USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 675 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 66 ASN : amide:sc= -1.03 K(o=-1.1,f=-1.8!) USER MOD Set 1.2: A 68 GLN : amide:sc= -0.114 X(o=-1.1,f=-1.6) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -0.0361 X(o=-0.036,f=0) USER MOD Single : A -1 SER OG : rot 39:sc= 1.07 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -153:sc= 0.232 (180deg=0.0272) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0336) USER MOD Single : A 38 SER OG : rot 180:sc= -0.393 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -74:sc= 0.616 USER MOD Single : A 54 LYS NZ :NH3+ -111:sc= -0.136 (180deg=-1.42) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot -170:sc= -1.64! USER MOD Single : A 65 GLN : amide:sc= -0.0442 X(o=-0.044,f=-0.43) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 30:sc= 0.341 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -20.414 -25.620 -31.466 1.00 0.00 N ATOM 2 CA GLY A -6 -20.061 -26.658 -30.515 1.00 0.00 C ATOM 3 C GLY A -6 -19.533 -27.908 -31.191 1.00 0.00 C ATOM 4 O GLY A -6 -20.275 -28.612 -31.875 1.00 0.00 O ATOM 0 H1 GLY A -6 -20.769 -24.787 -30.955 1.00 0.00 H new ATOM 0 H2 GLY A -6 -19.574 -25.355 -32.018 1.00 0.00 H new ATOM 0 H3 GLY A -6 -21.152 -25.973 -32.107 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -19.308 -26.275 -29.827 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -20.937 -26.913 -29.919 1.00 0.00 H new ATOM 8 N SER A -5 -18.247 -28.184 -31.000 1.00 0.00 N ATOM 9 CA SER A -5 -17.619 -29.355 -31.600 1.00 0.00 C ATOM 10 C SER A -5 -16.250 -29.617 -30.978 1.00 0.00 C ATOM 11 O SER A -5 -15.592 -28.698 -30.491 1.00 0.00 O ATOM 12 CB SER A -5 -17.476 -29.165 -33.112 1.00 0.00 C ATOM 13 OG SER A -5 -17.238 -30.402 -33.761 1.00 0.00 O ATOM 0 H SER A -5 -17.620 -27.612 -30.434 1.00 0.00 H new ATOM 0 HA SER A -5 -18.257 -30.217 -31.407 1.00 0.00 H new ATOM 0 HB2 SER A -5 -18.382 -28.709 -33.512 1.00 0.00 H new ATOM 0 HB3 SER A -5 -16.655 -28.478 -33.319 1.00 0.00 H new ATOM 0 HG SER A -5 -17.152 -30.254 -34.726 1.00 0.00 H new ATOM 19 N SER A -4 -15.830 -30.878 -30.998 1.00 0.00 N ATOM 20 CA SER A -4 -14.542 -31.263 -30.433 1.00 0.00 C ATOM 21 C SER A -4 -13.426 -30.367 -30.963 1.00 0.00 C ATOM 22 O SER A -4 -13.052 -30.449 -32.132 1.00 0.00 O ATOM 23 CB SER A -4 -14.235 -32.726 -30.759 1.00 0.00 C ATOM 24 OG SER A -4 -13.401 -33.304 -29.771 1.00 0.00 O ATOM 0 H SER A -4 -16.363 -31.650 -31.399 1.00 0.00 H new ATOM 0 HA SER A -4 -14.598 -31.143 -29.351 1.00 0.00 H new ATOM 0 HB2 SER A -4 -15.166 -33.289 -30.829 1.00 0.00 H new ATOM 0 HB3 SER A -4 -13.749 -32.791 -31.733 1.00 0.00 H new ATOM 0 HG SER A -4 -13.221 -34.239 -30.001 1.00 0.00 H new ATOM 30 N GLY A -3 -12.899 -29.511 -30.093 1.00 0.00 N ATOM 31 CA GLY A -3 -11.832 -28.611 -30.491 1.00 0.00 C ATOM 32 C GLY A -3 -11.725 -27.401 -29.584 1.00 0.00 C ATOM 33 O GLY A -3 -12.574 -26.511 -29.623 1.00 0.00 O ATOM 0 H GLY A -3 -13.192 -29.425 -29.120 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -10.885 -29.150 -30.485 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -12.004 -28.279 -31.515 1.00 0.00 H new ATOM 37 N SER A -2 -10.680 -27.369 -28.763 1.00 0.00 N ATOM 38 CA SER A -2 -10.469 -26.262 -27.838 1.00 0.00 C ATOM 39 C SER A -2 -9.633 -25.164 -28.487 1.00 0.00 C ATOM 40 O SER A -2 -8.408 -25.261 -28.559 1.00 0.00 O ATOM 41 CB SER A -2 -9.780 -26.758 -26.565 1.00 0.00 C ATOM 42 OG SER A -2 -10.729 -27.200 -25.610 1.00 0.00 O ATOM 0 H SER A -2 -9.967 -28.097 -28.720 1.00 0.00 H new ATOM 0 HA SER A -2 -11.443 -25.847 -27.578 1.00 0.00 H new ATOM 0 HB2 SER A -2 -9.100 -27.573 -26.810 1.00 0.00 H new ATOM 0 HB3 SER A -2 -9.177 -25.957 -26.139 1.00 0.00 H new ATOM 0 HG SER A -2 -10.263 -27.513 -24.807 1.00 0.00 H new ATOM 48 N SER A -1 -10.305 -24.119 -28.960 1.00 0.00 N ATOM 49 CA SER A -1 -9.625 -23.003 -29.607 1.00 0.00 C ATOM 50 C SER A -1 -8.935 -22.115 -28.576 1.00 0.00 C ATOM 51 O SER A -1 -9.550 -21.217 -28.003 1.00 0.00 O ATOM 52 CB SER A -1 -10.621 -22.176 -30.424 1.00 0.00 C ATOM 53 OG SER A -1 -11.607 -21.595 -29.588 1.00 0.00 O ATOM 0 H SER A -1 -11.319 -24.022 -28.907 1.00 0.00 H new ATOM 0 HA SER A -1 -8.866 -23.410 -30.275 1.00 0.00 H new ATOM 0 HB2 SER A -1 -10.091 -21.392 -30.965 1.00 0.00 H new ATOM 0 HB3 SER A -1 -11.100 -22.810 -31.170 1.00 0.00 H new ATOM 0 HG SER A -1 -11.192 -21.293 -28.753 1.00 0.00 H new ATOM 59 N GLY A 1 -7.651 -22.373 -28.346 1.00 0.00 N ATOM 60 CA GLY A 1 -6.898 -21.590 -27.385 1.00 0.00 C ATOM 61 C GLY A 1 -5.425 -21.948 -27.373 1.00 0.00 C ATOM 62 O GLY A 1 -5.042 -23.099 -27.583 1.00 0.00 O ATOM 0 H GLY A 1 -7.119 -23.111 -28.808 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.009 -20.531 -27.617 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.314 -21.744 -26.389 1.00 0.00 H new ATOM 66 N PRO A 2 -4.570 -20.945 -27.123 1.00 0.00 N ATOM 67 CA PRO A 2 -3.117 -21.136 -27.080 1.00 0.00 C ATOM 68 C PRO A 2 -2.674 -21.945 -25.866 1.00 0.00 C ATOM 69 O PRO A 2 -3.367 -22.017 -24.851 1.00 0.00 O ATOM 70 CB PRO A 2 -2.574 -19.707 -26.996 1.00 0.00 C ATOM 71 CG PRO A 2 -3.679 -18.918 -26.382 1.00 0.00 C ATOM 72 CD PRO A 2 -4.956 -19.548 -26.863 1.00 0.00 C ATOM 0 HA PRO A 2 -2.754 -21.695 -27.942 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -1.670 -19.662 -26.388 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -2.314 -19.323 -27.983 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -3.618 -18.942 -25.294 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -3.624 -17.871 -26.681 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -5.744 -19.482 -26.113 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -5.331 -19.060 -27.763 1.00 0.00 H new ATOM 80 N PRO A 3 -1.492 -22.571 -25.970 1.00 0.00 N ATOM 81 CA PRO A 3 -0.930 -23.386 -24.890 1.00 0.00 C ATOM 82 C PRO A 3 -0.490 -22.544 -23.697 1.00 0.00 C ATOM 83 O PRO A 3 0.519 -21.842 -23.757 1.00 0.00 O ATOM 84 CB PRO A 3 0.279 -24.058 -25.545 1.00 0.00 C ATOM 85 CG PRO A 3 0.667 -23.143 -26.654 1.00 0.00 C ATOM 86 CD PRO A 3 -0.613 -22.529 -27.151 1.00 0.00 C ATOM 0 HA PRO A 3 -1.660 -24.089 -24.488 1.00 0.00 H new ATOM 0 HB2 PRO A 3 1.095 -24.185 -24.833 1.00 0.00 H new ATOM 0 HB3 PRO A 3 0.026 -25.049 -25.920 1.00 0.00 H new ATOM 0 HG2 PRO A 3 1.358 -22.376 -26.304 1.00 0.00 H new ATOM 0 HG3 PRO A 3 1.174 -23.688 -27.451 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -0.460 -21.508 -27.502 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -1.032 -23.093 -27.984 1.00 0.00 H new ATOM 94 N LYS A 4 -1.254 -22.619 -22.612 1.00 0.00 N ATOM 95 CA LYS A 4 -0.943 -21.865 -21.403 1.00 0.00 C ATOM 96 C LYS A 4 -0.034 -22.669 -20.480 1.00 0.00 C ATOM 97 O LYS A 4 -0.293 -23.840 -20.202 1.00 0.00 O ATOM 98 CB LYS A 4 -2.231 -21.488 -20.667 1.00 0.00 C ATOM 99 CG LYS A 4 -3.002 -20.360 -21.329 1.00 0.00 C ATOM 100 CD LYS A 4 -4.040 -19.767 -20.391 1.00 0.00 C ATOM 101 CE LYS A 4 -5.144 -19.056 -21.158 1.00 0.00 C ATOM 102 NZ LYS A 4 -6.003 -18.236 -20.260 1.00 0.00 N ATOM 0 H LYS A 4 -2.093 -23.195 -22.545 1.00 0.00 H new ATOM 0 HA LYS A 4 -0.420 -20.955 -21.696 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -2.873 -22.367 -20.602 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -1.984 -21.198 -19.646 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -2.308 -19.581 -21.645 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -3.493 -20.733 -22.228 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -4.473 -20.558 -19.779 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -3.558 -19.065 -19.711 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -4.702 -18.416 -21.922 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -5.759 -19.792 -21.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -6.743 -17.767 -20.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -6.445 -18.850 -19.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -5.421 -17.517 -19.785 1.00 0.00 H new ATOM 116 N PHE A 5 1.032 -22.033 -20.005 1.00 0.00 N ATOM 117 CA PHE A 5 1.979 -22.689 -19.112 1.00 0.00 C ATOM 118 C PHE A 5 1.965 -22.039 -17.731 1.00 0.00 C ATOM 119 O PHE A 5 1.335 -21.001 -17.529 1.00 0.00 O ATOM 120 CB PHE A 5 3.391 -22.632 -19.700 1.00 0.00 C ATOM 121 CG PHE A 5 3.511 -23.307 -21.037 1.00 0.00 C ATOM 122 CD1 PHE A 5 3.235 -24.658 -21.173 1.00 0.00 C ATOM 123 CD2 PHE A 5 3.898 -22.590 -22.157 1.00 0.00 C ATOM 124 CE1 PHE A 5 3.345 -25.281 -22.401 1.00 0.00 C ATOM 125 CE2 PHE A 5 4.010 -23.208 -23.389 1.00 0.00 C ATOM 126 CZ PHE A 5 3.732 -24.555 -23.511 1.00 0.00 C ATOM 0 H PHE A 5 1.261 -21.064 -20.224 1.00 0.00 H new ATOM 0 HA PHE A 5 1.678 -23.731 -19.007 1.00 0.00 H new ATOM 0 HB2 PHE A 5 3.693 -21.589 -19.800 1.00 0.00 H new ATOM 0 HB3 PHE A 5 4.086 -23.099 -19.002 1.00 0.00 H new ATOM 0 HD1 PHE A 5 2.930 -25.230 -20.309 1.00 0.00 H new ATOM 0 HD2 PHE A 5 4.115 -21.536 -22.067 1.00 0.00 H new ATOM 0 HE1 PHE A 5 3.129 -26.335 -22.493 1.00 0.00 H new ATOM 0 HE2 PHE A 5 4.314 -22.638 -24.254 1.00 0.00 H new ATOM 0 HZ PHE A 5 3.817 -25.040 -24.472 1.00 0.00 H new ATOM 136 N ASP A 6 2.663 -22.658 -16.786 1.00 0.00 N ATOM 137 CA ASP A 6 2.732 -22.141 -15.424 1.00 0.00 C ATOM 138 C ASP A 6 4.123 -21.593 -15.121 1.00 0.00 C ATOM 139 O ASP A 6 5.137 -22.116 -15.583 1.00 0.00 O ATOM 140 CB ASP A 6 2.372 -23.237 -14.420 1.00 0.00 C ATOM 141 CG ASP A 6 1.029 -23.875 -14.717 1.00 0.00 C ATOM 142 OD1 ASP A 6 0.003 -23.169 -14.628 1.00 0.00 O ATOM 143 OD2 ASP A 6 1.004 -25.082 -15.039 1.00 0.00 O ATOM 0 H ASP A 6 3.189 -23.519 -16.938 1.00 0.00 H new ATOM 0 HA ASP A 6 2.013 -21.327 -15.334 1.00 0.00 H new ATOM 0 HB2 ASP A 6 3.146 -24.004 -14.431 1.00 0.00 H new ATOM 0 HB3 ASP A 6 2.356 -22.815 -13.415 1.00 0.00 H new ATOM 148 N PRO A 7 4.174 -20.514 -14.325 1.00 0.00 N ATOM 149 CA PRO A 7 5.435 -19.871 -13.943 1.00 0.00 C ATOM 150 C PRO A 7 6.259 -20.732 -12.992 1.00 0.00 C ATOM 151 O PRO A 7 7.445 -20.966 -13.221 1.00 0.00 O ATOM 152 CB PRO A 7 4.981 -18.587 -13.244 1.00 0.00 C ATOM 153 CG PRO A 7 3.613 -18.894 -12.739 1.00 0.00 C ATOM 154 CD PRO A 7 3.005 -19.838 -13.738 1.00 0.00 C ATOM 0 HA PRO A 7 6.082 -19.698 -14.803 1.00 0.00 H new ATOM 0 HB2 PRO A 7 5.654 -18.321 -12.429 1.00 0.00 H new ATOM 0 HB3 PRO A 7 4.968 -17.744 -13.934 1.00 0.00 H new ATOM 0 HG2 PRO A 7 3.655 -19.348 -11.749 1.00 0.00 H new ATOM 0 HG3 PRO A 7 3.018 -17.986 -12.648 1.00 0.00 H new ATOM 0 HD2 PRO A 7 2.329 -20.547 -13.261 1.00 0.00 H new ATOM 0 HD3 PRO A 7 2.427 -19.306 -14.494 1.00 0.00 H new ATOM 162 N ASN A 8 5.622 -21.202 -11.924 1.00 0.00 N ATOM 163 CA ASN A 8 6.298 -22.037 -10.937 1.00 0.00 C ATOM 164 C ASN A 8 7.434 -21.274 -10.265 1.00 0.00 C ATOM 165 O ASN A 8 8.480 -21.844 -9.957 1.00 0.00 O ATOM 166 CB ASN A 8 6.841 -23.305 -11.599 1.00 0.00 C ATOM 167 CG ASN A 8 6.883 -24.483 -10.645 1.00 0.00 C ATOM 168 OD1 ASN A 8 7.956 -24.968 -10.285 1.00 0.00 O ATOM 169 ND2 ASN A 8 5.711 -24.949 -10.229 1.00 0.00 N ATOM 0 H ASN A 8 4.639 -21.019 -11.720 1.00 0.00 H new ATOM 0 HA ASN A 8 5.571 -22.316 -10.174 1.00 0.00 H new ATOM 0 HB2 ASN A 8 6.219 -23.558 -12.457 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.845 -23.112 -11.978 1.00 0.00 H new ATOM 0 HD21 ASN A 8 5.676 -25.740 -9.585 1.00 0.00 H new ATOM 0 HD22 ASN A 8 4.846 -24.516 -10.553 1.00 0.00 H new ATOM 176 N GLU A 9 7.221 -19.981 -10.040 1.00 0.00 N ATOM 177 CA GLU A 9 8.228 -19.140 -9.404 1.00 0.00 C ATOM 178 C GLU A 9 7.615 -17.828 -8.922 1.00 0.00 C ATOM 179 O GLU A 9 6.581 -17.391 -9.425 1.00 0.00 O ATOM 180 CB GLU A 9 9.373 -18.854 -10.377 1.00 0.00 C ATOM 181 CG GLU A 9 10.500 -18.037 -9.767 1.00 0.00 C ATOM 182 CD GLU A 9 11.840 -18.311 -10.422 1.00 0.00 C ATOM 183 OE1 GLU A 9 12.136 -19.493 -10.694 1.00 0.00 O ATOM 184 OE2 GLU A 9 12.593 -17.344 -10.662 1.00 0.00 O ATOM 0 H GLU A 9 6.360 -19.494 -10.289 1.00 0.00 H new ATOM 0 HA GLU A 9 8.620 -19.676 -8.540 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.776 -19.800 -10.739 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.978 -18.323 -11.243 1.00 0.00 H new ATOM 0 HG2 GLU A 9 10.265 -16.976 -9.858 1.00 0.00 H new ATOM 0 HG3 GLU A 9 10.569 -18.258 -8.702 1.00 0.00 H new ATOM 191 N VAL A 10 8.262 -17.205 -7.942 1.00 0.00 N ATOM 192 CA VAL A 10 7.783 -15.943 -7.391 1.00 0.00 C ATOM 193 C VAL A 10 7.772 -14.849 -8.453 1.00 0.00 C ATOM 194 O VAL A 10 8.675 -14.767 -9.286 1.00 0.00 O ATOM 195 CB VAL A 10 8.650 -15.483 -6.204 1.00 0.00 C ATOM 196 CG1 VAL A 10 8.074 -14.222 -5.579 1.00 0.00 C ATOM 197 CG2 VAL A 10 8.771 -16.593 -5.172 1.00 0.00 C ATOM 0 H VAL A 10 9.119 -17.554 -7.513 1.00 0.00 H new ATOM 0 HA VAL A 10 6.765 -16.116 -7.041 1.00 0.00 H new ATOM 0 HB VAL A 10 9.649 -15.252 -6.574 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.700 -13.912 -4.742 1.00 0.00 H new ATOM 0 HG12 VAL A 10 8.045 -13.427 -6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 10 7.064 -14.422 -5.222 1.00 0.00 H new ATOM 0 HG21 VAL A 10 9.387 -16.251 -4.340 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.780 -16.858 -4.805 1.00 0.00 H new ATOM 0 HG23 VAL A 10 9.233 -17.467 -5.630 1.00 0.00 H new ATOM 207 N LYS A 11 6.745 -14.007 -8.417 1.00 0.00 N ATOM 208 CA LYS A 11 6.615 -12.915 -9.374 1.00 0.00 C ATOM 209 C LYS A 11 6.257 -11.612 -8.668 1.00 0.00 C ATOM 210 O LYS A 11 5.399 -11.588 -7.785 1.00 0.00 O ATOM 211 CB LYS A 11 5.550 -13.250 -10.421 1.00 0.00 C ATOM 212 CG LYS A 11 5.322 -12.141 -11.433 1.00 0.00 C ATOM 213 CD LYS A 11 6.223 -12.299 -12.646 1.00 0.00 C ATOM 214 CE LYS A 11 7.539 -11.559 -12.462 1.00 0.00 C ATOM 215 NZ LYS A 11 7.462 -10.157 -12.959 1.00 0.00 N ATOM 0 H LYS A 11 5.989 -14.060 -7.734 1.00 0.00 H new ATOM 0 HA LYS A 11 7.576 -12.786 -9.871 1.00 0.00 H new ATOM 0 HB2 LYS A 11 5.844 -14.157 -10.949 1.00 0.00 H new ATOM 0 HB3 LYS A 11 4.610 -13.467 -9.914 1.00 0.00 H new ATOM 0 HG2 LYS A 11 4.279 -12.145 -11.750 1.00 0.00 H new ATOM 0 HG3 LYS A 11 5.508 -11.175 -10.964 1.00 0.00 H new ATOM 0 HD2 LYS A 11 6.420 -13.357 -12.819 1.00 0.00 H new ATOM 0 HD3 LYS A 11 5.712 -11.921 -13.532 1.00 0.00 H new ATOM 0 HE2 LYS A 11 7.809 -11.555 -11.406 1.00 0.00 H new ATOM 0 HE3 LYS A 11 8.331 -12.089 -12.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 8.409 -9.838 -13.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 6.819 -10.113 -13.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 7.104 -9.540 -12.203 1.00 0.00 H new ATOM 229 N VAL A 12 6.919 -10.529 -9.063 1.00 0.00 N ATOM 230 CA VAL A 12 6.668 -9.221 -8.469 1.00 0.00 C ATOM 231 C VAL A 12 6.075 -8.258 -9.491 1.00 0.00 C ATOM 232 O VAL A 12 6.512 -8.210 -10.641 1.00 0.00 O ATOM 233 CB VAL A 12 7.958 -8.609 -7.892 1.00 0.00 C ATOM 234 CG1 VAL A 12 7.677 -7.246 -7.280 1.00 0.00 C ATOM 235 CG2 VAL A 12 8.579 -9.545 -6.866 1.00 0.00 C ATOM 0 H VAL A 12 7.633 -10.532 -9.792 1.00 0.00 H new ATOM 0 HA VAL A 12 5.954 -9.373 -7.660 1.00 0.00 H new ATOM 0 HB VAL A 12 8.670 -8.474 -8.706 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.601 -6.830 -6.878 1.00 0.00 H new ATOM 0 HG12 VAL A 12 7.281 -6.578 -8.045 1.00 0.00 H new ATOM 0 HG13 VAL A 12 6.947 -7.351 -6.477 1.00 0.00 H new ATOM 0 HG21 VAL A 12 9.490 -9.097 -6.469 1.00 0.00 H new ATOM 0 HG22 VAL A 12 7.873 -9.714 -6.053 1.00 0.00 H new ATOM 0 HG23 VAL A 12 8.820 -10.496 -7.340 1.00 0.00 H new ATOM 245 N VAL A 13 5.077 -7.491 -9.064 1.00 0.00 N ATOM 246 CA VAL A 13 4.424 -6.527 -9.942 1.00 0.00 C ATOM 247 C VAL A 13 4.423 -5.133 -9.324 1.00 0.00 C ATOM 248 O VAL A 13 4.071 -4.961 -8.156 1.00 0.00 O ATOM 249 CB VAL A 13 2.972 -6.940 -10.249 1.00 0.00 C ATOM 250 CG1 VAL A 13 2.304 -5.915 -11.152 1.00 0.00 C ATOM 251 CG2 VAL A 13 2.935 -8.324 -10.881 1.00 0.00 C ATOM 0 H VAL A 13 4.703 -7.518 -8.115 1.00 0.00 H new ATOM 0 HA VAL A 13 4.994 -6.510 -10.871 1.00 0.00 H new ATOM 0 HB VAL A 13 2.417 -6.978 -9.311 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.279 -6.224 -11.358 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.298 -4.944 -10.657 1.00 0.00 H new ATOM 0 HG13 VAL A 13 2.856 -5.841 -12.089 1.00 0.00 H new ATOM 0 HG21 VAL A 13 1.902 -8.600 -11.091 1.00 0.00 H new ATOM 0 HG22 VAL A 13 3.505 -8.315 -11.810 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.372 -9.049 -10.195 1.00 0.00 H new ATOM 261 N TYR A 14 4.819 -4.141 -10.114 1.00 0.00 N ATOM 262 CA TYR A 14 4.867 -2.762 -9.643 1.00 0.00 C ATOM 263 C TYR A 14 3.757 -1.931 -10.280 1.00 0.00 C ATOM 264 O TYR A 14 3.425 -2.111 -11.453 1.00 0.00 O ATOM 265 CB TYR A 14 6.229 -2.141 -9.958 1.00 0.00 C ATOM 266 CG TYR A 14 7.390 -2.880 -9.333 1.00 0.00 C ATOM 267 CD1 TYR A 14 7.651 -4.206 -9.657 1.00 0.00 C ATOM 268 CD2 TYR A 14 8.227 -2.253 -8.417 1.00 0.00 C ATOM 269 CE1 TYR A 14 8.710 -4.885 -9.088 1.00 0.00 C ATOM 270 CE2 TYR A 14 9.289 -2.925 -7.844 1.00 0.00 C ATOM 271 CZ TYR A 14 9.527 -4.241 -8.183 1.00 0.00 C ATOM 272 OH TYR A 14 10.584 -4.913 -7.614 1.00 0.00 O ATOM 0 H TYR A 14 5.111 -4.266 -11.083 1.00 0.00 H new ATOM 0 HA TYR A 14 4.719 -2.767 -8.563 1.00 0.00 H new ATOM 0 HB2 TYR A 14 6.366 -2.115 -11.039 1.00 0.00 H new ATOM 0 HB3 TYR A 14 6.237 -1.108 -9.610 1.00 0.00 H new ATOM 0 HD1 TYR A 14 7.014 -4.714 -10.366 1.00 0.00 H new ATOM 0 HD2 TYR A 14 8.044 -1.223 -8.149 1.00 0.00 H new ATOM 0 HE1 TYR A 14 8.898 -5.916 -9.351 1.00 0.00 H new ATOM 0 HE2 TYR A 14 9.930 -2.423 -7.134 1.00 0.00 H new ATOM 0 HH TYR A 14 11.059 -4.315 -7.000 1.00 0.00 H new ATOM 282 N LEU A 15 3.187 -1.020 -9.499 1.00 0.00 N ATOM 283 CA LEU A 15 2.114 -0.159 -9.985 1.00 0.00 C ATOM 284 C LEU A 15 2.343 1.288 -9.560 1.00 0.00 C ATOM 285 O LEU A 15 3.100 1.559 -8.628 1.00 0.00 O ATOM 286 CB LEU A 15 0.763 -0.650 -9.461 1.00 0.00 C ATOM 287 CG LEU A 15 0.185 -1.886 -10.150 1.00 0.00 C ATOM 288 CD1 LEU A 15 0.048 -1.648 -11.646 1.00 0.00 C ATOM 289 CD2 LEU A 15 1.056 -3.104 -9.879 1.00 0.00 C ATOM 0 H LEU A 15 3.450 -0.858 -8.527 1.00 0.00 H new ATOM 0 HA LEU A 15 2.111 -0.202 -11.074 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.865 -0.866 -8.398 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.043 0.163 -9.553 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.807 -2.076 -9.741 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.365 -2.539 -12.120 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.617 -0.802 -11.820 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.028 -1.432 -12.071 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.629 -3.975 -10.377 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.061 -2.924 -10.260 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.102 -3.287 -8.805 1.00 0.00 H new ATOM 301 N ARG A 16 1.681 2.213 -10.248 1.00 0.00 N ATOM 302 CA ARG A 16 1.811 3.632 -9.941 1.00 0.00 C ATOM 303 C ARG A 16 0.503 4.190 -9.387 1.00 0.00 C ATOM 304 O ARG A 16 -0.551 4.063 -10.011 1.00 0.00 O ATOM 305 CB ARG A 16 2.222 4.411 -11.192 1.00 0.00 C ATOM 306 CG ARG A 16 1.314 4.167 -12.386 1.00 0.00 C ATOM 307 CD ARG A 16 1.802 2.999 -13.228 1.00 0.00 C ATOM 308 NE ARG A 16 1.452 3.156 -14.637 1.00 0.00 N ATOM 309 CZ ARG A 16 1.705 2.239 -15.564 1.00 0.00 C ATOM 310 NH1 ARG A 16 2.306 1.104 -15.232 1.00 0.00 N ATOM 311 NH2 ARG A 16 1.356 2.455 -16.826 1.00 0.00 N ATOM 0 H ARG A 16 1.049 2.005 -11.021 1.00 0.00 H new ATOM 0 HA ARG A 16 2.585 3.745 -9.181 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.227 5.476 -10.961 1.00 0.00 H new ATOM 0 HB3 ARG A 16 3.243 4.139 -11.461 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.300 3.968 -12.039 1.00 0.00 H new ATOM 0 HG3 ARG A 16 1.270 5.066 -13.000 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.884 2.909 -13.131 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.370 2.073 -12.848 1.00 0.00 H new ATOM 0 HE ARG A 16 0.988 4.017 -14.925 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.575 0.934 -14.263 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.499 0.401 -15.946 1.00 0.00 H new ATOM 0 HH21 ARG A 16 0.893 3.326 -17.085 1.00 0.00 H new ATOM 0 HH22 ARG A 16 1.551 1.750 -17.537 1.00 0.00 H new ATOM 325 N CYS A 17 0.579 4.808 -8.214 1.00 0.00 N ATOM 326 CA CYS A 17 -0.598 5.385 -7.575 1.00 0.00 C ATOM 327 C CYS A 17 -0.198 6.428 -6.537 1.00 0.00 C ATOM 328 O CYS A 17 0.974 6.544 -6.177 1.00 0.00 O ATOM 329 CB CYS A 17 -1.437 4.288 -6.918 1.00 0.00 C ATOM 330 SG CYS A 17 -0.554 3.341 -5.656 1.00 0.00 S ATOM 0 H CYS A 17 1.444 4.922 -7.686 1.00 0.00 H new ATOM 0 HA CYS A 17 -1.194 5.876 -8.344 1.00 0.00 H new ATOM 0 HB2 CYS A 17 -2.319 4.741 -6.466 1.00 0.00 H new ATOM 0 HB3 CYS A 17 -1.790 3.604 -7.690 1.00 0.00 H new ATOM 0 HG CYS A 17 -1.346 2.439 -5.157 1.00 0.00 H new ATOM 336 N THR A 18 -1.180 7.186 -6.058 1.00 0.00 N ATOM 337 CA THR A 18 -0.930 8.221 -5.063 1.00 0.00 C ATOM 338 C THR A 18 -1.279 7.733 -3.662 1.00 0.00 C ATOM 339 O THR A 18 -2.316 7.105 -3.454 1.00 0.00 O ATOM 340 CB THR A 18 -1.737 9.498 -5.366 1.00 0.00 C ATOM 341 OG1 THR A 18 -1.410 9.986 -6.671 1.00 0.00 O ATOM 342 CG2 THR A 18 -1.454 10.575 -4.330 1.00 0.00 C ATOM 0 H THR A 18 -2.156 7.102 -6.343 1.00 0.00 H new ATOM 0 HA THR A 18 0.134 8.453 -5.109 1.00 0.00 H new ATOM 0 HB THR A 18 -2.797 9.249 -5.328 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.928 10.797 -6.856 1.00 0.00 H new ATOM 0 HG21 THR A 18 -2.035 11.467 -4.565 1.00 0.00 H new ATOM 0 HG22 THR A 18 -1.732 10.211 -3.341 1.00 0.00 H new ATOM 0 HG23 THR A 18 -0.392 10.820 -4.341 1.00 0.00 H new ATOM 350 N GLY A 19 -0.406 8.026 -2.703 1.00 0.00 N ATOM 351 CA GLY A 19 -0.641 7.609 -1.333 1.00 0.00 C ATOM 352 C GLY A 19 -1.908 8.206 -0.755 1.00 0.00 C ATOM 353 O GLY A 19 -2.344 9.278 -1.172 1.00 0.00 O ATOM 0 H GLY A 19 0.460 8.545 -2.850 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -0.704 6.522 -1.293 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.209 7.902 -0.716 1.00 0.00 H new ATOM 357 N GLY A 20 -2.503 7.509 0.208 1.00 0.00 N ATOM 358 CA GLY A 20 -3.724 7.991 0.828 1.00 0.00 C ATOM 359 C GLY A 20 -4.788 8.351 -0.190 1.00 0.00 C ATOM 360 O GLY A 20 -5.531 9.315 -0.006 1.00 0.00 O ATOM 0 H GLY A 20 -2.161 6.619 0.570 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.113 7.226 1.500 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -3.498 8.866 1.437 1.00 0.00 H new ATOM 364 N GLU A 21 -4.860 7.576 -1.268 1.00 0.00 N ATOM 365 CA GLU A 21 -5.839 7.821 -2.320 1.00 0.00 C ATOM 366 C GLU A 21 -6.418 6.509 -2.841 1.00 0.00 C ATOM 367 O GLU A 21 -5.762 5.468 -2.800 1.00 0.00 O ATOM 368 CB GLU A 21 -5.200 8.602 -3.471 1.00 0.00 C ATOM 369 CG GLU A 21 -4.963 10.068 -3.154 1.00 0.00 C ATOM 370 CD GLU A 21 -6.201 10.918 -3.362 1.00 0.00 C ATOM 371 OE1 GLU A 21 -6.913 10.693 -4.363 1.00 0.00 O ATOM 372 OE2 GLU A 21 -6.458 11.808 -2.525 1.00 0.00 O ATOM 0 H GLU A 21 -4.252 6.774 -1.435 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.650 8.413 -1.895 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.249 8.137 -3.731 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.841 8.528 -4.349 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.631 10.163 -2.120 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -4.157 10.446 -3.783 1.00 0.00 H new ATOM 379 N VAL A 22 -7.653 6.566 -3.329 1.00 0.00 N ATOM 380 CA VAL A 22 -8.322 5.384 -3.859 1.00 0.00 C ATOM 381 C VAL A 22 -8.129 5.272 -5.367 1.00 0.00 C ATOM 382 O VAL A 22 -8.235 6.260 -6.092 1.00 0.00 O ATOM 383 CB VAL A 22 -9.829 5.404 -3.545 1.00 0.00 C ATOM 384 CG1 VAL A 22 -10.518 4.192 -4.155 1.00 0.00 C ATOM 385 CG2 VAL A 22 -10.060 5.458 -2.042 1.00 0.00 C ATOM 0 H VAL A 22 -8.211 7.419 -3.368 1.00 0.00 H new ATOM 0 HA VAL A 22 -7.869 4.520 -3.373 1.00 0.00 H new ATOM 0 HB VAL A 22 -10.263 6.300 -3.989 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -11.582 4.223 -3.923 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -10.382 4.202 -5.236 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.083 3.281 -3.743 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -11.131 5.472 -1.839 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -9.613 4.581 -1.573 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.602 6.360 -1.636 1.00 0.00 H new ATOM 395 N GLY A 23 -7.844 4.060 -5.834 1.00 0.00 N ATOM 396 CA GLY A 23 -7.641 3.841 -7.254 1.00 0.00 C ATOM 397 C GLY A 23 -8.862 4.202 -8.076 1.00 0.00 C ATOM 398 O GLY A 23 -9.730 4.945 -7.619 1.00 0.00 O ATOM 0 H GLY A 23 -7.750 3.226 -5.254 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -6.791 4.434 -7.592 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.388 2.795 -7.425 1.00 0.00 H new ATOM 402 N ALA A 24 -8.930 3.675 -9.295 1.00 0.00 N ATOM 403 CA ALA A 24 -10.053 3.946 -10.183 1.00 0.00 C ATOM 404 C ALA A 24 -11.273 3.116 -9.794 1.00 0.00 C ATOM 405 O ALA A 24 -11.179 2.200 -8.977 1.00 0.00 O ATOM 406 CB ALA A 24 -9.663 3.669 -11.627 1.00 0.00 C ATOM 0 H ALA A 24 -8.220 3.058 -9.689 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.316 4.999 -10.085 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -10.512 3.876 -12.279 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -8.826 4.309 -11.907 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -9.372 2.624 -11.731 1.00 0.00 H new ATOM 412 N THR A 25 -12.418 3.444 -10.385 1.00 0.00 N ATOM 413 CA THR A 25 -13.656 2.730 -10.099 1.00 0.00 C ATOM 414 C THR A 25 -13.566 1.273 -10.538 1.00 0.00 C ATOM 415 O THR A 25 -13.649 0.968 -11.728 1.00 0.00 O ATOM 416 CB THR A 25 -14.860 3.391 -10.797 1.00 0.00 C ATOM 417 OG1 THR A 25 -14.926 4.779 -10.449 1.00 0.00 O ATOM 418 CG2 THR A 25 -16.158 2.702 -10.406 1.00 0.00 C ATOM 0 H THR A 25 -12.513 4.199 -11.064 1.00 0.00 H new ATOM 0 HA THR A 25 -13.802 2.772 -9.020 1.00 0.00 H new ATOM 0 HB THR A 25 -14.726 3.293 -11.874 1.00 0.00 H new ATOM 0 HG1 THR A 25 -15.693 5.193 -10.898 1.00 0.00 H new ATOM 0 HG21 THR A 25 -16.994 3.186 -10.911 1.00 0.00 H new ATOM 0 HG22 THR A 25 -16.116 1.653 -10.699 1.00 0.00 H new ATOM 0 HG23 THR A 25 -16.296 2.772 -9.327 1.00 0.00 H new ATOM 426 N SER A 26 -13.394 0.378 -9.571 1.00 0.00 N ATOM 427 CA SER A 26 -13.289 -1.048 -9.859 1.00 0.00 C ATOM 428 C SER A 26 -12.160 -1.320 -10.848 1.00 0.00 C ATOM 429 O SER A 26 -12.358 -1.983 -11.866 1.00 0.00 O ATOM 430 CB SER A 26 -14.612 -1.575 -10.420 1.00 0.00 C ATOM 431 OG SER A 26 -14.783 -2.949 -10.115 1.00 0.00 O ATOM 0 H SER A 26 -13.324 0.615 -8.581 1.00 0.00 H new ATOM 0 HA SER A 26 -13.065 -1.567 -8.927 1.00 0.00 H new ATOM 0 HB2 SER A 26 -15.441 -1.001 -10.006 1.00 0.00 H new ATOM 0 HB3 SER A 26 -14.635 -1.433 -11.501 1.00 0.00 H new ATOM 0 HG SER A 26 -15.636 -3.262 -10.483 1.00 0.00 H new ATOM 437 N ALA A 27 -10.975 -0.803 -10.540 1.00 0.00 N ATOM 438 CA ALA A 27 -9.813 -0.992 -11.399 1.00 0.00 C ATOM 439 C ALA A 27 -8.994 -2.201 -10.959 1.00 0.00 C ATOM 440 O ALA A 27 -8.322 -2.837 -11.771 1.00 0.00 O ATOM 441 CB ALA A 27 -8.949 0.261 -11.401 1.00 0.00 C ATOM 0 H ALA A 27 -10.795 -0.250 -9.702 1.00 0.00 H new ATOM 0 HA ALA A 27 -10.168 -1.177 -12.413 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.085 0.106 -12.047 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -9.532 1.104 -11.771 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -8.611 0.471 -10.386 1.00 0.00 H new ATOM 447 N LEU A 28 -9.055 -2.512 -9.669 1.00 0.00 N ATOM 448 CA LEU A 28 -8.319 -3.645 -9.119 1.00 0.00 C ATOM 449 C LEU A 28 -9.163 -4.915 -9.161 1.00 0.00 C ATOM 450 O LEU A 28 -8.635 -6.019 -9.287 1.00 0.00 O ATOM 451 CB LEU A 28 -7.889 -3.350 -7.681 1.00 0.00 C ATOM 452 CG LEU A 28 -7.005 -2.119 -7.483 1.00 0.00 C ATOM 453 CD1 LEU A 28 -6.933 -1.744 -6.011 1.00 0.00 C ATOM 454 CD2 LEU A 28 -5.611 -2.369 -8.040 1.00 0.00 C ATOM 0 H LEU A 28 -9.607 -1.995 -8.984 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.431 -3.802 -9.731 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.785 -3.230 -7.073 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.357 -4.220 -7.297 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.449 -1.286 -8.028 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.299 -0.865 -5.890 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.935 -1.522 -5.643 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.513 -2.575 -5.444 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.995 -1.482 -7.891 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.159 -3.216 -7.523 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.679 -2.588 -9.106 1.00 0.00 H new ATOM 466 N ALA A 29 -10.477 -4.749 -9.055 1.00 0.00 N ATOM 467 CA ALA A 29 -11.395 -5.881 -9.084 1.00 0.00 C ATOM 468 C ALA A 29 -11.019 -6.863 -10.188 1.00 0.00 C ATOM 469 O ALA A 29 -10.773 -8.044 -9.944 1.00 0.00 O ATOM 470 CB ALA A 29 -12.825 -5.396 -9.270 1.00 0.00 C ATOM 0 H ALA A 29 -10.930 -3.841 -8.948 1.00 0.00 H new ATOM 0 HA ALA A 29 -11.322 -6.402 -8.129 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -13.500 -6.252 -9.290 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -13.097 -4.739 -8.444 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -12.905 -4.849 -10.210 1.00 0.00 H new ATOM 476 N PRO A 30 -10.975 -6.366 -11.433 1.00 0.00 N ATOM 477 CA PRO A 30 -10.630 -7.184 -12.600 1.00 0.00 C ATOM 478 C PRO A 30 -9.162 -7.596 -12.607 1.00 0.00 C ATOM 479 O PRO A 30 -8.785 -8.581 -13.241 1.00 0.00 O ATOM 480 CB PRO A 30 -10.932 -6.260 -13.783 1.00 0.00 C ATOM 481 CG PRO A 30 -10.804 -4.883 -13.229 1.00 0.00 C ATOM 482 CD PRO A 30 -11.257 -4.968 -11.798 1.00 0.00 C ATOM 0 HA PRO A 30 -11.187 -8.121 -12.620 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -10.232 -6.424 -14.602 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -11.932 -6.437 -14.178 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -9.774 -4.531 -13.292 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -11.417 -4.178 -13.791 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -10.713 -4.269 -11.162 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -12.316 -4.732 -11.697 1.00 0.00 H new ATOM 490 N LYS A 31 -8.336 -6.835 -11.896 1.00 0.00 N ATOM 491 CA LYS A 31 -6.908 -7.120 -11.818 1.00 0.00 C ATOM 492 C LYS A 31 -6.645 -8.337 -10.937 1.00 0.00 C ATOM 493 O LYS A 31 -5.862 -9.217 -11.296 1.00 0.00 O ATOM 494 CB LYS A 31 -6.154 -5.907 -11.270 1.00 0.00 C ATOM 495 CG LYS A 31 -6.181 -4.704 -12.198 1.00 0.00 C ATOM 496 CD LYS A 31 -5.103 -4.798 -13.264 1.00 0.00 C ATOM 497 CE LYS A 31 -5.423 -3.912 -14.459 1.00 0.00 C ATOM 498 NZ LYS A 31 -6.474 -4.511 -15.327 1.00 0.00 N ATOM 0 H LYS A 31 -8.632 -6.016 -11.365 1.00 0.00 H new ATOM 0 HA LYS A 31 -6.550 -7.337 -12.824 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -6.586 -5.625 -10.310 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -5.118 -6.188 -11.083 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -7.159 -4.632 -12.674 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.041 -3.792 -11.617 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.143 -4.505 -12.839 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.004 -5.833 -13.593 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -5.755 -2.935 -14.108 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.518 -3.750 -15.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.556 -3.959 -16.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.216 -5.492 -15.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.385 -4.502 -14.826 1.00 0.00 H new ATOM 512 N ILE A 32 -7.303 -8.381 -9.784 1.00 0.00 N ATOM 513 CA ILE A 32 -7.141 -9.491 -8.853 1.00 0.00 C ATOM 514 C ILE A 32 -8.136 -10.608 -9.151 1.00 0.00 C ATOM 515 O ILE A 32 -8.016 -11.715 -8.629 1.00 0.00 O ATOM 516 CB ILE A 32 -7.323 -9.033 -7.394 1.00 0.00 C ATOM 517 CG1 ILE A 32 -6.555 -7.733 -7.145 1.00 0.00 C ATOM 518 CG2 ILE A 32 -6.859 -10.121 -6.436 1.00 0.00 C ATOM 519 CD1 ILE A 32 -6.792 -7.146 -5.771 1.00 0.00 C ATOM 0 H ILE A 32 -7.954 -7.660 -9.472 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.126 -9.867 -8.984 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.382 -8.847 -7.216 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.489 -7.920 -7.273 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -6.843 -7.000 -7.899 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.994 -9.783 -5.409 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.446 -11.025 -6.600 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.805 -10.336 -6.612 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -6.217 -6.226 -5.664 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -7.853 -6.927 -5.647 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -6.478 -7.861 -5.011 1.00 0.00 H new ATOM 531 N GLY A 33 -9.117 -10.309 -9.997 1.00 0.00 N ATOM 532 CA GLY A 33 -10.117 -11.299 -10.352 1.00 0.00 C ATOM 533 C GLY A 33 -9.526 -12.683 -10.528 1.00 0.00 C ATOM 534 O GLY A 33 -9.886 -13.629 -9.826 1.00 0.00 O ATOM 0 H GLY A 33 -9.237 -9.399 -10.443 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.883 -11.330 -9.578 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.610 -10.998 -11.276 1.00 0.00 H new ATOM 538 N PRO A 34 -8.597 -12.817 -11.486 1.00 0.00 N ATOM 539 CA PRO A 34 -7.936 -14.094 -11.775 1.00 0.00 C ATOM 540 C PRO A 34 -6.988 -14.521 -10.659 1.00 0.00 C ATOM 541 O PRO A 34 -6.778 -15.713 -10.432 1.00 0.00 O ATOM 542 CB PRO A 34 -7.155 -13.806 -13.059 1.00 0.00 C ATOM 543 CG PRO A 34 -6.920 -12.335 -13.038 1.00 0.00 C ATOM 544 CD PRO A 34 -8.120 -11.733 -12.361 1.00 0.00 C ATOM 0 HA PRO A 34 -8.651 -14.911 -11.869 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.215 -14.357 -13.082 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -7.721 -14.104 -13.942 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.005 -12.094 -12.497 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -6.805 -11.944 -14.049 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -7.855 -10.843 -11.790 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -8.881 -11.434 -13.082 1.00 0.00 H new ATOM 552 N LEU A 35 -6.419 -13.541 -9.966 1.00 0.00 N ATOM 553 CA LEU A 35 -5.493 -13.817 -8.872 1.00 0.00 C ATOM 554 C LEU A 35 -6.176 -14.618 -7.769 1.00 0.00 C ATOM 555 O LEU A 35 -5.673 -15.655 -7.339 1.00 0.00 O ATOM 556 CB LEU A 35 -4.943 -12.508 -8.302 1.00 0.00 C ATOM 557 CG LEU A 35 -3.675 -11.968 -8.963 1.00 0.00 C ATOM 558 CD1 LEU A 35 -3.953 -11.568 -10.404 1.00 0.00 C ATOM 559 CD2 LEU A 35 -3.125 -10.787 -8.177 1.00 0.00 C ATOM 0 H LEU A 35 -6.582 -12.549 -10.141 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.668 -14.410 -9.267 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.720 -11.747 -8.378 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.742 -12.654 -7.241 1.00 0.00 H new ATOM 0 HG LEU A 35 -2.925 -12.759 -8.965 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -3.039 -11.186 -10.858 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -4.300 -12.437 -10.962 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -4.720 -10.794 -10.425 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -2.222 -10.416 -8.662 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.871 -9.993 -8.143 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -2.887 -11.105 -7.162 1.00 0.00 H new ATOM 571 N GLY A 36 -7.327 -14.131 -7.316 1.00 0.00 N ATOM 572 CA GLY A 36 -8.062 -14.816 -6.268 1.00 0.00 C ATOM 573 C GLY A 36 -8.419 -13.898 -5.116 1.00 0.00 C ATOM 574 O GLY A 36 -9.596 -13.709 -4.805 1.00 0.00 O ATOM 0 H GLY A 36 -7.764 -13.274 -7.656 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.974 -15.241 -6.686 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.465 -15.648 -5.894 1.00 0.00 H new ATOM 578 N LEU A 37 -7.403 -13.327 -4.480 1.00 0.00 N ATOM 579 CA LEU A 37 -7.615 -12.424 -3.353 1.00 0.00 C ATOM 580 C LEU A 37 -8.704 -11.405 -3.670 1.00 0.00 C ATOM 581 O LEU A 37 -9.143 -11.286 -4.814 1.00 0.00 O ATOM 582 CB LEU A 37 -6.313 -11.704 -2.999 1.00 0.00 C ATOM 583 CG LEU A 37 -5.247 -12.549 -2.301 1.00 0.00 C ATOM 584 CD1 LEU A 37 -4.550 -13.460 -3.299 1.00 0.00 C ATOM 585 CD2 LEU A 37 -4.237 -11.656 -1.595 1.00 0.00 C ATOM 0 H LEU A 37 -6.424 -13.473 -4.725 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.937 -13.018 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.884 -11.299 -3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.553 -10.856 -2.358 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.737 -13.172 -1.553 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.795 -14.054 -2.784 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -5.282 -14.124 -3.759 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.073 -12.856 -4.071 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -3.486 -12.274 -1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.752 -11.007 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.749 -11.046 -0.850 1.00 0.00 H new ATOM 597 N SER A 38 -9.134 -10.669 -2.650 1.00 0.00 N ATOM 598 CA SER A 38 -10.173 -9.660 -2.820 1.00 0.00 C ATOM 599 C SER A 38 -9.569 -8.259 -2.860 1.00 0.00 C ATOM 600 O SER A 38 -8.615 -7.947 -2.147 1.00 0.00 O ATOM 601 CB SER A 38 -11.196 -9.754 -1.686 1.00 0.00 C ATOM 602 OG SER A 38 -12.116 -8.678 -1.738 1.00 0.00 O ATOM 0 H SER A 38 -8.779 -10.753 -1.697 1.00 0.00 H new ATOM 0 HA SER A 38 -10.675 -9.848 -3.769 1.00 0.00 H new ATOM 0 HB2 SER A 38 -11.734 -10.700 -1.755 1.00 0.00 H new ATOM 0 HB3 SER A 38 -10.680 -9.749 -0.726 1.00 0.00 H new ATOM 0 HG SER A 38 -12.760 -8.762 -1.004 1.00 0.00 H new ATOM 608 N PRO A 39 -10.137 -7.395 -3.713 1.00 0.00 N ATOM 609 CA PRO A 39 -9.672 -6.013 -3.867 1.00 0.00 C ATOM 610 C PRO A 39 -9.979 -5.158 -2.643 1.00 0.00 C ATOM 611 O PRO A 39 -9.298 -4.168 -2.377 1.00 0.00 O ATOM 612 CB PRO A 39 -10.454 -5.509 -5.082 1.00 0.00 C ATOM 613 CG PRO A 39 -11.684 -6.349 -5.117 1.00 0.00 C ATOM 614 CD PRO A 39 -11.277 -7.699 -4.594 1.00 0.00 C ATOM 0 HA PRO A 39 -8.590 -5.958 -3.987 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.700 -4.452 -4.984 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.874 -5.618 -5.999 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -12.472 -5.913 -4.502 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -12.076 -6.425 -6.131 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -12.089 -8.180 -4.049 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -10.992 -8.373 -5.402 1.00 0.00 H new ATOM 622 N LYS A 40 -11.010 -5.546 -1.900 1.00 0.00 N ATOM 623 CA LYS A 40 -11.408 -4.817 -0.702 1.00 0.00 C ATOM 624 C LYS A 40 -10.372 -4.983 0.406 1.00 0.00 C ATOM 625 O LYS A 40 -9.866 -4.001 0.949 1.00 0.00 O ATOM 626 CB LYS A 40 -12.774 -5.303 -0.214 1.00 0.00 C ATOM 627 CG LYS A 40 -13.332 -4.491 0.943 1.00 0.00 C ATOM 628 CD LYS A 40 -14.094 -3.272 0.451 1.00 0.00 C ATOM 629 CE LYS A 40 -15.533 -3.617 0.103 1.00 0.00 C ATOM 630 NZ LYS A 40 -16.325 -2.406 -0.250 1.00 0.00 N ATOM 0 H LYS A 40 -11.586 -6.362 -2.107 1.00 0.00 H new ATOM 0 HA LYS A 40 -11.475 -3.759 -0.957 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -13.480 -5.269 -1.044 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -12.691 -6.346 0.092 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.993 -5.117 1.543 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.517 -4.174 1.593 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -14.080 -2.499 1.219 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -13.595 -2.860 -0.426 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -15.547 -4.316 -0.733 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -16.000 -4.122 0.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -17.300 -2.684 -0.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -16.334 -1.750 0.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -15.895 -1.937 -1.073 1.00 0.00 H new ATOM 644 N LYS A 41 -10.060 -6.232 0.735 1.00 0.00 N ATOM 645 CA LYS A 41 -9.083 -6.527 1.776 1.00 0.00 C ATOM 646 C LYS A 41 -7.711 -5.969 1.408 1.00 0.00 C ATOM 647 O LYS A 41 -7.050 -5.330 2.227 1.00 0.00 O ATOM 648 CB LYS A 41 -8.987 -8.038 2.000 1.00 0.00 C ATOM 649 CG LYS A 41 -8.354 -8.418 3.327 1.00 0.00 C ATOM 650 CD LYS A 41 -9.272 -8.095 4.494 1.00 0.00 C ATOM 651 CE LYS A 41 -8.595 -8.372 5.828 1.00 0.00 C ATOM 652 NZ LYS A 41 -8.520 -9.831 6.120 1.00 0.00 N ATOM 0 H LYS A 41 -10.470 -7.056 0.296 1.00 0.00 H new ATOM 0 HA LYS A 41 -9.415 -6.049 2.698 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.987 -8.469 1.948 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.407 -8.481 1.190 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -8.122 -9.483 3.329 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -7.410 -7.886 3.447 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -9.569 -7.047 4.446 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.183 -8.688 4.417 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.590 -7.951 5.819 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -9.144 -7.870 6.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -8.052 -9.978 7.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -9.481 -10.228 6.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -7.975 -10.307 5.373 1.00 0.00 H new ATOM 666 N VAL A 42 -7.290 -6.214 0.172 1.00 0.00 N ATOM 667 CA VAL A 42 -5.998 -5.734 -0.305 1.00 0.00 C ATOM 668 C VAL A 42 -5.995 -4.216 -0.447 1.00 0.00 C ATOM 669 O VAL A 42 -5.053 -3.545 -0.027 1.00 0.00 O ATOM 670 CB VAL A 42 -5.630 -6.366 -1.660 1.00 0.00 C ATOM 671 CG1 VAL A 42 -4.327 -5.782 -2.185 1.00 0.00 C ATOM 672 CG2 VAL A 42 -5.533 -7.878 -1.534 1.00 0.00 C ATOM 0 H VAL A 42 -7.824 -6.742 -0.518 1.00 0.00 H new ATOM 0 HA VAL A 42 -5.257 -6.028 0.438 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.419 -6.134 -2.375 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.083 -6.240 -3.143 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.437 -4.705 -2.315 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.526 -5.981 -1.473 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.272 -8.308 -2.501 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.765 -8.134 -0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.492 -8.278 -1.206 1.00 0.00 H new ATOM 682 N GLY A 43 -7.057 -3.680 -1.041 1.00 0.00 N ATOM 683 CA GLY A 43 -7.156 -2.244 -1.227 1.00 0.00 C ATOM 684 C GLY A 43 -7.143 -1.486 0.086 1.00 0.00 C ATOM 685 O GLY A 43 -6.477 -0.459 0.211 1.00 0.00 O ATOM 0 H GLY A 43 -7.850 -4.214 -1.396 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -6.327 -1.903 -1.848 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -8.074 -2.013 -1.767 1.00 0.00 H new ATOM 689 N ASP A 44 -7.881 -1.994 1.067 1.00 0.00 N ATOM 690 CA ASP A 44 -7.952 -1.358 2.377 1.00 0.00 C ATOM 691 C ASP A 44 -6.597 -1.402 3.077 1.00 0.00 C ATOM 692 O ASP A 44 -6.208 -0.452 3.757 1.00 0.00 O ATOM 693 CB ASP A 44 -9.010 -2.043 3.244 1.00 0.00 C ATOM 694 CG ASP A 44 -9.256 -1.309 4.547 1.00 0.00 C ATOM 695 OD1 ASP A 44 -8.370 -0.537 4.970 1.00 0.00 O ATOM 696 OD2 ASP A 44 -10.336 -1.504 5.143 1.00 0.00 O ATOM 0 H ASP A 44 -8.438 -2.844 0.980 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.232 -0.315 2.232 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -9.944 -2.110 2.686 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -8.693 -3.063 3.460 1.00 0.00 H new ATOM 701 N ASP A 45 -5.885 -2.510 2.907 1.00 0.00 N ATOM 702 CA ASP A 45 -4.574 -2.678 3.522 1.00 0.00 C ATOM 703 C ASP A 45 -3.573 -1.680 2.949 1.00 0.00 C ATOM 704 O ASP A 45 -2.779 -1.091 3.683 1.00 0.00 O ATOM 705 CB ASP A 45 -4.067 -4.106 3.310 1.00 0.00 C ATOM 706 CG ASP A 45 -4.561 -5.060 4.380 1.00 0.00 C ATOM 707 OD1 ASP A 45 -5.744 -4.959 4.764 1.00 0.00 O ATOM 708 OD2 ASP A 45 -3.763 -5.908 4.833 1.00 0.00 O ATOM 0 H ASP A 45 -6.194 -3.306 2.348 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.675 -2.491 4.591 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -4.391 -4.462 2.332 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -2.977 -4.104 3.304 1.00 0.00 H new ATOM 713 N ILE A 46 -3.616 -1.495 1.634 1.00 0.00 N ATOM 714 CA ILE A 46 -2.713 -0.568 0.963 1.00 0.00 C ATOM 715 C ILE A 46 -3.034 0.877 1.333 1.00 0.00 C ATOM 716 O ILE A 46 -2.141 1.656 1.663 1.00 0.00 O ATOM 717 CB ILE A 46 -2.784 -0.721 -0.568 1.00 0.00 C ATOM 718 CG1 ILE A 46 -2.387 -2.140 -0.979 1.00 0.00 C ATOM 719 CG2 ILE A 46 -1.885 0.303 -1.245 1.00 0.00 C ATOM 720 CD1 ILE A 46 -2.775 -2.489 -2.399 1.00 0.00 C ATOM 0 H ILE A 46 -4.267 -1.975 1.012 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.705 -0.812 1.298 1.00 0.00 H new ATOM 0 HB ILE A 46 -3.810 -0.543 -0.889 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.309 -2.254 -0.867 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.855 -2.851 -0.298 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.946 0.182 -2.327 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.209 1.308 -0.973 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -0.855 0.154 -0.921 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.463 -3.509 -2.621 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -3.856 -2.408 -2.511 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -2.286 -1.801 -3.089 1.00 0.00 H new ATOM 732 N ALA A 47 -4.315 1.226 1.278 1.00 0.00 N ATOM 733 CA ALA A 47 -4.754 2.575 1.611 1.00 0.00 C ATOM 734 C ALA A 47 -4.314 2.964 3.018 1.00 0.00 C ATOM 735 O ALA A 47 -3.794 4.058 3.238 1.00 0.00 O ATOM 736 CB ALA A 47 -6.266 2.685 1.479 1.00 0.00 C ATOM 0 H ALA A 47 -5.067 0.593 1.006 1.00 0.00 H new ATOM 0 HA ALA A 47 -4.288 3.266 0.909 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -6.580 3.698 1.731 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -6.559 2.458 0.454 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -6.743 1.978 2.158 1.00 0.00 H new ATOM 742 N LYS A 48 -4.527 2.061 3.970 1.00 0.00 N ATOM 743 CA LYS A 48 -4.152 2.309 5.357 1.00 0.00 C ATOM 744 C LYS A 48 -2.637 2.397 5.504 1.00 0.00 C ATOM 745 O LYS A 48 -2.125 3.184 6.300 1.00 0.00 O ATOM 746 CB LYS A 48 -4.699 1.201 6.260 1.00 0.00 C ATOM 747 CG LYS A 48 -4.061 -0.155 6.013 1.00 0.00 C ATOM 748 CD LYS A 48 -4.403 -1.142 7.118 1.00 0.00 C ATOM 749 CE LYS A 48 -3.405 -1.064 8.263 1.00 0.00 C ATOM 750 NZ LYS A 48 -3.535 -2.220 9.192 1.00 0.00 N ATOM 0 H LYS A 48 -4.957 1.151 3.806 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.584 3.263 5.659 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -4.543 1.482 7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.776 1.120 6.110 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.400 -0.548 5.055 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.979 -0.042 5.947 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.406 -0.937 7.493 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.415 -2.154 6.713 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.392 -1.034 7.861 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.557 -0.136 8.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.838 -2.130 9.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.493 -2.235 9.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.365 -3.104 8.672 1.00 0.00 H new ATOM 764 N ALA A 49 -1.924 1.585 4.730 1.00 0.00 N ATOM 765 CA ALA A 49 -0.467 1.574 4.772 1.00 0.00 C ATOM 766 C ALA A 49 0.107 2.885 4.244 1.00 0.00 C ATOM 767 O ALA A 49 1.066 3.423 4.798 1.00 0.00 O ATOM 768 CB ALA A 49 0.076 0.399 3.973 1.00 0.00 C ATOM 0 H ALA A 49 -2.332 0.926 4.066 1.00 0.00 H new ATOM 0 HA ALA A 49 -0.159 1.465 5.812 1.00 0.00 H new ATOM 0 HB1 ALA A 49 1.165 0.404 4.013 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.299 -0.533 4.396 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.249 0.483 2.936 1.00 0.00 H new ATOM 774 N THR A 50 -0.485 3.395 3.169 1.00 0.00 N ATOM 775 CA THR A 50 -0.032 4.641 2.565 1.00 0.00 C ATOM 776 C THR A 50 -0.740 5.841 3.183 1.00 0.00 C ATOM 777 O THR A 50 -0.846 6.899 2.564 1.00 0.00 O ATOM 778 CB THR A 50 -0.270 4.648 1.043 1.00 0.00 C ATOM 779 OG1 THR A 50 -1.655 4.418 0.763 1.00 0.00 O ATOM 780 CG2 THR A 50 0.575 3.583 0.359 1.00 0.00 C ATOM 0 H THR A 50 -1.280 2.963 2.698 1.00 0.00 H new ATOM 0 HA THR A 50 1.038 4.714 2.758 1.00 0.00 H new ATOM 0 HB THR A 50 0.021 5.625 0.656 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.867 3.474 0.916 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.390 3.606 -0.715 1.00 0.00 H new ATOM 0 HG22 THR A 50 1.630 3.778 0.550 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.310 2.601 0.751 1.00 0.00 H new ATOM 788 N GLY A 51 -1.222 5.670 4.411 1.00 0.00 N ATOM 789 CA GLY A 51 -1.913 6.749 5.093 1.00 0.00 C ATOM 790 C GLY A 51 -1.038 7.972 5.280 1.00 0.00 C ATOM 791 O GLY A 51 -1.441 9.088 4.954 1.00 0.00 O ATOM 0 H GLY A 51 -1.146 4.804 4.945 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.801 7.025 4.524 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.255 6.399 6.067 1.00 0.00 H new ATOM 795 N ASP A 52 0.163 7.763 5.808 1.00 0.00 N ATOM 796 CA ASP A 52 1.098 8.858 6.039 1.00 0.00 C ATOM 797 C ASP A 52 1.710 9.336 4.726 1.00 0.00 C ATOM 798 O ASP A 52 2.167 10.474 4.621 1.00 0.00 O ATOM 799 CB ASP A 52 2.203 8.419 7.001 1.00 0.00 C ATOM 800 CG ASP A 52 2.830 7.098 6.600 1.00 0.00 C ATOM 801 OD1 ASP A 52 2.074 6.141 6.330 1.00 0.00 O ATOM 802 OD2 ASP A 52 4.076 7.021 6.556 1.00 0.00 O ATOM 0 H ASP A 52 0.512 6.845 6.084 1.00 0.00 H new ATOM 0 HA ASP A 52 0.547 9.686 6.485 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.975 9.188 7.038 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.792 8.332 8.007 1.00 0.00 H new ATOM 807 N TRP A 53 1.716 8.459 3.729 1.00 0.00 N ATOM 808 CA TRP A 53 2.273 8.792 2.422 1.00 0.00 C ATOM 809 C TRP A 53 1.255 9.543 1.572 1.00 0.00 C ATOM 810 O TRP A 53 1.376 9.603 0.348 1.00 0.00 O ATOM 811 CB TRP A 53 2.723 7.522 1.699 1.00 0.00 C ATOM 812 CG TRP A 53 4.147 7.150 1.981 1.00 0.00 C ATOM 813 CD1 TRP A 53 5.243 7.480 1.237 1.00 0.00 C ATOM 814 CD2 TRP A 53 4.627 6.375 3.085 1.00 0.00 C ATOM 815 NE1 TRP A 53 6.376 6.957 1.812 1.00 0.00 N ATOM 816 CE2 TRP A 53 6.026 6.275 2.947 1.00 0.00 C ATOM 817 CE3 TRP A 53 4.013 5.757 4.177 1.00 0.00 C ATOM 818 CZ2 TRP A 53 6.816 5.583 3.860 1.00 0.00 C ATOM 819 CZ3 TRP A 53 4.799 5.070 5.083 1.00 0.00 C ATOM 820 CH2 TRP A 53 6.188 4.987 4.920 1.00 0.00 C ATOM 0 H TRP A 53 1.342 7.513 3.800 1.00 0.00 H new ATOM 0 HA TRP A 53 3.137 9.439 2.576 1.00 0.00 H new ATOM 0 HB2 TRP A 53 2.075 6.696 1.993 1.00 0.00 H new ATOM 0 HB3 TRP A 53 2.597 7.660 0.625 1.00 0.00 H new ATOM 0 HD1 TRP A 53 5.223 8.066 0.330 1.00 0.00 H new ATOM 0 HE1 TRP A 53 7.325 7.060 1.452 1.00 0.00 H new ATOM 0 HE3 TRP A 53 2.943 5.815 4.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 7.887 5.519 3.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 4.334 4.589 5.931 1.00 0.00 H new ATOM 0 HH2 TRP A 53 6.775 4.442 5.645 1.00 0.00 H new ATOM 831 N LYS A 54 0.251 10.116 2.227 1.00 0.00 N ATOM 832 CA LYS A 54 -0.788 10.866 1.531 1.00 0.00 C ATOM 833 C LYS A 54 -0.188 12.029 0.748 1.00 0.00 C ATOM 834 O LYS A 54 0.314 12.989 1.331 1.00 0.00 O ATOM 835 CB LYS A 54 -1.824 11.389 2.529 1.00 0.00 C ATOM 836 CG LYS A 54 -1.364 12.617 3.296 1.00 0.00 C ATOM 837 CD LYS A 54 -2.141 12.790 4.590 1.00 0.00 C ATOM 838 CE LYS A 54 -3.530 13.354 4.335 1.00 0.00 C ATOM 839 NZ LYS A 54 -4.492 12.293 3.927 1.00 0.00 N ATOM 0 H LYS A 54 0.135 10.075 3.240 1.00 0.00 H new ATOM 0 HA LYS A 54 -1.278 10.192 0.828 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -2.743 11.628 1.994 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -2.065 10.597 3.238 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -0.300 12.531 3.518 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -1.489 13.503 2.674 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -2.225 11.828 5.096 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -1.594 13.455 5.258 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -3.893 13.847 5.237 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -3.476 14.115 3.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -4.753 12.426 2.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -4.051 11.359 4.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -5.345 12.352 4.519 1.00 0.00 H new ATOM 853 N GLY A 55 -0.246 11.938 -0.577 1.00 0.00 N ATOM 854 CA GLY A 55 0.294 12.990 -1.418 1.00 0.00 C ATOM 855 C GLY A 55 1.694 12.679 -1.910 1.00 0.00 C ATOM 856 O GLY A 55 2.191 13.319 -2.837 1.00 0.00 O ATOM 0 H GLY A 55 -0.658 11.154 -1.083 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -0.364 13.140 -2.274 1.00 0.00 H new ATOM 0 HA3 GLY A 55 0.308 13.926 -0.859 1.00 0.00 H new ATOM 860 N LEU A 56 2.332 11.694 -1.288 1.00 0.00 N ATOM 861 CA LEU A 56 3.684 11.299 -1.666 1.00 0.00 C ATOM 862 C LEU A 56 3.657 10.111 -2.623 1.00 0.00 C ATOM 863 O LEU A 56 3.126 9.050 -2.296 1.00 0.00 O ATOM 864 CB LEU A 56 4.501 10.947 -0.422 1.00 0.00 C ATOM 865 CG LEU A 56 4.721 12.081 0.580 1.00 0.00 C ATOM 866 CD1 LEU A 56 3.496 12.256 1.464 1.00 0.00 C ATOM 867 CD2 LEU A 56 5.958 11.814 1.425 1.00 0.00 C ATOM 0 H LEU A 56 1.935 11.154 -0.519 1.00 0.00 H new ATOM 0 HA LEU A 56 4.153 12.142 -2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.005 10.125 0.093 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.475 10.579 -0.744 1.00 0.00 H new ATOM 0 HG LEU A 56 4.878 13.006 0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.670 13.067 2.171 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.631 12.494 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.307 11.332 2.011 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.099 12.631 2.132 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.831 10.879 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.832 11.740 0.778 1.00 0.00 H new ATOM 879 N ARG A 57 4.234 10.298 -3.806 1.00 0.00 N ATOM 880 CA ARG A 57 4.277 9.242 -4.810 1.00 0.00 C ATOM 881 C ARG A 57 5.476 8.326 -4.586 1.00 0.00 C ATOM 882 O ARG A 57 6.615 8.788 -4.501 1.00 0.00 O ATOM 883 CB ARG A 57 4.339 9.846 -6.214 1.00 0.00 C ATOM 884 CG ARG A 57 5.723 10.336 -6.606 1.00 0.00 C ATOM 885 CD ARG A 57 6.217 11.422 -5.663 1.00 0.00 C ATOM 886 NE ARG A 57 7.410 12.091 -6.176 1.00 0.00 N ATOM 887 CZ ARG A 57 7.382 13.010 -7.136 1.00 0.00 C ATOM 888 NH1 ARG A 57 6.228 13.367 -7.683 1.00 0.00 N ATOM 889 NH2 ARG A 57 8.509 13.574 -7.549 1.00 0.00 N ATOM 0 H ARG A 57 4.678 11.171 -4.092 1.00 0.00 H new ATOM 0 HA ARG A 57 3.367 8.650 -4.716 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.009 9.099 -6.936 1.00 0.00 H new ATOM 0 HB3 ARG A 57 3.638 10.678 -6.273 1.00 0.00 H new ATOM 0 HG2 ARG A 57 6.422 9.500 -6.598 1.00 0.00 H new ATOM 0 HG3 ARG A 57 5.699 10.721 -7.625 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.427 12.157 -5.511 1.00 0.00 H new ATOM 0 HD3 ARG A 57 6.437 10.984 -4.689 1.00 0.00 H new ATOM 0 HE ARG A 57 8.314 11.839 -5.776 1.00 0.00 H new ATOM 0 HH11 ARG A 57 5.359 12.936 -7.367 1.00 0.00 H new ATOM 0 HH12 ARG A 57 6.209 14.072 -8.419 1.00 0.00 H new ATOM 0 HH21 ARG A 57 9.398 13.303 -7.130 1.00 0.00 H new ATOM 0 HH22 ARG A 57 8.486 14.279 -8.286 1.00 0.00 H new ATOM 903 N ILE A 58 5.213 7.027 -4.489 1.00 0.00 N ATOM 904 CA ILE A 58 6.270 6.048 -4.275 1.00 0.00 C ATOM 905 C ILE A 58 5.989 4.759 -5.040 1.00 0.00 C ATOM 906 O ILE A 58 4.849 4.482 -5.415 1.00 0.00 O ATOM 907 CB ILE A 58 6.438 5.718 -2.780 1.00 0.00 C ATOM 908 CG1 ILE A 58 5.319 4.785 -2.312 1.00 0.00 C ATOM 909 CG2 ILE A 58 6.450 6.996 -1.954 1.00 0.00 C ATOM 910 CD1 ILE A 58 3.933 5.291 -2.644 1.00 0.00 C ATOM 0 H ILE A 58 4.276 6.629 -4.555 1.00 0.00 H new ATOM 0 HA ILE A 58 7.193 6.494 -4.646 1.00 0.00 H new ATOM 0 HB ILE A 58 7.392 5.209 -2.640 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.459 3.805 -2.769 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.398 4.648 -1.234 1.00 0.00 H new ATOM 0 HG21 ILE A 58 6.569 6.747 -0.900 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.279 7.628 -2.274 1.00 0.00 H new ATOM 0 HG23 ILE A 58 5.511 7.530 -2.096 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.190 4.580 -2.283 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.774 6.257 -2.165 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.835 5.401 -3.724 1.00 0.00 H new ATOM 922 N THR A 59 7.035 3.971 -5.267 1.00 0.00 N ATOM 923 CA THR A 59 6.901 2.710 -5.986 1.00 0.00 C ATOM 924 C THR A 59 6.677 1.550 -5.024 1.00 0.00 C ATOM 925 O THR A 59 7.490 1.303 -4.133 1.00 0.00 O ATOM 926 CB THR A 59 8.147 2.418 -6.844 1.00 0.00 C ATOM 927 OG1 THR A 59 8.400 3.514 -7.730 1.00 0.00 O ATOM 928 CG2 THR A 59 7.962 1.141 -7.649 1.00 0.00 C ATOM 0 H THR A 59 7.985 4.184 -4.963 1.00 0.00 H new ATOM 0 HA THR A 59 6.034 2.809 -6.639 1.00 0.00 H new ATOM 0 HB THR A 59 8.998 2.288 -6.176 1.00 0.00 H new ATOM 0 HG1 THR A 59 9.194 3.321 -8.270 1.00 0.00 H new ATOM 0 HG21 THR A 59 8.854 0.955 -8.247 1.00 0.00 H new ATOM 0 HG22 THR A 59 7.799 0.304 -6.971 1.00 0.00 H new ATOM 0 HG23 THR A 59 7.100 1.248 -8.307 1.00 0.00 H new ATOM 936 N VAL A 60 5.570 0.838 -5.210 1.00 0.00 N ATOM 937 CA VAL A 60 5.239 -0.298 -4.358 1.00 0.00 C ATOM 938 C VAL A 60 5.249 -1.600 -5.152 1.00 0.00 C ATOM 939 O VAL A 60 4.710 -1.671 -6.257 1.00 0.00 O ATOM 940 CB VAL A 60 3.859 -0.123 -3.698 1.00 0.00 C ATOM 941 CG1 VAL A 60 3.531 -1.321 -2.820 1.00 0.00 C ATOM 942 CG2 VAL A 60 3.815 1.167 -2.892 1.00 0.00 C ATOM 0 H VAL A 60 4.887 1.028 -5.943 1.00 0.00 H new ATOM 0 HA VAL A 60 6.001 -0.343 -3.580 1.00 0.00 H new ATOM 0 HB VAL A 60 3.105 -0.061 -4.483 1.00 0.00 H new ATOM 0 HG11 VAL A 60 2.552 -1.179 -2.362 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.520 -2.226 -3.428 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.286 -1.418 -2.040 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.833 1.275 -2.432 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.578 1.136 -2.114 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.002 2.015 -3.551 1.00 0.00 H new ATOM 952 N LYS A 61 5.865 -2.630 -4.581 1.00 0.00 N ATOM 953 CA LYS A 61 5.944 -3.932 -5.233 1.00 0.00 C ATOM 954 C LYS A 61 4.967 -4.918 -4.601 1.00 0.00 C ATOM 955 O LYS A 61 4.921 -5.063 -3.378 1.00 0.00 O ATOM 956 CB LYS A 61 7.369 -4.483 -5.147 1.00 0.00 C ATOM 957 CG LYS A 61 7.664 -5.204 -3.843 1.00 0.00 C ATOM 958 CD LYS A 61 9.031 -5.867 -3.869 1.00 0.00 C ATOM 959 CE LYS A 61 9.063 -7.114 -2.999 1.00 0.00 C ATOM 960 NZ LYS A 61 10.429 -7.388 -2.473 1.00 0.00 N ATOM 0 H LYS A 61 6.317 -2.588 -3.668 1.00 0.00 H new ATOM 0 HA LYS A 61 5.674 -3.802 -6.281 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.535 -5.169 -5.978 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.075 -3.661 -5.266 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.618 -4.495 -3.016 1.00 0.00 H new ATOM 0 HG3 LYS A 61 6.897 -5.957 -3.661 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.289 -6.131 -4.895 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.786 -5.161 -3.522 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.370 -6.994 -2.166 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.718 -7.970 -3.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.409 -8.246 -1.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.085 -7.528 -3.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 10.748 -6.582 -1.899 1.00 0.00 H new ATOM 974 N LEU A 62 4.189 -5.593 -5.439 1.00 0.00 N ATOM 975 CA LEU A 62 3.214 -6.567 -4.962 1.00 0.00 C ATOM 976 C LEU A 62 3.623 -7.984 -5.352 1.00 0.00 C ATOM 977 O LEU A 62 3.670 -8.326 -6.534 1.00 0.00 O ATOM 978 CB LEU A 62 1.829 -6.251 -5.528 1.00 0.00 C ATOM 979 CG LEU A 62 1.167 -4.974 -5.008 1.00 0.00 C ATOM 980 CD1 LEU A 62 0.030 -4.550 -5.925 1.00 0.00 C ATOM 981 CD2 LEU A 62 0.661 -5.176 -3.587 1.00 0.00 C ATOM 0 H LEU A 62 4.214 -5.484 -6.453 1.00 0.00 H new ATOM 0 HA LEU A 62 3.179 -6.505 -3.874 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.909 -6.179 -6.613 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.170 -7.092 -5.312 1.00 0.00 H new ATOM 0 HG LEU A 62 1.913 -4.180 -4.997 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.429 -3.640 -5.539 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.420 -4.363 -6.926 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.717 -5.343 -5.969 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.193 -4.257 -3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.070 -5.984 -3.573 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.497 -5.431 -2.936 1.00 0.00 H new ATOM 993 N THR A 63 3.918 -8.806 -4.350 1.00 0.00 N ATOM 994 CA THR A 63 4.323 -10.186 -4.587 1.00 0.00 C ATOM 995 C THR A 63 3.274 -11.163 -4.068 1.00 0.00 C ATOM 996 O THR A 63 3.046 -11.261 -2.862 1.00 0.00 O ATOM 997 CB THR A 63 5.675 -10.498 -3.918 1.00 0.00 C ATOM 998 OG1 THR A 63 6.655 -9.536 -4.321 1.00 0.00 O ATOM 999 CG2 THR A 63 6.149 -11.897 -4.284 1.00 0.00 C ATOM 0 H THR A 63 3.884 -8.540 -3.366 1.00 0.00 H new ATOM 0 HA THR A 63 4.425 -10.305 -5.666 1.00 0.00 H new ATOM 0 HB THR A 63 5.541 -10.448 -2.837 1.00 0.00 H new ATOM 0 HG1 THR A 63 7.542 -9.827 -4.022 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.105 -12.095 -3.800 1.00 0.00 H new ATOM 0 HG22 THR A 63 5.414 -12.629 -3.949 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.267 -11.970 -5.365 1.00 0.00 H new ATOM 1007 N ILE A 64 2.640 -11.885 -4.986 1.00 0.00 N ATOM 1008 CA ILE A 64 1.616 -12.857 -4.619 1.00 0.00 C ATOM 1009 C ILE A 64 2.095 -14.282 -4.875 1.00 0.00 C ATOM 1010 O ILE A 64 2.466 -14.630 -5.995 1.00 0.00 O ATOM 1011 CB ILE A 64 0.309 -12.618 -5.398 1.00 0.00 C ATOM 1012 CG1 ILE A 64 -0.419 -11.389 -4.851 1.00 0.00 C ATOM 1013 CG2 ILE A 64 -0.584 -13.847 -5.323 1.00 0.00 C ATOM 1014 CD1 ILE A 64 0.512 -10.284 -4.404 1.00 0.00 C ATOM 0 H ILE A 64 2.817 -11.816 -5.988 1.00 0.00 H new ATOM 0 HA ILE A 64 1.423 -12.727 -3.554 1.00 0.00 H new ATOM 0 HB ILE A 64 0.555 -12.435 -6.444 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.088 -11.001 -5.619 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.042 -11.691 -4.009 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.504 -13.663 -5.878 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.064 -14.702 -5.756 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.825 -14.058 -4.281 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -0.073 -9.445 -4.028 1.00 0.00 H new ATOM 0 HD12 ILE A 64 1.164 -10.655 -3.613 1.00 0.00 H new ATOM 0 HD13 ILE A 64 1.118 -9.955 -5.248 1.00 0.00 H new ATOM 1026 N GLN A 65 2.081 -15.101 -3.829 1.00 0.00 N ATOM 1027 CA GLN A 65 2.512 -16.490 -3.940 1.00 0.00 C ATOM 1028 C GLN A 65 1.696 -17.389 -3.019 1.00 0.00 C ATOM 1029 O GLN A 65 1.518 -17.088 -1.839 1.00 0.00 O ATOM 1030 CB GLN A 65 4.000 -16.612 -3.606 1.00 0.00 C ATOM 1031 CG GLN A 65 4.695 -17.752 -4.332 1.00 0.00 C ATOM 1032 CD GLN A 65 4.649 -19.053 -3.555 1.00 0.00 C ATOM 1033 OE1 GLN A 65 3.923 -19.980 -3.915 1.00 0.00 O ATOM 1034 NE2 GLN A 65 5.427 -19.130 -2.482 1.00 0.00 N ATOM 0 H GLN A 65 1.776 -14.827 -2.895 1.00 0.00 H new ATOM 0 HA GLN A 65 2.350 -16.813 -4.968 1.00 0.00 H new ATOM 0 HB2 GLN A 65 4.498 -15.675 -3.857 1.00 0.00 H new ATOM 0 HB3 GLN A 65 4.112 -16.755 -2.531 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.226 -17.898 -5.305 1.00 0.00 H new ATOM 0 HG3 GLN A 65 5.734 -17.480 -4.517 1.00 0.00 H new ATOM 0 HE21 GLN A 65 6.013 -18.338 -2.219 1.00 0.00 H new ATOM 0 HE22 GLN A 65 5.438 -19.981 -1.920 1.00 0.00 H new ATOM 1043 N ASN A 66 1.202 -18.495 -3.565 1.00 0.00 N ATOM 1044 CA ASN A 66 0.403 -19.439 -2.791 1.00 0.00 C ATOM 1045 C ASN A 66 -0.749 -18.728 -2.088 1.00 0.00 C ATOM 1046 O ASN A 66 -0.953 -18.894 -0.885 1.00 0.00 O ATOM 1047 CB ASN A 66 1.278 -20.157 -1.762 1.00 0.00 C ATOM 1048 CG ASN A 66 0.525 -21.244 -1.020 1.00 0.00 C ATOM 1049 OD1 ASN A 66 -0.030 -21.007 0.053 1.00 0.00 O ATOM 1050 ND2 ASN A 66 0.503 -22.443 -1.590 1.00 0.00 N ATOM 0 H ASN A 66 1.341 -18.760 -4.540 1.00 0.00 H new ATOM 0 HA ASN A 66 -0.013 -20.174 -3.480 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.140 -20.595 -2.265 1.00 0.00 H new ATOM 0 HB3 ASN A 66 1.662 -19.431 -1.045 1.00 0.00 H new ATOM 0 HD21 ASN A 66 0.012 -23.214 -1.137 1.00 0.00 H new ATOM 0 HD22 ASN A 66 0.977 -22.593 -2.480 1.00 0.00 H new ATOM 1057 N ARG A 67 -1.500 -17.935 -2.846 1.00 0.00 N ATOM 1058 CA ARG A 67 -2.631 -17.198 -2.296 1.00 0.00 C ATOM 1059 C ARG A 67 -2.182 -16.283 -1.159 1.00 0.00 C ATOM 1060 O ARG A 67 -2.765 -16.293 -0.076 1.00 0.00 O ATOM 1061 CB ARG A 67 -3.702 -18.167 -1.792 1.00 0.00 C ATOM 1062 CG ARG A 67 -4.198 -19.133 -2.855 1.00 0.00 C ATOM 1063 CD ARG A 67 -5.439 -19.881 -2.394 1.00 0.00 C ATOM 1064 NE ARG A 67 -6.618 -19.019 -2.367 1.00 0.00 N ATOM 1065 CZ ARG A 67 -7.769 -19.367 -1.801 1.00 0.00 C ATOM 1066 NH1 ARG A 67 -7.894 -20.551 -1.219 1.00 0.00 N ATOM 1067 NH2 ARG A 67 -8.797 -18.528 -1.817 1.00 0.00 N ATOM 0 H ARG A 67 -1.345 -17.787 -3.843 1.00 0.00 H new ATOM 0 HA ARG A 67 -3.053 -16.582 -3.091 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -3.299 -18.737 -0.955 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.547 -17.594 -1.411 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -4.422 -18.585 -3.770 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -3.410 -19.847 -3.095 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.622 -20.725 -3.059 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -5.267 -20.291 -1.399 1.00 0.00 H new ATOM 0 HE ARG A 67 -6.554 -18.101 -2.806 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.106 -21.198 -1.205 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -8.779 -20.815 -0.785 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -8.704 -17.616 -2.264 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -9.680 -18.795 -1.383 1.00 0.00 H new ATOM 1081 N GLN A 68 -1.143 -15.495 -1.416 1.00 0.00 N ATOM 1082 CA GLN A 68 -0.617 -14.576 -0.414 1.00 0.00 C ATOM 1083 C GLN A 68 -0.411 -13.185 -1.006 1.00 0.00 C ATOM 1084 O GLN A 68 -0.359 -13.020 -2.225 1.00 0.00 O ATOM 1085 CB GLN A 68 0.704 -15.104 0.149 1.00 0.00 C ATOM 1086 CG GLN A 68 0.576 -16.452 0.839 1.00 0.00 C ATOM 1087 CD GLN A 68 1.920 -17.057 1.192 1.00 0.00 C ATOM 1088 OE1 GLN A 68 2.916 -16.348 1.330 1.00 0.00 O ATOM 1089 NE2 GLN A 68 1.955 -18.377 1.340 1.00 0.00 N ATOM 0 H GLN A 68 -0.649 -15.475 -2.308 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.345 -14.503 0.394 1.00 0.00 H new ATOM 0 HB2 GLN A 68 1.427 -15.188 -0.662 1.00 0.00 H new ATOM 0 HB3 GLN A 68 1.103 -14.379 0.858 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.016 -16.336 1.747 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.032 -17.138 0.190 1.00 0.00 H new ATOM 0 HE21 GLN A 68 1.105 -18.927 1.216 1.00 0.00 H new ATOM 0 HE22 GLN A 68 2.832 -18.841 1.577 1.00 0.00 H new ATOM 1098 N ALA A 69 -0.295 -12.188 -0.135 1.00 0.00 N ATOM 1099 CA ALA A 69 -0.094 -10.812 -0.572 1.00 0.00 C ATOM 1100 C ALA A 69 0.959 -10.114 0.282 1.00 0.00 C ATOM 1101 O ALA A 69 0.992 -10.281 1.501 1.00 0.00 O ATOM 1102 CB ALA A 69 -1.408 -10.046 -0.525 1.00 0.00 C ATOM 0 H ALA A 69 -0.337 -12.307 0.877 1.00 0.00 H new ATOM 0 HA ALA A 69 0.265 -10.832 -1.601 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.243 -9.020 -0.854 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.133 -10.526 -1.183 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.791 -10.043 0.496 1.00 0.00 H new ATOM 1108 N GLN A 70 1.817 -9.333 -0.366 1.00 0.00 N ATOM 1109 CA GLN A 70 2.872 -8.610 0.335 1.00 0.00 C ATOM 1110 C GLN A 70 2.963 -7.169 -0.154 1.00 0.00 C ATOM 1111 O GLN A 70 2.946 -6.910 -1.358 1.00 0.00 O ATOM 1112 CB GLN A 70 4.216 -9.314 0.141 1.00 0.00 C ATOM 1113 CG GLN A 70 4.311 -10.653 0.854 1.00 0.00 C ATOM 1114 CD GLN A 70 5.740 -11.141 0.991 1.00 0.00 C ATOM 1115 OE1 GLN A 70 6.240 -11.879 0.142 1.00 0.00 O ATOM 1116 NE2 GLN A 70 6.405 -10.731 2.065 1.00 0.00 N ATOM 0 H GLN A 70 1.803 -9.185 -1.375 1.00 0.00 H new ATOM 0 HA GLN A 70 2.626 -8.598 1.397 1.00 0.00 H new ATOM 0 HB2 GLN A 70 4.386 -9.467 -0.925 1.00 0.00 H new ATOM 0 HB3 GLN A 70 5.013 -8.663 0.501 1.00 0.00 H new ATOM 0 HG2 GLN A 70 3.864 -10.565 1.844 1.00 0.00 H new ATOM 0 HG3 GLN A 70 3.729 -11.394 0.306 1.00 0.00 H new ATOM 0 HE21 GLN A 70 5.951 -10.119 2.743 1.00 0.00 H new ATOM 0 HE22 GLN A 70 7.370 -11.028 2.212 1.00 0.00 H new ATOM 1125 N ILE A 71 3.059 -6.235 0.786 1.00 0.00 N ATOM 1126 CA ILE A 71 3.154 -4.820 0.449 1.00 0.00 C ATOM 1127 C ILE A 71 4.361 -4.174 1.122 1.00 0.00 C ATOM 1128 O ILE A 71 4.549 -4.298 2.331 1.00 0.00 O ATOM 1129 CB ILE A 71 1.881 -4.057 0.862 1.00 0.00 C ATOM 1130 CG1 ILE A 71 1.575 -4.296 2.342 1.00 0.00 C ATOM 1131 CG2 ILE A 71 0.704 -4.482 -0.003 1.00 0.00 C ATOM 1132 CD1 ILE A 71 0.339 -3.570 2.828 1.00 0.00 C ATOM 0 H ILE A 71 3.073 -6.432 1.787 1.00 0.00 H new ATOM 0 HA ILE A 71 3.269 -4.760 -0.633 1.00 0.00 H new ATOM 0 HB ILE A 71 2.050 -2.991 0.712 1.00 0.00 H new ATOM 0 HG12 ILE A 71 1.448 -5.365 2.511 1.00 0.00 H new ATOM 0 HG13 ILE A 71 2.431 -3.979 2.938 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -0.188 -3.934 0.301 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.924 -4.266 -1.048 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.531 -5.551 0.118 1.00 0.00 H new ATOM 0 HD11 ILE A 71 0.183 -3.785 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 71 0.470 -2.497 2.691 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.527 -3.905 2.258 1.00 0.00 H new ATOM 1144 N GLU A 72 5.174 -3.484 0.329 1.00 0.00 N ATOM 1145 CA GLU A 72 6.362 -2.818 0.848 1.00 0.00 C ATOM 1146 C GLU A 72 6.732 -1.614 -0.014 1.00 0.00 C ATOM 1147 O GLU A 72 6.482 -1.599 -1.219 1.00 0.00 O ATOM 1148 CB GLU A 72 7.537 -3.796 0.908 1.00 0.00 C ATOM 1149 CG GLU A 72 8.852 -3.145 1.305 1.00 0.00 C ATOM 1150 CD GLU A 72 8.866 -2.695 2.753 1.00 0.00 C ATOM 1151 OE1 GLU A 72 8.416 -3.472 3.621 1.00 0.00 O ATOM 1152 OE2 GLU A 72 9.328 -1.565 3.018 1.00 0.00 O ATOM 0 H GLU A 72 5.032 -3.372 -0.675 1.00 0.00 H new ATOM 0 HA GLU A 72 6.139 -2.467 1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.304 -4.588 1.620 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.655 -4.269 -0.067 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.667 -3.850 1.140 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.038 -2.286 0.660 1.00 0.00 H new ATOM 1159 N VAL A 73 7.328 -0.605 0.614 1.00 0.00 N ATOM 1160 CA VAL A 73 7.733 0.604 -0.095 1.00 0.00 C ATOM 1161 C VAL A 73 9.242 0.638 -0.305 1.00 0.00 C ATOM 1162 O VAL A 73 10.015 0.546 0.649 1.00 0.00 O ATOM 1163 CB VAL A 73 7.303 1.871 0.667 1.00 0.00 C ATOM 1164 CG1 VAL A 73 7.842 3.116 -0.020 1.00 0.00 C ATOM 1165 CG2 VAL A 73 5.787 1.933 0.786 1.00 0.00 C ATOM 0 H VAL A 73 7.541 -0.601 1.611 1.00 0.00 H new ATOM 0 HA VAL A 73 7.235 0.585 -1.064 1.00 0.00 H new ATOM 0 HB VAL A 73 7.722 1.829 1.672 1.00 0.00 H new ATOM 0 HG11 VAL A 73 7.528 4.001 0.533 1.00 0.00 H new ATOM 0 HG12 VAL A 73 8.931 3.073 -0.049 1.00 0.00 H new ATOM 0 HG13 VAL A 73 7.454 3.167 -1.037 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.501 2.835 1.327 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.344 1.952 -0.210 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.428 1.057 1.326 1.00 0.00 H new ATOM 1175 N VAL A 74 9.657 0.771 -1.561 1.00 0.00 N ATOM 1176 CA VAL A 74 11.075 0.819 -1.897 1.00 0.00 C ATOM 1177 C VAL A 74 11.657 2.202 -1.626 1.00 0.00 C ATOM 1178 O VAL A 74 11.001 3.227 -1.813 1.00 0.00 O ATOM 1179 CB VAL A 74 11.314 0.454 -3.374 1.00 0.00 C ATOM 1180 CG1 VAL A 74 10.771 -0.935 -3.675 1.00 0.00 C ATOM 1181 CG2 VAL A 74 10.683 1.492 -4.288 1.00 0.00 C ATOM 0 H VAL A 74 9.031 0.847 -2.363 1.00 0.00 H new ATOM 0 HA VAL A 74 11.576 0.087 -1.264 1.00 0.00 H new ATOM 0 HB VAL A 74 12.388 0.446 -3.559 1.00 0.00 H new ATOM 0 HG11 VAL A 74 10.949 -1.176 -4.723 1.00 0.00 H new ATOM 0 HG12 VAL A 74 11.275 -1.667 -3.044 1.00 0.00 H new ATOM 0 HG13 VAL A 74 9.700 -0.958 -3.474 1.00 0.00 H new ATOM 0 HG21 VAL A 74 10.862 1.218 -5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.610 1.535 -4.103 1.00 0.00 H new ATOM 0 HG23 VAL A 74 11.125 2.468 -4.089 1.00 0.00 H new ATOM 1191 N PRO A 75 12.920 2.234 -1.175 1.00 0.00 N ATOM 1192 CA PRO A 75 13.620 3.486 -0.870 1.00 0.00 C ATOM 1193 C PRO A 75 13.943 4.290 -2.124 1.00 0.00 C ATOM 1194 O PRO A 75 13.645 5.482 -2.203 1.00 0.00 O ATOM 1195 CB PRO A 75 14.907 3.015 -0.190 1.00 0.00 C ATOM 1196 CG PRO A 75 15.130 1.637 -0.711 1.00 0.00 C ATOM 1197 CD PRO A 75 13.762 1.052 -0.929 1.00 0.00 C ATOM 0 HA PRO A 75 13.015 4.152 -0.254 1.00 0.00 H new ATOM 0 HB2 PRO A 75 15.744 3.670 -0.431 1.00 0.00 H new ATOM 0 HB3 PRO A 75 14.804 3.016 0.895 1.00 0.00 H new ATOM 0 HG2 PRO A 75 15.698 1.658 -1.641 1.00 0.00 H new ATOM 0 HG3 PRO A 75 15.702 1.039 -0.001 1.00 0.00 H new ATOM 0 HD2 PRO A 75 13.749 0.366 -1.776 1.00 0.00 H new ATOM 0 HD3 PRO A 75 13.422 0.491 -0.059 1.00 0.00 H new ATOM 1205 N SER A 76 14.554 3.630 -3.103 1.00 0.00 N ATOM 1206 CA SER A 76 14.921 4.285 -4.353 1.00 0.00 C ATOM 1207 C SER A 76 15.331 3.258 -5.405 1.00 0.00 C ATOM 1208 O SER A 76 16.115 2.351 -5.130 1.00 0.00 O ATOM 1209 CB SER A 76 16.064 5.275 -4.119 1.00 0.00 C ATOM 1210 OG SER A 76 17.210 4.619 -3.604 1.00 0.00 O ATOM 0 H SER A 76 14.805 2.643 -3.055 1.00 0.00 H new ATOM 0 HA SER A 76 14.049 4.827 -4.719 1.00 0.00 H new ATOM 0 HB2 SER A 76 16.316 5.772 -5.056 1.00 0.00 H new ATOM 0 HB3 SER A 76 15.741 6.050 -3.424 1.00 0.00 H new ATOM 0 HG SER A 76 17.926 5.273 -3.465 1.00 0.00 H new ATOM 1216 N ALA A 77 14.793 3.409 -6.611 1.00 0.00 N ATOM 1217 CA ALA A 77 15.103 2.498 -7.705 1.00 0.00 C ATOM 1218 C ALA A 77 16.013 3.162 -8.733 1.00 0.00 C ATOM 1219 O ALA A 77 15.642 4.160 -9.351 1.00 0.00 O ATOM 1220 CB ALA A 77 13.822 2.013 -8.367 1.00 0.00 C ATOM 0 H ALA A 77 14.140 4.154 -6.855 1.00 0.00 H new ATOM 0 HA ALA A 77 15.633 1.640 -7.291 1.00 0.00 H new ATOM 0 HB1 ALA A 77 14.069 1.333 -9.183 1.00 0.00 H new ATOM 0 HB2 ALA A 77 13.208 1.491 -7.633 1.00 0.00 H new ATOM 0 HB3 ALA A 77 13.270 2.867 -8.761 1.00 0.00 H new ATOM 1226 N SER A 78 17.206 2.603 -8.910 1.00 0.00 N ATOM 1227 CA SER A 78 18.171 3.144 -9.859 1.00 0.00 C ATOM 1228 C SER A 78 18.769 2.035 -10.718 1.00 0.00 C ATOM 1229 O SER A 78 18.609 2.024 -11.938 1.00 0.00 O ATOM 1230 CB SER A 78 19.284 3.889 -9.119 1.00 0.00 C ATOM 1231 OG SER A 78 18.926 5.240 -8.886 1.00 0.00 O ATOM 0 H SER A 78 17.527 1.775 -8.408 1.00 0.00 H new ATOM 0 HA SER A 78 17.648 3.843 -10.512 1.00 0.00 H new ATOM 0 HB2 SER A 78 19.488 3.395 -8.169 1.00 0.00 H new ATOM 0 HB3 SER A 78 20.203 3.849 -9.703 1.00 0.00 H new ATOM 0 HG SER A 78 19.653 5.694 -8.410 1.00 0.00 H new ATOM 1237 N ALA A 79 19.460 1.102 -10.071 1.00 0.00 N ATOM 1238 CA ALA A 79 20.082 -0.014 -10.773 1.00 0.00 C ATOM 1239 C ALA A 79 19.727 -1.343 -10.116 1.00 0.00 C ATOM 1240 O ALA A 79 20.534 -2.273 -10.097 1.00 0.00 O ATOM 1241 CB ALA A 79 21.592 0.168 -10.820 1.00 0.00 C ATOM 0 H ALA A 79 19.603 1.097 -9.061 1.00 0.00 H new ATOM 0 HA ALA A 79 19.697 -0.029 -11.793 1.00 0.00 H new ATOM 0 HB1 ALA A 79 22.044 -0.673 -11.347 1.00 0.00 H new ATOM 0 HB2 ALA A 79 21.831 1.094 -11.342 1.00 0.00 H new ATOM 0 HB3 ALA A 79 21.985 0.213 -9.804 1.00 0.00 H new ATOM 1247 N LEU A 80 18.516 -1.426 -9.576 1.00 0.00 N ATOM 1248 CA LEU A 80 18.054 -2.642 -8.916 1.00 0.00 C ATOM 1249 C LEU A 80 17.610 -3.682 -9.940 1.00 0.00 C ATOM 1250 O LEU A 80 16.420 -3.825 -10.219 1.00 0.00 O ATOM 1251 CB LEU A 80 16.900 -2.322 -7.964 1.00 0.00 C ATOM 1252 CG LEU A 80 17.138 -1.174 -6.983 1.00 0.00 C ATOM 1253 CD1 LEU A 80 15.908 -0.949 -6.117 1.00 0.00 C ATOM 1254 CD2 LEU A 80 18.357 -1.456 -6.118 1.00 0.00 C ATOM 0 H LEU A 80 17.836 -0.666 -9.582 1.00 0.00 H new ATOM 0 HA LEU A 80 18.885 -3.054 -8.344 1.00 0.00 H new ATOM 0 HB2 LEU A 80 16.018 -2.087 -8.560 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.668 -3.220 -7.392 1.00 0.00 H new ATOM 0 HG LEU A 80 17.326 -0.265 -7.555 1.00 0.00 H new ATOM 0 HD11 LEU A 80 16.096 -0.128 -5.425 1.00 0.00 H new ATOM 0 HD12 LEU A 80 15.057 -0.701 -6.751 1.00 0.00 H new ATOM 0 HD13 LEU A 80 15.689 -1.856 -5.553 1.00 0.00 H new ATOM 0 HD21 LEU A 80 18.511 -0.628 -5.426 1.00 0.00 H new ATOM 0 HD22 LEU A 80 18.198 -2.376 -5.555 1.00 0.00 H new ATOM 0 HD23 LEU A 80 19.236 -1.567 -6.753 1.00 0.00 H new ATOM 1266 N SER A 81 18.576 -4.408 -10.494 1.00 0.00 N ATOM 1267 CA SER A 81 18.285 -5.435 -11.488 1.00 0.00 C ATOM 1268 C SER A 81 18.835 -6.788 -11.048 1.00 0.00 C ATOM 1269 O SER A 81 20.017 -7.079 -11.227 1.00 0.00 O ATOM 1270 CB SER A 81 18.881 -5.046 -12.843 1.00 0.00 C ATOM 1271 OG SER A 81 18.884 -6.149 -13.733 1.00 0.00 O ATOM 0 H SER A 81 19.566 -4.304 -10.272 1.00 0.00 H new ATOM 0 HA SER A 81 17.202 -5.516 -11.585 1.00 0.00 H new ATOM 0 HB2 SER A 81 18.306 -4.227 -13.275 1.00 0.00 H new ATOM 0 HB3 SER A 81 19.899 -4.683 -12.705 1.00 0.00 H new ATOM 0 HG SER A 81 19.268 -5.875 -14.592 1.00 0.00 H new ATOM 1277 N GLY A 82 17.967 -7.613 -10.470 1.00 0.00 N ATOM 1278 CA GLY A 82 18.383 -8.926 -10.012 1.00 0.00 C ATOM 1279 C GLY A 82 17.824 -10.043 -10.871 1.00 0.00 C ATOM 1280 O GLY A 82 18.393 -10.408 -11.900 1.00 0.00 O ATOM 0 H GLY A 82 16.983 -7.396 -10.311 1.00 0.00 H new ATOM 0 HA2 GLY A 82 19.472 -8.980 -10.014 1.00 0.00 H new ATOM 0 HA3 GLY A 82 18.059 -9.067 -8.981 1.00 0.00 H new ATOM 1284 N PRO A 83 16.683 -10.607 -10.447 1.00 0.00 N ATOM 1285 CA PRO A 83 16.023 -11.698 -11.170 1.00 0.00 C ATOM 1286 C PRO A 83 15.418 -11.236 -12.491 1.00 0.00 C ATOM 1287 O PRO A 83 14.409 -10.531 -12.510 1.00 0.00 O ATOM 1288 CB PRO A 83 14.922 -12.147 -10.205 1.00 0.00 C ATOM 1289 CG PRO A 83 14.640 -10.948 -9.368 1.00 0.00 C ATOM 1290 CD PRO A 83 15.949 -10.222 -9.230 1.00 0.00 C ATOM 0 HA PRO A 83 16.722 -12.490 -11.440 1.00 0.00 H new ATOM 0 HB2 PRO A 83 14.032 -12.472 -10.744 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.250 -12.988 -9.594 1.00 0.00 H new ATOM 0 HG2 PRO A 83 13.889 -10.312 -9.837 1.00 0.00 H new ATOM 0 HG3 PRO A 83 14.249 -11.236 -8.392 1.00 0.00 H new ATOM 0 HD2 PRO A 83 15.806 -9.143 -9.172 1.00 0.00 H new ATOM 0 HD3 PRO A 83 16.482 -10.522 -8.328 1.00 0.00 H new ATOM 1298 N SER A 84 16.041 -11.638 -13.594 1.00 0.00 N ATOM 1299 CA SER A 84 15.565 -11.263 -14.920 1.00 0.00 C ATOM 1300 C SER A 84 14.144 -11.768 -15.151 1.00 0.00 C ATOM 1301 O SER A 84 13.869 -12.960 -15.021 1.00 0.00 O ATOM 1302 CB SER A 84 16.498 -11.820 -15.997 1.00 0.00 C ATOM 1303 OG SER A 84 16.486 -13.237 -15.998 1.00 0.00 O ATOM 0 H SER A 84 16.876 -12.223 -13.596 1.00 0.00 H new ATOM 0 HA SER A 84 15.559 -10.175 -14.982 1.00 0.00 H new ATOM 0 HB2 SER A 84 16.191 -11.450 -16.975 1.00 0.00 H new ATOM 0 HB3 SER A 84 17.513 -11.462 -15.824 1.00 0.00 H new ATOM 0 HG SER A 84 15.608 -13.557 -15.704 1.00 0.00 H new ATOM 1309 N SER A 85 13.246 -10.851 -15.496 1.00 0.00 N ATOM 1310 CA SER A 85 11.852 -11.202 -15.742 1.00 0.00 C ATOM 1311 C SER A 85 11.744 -12.282 -16.813 1.00 0.00 C ATOM 1312 O SER A 85 11.984 -12.029 -17.993 1.00 0.00 O ATOM 1313 CB SER A 85 11.060 -9.964 -16.168 1.00 0.00 C ATOM 1314 OG SER A 85 9.693 -10.277 -16.369 1.00 0.00 O ATOM 0 H SER A 85 13.458 -9.860 -15.611 1.00 0.00 H new ATOM 0 HA SER A 85 11.432 -11.592 -14.815 1.00 0.00 H new ATOM 0 HB2 SER A 85 11.151 -9.190 -15.406 1.00 0.00 H new ATOM 0 HB3 SER A 85 11.482 -9.557 -17.087 1.00 0.00 H new ATOM 0 HG SER A 85 9.209 -9.469 -16.639 1.00 0.00 H new ATOM 1320 N GLY A 86 11.382 -13.490 -16.392 1.00 0.00 N ATOM 1321 CA GLY A 86 11.249 -14.593 -17.327 1.00 0.00 C ATOM 1322 C GLY A 86 9.803 -14.883 -17.678 1.00 0.00 C ATOM 1323 O GLY A 86 9.265 -14.322 -18.632 1.00 0.00 O ATOM 0 H GLY A 86 11.178 -13.725 -15.421 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.802 -14.362 -18.238 1.00 0.00 H new ATOM 0 HA3 GLY A 86 11.702 -15.487 -16.897 1.00 0.00 H new TER 1327 GLY A 86