USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 792 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 18 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HE2:sc= -2.73 K(o=-2.7,f=-4.9!) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 41:sc= 0.267 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl -118:sc= -1.12 (180deg=-5.63!) USER MOD Single : A 43 MET CE :methyl -105:sc= -2.15 (180deg=-5.33!) USER MOD Single : A 49 ASN : amide:sc=-0.00157 X(o=-0.0016,f=-0.0016) USER MOD Single : A 51 HIS : no HD1:sc= 0 X(o=0,f=-0.00091) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -1.67! C(o=-1.7!,f=-7.5!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -1.66 K(o=-1.7,f=-7.2!) USER MOD Single : A 89 GLN : amide:sc= -0.0382 X(o=-0.038,f=-0.038) USER MOD Single : A 96 SER OG : rot 40:sc= 0.941 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.072 -23.504 -20.831 1.00 0.00 N ATOM 2 CA GLY A 1 18.448 -23.240 -19.548 1.00 0.00 C ATOM 3 C GLY A 1 18.519 -24.431 -18.614 1.00 0.00 C ATOM 4 O GLY A 1 17.669 -25.321 -18.666 1.00 0.00 O ATOM 0 H1 GLY A 1 18.997 -22.660 -21.434 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.075 -23.739 -20.687 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.592 -24.302 -21.293 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.935 -22.385 -19.079 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.405 -22.966 -19.704 1.00 0.00 H new ATOM 8 N SER A 2 19.534 -24.450 -17.756 1.00 0.00 N ATOM 9 CA SER A 2 19.715 -25.543 -16.809 1.00 0.00 C ATOM 10 C SER A 2 19.406 -25.087 -15.386 1.00 0.00 C ATOM 11 O SER A 2 20.299 -24.667 -14.650 1.00 0.00 O ATOM 12 CB SER A 2 21.146 -26.082 -16.885 1.00 0.00 C ATOM 13 OG SER A 2 21.251 -27.342 -16.246 1.00 0.00 O ATOM 0 H SER A 2 20.244 -23.720 -17.698 1.00 0.00 H new ATOM 0 HA SER A 2 19.020 -26.339 -17.076 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.449 -26.173 -17.928 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.830 -25.375 -16.416 1.00 0.00 H new ATOM 0 HG SER A 2 22.174 -27.665 -16.310 1.00 0.00 H new ATOM 19 N SER A 3 18.135 -25.173 -15.006 1.00 0.00 N ATOM 20 CA SER A 3 17.707 -24.766 -13.673 1.00 0.00 C ATOM 21 C SER A 3 16.376 -25.416 -13.307 1.00 0.00 C ATOM 22 O SER A 3 15.352 -25.155 -13.935 1.00 0.00 O ATOM 23 CB SER A 3 17.581 -23.243 -13.598 1.00 0.00 C ATOM 24 OG SER A 3 17.485 -22.804 -12.254 1.00 0.00 O ATOM 0 H SER A 3 17.384 -25.521 -15.602 1.00 0.00 H new ATOM 0 HA SER A 3 18.461 -25.097 -12.959 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.445 -22.780 -14.074 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.700 -22.920 -14.153 1.00 0.00 H new ATOM 0 HG SER A 3 17.407 -21.827 -12.234 1.00 0.00 H new ATOM 30 N GLY A 4 16.402 -26.268 -12.286 1.00 0.00 N ATOM 31 CA GLY A 4 15.193 -26.943 -11.854 1.00 0.00 C ATOM 32 C GLY A 4 14.556 -26.278 -10.651 1.00 0.00 C ATOM 33 O GLY A 4 15.191 -26.126 -9.607 1.00 0.00 O ATOM 0 H GLY A 4 17.238 -26.502 -11.751 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.478 -26.962 -12.676 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.426 -27.980 -11.611 1.00 0.00 H new ATOM 37 N SER A 5 13.295 -25.879 -10.794 1.00 0.00 N ATOM 38 CA SER A 5 12.573 -25.221 -9.713 1.00 0.00 C ATOM 39 C SER A 5 12.009 -26.246 -8.733 1.00 0.00 C ATOM 40 O SER A 5 10.957 -26.838 -8.976 1.00 0.00 O ATOM 41 CB SER A 5 11.441 -24.360 -10.276 1.00 0.00 C ATOM 42 OG SER A 5 10.889 -23.524 -9.274 1.00 0.00 O ATOM 0 H SER A 5 12.753 -26.001 -11.649 1.00 0.00 H new ATOM 0 HA SER A 5 13.275 -24.581 -9.178 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.818 -23.749 -11.096 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.662 -25.002 -10.688 1.00 0.00 H new ATOM 0 HG SER A 5 10.169 -22.983 -9.660 1.00 0.00 H new ATOM 48 N SER A 6 12.717 -26.451 -7.627 1.00 0.00 N ATOM 49 CA SER A 6 12.289 -27.407 -6.612 1.00 0.00 C ATOM 50 C SER A 6 12.561 -26.870 -5.210 1.00 0.00 C ATOM 51 O SER A 6 13.713 -26.703 -4.810 1.00 0.00 O ATOM 52 CB SER A 6 13.008 -28.744 -6.807 1.00 0.00 C ATOM 53 OG SER A 6 12.407 -29.764 -6.029 1.00 0.00 O ATOM 0 H SER A 6 13.589 -25.968 -7.411 1.00 0.00 H new ATOM 0 HA SER A 6 11.215 -27.560 -6.721 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.983 -29.023 -7.860 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.057 -28.640 -6.529 1.00 0.00 H new ATOM 0 HG SER A 6 12.883 -30.608 -6.172 1.00 0.00 H new ATOM 59 N GLY A 7 11.491 -26.601 -4.469 1.00 0.00 N ATOM 60 CA GLY A 7 11.634 -26.085 -3.120 1.00 0.00 C ATOM 61 C GLY A 7 10.482 -26.485 -2.220 1.00 0.00 C ATOM 62 O GLY A 7 9.337 -26.570 -2.666 1.00 0.00 O ATOM 0 H GLY A 7 10.528 -26.731 -4.778 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.568 -26.449 -2.692 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.702 -24.998 -3.156 1.00 0.00 H new ATOM 66 N LYS A 8 10.783 -26.734 -0.950 1.00 0.00 N ATOM 67 CA LYS A 8 9.764 -27.129 0.015 1.00 0.00 C ATOM 68 C LYS A 8 9.697 -26.135 1.171 1.00 0.00 C ATOM 69 O LYS A 8 10.691 -25.493 1.507 1.00 0.00 O ATOM 70 CB LYS A 8 10.056 -28.532 0.550 1.00 0.00 C ATOM 71 CG LYS A 8 10.092 -29.600 -0.530 1.00 0.00 C ATOM 72 CD LYS A 8 8.719 -30.210 -0.757 1.00 0.00 C ATOM 73 CE LYS A 8 7.935 -29.438 -1.808 1.00 0.00 C ATOM 74 NZ LYS A 8 6.984 -30.316 -2.545 1.00 0.00 N ATOM 0 H LYS A 8 11.725 -26.669 -0.565 1.00 0.00 H new ATOM 0 HA LYS A 8 8.800 -27.135 -0.493 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.014 -28.521 1.070 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.296 -28.797 1.286 1.00 0.00 H new ATOM 0 HG2 LYS A 8 10.456 -29.165 -1.461 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.796 -30.382 -0.246 1.00 0.00 H new ATOM 0 HD2 LYS A 8 8.828 -31.248 -1.072 1.00 0.00 H new ATOM 0 HD3 LYS A 8 8.163 -30.218 0.181 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.385 -28.628 -1.329 1.00 0.00 H new ATOM 0 HE3 LYS A 8 8.628 -28.979 -2.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.469 -29.753 -3.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 7.511 -31.074 -3.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 6.307 -30.734 -1.875 1.00 0.00 H new ATOM 88 N GLU A 9 8.518 -26.018 1.776 1.00 0.00 N ATOM 89 CA GLU A 9 8.323 -25.103 2.894 1.00 0.00 C ATOM 90 C GLU A 9 7.160 -25.557 3.772 1.00 0.00 C ATOM 91 O GLU A 9 6.085 -25.888 3.273 1.00 0.00 O ATOM 92 CB GLU A 9 8.068 -23.684 2.383 1.00 0.00 C ATOM 93 CG GLU A 9 6.707 -23.509 1.729 1.00 0.00 C ATOM 94 CD GLU A 9 6.578 -22.188 0.996 1.00 0.00 C ATOM 95 OE1 GLU A 9 7.073 -22.091 -0.146 1.00 0.00 O ATOM 96 OE2 GLU A 9 5.980 -21.249 1.565 1.00 0.00 O ATOM 0 H GLU A 9 7.686 -26.545 1.511 1.00 0.00 H new ATOM 0 HA GLU A 9 9.232 -25.106 3.495 1.00 0.00 H new ATOM 0 HB2 GLU A 9 8.154 -22.986 3.216 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.844 -23.421 1.664 1.00 0.00 H new ATOM 0 HG2 GLU A 9 6.537 -24.327 1.029 1.00 0.00 H new ATOM 0 HG3 GLU A 9 5.931 -23.575 2.491 1.00 0.00 H new ATOM 103 N ALA A 10 7.384 -25.570 5.081 1.00 0.00 N ATOM 104 CA ALA A 10 6.356 -25.982 6.029 1.00 0.00 C ATOM 105 C ALA A 10 6.456 -25.189 7.327 1.00 0.00 C ATOM 106 O ALA A 10 7.390 -25.372 8.108 1.00 0.00 O ATOM 107 CB ALA A 10 6.463 -27.474 6.310 1.00 0.00 C ATOM 0 H ALA A 10 8.269 -25.300 5.510 1.00 0.00 H new ATOM 0 HA ALA A 10 5.383 -25.777 5.583 1.00 0.00 H new ATOM 0 HB1 ALA A 10 5.689 -27.767 7.019 1.00 0.00 H new ATOM 0 HB2 ALA A 10 6.333 -28.029 5.381 1.00 0.00 H new ATOM 0 HB3 ALA A 10 7.444 -27.696 6.731 1.00 0.00 H new ATOM 113 N LEU A 11 5.489 -24.306 7.551 1.00 0.00 N ATOM 114 CA LEU A 11 5.468 -23.483 8.755 1.00 0.00 C ATOM 115 C LEU A 11 4.037 -23.201 9.198 1.00 0.00 C ATOM 116 O LEU A 11 3.184 -22.850 8.384 1.00 0.00 O ATOM 117 CB LEU A 11 6.207 -22.166 8.510 1.00 0.00 C ATOM 118 CG LEU A 11 6.024 -21.085 9.576 1.00 0.00 C ATOM 119 CD1 LEU A 11 6.578 -21.553 10.912 1.00 0.00 C ATOM 120 CD2 LEU A 11 6.694 -19.790 9.142 1.00 0.00 C ATOM 0 H LEU A 11 4.709 -24.142 6.914 1.00 0.00 H new ATOM 0 HA LEU A 11 5.972 -24.033 9.549 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.272 -22.382 8.419 1.00 0.00 H new ATOM 0 HB3 LEU A 11 5.880 -21.762 7.552 1.00 0.00 H new ATOM 0 HG LEU A 11 4.957 -20.896 9.695 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.439 -20.770 11.658 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.052 -22.454 11.229 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.641 -21.771 10.809 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.554 -19.032 9.912 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.760 -19.964 8.994 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.249 -19.445 8.209 1.00 0.00 H new ATOM 132 N GLU A 12 3.781 -23.356 10.494 1.00 0.00 N ATOM 133 CA GLU A 12 2.452 -23.116 11.044 1.00 0.00 C ATOM 134 C GLU A 12 2.521 -22.169 12.239 1.00 0.00 C ATOM 135 O GLU A 12 3.154 -22.474 13.250 1.00 0.00 O ATOM 136 CB GLU A 12 1.803 -24.437 11.463 1.00 0.00 C ATOM 137 CG GLU A 12 0.502 -24.261 12.227 1.00 0.00 C ATOM 138 CD GLU A 12 -0.706 -24.192 11.314 1.00 0.00 C ATOM 139 OE1 GLU A 12 -0.685 -23.383 10.362 1.00 0.00 O ATOM 140 OE2 GLU A 12 -1.672 -24.946 11.552 1.00 0.00 O ATOM 0 H GLU A 12 4.476 -23.646 11.182 1.00 0.00 H new ATOM 0 HA GLU A 12 1.844 -22.651 10.268 1.00 0.00 H new ATOM 0 HB2 GLU A 12 1.613 -25.037 10.573 1.00 0.00 H new ATOM 0 HB3 GLU A 12 2.505 -24.997 12.081 1.00 0.00 H new ATOM 0 HG2 GLU A 12 0.379 -25.090 12.924 1.00 0.00 H new ATOM 0 HG3 GLU A 12 0.555 -23.350 12.822 1.00 0.00 H new ATOM 147 N ALA A 13 1.865 -21.020 12.114 1.00 0.00 N ATOM 148 CA ALA A 13 1.849 -20.029 13.183 1.00 0.00 C ATOM 149 C ALA A 13 0.459 -19.427 13.354 1.00 0.00 C ATOM 150 O ALA A 13 -0.066 -18.784 12.444 1.00 0.00 O ATOM 151 CB ALA A 13 2.870 -18.936 12.903 1.00 0.00 C ATOM 0 H ALA A 13 1.338 -20.752 11.283 1.00 0.00 H new ATOM 0 HA ALA A 13 2.115 -20.530 14.114 1.00 0.00 H new ATOM 0 HB1 ALA A 13 2.848 -18.202 13.709 1.00 0.00 H new ATOM 0 HB2 ALA A 13 3.865 -19.376 12.840 1.00 0.00 H new ATOM 0 HB3 ALA A 13 2.629 -18.446 11.960 1.00 0.00 H new ATOM 157 N LEU A 14 -0.134 -19.641 14.523 1.00 0.00 N ATOM 158 CA LEU A 14 -1.465 -19.120 14.813 1.00 0.00 C ATOM 159 C LEU A 14 -1.436 -17.602 14.958 1.00 0.00 C ATOM 160 O LEU A 14 -2.244 -16.894 14.357 1.00 0.00 O ATOM 161 CB LEU A 14 -2.016 -19.755 16.091 1.00 0.00 C ATOM 162 CG LEU A 14 -1.966 -21.282 16.158 1.00 0.00 C ATOM 163 CD1 LEU A 14 -0.649 -21.747 16.757 1.00 0.00 C ATOM 164 CD2 LEU A 14 -3.141 -21.819 16.963 1.00 0.00 C ATOM 0 H LEU A 14 0.286 -20.172 15.286 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.117 -19.375 13.978 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.461 -19.356 16.940 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.052 -19.440 16.212 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.038 -21.674 15.143 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.632 -22.836 16.797 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.177 -21.393 16.139 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.546 -21.346 17.765 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.089 -22.907 17.000 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.101 -21.419 17.976 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.075 -21.516 16.490 1.00 0.00 H new ATOM 176 N VAL A 15 -0.496 -17.106 15.758 1.00 0.00 N ATOM 177 CA VAL A 15 -0.359 -15.672 15.979 1.00 0.00 C ATOM 178 C VAL A 15 0.209 -14.978 14.745 1.00 0.00 C ATOM 179 O VAL A 15 1.154 -15.452 14.116 1.00 0.00 O ATOM 180 CB VAL A 15 0.550 -15.375 17.186 1.00 0.00 C ATOM 181 CG1 VAL A 15 1.898 -16.059 17.021 1.00 0.00 C ATOM 182 CG2 VAL A 15 0.722 -13.874 17.366 1.00 0.00 C ATOM 0 H VAL A 15 0.181 -17.677 16.263 1.00 0.00 H new ATOM 0 HA VAL A 15 -1.358 -15.286 16.182 1.00 0.00 H new ATOM 0 HB VAL A 15 0.076 -15.773 18.083 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.526 -15.837 17.884 1.00 0.00 H new ATOM 0 HG12 VAL A 15 1.752 -17.137 16.945 1.00 0.00 H new ATOM 0 HG13 VAL A 15 2.383 -15.694 16.116 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.367 -13.682 18.223 1.00 0.00 H new ATOM 0 HG22 VAL A 15 1.174 -13.449 16.470 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -0.252 -13.414 17.534 1.00 0.00 H new ATOM 192 N PRO A 16 -0.379 -13.826 14.392 1.00 0.00 N ATOM 193 CA PRO A 16 0.053 -13.040 13.232 1.00 0.00 C ATOM 194 C PRO A 16 1.416 -12.391 13.446 1.00 0.00 C ATOM 195 O PRO A 16 2.072 -12.624 14.462 1.00 0.00 O ATOM 196 CB PRO A 16 -1.034 -11.970 13.103 1.00 0.00 C ATOM 197 CG PRO A 16 -1.596 -11.833 14.477 1.00 0.00 C ATOM 198 CD PRO A 16 -1.511 -13.201 15.097 1.00 0.00 C ATOM 0 HA PRO A 16 0.169 -13.658 12.342 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -0.620 -11.026 12.749 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -1.802 -12.269 12.389 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -1.031 -11.105 15.059 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -2.628 -11.483 14.444 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -1.334 -13.145 16.171 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -2.433 -13.764 14.955 1.00 0.00 H new ATOM 206 N VAL A 17 1.837 -11.578 12.483 1.00 0.00 N ATOM 207 CA VAL A 17 3.121 -10.894 12.567 1.00 0.00 C ATOM 208 C VAL A 17 3.061 -9.525 11.898 1.00 0.00 C ATOM 209 O VAL A 17 2.244 -9.293 11.006 1.00 0.00 O ATOM 210 CB VAL A 17 4.242 -11.723 11.913 1.00 0.00 C ATOM 211 CG1 VAL A 17 4.875 -12.661 12.930 1.00 0.00 C ATOM 212 CG2 VAL A 17 3.704 -12.501 10.722 1.00 0.00 C ATOM 0 H VAL A 17 1.307 -11.377 11.635 1.00 0.00 H new ATOM 0 HA VAL A 17 3.343 -10.768 13.627 1.00 0.00 H new ATOM 0 HB VAL A 17 5.012 -11.040 11.554 1.00 0.00 H new ATOM 0 HG11 VAL A 17 5.665 -13.239 12.450 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.298 -12.078 13.749 1.00 0.00 H new ATOM 0 HG13 VAL A 17 4.116 -13.339 13.321 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.510 -13.081 10.272 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.914 -13.174 11.054 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.302 -11.806 9.985 1.00 0.00 H new ATOM 222 N THR A 18 3.932 -8.620 12.333 1.00 0.00 N ATOM 223 CA THR A 18 3.977 -7.273 11.778 1.00 0.00 C ATOM 224 C THR A 18 4.966 -7.190 10.621 1.00 0.00 C ATOM 225 O THR A 18 6.145 -7.511 10.775 1.00 0.00 O ATOM 226 CB THR A 18 4.368 -6.237 12.849 1.00 0.00 C ATOM 227 OG1 THR A 18 3.517 -6.370 13.993 1.00 0.00 O ATOM 228 CG2 THR A 18 4.265 -4.824 12.295 1.00 0.00 C ATOM 0 H THR A 18 4.616 -8.796 13.069 1.00 0.00 H new ATOM 0 HA THR A 18 2.975 -7.046 11.414 1.00 0.00 H new ATOM 0 HB THR A 18 5.401 -6.421 13.143 1.00 0.00 H new ATOM 0 HG1 THR A 18 3.773 -5.709 14.670 1.00 0.00 H new ATOM 0 HG21 THR A 18 4.546 -4.109 13.068 1.00 0.00 H new ATOM 0 HG22 THR A 18 4.935 -4.718 11.442 1.00 0.00 H new ATOM 0 HG23 THR A 18 3.240 -4.632 11.977 1.00 0.00 H new ATOM 236 N ILE A 19 4.480 -6.756 9.463 1.00 0.00 N ATOM 237 CA ILE A 19 5.322 -6.629 8.281 1.00 0.00 C ATOM 238 C ILE A 19 5.515 -5.165 7.898 1.00 0.00 C ATOM 239 O ILE A 19 4.843 -4.281 8.429 1.00 0.00 O ATOM 240 CB ILE A 19 4.725 -7.387 7.080 1.00 0.00 C ATOM 241 CG1 ILE A 19 3.386 -6.769 6.674 1.00 0.00 C ATOM 242 CG2 ILE A 19 4.555 -8.861 7.416 1.00 0.00 C ATOM 243 CD1 ILE A 19 2.945 -7.148 5.277 1.00 0.00 C ATOM 0 H ILE A 19 3.507 -6.486 9.319 1.00 0.00 H new ATOM 0 HA ILE A 19 6.288 -7.067 8.533 1.00 0.00 H new ATOM 0 HB ILE A 19 5.412 -7.304 6.238 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.621 -7.080 7.385 1.00 0.00 H new ATOM 0 HG13 ILE A 19 3.461 -5.684 6.741 1.00 0.00 H new ATOM 0 HG21 ILE A 19 4.132 -9.383 6.558 1.00 0.00 H new ATOM 0 HG22 ILE A 19 5.525 -9.292 7.662 1.00 0.00 H new ATOM 0 HG23 ILE A 19 3.885 -8.965 8.270 1.00 0.00 H new ATOM 0 HD11 ILE A 19 1.988 -6.674 5.056 1.00 0.00 H new ATOM 0 HD12 ILE A 19 3.691 -6.812 4.556 1.00 0.00 H new ATOM 0 HD13 ILE A 19 2.838 -8.231 5.210 1.00 0.00 H new ATOM 255 N GLU A 20 6.437 -4.918 6.973 1.00 0.00 N ATOM 256 CA GLU A 20 6.717 -3.560 6.520 1.00 0.00 C ATOM 257 C GLU A 20 6.433 -3.416 5.027 1.00 0.00 C ATOM 258 O GLU A 20 6.945 -4.180 4.210 1.00 0.00 O ATOM 259 CB GLU A 20 8.174 -3.192 6.810 1.00 0.00 C ATOM 260 CG GLU A 20 8.393 -2.630 8.205 1.00 0.00 C ATOM 261 CD GLU A 20 9.858 -2.383 8.511 1.00 0.00 C ATOM 262 OE1 GLU A 20 10.501 -1.622 7.758 1.00 0.00 O ATOM 263 OE2 GLU A 20 10.360 -2.949 9.503 1.00 0.00 O ATOM 0 H GLU A 20 7.002 -5.639 6.523 1.00 0.00 H new ATOM 0 HA GLU A 20 6.062 -2.880 7.065 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.796 -4.078 6.682 1.00 0.00 H new ATOM 0 HB3 GLU A 20 8.508 -2.459 6.075 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.842 -1.695 8.307 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.984 -3.323 8.940 1.00 0.00 H new ATOM 270 N VAL A 21 5.611 -2.431 4.679 1.00 0.00 N ATOM 271 CA VAL A 21 5.258 -2.184 3.286 1.00 0.00 C ATOM 272 C VAL A 21 5.796 -0.839 2.813 1.00 0.00 C ATOM 273 O VAL A 21 5.720 0.157 3.530 1.00 0.00 O ATOM 274 CB VAL A 21 3.733 -2.217 3.080 1.00 0.00 C ATOM 275 CG1 VAL A 21 3.394 -2.251 1.597 1.00 0.00 C ATOM 276 CG2 VAL A 21 3.123 -3.409 3.802 1.00 0.00 C ATOM 0 H VAL A 21 5.177 -1.790 5.343 1.00 0.00 H new ATOM 0 HA VAL A 21 5.713 -2.980 2.698 1.00 0.00 H new ATOM 0 HB VAL A 21 3.308 -1.308 3.504 1.00 0.00 H new ATOM 0 HG11 VAL A 21 2.311 -2.274 1.472 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.797 -1.362 1.111 1.00 0.00 H new ATOM 0 HG13 VAL A 21 3.831 -3.141 1.144 1.00 0.00 H new ATOM 0 HG21 VAL A 21 2.044 -3.416 3.645 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.553 -4.331 3.410 1.00 0.00 H new ATOM 0 HG23 VAL A 21 3.334 -3.335 4.869 1.00 0.00 H new ATOM 286 N GLU A 22 6.338 -0.819 1.599 1.00 0.00 N ATOM 287 CA GLU A 22 6.890 0.405 1.030 1.00 0.00 C ATOM 288 C GLU A 22 5.785 1.272 0.431 1.00 0.00 C ATOM 289 O GLU A 22 5.224 0.948 -0.615 1.00 0.00 O ATOM 290 CB GLU A 22 7.929 0.073 -0.043 1.00 0.00 C ATOM 291 CG GLU A 22 9.336 -0.094 0.504 1.00 0.00 C ATOM 292 CD GLU A 22 10.253 -0.827 -0.456 1.00 0.00 C ATOM 293 OE1 GLU A 22 9.902 -1.953 -0.867 1.00 0.00 O ATOM 294 OE2 GLU A 22 11.320 -0.276 -0.796 1.00 0.00 O ATOM 0 H GLU A 22 6.407 -1.635 0.991 1.00 0.00 H new ATOM 0 HA GLU A 22 7.373 0.962 1.833 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.634 -0.845 -0.551 1.00 0.00 H new ATOM 0 HB3 GLU A 22 7.931 0.865 -0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 22 9.756 0.888 0.723 1.00 0.00 H new ATOM 0 HG3 GLU A 22 9.293 -0.639 1.447 1.00 0.00 H new ATOM 301 N VAL A 23 5.478 2.376 1.106 1.00 0.00 N ATOM 302 CA VAL A 23 4.441 3.291 0.641 1.00 0.00 C ATOM 303 C VAL A 23 4.702 4.710 1.132 1.00 0.00 C ATOM 304 O VAL A 23 4.895 4.957 2.322 1.00 0.00 O ATOM 305 CB VAL A 23 3.046 2.844 1.115 1.00 0.00 C ATOM 306 CG1 VAL A 23 1.983 3.829 0.651 1.00 0.00 C ATOM 307 CG2 VAL A 23 2.737 1.440 0.616 1.00 0.00 C ATOM 0 H VAL A 23 5.932 2.658 1.975 1.00 0.00 H new ATOM 0 HA VAL A 23 4.469 3.275 -0.449 1.00 0.00 H new ATOM 0 HB VAL A 23 3.041 2.827 2.205 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.004 3.496 0.995 1.00 0.00 H new ATOM 0 HG12 VAL A 23 2.197 4.815 1.062 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.986 3.882 -0.438 1.00 0.00 H new ATOM 0 HG21 VAL A 23 1.747 1.141 0.961 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.761 1.428 -0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 23 3.481 0.744 1.003 1.00 0.00 H new ATOM 317 N PRO A 24 4.707 5.668 0.193 1.00 0.00 N ATOM 318 CA PRO A 24 4.941 7.082 0.506 1.00 0.00 C ATOM 319 C PRO A 24 3.783 7.706 1.274 1.00 0.00 C ATOM 320 O PRO A 24 2.616 7.471 0.957 1.00 0.00 O ATOM 321 CB PRO A 24 5.080 7.731 -0.874 1.00 0.00 C ATOM 322 CG PRO A 24 4.319 6.838 -1.791 1.00 0.00 C ATOM 323 CD PRO A 24 4.484 5.447 -1.246 1.00 0.00 C ATOM 0 HA PRO A 24 5.812 7.219 1.147 1.00 0.00 H new ATOM 0 HB2 PRO A 24 4.673 8.742 -0.879 1.00 0.00 H new ATOM 0 HB3 PRO A 24 6.126 7.807 -1.172 1.00 0.00 H new ATOM 0 HG2 PRO A 24 3.267 7.121 -1.827 1.00 0.00 H new ATOM 0 HG3 PRO A 24 4.702 6.906 -2.809 1.00 0.00 H new ATOM 0 HD2 PRO A 24 3.599 4.837 -1.426 1.00 0.00 H new ATOM 0 HD3 PRO A 24 5.326 4.932 -1.708 1.00 0.00 H new ATOM 331 N PHE A 25 4.110 8.500 2.287 1.00 0.00 N ATOM 332 CA PHE A 25 3.097 9.158 3.103 1.00 0.00 C ATOM 333 C PHE A 25 2.194 10.039 2.243 1.00 0.00 C ATOM 334 O PHE A 25 1.092 10.404 2.653 1.00 0.00 O ATOM 335 CB PHE A 25 3.757 10.000 4.197 1.00 0.00 C ATOM 336 CG PHE A 25 2.787 10.531 5.213 1.00 0.00 C ATOM 337 CD1 PHE A 25 1.967 11.606 4.910 1.00 0.00 C ATOM 338 CD2 PHE A 25 2.696 9.956 6.470 1.00 0.00 C ATOM 339 CE1 PHE A 25 1.072 12.097 5.844 1.00 0.00 C ATOM 340 CE2 PHE A 25 1.803 10.442 7.406 1.00 0.00 C ATOM 341 CZ PHE A 25 0.991 11.514 7.093 1.00 0.00 C ATOM 0 H PHE A 25 5.071 8.704 2.563 1.00 0.00 H new ATOM 0 HA PHE A 25 2.486 8.385 3.569 1.00 0.00 H new ATOM 0 HB2 PHE A 25 4.509 9.396 4.705 1.00 0.00 H new ATOM 0 HB3 PHE A 25 4.280 10.837 3.734 1.00 0.00 H new ATOM 0 HD1 PHE A 25 2.027 12.066 3.934 1.00 0.00 H new ATOM 0 HD2 PHE A 25 3.330 9.119 6.721 1.00 0.00 H new ATOM 0 HE1 PHE A 25 0.438 12.935 5.596 1.00 0.00 H new ATOM 0 HE2 PHE A 25 1.740 9.984 8.382 1.00 0.00 H new ATOM 0 HZ PHE A 25 0.294 11.896 7.824 1.00 0.00 H new ATOM 351 N ASP A 26 2.670 10.376 1.050 1.00 0.00 N ATOM 352 CA ASP A 26 1.908 11.213 0.131 1.00 0.00 C ATOM 353 C ASP A 26 0.670 10.477 -0.375 1.00 0.00 C ATOM 354 O ASP A 26 -0.242 11.086 -0.936 1.00 0.00 O ATOM 355 CB ASP A 26 2.781 11.638 -1.050 1.00 0.00 C ATOM 356 CG ASP A 26 3.837 12.651 -0.653 1.00 0.00 C ATOM 357 OD1 ASP A 26 3.463 13.767 -0.236 1.00 0.00 O ATOM 358 OD2 ASP A 26 5.039 12.327 -0.758 1.00 0.00 O ATOM 0 H ASP A 26 3.581 10.082 0.696 1.00 0.00 H new ATOM 0 HA ASP A 26 1.585 12.102 0.672 1.00 0.00 H new ATOM 0 HB2 ASP A 26 3.266 10.759 -1.475 1.00 0.00 H new ATOM 0 HB3 ASP A 26 2.150 12.062 -1.831 1.00 0.00 H new ATOM 363 N LEU A 27 0.646 9.164 -0.176 1.00 0.00 N ATOM 364 CA LEU A 27 -0.479 8.344 -0.613 1.00 0.00 C ATOM 365 C LEU A 27 -1.378 7.983 0.565 1.00 0.00 C ATOM 366 O LEU A 27 -2.590 7.827 0.408 1.00 0.00 O ATOM 367 CB LEU A 27 0.027 7.070 -1.292 1.00 0.00 C ATOM 368 CG LEU A 27 0.709 7.258 -2.648 1.00 0.00 C ATOM 369 CD1 LEU A 27 1.428 5.984 -3.065 1.00 0.00 C ATOM 370 CD2 LEU A 27 -0.306 7.669 -3.703 1.00 0.00 C ATOM 0 H LEU A 27 1.393 8.644 0.285 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.063 8.922 -1.329 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.730 6.578 -0.619 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.817 6.392 -1.423 1.00 0.00 H new ATOM 0 HG LEU A 27 1.448 8.054 -2.554 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.907 6.137 -4.032 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.184 5.733 -2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.709 5.169 -3.141 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.197 7.798 -4.661 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.069 6.896 -3.795 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.775 8.608 -3.410 1.00 0.00 H new ATOM 382 N HIS A 28 -0.779 7.854 1.744 1.00 0.00 N ATOM 383 CA HIS A 28 -1.527 7.514 2.949 1.00 0.00 C ATOM 384 C HIS A 28 -2.858 8.258 2.990 1.00 0.00 C ATOM 385 O HIS A 28 -3.922 7.643 3.076 1.00 0.00 O ATOM 386 CB HIS A 28 -0.706 7.846 4.195 1.00 0.00 C ATOM 387 CG HIS A 28 0.510 6.986 4.357 1.00 0.00 C ATOM 388 ND1 HIS A 28 1.425 7.160 5.374 1.00 0.00 N ATOM 389 CD2 HIS A 28 0.959 5.941 3.624 1.00 0.00 C ATOM 390 CE1 HIS A 28 2.385 6.260 5.258 1.00 0.00 C ATOM 391 NE2 HIS A 28 2.126 5.507 4.205 1.00 0.00 N ATOM 0 H HIS A 28 0.222 7.980 1.891 1.00 0.00 H new ATOM 0 HA HIS A 28 -1.729 6.443 2.931 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -0.399 8.891 4.150 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -1.338 7.737 5.076 1.00 0.00 H new ATOM 0 HD1 HIS A 28 1.369 7.872 6.102 1.00 0.00 H new ATOM 0 HD2 HIS A 28 0.488 5.525 2.746 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.237 6.158 5.913 1.00 0.00 H new ATOM 399 N ARG A 29 -2.791 9.584 2.928 1.00 0.00 N ATOM 400 CA ARG A 29 -3.992 10.412 2.960 1.00 0.00 C ATOM 401 C ARG A 29 -5.072 9.838 2.049 1.00 0.00 C ATOM 402 O ARG A 29 -6.260 9.885 2.370 1.00 0.00 O ATOM 403 CB ARG A 29 -3.661 11.844 2.536 1.00 0.00 C ATOM 404 CG ARG A 29 -3.188 11.960 1.096 1.00 0.00 C ATOM 405 CD ARG A 29 -2.313 13.187 0.893 1.00 0.00 C ATOM 406 NE ARG A 29 -3.103 14.380 0.600 1.00 0.00 N ATOM 407 CZ ARG A 29 -2.569 15.571 0.355 1.00 0.00 C ATOM 408 NH1 ARG A 29 -1.253 15.729 0.369 1.00 0.00 N ATOM 409 NH2 ARG A 29 -3.354 16.610 0.096 1.00 0.00 N ATOM 0 H ARG A 29 -1.919 10.108 2.855 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.370 10.421 3.982 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -4.545 12.467 2.670 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.889 12.240 3.196 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -2.630 11.065 0.822 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.051 12.013 0.432 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.716 13.359 1.789 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.616 13.004 0.075 1.00 0.00 H new ATOM 0 HE ARG A 29 -4.119 14.294 0.583 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.646 14.934 0.569 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.847 16.646 0.180 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -4.367 16.493 0.085 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -2.944 17.525 -0.092 1.00 0.00 H new ATOM 423 N TYR A 30 -4.653 9.297 0.911 1.00 0.00 N ATOM 424 CA TYR A 30 -5.585 8.716 -0.049 1.00 0.00 C ATOM 425 C TYR A 30 -5.939 7.283 0.334 1.00 0.00 C ATOM 426 O TYR A 30 -7.063 6.829 0.117 1.00 0.00 O ATOM 427 CB TYR A 30 -4.987 8.747 -1.456 1.00 0.00 C ATOM 428 CG TYR A 30 -4.638 10.138 -1.937 1.00 0.00 C ATOM 429 CD1 TYR A 30 -5.583 11.156 -1.920 1.00 0.00 C ATOM 430 CD2 TYR A 30 -3.364 10.434 -2.406 1.00 0.00 C ATOM 431 CE1 TYR A 30 -5.270 12.427 -2.359 1.00 0.00 C ATOM 432 CE2 TYR A 30 -3.042 11.703 -2.846 1.00 0.00 C ATOM 433 CZ TYR A 30 -3.998 12.696 -2.820 1.00 0.00 C ATOM 434 OH TYR A 30 -3.682 13.962 -3.256 1.00 0.00 O ATOM 0 H TYR A 30 -3.674 9.248 0.630 1.00 0.00 H new ATOM 0 HA TYR A 30 -6.498 9.312 -0.037 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -4.089 8.130 -1.473 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -5.695 8.298 -2.152 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -6.579 10.950 -1.557 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -2.613 9.658 -2.427 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -6.017 13.207 -2.342 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.047 11.916 -3.208 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.746 13.984 -3.547 1.00 0.00 H new ATOM 444 N VAL A 31 -4.972 6.574 0.906 1.00 0.00 N ATOM 445 CA VAL A 31 -5.179 5.192 1.322 1.00 0.00 C ATOM 446 C VAL A 31 -6.176 5.109 2.474 1.00 0.00 C ATOM 447 O VAL A 31 -7.199 4.431 2.374 1.00 0.00 O ATOM 448 CB VAL A 31 -3.857 4.531 1.754 1.00 0.00 C ATOM 449 CG1 VAL A 31 -4.112 3.138 2.310 1.00 0.00 C ATOM 450 CG2 VAL A 31 -2.883 4.477 0.587 1.00 0.00 C ATOM 0 H VAL A 31 -4.036 6.934 1.092 1.00 0.00 H new ATOM 0 HA VAL A 31 -5.578 4.658 0.459 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.410 5.135 2.544 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.166 2.687 2.610 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.772 3.207 3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.581 2.521 1.544 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.954 4.007 0.910 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.320 3.896 -0.225 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.676 5.489 0.239 1.00 0.00 H new ATOM 460 N ILE A 32 -5.870 5.802 3.565 1.00 0.00 N ATOM 461 CA ILE A 32 -6.740 5.808 4.735 1.00 0.00 C ATOM 462 C ILE A 32 -8.162 6.213 4.360 1.00 0.00 C ATOM 463 O ILE A 32 -9.104 5.440 4.533 1.00 0.00 O ATOM 464 CB ILE A 32 -6.215 6.766 5.821 1.00 0.00 C ATOM 465 CG1 ILE A 32 -4.795 6.374 6.234 1.00 0.00 C ATOM 466 CG2 ILE A 32 -7.143 6.758 7.027 1.00 0.00 C ATOM 467 CD1 ILE A 32 -4.121 7.397 7.122 1.00 0.00 C ATOM 0 H ILE A 32 -5.026 6.367 3.664 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.746 4.792 5.130 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.189 7.776 5.412 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.828 5.417 6.755 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.192 6.228 5.338 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.759 7.440 7.786 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.139 7.079 6.722 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -7.197 5.750 7.438 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.118 7.054 7.376 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.056 8.349 6.596 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.702 7.526 8.035 1.00 0.00 H new ATOM 479 N GLY A 33 -8.309 7.429 3.845 1.00 0.00 N ATOM 480 CA GLY A 33 -9.620 7.915 3.452 1.00 0.00 C ATOM 481 C GLY A 33 -10.172 8.940 4.421 1.00 0.00 C ATOM 482 O GLY A 33 -9.519 9.290 5.404 1.00 0.00 O ATOM 0 H GLY A 33 -7.545 8.087 3.693 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -9.557 8.357 2.457 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.311 7.074 3.385 1.00 0.00 H new ATOM 486 N GLN A 34 -11.378 9.425 4.145 1.00 0.00 N ATOM 487 CA GLN A 34 -12.018 10.418 4.998 1.00 0.00 C ATOM 488 C GLN A 34 -12.538 9.779 6.282 1.00 0.00 C ATOM 489 O GLN A 34 -12.523 10.397 7.346 1.00 0.00 O ATOM 490 CB GLN A 34 -13.165 11.101 4.253 1.00 0.00 C ATOM 491 CG GLN A 34 -14.242 10.138 3.780 1.00 0.00 C ATOM 492 CD GLN A 34 -15.278 10.807 2.899 1.00 0.00 C ATOM 493 OE1 GLN A 34 -15.603 11.979 3.084 1.00 0.00 O ATOM 494 NE2 GLN A 34 -15.803 10.062 1.932 1.00 0.00 N ATOM 0 H GLN A 34 -11.932 9.145 3.336 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.271 11.167 5.263 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -13.618 11.847 4.906 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -12.762 11.634 3.392 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.776 9.320 3.230 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.737 9.698 4.646 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.504 9.094 1.815 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -16.505 10.458 1.307 1.00 0.00 H new ATOM 503 N LYS A 35 -12.998 8.537 6.174 1.00 0.00 N ATOM 504 CA LYS A 35 -13.522 7.812 7.325 1.00 0.00 C ATOM 505 C LYS A 35 -12.881 6.433 7.439 1.00 0.00 C ATOM 506 O LYS A 35 -13.561 5.441 7.695 1.00 0.00 O ATOM 507 CB LYS A 35 -15.042 7.672 7.216 1.00 0.00 C ATOM 508 CG LYS A 35 -15.742 7.573 8.560 1.00 0.00 C ATOM 509 CD LYS A 35 -17.035 6.780 8.459 1.00 0.00 C ATOM 510 CE LYS A 35 -17.519 6.328 9.829 1.00 0.00 C ATOM 511 NZ LYS A 35 -18.984 6.061 9.838 1.00 0.00 N ATOM 0 H LYS A 35 -13.018 8.011 5.300 1.00 0.00 H new ATOM 0 HA LYS A 35 -13.278 8.381 8.222 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.439 8.529 6.671 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -15.275 6.784 6.628 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -15.078 7.098 9.283 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -15.956 8.574 8.934 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -17.802 7.392 7.984 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -16.881 5.910 7.821 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -16.983 5.426 10.124 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -17.285 7.094 10.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -19.275 5.755 10.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -19.497 6.929 9.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -19.205 5.312 9.151 1.00 0.00 H new ATOM 525 N GLY A 36 -11.566 6.379 7.248 1.00 0.00 N ATOM 526 CA GLY A 36 -10.855 5.117 7.334 1.00 0.00 C ATOM 527 C GLY A 36 -11.656 3.960 6.769 1.00 0.00 C ATOM 528 O GLY A 36 -11.706 2.883 7.362 1.00 0.00 O ATOM 0 H GLY A 36 -10.981 7.187 7.035 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.911 5.198 6.796 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -10.611 4.911 8.376 1.00 0.00 H new ATOM 532 N SER A 37 -12.286 4.185 5.621 1.00 0.00 N ATOM 533 CA SER A 37 -13.094 3.154 4.979 1.00 0.00 C ATOM 534 C SER A 37 -12.310 2.465 3.865 1.00 0.00 C ATOM 535 O SER A 37 -12.281 1.239 3.778 1.00 0.00 O ATOM 536 CB SER A 37 -14.379 3.762 4.413 1.00 0.00 C ATOM 537 OG SER A 37 -15.259 4.153 5.454 1.00 0.00 O ATOM 0 H SER A 37 -12.253 5.071 5.116 1.00 0.00 H new ATOM 0 HA SER A 37 -13.354 2.409 5.731 1.00 0.00 H new ATOM 0 HB2 SER A 37 -14.135 4.626 3.795 1.00 0.00 H new ATOM 0 HB3 SER A 37 -14.874 3.037 3.767 1.00 0.00 H new ATOM 0 HG SER A 37 -14.745 4.564 6.180 1.00 0.00 H new ATOM 543 N GLY A 38 -11.677 3.267 3.013 1.00 0.00 N ATOM 544 CA GLY A 38 -10.902 2.718 1.916 1.00 0.00 C ATOM 545 C GLY A 38 -10.019 1.565 2.349 1.00 0.00 C ATOM 546 O GLY A 38 -9.911 0.559 1.647 1.00 0.00 O ATOM 0 H GLY A 38 -11.687 4.286 3.063 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -11.579 2.379 1.132 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -10.282 3.504 1.484 1.00 0.00 H new ATOM 550 N ILE A 39 -9.384 1.710 3.507 1.00 0.00 N ATOM 551 CA ILE A 39 -8.506 0.673 4.032 1.00 0.00 C ATOM 552 C ILE A 39 -9.308 -0.507 4.571 1.00 0.00 C ATOM 553 O ILE A 39 -9.001 -1.663 4.282 1.00 0.00 O ATOM 554 CB ILE A 39 -7.598 1.216 5.151 1.00 0.00 C ATOM 555 CG1 ILE A 39 -6.535 2.149 4.568 1.00 0.00 C ATOM 556 CG2 ILE A 39 -6.945 0.070 5.908 1.00 0.00 C ATOM 557 CD1 ILE A 39 -5.504 2.599 5.580 1.00 0.00 C ATOM 0 H ILE A 39 -9.462 2.537 4.100 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.884 0.338 3.202 1.00 0.00 H new ATOM 0 HB ILE A 39 -8.211 1.785 5.850 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.029 1.641 3.747 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.025 3.026 4.146 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -6.307 0.471 6.695 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.716 -0.559 6.352 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.343 -0.524 5.220 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.783 3.258 5.096 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -5.999 3.135 6.390 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.987 1.729 5.984 1.00 0.00 H new ATOM 569 N ARG A 40 -10.339 -0.205 5.355 1.00 0.00 N ATOM 570 CA ARG A 40 -11.187 -1.240 5.933 1.00 0.00 C ATOM 571 C ARG A 40 -11.512 -2.317 4.903 1.00 0.00 C ATOM 572 O ARG A 40 -11.475 -3.510 5.202 1.00 0.00 O ATOM 573 CB ARG A 40 -12.480 -0.626 6.472 1.00 0.00 C ATOM 574 CG ARG A 40 -12.390 -0.193 7.926 1.00 0.00 C ATOM 575 CD ARG A 40 -13.755 0.189 8.479 1.00 0.00 C ATOM 576 NE ARG A 40 -14.663 -0.952 8.533 1.00 0.00 N ATOM 577 CZ ARG A 40 -15.942 -0.858 8.878 1.00 0.00 C ATOM 578 NH1 ARG A 40 -16.461 0.319 9.197 1.00 0.00 N ATOM 579 NH2 ARG A 40 -16.705 -1.943 8.903 1.00 0.00 N ATOM 0 H ARG A 40 -10.606 0.747 5.604 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.642 -1.703 6.755 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -12.745 0.237 5.861 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.287 -1.351 6.367 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.968 -1.002 8.522 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -11.711 0.655 8.013 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -13.637 0.606 9.479 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -14.192 0.971 7.858 1.00 0.00 H new ATOM 0 HE ARG A 40 -14.295 -1.872 8.293 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -15.878 1.156 9.178 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -17.444 0.388 9.462 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -16.309 -2.850 8.657 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -17.687 -1.870 9.168 1.00 0.00 H new ATOM 593 N LYS A 41 -11.831 -1.887 3.686 1.00 0.00 N ATOM 594 CA LYS A 41 -12.162 -2.812 2.610 1.00 0.00 C ATOM 595 C LYS A 41 -11.188 -3.985 2.581 1.00 0.00 C ATOM 596 O LYS A 41 -11.599 -5.145 2.540 1.00 0.00 O ATOM 597 CB LYS A 41 -12.144 -2.087 1.262 1.00 0.00 C ATOM 598 CG LYS A 41 -12.268 -3.018 0.068 1.00 0.00 C ATOM 599 CD LYS A 41 -12.751 -2.278 -1.167 1.00 0.00 C ATOM 600 CE LYS A 41 -14.235 -1.951 -1.078 1.00 0.00 C ATOM 601 NZ LYS A 41 -14.833 -1.716 -2.421 1.00 0.00 N ATOM 0 H LYS A 41 -11.867 -0.903 3.421 1.00 0.00 H new ATOM 0 HA LYS A 41 -13.164 -3.199 2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -12.961 -1.366 1.236 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -11.216 -1.521 1.176 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -11.302 -3.479 -0.137 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -12.962 -3.825 0.305 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -12.181 -1.357 -1.286 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -12.564 -2.885 -2.053 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -14.759 -2.771 -0.586 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.375 -1.065 -0.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.844 -1.496 -2.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -14.351 -0.918 -2.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -14.722 -2.570 -3.005 1.00 0.00 H new ATOM 615 N MET A 42 -9.896 -3.676 2.605 1.00 0.00 N ATOM 616 CA MET A 42 -8.864 -4.705 2.585 1.00 0.00 C ATOM 617 C MET A 42 -8.884 -5.521 3.874 1.00 0.00 C ATOM 618 O MET A 42 -9.100 -6.732 3.849 1.00 0.00 O ATOM 619 CB MET A 42 -7.484 -4.072 2.391 1.00 0.00 C ATOM 620 CG MET A 42 -7.361 -3.267 1.108 1.00 0.00 C ATOM 621 SD MET A 42 -6.198 -1.897 1.256 1.00 0.00 S ATOM 622 CE MET A 42 -4.644 -2.738 0.960 1.00 0.00 C ATOM 0 H MET A 42 -9.539 -2.721 2.638 1.00 0.00 H new ATOM 0 HA MET A 42 -9.070 -5.373 1.749 1.00 0.00 H new ATOM 0 HB2 MET A 42 -7.268 -3.423 3.240 1.00 0.00 H new ATOM 0 HB3 MET A 42 -6.729 -4.858 2.391 1.00 0.00 H new ATOM 0 HG2 MET A 42 -7.040 -3.925 0.300 1.00 0.00 H new ATOM 0 HG3 MET A 42 -8.341 -2.878 0.832 1.00 0.00 H new ATOM 0 HE1 MET A 42 -4.012 -2.656 1.844 1.00 0.00 H new ATOM 0 HE2 MET A 42 -4.834 -3.790 0.746 1.00 0.00 H new ATOM 0 HE3 MET A 42 -4.139 -2.280 0.109 1.00 0.00 H new ATOM 632 N MET A 43 -8.658 -4.849 4.998 1.00 0.00 N ATOM 633 CA MET A 43 -8.652 -5.513 6.296 1.00 0.00 C ATOM 634 C MET A 43 -9.760 -6.557 6.379 1.00 0.00 C ATOM 635 O MET A 43 -9.627 -7.565 7.074 1.00 0.00 O ATOM 636 CB MET A 43 -8.818 -4.486 7.419 1.00 0.00 C ATOM 637 CG MET A 43 -7.705 -3.451 7.465 1.00 0.00 C ATOM 638 SD MET A 43 -7.586 -2.633 9.067 1.00 0.00 S ATOM 639 CE MET A 43 -8.466 -1.108 8.735 1.00 0.00 C ATOM 0 H MET A 43 -8.477 -3.846 5.036 1.00 0.00 H new ATOM 0 HA MET A 43 -7.693 -6.018 6.413 1.00 0.00 H new ATOM 0 HB2 MET A 43 -9.773 -3.975 7.295 1.00 0.00 H new ATOM 0 HB3 MET A 43 -8.857 -5.008 8.375 1.00 0.00 H new ATOM 0 HG2 MET A 43 -6.755 -3.934 7.236 1.00 0.00 H new ATOM 0 HG3 MET A 43 -7.877 -2.703 6.691 1.00 0.00 H new ATOM 0 HE1 MET A 43 -7.752 -0.290 8.636 1.00 0.00 H new ATOM 0 HE2 MET A 43 -9.033 -1.209 7.810 1.00 0.00 H new ATOM 0 HE3 MET A 43 -9.149 -0.896 9.558 1.00 0.00 H new ATOM 649 N ASP A 44 -10.854 -6.310 5.665 1.00 0.00 N ATOM 650 CA ASP A 44 -11.985 -7.230 5.658 1.00 0.00 C ATOM 651 C ASP A 44 -11.825 -8.279 4.561 1.00 0.00 C ATOM 652 O ASP A 44 -12.236 -9.427 4.724 1.00 0.00 O ATOM 653 CB ASP A 44 -13.293 -6.462 5.459 1.00 0.00 C ATOM 654 CG ASP A 44 -13.928 -6.050 6.773 1.00 0.00 C ATOM 655 OD1 ASP A 44 -13.183 -5.848 7.753 1.00 0.00 O ATOM 656 OD2 ASP A 44 -15.171 -5.933 6.820 1.00 0.00 O ATOM 0 H ASP A 44 -10.981 -5.481 5.084 1.00 0.00 H new ATOM 0 HA ASP A 44 -12.014 -7.739 6.622 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.101 -5.574 4.857 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.993 -7.082 4.899 1.00 0.00 H new ATOM 661 N GLU A 45 -11.227 -7.875 3.445 1.00 0.00 N ATOM 662 CA GLU A 45 -11.015 -8.779 2.322 1.00 0.00 C ATOM 663 C GLU A 45 -9.961 -9.829 2.660 1.00 0.00 C ATOM 664 O GLU A 45 -10.169 -11.025 2.451 1.00 0.00 O ATOM 665 CB GLU A 45 -10.590 -7.994 1.079 1.00 0.00 C ATOM 666 CG GLU A 45 -9.083 -7.870 0.924 1.00 0.00 C ATOM 667 CD GLU A 45 -8.684 -7.151 -0.349 1.00 0.00 C ATOM 668 OE1 GLU A 45 -8.569 -5.908 -0.318 1.00 0.00 O ATOM 669 OE2 GLU A 45 -8.487 -7.832 -1.377 1.00 0.00 O ATOM 0 H GLU A 45 -10.881 -6.927 3.295 1.00 0.00 H new ATOM 0 HA GLU A 45 -11.957 -9.288 2.116 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -10.999 -8.482 0.194 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -11.026 -6.996 1.123 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.676 -7.334 1.782 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.638 -8.865 0.929 1.00 0.00 H new ATOM 676 N PHE A 46 -8.827 -9.374 3.183 1.00 0.00 N ATOM 677 CA PHE A 46 -7.739 -10.272 3.550 1.00 0.00 C ATOM 678 C PHE A 46 -7.839 -10.677 5.018 1.00 0.00 C ATOM 679 O PHE A 46 -7.100 -11.544 5.484 1.00 0.00 O ATOM 680 CB PHE A 46 -6.388 -9.606 3.283 1.00 0.00 C ATOM 681 CG PHE A 46 -6.153 -9.283 1.836 1.00 0.00 C ATOM 682 CD1 PHE A 46 -5.809 -10.280 0.937 1.00 0.00 C ATOM 683 CD2 PHE A 46 -6.277 -7.984 1.373 1.00 0.00 C ATOM 684 CE1 PHE A 46 -5.593 -9.987 -0.397 1.00 0.00 C ATOM 685 CE2 PHE A 46 -6.063 -7.684 0.041 1.00 0.00 C ATOM 686 CZ PHE A 46 -5.719 -8.687 -0.845 1.00 0.00 C ATOM 0 H PHE A 46 -8.638 -8.388 3.362 1.00 0.00 H new ATOM 0 HA PHE A 46 -7.820 -11.170 2.938 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -6.323 -8.688 3.867 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -5.593 -10.263 3.634 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -5.708 -11.298 1.283 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -6.544 -7.196 2.061 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -5.326 -10.774 -1.087 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.165 -6.667 -0.307 1.00 0.00 H new ATOM 0 HZ PHE A 46 -5.549 -8.455 -1.886 1.00 0.00 H new ATOM 696 N GLU A 47 -8.756 -10.043 5.740 1.00 0.00 N ATOM 697 CA GLU A 47 -8.952 -10.335 7.155 1.00 0.00 C ATOM 698 C GLU A 47 -7.692 -10.016 7.955 1.00 0.00 C ATOM 699 O GLU A 47 -7.261 -10.804 8.797 1.00 0.00 O ATOM 700 CB GLU A 47 -9.331 -11.805 7.346 1.00 0.00 C ATOM 701 CG GLU A 47 -10.788 -12.103 7.034 1.00 0.00 C ATOM 702 CD GLU A 47 -11.290 -13.355 7.726 1.00 0.00 C ATOM 703 OE1 GLU A 47 -11.466 -13.318 8.963 1.00 0.00 O ATOM 704 OE2 GLU A 47 -11.505 -14.371 7.034 1.00 0.00 O ATOM 0 H GLU A 47 -9.376 -9.323 5.368 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.764 -9.707 7.521 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.698 -12.421 6.707 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.122 -12.095 8.376 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.401 -11.254 7.337 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.909 -12.215 5.957 1.00 0.00 H new ATOM 711 N VAL A 48 -7.106 -8.853 7.687 1.00 0.00 N ATOM 712 CA VAL A 48 -5.897 -8.428 8.381 1.00 0.00 C ATOM 713 C VAL A 48 -6.077 -7.047 9.001 1.00 0.00 C ATOM 714 O VAL A 48 -7.160 -6.467 8.946 1.00 0.00 O ATOM 715 CB VAL A 48 -4.685 -8.397 7.430 1.00 0.00 C ATOM 716 CG1 VAL A 48 -4.119 -9.797 7.242 1.00 0.00 C ATOM 717 CG2 VAL A 48 -5.073 -7.785 6.093 1.00 0.00 C ATOM 0 H VAL A 48 -7.450 -8.188 6.994 1.00 0.00 H new ATOM 0 HA VAL A 48 -5.712 -9.157 9.170 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.910 -7.774 7.876 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.264 -9.756 6.567 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.802 -10.194 8.206 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.885 -10.445 6.817 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.205 -7.771 5.434 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.865 -8.379 5.637 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.427 -6.766 6.248 1.00 0.00 H new ATOM 727 N ASN A 49 -5.007 -6.526 9.594 1.00 0.00 N ATOM 728 CA ASN A 49 -5.046 -5.213 10.226 1.00 0.00 C ATOM 729 C ASN A 49 -3.883 -4.346 9.751 1.00 0.00 C ATOM 730 O ASN A 49 -2.723 -4.632 10.046 1.00 0.00 O ATOM 731 CB ASN A 49 -5.002 -5.355 11.748 1.00 0.00 C ATOM 732 CG ASN A 49 -6.148 -6.192 12.285 1.00 0.00 C ATOM 733 OD1 ASN A 49 -5.944 -7.305 12.770 1.00 0.00 O ATOM 734 ND2 ASN A 49 -7.360 -5.659 12.198 1.00 0.00 N ATOM 0 H ASN A 49 -4.102 -6.994 9.650 1.00 0.00 H new ATOM 0 HA ASN A 49 -5.979 -4.727 9.940 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -4.056 -5.810 12.040 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -5.034 -4.365 12.203 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -8.170 -6.175 12.541 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -7.482 -4.733 11.788 1.00 0.00 H new ATOM 741 N ILE A 50 -4.204 -3.287 9.016 1.00 0.00 N ATOM 742 CA ILE A 50 -3.188 -2.377 8.501 1.00 0.00 C ATOM 743 C ILE A 50 -3.002 -1.181 9.428 1.00 0.00 C ATOM 744 O ILE A 50 -3.974 -0.574 9.879 1.00 0.00 O ATOM 745 CB ILE A 50 -3.547 -1.871 7.092 1.00 0.00 C ATOM 746 CG1 ILE A 50 -3.607 -3.039 6.106 1.00 0.00 C ATOM 747 CG2 ILE A 50 -2.535 -0.832 6.630 1.00 0.00 C ATOM 748 CD1 ILE A 50 -4.158 -2.657 4.750 1.00 0.00 C ATOM 0 H ILE A 50 -5.160 -3.038 8.763 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.257 -2.941 8.448 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.530 -1.402 7.130 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.605 -3.449 5.980 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -4.224 -3.831 6.530 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.801 -0.483 5.632 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -2.537 0.011 7.322 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -1.541 -1.278 6.605 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.171 -3.534 4.103 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.172 -2.274 4.864 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.528 -1.887 4.305 1.00 0.00 H new ATOM 760 N HIS A 51 -1.747 -0.845 9.709 1.00 0.00 N ATOM 761 CA HIS A 51 -1.432 0.282 10.580 1.00 0.00 C ATOM 762 C HIS A 51 -0.568 1.306 9.852 1.00 0.00 C ATOM 763 O HIS A 51 0.448 0.961 9.249 1.00 0.00 O ATOM 764 CB HIS A 51 -0.715 -0.206 11.839 1.00 0.00 C ATOM 765 CG HIS A 51 -1.646 -0.627 12.934 1.00 0.00 C ATOM 766 ND1 HIS A 51 -1.562 -0.141 14.222 1.00 0.00 N ATOM 767 CD2 HIS A 51 -2.687 -1.493 12.927 1.00 0.00 C ATOM 768 CE1 HIS A 51 -2.510 -0.691 14.960 1.00 0.00 C ATOM 769 NE2 HIS A 51 -3.206 -1.515 14.198 1.00 0.00 N ATOM 0 H HIS A 51 -0.931 -1.338 9.346 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.368 0.762 10.867 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -0.071 -1.046 11.578 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -0.068 0.589 12.209 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -3.043 -2.061 12.080 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -2.686 -0.499 16.008 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -4.000 -2.077 14.504 1.00 0.00 H new ATOM 777 N VAL A 52 -0.980 2.569 9.911 1.00 0.00 N ATOM 778 CA VAL A 52 -0.244 3.645 9.259 1.00 0.00 C ATOM 779 C VAL A 52 0.434 4.548 10.283 1.00 0.00 C ATOM 780 O VAL A 52 -0.139 4.898 11.315 1.00 0.00 O ATOM 781 CB VAL A 52 -1.168 4.499 8.370 1.00 0.00 C ATOM 782 CG1 VAL A 52 -0.393 5.647 7.741 1.00 0.00 C ATOM 783 CG2 VAL A 52 -1.822 3.638 7.301 1.00 0.00 C ATOM 0 H VAL A 52 -1.820 2.872 10.404 1.00 0.00 H new ATOM 0 HA VAL A 52 0.516 3.175 8.635 1.00 0.00 H new ATOM 0 HB VAL A 52 -1.954 4.923 8.995 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -1.062 6.239 7.117 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.024 6.278 8.526 1.00 0.00 H new ATOM 0 HG13 VAL A 52 0.416 5.248 7.129 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.471 4.257 6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.052 3.184 6.678 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.413 2.855 7.776 1.00 0.00 H new ATOM 793 N PRO A 53 1.685 4.937 9.994 1.00 0.00 N ATOM 794 CA PRO A 53 2.468 5.804 10.877 1.00 0.00 C ATOM 795 C PRO A 53 1.930 7.231 10.915 1.00 0.00 C ATOM 796 O PRO A 53 1.532 7.780 9.889 1.00 0.00 O ATOM 797 CB PRO A 53 3.866 5.777 10.254 1.00 0.00 C ATOM 798 CG PRO A 53 3.634 5.459 8.817 1.00 0.00 C ATOM 799 CD PRO A 53 2.431 4.557 8.782 1.00 0.00 C ATOM 0 HA PRO A 53 2.441 5.462 11.912 1.00 0.00 H new ATOM 0 HB2 PRO A 53 4.370 6.736 10.371 1.00 0.00 H new ATOM 0 HB3 PRO A 53 4.497 5.026 10.729 1.00 0.00 H new ATOM 0 HG2 PRO A 53 3.458 6.367 8.240 1.00 0.00 H new ATOM 0 HG3 PRO A 53 4.503 4.967 8.381 1.00 0.00 H new ATOM 0 HD2 PRO A 53 1.839 4.712 7.880 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.717 3.505 8.799 1.00 0.00 H new ATOM 807 N ALA A 54 1.921 7.824 12.104 1.00 0.00 N ATOM 808 CA ALA A 54 1.435 9.188 12.274 1.00 0.00 C ATOM 809 C ALA A 54 2.117 10.140 11.298 1.00 0.00 C ATOM 810 O ALA A 54 3.137 9.817 10.688 1.00 0.00 O ATOM 811 CB ALA A 54 1.652 9.651 13.706 1.00 0.00 C ATOM 0 H ALA A 54 2.245 7.381 12.964 1.00 0.00 H new ATOM 0 HA ALA A 54 0.366 9.196 12.060 1.00 0.00 H new ATOM 0 HB1 ALA A 54 1.284 10.671 13.818 1.00 0.00 H new ATOM 0 HB2 ALA A 54 1.111 8.994 14.387 1.00 0.00 H new ATOM 0 HB3 ALA A 54 2.716 9.621 13.941 1.00 0.00 H new ATOM 817 N PRO A 55 1.544 11.343 11.145 1.00 0.00 N ATOM 818 CA PRO A 55 2.081 12.367 10.244 1.00 0.00 C ATOM 819 C PRO A 55 3.397 12.949 10.747 1.00 0.00 C ATOM 820 O PRO A 55 4.252 13.347 9.957 1.00 0.00 O ATOM 821 CB PRO A 55 0.990 13.440 10.236 1.00 0.00 C ATOM 822 CG PRO A 55 0.279 13.268 11.534 1.00 0.00 C ATOM 823 CD PRO A 55 0.328 11.797 11.841 1.00 0.00 C ATOM 0 HA PRO A 55 2.308 11.963 9.257 1.00 0.00 H new ATOM 0 HB2 PRO A 55 1.418 14.439 10.148 1.00 0.00 H new ATOM 0 HB3 PRO A 55 0.312 13.309 9.393 1.00 0.00 H new ATOM 0 HG2 PRO A 55 0.760 13.847 12.322 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -0.751 13.618 11.464 1.00 0.00 H new ATOM 0 HD2 PRO A 55 0.386 11.612 12.914 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -0.560 11.281 11.476 1.00 0.00 H new ATOM 831 N GLU A 56 3.552 12.996 12.067 1.00 0.00 N ATOM 832 CA GLU A 56 4.765 13.531 12.674 1.00 0.00 C ATOM 833 C GLU A 56 5.975 12.669 12.323 1.00 0.00 C ATOM 834 O GLU A 56 7.085 13.175 12.158 1.00 0.00 O ATOM 835 CB GLU A 56 4.608 13.613 14.194 1.00 0.00 C ATOM 836 CG GLU A 56 4.348 12.269 14.852 1.00 0.00 C ATOM 837 CD GLU A 56 4.595 12.295 16.348 1.00 0.00 C ATOM 838 OE1 GLU A 56 3.860 13.011 17.059 1.00 0.00 O ATOM 839 OE2 GLU A 56 5.525 11.598 16.807 1.00 0.00 O ATOM 0 H GLU A 56 2.854 12.670 12.735 1.00 0.00 H new ATOM 0 HA GLU A 56 4.927 14.533 12.278 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.511 14.049 14.621 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.786 14.289 14.430 1.00 0.00 H new ATOM 0 HG2 GLU A 56 3.317 11.969 14.663 1.00 0.00 H new ATOM 0 HG3 GLU A 56 4.988 11.515 14.395 1.00 0.00 H new ATOM 846 N LEU A 57 5.752 11.364 12.211 1.00 0.00 N ATOM 847 CA LEU A 57 6.823 10.431 11.880 1.00 0.00 C ATOM 848 C LEU A 57 7.175 10.510 10.398 1.00 0.00 C ATOM 849 O LEU A 57 8.273 10.128 9.991 1.00 0.00 O ATOM 850 CB LEU A 57 6.411 9.002 12.243 1.00 0.00 C ATOM 851 CG LEU A 57 6.233 8.713 13.733 1.00 0.00 C ATOM 852 CD1 LEU A 57 5.615 7.338 13.940 1.00 0.00 C ATOM 853 CD2 LEU A 57 7.566 8.814 14.459 1.00 0.00 C ATOM 0 H LEU A 57 4.839 10.928 12.345 1.00 0.00 H new ATOM 0 HA LEU A 57 7.704 10.707 12.459 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.474 8.775 11.735 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.161 8.317 11.848 1.00 0.00 H new ATOM 0 HG LEU A 57 5.557 9.460 14.150 1.00 0.00 H new ATOM 0 HD11 LEU A 57 5.496 7.150 15.007 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.640 7.300 13.454 1.00 0.00 H new ATOM 0 HD13 LEU A 57 6.266 6.578 13.508 1.00 0.00 H new ATOM 0 HD21 LEU A 57 7.420 8.605 15.519 1.00 0.00 H new ATOM 0 HD22 LEU A 57 8.265 8.090 14.039 1.00 0.00 H new ATOM 0 HD23 LEU A 57 7.970 9.819 14.340 1.00 0.00 H new ATOM 865 N GLN A 58 6.240 11.009 9.598 1.00 0.00 N ATOM 866 CA GLN A 58 6.453 11.140 8.162 1.00 0.00 C ATOM 867 C GLN A 58 7.239 9.951 7.618 1.00 0.00 C ATOM 868 O GLN A 58 8.251 10.122 6.938 1.00 0.00 O ATOM 869 CB GLN A 58 7.195 12.441 7.851 1.00 0.00 C ATOM 870 CG GLN A 58 8.127 12.890 8.965 1.00 0.00 C ATOM 871 CD GLN A 58 8.809 14.209 8.658 1.00 0.00 C ATOM 872 OE1 GLN A 58 10.027 14.266 8.484 1.00 0.00 O ATOM 873 NE2 GLN A 58 8.026 15.280 8.591 1.00 0.00 N ATOM 0 H GLN A 58 5.327 11.330 9.920 1.00 0.00 H new ATOM 0 HA GLN A 58 5.477 11.161 7.676 1.00 0.00 H new ATOM 0 HB2 GLN A 58 7.772 12.311 6.936 1.00 0.00 H new ATOM 0 HB3 GLN A 58 6.466 13.228 7.659 1.00 0.00 H new ATOM 0 HG2 GLN A 58 7.561 12.985 9.891 1.00 0.00 H new ATOM 0 HG3 GLN A 58 8.884 12.124 9.131 1.00 0.00 H new ATOM 0 HE21 GLN A 58 7.021 15.188 8.742 1.00 0.00 H new ATOM 0 HE22 GLN A 58 8.429 16.195 8.389 1.00 0.00 H new ATOM 882 N SER A 59 6.766 8.746 7.922 1.00 0.00 N ATOM 883 CA SER A 59 7.427 7.529 7.468 1.00 0.00 C ATOM 884 C SER A 59 6.758 6.985 6.209 1.00 0.00 C ATOM 885 O SER A 59 5.552 7.137 6.019 1.00 0.00 O ATOM 886 CB SER A 59 7.403 6.468 8.570 1.00 0.00 C ATOM 887 OG SER A 59 8.403 5.487 8.356 1.00 0.00 O ATOM 0 H SER A 59 5.928 8.587 8.481 1.00 0.00 H new ATOM 0 HA SER A 59 8.463 7.774 7.232 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.556 6.943 9.539 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.423 5.992 8.600 1.00 0.00 H new ATOM 0 HG SER A 59 8.368 4.822 9.075 1.00 0.00 H new ATOM 893 N ASP A 60 7.551 6.352 5.352 1.00 0.00 N ATOM 894 CA ASP A 60 7.037 5.785 4.111 1.00 0.00 C ATOM 895 C ASP A 60 6.939 4.265 4.207 1.00 0.00 C ATOM 896 O ASP A 60 6.890 3.571 3.192 1.00 0.00 O ATOM 897 CB ASP A 60 7.935 6.176 2.936 1.00 0.00 C ATOM 898 CG ASP A 60 8.330 7.639 2.971 1.00 0.00 C ATOM 899 OD1 ASP A 60 7.550 8.450 3.514 1.00 0.00 O ATOM 900 OD2 ASP A 60 9.417 7.973 2.455 1.00 0.00 O ATOM 0 H ASP A 60 8.552 6.219 5.494 1.00 0.00 H new ATOM 0 HA ASP A 60 6.037 6.186 3.944 1.00 0.00 H new ATOM 0 HB2 ASP A 60 8.834 5.560 2.949 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.417 5.965 2.001 1.00 0.00 H new ATOM 905 N ILE A 61 6.912 3.756 5.434 1.00 0.00 N ATOM 906 CA ILE A 61 6.819 2.320 5.664 1.00 0.00 C ATOM 907 C ILE A 61 5.596 1.975 6.507 1.00 0.00 C ATOM 908 O ILE A 61 5.569 2.232 7.711 1.00 0.00 O ATOM 909 CB ILE A 61 8.081 1.779 6.361 1.00 0.00 C ATOM 910 CG1 ILE A 61 9.327 2.489 5.832 1.00 0.00 C ATOM 911 CG2 ILE A 61 8.194 0.275 6.159 1.00 0.00 C ATOM 912 CD1 ILE A 61 9.656 2.144 4.396 1.00 0.00 C ATOM 0 H ILE A 61 6.953 4.317 6.285 1.00 0.00 H new ATOM 0 HA ILE A 61 6.725 1.849 4.685 1.00 0.00 H new ATOM 0 HB ILE A 61 8.001 1.977 7.430 1.00 0.00 H new ATOM 0 HG12 ILE A 61 9.184 3.566 5.915 1.00 0.00 H new ATOM 0 HG13 ILE A 61 10.178 2.231 6.463 1.00 0.00 H new ATOM 0 HG21 ILE A 61 9.091 -0.093 6.657 1.00 0.00 H new ATOM 0 HG22 ILE A 61 7.317 -0.216 6.581 1.00 0.00 H new ATOM 0 HG23 ILE A 61 8.255 0.055 5.093 1.00 0.00 H new ATOM 0 HD11 ILE A 61 10.551 2.684 4.088 1.00 0.00 H new ATOM 0 HD12 ILE A 61 9.831 1.072 4.310 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.822 2.428 3.754 1.00 0.00 H new ATOM 924 N ILE A 62 4.589 1.390 5.869 1.00 0.00 N ATOM 925 CA ILE A 62 3.365 1.008 6.562 1.00 0.00 C ATOM 926 C ILE A 62 3.512 -0.359 7.223 1.00 0.00 C ATOM 927 O ILE A 62 4.092 -1.279 6.647 1.00 0.00 O ATOM 928 CB ILE A 62 2.162 0.975 5.601 1.00 0.00 C ATOM 929 CG1 ILE A 62 1.724 2.398 5.249 1.00 0.00 C ATOM 930 CG2 ILE A 62 1.010 0.199 6.224 1.00 0.00 C ATOM 931 CD1 ILE A 62 0.768 2.463 4.078 1.00 0.00 C ATOM 0 H ILE A 62 4.596 1.170 4.873 1.00 0.00 H new ATOM 0 HA ILE A 62 3.187 1.762 7.329 1.00 0.00 H new ATOM 0 HB ILE A 62 2.461 0.470 4.683 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.250 2.850 6.120 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.607 2.995 5.021 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.166 0.184 5.534 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.329 -0.823 6.430 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.709 0.680 7.155 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.500 3.502 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 62 1.246 2.041 3.194 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.132 1.893 4.311 1.00 0.00 H new ATOM 943 N ALA A 63 2.981 -0.484 8.434 1.00 0.00 N ATOM 944 CA ALA A 63 3.049 -1.738 9.173 1.00 0.00 C ATOM 945 C ALA A 63 1.728 -2.496 9.091 1.00 0.00 C ATOM 946 O ALA A 63 0.679 -1.974 9.468 1.00 0.00 O ATOM 947 CB ALA A 63 3.421 -1.478 10.624 1.00 0.00 C ATOM 0 H ALA A 63 2.498 0.269 8.925 1.00 0.00 H new ATOM 0 HA ALA A 63 3.822 -2.357 8.718 1.00 0.00 H new ATOM 0 HB1 ALA A 63 3.468 -2.424 11.163 1.00 0.00 H new ATOM 0 HB2 ALA A 63 4.393 -0.987 10.668 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.669 -0.836 11.083 1.00 0.00 H new ATOM 953 N ILE A 64 1.787 -3.728 8.596 1.00 0.00 N ATOM 954 CA ILE A 64 0.595 -4.556 8.466 1.00 0.00 C ATOM 955 C ILE A 64 0.693 -5.802 9.340 1.00 0.00 C ATOM 956 O ILE A 64 1.689 -6.525 9.300 1.00 0.00 O ATOM 957 CB ILE A 64 0.364 -4.985 7.005 1.00 0.00 C ATOM 958 CG1 ILE A 64 0.323 -3.758 6.091 1.00 0.00 C ATOM 959 CG2 ILE A 64 -0.925 -5.784 6.885 1.00 0.00 C ATOM 960 CD1 ILE A 64 0.209 -4.101 4.622 1.00 0.00 C ATOM 0 H ILE A 64 2.648 -4.174 8.279 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.248 -3.949 8.796 1.00 0.00 H new ATOM 0 HB ILE A 64 1.193 -5.620 6.693 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.522 -3.131 6.376 1.00 0.00 H new ATOM 0 HG13 ILE A 64 1.225 -3.167 6.249 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.074 -6.080 5.847 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.861 -6.674 7.510 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.765 -5.171 7.212 1.00 0.00 H new ATOM 0 HD11 ILE A 64 0.185 -3.183 4.035 1.00 0.00 H new ATOM 0 HD12 ILE A 64 1.067 -4.702 4.321 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.708 -4.665 4.450 1.00 0.00 H new ATOM 972 N THR A 65 -0.349 -6.049 10.128 1.00 0.00 N ATOM 973 CA THR A 65 -0.381 -7.208 11.011 1.00 0.00 C ATOM 974 C THR A 65 -1.273 -8.306 10.445 1.00 0.00 C ATOM 975 O THR A 65 -2.350 -8.034 9.916 1.00 0.00 O ATOM 976 CB THR A 65 -0.883 -6.829 12.418 1.00 0.00 C ATOM 977 OG1 THR A 65 -0.148 -5.703 12.913 1.00 0.00 O ATOM 978 CG2 THR A 65 -0.736 -7.999 13.378 1.00 0.00 C ATOM 0 H THR A 65 -1.182 -5.462 10.172 1.00 0.00 H new ATOM 0 HA THR A 65 0.642 -7.577 11.085 1.00 0.00 H new ATOM 0 HB THR A 65 -1.939 -6.570 12.346 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.474 -5.467 13.807 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.097 -7.708 14.364 1.00 0.00 H new ATOM 0 HG22 THR A 65 -1.319 -8.844 13.013 1.00 0.00 H new ATOM 0 HG23 THR A 65 0.314 -8.285 13.445 1.00 0.00 H new ATOM 986 N GLY A 66 -0.819 -9.550 10.560 1.00 0.00 N ATOM 987 CA GLY A 66 -1.590 -10.671 10.055 1.00 0.00 C ATOM 988 C GLY A 66 -0.747 -11.918 9.872 1.00 0.00 C ATOM 989 O GLY A 66 0.460 -11.903 10.119 1.00 0.00 O ATOM 0 H GLY A 66 0.069 -9.802 10.994 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.407 -10.886 10.744 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -2.041 -10.398 9.101 1.00 0.00 H new ATOM 993 N LEU A 67 -1.383 -13.002 9.440 1.00 0.00 N ATOM 994 CA LEU A 67 -0.684 -14.265 9.225 1.00 0.00 C ATOM 995 C LEU A 67 0.231 -14.181 8.009 1.00 0.00 C ATOM 996 O LEU A 67 -0.154 -13.657 6.965 1.00 0.00 O ATOM 997 CB LEU A 67 -1.691 -15.403 9.043 1.00 0.00 C ATOM 998 CG LEU A 67 -2.513 -15.776 10.278 1.00 0.00 C ATOM 999 CD1 LEU A 67 -3.482 -16.901 9.953 1.00 0.00 C ATOM 1000 CD2 LEU A 67 -1.598 -16.172 11.428 1.00 0.00 C ATOM 0 H LEU A 67 -2.381 -13.032 9.232 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.071 -14.467 10.104 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.379 -15.128 8.243 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.151 -16.289 8.709 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.091 -14.904 10.584 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.058 -17.153 10.843 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.159 -16.581 9.161 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.924 -17.777 9.621 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.200 -16.434 12.298 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -0.993 -17.030 11.133 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.944 -15.336 11.677 1.00 0.00 H new ATOM 1012 N ALA A 68 1.445 -14.703 8.151 1.00 0.00 N ATOM 1013 CA ALA A 68 2.414 -14.691 7.062 1.00 0.00 C ATOM 1014 C ALA A 68 1.731 -14.913 5.718 1.00 0.00 C ATOM 1015 O ALA A 68 2.172 -14.390 4.693 1.00 0.00 O ATOM 1016 CB ALA A 68 3.484 -15.748 7.295 1.00 0.00 C ATOM 0 H ALA A 68 1.781 -15.139 9.010 1.00 0.00 H new ATOM 0 HA ALA A 68 2.888 -13.710 7.041 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.201 -15.727 6.474 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.000 -15.542 8.233 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.018 -16.732 7.346 1.00 0.00 H new ATOM 1022 N ALA A 69 0.656 -15.692 5.727 1.00 0.00 N ATOM 1023 CA ALA A 69 -0.088 -15.982 4.507 1.00 0.00 C ATOM 1024 C ALA A 69 -0.908 -14.775 4.064 1.00 0.00 C ATOM 1025 O ALA A 69 -0.827 -14.347 2.913 1.00 0.00 O ATOM 1026 CB ALA A 69 -0.991 -17.189 4.715 1.00 0.00 C ATOM 0 H ALA A 69 0.280 -16.134 6.566 1.00 0.00 H new ATOM 0 HA ALA A 69 0.629 -16.210 3.718 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.541 -17.395 3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.385 -18.056 4.977 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.695 -16.982 5.521 1.00 0.00 H new ATOM 1032 N ASN A 70 -1.698 -14.232 4.985 1.00 0.00 N ATOM 1033 CA ASN A 70 -2.534 -13.075 4.687 1.00 0.00 C ATOM 1034 C ASN A 70 -1.679 -11.860 4.339 1.00 0.00 C ATOM 1035 O ASN A 70 -1.967 -11.136 3.386 1.00 0.00 O ATOM 1036 CB ASN A 70 -3.437 -12.752 5.880 1.00 0.00 C ATOM 1037 CG ASN A 70 -4.022 -13.998 6.516 1.00 0.00 C ATOM 1038 OD1 ASN A 70 -3.691 -15.119 6.131 1.00 0.00 O ATOM 1039 ND2 ASN A 70 -4.897 -13.806 7.497 1.00 0.00 N ATOM 0 H ASN A 70 -1.777 -14.574 5.943 1.00 0.00 H new ATOM 0 HA ASN A 70 -3.154 -13.319 3.825 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -2.865 -12.201 6.626 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.247 -12.100 5.553 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -5.324 -14.606 7.964 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -5.142 -12.858 7.784 1.00 0.00 H new ATOM 1046 N LEU A 71 -0.624 -11.643 5.119 1.00 0.00 N ATOM 1047 CA LEU A 71 0.274 -10.517 4.894 1.00 0.00 C ATOM 1048 C LEU A 71 0.745 -10.477 3.443 1.00 0.00 C ATOM 1049 O LEU A 71 0.858 -9.407 2.845 1.00 0.00 O ATOM 1050 CB LEU A 71 1.481 -10.607 5.830 1.00 0.00 C ATOM 1051 CG LEU A 71 1.165 -10.721 7.321 1.00 0.00 C ATOM 1052 CD1 LEU A 71 2.381 -11.218 8.089 1.00 0.00 C ATOM 1053 CD2 LEU A 71 0.697 -9.382 7.872 1.00 0.00 C ATOM 0 H LEU A 71 -0.371 -12.232 5.912 1.00 0.00 H new ATOM 0 HA LEU A 71 -0.275 -9.599 5.105 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.078 -11.471 5.538 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.101 -9.724 5.677 1.00 0.00 H new ATOM 0 HG LEU A 71 0.360 -11.445 7.446 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.137 -11.293 9.149 1.00 0.00 H new ATOM 0 HD12 LEU A 71 2.672 -12.199 7.714 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.206 -10.519 7.955 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.477 -9.483 8.935 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.481 -8.637 7.733 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.202 -9.065 7.344 1.00 0.00 H new ATOM 1065 N ASP A 72 1.016 -11.650 2.881 1.00 0.00 N ATOM 1066 CA ASP A 72 1.470 -11.751 1.499 1.00 0.00 C ATOM 1067 C ASP A 72 0.411 -11.218 0.540 1.00 0.00 C ATOM 1068 O ASP A 72 0.699 -10.378 -0.313 1.00 0.00 O ATOM 1069 CB ASP A 72 1.805 -13.202 1.155 1.00 0.00 C ATOM 1070 CG ASP A 72 3.214 -13.584 1.563 1.00 0.00 C ATOM 1071 OD1 ASP A 72 3.765 -12.934 2.477 1.00 0.00 O ATOM 1072 OD2 ASP A 72 3.767 -14.534 0.969 1.00 0.00 O ATOM 0 H ASP A 72 0.929 -12.545 3.362 1.00 0.00 H new ATOM 0 HA ASP A 72 2.369 -11.144 1.392 1.00 0.00 H new ATOM 0 HB2 ASP A 72 1.095 -13.863 1.651 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.687 -13.354 0.082 1.00 0.00 H new ATOM 1077 N ARG A 73 -0.814 -11.712 0.684 1.00 0.00 N ATOM 1078 CA ARG A 73 -1.915 -11.287 -0.172 1.00 0.00 C ATOM 1079 C ARG A 73 -2.214 -9.804 0.022 1.00 0.00 C ATOM 1080 O ARG A 73 -2.210 -9.029 -0.935 1.00 0.00 O ATOM 1081 CB ARG A 73 -3.168 -12.114 0.125 1.00 0.00 C ATOM 1082 CG ARG A 73 -2.867 -13.524 0.605 1.00 0.00 C ATOM 1083 CD ARG A 73 -3.966 -14.496 0.202 1.00 0.00 C ATOM 1084 NE ARG A 73 -3.550 -15.887 0.357 1.00 0.00 N ATOM 1085 CZ ARG A 73 -2.690 -16.491 -0.455 1.00 0.00 C ATOM 1086 NH1 ARG A 73 -2.156 -15.831 -1.472 1.00 0.00 N ATOM 1087 NH2 ARG A 73 -2.361 -17.761 -0.249 1.00 0.00 N ATOM 0 H ARG A 73 -1.069 -12.407 1.385 1.00 0.00 H new ATOM 0 HA ARG A 73 -1.619 -11.447 -1.209 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -3.761 -11.600 0.882 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.779 -12.169 -0.776 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -1.916 -13.856 0.189 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.758 -13.525 1.690 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -4.852 -14.313 0.809 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -4.247 -14.315 -0.835 1.00 0.00 H new ATOM 0 HE ARG A 73 -3.941 -16.424 1.131 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -2.405 -14.855 -1.634 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -1.496 -16.299 -2.093 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -2.769 -18.273 0.533 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -1.700 -18.224 -0.873 1.00 0.00 H new ATOM 1101 N ALA A 74 -2.472 -9.415 1.267 1.00 0.00 N ATOM 1102 CA ALA A 74 -2.771 -8.025 1.586 1.00 0.00 C ATOM 1103 C ALA A 74 -1.674 -7.096 1.078 1.00 0.00 C ATOM 1104 O ALA A 74 -1.942 -6.140 0.352 1.00 0.00 O ATOM 1105 CB ALA A 74 -2.955 -7.857 3.087 1.00 0.00 C ATOM 0 H ALA A 74 -2.480 -10.043 2.070 1.00 0.00 H new ATOM 0 HA ALA A 74 -3.700 -7.754 1.084 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -3.178 -6.814 3.312 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.779 -8.485 3.425 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.040 -8.151 3.601 1.00 0.00 H new ATOM 1111 N LYS A 75 -0.435 -7.385 1.465 1.00 0.00 N ATOM 1112 CA LYS A 75 0.705 -6.576 1.049 1.00 0.00 C ATOM 1113 C LYS A 75 0.735 -6.419 -0.468 1.00 0.00 C ATOM 1114 O LYS A 75 1.037 -5.343 -0.983 1.00 0.00 O ATOM 1115 CB LYS A 75 2.010 -7.212 1.532 1.00 0.00 C ATOM 1116 CG LYS A 75 3.247 -6.402 1.183 1.00 0.00 C ATOM 1117 CD LYS A 75 4.521 -7.182 1.459 1.00 0.00 C ATOM 1118 CE LYS A 75 5.731 -6.519 0.819 1.00 0.00 C ATOM 1119 NZ LYS A 75 6.982 -6.795 1.578 1.00 0.00 N ATOM 0 H LYS A 75 -0.195 -8.173 2.066 1.00 0.00 H new ATOM 0 HA LYS A 75 0.601 -5.588 1.497 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.963 -7.341 2.613 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.103 -8.207 1.096 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.213 -6.120 0.131 1.00 0.00 H new ATOM 0 HG3 LYS A 75 3.253 -5.478 1.761 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.675 -7.260 2.535 1.00 0.00 H new ATOM 0 HD3 LYS A 75 4.417 -8.198 1.077 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.841 -6.876 -0.205 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.569 -5.442 0.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 7.783 -6.326 1.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 6.887 -6.432 2.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.151 -7.821 1.608 1.00 0.00 H new ATOM 1133 N ALA A 76 0.419 -7.498 -1.177 1.00 0.00 N ATOM 1134 CA ALA A 76 0.407 -7.478 -2.634 1.00 0.00 C ATOM 1135 C ALA A 76 -0.599 -6.460 -3.161 1.00 0.00 C ATOM 1136 O ALA A 76 -0.327 -5.746 -4.126 1.00 0.00 O ATOM 1137 CB ALA A 76 0.093 -8.863 -3.178 1.00 0.00 C ATOM 0 H ALA A 76 0.168 -8.397 -0.765 1.00 0.00 H new ATOM 0 HA ALA A 76 1.398 -7.181 -2.977 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.087 -8.833 -4.268 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.852 -9.568 -2.838 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.885 -9.182 -2.819 1.00 0.00 H new ATOM 1143 N GLY A 77 -1.762 -6.398 -2.520 1.00 0.00 N ATOM 1144 CA GLY A 77 -2.791 -5.464 -2.938 1.00 0.00 C ATOM 1145 C GLY A 77 -2.351 -4.019 -2.809 1.00 0.00 C ATOM 1146 O GLY A 77 -2.504 -3.229 -3.742 1.00 0.00 O ATOM 0 H GLY A 77 -2.010 -6.978 -1.718 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -3.062 -5.667 -3.974 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.687 -5.623 -2.337 1.00 0.00 H new ATOM 1150 N LEU A 78 -1.803 -3.671 -1.651 1.00 0.00 N ATOM 1151 CA LEU A 78 -1.340 -2.311 -1.401 1.00 0.00 C ATOM 1152 C LEU A 78 -0.249 -1.916 -2.392 1.00 0.00 C ATOM 1153 O LEU A 78 -0.308 -0.849 -3.004 1.00 0.00 O ATOM 1154 CB LEU A 78 -0.815 -2.183 0.030 1.00 0.00 C ATOM 1155 CG LEU A 78 -0.849 -0.780 0.636 1.00 0.00 C ATOM 1156 CD1 LEU A 78 -2.284 -0.297 0.783 1.00 0.00 C ATOM 1157 CD2 LEU A 78 -0.139 -0.762 1.981 1.00 0.00 C ATOM 0 H LEU A 78 -1.668 -4.312 -0.869 1.00 0.00 H new ATOM 0 HA LEU A 78 -2.186 -1.637 -1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.397 -2.847 0.669 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.214 -2.541 0.051 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.325 -0.102 -0.038 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.289 0.703 1.216 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.761 -0.271 -0.197 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.832 -0.977 1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.173 0.245 2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.634 -1.454 2.663 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.900 -1.064 1.848 1.00 0.00 H new ATOM 1169 N LEU A 79 0.744 -2.784 -2.545 1.00 0.00 N ATOM 1170 CA LEU A 79 1.849 -2.528 -3.465 1.00 0.00 C ATOM 1171 C LEU A 79 1.329 -2.128 -4.842 1.00 0.00 C ATOM 1172 O LEU A 79 1.765 -1.129 -5.414 1.00 0.00 O ATOM 1173 CB LEU A 79 2.737 -3.767 -3.582 1.00 0.00 C ATOM 1174 CG LEU A 79 3.539 -4.140 -2.334 1.00 0.00 C ATOM 1175 CD1 LEU A 79 4.131 -5.533 -2.476 1.00 0.00 C ATOM 1176 CD2 LEU A 79 4.635 -3.116 -2.080 1.00 0.00 C ATOM 0 H LEU A 79 0.808 -3.671 -2.045 1.00 0.00 H new ATOM 0 HA LEU A 79 2.439 -1.702 -3.066 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.108 -4.615 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.435 -3.613 -4.405 1.00 0.00 H new ATOM 0 HG LEU A 79 2.864 -4.141 -1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 79 4.698 -5.781 -1.579 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.328 -6.258 -2.609 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.792 -5.561 -3.342 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.196 -3.397 -1.188 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.308 -3.083 -2.937 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.188 -2.133 -1.933 1.00 0.00 H new ATOM 1188 N GLU A 80 0.394 -2.914 -5.367 1.00 0.00 N ATOM 1189 CA GLU A 80 -0.186 -2.639 -6.676 1.00 0.00 C ATOM 1190 C GLU A 80 -0.998 -1.347 -6.653 1.00 0.00 C ATOM 1191 O GLU A 80 -1.024 -0.600 -7.631 1.00 0.00 O ATOM 1192 CB GLU A 80 -1.073 -3.804 -7.120 1.00 0.00 C ATOM 1193 CG GLU A 80 -0.306 -5.089 -7.381 1.00 0.00 C ATOM 1194 CD GLU A 80 -1.030 -6.018 -8.337 1.00 0.00 C ATOM 1195 OE1 GLU A 80 -1.783 -5.515 -9.197 1.00 0.00 O ATOM 1196 OE2 GLU A 80 -0.842 -7.247 -8.223 1.00 0.00 O ATOM 0 H GLU A 80 0.023 -3.745 -4.907 1.00 0.00 H new ATOM 0 HA GLU A 80 0.631 -2.521 -7.388 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.825 -3.989 -6.353 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.606 -3.519 -8.027 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.675 -4.846 -7.790 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -0.138 -5.606 -6.436 1.00 0.00 H new ATOM 1203 N ARG A 81 -1.660 -1.092 -5.529 1.00 0.00 N ATOM 1204 CA ARG A 81 -2.473 0.107 -5.377 1.00 0.00 C ATOM 1205 C ARG A 81 -1.601 1.359 -5.364 1.00 0.00 C ATOM 1206 O ARG A 81 -2.012 2.421 -5.832 1.00 0.00 O ATOM 1207 CB ARG A 81 -3.297 0.032 -4.090 1.00 0.00 C ATOM 1208 CG ARG A 81 -4.617 0.783 -4.165 1.00 0.00 C ATOM 1209 CD ARG A 81 -5.719 -0.088 -4.747 1.00 0.00 C ATOM 1210 NE ARG A 81 -6.962 0.656 -4.935 1.00 0.00 N ATOM 1211 CZ ARG A 81 -8.148 0.079 -5.085 1.00 0.00 C ATOM 1212 NH1 ARG A 81 -8.254 -1.243 -5.068 1.00 0.00 N ATOM 1213 NH2 ARG A 81 -9.234 0.824 -5.251 1.00 0.00 N ATOM 0 H ARG A 81 -1.649 -1.700 -4.710 1.00 0.00 H new ATOM 0 HA ARG A 81 -3.149 0.166 -6.230 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -3.497 -1.014 -3.857 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -2.706 0.434 -3.267 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -4.904 1.118 -3.168 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -4.495 1.676 -4.778 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -5.392 -0.495 -5.704 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -5.900 -0.935 -4.085 1.00 0.00 H new ATOM 0 HE ARG A 81 -6.916 1.675 -4.952 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -7.423 -1.820 -4.939 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -9.167 -1.683 -5.184 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -9.158 1.841 -5.263 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -10.145 0.379 -5.366 1.00 0.00 H new ATOM 1227 N VAL A 82 -0.394 1.226 -4.824 1.00 0.00 N ATOM 1228 CA VAL A 82 0.538 2.346 -4.750 1.00 0.00 C ATOM 1229 C VAL A 82 1.137 2.653 -6.117 1.00 0.00 C ATOM 1230 O VAL A 82 1.377 3.813 -6.456 1.00 0.00 O ATOM 1231 CB VAL A 82 1.678 2.062 -3.754 1.00 0.00 C ATOM 1232 CG1 VAL A 82 2.700 3.188 -3.777 1.00 0.00 C ATOM 1233 CG2 VAL A 82 1.122 1.864 -2.352 1.00 0.00 C ATOM 0 H VAL A 82 -0.038 0.354 -4.431 1.00 0.00 H new ATOM 0 HA VAL A 82 -0.031 3.209 -4.404 1.00 0.00 H new ATOM 0 HB VAL A 82 2.180 1.142 -4.055 1.00 0.00 H new ATOM 0 HG11 VAL A 82 3.498 2.970 -3.067 1.00 0.00 H new ATOM 0 HG12 VAL A 82 3.120 3.278 -4.779 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.216 4.125 -3.502 1.00 0.00 H new ATOM 0 HG21 VAL A 82 1.941 1.664 -1.661 1.00 0.00 H new ATOM 0 HG22 VAL A 82 0.595 2.765 -2.039 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.432 1.020 -2.350 1.00 0.00 H new ATOM 1243 N LYS A 83 1.378 1.607 -6.900 1.00 0.00 N ATOM 1244 CA LYS A 83 1.948 1.763 -8.234 1.00 0.00 C ATOM 1245 C LYS A 83 0.923 2.351 -9.198 1.00 0.00 C ATOM 1246 O LYS A 83 1.271 3.117 -10.096 1.00 0.00 O ATOM 1247 CB LYS A 83 2.445 0.415 -8.760 1.00 0.00 C ATOM 1248 CG LYS A 83 3.615 -0.150 -7.974 1.00 0.00 C ATOM 1249 CD LYS A 83 4.005 -1.532 -8.470 1.00 0.00 C ATOM 1250 CE LYS A 83 5.205 -2.080 -7.713 1.00 0.00 C ATOM 1251 NZ LYS A 83 6.490 -1.591 -8.286 1.00 0.00 N ATOM 0 H LYS A 83 1.187 0.641 -6.634 1.00 0.00 H new ATOM 0 HA LYS A 83 2.791 2.451 -8.164 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.623 -0.300 -8.736 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.740 0.528 -9.803 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.469 0.522 -8.058 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.353 -0.202 -6.917 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.161 -2.212 -8.356 1.00 0.00 H new ATOM 0 HD3 LYS A 83 4.236 -1.486 -9.534 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.139 -1.786 -6.665 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.186 -3.169 -7.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.285 -1.986 -7.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.565 -1.893 -9.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.519 -0.553 -8.237 1.00 0.00 H new ATOM 1265 N GLU A 84 -0.341 1.988 -9.005 1.00 0.00 N ATOM 1266 CA GLU A 84 -1.416 2.481 -9.859 1.00 0.00 C ATOM 1267 C GLU A 84 -1.908 3.844 -9.382 1.00 0.00 C ATOM 1268 O GLU A 84 -2.410 4.647 -10.170 1.00 0.00 O ATOM 1269 CB GLU A 84 -2.577 1.485 -9.881 1.00 0.00 C ATOM 1270 CG GLU A 84 -2.465 0.440 -10.977 1.00 0.00 C ATOM 1271 CD GLU A 84 -3.657 -0.495 -11.018 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -3.622 -1.532 -10.325 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -4.627 -0.188 -11.743 1.00 0.00 O ATOM 0 H GLU A 84 -0.646 1.355 -8.266 1.00 0.00 H new ATOM 0 HA GLU A 84 -1.022 2.590 -10.869 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -2.630 0.982 -8.916 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -3.511 2.032 -10.007 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.367 0.939 -11.941 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.556 -0.143 -10.826 1.00 0.00 H new ATOM 1280 N LEU A 85 -1.762 4.098 -8.086 1.00 0.00 N ATOM 1281 CA LEU A 85 -2.192 5.364 -7.502 1.00 0.00 C ATOM 1282 C LEU A 85 -1.304 6.511 -7.974 1.00 0.00 C ATOM 1283 O LEU A 85 -1.787 7.484 -8.554 1.00 0.00 O ATOM 1284 CB LEU A 85 -2.166 5.279 -5.975 1.00 0.00 C ATOM 1285 CG LEU A 85 -3.412 4.689 -5.315 1.00 0.00 C ATOM 1286 CD1 LEU A 85 -3.103 4.247 -3.892 1.00 0.00 C ATOM 1287 CD2 LEU A 85 -4.551 5.698 -5.326 1.00 0.00 C ATOM 0 H LEU A 85 -1.350 3.445 -7.420 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.212 5.560 -7.831 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -1.304 4.680 -5.679 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.009 6.282 -5.578 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.723 3.815 -5.887 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -4.001 3.830 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -2.319 3.490 -3.908 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -2.767 5.105 -3.309 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.430 5.260 -4.852 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -4.251 6.592 -4.779 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.790 5.966 -6.355 1.00 0.00 H new ATOM 1299 N GLN A 86 -0.004 6.389 -7.723 1.00 0.00 N ATOM 1300 CA GLN A 86 0.950 7.415 -8.125 1.00 0.00 C ATOM 1301 C GLN A 86 0.962 7.585 -9.640 1.00 0.00 C ATOM 1302 O GLN A 86 0.952 8.705 -10.149 1.00 0.00 O ATOM 1303 CB GLN A 86 2.353 7.058 -7.628 1.00 0.00 C ATOM 1304 CG GLN A 86 2.873 5.737 -8.169 1.00 0.00 C ATOM 1305 CD GLN A 86 3.953 5.132 -7.295 1.00 0.00 C ATOM 1306 OE1 GLN A 86 3.956 3.927 -7.037 1.00 0.00 O ATOM 1307 NE2 GLN A 86 4.877 5.966 -6.834 1.00 0.00 N ATOM 0 H GLN A 86 0.412 5.590 -7.244 1.00 0.00 H new ATOM 0 HA GLN A 86 0.641 8.359 -7.675 1.00 0.00 H new ATOM 0 HB2 GLN A 86 3.043 7.853 -7.911 1.00 0.00 H new ATOM 0 HB3 GLN A 86 2.344 7.016 -6.539 1.00 0.00 H new ATOM 0 HG2 GLN A 86 2.045 5.033 -8.256 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.268 5.890 -9.173 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.835 6.957 -7.073 1.00 0.00 H new ATOM 0 HE22 GLN A 86 5.629 5.616 -6.240 1.00 0.00 H new ATOM 1316 N ALA A 87 0.985 6.465 -10.355 1.00 0.00 N ATOM 1317 CA ALA A 87 0.997 6.490 -11.813 1.00 0.00 C ATOM 1318 C ALA A 87 -0.062 7.445 -12.355 1.00 0.00 C ATOM 1319 O ALA A 87 0.085 7.994 -13.446 1.00 0.00 O ATOM 1320 CB ALA A 87 0.781 5.089 -12.367 1.00 0.00 C ATOM 0 H ALA A 87 0.996 5.529 -9.949 1.00 0.00 H new ATOM 0 HA ALA A 87 1.973 6.850 -12.137 1.00 0.00 H new ATOM 0 HB1 ALA A 87 0.792 5.123 -13.456 1.00 0.00 H new ATOM 0 HB2 ALA A 87 1.577 4.432 -12.016 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -0.181 4.707 -12.026 1.00 0.00 H new ATOM 1326 N GLU A 88 -1.129 7.635 -11.585 1.00 0.00 N ATOM 1327 CA GLU A 88 -2.213 8.522 -11.990 1.00 0.00 C ATOM 1328 C GLU A 88 -1.900 9.969 -11.619 1.00 0.00 C ATOM 1329 O GLU A 88 -1.597 10.790 -12.484 1.00 0.00 O ATOM 1330 CB GLU A 88 -3.527 8.090 -11.336 1.00 0.00 C ATOM 1331 CG GLU A 88 -3.969 6.689 -11.725 1.00 0.00 C ATOM 1332 CD GLU A 88 -4.729 6.660 -13.037 1.00 0.00 C ATOM 1333 OE1 GLU A 88 -5.339 7.691 -13.392 1.00 0.00 O ATOM 1334 OE2 GLU A 88 -4.713 5.607 -13.708 1.00 0.00 O ATOM 0 H GLU A 88 -1.266 7.187 -10.679 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.315 8.456 -13.073 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.417 8.140 -10.253 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.309 8.798 -11.610 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -3.094 6.044 -11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -4.599 6.278 -10.936 1.00 0.00 H new ATOM 1341 N GLN A 89 -1.974 10.272 -10.327 1.00 0.00 N ATOM 1342 CA GLN A 89 -1.699 11.619 -9.842 1.00 0.00 C ATOM 1343 C GLN A 89 -0.424 12.174 -10.468 1.00 0.00 C ATOM 1344 O GLN A 89 -0.240 13.388 -10.551 1.00 0.00 O ATOM 1345 CB GLN A 89 -1.575 11.620 -8.318 1.00 0.00 C ATOM 1346 CG GLN A 89 -0.825 10.417 -7.768 1.00 0.00 C ATOM 1347 CD GLN A 89 -0.275 10.659 -6.376 1.00 0.00 C ATOM 1348 OE1 GLN A 89 -1.028 10.860 -5.424 1.00 0.00 O ATOM 1349 NE2 GLN A 89 1.048 10.639 -6.251 1.00 0.00 N ATOM 0 H GLN A 89 -2.222 9.603 -9.598 1.00 0.00 H new ATOM 0 HA GLN A 89 -2.532 12.259 -10.132 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -1.065 12.531 -8.004 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -2.573 11.647 -7.881 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -1.493 9.556 -7.746 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -0.004 10.167 -8.440 1.00 0.00 H new ATOM 0 HE21 GLN A 89 1.635 10.468 -7.068 1.00 0.00 H new ATOM 0 HE22 GLN A 89 1.476 10.794 -5.338 1.00 0.00 H new ATOM 1358 N GLU A 90 0.453 11.277 -10.907 1.00 0.00 N ATOM 1359 CA GLU A 90 1.711 11.678 -11.525 1.00 0.00 C ATOM 1360 C GLU A 90 1.559 11.804 -13.038 1.00 0.00 C ATOM 1361 O GLU A 90 2.196 12.647 -13.668 1.00 0.00 O ATOM 1362 CB GLU A 90 2.812 10.668 -11.193 1.00 0.00 C ATOM 1363 CG GLU A 90 2.942 10.373 -9.709 1.00 0.00 C ATOM 1364 CD GLU A 90 3.877 11.336 -9.003 1.00 0.00 C ATOM 1365 OE1 GLU A 90 3.840 12.542 -9.324 1.00 0.00 O ATOM 1366 OE2 GLU A 90 4.646 10.883 -8.129 1.00 0.00 O ATOM 0 H GLU A 90 0.315 10.268 -10.846 1.00 0.00 H new ATOM 0 HA GLU A 90 1.989 12.653 -11.124 1.00 0.00 H new ATOM 0 HB2 GLU A 90 2.611 9.737 -11.723 1.00 0.00 H new ATOM 0 HB3 GLU A 90 3.764 11.047 -11.564 1.00 0.00 H new ATOM 0 HG2 GLU A 90 1.957 10.423 -9.245 1.00 0.00 H new ATOM 0 HG3 GLU A 90 3.307 9.355 -9.575 1.00 0.00 H new ATOM 1373 N ASP A 91 0.711 10.958 -13.613 1.00 0.00 N ATOM 1374 CA ASP A 91 0.474 10.974 -15.052 1.00 0.00 C ATOM 1375 C ASP A 91 0.325 12.404 -15.563 1.00 0.00 C ATOM 1376 O ASP A 91 0.780 12.733 -16.657 1.00 0.00 O ATOM 1377 CB ASP A 91 -0.778 10.165 -15.393 1.00 0.00 C ATOM 1378 CG ASP A 91 -1.358 10.537 -16.743 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -0.592 11.007 -17.610 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -2.579 10.359 -16.934 1.00 0.00 O ATOM 0 H ASP A 91 0.177 10.253 -13.105 1.00 0.00 H new ATOM 0 HA ASP A 91 1.335 10.520 -15.542 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -0.534 9.103 -15.386 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -1.531 10.324 -14.621 1.00 0.00 H new ATOM 1385 N ARG A 92 -0.316 13.250 -14.762 1.00 0.00 N ATOM 1386 CA ARG A 92 -0.526 14.643 -15.133 1.00 0.00 C ATOM 1387 C ARG A 92 0.799 15.397 -15.190 1.00 0.00 C ATOM 1388 O ARG A 92 1.173 15.938 -16.230 1.00 0.00 O ATOM 1389 CB ARG A 92 -1.469 15.322 -14.137 1.00 0.00 C ATOM 1390 CG ARG A 92 -2.452 14.366 -13.482 1.00 0.00 C ATOM 1391 CD ARG A 92 -3.762 15.061 -13.143 1.00 0.00 C ATOM 1392 NE ARG A 92 -3.556 16.238 -12.302 1.00 0.00 N ATOM 1393 CZ ARG A 92 -3.330 16.177 -10.995 1.00 0.00 C ATOM 1394 NH1 ARG A 92 -3.281 15.002 -10.382 1.00 0.00 N ATOM 1395 NH2 ARG A 92 -3.152 17.291 -10.298 1.00 0.00 N ATOM 0 H ARG A 92 -0.699 12.994 -13.852 1.00 0.00 H new ATOM 0 HA ARG A 92 -0.979 14.664 -16.124 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -0.877 15.808 -13.362 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.025 16.105 -14.652 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.646 13.527 -14.150 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -2.011 13.955 -12.574 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.264 15.357 -14.064 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.422 14.361 -12.631 1.00 0.00 H new ATOM 0 HE ARG A 92 -3.588 17.157 -12.743 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -3.417 14.143 -10.915 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -3.107 14.957 -9.378 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -3.189 18.197 -10.766 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -2.979 17.242 -9.294 1.00 0.00 H new ATOM 1409 N ALA A 93 1.505 15.428 -14.065 1.00 0.00 N ATOM 1410 CA ALA A 93 2.789 16.114 -13.987 1.00 0.00 C ATOM 1411 C ALA A 93 3.743 15.619 -15.070 1.00 0.00 C ATOM 1412 O ALA A 93 4.682 16.318 -15.451 1.00 0.00 O ATOM 1413 CB ALA A 93 3.407 15.924 -12.610 1.00 0.00 C ATOM 0 H ALA A 93 1.210 14.986 -13.195 1.00 0.00 H new ATOM 0 HA ALA A 93 2.615 17.177 -14.151 1.00 0.00 H new ATOM 0 HB1 ALA A 93 4.365 16.442 -12.567 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.739 16.333 -11.852 1.00 0.00 H new ATOM 0 HB3 ALA A 93 3.560 14.861 -12.423 1.00 0.00 H new ATOM 1419 N LEU A 94 3.496 14.408 -15.559 1.00 0.00 N ATOM 1420 CA LEU A 94 4.333 13.819 -16.598 1.00 0.00 C ATOM 1421 C LEU A 94 4.012 14.419 -17.964 1.00 0.00 C ATOM 1422 O LEU A 94 4.907 14.859 -18.684 1.00 0.00 O ATOM 1423 CB LEU A 94 4.139 12.302 -16.637 1.00 0.00 C ATOM 1424 CG LEU A 94 5.197 11.510 -17.408 1.00 0.00 C ATOM 1425 CD1 LEU A 94 5.269 10.079 -16.896 1.00 0.00 C ATOM 1426 CD2 LEU A 94 4.897 11.530 -18.899 1.00 0.00 C ATOM 0 H LEU A 94 2.724 13.816 -15.253 1.00 0.00 H new ATOM 0 HA LEU A 94 5.373 14.041 -16.360 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.113 11.933 -15.612 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.164 12.092 -17.077 1.00 0.00 H new ATOM 0 HG LEU A 94 6.166 11.982 -17.247 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.026 9.530 -17.455 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.532 10.084 -15.838 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.300 9.596 -17.027 1.00 0.00 H new ATOM 0 HD21 LEU A 94 5.660 10.962 -19.431 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.919 11.083 -19.079 1.00 0.00 H new ATOM 0 HD23 LEU A 94 4.896 12.560 -19.256 1.00 0.00 H new ATOM 1438 N ARG A 95 2.729 14.435 -18.309 1.00 0.00 N ATOM 1439 CA ARG A 95 2.290 14.983 -19.587 1.00 0.00 C ATOM 1440 C ARG A 95 2.541 16.487 -19.650 1.00 0.00 C ATOM 1441 O ARG A 95 2.720 17.052 -20.728 1.00 0.00 O ATOM 1442 CB ARG A 95 0.803 14.695 -19.806 1.00 0.00 C ATOM 1443 CG ARG A 95 -0.091 15.241 -18.705 1.00 0.00 C ATOM 1444 CD ARG A 95 -1.563 15.058 -19.042 1.00 0.00 C ATOM 1445 NE ARG A 95 -2.426 15.867 -18.184 1.00 0.00 N ATOM 1446 CZ ARG A 95 -3.752 15.801 -18.205 1.00 0.00 C ATOM 1447 NH1 ARG A 95 -4.366 14.968 -19.035 1.00 0.00 N ATOM 1448 NH2 ARG A 95 -4.468 16.569 -17.394 1.00 0.00 N ATOM 0 H ARG A 95 1.976 14.075 -17.722 1.00 0.00 H new ATOM 0 HA ARG A 95 2.867 14.502 -20.377 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.495 15.125 -20.759 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.657 13.617 -19.880 1.00 0.00 H new ATOM 0 HG2 ARG A 95 0.134 14.734 -17.767 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.120 16.300 -18.554 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.732 15.328 -20.084 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -1.831 14.007 -18.937 1.00 0.00 H new ATOM 0 HE ARG A 95 -1.986 16.518 -17.534 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.819 14.375 -19.660 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.385 14.920 -19.048 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -4.000 17.211 -16.754 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -5.487 16.518 -17.411 1.00 0.00 H new ATOM 1462 N SER A 96 2.551 17.129 -18.485 1.00 0.00 N ATOM 1463 CA SER A 96 2.776 18.567 -18.408 1.00 0.00 C ATOM 1464 C SER A 96 4.235 18.873 -18.078 1.00 0.00 C ATOM 1465 O SER A 96 4.692 18.639 -16.960 1.00 0.00 O ATOM 1466 CB SER A 96 1.862 19.191 -17.352 1.00 0.00 C ATOM 1467 OG SER A 96 2.320 18.900 -16.043 1.00 0.00 O ATOM 0 H SER A 96 2.406 16.676 -17.583 1.00 0.00 H new ATOM 0 HA SER A 96 2.544 18.998 -19.382 1.00 0.00 H new ATOM 0 HB2 SER A 96 1.821 20.271 -17.494 1.00 0.00 H new ATOM 0 HB3 SER A 96 0.847 18.814 -17.477 1.00 0.00 H new ATOM 0 HG SER A 96 3.298 18.955 -16.019 1.00 0.00 H new ATOM 1473 N PHE A 97 4.959 19.396 -19.062 1.00 0.00 N ATOM 1474 CA PHE A 97 6.366 19.732 -18.878 1.00 0.00 C ATOM 1475 C PHE A 97 6.718 21.022 -19.614 1.00 0.00 C ATOM 1476 O PHE A 97 5.918 21.545 -20.391 1.00 0.00 O ATOM 1477 CB PHE A 97 7.255 18.590 -19.375 1.00 0.00 C ATOM 1478 CG PHE A 97 6.699 17.876 -20.575 1.00 0.00 C ATOM 1479 CD1 PHE A 97 6.320 18.584 -21.704 1.00 0.00 C ATOM 1480 CD2 PHE A 97 6.556 16.499 -20.572 1.00 0.00 C ATOM 1481 CE1 PHE A 97 5.808 17.929 -22.808 1.00 0.00 C ATOM 1482 CE2 PHE A 97 6.044 15.838 -21.674 1.00 0.00 C ATOM 1483 CZ PHE A 97 5.671 16.554 -22.793 1.00 0.00 C ATOM 0 H PHE A 97 4.595 19.596 -19.994 1.00 0.00 H new ATOM 0 HA PHE A 97 6.541 19.882 -17.813 1.00 0.00 H new ATOM 0 HB2 PHE A 97 8.239 18.988 -19.623 1.00 0.00 H new ATOM 0 HB3 PHE A 97 7.395 17.872 -18.567 1.00 0.00 H new ATOM 0 HD1 PHE A 97 6.426 19.659 -21.722 1.00 0.00 H new ATOM 0 HD2 PHE A 97 6.848 15.934 -19.699 1.00 0.00 H new ATOM 0 HE1 PHE A 97 5.515 18.492 -23.682 1.00 0.00 H new ATOM 0 HE2 PHE A 97 5.936 14.763 -21.659 1.00 0.00 H new ATOM 0 HZ PHE A 97 5.273 16.041 -23.656 1.00 0.00 H new ATOM 1493 N LYS A 98 7.919 21.531 -19.365 1.00 0.00 N ATOM 1494 CA LYS A 98 8.379 22.759 -20.001 1.00 0.00 C ATOM 1495 C LYS A 98 8.224 22.675 -21.517 1.00 0.00 C ATOM 1496 O LYS A 98 8.490 21.637 -22.122 1.00 0.00 O ATOM 1497 CB LYS A 98 9.842 23.027 -19.642 1.00 0.00 C ATOM 1498 CG LYS A 98 10.382 24.325 -20.219 1.00 0.00 C ATOM 1499 CD LYS A 98 11.819 24.570 -19.792 1.00 0.00 C ATOM 1500 CE LYS A 98 12.528 25.520 -20.744 1.00 0.00 C ATOM 1501 NZ LYS A 98 12.234 26.945 -20.428 1.00 0.00 N ATOM 0 H LYS A 98 8.593 21.111 -18.725 1.00 0.00 H new ATOM 0 HA LYS A 98 7.765 23.582 -19.634 1.00 0.00 H new ATOM 0 HB2 LYS A 98 9.942 23.052 -18.557 1.00 0.00 H new ATOM 0 HB3 LYS A 98 10.453 22.198 -20.000 1.00 0.00 H new ATOM 0 HG2 LYS A 98 10.325 24.292 -21.307 1.00 0.00 H new ATOM 0 HG3 LYS A 98 9.758 25.157 -19.893 1.00 0.00 H new ATOM 0 HD2 LYS A 98 11.835 24.984 -18.784 1.00 0.00 H new ATOM 0 HD3 LYS A 98 12.356 23.622 -19.755 1.00 0.00 H new ATOM 0 HE2 LYS A 98 13.604 25.351 -20.691 1.00 0.00 H new ATOM 0 HE3 LYS A 98 12.221 25.304 -21.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 12.736 27.560 -21.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 11.210 27.113 -20.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 12.550 27.158 -19.460 1.00 0.00 H new ATOM 1515 N SER A 99 7.793 23.777 -22.125 1.00 0.00 N ATOM 1516 CA SER A 99 7.600 23.827 -23.569 1.00 0.00 C ATOM 1517 C SER A 99 8.725 23.094 -24.293 1.00 0.00 C ATOM 1518 O SER A 99 9.899 23.429 -24.140 1.00 0.00 O ATOM 1519 CB SER A 99 7.533 25.279 -24.045 1.00 0.00 C ATOM 1520 OG SER A 99 7.558 25.354 -25.461 1.00 0.00 O ATOM 0 H SER A 99 7.571 24.646 -21.639 1.00 0.00 H new ATOM 0 HA SER A 99 6.658 23.331 -23.803 1.00 0.00 H new ATOM 0 HB2 SER A 99 6.623 25.747 -23.669 1.00 0.00 H new ATOM 0 HB3 SER A 99 8.373 25.839 -23.633 1.00 0.00 H new ATOM 0 HG SER A 99 7.513 26.292 -25.740 1.00 0.00 H new ATOM 1526 N GLY A 100 8.356 22.090 -25.083 1.00 0.00 N ATOM 1527 CA GLY A 100 9.346 21.325 -25.819 1.00 0.00 C ATOM 1528 C GLY A 100 9.233 21.522 -27.319 1.00 0.00 C ATOM 1529 O GLY A 100 8.620 20.724 -28.027 1.00 0.00 O ATOM 0 H GLY A 100 7.391 21.793 -25.226 1.00 0.00 H new ATOM 0 HA2 GLY A 100 10.344 21.617 -25.491 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.231 20.267 -25.585 1.00 0.00 H new ATOM 1533 N PRO A 101 9.836 22.608 -27.823 1.00 0.00 N ATOM 1534 CA PRO A 101 9.814 22.935 -29.251 1.00 0.00 C ATOM 1535 C PRO A 101 10.651 21.966 -30.080 1.00 0.00 C ATOM 1536 O PRO A 101 10.765 22.114 -31.297 1.00 0.00 O ATOM 1537 CB PRO A 101 10.415 24.342 -29.304 1.00 0.00 C ATOM 1538 CG PRO A 101 11.270 24.434 -28.087 1.00 0.00 C ATOM 1539 CD PRO A 101 10.586 23.604 -27.036 1.00 0.00 C ATOM 0 HA PRO A 101 8.809 22.871 -29.668 1.00 0.00 H new ATOM 0 HB2 PRO A 101 11.001 24.489 -30.211 1.00 0.00 H new ATOM 0 HB3 PRO A 101 9.637 25.105 -29.300 1.00 0.00 H new ATOM 0 HG2 PRO A 101 12.274 24.060 -28.287 1.00 0.00 H new ATOM 0 HG3 PRO A 101 11.374 25.469 -27.760 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.305 23.130 -26.368 1.00 0.00 H new ATOM 0 HD3 PRO A 101 9.924 24.207 -26.415 1.00 0.00 H new ATOM 1547 N SER A 102 11.233 20.975 -29.414 1.00 0.00 N ATOM 1548 CA SER A 102 12.063 19.983 -30.088 1.00 0.00 C ATOM 1549 C SER A 102 11.228 19.137 -31.044 1.00 0.00 C ATOM 1550 O SER A 102 10.000 19.231 -31.064 1.00 0.00 O ATOM 1551 CB SER A 102 12.755 19.083 -29.063 1.00 0.00 C ATOM 1552 OG SER A 102 11.868 18.090 -28.575 1.00 0.00 O ATOM 0 H SER A 102 11.145 20.837 -28.407 1.00 0.00 H new ATOM 0 HA SER A 102 12.821 20.512 -30.665 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.623 18.607 -29.519 1.00 0.00 H new ATOM 0 HB3 SER A 102 13.122 19.687 -28.233 1.00 0.00 H new ATOM 0 HG SER A 102 12.335 17.527 -27.923 1.00 0.00 H new ATOM 1558 N SER A 103 11.902 18.308 -31.835 1.00 0.00 N ATOM 1559 CA SER A 103 11.225 17.447 -32.797 1.00 0.00 C ATOM 1560 C SER A 103 10.421 16.364 -32.083 1.00 0.00 C ATOM 1561 O SER A 103 10.826 15.864 -31.036 1.00 0.00 O ATOM 1562 CB SER A 103 12.241 16.804 -33.742 1.00 0.00 C ATOM 1563 OG SER A 103 12.599 17.692 -34.787 1.00 0.00 O ATOM 0 H SER A 103 12.918 18.215 -31.828 1.00 0.00 H new ATOM 0 HA SER A 103 10.538 18.062 -33.378 1.00 0.00 H new ATOM 0 HB2 SER A 103 13.132 16.518 -33.183 1.00 0.00 H new ATOM 0 HB3 SER A 103 11.822 15.891 -34.164 1.00 0.00 H new ATOM 0 HG SER A 103 13.251 17.258 -35.376 1.00 0.00 H new ATOM 1569 N GLY A 104 9.278 16.008 -32.660 1.00 0.00 N ATOM 1570 CA GLY A 104 8.433 14.987 -32.067 1.00 0.00 C ATOM 1571 C GLY A 104 7.100 15.537 -31.600 1.00 0.00 C ATOM 1572 O GLY A 104 6.183 15.721 -32.398 1.00 0.00 O ATOM 0 H GLY A 104 8.921 16.408 -33.528 1.00 0.00 H new ATOM 0 HA2 GLY A 104 8.261 14.195 -32.795 1.00 0.00 H new ATOM 0 HA3 GLY A 104 8.953 14.536 -31.222 1.00 0.00 H new TER 1576 GLY A 104