GLY A 42 296.838 117.429 393.029 1.00 0.00 O ATOM 0 H GLY A 42 294.645 118.708 396.367 1.00 0.00 H new ATOM 0 HA2 GLY A 42 296.072 117.241 395.525 1.00 0.00 H new ATOM 0 HA3 GLY A 42 294.783 116.490 394.605 1.00 0.00 H new ATOM 690 N LEU A 43 295.279 119.074 392.966 1.00 0.00 N ATOM 691 CA LEU A 43 295.665 119.695 391.703 1.00 0.00 C ATOM 692 C LEU A 43 296.421 121.012 391.808 1.00 0.00 C ATOM 693 O LEU A 43 296.134 121.861 392.657 1.00 0.00 O ATOM 694 CB LEU A 43 294.515 119.726 390.642 1.00 0.00 C ATOM 695 CG LEU A 43 293.685 121.017 390.408 1.00 0.00 C ATOM 696 CD1 LEU A 43 292.783 120.821 389.178 1.00 0.00 C ATOM 697 CD2 LEU A 43 292.831 121.437 391.611 1.00 0.00 C ATOM 0 H LEU A 43 294.492 119.550 393.407 1.00 0.00 H new ATOM 0 HA LEU A 43 296.418 119.007 391.319 1.00 0.00 H new ATOM 0 HB2 LEU A 43 294.956 119.450 389.684 1.00 0.00 H new ATOM 0 HB3 LEU A 43 293.812 118.937 390.908 1.00 0.00 H new ATOM 0 HG LEU A 43 294.401 121.823 390.249 1.00 0.00 H new ATOM 0 HD11 LEU A 43 292.197 121.725 389.009 1.00 0.00 H new ATOM 0 HD12 LEU A 43 293.400 120.619 388.303 1.00 0.00 H new ATOM 0 HD13 LEU A 43 292.111 119.980 389.350 1.00 0.00 H new ATOM 0 HD21 LEU A 43 292.282 122.347 391.368 1.00 0.00 H new ATOM 0 HD22 LEU A 43 292.126 120.641 391.852 1.00 0.00 H new ATOM 0 HD23 LEU A 43 293.477 121.622 392.469 1.00 0.00 H new ATOM 709 N SER A 44 297.395 121.242 390.867 1.00 0.00 N ATOM 710 CA SER A 44 298.291 122.408 390.691 1.00 0.00 C ATOM 711 C SER A 44 297.587 123.708 390.246 1.00 0.00 C ATOM 712 O SER A 44 297.968 124.368 389.282 1.00 0.00 O ATOM 713 CB SER A 44 299.451 122.033 389.698 1.00 0.00 C ATOM 714 OG SER A 44 300.530 122.974 389.649 1.00 0.00 O ATOM 0 H SER A 44 297.579 120.540 390.150 1.00 0.00 H new ATOM 0 HA SER A 44 298.690 122.635 391.680 1.00 0.00 H new ATOM 0 HB2 SER A 44 299.850 121.059 389.980 1.00 0.00 H new ATOM 0 HB3 SER A 44 299.033 121.929 388.697 1.00 0.00 H new ATOM 0 HG SER A 44 300.174 123.872 389.486 1.00 0.00 H new ATOM 720 N SER A 45 296.520 124.064 390.996 1.00 0.00 N ATOM 721 CA SER A 45 295.574 125.172 390.874 1.00 0.00 C ATOM 722 C SER A 45 296.109 126.557 391.248 1.00 0.00 C ATOM 723 O SER A 45 295.690 127.548 390.655 1.00 0.00 O ATOM 724 CB SER A 45 294.227 124.895 391.642 1.00 0.00 C ATOM 725 OG SER A 45 294.425 124.199 392.882 1.00 0.00 O ATOM 0 H SER A 45 296.280 123.496 391.809 1.00 0.00 H new ATOM 0 HA SER A 45 295.388 125.210 389.801 1.00 0.00 H new ATOM 0 HB2 SER A 45 293.725 125.842 391.839 1.00 0.00 H new ATOM 0 HB3 SER A 45 293.564 124.310 391.004 1.00 0.00 H new ATOM 0 HG SER A 45 293.724 124.456 393.517 1.00 0.00 H new ATOM 731 N ALA A 46 297.059 126.660 392.223 1.00 0.00 N ATOM 732 CA ALA A 46 297.594 127.872 392.869 1.00 0.00 C ATOM 733 C ALA A 46 298.462 128.816 392.028 1.00 0.00 C ATOM 734 O ALA A 46 299.064 129.758 392.537 1.00 0.00 O ATOM 735 CB ALA A 46 298.247 127.579 394.236 1.00 0.00 C ATOM 0 H ALA A 46 297.499 125.821 392.601 1.00 0.00 H new ATOM 0 HA ALA A 46 296.682 128.450 393.016 1.00 0.00 H new ATOM 0 HB1 ALA A 46 298.623 128.507 394.666 1.00 0.00 H new ATOM 0 HB2 ALA A 46 297.507 127.142 394.907 1.00 0.00 H new ATOM 0 HB3 ALA A 46 299.073 126.880 394.102 1.00 0.00 H new ATOM 741 N HIS A 47 298.565 128.535 390.705 1.00 0.00 N ATOM 742 CA HIS A 47 299.270 129.282 389.672 1.00 0.00 C ATOM 743 C HIS A 47 298.696 130.686 389.390 1.00 0.00 C ATOM 744 O HIS A 47 299.426 131.674 389.369 1.00 0.00 O ATOM 745 CB HIS A 47 299.290 128.424 388.378 1.00 0.00 C ATOM 746 CG HIS A 47 300.540 128.615 387.575 1.00 0.00 C ATOM 747 ND1 HIS A 47 301.741 128.032 387.912 1.00 0.00 N ATOM 748 CD2 HIS A 47 300.791 129.379 386.480 1.00 0.00 C ATOM 749 CE1 HIS A 47 302.655 128.464 387.008 1.00 0.00 C ATOM 750 NE2 HIS A 47 302.127 129.285 386.122 1.00 0.00 N ATOM 0 H HIS A 47 298.113 127.707 390.317 1.00 0.00 H new ATOM 0 HA HIS A 47 300.279 129.468 390.040 1.00 0.00 H new ATOM 0 HB2 HIS A 47 299.191 127.371 388.644 1.00 0.00 H new ATOM 0 HB3 HIS A 47 298.426 128.680 387.764 1.00 0.00 H new ATOM 0 HD2 HIS A 47 300.054 129.975 385.962 1.00 0.00 H new ATOM 0 HE1 HIS A 47 303.694 128.170 387.013 1.00 0.00 H new ATOM 0 HE2 HIS A 47 302.597 129.749 385.345 1.00 0.00 H new ATOM 758 N THR A 48 297.349 130.783 389.186 1.00 0.00 N ATOM 759 CA THR A 48 296.609 132.030 388.978 1.00 0.00 C ATOM 760 C THR A 48 295.304 131.957 389.778 1.00 0.00 C ATOM 761 O THR A 48 294.650 130.905 389.865 1.00 0.00 O ATOM 762 CB THR A 48 296.315 132.435 387.503 1.00 0.00 C ATOM 763 OG1 THR A 48 295.409 131.583 386.803 1.00 0.00 O ATOM 764 CG2 THR A 48 297.603 132.485 386.663 1.00 0.00 C ATOM 0 H THR A 48 296.745 129.961 389.164 1.00 0.00 H new ATOM 0 HA THR A 48 297.272 132.821 389.328 1.00 0.00 H new ATOM 0 HB THR A 48 295.850 133.415 387.609 1.00 0.00 H new ATOM 0 HG1 THR A 48 295.286 131.917 385.890 1.00 0.00 H new ATOM 0 HG21 THR A 48 297.359 132.771 385.640 1.00 0.00 H new ATOM 0 HG22 THR A 48 298.288 133.217 387.091 1.00 0.00 H new ATOM 0 HG23 THR A 48 298.075 131.503 386.662 1.00 0.00 H new ATOM 772 N ASN A 49 294.826 133.125 390.340 1.00 0.00 N ATOM 773 CA ASN A 49 293.564 133.263 391.096 1.00 0.00 C ATOM 774 C ASN A 49 292.341 132.954 390.247 1.00 0.00 C ATOM 775 O ASN A 49 291.367 132.426 390.752 1.00 0.00 O ATOM 776 CB ASN A 49 293.383 134.657 391.780 1.00 0.00 C ATOM 777 CG ASN A 49 292.848 134.596 393.223 1.00 0.00 C ATOM 778 OD1 ASN A 49 293.667 134.750 394.134 1.00 0.00 O ATOM 779 ND2 ASN A 49 291.527 134.402 393.498 1.00 0.00 N ATOM 0 H ASN A 49 295.335 134.006 390.266 1.00 0.00 H new ATOM 0 HA ASN A 49 293.647 132.518 391.888 1.00 0.00 H new ATOM 0 HB2 ASN A 49 294.343 135.173 391.783 1.00 0.00 H new ATOM 0 HB3 ASN A 49 292.701 135.257 391.178 1.00 0.00 H new ATOM 0 HD21 ASN A 49 291.205 134.383 394.466 1.00 0.00 H new ATOM 0 HD22 ASN A 49 290.861 134.276 392.736 1.00 0.00 H new ATOM 786 N ARG A 50 292.439 133.210 388.912 1.00 0.00 N ATOM 787 CA ARG A 50 291.459 132.928 387.880 1.00 0.00 C ATOM 788 C ARG A 50 291.330 131.437 387.562 1.00 0.00 C ATOM 789 O ARG A 50 290.215 130.961 387.394 1.00 0.00 O ATOM 790 CB ARG A 50 291.778 133.702 386.567 1.00 0.00 C ATOM 791 CG ARG A 50 292.085 135.208 386.735 1.00 0.00 C ATOM 792 CD ARG A 50 293.559 135.531 387.062 1.00 0.00 C ATOM 793 NE ARG A 50 293.731 137.022 387.208 1.00 0.00 N ATOM 794 CZ ARG A 50 294.041 137.865 386.173 1.00 0.00 C ATOM 795 NH1 ARG A 50 294.222 137.394 384.905 1.00 0.00 N1+ ATOM 796 NH2 ARG A 50 294.170 139.203 386.418 1.00 0.00 N ATOM 0 H ARG A 50 293.273 133.651 388.525 1.00 0.00 H new ATOM 0 HA ARG A 50 290.506 133.267 388.287 1.00 0.00 H new ATOM 0 HB2 ARG A 50 292.633 133.227 386.085 1.00 0.00 H new ATOM 0 HB3 ARG A 50 290.931 133.596 385.889 1.00 0.00 H new ATOM 0 HG2 ARG A 50 291.808 135.726 385.817 1.00 0.00 H new ATOM 0 HG3 ARG A 50 291.454 135.608 387.529 1.00 0.00 H new ATOM 0 HD2 ARG A 50 293.856 135.029 387.983 1.00 0.00 H new ATOM 0 HD3 ARG A 50 294.208 135.156 386.271 1.00 0.00 H new ATOM 0 HE ARG A 50 293.609 137.429 388.135 1.00 0.00 H new ATOM 0 HH11 ARG A 50 294.127 136.397 384.713 1.00 0.00 H new ATOM 0 HH12 ARG A 50 294.452 138.039 384.149 1.00 0.00 H new ATOM 0 HH21 ARG A 50 294.036 139.564 387.363 1.00 0.00 H new ATOM 0 HH22 ARG A 50 294.400 139.841 385.656 1.00 0.00 H new ATOM 810 N LYS A 51 292.461 130.665 387.503 1.00 0.00 N ATOM 811 CA LYS A 51 292.498 129.208 387.309 1.00 0.00 C ATOM 812 C LYS A 51 292.045 128.425 388.525 1.00 0.00 C ATOM 813 O LYS A 51 291.168 127.551 388.434 1.00 0.00 O ATOM 814 CB LYS A 51 293.922 128.726 386.931 1.00 0.00 C ATOM 815 CG LYS A 51 294.069 127.232 386.582 1.00 0.00 C ATOM 816 CD LYS A 51 295.526 126.865 386.276 1.00 0.00 C ATOM 817 CE LYS A 51 295.728 125.383 385.922 1.00 0.00 C ATOM 818 NZ LYS A 51 295.361 124.497 387.053 1.00 0.00 N1+ ATOM 0 H LYS A 51 293.393 131.069 387.594 1.00 0.00 H new ATOM 0 HA LYS A 51 291.798 129.016 386.496 1.00 0.00 H new ATOM 0 HB2 LYS A 51 294.266 129.312 386.078 1.00 0.00 H new ATOM 0 HB3 LYS A 51 294.591 128.950 387.762 1.00 0.00 H new ATOM 0 HG2 LYS A 51 293.707 126.626 387.413 1.00 0.00 H new ATOM 0 HG3 LYS A 51 293.445 126.996 385.720 1.00 0.00 H new ATOM 0 HD2 LYS A 51 295.880 127.479 385.448 1.00 0.00 H new ATOM 0 HD3 LYS A 51 296.143 127.110 387.141 1.00 0.00 H new ATOM 0 HE2 LYS A 51 295.124 125.131 385.051 1.00 0.00 H new ATOM 0 HE3 LYS A 51 296.769 125.212 385.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 295.477 123.504 386.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 295.978 124.698 387.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 294.370 124.667 387.320 1.00 0.00 H new ATOM 832 N VAL A 52 292.565 128.785 389.759 1.00 0.00 N ATOM 833 CA VAL A 52 292.123 128.135 391.014 1.00 0.00 C ATOM 834 C VAL A 52 290.705 128.448 391.319 1.00 0.00 C ATOM 835 O VAL A 52 289.936 127.515 391.529 1.00 0.00 O ATOM 836 CB VAL A 52 292.949 128.316 392.308 1.00 0.00 C ATOM 837 CG1 VAL A 52 293.146 129.784 392.744 1.00 0.00 C ATOM 838 CG2 VAL A 52 292.408 127.416 393.467 1.00 0.00 C ATOM 0 H VAL A 52 293.274 129.507 389.888 1.00 0.00 H new ATOM 0 HA VAL A 52 292.290 127.091 390.748 1.00 0.00 H new ATOM 0 HB VAL A 52 293.953 127.972 392.059 1.00 0.00 H new ATOM 0 HG11 VAL A 52 293.736 129.815 393.660 1.00 0.00 H new ATOM 0 HG12 VAL A 52 293.667 130.330 391.958 1.00 0.00 H new ATOM 0 HG13 VAL A 52 292.174 130.244 392.923 1.00 0.00 H new ATOM 0 HG21 VAL A 52 293.013 127.570 394.360 1.00 0.00 H new ATOM 0 HG22 VAL A 52 291.372 127.681 393.680 1.00 0.00 H new ATOM 0 HG23 VAL A 52 292.461 126.369 393.169 1.00 0.00 H new ATOM 848 N TRP A 53 290.299 129.761 391.229 1.00 0.00 N ATOM 849 CA TRP A 53 288.919 130.197 391.383 1.00 0.00 C ATOM 850 C TRP A 53 288.009 129.609 390.344 1.00 0.00 C ATOM 851 O TRP A 53 286.954 129.161 390.713 1.00 0.00 O ATOM 852 CB TRP A 53 288.686 131.698 391.609 1.00 0.00 C ATOM 853 CG TRP A 53 288.922 132.278 392.977 1.00 0.00 C ATOM 854 CD1 TRP A 53 288.439 133.498 393.343 1.00 0.00 C ATOM 855 CD2 TRP A 53 289.363 131.637 394.194 1.00 0.00 C ATOM 856 NE1 TRP A 53 288.540 133.662 394.688 1.00 0.00 N ATOM 857 CE2 TRP A 53 289.167 132.558 395.218 1.00 0.00 C ATOM 858 CE3 TRP A 53 289.846 130.381 394.466 1.00 0.00 C ATOM 859 CZ2 TRP A 53 289.514 132.261 396.498 1.00 0.00 C ATOM 860 CZ3 TRP A 53 290.216 130.097 395.752 1.00 0.00 C ATOM 861 CH2 TRP A 53 290.096 131.040 396.739 1.00 0.00 C ATOM 0 H TRP A 53 290.946 130.528 391.046 1.00 0.00 H new ATOM 0 HA TRP A 53 288.637 129.773 392.347 1.00 0.00 H new ATOM 0 HB2 TRP A 53 289.323 132.238 390.909 1.00 0.00 H new ATOM 0 HB3 TRP A 53 287.654 131.915 391.334 1.00 0.00 H new ATOM 0 HD1 TRP A 53 288.033 134.231 392.661 1.00 0.00 H new ATOM 0 HE1 TRP A 53 288.207 134.468 395.216 1.00 0.00 H new ATOM 0 HE3 TRP A 53 289.931 129.638 393.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 289.338 132.962 397.300 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 290.607 129.119 395.992 1.00 0.00 H new ATOM 0 HH2 TRP A 53 290.467 130.818 397.729 1.00 0.00 H new ATOM 872 N LYS A 54 288.415 129.406 389.072 1.00 0.00 N ATOM 873 CA LYS A 54 287.641 128.598 388.111 1.00 0.00 C ATOM 874 C LYS A 54 287.450 127.135 388.496 1.00 0.00 C ATOM 875 O LYS A 54 286.326 126.662 388.416 1.00 0.00 O ATOM 876 CB LYS A 54 288.461 128.613 386.807 1.00 0.00 C ATOM 877 CG LYS A 54 288.477 127.419 385.837 1.00 0.00 C ATOM 878 CD LYS A 54 289.259 127.787 384.574 1.00 0.00 C ATOM 879 CE LYS A 54 289.348 126.639 383.563 1.00 0.00 C ATOM 880 NZ LYS A 54 290.158 127.033 382.388 1.00 0.00 N1+ ATOM 0 H LYS A 54 289.277 129.793 388.688 1.00 0.00 H new ATOM 0 HA LYS A 54 286.642 129.029 388.049 1.00 0.00 H new ATOM 0 HB2 LYS A 54 288.125 129.478 386.235 1.00 0.00 H new ATOM 0 HB3 LYS A 54 289.497 128.801 387.090 1.00 0.00 H new ATOM 0 HG2 LYS A 54 288.933 126.554 386.319 1.00 0.00 H new ATOM 0 HG3 LYS A 54 287.457 127.138 385.575 1.00 0.00 H new ATOM 0 HD2 LYS A 54 288.785 128.646 384.098 1.00 0.00 H new ATOM 0 HD3 LYS A 54 290.266 128.094 384.855 1.00 0.00 H new ATOM 0 HE2 LYS A 54 289.791 125.764 384.038 1.00 0.00 H new ATOM 0 HE3 LYS A 54 288.346 126.354 383.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 290.205 126.240 381.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 289.720 127.854 381.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 291.119 127.282 382.697 1.00 0.00 H new ATOM 894 N LYS A 55 288.498 126.393 388.997 1.00 0.00 N ATOM 895 CA LYS A 55 288.306 125.017 389.534 1.00 0.00 C ATOM 896 C LYS A 55 287.426 124.984 390.807 1.00 0.00 C ATOM 897 O LYS A 55 286.499 124.184 390.988 1.00 0.00 O ATOM 898 CB LYS A 55 289.653 124.300 389.835 1.00 0.00 C ATOM 899 CG LYS A 55 290.637 124.259 388.657 1.00 0.00 C ATOM 900 CD LYS A 55 290.104 123.452 387.467 1.00 0.00 C ATOM 901 CE LYS A 55 291.155 123.228 386.373 1.00 0.00 C ATOM 902 NZ LYS A 55 291.596 124.511 385.777 1.00 0.00 N1+ ATOM 0 H LYS A 55 289.461 126.727 389.035 1.00 0.00 H new ATOM 0 HA LYS A 55 287.788 124.481 388.738 1.00 0.00 H new ATOM 0 HB2 LYS A 55 290.135 124.800 390.675 1.00 0.00 H new ATOM 0 HB3 LYS A 55 289.442 123.278 390.150 1.00 0.00 H new ATOM 0 HG2 LYS A 55 290.852 125.277 388.333 1.00 0.00 H new ATOM 0 HG3 LYS A 55 291.580 123.826 388.991 1.00 0.00 H new ATOM 0 HD2 LYS A 55 289.746 122.486 387.822 1.00 0.00 H new ATOM 0 HD3 LYS A 55 289.247 123.971 387.038 1.00 0.00 H new ATOM 0 HE2 LYS A 55 292.014 122.706 386.793 1.00 0.00 H new ATOM 0 HE3 LYS A 55 290.742 122.586 385.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 291.821 124.368 384.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 290.835 125.214 385.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 292.442 124.853 386.276 1.00 0.00 H new ATOM 916 N PHE A 56 287.674 125.993 391.678 1.00 0.00 N ATOM 917 CA PHE A 56 286.906 126.298 392.908 1.00 0.00 C ATOM 918 C PHE A 56 285.424 126.643 392.676 1.00 0.00 C ATOM 919 O PHE A 56 284.493 126.038 393.214 1.00 0.00 O ATOM 920 CB PHE A 56 287.595 127.436 393.717 1.00 0.00 C ATOM 921 CG PHE A 56 287.951 126.927 395.064 1.00 0.00 C ATOM 922 CD1 PHE A 56 287.257 127.351 396.166 1.00 0.00 C ATOM 923 CD2 PHE A 56 288.889 125.924 395.190 1.00 0.00 C ATOM 924 CE1 PHE A 56 287.486 126.777 397.391 1.00 0.00 C ATOM 925 CE2 PHE A 56 289.093 125.313 396.405 1.00 0.00 C ATOM 926 CZ PHE A 56 288.403 125.756 397.511 1.00 0.00 C ATOM 0 H PHE A 56 288.447 126.643 391.536 1.00 0.00 H new ATOM 0 HA PHE A 56 286.909 125.370 393.479 1.00 0.00 H new ATOM 0 HB2 PHE A 56 288.489 127.779 393.196 1.00 0.00 H new ATOM 0 HB3 PHE A 56 286.927 128.293 393.803 1.00 0.00 H new ATOM 0 HD1 PHE A 56 286.526 128.141 396.070 1.00 0.00 H new ATOM 0 HD2 PHE A 56 289.466 125.617 394.330 1.00 0.00 H new ATOM 0 HE1 PHE A 56 286.948 127.125 398.260 1.00 0.00 H new ATOM 0 HE2 PHE A 56 289.789 124.492 396.491 1.00 0.00 H new ATOM 0 HZ PHE A 56 288.581 125.302 398.475 1.00 0.00 H new ATOM 936 N VAL A 57 285.170 127.612 391.762 1.00 0.00 N ATOM 937 CA VAL A 57 283.883 128.010 391.204 1.00 0.00 C ATOM 938 C VAL A 57 283.178 126.929 390.383 1.00 0.00 C ATOM 939 O VAL A 57 281.957 126.798 390.443 1.00 0.00 O ATOM 940 CB VAL A 57 283.507 129.500 391.140 1.00 0.00 C ATOM 941 CG1 VAL A 57 283.054 129.918 392.578 1.00 0.00 C ATOM 942 CG2 VAL A 57 284.555 130.512 390.661 1.00 0.00 C ATOM 0 H VAL A 57 285.930 128.171 391.375 1.00 0.00 H new ATOM 0 HA VAL A 57 283.152 128.055 392.011 1.00 0.00 H new ATOM 0 HB VAL A 57 282.743 129.550 390.364 1.00 0.00 H new ATOM 0 HG11 VAL A 57 282.777 130.972 392.580 1.00 0.00 H new ATOM 0 HG12 VAL A 57 282.196 129.317 392.878 1.00 0.00 H new ATOM 0 HG13 VAL A 57 283.873 129.757 393.279 1.00 0.00 H new ATOM 0 HG21 VAL A 57 284.127 131.514 390.677 1.00 0.00 H new ATOM 0 HG22 VAL A 57 285.422 130.478 391.321 1.00 0.00 H new ATOM 0 HG23 VAL A 57 284.862 130.264 389.645 1.00 0.00 H new ATOM 952 N GLU A 58 283.963 126.043 389.691 1.00 0.00 N ATOM 953 CA GLU A 58 283.522 124.756 389.121 1.00 0.00 C ATOM 954 C GLU A 58 283.032 123.759 390.207 1.00 0.00 C ATOM 955 O GLU A 58 282.022 123.095 389.999 1.00 0.00 O ATOM 956 CB GLU A 58 284.609 124.121 388.214 1.00 0.00 C ATOM 957 CG GLU A 58 284.150 122.923 387.360 1.00 0.00 C ATOM 958 CD GLU A 58 285.272 122.443 386.434 1.00 0.00 C ATOM 959 OE1 GLU A 58 285.016 121.475 385.668 1.00 0.00 O ATOM 960 OE2 GLU A 58 286.392 123.021 386.475 1.00 0.00 O1- ATOM 0 H GLU A 58 284.951 126.225 389.517 1.00 0.00 H new ATOM 0 HA GLU A 58 282.661 124.981 388.491 1.00 0.00 H new ATOM 0 HB2 GLU A 58 284.996 124.892 387.547 1.00 0.00 H new ATOM 0 HB3 GLU A 58 285.438 123.798 388.843 1.00 0.00 H new ATOM 0 HG2 GLU A 58 283.838 122.107 388.011 1.00 0.00 H new ATOM 0 HG3 GLU A 58 283.281 123.207 386.766 1.00 0.00 H new ATOM 967 N ALA A 59 283.673 123.710 391.435 1.00 0.00 N ATOM 968 CA ALA A 59 283.153 123.000 392.635 1.00 0.00 C ATOM 969 C ALA A 59 281.842 123.520 393.162 1.00 0.00 C ATOM 970 O ALA A 59 280.931 122.773 393.471 1.00 0.00 O ATOM 971 CB ALA A 59 283.963 123.206 393.955 1.00 0.00 C ATOM 0 H ALA A 59 284.568 124.170 391.602 1.00 0.00 H new ATOM 0 HA ALA A 59 283.156 121.990 392.224 1.00 0.00 H new ATOM 0 HB1 ALA A 59 283.493 122.643 394.762 1.00 0.00 H new ATOM 0 HB2 ALA A 59 284.985 122.854 393.814 1.00 0.00 H new ATOM 0 HB3 ALA A 59 283.977 124.265 394.212 1.00 0.00 H new ATOM 977 N TYR A 60 281.789 124.867 393.324 1.00 0.00 N ATOM 978 CA TYR A 60 280.891 125.721 394.101 1.00 0.00 C ATOM 979 C TYR A 60 279.361 125.471 393.919 1.00 0.00 C ATOM 980 O TYR A 60 278.532 125.897 394.702 1.00 0.00 O ATOM 981 CB TYR A 60 281.282 127.174 393.692 1.00 0.00 C ATOM 982 CG TYR A 60 280.836 128.397 394.464 1.00 0.00 C ATOM 983 CD1 TYR A 60 279.762 129.141 393.997 1.00 0.00 C ATOM 984 CD2 TYR A 60 281.681 128.982 395.400 1.00 0.00 C ATOM 985 CE1 TYR A 60 279.536 130.428 394.454 1.00 0.00 C ATOM 986 CE2 TYR A 60 281.489 130.283 395.822 1.00 0.00 C ATOM 987 CZ TYR A 60 280.404 131.000 395.358 1.00 0.00 C ATOM 988 OH TYR A 60 280.199 132.313 395.832 1.00 0.00 O ATOM 0 H TYR A 60 282.476 125.445 392.840 1.00 0.00 H new ATOM 0 HA TYR A 60 281.025 125.502 395.160 1.00 0.00 H new ATOM 0 HB2 TYR A 60 282.371 127.205 393.666 1.00 0.00 H new ATOM 0 HB3 TYR A 60 280.934 127.311 392.668 1.00 0.00 H new ATOM 0 HD1 TYR A 60 279.093 128.710 393.267 1.00 0.00 H new ATOM 0 HD2 TYR A 60 282.502 128.409 395.804 1.00 0.00 H new ATOM 0 HE1 TYR A 60 278.679 130.984 394.102 1.00 0.00 H new ATOM 0 HE2 TYR A 60 282.185 130.738 396.512 1.00 0.00 H new ATOM 0 HH TYR A 60 279.335 132.646 395.510 1.00 0.00 H new ATOM 998 N GLY A 61 278.943 124.695 392.892 1.00 0.00 N ATOM 999 CA GLY A 61 277.606 124.095 392.798 1.00 0.00 C ATOM 1000 C GLY A 61 277.361 122.848 393.664 1.00 0.00 C ATOM 1001 O GLY A 61 276.214 122.457 393.855 1.00 0.00 O ATOM 0 H GLY A 61 279.540 124.469 392.097 1.00 0.00 H new ATOM 0 HA2 GLY A 61 276.871 124.852 393.071 1.00 0.00 H new ATOM 0 HA3 GLY A 61 277.421 123.831 391.757 1.00 0.00 H new ATOM 1005 N LYS A 62 278.414 122.174 394.224 1.00 0.00 N ATOM 1006 CA LYS A 62 278.348 120.922 394.990 1.00 0.00 C ATOM 1007 C LYS A 62 277.807 120.892 396.420 1.00 0.00 C ATOM 1008 O LYS A 62 277.214 119.894 396.804 1.00 0.00 O ATOM 1009 CB LYS A 62 279.681 120.099 394.888 1.00 0.00 C ATOM 1010 CG LYS A 62 280.973 120.724 395.470 1.00 0.00 C ATOM 1011 CD LYS A 62 281.623 120.093 396.711 1.00 0.00 C ATOM 1012 CE LYS A 62 281.089 120.659 398.031 1.00 0.00 C ATOM 1013 NZ LYS A 62 281.994 120.339 399.160 1.00 0.00 N1+ ATOM 0 H LYS A 62 279.370 122.520 394.140 1.00 0.00 H new ATOM 0 HA LYS A 62 277.522 120.451 394.457 1.00 0.00 H new ATOM 0 HB2 LYS A 62 279.521 119.142 395.385 1.00 0.00 H new ATOM 0 HB3 LYS A 62 279.860 119.885 393.834 1.00 0.00 H new ATOM 0 HG2 LYS A 62 281.720 120.729 394.676 1.00 0.00 H new ATOM 0 HG3 LYS A 62 280.754 121.765 395.709 1.00 0.00 H new ATOM 0 HD2 LYS A 62 281.456 119.016 396.692 1.00 0.00 H new ATOM 0 HD3 LYS A 62 282.701 120.249 396.667 1.00 0.00 H new ATOM 0 HE2 LYS A 62 280.977 121.740 397.947 1.00 0.00 H new ATOM 0 HE3 LYS A 62 280.098 120.251 398.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 281.605 120.735 400.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 282.080 119.307 399.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 282.932 120.750 398.980 1.00 0.00 H new ATOM 1027 N ALA A 63 277.967 121.942 397.263 1.00 0.00 N ATOM 1028 CA ALA A 63 277.467 121.986 398.648 1.00 0.00 C ATOM 1029 C ALA A 63 276.335 122.994 398.784 1.00 0.00 C ATOM 1030 O ALA A 63 276.125 123.585 399.840 1.00 0.00 O ATOM 1031 CB ALA A 63 278.572 122.298 399.702 1.00 0.00 C ATOM 0 H ALA A 63 278.457 122.794 396.989 1.00 0.00 H new ATOM 0 HA ALA A 63 277.100 120.982 398.859 1.00 0.00 H new ATOM 0 HB1 ALA A 63 278.130 122.314 400.698 1.00 0.00 H new ATOM 0 HB2 ALA A 63 279.343 121.529 399.659 1.00 0.00 H new ATOM 0 HB3 ALA A 63 279.017 123.270 399.486 1.00 0.00 H new ATOM 1037 N ILE A 64 275.559 123.231 397.706 1.00 0.00 N ATOM 1038 CA ILE A 64 274.447 124.177 397.698 1.00 0.00 C ATOM 1039 C ILE A 64 273.148 123.614 397.085 1.00 0.00 C ATOM 1040 O ILE A 64 272.914 123.752 395.885 1.00 0.00 O ATOM 1041 CB ILE A 64 274.907 125.512 397.112 1.00 0.00 C ATOM 1042 CG1 ILE A 64 273.904 126.636 397.450 1.00 0.00 C ATOM 1043 CG2 ILE A 64 275.336 125.423 395.631 1.00 0.00 C ATOM 1044 CD1 ILE A 64 274.577 128.007 397.567 1.00 0.00 C ATOM 0 H ILE A 64 275.697 122.761 396.811 1.00 0.00 H new ATOM 0 HA ILE A 64 274.153 124.363 398.731 1.00 0.00 H new ATOM 0 HB ILE A 64 275.838 125.793 397.605 1.00 0.00 H new ATOM 0 HG12 ILE A 64 273.135 126.677 396.678 1.00 0.00 H new ATOM 0 HG13 ILE A 64 273.402 126.400 398.388 1.00 0.00 H new ATOM 0 HG21 ILE A 64 275.650 126.407 395.283 1.00 0.00 H new ATOM 0 HG22 ILE A 64 276.165 124.723 395.534 1.00 0.00 H new ATOM 0 HG23 ILE A 64 274.496 125.076 395.029 1.00 0.00 H new ATOM 0 HD11 ILE A 64 273.827 128.761 397.806 1.00 0.00 H new ATOM 0 HD12 ILE A 64 275.327 127.978 398.357 1.00 0.00 H new ATOM 0 HD13 ILE A 64 275.057 128.259 396.621 1.00 0.00 H new ATOM 1056 N PRO A 65 272.249 122.939 397.848 1.00 0.00 N ATOM 1057 CA PRO A 65 270.987 122.368 397.346 1.00 0.00 C ATOM 1058 C PRO A 65 269.871 123.341 396.880 1.00 0.00 C ATOM 1059 O PRO A 65 269.270 122.959 395.876 1.00 0.00 O ATOM 1060 CB PRO A 65 270.503 121.441 398.492 1.00 0.00 C ATOM 1061 CG PRO A 65 271.754 121.173 399.330 1.00 0.00 C ATOM 1062 CD PRO A 65 272.519 122.489 399.216 1.00 0.00 C ATOM 0 HA PRO A 65 271.198 121.864 396.403 1.00 0.00 H new ATOM 0 HB2 PRO A 65 269.724 121.919 399.086 1.00 0.00 H new ATOM 0 HB3 PRO A 65 270.082 120.515 398.101 1.00 0.00 H new ATOM 0 HG2 PRO A 65 271.506 120.937 400.365 1.00 0.00 H new ATOM 0 HG3 PRO A 65 272.331 120.334 398.941 1.00 0.00 H new ATOM 0 HD2 PRO A 65 272.174 123.216 399.951 1.00 0.00 H new ATOM 0 HD3 PRO A 65 273.586 122.346 399.386 1.00 0.00 H new ATOM 1070 N PRO A 66 269.467 124.489 397.492 1.00 0.00 N ATOM 1071 CA PRO A 66 268.320 125.281 397.040 1.00 0.00 C ATOM 1072 C PRO A 66 268.759 126.421 396.102 1.00 0.00 C ATOM 1073 O PRO A 66 269.431 126.192 395.100 1.00 0.00 O ATOM 1074 CB PRO A 66 267.757 125.769 398.394 1.00 0.00 C ATOM 1075 CG PRO A 66 268.998 126.050 399.247 1.00 0.00 C ATOM 1076 CD PRO A 66 269.977 124.966 398.781 1.00 0.00 C ATOM 0 HA PRO A 66 267.586 124.743 396.440 1.00 0.00 H new ATOM 0 HB2 PRO A 66 267.149 126.665 398.271 1.00 0.00 H new ATOM 0 HB3 PRO A 66 267.121 125.013 398.855 1.00 0.00 H new ATOM 0 HG2 PRO A 66 269.390 127.052 399.074 1.00 0.00 H new ATOM 0 HG3 PRO A 66 268.784 125.971 400.313 1.00 0.00 H new ATOM 0 HD2 PRO A 66 270.985 125.369 398.677 1.00 0.00 H new ATOM 0 HD3 PRO A 66 270.032 124.152 399.504 1.00 0.00 H new ATOM 1084 N ALA A 67 268.365 127.681 396.410 1.00 0.00 N ATOM 1085 CA ALA A 67 268.673 128.883 395.659 1.00 0.00 C ATOM 1086 C ALA A 67 269.836 129.629 396.338 1.00 0.00 C ATOM 1087 O ALA A 67 269.715 129.902 397.533 1.00 0.00 O ATOM 1088 CB ALA A 67 267.420 129.785 395.593 1.00 0.00 C ATOM 0 H ALA A 67 267.796 127.876 397.234 1.00 0.00 H new ATOM 0 HA ALA A 67 268.970 128.618 394.644 1.00 0.00 H new ATOM 0 HB1 ALA A 67 267.651 130.688 395.029 1.00 0.00 H new ATOM 0 HB2 ALA A 67 266.610 129.247 395.101 1.00 0.00 H new ATOM 0 HB3 ALA A 67 267.114 130.057 396.603 1.00 0.00 H new ATOM 1094 N PRO A 68 270.966 129.991 395.675 1.00 0.00 N ATOM 1095 CA PRO A 68 272.154 130.612 396.285 1.00 0.00 C ATOM 1096 C PRO A 68 272.055 131.942 397.060 1.00 0.00 C ATOM 1097 O PRO A 68 272.731 131.960 398.088 1.00 0.00 O ATOM 1098 CB PRO A 68 273.165 130.716 395.122 1.00 0.00 C ATOM 1099 CG PRO A 68 272.774 129.565 394.199 1.00 0.00 C ATOM 1100 CD PRO A 68 271.249 129.560 394.303 1.00 0.00 C ATOM 0 HA PRO A 68 272.427 129.971 397.124 1.00 0.00 H new ATOM 0 HB2 PRO A 68 273.094 131.678 394.615 1.00 0.00 H new ATOM 0 HB3 PRO A 68 274.192 130.616 395.474 1.00 0.00 H new ATOM 0 HG2 PRO A 68 273.110 129.733 393.176 1.00 0.00 H new ATOM 0 HG3 PRO A 68 273.206 128.619 394.525 1.00 0.00 H new ATOM 0 HD2 PRO A 68 270.801 130.237 393.575 1.00 0.00 H new ATOM 0 HD3 PRO A 68 270.842 128.568 394.108 1.00 0.00 H new ATOM 1108 N PRO A 69 271.378 133.069 396.723 1.00 0.00 N ATOM 1109 CA PRO A 69 271.430 134.317 397.497 1.00 0.00 C ATOM 1110 C PRO A 69 270.561 134.275 398.769 1.00 0.00 C ATOM 1111 O PRO A 69 269.367 134.560 398.710 1.00 0.00 O ATOM 1112 CB PRO A 69 270.968 135.379 396.475 1.00 0.00 C ATOM 1113 CG PRO A 69 270.024 134.629 395.531 1.00 0.00 C ATOM 1114 CD PRO A 69 270.639 133.229 395.470 1.00 0.00 C ATOM 0 HA PRO A 69 272.422 134.526 397.898 1.00 0.00 H new ATOM 0 HB2 PRO A 69 270.459 136.207 396.968 1.00 0.00 H new ATOM 0 HB3 PRO A 69 271.814 135.802 395.934 1.00 0.00 H new ATOM 0 HG2 PRO A 69 269.004 134.605 395.915 1.00 0.00 H new ATOM 0 HG3 PRO A 69 269.983 135.095 394.547 1.00 0.00 H new ATOM 0 HD2 PRO A 69 269.867 132.466 395.370 1.00 0.00 H new ATOM 0 HD3 PRO A 69 271.300 133.128 394.609 1.00 0.00 H new ATOM 1122 N ALA A 70 271.172 133.932 399.930 1.00 0.00 N ATOM 1123 CA ALA A 70 270.523 133.846 401.229 1.00 0.00 C ATOM 1124 C ALA A 70 271.532 134.253 402.312 1.00 0.00 C ATOM 1125 O ALA A 70 272.710 133.902 402.181 1.00 0.00 O ATOM 1126 CB ALA A 70 270.016 132.409 401.487 1.00 0.00 C ATOM 0 H ALA A 70 272.165 133.703 399.971 1.00 0.00 H new ATOM 0 HA ALA A 70 269.664 134.517 401.252 1.00 0.00 H new ATOM 0 HB1 ALA A 70 269.533 132.363 402.463 1.00 0.00 H new ATOM 0 HB2 ALA A 70 269.299 132.132 400.714 1.00 0.00 H new ATOM 0 HB3 ALA A 70 270.858 131.717 401.466 1.00 0.00 H new ATOM 1132 N PRO A 71 271.170 134.988 403.391 1.00 0.00 N ATOM 1133 CA PRO A 71 272.110 135.455 404.415 1.00 0.00 C ATOM 1134 C PRO A 71 272.370 134.398 405.517 1.00 0.00 C ATOM 1135 O PRO A 71 271.588 133.451 405.629 1.00 0.00 O ATOM 1136 CB PRO A 71 271.359 136.681 404.983 1.00 0.00 C ATOM 1137 CG PRO A 71 269.880 136.286 404.921 1.00 0.00 C ATOM 1138 CD PRO A 71 269.809 135.480 403.622 1.00 0.00 C ATOM 0 HA PRO A 71 273.103 135.670 404.021 1.00 0.00 H new ATOM 0 HB2 PRO A 71 271.669 136.898 406.005 1.00 0.00 H new ATOM 0 HB3 PRO A 71 271.556 137.576 404.393 1.00 0.00 H new ATOM 0 HG2 PRO A 71 269.582 135.692 405.785 1.00 0.00 H new ATOM 0 HG3 PRO A 71 269.227 137.159 404.894 1.00 0.00 H new ATOM 0 HD2 PRO A 71 269.103 134.654 403.711 1.00 0.00 H new ATOM 0 HD3 PRO A 71 269.470 136.101 402.793 1.00 0.00 H new ATOM 1146 N PRO A 72 273.437 134.520 406.342 1.00 0.00 N ATOM 1147 CA PRO A 72 273.721 133.628 407.470 1.00 0.00 C ATOM 1148 C PRO A 72 272.841 133.957 408.698 1.00 0.00 C ATOM 1149 O PRO A 72 272.673 135.129 409.054 1.00 0.00 O ATOM 1150 CB PRO A 72 275.227 133.860 407.702 1.00 0.00 C ATOM 1151 CG PRO A 72 275.487 135.308 407.279 1.00 0.00 C ATOM 1152 CD PRO A 72 274.445 135.571 406.199 1.00 0.00 C ATOM 0 HA PRO A 72 273.490 132.580 407.281 1.00 0.00 H new ATOM 0 HB2 PRO A 72 275.492 133.703 408.748 1.00 0.00 H new ATOM 0 HB3 PRO A 72 275.826 133.165 407.113 1.00 0.00 H new ATOM 0 HG2 PRO A 72 275.374 135.995 408.118 1.00 0.00 H new ATOM 0 HG3 PRO A 72 276.499 135.436 406.896 1.00 0.00 H new ATOM 0 HD2 PRO A 72 273.999 136.558 406.320 1.00 0.00 H new ATOM 0 HD3 PRO A 72 274.897 135.545 405.207 1.00 0.00 H new ATOM 1160 N LEU A 73 272.260 132.916 409.346 1.00 0.00 N ATOM 1161 CA LEU A 73 271.349 133.014 410.472 1.00 0.00 C ATOM 1162 C LEU A 73 271.840 132.059 411.566 1.00 0.00 C ATOM 1163 O LEU A 73 272.228 130.930 411.272 1.00 0.00 O ATOM 1164 CB LEU A 73 269.888 132.647 410.046 1.00 0.00 C ATOM 1165 CG LEU A 73 269.311 133.478 408.859 1.00 0.00 C ATOM 1166 CD1 LEU A 73 267.965 132.927 408.352 1.00 0.00 C ATOM 1167 CD2 LEU A 73 269.150 134.977 409.175 1.00 0.00 C ATOM 0 H LEU A 73 272.434 131.949 409.071 1.00 0.00 H new ATOM 0 HA LEU A 73 271.333 134.039 410.842 1.00 0.00 H new ATOM 0 HB2 LEU A 73 269.860 131.591 409.776 1.00 0.00 H new ATOM 0 HB3 LEU A 73 269.233 132.773 410.908 1.00 0.00 H new ATOM 0 HG LEU A 73 270.061 133.376 408.074 1.00 0.00 H new ATOM 0 HD11 LEU A 73 267.608 133.542 407.526 1.00 0.00 H new ATOM 0 HD12 LEU A 73 268.098 131.901 408.009 1.00 0.00 H new ATOM 0 HD13 LEU A 73 267.235 132.948 409.161 1.00 0.00 H new ATOM 0 HD21 LEU A 73 268.744 135.491 408.304 1.00 0.00 H new ATOM 0 HD22 LEU A 73 268.470 135.100 410.018 1.00 0.00 H new ATOM 0 HD23 LEU A 73 270.122 135.402 409.427 1.00 0.00 H new ATOM 1179 N THR A 74 271.807 132.500 412.855 1.00 0.00 N ATOM 1180 CA THR A 74 272.200 131.772 414.084 1.00 0.00 C ATOM 1181 C THR A 74 273.692 131.905 414.387 1.00 0.00 C ATOM 1182 O THR A 74 274.360 130.948 414.765 1.00 0.00 O ATOM 1183 CB THR A 74 271.741 130.302 414.215 1.00 0.00 C ATOM 1184 OG1 THR A 74 270.436 130.139 413.683 1.00 0.00 O ATOM 1185 CG2 THR A 74 271.643 129.842 415.685 1.00 0.00 C ATOM 0 H THR A 74 271.481 133.442 413.072 1.00 0.00 H new ATOM 0 HA THR A 74 271.622 132.293 414.847 1.00 0.00 H new ATOM 0 HB THR A 74 272.488 129.716 413.679 1.00 0.00 H new ATOM 0 HG1 THR A 74 270.161 129.203 413.772 1.00 0.00 H new ATOM 0 HG21 THR A 74 271.317 128.803 415.720 1.00 0.00 H new ATOM 0 HG22 THR A 74 272.620 129.932 416.160 1.00 0.00 H new ATOM 0 HG23 THR A 74 270.923 130.466 416.214 1.00 0.00 H new ATOM 1193 N LEU A 75 274.275 133.119 414.196 1.00 0.00 N ATOM 1194 CA LEU A 75 275.701 133.391 414.392 1.00 0.00 C ATOM 1195 C LEU A 75 275.915 134.196 415.647 1.00 0.00 C ATOM 1196 O LEU A 75 276.554 133.762 416.597 1.00 0.00 O ATOM 1197 CB LEU A 75 276.348 134.192 413.210 1.00 0.00 C ATOM 1198 CG LEU A 75 276.721 133.290 411.997 1.00 0.00 C ATOM 1199 CD1 LEU A 75 275.530 132.667 411.252 1.00 0.00 C ATOM 1200 CD2 LEU A 75 277.662 133.977 410.986 1.00 0.00 C ATOM 0 H LEU A 75 273.748 133.940 413.897 1.00 0.00 H new ATOM 0 HA LEU A 75 276.177 132.413 414.454 1.00 0.00 H new ATOM 0 HB2 LEU A 75 275.655 134.966 412.881 1.00 0.00 H new ATOM 0 HB3 LEU A 75 277.244 134.698 413.569 1.00 0.00 H new ATOM 0 HG LEU A 75 277.257 132.470 412.475 1.00 0.00 H new ATOM 0 HD11 LEU A 75 275.896 132.058 410.426 1.00 0.00 H new ATOM 0 HD12 LEU A 75 274.958 132.042 411.938 1.00 0.00 H new ATOM 0 HD13 LEU A 75 274.890 133.459 410.863 1.00 0.00 H new ATOM 0 HD21 LEU A 75 277.880 133.291 410.167 1.00 0.00 H new ATOM 0 HD22 LEU A 75 277.181 134.872 410.591 1.00 0.00 H new ATOM 0 HD23 LEU A 75 278.591 134.254 411.484 1.00 0.00 H new ATOM 1212 N SER A 76 275.388 135.443 415.635 1.00 0.00 N ATOM 1213 CA SER A 76 275.529 136.460 416.660 1.00 0.00 C ATOM 1214 C SER A 76 274.249 136.594 417.483 1.00 0.00 C ATOM 1215 O SER A 76 273.969 137.673 417.998 1.00 0.00 O ATOM 1216 CB SER A 76 276.022 137.821 416.089 1.00 0.00 C ATOM 1217 OG SER A 76 276.398 138.765 417.094 1.00 0.00 O ATOM 0 H SER A 76 274.820 135.769 414.853 1.00 0.00 H new ATOM 0 HA SER A 76 276.314 136.128 417.339 1.00 0.00 H new ATOM 0 HB2 SER A 76 276.875 137.642 415.434 1.00 0.00 H new ATOM 0 HB3 SER A 76 275.233 138.254 415.474 1.00 0.00 H new ATOM 0 HG SER A 76 275.715 138.785 417.796 1.00 0.00 H new ATOM 1223 N LYS A 77 273.460 135.481 417.575 1.00 0.00 N ATOM 1224 CA LYS A 77 272.155 135.302 418.234 1.00 0.00 C ATOM 1225 C LYS A 77 271.041 135.590 417.227 1.00 0.00 C ATOM 1226 O LYS A 77 270.505 136.694 417.147 1.00 0.00 O ATOM 1227 CB LYS A 77 271.965 136.069 419.575 1.00 0.00 C ATOM 1228 CG LYS A 77 270.715 135.674 420.382 1.00 0.00 C ATOM 1229 CD LYS A 77 270.617 136.459 421.701 1.00 0.00 C ATOM 1230 CE LYS A 77 269.312 136.210 422.472 1.00 0.00 C ATOM 1231 NZ LYS A 77 269.188 134.793 422.885 1.00 0.00 N1+ ATOM 0 H LYS A 77 273.764 134.609 417.143 1.00 0.00 H new ATOM 0 HA LYS A 77 272.109 134.260 418.551 1.00 0.00 H new ATOM 0 HB2 LYS A 77 272.846 135.907 420.196 1.00 0.00 H new ATOM 0 HB3 LYS A 77 271.918 137.137 419.361 1.00 0.00 H new ATOM 0 HG2 LYS A 77 269.823 135.856 419.783 1.00 0.00 H new ATOM 0 HG3 LYS A 77 270.743 134.606 420.596 1.00 0.00 H new ATOM 0 HD2 LYS A 77 271.461 136.191 422.337 1.00 0.00 H new ATOM 0 HD3 LYS A 77 270.705 137.524 421.487 1.00 0.00 H new ATOM 0 HE2 LYS A 77 269.281 136.851 423.353 1.00 0.00 H new ATOM 0 HE3 LYS A 77 268.461 136.484 421.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 268.296 134.659 423.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 269.194 134.184 422.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 269.987 134.540 423.500 1.00 0.00 H new ATOM 1245 N LEU A 78 270.733 134.593 416.332 1.00 0.00 N ATOM 1246 CA LEU A 78 269.798 134.627 415.177 1.00 0.00 C ATOM 1247 C LEU A 78 270.400 135.381 413.968 1.00 0.00 C ATOM 1248 O LEU A 78 270.362 134.942 412.824 1.00 0.00 O ATOM 1249 CB LEU A 78 268.324 135.053 415.484 1.00 0.00 C ATOM 1250 CG LEU A 78 267.462 134.042 416.295 1.00 0.00 C ATOM 1251 CD1 LEU A 78 267.173 132.742 415.523 1.00 0.00 C ATOM 1252 CD2 LEU A 78 267.992 133.725 417.704 1.00 0.00 C ATOM 0 H LEU A 78 271.173 133.677 416.416 1.00 0.00 H new ATOM 0 HA LEU A 78 269.689 133.577 414.904 1.00 0.00 H new ATOM 0 HB2 LEU A 78 268.348 135.996 416.031 1.00 0.00 H new ATOM 0 HB3 LEU A 78 267.821 135.247 414.537 1.00 0.00 H new ATOM 0 HG LEU A 78 266.521 134.573 416.436 1.00 0.00 H new ATOM 0 HD11 LEU A 78 266.568 132.078 416.141 1.00 0.00 H new ATOM 0 HD12 LEU A 78 266.632 132.976 414.606 1.00 0.00 H new ATOM 0 HD13 LEU A 78 268.113 132.250 415.274 1.00 0.00 H new ATOM 0 HD21 LEU A 78 267.326 133.013 418.191 1.00 0.00 H new ATOM 0 HD22 LEU A 78 268.991 133.295 417.629 1.00 0.00 H new ATOM 0 HD23 LEU A 78 268.035 134.642 418.292 1.00 0.00 H new ATOM 1264 N GLU A 79 271.044 136.516 414.291 1.00 0.00 N ATOM 1265 CA GLU A 79 271.848 137.519 413.614 1.00 0.00 C ATOM 1266 C GLU A 79 273.259 137.035 413.241 1.00 0.00 C ATOM 1267 O GLU A 79 273.658 135.934 413.614 1.00 0.00 O ATOM 1268 CB GLU A 79 271.981 138.599 414.742 1.00 0.00 C ATOM 1269 CG GLU A 79 272.950 139.781 414.549 1.00 0.00 C ATOM 1270 CD GLU A 79 272.905 140.706 415.761 1.00 0.00 C ATOM 1271 OE1 GLU A 79 271.827 141.316 416.000 1.00 0.00 O ATOM 1272 OE2 GLU A 79 273.944 140.819 416.463 1.00 0.00 O1- ATOM 0 H GLU A 79 270.984 136.797 415.270 1.00 0.00 H new ATOM 0 HA GLU A 79 271.399 137.835 412.672 1.00 0.00 H new ATOM 0 HB2 GLU A 79 270.988 139.015 414.915 1.00 0.00 H new ATOM 0 HB3 GLU A 79 272.274 138.082 415.656 1.00 0.00 H new ATOM 0 HG2 GLU A 79 273.964 139.409 414.405 1.00 0.00 H new ATOM 0 HG3 GLU A 79 272.683 140.336 413.650 1.00 0.00 H new ATOM 1279 N HIS A 80 274.082 137.898 412.577 1.00 0.00 N ATOM 1280 CA HIS A 80 275.512 137.722 412.355 1.00 0.00 C ATOM 1281 C HIS A 80 276.233 139.058 412.571 1.00 0.00 C ATOM 1282 O HIS A 80 277.271 139.352 411.975 1.00 0.00 O ATOM 1283 CB HIS A 80 275.764 137.209 410.902 1.00 0.00 C ATOM 1284 CG HIS A 80 275.104 138.052 409.822 1.00 0.00 C ATOM 1285 ND1 HIS A 80 273.856 137.810 409.277 1.00 0.00 N ATOM 1286 CD2 HIS A 80 275.538 139.205 409.234 1.00 0.00 C ATOM 1287 CE1 HIS A 80 273.598 138.819 408.409 1.00 0.00 C ATOM 1288 NE2 HIS A 80 274.589 139.686 408.349 1.00 0.00 N ATOM 0 H HIS A 80 273.732 138.766 412.172 1.00 0.00 H new ATOM 0 HA HIS A 80 275.899 136.987 413.061 1.00 0.00 H new ATOM 0 HB2 HIS A 80 276.838 137.180 410.720 1.00 0.00 H new ATOM 0 HB3 HIS A 80 275.400 136.185 410.822 1.00 0.00 H new ATOM 0 HD1 HIS A 80 273.245 137.021 409.488 1.00 0.00 H new ATOM 0 HD2 HIS A 80 276.489 139.676 409.432 1.00 0.00 H new ATOM 0 HE1 HIS A 80 272.687 138.903 407.834 1.00 0.00 H new TER 1296 HIS A 80